A0A087YIF8_POEFO Loading...

ATP-dependent RNA helicase DHX8

Involved in pre-mRNA splicing as component of the spliceosome. Facilitates nuclear export of spliced mRNA by releasing the RNA from the spliceosome.

AlphaFold DB , UniProt , Accession A0A087YIF8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,252 aa.

						>A0A087YIF8_POEFO|A0A087YIF8
MCFRLKRKRKLLLHPICLPSSTFVEQKQDSWKMADGGVDELSQLEYLSLVSKVCTELDNHLGINDKDLAEFVISLAEKQPSFDGFKALLLENGAEFTDSLISNLLRLIQTMRPPSKASTSKASDVLIKPKSEKDRLKELFPALCKPNDPSPKRILDEDDVKVAADAMKELEMFMPSVSGADSKVSKSKSEKSRHRSRSRERERHRDRDRDRDRDRDRGGDRKRRHHSRSRSRSRSRSRDRHRDRDRDRDRDRGKRKDKSSRWSDRSPSPRKDPDKDSDRWKDKHVDRPPPEEPSVGDIYNGKVTSIMQFGCFVQLEGLRKRWEGLVHISELRREGRVANVADVVSKGQRVKVKVLSFTGSKTSLSMKDVDQDTGEDLNPNRRRNMGPEGGEDVSMRNPDRPSNLNLGHAPELEQDDTLERKRLTKISDPEKWEIKQMIAANVLSKEEFPDFDDETGILPKVDDEEDEDLEIELVEEEPPFLRGHTKQSMDMSPVKIVKNPDGSLSQAAMMQSALAKERRELKQAAREAEMDSIPMGLNKHWVDPLPDVDGRQIAANMRGIGMMPNDIPEWKKHAFGGNKASYGKKTQLSILEQRESLPIYKLKEQLIQAVHDNQILIVIGETGSGKTTQITQYLAEAGYTTRGKIGCTQPRRVAAMSVAKRVSEEYGCCLGQEVGYTIRFEDCTSPETVIKYMTDGMLLRECLIDSELGQYAIIMLDEAHERTIHTDVLFGLLKKTVQKRTDMKLIVTSATLDAVKFSQYFYEAPIFTIPGRTYPVEVLYTKEPETDYLDASLITVMQIHLTEPPGDILVFLTGQEEIDTACEILYERMKSLGPDVPELIILPVYSALPSEMQTRIFDPAPPGSRKVVIATNIAETSLTIDGIYYVVDPGFVKQKVYNSKTGIDQLVVTPISQAQAKQRAGRAGRTGPGKCYRLYTERAYRDEMLTTNVPEIQRTNLASTVLSLKAMGINDLLSFDFMDAPPMETLITAMEQLYTLGALDDEGLLTRLGRRMAEFPLEPMLCKMLIMSVHLGCSEEMLTIVSMLSVQNVFYRPKDKQALADQKKAKFHQPEGDHLTLLAVYNSWKNNKFSNPWCYENFIQARSLRRAQDIRKQMLGIMDRHKLDVVSCGKATVRVQKAICSGFFRNAAKKDPQEGYRTLIDQQVVYIHPSSALFNRQPEWVVYHELVLTTKEYMREVTTIDPRWLVEFAPAFFKVSDPTRLSKQKKQQRLEPLYNRYEEPNAWRISRAFRRR
					

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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	42.4	Very low	31.8	Very low	236 Å²	236	202 Å²	202	100%	1.163	91%	0.905	S	S	*	*				0	47.6	0	-162	168.4	-178.4	0	0	111.4
2	C	32.4	Very low	31.5	Very low	119 Å²	119	200.4 Å²	200.4	80%	0.804	91%	0.909	S	S	*	*			trans	-111.9	11.7	-152.4	-54.2	0	0	0	0	116.2
3	F	30.2	Very low	31.5	Very low	206 Å²	206	197.8 Å²	197.8	90%	0.904	91%	0.906	S	S	*	*	S	Bend	trans	-103.7	-1.2	-168.2	-108.3	-86	0	0	0	116.5
4	R	30.9	Very low	31.1	Very low	245 Å²	245	197.1 Å²	197.1	93%	0.925	90%	0.904	S	S	*	*	S	Bend	trans	-101.5	-11.5	-171.3	-136.1	173.4	-172.1	175.5	1.9	116.3
5	L	32.7	Very low	31.8	Very low	160 Å²	160	190.8 Å²	190.8	84%	0.838	89%	0.888	S	S	*	*	S	Bend	trans	-95.6	-26.1	-177.9	-89.1	158.1	0	0	0	115	R7	L5-R7 PolarHBondContact O-N 2.99Å
6	K	31.2	Very low	31.4	Very low	205 Å²	205	189.7 Å²	189.7	89%	0.891	89%	0.888	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	4.9	180	-79.6	-172.5	173.5	-178.3	0	115.3
7	R	29.5	Very low	31.1	Very low	239 Å²	239	184.8 Å²	184.8	90%	0.902	88%	0.878	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	-0.9	-174.7	-121	-179.5	-173.9	-176.6	1.9	116.7	L5	L5-R7 PolarHBondContact O-N 2.99Å
8	K	29.7	Very low	30.8	Very low	197 Å²	197	183.8 Å²	183.8	86%	0.857	88%	0.878	S	S	*	*	S	Bend	trans	-104.8	-9.3	177.2	-89.4	-166.3	171.6	-170.7	0	116	K10	K8-K10 VanDerWaalsContact C-N 3.32Å; K8-K10 PolarHBondContact O-N 3.14Å
9	R	32	Very low	31	Very low	251 Å²	251	179.5 Å²	179.5	95%	0.947	87%	0.866	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	20.7	-175.3	-113.3	-174.5	-173.5	-174.7	2.8	115.6
10	K	30.7	Very low	30.8	Very low	204 Å²	204	175.9 Å²	175.9	89%	0.887	86%	0.861	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.9	14.6	-173.9	-142.4	-175.3	-177.6	-175.8	0	115.8	K8	K8-K10 VanDerWaalsContact C-N 3.32Å; K8-K10 PolarHBondContact O-N 3.14Å
11	L	28.3	Very low	30.6	Very low	160 Å²	160	172.8 Å²	172.8	84%	0.838	86%	0.856	S	S	*	*	S	Bend	trans	-147.6	93	177	-97.5	161.7	0	0	0	109
12	L	28.3	Very low	29.8	Very low	183 Å²	183	167.1 Å²	167.1	96%	0.958	84%	0.836	S	S	*	*			trans	164	79.3	154	-92.5	164.3	0	0	0	108.7
13	L	30.8	Very low	29.5	Very low	166 Å²	166	170.9 Å²	170.9	87%	0.869	84%	0.839	S	S	*	*			trans	-143.9	98.6	166.6	-112	174.8	0	0	0	107.4
14	H	27	Very low	29.4	Very low	188 Å²	188	166.4 Å²	166.4	87%	0.87	83%	0.828	S	S	*	*			trans	-158	153.1	156.5	-104.1	-73.7	0	0	0	108.4
15	P	40.8	Very low	29.3	Very low	103 Å²	103	163.1 Å²	163.1	67%	0.669	82%	0.823	S	S	*	*			trans	-106.8	164.8	-156.5	39.4	-33.8	0	0	0	114.1
16	I	25.3	Very low	28.9	Very low	173 Å²	173	164.6 Å²	164.6	89%	0.887	83%	0.825	S	S	*	*			trans	-130.6	113	163	-58.6	178.2	0	0	0	107.6
17	C	26.5	Very low	28.8	Very low	107 Å²	107	164.7 Å²	164.7	72%	0.723	83%	0.826	S	S	*	*			trans	-99.6	149.8	168.2	-62.2	0	0	0	0	109.4
18	L	25.4	Very low	28.7	Very low	167 Å²	167	161.3 Å²	161.3	87%	0.874	82%	0.82	S	S	*	*			trans	177	159.6	143.8	-95.1	167.4	0	0	0	108.5
19	P	35.2	Very low	28.8	Very low	101 Å²	101	158.7 Å²	158.7	66%	0.656	82%	0.816	S	S	*	*				-134.9	168.3	-110.9	44.8	-30.3	0	0	0	117.4
20	S	26	Very low	28.6	Very low	108 Å²	108	151.4 Å²	151.4	76%	0.755	80%	0.803	S	S	*	*			trans	21.5	123.9	147.4	63.9	0	0	0	0	121.9
21	S	26.4	Very low	28.4	Very low	110 Å²	110	154.1 Å²	154.1	77%	0.769	81%	0.808	S	S	*	*				-162.1	112.6	126.9	45.8	0	0	0	0	114.7
22	T	26.7	Very low	28.4	Very low	118 Å²	118	156.3 Å²	156.3	72%	0.724	81%	0.811	S	S	*	*			trans	31.1	117.2	136.6	58.3	0	0	0	0	122.1
23	F	25.2	Very low	28.9	Very low	198 Å²	198	156.9 Å²	156.9	87%	0.868	81%	0.811	S	S	*	*				-171.8	99.8	124.1	-107.4	-78.8	0	0	0	106.1
24	V	28.9	Very low	29.1	Very low	112 Å²	112	153.5 Å²	153.5	68%	0.679	81%	0.807	S	S	*	*				66.2	120.6	79.7	178.4	0	0	0	0	113.2
25	E	28.3	Very low	29.7	Very low	175 Å²	175	153 Å²	153	82%	0.818	81%	0.811	S	S	*	*			trans	-20.9	129.1	169.2	-59.9	156	123.3	0	0	117.4
26	Q	25.3	Very low	29.6	Very low	191 Å²	191	151.5 Å²	151.5	89%	0.893	82%	0.815	S	S	*	*			trans	-174.5	94.5	131.3	-105.6	171.5	39.8	0	0	112.9
27	K	27.7	Very low	30.3	Very low	208 Å²	208	145.4 Å²	145.4	90%	0.904	79%	0.794	S	S	*	*			trans	178.6	80.2	135.2	-101.3	172.7	-178.7	-179.9	0	111.6
28	Q	28.3	Very low	31.2	Very low	168 Å²	168	145.4 Å²	145.4	79%	0.785	79%	0.791	S	S	*	*			trans	-75.9	162.2	154.6	-147.1	160.4	-8	0	0	108.8
29	D	31.9	Very low	32.4	Very low	141 Å²	141	142 Å²	142	75%	0.754	77%	0.774	S	S	*	*			trans	52.6	108.4	166	-53.9	-24.6	0	0	0	119.5
30	S	27.3	Very low	33.6	Very low	99 Å²	99	143.4 Å²	143.4	69%	0.692	77%	0.771	S	S	*	*			trans	-177.7	41.9	143.2	34.4	0	0	0	0	116.6
31	W	27.1	Very low	35.1	Very low	261 Å²	261	143.1 Å²	143.1	99%	0.989	76%	0.761	S	S	*	*			trans	-123.1	100.1	164.5	-64.9	106.7	0	0	0	110.6
32	K	28	Very low	36.7	Very low	205 Å²	205	139.8 Å²	139.8	89%	0.891	74%	0.737	S	S	*	*			trans	-88.2	147.7	-179.4	-76.8	-173.3	174.4	-178.5	0	111.6	A34	K32-A34 PolarHBondContact O-N 3.38Å
33	M	38.1	Very low	38.7	Very low	195 Å²	195	140.4 Å²	140.4	96%	0.961	73%	0.732	S	S	*	*			trans	-44.4	124.3	168.8	-68.9	-76.9	-170.4	0	0	113.5
34	A	35.1	Very low	40.8	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	72%	0.72	S	S	*	*			trans	-159.8	125.8	149.7	0	0	0	0	0	109.7	K32	K32-A34 PolarHBondContact O-N 3.38Å
35	D	40.6	Very low	42.9	Very low	176 Å²	176	135.2 Å²	135.2	94%	0.941	71%	0.706	S	S	*	*			trans	57.4	67.5	165.1	-141.1	28.6	0	0	0	117.3
36	G	37.5	Very low	45.4	Very low	73 Å²	73	131 Å²	131	75%	0.753	68%	0.683	S	S	*	*			trans	-104.3	136.2	176.2	0	0	0	0	0	113.5
37	G	41.5	Very low	48	Very low	44 Å²	44	125.9 Å²	125.9	45%	0.454	66%	0.662	S	S	.	*	S	Bend	trans	155.5	-26.3	173.3	0	0	0	0	0	115.1
38	V	44	Very low	50.6	Low	107 Å²	107	118.5 Å²	118.5	65%	0.648	64%	0.636	S	S	*	*	S	Bend	trans	-94.1	-34.9	174.5	-177.3	0	0	0	0	111.8	S42	V38-S42 PolarHBondContact O-N 3.4Å; V38-S42 PolarHBondContact O-OG 3.08Å
39	D	51.9	Low	53.3	Low	97 Å²	97	110.7 Å²	110.7	52%	0.519	60%	0.6	S	S	.	*	H	α-helix	trans	-75.6	-31	-178.2	-76.3	16.1	0	0	0	112.2	L41 S42 Q43 K116	D39-L41 VanDerWaalsContact C-N 3.34Å; D39-L41 PolarHBondContact O-N 2.58Å; D39-S42 WeakPolarHBondContact O-CB 3.41Å; D39-S42 PolarHBondContact O-N 3.46Å; D39-Q43 WeakPolarHBondContact O-CB 3.35Å; D39-Q43 PolarHBondContact O-N 3.07Å; D39-K116 IonicContact OD1-NZ 3.75Å; D39-K116 PolarHBondContact OD1-NZ 2.96Å; D39-K116 IonicContact OD2-NZ 2.75Å
40	E	58.9	Low	55.8	Low	129 Å²	129	104.1 Å²	104.1	60%	0.603	57%	0.565	S	S	*	*	H	α-helix	trans	-61.2	-40.9	173.6	-64.7	-175	154.9	0	0	112.3	Q43 L44	E40-Q43 WeakPolarHBondContact O-CB 3.32Å; E40-Q43 PolarHBondContact O-N 3.15Å; E40-L44 WeakPolarHBondContact O-CG 3.47Å; E40-L44 PolarHBondContact O-N 3.28Å
41	L	58.9	Low	58.5	Low	103 Å²	103	102.7 Å²	102.7	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-68.4	-40	178.6	-156.7	156	0	0	0	110.4	D39 Q43 L44 E45	D39-L41 VanDerWaalsContact C-N 3.34Å; D39-L41 PolarHBondContact O-N 2.58Å; L41-Q43 VanDerWaalsContact C-N 3.28Å; L41-Q43 PolarHBondContact O-N 3.44Å; L41-L44 PolarHBondContact O-N 3.5Å; L41-E45 HydrophobicContact CD2-CG 4.32Å; L41-E45 WeakPolarHBondContact O-CG 3.37Å; L41-E45 PolarHBondContact O-N 3.23Å
42	S	59.9	Low	61.2	Low	40 Å²	40	94.6 Å²	94.6	28%	0.28	53%	0.527	S	S	.	.	H	α-helix	trans	-62.3	-35.2	172.2	-51.9	0	0	0	0	112.2	V38 D39 Y46	V38-S42 PolarHBondContact O-N 3.4Å; V38-S42 PolarHBondContact O-OG 3.08Å; D39-S42 WeakPolarHBondContact O-CB 3.41Å; D39-S42 PolarHBondContact O-N 3.46Å; S42-Y46 PolarHBondContact O-N 3.06Å
43	Q	67.6	Low	63.9	Low	131 Å²	131	84.9 Å²	84.9	61%	0.612	49%	0.485	S	S	*	.	H	α-helix	trans	-73.8	-35.9	178.6	-162.1	170	24.7	0	0	112	D39 E40 L41 Y46 L47	D39-Q43 WeakPolarHBondContact O-CB 3.35Å; D39-Q43 PolarHBondContact O-N 3.07Å; E40-Q43 WeakPolarHBondContact O-CB 3.32Å; E40-Q43 PolarHBondContact O-N 3.15Å; L41-Q43 VanDerWaalsContact C-N 3.28Å; L41-Q43 PolarHBondContact O-N 3.44Å; Q43-Y46 PolarHBondContact O-N 3.45Å; Q43-L47 VanDerWaalsContact O-CG 3.31Å; Q43-L47 WeakPolarHBondContact O-CG 3.43Å; Q43-L47 PolarHBondContact O-N 3.09Å
44	L	69.6	Low	66.1	Low	118 Å²	118	76 Å²	76	62%	0.618	44%	0.442	S	S	*	.	H	α-helix	trans	-66.9	-40.4	170.9	-74.1	165.1	0	0	0	112.3	E40 L41 L47 S48	E40-L44 WeakPolarHBondContact O-CG 3.47Å; E40-L44 PolarHBondContact O-N 3.28Å; L41-L44 PolarHBondContact O-N 3.5Å; L44-L47 PolarHBondContact O-N 3Å; L44-S48 PolarHBondContact O-N 3.1Å
45	E	72.9	Confident	68.5	Low	83 Å²	83	74.5 Å²	74.5	39%	0.388	42%	0.423	S	S	.	.	H	α-helix	trans	-61.3	-44.7	172.9	-74.9	-179.8	170.7	0	0	111.6	L41 L47 S48 L49	L41-E45 HydrophobicContact CD2-CG 4.32Å; L41-E45 WeakPolarHBondContact O-CG 3.37Å; L41-E45 PolarHBondContact O-N 3.23Å; E45-L47 PolarHBondContact O-N 3.28Å; E45-S48 WeakPolarHBondContact O-CB 3.38Å; E45-S48 PolarHBondContact O-N 3.42Å; E45-L49 PolarHBondContact O-N 3.08Å
46	Y	80.6	Confident	70.4	Confident	85 Å²	85	68.3 Å²	68.3	33%	0.333	39%	0.388	S	S	.	.	H	α-helix	trans	-60.6	-44.9	175	-175.9	-95.7	0	0	0	112.2	S42 Q43 S48 L49 V50 E70 I73	S42-Y46 PolarHBondContact O-N 3.06Å; Q43-Y46 PolarHBondContact O-N 3.45Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.49Å; Y46-L49 WeakPolarHBondContact O-CB 3.24Å; Y46-L49 PolarHBondContact O-N 2.75Å; Y46-L49 VanDerWaalsContact O-N 3.15Å; Y46-V50 HydrophobicContact CD1-CG2 4.01Å; Y46-V50 HydrophobicContact CE1-CG2 3.61Å; Y46-V50 WeakPolarHBondContact O-CG2 3.46Å; Y46-V50 PolarHBondContact O-N 2.75Å; Y46-E70 HydrophobicContact CE1-CG 4.39Å; Y46-I73 HydrophobicContact CE2-CG2 4.18Å
47	L	80.4	Confident	72.5	Confident	84 Å²	84	64.9 Å²	64.9	44%	0.44	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-34	175.5	-72.3	167.1	0	0	0	112.5	Q43 L44 E45 S51	Q43-L47 VanDerWaalsContact O-CG 3.31Å; Q43-L47 WeakPolarHBondContact O-CG 3.43Å; Q43-L47 PolarHBondContact O-N 3.09Å; L44-L47 PolarHBondContact O-N 3Å; E45-L47 PolarHBondContact O-N 3.28Å; L47-S51 WeakPolarHBondContact O-CB 3.23Å; L47-S51 PolarHBondContact O-N 3.43Å
48	S	82.3	Confident	74.5	Confident	53 Å²	53	65.9 Å²	65.9	37%	0.371	35%	0.347	S	S	.	.	H	α-helix	trans	-66.8	-39.6	172.7	-166.9	0	0	0	0	112.3	L44 E45 Y46 K52	L44-S48 PolarHBondContact O-N 3.1Å; E45-S48 WeakPolarHBondContact O-CB 3.38Å; E45-S48 PolarHBondContact O-N 3.42Å; Y46-S48 VanDerWaalsContact C-N 3.29Å; Y46-S48 PolarHBondContact O-N 3.49Å; S48-K52 WeakPolarHBondContact O-CG 3.45Å; S48-K52 PolarHBondContact O-N 3.02Å; S48-K52 VanDerWaalsContact O-N 3.08Å
49	L	85.6	Confident	76.3	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-48.5	173.7	172.9	60.6	0	0	0	111.3	E45 Y46 S51 K52 V53 I73 I108 M111	E45-L49 PolarHBondContact O-N 3.08Å; Y46-L49 WeakPolarHBondContact O-CB 3.24Å; Y46-L49 PolarHBondContact O-N 2.75Å; Y46-L49 VanDerWaalsContact O-N 3.15Å; L49-S51 PolarHBondContact O-N 3.47Å; L49-K52 PolarHBondContact O-N 3.29Å; L49-V53 HydrophobicContact CD1-CG2 4.03Å; L49-V53 WeakPolarHBondContact O-CG2 3.23Å; L49-V53 PolarHBondContact O-N 3.37Å; L49-I73 HydrophobicContact CD2-CD1 4.3Å; L49-I73 HydrophobicContact CD2-CG2 4.48Å; L49-I73 HydrophobicContact CG-CD1 3.98Å; L49-I108 HydrophobicContact CD1-CG1 4.12Å; L49-M111 HydrophobicContact CB-CE 4.46Å; L49-M111 HydrophobicContact CD1-CB 4.48Å; L49-M111 HydrophobicContact CD1-CE 3.52Å
50	V	83.8	Confident	77.5	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-56.3	-49.6	176.6	174.4	0	0	0	0	110.7	Y46 K52 V53 C54 K66 A69 E70 I73	Y46-V50 HydrophobicContact CD1-CG2 4.01Å; Y46-V50 HydrophobicContact CE1-CG2 3.61Å; Y46-V50 WeakPolarHBondContact O-CG2 3.46Å; Y46-V50 PolarHBondContact O-N 2.75Å; V50-K52 VanDerWaalsContact C-N 3.33Å; V50-K52 PolarHBondContact O-N 2.92Å; V50-V53 PolarHBondContact O-N 3.44Å; V50-C54 PolarHBondContact O-N 3.41Å; V50-C54 PolarHBondContact O-SG 2.9Å; V50-K66 HydrophobicContact CG1-CG 3.85Å; V50-A69 HydrophobicContact CG1-CB 4.2Å; V50-E70 HydrophobicContact CB-CG 4.45Å; V50-E70 HydrophobicContact CG1-CG 3.89Å; V50-E70 HydrophobicContact CG2-CG 3.6Å; V50-I73 HydrophobicContact CB-CD1 4.41Å; V50-I73 HydrophobicContact CG2-CD1 3.71Å
51	S	84.8	Confident	78.2	Confident	70 Å²	70	63.7 Å²	63.7	49%	0.49	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-39.5	179.2	175.7	0	0	0	0	113.2	L47 L49 C54 T55	L47-S51 WeakPolarHBondContact O-CB 3.23Å; L47-S51 PolarHBondContact O-N 3.43Å; L49-S51 PolarHBondContact O-N 3.47Å; S51-C54 PolarHBondContact O-N 3.02Å; S51-T55 PolarHBondContact O-N 2.88Å; S51-T55 PolarHBondContact O-OG1 3.3Å
52	K	82.9	Confident	79	Confident	91 Å²	91	61.5 Å²	61.5	40%	0.396	34%	0.335	S	S	.	.	H	α-helix	trans	-70.2	-37.9	175.5	-73.5	168.4	179.9	164.8	0	112.4	S48 L49 V50 T55 E56 M111	S48-K52 WeakPolarHBondContact O-CG 3.45Å; S48-K52 PolarHBondContact O-N 3.02Å; S48-K52 VanDerWaalsContact O-N 3.08Å; L49-K52 PolarHBondContact O-N 3.29Å; V50-K52 VanDerWaalsContact C-N 3.33Å; V50-K52 PolarHBondContact O-N 2.92Å; K52-T55 WeakPolarHBondContact O-CB 3.41Å; K52-T55 PolarHBondContact O-N 3.14Å; K52-E56 PolarHBondContact O-N 3.21Å; K52-M111 HydrophobicContact CB-CE 4.15Å; K52-M111 HydrophobicContact CD-CE 3.49Å; K52-M111 VanDerWaalsContact CD-CE 3.49Å; K52-M111 HydrophobicContact CD-SD 3.56Å; K52-M111 VanDerWaalsContact CD-SD 3.56Å; K52-M111 HydrophobicContact CG-CE 4.47Å; K52-M111 PolarHBondContact NZ-SD 3.43Å; K52-M111 VanDerWaalsContact NZ-SD 3.37Å
53	V	83.9	Confident	79.7	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-42.3	173.4	171.5	0	0	0	0	111	L49 V50 T55 E56 L57 A69 I73 L104 I108	L49-V53 HydrophobicContact CD1-CG2 4.03Å; L49-V53 WeakPolarHBondContact O-CG2 3.23Å; L49-V53 PolarHBondContact O-N 3.37Å; V50-V53 PolarHBondContact O-N 3.44Å; V53-T55 VanDerWaalsContact C-N 3.27Å; V53-T55 PolarHBondContact O-N 2.86Å; V53-E56 PolarHBondContact O-N 3.38Å; V53-L57 HydrophobicContact CG1-CD1 3.99Å; V53-L57 VanDerWaalsContact O-CG 3.29Å; V53-L57 WeakPolarHBondContact O-CG 3.42Å; V53-L57 PolarHBondContact O-N 2.82Å; V53-A69 HydrophobicContact CB-CB 4.15Å; V53-A69 HydrophobicContact CG1-CB 3.7Å; V53-I73 HydrophobicContact CB-CD1 4.44Å; V53-I73 HydrophobicContact CG2-CD1 4.17Å; V53-I73 HydrophobicContact CG2-CG1 4.18Å; V53-L104 HydrophobicContact CG1-CD2 4.15Å; V53-L104 HydrophobicContact CG2-CD2 4.49Å; V53-I108 HydrophobicContact CG2-CG1 4.19Å
54	C	84.7	Confident	80.1	Confident	9 Å²	9	62.2 Å²	62.2	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-56.9	-41.6	170.6	-63.1	0	0	0	0	112	V50 S51 L57 D58 A69	V50-C54 PolarHBondContact O-N 3.41Å; V50-C54 PolarHBondContact O-SG 2.9Å; S51-C54 PolarHBondContact O-N 3.02Å; C54-L57 PolarHBondContact O-N 3.44Å; C54-D58 WeakPolarHBondContact O-CB 3.36Å; C54-D58 PolarHBondContact O-N 3.47Å; C54-A69 WeakPolarHBondContact SG-CB 3.21Å
55	T	85.1	Confident	80.6	Confident	64 Å²	64	60.2 Å²	60.2	39%	0.393	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-41.7	-178.1	-53.9	0	0	0	0	112	S51 K52 V53 D58 N59	S51-T55 PolarHBondContact O-N 2.88Å; S51-T55 PolarHBondContact O-OG1 3.3Å; K52-T55 WeakPolarHBondContact O-CB 3.41Å; K52-T55 PolarHBondContact O-N 3.14Å; V53-T55 VanDerWaalsContact C-N 3.27Å; V53-T55 PolarHBondContact O-N 2.86Å; T55-D58 PolarHBondContact O-N 3.28Å; T55-N59 WeakPolarHBondContact O-CB 2.96Å; T55-N59 PolarHBondContact O-N 2.87Å; T55-N59 PolarHBondContact O-ND2 3.45Å
56	E	81.9	Confident	81	Confident	46 Å²	46	61 Å²	61	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-67	-37.8	174.7	-71.1	-62.8	124.4	0	0	112.6	K52 V53 H60 L104 L107	K52-E56 PolarHBondContact O-N 3.21Å; V53-E56 PolarHBondContact O-N 3.38Å; E56-H60 WeakPolarHBondContact O-CB 3.5Å; E56-H60 PolarHBondContact O-N 2.89Å; E56-H60 VanDerWaalsContact O-N 3.12Å; E56-L104 HydrophobicContact CB-CD2 4.02Å; E56-L107 HydrophobicContact CG-CD1 3.65Å
57	L	82.1	Confident	81	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-66.4	-38.7	174.1	-68.5	170.2	0	0	0	111.8	V53 C54 L61 G62 I63 L68 A69 F96 L104	V53-L57 HydrophobicContact CG1-CD1 3.99Å; V53-L57 VanDerWaalsContact O-CG 3.29Å; V53-L57 WeakPolarHBondContact O-CG 3.42Å; V53-L57 PolarHBondContact O-N 2.82Å; C54-L57 PolarHBondContact O-N 3.44Å; L57-L61 HydrophobicContact CD2-CD1 3.92Å; L57-L61 WeakPolarHBondContact O-CA 3.33Å; L57-L61 VanDerWaalsContact O-CB 3.27Å; L57-L61 WeakPolarHBondContact O-CB 3.48Å; L57-L61 PolarHBondContact O-N 3.4Å; L57-G62 PolarHBondContact O-N 2.74Å; L57-I63 CarbonylContact C-O 3.49Å; L57-L68 HydrophobicContact CD1-CD2 4.45Å; L57-L68 HydrophobicContact CD1-CG 4.43Å; L57-A69 HydrophobicContact CD1-CB 4.39Å; L57-F96 HydrophobicContact CD2-CE2 4.28Å; L57-F96 HydrophobicContact CD2-CZ 4.1Å; L57-L104 HydrophobicContact CD2-CD1 4.29Å
58	D	83.1	Confident	80.9	Confident	65 Å²	65	61.3 Å²	61.3	35%	0.348	34%	0.339	S	S	.	.	H	α-helix	trans	-68.2	-45.8	175.7	-156.5	12.5	0	0	0	111.2	C54 T55 H60 G62 I63 N64	C54-D58 WeakPolarHBondContact O-CB 3.36Å; C54-D58 PolarHBondContact O-N 3.47Å; T55-D58 PolarHBondContact O-N 3.28Å; D58-H60 VanDerWaalsContact C-N 3.29Å; D58-H60 PolarHBondContact O-N 3.09Å; D58-G62 VanDerWaalsContact O-CA 3.28Å; D58-G62 WeakPolarHBondContact O-CA 3.34Å; D58-G62 PolarHBondContact O-N 2.79Å; D58-G62 WeakPolarHBondContact OD1-CA 3.44Å; D58-I63 PolarHBondContact N-O 3.31Å; D58-N64 HydrophobicContact CB-CB 4.2Å; D58-N64 WeakPolarHBondContact OD2-CB 3.3Å; D58-N64 PolarHBondContact OD2-ND2 3.03Å
59	N	82.2	Confident	80.9	Confident	113 Å²	113	58.8 Å²	58.8	60%	0.604	32%	0.321	S	S	*	.	H	α-helix	trans	-57.2	-37.5	176.7	-76.6	-23.4	0	0	0	113.6	T55	T55-N59 WeakPolarHBondContact O-CB 2.96Å; T55-N59 PolarHBondContact O-N 2.87Å; T55-N59 PolarHBondContact O-ND2 3.45Å
60	H	75.3	Confident	80.9	Confident	102 Å²	102	61.2 Å²	61.2	47%	0.472	33%	0.332	S	S	.	.	H	α-helix	trans	-101	-23.4	-175	-80.8	-73	0	0	0	115.4	E56 D58 L100	E56-H60 WeakPolarHBondContact O-CB 3.5Å; E56-H60 PolarHBondContact O-N 2.89Å; E56-H60 VanDerWaalsContact O-N 3.12Å; D58-H60 VanDerWaalsContact C-N 3.29Å; D58-H60 PolarHBondContact O-N 3.09Å; H60-L100 HydrophobicContact CB-CD1 4.21Å; H60-L100 HydrophobicContact CB-CD2 3.91Å
61	L	74.9	Confident	80.8	Confident	73 Å²	73	65.3 Å²	65.3	38%	0.382	35%	0.35	S	S	.	.	H	α-helix	trans	-128.3	-14.3	-174.2	-54.3	169	0	0	0	113.7	L57 I63 F96	L57-L61 HydrophobicContact CD2-CD1 3.92Å; L57-L61 WeakPolarHBondContact O-CA 3.33Å; L57-L61 VanDerWaalsContact O-CB 3.27Å; L57-L61 WeakPolarHBondContact O-CB 3.48Å; L57-L61 PolarHBondContact O-N 3.4Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 HydrophobicContact CB-CB 4.47Å; L61-I63 HydrophobicContact CB-CD1 4.14Å; L61-I63 HydrophobicContact CB-CG1 4.11Å; L61-F96 HydrophobicContact CD1-CD1 3.96Å; L61-F96 HydrophobicContact CD1-CE1 3.46Å; L61-F96 VanDerWaalsContact CD1-CE1 3.46Å; L61-F96 HydrophobicContact CD1-CZ 4.09Å
62	G	75.2	Confident	80.7	Confident	57 Å²	57	62.1 Å²	62.1	59%	0.588	33%	0.328	S	S	*	.	S	Bend	trans	69.2	30.3	-171.9	0	0	0	0	0	113.5	L57 D58	L57-G62 PolarHBondContact O-N 2.74Å; D58-G62 VanDerWaalsContact O-CA 3.28Å; D58-G62 WeakPolarHBondContact O-CA 3.34Å; D58-G62 PolarHBondContact O-N 2.79Å; D58-G62 WeakPolarHBondContact OD1-CA 3.44Å
63	I	75.2	Confident	80.8	Confident	75 Å²	75	57.9 Å²	57.9	39%	0.385	31%	0.309	S	S	.	.			trans	-120.9	104.4	-178.5	-56.4	175.8	0	0	0	109.2	L57 D58 L61 D65 L68	L57-I63 CarbonylContact C-O 3.49Å; D58-I63 PolarHBondContact N-O 3.31Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 HydrophobicContact CB-CB 4.47Å; L61-I63 HydrophobicContact CB-CD1 4.14Å; L61-I63 HydrophobicContact CB-CG1 4.11Å; I63-D65 HydrophobicContact CG2-CB 4.04Å; I63-L68 HydrophobicContact CG2-CD2 3.93Å
64	N	74.9	Confident	80.7	Confident	110 Å²	110	59.5 Å²	59.5	59%	0.588	32%	0.321	S	S	*	.			trans	-102.1	80.4	174.5	-155.8	-38.3	0	0	0	109.7	D58	D58-N64 HydrophobicContact CB-CB 4.2Å; D58-N64 WeakPolarHBondContact OD2-CB 3.3Å; D58-N64 PolarHBondContact OD2-ND2 3.03Å
65	D	80.8	Confident	80.5	Confident	76 Å²	76	59.3 Å²	59.3	41%	0.406	32%	0.319	S	S	.	.			trans	-125.2	126.7	-179.1	-170	-28.2	0	0	0	110	I63 D67 L68 A69	I63-D65 HydrophobicContact CG2-CB 4.04Å; D65-D67 PolarHBondContact OD1-N 3.46Å; D65-L68 HydrophobicContact CB-CB 3.96Å; D65-L68 PolarHBondContact OD1-N 3.34Å; D65-A69 PolarHBondContact O-N 3.42Å
66	K	81.5	Confident	80.2	Confident	100 Å²	100	56.6 Å²	56.6	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-76.7	-38.8	-176.2	-175.7	174.1	176.4	-79.4	0	112.4	V50 L68 A69 E70	V50-K66 HydrophobicContact CG1-CG 3.85Å; K66-L68 VanDerWaalsContact C-N 3.3Å; K66-L68 PolarHBondContact O-N 3.34Å; K66-A69 PolarHBondContact O-N 3Å; K66-E70 VanDerWaalsContact CE-OE1 3.29Å; K66-E70 WeakPolarHBondContact CE-OE1 3.48Å; K66-E70 IonicContact NZ-OE1 3.16Å; K66-E70 PolarHBondContact NZ-OE1 2.94Å; K66-E70 PolarHBondContact O-N 3.48Å
67	D	79.8	Confident	80	Confident	121 Å²	121	58.7 Å²	58.7	65%	0.647	31%	0.313	S	S	*	.	H	α-helix	trans	-72	-34.2	-176.3	-64.6	-5.3	0	0	0	109.6	D65 F71	D65-D67 PolarHBondContact OD1-N 3.46Å; D67-F71 WeakPolarHBondContact O-CB 3.37Å; D67-F71 PolarHBondContact O-N 3.06Å
68	L	79.1	Confident	79.8	Confident	55 Å²	55	65 Å²	65	29%	0.288	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-42.9	170.7	-176.2	63	0	0	0	112.3	L57 I63 D65 K66 F71 V72	L57-L68 HydrophobicContact CD1-CD2 4.45Å; L57-L68 HydrophobicContact CD1-CG 4.43Å; I63-L68 HydrophobicContact CG2-CD2 3.93Å; D65-L68 HydrophobicContact CB-CB 3.96Å; D65-L68 PolarHBondContact OD1-N 3.34Å; K66-L68 VanDerWaalsContact C-N 3.3Å; K66-L68 PolarHBondContact O-N 3.34Å; L68-F71 PolarHBondContact O-N 3.21Å; L68-V72 WeakPolarHBondContact O-CG2 3.14Å; L68-V72 PolarHBondContact O-N 3.14Å
69	A	82.6	Confident	79.5	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-44.5	178.2	0	0	0	0	0	112.2	V50 V53 C54 L57 D65 K66 F71 V72 I73	V50-A69 HydrophobicContact CG1-CB 4.2Å; V53-A69 HydrophobicContact CB-CB 4.15Å; V53-A69 HydrophobicContact CG1-CB 3.7Å; C54-A69 WeakPolarHBondContact SG-CB 3.21Å; L57-A69 HydrophobicContact CD1-CB 4.39Å; D65-A69 PolarHBondContact O-N 3.42Å; K66-A69 PolarHBondContact O-N 3Å; A69-F71 VanDerWaalsContact C-N 3.32Å; A69-F71 PolarHBondContact O-N 2.75Å; A69-V72 PolarHBondContact O-N 3.25Å; A69-I73 WeakPolarHBondContact O-CD1 3.21Å; A69-I73 VanDerWaalsContact O-CG1 3.29Å; A69-I73 WeakPolarHBondContact O-CG1 3.14Å; A69-I73 PolarHBondContact O-N 3.29Å
70	E	84.7	Confident	79.1	Confident	55 Å²	55	64.6 Å²	64.6	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-37.6	174.1	-72.3	-176.1	-167.2	0	0	111.8	Y46 V50 K66 I73 S74	Y46-E70 HydrophobicContact CE1-CG 4.39Å; V50-E70 HydrophobicContact CB-CG 4.45Å; V50-E70 HydrophobicContact CG1-CG 3.89Å; V50-E70 HydrophobicContact CG2-CG 3.6Å; K66-E70 VanDerWaalsContact CE-OE1 3.29Å; K66-E70 WeakPolarHBondContact CE-OE1 3.48Å; K66-E70 IonicContact NZ-OE1 3.16Å; K66-E70 PolarHBondContact NZ-OE1 2.94Å; K66-E70 PolarHBondContact O-N 3.48Å; E70-I73 PolarHBondContact O-N 3.26Å; E70-S74 PolarHBondContact O-N 3.45Å
71	F	82.3	Confident	79.3	Confident	89 Å²	89	62.8 Å²	62.8	39%	0.39	34%	0.339	S	S	.	.	H	α-helix	trans	-63.7	-46.1	173.5	-177.2	-110.2	0	0	0	112.7	D67 L68 A69 I73 S74 L75	D67-F71 WeakPolarHBondContact O-CB 3.37Å; D67-F71 PolarHBondContact O-N 3.06Å; L68-F71 PolarHBondContact O-N 3.21Å; A69-F71 VanDerWaalsContact C-N 3.32Å; A69-F71 PolarHBondContact O-N 2.75Å; F71-I73 VanDerWaalsContact C-N 3.33Å; F71-I73 PolarHBondContact O-N 3.36Å; F71-S74 WeakPolarHBondContact O-CB 3.24Å; F71-S74 PolarHBondContact O-N 2.85Å; F71-S74 VanDerWaalsContact O-N 3.09Å; F71-S74 PolarHBondContact O-OG 3.04Å; F71-L75 HydrophobicContact CD1-CD1 4.16Å; F71-L75 HydrophobicContact CE1-CD1 3.69Å; F71-L75 HydrophobicContact CE1-CG 4.23Å; F71-L75 HydrophobicContact CZ-CD1 4.12Å; F71-L75 HydrophobicContact CZ-CD2 4.25Å; F71-L75 HydrophobicContact CZ-CG 4.29Å; F71-L75 PolarHBondContact O-N 2.9Å
72	V	83	Confident	79.5	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-40	176.9	169.1	0	0	0	0	111.5	L68 A69 L75 A76 F85	L68-V72 WeakPolarHBondContact O-CG2 3.14Å; L68-V72 PolarHBondContact O-N 3.14Å; A69-V72 PolarHBondContact O-N 3.25Å; V72-L75 PolarHBondContact O-N 3.41Å; V72-A76 PolarHBondContact O-N 3.33Å; V72-A76 VanDerWaalsContact O-N 3.14Å; V72-F85 HydrophobicContact CG1-CZ 4.04Å
73	I	85.3	Confident	79.7	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-46.3	172	-67.9	160.7	0	0	0	110.3	Y46 L49 V50 V53 A69 E70 F71 L75 A76 E77 I108	Y46-I73 HydrophobicContact CE2-CG2 4.18Å; L49-I73 HydrophobicContact CD2-CD1 4.3Å; L49-I73 HydrophobicContact CD2-CG2 4.48Å; L49-I73 HydrophobicContact CG-CD1 3.98Å; V50-I73 HydrophobicContact CB-CD1 4.41Å; V50-I73 HydrophobicContact CG2-CD1 3.71Å; V53-I73 HydrophobicContact CB-CD1 4.44Å; V53-I73 HydrophobicContact CG2-CD1 4.17Å; V53-I73 HydrophobicContact CG2-CG1 4.18Å; A69-I73 WeakPolarHBondContact O-CD1 3.21Å; A69-I73 VanDerWaalsContact O-CG1 3.29Å; A69-I73 WeakPolarHBondContact O-CG1 3.14Å; A69-I73 PolarHBondContact O-N 3.29Å; E70-I73 PolarHBondContact O-N 3.26Å; F71-I73 VanDerWaalsContact C-N 3.33Å; F71-I73 PolarHBondContact O-N 3.36Å; I73-L75 PolarHBondContact O-N 3.02Å; I73-A76 PolarHBondContact O-N 3.33Å; I73-A76 VanDerWaalsContact O-N 3.13Å; I73-E77 WeakPolarHBondContact O-CG 2.97Å; I73-E77 PolarHBondContact O-N 3.11Å; I73-I108 HydrophobicContact CG1-CD1 4.07Å; I73-I108 HydrophobicContact CG1-CG1 4.13Å
74	S	80.9	Confident	79.8	Confident	35 Å²	35	62.4 Å²	62.4	25%	0.245	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-23.5	177.9	88.8	0	0	0	0	114.5	E70 F71 K78	E70-S74 PolarHBondContact O-N 3.45Å; F71-S74 WeakPolarHBondContact O-CB 3.24Å; F71-S74 PolarHBondContact O-N 2.85Å; F71-S74 VanDerWaalsContact O-N 3.09Å; F71-S74 PolarHBondContact O-OG 3.04Å; S74-K78 WeakPolarHBondContact O-CD 3.3Å; S74-K78 WeakPolarHBondContact O-CE 3.4Å; S74-K78 WeakPolarHBondContact O-CG 3.29Å
75	L	81	Confident	80.2	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-78	-41.1	173.2	-69.3	179.3	0	0	0	111.4	F71 V72 I73 E77 K78 Q79 F85 L89	F71-L75 HydrophobicContact CD1-CD1 4.16Å; F71-L75 HydrophobicContact CE1-CD1 3.69Å; F71-L75 HydrophobicContact CE1-CG 4.23Å; F71-L75 HydrophobicContact CZ-CD1 4.12Å; F71-L75 HydrophobicContact CZ-CD2 4.25Å; F71-L75 HydrophobicContact CZ-CG 4.29Å; F71-L75 PolarHBondContact O-N 2.9Å; V72-L75 PolarHBondContact O-N 3.41Å; I73-L75 PolarHBondContact O-N 3.02Å; L75-E77 VanDerWaalsContact C-N 3.28Å; L75-E77 PolarHBondContact O-N 2.9Å; L75-K78 HydrophobicContact CD2-CD 4.4Å; L75-K78 PolarHBondContact O-N 3.41Å; L75-K78 VanDerWaalsContact O-N 3.12Å; L75-Q79 PolarHBondContact O-N 2.76Å; L75-F85 HydrophobicContact CB-CD2 4.34Å; L75-F85 HydrophobicContact CB-CE2 4.02Å; L75-L89 HydrophobicContact CD1-CD2 3.98Å
76	A	79.1	Confident	80.3	Confident	6 Å²	6	56.1 Å²	56.1	5%	0.05	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-30.7	174.8	0	0	0	0	0	112.6	V72 I73 K78 Q79 F85 L105 I108	V72-A76 PolarHBondContact O-N 3.33Å; V72-A76 VanDerWaalsContact O-N 3.14Å; I73-A76 PolarHBondContact O-N 3.33Å; I73-A76 VanDerWaalsContact O-N 3.13Å; A76-K78 VanDerWaalsContact C-N 3.32Å; A76-K78 PolarHBondContact O-N 2.8Å; A76-Q79 CarbonylContact O-C 3.58Å; A76-F85 HydrophobicContact CB-CD2 4.02Å; A76-F85 HydrophobicContact CB-CE2 3.65Å; A76-F85 HydrophobicContact CB-CZ 4.03Å; A76-L105 HydrophobicContact CB-CD1 4.16Å; A76-I108 HydrophobicContact CB-CB 4.46Å; A76-I108 HydrophobicContact CB-CD1 3.77Å; A76-I108 HydrophobicContact CB-CG2 3.95Å
77	E	76.7	Confident	80.3	Confident	91 Å²	91	54 Å²	54	43%	0.425	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-29.7	172.2	-69.2	-166.8	161.6	0	0	113.4	I73 L75 R112	I73-E77 WeakPolarHBondContact O-CG 2.97Å; I73-E77 PolarHBondContact O-N 3.11Å; L75-E77 VanDerWaalsContact C-N 3.28Å; L75-E77 PolarHBondContact O-N 2.9Å; E77-R112 IonicContact OE1-CZ 2.77Å; E77-R112 IonicContact OE1-NE 3.85Å; E77-R112 PolarHBondContact OE1-NE 3.31Å; E77-R112 IonicContact OE1-NH2 2.93Å; E77-R112 PolarHBondContact OE1-NH2 2.72Å; E77-R112 IonicContact OE2-NH2 2.83Å
78	K	78.4	Confident	80.1	Confident	134 Å²	134	49.6 Å²	49.6	58%	0.583	27%	0.265	S	S	*	.	H	α-helix	trans	-77.9	-35.9	-179.3	-71	162.8	-170.8	159.1	0	112.7	S74 L75 A76	S74-K78 WeakPolarHBondContact O-CD 3.3Å; S74-K78 WeakPolarHBondContact O-CE 3.4Å; S74-K78 WeakPolarHBondContact O-CG 3.29Å; L75-K78 HydrophobicContact CD2-CD 4.4Å; L75-K78 PolarHBondContact O-N 3.41Å; L75-K78 VanDerWaalsContact O-N 3.12Å; A76-K78 VanDerWaalsContact C-N 3.32Å; A76-K78 PolarHBondContact O-N 2.8Å
79	Q	76.8	Confident	80.2	Confident	79 Å²	79	47.1 Å²	47.1	37%	0.369	25%	0.252	S	S	.	.			trans	-140.3	108.8	174.3	-66.4	-166.4	22.3	0	0	111.3	L75 A76 S81 L88	L75-Q79 PolarHBondContact O-N 2.76Å; A76-Q79 CarbonylContact O-C 3.58Å; Q79-S81 VanDerWaalsContact C-N 3.28Å; Q79-S81 PolarHBondContact O-N 2.97Å; Q79-L88 HydrophobicContact CB-CD1 4.05Å; Q79-L88 HydrophobicContact CG-CD1 3.77Å
80	P	73.9	Confident	80	Confident	90 Å²	90	51.6 Å²	51.6	58%	0.584	28%	0.276	S	S	*	.			trans	-82.5	2.7	-179.6	33.6	-36.5	0	0	0	114	Q109	P80-Q109 PolarHBondContact O-NE2 3.14Å
81	S	78.8	Confident	79.7	Confident	63 Å²	63	56.5 Å²	56.5	44%	0.441	30%	0.298	S	S	.	.	S	Bend	trans	-88.5	141	174.9	52.4	0	0	0	0	111.1	Q79 D83 G84 F85	Q79-S81 VanDerWaalsContact C-N 3.28Å; Q79-S81 PolarHBondContact O-N 2.97Å; S81-D83 PolarHBondContact O-N 3.4Å; S81-G84 PolarHBondContact O-N 2.87Å; S81-F85 WeakPolarHBondContact O-CB 3.06Å; S81-F85 PolarHBondContact O-N 2.98Å
82	F	78.9	Confident	79.3	Confident	65 Å²	65	56.5 Å²	56.5	29%	0.285	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-51	-177.1	176.4	-102.6	0	0	0	113	G84 F85 K86 D98 I101 L105	F82-G84 VanDerWaalsContact C-N 3.28Å; F82-G84 PolarHBondContact O-N 2.87Å; F82-F85 PolarHBondContact O-N 2.88Å; F82-K86 HydrophobicContact CE1-CD 4.43Å; F82-K86 VanDerWaalsContact O-CB 3.27Å; F82-K86 WeakPolarHBondContact O-CB 3.16Å; F82-K86 PolarHBondContact O-N 2.82Å; F82-D98 HydrophobicContact CZ-CB 4.25Å; F82-I101 HydrophobicContact CD2-CG2 4.18Å; F82-I101 HydrophobicContact CE2-CB 4.12Å; F82-I101 HydrophobicContact CE2-CG2 3.8Å; F82-L105 HydrophobicContact CB-CD2 4.16Å; F82-L105 HydrophobicContact CD2-CD2 4.48Å
83	D	80.1	Confident	78.5	Confident	123 Å²	123	59.5 Å²	59.5	66%	0.658	33%	0.334	S	S	*	.	H	α-helix	trans	-64.9	-33.2	-179.6	-57.3	-46.1	0	0	0	112.5	S81 A87	S81-D83 PolarHBondContact O-N 3.4Å; D83-A87 WeakPolarHBondContact O-CB 3.34Å; D83-A87 PolarHBondContact O-N 2.88Å
84	G	78.3	Confident	77.6	Confident	9 Å²	9	60.6 Å²	60.6	9%	0.093	34%	0.343	C	S	.	.	H	α-helix	trans	-72.3	-46	178.3	0	0	0	0	0	113	S81 F82 A87 L88	S81-G84 PolarHBondContact O-N 2.87Å; F82-G84 VanDerWaalsContact C-N 3.28Å; F82-G84 PolarHBondContact O-N 2.87Å; G84-A87 PolarHBondContact O-N 2.92Å; G84-L88 PolarHBondContact O-N 3.36Å
85	F	82.7	Confident	76.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.1	-42.2	173.2	-178.6	-127.6	0	0	0	111.5	V72 L75 A76 S81 F82 L88 L89 I101 L105	V72-F85 HydrophobicContact CG1-CZ 4.04Å; L75-F85 HydrophobicContact CB-CD2 4.34Å; L75-F85 HydrophobicContact CB-CE2 4.02Å; A76-F85 HydrophobicContact CB-CD2 4.02Å; A76-F85 HydrophobicContact CB-CE2 3.65Å; A76-F85 HydrophobicContact CB-CZ 4.03Å; S81-F85 WeakPolarHBondContact O-CB 3.06Å; S81-F85 PolarHBondContact O-N 2.98Å; F82-F85 PolarHBondContact O-N 2.88Å; F85-L88 PolarHBondContact O-N 3.09Å; F85-L89 HydrophobicContact CD1-CD1 4.07Å; F85-L89 HydrophobicContact CD2-CD1 4.31Å; F85-L89 HydrophobicContact CD2-CG 4.45Å; F85-L89 HydrophobicContact CE1-CD1 3.79Å; F85-L89 HydrophobicContact CE2-CD1 4.03Å; F85-L89 HydrophobicContact CE2-CD2 4.47Å; F85-L89 HydrophobicContact CE2-CG 4.22Å; F85-L89 HydrophobicContact CG-CD1 4.34Å; F85-L89 HydrophobicContact CZ-CD1 3.77Å; F85-L89 HydrophobicContact CZ-CG 4.41Å; F85-L89 WeakPolarHBondContact O-CG 3.31Å; F85-L89 PolarHBondContact O-N 3.35Å; F85-I101 HydrophobicContact CD1-CG2 3.67Å; F85-I101 HydrophobicContact CE1-CG2 3.99Å; F85-L105 HydrophobicContact CB-CD1 4.49Å; F85-L105 HydrophobicContact CD1-CB 3.92Å; F85-L105 HydrophobicContact CD1-CD1 4.01Å; F85-L105 HydrophobicContact CD1-CD2 4.3Å; F85-L105 HydrophobicContact CD1-CG 4.3Å; F85-L105 HydrophobicContact CE1-CB 4.02Å; F85-L105 HydrophobicContact CE1-CD1 4.43Å; F85-L105 HydrophobicContact CG-CD1 4.25Å
86	K	81.8	Confident	76.8	Confident	54 Å²	54	68.8 Å²	68.8	24%	0.235	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-44	173.7	178.7	170.3	173.5	178.2	0	112.4	F82 L89 L90 D98 I101	F82-K86 HydrophobicContact CE1-CD 4.43Å; F82-K86 VanDerWaalsContact O-CB 3.27Å; F82-K86 WeakPolarHBondContact O-CB 3.16Å; F82-K86 PolarHBondContact O-N 2.82Å; K86-L89 PolarHBondContact O-N 2.96Å; K86-L90 HydrophobicContact CG-CD1 4.19Å; K86-L90 PolarHBondContact O-N 2.85Å; K86-L90 VanDerWaalsContact O-N 3.09Å; K86-D98 WeakPolarHBondContact CE-OD1 3.21Å; K86-D98 IonicContact NZ-OD1 3.61Å; K86-D98 PolarHBondContact NZ-OD1 3.02Å; K86-D98 IonicContact NZ-OD2 2.72Å; K86-D98 PolarHBondContact NZ-OD2 3.37Å; K86-I101 HydrophobicContact CB-CD1 4.3Å; K86-I101 HydrophobicContact CB-CG2 4.3Å; K86-I101 HydrophobicContact CD-CD1 4.38Å; K86-I101 HydrophobicContact CG-CD1 3.95Å
87	A	81.4	Confident	76.9	Confident	56 Å²	56	72.3 Å²	72.3	46%	0.463	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-44.5	177	0	0	0	0	0	112.2	D83 G84 L90 E91	D83-A87 WeakPolarHBondContact O-CB 3.34Å; D83-A87 PolarHBondContact O-N 2.88Å; G84-A87 PolarHBondContact O-N 2.92Å; A87-L90 PolarHBondContact O-N 3.36Å; A87-E91 WeakPolarHBondContact O-CB 3.35Å; A87-E91 PolarHBondContact O-N 2.87Å
88	L	77.2	Confident	76.9	Confident	28 Å²	28	71.8 Å²	71.8	15%	0.147	40%	0.398	C	S	.	.	H	α-helix	trans	-65.1	-37.5	177.4	-78.6	168.1	0	0	0	113.1	Q79 G84 F85 E91 N92	Q79-L88 HydrophobicContact CB-CD1 4.05Å; Q79-L88 HydrophobicContact CG-CD1 3.77Å; G84-L88 PolarHBondContact O-N 3.36Å; F85-L88 PolarHBondContact O-N 3.09Å; L88-E91 PolarHBondContact O-N 3.23Å; L88-N92 PolarHBondContact O-N 3.06Å; L88-N92 VanDerWaalsContact O-N 3.09Å; L88-N92 PolarHBondContact O-ND2 3.02Å
89	L	79.5	Confident	77	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.016	40%	0.395	C	S	.	.	H	α-helix	trans	-64.2	-44.3	174.4	-74.3	168.3	0	0	0	111.5	L75 F85 K86 N92 G93 A94 F96 I101	L75-L89 HydrophobicContact CD1-CD2 3.98Å; F85-L89 HydrophobicContact CD1-CD1 4.07Å; F85-L89 HydrophobicContact CD2-CD1 4.31Å; F85-L89 HydrophobicContact CD2-CG 4.45Å; F85-L89 HydrophobicContact CE1-CD1 3.79Å; F85-L89 HydrophobicContact CE2-CD1 4.03Å; F85-L89 HydrophobicContact CE2-CD2 4.47Å; F85-L89 HydrophobicContact CE2-CG 4.22Å; F85-L89 HydrophobicContact CG-CD1 4.34Å; F85-L89 HydrophobicContact CZ-CD1 3.77Å; F85-L89 HydrophobicContact CZ-CG 4.41Å; F85-L89 WeakPolarHBondContact O-CG 3.31Å; F85-L89 PolarHBondContact O-N 3.35Å; K86-L89 PolarHBondContact O-N 2.96Å; L89-N92 CarbonylContact O-C 3.4Å; L89-N92 PolarHBondContact O-N 3.44Å; L89-G93 PolarHBondContact O-N 2.84Å; L89-A94 HydrophobicContact CB-CB 4.33Å; L89-A94 HydrophobicContact CD2-CB 4.27Å; L89-A94 WeakPolarHBondContact O-CB 3.35Å; L89-A94 PolarHBondContact O-N 2.73Å; L89-F96 HydrophobicContact CD1-CD2 4.14Å; L89-F96 HydrophobicContact CD2-CD2 4.28Å; L89-F96 HydrophobicContact CD2-CE2 4.05Å; L89-I101 HydrophobicContact CD1-CD1 4.29Å; L89-I101 HydrophobicContact CD1-CG1 4.01Å; L89-I101 HydrophobicContact CD1-CG2 4.15Å
90	L	78.9	Confident	77.2	Confident	95 Å²	95	65.2 Å²	65.2	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-62.2	-42.5	174.3	-90.7	154.2	0	0	0	112.7	K86 A87 N92 G93	K86-L90 HydrophobicContact CG-CD1 4.19Å; K86-L90 PolarHBondContact O-N 2.85Å; K86-L90 VanDerWaalsContact O-N 3.09Å; A87-L90 PolarHBondContact O-N 3.36Å; L90-N92 VanDerWaalsContact C-N 3.26Å; L90-N92 PolarHBondContact O-N 3.05Å; L90-G93 PolarHBondContact O-N 3.29Å
91	E	79	Confident	77.6	Confident	157 Å²	157	61.1 Å²	61.1	73%	0.734	35%	0.351	S	S	*	.	H	α-helix	trans	-62.5	-33.1	176.6	-173.2	174.9	-155.1	0	0	112.4	A87 L88 G93	A87-E91 WeakPolarHBondContact O-CB 3.35Å; A87-E91 PolarHBondContact O-N 2.87Å; L88-E91 PolarHBondContact O-N 3.23Å; E91-G93 VanDerWaalsContact C-N 3.31Å
92	N	74.6	Confident	77.6	Confident	89 Å²	89	60.8 Å²	60.8	48%	0.476	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	11.1	175.1	-70.3	-94.2	0	0	0	113.3	L88 L89 L90	L88-N92 PolarHBondContact O-N 3.06Å; L88-N92 VanDerWaalsContact O-N 3.09Å; L88-N92 PolarHBondContact O-ND2 3.02Å; L89-N92 CarbonylContact O-C 3.4Å; L89-N92 PolarHBondContact O-N 3.44Å; L90-N92 VanDerWaalsContact C-N 3.26Å; L90-N92 PolarHBondContact O-N 3.05Å
93	G	64.6	Low	77.8	Confident	67 Å²	67	61 Å²	61	69%	0.691	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	15.7	172.3	0	0	0	0	0	116.1	L89 L90 E91	L89-G93 PolarHBondContact O-N 2.84Å; L90-G93 PolarHBondContact O-N 3.29Å; E91-G93 VanDerWaalsContact C-N 3.31Å
94	A	66.8	Low	77.9	Confident	23 Å²	23	55.1 Å²	55.1	19%	0.19	32%	0.321	C	S	.	.			trans	-96.6	93.2	-180	0	0	0	0	0	112.1	L89 F96	L89-A94 HydrophobicContact CB-CB 4.33Å; L89-A94 HydrophobicContact CD2-CB 4.27Å; L89-A94 WeakPolarHBondContact O-CB 3.35Å; L89-A94 PolarHBondContact O-N 2.73Å; A94-F96 VanDerWaalsContact C-N 3.27Å; A94-F96 HydrophobicContact CB-CD1 4.28Å; A94-F96 HydrophobicContact CB-CD2 4.34Å; A94-F96 HydrophobicContact CB-CE1 3.96Å; A94-F96 HydrophobicContact CB-CE2 4.03Å; A94-F96 HydrophobicContact CB-CG 4.46Å; A94-F96 HydrophobicContact CB-CZ 3.83Å; A94-F96 PolarHBondContact O-N 3.05Å
95	E	66.7	Low	78.1	Confident	179 Å²	179	55.3 Å²	55.3	84%	0.836	32%	0.32	S	S	*	.			trans	-75.6	73.5	172.7	-67.3	-171	162	0	0	111.7
96	F	79.5	Confident	78.1	Confident	33 Å²	33	63.6 Å²	63.6	15%	0.145	35%	0.351	C	S	.	.			trans	-88.5	154	173.6	-61.1	-17.9	0	0	0	111.9	L57 L61 L89 A94 L100 I101	L57-F96 HydrophobicContact CD2-CE2 4.28Å; L57-F96 HydrophobicContact CD2-CZ 4.1Å; L61-F96 HydrophobicContact CD1-CD1 3.96Å; L61-F96 HydrophobicContact CD1-CE1 3.46Å; L61-F96 VanDerWaalsContact CD1-CE1 3.46Å; L61-F96 HydrophobicContact CD1-CZ 4.09Å; L89-F96 HydrophobicContact CD1-CD2 4.14Å; L89-F96 HydrophobicContact CD2-CD2 4.28Å; L89-F96 HydrophobicContact CD2-CE2 4.05Å; A94-F96 VanDerWaalsContact C-N 3.27Å; A94-F96 HydrophobicContact CB-CD1 4.28Å; A94-F96 HydrophobicContact CB-CD2 4.34Å; A94-F96 HydrophobicContact CB-CE1 3.96Å; A94-F96 HydrophobicContact CB-CE2 4.03Å; A94-F96 HydrophobicContact CB-CG 4.46Å; A94-F96 HydrophobicContact CB-CZ 3.83Å; A94-F96 PolarHBondContact O-N 3.05Å; F96-L100 HydrophobicContact CB-CD2 4.27Å; F96-L100 HydrophobicContact CG-CD2 4.28Å; F96-I101 HydrophobicContact CB-CD1 4.06Å; F96-I101 HydrophobicContact CB-CG1 3.71Å
97	T	80.9	Confident	78.1	Confident	80 Å²	80	62.9 Å²	62.9	49%	0.491	35%	0.35	S	S	.	.			trans	-74.6	145.8	175.9	55.2	0	0	0	0	111.5	S99 L100 I101	T97-S99 PolarHBondContact O-N 3.34Å; T97-S99 VanDerWaalsContact O-N 3.11Å; T97-S99 PolarHBondContact OG1-OG 2.68Å; T97-L100 WeakPolarHBondContact O-CA 3.25Å; T97-L100 WeakPolarHBondContact O-CB 3.25Å; T97-L100 PolarHBondContact O-N 3.26Å; T97-L100 WeakPolarHBondContact OG1-CB 3.28Å; T97-I101 WeakPolarHBondContact O-CG1 3.42Å; T97-I101 PolarHBondContact O-N 3.27Å
98	D	76.1	Confident	78.2	Confident	80 Å²	80	60.5 Å²	60.5	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-56.1	-32.4	-178.6	-74.2	12.9	0	0	0	113.5	F82 K86 S102	F82-D98 HydrophobicContact CZ-CB 4.25Å; K86-D98 WeakPolarHBondContact CE-OD1 3.21Å; K86-D98 IonicContact NZ-OD1 3.61Å; K86-D98 PolarHBondContact NZ-OD1 3.02Å; K86-D98 IonicContact NZ-OD2 2.72Å; K86-D98 PolarHBondContact NZ-OD2 3.37Å; D98-S102 VanDerWaalsContact O-CB 3.31Å; D98-S102 WeakPolarHBondContact O-CB 3.37Å; D98-S102 PolarHBondContact O-N 3.46Å
99	S	79.8	Confident	78.3	Confident	74 Å²	74	64.4 Å²	64.4	52%	0.517	35%	0.347	S	S	.	.	H	α-helix	trans	-67.4	-42.4	173.1	50.2	0	0	0	0	112.9	T97 S102 N103	T97-S99 PolarHBondContact O-N 3.34Å; T97-S99 VanDerWaalsContact O-N 3.11Å; T97-S99 PolarHBondContact OG1-OG 2.68Å; S99-S102 PolarHBondContact O-N 2.97Å; S99-N103 WeakPolarHBondContact O-CB 3.49Å; S99-N103 PolarHBondContact O-N 3.01Å
100	L	81.7	Confident	78.2	Confident	2 Å²	2	69 Å²	69	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-66.8	-44.3	176	179	60.1	0	0	0	111	H60 F96 T97 S102 N103 L104	H60-L100 HydrophobicContact CB-CD1 4.21Å; H60-L100 HydrophobicContact CB-CD2 3.91Å; F96-L100 HydrophobicContact CB-CD2 4.27Å; F96-L100 HydrophobicContact CG-CD2 4.28Å; T97-L100 WeakPolarHBondContact O-CA 3.25Å; T97-L100 WeakPolarHBondContact O-CB 3.25Å; T97-L100 PolarHBondContact O-N 3.26Å; T97-L100 WeakPolarHBondContact OG1-CB 3.28Å; L100-S102 VanDerWaalsContact C-N 3.29Å; L100-S102 PolarHBondContact O-N 3.34Å; L100-N103 PolarHBondContact O-N 3.38Å; L100-L104 HydrophobicContact CD1-CD1 3.98Å; L100-L104 HydrophobicContact CD1-CG 3.96Å; L100-L104 HydrophobicContact CG-CD1 3.88Å; L100-L104 HydrophobicContact CG-CG 4.31Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 2.85Å
101	I	81.3	Confident	77.7	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-59.2	-42	176.1	-61.8	174.2	0	0	0	110.5	F82 F85 K86 L89 F96 T97 L105	F82-I101 HydrophobicContact CD2-CG2 4.18Å; F82-I101 HydrophobicContact CE2-CB 4.12Å; F82-I101 HydrophobicContact CE2-CG2 3.8Å; F85-I101 HydrophobicContact CD1-CG2 3.67Å; F85-I101 HydrophobicContact CE1-CG2 3.99Å; K86-I101 HydrophobicContact CB-CD1 4.3Å; K86-I101 HydrophobicContact CB-CG2 4.3Å; K86-I101 HydrophobicContact CD-CD1 4.38Å; K86-I101 HydrophobicContact CG-CD1 3.95Å; L89-I101 HydrophobicContact CD1-CD1 4.29Å; L89-I101 HydrophobicContact CD1-CG1 4.01Å; L89-I101 HydrophobicContact CD1-CG2 4.15Å; F96-I101 HydrophobicContact CB-CD1 4.06Å; F96-I101 HydrophobicContact CB-CG1 3.71Å; T97-I101 WeakPolarHBondContact O-CG1 3.42Å; T97-I101 PolarHBondContact O-N 3.27Å; I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 PolarHBondContact O-N 2.93Å
102	S	80.3	Confident	77.2	Confident	56 Å²	56	65.1 Å²	65.1	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-66	-45.1	177.9	-165.4	0	0	0	0	112	D98 S99 L100 R106	D98-S102 VanDerWaalsContact O-CB 3.31Å; D98-S102 WeakPolarHBondContact O-CB 3.37Å; D98-S102 PolarHBondContact O-N 3.46Å; S99-S102 PolarHBondContact O-N 2.97Å; L100-S102 VanDerWaalsContact C-N 3.29Å; L100-S102 PolarHBondContact O-N 3.34Å; S102-R106 VanDerWaalsContact O-CB 3.25Å; S102-R106 WeakPolarHBondContact O-CB 3.5Å; S102-R106 PolarHBondContact O-N 2.95Å
103	N	81.9	Confident	76.4	Confident	69 Å²	69	63.3 Å²	63.3	37%	0.369	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-44.4	177.7	-77.5	-6.7	0	0	0	112.4	S99 L100 R106 L107	S99-N103 WeakPolarHBondContact O-CB 3.49Å; S99-N103 PolarHBondContact O-N 3.01Å; L100-N103 PolarHBondContact O-N 3.38Å; N103-R106 PolarHBondContact O-N 3.48Å; N103-L107 WeakPolarHBondContact O-CB 3.08Å; N103-L107 PolarHBondContact O-N 2.96Å
104	L	83.6	Confident	75.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.8	-48.8	177	-72.9	173.6	0	0	0	111.4	V53 E56 L57 L100 R106 L107 I108	V53-L104 HydrophobicContact CG1-CD2 4.15Å; V53-L104 HydrophobicContact CG2-CD2 4.49Å; E56-L104 HydrophobicContact CB-CD2 4.02Å; L57-L104 HydrophobicContact CD2-CD1 4.29Å; L100-L104 HydrophobicContact CD1-CD1 3.98Å; L100-L104 HydrophobicContact CD1-CG 3.96Å; L100-L104 HydrophobicContact CG-CD1 3.88Å; L100-L104 HydrophobicContact CG-CG 4.31Å; L100-L104 WeakPolarHBondContact O-CB 3.42Å; L100-L104 VanDerWaalsContact O-CG 3.29Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 2.85Å; L104-R106 VanDerWaalsContact C-N 3.29Å; L104-R106 PolarHBondContact O-N 3.1Å; L104-L107 PolarHBondContact O-N 2.88Å; L104-I108 WeakPolarHBondContact O-CD1 3.41Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.34Å; L104-I108 PolarHBondContact O-N 2.73Å
105	L	82.4	Confident	74.5	Confident	12 Å²	12	70 Å²	70	6%	0.063	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-41	177.5	-173.8	61.7	0	0	0	111.4	A76 F82 F85 I101 I108 Q109	A76-L105 HydrophobicContact CB-CD1 4.16Å; F82-L105 HydrophobicContact CB-CD2 4.16Å; F82-L105 HydrophobicContact CD2-CD2 4.48Å; F85-L105 HydrophobicContact CB-CD1 4.49Å; F85-L105 HydrophobicContact CD1-CB 3.92Å; F85-L105 HydrophobicContact CD1-CD1 4.01Å; F85-L105 HydrophobicContact CD1-CD2 4.3Å; F85-L105 HydrophobicContact CD1-CG 4.3Å; F85-L105 HydrophobicContact CE1-CB 4.02Å; F85-L105 HydrophobicContact CE1-CD1 4.43Å; F85-L105 HydrophobicContact CG-CD1 4.25Å; I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 PolarHBondContact O-N 2.93Å; L105-I108 PolarHBondContact O-N 3.18Å; L105-Q109 HydrophobicContact CD1-CG 4.43Å; L105-Q109 WeakPolarHBondContact O-CB 3.37Å; L105-Q109 VanDerWaalsContact O-CG 3.26Å; L105-Q109 WeakPolarHBondContact O-CG 3.39Å; L105-Q109 PolarHBondContact O-N 3.12Å
106	R	81.8	Confident	73.1	Confident	174 Å²	174	69 Å²	69	66%	0.657	37%	0.367	S	S	*	.	H	α-helix	trans	-65.4	-42.6	176.5	-174.4	178.6	179.7	-173.9	-0.4	112.7	S102 N103 L104 Q109 T110	S102-R106 VanDerWaalsContact O-CB 3.25Å; S102-R106 WeakPolarHBondContact O-CB 3.5Å; S102-R106 PolarHBondContact O-N 2.95Å; N103-R106 PolarHBondContact O-N 3.48Å; L104-R106 VanDerWaalsContact C-N 3.29Å; L104-R106 PolarHBondContact O-N 3.1Å; R106-Q109 PolarHBondContact O-N 2.75Å; R106-T110 HydrophobicContact CG-CG2 4.38Å; R106-T110 WeakPolarHBondContact O-CB 3.48Å; R106-T110 VanDerWaalsContact O-CG2 3.29Å; R106-T110 WeakPolarHBondContact O-CG2 3.49Å; R106-T110 PolarHBondContact O-N 3.05Å; R106-T110 PolarHBondContact O-OG1 3.14Å
107	L	82.2	Confident	70.8	Confident	40 Å²	40	71.7 Å²	71.7	21%	0.209	40%	0.396	C	S	.	.	H	α-helix	trans	-61.2	-46.2	174.9	-89.5	161.6	0	0	0	111.6	E56 N103 L104 Q109 T110 M111	E56-L107 HydrophobicContact CG-CD1 3.65Å; N103-L107 WeakPolarHBondContact O-CB 3.08Å; N103-L107 PolarHBondContact O-N 2.96Å; L104-L107 PolarHBondContact O-N 2.88Å; L107-Q109 PolarHBondContact O-N 3.21Å; L107-T110 PolarHBondContact O-N 2.87Å; L107-T110 PolarHBondContact O-OG1 3.46Å; L107-M111 HydrophobicContact CB-CE 4.42Å; L107-M111 HydrophobicContact CD2-CE 3.56Å; L107-M111 HydrophobicContact CD2-SD 4.19Å; L107-M111 PolarHBondContact O-N 3.07Å
108	I	83.7	Confident	68.4	Low	6 Å²	6	73.5 Å²	73.5	3%	0.031	41%	0.412	C	S	.	.	H	α-helix	trans	-66.2	-39	179.8	-64.1	162.5	0	0	0	111	L49 V53 I73 A76 L104 L105 R112	L49-I108 HydrophobicContact CD1-CG1 4.12Å; V53-I108 HydrophobicContact CG2-CG1 4.19Å; I73-I108 HydrophobicContact CG1-CD1 4.07Å; I73-I108 HydrophobicContact CG1-CG1 4.13Å; A76-I108 HydrophobicContact CB-CB 4.46Å; A76-I108 HydrophobicContact CB-CD1 3.77Å; A76-I108 HydrophobicContact CB-CG2 3.95Å; L104-I108 WeakPolarHBondContact O-CD1 3.41Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.34Å; L104-I108 PolarHBondContact O-N 2.73Å; L105-I108 PolarHBondContact O-N 3.18Å; I108-R112 WeakPolarHBondContact O-CB 3.47Å
109	Q	79.6	Confident	66.2	Low	110 Å²	110	76.7 Å²	76.7	51%	0.514	44%	0.435	S	S	.	.	H	α-helix	trans	-73.6	-27	176.8	-72.9	178.3	1.6	0	0	114.1	P80 L105 R106 L107	P80-Q109 PolarHBondContact O-NE2 3.14Å; L105-Q109 HydrophobicContact CD1-CG 4.43Å; L105-Q109 WeakPolarHBondContact O-CB 3.37Å; L105-Q109 VanDerWaalsContact O-CG 3.26Å; L105-Q109 WeakPolarHBondContact O-CG 3.39Å; L105-Q109 PolarHBondContact O-N 3.12Å; R106-Q109 PolarHBondContact O-N 2.75Å; L107-Q109 PolarHBondContact O-N 3.21Å
110	T	76	Confident	63.7	Low	98 Å²	98	78.2 Å²	78.2	60%	0.601	45%	0.446	S	S	*	.	H	α-helix	trans	-91.4	-22.1	-175.7	48.2	0	0	0	0	114.5	R106 L107	R106-T110 HydrophobicContact CG-CG2 4.38Å; R106-T110 WeakPolarHBondContact O-CB 3.48Å; R106-T110 VanDerWaalsContact O-CG2 3.29Å; R106-T110 WeakPolarHBondContact O-CG2 3.49Å; R106-T110 PolarHBondContact O-N 3.05Å; R106-T110 PolarHBondContact O-OG1 3.14Å; L107-T110 PolarHBondContact O-N 2.87Å; L107-T110 PolarHBondContact O-OG1 3.46Å
111	M	69.4	Low	61.1	Low	51 Å²	51	88.3 Å²	88.3	25%	0.251	49%	0.489	S	S	.	.	S	Bend	trans	-113.7	10.7	-176.5	-58.9	-172.8	-54.4	0	0	114.4	L49 K52 L107	L49-M111 HydrophobicContact CB-CE 4.46Å; L49-M111 HydrophobicContact CD1-CB 4.48Å; L49-M111 HydrophobicContact CD1-CE 3.52Å; K52-M111 HydrophobicContact CB-CE 4.15Å; K52-M111 HydrophobicContact CD-CE 3.49Å; K52-M111 VanDerWaalsContact CD-CE 3.49Å; K52-M111 HydrophobicContact CD-SD 3.56Å; K52-M111 VanDerWaalsContact CD-SD 3.56Å; K52-M111 HydrophobicContact CG-CE 4.47Å; K52-M111 PolarHBondContact NZ-SD 3.43Å; K52-M111 VanDerWaalsContact NZ-SD 3.37Å; L107-M111 HydrophobicContact CB-CE 4.42Å; L107-M111 HydrophobicContact CD2-CE 3.56Å; L107-M111 HydrophobicContact CD2-SD 4.19Å; L107-M111 PolarHBondContact O-N 3.07Å
112	R	68.6	Low	58.6	Low	121 Å²	121	93 Å²	93	46%	0.457	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-92.2	128.3	177.9	-170.1	177.8	-171.5	-126.3	2.3	110.9	E77 I108	E77-R112 IonicContact OE1-CZ 2.77Å; E77-R112 IonicContact OE1-NE 3.85Å; E77-R112 PolarHBondContact OE1-NE 3.31Å; E77-R112 IonicContact OE1-NH2 2.93Å; E77-R112 PolarHBondContact OE1-NH2 2.72Å; E77-R112 IonicContact OE2-NH2 2.83Å; I108-R112 WeakPolarHBondContact O-CB 3.47Å
113	P	57.4	Low	56	Low	51 Å²	51	96 Å²	96	33%	0.331	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-66.7	148.3	173.8	26.6	-33.7	0	0	0	111.4
114	P	48.6	Very low	53.5	Low	126 Å²	126	99.9 Å²	99.9	82%	0.818	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-69.6	133.2	179.6	28.7	-34.4	0	0	0	111.3
115	S	42.7	Very low	50.9	Low	105 Å²	105	106.8 Å²	106.8	73%	0.734	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-66.7	134.7	179.9	48.8	0	0	0	0	112.2	A117	S115-A117 PolarHBondContact O-N 2.99Å; S115-A117 VanDerWaalsContact O-N 3.14Å
116	K	38	Very low	48.4	Very low	156 Å²	156	113 Å²	113	68%	0.678	65%	0.645	S	S	*	*			trans	-58	115.1	176.8	-65	171	-173	164.5	0	109.5	D39 S118	D39-K116 IonicContact OD1-NZ 3.75Å; D39-K116 PolarHBondContact OD1-NZ 2.96Å; D39-K116 IonicContact OD2-NZ 2.75Å; K116-S118 PolarHBondContact O-N 3.31Å
117	A	31.3	Very low	46.3	Very low	91 Å²	91	111.5 Å²	111.5	75%	0.752	65%	0.648	S	S	*	*			trans	-66.3	130.7	173	0	0	0	0	0	110.2	S115 T119	S115-A117 PolarHBondContact O-N 2.99Å; S115-A117 VanDerWaalsContact O-N 3.14Å; A117-T119 PolarHBondContact O-N 3.32Å
118	S	29.7	Very low	43.8	Very low	118 Å²	118	119 Å²	119	83%	0.825	68%	0.679	S	S	*	*			trans	-73.2	100.4	-174	43.7	0	0	0	0	112.2	K116 S120	K116-S118 PolarHBondContact O-N 3.31Å; S118-S120 PolarHBondContact O-N 2.9Å
119	T	29.3	Very low	41.5	Very low	147 Å²	147	124.6 Å²	124.6	90%	0.902	72%	0.716	S	S	*	*			trans	-64.7	114.8	175	48.9	0	0	0	0	111.2	A117	A117-T119 PolarHBondContact O-N 3.32Å
120	S	27.3	Very low	39.4	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	72%	0.722	S	S	*	*			trans	-134.6	143.4	161.7	67	0	0	0	0	110	S118	S118-S120 PolarHBondContact O-N 2.9Å
121	K	28.2	Very low	38.1	Very low	213 Å²	213	124.5 Å²	124.5	93%	0.926	71%	0.713	S	S	*	*			trans	69.3	110.6	-172.3	-56.1	179.7	179.5	177.7	0	115
122	A	28.6	Very low	37	Very low	103 Å²	103	129.8 Å²	129.8	85%	0.851	74%	0.737	S	S	*	*			trans	-96.6	156	162.7	0	0	0	0	0	110.5
123	S	26	Very low	36	Very low	119 Å²	119	132.1 Å²	132.1	83%	0.832	75%	0.75	S	S	*	*			trans	-161.7	147.6	161.1	51.5	0	0	0	0	109.5
124	D	29.8	Very low	35.6	Very low	151 Å²	151	132.9 Å²	132.9	81%	0.807	75%	0.752	S	S	*	*			trans	-65.9	150.8	-170.2	-54.2	-90	0	0	0	115.6
125	V	29.2	Very low	35.7	Very low	144 Å²	144	135.2 Å²	135.2	87%	0.873	74%	0.744	S	S	*	*				-156.6	136.7	126.6	167.5	0	0	0	0	108.8
126	L	29.6	Very low	36.1	Very low	142 Å²	142	134.7 Å²	134.7	74%	0.743	73%	0.733	S	S	*	*			trans	-81.8	128.7	169.9	-82.2	99.6	0	0	0	113.5
127	I	38.2	Very low	36.8	Very low	143 Å²	143	133.5 Å²	133.5	73%	0.733	73%	0.727	S	S	*	*			trans	42.6	116.4	141	-48.9	177.5	0	0	0	118.8
128	K	28	Very low	37.6	Very low	198 Å²	198	135 Å²	135	86%	0.861	72%	0.719	S	S	*	*			trans	-132.6	143.8	132.4	-74.5	-169.4	178.5	178.7	0	109.8
129	P	35.8	Very low	38.4	Very low	124 Å²	124	135 Å²	135	81%	0.805	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-74.4	132.4	-178.8	29.5	-34	0	0	0	112
130	K	36.6	Very low	39.1	Very low	147 Å²	147	133.3 Å²	133.3	64%	0.639	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-68.1	148.2	163.4	-83.1	-171.9	170.6	-172.8	0	109.7	E138	K130-E138 IonicContact NZ-OE1 3.02Å; K130-E138 PolarHBondContact NZ-OE1 3.22Å
131	S	48.8	Very low	39.8	Very low	59 Å²	59	132.8 Å²	132.8	41%	0.413	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-75.7	154	-179.8	90.7	0	0	0	0	112.3	K133 D134 R135	S131-K133 PolarHBondContact O-N 3.35Å; S131-D134 WeakPolarHBondContact CB-OD2 3.39Å; S131-D134 PolarHBondContact N-OD2 3.38Å; S131-D134 PolarHBondContact O-N 2.63Å; S131-D134 VanDerWaalsContact O-N 3.08Å; S131-D134 PolarHBondContact OG-OD2 3.08Å; S131-R135 PolarHBondContact O-N 2.86Å
132	E	46.3	Very low	40.6	Very low	162 Å²	162	127 Å²	127	76%	0.757	68%	0.676	S	S	*	*	H	α-helix	trans	-60.5	-32.6	179.3	-169.7	171.2	-158.3	0	0	112.6	D134 R135 L136	E132-D134 VanDerWaalsContact C-N 3.29Å; E132-D134 PolarHBondContact O-N 2.84Å; E132-R135 PolarHBondContact O-N 3.46Å; E132-L136 HydrophobicContact CG-CD1 4.34Å; E132-L136 PolarHBondContact O-N 2.89Å
133	K	46.2	Very low	41.2	Very low	169 Å²	169	128.9 Å²	128.9	74%	0.735	67%	0.67	S	S	*	*	H	α-helix	trans	-65.6	-28.4	175.7	-77.5	-172.6	175	179.9	0	113.6	S131 K137	S131-K133 PolarHBondContact O-N 3.35Å; K133-K137 PolarHBondContact O-N 3.02Å; K133-K137 VanDerWaalsContact O-N 3.15Å
134	D	49.9	Very low	41.9	Very low	67 Å²	67	127 Å²	127	36%	0.358	66%	0.656	S	S	.	*	H	α-helix	trans	-77.4	-39.2	180	-56.1	-54.8	0	0	0	110.8	S131 E132 K137 E138	S131-D134 WeakPolarHBondContact CB-OD2 3.39Å; S131-D134 PolarHBondContact N-OD2 3.38Å; S131-D134 PolarHBondContact O-N 2.63Å; S131-D134 VanDerWaalsContact O-N 3.08Å; S131-D134 PolarHBondContact OG-OD2 3.08Å; E132-D134 VanDerWaalsContact C-N 3.29Å; E132-D134 PolarHBondContact O-N 2.84Å; D134-K137 WeakPolarHBondContact O-CB 3.46Å; D134-K137 PolarHBondContact O-N 2.82Å; D134-E138 PolarHBondContact O-N 3.43Å; D134-E138 VanDerWaalsContact O-N 3.1Å
135	R	50.1	Low	42.8	Very low	175 Å²	175	128.2 Å²	128.2	66%	0.66	65%	0.654	S	S	*	*	H	α-helix	trans	-62.1	-41.4	170	-85.2	-178.6	160.6	176.9	-6	112.4	S131 E132 K137 E138 L139	S131-R135 PolarHBondContact O-N 2.86Å; E132-R135 PolarHBondContact O-N 3.46Å; R135-K137 VanDerWaalsContact C-N 3.3Å; R135-K137 PolarHBondContact O-N 3.41Å; R135-E138 PolarHBondContact O-N 3.04Å; R135-L139 VanDerWaalsContact O-CD1 3.3Å; R135-L139 WeakPolarHBondContact O-CD1 3.42Å; R135-L139 PolarHBondContact O-N 3.28Å
136	L	51.1	Low	43.2	Very low	94 Å²	94	127.2 Å²	127.2	49%	0.492	65%	0.651	S	S	.	*	H	α-helix	trans	-64.2	-32.8	176.3	-81.5	161.4	0	0	0	112.9	E132 F140	E132-L136 HydrophobicContact CG-CD1 4.34Å; E132-L136 PolarHBondContact O-N 2.89Å; L136-F140 HydrophobicContact CD2-CD2 4.28Å; L136-F140 PolarHBondContact O-N 3.45Å
137	K	52.7	Low	43.6	Very low	131 Å²	131	128.3 Å²	128.3	57%	0.57	66%	0.658	S	S	*	*	H	α-helix	trans	-67.6	-40.2	171.2	-87.7	-178.8	172	180	0	113.2	K133 D134 R135	K133-K137 PolarHBondContact O-N 3.02Å; K133-K137 VanDerWaalsContact O-N 3.15Å; D134-K137 WeakPolarHBondContact O-CB 3.46Å; D134-K137 PolarHBondContact O-N 2.82Å; R135-K137 VanDerWaalsContact C-N 3.3Å; R135-K137 PolarHBondContact O-N 3.41Å
138	E	49.3	Very low	43.7	Very low	124 Å²	124	128 Å²	128	58%	0.579	66%	0.658	S	S	*	*	H	α-helix	trans	-67.5	-38.6	177.5	-73.4	170.3	172.1	0	0	111.3	K130 D134 R135	K130-E138 IonicContact NZ-OE1 3.02Å; K130-E138 PolarHBondContact NZ-OE1 3.22Å; D134-E138 PolarHBondContact O-N 3.43Å; D134-E138 VanDerWaalsContact O-N 3.1Å; R135-E138 PolarHBondContact O-N 3.04Å
139	L	45.6	Very low	44.4	Very low	118 Å²	118	124.8 Å²	124.8	62%	0.618	66%	0.657	S	S	*	*	H	α-helix	trans	-79.9	-35.8	178.9	-88	80.9	0	0	0	114.7	R135	R135-L139 VanDerWaalsContact O-CD1 3.3Å; R135-L139 WeakPolarHBondContact O-CD1 3.42Å; R135-L139 PolarHBondContact O-N 3.28Å
140	F	43.8	Very low	44.3	Very low	110 Å²	110	122.2 Å²	122.2	48%	0.482	64%	0.642	S	S	.	*			trans	-132.6	59.4	-170.6	-60.2	-69	0	0	0	114	L136 A142 L143	L136-F140 HydrophobicContact CD2-CD2 4.28Å; L136-F140 PolarHBondContact O-N 3.45Å; F140-A142 PolarHBondContact O-N 3.47Å; F140-A142 VanDerWaalsContact O-N 3.09Å; F140-L143 HydrophobicContact CB-CB 4.42Å; F140-L143 HydrophobicContact CB-CD1 4.17Å; F140-L143 HydrophobicContact CG-CD1 4.5Å; F140-L143 PolarHBondContact O-N 2.84Å; F140-L143 VanDerWaalsContact O-N 3.07Å
141	P	42.2	Very low	44.4	Very low	95 Å²	95	121.9 Å²	121.9	62%	0.617	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-59.9	-25.8	-175.4	23.7	-34.7	0	0	0	114.3	L143	P141-L143 VanDerWaalsContact C-N 3.33Å; P141-L143 PolarHBondContact O-N 2.87Å
142	A	44.5	Very low	43.6	Very low	92 Å²	92	127.7 Å²	127.7	76%	0.76	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-68.5	-27.2	177.7	0	0	0	0	0	113.9	F140 C144	F140-A142 PolarHBondContact O-N 3.47Å; F140-A142 VanDerWaalsContact O-N 3.09Å; A142-C144 VanDerWaalsContact C-N 3.32Å; A142-C144 PolarHBondContact O-N 3.29Å
143	L	41.5	Very low	43.3	Very low	142 Å²	142	131.6 Å²	131.6	74%	0.743	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-85	0.8	-175.3	-87.8	160.3	0	0	0	114	F140 P141	F140-L143 HydrophobicContact CB-CB 4.42Å; F140-L143 HydrophobicContact CB-CD1 4.17Å; F140-L143 HydrophobicContact CG-CD1 4.5Å; F140-L143 PolarHBondContact O-N 2.84Å; F140-L143 VanDerWaalsContact O-N 3.07Å; P141-L143 VanDerWaalsContact C-N 3.33Å; P141-L143 PolarHBondContact O-N 2.87Å
144	C	41.2	Very low	42.8	Very low	79 Å²	79	130 Å²	130	53%	0.534	68%	0.678	S	S	.	*	G	3₁₀ helix	trans	-104	15.9	-176.8	-76.4	0	0	0	0	115	A142	A142-C144 VanDerWaalsContact C-N 3.32Å; A142-C144 PolarHBondContact O-N 3.29Å
145	K	48.3	Very low	42.1	Very low	177 Å²	177	134 Å²	134	77%	0.77	70%	0.699	S	S	*	*	S	Bend	trans	-94.1	135.9	168.4	-69.9	-174	178.4	-179.6	0	110.5
146	P	38	Very low	41.9	Very low	124 Å²	124	130.4 Å²	130.4	81%	0.805	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-71	148.2	173.6	30.5	-34.3	0	0	0	111.2
147	N	38.3	Very low	41.4	Very low	165 Å²	165	133.8 Å²	133.8	88%	0.882	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-77.5	130.9	-178.6	-66.9	-29.8	0	0	0	112
148	D	39.5	Very low	41.1	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-99.9	118.4	173.3	-175	7.8	0	0	0	109.9	S150	D148-S150 PolarHBondContact O-N 3.49Å
149	P	43.3	Very low	41.1	Very low	131 Å²	131	131.6 Å²	131.6	85%	0.851	71%	0.705	S	S	*	*			trans	-85.4	62.6	-166.5	35.1	-37.8	0	0	0	113.9
150	S	33.3	Very low	41.4	Very low	69 Å²	69	130.3 Å²	130.3	48%	0.483	70%	0.701	S	S	.	*			trans	-145.5	134	165.4	70.2	0	0	0	0	114.1	D148 K152	D148-S150 PolarHBondContact O-N 3.49Å; S150-K152 PolarHBondContact O-N 2.61Å; S150-K152 VanDerWaalsContact O-N 3.14Å
151	P	37.8	Very low	41.6	Very low	140 Å²	140	130.7 Å²	130.7	91%	0.909	70%	0.703	S	S	*	*			trans	-83.6	90.4	-177.5	32.8	-34.2	0	0	0	111.6
152	K	33.6	Very low	42.6	Very low	181 Å²	181	131.2 Å²	131.2	79%	0.787	70%	0.704	S	S	*	*			trans	-84.9	137.5	164.5	-72.8	-174.2	-180	176.3	0	110.6	S150	S150-K152 PolarHBondContact O-N 2.61Å; S150-K152 VanDerWaalsContact O-N 3.14Å
153	R	39.3	Very low	42.9	Very low	244 Å²	244	129.5 Å²	129.5	92%	0.921	69%	0.69	S	S	*	*			trans	-69.8	138.3	169.2	-63.3	173.1	177.3	170.4	-3.6	109.1
154	I	34.7	Very low	43.5	Very low	136 Å²	136	125.3 Å²	125.3	70%	0.697	68%	0.676	S	S	*	*			trans	-132	97.7	160.6	-56.1	-180	0	0	0	106.8
155	L	36.8	Very low	44.4	Very low	150 Å²	150	125.7 Å²	125.7	79%	0.785	67%	0.672	S	S	*	*			trans	-117.6	127.5	144.5	-73.4	170.9	0	0	0	102.7
156	D	45.3	Very low	44.8	Very low	101 Å²	101	119.5 Å²	119.5	54%	0.54	66%	0.655	S	S	.	*			trans	-75.6	141.2	-173.1	-68.9	-46.7	0	0	0	110.8	D158 D159	D156-D158 PolarHBondContact O-N 2.62Å; D156-D158 VanDerWaalsContact O-N 3.14Å; D156-D159 PolarHBondContact O-N 2.86Å
157	E	41.2	Very low	45.5	Very low	165 Å²	165	119.8 Å²	119.8	77%	0.771	65%	0.647	S	S	*	*	H	α-helix	trans	-67.6	-17.5	-169.8	-65.1	-167.1	138.4	0	0	113.4	K161	E157-K161 PolarHBondContact O-N 2.84Å
158	D	45.3	Very low	46.1	Very low	101 Å²	101	117.6 Å²	117.6	54%	0.54	63%	0.629	S	S	.	*	H	α-helix	trans	-81.4	-33.7	176.2	-67.4	-41.6	0	0	0	112.8	D156 V160 K161 V162	D156-D158 PolarHBondContact O-N 2.62Å; D156-D158 VanDerWaalsContact O-N 3.14Å; D158-V160 PolarHBondContact O-N 3.25Å; D158-K161 WeakPolarHBondContact O-CB 3.48Å; D158-K161 PolarHBondContact O-N 2.87Å; D158-K161 VanDerWaalsContact O-N 3.1Å; D158-K161 IonicContact OD1-NZ 2.75Å; D158-K161 PolarHBondContact OD1-NZ 2.71Å; D158-V162 WeakPolarHBondContact O-CG2 3.46Å; D158-V162 PolarHBondContact O-N 2.74Å
159	D	48.7	Very low	46.8	Very low	107 Å²	107	117.7 Å²	117.7	57%	0.572	63%	0.626	S	S	*	*	H	α-helix	trans	-60.5	-38.3	171.9	-73.1	-23.4	0	0	0	111	D156 K161 V162 A163	D156-D159 PolarHBondContact O-N 2.86Å; D159-K161 VanDerWaalsContact C-N 3.32Å; D159-K161 PolarHBondContact O-N 3.36Å; D159-V162 PolarHBondContact O-N 3.02Å; D159-A163 WeakPolarHBondContact O-CB 3.44Å; D159-A163 PolarHBondContact O-N 2.73Å
160	V	51.9	Low	46.9	Very low	91 Å²	91	117.4 Å²	117.4	55%	0.552	62%	0.616	S	S	*	*	H	α-helix	trans	-67.4	-31.9	177.4	-177.3	0	0	0	0	111.7	D158 A164	D158-V160 PolarHBondContact O-N 3.25Å; V160-A164 WeakPolarHBondContact O-CB 3.41Å; V160-A164 PolarHBondContact O-N 2.75Å
161	K	49.7	Very low	47.5	Very low	118 Å²	118	121.6 Å²	121.6	51%	0.513	63%	0.628	S	S	.	*	H	α-helix	trans	-71.1	-47.6	171.4	-71.3	174.2	-165.9	148.2	0	111.8	E157 D158 D159 A163 A164 D165	E157-K161 PolarHBondContact O-N 2.84Å; D158-K161 WeakPolarHBondContact O-CB 3.48Å; D158-K161 PolarHBondContact O-N 2.87Å; D158-K161 VanDerWaalsContact O-N 3.1Å; D158-K161 IonicContact OD1-NZ 2.75Å; D158-K161 PolarHBondContact OD1-NZ 2.71Å; D159-K161 VanDerWaalsContact C-N 3.32Å; D159-K161 PolarHBondContact O-N 3.36Å; K161-A163 VanDerWaalsContact C-N 3.28Å; K161-A163 PolarHBondContact O-N 3.33Å; K161-A164 WeakPolarHBondContact O-CA 3.28Å; K161-A164 WeakPolarHBondContact O-CB 3.49Å; K161-A164 PolarHBondContact O-N 3.17Å; K161-D165 PolarHBondContact O-N 2.94Å
162	V	61.9	Low	47.7	Very low	106 Å²	106	122.3 Å²	122.3	64%	0.642	62%	0.621	S	S	*	*	H	α-helix	trans	-58.2	-42.8	-179	172.5	0	0	0	0	110.5	D158 D159 A164 A166	D158-V162 WeakPolarHBondContact O-CG2 3.46Å; D158-V162 PolarHBondContact O-N 2.74Å; D159-V162 PolarHBondContact O-N 3.02Å; V162-A164 VanDerWaalsContact C-N 3.34Å; V162-A164 PolarHBondContact O-N 3.06Å; V162-A166 VanDerWaalsContact O-CB 3.27Å; V162-A166 WeakPolarHBondContact O-CB 3.26Å; V162-A166 PolarHBondContact O-N 2.87Å; V162-A166 VanDerWaalsContact O-N 3.11Å
163	A	51.8	Low	48.1	Very low	56 Å²	56	122.4 Å²	122.4	46%	0.463	62%	0.622	S	S	.	*	H	α-helix	trans	-64.3	-34.9	173.8	0	0	0	0	0	113.5	D159 K161 M167	D159-A163 WeakPolarHBondContact O-CB 3.44Å; D159-A163 PolarHBondContact O-N 2.73Å; K161-A163 VanDerWaalsContact C-N 3.28Å; K161-A163 PolarHBondContact O-N 3.33Å; A163-M167 PolarHBondContact O-N 3.28Å
164	A	53.4	Low	48.2	Very low	54 Å²	54	118.2 Å²	118.2	45%	0.446	61%	0.614	S	S	.	*	H	α-helix	trans	-74	-44.8	-179.3	0	0	0	0	0	112.9	V160 K161 V162 M167 K168	V160-A164 WeakPolarHBondContact O-CB 3.41Å; V160-A164 PolarHBondContact O-N 2.75Å; K161-A164 WeakPolarHBondContact O-CA 3.28Å; K161-A164 WeakPolarHBondContact O-CB 3.49Å; K161-A164 PolarHBondContact O-N 3.17Å; V162-A164 VanDerWaalsContact C-N 3.34Å; V162-A164 PolarHBondContact O-N 3.06Å; A164-M167 PolarHBondContact O-N 3.01Å; A164-K168 WeakPolarHBondContact O-CB 3.2Å; A164-K168 PolarHBondContact O-N 3.22Å
165	D	61	Low	48.2	Very low	87 Å²	87	117.7 Å²	117.7	47%	0.465	62%	0.62	S	S	.	*	H	α-helix	trans	-70.6	-32.8	177	-79.6	-48.5	0	0	0	111.6	K161 K168 E169	K161-D165 PolarHBondContact O-N 2.94Å; D165-K168 WeakPolarHBondContact O-CB 3.47Å; D165-K168 PolarHBondContact O-N 3.06Å; D165-K168 WeakPolarHBondContact OD1-CD 3.42Å; D165-K168 IonicContact OD1-NZ 3.59Å; D165-K168 PolarHBondContact OD1-NZ 2.86Å; D165-E169 PolarHBondContact O-N 2.63Å
166	A	55.8	Low	47.8	Very low	48 Å²	48	116.1 Å²	116.1	40%	0.397	62%	0.622	S	S	.	*	H	α-helix	trans	-63.3	-40.7	173.4	0	0	0	0	0	113.4	V162 K168 L170	V162-A166 VanDerWaalsContact O-CB 3.27Å; V162-A166 WeakPolarHBondContact O-CB 3.26Å; V162-A166 PolarHBondContact O-N 2.87Å; V162-A166 VanDerWaalsContact O-N 3.11Å; A166-K168 VanDerWaalsContact C-N 3.31Å; A166-K168 PolarHBondContact O-N 3.09Å; A166-L170 PolarHBondContact O-N 3.3Å
167	M	53.3	Low	47	Very low	130 Å²	130	118.3 Å²	118.3	64%	0.64	64%	0.638	S	S	*	*	H	α-helix	trans	-68.8	-30.7	174.3	-72.3	-155.4	-59.8	0	0	112.6	A163 A164 L170 E171	A163-M167 PolarHBondContact O-N 3.28Å; A164-M167 PolarHBondContact O-N 3.01Å; M167-L170 WeakPolarHBondContact O-CB 3.36Å; M167-L170 PolarHBondContact O-N 3.12Å; M167-E171 PolarHBondContact O-N 3Å
168	K	50.5	Low	46.4	Very low	119 Å²	119	116.3 Å²	116.3	52%	0.517	64%	0.643	S	S	.	*	H	α-helix	trans	-72.9	-33.7	178.1	179.8	-170.7	173.9	-164.7	0	112.7	A164 D165 A166 M172	A164-K168 WeakPolarHBondContact O-CB 3.2Å; A164-K168 PolarHBondContact O-N 3.22Å; D165-K168 WeakPolarHBondContact O-CB 3.47Å; D165-K168 PolarHBondContact O-N 3.06Å; D165-K168 WeakPolarHBondContact OD1-CD 3.42Å; D165-K168 IonicContact OD1-NZ 3.59Å; D165-K168 PolarHBondContact OD1-NZ 2.86Å; A166-K168 VanDerWaalsContact C-N 3.31Å; A166-K168 PolarHBondContact O-N 3.09Å; K168-M172 WeakPolarHBondContact O-CG 3.49Å; K168-M172 PolarHBondContact O-N 3.12Å
169	E	55.2	Low	45.5	Very low	138 Å²	138	115.1 Å²	115.1	65%	0.645	65%	0.654	S	S	*	*	H	α-helix	trans	-65	-39.9	167	-71.3	-165.5	134.8	0	0	111.5	D165 M172 F173	D165-E169 PolarHBondContact O-N 2.63Å; E169-M172 WeakPolarHBondContact O-CB 3.25Å; E169-M172 PolarHBondContact O-N 3.39Å; E169-F173 WeakPolarHBondContact O-CD2 3.22Å
170	L	45.2	Very low	44.4	Very low	125 Å²	125	114.9 Å²	114.9	65%	0.654	67%	0.667	S	S	*	*	H	α-helix	trans	-62.7	-40.7	175.6	-85.4	160.4	0	0	0	113.1	A166 M167 M172 F173	A166-L170 PolarHBondContact O-N 3.3Å; M167-L170 WeakPolarHBondContact O-CB 3.36Å; M167-L170 PolarHBondContact O-N 3.12Å; L170-M172 PolarHBondContact O-N 2.94Å; L170-F173 PolarHBondContact O-N 2.79Å
171	E	44.4	Very low	43.2	Very low	156 Å²	156	117.1 Å²	117.1	73%	0.729	68%	0.676	S	S	*	*	H	α-helix	trans	-62.5	-28.6	174.9	-74.6	-170.9	145.3	0	0	112.9	M167 F173	M167-E171 PolarHBondContact O-N 3Å; E171-F173 VanDerWaalsContact C-N 3.26Å; E171-F173 PolarHBondContact O-N 3.25Å
172	M	42.1	Very low	42.1	Very low	155 Å²	155	116.7 Å²	116.7	76%	0.764	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-13	178.6	-73.2	179.4	56.6	0	0	114.5	K168 E169 L170	K168-M172 WeakPolarHBondContact O-CG 3.49Å; K168-M172 PolarHBondContact O-N 3.12Å; E169-M172 WeakPolarHBondContact O-CB 3.25Å; E169-M172 PolarHBondContact O-N 3.39Å; L170-M172 PolarHBondContact O-N 2.94Å
173	F	43.5	Very low	40.4	Very low	184 Å²	184	120.2 Å²	120.2	81%	0.807	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-2.1	-179.3	-85.5	-82.1	0	0	0	115	E169 L170 E171	E169-F173 WeakPolarHBondContact O-CD2 3.22Å; L170-F173 PolarHBondContact O-N 2.79Å; E171-F173 VanDerWaalsContact C-N 3.26Å; E171-F173 PolarHBondContact O-N 3.25Å
174	M	41	Very low	39.1	Very low	155 Å²	155	124.1 Å²	124.1	76%	0.764	71%	0.712	S	S	*	*	S	Bend	trans	-88.7	124.9	178.5	-68.7	-165.1	71.3	0	0	112.8
175	P	34.4	Very low	37.7	Very low	125 Å²	125	126.6 Å²	126.6	81%	0.812	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-74.8	131.7	176.3	30.3	-33.9	0	0	0	111.5
176	S	28.8	Very low	35.9	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-88.2	145.2	-175.6	54.9	0	0	0	0	114
177	V	28.7	Very low	34.4	Very low	148 Å²	148	134.8 Å²	134.8	90%	0.897	76%	0.762	S	S	*	*			trans	-134.2	133.9	157.5	-174.7	0	0	0	0	107.1
178	S	27.8	Very low	33	Very low	123 Å²	123	138 Å²	138	86%	0.86	77%	0.773	S	S	*	*			trans	-98.1	157	-165.3	47.1	0	0	0	0	114.1
179	G	26.7	Very low	31.7	Very low	75 Å²	75	137 Å²	137	77%	0.773	78%	0.781	S	S	*	*			trans	-164.5	43.2	-170	0	0	0	0	0	117.8
180	A	26.3	Very low	30.2	Very low	103 Å²	103	137.3 Å²	137.3	85%	0.851	78%	0.782	S	S	*	*			trans	68.4	123.6	164.3	0	0	0	0	0	120.9
181	D	25.7	Very low	29.3	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	78%	0.783	S	S	*	*			trans	-40.9	147.2	166.2	-77.8	-87.5	0	0	0	118.3
182	S	26.8	Very low	28.5	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	78%	0.783	S	S	*	*				179	118.1	83.7	39.6	0	0	0	0	117.7
183	K	25.8	Very low	27.7	Very low	181 Å²	181	139.6 Å²	139.6	79%	0.787	79%	0.787	S	S	*	*			trans	48.1	123.7	132.7	-71.3	176.3	179.9	170	0	123.3
184	V	25.7	Very low	26.8	Very low	137 Å²	137	138.8 Å²	138.8	83%	0.83	79%	0.785	S	S	*	*			trans	77.4	138.3	130	175.4	0	0	0	0	116.9
185	S	23.9	Very low	26	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	79%	0.787	S	S	*	*			cis	-151.3	151.2	5.9	41.5	0	0	0	0	115.9
186	K	23.2	Very low	25.7	Very low	198 Å²	198	140.2 Å²	140.2	86%	0.861	78%	0.781	S	S	*	*			trans	-3.7	167.5	148.7	-73.8	177.3	173.6	174	0	123.4
187	S	23.2	Very low	25.6	Very low	108 Å²	108	146.2 Å²	146.2	76%	0.755	79%	0.786	S	S	*	*			trans	78.8	128.3	167.3	29.2	0	0	0	0	116.3
188	K	23.7	Very low	25.6	Very low	199 Å²	199	143.9 Å²	143.9	87%	0.865	78%	0.777	S	S	*	*				67.9	134.2	54.6	-71.3	-169.4	177.4	-174.1	0	112.6
189	S	23.8	Very low	25.5	Very low	98 Å²	98	148 Å²	148	69%	0.685	77%	0.773	S	S	*	*			cis	-173.5	168.7	-7.8	44.8	0	0	0	0	111.5
190	E	24.5	Very low	25.6	Very low	144 Å²	144	150.4 Å²	150.4	67%	0.673	76%	0.764	S	S	*	*			trans	79.9	125.4	155.8	-57.4	-126.7	108.9	0	0	122.6
191	K	25.3	Very low	25.5	Very low	154 Å²	154	154.7 Å²	154.7	67%	0.67	76%	0.759	S	S	*	*				53.4	93.4	129.8	-61.1	172.6	-178.3	145.1	0	122.8
192	S	26.9	Very low	25.6	Very low	104 Å²	104	154.5 Å²	154.5	73%	0.727	75%	0.753	S	S	*	*				85.1	146.8	109.3	84.4	0	0	0	0	123.6
193	R	25.1	Very low	25.6	Very low	225 Å²	225	157.8 Å²	157.8	85%	0.849	75%	0.749	S	S	*	*			trans	77.5	94	152.6	-71.9	177.8	175.2	178.2	-0.4	121.9
194	H	25.7	Very low	25.8	Very low	167 Å²	167	155.8 Å²	155.8	77%	0.773	74%	0.742	S	S	*	*				78.1	128.6	121.5	-86.5	-24	0	0	0	124.7
195	R	24.1	Very low	25.8	Very low	210 Å²	210	159 Å²	159	79%	0.792	74%	0.739	S	S	*	*			trans	84.3	92.8	134	-75.2	-176.5	173.4	-173.3	-1.9	122.1
196	S	28.2	Very low	26.1	Very low	100 Å²	100	159.5 Å²	159.5	70%	0.699	73%	0.734	S	S	*	*				95.5	152.9	105.4	77.3	0	0	0	0	122.3
197	R	26.3	Very low	26.2	Very low	243 Å²	243	161.8 Å²	161.8	92%	0.917	74%	0.737	S	S	*	*			trans	73.3	146	172.3	-65.5	176.5	172.1	167	-2.9	115.2
198	S	28.9	Very low	26.6	Very low	100 Å²	100	163.5 Å²	163.5	70%	0.699	74%	0.738	S	S	*	*			cis	-159.8	156.7	-3.5	41.1	0	0	0	0	109.6
199	R	26.3	Very low	26.7	Very low	208 Å²	208	165.9 Å²	165.9	79%	0.785	74%	0.741	S	S	*	*				177.8	138.9	91.7	-94.1	-174.7	166.2	125.1	-0.7	109.8
200	E	27.3	Very low	27.2	Very low	126 Å²	126	168 Å²	168	59%	0.589	75%	0.745	S	S	*	*				62.6	137.9	96.8	-58.5	-171.9	105.8	0	0	115.4
201	R	26.1	Very low	27.3	Very low	194 Å²	194	172.4 Å²	172.4	73%	0.732	76%	0.755	S	S	*	*			cis	-158.6	148.3	3.7	-110.2	171.3	-148.1	-164.8	6.9	109.1
202	E	26.2	Very low	27.8	Very low	134 Å²	134	171.9 Å²	171.9	63%	0.626	76%	0.76	S	S	*	*				50	142.1	101	-60.5	-159.8	137.3	0	0	117.4
203	R	27.3	Very low	27.8	Very low	177 Å²	177	177.2 Å²	177.2	67%	0.668	76%	0.764	S	S	*	*			cis	-172.4	160.5	3.1	-117	176	-157.2	-150.2	20.6	112.3
204	H	29.3	Very low	28.4	Very low	139 Å²	139	173.9 Å²	173.9	64%	0.644	76%	0.763	S	S	*	*			trans	65.7	159.3	153.9	-69.5	-47.4	0	0	0	119.2
205	R	26.5	Very low	28.5	Very low	203 Å²	203	176.5 Å²	176.5	77%	0.766	77%	0.766	S	S	*	*			cis	-154.9	154.3	3.5	-133.3	-173.1	179.4	138.9	4.8	115
206	D	29.5	Very low	28.9	Very low	119 Å²	119	173.7 Å²	173.7	64%	0.636	77%	0.767	S	S	*	*			trans	-16	147.5	166.3	-24.3	-37.2	0	0	0	122.1
207	R	25.9	Very low	28.9	Very low	246 Å²	246	180.6 Å²	180.6	93%	0.928	78%	0.778	S	S	*	*				-171.6	135.8	123	-110	174.9	-174.7	164	4.5	115.7
208	D	31.4	Very low	28.9	Very low	144 Å²	144	173.3 Å²	173.3	77%	0.77	78%	0.778	S	S	*	*			trans	-82	164.6	174.3	-38.7	-89.6	0	0	0	113.6
209	R	27.1	Very low	28.9	Very low	248 Å²	248	172.2 Å²	172.2	94%	0.936	78%	0.782	S	S	*	*			trans	-169.3	113.2	143.2	-112.3	168.9	-170.6	175.3	4.2	113.4
210	D	33.2	Very low	28.9	Very low	144 Å²	144	168.2 Å²	168.2	77%	0.77	78%	0.777	S	S	*	*			trans	-66.5	157.6	161.1	-51.6	-75.7	0	0	0	112
211	R	27.6	Very low	29	Very low	235 Å²	235	170.9 Å²	170.9	89%	0.887	78%	0.782	S	S	*	*			trans	-168.2	115	143.7	-112.5	166	-170.8	-177.6	3	112.7
212	D	34.4	Very low	29.2	Very low	144 Å²	144	169.1 Å²	169.1	77%	0.77	78%	0.779	S	S	*	*			trans	-61.3	156.8	162.4	-46.8	-81.7	0	0	0	111.7
213	R	28.1	Very low	29.5	Very low	216 Å²	216	171.9 Å²	171.9	82%	0.815	78%	0.784	S	S	*	*			trans	-167.4	104.1	141.5	-110.1	160.9	-167.5	-171.7	3.4	112.9
214	D	36.4	Very low	29.6	Very low	154 Å²	154	172.7 Å²	172.7	82%	0.824	79%	0.787	S	S	*	*			trans	-57.3	148	149.5	-64.9	-60.6	0	0	0	110.6
215	R	28.4	Very low	29.8	Very low	222 Å²	222	174.1 Å²	174.1	84%	0.838	79%	0.794	S	S	*	*			trans	-164.2	96.2	151.7	-115.3	167.7	-164	-161	1.3	113.9
216	D	33	Very low	29.9	Very low	152 Å²	152	172.4 Å²	172.4	81%	0.813	79%	0.794	S	S	*	*			trans	-60.4	138.9	143.6	-86.1	-50.9	0	0	0	110.4
217	R	27.6	Very low	29.9	Very low	245 Å²	245	170.8 Å²	170.8	93%	0.925	79%	0.792	S	S	*	*				164.6	117.9	124.4	-89.6	165.9	-176.6	-171.9	1.9	114.1
218	G	26.6	Very low	29.9	Very low	89 Å²	89	170.5 Å²	170.5	92%	0.918	79%	0.791	S	S	*	*				45.6	118.7	121	0	0	0	0	0	121.8
219	G	28.2	Very low	29.6	Very low	77 Å²	77	169.2 Å²	169.2	79%	0.794	79%	0.793	S	S	*	*			trans	166.1	84.8	164.8	0	0	0	0	0	109.1
220	D	27.7	Very low	29.8	Very low	124 Å²	124	169 Å²	169	66%	0.663	79%	0.792	S	S	*	*				64.3	90.9	55.9	-168.1	40.3	0	0	0	114.6
221	R	29.3	Very low	29.5	Very low	183 Å²	183	167.4 Å²	167.4	69%	0.691	79%	0.792	S	S	*	*				153.5	118.9	129.1	-84.9	153.3	-166.6	-149.7	-0.9	115.2
222	K	29.9	Very low	29.5	Very low	157 Å²	157	168.2 Å²	168.2	68%	0.683	80%	0.795	S	S	*	*			trans	74.4	145.3	134.9	-66.7	167.6	-173.8	167.6	0	116.6
223	R	31.3	Very low	29.1	Very low	191 Å²	191	167.5 Å²	167.5	72%	0.721	80%	0.801	S	S	*	*			cis	-159.8	133.9	12.5	-125.7	160.5	-178.8	-179.2	-0	111.3
224	R	30.9	Very low	29.1	Very low	195 Å²	195	168.6 Å²	168.6	74%	0.736	81%	0.805	S	S	*	*			trans	63.4	152.5	147.2	-62.8	179.8	163.5	166.4	-3.9	118.4
225	H	31.8	Very low	28.7	Very low	169 Å²	169	166.3 Å²	166.3	78%	0.782	80%	0.801	S	S	*	*			cis	-150.4	154.6	-19.7	-98.2	-48.4	0	0	0	105.2
226	H	29.3	Very low	28.6	Very low	166 Å²	166	166.4 Å²	166.4	77%	0.769	80%	0.802	S	S	*	*				-152.4	178	56.4	-153	74	0	0	0	113.4
227	S	29.4	Very low	28.4	Very low	85 Å²	85	164 Å²	164	59%	0.594	80%	0.797	S	S	*	*			trans	-67.5	151.5	-173.5	-23.9	0	0	0	0	113
228	R	25.4	Very low	28.3	Very low	241 Å²	241	163.7 Å²	163.7	91%	0.909	80%	0.796	S	S	*	*			cis	64	144.8	21.7	-69.5	-174.8	175.1	174.3	0.3	114.4
229	S	26.5	Very low	28.4	Very low	116 Å²	116	165.4 Å²	165.4	81%	0.811	78%	0.784	S	S	*	*			cis	-151.3	167.3	28.1	48.7	0	0	0	0	115.6
230	R	29.9	Very low	28.3	Very low	245 Å²	245	171.5 Å²	171.5	93%	0.925	78%	0.783	S	S	*	*			trans	-97.4	147.2	168.6	-65.5	167.5	164.9	152.3	-8.4	112.1
231	S	27.6	Very low	28.4	Very low	109 Å²	109	172.2 Å²	172.2	76%	0.762	78%	0.782	S	S	*	*			trans	-168.6	124.1	144.4	46.5	0	0	0	0	109.4
232	R	28.3	Very low	28.3	Very low	252 Å²	252	173.2 Å²	173.2	95%	0.951	79%	0.786	S	S	*	*				63.2	102.4	61.4	-80.9	-171	170.1	171.5	-2.8	115.2
233	S	26.5	Very low	28.3	Very low	129 Å²	129	170.1 Å²	170.1	90%	0.902	78%	0.777	S	S	*	*			trans	-160.5	176.9	134.7	59.8	0	0	0	0	109.7
234	R	27.6	Very low	28.4	Very low	239 Å²	239	170.5 Å²	170.5	90%	0.902	78%	0.778	S	S	*	*			trans	-120.1	154.6	-166.2	-72	172.9	163.9	151.7	-10	113.5
235	S	28.3	Very low	28.5	Very low	106 Å²	106	165.6 Å²	165.6	74%	0.741	77%	0.767	S	S	*	*			trans	100.3	152.7	136.7	82.6	0	0	0	0	121.1
236	R	25.6	Very low	28.6	Very low	224 Å²	224	167 Å²	167	85%	0.845	77%	0.765	S	S	*	*			trans	81.9	90.3	159	-69.1	179	175.6	162.5	-0.6	120.6
237	S	28.5	Very low	28.8	Very low	103 Å²	103	164 Å²	164	72%	0.72	76%	0.755	S	S	*	*				64.8	138.1	116.4	66	0	0	0	0	123.4
238	R	26.7	Very low	28.9	Very low	238 Å²	238	169.5 Å²	169.5	90%	0.898	76%	0.762	S	S	*	*			trans	86.5	139.6	150.5	-92.2	-176.3	175.7	165.3	-0.2	120.8
239	D	28.1	Very low	29.2	Very low	125 Å²	125	162.5 Å²	162.5	67%	0.668	74%	0.743	S	S	*	*			trans	-15.3	139.1	163.9	-70.6	-93.6	0	0	0	122.4
240	R	26.7	Very low	29.4	Very low	205 Å²	205	166.3 Å²	166.3	77%	0.774	74%	0.74	S	S	*	*			trans	76.7	134.8	133.2	-74.2	179.1	-172.7	-159.5	-0	121.4
241	H	27.9	Very low	29.5	Very low	139 Å²	139	160.4 Å²	160.4	64%	0.644	73%	0.727	S	S	*	*			trans	76.6	121.9	146.3	-70.6	-45.3	0	0	0	120.5
242	R	28.3	Very low	29.6	Very low	204 Å²	204	166 Å²	166	77%	0.77	73%	0.731	S	S	*	*			trans	75.1	155.6	131.2	-73.3	-174.8	170.1	153.7	-1.2	117.1
243	D	30.5	Very low	29.6	Very low	91 Å²	91	157.6 Å²	157.6	49%	0.487	72%	0.722	S	S	.	*			cis	-151	156.9	-0.2	-127.3	-9	0	0	0	109.8
244	R	31.9	Very low	29.9	Very low	199 Å²	199	161.2 Å²	161.2	75%	0.751	72%	0.722	S	S	*	*			trans	69.8	165.3	144.1	-75.1	174.8	-141.6	-169.2	6.5	119.3
245	D	33.2	Very low	30	Very low	93 Å²	93	161.8 Å²	161.8	50%	0.497	72%	0.724	S	S	.	*			cis	-148.5	152	8.7	-132.9	-8.8	0	0	0	114.1
246	R	33.8	Very low	30.3	Very low	198 Å²	198	165 Å²	165	75%	0.747	73%	0.725	S	S	*	*			trans	65.9	149.1	152.6	-68.1	171.2	-139.1	-174.1	10	118.5
247	D	34.3	Very low	30.7	Very low	103 Å²	103	160 Å²	160	55%	0.551	72%	0.715	S	S	*	*			cis	-157.2	167.6	3.4	-113.4	-12.6	0	0	0	107.2
248	R	31.4	Very low	30.6	Very low	200 Å²	200	165.6 Å²	165.6	76%	0.755	73%	0.726	S	S	*	*			cis	-161.6	172.5	0.4	-131.9	177.3	-91.4	158.1	1.5	106.3
249	D	31.9	Very low	30.6	Very low	94 Å²	94	159.1 Å²	159.1	50%	0.503	72%	0.717	S	S	.	*			cis	-155.3	-179.8	-5.5	-150.3	-33.9	0	0	0	108.1
250	R	30	Very low	30.5	Very low	196 Å²	196	158.7 Å²	158.7	74%	0.74	72%	0.724	S	S	*	*			trans	33	116.6	154.1	-77.6	145.2	-134	-152.8	10.3	121.9
251	D	32.6	Very low	30.4	Very low	122 Å²	122	157.7 Å²	157.7	65%	0.652	72%	0.72	S	S	*	*				78.5	135	70.4	-95.5	3.6	0	0	0	113.1
252	R	28.5	Very low	30.2	Very low	227 Å²	227	161.3 Å²	161.3	86%	0.857	73%	0.728	S	S	*	*			cis	-151.1	176.2	9.1	-95.1	149.4	-163.8	-163.2	4.4	108.2
253	G	28.6	Very low	30.2	Very low	74 Å²	74	156.3 Å²	156.3	76%	0.763	72%	0.724	S	S	*	*			cis	170.8	156	0.5	0	0	0	0	0	110.5
254	K	34.4	Very low	30.1	Very low	205 Å²	205	158.5 Å²	158.5	89%	0.891	74%	0.736	S	S	*	*			trans	-83.3	148.1	-170.7	-55.8	164.9	-179.7	171.5	0	113.6
255	R	29.2	Very low	29.9	Very low	252 Å²	252	160.1 Å²	160.1	95%	0.951	74%	0.743	S	S	*	*				178.7	-179.8	110.7	-100.8	178.6	172.3	176.8	-1.8	114.9
256	K	33.9	Very low	29.6	Very low	173 Å²	173	160.6 Å²	160.6	75%	0.752	75%	0.753	S	S	*	*			trans	-101.8	154.5	-164.5	-108.9	175.9	154.1	-96.5	0	114.1
257	D	33.4	Very low	29.7	Very low	120 Å²	120	157.4 Å²	157.4	64%	0.642	76%	0.758	S	S	*	*			trans	50.8	107.9	143.9	-47.9	-24.4	0	0	0	120.4
258	K	27.5	Very low	29.4	Very low	220 Å²	220	157.4 Å²	157.4	96%	0.957	77%	0.766	S	S	*	*			trans	-162.8	168.5	135.5	-114.9	172.4	-174.5	-177.9	0	113
259	S	26.1	Very low	29.9	Very low	101 Å²	101	152.8 Å²	152.8	71%	0.706	76%	0.762	S	S	*	*			trans	-111.9	175.1	-166.3	54.9	0	0	0	0	114
260	S	26.4	Very low	29.7	Very low	116 Å²	116	158.7 Å²	158.7	81%	0.811	78%	0.777	S	S	*	*			trans	77	149.7	161.9	79.4	0	0	0	0	118
261	R	24.5	Very low	29.4	Very low	185 Å²	185	158.2 Å²	158.2	70%	0.698	78%	0.78	S	S	*	*			cis	-174.9	138.9	-25.1	-166.5	-170.6	-167.5	166.5	2.6	110.7
262	W	24.1	Very low	29.7	Very low	214 Å²	214	159.6 Å²	159.6	81%	0.811	79%	0.788	S	S	*	*			trans	60.5	168.4	162.4	-64.3	-27.6	0	0	0	117.8
263	S	27.7	Very low	30.1	Very low	99 Å²	99	154.5 Å²	154.5	69%	0.692	78%	0.784	S	S	*	*			cis	-133.6	-175.4	-3.9	72.1	0	0	0	0	110.2
264	D	29.2	Very low	30.4	Very low	138 Å²	138	157.5 Å²	157.5	74%	0.738	78%	0.783	S	S	*	*			cis	-159.5	174.6	14.2	-135.2	-51.9	0	0	0	114
265	R	27.2	Very low	30.4	Very low	233 Å²	233	156.3 Å²	156.3	88%	0.879	78%	0.777	S	S	*	*			trans	69.6	103.8	166.1	-67.4	-176	179	-164.7	-1.5	120.4
266	S	27.2	Very low	30.2	Very low	103 Å²	103	150.7 Å²	150.7	72%	0.72	77%	0.766	S	S	*	*			trans	-74.4	175.4	151.1	-42.3	0	0	0	0	111.4
267	P	36	Very low	29.9	Very low	130 Å²	130	147.3 Å²	147.3	84%	0.844	77%	0.765	S	S	*	*				-135.8	142.5	75.9	25.9	-5.7	0	0	0	115.9
268	S	28.3	Very low	29.7	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	77%	0.768	S	S	*	*			trans	-72.9	174	156.7	-38.9	0	0	0	0	109.3
269	P	41.6	Very low	29.7	Very low	103 Å²	103	146.1 Å²	146.1	67%	0.669	76%	0.755	S	S	*	*			cis	-157.8	177.4	36.1	45.9	-24.2	0	0	0	121
270	R	26.4	Very low	29.8	Very low	218 Å²	218	150.9 Å²	150.9	82%	0.823	76%	0.757	S	S	*	*			trans	75.1	128.7	142.2	-83.6	163.3	-177.7	-174.9	1.1	121.5
271	K	25.6	Very low	30.1	Very low	187 Å²	187	153.5 Å²	153.5	81%	0.813	75%	0.754	S	S	*	*			trans	75.6	139.6	132.1	-74.4	-174.5	168	-160.9	0	120.5
272	D	37	Very low	30.5	Very low	150 Å²	150	150 Å²	150	80%	0.802	75%	0.75	S	S	*	*			trans	-55.5	152.9	152.6	-36.8	-96.8	0	0	0	111.2
273	P	37.7	Very low	30.8	Very low	121 Å²	121	148.3 Å²	148.3	79%	0.786	75%	0.748	S	S	*	*				-145.8	-176.4	86.3	40	-23.5	0	0	0	115.6
274	D	34.1	Very low	30.8	Very low	136 Å²	136	150.5 Å²	150.5	73%	0.727	75%	0.747	S	S	*	*			trans	-55.5	157.3	178	-65.3	-93.6	0	0	0	117.7
275	K	34.8	Very low	31	Very low	180 Å²	180	150.8 Å²	150.8	78%	0.783	75%	0.753	S	S	*	*			trans	68	149	148.8	-76.9	169.6	-176	-179.5	0	118
276	D	25.4	Very low	31.5	Very low	134 Å²	134	145.9 Å²	145.9	72%	0.717	75%	0.745	S	S	*	*			cis	-156.2	171.8	14	-118.7	-34.8	0	0	0	112.2
277	S	26.8	Very low	32.2	Very low	103 Å²	103	152 Å²	152	72%	0.72	75%	0.752	S	S	*	*			trans	63.3	117.7	148.6	69.5	0	0	0	0	124.3
278	D	29.7	Very low	32.6	Very low	132 Å²	132	149.6 Å²	149.6	71%	0.706	74%	0.736	S	S	*	*				78.9	133.5	124.6	-102	24.4	0	0	0	126.4
279	R	27.8	Very low	33.8	Very low	183 Å²	183	148 Å²	148	69%	0.691	72%	0.723	S	S	*	*			trans	71.8	146.5	155.2	-63.6	177.3	-166.8	-154.9	3	118.7
280	W	28.1	Very low	34.5	Very low	200 Å²	200	146.7 Å²	146.7	76%	0.758	72%	0.715	S	S	*	*			cis	-147.7	161.5	0.7	-131.3	-26.5	0	0	0	112.2
281	K	32	Very low	35.9	Very low	171 Å²	171	141.7 Å²	141.7	74%	0.743	70%	0.701	S	S	*	*			trans	-11.5	157.5	158.1	-78.1	-178.4	171.7	-163.4	0	119.1
282	D	32.9	Very low	37.9	Very low	112 Å²	112	138 Å²	138	60%	0.599	69%	0.687	S	S	*	*			cis	-156.5	165.2	29.5	-142.3	22.5	0	0	0	108.8
283	K	30.9	Very low	39.6	Very low	178 Å²	178	131.1 Å²	131.1	77%	0.774	65%	0.65	S	S	*	*			cis	-144.3	170	23.2	-91.6	177.9	179.5	168.4	0	112.8
284	H	28.1	Very low	41.3	Very low	145 Å²	145	127.6 Å²	127.6	67%	0.671	63%	0.628	S	S	*	*			trans	-91.7	151.5	161.7	-80	-118.6	0	0	0	112.7	D286	H284-D286 IonicContact CE1-OD1 2.78Å; H284-D286 IonicContact CG-OD1 2.81Å; H284-D286 IonicContact ND1-OD1 3.65Å; H284-D286 PolarHBondContact ND1-OD1 3.03Å; H284-D286 IonicContact ND1-OD2 3.19Å
285	V	34.1	Very low	43.4	Very low	144 Å²	144	124.7 Å²	124.7	87%	0.873	62%	0.615	S	S	*	*			trans	-133.7	105.3	138.5	179.6	0	0	0	0	106.9	R287	V285-R287 PolarHBondContact O-N 3.3Å
286	D	36.1	Very low	45.1	Very low	131 Å²	131	116.5 Å²	116.5	70%	0.701	58%	0.582	S	S	*	*			trans	-75.5	90.3	-179	-62.8	-36.9	0	0	0	110.3	H284	H284-D286 IonicContact CE1-OD1 2.78Å; H284-D286 IonicContact CG-OD1 2.81Å; H284-D286 IonicContact ND1-OD1 3.65Å; H284-D286 PolarHBondContact ND1-OD1 3.03Å; H284-D286 IonicContact ND1-OD2 3.19Å
287	R	42.1	Very low	47.6	Very low	231 Å²	231	113.1 Å²	113.1	87%	0.872	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-77	120.9	164.7	-160.1	175.3	-166.6	-177.5	3.5	107.7	V285	V285-R287 PolarHBondContact O-N 3.3Å
288	P	45.8	Very low	50.3	Low	80 Å²	80	110.9 Å²	110.9	52%	0.519	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-61.6	150.3	178.9	25.8	-34.2	0	0	0	110.4
289	P	52.3	Low	53	Low	68 Å²	68	106.1 Å²	106.1	44%	0.442	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-53.7	135.4	171.5	-23.7	33.4	0	0	0	109.8	E291	P289-E291 PolarHBondContact O-N 2.99Å
290	P	56.6	Low	55.7	Low	77 Å²	77	102 Å²	102	50%	0.5	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-57.8	140.2	179.9	24.8	-33.5	0	0	0	110.2	E292 L318	P290-E292 PolarHBondContact O-N 3.3Å; P290-L318 HydrophobicContact CG-CD2 4.13Å; P290-L318 VanDerWaalsContact O-CD2 3.31Å; P290-L318 WeakPolarHBondContact O-CD2 3.12Å
291	E	56.6	Low	58.5	Low	112 Å²	112	92.6 Å²	92.6	52%	0.523	47%	0.472	S	S	.	.	S	Bend	trans	-80	-13	-175.9	-55.7	-162	139.2	0	0	112.1	P289 R319 W322	P289-E291 PolarHBondContact O-N 2.99Å; E291-R319 WeakPolarHBondContact OE1-CD 3.21Å; E291-R319 IonicContact OE1-CZ 3.76Å; E291-R319 IonicContact OE1-NH1 3.72Å; E291-R319 PolarHBondContact OE1-NH1 3.3Å; E291-W322 PolarHBondContact O-NE1 2.76Å
292	E	67.7	Low	61.2	Low	110 Å²	110	88.8 Å²	88.8	51%	0.514	46%	0.456	S	S	.	.	S	Bend	trans	-131	149.1	-178.3	-56.4	-164.2	142.1	0	0	111.3	P290 W322 F357	P290-E292 PolarHBondContact O-N 3.3Å; E292-W322 HydrophobicContact CG-CZ2 4.3Å; E292-F357 HydrophobicContact CB-CE1 3.86Å; E292-F357 HydrophobicContact CB-CZ 4.31Å; E292-F357 HydrophobicContact CG-CE1 4.21Å; E292-F357 HydrophobicContact CG-CZ 4.42Å
293	P	72.8	Confident	63.7	Low	5 Å²	5	83.5 Å²	83.5	3%	0.032	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-76.9	128.4	179.5	28.7	-31.6	0	0	0	112.4	Y299 L315 L318 V354 F357 T362	P293-Y299 HydrophobicContact CB-CE2 4.23Å; P293-L315 HydrophobicContact CB-CD1 4.03Å; P293-L318 HydrophobicContact CB-CD1 3.88Å; P293-L318 HydrophobicContact CG-CD1 4.47Å; P293-V354 HydrophobicContact CB-CG2 4.19Å; P293-F357 HydrophobicContact CG-CD1 4.46Å; P293-F357 HydrophobicContact CG-CD2 4.09Å; P293-F357 HydrophobicContact CG-CE2 4.33Å; P293-F357 HydrophobicContact CG-CG 4.15Å; P293-T362 HydrophobicContact CG-CG2 3.7Å
294	S	73.1	Confident	66.3	Low	47 Å²	47	76.7 Å²	76.7	33%	0.329	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-76.5	134.5	175.5	34.7	0	0	0	0	112.3	D297 Y299 V354	S294-D297 VanDerWaalsContact CB-OD2 3.27Å; S294-D297 WeakPolarHBondContact CB-OD2 3.31Å; S294-D297 PolarHBondContact O-N 2.8Å; S294-D297 PolarHBondContact OG-OD2 2.95Å; S294-Y299 PolarHBondContact N-OH 3.44Å; S294-Y299 VanDerWaalsContact N-OH 3.17Å; S294-Y299 PolarHBondContact OG-OH 3.13Å; S294-Y299 VanDerWaalsContact OG-OH 3.12Å; S294-V354 WeakPolarHBondContact O-CB 3.37Å
295	V	77.3	Confident	68.8	Low	75 Å²	75	71.9 Å²	71.9	46%	0.455	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	133.7	177.5	179.1	0	0	0	0	110.2	V354 L355 F357 M385	V295-V354 HydrophobicContact CG2-CG1 4.26Å; V295-L355 WeakPolarHBondContact CG1-O 3.37Å; V295-F357 HydrophobicContact CG2-CB 4.02Å; V295-M385 HydrophobicContact CG1-SD 4.46Å
296	G	70.8	Confident	71.1	Confident	9 Å²	9	67.6 Å²	67.6	9%	0.093	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-5.3	-179.8	0	0	0	0	0	115.2	K353 V354 R382	G296-K353 WeakPolarHBondContact O-CE 3.2Å; G296-V354 PolarHBondContact N-O 2.77Å; G296-R382 PolarHBondContact O-NE 3.23Å; G296-R382 PolarHBondContact O-NH2 3.07Å
297	D	78.9	Confident	73.2	Confident	62 Å²	62	65.4 Å²	65.4	33%	0.332	34%	0.342	S	S	.	.			trans	-90.3	161.5	172	-71.6	-33.8	0	0	0	112.2	S294 Y299 K353 V354 R382	S294-D297 VanDerWaalsContact CB-OD2 3.27Å; S294-D297 WeakPolarHBondContact CB-OD2 3.31Å; S294-D297 PolarHBondContact O-N 2.8Å; S294-D297 PolarHBondContact OG-OD2 2.95Å; D297-Y299 HydrophobicContact CB-CE2 4.11Å; D297-K353 WeakPolarHBondContact O-CA 3.37Å; D297-V354 PolarHBondContact O-N 3.44Å; D297-R382 IonicContact OD1-CZ 2.68Å; D297-R382 IonicContact OD1-NH2 3.53Å; D297-R382 PolarHBondContact OD1-NH2 2.88Å
298	I	83.4	Confident	74.6	Confident	56 Å²	56	63.4 Å²	63.4	29%	0.287	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.2	-175.4	-61.4	171.8	0	0	0	109.2	K351 V352 K353 V369 D376	I298-K351 HydrophobicContact CG2-CB 4.39Å; I298-V352 WeakPolarHBondContact CA-O 3.4Å; I298-K353 HydrophobicContact CG1-CB 4.21Å; I298-K353 HydrophobicContact CG1-CG 4.25Å; I298-V369 HydrophobicContact CD1-CG1 4.07Å; I298-V369 HydrophobicContact CD1-CG2 3.8Å; I298-V369 HydrophobicContact CG1-CG2 3.84Å; I298-V369 HydrophobicContact CG2-CG1 3.84Å; I298-V369 HydrophobicContact CG2-CG2 4.2Å; I298-D376 HydrophobicContact CD1-CB 4Å
299	Y	84.8	Confident	75.9	Confident	33 Å²	33	64.4 Å²	64.4	13%	0.129	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	150	178	-66.9	-91.8	0	0	0	110.9	P293 S294 D297 L315 L318 V352 V354	P293-Y299 HydrophobicContact CB-CE2 4.23Å; S294-Y299 PolarHBondContact N-OH 3.44Å; S294-Y299 VanDerWaalsContact N-OH 3.17Å; S294-Y299 PolarHBondContact OG-OH 3.13Å; S294-Y299 VanDerWaalsContact OG-OH 3.12Å; D297-Y299 HydrophobicContact CB-CE2 4.11Å; Y299-L315 HydrophobicContact CD2-CD1 4.43Å; Y299-L315 HydrophobicContact CG-CD1 4.45Å; Y299-L318 HydrophobicContact CD1-CG 4.46Å; Y299-L318 HydrophobicContact CE1-CD1 4.27Å; Y299-L318 HydrophobicContact CE1-CD2 3.82Å; Y299-L318 HydrophobicContact CE1-CG 4.04Å; Y299-V352 PolarHBondContact N-O 2.84Å; Y299-V352 WeakPolarHBondContact O-CG2 3.33Å; Y299-V352 PolarHBondContact O-N 3.01Å; Y299-V354 HydrophobicContact CD2-CG2 3.77Å; Y299-V354 HydrophobicContact CE2-CG2 3.84Å
300	N	84.9	Confident	77.4	Confident	97 Å²	97	61.1 Å²	61.1	52%	0.519	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	141.2	162	-67.2	-41	0	0	0	108.6	E316	N300-E316 PolarHBondContact O-N 2.8Å
301	G	86.7	Confident	78.8	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	166.7	177.3	0	0	0	0	0	113.3	Q314 R349 V350	G301-Q314 CarbonylContact C-O 3.59Å; G301-Q314 WeakPolarHBondContact CA-O 3.25Å; G301-R349 CarbonylContact O-C 3.6Å; G301-R349 VanDerWaalsContact O-CA 3.31Å; G301-R349 WeakPolarHBondContact O-CA 3.48Å; G301-V350 PolarHBondContact N-O 3Å; G301-V350 PolarHBondContact O-N 3.25Å
302	K	88.8	Confident	80.3	Confident	91 Å²	91	54.9 Å²	54.9	40%	0.396	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.3	-177.8	-169.9	177	-176.1	177	0	110.7	T304 V313 Q314 G347 Q348	K302-T304 PolarHBondContact O-N 3.33Å; K302-T304 VanDerWaalsContact O-N 3.14Å; K302-V313 WeakPolarHBondContact O-CA 3.37Å; K302-Q314 PolarHBondContact N-O 3.49Å; K302-Q314 PolarHBondContact O-N 3.21Å; K302-G347 WeakPolarHBondContact CE-O 3.38Å; K302-Q348 CarbonylContact C-O 3.5Å; K302-Q348 WeakPolarHBondContact CA-O 3.41Å
303	V	87.1	Confident	81.3	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	110.8	179.9	-179.4	0	0	0	0	109.8	I306 C311 F312 V313 V344 G347 Q348 V350	V303-I306 HydrophobicContact CG1-CD1 4.43Å; V303-I306 HydrophobicContact CG1-CG1 3.95Å; V303-C311 HydrophobicContact CG1-CB 4.21Å; V303-F312 CarbonylContact C-O 3.6Å; V303-F312 WeakPolarHBondContact CA-O 3.46Å; V303-V313 HydrophobicContact CG2-CG2 4.27Å; V303-V344 HydrophobicContact CG2-CB 4.36Å; V303-G347 WeakPolarHBondContact O-CA 3.25Å; V303-G347 PolarHBondContact O-N 3.07Å; V303-Q348 HydrophobicContact CG2-CB 4.39Å; V303-Q348 PolarHBondContact N-O 3.1Å; V303-V350 HydrophobicContact CG2-CG1 4.3Å; V303-V350 HydrophobicContact CG2-CG2 4.29Å
304	T	84.9	Confident	81.9	Confident	34 Å²	34	51.6 Å²	51.6	21%	0.209	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-40.1	-179.4	52	0	0	0	0	112.2	K302 F312 Q314 E323 K346	K302-T304 PolarHBondContact O-N 3.33Å; K302-T304 VanDerWaalsContact O-N 3.14Å; T304-F312 PolarHBondContact N-O 3.25Å; T304-F312 WeakPolarHBondContact OG1-CB 3.44Å; T304-F312 PolarHBondContact OG1-O 3.41Å; T304-Q314 HydrophobicContact CG2-CB 3.55Å; T304-E323 PolarHBondContact OG1-OE2 3.11Å; T304-K346 WeakPolarHBondContact O-CE 3.29Å
305	S	80	Confident	82.5	Confident	44 Å²	44	49.6 Å²	49.6	31%	0.308	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.7	-179	-162.3	0	0	0	0	112.1	C311 F312	S305-C311 WeakPolarHBondContact O-CA 3.34Å; S305-F312 PolarHBondContact O-N 3.14Å
306	I	82.3	Confident	82.4	Confident	54 Å²	54	49 Å²	49	28%	0.277	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130	178.9	-61.5	167.3	0	0	0	107.6	V303 C311 V340 V344 K346	V303-I306 HydrophobicContact CG1-CD1 4.43Å; V303-I306 HydrophobicContact CG1-CG1 3.95Å; I306-C311 HydrophobicContact CG1-CB 4.3Å; I306-V340 HydrophobicContact CG2-CB 3.87Å; I306-V340 HydrophobicContact CG2-CG1 3.81Å; I306-V344 HydrophobicContact CD1-CG2 4.29Å; I306-V344 WeakPolarHBondContact CD1-O 3.34Å; I306-V344 HydrophobicContact CG1-CG2 4.38Å; I306-K346 HydrophobicContact CD1-CB 4.47Å
307	M	81.3	Confident	82.2	Confident	85 Å²	85	51.9 Å²	51.9	42%	0.419	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	168.3	175.9	-67.7	-167.4	178.9	0	0	110.3	F309 G310 F312 V340	M307-F309 HydrophobicContact CB-CD1 4.32Å; M307-F309 HydrophobicContact CB-CE1 4Å; M307-F309 HydrophobicContact CB-CZ 4.16Å; M307-F309 PolarHBondContact O-N 3.04Å; M307-F309 HydrophobicContact SD-CE1 3.85Å; M307-F309 HydrophobicContact SD-CZ 3.58Å; M307-F309 VanDerWaalsContact SD-CZ 3.58Å; M307-G310 CarbonylContact C-O 3.43Å; M307-G310 WeakPolarHBondContact CA-O 3.44Å; M307-G310 PolarHBondContact N-O 3.14Å; M307-G310 PolarHBondContact O-N 3.42Å; M307-F312 HydrophobicContact CE-CE2 4Å; M307-F312 HydrophobicContact CG-CE2 4.38Å; M307-F312 HydrophobicContact SD-CE2 3.8Å; M307-V340 WeakPolarHBondContact O-CG2 3.21Å
308	Q	70.8	Confident	81.8	Confident	189 Å²	189	50.1 Å²	50.1	88%	0.883	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.9	-176.2	-68.1	176.3	-16	0	0	113.8
309	F	73.4	Confident	80.6	Confident	101 Å²	101	55.5 Å²	55.5	44%	0.443	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-4.8	-179	57.3	-96	0	0	0	114.7	M307 L325 H327 I328	M307-F309 HydrophobicContact CB-CD1 4.32Å; M307-F309 HydrophobicContact CB-CE1 4Å; M307-F309 HydrophobicContact CB-CZ 4.16Å; M307-F309 PolarHBondContact O-N 3.04Å; M307-F309 HydrophobicContact SD-CE1 3.85Å; M307-F309 HydrophobicContact SD-CZ 3.58Å; M307-F309 VanDerWaalsContact SD-CZ 3.58Å; F309-L325 HydrophobicContact CD2-CD1 4.32Å; F309-L325 HydrophobicContact CD2-CD2 4.17Å; F309-L325 HydrophobicContact CE2-CD1 3.94Å; F309-L325 HydrophobicContact CE2-CD2 3.82Å; F309-H327 PolarHBondContact O-CD2 3.44Å; F309-I328 PolarHBondContact O-N 2.94Å
310	G	84.1	Confident	79.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.7	179.2	-176.7	0	0	0	0	0	113.7	M307 V326	M307-G310 CarbonylContact C-O 3.43Å; M307-G310 WeakPolarHBondContact CA-O 3.44Å; M307-G310 PolarHBondContact N-O 3.14Å; M307-G310 PolarHBondContact O-N 3.42Å; G310-V326 CarbonylContact C-O 3.57Å; G310-V326 WeakPolarHBondContact CA-O 3.41Å
311	C	85.1	Confident	79.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.9	173.4	64	0	0	0	0	111.6	V303 S305 I306 V326 V340 V344	V303-C311 HydrophobicContact CG1-CB 4.21Å; S305-C311 WeakPolarHBondContact O-CA 3.34Å; I306-C311 HydrophobicContact CG1-CB 4.3Å; C311-V326 PolarHBondContact N-O 3.26Å; C311-V326 PolarHBondContact O-N 2.81Å; C311-V340 HydrophobicContact CB-CG1 4Å; C311-V344 HydrophobicContact CB-CG2 4.01Å
312	F	87.8	Confident	78.6	Confident	58 Å²	58	65.7 Å²	65.7	25%	0.254	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.6	171.1	-74.6	-87.4	0	0	0	109.5	V303 T304 S305 M307 G324 L325	V303-F312 CarbonylContact C-O 3.6Å; V303-F312 WeakPolarHBondContact CA-O 3.46Å; T304-F312 PolarHBondContact N-O 3.25Å; T304-F312 WeakPolarHBondContact OG1-CB 3.44Å; T304-F312 PolarHBondContact OG1-O 3.41Å; S305-F312 PolarHBondContact O-N 3.14Å; M307-F312 HydrophobicContact CE-CE2 4Å; M307-F312 HydrophobicContact CG-CE2 4.38Å; M307-F312 HydrophobicContact SD-CE2 3.8Å; F312-G324 CarbonylContact C-O 3.58Å; F312-G324 WeakPolarHBondContact CA-O 3.38Å; F312-L325 HydrophobicContact CD1-CB 4.46Å; F312-L325 HydrophobicContact CD2-CD1 4.22Å; F312-L325 HydrophobicContact CE1-CB 4.16Å; F312-L325 HydrophobicContact CE1-CD1 4.26Å; F312-L325 HydrophobicContact CE2-CD1 3.94Å; F312-L325 HydrophobicContact CG-CD1 4.5Å; F312-L325 HydrophobicContact CZ-CD1 3.97Å
313	V	88.4	Confident	78.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.7	-179.7	-177.7	0	0	0	0	108.3	K302 V303 E323 G324 V326 V350 V352 L364	K302-V313 WeakPolarHBondContact O-CA 3.37Å; V303-V313 HydrophobicContact CG2-CG2 4.27Å; V313-E323 WeakPolarHBondContact O-CA 3.46Å; V313-G324 PolarHBondContact N-O 3.19Å; V313-G324 PolarHBondContact O-N 3.19Å; V313-V326 HydrophobicContact CG2-CG2 3.87Å; V313-V350 HydrophobicContact CG1-CG2 3.77Å; V313-V350 HydrophobicContact CG2-CG2 4.1Å; V313-V352 HydrophobicContact CG1-CG1 4.37Å; V313-V352 HydrophobicContact CG1-CG2 4.15Å; V313-L364 HydrophobicContact CB-CD1 4.02Å
314	Q	87.1	Confident	78.1	Confident	46 Å²	46	65.8 Å²	65.8	22%	0.215	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.1	170.6	-175.8	-171.8	-10.7	0	0	109.3	G301 K302 T304 W322 E323	G301-Q314 CarbonylContact C-O 3.59Å; G301-Q314 WeakPolarHBondContact CA-O 3.25Å; K302-Q314 PolarHBondContact N-O 3.49Å; K302-Q314 PolarHBondContact O-N 3.21Å; T304-Q314 HydrophobicContact CG2-CB 3.55Å; Q314-W322 WeakPolarHBondContact CA-O 3.4Å; Q314-E323 HydrophobicContact CB-CG 3.97Å; Q314-E323 HydrophobicContact CG-CG 4.16Å
315	L	85.3	Confident	78.1	Confident	5 Å²	5	66.3 Å²	66.3	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134	177.9	-55.3	-175.6	0	0	0	110.8	P293 Y299 L318 W322 V352 L364	P293-L315 HydrophobicContact CB-CD1 4.03Å; Y299-L315 HydrophobicContact CD2-CD1 4.43Å; Y299-L315 HydrophobicContact CG-CD1 4.45Å; L315-L318 HydrophobicContact CB-CD1 4.2Å; L315-L318 HydrophobicContact CD1-CD1 4Å; L315-W322 PolarHBondContact N-O 2.98Å; L315-V352 HydrophobicContact CD2-CG2 3.58Å; L315-L364 HydrophobicContact CD2-CD1 3.93Å; L315-L364 HydrophobicContact CD2-CD2 4.35Å
316	E	75.4	Confident	78.4	Confident	63 Å²	63	64.2 Å²	64.2	29%	0.294	30%	0.302	S	S	.	.	S	Bend	trans	-100.1	136.8	173.6	-63.2	-173.2	-177.2	0	0	109.6	N300 R349	N300-E316 PolarHBondContact O-N 2.8Å; E316-R349 VanDerWaalsContact CD-NH2 3.33Å; E316-R349 IonicContact OE1-CZ 2.59Å; E316-R349 IonicContact OE1-NE 2.65Å; E316-R349 PolarHBondContact OE1-NE 3.39Å; E316-R349 IonicContact OE1-NH2 3.17Å; E316-R349 PolarHBondContact OE1-NH2 3.14Å; E316-R349 VanDerWaalsContact OE1-NH2 3.14Å; E316-R349 IonicContact OE2-CZ 3.02Å; E316-R349 VanDerWaalsContact OE2-CZ 3.29Å; E316-R349 IonicContact OE2-NE 2.82Å; E316-R349 PolarHBondContact OE2-NE 3.29Å; E316-R349 IonicContact OE2-NH2 3.82Å; E316-R349 PolarHBondContact OE2-NH2 3.49Å
317	G	65.4	Low	78.4	Confident	69 Å²	69	65.7 Å²	65.7	71%	0.711	31%	0.308	S	S	*	.	S	Bend	trans	108.1	-7.5	177.2	0	0	0	0	0	116.4
318	L	70.4	Confident	78.4	Confident	24 Å²	24	63.3 Å²	63.3	13%	0.126	30%	0.296	C	S	.	.	S	Bend	trans	-93.5	154.1	173.6	-65.7	168.1	0	0	0	111.6	P290 P293 Y299 L315 K320	P290-L318 HydrophobicContact CG-CD2 4.13Å; P290-L318 VanDerWaalsContact O-CD2 3.31Å; P290-L318 WeakPolarHBondContact O-CD2 3.12Å; P293-L318 HydrophobicContact CB-CD1 3.88Å; P293-L318 HydrophobicContact CG-CD1 4.47Å; Y299-L318 HydrophobicContact CD1-CG 4.46Å; Y299-L318 HydrophobicContact CE1-CD1 4.27Å; Y299-L318 HydrophobicContact CE1-CD2 3.82Å; Y299-L318 HydrophobicContact CE1-CG 4.04Å; L315-L318 HydrophobicContact CB-CD1 4.2Å; L315-L318 HydrophobicContact CD1-CD1 4Å; L318-K320 VanDerWaalsContact C-N 3.27Å; L318-K320 PolarHBondContact O-N 3.27Å
319	R	58.6	Low	78.8	Confident	169 Å²	169	57.9 Å²	57.9	64%	0.638	28%	0.279	S	S	*	.	S	Bend	trans	-68.6	-24.8	-176.3	-143.5	-178.1	-169.3	-164.3	4.7	113.7	E291	E291-R319 WeakPolarHBondContact OE1-CD 3.21Å; E291-R319 IonicContact OE1-CZ 3.76Å; E291-R319 IonicContact OE1-NH1 3.72Å; E291-R319 PolarHBondContact OE1-NH1 3.3Å
320	K	67.5	Low	79.2	Confident	115 Å²	115	54.5 Å²	54.5	50%	0.5	27%	0.265	S	S	.	.	S	Bend	trans	-116.5	143.9	178.5	-178.5	179.6	173.3	-166	0	108.9	L318 W322	L318-K320 VanDerWaalsContact C-N 3.27Å; L318-K320 PolarHBondContact O-N 3.27Å; K320-W322 HydrophobicContact CD-CZ2 3.78Å; K320-W322 VanDerWaalsContact NZ-CH2 3.34Å; K320-W322 VanDerWaalsContact NZ-CZ2 3.35Å; K320-W322 PolarHBondContact O-N 2.97Å
321	R	71.3	Confident	78.9	Confident	212 Å²	212	54.9 Å²	54.9	80%	0.8	27%	0.267	S	S	*	.			trans	-69.6	113.3	173.8	-66.3	-171.6	-180	-176	2.2	109.2
322	W	75.8	Confident	78.5	Confident	19 Å²	19	62.4 Å²	62.4	7%	0.072	30%	0.295	C	S	.	.			trans	-114.3	132.6	173.8	-71	109	0	0	0	109.6	E291 E292 Q314 L315 K320 F357 G359	E291-W322 PolarHBondContact O-NE1 2.76Å; E292-W322 HydrophobicContact CG-CZ2 4.3Å; Q314-W322 WeakPolarHBondContact CA-O 3.4Å; L315-W322 PolarHBondContact N-O 2.98Å; K320-W322 HydrophobicContact CD-CZ2 3.78Å; K320-W322 VanDerWaalsContact NZ-CH2 3.34Å; K320-W322 VanDerWaalsContact NZ-CZ2 3.35Å; K320-W322 PolarHBondContact O-N 2.97Å; W322-F357 HydrophobicContact CE3-CE2 4.37Å; W322-F357 AromaticContact CH2-CE2 3.92Å; W322-F357 HydrophobicContact CH2-CE2 3.92Å; W322-F357 AromaticContact CH2-CZ 3.75Å; W322-F357 HydrophobicContact CH2-CZ 3.75Å; W322-F357 HydrophobicContact CZ2-CE2 4.43Å; W322-F357 HydrophobicContact CZ2-CZ 4.03Å; W322-F357 AromaticContact CZ3-CE2 3.9Å; W322-F357 HydrophobicContact CZ3-CE2 3.9Å; W322-F357 HydrophobicContact CZ3-CZ 4.23Å; W322-G359 WeakPolarHBondContact CH2-O 3.43Å; W322-G359 VanDerWaalsContact CZ3-O 3.26Å; W322-G359 WeakPolarHBondContact CZ3-O 3.44Å
323	E	81.4	Confident	77.3	Confident	93 Å²	93	67.2 Å²	67.2	44%	0.435	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.3	172	-60.3	-162.9	-166.6	0	0	110	T304 V313 Q314 T362	T304-E323 PolarHBondContact OG1-OE2 3.11Å; V313-E323 WeakPolarHBondContact O-CA 3.46Å; Q314-E323 HydrophobicContact CB-CG 3.97Å; Q314-E323 HydrophobicContact CG-CG 4.16Å; E323-T362 PolarHBondContact O-OG1 2.85Å
324	G	83.7	Confident	75.8	Confident	2 Å²	2	74.3 Å²	74.3	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	153.8	-179.5	0	0	0	0	0	113.2	F312 V313 T362	F312-G324 CarbonylContact C-O 3.58Å; F312-G324 WeakPolarHBondContact CA-O 3.38Å; V313-G324 PolarHBondContact N-O 3.19Å; V313-G324 PolarHBondContact O-N 3.19Å; G324-T362 WeakPolarHBondContact CA-O 3.4Å; G324-T362 WeakPolarHBondContact CA-OG1 3.48Å; G324-T362 PolarHBondContact N-OG1 2.73Å
325	L	86.1	Confident	74.4	Confident	44 Å²	44	75.4 Å²	75.4	23%	0.23	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.4	-178.6	-178.8	67.9	0	0	0	110.3	F309 F312 T362 L364	F309-L325 HydrophobicContact CD2-CD1 4.32Å; F309-L325 HydrophobicContact CD2-CD2 4.17Å; F309-L325 HydrophobicContact CE2-CD1 3.94Å; F309-L325 HydrophobicContact CE2-CD2 3.82Å; F312-L325 HydrophobicContact CD1-CB 4.46Å; F312-L325 HydrophobicContact CD2-CD1 4.22Å; F312-L325 HydrophobicContact CE1-CB 4.16Å; F312-L325 HydrophobicContact CE1-CD1 4.26Å; F312-L325 HydrophobicContact CE2-CD1 3.94Å; F312-L325 HydrophobicContact CG-CD1 4.5Å; F312-L325 HydrophobicContact CZ-CD1 3.97Å; L325-T362 PolarHBondContact N-O 3.21Å; L325-T362 VanDerWaalsContact N-O 3.09Å; L325-L364 PolarHBondContact O-N 3.48Å
326	V	86.3	Confident	73.1	Confident	0 Å²	0	87 Å²	87	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	112	161.4	-171.7	0	0	0	0	107.5	G310 C311 V313 E330 L331 V352 L364 M366	G310-V326 CarbonylContact C-O 3.57Å; G310-V326 WeakPolarHBondContact CA-O 3.41Å; C311-V326 PolarHBondContact N-O 3.26Å; C311-V326 PolarHBondContact O-N 2.81Å; V313-V326 HydrophobicContact CG2-CG2 3.87Å; V326-E330 HydrophobicContact CG1-CB 4.33Å; V326-L331 HydrophobicContact CB-CD1 4.22Å; V326-L331 HydrophobicContact CG1-CD1 3.75Å; V326-L331 HydrophobicContact CG1-CG 3.98Å; V326-V352 HydrophobicContact CG2-CG1 4.06Å; V326-L364 WeakPolarHBondContact CA-O 3.42Å; V326-L364 HydrophobicContact CG2-CB 3.69Å; V326-M366 HydrophobicContact CG1-CG 4.21Å; V326-M366 HydrophobicContact CG1-SD 4.46Å; V326-M366 HydrophobicContact CG2-CG 4.2Å; V326-M366 HydrophobicContact CG2-SD 4.47Å
327	H	81.6	Confident	72.8	Confident	86 Å²	86	85.5 Å²	85.5	40%	0.398	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	149	176.3	-175.1	-111.5	0	0	0	110.9	F309 S329 E330 L331	F309-H327 PolarHBondContact O-CD2 3.44Å; H327-S329 PolarHBondContact CE1-OG 3.46Å; H327-S329 VanDerWaalsContact CE1-OG 3.3Å; H327-S329 PolarHBondContact ND1-OG 2.95Å; H327-S329 VanDerWaalsContact ND1-OG 3.15Å; H327-S329 PolarHBondContact O-N 3Å; H327-E330 PolarHBondContact O-N 3.33Å; H327-L331 PolarHBondContact O-N 3.05Å
328	I	80.8	Confident	72.8	Confident	34 Å²	34	86.1 Å²	86.1	17%	0.174	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-52.2	-29.3	-175.9	-167.4	168	0	0	0	114.3	F309 E330 V337 V340	F309-I328 PolarHBondContact O-N 2.94Å; I328-E330 VanDerWaalsContact C-N 3.34Å; I328-E330 PolarHBondContact O-N 3.2Å; I328-V337 HydrophobicContact CD1-CB 4.41Å; I328-V337 HydrophobicContact CD1-CG1 4.11Å; I328-V337 WeakPolarHBondContact CD1-O 3.26Å; I328-V337 HydrophobicContact CG1-CB 3.97Å; I328-V337 HydrophobicContact CG1-CG1 3.91Å; I328-V340 HydrophobicContact CB-CG2 4.17Å; I328-V340 HydrophobicContact CD1-CG2 3.81Å; I328-V340 HydrophobicContact CG1-CG2 3.96Å
329	S	78.8	Confident	73	Confident	75 Å²	75	89.7 Å²	89.7	52%	0.524	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-76	-12.4	176.6	-41.3	0	0	0	0	115.5	H327	H327-S329 PolarHBondContact CE1-OG 3.46Å; H327-S329 VanDerWaalsContact CE1-OG 3.3Å; H327-S329 PolarHBondContact ND1-OG 2.95Å; H327-S329 VanDerWaalsContact ND1-OG 3.15Å; H327-S329 PolarHBondContact O-N 3Å
330	E	81.6	Confident	73.6	Confident	31 Å²	31	81.9 Å²	81.9	15%	0.145	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-115.1	8	-176.8	-70.5	-80.1	-169.9	0	0	112	V326 H327 I328 L355 S365 M366 K367 R381	V326-E330 HydrophobicContact CG1-CB 4.33Å; H327-E330 PolarHBondContact O-N 3.33Å; I328-E330 VanDerWaalsContact C-N 3.34Å; I328-E330 PolarHBondContact O-N 3.2Å; E330-L355 HydrophobicContact CG-CD1 4.39Å; E330-S365 PolarHBondContact O-OG 3.41Å; E330-S365 WeakPolarHBondContact OE2-CB 3.4Å; E330-S365 PolarHBondContact OE2-OG 3.39Å; E330-M366 PolarHBondContact O-N 3.32Å; E330-K367 WeakPolarHBondContact O-CB 3.44Å; E330-K367 PolarHBondContact O-N 3.04Å; E330-R381 IonicContact OE1-CZ 3.87Å; E330-R381 IonicContact OE1-NH1 2.64Å; E330-R381 PolarHBondContact OE1-NH1 3.46Å; E330-R381 IonicContact OE1-NH2 3.48Å; E330-R381 PolarHBondContact OE1-NH2 3.27Å; E330-R381 IonicContact OE2-NH1 3.8Å
331	L	79.1	Confident	73.9	Confident	8 Å²	8	79.5 Å²	79.5	4%	0.042	40%	0.398	C	S	.	.	S	Bend	trans	-79.7	-31.7	174.7	-101.2	102.8	0	0	0	114.1	V326 H327 V340 V343 V344 M366	V326-L331 HydrophobicContact CB-CD1 4.22Å; V326-L331 HydrophobicContact CG1-CD1 3.75Å; V326-L331 HydrophobicContact CG1-CG 3.98Å; H327-L331 PolarHBondContact O-N 3.05Å; L331-V340 HydrophobicContact CD1-CG1 4.18Å; L331-V340 HydrophobicContact CD2-CG1 3.96Å; L331-V343 HydrophobicContact CD2-CB 3.97Å; L331-V343 HydrophobicContact CD2-CG1 3.89Å; L331-V344 HydrophobicContact CD2-CB 4.49Å; L331-V344 HydrophobicContact CD2-CG1 3.87Å; L331-V344 HydrophobicContact CD2-CG2 3.84Å; L331-M366 HydrophobicContact CG-SD 4.34Å
332	R	75.6	Confident	74.1	Confident	158 Å²	158	75 Å²	75	60%	0.596	39%	0.389	S	S	*	.			trans	-144.9	145.9	-174.1	-158.1	175.5	-173.1	-163.5	2.6	112	E334 V337	R332-E334 WeakPolarHBondContact CD-O 3.46Å; R332-V337 HydrophobicContact CB-CG2 4.13Å
333	R	62.9	Low	73.9	Confident	158 Å²	158	76.3 Å²	76.3	60%	0.596	40%	0.4	S	S	*	.	S	Bend	trans	-77	-32.1	179.5	-169.6	174.1	-179	161.2	3.3	113.7	K367	R333-K367 HydrophobicContact CB-CG 4.2Å
334	E	56.4	Low	73.7	Confident	149 Å²	149	72 Å²	72	70%	0.696	38%	0.38	S	S	*	.	S	Bend	trans	-130.8	141.4	-174	-62.3	-174.7	164.4	0	0	112.1	R332	R332-E334 WeakPolarHBondContact CD-O 3.46Å
335	G	58.3	Low	73.6	Confident	69 Å²	69	75.6 Å²	75.6	71%	0.711	40%	0.404	S	S	*	.	S	Bend	trans	82	153.5	-173.5	0	0	0	0	0	113.9
336	R	58.4	Low	73.4	Confident	248 Å²	248	81.1 Å²	81.1	94%	0.936	43%	0.426	S	S	*	.			trans	-85.4	122.3	167.9	-73.6	-179.4	175.2	174.6	-5.1	108.6
337	V	68	Low	73	Confident	32 Å²	32	82.7 Å²	82.7	19%	0.194	44%	0.443	C	S	.	.			trans	-79.5	123.8	172.2	-179.3	0	0	0	0	108.4	I328 R332 N339 V343	I328-V337 HydrophobicContact CD1-CB 4.41Å; I328-V337 HydrophobicContact CD1-CG1 4.11Å; I328-V337 WeakPolarHBondContact CD1-O 3.26Å; I328-V337 HydrophobicContact CG1-CB 3.97Å; I328-V337 HydrophobicContact CG1-CG1 3.91Å; R332-V337 HydrophobicContact CB-CG2 4.13Å; V337-N339 WeakPolarHBondContact CG1-O 3.47Å; V337-V343 HydrophobicContact CB-CG2 4.47Å; V337-V343 HydrophobicContact CG1-CG2 3.69Å; V337-V343 HydrophobicContact CG2-CG2 3.9Å
338	A	66	Low	73.1	Confident	82 Å²	82	82.4 Å²	82.4	68%	0.678	44%	0.442	S	S	*	.	S	Bend	trans	-90	-45.6	178.8	0	0	0	0	0	111.8
339	N	74.3	Confident	73.4	Confident	100 Å²	100	89.1 Å²	89.1	54%	0.535	47%	0.465	S	S	.	.			trans	-121.9	140.7	170.9	-59.3	-61.2	0	0	0	110.5	V337 A341 D342	V337-N339 WeakPolarHBondContact CG1-O 3.47Å; N339-A341 VanDerWaalsContact C-N 3.28Å; N339-A341 PolarHBondContact O-N 3.48Å; N339-D342 PolarHBondContact O-N 3.32Å
340	V	71.7	Confident	73.7	Confident	4 Å²	4	85.9 Å²	85.9	2%	0.024	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-66.5	-31.4	179.4	-174.7	0	0	0	0	112.1	I306 M307 C311 I328 L331 D342 V343 V344	I306-V340 HydrophobicContact CG2-CB 3.87Å; I306-V340 HydrophobicContact CG2-CG1 3.81Å; M307-V340 WeakPolarHBondContact O-CG2 3.21Å; C311-V340 HydrophobicContact CB-CG1 4Å; I328-V340 HydrophobicContact CB-CG2 4.17Å; I328-V340 HydrophobicContact CD1-CG2 3.81Å; I328-V340 HydrophobicContact CG1-CG2 3.96Å; L331-V340 HydrophobicContact CD1-CG1 4.18Å; L331-V340 HydrophobicContact CD2-CG1 3.96Å; V340-D342 PolarHBondContact O-N 3.18Å; V340-V343 PolarHBondContact O-N 3.43Å; V340-V344 HydrophobicContact CG1-CG2 3.81Å; V340-V344 PolarHBondContact O-N 2.86Å
341	A	74	Confident	74	Confident	66 Å²	66	86.3 Å²	86.3	55%	0.545	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-65.1	-19.7	-179.7	0	0	0	0	0	114.1	N339 V343	N339-A341 VanDerWaalsContact C-N 3.28Å; N339-A341 PolarHBondContact O-N 3.48Å; A341-V343 PolarHBondContact O-N 2.9Å
342	D	75.3	Confident	74.4	Confident	116 Å²	116	86 Å²	86	62%	0.62	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-75.3	-11.4	178.1	-52.2	-23.5	0	0	0	112.2	N339 V340	N339-D342 PolarHBondContact O-N 3.32Å; V340-D342 PolarHBondContact O-N 3.18Å
343	V	71.2	Confident	74.9	Confident	48 Å²	48	78.6 Å²	78.6	29%	0.291	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-31.6	-171.1	-173.2	0	0	0	0	112.8	L331 V337 V340 A341	L331-V343 HydrophobicContact CD2-CB 3.97Å; L331-V343 HydrophobicContact CD2-CG1 3.89Å; V337-V343 HydrophobicContact CB-CG2 4.47Å; V337-V343 HydrophobicContact CG1-CG2 3.69Å; V337-V343 HydrophobicContact CG2-CG2 3.9Å; V340-V343 PolarHBondContact O-N 3.43Å; A341-V343 PolarHBondContact O-N 2.9Å
344	V	77.3	Confident	75.9	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.012	39%	0.386	C	S	.	.			trans	-136.5	141.3	-179.8	-70	0	0	0	0	112.7	V303 I306 C311 L331 V340 M366	V303-V344 HydrophobicContact CG2-CB 4.36Å; I306-V344 HydrophobicContact CD1-CG2 4.29Å; I306-V344 WeakPolarHBondContact CD1-O 3.34Å; I306-V344 HydrophobicContact CG1-CG2 4.38Å; C311-V344 HydrophobicContact CB-CG2 4.01Å; L331-V344 HydrophobicContact CD2-CB 4.49Å; L331-V344 HydrophobicContact CD2-CG1 3.87Å; L331-V344 HydrophobicContact CD2-CG2 3.84Å; V340-V344 HydrophobicContact CG1-CG2 3.81Å; V340-V344 PolarHBondContact O-N 2.86Å; V344-M366 HydrophobicContact CG1-CE 3.94Å; V344-M366 HydrophobicContact CG1-SD 4.19Å
345	S	82.8	Confident	77.1	Confident	77 Å²	77	65.2 Å²	65.2	54%	0.538	36%	0.359	S	S	.	.			trans	-100.7	146.7	173.1	-73.1	0	0	0	0	112.3	G347 Q348	S345-G347 PolarHBondContact O-N 3.03Å; S345-Q348 WeakPolarHBondContact O-CB 3.21Å; S345-Q348 PolarHBondContact O-N 2.89Å; S345-Q348 VanDerWaalsContact O-N 3.08Å
346	K	81.5	Confident	78.1	Confident	160 Å²	160	63.8 Å²	63.8	70%	0.696	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	125.3	175.6	-171.8	-179.8	-173	-179.4	0	110.1	T304 I306	T304-K346 WeakPolarHBondContact O-CE 3.29Å; I306-K346 HydrophobicContact CD1-CB 4.47Å
347	G	77	Confident	78.8	Confident	34 Å²	34	54.1 Å²	54.1	35%	0.351	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-3	-176.6	0	0	0	0	0	115.5	K302 V303 S345	K302-G347 WeakPolarHBondContact CE-O 3.38Å; V303-G347 WeakPolarHBondContact O-CA 3.25Å; V303-G347 PolarHBondContact O-N 3.07Å; S345-G347 PolarHBondContact O-N 3.03Å
348	Q	84.7	Confident	78.6	Confident	79 Å²	79	57.4 Å²	57.4	37%	0.369	32%	0.323	S	S	.	.			trans	-63.5	144.1	174	-176.5	175	-9.3	0	0	111.2	K302 V303 S345 V350	K302-Q348 CarbonylContact C-O 3.5Å; K302-Q348 WeakPolarHBondContact CA-O 3.41Å; V303-Q348 HydrophobicContact CG2-CB 4.39Å; V303-Q348 PolarHBondContact N-O 3.1Å; S345-Q348 WeakPolarHBondContact O-CB 3.21Å; S345-Q348 PolarHBondContact O-N 2.89Å; S345-Q348 VanDerWaalsContact O-N 3.08Å; Q348-V350 HydrophobicContact CG-CG1 4.3Å
349	R	85.8	Confident	78.5	Confident	175 Å²	175	56 Å²	56	66%	0.66	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.5	170.2	-81.4	-179.9	162.1	167.8	-10.5	110.6	G301 E316	G301-R349 CarbonylContact O-C 3.6Å; G301-R349 VanDerWaalsContact O-CA 3.31Å; G301-R349 WeakPolarHBondContact O-CA 3.48Å; E316-R349 VanDerWaalsContact CD-NH2 3.33Å; E316-R349 IonicContact OE1-CZ 2.59Å; E316-R349 IonicContact OE1-NE 2.65Å; E316-R349 PolarHBondContact OE1-NE 3.39Å; E316-R349 IonicContact OE1-NH2 3.17Å; E316-R349 PolarHBondContact OE1-NH2 3.14Å; E316-R349 VanDerWaalsContact OE1-NH2 3.14Å; E316-R349 IonicContact OE2-CZ 3.02Å; E316-R349 VanDerWaalsContact OE2-CZ 3.29Å; E316-R349 IonicContact OE2-NE 2.82Å; E316-R349 PolarHBondContact OE2-NE 3.29Å; E316-R349 IonicContact OE2-NH2 3.82Å; E316-R349 PolarHBondContact OE2-NH2 3.49Å
350	V	87.1	Confident	77.8	Confident	7 Å²	7	56 Å²	56	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155.8	-174.4	-66	0	0	0	0	109.9	G301 V303 V313 Q348 V352 M366	G301-V350 PolarHBondContact N-O 3Å; G301-V350 PolarHBondContact O-N 3.25Å; V303-V350 HydrophobicContact CG2-CG1 4.3Å; V303-V350 HydrophobicContact CG2-CG2 4.29Å; V313-V350 HydrophobicContact CG1-CG2 3.77Å; V313-V350 HydrophobicContact CG2-CG2 4.1Å; Q348-V350 HydrophobicContact CG-CG1 4.3Å; V350-V352 HydrophobicContact CG2-CG1 4.17Å; V350-M366 HydrophobicContact CB-CE 3.97Å; V350-M366 HydrophobicContact CB-SD 4.29Å; V350-M366 HydrophobicContact CG1-CE 3.57Å; V350-M366 HydrophobicContact CG1-SD 4.19Å; V350-M366 HydrophobicContact CG2-SD 4.38Å
351	K	87.7	Confident	77.7	Confident	41 Å²	41	63.2 Å²	63.2	18%	0.178	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132	170.4	-62.5	-180	-173.7	155.6	0	109.2	I298 V369 Q371 D372 T373 G374	I298-K351 HydrophobicContact CG2-CB 4.39Å; K351-V369 HydrophobicContact CB-CG1 3.73Å; K351-Q371 WeakPolarHBondContact CD-O 3.4Å; K351-Q371 WeakPolarHBondContact CE-O 3.45Å; K351-Q371 PolarHBondContact NZ-O 3.01Å; K351-Q371 PolarHBondContact O-NE2 3.29Å; K351-Q371 PolarHBondContact O-OE1 3.46Å; K351-D372 PolarHBondContact NZ-O 2.82Å; K351-T373 VanDerWaalsContact NZ-C 3.28Å; K351-T373 PolarHBondContact NZ-O 2.62Å; K351-G374 VanDerWaalsContact NZ-N 3.15Å
352	V	86.9	Confident	78.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	133.4	-172	-80.8	0	0	0	0	111.7	I298 Y299 V313 L315 V326 V350 L364 S365 M366	I298-V352 WeakPolarHBondContact CA-O 3.4Å; Y299-V352 PolarHBondContact N-O 2.84Å; Y299-V352 WeakPolarHBondContact O-CG2 3.33Å; Y299-V352 PolarHBondContact O-N 3.01Å; V313-V352 HydrophobicContact CG1-CG1 4.37Å; V313-V352 HydrophobicContact CG1-CG2 4.15Å; L315-V352 HydrophobicContact CD2-CG2 3.58Å; V326-V352 HydrophobicContact CG2-CG1 4.06Å; V350-V352 HydrophobicContact CG2-CG1 4.17Å; V352-L364 HydrophobicContact CB-CB 4.31Å; V352-L364 HydrophobicContact CB-CD1 4.4Å; V352-L364 HydrophobicContact CG1-CB 4.41Å; V352-L364 HydrophobicContact CG2-CD1 4.22Å; V352-S365 WeakPolarHBondContact CA-O 3.27Å; V352-M366 HydrophobicContact CG1-CG 3.61Å
353	K	85.6	Confident	78.4	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.017	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.1	172.3	-168.8	175.9	-167.3	175.1	0	109.9	G296 D297 I298 L355 L364 S365 D368 V369 D376 N378	G296-K353 WeakPolarHBondContact O-CE 3.2Å; D297-K353 WeakPolarHBondContact O-CA 3.37Å; I298-K353 HydrophobicContact CG1-CB 4.21Å; I298-K353 HydrophobicContact CG1-CG 4.25Å; K353-L355 PolarHBondContact O-N 3.46Å; K353-L364 WeakPolarHBondContact O-CA 3.47Å; K353-S365 PolarHBondContact N-O 3.07Å; K353-S365 PolarHBondContact O-N 2.84Å; K353-D368 HydrophobicContact CD-CB 3.95Å; K353-V369 HydrophobicContact CB-CG2 3.56Å; K353-D376 WeakPolarHBondContact CE-OD2 3.47Å; K353-D376 IonicContact NZ-OD1 3.14Å; K353-D376 PolarHBondContact NZ-OD1 3.43Å; K353-D376 IonicContact NZ-OD2 3.53Å; K353-D376 PolarHBondContact NZ-OD2 3.17Å; K353-N378 PolarHBondContact NZ-O 3.01Å
354	V	84.9	Confident	79.2	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.3	174	-175.7	0	0	0	0	108.7	P293 S294 V295 G296 D297 Y299 L364	P293-V354 HydrophobicContact CB-CG2 4.19Å; S294-V354 WeakPolarHBondContact O-CB 3.37Å; V295-V354 HydrophobicContact CG2-CG1 4.26Å; G296-V354 PolarHBondContact N-O 2.77Å; D297-V354 PolarHBondContact O-N 3.44Å; Y299-V354 HydrophobicContact CD2-CG2 3.77Å; Y299-V354 HydrophobicContact CE2-CG2 3.84Å; V354-L364 HydrophobicContact CB-CD2 4.4Å; V354-L364 HydrophobicContact CG2-CD2 3.95Å
355	L	81.7	Confident	79.7	Confident	24 Å²	24	55.1 Å²	55.1	13%	0.126	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-36.2	176.6	-67.5	-173.1	0	0	0	112.3	V295 E330 K353 S363	V295-L355 WeakPolarHBondContact CG1-O 3.37Å; E330-L355 HydrophobicContact CG-CD1 4.39Å; K353-L355 PolarHBondContact O-N 3.46Å; L355-S363 PolarHBondContact N-O 3.1Å
356	S	78.4	Confident	79.6	Confident	40 Å²	40	52.2 Å²	52.2	28%	0.28	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	149.9	173.5	59.7	0	0	0	0	110.8	S363	S356-S363 PolarHBondContact N-O 2.78Å; S356-S363 PolarHBondContact O-N 3.38Å
357	F	73.2	Confident	79.7	Confident	45 Å²	45	48.2 Å²	48.2	20%	0.197	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	131.1	172.2	175.1	-131.9	0	0	0	108.8	E292 P293 V295 W322 T362	E292-F357 HydrophobicContact CB-CE1 3.86Å; E292-F357 HydrophobicContact CB-CZ 4.31Å; E292-F357 HydrophobicContact CG-CE1 4.21Å; E292-F357 HydrophobicContact CG-CZ 4.42Å; P293-F357 HydrophobicContact CG-CD1 4.46Å; P293-F357 HydrophobicContact CG-CD2 4.09Å; P293-F357 HydrophobicContact CG-CE2 4.33Å; P293-F357 HydrophobicContact CG-CG 4.15Å; V295-F357 HydrophobicContact CG2-CB 4.02Å; W322-F357 HydrophobicContact CE3-CE2 4.37Å; W322-F357 AromaticContact CH2-CE2 3.92Å; W322-F357 HydrophobicContact CH2-CE2 3.92Å; W322-F357 AromaticContact CH2-CZ 3.75Å; W322-F357 HydrophobicContact CH2-CZ 3.75Å; W322-F357 HydrophobicContact CZ2-CE2 4.43Å; W322-F357 HydrophobicContact CZ2-CZ 4.03Å; W322-F357 AromaticContact CZ3-CE2 3.9Å; W322-F357 HydrophobicContact CZ3-CE2 3.9Å; W322-F357 HydrophobicContact CZ3-CZ 4.23Å; F357-T362 HydrophobicContact CB-CG2 4.38Å; F357-T362 HydrophobicContact CD2-CG2 3.43Å; F357-T362 VanDerWaalsContact CD2-CG2 3.43Å; F357-T362 HydrophobicContact CE2-CG2 4.09Å; F357-T362 HydrophobicContact CG-CG2 4.25Å
358	T	64.2	Low	79.6	Confident	101 Å²	101	46.9 Å²	46.9	62%	0.62	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.1	68.3	-177.3	-45	0	0	0	0	109.1	S360 K361	T358-S360 VanDerWaalsContact C-N 3.25Å; T358-S360 PolarHBondContact O-N 3.46Å; T358-K361 PolarHBondContact N-O 2.94Å; T358-K361 PolarHBondContact O-N 2.93Å
359	G	62.7	Low	79.3	Confident	51 Å²	51	43.3 Å²	43.3	53%	0.526	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	-63.4	171.5	0	0	0	0	0	115.9	W322	W322-G359 WeakPolarHBondContact CH2-O 3.43Å; W322-G359 VanDerWaalsContact CZ3-O 3.26Å; W322-G359 WeakPolarHBondContact CZ3-O 3.44Å
360	S	60.5	Low	78.9	Confident	100 Å²	100	37.2 Å²	37.2	70%	0.699	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-11.9	178.6	60	0	0	0	0	113.7	T358	T358-S360 VanDerWaalsContact C-N 3.25Å; T358-S360 PolarHBondContact O-N 3.46Å
361	K	70.2	Confident	78.6	Confident	157 Å²	157	39.7 Å²	39.7	68%	0.683	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	-179.8	-63	176.6	-175.5	173.1	0	110.1	T358	T358-K361 PolarHBondContact N-O 2.94Å; T358-K361 PolarHBondContact O-N 2.93Å
362	T	80.9	Confident	77.8	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.8	164.6	51.5	0	0	0	0	109.3	P293 E323 G324 L325 F357	P293-T362 HydrophobicContact CG-CG2 3.7Å; E323-T362 PolarHBondContact O-OG1 2.85Å; G324-T362 WeakPolarHBondContact CA-O 3.4Å; G324-T362 WeakPolarHBondContact CA-OG1 3.48Å; G324-T362 PolarHBondContact N-OG1 2.73Å; L325-T362 PolarHBondContact N-O 3.21Å; L325-T362 VanDerWaalsContact N-O 3.09Å; F357-T362 HydrophobicContact CB-CG2 4.38Å; F357-T362 HydrophobicContact CD2-CG2 3.43Å; F357-T362 VanDerWaalsContact CD2-CG2 3.43Å; F357-T362 HydrophobicContact CE2-CG2 4.09Å; F357-T362 HydrophobicContact CG-CG2 4.25Å
363	S	83	Confident	76.8	Confident	54 Å²	54	48.9 Å²	48.9	38%	0.378	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.1	170.5	-68.8	0	0	0	0	109.3	L355 S356	L355-S363 PolarHBondContact N-O 3.1Å; S356-S363 PolarHBondContact N-O 2.78Å; S356-S363 PolarHBondContact O-N 3.38Å
364	L	88	Confident	75.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	149.9	-168.9	-59.8	179.2	0	0	0	110.7	V313 L315 L325 V326 V352 K353 V354	V313-L364 HydrophobicContact CB-CD1 4.02Å; L315-L364 HydrophobicContact CD2-CD1 3.93Å; L315-L364 HydrophobicContact CD2-CD2 4.35Å; L325-L364 PolarHBondContact O-N 3.48Å; V326-L364 WeakPolarHBondContact CA-O 3.42Å; V326-L364 HydrophobicContact CG2-CB 3.69Å; V352-L364 HydrophobicContact CB-CB 4.31Å; V352-L364 HydrophobicContact CB-CD1 4.4Å; V352-L364 HydrophobicContact CG1-CB 4.41Å; V352-L364 HydrophobicContact CG2-CD1 4.22Å; K353-L364 WeakPolarHBondContact O-CA 3.47Å; V354-L364 HydrophobicContact CB-CD2 4.4Å; V354-L364 HydrophobicContact CG2-CD2 3.95Å
365	S	86.1	Confident	75	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.8	169.7	-178.3	0	0	0	0	111.1	E330 V352 K353 K367 D368	E330-S365 PolarHBondContact O-OG 3.41Å; E330-S365 WeakPolarHBondContact OE2-CB 3.4Å; E330-S365 PolarHBondContact OE2-OG 3.39Å; V352-S365 WeakPolarHBondContact CA-O 3.27Å; K353-S365 PolarHBondContact N-O 3.07Å; K353-S365 PolarHBondContact O-N 2.84Å; S365-K367 PolarHBondContact OG-N 2.78Å; S365-K367 VanDerWaalsContact OG-N 3.15Å; S365-D368 PolarHBondContact OG-N 2.96Å
366	M	82.1	Confident	74.6	Confident	17 Å²	17	57.2 Å²	57.2	8%	0.084	33%	0.326	C	S	.	.	S	Bend	trans	-92.8	-21.9	165.6	-67.6	173.7	57.3	0	0	111.2	V326 E330 L331 V344 V350 V352 V369 Q371	V326-M366 HydrophobicContact CG1-CG 4.21Å; V326-M366 HydrophobicContact CG1-SD 4.46Å; V326-M366 HydrophobicContact CG2-CG 4.2Å; V326-M366 HydrophobicContact CG2-SD 4.47Å; E330-M366 PolarHBondContact O-N 3.32Å; L331-M366 HydrophobicContact CG-SD 4.34Å; V344-M366 HydrophobicContact CG1-CE 3.94Å; V344-M366 HydrophobicContact CG1-SD 4.19Å; V350-M366 HydrophobicContact CB-CE 3.97Å; V350-M366 HydrophobicContact CB-SD 4.29Å; V350-M366 HydrophobicContact CG1-CE 3.57Å; V350-M366 HydrophobicContact CG1-SD 4.19Å; V350-M366 HydrophobicContact CG2-SD 4.38Å; V352-M366 HydrophobicContact CG1-CG 3.61Å; M366-V369 PolarHBondContact O-N 2.94Å; M366-Q371 PolarHBondContact O-NE2 3.2Å
367	K	82.4	Confident	74.2	Confident	75 Å²	75	58.8 Å²	58.8	33%	0.326	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-34.2	-175.9	166.8	-179.1	174.3	-170.3	0	114.1	E330 R333 S365 V369	E330-K367 WeakPolarHBondContact O-CB 3.44Å; E330-K367 PolarHBondContact O-N 3.04Å; R333-K367 HydrophobicContact CB-CG 4.2Å; S365-K367 PolarHBondContact OG-N 2.78Å; S365-K367 VanDerWaalsContact OG-N 3.15Å; K367-V369 VanDerWaalsContact C-N 3.26Å; K367-V369 PolarHBondContact O-N 3.43Å
368	D	76.3	Confident	73.7	Confident	6 Å²	6	59.8 Å²	59.8	3%	0.032	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3.1	178.6	-77.5	-23.1	0	0	0	113	K353 S365 L377 N378 R381	K353-D368 HydrophobicContact CD-CB 3.95Å; S365-D368 PolarHBondContact OG-N 2.96Å; D368-L377 PolarHBondContact O-N 3.33Å; D368-N378 HydrophobicContact CB-CB 4.24Å; D368-N378 VanDerWaalsContact OD1-CB 3.31Å; D368-N378 WeakPolarHBondContact OD1-CB 3.37Å; D368-N378 PolarHBondContact OD1-ND2 2.7Å; D368-R381 IonicContact OD1-NH1 3.25Å; D368-R381 WeakPolarHBondContact OD2-CD 3.49Å; D368-R381 IonicContact OD2-CZ 2.68Å; D368-R381 IonicContact OD2-NE 2.7Å; D368-R381 IonicContact OD2-NH1 3.29Å; D368-R381 PolarHBondContact OD2-NH1 3.11Å
369	V	78.8	Confident	73.3	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-130.6	128.7	-175.7	-176.8	0	0	0	0	111.3	I298 K351 K353 M366 K367 Q371	I298-V369 HydrophobicContact CD1-CG1 4.07Å; I298-V369 HydrophobicContact CD1-CG2 3.8Å; I298-V369 HydrophobicContact CG1-CG2 3.84Å; I298-V369 HydrophobicContact CG2-CG1 3.84Å; I298-V369 HydrophobicContact CG2-CG2 4.2Å; K351-V369 HydrophobicContact CB-CG1 3.73Å; K353-V369 HydrophobicContact CB-CG2 3.56Å; M366-V369 PolarHBondContact O-N 2.94Å; K367-V369 VanDerWaalsContact C-N 3.26Å; K367-V369 PolarHBondContact O-N 3.43Å; V369-Q371 PolarHBondContact O-N 3.49Å; V369-Q371 PolarHBondContact O-NE2 3.13Å; V369-Q371 VanDerWaalsContact O-NE2 3.14Å
370	D	77.4	Confident	72.8	Confident	48 Å²	48	62.3 Å²	62.3	26%	0.257	34%	0.34	S	S	.	.			trans	-69.2	125.4	167.2	179.8	16.8	0	0	0	110.3	D372 T373 G374 E375 L377	D370-D372 PolarHBondContact OD1-N 2.57Å; D370-D372 VanDerWaalsContact OD1-N 3.15Å; D370-T373 WeakPolarHBondContact CB-OG1 3.49Å; D370-T373 VanDerWaalsContact CG-OG1 3.3Å; D370-T373 VanDerWaalsContact OD2-CB 3.3Å; D370-T373 WeakPolarHBondContact OD2-CB 3.35Å; D370-T373 VanDerWaalsContact OD2-CG2 3.24Å; D370-T373 WeakPolarHBondContact OD2-CG2 3.45Å; D370-T373 PolarHBondContact OD2-N 2.91Å; D370-T373 VanDerWaalsContact OD2-N 3.17Å; D370-T373 PolarHBondContact OD2-OG1 3.36Å; D370-G374 WeakPolarHBondContact O-CA 3.36Å; D370-G374 PolarHBondContact O-N 3.43Å; D370-E375 PolarHBondContact N-O 2.9Å; D370-E375 VanDerWaalsContact N-O 3.13Å; D370-L377 HydrophobicContact CB-CD1 4.08Å; D370-L377 HydrophobicContact CB-CD2 4.26Å; D370-L377 HydrophobicContact CB-CG 4.18Å
371	Q	80.4	Confident	72.5	Confident	59 Å²	59	62.1 Å²	62.1	28%	0.276	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.6	-176.9	-58.8	-59.3	-66.1	0	0	111.6	K351 M366 V369	K351-Q371 WeakPolarHBondContact CD-O 3.4Å; K351-Q371 WeakPolarHBondContact CE-O 3.45Å; K351-Q371 PolarHBondContact NZ-O 3.01Å; K351-Q371 PolarHBondContact O-NE2 3.29Å; K351-Q371 PolarHBondContact O-OE1 3.46Å; M366-Q371 PolarHBondContact O-NE2 3.2Å; V369-Q371 PolarHBondContact O-N 3.49Å; V369-Q371 PolarHBondContact O-NE2 3.13Å; V369-Q371 VanDerWaalsContact O-NE2 3.14Å
372	D	70.6	Confident	71.3	Confident	148 Å²	148	61.5 Å²	61.5	79%	0.791	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-57.6	-176.5	-69.7	-33.7	0	0	0	111.2	K351 D370	K351-D372 PolarHBondContact NZ-O 2.82Å; D370-D372 PolarHBondContact OD1-N 2.57Å; D370-D372 VanDerWaalsContact OD1-N 3.15Å
373	T	66.3	Low	69.3	Low	85 Å²	85	72.1 Å²	72.1	52%	0.521	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-41.7	178.4	63.8	0	0	0	0	112.6	K351 D370 E375	K351-T373 VanDerWaalsContact NZ-C 3.28Å; K351-T373 PolarHBondContact NZ-O 2.62Å; D370-T373 WeakPolarHBondContact CB-OG1 3.49Å; D370-T373 VanDerWaalsContact CG-OG1 3.3Å; D370-T373 VanDerWaalsContact OD2-CB 3.3Å; D370-T373 WeakPolarHBondContact OD2-CB 3.35Å; D370-T373 VanDerWaalsContact OD2-CG2 3.24Å; D370-T373 WeakPolarHBondContact OD2-CG2 3.45Å; D370-T373 PolarHBondContact OD2-N 2.91Å; D370-T373 VanDerWaalsContact OD2-N 3.17Å; D370-T373 PolarHBondContact OD2-OG1 3.36Å; T373-E375 PolarHBondContact OG1-N 3.44Å
374	G	64	Low	67.2	Low	23 Å²	23	76.5 Å²	76.5	24%	0.237	38%	0.376	C	S	.	.			trans	89.7	7.6	-170.1	0	0	0	0	0	114.5	K351 D370	K351-G374 VanDerWaalsContact NZ-N 3.15Å; D370-G374 WeakPolarHBondContact O-CA 3.36Å; D370-G374 PolarHBondContact O-N 3.43Å
375	E	68.9	Low	64.8	Low	137 Å²	137	82.4 Å²	82.4	64%	0.64	41%	0.405	S	S	*	.			trans	-72.1	147.7	177.7	-65.6	-172.7	168.5	0	0	112.6	D370 T373 L377	D370-E375 PolarHBondContact N-O 2.9Å; D370-E375 VanDerWaalsContact N-O 3.13Å; T373-E375 PolarHBondContact OG1-N 3.44Å; E375-L377 PolarHBondContact O-N 3.3Å
376	D	73.2	Confident	62.2	Low	44 Å²	44	85.1 Å²	85.1	24%	0.235	43%	0.434	C	S	.	.	B	Isolated β-bridge	trans	-76.2	105.3	175.2	-176.7	-0.6	0	0	0	110	I298 K353 N378 P379	I298-D376 HydrophobicContact CD1-CB 4Å; K353-D376 WeakPolarHBondContact CE-OD2 3.47Å; K353-D376 IonicContact NZ-OD1 3.14Å; K353-D376 PolarHBondContact NZ-OD1 3.43Å; K353-D376 IonicContact NZ-OD2 3.53Å; K353-D376 PolarHBondContact NZ-OD2 3.17Å; D376-N378 PolarHBondContact O-N 2.96Å; D376-N378 VanDerWaalsContact OD1-C 3.26Å; D376-N378 PolarHBondContact OD1-N 2.92Å; D376-P379 WeakPolarHBondContact OD2-CA 3.45Å
377	L	69.2	Low	59.9	Low	74 Å²	74	91 Å²	91	39%	0.387	47%	0.473	S	S	.	.	S	Bend	trans	-75	-4.4	-178.1	-64.9	176.2	0	0	0	113.2	D368 D370 E375	D368-L377 PolarHBondContact O-N 3.33Å; D370-L377 HydrophobicContact CB-CD1 4.08Å; D370-L377 HydrophobicContact CB-CD2 4.26Å; D370-L377 HydrophobicContact CB-CG 4.18Å; E375-L377 PolarHBondContact O-N 3.3Å
378	N	62.5	Low	57.5	Low	65 Å²	65	96.4 Å²	96.4	35%	0.348	50%	0.499	S	S	.	.			trans	-150.6	64.4	-174.1	-162.6	4.7	0	0	0	112.8	K353 D368 D376 N380 R381	K353-N378 PolarHBondContact NZ-O 3.01Å; D368-N378 HydrophobicContact CB-CB 4.24Å; D368-N378 VanDerWaalsContact OD1-CB 3.31Å; D368-N378 WeakPolarHBondContact OD1-CB 3.37Å; D368-N378 PolarHBondContact OD1-ND2 2.7Å; D376-N378 PolarHBondContact O-N 2.96Å; D376-N378 VanDerWaalsContact OD1-C 3.26Å; D376-N378 PolarHBondContact OD1-N 2.92Å; N378-N380 VanDerWaalsContact C-N 3.31Å; N378-N380 PolarHBondContact O-N 3.19Å; N378-R381 PolarHBondContact O-N 3.06Å
379	P	56.7	Low	55.2	Low	77 Å²	77	99.9 Å²	99.9	50%	0.5	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-66.6	-28.2	-173.4	26	-35.1	0	0	0	113.7	D376 R381 R382	D376-P379 WeakPolarHBondContact OD2-CA 3.45Å; P379-R381 PolarHBondContact O-N 3.25Å; P379-R381 VanDerWaalsContact O-N 3.1Å; P379-R382 WeakPolarHBondContact O-CB 3.41Å; P379-R382 PolarHBondContact O-N 2.83Å; P379-R382 VanDerWaalsContact O-N 3.09Å
380	N	51.3	Low	52.8	Low	129 Å²	129	103.6 Å²	103.6	69%	0.69	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-60.8	-22	-179.9	-77.5	-13.2	0	0	0	113.5	N378 R382 R383	N378-N380 VanDerWaalsContact C-N 3.31Å; N378-N380 PolarHBondContact O-N 3.19Å; N380-R382 PolarHBondContact O-N 3.12Å; N380-R382 VanDerWaalsContact O-N 3.15Å; N380-R383 PolarHBondContact O-N 3.01Å
381	R	53.3	Low	50.6	Low	95 Å²	95	110.2 Å²	110.2	36%	0.358	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-61.7	-20.6	176.4	-153.1	173.2	-174.6	173	0.5	112.5	E330 D368 N378 P379 R383	E330-R381 IonicContact OE1-CZ 3.87Å; E330-R381 IonicContact OE1-NH1 2.64Å; E330-R381 PolarHBondContact OE1-NH1 3.46Å; E330-R381 IonicContact OE1-NH2 3.48Å; E330-R381 PolarHBondContact OE1-NH2 3.27Å; E330-R381 IonicContact OE2-NH1 3.8Å; D368-R381 IonicContact OD1-NH1 3.25Å; D368-R381 WeakPolarHBondContact OD2-CD 3.49Å; D368-R381 IonicContact OD2-CZ 2.68Å; D368-R381 IonicContact OD2-NE 2.7Å; D368-R381 IonicContact OD2-NH1 3.29Å; D368-R381 PolarHBondContact OD2-NH1 3.11Å; N378-R381 PolarHBondContact O-N 3.06Å; P379-R381 PolarHBondContact O-N 3.25Å; P379-R381 VanDerWaalsContact O-N 3.1Å; R381-R383 VanDerWaalsContact C-N 3.28Å; R381-R383 PolarHBondContact O-N 3.3Å
382	R	45.9	Very low	48.1	Very low	145 Å²	145	114.1 Å²	114.1	55%	0.547	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-66.1	-20.7	172.2	-74.2	-173.4	172.3	-152.6	-7.3	114.3	G296 D297 P379 N380	G296-R382 PolarHBondContact O-NE 3.23Å; G296-R382 PolarHBondContact O-NH2 3.07Å; D297-R382 IonicContact OD1-CZ 2.68Å; D297-R382 IonicContact OD1-NH2 3.53Å; D297-R382 PolarHBondContact OD1-NH2 2.88Å; P379-R382 WeakPolarHBondContact O-CB 3.41Å; P379-R382 PolarHBondContact O-N 2.83Å; P379-R382 VanDerWaalsContact O-N 3.09Å; N380-R382 PolarHBondContact O-N 3.12Å; N380-R382 VanDerWaalsContact O-N 3.15Å
383	R	38.6	Very low	46.1	Very low	228 Å²	228	114.3 Å²	114.3	86%	0.86	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-89.5	-9.6	-173.5	-129.3	178.5	-174.1	179.5	-0.1	114.8	N380 R381	N380-R383 PolarHBondContact O-N 3.01Å; R381-R383 VanDerWaalsContact C-N 3.28Å; R381-R383 PolarHBondContact O-N 3.3Å
384	N	40.2	Very low	44.3	Very low	146 Å²	146	114.8 Å²	114.8	78%	0.781	64%	0.641	S	S	*	*	S	Bend	trans	-110.1	19.1	-172.8	-84.6	52.3	0	0	0	114.1
385	M	36.7	Very low	42.8	Very low	125 Å²	125	123.1 Å²	123.1	62%	0.616	68%	0.676	S	S	*	*			trans	-127.1	81.3	171.1	-73	-168.8	172.4	0	0	110.5	V295	V295-M385 HydrophobicContact CG1-SD 4.46Å
386	G	31.8	Very low	41	Very low	58 Å²	58	126.9 Å²	126.9	60%	0.598	68%	0.684	S	S	*	*			trans	-78	155.7	155	0	0	0	0	0	110.1	E388	G386-E388 VanDerWaalsContact C-N 3.28Å; G386-E388 PolarHBondContact O-N 3.45Å
387	P	34.3	Very low	39.1	Very low	140 Å²	140	130.1 Å²	130.1	91%	0.909	70%	0.702	S	S	*	*	S	Bend	trans	-86.2	49.8	-170.2	36.7	-37.9	0	0	0	113.9
388	E	30.3	Very low	37.5	Very low	188 Å²	188	132 Å²	132	88%	0.879	72%	0.718	S	S	*	*			trans	-137.2	154.3	177	-67.9	-169.9	153.4	0	0	112.3	G386	G386-E388 VanDerWaalsContact C-N 3.28Å; G386-E388 PolarHBondContact O-N 3.45Å
389	G	28.8	Very low	36	Very low	79 Å²	79	135.1 Å²	135.1	81%	0.814	74%	0.735	S	S	*	*			trans	85.6	47.2	172.5	0	0	0	0	0	115.6	E391	G389-E391 PolarHBondContact O-N 3.15Å
390	G	29.2	Very low	35.2	Very low	82 Å²	82	140 Å²	140	85%	0.845	74%	0.743	S	S	*	*			trans	-90.5	63.7	177	0	0	0	0	0	115
391	E	29.6	Very low	34.3	Very low	187 Å²	187	139.7 Å²	139.7	87%	0.874	75%	0.749	S	S	*	*			trans	-157.7	172.6	162.8	-120.4	161.2	-144.7	0	0	112.5	G389	G389-E391 PolarHBondContact O-N 3.15Å
392	D	28.9	Very low	33.5	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	77%	0.766	S	S	*	*			trans	60.8	72.3	178.6	-113.9	-14.2	0	0	0	118.3
393	V	27.9	Very low	32.6	Very low	152 Å²	152	140.6 Å²	140.6	92%	0.921	78%	0.779	S	S	*	*			trans	-114.7	67.3	157.7	-170.4	0	0	0	0	110.2
394	S	29.6	Very low	32.2	Very low	94 Å²	94	137.2 Å²	137.2	66%	0.657	78%	0.778	S	S	*	*			trans	-85.4	122.9	171	51.5	0	0	0	0	111.5
395	M	31.9	Very low	31.6	Very low	198 Å²	198	137.9 Å²	137.9	98%	0.975	78%	0.781	S	S	*	*			trans	10.1	106.4	174.2	-54.5	-167.3	-152.7	0	0	119.2
396	R	31.8	Very low	31.1	Very low	217 Å²	217	139.6 Å²	139.6	82%	0.819	79%	0.792	S	S	*	*			trans	-110.4	126.9	165.2	-151.8	176.6	-155.4	165.4	13.1	111.8
397	N	33.1	Very low	30.8	Very low	112 Å²	112	140.2 Å²	140.2	60%	0.599	80%	0.798	S	S	*	*			trans	-66.6	134.4	-174.6	-169.4	48.8	0	0	0	112.9	D399	N397-D399 PolarHBondContact O-N 3.16Å
398	P	35.1	Very low	30.5	Very low	112 Å²	112	143.3 Å²	143.3	73%	0.727	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-27.4	-171.7	-24.3	35.7	0	0	0	116.7	R400	P398-R400 PolarHBondContact O-N 3.05Å
399	D	31.8	Very low	30.2	Very low	131 Å²	131	139 Å²	139	70%	0.701	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	23.7	-167	-65.4	-52.4	0	0	0	115.8	N397 P401	N397-D399 PolarHBondContact O-N 3.16Å; D399-P401 VanDerWaalsContact O-CD 3.32Å; D399-P401 WeakPolarHBondContact O-CD 3.26Å
400	R	38.3	Very low	30.3	Very low	180 Å²	180	141.1 Å²	141.1	68%	0.679	80%	0.796	S	S	*	*			trans	-83	116.7	175.5	-165.4	-177.2	-162.5	-175.7	10.2	110	P398 S402	P398-R400 PolarHBondContact O-N 3.05Å; R400-S402 PolarHBondContact O-N 3.45Å
401	P	32.9	Very low	30.3	Very low	123 Å²	123	146.3 Å²	146.3	80%	0.799	80%	0.798	S	S	*	*			trans	-70.7	98.9	177.8	28	-33.9	0	0	0	110.9	D399 N403	D399-P401 VanDerWaalsContact O-CD 3.32Å; D399-P401 WeakPolarHBondContact O-CD 3.26Å; P401-N403 PolarHBondContact O-N 3.49Å
402	S	36	Very low	30.2	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	80%	0.8	S	S	*	*			trans	-89.3	89.3	168.9	57.3	0	0	0	0	110.2	R400	R400-S402 PolarHBondContact O-N 3.45Å
403	N	28.4	Very low	30.3	Very low	154 Å²	154	147.6 Å²	147.6	82%	0.824	81%	0.805	S	S	*	*			trans	-171.8	114.6	157.3	-100.2	-17.4	0	0	0	111	P401	P401-N403 PolarHBondContact O-N 3.49Å
404	L	29.6	Very low	30.2	Very low	158 Å²	158	149.6 Å²	149.6	83%	0.827	80%	0.804	S	S	*	*			trans	-169.2	98.4	148.6	-109.9	169.6	0	0	0	107.5
405	N	26.5	Very low	30.4	Very low	159 Å²	159	152.1 Å²	152.1	85%	0.85	81%	0.81	S	S	*	*			trans	-74	124.7	168.5	-75.3	-5.6	0	0	0	108.3
406	L	27.9	Very low	30.2	Very low	162 Å²	162	150.2 Å²	150.2	85%	0.848	80%	0.804	S	S	*	*			trans	-110.3	127.3	159.7	-110.9	73	0	0	0	108.2
407	G	24.7	Very low	30.1	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	80%	0.804	S	S	*	*			trans	-117.4	148.7	165.2	0	0	0	0	0	109.8
408	H	27.2	Very low	30	Very low	204 Å²	204	148.4 Å²	148.4	94%	0.944	82%	0.815	S	S	*	*			trans	64.2	96.2	164.9	-103.6	45.3	0	0	0	118.3
409	A	24	Very low	29.9	Very low	99 Å²	99	152.3 Å²	152.3	82%	0.818	82%	0.823	S	S	*	*			trans	-159.9	160.8	133.6	0	0	0	0	0	107.8
410	P	31.1	Very low	30	Very low	123 Å²	123	155.5 Å²	155.5	80%	0.799	83%	0.825	S	S	*	*				-104.5	170.3	-124.6	38.2	-34.8	0	0	0	115.6
411	E	29.4	Very low	29.7	Very low	190 Å²	190	154.7 Å²	154.7	89%	0.888	83%	0.827	S	S	*	*			trans	-65.4	135.7	176.5	-64.2	159.5	124.7	0	0	112.4
412	L	27.7	Very low	29.6	Very low	171 Å²	171	160.7 Å²	160.7	90%	0.895	83%	0.834	S	S	*	*			trans	-139.1	144	151.9	-80.8	179	0	0	0	108.2
413	E	32.3	Very low	29.8	Very low	186 Å²	186	161.3 Å²	161.3	87%	0.869	83%	0.828	S	S	*	*			trans	-78.2	136.3	-158.8	-56.2	154.4	148.8	0	0	113.6
414	Q	25.5	Very low	30.5	Very low	193 Å²	193	159.4 Å²	159.4	90%	0.902	82%	0.822	S	S	*	*			trans	-168.1	158	133.9	-108.9	162	12.8	0	0	112.5
415	D	32.6	Very low	31.3	Very low	147 Å²	147	162 Å²	162	79%	0.786	83%	0.826	S	S	*	*			trans	-61.8	143.8	-174.1	-64.9	-75.1	0	0	0	114.6
416	D	27.8	Very low	33	Very low	158 Å²	158	156.8 Å²	156.8	85%	0.845	80%	0.798	S	S	*	*			trans	-173	66.7	139.4	-106.3	-21.6	0	0	0	110.8	L418	D416-L418 PolarHBondContact O-N 2.89Å
417	T	30.5	Very low	34.8	Very low	135 Å²	135	151.5 Å²	151.5	83%	0.828	78%	0.775	S	S	*	*			trans	-88.9	74	173	54	0	0	0	0	111.8
418	L	31.5	Very low	36.5	Very low	156 Å²	156	154.3 Å²	154.3	82%	0.817	77%	0.773	S	S	*	*			trans	-128.4	88.8	162.7	-76.5	177.9	0	0	0	110.2	D416 R420	D416-L418 PolarHBondContact O-N 2.89Å; L418-R420 VanDerWaalsContact C-N 3.29Å; L418-R420 PolarHBondContact O-N 2.84Å
419	E	32.1	Very low	38.6	Very low	194 Å²	194	148.6 Å²	148.6	91%	0.907	75%	0.754	S	S	*	*			trans	-67.2	88.7	165	-66.9	-164.8	140.2	0	0	109.1	K421	E419-K421 VanDerWaalsContact C-N 3.34Å; E419-K421 PolarHBondContact O-N 3.23Å
420	R	33.3	Very low	40.8	Very low	199 Å²	199	148.5 Å²	148.5	75%	0.751	74%	0.737	S	S	*	*			trans	-57.8	97.9	167.3	-81.3	-169.1	174.2	-161.2	-1	107.8	L418 R422 E465	L418-R420 VanDerWaalsContact C-N 3.29Å; L418-R420 PolarHBondContact O-N 2.84Å; R420-R422 PolarHBondContact O-N 3.21Å; R420-E465 IonicContact CZ-OE1 3.82Å; R420-E465 IonicContact NH1-OE1 3.98Å; R420-E465 PolarHBondContact NH1-OE1 2.89Å; R420-E465 VanDerWaalsContact NH1-OE1 3.11Å; R420-E465 IonicContact NH1-OE2 3.15Å; R420-E465 IonicContact NH2-OE1 3.42Å; R420-E465 PolarHBondContact NH2-OE1 2.66Å
421	K	32.5	Very low	42.8	Very low	162 Å²	162	147.8 Å²	147.8	70%	0.704	72%	0.721	S	S	*	*			trans	-44.4	136.7	166.6	-76.2	178.2	-179.7	170.4	0	107.7	E419 L423	E419-K421 VanDerWaalsContact C-N 3.34Å; E419-K421 PolarHBondContact O-N 3.23Å; K421-L423 VanDerWaalsContact C-N 3.28Å; K421-L423 PolarHBondContact O-N 3.18Å
422	R	31.9	Very low	44.8	Very low	250 Å²	250	146.2 Å²	146.2	94%	0.943	71%	0.707	S	S	*	*			trans	-72	87	174.2	-87.1	-176.1	163.1	-161.4	-6.3	109.5	R420 T424	R420-R422 PolarHBondContact O-N 3.21Å; R422-T424 PolarHBondContact O-N 3.27Å
423	L	39.5	Very low	47.2	Very low	117 Å²	117	143.5 Å²	143.5	61%	0.613	69%	0.69	S	S	*	*			trans	-55.9	129.7	168.9	-61.7	172.5	0	0	0	109.3	K421 K425	K421-L423 VanDerWaalsContact C-N 3.28Å; K421-L423 PolarHBondContact O-N 3.18Å; L423-K425 PolarHBondContact O-N 3.19Å
424	T	42.6	Very low	49.2	Very low	114 Å²	114	136.2 Å²	136.2	70%	0.699	66%	0.656	S	S	*	*			trans	-67.2	115.9	170.7	39.7	0	0	0	0	108.6	R422 I426	R422-T424 PolarHBondContact O-N 3.27Å; T424-I426 PolarHBondContact O-N 3.11Å
425	K	46.3	Very low	51.4	Low	211 Å²	211	134.1 Å²	134.1	92%	0.917	64%	0.644	S	S	*	*			trans	-65.7	101.9	177.2	-78.6	-156.8	168.7	-149.5	0	110.4	L423	L423-K425 PolarHBondContact O-N 3.19Å
426	I	62.1	Low	53.6	Low	51 Å²	51	131.6 Å²	131.6	26%	0.262	63%	0.628	S	S	.	*			trans	-53.4	137.3	162.9	-57.6	170.3	0	0	0	108.2	T424 E430 K431 I434 P449	T424-I426 PolarHBondContact O-N 3.11Å; I426-E430 HydrophobicContact CG2-CB 3.5Å; I426-E430 VanDerWaalsContact CG2-CB 3.5Å; I426-K431 HydrophobicContact CG2-CB 4.22Å; I426-I434 HydrophobicContact CG2-CD1 4.47Å; I426-P449 HydrophobicContact CD1-CB 4.35Å; I426-P449 HydrophobicContact CD1-CG 4.11Å
427	S	65.8	Low	55.9	Low	51 Å²	51	127.6 Å²	127.6	36%	0.357	61%	0.605	S	S	.	*			trans	-77.2	156.6	178.8	70	0	0	0	0	112	P429 E430 K431	S427-P429 VanDerWaalsContact C-CD 3.48Å; S427-P429 VanDerWaalsContact C-N 3.35Å; S427-E430 VanDerWaalsContact CB-OE2 3.26Å; S427-E430 WeakPolarHBondContact CB-OE2 3.47Å; S427-E430 PolarHBondContact N-OE2 2.76Å; S427-E430 PolarHBondContact O-N 2.75Å; S427-E430 VanDerWaalsContact O-N 3.08Å; S427-E430 WeakPolarHBondContact OG-CG 3.5Å; S427-E430 PolarHBondContact OG-OE2 3.04Å; S427-K431 WeakPolarHBondContact O-CB 3.2Å; S427-K431 PolarHBondContact O-N 3.48Å
428	D	60.1	Low	57.9	Low	130 Å²	130	125 Å²	125	70%	0.695	59%	0.585	S	S	*	*	H	α-helix	trans	-56.5	-37.8	-177.4	-58	-52.8	0	0	0	114.3	W432	D428-W432 WeakPolarHBondContact O-CB 3.47Å; D428-W432 PolarHBondContact O-N 3.3Å
429	P	71.9	Confident	59.9	Low	83 Å²	83	121.3 Å²	121.3	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-61.6	-46.1	171.9	-24	35.4	0	0	0	113.1	S427 W432 E433	S427-P429 VanDerWaalsContact C-CD 3.48Å; S427-P429 VanDerWaalsContact C-N 3.35Å; P429-W432 WeakPolarHBondContact O-CB 3.3Å; P429-W432 PolarHBondContact O-N 2.68Å; P429-W432 VanDerWaalsContact O-N 3.13Å; P429-E433 WeakPolarHBondContact O-CG 3.4Å; P429-E433 PolarHBondContact O-N 3.37Å
430	E	70.1	Confident	62.3	Low	97 Å²	97	115.2 Å²	115.2	45%	0.453	56%	0.56	S	S	.	*	H	α-helix	trans	-65.7	-41.9	179.2	-65.2	162.5	138.7	0	0	111	I426 S427 W432 E433 I434	I426-E430 HydrophobicContact CG2-CB 3.5Å; I426-E430 VanDerWaalsContact CG2-CB 3.5Å; S427-E430 VanDerWaalsContact CB-OE2 3.26Å; S427-E430 WeakPolarHBondContact CB-OE2 3.47Å; S427-E430 PolarHBondContact N-OE2 2.76Å; S427-E430 PolarHBondContact O-N 2.75Å; S427-E430 VanDerWaalsContact O-N 3.08Å; S427-E430 WeakPolarHBondContact OG-CG 3.5Å; S427-E430 PolarHBondContact OG-OE2 3.04Å; E430-W432 PolarHBondContact O-N 2.82Å; E430-E433 PolarHBondContact O-N 3.16Å; E430-I434 WeakPolarHBondContact O-CB 3.44Å; E430-I434 WeakPolarHBondContact O-CD1 3.32Å; E430-I434 VanDerWaalsContact O-CG1 3.27Å; E430-I434 WeakPolarHBondContact O-CG1 3.37Å; E430-I434 PolarHBondContact O-N 3.33Å
431	K	73	Confident	64.4	Low	109 Å²	109	113 Å²	113	47%	0.474	56%	0.563	S	S	.	*	H	α-helix	trans	-60.3	-31.5	173.8	-165.9	179.2	179.8	-173.8	0	111.1	I426 S427 K435 D466	I426-K431 HydrophobicContact CG2-CB 4.22Å; S427-K431 WeakPolarHBondContact O-CB 3.2Å; S427-K431 PolarHBondContact O-N 3.48Å; K431-K435 WeakPolarHBondContact O-CB 3.42Å; K431-K435 PolarHBondContact O-N 3.35Å; K431-D466 IonicContact NZ-OD2 3.55Å; K431-D466 PolarHBondContact NZ-OD2 2.83Å
432	W	72.4	Confident	66.6	Low	157 Å²	157	110.1 Å²	110.1	60%	0.595	56%	0.559	S	S	*	*	H	α-helix	trans	-77.7	-45.8	174.1	-175.5	91.4	0	0	0	112.9	D428 P429 E430 K435 Q436	D428-W432 WeakPolarHBondContact O-CB 3.47Å; D428-W432 PolarHBondContact O-N 3.3Å; P429-W432 WeakPolarHBondContact O-CB 3.3Å; P429-W432 PolarHBondContact O-N 2.68Å; P429-W432 VanDerWaalsContact O-N 3.13Å; E430-W432 PolarHBondContact O-N 2.82Å; W432-K435 WeakPolarHBondContact O-CB 3.22Å; W432-K435 PolarHBondContact O-N 2.82Å; W432-K435 VanDerWaalsContact O-N 3.15Å; W432-Q436 HydrophobicContact CD2-CG 4.07Å; W432-Q436 HydrophobicContact CE3-CG 4Å; W432-Q436 HydrophobicContact CH2-CG 3.75Å; W432-Q436 HydrophobicContact CZ2-CG 3.81Å; W432-Q436 HydrophobicContact CZ3-CG 3.85Å; W432-Q436 PolarHBondContact O-N 2.83Å
433	E	77.6	Confident	68.5	Low	113 Å²	113	100.1 Å²	100.1	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-44.3	179.3	-73	-175.8	165.2	0	0	111.9	P429 E430 K435 Q436 M437	P429-E433 WeakPolarHBondContact O-CG 3.4Å; P429-E433 PolarHBondContact O-N 3.37Å; E430-E433 PolarHBondContact O-N 3.16Å; E433-K435 VanDerWaalsContact C-N 3.27Å; E433-K435 PolarHBondContact O-N 3.44Å; E433-Q436 PolarHBondContact O-N 3.47Å; E433-Q436 VanDerWaalsContact O-N 3.12Å; E433-M437 PolarHBondContact O-N 2.77Å
434	I	74.4	Confident	69.9	Low	33 Å²	33	97 Å²	97	17%	0.169	51%	0.511	C	S	.	.	H	α-helix	trans	-57.6	-42.3	172.5	-69.5	165.6	0	0	0	110.4	I426 E430 Q436 M437 I438 L443 F448	I426-I434 HydrophobicContact CG2-CD1 4.47Å; E430-I434 WeakPolarHBondContact O-CB 3.44Å; E430-I434 WeakPolarHBondContact O-CD1 3.32Å; E430-I434 VanDerWaalsContact O-CG1 3.27Å; E430-I434 WeakPolarHBondContact O-CG1 3.37Å; E430-I434 PolarHBondContact O-N 3.33Å; I434-Q436 VanDerWaalsContact C-N 3.33Å; I434-Q436 PolarHBondContact O-N 2.91Å; I434-M437 HydrophobicContact CG1-CE 4.4Å; I434-M437 PolarHBondContact O-N 3.11Å; I434-I438 HydrophobicContact CG2-CD1 3.83Å; I434-I438 HydrophobicContact CG2-CG1 4.5Å; I434-I438 VanDerWaalsContact O-CG1 3.31Å; I434-I438 WeakPolarHBondContact O-CG1 3.44Å; I434-I438 PolarHBondContact O-N 2.8Å; I434-L443 HydrophobicContact CG2-CD2 4.22Å; I434-F448 HydrophobicContact CG2-CE2 4.35Å
435	K	72.2	Confident	70.6	Confident	150 Å²	150	100.3 Å²	100.3	65%	0.652	52%	0.516	S	S	*	.	H	α-helix	trans	-66.9	-31.4	178	-163.8	165.4	-172.5	166.6	0	112.7	K431 W432 E433 A439	K431-K435 WeakPolarHBondContact O-CB 3.42Å; K431-K435 PolarHBondContact O-N 3.35Å; W432-K435 WeakPolarHBondContact O-CB 3.22Å; W432-K435 PolarHBondContact O-N 2.82Å; W432-K435 VanDerWaalsContact O-N 3.15Å; E433-K435 VanDerWaalsContact C-N 3.27Å; E433-K435 PolarHBondContact O-N 3.44Å; K435-A439 WeakPolarHBondContact O-CB 3.49Å; K435-A439 PolarHBondContact O-N 3.08Å; K435-A439 VanDerWaalsContact O-N 3.09Å
436	Q	77.4	Confident	71.2	Confident	93 Å²	93	97.3 Å²	97.3	44%	0.435	51%	0.505	S	S	.	.	H	α-helix	trans	-71.2	-42.5	169.9	-65.9	-57.4	-46.9	0	0	112.2	W432 E433 I434 I438 A439 A440	W432-Q436 HydrophobicContact CD2-CG 4.07Å; W432-Q436 HydrophobicContact CE3-CG 4Å; W432-Q436 HydrophobicContact CH2-CG 3.75Å; W432-Q436 HydrophobicContact CZ2-CG 3.81Å; W432-Q436 HydrophobicContact CZ3-CG 3.85Å; W432-Q436 PolarHBondContact O-N 2.83Å; E433-Q436 PolarHBondContact O-N 3.47Å; E433-Q436 VanDerWaalsContact O-N 3.12Å; I434-Q436 VanDerWaalsContact C-N 3.33Å; I434-Q436 PolarHBondContact O-N 2.91Å; Q436-I438 VanDerWaalsContact C-N 3.32Å; Q436-I438 PolarHBondContact O-N 3.03Å; Q436-A439 PolarHBondContact O-N 2.97Å; Q436-A440 WeakPolarHBondContact O-CB 3.16Å; Q436-A440 PolarHBondContact O-N 3.03Å
437	M	77.6	Confident	71.3	Confident	75 Å²	75	100.5 Å²	100.5	37%	0.369	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-35.8	177.3	-69.5	-166	-70.3	0	0	112.4	E433 I434 A440 N441 V442 L443	E433-M437 PolarHBondContact O-N 2.77Å; I434-M437 HydrophobicContact CG1-CE 4.4Å; I434-M437 PolarHBondContact O-N 3.11Å; M437-A440 PolarHBondContact O-N 3.2Å; M437-N441 PolarHBondContact O-N 3.47Å; M437-V442 HydrophobicContact CB-CB 4.32Å; M437-V442 PolarHBondContact O-N 3Å; M437-L443 HydrophobicContact CB-CB 4.23Å; M437-L443 HydrophobicContact CE-CD1 4.41Å; M437-L443 PolarHBondContact O-N 3.17Å
438	I	71.6	Confident	71.3	Confident	80 Å²	80	101.2 Å²	101.2	41%	0.41	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-45.7	170.6	-67.9	165.7	0	0	0	110.8	I434 Q436 A440 N441 L443	I434-I438 HydrophobicContact CG2-CD1 3.83Å; I434-I438 HydrophobicContact CG2-CG1 4.5Å; I434-I438 VanDerWaalsContact O-CG1 3.31Å; I434-I438 WeakPolarHBondContact O-CG1 3.44Å; I434-I438 PolarHBondContact O-N 2.8Å; Q436-I438 VanDerWaalsContact C-N 3.32Å; Q436-I438 PolarHBondContact O-N 3.03Å; I438-A440 PolarHBondContact O-N 3.33Å; I438-N441 PolarHBondContact O-N 2.95Å; I438-L443 HydrophobicContact CG1-CB 4.35Å
439	A	73.5	Confident	71.4	Confident	79 Å²	79	98.9 Å²	98.9	65%	0.653	51%	0.508	S	S	*	.	H	α-helix	trans	-62.6	-25	177.3	0	0	0	0	0	113.4	K435 Q436	K435-A439 WeakPolarHBondContact O-CB 3.49Å; K435-A439 PolarHBondContact O-N 3.08Å; K435-A439 VanDerWaalsContact O-N 3.09Å; Q436-A439 PolarHBondContact O-N 2.97Å
440	A	81.6	Confident	70.7	Confident	65 Å²	65	98.2 Å²	98.2	54%	0.537	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.7	173.9	0	0	0	0	0	114.3	Q436 M437 I438 V442	Q436-A440 WeakPolarHBondContact O-CB 3.16Å; Q436-A440 PolarHBondContact O-N 3.03Å; M437-A440 PolarHBondContact O-N 3.2Å; I438-A440 PolarHBondContact O-N 3.33Å; A440-V442 HydrophobicContact CB-CG2 3.75Å; A440-V442 PolarHBondContact O-N 2.84Å
441	N	77.5	Confident	70	Confident	152 Å²	152	97.2 Å²	97.2	81%	0.813	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	30.3	-170	-77.2	-12.3	0	0	0	113.9	M437 I438	M437-N441 PolarHBondContact O-N 3.47Å; I438-N441 PolarHBondContact O-N 2.95Å
442	V	79.3	Confident	69.1	Low	102 Å²	102	94.9 Å²	94.9	62%	0.618	49%	0.487	S	S	*	.			trans	-85.3	-34	178.9	173.9	0	0	0	0	111.7	M437 A440	M437-V442 HydrophobicContact CB-CB 4.32Å; M437-V442 PolarHBondContact O-N 3Å; A440-V442 HydrophobicContact CB-CG2 3.75Å; A440-V442 PolarHBondContact O-N 2.84Å
443	L	72.4	Confident	68	Low	41 Å²	41	94.7 Å²	94.7	22%	0.215	50%	0.498	C	S	.	.	S	Bend	trans	-96.9	134.8	177.3	-150.2	80	0	0	0	110.7	I434 M437 I438 E447	I434-L443 HydrophobicContact CG2-CD2 4.22Å; M437-L443 HydrophobicContact CB-CB 4.23Å; M437-L443 HydrophobicContact CE-CD1 4.41Å; M437-L443 PolarHBondContact O-N 3.17Å; I438-L443 HydrophobicContact CG1-CB 4.35Å; L443-E447 HydrophobicContact CD1-CB 4.2Å; L443-E447 HydrophobicContact CD2-CB 4.41Å; L443-E447 HydrophobicContact CG-CB 4Å
444	S	68.1	Low	66.9	Low	50 Å²	50	98.2 Å²	98.2	35%	0.35	51%	0.514	S	S	.	.			trans	-78.7	168.6	171	74	0	0	0	0	111.6	E446 E447	S444-E446 VanDerWaalsContact C-N 3.29Å; S444-E447 VanDerWaalsContact CB-OE2 3.23Å; S444-E447 WeakPolarHBondContact CB-OE2 3.2Å; S444-E447 PolarHBondContact N-OE2 3.21Å; S444-E447 VanDerWaalsContact OG-CD 3.27Å; S444-E447 WeakPolarHBondContact OG-CG 3.12Å; S444-E447 PolarHBondContact OG-OE2 2.92Å
445	K	57.1	Low	66.1	Low	185 Å²	185	100.9 Å²	100.9	80%	0.804	53%	0.532	S	S	*	.	S	Bend	trans	-74.6	-21.1	178.6	-68	-177.1	177.5	-179	0	113.6	F451	K445-F451 VanDerWaalsContact O-CD2 3.24Å; K445-F451 WeakPolarHBondContact O-CD2 3.43Å
446	E	59.8	Low	65.4	Low	147 Å²	147	96.1 Å²	96.1	69%	0.687	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-21.2	-178.4	-68.3	143.1	-132.6	0	0	111.5	S444 F448 F451	S444-E446 VanDerWaalsContact C-N 3.29Å; E446-F448 VanDerWaalsContact C-N 3.26Å; E446-F448 PolarHBondContact O-N 3.18Å; E446-F451 HydrophobicContact CG-CE1 4.34Å; E446-F451 HydrophobicContact CG-CZ 4.08Å
447	E	64.2	Low	64	Low	118 Å²	118	98.6 Å²	98.6	55%	0.551	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	12.9	178.2	-69.5	163.6	125.4	0	0	113.5	L443 S444	L443-E447 HydrophobicContact CD1-CB 4.2Å; L443-E447 HydrophobicContact CD2-CB 4.41Å; L443-E447 HydrophobicContact CG-CB 4Å; S444-E447 VanDerWaalsContact CB-OE2 3.23Å; S444-E447 WeakPolarHBondContact CB-OE2 3.2Å; S444-E447 PolarHBondContact N-OE2 3.21Å; S444-E447 VanDerWaalsContact OG-CD 3.27Å; S444-E447 WeakPolarHBondContact OG-CG 3.12Å; S444-E447 PolarHBondContact OG-OE2 2.92Å
448	F	66.3	Low	62.8	Low	66 Å²	66	100.2 Å²	100.2	29%	0.289	55%	0.55	S	S	.	.			trans	-81.8	131.9	179	-162.4	-106.4	0	0	0	111.1	I434 E446 D450 F451	I434-F448 HydrophobicContact CG2-CE2 4.35Å; E446-F448 VanDerWaalsContact C-N 3.26Å; E446-F448 PolarHBondContact O-N 3.18Å; F448-D450 HydrophobicContact CD1-CB 3.9Å; F448-D450 HydrophobicContact CE1-CB 3.78Å; F448-D450 WeakPolarHBondContact CE1-OD2 3.38Å; F448-D450 PolarHBondContact O-N 2.89Å; F448-D450 VanDerWaalsContact O-N 3.09Å; F448-F451 HydrophobicContact CB-CB 4.31Å; F448-F451 VanDerWaalsContact O-CB 3.23Å; F448-F451 WeakPolarHBondContact O-CB 3.37Å; F448-F451 PolarHBondContact O-N 3.33Å
449	P	61.4	Low	61.4	Low	81 Å²	81	101.9 Å²	101.9	53%	0.526	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.8	-25.6	-177.3	-28.2	36.4	0	0	0	115.4	I426	I426-P449 HydrophobicContact CD1-CB 4.35Å; I426-P449 HydrophobicContact CD1-CG 4.11Å
450	D	56.7	Low	59.8	Low	70 Å²	70	106.5 Å²	106.5	37%	0.374	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.1	20.3	177.4	-44	-46.6	0	0	0	112.6	F448	F448-D450 HydrophobicContact CD1-CB 3.9Å; F448-D450 HydrophobicContact CE1-CB 3.78Å; F448-D450 WeakPolarHBondContact CE1-OD2 3.38Å; F448-D450 PolarHBondContact O-N 2.89Å; F448-D450 VanDerWaalsContact O-N 3.09Å
451	F	56.6	Low	57.8	Low	75 Å²	75	108 Å²	108	33%	0.329	57%	0.573	S	S	.	*			trans	-70.3	137.4	172.6	-170.2	-101.4	0	0	0	110.7	K445 E446 F448 D453	K445-F451 VanDerWaalsContact O-CD2 3.24Å; K445-F451 WeakPolarHBondContact O-CD2 3.43Å; E446-F451 HydrophobicContact CG-CE1 4.34Å; E446-F451 HydrophobicContact CG-CZ 4.08Å; F448-F451 HydrophobicContact CB-CB 4.31Å; F448-F451 VanDerWaalsContact O-CB 3.23Å; F448-F451 WeakPolarHBondContact O-CB 3.37Å; F448-F451 PolarHBondContact O-N 3.33Å; F451-D453 WeakPolarHBondContact CE1-OD1 3.43Å
452	D	53.6	Low	55.9	Low	61 Å²	61	105.3 Å²	105.3	33%	0.326	56%	0.559	S	S	.	*			trans	-127.5	106.5	-176.3	-177.4	74.1	0	0	0	109.6	E454 T455 G456	D452-E454 PolarHBondContact O-N 3.14Å; D452-E454 VanDerWaalsContact O-N 3.07Å; D452-T455 PolarHBondContact O-N 3.01Å; D452-T455 WeakPolarHBondContact OD2-CB 3.46Å; D452-T455 WeakPolarHBondContact OD2-CG2 3.49Å; D452-T455 PolarHBondContact OD2-N 2.88Å; D452-T455 PolarHBondContact OD2-OG1 3.33Å; D452-G456 PolarHBondContact O-N 2.68Å; D452-G456 VanDerWaalsContact O-N 3.09Å
453	D	49.6	Very low	54.1	Low	153 Å²	153	105.9 Å²	105.9	82%	0.818	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-25.7	-171.6	-71.1	-35.3	0	0	0	114	F451	F451-D453 WeakPolarHBondContact CE1-OD1 3.43Å
454	E	53.6	Low	52.7	Low	187 Å²	187	109.6 Å²	109.6	87%	0.874	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-23.6	-175.3	-164.5	166.8	-132.6	0	0	113.1	D452	D452-E454 PolarHBondContact O-N 3.14Å; D452-E454 VanDerWaalsContact O-N 3.07Å
455	T	58.4	Low	51.5	Low	89 Å²	89	113.2 Å²	113.2	55%	0.546	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.9	-29.8	-176.9	56.5	0	0	0	0	114.6	D452 I457	D452-T455 PolarHBondContact O-N 3.01Å; D452-T455 WeakPolarHBondContact OD2-CB 3.46Å; D452-T455 WeakPolarHBondContact OD2-CG2 3.49Å; D452-T455 PolarHBondContact OD2-N 2.88Å; D452-T455 PolarHBondContact OD2-OG1 3.33Å; T455-I457 PolarHBondContact O-N 3.22Å
456	G	57.4	Low	50.9	Low	49 Å²	49	110.5 Å²	110.5	51%	0.505	58%	0.581	S	S	.	*			trans	63.7	-6.9	167.9	0	0	0	0	0	117.9	D452	D452-G456 PolarHBondContact O-N 2.68Å; D452-G456 VanDerWaalsContact O-N 3.09Å
457	I	48.2	Very low	50.4	Low	145 Å²	145	108.8 Å²	108.8	74%	0.744	57%	0.573	S	S	*	*	S	Bend	trans	-138.2	127.3	173.9	-59.3	-179.9	0	0	0	107.2	T455	T455-I457 PolarHBondContact O-N 3.22Å
458	L	51.7	Low	50	Low	110 Å²	110	108.9 Å²	108.9	58%	0.576	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-50.5	140.2	-176	-83	77.5	0	0	0	112.6	K460 V461	L458-K460 PolarHBondContact O-N 2.8Å; L458-V461 HydrophobicContact CD2-CG2 4.23Å
459	P	43.2	Very low	49.9	Very low	114 Å²	114	108 Å²	108	74%	0.74	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-57.7	130.4	147.8	29.4	-31.7	0	0	0	106.4	V461	P459-V461 PolarHBondContact O-N 3.32Å; P459-V461 VanDerWaalsContact O-N 3.09Å
460	K	38.6	Very low	50.1	Low	176 Å²	176	105.2 Å²	105.2	77%	0.765	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-46.7	126.3	-178.5	-76.7	-178.4	173.1	-174.5	0	109.6	L458 D462	L458-K460 PolarHBondContact O-N 2.8Å; K460-D462 PolarHBondContact O-N 2.89Å
461	V	39.5	Very low	50.9	Low	97 Å²	97	103 Å²	103	59%	0.588	54%	0.543	S	S	*	.			trans	-64.7	102	154.2	-178.2	0	0	0	0	104.2	L458 P459 D463	L458-V461 HydrophobicContact CD2-CG2 4.23Å; P459-V461 PolarHBondContact O-N 3.32Å; P459-V461 VanDerWaalsContact O-N 3.09Å; V461-D463 PolarHBondContact O-N 3.28Å
462	D	38.1	Very low	51.6	Low	96 Å²	96	102.4 Å²	102.4	51%	0.513	54%	0.541	S	S	.	.			trans	-68.3	91.7	163	-69.9	-28.9	0	0	0	105.2	K460 E464 E465	K460-D462 PolarHBondContact O-N 2.89Å; D462-E464 HydrophobicContact CB-CB 4.37Å; D462-E464 PolarHBondContact O-N 2.89Å; D462-E465 PolarHBondContact O-N 2.93Å
463	D	42.2	Very low	52.6	Low	113 Å²	113	102.8 Å²	102.8	60%	0.604	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-52.6	-18.3	172.1	-72.1	-53	0	0	0	110.5	V461 E465 D466 E467	V461-D463 PolarHBondContact O-N 3.28Å; D463-E465 PolarHBondContact O-N 3.26Å; D463-D466 CarbonylContact O-C 3.45Å; D463-D466 PolarHBondContact O-N 2.85Å; D463-E467 PolarHBondContact O-N 3.03Å
464	E	42.8	Very low	53.7	Low	120 Å²	120	97.7 Å²	97.7	56%	0.561	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-53.5	-20.8	167	-55.6	-171.6	-173.4	0	0	116	D462 R1203	D462-E464 HydrophobicContact CB-CB 4.37Å; D462-E464 PolarHBondContact O-N 2.89Å; E464-R1203 PolarHBondContact O-NH2 3.15Å
465	E	43.5	Very low	54.1	Low	126 Å²	126	95.8 Å²	95.8	59%	0.589	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-77.2	-20.5	169.8	-81.6	-163.9	-160.9	0	0	112.7	R420 D462 D463	R420-E465 IonicContact CZ-OE1 3.82Å; R420-E465 IonicContact NH1-OE1 3.98Å; R420-E465 PolarHBondContact NH1-OE1 2.89Å; R420-E465 VanDerWaalsContact NH1-OE1 3.11Å; R420-E465 IonicContact NH1-OE2 3.15Å; R420-E465 IonicContact NH2-OE1 3.42Å; R420-E465 PolarHBondContact NH2-OE1 2.66Å; D462-E465 PolarHBondContact O-N 2.93Å; D463-E465 PolarHBondContact O-N 3.26Å
466	D	43.9	Very low	54.3	Low	128 Å²	128	99 Å²	99	68%	0.684	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-6.5	175.2	-87.1	-17	0	0	0	113	K431 D463	K431-D466 IonicContact NZ-OD2 3.55Å; K431-D466 PolarHBondContact NZ-OD2 2.83Å; D463-D466 CarbonylContact O-C 3.45Å; D463-D466 PolarHBondContact O-N 2.85Å
467	E	49.6	Very low	54.6	Low	111 Å²	111	99 Å²	99	52%	0.519	50%	0.504	S	S	.	.	S	Bend	trans	-68.9	129.8	175.8	-79.5	-161.1	162.7	0	0	113.1	D463 L469	D463-E467 PolarHBondContact O-N 3.03Å; E467-L469 VanDerWaalsContact C-N 3.33Å; E467-L469 PolarHBondContact O-N 2.86Å
468	D	56.2	Low	55.5	Low	120 Å²	120	92.7 Å²	92.7	64%	0.642	47%	0.472	S	S	*	.			trans	-60.5	85.1	171.1	-106.3	-42.4	0	0	0	111.2	E470 K1149	D468-E470 VanDerWaalsContact C-N 3.28Å; D468-E470 PolarHBondContact O-N 2.72Å; D468-K1149 IonicContact OD1-NZ 2.88Å
469	L	62.3	Low	56.4	Low	46 Å²	46	90.3 Å²	90.3	24%	0.241	46%	0.463	C	S	.	.			trans	-64.5	80.9	178.4	-92.4	156.9	0	0	0	112	E467 W1180 P1202 R1203 V1215	E467-L469 VanDerWaalsContact C-N 3.33Å; E467-L469 PolarHBondContact O-N 2.86Å; L469-W1180 WeakPolarHBondContact O-CZ2 3.18Å; L469-P1202 HydrophobicContact CB-CG 4.18Å; L469-R1203 HydrophobicContact CD1-CG 3.79Å; L469-R1203 VanDerWaalsContact CD1-NE 3.31Å; L469-V1215 HydrophobicContact CD2-CG1 3.92Å
470	E	66	Low	57.8	Low	24 Å²	24	87.3 Å²	87.3	11%	0.112	44%	0.439	C	S	.	.			trans	-72.2	127.7	173.7	176.3	178.2	-150.9	0	0	110.1	D468 S1216 S1222 K1225	D468-E470 VanDerWaalsContact C-N 3.28Å; D468-E470 PolarHBondContact O-N 2.72Å; E470-S1216 WeakPolarHBondContact CB-OG 3.19Å; E470-S1216 WeakPolarHBondContact O-CB 3.34Å; E470-S1216 PolarHBondContact O-N 3.09Å; E470-S1216 PolarHBondContact O-OG 2.86Å; E470-S1222 VanDerWaalsContact OE1-CB 3.24Å; E470-S1222 WeakPolarHBondContact OE1-CB 3.44Å; E470-S1222 PolarHBondContact OE1-OG 3.39Å; E470-K1225 VanDerWaalsContact OE2-CD 3.29Å; E470-K1225 WeakPolarHBondContact OE2-CD 3.35Å; E470-K1225 WeakPolarHBondContact OE2-CE 3.38Å; E470-K1225 IonicContact OE2-NZ 2.7Å; E470-K1225 PolarHBondContact OE2-NZ 3.17Å
471	I	73.7	Confident	59.2	Low	23 Å²	23	79.4 Å²	79.4	12%	0.118	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.9	178.9	-54.9	-180	0	0	0	108	W1180 P1202 L1205 V1206 F1213 K1214	I471-W1180 HydrophobicContact CB-CH2 4.25Å; I471-W1180 HydrophobicContact CD1-CH2 3.92Å; I471-W1180 HydrophobicContact CD1-CZ3 3.94Å; I471-W1180 HydrophobicContact CG1-CH2 3.93Å; I471-W1180 HydrophobicContact CG1-CZ3 4.42Å; I471-P1202 HydrophobicContact CD1-CB 3.74Å; I471-P1202 WeakPolarHBondContact CD1-O 3.47Å; I471-P1202 HydrophobicContact CG1-CB 4.37Å; I471-L1205 HydrophobicContact CD1-CB 3.96Å; I471-L1205 HydrophobicContact CD1-CD1 3.78Å; I471-L1205 HydrophobicContact CD1-CG 4.49Å; I471-V1206 HydrophobicContact CD1-CG2 4.25Å; I471-V1206 HydrophobicContact CG1-CG2 4.39Å; I471-V1206 HydrophobicContact CG2-CG2 4.34Å; I471-F1213 HydrophobicContact CG2-CB 3.61Å; I471-F1213 HydrophobicContact CG2-CD1 3.5Å; I471-F1213 HydrophobicContact CG2-CE1 4.42Å; I471-F1213 HydrophobicContact CG2-CG 3.82Å; I471-K1214 CarbonylContact C-O 3.57Å; I471-K1214 WeakPolarHBondContact CA-O 3.43Å
472	E	71.1	Confident	60.5	Low	62 Å²	62	82.5 Å²	82.5	29%	0.29	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	149.9	170	-68	-171	130.6	0	0	110.9	K1214 S1222	E472-K1214 PolarHBondContact N-O 3.24Å; E472-K1214 PolarHBondContact O-N 2.97Å; E472-S1222 WeakPolarHBondContact OE1-CA 3.36Å; E472-S1222 WeakPolarHBondContact OE1-CB 3.06Å
473	L	75.6	Confident	61.5	Low	69 Å²	69	79.9 Å²	79.9	36%	0.361	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	143.3	169.1	-66.1	168.9	0	0	0	110.6	E475 I1160 F1212 F1213	L473-E475 PolarHBondContact O-N 2.67Å; L473-I1160 HydrophobicContact CD2-CG1 4.48Å; L473-F1212 WeakPolarHBondContact CA-O 3.45Å; L473-F1212 HydrophobicContact CD2-CD1 4.14Å; L473-F1212 HydrophobicContact CD2-CE1 3.55Å; L473-F1212 HydrophobicContact CD2-CZ 3.92Å; L473-F1213 HydrophobicContact CD2-CD1 3.99Å; L473-F1213 HydrophobicContact CD2-CE1 3.59Å
474	V	73.3	Confident	62.5	Low	46 Å²	46	79.6 Å²	79.6	28%	0.279	40%	0.396	S	S	.	.			trans	-84.4	108	172.4	179.6	0	0	0	0	109.3	E476 F1212 K1214	V474-E476 HydrophobicContact CG1-CB 4.05Å; V474-E476 HydrophobicContact CG1-CG 4.04Å; V474-E476 PolarHBondContact O-N 3.32Å; V474-E476 VanDerWaalsContact O-N 3.12Å; V474-F1212 PolarHBondContact N-O 2.98Å; V474-K1214 HydrophobicContact CG2-CB 4.07Å
475	E	61	Low	63.1	Low	147 Å²	147	75.3 Å²	75.3	69%	0.687	38%	0.378	S	S	*	.			trans	-77	17.6	-177.9	-61.7	-179.8	162.8	0	0	114.5	L473 K1223	L473-E475 PolarHBondContact O-N 2.67Å; E475-K1223 IonicContact OE1-NZ 2.72Å; E475-K1223 PolarHBondContact OE1-NZ 3.39Å; E475-K1223 IonicContact OE2-NZ 3.85Å; E475-K1223 PolarHBondContact OE2-NZ 2.87Å
476	E	63.6	Low	63.5	Low	158 Å²	158	76.1 Å²	76.1	74%	0.738	38%	0.38	S	S	*	.			trans	-87.9	113.4	-174.7	-63.7	-161.6	168	0	0	112.9	V474	V474-E476 HydrophobicContact CG1-CB 4.05Å; V474-E476 HydrophobicContact CG1-CG 4.04Å; V474-E476 PolarHBondContact O-N 3.32Å; V474-E476 VanDerWaalsContact O-N 3.12Å
477	E	62.5	Low	63.8	Low	48 Å²	48	76.8 Å²	76.8	22%	0.224	38%	0.379	C	S	.	.			trans	-60.8	132.3	176.5	-71.8	174.2	-145	0	0	112.2	R482 G483 K486	E477-R482 HydrophobicContact CB-CG 4.18Å; E477-R482 PolarHBondContact O-NE 3.14Å; E477-R482 WeakPolarHBondContact OE2-CA 3.3Å; E477-G483 PolarHBondContact OE2-N 3.06Å; E477-K486 WeakPolarHBondContact OE1-CE 3.35Å; E477-K486 IonicContact OE1-NZ 3.2Å; E477-K486 PolarHBondContact OE1-NZ 3.38Å
478	P	68.3	Low	63.8	Low	13 Å²	13	72.2 Å²	72.2	8%	0.084	36%	0.359	C	S	.	.			trans	-54.5	138.4	175.6	-26.3	34.9	0	0	0	112	F480 L481 R482 Y994	P478-F480 VanDerWaalsContact C-N 3.27Å; P478-F480 HydrophobicContact CB-CD1 4.14Å; P478-F480 HydrophobicContact CB-CE1 3.73Å; P478-F480 HydrophobicContact CB-CZ 4.2Å; P478-F480 PolarHBondContact O-N 3.32Å; P478-F480 VanDerWaalsContact O-N 3.1Å; P478-L481 HydrophobicContact CB-CD1 4.41Å; P478-L481 HydrophobicContact CG-CD1 4.22Å; P478-L481 PolarHBondContact O-N 3.26Å; P478-R482 PolarHBondContact O-N 2.97Å; P478-Y994 HydrophobicContact CB-CD1 3.84Å; P478-Y994 HydrophobicContact CB-CE1 3.66Å; P478-Y994 HydrophobicContact CB-CE2 4.49Å; P478-Y994 HydrophobicContact CB-CG 4.34Å; P478-Y994 HydrophobicContact CG-CD1 3.56Å; P478-Y994 HydrophobicContact CG-CE1 3.59Å; P478-Y994 HydrophobicContact CG-CG 4.38Å
479	P	69.6	Low	63.5	Low	60 Å²	60	72.6 Å²	72.6	39%	0.39	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-52.1	-40.8	-171.6	-30.1	36.5	0	0	0	114.8	L481 D1001	P479-L481 VanDerWaalsContact C-N 3.35Å; P479-L481 PolarHBondContact O-N 3.19Å; P479-D1001 HydrophobicContact CG-CB 4.3Å
480	F	72.4	Confident	62.8	Low	50 Å²	50	77.8 Å²	77.8	22%	0.219	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-77.1	-8.3	-179.8	68.1	-86.9	0	0	0	115.5	P478 M990 Y994 D1001	P478-F480 VanDerWaalsContact C-N 3.27Å; P478-F480 HydrophobicContact CB-CD1 4.14Å; P478-F480 HydrophobicContact CB-CE1 3.73Å; P478-F480 HydrophobicContact CB-CZ 4.2Å; P478-F480 PolarHBondContact O-N 3.32Å; P478-F480 VanDerWaalsContact O-N 3.1Å; F480-M990 HydrophobicContact CD2-CE 4.32Å; F480-M990 HydrophobicContact CE2-CB 4.45Å; F480-M990 HydrophobicContact CE2-CE 3.92Å; F480-Y994 AromaticContact CE1-CD2 3.62Å; F480-Y994 HydrophobicContact CE1-CD2 3.62Å; F480-Y994 HydrophobicContact CE1-CE2 4.08Å; F480-Y994 AromaticContact CE1-CG 3.94Å; F480-Y994 HydrophobicContact CE1-CG 3.94Å; F480-Y994 HydrophobicContact CZ-CD2 4.28Å; F480-Y994 HydrophobicContact CZ-CG 4.22Å; F480-D1001 WeakPolarHBondContact CD1-O 3.06Å
481	L	67.9	Low	62.3	Low	11 Å²	11	81.7 Å²	81.7	6%	0.058	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-106.7	-6.3	177.8	-68	177.4	0	0	0	113.8	P478 P479 G483 H484 I987 E991	P478-L481 HydrophobicContact CB-CD1 4.41Å; P478-L481 HydrophobicContact CG-CD1 4.22Å; P478-L481 PolarHBondContact O-N 3.26Å; P479-L481 VanDerWaalsContact C-N 3.35Å; P479-L481 PolarHBondContact O-N 3.19Å; L481-G483 PolarHBondContact O-N 3.24Å; L481-G483 VanDerWaalsContact O-N 3.11Å; L481-H484 PolarHBondContact O-N 3.34Å; L481-I987 HydrophobicContact CD1-CG2 4.24Å; L481-I987 HydrophobicContact CD2-CG2 4.31Å; L481-E991 HydrophobicContact CD1-CB 4.37Å
482	R	66.1	Low	61.3	Low	161 Å²	161	84.7 Å²	84.7	61%	0.608	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	116.6	-170.9	-74.6	179.8	175.4	-175.2	-2.5	112.6	E477 P478	E477-R482 HydrophobicContact CB-CG 4.18Å; E477-R482 PolarHBondContact O-NE 3.14Å; E477-R482 WeakPolarHBondContact OE2-CA 3.3Å; P478-R482 PolarHBondContact O-N 2.97Å
483	G	59.5	Low	60.8	Low	41 Å²	41	85.7 Å²	85.7	42%	0.423	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-19.4	179.5	0	0	0	0	0	116	E477 L481	E477-G483 PolarHBondContact OE2-N 3.06Å; L481-G483 PolarHBondContact O-N 3.24Å; L481-G483 VanDerWaalsContact O-N 3.11Å
484	H	64.2	Low	60.2	Low	107 Å²	107	85.1 Å²	85.1	50%	0.495	44%	0.44	S	S	.	.	H	α-helix	trans	-74.9	-41.5	173.1	-73.5	-73.5	0	0	0	111.6	L481 K486 Q487 S488 I987	L481-H484 PolarHBondContact O-N 3.34Å; H484-K486 PolarHBondContact O-N 3.25Å; H484-K486 VanDerWaalsContact O-N 3.12Å; H484-Q487 PolarHBondContact O-N 3.48Å; H484-S488 PolarHBondContact O-N 2.88Å; H484-S488 PolarHBondContact O-OG 3.47Å; H484-I987 HydrophobicContact CB-CD1 4.35Å
485	T	55.2	Low	59.8	Low	30 Å²	30	90.5 Å²	90.5	18%	0.184	46%	0.46	C	S	.	.	H	α-helix	trans	-57.7	-31.2	-175.9	-43	0	0	0	0	113.5	S488	T485-S488 VanDerWaalsContact C-OG 3.32Å; T485-S488 WeakPolarHBondContact CA-OG 3.03Å; T485-S488 PolarHBondContact O-OG 2.9Å
486	K	52.5	Low	60.2	Low	143 Å²	143	84.7 Å²	84.7	62%	0.622	43%	0.433	S	S	*	.	H	α-helix	trans	-76.4	-26.8	179.1	-70.3	175.9	178.2	145.2	0	113.3	E477 H484	E477-K486 WeakPolarHBondContact OE1-CE 3.35Å; E477-K486 IonicContact OE1-NZ 3.2Å; E477-K486 PolarHBondContact OE1-NZ 3.38Å; H484-K486 PolarHBondContact O-N 3.25Å; H484-K486 VanDerWaalsContact O-N 3.12Å
487	Q	48.3	Very low	60.7	Low	142 Å²	142	78.8 Å²	78.8	66%	0.664	41%	0.408	S	S	*	.	H	α-helix	trans	-79.8	-27.5	174.1	-65	-177.4	-9.9	0	0	112.2	H484	H484-Q487 PolarHBondContact O-N 3.48Å
488	S	51.5	Low	61.2	Low	15 Å²	15	80.8 Å²	80.8	11%	0.105	42%	0.416	C	S	.	.	H	α-helix	trans	-72	-26.3	174.8	39.1	0	0	0	0	114	H484 T485 D490 M491	H484-S488 PolarHBondContact O-N 2.88Å; H484-S488 PolarHBondContact O-OG 3.47Å; T485-S488 VanDerWaalsContact C-OG 3.32Å; T485-S488 WeakPolarHBondContact CA-OG 3.03Å; T485-S488 PolarHBondContact O-OG 2.9Å; S488-D490 VanDerWaalsContact C-N 3.31Å; S488-D490 PolarHBondContact O-N 2.84Å; S488-M491 PolarHBondContact O-N 3.02Å; S488-M491 VanDerWaalsContact O-N 3.16Å
489	M	49.9	Very low	61.6	Low	129 Å²	129	83.5 Å²	83.5	64%	0.635	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-37.4	-179.8	-80.7	-69.5	-179.2	0	0	113.4	M491 K900	M489-M491 VanDerWaalsContact C-N 3.31Å; M489-M491 PolarHBondContact O-N 3.26Å; M489-K900 PolarHBondContact O-NZ 3.49Å
490	D	47.7	Very low	61.6	Low	154 Å²	154	84.1 Å²	84.1	82%	0.824	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.4	179.8	-72.7	-26	0	0	0	113.8	S488	S488-D490 VanDerWaalsContact C-N 3.31Å; S488-D490 PolarHBondContact O-N 2.84Å
491	M	54.6	Low	61.8	Low	107 Å²	107	88 Å²	88	53%	0.527	46%	0.457	S	S	.	.	S	Bend	trans	-75.6	137.4	-179.9	-65.3	-64.3	-74.7	0	0	111.1	S488 M489 K900	S488-M491 PolarHBondContact O-N 3.02Å; S488-M491 VanDerWaalsContact O-N 3.16Å; M489-M491 VanDerWaalsContact C-N 3.31Å; M489-M491 PolarHBondContact O-N 3.26Å; M491-K900 PolarHBondContact O-NZ 2.53Å
492	S	53	Low	62.4	Low	86 Å²	86	88 Å²	88	60%	0.601	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-78.6	140.9	175	63.1	0	0	0	0	111.1
493	P	60.5	Low	63.2	Low	82 Å²	82	81.9 Å²	81.9	53%	0.532	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-60.3	157.4	175.7	27.1	-35.6	0	0	0	112.1	K495	P493-K495 PolarHBondContact O-N 2.94Å
494	V	63.6	Low	64.3	Low	57 Å²	57	80.4 Å²	80.4	35%	0.345	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-57.7	121.3	-175.7	-179.3	0	0	0	0	111	I496 P982	V494-I496 HydrophobicContact CG1-CG1 4.47Å; V494-I496 PolarHBondContact O-N 2.92Å; V494-P982 HydrophobicContact CG2-CB 4.35Å; V494-P982 HydrophobicContact CG2-CG 3.32Å
495	K	63.6	Low	65.1	Low	159 Å²	159	75.7 Å²	75.7	69%	0.691	40%	0.403	S	S	*	.			trans	-73.3	94	174.5	-66.8	-172.7	178.6	-174.6	0	110.2	P493 V497	P493-K495 PolarHBondContact O-N 2.94Å; K495-V497 PolarHBondContact O-N 2.97Å
496	I	69.1	Low	66.4	Low	25 Å²	25	80.1 Å²	80.1	13%	0.128	42%	0.421	C	S	.	.	S	Bend	trans	-71.6	-21	175.9	-64.2	171.4	0	0	0	111.6	V494 V896 T909 L945 R954	V494-I496 HydrophobicContact CG1-CG1 4.47Å; V494-I496 PolarHBondContact O-N 2.92Å; I496-V896 HydrophobicContact CD1-CB 4.12Å; I496-V896 HydrophobicContact CD1-CG1 3.54Å; I496-V896 HydrophobicContact CD1-CG2 3.51Å; I496-T909 HydrophobicContact CG2-CG2 4.07Å; I496-L945 WeakPolarHBondContact O-CD1 3.46Å; I496-R954 HydrophobicContact CD1-CG 4.2Å; I496-R954 HydrophobicContact CG1-CG 4.4Å
497	V	74.5	Confident	67.8	Low	35 Å²	35	73.8 Å²	73.8	21%	0.212	40%	0.395	C	S	.	.	S	Bend	trans	-113.2	134.4	175.4	-174.6	0	0	0	0	109.3	K495 N499 S505 P910	K495-V497 PolarHBondContact O-N 2.97Å; V497-N499 WeakPolarHBondContact CG1-O 3.48Å; V497-S505 WeakPolarHBondContact CG1-OG 3.22Å; V497-P910 HydrophobicContact CG1-CG 4.21Å; V497-P910 HydrophobicContact CG2-CG 4.41Å
498	K	73.3	Confident	69.4	Low	90 Å²	90	67.3 Å²	67.3	39%	0.391	37%	0.366	S	S	.	.	S	Bend	trans	-64.8	-51.4	-178.6	-168.9	-178.6	176.3	-166.3	0	111.7	R941 D942 E943 M944 L945	K498-R941 PolarHBondContact NZ-O 2.78Å; K498-D942 WeakPolarHBondContact CD-O 3.2Å; K498-D942 WeakPolarHBondContact CE-O 3.37Å; K498-D942 VanDerWaalsContact NZ-C 3.35Å; K498-D942 PolarHBondContact NZ-O 2.88Å; K498-E943 WeakPolarHBondContact CB-O 3.47Å; K498-M944 WeakPolarHBondContact CD-O 3.29Å; K498-M944 PolarHBondContact NZ-O 2.73Å; K498-L945 HydrophobicContact CB-CD2 3.9Å; K498-L945 HydrophobicContact CB-CG 4.4Å; K498-L945 HydrophobicContact CD-CD2 4.49Å; K498-L945 HydrophobicContact CG-CD2 4.3Å
499	N	75.6	Confident	70.7	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.374	39%	0.394	S	S	.	.			trans	-121.1	102.5	177.6	-62.6	-8.5	0	0	0	109.1	V497 D501 G502 S505	V497-N499 WeakPolarHBondContact CG1-O 3.48Å; N499-D501 PolarHBondContact O-N 3.16Å; N499-G502 PolarHBondContact O-N 3.17Å; N499-S505 PolarHBondContact O-OG 3.07Å
500	P	70.3	Confident	72.1	Confident	73 Å²	73	71.3 Å²	71.3	47%	0.474	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.1	-178.2	26	-32.9	0	0	0	112.5	G502 S505	P500-G502 VanDerWaalsContact C-N 3.32Å; P500-S505 WeakPolarHBondContact O-CB 3.43Å
501	D	77.2	Confident	73.5	Confident	132 Å²	132	64.3 Å²	64.3	71%	0.706	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2.5	-179.6	-41.6	-72.1	0	0	0	113.4	N499 Q506	N499-D501 PolarHBondContact O-N 3.16Å; D501-Q506 PolarHBondContact O-NE2 2.84Å
502	G	79.9	Confident	74.4	Confident	9 Å²	9	62.5 Å²	62.5	9%	0.093	35%	0.345	C	S	.	.	S	Bend	trans	-67.2	161	-177.1	0	0	0	0	0	114.7	N499 P500 L504 S505 Q506	N499-G502 PolarHBondContact O-N 3.17Å; P500-G502 VanDerWaalsContact C-N 3.32Å; G502-L504 VanDerWaalsContact C-N 3.35Å; G502-L504 PolarHBondContact O-N 2.77Å; G502-S505 WeakPolarHBondContact O-CB 3.35Å; G502-S505 PolarHBondContact O-N 3.19Å; G502-Q506 WeakPolarHBondContact O-CG 3.44Å; G502-Q506 PolarHBondContact O-N 3.29Å
503	S	83.4	Confident	75.5	Confident	34 Å²	34	61.4 Å²	61.4	24%	0.238	34%	0.341	C	S	.	.	H	α-helix	trans	-59.2	-40.8	-176.8	60.5	0	0	0	0	113.2	S505 Q506 A507 E943	S503-S505 VanDerWaalsContact C-N 3.33Å; S503-S505 PolarHBondContact O-N 3.49Å; S503-Q506 PolarHBondContact O-N 3.16Å; S503-A507 PolarHBondContact O-N 2.92Å; S503-A507 VanDerWaalsContact O-N 3.09Å; S503-E943 WeakPolarHBondContact CB-OE1 3.46Å; S503-E943 VanDerWaalsContact N-CD 3.27Å; S503-E943 PolarHBondContact N-OE1 3.29Å; S503-E943 PolarHBondContact N-OE2 3.26Å; S503-E943 VanDerWaalsContact OG-CD 3.3Å; S503-E943 PolarHBondContact OG-OE1 3.44Å; S503-E943 PolarHBondContact OG-OE2 3.09Å
504	L	82.9	Confident	76.4	Confident	9 Å²	9	59.2 Å²	59.2	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-38.4	175.2	-66.9	172.1	0	0	0	112	G502 A507 A508 F891 P910 A939 E943 M944	G502-L504 VanDerWaalsContact C-N 3.35Å; G502-L504 PolarHBondContact O-N 2.77Å; L504-A507 PolarHBondContact O-N 3.02Å; L504-A508 PolarHBondContact O-N 3.18Å; L504-F891 HydrophobicContact CB-CE1 4.28Å; L504-F891 HydrophobicContact CB-CZ 4.36Å; L504-F891 HydrophobicContact CD2-CE1 4.46Å; L504-F891 HydrophobicContact CD2-CZ 3.95Å; L504-F891 VanDerWaalsContact O-CE1 3.28Å; L504-F891 WeakPolarHBondContact O-CE1 3.24Å; L504-F891 WeakPolarHBondContact O-CZ 3.4Å; L504-P910 HydrophobicContact CB-CB 4.14Å; L504-P910 HydrophobicContact CD1-CB 4.09Å; L504-A939 HydrophobicContact CD1-CB 4.04Å; L504-A939 HydrophobicContact CG-CB 4.15Å; L504-E943 WeakPolarHBondContact CB-OE2 3.47Å; L504-E943 HydrophobicContact CD1-CB 4.15Å; L504-E943 WeakPolarHBondContact CG-OE2 3.45Å; L504-E943 PolarHBondContact N-OE2 3.32Å; L504-M944 HydrophobicContact CD1-CE 3.71Å; L504-M944 HydrophobicContact CD1-CG 3.84Å
505	S	81.4	Confident	76.8	Confident	9 Å²	9	58.5 Å²	58.5	6%	0.063	33%	0.325	C	S	.	.	H	α-helix	trans	-66.9	-42.6	-179.3	-50.8	0	0	0	0	111.2	V497 N499 P500 G502 S503 A508 M509	V497-S505 WeakPolarHBondContact CG1-OG 3.22Å; N499-S505 PolarHBondContact O-OG 3.07Å; P500-S505 WeakPolarHBondContact O-CB 3.43Å; G502-S505 WeakPolarHBondContact O-CB 3.35Å; G502-S505 PolarHBondContact O-N 3.19Å; S503-S505 VanDerWaalsContact C-N 3.33Å; S503-S505 PolarHBondContact O-N 3.49Å; S505-A508 PolarHBondContact O-N 2.95Å; S505-M509 PolarHBondContact O-N 3.07Å
506	Q	82.7	Confident	77.5	Confident	123 Å²	123	55.3 Å²	55.3	58%	0.575	31%	0.311	S	S	*	.	H	α-helix	trans	-63.5	-44.7	174.5	-64.9	179.7	29.4	0	0	111.6	D501 G502 S503 A508 M509 M510	D501-Q506 PolarHBondContact O-NE2 2.84Å; G502-Q506 WeakPolarHBondContact O-CG 3.44Å; G502-Q506 PolarHBondContact O-N 3.29Å; S503-Q506 PolarHBondContact O-N 3.16Å; Q506-A508 VanDerWaalsContact C-N 3.35Å; Q506-A508 PolarHBondContact O-N 3.17Å; Q506-M509 PolarHBondContact O-N 3.23Å; Q506-M510 WeakPolarHBondContact O-CB 3.28Å; Q506-M510 PolarHBondContact O-N 3.32Å
507	A	80.9	Confident	78	Confident	9 Å²	9	59.1 Å²	59.1	7%	0.074	33%	0.328	C	S	.	.	H	α-helix	trans	-62	-37.8	176.4	0	0	0	0	0	113	S503 L504 M510 Q511 F891	S503-A507 PolarHBondContact O-N 2.92Å; S503-A507 VanDerWaalsContact O-N 3.09Å; L504-A507 PolarHBondContact O-N 3.02Å; A507-M510 PolarHBondContact O-N 3.12Å; A507-Q511 WeakPolarHBondContact O-CB 3.48Å; A507-Q511 PolarHBondContact O-N 2.89Å; A507-F891 HydrophobicContact CB-CZ 4.07Å
508	A	81.4	Confident	78.2	Confident	7 Å²	7	61.4 Å²	61.4	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-63.8	-39.1	174.9	0	0	0	0	0	113	L504 S505 Q506 S512 F891 V908	L504-A508 PolarHBondContact O-N 3.18Å; S505-A508 PolarHBondContact O-N 2.95Å; Q506-A508 VanDerWaalsContact C-N 3.35Å; Q506-A508 PolarHBondContact O-N 3.17Å; A508-S512 PolarHBondContact O-OG 3.45Å; A508-S512 VanDerWaalsContact O-OG 3.1Å; A508-F891 HydrophobicContact CB-CD1 4.21Å; A508-F891 HydrophobicContact CB-CE1 3.89Å; A508-V908 HydrophobicContact CB-CB 4.31Å; A508-V908 HydrophobicContact CB-CG1 3.9Å
509	M	78.6	Confident	78.3	Confident	139 Å²	139	63.4 Å²	63.4	69%	0.685	34%	0.338	S	S	*	.	H	α-helix	trans	-68.8	-47.7	173.2	-66.4	-173.3	-173.7	0	0	111.4	S505 Q506 Q511 S512 A513	S505-M509 PolarHBondContact O-N 3.07Å; Q506-M509 PolarHBondContact O-N 3.23Å; M509-Q511 PolarHBondContact O-N 2.92Å; M509-S512 WeakPolarHBondContact O-CB 3.34Å; M509-S512 PolarHBondContact O-N 3Å; M509-S512 VanDerWaalsContact O-N 3.08Å; M509-A513 PolarHBondContact O-N 3.16Å
510	M	79.6	Confident	78.4	Confident	89 Å²	89	64.7 Å²	64.7	44%	0.438	34%	0.342	S	S	.	.	H	α-helix	trans	-60.9	-43.7	-178.2	-173.1	172.5	-179.2	0	0	112.2	Q506 A507 S512 A513 L514 T786	Q506-M510 WeakPolarHBondContact O-CB 3.28Å; Q506-M510 PolarHBondContact O-N 3.32Å; A507-M510 PolarHBondContact O-N 3.12Å; M510-S512 PolarHBondContact O-N 3.44Å; M510-A513 WeakPolarHBondContact O-CA 3.48Å; M510-A513 WeakPolarHBondContact O-CB 3.44Å; M510-A513 PolarHBondContact O-N 3.14Å; M510-L514 HydrophobicContact CE-CD1 4.31Å; M510-L514 HydrophobicContact CG-CD1 4.09Å; M510-L514 HydrophobicContact CG-CG 4.24Å; M510-L514 WeakPolarHBondContact O-CG 3.46Å; M510-L514 PolarHBondContact O-N 2.97Å; M510-T786 HydrophobicContact SD-CG2 4.3Å
511	Q	76.5	Confident	78.8	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.028	35%	0.346	C	S	.	.	H	α-helix	trans	-60.1	-31.5	176.2	-172.5	69.5	-97.2	0	0	112.4	A507 M509 A513 L514 A515 D787 Y788	A507-Q511 WeakPolarHBondContact O-CB 3.48Å; A507-Q511 PolarHBondContact O-N 2.89Å; M509-Q511 PolarHBondContact O-N 2.92Å; Q511-A513 VanDerWaalsContact C-N 3.26Å; Q511-A513 PolarHBondContact O-N 3.08Å; Q511-L514 PolarHBondContact O-N 2.91Å; Q511-A515 VanDerWaalsContact O-CB 3.22Å; Q511-A515 WeakPolarHBondContact O-CB 3.46Å; Q511-A515 PolarHBondContact O-N 2.99Å; Q511-D787 PolarHBondContact NE2-OD1 2.86Å; Q511-Y788 HydrophobicContact CB-CD1 4.4Å; Q511-Y788 HydrophobicContact CB-CE1 3.66Å; Q511-Y788 HydrophobicContact CG-CD1 4.41Å; Q511-Y788 HydrophobicContact CG-CE1 3.6Å
512	S	73.4	Confident	78.7	Confident	70 Å²	70	64.1 Å²	64.1	49%	0.49	33%	0.33	S	S	.	.	H	α-helix	trans	-67.7	-29	177	-57.4	0	0	0	0	112.1	A508 M509 M510	A508-S512 PolarHBondContact O-OG 3.45Å; A508-S512 VanDerWaalsContact O-OG 3.1Å; M509-S512 WeakPolarHBondContact O-CB 3.34Å; M509-S512 PolarHBondContact O-N 3Å; M509-S512 VanDerWaalsContact O-N 3.08Å; M510-S512 PolarHBondContact O-N 3.44Å
513	A	77.1	Confident	78.4	Confident	62 Å²	62	69.3 Å²	69.3	51%	0.512	35%	0.352	S	S	.	.	H	α-helix	trans	-78	-47.6	170	0	0	0	0	0	112	M509 M510 Q511 A515 K516 E517	M509-A513 PolarHBondContact O-N 3.16Å; M510-A513 WeakPolarHBondContact O-CA 3.48Å; M510-A513 WeakPolarHBondContact O-CB 3.44Å; M510-A513 PolarHBondContact O-N 3.14Å; Q511-A513 VanDerWaalsContact C-N 3.26Å; Q511-A513 PolarHBondContact O-N 3.08Å; A513-A515 VanDerWaalsContact C-N 3.3Å; A513-A515 PolarHBondContact O-N 2.86Å; A513-K516 WeakPolarHBondContact O-CA 3.42Å; A513-K516 WeakPolarHBondContact O-CB 3.38Å; A513-K516 PolarHBondContact O-N 2.9Å; A513-E517 PolarHBondContact O-N 3.46Å
514	L	78.4	Confident	78	Confident	36 Å²	36	70.2 Å²	70.2	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-37.4	178.7	-66	174.4	0	0	0	112.5	M510 Q511 K516 E517 R518 D787	M510-L514 HydrophobicContact CE-CD1 4.31Å; M510-L514 HydrophobicContact CG-CD1 4.09Å; M510-L514 HydrophobicContact CG-CG 4.24Å; M510-L514 WeakPolarHBondContact O-CG 3.46Å; M510-L514 PolarHBondContact O-N 2.97Å; Q511-L514 PolarHBondContact O-N 2.91Å; L514-K516 VanDerWaalsContact C-N 3.33Å; L514-K516 PolarHBondContact O-N 3.18Å; L514-E517 PolarHBondContact O-N 3.38Å; L514-R518 VanDerWaalsContact O-CB 3.28Å; L514-R518 WeakPolarHBondContact O-CB 3.48Å; L514-R518 VanDerWaalsContact O-CG 3.23Å; L514-R518 WeakPolarHBondContact O-CG 3.37Å; L514-R518 PolarHBondContact O-N 2.81Å; L514-D787 HydrophobicContact CD1-CB 4.19Å
515	A	73.9	Confident	77.7	Confident	43 Å²	43	72.4 Å²	72.4	36%	0.355	38%	0.381	S	S	.	.	H	α-helix	trans	-67.2	-32.1	175	0	0	0	0	0	112.7	Q511 A513 R519	Q511-A515 VanDerWaalsContact O-CB 3.22Å; Q511-A515 WeakPolarHBondContact O-CB 3.46Å; Q511-A515 PolarHBondContact O-N 2.99Å; A513-A515 VanDerWaalsContact C-N 3.3Å; A513-A515 PolarHBondContact O-N 2.86Å; A515-R519 WeakPolarHBondContact O-CB 3.38Å; A515-R519 PolarHBondContact O-N 2.88Å; A515-R519 VanDerWaalsContact O-N 3.14Å
516	K	77.1	Confident	77.2	Confident	91 Å²	91	77.9 Å²	77.9	40%	0.396	40%	0.4	S	S	.	.	H	α-helix	trans	-70.4	-46	172.4	178.4	-176.4	172.5	-70.6	0	110.7	A513 L514 R519 E520 T1190	A513-K516 WeakPolarHBondContact O-CA 3.42Å; A513-K516 WeakPolarHBondContact O-CB 3.38Å; A513-K516 PolarHBondContact O-N 2.9Å; L514-K516 VanDerWaalsContact C-N 3.33Å; L514-K516 PolarHBondContact O-N 3.18Å; K516-R519 WeakPolarHBondContact O-CB 3.34Å; K516-R519 PolarHBondContact O-N 3.18Å; K516-E520 WeakPolarHBondContact CE-OE1 3.3Å; K516-E520 IonicContact NZ-OE1 2.68Å; K516-E520 PolarHBondContact NZ-OE1 3.32Å; K516-E520 IonicContact NZ-OE2 2.71Å; K516-E520 PolarHBondContact NZ-OE2 3.47Å; K516-E520 WeakPolarHBondContact O-CG 3.46Å; K516-E520 PolarHBondContact O-N 3.3Å; K516-T1190 HydrophobicContact CD-CG2 4.45Å
517	E	80	Confident	76.6	Confident	105 Å²	105	77.7 Å²	77.7	49%	0.491	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-47.5	176.3	-175.3	-179.6	-176.8	0	0	111.7	A513 L514 R519 E520 L521	A513-E517 PolarHBondContact O-N 3.46Å; L514-E517 PolarHBondContact O-N 3.38Å; E517-R519 VanDerWaalsContact C-N 3.26Å; E517-R519 PolarHBondContact O-N 2.9Å; E517-E520 PolarHBondContact O-N 3.44Å; E517-E520 VanDerWaalsContact O-N 3.1Å; E517-L521 HydrophobicContact CG-CD1 4.07Å; E517-L521 WeakPolarHBondContact O-CB 3.17Å; E517-L521 WeakPolarHBondContact O-CG 3.43Å; E517-L521 PolarHBondContact O-N 2.88Å
518	R	78.7	Confident	76.3	Confident	84 Å²	84	80 Å²	80	32%	0.317	42%	0.419	S	S	.	.	H	α-helix	trans	-56.8	-37.1	173.2	-77	169.4	158.1	150.3	-1	112.8	L514 K522 D787	L514-R518 VanDerWaalsContact O-CB 3.28Å; L514-R518 WeakPolarHBondContact O-CB 3.48Å; L514-R518 VanDerWaalsContact O-CG 3.23Å; L514-R518 WeakPolarHBondContact O-CG 3.37Å; L514-R518 PolarHBondContact O-N 2.81Å; R518-K522 VanDerWaalsContact O-CB 3.29Å; R518-K522 WeakPolarHBondContact O-CB 3.45Å; R518-K522 PolarHBondContact O-N 2.8Å; R518-D787 IonicContact CZ-OD2 2.8Å; R518-D787 VanDerWaalsContact NH1-CG 3.31Å; R518-D787 IonicContact NH1-OD1 2.66Å; R518-D787 PolarHBondContact NH1-OD1 3.01Å; R518-D787 IonicContact NH1-OD2 2.78Å; R518-D787 PolarHBondContact NH1-OD2 3.37Å; R518-D787 IonicContact NH2-OD2 3.93Å; R518-D787 PolarHBondContact NH2-OD2 3.18Å
519	R	74.4	Confident	75.6	Confident	132 Å²	132	85.7 Å²	85.7	50%	0.498	44%	0.444	S	S	.	.	H	α-helix	trans	-68.2	-44.7	173.7	168.5	179.1	-67.8	-162.4	-6.9	111.9	A515 K516 E517 K522 Q523 E816	A515-R519 WeakPolarHBondContact O-CB 3.38Å; A515-R519 PolarHBondContact O-N 2.88Å; A515-R519 VanDerWaalsContact O-N 3.14Å; K516-R519 WeakPolarHBondContact O-CB 3.34Å; K516-R519 PolarHBondContact O-N 3.18Å; E517-R519 VanDerWaalsContact C-N 3.26Å; E517-R519 PolarHBondContact O-N 2.9Å; R519-K522 PolarHBondContact O-N 2.76Å; R519-Q523 WeakPolarHBondContact O-CB 3.47Å; R519-Q523 PolarHBondContact O-N 3.19Å; R519-E816 IonicContact CZ-OE1 2.65Å; R519-E816 IonicContact CZ-OE2 2.8Å; R519-E816 IonicContact NH2-OE1 3.69Å; R519-E816 PolarHBondContact NH2-OE1 2.98Å; R519-E816 IonicContact NH2-OE2 2.92Å; R519-E816 PolarHBondContact NH2-OE2 3.3Å
520	E	78.4	Confident	74.7	Confident	96 Å²	96	85 Å²	85	45%	0.449	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-43.2	-179.2	-73.9	169.1	170	0	0	110.8	K516 E517 Q523 A524	K516-E520 WeakPolarHBondContact CE-OE1 3.3Å; K516-E520 IonicContact NZ-OE1 2.68Å; K516-E520 PolarHBondContact NZ-OE1 3.32Å; K516-E520 IonicContact NZ-OE2 2.71Å; K516-E520 PolarHBondContact NZ-OE2 3.47Å; K516-E520 WeakPolarHBondContact O-CG 3.46Å; K516-E520 PolarHBondContact O-N 3.3Å; E517-E520 PolarHBondContact O-N 3.44Å; E517-E520 VanDerWaalsContact O-N 3.1Å; E520-Q523 PolarHBondContact O-N 2.9Å; E520-A524 WeakPolarHBondContact O-CB 3.48Å; E520-A524 PolarHBondContact O-N 2.85Å
521	L	79.1	Confident	73.7	Confident	109 Å²	109	86.3 Å²	86.3	57%	0.571	45%	0.45	S	S	*	.	H	α-helix	trans	-58.8	-47.3	169.9	-76.5	167.6	0	0	0	112.5	E517 Q523 A524 A525	E517-L521 HydrophobicContact CG-CD1 4.07Å; E517-L521 WeakPolarHBondContact O-CB 3.17Å; E517-L521 WeakPolarHBondContact O-CG 3.43Å; E517-L521 PolarHBondContact O-N 2.88Å; L521-Q523 VanDerWaalsContact C-N 3.28Å; L521-Q523 PolarHBondContact O-N 3.21Å; L521-A524 PolarHBondContact O-N 3.1Å; L521-A525 VanDerWaalsContact O-CB 3.28Å; L521-A525 WeakPolarHBondContact O-CB 3.35Å; L521-A525 PolarHBondContact O-N 2.97Å
522	K	74	Confident	73	Confident	85 Å²	85	90.2 Å²	90.2	37%	0.37	48%	0.478	S	S	.	.	H	α-helix	trans	-72	-20.8	179.1	-169.8	152.5	-172.7	160	0	113.3	R518 R519 R526 E823	R518-K522 VanDerWaalsContact O-CB 3.29Å; R518-K522 WeakPolarHBondContact O-CB 3.45Å; R518-K522 PolarHBondContact O-N 2.8Å; R519-K522 PolarHBondContact O-N 2.76Å; K522-R526 PolarHBondContact O-N 3.39Å; K522-E823 IonicContact NZ-OE1 2.72Å; K522-E823 PolarHBondContact NZ-OE1 2.91Å; K522-E823 IonicContact NZ-OE2 3.76Å; K522-E823 PolarHBondContact NZ-OE2 3.36Å
523	Q	73.6	Confident	72.1	Confident	117 Å²	117	91.3 Å²	91.3	55%	0.547	48%	0.477	S	S	.	.	H	α-helix	trans	-75.4	-50.6	168.9	-178.2	169.7	-33.1	0	0	110.6	R519 E520 L521 A525 R526 E527	R519-Q523 WeakPolarHBondContact O-CB 3.47Å; R519-Q523 PolarHBondContact O-N 3.19Å; E520-Q523 PolarHBondContact O-N 2.9Å; L521-Q523 VanDerWaalsContact C-N 3.28Å; L521-Q523 PolarHBondContact O-N 3.21Å; Q523-A525 VanDerWaalsContact C-N 3.3Å; Q523-A525 PolarHBondContact O-N 3.4Å; Q523-R526 PolarHBondContact O-N 2.68Å; Q523-R526 VanDerWaalsContact O-N 3.13Å; Q523-E527 WeakPolarHBondContact O-CB 3.43Å; Q523-E527 PolarHBondContact O-N 2.61Å
524	A	75.9	Confident	70.8	Confident	53 Å²	53	93.4 Å²	93.4	44%	0.438	49%	0.485	S	S	.	.	H	α-helix	trans	-60.7	-36.6	177.2	0	0	0	0	0	112.6	E520 L521 E527 A528	E520-A524 WeakPolarHBondContact O-CB 3.48Å; E520-A524 PolarHBondContact O-N 2.85Å; L521-A524 PolarHBondContact O-N 3.1Å; A524-E527 PolarHBondContact O-N 3Å; A524-A528 WeakPolarHBondContact O-CB 3.47Å; A524-A528 PolarHBondContact O-N 3.17Å
525	A	76.3	Confident	69.4	Low	55 Å²	55	98.6 Å²	98.6	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-44.3	173.5	0	0	0	0	0	111.8	L521 Q523 A528 E529	L521-A525 VanDerWaalsContact O-CB 3.28Å; L521-A525 WeakPolarHBondContact O-CB 3.35Å; L521-A525 PolarHBondContact O-N 2.97Å; Q523-A525 VanDerWaalsContact C-N 3.3Å; Q523-A525 PolarHBondContact O-N 3.4Å; A525-A528 PolarHBondContact O-N 3.1Å; A525-E529 WeakPolarHBondContact O-CG 3.5Å; A525-E529 PolarHBondContact O-N 3.4Å
526	R	70.9	Confident	67.9	Low	124 Å²	124	98.7 Å²	98.7	47%	0.468	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-36.9	174.5	-173.2	-177.8	-61.5	119.3	12	112	K522 Q523 E529 M530	K522-R526 PolarHBondContact O-N 3.39Å; Q523-R526 PolarHBondContact O-N 2.68Å; Q523-R526 VanDerWaalsContact O-N 3.13Å; R526-E529 WeakPolarHBondContact O-CB 3.49Å; R526-E529 PolarHBondContact O-N 3.28Å; R526-M530 HydrophobicContact CG-CG 4.49Å; R526-M530 WeakPolarHBondContact O-CG 3.13Å; R526-M530 PolarHBondContact O-N 3.12Å
527	E	70.1	Confident	66.5	Low	119 Å²	119	100.8 Å²	100.8	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-63.6	-44.1	177.2	-162	158.7	-169.5	0	0	110.2	Q523 A524 M530 D531	Q523-E527 WeakPolarHBondContact O-CB 3.43Å; Q523-E527 PolarHBondContact O-N 2.61Å; A524-E527 PolarHBondContact O-N 3Å; E527-M530 PolarHBondContact O-N 2.73Å; E527-D531 PolarHBondContact O-N 3.49Å
528	A	73.8	Confident	64.6	Low	59 Å²	59	101.6 Å²	101.6	49%	0.488	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-37.9	171.3	0	0	0	0	0	113.6	A524 A525 D531 S532	A524-A528 WeakPolarHBondContact O-CB 3.47Å; A524-A528 PolarHBondContact O-N 3.17Å; A525-A528 PolarHBondContact O-N 3.1Å; A528-D531 PolarHBondContact O-N 3.06Å; A528-S532 WeakPolarHBondContact O-CB 3.39Å; A528-S532 PolarHBondContact O-N 3.47Å
529	E	67.6	Low	62.9	Low	125 Å²	125	105.7 Å²	105.7	58%	0.584	56%	0.558	S	S	*	*	H	α-helix	trans	-59.2	-46.1	170	-76.9	175.8	152.2	0	0	110.9	A525 R526 S532 I533	A525-E529 WeakPolarHBondContact O-CG 3.5Å; A525-E529 PolarHBondContact O-N 3.4Å; R526-E529 WeakPolarHBondContact O-CB 3.49Å; R526-E529 PolarHBondContact O-N 3.28Å; E529-S532 PolarHBondContact O-N 2.59Å; E529-S532 PolarHBondContact O-OG 3.13Å; E529-I533 PolarHBondContact O-N 2.8Å
530	M	59.2	Low	61.4	Low	125 Å²	125	105.4 Å²	105.4	62%	0.616	56%	0.562	S	S	*	*	H	α-helix	trans	-66.4	-37.7	178.3	-69	-151.6	73.4	0	0	112.9	R526 E527 S532 I533	R526-M530 HydrophobicContact CG-CG 4.49Å; R526-M530 WeakPolarHBondContact O-CG 3.13Å; R526-M530 PolarHBondContact O-N 3.12Å; E527-M530 PolarHBondContact O-N 2.73Å; M530-S532 VanDerWaalsContact C-N 3.32Å; M530-I533 WeakPolarHBondContact O-CB 3.35Å; M530-I533 PolarHBondContact O-N 2.89Å
531	D	59.9	Low	59.7	Low	117 Å²	117	111.7 Å²	111.7	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-70.8	-26.7	173.4	-84.1	-9.9	0	0	0	112.7	E527 A528 I533	E527-D531 PolarHBondContact O-N 3.49Å; A528-D531 PolarHBondContact O-N 3.06Å; D531-I533 VanDerWaalsContact C-N 3.28Å; D531-I533 PolarHBondContact O-N 3.08Å
532	S	60.5	Low	58	Low	88 Å²	88	112.9 Å²	112.9	62%	0.615	59%	0.593	S	S	*	*	H	α-helix	trans	-72.4	-18.8	174	81.3	0	0	0	0	113.7	A528 E529 M530 P534	A528-S532 WeakPolarHBondContact O-CB 3.39Å; A528-S532 PolarHBondContact O-N 3.47Å; E529-S532 PolarHBondContact O-N 2.59Å; E529-S532 PolarHBondContact O-OG 3.13Å; M530-S532 VanDerWaalsContact C-N 3.32Å; S532-P534 VanDerWaalsContact O-CD 3.31Å; S532-P534 WeakPolarHBondContact O-CD 3.45Å
533	I	55.9	Low	56.4	Low	93 Å²	93	113.1 Å²	113.1	48%	0.477	60%	0.599	S	S	.	*	S	Bend	trans	-69.9	118.9	173.8	-63.7	169.9	0	0	0	108	E529 M530 D531 M535	E529-I533 PolarHBondContact O-N 2.8Å; M530-I533 WeakPolarHBondContact O-CB 3.35Å; M530-I533 PolarHBondContact O-N 2.89Å; D531-I533 VanDerWaalsContact C-N 3.28Å; D531-I533 PolarHBondContact O-N 3.08Å; I533-M535 PolarHBondContact O-N 3.15Å
534	P	49.3	Very low	55.3	Low	105 Å²	105	113.1 Å²	113.1	68%	0.682	61%	0.609	S	S	*	*			trans	-57.7	124.2	-173.2	-28	36.2	0	0	0	113.1	S532 G536 L537	S532-P534 VanDerWaalsContact O-CD 3.31Å; S532-P534 WeakPolarHBondContact O-CD 3.45Å; P534-G536 PolarHBondContact O-N 3.24Å; P534-L537 PolarHBondContact O-N 3.32Å
535	M	48.9	Very low	53.8	Low	145 Å²	145	117.3 Å²	117.3	71%	0.714	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-3	-174.3	-66.3	-171.1	172.8	0	0	115.7	I533 L537	I533-M535 PolarHBondContact O-N 3.15Å; M535-L537 VanDerWaalsContact C-N 3.33Å
536	G	43	Very low	52	Low	46 Å²	46	116.7 Å²	116.7	47%	0.474	61%	0.614	S	S	.	*	H	α-helix	trans	-66.6	-28	172	0	0	0	0	0	114.3	P534 H540	P534-G536 PolarHBondContact O-N 3.24Å; G536-H540 PolarHBondContact O-ND1 2.94Å
537	L	46.3	Very low	51	Low	135 Å²	135	117.1 Å²	117.1	71%	0.707	63%	0.626	S	S	*	*	H	α-helix	trans	-76.4	-43.9	-177.8	-124.5	71.1	0	0	0	112.7	P534 M535 K539 H540	P534-L537 PolarHBondContact O-N 3.32Å; M535-L537 VanDerWaalsContact C-N 3.33Å; L537-K539 VanDerWaalsContact C-N 3.32Å; L537-K539 PolarHBondContact O-N 3.33Å; L537-H540 PolarHBondContact O-N 3.07Å
538	N	41.4	Very low	50.1	Low	122 Å²	122	115.9 Å²	115.9	65%	0.652	63%	0.627	S	S	*	*	H	α-helix	trans	-71.7	-26.4	-177.7	-122.8	-6.7	0	0	0	112.7	H540 W541	N538-H540 VanDerWaalsContact C-N 3.26Å; N538-H540 PolarHBondContact O-N 2.91Å; N538-W541 WeakPolarHBondContact O-CB 3.47Å; N538-W541 PolarHBondContact O-N 3.44Å; N538-W541 VanDerWaalsContact O-N 3.15Å
539	K	41.5	Very low	48.8	Very low	169 Å²	169	119.1 Å²	119.1	74%	0.735	64%	0.636	S	S	*	*	H	α-helix	trans	-66.6	-26.1	-179.5	-140.4	174.3	-173.4	-178.9	0	113.4	L537 W541	L537-K539 VanDerWaalsContact C-N 3.32Å; L537-K539 PolarHBondContact O-N 3.33Å; K539-W541 PolarHBondContact O-N 2.91Å
540	H	43.7	Very low	47.9	Very low	127 Å²	127	114.3 Å²	114.3	59%	0.588	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-3.6	175.3	-74.2	90.8	0	0	0	114.1	G536 L537 N538	G536-H540 PolarHBondContact O-ND1 2.94Å; L537-H540 PolarHBondContact O-N 3.07Å; N538-H540 VanDerWaalsContact C-N 3.26Å; N538-H540 PolarHBondContact O-N 2.91Å
541	W	42.5	Very low	47.4	Very low	228 Å²	228	115.3 Å²	115.3	86%	0.864	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-4.6	-178.7	-137.7	50.5	0	0	0	114	N538 K539	N538-W541 WeakPolarHBondContact O-CB 3.47Å; N538-W541 PolarHBondContact O-N 3.44Å; N538-W541 VanDerWaalsContact O-N 3.15Å; K539-W541 PolarHBondContact O-N 2.91Å
542	V	43.7	Very low	46.6	Very low	133 Å²	133	115.3 Å²	115.3	81%	0.806	61%	0.613	S	S	*	*	S	Bend	trans	-123.9	18.6	-177.3	-157	0	0	0	0	111.7
543	D	41.3	Very low	45.8	Very low	91 Å²	91	116.6 Å²	116.6	49%	0.487	61%	0.612	S	S	.	*			trans	-111.7	122.2	172.2	-164.3	-35.4	0	0	0	109.9	L545	D543-L545 VanDerWaalsContact C-N 3.3Å; D543-L545 PolarHBondContact O-N 2.57Å; D543-L545 PolarHBondContact OD1-N 2.89Å
544	P	50.2	Low	45.3	Very low	117 Å²	117	114.5 Å²	114.5	76%	0.76	61%	0.608	S	S	*	*	S	Bend	trans	-75.7	-10.1	176.5	30.7	-34.5	0	0	0	114.5
545	L	42.8	Very low	45.1	Very low	140 Å²	140	111.9 Å²	111.9	73%	0.733	60%	0.596	S	S	*	*	S	Bend	trans	-128.1	69.4	174	-77.6	95.5	0	0	0	112.3	D543 D547	D543-L545 VanDerWaalsContact C-N 3.3Å; D543-L545 PolarHBondContact O-N 2.57Å; D543-L545 PolarHBondContact OD1-N 2.89Å; L545-D547 PolarHBondContact O-N 2.7Å
546	P	39.9	Very low	44.6	Very low	42 Å²	42	110.4 Å²	110.4	27%	0.273	59%	0.591	S	S	.	*			trans	-67.2	131.2	168.7	29.6	-33.7	0	0	0	110.3	R551	P546-R551 PolarHBondContact O-NE 3.31Å; P546-R551 VanDerWaalsContact O-NE 3.07Å; P546-R551 PolarHBondContact O-NH2 2.79Å
547	D	50.5	Low	44.6	Very low	134 Å²	134	115.5 Å²	115.5	72%	0.717	60%	0.604	S	S	*	*			trans	-63.8	163.8	-179.4	-152.4	-11.8	0	0	0	112.3	L545 D549 G550	L545-D547 PolarHBondContact O-N 2.7Å; D547-D549 PolarHBondContact O-N 3.5Å; D547-G550 PolarHBondContact O-N 2.96Å
548	V	49.4	Very low	44.6	Very low	93 Å²	93	119 Å²	119	56%	0.564	61%	0.608	S	S	*	*	H	α-helix	trans	-60.4	-45.7	-164.8	-175.9	0	0	0	0	112.2	G550 R551 Q552	V548-G550 VanDerWaalsContact C-N 3.3Å; V548-G550 PolarHBondContact O-N 2.76Å; V548-R551 WeakPolarHBondContact O-CB 3.48Å; V548-R551 PolarHBondContact O-N 2.89Å; V548-Q552 PolarHBondContact O-N 3.19Å
549	D	46.7	Very low	44.3	Very low	126 Å²	126	116.4 Å²	116.4	67%	0.674	61%	0.61	S	S	*	*	H	α-helix	trans	-65	-31.8	-178.2	-71.4	-29.2	0	0	0	113.2	D547 R551 Q552 I553	D547-D549 PolarHBondContact O-N 3.5Å; D549-R551 PolarHBondContact O-N 3.42Å; D549-Q552 WeakPolarHBondContact O-CB 3.49Å; D549-Q552 PolarHBondContact O-N 2.81Å; D549-Q552 VanDerWaalsContact O-N 3.1Å; D549-I553 PolarHBondContact O-N 2.78Å
550	G	48.7	Very low	44	Very low	25 Å²	25	114.5 Å²	114.5	26%	0.258	61%	0.607	S	S	.	*	H	α-helix	trans	-61.5	-30.3	174.5	0	0	0	0	0	112.5	D547 V548 A554	D547-G550 PolarHBondContact O-N 2.96Å; V548-G550 VanDerWaalsContact C-N 3.3Å; V548-G550 PolarHBondContact O-N 2.76Å; G550-A554 WeakPolarHBondContact O-CB 3.29Å; G550-A554 PolarHBondContact O-N 3.46Å; G550-A554 VanDerWaalsContact O-N 3.14Å
551	R	49.1	Very low	43.7	Very low	146 Å²	146	112.4 Å²	112.4	55%	0.551	62%	0.619	S	S	*	*	H	α-helix	trans	-74.4	-35.6	175.7	-53.2	179.3	-169.3	-157.1	-1	111.6	P546 V548 D549 A554 A555	P546-R551 PolarHBondContact O-NE 3.31Å; P546-R551 VanDerWaalsContact O-NE 3.07Å; P546-R551 PolarHBondContact O-NH2 2.79Å; V548-R551 WeakPolarHBondContact O-CB 3.48Å; V548-R551 PolarHBondContact O-N 2.89Å; D549-R551 PolarHBondContact O-N 3.42Å; R551-A554 PolarHBondContact O-N 3.18Å; R551-A555 WeakPolarHBondContact O-CB 3.35Å; R551-A555 PolarHBondContact O-N 2.81Å
552	Q	43	Very low	43.3	Very low	117 Å²	117	109.4 Å²	109.4	55%	0.547	62%	0.617	S	S	.	*	H	α-helix	trans	-60.9	-45.8	176.6	-139.9	74.7	-4.7	0	0	110.8	V548 D549 A555 N556	V548-Q552 PolarHBondContact O-N 3.19Å; D549-Q552 WeakPolarHBondContact O-CB 3.49Å; D549-Q552 PolarHBondContact O-N 2.81Å; D549-Q552 VanDerWaalsContact O-N 3.1Å; Q552-A555 PolarHBondContact O-N 3.35Å; Q552-N556 WeakPolarHBondContact O-CB 3.25Å; Q552-N556 VanDerWaalsContact O-CG 3.25Å; Q552-N556 PolarHBondContact O-N 2.81Å
553	I	43.8	Very low	42.8	Very low	115 Å²	115	111.3 Å²	111.3	59%	0.59	62%	0.619	S	S	*	*	H	α-helix	trans	-66.3	-46.9	177.8	-61	167.7	0	0	0	110.8	D549 A555 N556 M557	D549-I553 PolarHBondContact O-N 2.78Å; I553-A555 PolarHBondContact O-N 3.25Å; I553-N556 PolarHBondContact O-N 3.4Å; I553-M557 PolarHBondContact O-N 2.99Å
554	A	44.6	Very low	42.8	Very low	48 Å²	48	111 Å²	111	40%	0.397	62%	0.622	S	S	.	*	H	α-helix	trans	-71.3	-11.8	178.6	0	0	0	0	0	114.9	G550 R551 R558	G550-A554 WeakPolarHBondContact O-CB 3.29Å; G550-A554 PolarHBondContact O-N 3.46Å; G550-A554 VanDerWaalsContact O-N 3.14Å; R551-A554 PolarHBondContact O-N 3.18Å; A554-R558 PolarHBondContact O-NE 2.77Å
555	A	45.3	Very low	42.5	Very low	51 Å²	51	109.5 Å²	109.5	42%	0.421	61%	0.608	S	S	.	*	H	α-helix	trans	-90.4	-43.6	169.9	0	0	0	0	0	111.3	R551 Q552 I553 M557 R558 G559	R551-A555 WeakPolarHBondContact O-CB 3.35Å; R551-A555 PolarHBondContact O-N 2.81Å; Q552-A555 PolarHBondContact O-N 3.35Å; I553-A555 PolarHBondContact O-N 3.25Å; A555-M557 PolarHBondContact O-N 2.92Å; A555-R558 CarbonylContact O-C 3.58Å; A555-R558 WeakPolarHBondContact O-CA 3.26Å; A555-R558 VanDerWaalsContact O-CB 3.23Å; A555-R558 WeakPolarHBondContact O-CB 3.36Å; A555-R558 PolarHBondContact O-N 2.83Å; A555-G559 PolarHBondContact O-N 3.01Å
556	N	39.7	Very low	42.9	Very low	114 Å²	114	107 Å²	107	61%	0.61	60%	0.595	S	S	*	*	H	α-helix	trans	-63.8	-40.2	178.6	-72.5	-11.5	0	0	0	112.2	Q552 I553 R558 G559	Q552-N556 WeakPolarHBondContact O-CB 3.25Å; Q552-N556 VanDerWaalsContact O-CG 3.25Å; Q552-N556 PolarHBondContact O-N 2.81Å; I553-N556 PolarHBondContact O-N 3.4Å; N556-R558 PolarHBondContact O-N 3.05Å; N556-G559 PolarHBondContact O-N 3.03Å; N556-G559 VanDerWaalsContact O-N 3.14Å
557	M	43.4	Very low	43.7	Very low	152 Å²	152	108.7 Å²	108.7	75%	0.749	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-23	169.6	-90.7	-172.3	162.7	0	0	113.6	I553 A555 G559	I553-M557 PolarHBondContact O-N 2.99Å; A555-M557 PolarHBondContact O-N 2.92Å; M557-G559 VanDerWaalsContact C-N 3.35Å
558	R	45.3	Very low	44.3	Very low	208 Å²	208	104.7 Å²	104.7	79%	0.785	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-12.4	177.1	-134.5	-179.6	-63.3	-163.8	-1.5	113.2	A554 A555 N556	A554-R558 PolarHBondContact O-NE 2.77Å; A555-R558 CarbonylContact O-C 3.58Å; A555-R558 WeakPolarHBondContact O-CA 3.26Å; A555-R558 VanDerWaalsContact O-CB 3.23Å; A555-R558 WeakPolarHBondContact O-CB 3.36Å; A555-R558 PolarHBondContact O-N 2.83Å; N556-R558 PolarHBondContact O-N 3.05Å
559	G	34.4	Very low	45.1	Very low	69 Å²	69	105.2 Å²	105.2	71%	0.711	58%	0.579	S	S	*	*	S	Bend	trans	-84.6	-14.9	177.5	0	0	0	0	0	114.7	A555 N556 M557	A555-G559 PolarHBondContact O-N 3.01Å; N556-G559 PolarHBondContact O-N 3.03Å; N556-G559 VanDerWaalsContact O-N 3.14Å; M557-G559 VanDerWaalsContact C-N 3.35Å
560	I	36.8	Very low	46.3	Very low	128 Å²	128	99.9 Å²	99.9	66%	0.656	55%	0.549	S	S	*	.	S	Bend	trans	-101	112	178.3	-59.5	178.8	0	0	0	108.5	M562	I560-M562 VanDerWaalsContact C-N 3.25Å; I560-M562 PolarHBondContact O-N 3.01Å
561	G	37.2	Very low	47.3	Very low	83 Å²	83	100.6 Å²	100.6	86%	0.856	55%	0.545	S	S	*	.			trans	-74.1	54.1	-167.7	0	0	0	0	0	116.5	M563	G561-M563 PolarHBondContact O-N 3.4Å
562	M	32.8	Very low	48.1	Very low	165 Å²	165	97.9 Å²	97.9	81%	0.813	54%	0.537	S	S	*	.			trans	-82.5	107.5	168.8	-71.2	-172	71.9	0	0	110.8	I560 P564	I560-M562 VanDerWaalsContact C-N 3.25Å; I560-M562 PolarHBondContact O-N 3.01Å; M562-P564 WeakPolarHBondContact O-CD 3.3Å
563	M	33.9	Very low	49.1	Very low	174 Å²	174	96.9 Å²	96.9	86%	0.857	53%	0.532	S	S	*	.			trans	-92.5	101.8	164.9	-80.8	-82.3	-162.6	0	0	109.3	G561 N565	G561-M563 PolarHBondContact O-N 3.4Å; M563-N565 PolarHBondContact O-N 3.48Å
564	P	41.3	Very low	49.9	Very low	84 Å²	84	91.7 Å²	91.7	55%	0.545	51%	0.507	S	S	.	.			trans	-72.5	79.8	171.8	29.7	-34.1	0	0	0	110.5	M562 D566	M562-P564 WeakPolarHBondContact O-CD 3.3Å; P564-D566 WeakPolarHBondContact CB-OD2 3.43Å; P564-D566 PolarHBondContact O-N 3.03Å
565	N	43.5	Very low	50.9	Low	85 Å²	85	92.5 Å²	92.5	46%	0.455	50%	0.501	S	S	.	.			trans	-81	69.9	152.3	-93.3	-15.6	0	0	0	107.8	M563 I567 K572 K1056	M563-N565 PolarHBondContact O-N 3.48Å; N565-I567 PolarHBondContact O-N 3.39Å; N565-K572 WeakPolarHBondContact O-CE 3.21Å; N565-K1056 PolarHBondContact OD1-NZ 3.49Å
566	D	50.6	Low	50.9	Low	89 Å²	89	93.1 Å²	93.1	48%	0.476	51%	0.513	S	S	.	.			trans	-82.7	56.6	-177.8	-67.2	-33.8	0	0	0	113.1	P564 P568 K572	P564-D566 WeakPolarHBondContact CB-OD2 3.43Å; P564-D566 PolarHBondContact O-N 3.03Å; D566-P568 WeakPolarHBondContact O-CD 3.39Å; D566-K572 IonicContact OD1-NZ 2.71Å; D566-K572 PolarHBondContact OD1-NZ 3.19Å
567	I	58.8	Low	51.4	Low	76 Å²	76	89.7 Å²	89.7	39%	0.39	50%	0.504	S	S	.	.			trans	-44.3	123.7	137.4	-57.3	172.8	0	0	0	106.9	N565 K571 K572	N565-I567 PolarHBondContact O-N 3.39Å; I567-K571 HydrophobicContact CG2-CB 3.37Å; I567-K572 HydrophobicContact CB-CG 3.93Å; I567-K572 HydrophobicContact CG2-CG 3.92Å; I567-K572 VanDerWaalsContact O-CD 3.25Å; I567-K572 WeakPolarHBondContact O-CD 3.39Å; I567-K572 WeakPolarHBondContact O-CE 3.36Å; I567-K572 WeakPolarHBondContact O-CG 3.49Å; I567-K572 PolarHBondContact O-NZ 3.04Å; I567-K572 VanDerWaalsContact O-NZ 3.14Å
568	P	62.6	Low	51.4	Low	50 Å²	50	90.5 Å²	90.5	33%	0.325	51%	0.512	S	S	.	.			trans	-51.9	149.8	178.5	-30.7	35.8	0	0	0	112.5	D566 W570 K571 K572	D566-P568 WeakPolarHBondContact O-CD 3.39Å; P568-W570 VanDerWaalsContact C-N 3.27Å; P568-W570 PolarHBondContact O-N 2.9Å; P568-K571 HydrophobicContact CB-CB 4.5Å; P568-K571 CarbonylContact O-C 3.52Å; P568-K571 WeakPolarHBondContact O-CA 3.5Å; P568-K571 WeakPolarHBondContact O-CB 3.21Å; P568-K571 PolarHBondContact O-N 2.92Å; P568-K572 PolarHBondContact O-N 3.02Å
569	E	66.4	Low	51.2	Low	104 Å²	104	90.6 Å²	90.6	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-52.3	-45.1	-176.8	-66	-172.7	148.3	0	0	112.4	K571 K572 H573 Y826 K830	E569-K571 VanDerWaalsContact C-N 3.27Å; E569-K571 PolarHBondContact O-N 2.82Å; E569-K572 WeakPolarHBondContact O-CB 3.49Å; E569-K572 PolarHBondContact O-N 3.49Å; E569-K572 VanDerWaalsContact O-N 3.13Å; E569-H573 PolarHBondContact O-N 3.4Å; E569-Y826 HydrophobicContact CB-CE1 3.76Å; E569-K830 IonicContact OE1-NZ 3.21Å; E569-K830 IonicContact OE2-NZ 2.65Å; E569-K830 PolarHBondContact OE2-NZ 3.39Å
570	W	70.4	Confident	51.5	Low	14 Å²	14	89.8 Å²	89.8	5%	0.053	51%	0.505	C	S	.	.	H	α-helix	trans	-59.6	-35.6	176.2	77.7	-105.7	0	0	0	113.1	P568 A574 D819 C822 Y826 P843	P568-W570 VanDerWaalsContact C-N 3.27Å; P568-W570 PolarHBondContact O-N 2.9Å; W570-A574 VanDerWaalsContact O-CB 3.24Å; W570-A574 WeakPolarHBondContact O-CB 3.5Å; W570-A574 PolarHBondContact O-N 3.36Å; W570-D819 HydrophobicContact CZ2-CB 4.41Å; W570-D819 WeakPolarHBondContact CZ2-O 3.31Å; W570-C822 HydrophobicContact CD2-CB 4.04Å; W570-C822 HydrophobicContact CE3-CB 3.71Å; W570-C822 HydrophobicContact CH2-CB 3.41Å; W570-C822 VanDerWaalsContact CH2-CB 3.41Å; W570-C822 HydrophobicContact CZ2-CB 3.77Å; W570-C822 HydrophobicContact CZ3-CB 3.39Å; W570-Y826 HydrophobicContact CB-CD1 3.71Å; W570-Y826 HydrophobicContact CB-CD2 3.68Å; W570-Y826 HydrophobicContact CB-CE1 4.22Å; W570-Y826 HydrophobicContact CB-CE2 4.21Å; W570-Y826 HydrophobicContact CB-CG 3.4Å; W570-Y826 VanDerWaalsContact CB-CG 3.4Å; W570-P843 HydrophobicContact CZ3-CG 4.17Å
571	K	69.7	Low	51.6	Low	40 Å²	40	87 Å²	87	17%	0.174	50%	0.496	C	S	.	.	H	α-helix	trans	-75.4	-37.8	174.8	-75.2	-168.9	179.2	-168.7	0	112	I567 P568 E569 H573 A574 F575 D819	I567-K571 HydrophobicContact CG2-CB 3.37Å; P568-K571 HydrophobicContact CB-CB 4.5Å; P568-K571 CarbonylContact O-C 3.52Å; P568-K571 WeakPolarHBondContact O-CA 3.5Å; P568-K571 WeakPolarHBondContact O-CB 3.21Å; P568-K571 PolarHBondContact O-N 2.92Å; E569-K571 VanDerWaalsContact C-N 3.27Å; E569-K571 PolarHBondContact O-N 2.82Å; K571-H573 VanDerWaalsContact C-N 3.27Å; K571-H573 PolarHBondContact O-N 3.16Å; K571-A574 PolarHBondContact O-N 3.48Å; K571-F575 HydrophobicContact CB-CD2 4Å; K571-F575 HydrophobicContact CB-CE2 3.58Å; K571-F575 HydrophobicContact CB-CZ 4.24Å; K571-F575 HydrophobicContact CD-CE2 3.92Å; K571-F575 HydrophobicContact CD-CZ 4.25Å; K571-F575 HydrophobicContact CG-CE2 3.79Å; K571-F575 HydrophobicContact CG-CZ 4.03Å; K571-F575 VanDerWaalsContact O-CB 3.3Å; K571-F575 WeakPolarHBondContact O-CB 3.48Å; K571-F575 WeakPolarHBondContact O-CD2 3.36Å; K571-F575 WeakPolarHBondContact O-CG 3.48Å; K571-F575 PolarHBondContact O-N 3.01Å; K571-D819 IonicContact NZ-OD1 3.11Å; K571-D819 IonicContact NZ-OD2 3.46Å; K571-D819 PolarHBondContact NZ-OD2 3.06Å
572	K	66.6	Low	51.9	Low	90 Å²	90	92.1 Å²	92.1	39%	0.391	49%	0.491	S	S	.	.	H	α-helix	trans	-57.7	-43.1	170.8	-72.9	167.3	174.6	151.5	0	110	N565 D566 I567 P568 E569 G576	N565-K572 WeakPolarHBondContact O-CE 3.21Å; D566-K572 IonicContact OD1-NZ 2.71Å; D566-K572 PolarHBondContact OD1-NZ 3.19Å; I567-K572 HydrophobicContact CB-CG 3.93Å; I567-K572 HydrophobicContact CG2-CG 3.92Å; I567-K572 VanDerWaalsContact O-CD 3.25Å; I567-K572 WeakPolarHBondContact O-CD 3.39Å; I567-K572 WeakPolarHBondContact O-CE 3.36Å; I567-K572 WeakPolarHBondContact O-CG 3.49Å; I567-K572 PolarHBondContact O-NZ 3.04Å; I567-K572 VanDerWaalsContact O-NZ 3.14Å; P568-K572 PolarHBondContact O-N 3.02Å; E569-K572 WeakPolarHBondContact O-CB 3.49Å; E569-K572 PolarHBondContact O-N 3.49Å; E569-K572 VanDerWaalsContact O-N 3.13Å; K572-G576 WeakPolarHBondContact O-CA 3.47Å; K572-G576 PolarHBondContact O-N 3.09Å
573	H	63.4	Low	52.6	Low	95 Å²	95	86.5 Å²	86.5	44%	0.44	48%	0.476	S	S	.	.	H	α-helix	trans	-65.6	-52.8	175.7	-151.6	-112	0	0	0	112.6	E569 K571 F575 G576 E838 R855	E569-H573 PolarHBondContact O-N 3.4Å; K571-H573 VanDerWaalsContact C-N 3.27Å; K571-H573 PolarHBondContact O-N 3.16Å; H573-F575 PolarHBondContact O-N 3.43Å; H573-F575 VanDerWaalsContact O-N 3.12Å; H573-G576 PolarHBondContact O-N 3.24Å; H573-E838 IonicContact CE1-OE1 2.77Å; H573-E838 PolarHBondContact CE1-OE1 3.07Å; H573-R855 PolarHBondContact O-NH1 3.27Å; H573-R855 VanDerWaalsContact O-NH1 3.11Å
574	A	61.1	Low	53.1	Low	6 Å²	6	84.5 Å²	84.5	5%	0.05	46%	0.462	C	S	.	.	H	α-helix	trans	-62.3	-20	179.8	0	0	0	0	0	113.9	W570 K571 R855	W570-A574 VanDerWaalsContact O-CB 3.24Å; W570-A574 WeakPolarHBondContact O-CB 3.5Å; W570-A574 PolarHBondContact O-N 3.36Å; K571-A574 PolarHBondContact O-N 3.48Å; A574-R855 PolarHBondContact O-NH1 3.01Å
575	F	65.4	Low	53.3	Low	65 Å²	65	89.6 Å²	89.6	29%	0.285	48%	0.476	S	S	.	.	H	α-helix	trans	-114.8	-12.1	-177.8	-50.1	-31.5	0	0	0	115.5	K571 H573 G577 M852	K571-F575 HydrophobicContact CB-CD2 4Å; K571-F575 HydrophobicContact CB-CE2 3.58Å; K571-F575 HydrophobicContact CB-CZ 4.24Å; K571-F575 HydrophobicContact CD-CE2 3.92Å; K571-F575 HydrophobicContact CD-CZ 4.25Å; K571-F575 HydrophobicContact CG-CE2 3.79Å; K571-F575 HydrophobicContact CG-CZ 4.03Å; K571-F575 VanDerWaalsContact O-CB 3.3Å; K571-F575 WeakPolarHBondContact O-CB 3.48Å; K571-F575 WeakPolarHBondContact O-CD2 3.36Å; K571-F575 WeakPolarHBondContact O-CG 3.48Å; K571-F575 PolarHBondContact O-N 3.01Å; H573-F575 PolarHBondContact O-N 3.43Å; H573-F575 VanDerWaalsContact O-N 3.12Å; F575-G577 PolarHBondContact O-N 2.99Å; F575-M852 HydrophobicContact CD1-CE 3.68Å; F575-M852 HydrophobicContact CD1-CG 3.82Å; F575-M852 HydrophobicContact CD1-SD 3.78Å; F575-M852 HydrophobicContact CD2-CE 3.68Å; F575-M852 HydrophobicContact CE1-CE 3.65Å; F575-M852 HydrophobicContact CE1-CG 3.91Å; F575-M852 HydrophobicContact CE1-SD 3.35Å; F575-M852 WeakPolarHBondContact CE1-SD 3.47Å; F575-M852 HydrophobicContact CE2-CE 3.59Å; F575-M852 HydrophobicContact CE2-SD 4.27Å; F575-M852 HydrophobicContact CG-CE 3.75Å; F575-M852 HydrophobicContact CG-SD 4.45Å; F575-M852 HydrophobicContact CZ-CE 3.6Å; F575-M852 HydrophobicContact CZ-SD 3.64Å
576	G	46.5	Very low	53.6	Low	65 Å²	65	89.4 Å²	89.4	67%	0.67	48%	0.478	S	S	*	.			trans	-73.9	46.6	-177	0	0	0	0	0	116	K572 H573	K572-G576 WeakPolarHBondContact O-CA 3.47Å; K572-G576 PolarHBondContact O-N 3.09Å; H573-G576 PolarHBondContact O-N 3.24Å
577	G	48.4	Very low	53.6	Low	41 Å²	41	95 Å²	95	42%	0.423	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-103.2	155.2	-178.2	0	0	0	0	0	114.5	F575	F575-G577 PolarHBondContact O-N 2.99Å
578	N	44	Very low	53.7	Low	169 Å²	169	96.2 Å²	96.2	90%	0.904	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-67.6	163.8	168.8	-99.5	-37.2	0	0	0	111.9	A580	N578-A580 PolarHBondContact O-N 3.11Å
579	K	40.9	Very low	54.3	Low	211 Å²	211	96.5 Å²	96.5	92%	0.917	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-50.6	120.1	-179.1	-68.7	178.9	178.8	175.7	0	111.8
580	A	41.4	Very low	54.7	Low	52 Å²	52	95.2 Å²	95.2	43%	0.43	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-61.8	139.7	-174.9	0	0	0	0	0	113.3	N578 T854	N578-A580 PolarHBondContact O-N 3.11Å; A580-T854 HydrophobicContact CB-CG2 4.02Å
581	S	37.8	Very low	55	Low	68 Å²	68	100 Å²	100	48%	0.476	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-102.8	133.8	169.1	176.9	0	0	0	0	108.9	G583	S581-G583 PolarHBondContact O-N 2.94Å; S581-G583 VanDerWaalsContact O-N 3.09Å
582	Y	43.5	Very low	55.6	Low	191 Å²	191	102.7 Å²	102.7	75%	0.749	55%	0.546	S	S	*	.			trans	-74	104.4	178.4	-81.9	-90	0	0	0	111.5	T854	Y582-T854 HydrophobicContact CD1-CG2 4.45Å; Y582-T854 HydrophobicContact CE1-CG2 4.27Å
583	G	48.8	Very low	56.1	Low	48 Å²	48	99.8 Å²	99.8	50%	0.495	53%	0.534	S	S	.	.	S	Bend	trans	78.7	169.3	166.6	0	0	0	0	0	116	S581 K585	S581-G583 PolarHBondContact O-N 2.94Å; S581-G583 VanDerWaalsContact O-N 3.09Å; G583-K585 PolarHBondContact O-N 3.06Å
584	K	43.8	Very low	56.9	Low	132 Å²	132	97 Å²	97	57%	0.574	52%	0.519	S	S	*	.			trans	-65	127.9	170	-76	173	180	159.4	0	109.7	T586 D881	K584-T586 VanDerWaalsContact C-N 3.26Å; K584-T586 PolarHBondContact O-N 2.79Å; K584-D881 IonicContact NZ-OD2 2.78Å; K584-D881 PolarHBondContact NZ-OD2 3Å
585	K	45.1	Very low	58	Low	191 Å²	191	101 Å²	101	83%	0.83	54%	0.537	S	S	*	.			trans	-72.8	84	162.7	-69.3	-174.1	179.3	-178.3	0	109.4	G583	G583-K585 PolarHBondContact O-N 3.06Å
586	T	49.8	Very low	58.9	Low	81 Å²	81	100.5 Å²	100.5	50%	0.497	54%	0.542	S	S	.	.			trans	-57.9	135.2	169.1	47.7	0	0	0	0	110.6	K584 Q593	K584-T586 VanDerWaalsContact C-N 3.26Å; K584-T586 PolarHBondContact O-N 2.79Å; T586-Q593 PolarHBondContact OG1-NE2 3.18Å
587	Q	51.5	Low	60.6	Low	205 Å²	205	99 Å²	99	96%	0.958	52%	0.518	S	S	*	.	S	Bend	trans	-80.8	-18.1	175.6	-67.1	177.5	-12.1	0	0	113.3
588	L	60.3	Low	62.3	Low	103 Å²	103	97.8 Å²	97.8	54%	0.539	50%	0.502	S	S	.	.	S	Bend	trans	-68.3	142.7	174.3	-67.1	167.5	0	0	0	111.3	Q593	L588-Q593 HydrophobicContact CB-CG 4.14Å; L588-Q593 PolarHBondContact O-NE2 3.46Å
589	S	74.6	Confident	64.3	Low	55 Å²	55	89.7 Å²	89.7	39%	0.385	46%	0.459	S	S	.	.			trans	-64.2	158.9	172.6	72.9	0	0	0	0	111.9	L591 E592 Q593	S589-L591 PolarHBondContact O-N 3.37Å; S589-E592 WeakPolarHBondContact CA-OE2 3.48Å; S589-E592 WeakPolarHBondContact CB-OE2 3.4Å; S589-E592 PolarHBondContact N-OE2 3.3Å; S589-E592 PolarHBondContact O-N 3.27Å; S589-E592 VanDerWaalsContact OG-CD 3.28Å; S589-E592 VanDerWaalsContact OG-CG 3.3Å; S589-E592 WeakPolarHBondContact OG-CG 3.43Å; S589-E592 PolarHBondContact OG-N 3.34Å; S589-E592 PolarHBondContact OG-OE2 2.66Å; S589-Q593 VanDerWaalsContact O-CG 3.3Å; S589-Q593 WeakPolarHBondContact O-CG 3.42Å; S589-Q593 PolarHBondContact O-N 3.47Å
590	I	76.1	Confident	66.5	Low	77 Å²	77	83.7 Å²	83.7	40%	0.395	43%	0.431	S	S	.	.	H	α-helix	trans	-60.9	-33.1	177.8	-65.9	177.3	0	0	0	111.3	Q593 R594 E665	I590-Q593 WeakPolarHBondContact O-CB 3.38Å; I590-Q593 PolarHBondContact O-N 2.98Å; I590-R594 WeakPolarHBondContact O-CG 3.39Å; I590-R594 PolarHBondContact O-N 2.71Å; I590-E665 HydrophobicContact CG2-CB 4.32Å; I590-E665 HydrophobicContact CG2-CG 3.95Å
591	L	76.6	Confident	68.8	Low	114 Å²	114	89.7 Å²	89.7	60%	0.597	45%	0.448	S	S	*	.	H	α-helix	trans	-71	-51	-178.9	-134.4	165.6	0	0	0	110.8	S589 Q593 R594 E595	S589-L591 PolarHBondContact O-N 3.37Å; L591-Q593 PolarHBondContact O-N 2.87Å; L591-R594 PolarHBondContact O-N 3.45Å; L591-E595 HydrophobicContact CD2-CG 4.06Å; L591-E595 WeakPolarHBondContact O-CG 3.44Å; L591-E595 PolarHBondContact O-N 3.28Å
592	E	81.2	Confident	71.2	Confident	98 Å²	98	87.9 Å²	87.9	46%	0.458	43%	0.433	S	S	.	.	H	α-helix	trans	-57	-36.9	173.7	-66.4	160.6	124.2	0	0	111.9	S589 S596	S589-E592 WeakPolarHBondContact CA-OE2 3.48Å; S589-E592 WeakPolarHBondContact CB-OE2 3.4Å; S589-E592 PolarHBondContact N-OE2 3.3Å; S589-E592 PolarHBondContact O-N 3.27Å; S589-E592 VanDerWaalsContact OG-CD 3.28Å; S589-E592 VanDerWaalsContact OG-CG 3.3Å; S589-E592 WeakPolarHBondContact OG-CG 3.43Å; S589-E592 PolarHBondContact OG-N 3.34Å; S589-E592 PolarHBondContact OG-OE2 2.66Å; E592-S596 WeakPolarHBondContact O-CB 3.44Å; E592-S596 PolarHBondContact O-N 3Å
593	Q	77.5	Confident	73.4	Confident	29 Å²	29	81.1 Å²	81.1	14%	0.136	41%	0.407	C	S	.	.	H	α-helix	trans	-61.8	-46.7	173.4	-73	174.1	42.8	0	0	112	T586 L588 S589 I590 L591 S596	T586-Q593 PolarHBondContact OG1-NE2 3.18Å; L588-Q593 HydrophobicContact CB-CG 4.14Å; L588-Q593 PolarHBondContact O-NE2 3.46Å; S589-Q593 VanDerWaalsContact O-CG 3.3Å; S589-Q593 WeakPolarHBondContact O-CG 3.42Å; S589-Q593 PolarHBondContact O-N 3.47Å; I590-Q593 WeakPolarHBondContact O-CB 3.38Å; I590-Q593 PolarHBondContact O-N 2.98Å; L591-Q593 PolarHBondContact O-N 2.87Å; Q593-S596 WeakPolarHBondContact O-CB 3.44Å; Q593-S596 PolarHBondContact O-N 3.38Å; Q593-S596 PolarHBondContact O-OG 3.5Å
594	R	80.6	Confident	75.5	Confident	36 Å²	36	86.6 Å²	86.6	14%	0.136	42%	0.42	C	S	.	.	H	α-helix	trans	-63.1	-45.3	177.4	-72.2	178.3	69.7	-165.9	-8.2	111.4	I590 L591 S596 L597 Q632 E636 E665	I590-R594 WeakPolarHBondContact O-CG 3.39Å; I590-R594 PolarHBondContact O-N 2.71Å; L591-R594 PolarHBondContact O-N 3.45Å; R594-S596 PolarHBondContact O-N 3.11Å; R594-L597 WeakPolarHBondContact O-CB 3.17Å; R594-L597 PolarHBondContact O-N 2.96Å; R594-Q632 VanDerWaalsContact NH1-OE1 3.13Å; R594-E636 IonicContact CZ-OE1 2.62Å; R594-E636 IonicContact NH1-OE1 4Å; R594-E636 IonicContact NH2-OE1 2.66Å; R594-E636 PolarHBondContact NH2-OE1 3.43Å; R594-E665 HydrophobicContact CG-CG 4.47Å
595	E	84.6	Confident	77.8	Confident	89 Å²	89	85.9 Å²	85.9	42%	0.416	42%	0.419	S	S	.	.	H	α-helix	trans	-63.8	-30.3	177.3	-62.5	-158.4	123.9	0	0	112.8	L591 L597 Y600	L591-E595 HydrophobicContact CD2-CG 4.06Å; L591-E595 WeakPolarHBondContact O-CG 3.44Å; L591-E595 PolarHBondContact O-N 3.28Å; E595-L597 PolarHBondContact O-N 3.42Å; E595-Y600 VanDerWaalsContact CA-CD1 3.46Å; E595-Y600 HydrophobicContact CB-CD1 3.78Å; E595-Y600 HydrophobicContact CB-CE1 3.62Å; E595-Y600 HydrophobicContact CG-CD1 4.08Å; E595-Y600 HydrophobicContact CG-CE1 3.46Å; E595-Y600 VanDerWaalsContact CG-CE1 3.46Å; E595-Y600 HydrophobicContact CG-CE2 4.47Å; E595-Y600 WeakPolarHBondContact O-CD1 3.33Å; E595-Y600 VanDerWaalsContact OE1-CE1 3.29Å; E595-Y600 WeakPolarHBondContact OE1-CE1 3.34Å; E595-Y600 VanDerWaalsContact OE1-CZ 3.26Å; E595-Y600 PolarHBondContact OE1-OH 2.75Å
596	S	83.6	Confident	80	Confident	56 Å²	56	76.9 Å²	76.9	39%	0.392	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.5	177.3	85.1	0	0	0	0	113.9	E592 Q593 R594 R772	E592-S596 WeakPolarHBondContact O-CB 3.44Å; E592-S596 PolarHBondContact O-N 3Å; Q593-S596 WeakPolarHBondContact O-CB 3.44Å; Q593-S596 PolarHBondContact O-N 3.38Å; Q593-S596 PolarHBondContact O-OG 3.5Å; R594-S596 PolarHBondContact O-N 3.11Å; S596-R772 PolarHBondContact O-NH1 3.37Å; S596-R772 PolarHBondContact O-NH2 2.98Å
597	L	83	Confident	82	Confident	33 Å²	33	75.2 Å²	75.2	17%	0.173	37%	0.367	C	S	.	.	S	Bend	trans	-73.7	141.9	-173.2	-66.4	172.7	0	0	0	112.2	R594 E595 I599 Y600 Q629	R594-L597 WeakPolarHBondContact O-CB 3.17Å; R594-L597 PolarHBondContact O-N 2.96Å; E595-L597 PolarHBondContact O-N 3.42Å; L597-I599 HydrophobicContact CB-CG2 4.15Å; L597-I599 PolarHBondContact O-N 3.02Å; L597-I599 VanDerWaalsContact O-N 3.12Å; L597-Y600 WeakPolarHBondContact O-CB 3.34Å; L597-Y600 PolarHBondContact O-N 2.93Å; L597-Q629 HydrophobicContact CD1-CG 3.57Å
598	P	82.8	Confident	83.9	Confident	15 Å²	15	71.2 Å²	71.2	10%	0.097	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.8	-36.7	-179.8	-28.5	35.6	0	0	0	114.5	Y600 R772	P598-Y600 VanDerWaalsContact C-N 3.29Å; P598-Y600 PolarHBondContact O-N 3.03Å; P598-R772 HydrophobicContact CG-CB 4.28Å; P598-R772 HydrophobicContact CG-CG 4Å
599	I	87.1	Confident	85.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-64.8	-26.2	179.4	-164.6	169.3	0	0	0	114.2	L597 K601 L602 K603 L606 S624 Q629 I630 Y633 I769	L597-I599 HydrophobicContact CB-CG2 4.15Å; L597-I599 PolarHBondContact O-N 3.02Å; L597-I599 VanDerWaalsContact O-N 3.12Å; I599-K601 VanDerWaalsContact C-N 3.3Å; I599-K601 PolarHBondContact O-N 2.72Å; I599-L602 CarbonylContact O-C 3.58Å; I599-L602 PolarHBondContact O-N 3.5Å; I599-K603 PolarHBondContact O-N 3.41Å; I599-L606 HydrophobicContact CD1-CD2 4.22Å; I599-S624 WeakPolarHBondContact CB-O 3.24Å; I599-S624 WeakPolarHBondContact CG2-O 3.1Å; I599-S624 PolarHBondContact N-O 2.86Å; I599-Q629 HydrophobicContact CD1-CB 4.5Å; I599-Q629 HydrophobicContact CG2-CB 3.78Å; I599-Q629 HydrophobicContact CG2-CG 3.77Å; I599-I630 HydrophobicContact CD1-CD1 4.05Å; I599-I630 HydrophobicContact CD1-CG1 3.45Å; I599-I630 VanDerWaalsContact CD1-CG1 3.45Å; I599-Y633 HydrophobicContact CG1-CE2 4.36Å; I599-Y633 HydrophobicContact CG2-CE2 4.27Å; I599-I769 HydrophobicContact CB-CD1 4.46Å; I599-I769 HydrophobicContact CD1-CD1 3.67Å; I599-I769 HydrophobicContact CG1-CD1 3.85Å
600	Y	87.6	Confident	86.2	Confident	84 Å²	84	64.7 Å²	64.7	33%	0.329	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-62.8	-38.5	-177.6	-174.2	-124.7	0	0	0	112	E595 L597 P598 L602 K603 Y633	E595-Y600 VanDerWaalsContact CA-CD1 3.46Å; E595-Y600 HydrophobicContact CB-CD1 3.78Å; E595-Y600 HydrophobicContact CB-CE1 3.62Å; E595-Y600 HydrophobicContact CG-CD1 4.08Å; E595-Y600 HydrophobicContact CG-CE1 3.46Å; E595-Y600 VanDerWaalsContact CG-CE1 3.46Å; E595-Y600 HydrophobicContact CG-CE2 4.47Å; E595-Y600 WeakPolarHBondContact O-CD1 3.33Å; E595-Y600 VanDerWaalsContact OE1-CE1 3.29Å; E595-Y600 WeakPolarHBondContact OE1-CE1 3.34Å; E595-Y600 VanDerWaalsContact OE1-CZ 3.26Å; E595-Y600 PolarHBondContact OE1-OH 2.75Å; L597-Y600 WeakPolarHBondContact O-CB 3.34Å; L597-Y600 PolarHBondContact O-N 2.93Å; P598-Y600 VanDerWaalsContact C-N 3.29Å; P598-Y600 PolarHBondContact O-N 3.03Å; Y600-L602 PolarHBondContact O-N 3.01Å; Y600-K603 HydrophobicContact CD2-CD 4.2Å; Y600-K603 HydrophobicContact CE2-CD 4.13Å; Y600-K603 VanDerWaalsContact O-CB 3.28Å; Y600-K603 WeakPolarHBondContact O-CB 3.39Å; Y600-K603 PolarHBondContact O-N 3.31Å; Y600-K603 VanDerWaalsContact O-N 3.09Å; Y600-Y633 WeakPolarHBondContact CD2-OH 3.37Å
601	K	88.4	Confident	86.9	Confident	179 Å²	179	66.7 Å²	66.7	78%	0.778	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.4	175.1	-63.1	-172.6	175.1	-170.1	0	114.3	I599	I599-K601 VanDerWaalsContact C-N 3.3Å; I599-K601 PolarHBondContact O-N 2.72Å
602	L	89.6	Confident	87.6	Confident	29 Å²	29	65.9 Å²	65.9	15%	0.152	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-117.4	10.5	-178.4	-62.8	179.3	0	0	0	112.4	I599 Y600 E604 Q605 L606 F767 P770	I599-L602 CarbonylContact O-C 3.58Å; I599-L602 PolarHBondContact O-N 3.5Å; Y600-L602 PolarHBondContact O-N 3.01Å; L602-E604 PolarHBondContact O-N 2.96Å; L602-Q605 PolarHBondContact O-N 3.03Å; L602-L606 WeakPolarHBondContact O-CB 3.46Å; L602-L606 PolarHBondContact O-N 3.36Å; L602-F767 HydrophobicContact CB-CE1 4.37Å; L602-F767 HydrophobicContact CB-CZ 4.09Å; L602-F767 HydrophobicContact CD1-CE1 4.33Å; L602-F767 HydrophobicContact CD1-CZ 4.43Å; L602-P770 HydrophobicContact CD1-CG 4.42Å
603	K	89.6	Confident	88	Confident	49 Å²	49	63.9 Å²	63.9	21%	0.213	31%	0.309	C	S	.	.	H	α-helix	trans	-52.9	-50.9	-175.8	177.3	176.6	-177	-178.9	0	112.7	I599 Y600 L606 I607 Y633 E636	I599-K603 PolarHBondContact O-N 3.41Å; Y600-K603 HydrophobicContact CD2-CD 4.2Å; Y600-K603 HydrophobicContact CE2-CD 4.13Å; Y600-K603 VanDerWaalsContact O-CB 3.28Å; Y600-K603 WeakPolarHBondContact O-CB 3.39Å; Y600-K603 PolarHBondContact O-N 3.31Å; Y600-K603 VanDerWaalsContact O-N 3.09Å; K603-L606 PolarHBondContact O-N 3.34Å; K603-I607 HydrophobicContact CG-CD1 3.89Å; K603-I607 VanDerWaalsContact O-CG1 3.3Å; K603-I607 WeakPolarHBondContact O-CG1 3.45Å; K603-I607 PolarHBondContact O-N 3.12Å; K603-Y633 HydrophobicContact CB-CD2 4.14Å; K603-Y633 HydrophobicContact CB-CE2 3.99Å; K603-Y633 HydrophobicContact CD-CD1 3.89Å; K603-Y633 HydrophobicContact CD-CD2 4.17Å; K603-Y633 HydrophobicContact CD-CE1 3.95Å; K603-Y633 HydrophobicContact CD-CE2 4.2Å; K603-Y633 HydrophobicContact CD-CG 4.03Å; K603-Y633 HydrophobicContact CG-CD1 4.29Å; K603-Y633 HydrophobicContact CG-CD2 3.7Å; K603-Y633 HydrophobicContact CG-CE2 3.95Å; K603-Y633 HydrophobicContact CG-CG 3.9Å; K603-E636 WeakPolarHBondContact CE-OE2 3.42Å; K603-E636 IonicContact NZ-OE2 2.84Å; K603-E636 PolarHBondContact NZ-OE2 2.87Å
604	E	91.4	Very high	88.7	Confident	163 Å²	163	65.4 Å²	65.4	76%	0.762	32%	0.316	S	S	*	.	H	α-helix	trans	-65.7	-45.8	-178.2	-62.5	178.9	167.2	0	0	111.7	L602 L606 I607 Q608	L602-E604 PolarHBondContact O-N 2.96Å; E604-L606 VanDerWaalsContact C-N 3.3Å; E604-L606 PolarHBondContact O-N 2.91Å; E604-I607 PolarHBondContact O-N 3.45Å; E604-Q608 PolarHBondContact O-N 2.85Å
605	Q	91.9	Very high	89.3	Confident	118 Å²	118	64.4 Å²	64.4	55%	0.551	31%	0.313	S	S	*	.	H	α-helix	trans	-62.6	-36.5	177.6	-62.5	-177.5	6.5	0	0	112.1	L602 A609 F767	L602-Q605 PolarHBondContact O-N 3.03Å; Q605-A609 VanDerWaalsContact O-CB 3.23Å; Q605-A609 WeakPolarHBondContact O-CB 3.38Å; Q605-A609 PolarHBondContact O-N 3.36Å; Q605-F767 HydrophobicContact CB-CE2 4.12Å; Q605-F767 HydrophobicContact CB-CZ 4.21Å
606	L	91.4	Very high	89.7	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-46	174	177.5	71.6	0	0	0	111.4	I599 L602 K603 E604 Q608 A609 V610 L616 V618 I630 F767	I599-L606 HydrophobicContact CD1-CD2 4.22Å; L602-L606 WeakPolarHBondContact O-CB 3.46Å; L602-L606 PolarHBondContact O-N 3.36Å; K603-L606 PolarHBondContact O-N 3.34Å; E604-L606 VanDerWaalsContact C-N 3.3Å; E604-L606 PolarHBondContact O-N 2.91Å; L606-Q608 VanDerWaalsContact C-N 3.3Å; L606-Q608 PolarHBondContact O-N 3.34Å; L606-A609 PolarHBondContact O-N 3.12Å; L606-V610 HydrophobicContact CD1-CG2 4.29Å; L606-V610 WeakPolarHBondContact O-CG2 3.22Å; L606-V610 PolarHBondContact O-N 3.28Å; L606-L616 HydrophobicContact CD1-CD2 4.18Å; L606-V618 HydrophobicContact CD1-CG2 4.3Å; L606-I630 HydrophobicContact CD2-CG1 3.92Å; L606-F767 HydrophobicContact CB-CE1 4.13Å; L606-F767 HydrophobicContact CB-CZ 3.92Å; L606-F767 HydrophobicContact CD1-CD1 4.04Å; L606-F767 HydrophobicContact CD1-CE1 3.97Å; L606-F767 HydrophobicContact CD1-CZ 4.41Å
607	I	91.9	Very high	90.2	Very high	46 Å²	46	57.8 Å²	57.8	24%	0.236	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-41.6	178.6	-69.6	165.4	0	0	0	110.2	K603 E604 H611 A637	K603-I607 HydrophobicContact CG-CD1 3.89Å; K603-I607 VanDerWaalsContact O-CG1 3.3Å; K603-I607 WeakPolarHBondContact O-CG1 3.45Å; K603-I607 PolarHBondContact O-N 3.12Å; E604-I607 PolarHBondContact O-N 3.45Å; I607-H611 WeakPolarHBondContact O-CB 3.43Å; I607-H611 PolarHBondContact O-N 2.7Å; I607-A637 HydrophobicContact CD1-CB 4.45Å; I607-A637 HydrophobicContact CG2-CB 4.15Å
608	Q	92.3	Very high	90.6	Very high	122 Å²	122	56.2 Å²	56.2	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-64.8	-48	173.7	-175	173.8	1.3	0	0	111.9	E604 L606 V610 H611 D612	E604-Q608 PolarHBondContact O-N 2.85Å; L606-Q608 VanDerWaalsContact C-N 3.3Å; L606-Q608 PolarHBondContact O-N 3.34Å; Q608-V610 VanDerWaalsContact C-N 3.27Å; Q608-V610 PolarHBondContact O-N 3.38Å; Q608-H611 WeakPolarHBondContact O-CB 3.42Å; Q608-H611 PolarHBondContact O-N 3.14Å; Q608-D612 VanDerWaalsContact CG-OD2 3.32Å; Q608-D612 WeakPolarHBondContact CG-OD2 3.33Å; Q608-D612 PolarHBondContact NE2-OD2 3.13Å; Q608-D612 PolarHBondContact O-N 3.21Å
609	A	91.8	Very high	90.8	Very high	18 Å²	18	56.7 Å²	56.7	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-35	178.1	0	0	0	0	0	112.9	Q605 L606 N613 L616 F767	Q605-A609 VanDerWaalsContact O-CB 3.23Å; Q605-A609 WeakPolarHBondContact O-CB 3.38Å; Q605-A609 PolarHBondContact O-N 3.36Å; L606-A609 PolarHBondContact O-N 3.12Å; A609-N613 WeakPolarHBondContact O-CB 3.42Å; A609-N613 PolarHBondContact O-N 2.86Å; A609-N613 PolarHBondContact O-ND2 3.32Å; A609-L616 HydrophobicContact CB-CD1 4.25Å; A609-L616 HydrophobicContact CB-CD2 4.02Å; A609-F767 HydrophobicContact CB-CD2 4.02Å; A609-F767 HydrophobicContact CB-CE2 4.28Å
610	V	91.4	Very high	90.6	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-75.1	-33.2	172.7	175.6	0	0	0	0	111.7	L606 Q608 N613 L616 L634 I713 K744 I746	L606-V610 HydrophobicContact CD1-CG2 4.29Å; L606-V610 WeakPolarHBondContact O-CG2 3.22Å; L606-V610 PolarHBondContact O-N 3.28Å; Q608-V610 VanDerWaalsContact C-N 3.27Å; Q608-V610 PolarHBondContact O-N 3.38Å; V610-N613 VanDerWaalsContact O-O 3.05Å; V610-L616 HydrophobicContact CG2-CD2 3.53Å; V610-L634 HydrophobicContact CB-CD2 4.11Å; V610-L634 HydrophobicContact CG1-CD2 3.68Å; V610-L634 HydrophobicContact CG2-CD2 4.31Å; V610-I713 HydrophobicContact CG1-CD1 4.32Å; V610-K744 HydrophobicContact CG1-CD 4.04Å; V610-K744 VanDerWaalsContact O-CD 3.29Å; V610-K744 WeakPolarHBondContact O-CD 3.22Å; V610-K744 WeakPolarHBondContact O-CE 3.32Å; V610-K744 PolarHBondContact O-NZ 3.41Å; V610-I746 HydrophobicContact CG1-CD1 4.14Å; V610-I746 HydrophobicContact CG2-CD1 3.75Å; V610-I746 HydrophobicContact CG2-CG1 4.44Å
611	H	90	Very high	90.1	Very high	120 Å²	120	56 Å²	56	56%	0.556	27%	0.269	S	S	*	.	H	α-helix	trans	-64	-50.7	174.5	177.7	-90.4	0	0	0	111.7	I607 Q608 N613 Y639 K744	I607-H611 WeakPolarHBondContact O-CB 3.43Å; I607-H611 PolarHBondContact O-N 2.7Å; Q608-H611 WeakPolarHBondContact O-CB 3.42Å; Q608-H611 PolarHBondContact O-N 3.14Å; H611-N613 PolarHBondContact O-N 2.97Å; H611-Y639 WeakPolarHBondContact CA-OH 3.46Å; H611-K744 PolarHBondContact O-NZ 3.45Å
612	D	91.3	Very high	89.5	Confident	97 Å²	97	49.2 Å²	49.2	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-77.6	-22.6	-169.2	-61.6	-16.3	0	0	0	113	Q608	Q608-D612 VanDerWaalsContact CG-OD2 3.32Å; Q608-D612 WeakPolarHBondContact CG-OD2 3.33Å; Q608-D612 PolarHBondContact NE2-OD2 3.13Å; Q608-D612 PolarHBondContact O-N 3.21Å
613	N	91	Very high	88.7	Confident	56 Å²	56	50.8 Å²	50.8	30%	0.299	27%	0.266	S	S	.	.			trans	-112.7	150.1	-177.9	-59.2	-76.2	0	0	0	112.8	A609 V610 H611 K744 P765	A609-N613 WeakPolarHBondContact O-CB 3.42Å; A609-N613 PolarHBondContact O-N 2.86Å; A609-N613 PolarHBondContact O-ND2 3.32Å; V610-N613 VanDerWaalsContact O-O 3.05Å; H611-N613 PolarHBondContact O-N 2.97Å; N613-K744 PolarHBondContact O-NZ 3.49Å; N613-P765 HydrophobicContact CB-CG 4.19Å; N613-P765 WeakPolarHBondContact OD1-CG 3.18Å
614	Q	91.1	Very high	88.2	Confident	61 Å²	61	48.6 Å²	48.6	29%	0.285	26%	0.257	S	S	.	.	S	Bend	trans	-87.6	-36.9	173.9	-159.6	-170.2	-2.2	0	0	112.4	V737 R740 M743 K744 L745	Q614-V737 VanDerWaalsContact CD-CG1 3.46Å; Q614-V737 HydrophobicContact CG-CG1 4.05Å; Q614-V737 VanDerWaalsContact NE2-CG1 3.34Å; Q614-V737 PolarHBondContact NE2-O 2.82Å; Q614-R740 PolarHBondContact NE2-O 2.87Å; Q614-M743 VanDerWaalsContact CG-O 3.24Å; Q614-M743 WeakPolarHBondContact CG-O 3.27Å; Q614-M743 PolarHBondContact NE2-O 3.29Å; Q614-M743 VanDerWaalsContact NE2-O 3.11Å; Q614-K744 WeakPolarHBondContact O-CA 3.44Å; Q614-L745 PolarHBondContact O-N 2.67Å
615	I	93.6	Very high	87.7	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.077	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.5	171.3	-52.9	166.4	0	0	0	108.1	V737 L745 F761 Y762 A764	I615-V737 HydrophobicContact CD1-CG1 4.04Å; I615-V737 HydrophobicContact CG1-CG1 3.87Å; I615-L745 CarbonylContact C-O 3.32Å; I615-L745 VanDerWaalsContact CA-O 3.31Å; I615-L745 WeakPolarHBondContact CA-O 3.31Å; I615-L745 HydrophobicContact CG1-CB 4.4Å; I615-L745 HydrophobicContact CG2-CD2 4.38Å; I615-F761 HydrophobicContact CD1-CB 4.11Å; I615-F761 HydrophobicContact CD1-CD1 4.03Å; I615-F761 HydrophobicContact CD1-CG 4.44Å; I615-F761 HydrophobicContact CG2-CB 4.07Å; I615-F761 HydrophobicContact CG2-CD1 4.47Å; I615-F761 HydrophobicContact CG2-CG 4.19Å; I615-Y762 HydrophobicContact CD1-CD2 4.37Å; I615-A764 HydrophobicContact CB-CB 4.06Å; I615-A764 HydrophobicContact CG2-CB 3.88Å
616	L	93.4	Very high	87.4	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.3	174.5	-172.4	68.4	0	0	0	110.7	L606 A609 V610 V618 L745 I746 V747 P765 F767	L606-L616 HydrophobicContact CD1-CD2 4.18Å; A609-L616 HydrophobicContact CB-CD1 4.25Å; A609-L616 HydrophobicContact CB-CD2 4.02Å; V610-L616 HydrophobicContact CG2-CD2 3.53Å; L616-V618 HydrophobicContact CD2-CG2 4.06Å; L616-V618 HydrophobicContact CG-CG2 4.2Å; L616-L745 PolarHBondContact N-O 3Å; L616-I746 WeakPolarHBondContact O-CA 3.45Å; L616-V747 PolarHBondContact O-N 2.71Å; L616-P765 HydrophobicContact CD1-CB 4.46Å; L616-P765 HydrophobicContact CD1-CG 4.03Å; L616-F767 HydrophobicContact CD1-CB 4.19Å; L616-F767 HydrophobicContact CD2-CB 4.43Å; L616-F767 HydrophobicContact CG-CB 4.41Å
617	I	93.1	Very high	87.2	Confident	1 Å²	1	37 Å²	37	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.1	175.2	-64.1	163.4	0	0	0	108.3	V747 A754 F757 A764 P765 I766 F767	I617-V747 CarbonylContact C-O 3.52Å; I617-V747 WeakPolarHBondContact CA-O 3.3Å; I617-V747 HydrophobicContact CG1-CB 4.44Å; I617-A754 HydrophobicContact CG2-CB 4.15Å; I617-F757 VanDerWaalsContact CD1-C 3.43Å; I617-F757 HydrophobicContact CD1-CB 3.8Å; I617-F757 HydrophobicContact CG1-CB 4.42Å; I617-A764 HydrophobicContact CD1-CB 3.99Å; I617-A764 HydrophobicContact CG1-CB 4.4Å; I617-P765 PolarHBondContact N-O 3.25Å; I617-I766 HydrophobicContact CB-CG1 4.48Å; I617-I766 CarbonylContact O-C 3.59Å; I617-I766 WeakPolarHBondContact O-CA 3.5Å; I617-F767 PolarHBondContact O-N 3.5Å
618	V	91.3	Very high	87	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.7	179.6	-175.2	0	0	0	0	110.2	L606 L616 K626 I630 I746 V747 T748 S749 F767 I769	L606-V618 HydrophobicContact CD1-CG2 4.3Å; L616-V618 HydrophobicContact CD2-CG2 4.06Å; L616-V618 HydrophobicContact CG-CG2 4.2Å; V618-K626 HydrophobicContact CG1-CD 4.46Å; V618-I630 HydrophobicContact CG1-CD1 4.35Å; V618-I746 HydrophobicContact CG2-CG2 3.9Å; V618-V747 PolarHBondContact N-O 3.4Å; V618-T748 HydrophobicContact CB-CG2 3.69Å; V618-T748 HydrophobicContact CG1-CG2 4.47Å; V618-T748 HydrophobicContact CG2-CG2 4.1Å; V618-T748 WeakPolarHBondContact O-CA 3.36Å; V618-S749 PolarHBondContact O-N 2.91Å; V618-F767 CarbonylContact C-O 3.56Å; V618-F767 WeakPolarHBondContact CA-O 3.17Å; V618-F767 HydrophobicContact CG1-CD1 4.26Å; V618-F767 HydrophobicContact CG2-CB 4.39Å; V618-I769 HydrophobicContact CG1-CD1 3.54Å; V618-I769 HydrophobicContact CG1-CG1 4.09Å
619	I	88.6	Confident	86.9	Confident	24 Å²	24	30.2 Å²	30.2	12%	0.123	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	134.9	166.6	-50.8	176.1	0	0	0	108	A754 I766 F767 T768 I769	I619-A754 HydrophobicContact CD1-CB 3.47Å; I619-A754 VanDerWaalsContact CD1-CB 3.47Å; I619-A754 HydrophobicContact CG1-CB 3.73Å; I619-I766 HydrophobicContact CD1-CG2 3.44Å; I619-I766 VanDerWaalsContact CD1-CG2 3.44Å; I619-I766 HydrophobicContact CG1-CG2 3.77Å; I619-F767 PolarHBondContact N-O 2.91Å; I619-T768 HydrophobicContact CB-CG2 4.44Å; I619-I769 PolarHBondContact O-N 3.03Å
620	G	83.1	Confident	86.9	Confident	2 Å²	2	29.4 Å²	29.4	2%	0.021	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	142	165.6	0	0	0	0	0	112	K626 S749	G620-K626 PolarHBondContact O-NZ 3.47Å; G620-S749 PolarHBondContact N-O 2.73Å
621	E	76.9	Confident	87	Confident	68 Å²	68	29.3 Å²	29.3	32%	0.318	17%	0.168	S	C	.	.			trans	-57.8	151.9	-179.5	-64.4	179.6	171	0	0	112	G623 S624 G771 R772 T773	E621-G623 PolarHBondContact O-N 2.77Å; E621-S624 VanDerWaalsContact O-CB 3.26Å; E621-S624 WeakPolarHBondContact O-CB 3.49Å; E621-S624 PolarHBondContact O-N 2.99Å; E621-S624 VanDerWaalsContact O-N 3.11Å; E621-S624 PolarHBondContact O-OG 3.11Å; E621-G771 WeakPolarHBondContact OE2-CA 3.45Å; E621-R772 PolarHBondContact OE2-N 3Å; E621-T773 PolarHBondContact OE1-OG1 3.28Å; E621-T773 VanDerWaalsContact OE1-OG1 3.12Å; E621-T773 WeakPolarHBondContact OE2-CG2 3.49Å; E621-T773 PolarHBondContact OE2-N 3.27Å; E621-T773 PolarHBondContact OE2-OG1 2.87Å
622	T	74.6	Confident	87	Confident	37 Å²	37	23.6 Å²	23.6	23%	0.227	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	130.5	173	58.8	0	0	0	0	110.2	A750 R925	T622-A750 HydrophobicContact CG2-CB 4.1Å; T622-R925 VanDerWaalsContact CB-NH2 3.32Å; T622-R925 PolarHBondContact OG1-NE 3.37Å; T622-R925 PolarHBondContact OG1-NH2 2.97Å
623	G	73.2	Confident	87.1	Confident	62 Å²	62	19 Å²	19	64%	0.639	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.9	-4.5	-175.6	0	0	0	0	0	115.2	E621 G625	E621-G623 PolarHBondContact O-N 2.77Å; G623-G625 PolarHBondContact O-N 3.48Å
624	S	78.4	Confident	87.1	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.014	10%	0.103	C	C	.	.	S	Bend	trans	-67.7	-14.2	173.3	56.7	0	0	0	0	114.8	I599 E621 K626	I599-S624 WeakPolarHBondContact CB-O 3.24Å; I599-S624 WeakPolarHBondContact CG2-O 3.1Å; I599-S624 PolarHBondContact N-O 2.86Å; E621-S624 VanDerWaalsContact O-CB 3.26Å; E621-S624 WeakPolarHBondContact O-CB 3.49Å; E621-S624 PolarHBondContact O-N 2.99Å; E621-S624 VanDerWaalsContact O-N 3.11Å; E621-S624 PolarHBondContact O-OG 3.11Å; S624-K626 WeakPolarHBondContact OG-CG 3.21Å
625	G	80.8	Confident	87	Confident	8 Å²	8	13.9 Å²	13.9	8%	0.082	9%	0.093	C	C	.	.	S	Bend	trans	104	4.1	179.5	0	0	0	0	0	115.8	G623 T627 T628 Q629	G623-G625 PolarHBondContact O-N 3.48Å; G625-T627 PolarHBondContact O-N 3.01Å; G625-T628 PolarHBondContact O-N 2.86Å; G625-T628 PolarHBondContact O-OG1 2.66Å; G625-Q629 WeakPolarHBondContact O-CB 3.33Å; G625-Q629 PolarHBondContact O-N 3.18Å
626	K	86.8	Confident	86.8	Confident	7 Å²	7	17.3 Å²	17.3	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-43.3	-68.6	-177.3	-52.3	-159.5	-54.1	-75.5	0	113.2	V618 G620 S624 T628 I630 E718 I769	V618-K626 HydrophobicContact CG1-CD 4.46Å; G620-K626 PolarHBondContact O-NZ 3.47Å; S624-K626 WeakPolarHBondContact OG-CG 3.21Å; K626-T628 VanDerWaalsContact C-N 3.35Å; K626-T628 PolarHBondContact O-N 2.96Å; K626-I630 HydrophobicContact CB-CD1 3.94Å; K626-I630 VanDerWaalsContact O-CB 3.25Å; K626-I630 WeakPolarHBondContact O-CB 3.2Å; K626-I630 WeakPolarHBondContact O-CD1 3.5Å; K626-I630 WeakPolarHBondContact O-CG1 3.32Å; K626-I630 PolarHBondContact O-N 2.97Å; K626-E718 IonicContact NZ-OE2 2.65Å; K626-I769 HydrophobicContact CG-CD1 4.29Å
627	T	86.5	Confident	86.5	Confident	24 Å²	24	19.1 Å²	19.1	15%	0.147	12%	0.124	C	C	.	.	H	α-helix	trans	-67	-32.6	-169.6	-29.9	0	0	0	0	113.4	G625 T631 Q649 V658 Y692 D717	G625-T627 PolarHBondContact O-N 3.01Å; T627-T631 PolarHBondContact O-OG1 3.32Å; T627-Q649 VanDerWaalsContact CG2-NE2 3.32Å; T627-V658 HydrophobicContact CG2-CG1 3.94Å; T627-V658 HydrophobicContact CG2-CG2 4.4Å; T627-Y692 HydrophobicContact CG2-CE1 4.36Å; T627-Y692 PolarHBondContact O-OH 2.97Å; T627-D717 WeakPolarHBondContact CB-OD2 3.48Å; T627-D717 WeakPolarHBondContact CG2-OD2 3.33Å; T627-D717 PolarHBondContact OG1-OD2 3.37Å
628	T	87.6	Confident	86.1	Confident	26 Å²	26	20.4 Å²	20.4	16%	0.16	14%	0.137	C	C	.	.	H	α-helix	trans	-83.6	-40.9	-178.8	54.7	0	0	0	0	112.4	G625 K626 T631 Q632 V658 V662	G625-T628 PolarHBondContact O-N 2.86Å; G625-T628 PolarHBondContact O-OG1 2.66Å; K626-T628 VanDerWaalsContact C-N 3.35Å; K626-T628 PolarHBondContact O-N 2.96Å; T628-T631 PolarHBondContact O-OG1 2.88Å; T628-Q632 WeakPolarHBondContact O-CG 3.48Å; T628-Q632 PolarHBondContact O-NE2 2.85Å; T628-V658 HydrophobicContact CG2-CG1 4.28Å; T628-V662 HydrophobicContact CG2-CG2 3.99Å
629	Q	90.4	Very high	85.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-95.9	-32	-171.1	-57.5	-48.6	-66.9	0	0	114.7	L597 I599 G625 T631 Q632 Y633 E665	L597-Q629 HydrophobicContact CD1-CG 3.57Å; I599-Q629 HydrophobicContact CD1-CB 4.5Å; I599-Q629 HydrophobicContact CG2-CB 3.78Å; I599-Q629 HydrophobicContact CG2-CG 3.77Å; G625-Q629 WeakPolarHBondContact O-CB 3.33Å; G625-Q629 PolarHBondContact O-N 3.18Å; Q629-T631 VanDerWaalsContact C-N 3.33Å; Q629-T631 PolarHBondContact O-N 2.83Å; Q629-Q632 PolarHBondContact O-N 3.49Å; Q629-Y633 HydrophobicContact CB-CD2 4.26Å; Q629-Y633 HydrophobicContact CB-CE1 4.11Å; Q629-Y633 HydrophobicContact CB-CE2 3.73Å; Q629-Y633 VanDerWaalsContact O-CG 3.23Å; Q629-Y633 PolarHBondContact O-N 2.79Å; Q629-E665 PolarHBondContact NE2-OE2 2.98Å
630	I	92.1	Very high	85.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.1	-46.6	-176.6	-66.2	173.7	0	0	0	110.4	I599 L606 V618 K626 Q632 Y633 L634 M715 I746 T748	I599-I630 HydrophobicContact CD1-CD1 4.05Å; I599-I630 HydrophobicContact CD1-CG1 3.45Å; I599-I630 VanDerWaalsContact CD1-CG1 3.45Å; L606-I630 HydrophobicContact CD2-CG1 3.92Å; V618-I630 HydrophobicContact CG1-CD1 4.35Å; K626-I630 HydrophobicContact CB-CD1 3.94Å; K626-I630 VanDerWaalsContact O-CB 3.25Å; K626-I630 WeakPolarHBondContact O-CB 3.2Å; K626-I630 WeakPolarHBondContact O-CD1 3.5Å; K626-I630 WeakPolarHBondContact O-CG1 3.32Å; K626-I630 PolarHBondContact O-N 2.97Å; I630-Q632 PolarHBondContact O-N 2.9Å; I630-Y633 PolarHBondContact O-N 3.14Å; I630-L634 HydrophobicContact CG2-CD1 3.72Å; I630-L634 HydrophobicContact CG2-CG 4.44Å; I630-L634 WeakPolarHBondContact O-CB 3.37Å; I630-L634 WeakPolarHBondContact O-CD1 3.1Å; I630-L634 WeakPolarHBondContact O-CG 3.23Å; I630-L634 PolarHBondContact O-N 3.45Å; I630-M715 HydrophobicContact CB-CE 4.29Å; I630-M715 HydrophobicContact CB-SD 3.97Å; I630-M715 HydrophobicContact CD1-CE 4.02Å; I630-M715 HydrophobicContact CG2-SD 3.82Å; I630-I746 HydrophobicContact CG2-CD1 4.25Å; I630-T748 HydrophobicContact CD1-CG2 4.07Å
631	T	92.8	Very high	85	Confident	0 Å²	0	28 Å²	28	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-42.9	176.5	50.1	0	0	0	0	112.6	T627 T628 Q629 A635 I645 C647 I690 Y692 M715	T627-T631 PolarHBondContact O-OG1 3.32Å; T628-T631 PolarHBondContact O-OG1 2.88Å; Q629-T631 VanDerWaalsContact C-N 3.33Å; Q629-T631 PolarHBondContact O-N 2.83Å; T631-A635 WeakPolarHBondContact O-CB 2.75Å; T631-A635 PolarHBondContact O-N 3.26Å; T631-I645 HydrophobicContact CG2-CG2 4.32Å; T631-C647 HydrophobicContact CG2-CB 3.82Å; T631-I690 HydrophobicContact CG2-CG2 4.35Å; T631-Y692 HydrophobicContact CG2-CE1 4.28Å; T631-Y692 PolarHBondContact OG1-OH 3.3Å; T631-M715 HydrophobicContact CG2-SD 4.07Å
632	Q	91.1	Very high	85	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-47.4	177	-70.2	-177.6	78.8	0	0	111.7	R594 T628 Q629 I630 L634 A635 E636 V662 E665 Y666	R594-Q632 VanDerWaalsContact NH1-OE1 3.13Å; T628-Q632 WeakPolarHBondContact O-CG 3.48Å; T628-Q632 PolarHBondContact O-NE2 2.85Å; Q629-Q632 PolarHBondContact O-N 3.49Å; I630-Q632 PolarHBondContact O-N 2.9Å; Q632-L634 VanDerWaalsContact C-N 3.3Å; Q632-L634 PolarHBondContact O-N 3.02Å; Q632-A635 WeakPolarHBondContact O-CA 3.29Å; Q632-A635 WeakPolarHBondContact O-CB 3.3Å; Q632-A635 PolarHBondContact O-N 3.39Å; Q632-E636 WeakPolarHBondContact O-CB 3.46Å; Q632-E636 VanDerWaalsContact O-CG 3.26Å; Q632-E636 WeakPolarHBondContact O-CG 3Å; Q632-E636 PolarHBondContact O-N 2.98Å; Q632-V662 HydrophobicContact CG-CG1 3.83Å; Q632-E665 PolarHBondContact NE2-OE2 2.77Å; Q632-Y666 HydrophobicContact CG-CD2 4.31Å
633	Y	92.1	Very high	85.6	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-65.1	-32.7	179.5	-60.6	-17.6	0	0	0	112.6	I599 Y600 K603 Q629 I630 A637	I599-Y633 HydrophobicContact CG1-CE2 4.36Å; I599-Y633 HydrophobicContact CG2-CE2 4.27Å; Y600-Y633 WeakPolarHBondContact CD2-OH 3.37Å; K603-Y633 HydrophobicContact CB-CD2 4.14Å; K603-Y633 HydrophobicContact CB-CE2 3.99Å; K603-Y633 HydrophobicContact CD-CD1 3.89Å; K603-Y633 HydrophobicContact CD-CD2 4.17Å; K603-Y633 HydrophobicContact CD-CE1 3.95Å; K603-Y633 HydrophobicContact CD-CE2 4.2Å; K603-Y633 HydrophobicContact CD-CG 4.03Å; K603-Y633 HydrophobicContact CG-CD1 4.29Å; K603-Y633 HydrophobicContact CG-CD2 3.7Å; K603-Y633 HydrophobicContact CG-CE2 3.95Å; K603-Y633 HydrophobicContact CG-CG 3.9Å; Q629-Y633 HydrophobicContact CB-CD2 4.26Å; Q629-Y633 HydrophobicContact CB-CE1 4.11Å; Q629-Y633 HydrophobicContact CB-CE2 3.73Å; Q629-Y633 VanDerWaalsContact O-CG 3.23Å; Q629-Y633 PolarHBondContact O-N 2.79Å; I630-Y633 PolarHBondContact O-N 3.14Å; Y633-A637 VanDerWaalsContact O-CB 3.26Å; Y633-A637 WeakPolarHBondContact O-CB 3.19Å; Y633-A637 PolarHBondContact O-N 3.43Å
634	L	91.4	Very high	86.5	Confident	2 Å²	2	31 Å²	31	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-74.2	-28.5	173.1	-66.8	170.4	0	0	0	112.6	V610 I630 Q632 Y639 I645 I713 I746	V610-L634 HydrophobicContact CB-CD2 4.11Å; V610-L634 HydrophobicContact CG1-CD2 3.68Å; V610-L634 HydrophobicContact CG2-CD2 4.31Å; I630-L634 HydrophobicContact CG2-CD1 3.72Å; I630-L634 HydrophobicContact CG2-CG 4.44Å; I630-L634 WeakPolarHBondContact O-CB 3.37Å; I630-L634 WeakPolarHBondContact O-CD1 3.1Å; I630-L634 WeakPolarHBondContact O-CG 3.23Å; I630-L634 PolarHBondContact O-N 3.45Å; Q632-L634 VanDerWaalsContact C-N 3.3Å; Q632-L634 PolarHBondContact O-N 3.02Å; L634-Y639 HydrophobicContact CB-CD2 4.48Å; L634-Y639 HydrophobicContact CD2-CD2 4.06Å; L634-Y639 HydrophobicContact CD2-CE2 3.98Å; L634-Y639 PolarHBondContact O-N 3.16Å; L634-I645 HydrophobicContact CB-CD1 3.96Å; L634-I713 HydrophobicContact CB-CD1 4.34Å; L634-I713 HydrophobicContact CD1-CD1 4.02Å; L634-I713 HydrophobicContact CD1-CG2 4.34Å; L634-I713 HydrophobicContact CD2-CD1 4.03Å; L634-I713 HydrophobicContact CG-CD1 4.36Å; L634-I746 HydrophobicContact CD1-CD1 3.49Å; L634-I746 VanDerWaalsContact CD1-CD1 3.49Å
635	A	89.3	Confident	87.2	Confident	7 Å²	7	31 Å²	31	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-69.9	-48	170.8	0	0	0	0	0	111.4	T631 Q632 A637 G638 T640 I645 I690	T631-A635 WeakPolarHBondContact O-CB 2.75Å; T631-A635 PolarHBondContact O-N 3.26Å; Q632-A635 WeakPolarHBondContact O-CA 3.29Å; Q632-A635 WeakPolarHBondContact O-CB 3.3Å; Q632-A635 PolarHBondContact O-N 3.39Å; A635-A637 PolarHBondContact O-N 2.8Å; A635-G638 PolarHBondContact O-N 3.26Å; A635-T640 VanDerWaalsContact CA-CG2 3.5Å; A635-T640 HydrophobicContact CB-CG2 3.76Å; A635-I645 HydrophobicContact CB-CD1 4.08Å; A635-I690 HydrophobicContact CB-CD1 3.86Å; A635-I690 HydrophobicContact CB-CG1 4.25Å
636	E	88.7	Confident	87.9	Confident	86 Å²	86	30.6 Å²	30.6	40%	0.402	17%	0.171	S	C	.	.	H	α-helix	trans	-57.6	-34.1	173.6	-68.4	164.2	-154.1	0	0	112.2	R594 K603 Q632 G638	R594-E636 IonicContact CZ-OE1 2.62Å; R594-E636 IonicContact NH1-OE1 4Å; R594-E636 IonicContact NH2-OE1 2.66Å; R594-E636 PolarHBondContact NH2-OE1 3.43Å; K603-E636 WeakPolarHBondContact CE-OE2 3.42Å; K603-E636 IonicContact NZ-OE2 2.84Å; K603-E636 PolarHBondContact NZ-OE2 2.87Å; Q632-E636 WeakPolarHBondContact O-CB 3.46Å; Q632-E636 VanDerWaalsContact O-CG 3.26Å; Q632-E636 WeakPolarHBondContact O-CG 3Å; Q632-E636 PolarHBondContact O-N 2.98Å; E636-G638 PolarHBondContact O-N 3.48Å
637	A	87.3	Confident	88.3	Confident	43 Å²	43	30.3 Å²	30.3	36%	0.355	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	5.1	174.9	0	0	0	0	0	114.7	I607 Y633 A635 Y639	I607-A637 HydrophobicContact CD1-CB 4.45Å; I607-A637 HydrophobicContact CG2-CB 4.15Å; Y633-A637 VanDerWaalsContact O-CB 3.26Å; Y633-A637 WeakPolarHBondContact O-CB 3.19Å; Y633-A637 PolarHBondContact O-N 3.43Å; A635-A637 PolarHBondContact O-N 2.8Å; A637-Y639 HydrophobicContact CB-CD2 4.08Å; A637-Y639 HydrophobicContact CB-CE2 4.17Å; A637-Y639 PolarHBondContact O-N 3.28Å
638	G	85.8	Confident	88.7	Confident	28 Å²	28	29.1 Å²	29.1	29%	0.289	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	6.7	168.9	0	0	0	0	0	116.6	A635 E636 T640 T641	A635-G638 PolarHBondContact O-N 3.26Å; E636-G638 PolarHBondContact O-N 3.48Å; G638-T640 PolarHBondContact O-N 3.38Å; G638-T640 VanDerWaalsContact O-N 3.12Å; G638-T641 WeakPolarHBondContact O-CG2 3.41Å; G638-T641 PolarHBondContact O-N 2.97Å; G638-T641 PolarHBondContact O-OG1 2.9Å
639	Y	82.9	Confident	88.8	Confident	21 Å²	21	28.4 Å²	28.4	8%	0.082	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-60.8	-21.2	175.7	-75.1	-81.3	0	0	0	113.3	H611 L634 A637 T641 R642 I713 K744	H611-Y639 WeakPolarHBondContact CA-OH 3.46Å; L634-Y639 HydrophobicContact CB-CD2 4.48Å; L634-Y639 HydrophobicContact CD2-CD2 4.06Å; L634-Y639 HydrophobicContact CD2-CE2 3.98Å; L634-Y639 PolarHBondContact O-N 3.16Å; A637-Y639 HydrophobicContact CB-CD2 4.08Å; A637-Y639 HydrophobicContact CB-CE2 4.17Å; A637-Y639 PolarHBondContact O-N 3.28Å; Y639-T641 PolarHBondContact O-N 3.33Å; Y639-R642 PolarHBondContact O-N 2.92Å; Y639-R642 VanDerWaalsContact O-N 3.07Å; Y639-I713 HydrophobicContact CD1-CD1 3.78Å; Y639-I713 HydrophobicContact CD1-CG1 4.32Å; Y639-I713 HydrophobicContact CD2-CD1 3.93Å; Y639-I713 HydrophobicContact CE1-CD1 4.23Å; Y639-I713 HydrophobicContact CE2-CD1 4.37Å; Y639-I713 HydrophobicContact CG-CD1 3.61Å; Y639-I713 HydrophobicContact CG-CG1 4.4Å; Y639-K744 HydrophobicContact CE1-CD 4.04Å
640	T	79.8	Confident	88.6	Confident	46 Å²	46	30 Å²	30	28%	0.282	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-53.3	-30.8	173.9	63.7	0	0	0	0	113.6	A635 G638 R642 G643 I645 V689	A635-T640 VanDerWaalsContact CA-CG2 3.5Å; A635-T640 HydrophobicContact CB-CG2 3.76Å; G638-T640 PolarHBondContact O-N 3.38Å; G638-T640 VanDerWaalsContact O-N 3.12Å; T640-R642 PolarHBondContact O-N 2.68Å; T640-G643 WeakPolarHBondContact CA-O 3.29Å; T640-G643 PolarHBondContact O-N 3.12Å; T640-I645 HydrophobicContact CG2-CD1 4.29Å; T640-V689 HydrophobicContact CG2-CG1 3.26Å
641	T	77.4	Confident	88.2	Confident	120 Å²	120	33 Å²	33	74%	0.736	18%	0.179	S	C	*	.	G	3₁₀ helix	trans	-65.1	-18.4	178.4	58.1	0	0	0	0	113.6	G638 Y639	G638-T641 WeakPolarHBondContact O-CG2 3.41Å; G638-T641 PolarHBondContact O-N 2.97Å; G638-T641 PolarHBondContact O-OG1 2.9Å; Y639-T641 PolarHBondContact O-N 3.33Å
642	R	76.8	Confident	87.7	Confident	162 Å²	162	36.8 Å²	36.8	61%	0.611	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-102	-10.7	-178.3	-57	-175.5	-174.6	-175.2	2.2	113.7	Y639 T640 A712	Y639-R642 PolarHBondContact O-N 2.92Å; Y639-R642 VanDerWaalsContact O-N 3.07Å; T640-R642 PolarHBondContact O-N 2.68Å; R642-A712 HydrophobicContact CB-CB 3.93Å
643	G	86	Confident	87.1	Confident	21 Å²	21	42.1 Å²	42.1	22%	0.216	23%	0.226	C	C	.	.	S	Bend	trans	149.8	178.9	-173.3	0	0	0	0	0	112.5	T640	T640-G643 WeakPolarHBondContact CA-O 3.29Å; T640-G643 PolarHBondContact O-N 3.12Å
644	K	92.3	Very high	86.6	Confident	47 Å²	47	42.6 Å²	42.6	20%	0.204	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	154.2	-178.2	-58.8	-176.7	-175.1	-119.1	0	111	S685 P686 T688 V689 Q710 Y711 A712	K644-S685 PolarHBondContact NZ-O 3.09Å; K644-P686 PolarHBondContact NZ-O 2.97Å; K644-T688 WeakPolarHBondContact CD-O 3.45Å; K644-T688 VanDerWaalsContact CE-O 3.3Å; K644-T688 WeakPolarHBondContact CE-O 3.39Å; K644-T688 WeakPolarHBondContact CG-O 3.46Å; K644-T688 PolarHBondContact NZ-O 2.9Å; K644-V689 WeakPolarHBondContact CA-O 3.24Å; K644-Q710 PolarHBondContact N-O 3.46Å; K644-Y711 HydrophobicContact CB-CD1 4.01Å; K644-Y711 HydrophobicContact CB-CE1 4.13Å; K644-Y711 WeakPolarHBondContact O-CA 3.14Å; K644-A712 PolarHBondContact O-N 3.21Å
645	I	94.3	Very high	86.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	112	171.3	-61.7	173.5	0	0	0	107.4	T631 L634 A635 T640 V689 K691	T631-I645 HydrophobicContact CG2-CG2 4.32Å; L634-I645 HydrophobicContact CB-CD1 3.96Å; A635-I645 HydrophobicContact CB-CD1 4.08Å; T640-I645 HydrophobicContact CG2-CD1 4.29Å; I645-V689 PolarHBondContact N-O 3.49Å; I645-K691 PolarHBondContact O-N 3.01Å
646	G	94.5	Very high	86.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.7	176.9	0	0	0	0	0	111	I713 I714 M715	G646-I713 PolarHBondContact N-O 3.48Å; G646-I714 CarbonylContact O-C 3.57Å; G646-I714 WeakPolarHBondContact O-CA 3.48Å; G646-M715 PolarHBondContact O-N 2.82Å
647	C	95.2	Very high	85.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	121.5	169.3	-179.8	0	0	0	0	109.4	T631 K691 Y692 M693 M715	T631-C647 HydrophobicContact CG2-CB 3.82Å; C647-K691 PolarHBondContact N-O 3.02Å; C647-Y692 HydrophobicContact CB-CD1 3.66Å; C647-Y692 HydrophobicContact CB-CE1 3.66Å; C647-Y692 CarbonylContact O-C 3.59Å; C647-Y692 WeakPolarHBondContact O-CA 3.28Å; C647-M693 PolarHBondContact O-N 3.4Å; C647-M715 CarbonylContact C-O 3.53Å; C647-M715 WeakPolarHBondContact CA-O 3.36Å; C647-M715 HydrophobicContact CB-CB 4.38Å
648	T	94.1	Very high	85.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	156.2	176.6	85.9	0	0	0	0	111.7	M693 D695 L698 M715 L716	T648-M693 CarbonylContact C-O 3.47Å; T648-M693 VanDerWaalsContact CA-O 3.24Å; T648-M693 WeakPolarHBondContact CA-O 3.16Å; T648-M693 HydrophobicContact CG2-CG 4.17Å; T648-D695 WeakPolarHBondContact CB-OD1 3.48Å; T648-D695 PolarHBondContact OG1-OD1 3.25Å; T648-L698 HydrophobicContact CG2-CB 4.11Å; T648-L698 HydrophobicContact CG2-CD2 3.53Å; T648-L698 HydrophobicContact CG2-CG 4.44Å; T648-M715 PolarHBondContact N-O 3.05Å; T648-L716 HydrophobicContact CG2-CD2 3.75Å
649	Q	90.9	Very high	86.1	Confident	11 Å²	11	41.5 Å²	41.5	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	134	175.8	-72.5	-68.4	-67.5	0	0	108.7	T627 R651 A655 M693 T694 D695 D717	T627-Q649 VanDerWaalsContact CG2-NE2 3.32Å; Q649-R651 PolarHBondContact O-N 3.1Å; Q649-A655 HydrophobicContact CB-CB 4.11Å; Q649-A655 HydrophobicContact CG-CB 4.29Å; Q649-M693 PolarHBondContact N-O 3.15Å; Q649-T694 VanDerWaalsContact O-CA 3.29Å; Q649-T694 WeakPolarHBondContact O-CA 3.48Å; Q649-D695 PolarHBondContact N-OD1 2.97Å; Q649-D695 PolarHBondContact O-N 3.18Å; Q649-D717 PolarHBondContact NE2-OD2 3.16Å
650	P	85.4	Confident	86.4	Confident	33 Å²	33	45.5 Å²	45.5	21%	0.214	24%	0.236	C	C	.	.	S	Bend	trans	-64.3	-24.1	175.6	23.1	-32.1	0	0	0	112.8	E718 E721 T723	P650-E718 HydrophobicContact CG-CB 4.25Å; P650-E721 WeakPolarHBondContact CB-OE2 3.28Å; P650-E721 HydrophobicContact CG-CB 4.35Å; P650-E721 HydrophobicContact CG-CG 4.18Å; P650-E721 VanDerWaalsContact CG-OE2 3.32Å; P650-E721 WeakPolarHBondContact CG-OE2 3.31Å; P650-T723 HydrophobicContact CB-CG2 3.86Å
651	R	83.8	Confident	86.7	Confident	64 Å²	64	47.4 Å²	47.4	24%	0.242	24%	0.238	C	C	.	.	S	Bend	trans	-118.3	124.9	-171.8	-52.4	-164.1	-167.3	179.9	-11.6	113.6	Q649 V653 A654 A655 E721 I873 T876 S877	Q649-R651 PolarHBondContact O-N 3.1Å; R651-V653 VanDerWaalsContact C-N 3.31Å; R651-V653 PolarHBondContact O-N 3.16Å; R651-A654 HydrophobicContact CB-CB 4.33Å; R651-A654 WeakPolarHBondContact O-CB 3.33Å; R651-A654 PolarHBondContact O-N 2.89Å; R651-A655 PolarHBondContact O-N 3.2Å; R651-A655 VanDerWaalsContact O-N 3.13Å; R651-E721 IonicContact CZ-OE1 3.32Å; R651-E721 IonicContact CZ-OE2 2.66Å; R651-E721 IonicContact NE-OE1 3.52Å; R651-E721 PolarHBondContact NE-OE1 3.43Å; R651-E721 IonicContact NE-OE2 3.68Å; R651-E721 PolarHBondContact NE-OE2 2.95Å; R651-E721 VanDerWaalsContact NE-OE2 3.07Å; R651-E721 IonicContact NH2-OE1 2.63Å; R651-E721 PolarHBondContact NH2-OE1 2.79Å; R651-E721 IonicContact NH2-OE2 3.51Å; R651-I873 PolarHBondContact NH1-O 3.03Å; R651-T876 PolarHBondContact NH1-OG1 2.98Å; R651-T876 PolarHBondContact NH2-OG1 3.48Å; R651-S877 WeakPolarHBondContact CD-OG 3.15Å; R651-S877 VanDerWaalsContact CZ-OG 3.29Å; R651-S877 PolarHBondContact NE-OG 3.13Å; R651-S877 PolarHBondContact NH1-OG 3.19Å; R651-S877 VanDerWaalsContact NH1-OG 3.11Å
652	R	83	Confident	87.3	Confident	79 Å²	79	41.7 Å²	41.7	30%	0.298	20%	0.203	S	C	.	.	H	α-helix	trans	-47.9	-47	178.4	-70	178	81.2	-109	-1.1	113.4	A654 A655 M656 I678 R679 E681 T694	R652-A654 VanDerWaalsContact C-N 3.34Å; R652-A654 PolarHBondContact O-N 3.37Å; R652-A655 PolarHBondContact O-N 3.11Å; R652-M656 WeakPolarHBondContact O-CG 3.33Å; R652-M656 PolarHBondContact O-N 2.92Å; R652-M656 VanDerWaalsContact O-N 3.12Å; R652-I678 HydrophobicContact CB-CD1 4.12Å; R652-I678 HydrophobicContact CG-CB 4.3Å; R652-I678 HydrophobicContact CG-CD1 4.37Å; R652-R679 PolarHBondContact NE-O 3.35Å; R652-R679 VanDerWaalsContact NE-O 3.16Å; R652-R679 PolarHBondContact NH2-O 3.36Å; R652-E681 IonicContact NH2-OE2 3.07Å; R652-T694 HydrophobicContact CB-CG2 4.41Å; R652-T694 HydrophobicContact CG-CG2 3.79Å
653	V	78.6	Confident	87.9	Confident	111 Å²	111	34.2 Å²	34.2	67%	0.673	18%	0.176	S	C	*	.	H	α-helix	trans	-66.2	-36.2	-177.4	-178.8	0	0	0	0	111.8	R651 M656 S657	R651-V653 VanDerWaalsContact C-N 3.31Å; R651-V653 PolarHBondContact O-N 3.16Å; V653-M656 PolarHBondContact O-N 3.16Å; V653-S657 WeakPolarHBondContact O-CB 3.26Å; V653-S657 PolarHBondContact O-N 3.37Å; V653-S657 PolarHBondContact O-OG 2.95Å; V653-S657 VanDerWaalsContact O-OG 3.11Å
654	A	81.4	Confident	87.9	Confident	13 Å²	13	37.3 Å²	37.3	11%	0.107	19%	0.185	C	C	.	.	H	α-helix	trans	-68.6	-43.3	176.8	0	0	0	0	0	111.3	R651 R652 M656 S657 V658	R651-A654 HydrophobicContact CB-CB 4.33Å; R651-A654 WeakPolarHBondContact O-CB 3.33Å; R651-A654 PolarHBondContact O-N 2.89Å; R652-A654 VanDerWaalsContact C-N 3.34Å; R652-A654 PolarHBondContact O-N 3.37Å; A654-M656 VanDerWaalsContact C-N 3.32Å; A654-M656 PolarHBondContact O-N 3.35Å; A654-S657 PolarHBondContact O-N 2.89Å; A654-S657 PolarHBondContact O-OG 3.31Å; A654-V658 VanDerWaalsContact O-CB 3.28Å; A654-V658 WeakPolarHBondContact O-CB 3.41Å; A654-V658 VanDerWaalsContact O-CG2 3.25Å; A654-V658 WeakPolarHBondContact O-CG2 3.38Å; A654-V658 PolarHBondContact O-N 3.46Å
655	A	86.9	Confident	87.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-56	-45.9	173.4	0	0	0	0	0	112	Q649 R651 R652 A659 I678	Q649-A655 HydrophobicContact CB-CB 4.11Å; Q649-A655 HydrophobicContact CG-CB 4.29Å; R651-A655 PolarHBondContact O-N 3.2Å; R651-A655 VanDerWaalsContact O-N 3.13Å; R652-A655 PolarHBondContact O-N 3.11Å; A655-A659 WeakPolarHBondContact O-CB 3.42Å; A655-A659 PolarHBondContact O-N 2.96Å; A655-I678 HydrophobicContact CB-CG2 3.84Å
656	M	84.9	Confident	87.2	Confident	54 Å²	54	39.5 Å²	39.5	27%	0.266	19%	0.193	S	C	.	.	H	α-helix	trans	-65.8	-47.2	177.9	-64	172.8	90.7	0	0	112.8	R652 V653 A654 K660 Y676 I678 E681	R652-M656 WeakPolarHBondContact O-CG 3.33Å; R652-M656 PolarHBondContact O-N 2.92Å; R652-M656 VanDerWaalsContact O-N 3.12Å; V653-M656 PolarHBondContact O-N 3.16Å; A654-M656 VanDerWaalsContact C-N 3.32Å; A654-M656 PolarHBondContact O-N 3.35Å; M656-K660 WeakPolarHBondContact O-CB 3.36Å; M656-K660 PolarHBondContact O-N 3.22Å; M656-Y676 HydrophobicContact CE-CE2 4.18Å; M656-Y676 HydrophobicContact CG-CD2 4.04Å; M656-Y676 HydrophobicContact CG-CE2 3.64Å; M656-I678 HydrophobicContact CE-CD1 4.34Å; M656-I678 HydrophobicContact CG-CD1 3.71Å; M656-I678 HydrophobicContact SD-CD1 3.56Å; M656-I678 VanDerWaalsContact SD-CD1 3.56Å; M656-E681 WeakPolarHBondContact CE-OE2 3.1Å
657	S	82.8	Confident	86.8	Confident	67 Å²	67	42.9 Å²	42.9	47%	0.469	23%	0.228	S	C	.	.	H	α-helix	trans	-71.6	-39	-175.3	64.8	0	0	0	0	112.3	V653 A654 R661	V653-S657 WeakPolarHBondContact O-CB 3.26Å; V653-S657 PolarHBondContact O-N 3.37Å; V653-S657 PolarHBondContact O-OG 2.95Å; V653-S657 VanDerWaalsContact O-OG 3.11Å; A654-S657 PolarHBondContact O-N 2.89Å; A654-S657 PolarHBondContact O-OG 3.31Å; S657-R661 VanDerWaalsContact O-CB 3.31Å; S657-R661 WeakPolarHBondContact O-CB 2.99Å; S657-R661 PolarHBondContact O-N 3.44Å
658	V	87.5	Confident	86.4	Confident	21 Å²	21	43.7 Å²	43.7	13%	0.127	23%	0.233	C	C	.	.	H	α-helix	trans	-67.3	-46.6	174.1	175.6	0	0	0	0	110.5	T627 T628 A654 K660 R661 V662 Y692	T627-V658 HydrophobicContact CG2-CG1 3.94Å; T627-V658 HydrophobicContact CG2-CG2 4.4Å; T628-V658 HydrophobicContact CG2-CG1 4.28Å; A654-V658 VanDerWaalsContact O-CB 3.28Å; A654-V658 WeakPolarHBondContact O-CB 3.41Å; A654-V658 VanDerWaalsContact O-CG2 3.25Å; A654-V658 WeakPolarHBondContact O-CG2 3.38Å; A654-V658 PolarHBondContact O-N 3.46Å; V658-K660 VanDerWaalsContact C-N 3.33Å; V658-K660 PolarHBondContact O-N 2.95Å; V658-R661 PolarHBondContact O-N 2.64Å; V658-V662 HydrophobicContact CG1-CG2 4.13Å; V658-V662 WeakPolarHBondContact O-CB 3.44Å; V658-V662 WeakPolarHBondContact O-CG2 3.27Å; V658-V662 PolarHBondContact O-N 2.65Å; V658-Y692 HydrophobicContact CG1-CD1 4.02Å; V658-Y692 HydrophobicContact CG1-CE1 3.53Å; V658-Y692 HydrophobicContact CG1-CE2 4.47Å
659	A	90.4	Very high	86.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-43.6	177.2	0	0	0	0	0	112.2	A655 V662 S663 L670 V674 Y676 Y692	A655-A659 WeakPolarHBondContact O-CB 3.42Å; A655-A659 PolarHBondContact O-N 2.96Å; A659-V662 PolarHBondContact O-N 3.19Å; A659-S663 WeakPolarHBondContact O-CB 3.45Å; A659-S663 PolarHBondContact O-N 3.12Å; A659-S663 PolarHBondContact O-OG 2.87Å; A659-L670 HydrophobicContact CB-CD1 3.96Å; A659-V674 WeakPolarHBondContact O-CG1 3.4Å; A659-Y676 HydrophobicContact CB-CD1 4.07Å; A659-Y676 HydrophobicContact CB-CG 4.21Å; A659-Y692 HydrophobicContact CB-CD2 3.63Å; A659-Y692 HydrophobicContact CB-CE2 4.47Å; A659-Y692 HydrophobicContact CB-CG 4.04Å
660	K	88.1	Confident	86	Confident	105 Å²	105	50.5 Å²	50.5	46%	0.457	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-51.9	174.4	-174	174	-174.5	-80.8	0	111.5	M656 V658 V662 S663 E664 L670	M656-K660 WeakPolarHBondContact O-CB 3.36Å; M656-K660 PolarHBondContact O-N 3.22Å; V658-K660 VanDerWaalsContact C-N 3.33Å; V658-K660 PolarHBondContact O-N 2.95Å; K660-V662 VanDerWaalsContact C-N 3.28Å; K660-V662 PolarHBondContact O-N 3.47Å; K660-S663 PolarHBondContact O-N 3.43Å; K660-S663 VanDerWaalsContact O-N 3.16Å; K660-S663 PolarHBondContact O-OG 2.85Å; K660-E664 IonicContact NZ-OE1 2.75Å; K660-E664 PolarHBondContact NZ-OE1 3.42Å; K660-E664 WeakPolarHBondContact O-CG 3.46Å; K660-E664 PolarHBondContact O-N 2.81Å; K660-L670 HydrophobicContact CB-CD2 4.06Å; K660-L670 HydrophobicContact CG-CD2 4.39Å
661	R	85.6	Confident	86.1	Confident	86 Å²	86	49.7 Å²	49.7	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-60.6	-36.9	179.4	176.9	59.1	-172.8	-159.7	2	112.3	S657 V658 E664 E665	S657-R661 VanDerWaalsContact O-CB 3.31Å; S657-R661 WeakPolarHBondContact O-CB 2.99Å; S657-R661 PolarHBondContact O-N 3.44Å; V658-R661 PolarHBondContact O-N 2.64Å; R661-E664 WeakPolarHBondContact O-CB 3.5Å; R661-E664 PolarHBondContact O-N 2.97Å; R661-E665 IonicContact CZ-OE1 3.96Å; R661-E665 VanDerWaalsContact CZ-OE1 3.3Å; R661-E665 IonicContact NE-OE1 2.76Å; R661-E665 PolarHBondContact NE-OE1 2.82Å; R661-E665 IonicContact NH2-OE1 2.76Å; R661-E665 PolarHBondContact NH2-OE1 2.81Å; R661-E665 WeakPolarHBondContact O-CB 3.46Å; R661-E665 WeakPolarHBondContact O-CG 3.32Å; R661-E665 PolarHBondContact O-N 3.11Å
662	V	89.8	Confident	86.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-74.9	-33.2	177.5	173.3	0	0	0	0	111.5	T628 Q632 V658 A659 K660 E664 E665 Y666 V674 Y692	T628-V662 HydrophobicContact CG2-CG2 3.99Å; Q632-V662 HydrophobicContact CG-CG1 3.83Å; V658-V662 HydrophobicContact CG1-CG2 4.13Å; V658-V662 WeakPolarHBondContact O-CB 3.44Å; V658-V662 WeakPolarHBondContact O-CG2 3.27Å; V658-V662 PolarHBondContact O-N 2.65Å; A659-V662 PolarHBondContact O-N 3.19Å; K660-V662 VanDerWaalsContact C-N 3.28Å; K660-V662 PolarHBondContact O-N 3.47Å; V662-E664 VanDerWaalsContact C-N 3.31Å; V662-E664 PolarHBondContact O-N 2.71Å; V662-E665 PolarHBondContact O-N 3.21Å; V662-Y666 WeakPolarHBondContact O-CB 3.31Å; V662-Y666 PolarHBondContact O-N 2.95Å; V662-V674 HydrophobicContact CB-CG1 4.37Å; V662-V674 HydrophobicContact CG1-CG1 4.15Å; V662-V674 HydrophobicContact CG1-CG2 4.16Å; V662-Y692 HydrophobicContact CB-CE2 4.13Å; V662-Y692 HydrophobicContact CG1-CE2 4.17Å; V662-Y692 HydrophobicContact CG2-CE2 4.42Å
663	S	90.1	Very high	86.8	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-63.3	-38.1	169	70.1	0	0	0	0	112.1	A659 K660 G667 C668	A659-S663 WeakPolarHBondContact O-CB 3.45Å; A659-S663 PolarHBondContact O-N 3.12Å; A659-S663 PolarHBondContact O-OG 2.87Å; K660-S663 PolarHBondContact O-N 3.43Å; K660-S663 VanDerWaalsContact O-N 3.16Å; K660-S663 PolarHBondContact O-OG 2.85Å; S663-G667 PolarHBondContact O-N 2.85Å; S663-C668 PolarHBondContact O-N 3.08Å
664	E	87.2	Confident	87.5	Confident	85 Å²	85	45.3 Å²	45.3	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-68.2	-34.9	173.5	-68.1	167.5	177.9	0	0	112.6	K660 R661 V662	K660-E664 IonicContact NZ-OE1 2.75Å; K660-E664 PolarHBondContact NZ-OE1 3.42Å; K660-E664 WeakPolarHBondContact O-CG 3.46Å; K660-E664 PolarHBondContact O-N 2.81Å; R661-E664 WeakPolarHBondContact O-CB 3.5Å; R661-E664 PolarHBondContact O-N 2.97Å; V662-E664 VanDerWaalsContact C-N 3.31Å; V662-E664 PolarHBondContact O-N 2.71Å
665	E	86.6	Confident	88.1	Confident	17 Å²	17	44.7 Å²	44.7	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-78.4	-27.4	177	-78.4	-178.7	-169.5	0	0	114.4	I590 R594 Q629 Q632 R661 V662	I590-E665 HydrophobicContact CG2-CB 4.32Å; I590-E665 HydrophobicContact CG2-CG 3.95Å; R594-E665 HydrophobicContact CG-CG 4.47Å; Q629-E665 PolarHBondContact NE2-OE2 2.98Å; Q632-E665 PolarHBondContact NE2-OE2 2.77Å; R661-E665 IonicContact CZ-OE1 3.96Å; R661-E665 VanDerWaalsContact CZ-OE1 3.3Å; R661-E665 IonicContact NE-OE1 2.76Å; R661-E665 PolarHBondContact NE-OE1 2.82Å; R661-E665 IonicContact NH2-OE1 2.76Å; R661-E665 PolarHBondContact NH2-OE1 2.81Å; R661-E665 WeakPolarHBondContact O-CB 3.46Å; R661-E665 WeakPolarHBondContact O-CG 3.32Å; R661-E665 PolarHBondContact O-N 3.11Å; V662-E665 PolarHBondContact O-N 3.21Å
666	Y	84.4	Confident	88.5	Confident	78 Å²	78	45.3 Å²	45.3	31%	0.306	25%	0.249	S	C	.	.	H	α-helix	trans	-91.1	-19.7	179	-158.8	-94.3	0	0	0	112.5	Q632 V662 C668 E673 V674	Q632-Y666 HydrophobicContact CG-CD2 4.31Å; V662-Y666 WeakPolarHBondContact O-CB 3.31Å; V662-Y666 PolarHBondContact O-N 2.95Å; Y666-C668 HydrophobicContact CD1-CB 4.45Å; Y666-E673 HydrophobicContact CE1-CB 4.35Å; Y666-E673 WeakPolarHBondContact CE1-OE2 3.32Å; Y666-V674 HydrophobicContact CD1-CG2 4.47Å; Y666-V674 HydrophobicContact CG-CG2 4.33Å
667	G	84.9	Confident	88.8	Confident	71 Å²	71	42.8 Å²	42.8	73%	0.732	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.2	9.1	176.2	0	0	0	0	0	115.6	S663	S663-G667 PolarHBondContact O-N 2.85Å
668	C	87	Confident	89.1	Confident	16 Å²	16	39.7 Å²	39.7	11%	0.108	22%	0.215	C	C	.	.	S	Bend	trans	-100.7	160.6	-178.6	69.6	0	0	0	0	112.6	S663 Y666 E673	S663-C668 PolarHBondContact O-N 3.08Å; Y666-C668 HydrophobicContact CD1-CB 4.45Å; C668-E673 HydrophobicContact CB-CB 4.33Å; C668-E673 WeakPolarHBondContact CB-OE2 3.21Å
669	C	88.4	Confident	88.8	Confident	89 Å²	89	43 Å²	43	60%	0.601	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-77.8	135.8	168.4	-64.3	0	0	0	0	111.3	G671 Q672	C669-G671 PolarHBondContact O-N 3.33Å; C669-Q672 HydrophobicContact CB-CG 4.37Å; C669-Q672 VanDerWaalsContact CB-OE1 3.3Å; C669-Q672 VanDerWaalsContact N-OE1 3.11Å; C669-Q672 WeakPolarHBondContact O-CB 3.25Å; C669-Q672 PolarHBondContact O-N 3.14Å
670	L	89.4	Confident	88	Confident	65 Å²	65	44.5 Å²	44.5	34%	0.34	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	119.7	178.7	-172	62	0	0	0	111.4	A659 K660 Y676	A659-L670 HydrophobicContact CB-CD1 3.96Å; K660-L670 HydrophobicContact CB-CD2 4.06Å; K660-L670 HydrophobicContact CG-CD2 4.39Å; L670-Y676 HydrophobicContact CD1-CD1 4.07Å; L670-Y676 HydrophobicContact CD2-CD1 4.2Å; L670-Y676 HydrophobicContact CD2-CE1 3.84Å; L670-Y676 HydrophobicContact CG-CD1 4.24Å; L670-Y676 HydrophobicContact CG-CE1 4.2Å
671	G	87.4	Confident	87.5	Confident	16 Å²	16	43 Å²	43	17%	0.165	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.5	-14.9	-173	0	0	0	0	0	114.4	C669 V674 C683 S685 T688	C669-G671 PolarHBondContact O-N 3.33Å; G671-V674 PolarHBondContact N-O 2.92Å; G671-C683 WeakPolarHBondContact CA-O 3.42Å; G671-S685 WeakPolarHBondContact O-CB 3.5Å; G671-S685 PolarHBondContact O-N 2.66Å; G671-S685 PolarHBondContact O-OG 2.97Å; G671-T688 PolarHBondContact O-OG1 2.77Å
672	Q	90.2	Very high	87.5	Confident	85 Å²	85	43.6 Å²	43.6	40%	0.397	24%	0.236	S	C	.	.	S	Bend	trans	-80.8	-124.9	165.9	-60.3	-178.7	-62.9	0	0	109.2	C669 V674 T688	C669-Q672 HydrophobicContact CB-CG 4.37Å; C669-Q672 VanDerWaalsContact CB-OE1 3.3Å; C669-Q672 VanDerWaalsContact N-OE1 3.11Å; C669-Q672 WeakPolarHBondContact O-CB 3.25Å; C669-Q672 PolarHBondContact O-N 3.14Å; Q672-V674 VanDerWaalsContact C-N 3.3Å; Q672-V674 PolarHBondContact O-N 2.86Å; Q672-T688 WeakPolarHBondContact O-CA 3.35Å; Q672-T688 WeakPolarHBondContact O-CB 3.48Å; Q672-T688 PolarHBondContact O-N 3.48Å; Q672-T688 PolarHBondContact O-OG1 2.91Å
673	E	90.3	Very high	87.5	Confident	78 Å²	78	45.8 Å²	45.8	36%	0.364	25%	0.251	S	S	.	.	S	Bend	trans	-56.5	-37.8	-177.5	-59.4	175.8	108.8	0	0	113.7	Y666 C668 T688 V689 I690	Y666-E673 HydrophobicContact CE1-CB 4.35Å; Y666-E673 WeakPolarHBondContact CE1-OE2 3.32Å; C668-E673 HydrophobicContact CB-CB 4.33Å; C668-E673 WeakPolarHBondContact CB-OE2 3.21Å; E673-T688 CarbonylContact O-C 3.58Å; E673-V689 PolarHBondContact O-N 3.19Å; E673-I690 PolarHBondContact O-N 3.41Å
674	V	93.9	Very high	87.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.3	171.5	-177.8	0	0	0	0	108.9	A659 V662 Y666 G671 Q672 I690 Y692	A659-V674 WeakPolarHBondContact O-CG1 3.4Å; V662-V674 HydrophobicContact CB-CG1 4.37Å; V662-V674 HydrophobicContact CG1-CG1 4.15Å; V662-V674 HydrophobicContact CG1-CG2 4.16Å; Y666-V674 HydrophobicContact CD1-CG2 4.47Å; Y666-V674 HydrophobicContact CG-CG2 4.33Å; G671-V674 PolarHBondContact N-O 2.92Å; Q672-V674 VanDerWaalsContact C-N 3.3Å; Q672-V674 PolarHBondContact O-N 2.86Å; V674-I690 HydrophobicContact CG2-CB 4.4Å; V674-I690 HydrophobicContact CG2-CD1 4.43Å; V674-Y692 HydrophobicContact CG1-CD2 4.32Å; V674-Y692 HydrophobicContact CG1-CE2 4.13Å
675	G	94.1	Very high	87.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	173.5	-179.4	0	0	0	0	0	112.5	C683 I690 Y692	G675-C683 CarbonylContact C-O 3.53Å; G675-C683 WeakPolarHBondContact CA-O 3.27Å; G675-I690 PolarHBondContact N-O 2.71Å; G675-Y692 PolarHBondContact O-N 3.17Å
676	Y	94.4	Very high	87.6	Confident	13 Å²	13	50.5 Å²	50.5	5%	0.051	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	148.5	175.7	74.5	-84.1	0	0	0	114	M656 A659 L670 I678 E681 C683 Y692	M656-Y676 HydrophobicContact CE-CE2 4.18Å; M656-Y676 HydrophobicContact CG-CD2 4.04Å; M656-Y676 HydrophobicContact CG-CE2 3.64Å; A659-Y676 HydrophobicContact CB-CD1 4.07Å; A659-Y676 HydrophobicContact CB-CG 4.21Å; L670-Y676 HydrophobicContact CD1-CD1 4.07Å; L670-Y676 HydrophobicContact CD2-CD1 4.2Å; L670-Y676 HydrophobicContact CD2-CE1 3.84Å; L670-Y676 HydrophobicContact CG-CD1 4.24Å; L670-Y676 HydrophobicContact CG-CE1 4.2Å; Y676-I678 HydrophobicContact CD2-CD1 4.48Å; Y676-I678 HydrophobicContact CD2-CG1 4.25Å; Y676-I678 HydrophobicContact CD2-CG2 4.2Å; Y676-I678 HydrophobicContact CE2-CD1 4.07Å; Y676-I678 HydrophobicContact CE2-CG1 4.08Å; Y676-E681 HydrophobicContact CE2-CG 4.14Å; Y676-E681 PolarHBondContact OH-OE1 2.87Å; Y676-C683 HydrophobicContact CD1-CB 3.84Å; Y676-C683 HydrophobicContact CE1-CB 3.46Å; Y676-C683 VanDerWaalsContact CE1-CB 3.46Å; Y676-C683 PolarHBondContact N-O 3.1Å; Y676-C683 CarbonylContact O-C 3.55Å; Y676-C683 PolarHBondContact O-N 3.23Å; Y676-C683 PolarHBondContact OH-SG 3.42Å; Y676-Y692 CarbonylContact C-O 3.53Å; Y676-Y692 WeakPolarHBondContact CA-O 3.35Å; Y676-Y692 WeakPolarHBondContact CB-O 3.47Å
677	T	91.6	Very high	87.8	Confident	1 Å²	1	53 Å²	53	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	107.4	-179.3	-55.1	0	0	0	0	109.9	D682 T684 K691 Y692 M693 T694 M697	T677-D682 WeakPolarHBondContact CB-OD1 3.44Å; T677-D682 HydrophobicContact CG2-CB 4.31Å; T677-D682 PolarHBondContact OG1-OD1 2.89Å; T677-T684 VanDerWaalsContact OG1-CG2 3.23Å; T677-T684 WeakPolarHBondContact OG1-CG2 3.28Å; T677-K691 WeakPolarHBondContact OG1-CE 3.23Å; T677-Y692 PolarHBondContact N-O 3.06Å; T677-M693 VanDerWaalsContact O-CA 3.22Å; T677-M693 WeakPolarHBondContact O-CA 3.47Å; T677-M693 VanDerWaalsContact O-CB 3.27Å; T677-M693 WeakPolarHBondContact O-CB 3.07Å; T677-T694 PolarHBondContact O-N 3.08Å; T677-M697 HydrophobicContact CG2-CE 3.64Å
678	I	89.7	Confident	88.1	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	166.6	175.7	62.9	176.5	0	0	0	110.4	R652 A655 M656 Y676 F680 E681 T694	R652-I678 HydrophobicContact CB-CD1 4.12Å; R652-I678 HydrophobicContact CG-CB 4.3Å; R652-I678 HydrophobicContact CG-CD1 4.37Å; A655-I678 HydrophobicContact CB-CG2 3.84Å; M656-I678 HydrophobicContact CE-CD1 4.34Å; M656-I678 HydrophobicContact CG-CD1 3.71Å; M656-I678 HydrophobicContact SD-CD1 3.56Å; M656-I678 VanDerWaalsContact SD-CD1 3.56Å; Y676-I678 HydrophobicContact CD2-CD1 4.48Å; Y676-I678 HydrophobicContact CD2-CG1 4.25Å; Y676-I678 HydrophobicContact CD2-CG2 4.2Å; Y676-I678 HydrophobicContact CE2-CD1 4.07Å; Y676-I678 HydrophobicContact CE2-CG1 4.08Å; I678-F680 PolarHBondContact O-N 2.87Å; I678-F680 VanDerWaalsContact O-N 3.11Å; I678-E681 CarbonylContact C-O 3.58Å; I678-E681 HydrophobicContact CD1-CB 4.17Å; I678-E681 HydrophobicContact CG1-CB 3.8Å; I678-E681 VanDerWaalsContact CG1-O 3.32Å; I678-E681 WeakPolarHBondContact CG1-O 3.32Å; I678-E681 PolarHBondContact N-O 3.41Å; I678-E681 CarbonylContact O-C 3.53Å; I678-E681 PolarHBondContact O-N 2.95Å; I678-E681 VanDerWaalsContact O-N 3.09Å; I678-T694 HydrophobicContact CB-CG2 4.44Å; I678-T694 HydrophobicContact CG2-CG2 3.96Å
679	R	81.6	Confident	88.3	Confident	89 Å²	89	50.8 Å²	50.8	34%	0.336	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	123.4	175.3	-168.7	175.1	168	156.3	-1.1	110.2	R652 M697 P1016	R652-R679 PolarHBondContact NE-O 3.35Å; R652-R679 VanDerWaalsContact NE-O 3.16Å; R652-R679 PolarHBondContact NH2-O 3.36Å; R679-M697 HydrophobicContact CB-SD 4.38Å; R679-P1016 PolarHBondContact NH1-O 3.12Å; R679-P1016 PolarHBondContact NH2-O 3.13Å
680	F	72.1	Confident	88.6	Confident	33 Å²	33	46.6 Å²	46.6	15%	0.145	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	2.7	-177.1	-40.6	-54.9	0	0	0	117.9	I678 I1110 Q1113	I678-F680 PolarHBondContact O-N 2.87Å; I678-F680 VanDerWaalsContact O-N 3.11Å; F680-I1110 HydrophobicContact CD1-CG1 3.76Å; F680-I1110 HydrophobicContact CD2-CG1 4.14Å; F680-I1110 HydrophobicContact CE1-CB 4.28Å; F680-I1110 HydrophobicContact CE1-CD1 4.42Å; F680-I1110 HydrophobicContact CE1-CG1 3.46Å; F680-I1110 VanDerWaalsContact CE1-CG1 3.46Å; F680-I1110 HydrophobicContact CE1-CG2 4.33Å; F680-I1110 HydrophobicContact CE2-CD1 4.06Å; F680-I1110 HydrophobicContact CE2-CG1 3.83Å; F680-I1110 HydrophobicContact CG-CG1 4.09Å; F680-I1110 HydrophobicContact CZ-CD1 3.93Å; F680-I1110 HydrophobicContact CZ-CG1 3.45Å; F680-I1110 VanDerWaalsContact CZ-CG1 3.45Å; F680-Q1113 VanDerWaalsContact CD1-OE1 3.29Å
681	E	78.9	Confident	88.9	Confident	74 Å²	74	44.3 Å²	44.3	35%	0.346	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	115.8	-175.7	-174.1	169	-158.8	0	0	109.6	R652 M656 Y676 I678	R652-E681 IonicContact NH2-OE2 3.07Å; M656-E681 WeakPolarHBondContact CE-OE2 3.1Å; Y676-E681 HydrophobicContact CE2-CG 4.14Å; Y676-E681 PolarHBondContact OH-OE1 2.87Å; I678-E681 CarbonylContact C-O 3.58Å; I678-E681 HydrophobicContact CD1-CB 4.17Å; I678-E681 HydrophobicContact CG1-CB 3.8Å; I678-E681 VanDerWaalsContact CG1-O 3.32Å; I678-E681 WeakPolarHBondContact CG1-O 3.32Å; I678-E681 PolarHBondContact N-O 3.41Å; I678-E681 CarbonylContact O-C 3.53Å; I678-E681 PolarHBondContact O-N 2.95Å; I678-E681 VanDerWaalsContact O-N 3.09Å
682	D	85.9	Confident	89.2	Confident	98 Å²	98	43.6 Å²	43.6	52%	0.524	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.8	-176.2	-165.7	-1.1	0	0	0	108.8	T677 T684	T677-D682 WeakPolarHBondContact CB-OD1 3.44Å; T677-D682 HydrophobicContact CG2-CB 4.31Å; T677-D682 PolarHBondContact OG1-OD1 2.89Å; D682-T684 WeakPolarHBondContact OD1-CG2 3.42Å; D682-T684 PolarHBondContact OD1-OG1 2.93Å
683	C	88.5	Confident	89.4	Confident	46 Å²	46	39.5 Å²	39.5	31%	0.311	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	69.4	178.1	-65.8	0	0	0	0	107.7	G671 G675 Y676	G671-C683 WeakPolarHBondContact CA-O 3.42Å; G675-C683 CarbonylContact C-O 3.53Å; G675-C683 WeakPolarHBondContact CA-O 3.27Å; Y676-C683 HydrophobicContact CD1-CB 3.84Å; Y676-C683 HydrophobicContact CE1-CB 3.46Å; Y676-C683 VanDerWaalsContact CE1-CB 3.46Å; Y676-C683 PolarHBondContact N-O 3.1Å; Y676-C683 CarbonylContact O-C 3.55Å; Y676-C683 PolarHBondContact O-N 3.23Å; Y676-C683 PolarHBondContact OH-SG 3.42Å
684	T	89.2	Confident	89.6	Confident	49 Å²	49	36.5 Å²	36.5	30%	0.301	20%	0.195	S	C	.	.			trans	-133.3	160.3	175.1	59.8	0	0	0	0	110.8	T677 D682 T688 K691	T677-T684 VanDerWaalsContact OG1-CG2 3.23Å; T677-T684 WeakPolarHBondContact OG1-CG2 3.28Å; D682-T684 WeakPolarHBondContact OD1-CG2 3.42Å; D682-T684 PolarHBondContact OD1-OG1 2.93Å; T684-T688 HydrophobicContact CG2-CG2 4.25Å; T684-K691 HydrophobicContact CG2-CD 4.31Å; T684-K691 HydrophobicContact CG2-CG 4.03Å
685	S	89.5	Confident	89.4	Confident	32 Å²	32	36.6 Å²	36.6	22%	0.224	20%	0.196	C	C	.	.			trans	-135.3	171.9	177.8	62.7	0	0	0	0	110.2	K644 G671 E687 T688	K644-S685 PolarHBondContact NZ-O 3.09Å; G671-S685 WeakPolarHBondContact O-CB 3.5Å; G671-S685 PolarHBondContact O-N 2.66Å; G671-S685 PolarHBondContact O-OG 2.97Å; S685-E687 PolarHBondContact O-N 3.24Å; S685-E687 PolarHBondContact OG-N 3.17Å; S685-T688 PolarHBondContact N-OG1 2.8Å; S685-T688 WeakPolarHBondContact O-CB 3.49Å; S685-T688 PolarHBondContact O-N 3.32Å; S685-T688 VanDerWaalsContact O-N 3.12Å; S685-T688 PolarHBondContact O-OG1 3.4Å; S685-T688 PolarHBondContact OG-N 3.33Å; S685-T688 PolarHBondContact OG-OG1 3.41Å
686	P	87.4	Confident	89.2	Confident	125 Å²	125	37.8 Å²	37.8	81%	0.812	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-38.6	169.2	-26.7	36.8	0	0	0	112	K644 T688	K644-P686 PolarHBondContact NZ-O 2.97Å; P686-T688 VanDerWaalsContact C-N 3.28Å; P686-T688 PolarHBondContact O-N 3.4Å
687	E	89	Confident	89	Confident	131 Å²	131	38 Å²	38	61%	0.612	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.5	179.6	-60.1	174.9	173.1	0	0	114.1	S685 V689	S685-E687 PolarHBondContact O-N 3.24Å; S685-E687 PolarHBondContact OG-N 3.17Å; E687-V689 PolarHBondContact O-N 3.4Å; E687-V689 VanDerWaalsContact O-N 3.14Å
688	T	91.7	Very high	89	Confident	2 Å²	2	38 Å²	38	1%	0.012	21%	0.209	C	C	.	.			trans	-63.7	116.3	-179.7	-57.9	0	0	0	0	112.3	K644 G671 Q672 E673 T684 S685 P686 I690 K691	K644-T688 WeakPolarHBondContact CD-O 3.45Å; K644-T688 VanDerWaalsContact CE-O 3.3Å; K644-T688 WeakPolarHBondContact CE-O 3.39Å; K644-T688 WeakPolarHBondContact CG-O 3.46Å; K644-T688 PolarHBondContact NZ-O 2.9Å; G671-T688 PolarHBondContact O-OG1 2.77Å; Q672-T688 WeakPolarHBondContact O-CA 3.35Å; Q672-T688 WeakPolarHBondContact O-CB 3.48Å; Q672-T688 PolarHBondContact O-N 3.48Å; Q672-T688 PolarHBondContact O-OG1 2.91Å; E673-T688 CarbonylContact O-C 3.58Å; T684-T688 HydrophobicContact CG2-CG2 4.25Å; S685-T688 PolarHBondContact N-OG1 2.8Å; S685-T688 WeakPolarHBondContact O-CB 3.49Å; S685-T688 PolarHBondContact O-N 3.32Å; S685-T688 VanDerWaalsContact O-N 3.12Å; S685-T688 PolarHBondContact O-OG1 3.4Å; S685-T688 PolarHBondContact OG-N 3.33Å; S685-T688 PolarHBondContact OG-OG1 3.41Å; P686-T688 VanDerWaalsContact C-N 3.28Å; P686-T688 PolarHBondContact O-N 3.4Å; T688-I690 VanDerWaalsContact CG2-O 3.28Å; T688-I690 WeakPolarHBondContact CG2-O 3.06Å; T688-K691 HydrophobicContact CG2-CB 4.24Å
689	V	92	Very high	89	Confident	38 Å²	38	38.3 Å²	38.3	23%	0.23	21%	0.211	C	C	.	.			trans	-94.7	-45.7	178.7	176	0	0	0	0	111	T640 K644 I645 E673 E687	T640-V689 HydrophobicContact CG2-CG1 3.26Å; K644-V689 WeakPolarHBondContact CA-O 3.24Å; I645-V689 PolarHBondContact N-O 3.49Å; E673-V689 PolarHBondContact O-N 3.19Å; E687-V689 PolarHBondContact O-N 3.4Å; E687-V689 VanDerWaalsContact O-N 3.14Å
690	I	94.2	Very high	89.3	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	117.5	177.2	-53.1	179.2	0	0	0	108.3	T631 A635 E673 V674 G675 T688 Y692	T631-I690 HydrophobicContact CG2-CG2 4.35Å; A635-I690 HydrophobicContact CB-CD1 3.86Å; A635-I690 HydrophobicContact CB-CG1 4.25Å; E673-I690 PolarHBondContact O-N 3.41Å; V674-I690 HydrophobicContact CG2-CB 4.4Å; V674-I690 HydrophobicContact CG2-CD1 4.43Å; G675-I690 PolarHBondContact N-O 2.71Å; T688-I690 VanDerWaalsContact CG2-O 3.28Å; T688-I690 WeakPolarHBondContact CG2-O 3.06Å; I690-Y692 HydrophobicContact CG2-CD2 4.3Å; I690-Y692 HydrophobicContact CG2-CE2 3.66Å
691	K	94.6	Very high	90.1	Very high	17 Å²	17	36 Å²	36	7%	0.074	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	110	-175.7	-173.9	-179.1	169.1	-168.3	0	110.7	I645 C647 T677 T684 T688 M693 E701 Y711	I645-K691 PolarHBondContact O-N 3.01Å; C647-K691 PolarHBondContact N-O 3.02Å; T677-K691 WeakPolarHBondContact OG1-CE 3.23Å; T684-K691 HydrophobicContact CG2-CD 4.31Å; T684-K691 HydrophobicContact CG2-CG 4.03Å; T688-K691 HydrophobicContact CG2-CB 4.24Å; K691-M693 HydrophobicContact CB-CE 4.29Å; K691-M693 HydrophobicContact CD-CE 4.07Å; K691-M693 HydrophobicContact CG-CE 4.01Å; K691-M693 WeakPolarHBondContact O-CE 3.49Å; K691-E701 IonicContact NZ-OE1 3.75Å; K691-E701 PolarHBondContact NZ-OE1 2.87Å; K691-E701 IonicContact NZ-OE2 2.72Å; K691-E701 PolarHBondContact NZ-OE2 3.06Å; K691-Y711 HydrophobicContact CD-CE1 4.4Å; K691-Y711 WeakPolarHBondContact CD-OH 3.4Å; K691-Y711 PolarHBondContact NZ-OH 3.39Å
692	Y	95.3	Very high	90.5	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	133.7	171.3	-68.9	-83.1	0	0	0	110.4	T627 T631 C647 V658 A659 V662 V674 G675 Y676 T677 I690	T627-Y692 HydrophobicContact CG2-CE1 4.36Å; T627-Y692 PolarHBondContact O-OH 2.97Å; T631-Y692 HydrophobicContact CG2-CE1 4.28Å; T631-Y692 PolarHBondContact OG1-OH 3.3Å; C647-Y692 HydrophobicContact CB-CD1 3.66Å; C647-Y692 HydrophobicContact CB-CE1 3.66Å; C647-Y692 CarbonylContact O-C 3.59Å; C647-Y692 WeakPolarHBondContact O-CA 3.28Å; V658-Y692 HydrophobicContact CG1-CD1 4.02Å; V658-Y692 HydrophobicContact CG1-CE1 3.53Å; V658-Y692 HydrophobicContact CG1-CE2 4.47Å; A659-Y692 HydrophobicContact CB-CD2 3.63Å; A659-Y692 HydrophobicContact CB-CE2 4.47Å; A659-Y692 HydrophobicContact CB-CG 4.04Å; V662-Y692 HydrophobicContact CB-CE2 4.13Å; V662-Y692 HydrophobicContact CG1-CE2 4.17Å; V662-Y692 HydrophobicContact CG2-CE2 4.42Å; V674-Y692 HydrophobicContact CG1-CD2 4.32Å; V674-Y692 HydrophobicContact CG1-CE2 4.13Å; G675-Y692 PolarHBondContact O-N 3.17Å; Y676-Y692 CarbonylContact C-O 3.53Å; Y676-Y692 WeakPolarHBondContact CA-O 3.35Å; Y676-Y692 WeakPolarHBondContact CB-O 3.47Å; T677-Y692 PolarHBondContact N-O 3.06Å; I690-Y692 HydrophobicContact CG2-CD2 4.3Å; I690-Y692 HydrophobicContact CG2-CE2 3.66Å
693	M	94.4	Very high	90.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	160.1	-178.4	68.6	-162.7	89.6	0	0	112.6	C647 T648 Q649 T677 K691 M697 L698 Y711	C647-M693 PolarHBondContact O-N 3.4Å; T648-M693 CarbonylContact C-O 3.47Å; T648-M693 VanDerWaalsContact CA-O 3.24Å; T648-M693 WeakPolarHBondContact CA-O 3.16Å; T648-M693 HydrophobicContact CG2-CG 4.17Å; Q649-M693 PolarHBondContact N-O 3.15Å; T677-M693 VanDerWaalsContact O-CA 3.22Å; T677-M693 WeakPolarHBondContact O-CA 3.47Å; T677-M693 VanDerWaalsContact O-CB 3.27Å; T677-M693 WeakPolarHBondContact O-CB 3.07Å; K691-M693 HydrophobicContact CB-CE 4.29Å; K691-M693 HydrophobicContact CD-CE 4.07Å; K691-M693 HydrophobicContact CG-CE 4.01Å; K691-M693 WeakPolarHBondContact O-CE 3.49Å; M693-M697 HydrophobicContact CB-CB 4.47Å; M693-L698 HydrophobicContact CG-CB 4.29Å; M693-L698 HydrophobicContact SD-CB 3.71Å; M693-L698 HydrophobicContact SD-CD1 4.05Å; M693-L698 HydrophobicContact SD-CG 4.39Å; M693-Y711 HydrophobicContact CE-CE1 3.91Å
694	T	92.9	Very high	90.2	Very high	14 Å²	14	35.3 Å²	35.3	9%	0.086	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	145.2	166	41.7	0	0	0	0	111	Q649 R652 T677 I678 G696 M697 L698	Q649-T694 VanDerWaalsContact O-CA 3.29Å; Q649-T694 WeakPolarHBondContact O-CA 3.48Å; R652-T694 HydrophobicContact CB-CG2 4.41Å; R652-T694 HydrophobicContact CG-CG2 3.79Å; T677-T694 PolarHBondContact O-N 3.08Å; I678-T694 HydrophobicContact CB-CG2 4.44Å; I678-T694 HydrophobicContact CG2-CG2 3.96Å; T694-G696 VanDerWaalsContact C-N 3.26Å; T694-G696 PolarHBondContact O-N 3.37Å; T694-G696 VanDerWaalsContact O-N 3.14Å; T694-M697 WeakPolarHBondContact O-CA 3.46Å; T694-M697 WeakPolarHBondContact O-CB 3.31Å; T694-M697 PolarHBondContact O-N 2.95Å; T694-M697 WeakPolarHBondContact OG1-CG 3.25Å; T694-L698 PolarHBondContact O-N 3.29Å
695	D	91.2	Very high	90.1	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-45.9	-46.8	179.1	-65.1	11.9	0	0	0	113.1	T648 Q649 M697 L698 L699 H725 T726 L729	T648-D695 WeakPolarHBondContact CB-OD1 3.48Å; T648-D695 PolarHBondContact OG1-OD1 3.25Å; Q649-D695 PolarHBondContact N-OD1 2.97Å; Q649-D695 PolarHBondContact O-N 3.18Å; D695-M697 PolarHBondContact O-N 3.49Å; D695-L698 PolarHBondContact O-N 3.4Å; D695-L698 VanDerWaalsContact O-N 3.12Å; D695-L699 PolarHBondContact O-N 3.31Å; D695-H725 HydrophobicContact CB-CB 3.78Å; D695-T726 WeakPolarHBondContact OD2-CB 3.43Å; D695-T726 PolarHBondContact OD2-OG1 3.41Å; D695-L729 HydrophobicContact CB-CD1 3.97Å
696	G	89.2	Confident	89.8	Confident	25 Å²	25	36.5 Å²	36.5	26%	0.258	20%	0.204	S	C	.	.	H	α-helix	trans	-66.2	-13.7	177.4	0	0	0	0	0	115.7	T694 R700	T694-G696 VanDerWaalsContact C-N 3.26Å; T694-G696 PolarHBondContact O-N 3.37Å; T694-G696 VanDerWaalsContact O-N 3.14Å; G696-R700 PolarHBondContact O-N 3.43Å
697	M	90.4	Very high	89.7	Confident	18 Å²	18	35.7 Å²	35.7	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-85.7	-39.7	169.4	-67.9	-60	-67.7	0	0	111.3	T677 R679 M693 T694 D695 L699 R700 E701	T677-M697 HydrophobicContact CG2-CE 3.64Å; R679-M697 HydrophobicContact CB-SD 4.38Å; M693-M697 HydrophobicContact CB-CB 4.47Å; T694-M697 WeakPolarHBondContact O-CA 3.46Å; T694-M697 WeakPolarHBondContact O-CB 3.31Å; T694-M697 PolarHBondContact O-N 2.95Å; T694-M697 WeakPolarHBondContact OG1-CG 3.25Å; D695-M697 PolarHBondContact O-N 3.49Å; M697-L699 VanDerWaalsContact C-N 3.31Å; M697-L699 PolarHBondContact O-N 3.27Å; M697-R700 WeakPolarHBondContact O-CB 3.38Å; M697-R700 PolarHBondContact O-N 3.22Å; M697-E701 PolarHBondContact O-N 2.97Å
698	L	92.1	Very high	89.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.6	-44	169.9	-179	59.8	0	0	0	110.6	T648 M693 T694 D695 R700 E701 C702 L708 Y711 I714 L716 L729 L733	T648-L698 HydrophobicContact CG2-CB 4.11Å; T648-L698 HydrophobicContact CG2-CD2 3.53Å; T648-L698 HydrophobicContact CG2-CG 4.44Å; M693-L698 HydrophobicContact CG-CB 4.29Å; M693-L698 HydrophobicContact SD-CB 3.71Å; M693-L698 HydrophobicContact SD-CD1 4.05Å; M693-L698 HydrophobicContact SD-CG 4.39Å; T694-L698 PolarHBondContact O-N 3.29Å; D695-L698 PolarHBondContact O-N 3.4Å; D695-L698 VanDerWaalsContact O-N 3.12Å; L698-R700 PolarHBondContact O-N 2.93Å; L698-E701 CarbonylContact O-C 3.58Å; L698-E701 WeakPolarHBondContact O-CA 3.43Å; L698-E701 PolarHBondContact O-N 2.93Å; L698-C702 PolarHBondContact O-N 2.88Å; L698-C702 PolarHBondContact O-SG 2.93Å; L698-L708 HydrophobicContact CD1-CD1 4.48Å; L698-L708 HydrophobicContact CD1-CD2 3.99Å; L698-Y711 HydrophobicContact CD1-CE2 4.4Å; L698-I714 HydrophobicContact CD1-CD1 3.88Å; L698-I714 HydrophobicContact CD2-CD1 3.97Å; L698-I714 HydrophobicContact CD2-CG2 3.86Å; L698-L716 HydrophobicContact CD2-CD2 4.26Å; L698-L729 HydrophobicContact CB-CD1 4.29Å; L698-L729 HydrophobicContact CB-CD2 4.38Å; L698-L729 HydrophobicContact CD2-CD1 4.12Å; L698-L729 HydrophobicContact CD2-CD2 3.9Å; L698-L729 HydrophobicContact CG-CD1 4.44Å; L698-L729 HydrophobicContact CG-CD2 3.87Å; L698-L733 HydrophobicContact CD2-CD1 4.45Å
699	L	89.9	Confident	89.5	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-33.4	176.6	-173	67.5	0	0	0	112.7	D695 M697 C702 L703 H725 V728 L729 L732 M967	D695-L699 PolarHBondContact O-N 3.31Å; M697-L699 VanDerWaalsContact C-N 3.31Å; M697-L699 PolarHBondContact O-N 3.27Å; L699-C702 WeakPolarHBondContact O-CB 3.29Å; L699-L703 PolarHBondContact O-N 2.93Å; L699-H725 HydrophobicContact CD2-CB 4.43Å; L699-H725 VanDerWaalsContact CD2-ND1 3.34Å; L699-H725 WeakPolarHBondContact CD2-ND1 3.4Å; L699-V728 HydrophobicContact CD1-CB 4.39Å; L699-V728 HydrophobicContact CD1-CG1 3.54Å; L699-V728 HydrophobicContact CD2-CG1 4.46Å; L699-L729 HydrophobicContact CB-CD2 4.35Å; L699-L729 HydrophobicContact CB-CG 4.48Å; L699-L729 HydrophobicContact CD1-CD2 4.23Å; L699-L729 HydrophobicContact CD1-CG 4.37Å; L699-L732 HydrophobicContact CD1-CD1 3.5Å; L699-L732 VanDerWaalsContact CD1-CD1 3.5Å; L699-M967 HydrophobicContact CD1-CE 3.76Å; L699-M967 HydrophobicContact CG-CE 4.28Å; L699-M967 WeakPolarHBondContact O-CE 3.29Å
700	R	86.3	Confident	89.3	Confident	43 Å²	43	35.3 Å²	35.3	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-71.3	-36	171.5	152.1	166.8	-79.3	156.7	-2.5	112.5	G696 M697 L698 C702 L703 I704 E1014 P1016	G696-R700 PolarHBondContact O-N 3.43Å; M697-R700 WeakPolarHBondContact O-CB 3.38Å; M697-R700 PolarHBondContact O-N 3.22Å; L698-R700 PolarHBondContact O-N 2.93Å; R700-C702 VanDerWaalsContact C-N 3.31Å; R700-L703 WeakPolarHBondContact O-CB 3.27Å; R700-L703 PolarHBondContact O-N 2.65Å; R700-L703 VanDerWaalsContact O-N 3.16Å; R700-I704 PolarHBondContact O-N 3.14Å; R700-E1014 PolarHBondContact NH2-O 3.31Å; R700-P1016 VanDerWaalsContact NH2-CD 3.28Å
701	E	88.6	Confident	89.3	Confident	32 Å²	32	35.4 Å²	35.4	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-36.3	174.8	-71	173.7	-151	0	0	110.3	K691 M697 L698 L703 I704 D705 Y711	K691-E701 IonicContact NZ-OE1 3.75Å; K691-E701 PolarHBondContact NZ-OE1 2.87Å; K691-E701 IonicContact NZ-OE2 2.72Å; K691-E701 PolarHBondContact NZ-OE2 3.06Å; M697-E701 PolarHBondContact O-N 2.97Å; L698-E701 CarbonylContact O-C 3.58Å; L698-E701 WeakPolarHBondContact O-CA 3.43Å; L698-E701 PolarHBondContact O-N 2.93Å; E701-L703 VanDerWaalsContact C-N 3.25Å; E701-L703 PolarHBondContact O-N 3.44Å; E701-I704 PolarHBondContact O-N 3.13Å; E701-D705 PolarHBondContact O-N 3.24Å; E701-Y711 WeakPolarHBondContact OE2-CE2 3.49Å; E701-Y711 PolarHBondContact OE2-OH 2.9Å
702	C	88.3	Confident	89.2	Confident	10 Å²	10	34.7 Å²	34.7	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-27.7	168.3	-56.3	0	0	0	0	114.3	L698 L699 R700 I704 D705 L732 M967	L698-C702 PolarHBondContact O-N 2.88Å; L698-C702 PolarHBondContact O-SG 2.93Å; L699-C702 WeakPolarHBondContact O-CB 3.29Å; R700-C702 VanDerWaalsContact C-N 3.31Å; C702-I704 VanDerWaalsContact C-N 3.31Å; C702-D705 WeakPolarHBondContact CA-O 3.22Å; C702-L732 HydrophobicContact CB-CD1 4.44Å; C702-M967 HydrophobicContact CB-CE 3.76Å
703	L	84.2	Confident	89.1	Confident	55 Å²	55	34.7 Å²	34.7	29%	0.288	20%	0.195	S	C	.	.	H	α-helix	trans	-73	-22.9	174.4	-75.1	169.1	0	0	0	112.8	L699 R700 E701 S963 A966 M967	L699-L703 PolarHBondContact O-N 2.93Å; R700-L703 WeakPolarHBondContact O-CB 3.27Å; R700-L703 PolarHBondContact O-N 2.65Å; R700-L703 VanDerWaalsContact O-N 3.16Å; E701-L703 VanDerWaalsContact C-N 3.25Å; E701-L703 PolarHBondContact O-N 3.44Å; L703-S963 WeakPolarHBondContact CD2-O 3.4Å; L703-A966 HydrophobicContact CD2-CB 3.93Å; L703-M967 HydrophobicContact CD2-CE 3.67Å; L703-M967 HydrophobicContact CD2-CG 3.63Å; L703-M967 HydrophobicContact CD2-SD 4.49Å; L703-M967 HydrophobicContact CG-CE 3.63Å; L703-M967 HydrophobicContact CG-CG 4.49Å
704	I	84.9	Confident	89.1	Confident	137 Å²	137	34.7 Å²	34.7	70%	0.703	20%	0.195	S	C	*	.	H	α-helix	trans	-97.8	-39.8	-178.7	-59.5	171.5	0	0	0	110.2	R700 E701 C702	R700-I704 PolarHBondContact O-N 3.14Å; E701-I704 PolarHBondContact O-N 3.13Å; C702-I704 VanDerWaalsContact C-N 3.31Å
705	D	86.8	Confident	89.2	Confident	47 Å²	47	34.1 Å²	34.1	25%	0.251	19%	0.191	S	C	.	.			trans	-137.1	100.4	-179.6	174.8	6.2	0	0	0	109.6	E701 C702 E707 L708 G709	E701-D705 PolarHBondContact O-N 3.24Å; C702-D705 WeakPolarHBondContact CA-O 3.22Å; D705-E707 PolarHBondContact O-N 3.09Å; D705-E707 PolarHBondContact OD1-N 3.21Å; D705-L708 VanDerWaalsContact CG-N 3.32Å; D705-L708 PolarHBondContact O-N 3.05Å; D705-L708 PolarHBondContact OD1-N 3.44Å; D705-L708 WeakPolarHBondContact OD2-CA 3.35Å; D705-L708 PolarHBondContact OD2-N 3.44Å; D705-G709 PolarHBondContact OD2-N 3.34Å
706	S	83.5	Confident	89.2	Confident	59 Å²	59	34 Å²	34	41%	0.413	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.9	179.6	179.2	0	0	0	0	114	T736	S706-T736 PolarHBondContact O-OG1 2.98Å
707	E	84.6	Confident	89.3	Confident	109 Å²	109	32.9 Å²	32.9	51%	0.509	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-5.8	-178.6	-56.8	-166.7	154.2	0	0	112.2	D705 G709 R740	D705-E707 PolarHBondContact O-N 3.09Å; D705-E707 PolarHBondContact OD1-N 3.21Å; E707-G709 PolarHBondContact O-N 3.43Å; E707-R740 PolarHBondContact O-NH1 3.09Å; E707-R740 VanDerWaalsContact O-NH1 3.14Å
708	L	88.8	Confident	89.1	Confident	2 Å²	2	33 Å²	33	1%	0.01	18%	0.179	C	C	.	.			trans	52.3	41.6	174.4	-66.1	167.8	0	0	0	112	L698 D705 Q710 Y711 I714 L733 R740 M743	L698-L708 HydrophobicContact CD1-CD1 4.48Å; L698-L708 HydrophobicContact CD1-CD2 3.99Å; D705-L708 VanDerWaalsContact CG-N 3.32Å; D705-L708 PolarHBondContact O-N 3.05Å; D705-L708 PolarHBondContact OD1-N 3.44Å; D705-L708 WeakPolarHBondContact OD2-CA 3.35Å; D705-L708 PolarHBondContact OD2-N 3.44Å; L708-Q710 PolarHBondContact O-N 3.09Å; L708-Y711 HydrophobicContact CB-CD2 4.23Å; L708-Y711 HydrophobicContact CD2-CD2 4.29Å; L708-Y711 HydrophobicContact CD2-CE2 4.44Å; L708-Y711 PolarHBondContact O-N 2.8Å; L708-I714 HydrophobicContact CD1-CD1 3.82Å; L708-L733 HydrophobicContact CD1-CD2 3.55Å; L708-R740 VanDerWaalsContact C-NH1 3.35Å; L708-R740 PolarHBondContact O-NH1 2.94Å; L708-M743 HydrophobicContact CB-CE 4.4Å; L708-M743 HydrophobicContact CD1-CE 4.08Å
709	G	87.3	Confident	88.8	Confident	46 Å²	46	33 Å²	33	47%	0.474	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-20.9	-171.6	0	0	0	0	0	114.4	D705 E707 Y711	D705-G709 PolarHBondContact OD2-N 3.34Å; E707-G709 PolarHBondContact O-N 3.43Å; G709-Y711 VanDerWaalsContact C-N 3.28Å; G709-Y711 PolarHBondContact O-N 3Å
710	Q	88.9	Confident	88.5	Confident	115 Å²	115	33.8 Å²	33.8	54%	0.537	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.6	174.9	-57.5	-174.5	29.1	0	0	113.9	K644 L708	K644-Q710 PolarHBondContact N-O 3.46Å; L708-Q710 PolarHBondContact O-N 3.09Å
711	Y	92.6	Very high	88.1	Confident	3 Å²	3	33.4 Å²	33.4	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.3	-175.3	-61.8	-77.1	0	0	0	112.2	K644 K691 M693 L698 E701 L708 G709 I714 R740	K644-Y711 HydrophobicContact CB-CD1 4.01Å; K644-Y711 HydrophobicContact CB-CE1 4.13Å; K644-Y711 WeakPolarHBondContact O-CA 3.14Å; K691-Y711 HydrophobicContact CD-CE1 4.4Å; K691-Y711 WeakPolarHBondContact CD-OH 3.4Å; K691-Y711 PolarHBondContact NZ-OH 3.39Å; M693-Y711 HydrophobicContact CE-CE1 3.91Å; L698-Y711 HydrophobicContact CD1-CE2 4.4Å; E701-Y711 WeakPolarHBondContact OE2-CE2 3.49Å; E701-Y711 PolarHBondContact OE2-OH 2.9Å; L708-Y711 HydrophobicContact CB-CD2 4.23Å; L708-Y711 HydrophobicContact CD2-CD2 4.29Å; L708-Y711 HydrophobicContact CD2-CE2 4.44Å; L708-Y711 PolarHBondContact O-N 2.8Å; G709-Y711 VanDerWaalsContact C-N 3.28Å; G709-Y711 PolarHBondContact O-N 3Å; Y711-I714 HydrophobicContact CD2-CD1 4.27Å; Y711-I714 HydrophobicContact CG-CD1 4.2Å; Y711-I714 HydrophobicContact CG-CG1 4.24Å; Y711-R740 PolarHBondContact O-NH1 2.9Å; Y711-R740 PolarHBondContact O-NH2 2.86Å
712	A	92.4	Very high	88	Confident	3 Å²	3	32.8 Å²	32.8	3%	0.025	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-38.2	171.1	0	0	0	0	0	111.9	R642 K644 K744	R642-A712 HydrophobicContact CB-CB 3.93Å; K644-A712 PolarHBondContact O-N 3.21Å; A712-K744 PolarHBondContact O-N 3.15Å; A712-K744 VanDerWaalsContact O-N 3.14Å
713	I	93.3	Very high	88	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	136.4	175.7	-52.1	-171.7	0	0	0	109.1	V610 L634 Y639 G646 K744 I746	V610-I713 HydrophobicContact CG1-CD1 4.32Å; L634-I713 HydrophobicContact CB-CD1 4.34Å; L634-I713 HydrophobicContact CD1-CD1 4.02Å; L634-I713 HydrophobicContact CD1-CG2 4.34Å; L634-I713 HydrophobicContact CD2-CD1 4.03Å; L634-I713 HydrophobicContact CG-CD1 4.36Å; Y639-I713 HydrophobicContact CD1-CD1 3.78Å; Y639-I713 HydrophobicContact CD1-CG1 4.32Å; Y639-I713 HydrophobicContact CD2-CD1 3.93Å; Y639-I713 HydrophobicContact CE1-CD1 4.23Å; Y639-I713 HydrophobicContact CE2-CD1 4.37Å; Y639-I713 HydrophobicContact CG-CD1 3.61Å; Y639-I713 HydrophobicContact CG-CG1 4.4Å; G646-I713 PolarHBondContact N-O 3.48Å; I713-K744 WeakPolarHBondContact CA-O 3.41Å; I713-K744 HydrophobicContact CG1-CB 4.25Å; I713-K744 HydrophobicContact CG2-CB 4.48Å; I713-I746 HydrophobicContact CG2-CD1 3.96Å; I713-I746 HydrophobicContact CG2-CG1 4.18Å
714	I	94.4	Very high	88.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.9	166.4	-64.7	-172.1	0	0	0	110.1	G646 L698 L708 Y711 L716 L733 M743 K744 I746	G646-I714 CarbonylContact O-C 3.57Å; G646-I714 WeakPolarHBondContact O-CA 3.48Å; L698-I714 HydrophobicContact CD1-CD1 3.88Å; L698-I714 HydrophobicContact CD2-CD1 3.97Å; L698-I714 HydrophobicContact CD2-CG2 3.86Å; L708-I714 HydrophobicContact CD1-CD1 3.82Å; Y711-I714 HydrophobicContact CD2-CD1 4.27Å; Y711-I714 HydrophobicContact CG-CD1 4.2Å; Y711-I714 HydrophobicContact CG-CG1 4.24Å; I714-L716 HydrophobicContact CG2-CD2 3.99Å; I714-L716 HydrophobicContact CG2-CG 4.39Å; I714-L733 HydrophobicContact CD1-CD2 4.25Å; I714-L733 HydrophobicContact CG2-CD1 4.43Å; I714-M743 HydrophobicContact CB-CE 4.17Å; I714-M743 HydrophobicContact CD1-CE 3.49Å; I714-M743 VanDerWaalsContact CD1-CE 3.49Å; I714-M743 HydrophobicContact CG1-CE 3.73Å; I714-K744 PolarHBondContact N-O 3.44Å; I714-K744 VanDerWaalsContact N-O 3.08Å; I714-I746 PolarHBondContact O-N 3.08Å
715	M	94.6	Very high	88.5	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	110	174.5	176.2	174.5	166.9	0	0	109.1	I630 T631 G646 C647 T648 D717 I746 T748	I630-M715 HydrophobicContact CB-CE 4.29Å; I630-M715 HydrophobicContact CB-SD 3.97Å; I630-M715 HydrophobicContact CD1-CE 4.02Å; I630-M715 HydrophobicContact CG2-SD 3.82Å; T631-M715 HydrophobicContact CG2-SD 4.07Å; G646-M715 PolarHBondContact O-N 2.82Å; C647-M715 CarbonylContact C-O 3.53Å; C647-M715 WeakPolarHBondContact CA-O 3.36Å; C647-M715 HydrophobicContact CB-CB 4.38Å; T648-M715 PolarHBondContact N-O 3.05Å; M715-D717 HydrophobicContact CE-CB 4.02Å; M715-I746 CarbonylContact C-O 3.57Å; M715-I746 VanDerWaalsContact CA-O 3.31Å; M715-I746 WeakPolarHBondContact CA-O 3.24Å; M715-I746 HydrophobicContact CB-CB 4.42Å; M715-T748 HydrophobicContact CE-CG2 3.83Å; M715-T748 WeakPolarHBondContact CE-OG1 3.41Å; M715-T748 HydrophobicContact CG-CG2 4.28Å
716	L	93.1	Very high	88.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	105.2	172.1	-58.8	179.3	0	0	0	108.5	T648 L698 I714 L729 F730 L733 L745 I746 T748	T648-L716 HydrophobicContact CG2-CD2 3.75Å; L698-L716 HydrophobicContact CD2-CD2 4.26Å; I714-L716 HydrophobicContact CG2-CD2 3.99Å; I714-L716 HydrophobicContact CG2-CG 4.39Å; L716-L729 HydrophobicContact CD2-CD1 4.39Å; L716-F730 HydrophobicContact CD1-CD1 3.55Å; L716-F730 HydrophobicContact CD1-CE1 3.58Å; L716-L733 HydrophobicContact CD1-CD1 3.79Å; L716-L733 HydrophobicContact CD2-CD1 3.93Å; L716-L733 HydrophobicContact CG-CD1 4.18Å; L716-L745 HydrophobicContact CD1-CD1 4.03Å; L716-L745 HydrophobicContact CG-CD1 4.07Å; L716-I746 PolarHBondContact N-O 3.44Å; L716-T748 PolarHBondContact O-N 3.22Å; L716-T748 PolarHBondContact O-OG1 2.72Å
717	D	90.6	Very high	88.9	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.126	C	C	.	.			trans	-107.2	153.2	-174.4	-173.2	42.1	0	0	0	113.9	T627 Q649 M715 A719 T748	T627-D717 WeakPolarHBondContact CB-OD2 3.48Å; T627-D717 WeakPolarHBondContact CG2-OD2 3.33Å; T627-D717 PolarHBondContact OG1-OD2 3.37Å; Q649-D717 PolarHBondContact NE2-OD2 3.16Å; M715-D717 HydrophobicContact CE-CB 4.02Å; D717-A719 PolarHBondContact O-N 3.27Å; D717-T748 WeakPolarHBondContact CA-OG1 3.47Å; D717-T748 WeakPolarHBondContact CB-OG1 3.42Å; D717-T748 WeakPolarHBondContact OD1-CB 3.39Å; D717-T748 PolarHBondContact OD1-OG1 3.39Å
718	E	86.6	Confident	89.2	Confident	21 Å²	21	18.8 Å²	18.8	10%	0.098	10%	0.102	C	C	.	.	S	Bend	trans	48.5	40.4	-166	-54.7	-67.8	-136.2	0	0	113	K626 P650 H720 E721 T748	K626-E718 IonicContact NZ-OE2 2.65Å; P650-E718 HydrophobicContact CG-CB 4.25Å; E718-H720 VanDerWaalsContact CD-CE1 3.47Å; E718-H720 PolarHBondContact O-N 3.1Å; E718-H720 IonicContact OE1-CE1 2.67Å; E718-H720 IonicContact OE2-CE1 3.11Å; E718-H720 PolarHBondContact OE2-CE1 3.37Å; E718-H720 IonicContact OE2-ND1 3.14Å; E718-H720 PolarHBondContact OE2-ND1 3.46Å; E718-E721 PolarHBondContact O-N 3.08Å; E718-T748 PolarHBondContact N-O 2.85Å
719	A	85.4	Confident	89.3	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-49.6	-17.8	174.5	0	0	0	0	0	114.5	D717 E721 R722 F730 V747 T748 F757	D717-A719 PolarHBondContact O-N 3.27Å; A719-E721 VanDerWaalsContact C-N 3.34Å; A719-R722 WeakPolarHBondContact O-CD 3.46Å; A719-R722 PolarHBondContact O-N 3.19Å; A719-F730 HydrophobicContact CB-CE1 4.38Å; A719-F730 HydrophobicContact CB-CZ 3.93Å; A719-V747 HydrophobicContact CB-CG1 3.7Å; A719-T748 PolarHBondContact N-O 3.41Å; A719-F757 HydrophobicContact CB-CE1 4.01Å; A719-F757 HydrophobicContact CB-CZ 4.21Å
720	H	82.8	Confident	89.5	Confident	24 Å²	24	16.5 Å²	16.5	11%	0.111	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-72.6	-16	174.9	77.8	-97.3	0	0	0	114.6	E718 R722 T751 T876 Q918	E718-H720 VanDerWaalsContact CD-CE1 3.47Å; E718-H720 PolarHBondContact O-N 3.1Å; E718-H720 IonicContact OE1-CE1 2.67Å; E718-H720 IonicContact OE2-CE1 3.11Å; E718-H720 PolarHBondContact OE2-CE1 3.37Å; E718-H720 IonicContact OE2-ND1 3.14Å; E718-H720 PolarHBondContact OE2-ND1 3.46Å; H720-R722 PolarHBondContact O-N 2.94Å; H720-T751 HydrophobicContact CB-CG2 3.75Å; H720-T751 WeakPolarHBondContact CB-OG1 3.47Å; H720-T876 WeakPolarHBondContact NE2-CG2 3.47Å; H720-Q918 PolarHBondContact CD2-NE2 3.47Å; H720-Q918 PolarHBondContact NE2-NE2 3.29Å
721	E	77.9	Confident	89.5	Confident	35 Å²	35	11 Å²	11	16%	0.164	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-71.3	-18.4	174.2	-63.6	-151.4	152.9	0	0	112.1	P650 R651 E718 A719 T723 T876	P650-E721 WeakPolarHBondContact CB-OE2 3.28Å; P650-E721 HydrophobicContact CG-CB 4.35Å; P650-E721 HydrophobicContact CG-CG 4.18Å; P650-E721 VanDerWaalsContact CG-OE2 3.32Å; P650-E721 WeakPolarHBondContact CG-OE2 3.31Å; R651-E721 IonicContact CZ-OE1 3.32Å; R651-E721 IonicContact CZ-OE2 2.66Å; R651-E721 IonicContact NE-OE1 3.52Å; R651-E721 PolarHBondContact NE-OE1 3.43Å; R651-E721 IonicContact NE-OE2 3.68Å; R651-E721 PolarHBondContact NE-OE2 2.95Å; R651-E721 VanDerWaalsContact NE-OE2 3.07Å; R651-E721 IonicContact NH2-OE1 2.63Å; R651-E721 PolarHBondContact NH2-OE1 2.79Å; R651-E721 IonicContact NH2-OE2 3.51Å; E718-E721 PolarHBondContact O-N 3.08Å; A719-E721 VanDerWaalsContact C-N 3.34Å; E721-T723 HydrophobicContact CB-CG2 4.26Å; E721-T723 PolarHBondContact O-N 2.81Å; E721-T876 VanDerWaalsContact OE1-CB 3.23Å; E721-T876 WeakPolarHBondContact OE1-CB 3.25Å; E721-T876 WeakPolarHBondContact OE1-CG2 3.29Å; E721-T876 PolarHBondContact OE1-OG1 3.3Å
722	R	86.1	Confident	89.4	Confident	19 Å²	19	11.7 Å²	11.7	7%	0.072	6%	0.057	C	C	.	.			trans	48.3	50.9	173.3	-64.4	-64.4	-55.6	-81.8	-8.2	113.6	A719 H720 D727 P950 E951 D979	A719-R722 WeakPolarHBondContact O-CD 3.46Å; A719-R722 PolarHBondContact O-N 3.19Å; H720-R722 PolarHBondContact O-N 2.94Å; R722-D727 IonicContact CZ-OD1 3.26Å; R722-D727 IonicContact CZ-OD2 2.68Å; R722-D727 IonicContact NE-OD1 3.58Å; R722-D727 PolarHBondContact NE-OD1 3.45Å; R722-D727 IonicContact NE-OD2 3.43Å; R722-D727 PolarHBondContact NE-OD2 3.41Å; R722-D727 IonicContact NH2-OD1 2.96Å; R722-D727 IonicContact NH2-OD2 2.75Å; R722-D727 PolarHBondContact NH2-OD2 2.78Å; R722-P950 HydrophobicContact CB-CB 4.47Å; R722-E951 WeakPolarHBondContact O-CB 3.2Å; R722-E951 PolarHBondContact O-N 3.3Å; R722-D979 IonicContact CZ-OD2 2.85Å; R722-D979 IonicContact NH1-OD2 2.63Å; R722-D979 PolarHBondContact NH1-OD2 3.02Å; R722-D979 IonicContact NH2-OD2 3.28Å; R722-D979 PolarHBondContact NH2-OD2 2.89Å
723	T	88.2	Confident	89.3	Confident	22 Å²	22	11.5 Å²	11.5	14%	0.135	6%	0.056	C	C	.	.			trans	-73.2	158.5	177.1	86.7	0	0	0	0	111	P650 E721 H725 T726 D727 E951	P650-T723 HydrophobicContact CB-CG2 3.86Å; E721-T723 HydrophobicContact CB-CG2 4.26Å; E721-T723 PolarHBondContact O-N 2.81Å; T723-H725 PolarHBondContact O-N 3.09Å; T723-H725 PolarHBondContact OG1-N 3.47Å; T723-T726 PolarHBondContact O-N 3.4Å; T723-T726 VanDerWaalsContact O-N 3.1Å; T723-T726 PolarHBondContact OG1-N 3.12Å; T723-T726 VanDerWaalsContact OG1-N 3.17Å; T723-T726 PolarHBondContact OG1-OG1 3.09Å; T723-D727 PolarHBondContact O-N 2.93Å; T723-E951 WeakPolarHBondContact CA-OE2 3.31Å; T723-E951 WeakPolarHBondContact CB-OE2 3.34Å
724	I	89.5	Confident	89.2	Confident	22 Å²	22	12.1 Å²	12.1	11%	0.113	6%	0.058	C	C	.	.	H	α-helix	trans	-54.4	-42	178	-51.8	154.5	0	0	0	110.7	V728 E951 I952 T955 L957 T960	I724-V728 WeakPolarHBondContact O-CB 3.49Å; I724-V728 VanDerWaalsContact O-CG2 3.22Å; I724-V728 WeakPolarHBondContact O-CG2 3.5Å; I724-V728 PolarHBondContact O-N 3.33Å; I724-V728 VanDerWaalsContact O-N 3.13Å; I724-E951 HydrophobicContact CD1-CG 4.06Å; I724-E951 HydrophobicContact CG1-CB 3.94Å; I724-E951 HydrophobicContact CG1-CG 3.68Å; I724-E951 WeakPolarHBondContact CG1-OE2 3.39Å; I724-E951 PolarHBondContact N-OE2 3.01Å; I724-I952 HydrophobicContact CG2-CG1 4.35Å; I724-T955 HydrophobicContact CD1-CG2 4.2Å; I724-T955 WeakPolarHBondContact CD1-OG1 3.19Å; I724-L957 HydrophobicContact CG2-CD2 4.5Å; I724-T960 HydrophobicContact CG2-CG2 4.06Å; I724-T960 WeakPolarHBondContact CG2-OG1 3.46Å
725	H	90.3	Very high	88.9	Confident	75 Å²	75	15.7 Å²	15.7	35%	0.347	7%	0.074	S	C	.	.	H	α-helix	trans	-70.5	-37.7	-179	-62.6	-41.6	0	0	0	112.2	D695 L699 T723 L729	D695-H725 HydrophobicContact CB-CB 3.78Å; L699-H725 HydrophobicContact CD2-CB 4.43Å; L699-H725 VanDerWaalsContact CD2-ND1 3.34Å; L699-H725 WeakPolarHBondContact CD2-ND1 3.4Å; T723-H725 PolarHBondContact O-N 3.09Å; T723-H725 PolarHBondContact OG1-N 3.47Å; H725-L729 VanDerWaalsContact O-CB 3.3Å; H725-L729 WeakPolarHBondContact O-CB 3.46Å; H725-L729 WeakPolarHBondContact O-CG 3.42Å; H725-L729 PolarHBondContact O-N 2.95Å
726	T	90.6	Very high	88.6	Confident	2 Å²	2	16 Å²	16	1%	0.012	8%	0.076	C	C	.	.	H	α-helix	trans	-64.6	-45.6	177.2	-32.5	0	0	0	0	110.9	D695 T723 V728 L729 F730	D695-T726 WeakPolarHBondContact OD2-CB 3.43Å; D695-T726 PolarHBondContact OD2-OG1 3.41Å; T723-T726 PolarHBondContact O-N 3.4Å; T723-T726 VanDerWaalsContact O-N 3.1Å; T723-T726 PolarHBondContact OG1-N 3.12Å; T723-T726 VanDerWaalsContact OG1-N 3.17Å; T723-T726 PolarHBondContact OG1-OG1 3.09Å; T726-V728 PolarHBondContact O-N 2.89Å; T726-L729 WeakPolarHBondContact O-CB 3.16Å; T726-L729 PolarHBondContact O-N 3.01Å; T726-F730 HydrophobicContact CG2-CE1 3.9Å; T726-F730 HydrophobicContact CG2-CE2 4.13Å; T726-F730 HydrophobicContact CG2-CZ 3.53Å; T726-F730 WeakPolarHBondContact O-CG 3.49Å; T726-F730 PolarHBondContact O-N 2.7Å
727	D	89.6	Confident	88.5	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-66.9	-37.7	-178.9	-79.4	19.1	0	0	0	112.8	R722 T723 F730 G731	R722-D727 IonicContact CZ-OD1 3.26Å; R722-D727 IonicContact CZ-OD2 2.68Å; R722-D727 IonicContact NE-OD1 3.58Å; R722-D727 PolarHBondContact NE-OD1 3.45Å; R722-D727 IonicContact NE-OD2 3.43Å; R722-D727 PolarHBondContact NE-OD2 3.41Å; R722-D727 IonicContact NH2-OD1 2.96Å; R722-D727 IonicContact NH2-OD2 2.75Å; R722-D727 PolarHBondContact NH2-OD2 2.78Å; T723-D727 PolarHBondContact O-N 2.93Å; D727-F730 PolarHBondContact O-N 3.09Å; D727-G731 PolarHBondContact O-N 2.64Å
728	V	90.2	Very high	88.4	Confident	2 Å²	2	22 Å²	22	1%	0.012	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-42.7	171.9	171.7	0	0	0	0	110.9	L699 I724 T726 F730 G731 L732 I952 T960 L964 F977	L699-V728 HydrophobicContact CD1-CB 4.39Å; L699-V728 HydrophobicContact CD1-CG1 3.54Å; L699-V728 HydrophobicContact CD2-CG1 4.46Å; I724-V728 WeakPolarHBondContact O-CB 3.49Å; I724-V728 VanDerWaalsContact O-CG2 3.22Å; I724-V728 WeakPolarHBondContact O-CG2 3.5Å; I724-V728 PolarHBondContact O-N 3.33Å; I724-V728 VanDerWaalsContact O-N 3.13Å; T726-V728 PolarHBondContact O-N 2.89Å; V728-F730 VanDerWaalsContact C-N 3.29Å; V728-F730 PolarHBondContact O-N 3.11Å; V728-G731 PolarHBondContact O-N 2.91Å; V728-L732 HydrophobicContact CG1-CD1 3.77Å; V728-L732 HydrophobicContact CG1-CG 4.27Å; V728-L732 VanDerWaalsContact O-CG 3.32Å; V728-L732 WeakPolarHBondContact O-CG 3.4Å; V728-L732 PolarHBondContact O-N 3.12Å; V728-I952 HydrophobicContact CG2-CD1 4.46Å; V728-T960 HydrophobicContact CG2-CG2 3.57Å; V728-L964 HydrophobicContact CG1-CD2 3.92Å; V728-F977 HydrophobicContact CG2-CE1 4.39Å
729	L	91.1	Very high	88.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.1	-35.6	176.1	-79.3	170	0	0	0	112.3	D695 L698 L699 L716 H725 T726 L732 L733	D695-L729 HydrophobicContact CB-CD1 3.97Å; L698-L729 HydrophobicContact CB-CD1 4.29Å; L698-L729 HydrophobicContact CB-CD2 4.38Å; L698-L729 HydrophobicContact CD2-CD1 4.12Å; L698-L729 HydrophobicContact CD2-CD2 3.9Å; L698-L729 HydrophobicContact CG-CD1 4.44Å; L698-L729 HydrophobicContact CG-CD2 3.87Å; L699-L729 HydrophobicContact CB-CD2 4.35Å; L699-L729 HydrophobicContact CB-CG 4.48Å; L699-L729 HydrophobicContact CD1-CD2 4.23Å; L699-L729 HydrophobicContact CD1-CG 4.37Å; L716-L729 HydrophobicContact CD2-CD1 4.39Å; H725-L729 VanDerWaalsContact O-CB 3.3Å; H725-L729 WeakPolarHBondContact O-CB 3.46Å; H725-L729 WeakPolarHBondContact O-CG 3.42Å; H725-L729 PolarHBondContact O-N 2.95Å; T726-L729 WeakPolarHBondContact O-CB 3.16Å; T726-L729 PolarHBondContact O-N 3.01Å; L729-L732 PolarHBondContact O-N 3.46Å; L729-L733 HydrophobicContact CB-CD1 4.2Å; L729-L733 HydrophobicContact CD2-CD1 4.38Å; L729-L733 WeakPolarHBondContact O-CB 3.38Å; L729-L733 WeakPolarHBondContact O-CD1 3.35Å; L729-L733 VanDerWaalsContact O-CG 3.28Å; L729-L733 WeakPolarHBondContact O-CG 3.48Å; L729-L733 PolarHBondContact O-N 3.46Å
730	F	91.4	Very high	88.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-51.9	173.7	-62.8	-33.8	0	0	0	111.9	L716 A719 T726 D727 V728 L732 L733 K734 V747 F757 Y760 F761 M978	L716-F730 HydrophobicContact CD1-CD1 3.55Å; L716-F730 HydrophobicContact CD1-CE1 3.58Å; A719-F730 HydrophobicContact CB-CE1 4.38Å; A719-F730 HydrophobicContact CB-CZ 3.93Å; T726-F730 HydrophobicContact CG2-CE1 3.9Å; T726-F730 HydrophobicContact CG2-CE2 4.13Å; T726-F730 HydrophobicContact CG2-CZ 3.53Å; T726-F730 WeakPolarHBondContact O-CG 3.49Å; T726-F730 PolarHBondContact O-N 2.7Å; D727-F730 PolarHBondContact O-N 3.09Å; V728-F730 VanDerWaalsContact C-N 3.29Å; V728-F730 PolarHBondContact O-N 3.11Å; F730-L732 VanDerWaalsContact C-N 3.32Å; F730-L732 PolarHBondContact O-N 3.12Å; F730-L733 PolarHBondContact O-N 3.45Å; F730-K734 WeakPolarHBondContact O-CB 3.49Å; F730-K734 PolarHBondContact O-N 3.09Å; F730-V747 HydrophobicContact CE1-CG1 4.25Å; F730-F757 AromaticContact CE2-CE1 3.93Å; F730-F757 HydrophobicContact CE2-CE1 3.93Å; F730-F757 HydrophobicContact CZ-CD1 4.49Å; F730-F757 AromaticContact CZ-CE1 3.74Å; F730-F757 HydrophobicContact CZ-CE1 3.74Å; F730-Y760 HydrophobicContact CB-CE1 3.86Å; F730-F761 HydrophobicContact CB-CZ 3.96Å; F730-F761 HydrophobicContact CD1-CE2 4.18Å; F730-F761 AromaticContact CD1-CZ 3.76Å; F730-F761 HydrophobicContact CD1-CZ 3.76Å; F730-F761 HydrophobicContact CG-CZ 4.06Å; F730-M978 HydrophobicContact CD2-CE 3.88Å; F730-M978 HydrophobicContact CE2-CE 4.13Å; F730-M978 HydrophobicContact CG-CE 4.5Å
731	G	89.4	Confident	88.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.3	-26.5	-178.9	0	0	0	0	0	114.4	D727 V728 K735 Y760	D727-G731 PolarHBondContact O-N 2.64Å; V728-G731 PolarHBondContact O-N 2.91Å; G731-K735 WeakPolarHBondContact O-CD 3Å; G731-K735 WeakPolarHBondContact O-CG 3.39Å; G731-Y760 VanDerWaalsContact CA-OH 3.22Å; G731-Y760 WeakPolarHBondContact CA-OH 3.5Å; G731-Y760 PolarHBondContact N-OH 2.93Å
732	L	89.9	Confident	89.1	Confident	16 Å²	16	36 Å²	36	8%	0.084	18%	0.177	C	C	.	.	H	α-helix	trans	-74	-54.6	171.2	-68	171.9	0	0	0	111.4	L699 C702 V728 L729 F730 K734 K735 T736 M967 I969	L699-L732 HydrophobicContact CD1-CD1 3.5Å; L699-L732 VanDerWaalsContact CD1-CD1 3.5Å; C702-L732 HydrophobicContact CB-CD1 4.44Å; V728-L732 HydrophobicContact CG1-CD1 3.77Å; V728-L732 HydrophobicContact CG1-CG 4.27Å; V728-L732 VanDerWaalsContact O-CG 3.32Å; V728-L732 WeakPolarHBondContact O-CG 3.4Å; V728-L732 PolarHBondContact O-N 3.12Å; L729-L732 PolarHBondContact O-N 3.46Å; F730-L732 VanDerWaalsContact C-N 3.32Å; F730-L732 PolarHBondContact O-N 3.12Å; L732-K734 VanDerWaalsContact C-N 3.32Å; L732-K734 PolarHBondContact O-N 2.94Å; L732-K735 WeakPolarHBondContact O-CA 3.48Å; L732-K735 WeakPolarHBondContact O-CB 3.28Å; L732-K735 PolarHBondContact O-N 3.11Å; L732-T736 PolarHBondContact O-N 2.68Å; L732-T736 PolarHBondContact O-OG1 3.03Å; L732-M967 HydrophobicContact CD1-CE 3.81Å; L732-M967 HydrophobicContact CD1-SD 3.51Å; L732-M967 VanDerWaalsContact CD1-SD 3.51Å; L732-M967 HydrophobicContact CD2-SD 3.53Å; L732-M967 VanDerWaalsContact CD2-SD 3.53Å; L732-M967 HydrophobicContact CG-SD 4.17Å; L732-I969 HydrophobicContact CD2-CD1 3.64Å
733	L	90.9	Very high	89.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-34.1	-175.7	-70.3	163.7	0	0	0	111.7	L698 L708 I714 L716 L729 F730 K735 T736 V737 M743 L745	L698-L733 HydrophobicContact CD2-CD1 4.45Å; L708-L733 HydrophobicContact CD1-CD2 3.55Å; I714-L733 HydrophobicContact CD1-CD2 4.25Å; I714-L733 HydrophobicContact CG2-CD1 4.43Å; L716-L733 HydrophobicContact CD1-CD1 3.79Å; L716-L733 HydrophobicContact CD2-CD1 3.93Å; L716-L733 HydrophobicContact CG-CD1 4.18Å; L729-L733 HydrophobicContact CB-CD1 4.2Å; L729-L733 HydrophobicContact CD2-CD1 4.38Å; L729-L733 WeakPolarHBondContact O-CB 3.38Å; L729-L733 WeakPolarHBondContact O-CD1 3.35Å; L729-L733 VanDerWaalsContact O-CG 3.28Å; L729-L733 WeakPolarHBondContact O-CG 3.48Å; L729-L733 PolarHBondContact O-N 3.46Å; F730-L733 PolarHBondContact O-N 3.45Å; L733-K735 VanDerWaalsContact C-N 3.26Å; L733-K735 PolarHBondContact O-N 3.49Å; L733-T736 PolarHBondContact O-N 3.09Å; L733-V737 WeakPolarHBondContact O-CB 2.99Å; L733-V737 WeakPolarHBondContact O-CG2 3.39Å; L733-V737 PolarHBondContact O-N 2.87Å; L733-M743 HydrophobicContact CD2-CE 3.68Å; L733-L745 HydrophobicContact CB-CD1 4.48Å; L733-L745 HydrophobicContact CB-CD2 4.22Å; L733-L745 HydrophobicContact CD1-CD1 4.11Å
734	K	90.1	Very high	89.5	Confident	13 Å²	13	35.4 Å²	35.4	6%	0.057	17%	0.173	C	C	.	.	H	α-helix	trans	-54.9	-41.4	170.2	-173.8	171.1	174.7	-173.8	0	111.8	F730 L732 Q738 Y760 F761 Y762 D976	F730-K734 WeakPolarHBondContact O-CB 3.49Å; F730-K734 PolarHBondContact O-N 3.09Å; L732-K734 VanDerWaalsContact C-N 3.32Å; L732-K734 PolarHBondContact O-N 2.94Å; K734-Q738 WeakPolarHBondContact O-CG 3.4Å; K734-Q738 PolarHBondContact O-N 2.94Å; K734-Y760 HydrophobicContact CD-CD1 4.27Å; K734-Y760 HydrophobicContact CD-CE1 3.62Å; K734-Y760 HydrophobicContact CD-CE2 4.25Å; K734-Y760 WeakPolarHBondContact CE-O 3.45Å; K734-Y760 PolarHBondContact NZ-O 3.03Å; K734-F761 HydrophobicContact CB-CD1 4.49Å; K734-F761 HydrophobicContact CB-CE1 4.13Å; K734-F761 HydrophobicContact CG-CD1 4.48Å; K734-Y762 HydrophobicContact CD-CE2 4.42Å; K734-Y762 VanDerWaalsContact CE-CZ 3.44Å; K734-Y762 VanDerWaalsContact CE-OH 3.24Å; K734-Y762 WeakPolarHBondContact CE-OH 3.37Å; K734-Y762 HydrophobicContact CG-CE2 3.81Å; K734-Y762 WeakPolarHBondContact CG-OH 3.42Å; K734-D976 WeakPolarHBondContact CD-OD2 3.35Å; K734-D976 WeakPolarHBondContact CE-OD2 3.43Å; K734-D976 IonicContact NZ-OD1 2.74Å; K734-D976 PolarHBondContact NZ-OD1 2.94Å; K734-D976 IonicContact NZ-OD2 3.16Å; K734-D976 PolarHBondContact NZ-OD2 2.88Å
735	K	87.9	Confident	89.7	Confident	74 Å²	74	34.4 Å²	34.4	32%	0.322	17%	0.167	S	C	.	.	H	α-helix	trans	-75.7	-37.4	175.9	-68.1	172	178.7	174.7	0	113	G731 L732 L733 K739 F975	G731-K735 WeakPolarHBondContact O-CD 3Å; G731-K735 WeakPolarHBondContact O-CG 3.39Å; L732-K735 WeakPolarHBondContact O-CA 3.48Å; L732-K735 WeakPolarHBondContact O-CB 3.28Å; L732-K735 PolarHBondContact O-N 3.11Å; L733-K735 VanDerWaalsContact C-N 3.26Å; L733-K735 PolarHBondContact O-N 3.49Å; K735-K739 PolarHBondContact O-N 2.59Å; K735-F975 HydrophobicContact CD-CE2 4.48Å
736	T	89.3	Confident	89.9	Confident	10 Å²	10	30.9 Å²	30.9	6%	0.061	15%	0.151	C	C	.	.	H	α-helix	trans	-68.1	-42.7	176.7	-57.7	0	0	0	0	111.6	S706 L732 L733 Q738 K739 R740 M743	S706-T736 PolarHBondContact O-OG1 2.98Å; L732-T736 PolarHBondContact O-N 2.68Å; L732-T736 PolarHBondContact O-OG1 3.03Å; L733-T736 PolarHBondContact O-N 3.09Å; T736-Q738 VanDerWaalsContact C-N 3.32Å; T736-Q738 PolarHBondContact O-N 3.06Å; T736-K739 WeakPolarHBondContact O-CB 3.46Å; T736-K739 PolarHBondContact O-N 3.27Å; T736-R740 WeakPolarHBondContact O-CB 3.43Å; T736-R740 PolarHBondContact O-N 2.61Å; T736-M743 HydrophobicContact CG2-SD 3.89Å
737	V	90.4	Very high	90	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.024	15%	0.151	C	C	.	.	H	α-helix	trans	-60.4	-38.7	175.9	167.2	0	0	0	0	111.5	Q614 I615 L733 K739 R740 L745	Q614-V737 VanDerWaalsContact CD-CG1 3.46Å; Q614-V737 HydrophobicContact CG-CG1 4.05Å; Q614-V737 VanDerWaalsContact NE2-CG1 3.34Å; Q614-V737 PolarHBondContact NE2-O 2.82Å; I615-V737 HydrophobicContact CD1-CG1 4.04Å; I615-V737 HydrophobicContact CG1-CG1 3.87Å; L733-V737 WeakPolarHBondContact O-CB 2.99Å; L733-V737 WeakPolarHBondContact O-CG2 3.39Å; L733-V737 PolarHBondContact O-N 2.87Å; V737-K739 PolarHBondContact O-N 3.44Å; V737-R740 PolarHBondContact O-N 2.95Å; V737-L745 HydrophobicContact CG2-CB 4.01Å; V737-L745 HydrophobicContact CG2-CD2 4.35Å
738	Q	88.3	Confident	90	Very high	122 Å²	122	30.8 Å²	30.8	57%	0.57	15%	0.151	S	C	*	.	H	α-helix	trans	-63.9	-34.5	172.2	-78.3	-173.3	-43.1	0	0	113.9	K734 T736 Y762	K734-Q738 WeakPolarHBondContact O-CG 3.4Å; K734-Q738 PolarHBondContact O-N 2.94Å; T736-Q738 VanDerWaalsContact C-N 3.32Å; T736-Q738 PolarHBondContact O-N 3.06Å; Q738-Y762 HydrophobicContact CG-CE2 4.38Å; Q738-Y762 PolarHBondContact NE2-OH 3.48Å; Q738-Y762 VanDerWaalsContact NE2-OH 3.08Å
739	K	88.6	Confident	89.6	Confident	141 Å²	141	30.8 Å²	30.8	61%	0.613	15%	0.151	S	C	*	.	H	α-helix	trans	-78.4	-35.4	176.3	-69.8	178.2	174.8	-173.4	0	112.7	K735 T736 V737	K735-K739 PolarHBondContact O-N 2.59Å; T736-K739 WeakPolarHBondContact O-CB 3.46Å; T736-K739 PolarHBondContact O-N 3.27Å; V737-K739 PolarHBondContact O-N 3.44Å
740	R	87.3	Confident	88.8	Confident	35 Å²	35	32 Å²	32	13%	0.132	16%	0.161	C	C	.	.			trans	-123.5	89.1	-163.2	-171.9	176.4	167.6	-148.9	-12.1	111	Q614 E707 L708 Y711 T736 V737 D742 M743	Q614-R740 PolarHBondContact NE2-O 2.87Å; E707-R740 PolarHBondContact O-NH1 3.09Å; E707-R740 VanDerWaalsContact O-NH1 3.14Å; L708-R740 VanDerWaalsContact C-NH1 3.35Å; L708-R740 PolarHBondContact O-NH1 2.94Å; Y711-R740 PolarHBondContact O-NH1 2.9Å; Y711-R740 PolarHBondContact O-NH2 2.86Å; T736-R740 WeakPolarHBondContact O-CB 3.43Å; T736-R740 PolarHBondContact O-N 2.61Å; V737-R740 PolarHBondContact O-N 2.95Å; R740-D742 VanDerWaalsContact C-N 3.31Å; R740-D742 WeakPolarHBondContact CG-OD1 3.33Å; R740-D742 IonicContact CZ-OD2 3.72Å; R740-D742 VanDerWaalsContact CZ-OD2 3.28Å; R740-D742 IonicContact NE-OD1 3.35Å; R740-D742 PolarHBondContact NE-OD1 3.04Å; R740-D742 IonicContact NE-OD2 3.84Å; R740-D742 PolarHBondContact NE-OD2 2.85Å; R740-D742 IonicContact NH2-OD2 2.69Å; R740-D742 PolarHBondContact NH2-OD2 2.92Å; R740-D742 PolarHBondContact O-N 2.93Å; R740-M743 HydrophobicContact CB-CB 4.39Å; R740-M743 HydrophobicContact CG-CB 3.97Å; R740-M743 PolarHBondContact O-N 2.83Å
741	T	84.6	Confident	87.7	Confident	115 Å²	115	33.2 Å²	33.2	71%	0.706	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.8	-173.2	52	0	0	0	0	115
742	D	87.6	Confident	86.2	Confident	83 Å²	83	39.4 Å²	39.4	44%	0.444	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-21.2	173.6	64.2	-68.7	0	0	0	113.4	R740	R740-D742 VanDerWaalsContact C-N 3.31Å; R740-D742 WeakPolarHBondContact CG-OD1 3.33Å; R740-D742 IonicContact CZ-OD2 3.72Å; R740-D742 VanDerWaalsContact CZ-OD2 3.28Å; R740-D742 IonicContact NE-OD1 3.35Å; R740-D742 PolarHBondContact NE-OD1 3.04Å; R740-D742 IonicContact NE-OD2 3.84Å; R740-D742 PolarHBondContact NE-OD2 2.85Å; R740-D742 IonicContact NH2-OD2 2.69Å; R740-D742 PolarHBondContact NH2-OD2 2.92Å; R740-D742 PolarHBondContact O-N 2.93Å
743	M	90.2	Very high	85.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.			trans	-81.1	131.8	179	-176	-176.6	-178	0	0	110.8	Q614 L708 I714 L733 T736 R740	Q614-M743 VanDerWaalsContact CG-O 3.24Å; Q614-M743 WeakPolarHBondContact CG-O 3.27Å; Q614-M743 PolarHBondContact NE2-O 3.29Å; Q614-M743 VanDerWaalsContact NE2-O 3.11Å; L708-M743 HydrophobicContact CB-CE 4.4Å; L708-M743 HydrophobicContact CD1-CE 4.08Å; I714-M743 HydrophobicContact CB-CE 4.17Å; I714-M743 HydrophobicContact CD1-CE 3.49Å; I714-M743 VanDerWaalsContact CD1-CE 3.49Å; I714-M743 HydrophobicContact CG1-CE 3.73Å; L733-M743 HydrophobicContact CD2-CE 3.68Å; T736-M743 HydrophobicContact CG2-SD 3.89Å; R740-M743 HydrophobicContact CB-CB 4.39Å; R740-M743 HydrophobicContact CG-CB 3.97Å; R740-M743 PolarHBondContact O-N 2.83Å
744	K	92.3	Very high	84.3	Confident	28 Å²	28	40.6 Å²	40.6	12%	0.122	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	142.2	175.1	-64.7	176	173.2	-69.7	0	112	V610 H611 N613 Q614 Y639 A712 I713 I714	V610-K744 HydrophobicContact CG1-CD 4.04Å; V610-K744 VanDerWaalsContact O-CD 3.29Å; V610-K744 WeakPolarHBondContact O-CD 3.22Å; V610-K744 WeakPolarHBondContact O-CE 3.32Å; V610-K744 PolarHBondContact O-NZ 3.41Å; H611-K744 PolarHBondContact O-NZ 3.45Å; N613-K744 PolarHBondContact O-NZ 3.49Å; Q614-K744 WeakPolarHBondContact O-CA 3.44Å; Y639-K744 HydrophobicContact CE1-CD 4.04Å; A712-K744 PolarHBondContact O-N 3.15Å; A712-K744 VanDerWaalsContact O-N 3.14Å; I713-K744 WeakPolarHBondContact CA-O 3.41Å; I713-K744 HydrophobicContact CG1-CB 4.25Å; I713-K744 HydrophobicContact CG2-CB 4.48Å; I714-K744 PolarHBondContact N-O 3.44Å; I714-K744 VanDerWaalsContact N-O 3.08Å
745	L	93.8	Very high	84	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126	179.4	178.6	63.8	0	0	0	110.2	Q614 I615 L616 L716 L733 V737 V747 F761	Q614-L745 PolarHBondContact O-N 2.67Å; I615-L745 CarbonylContact C-O 3.32Å; I615-L745 VanDerWaalsContact CA-O 3.31Å; I615-L745 WeakPolarHBondContact CA-O 3.31Å; I615-L745 HydrophobicContact CG1-CB 4.4Å; I615-L745 HydrophobicContact CG2-CD2 4.38Å; L616-L745 PolarHBondContact N-O 3Å; L716-L745 HydrophobicContact CD1-CD1 4.03Å; L716-L745 HydrophobicContact CG-CD1 4.07Å; L733-L745 HydrophobicContact CB-CD1 4.48Å; L733-L745 HydrophobicContact CB-CD2 4.22Å; L733-L745 HydrophobicContact CD1-CD1 4.11Å; V737-L745 HydrophobicContact CG2-CB 4.01Å; V737-L745 HydrophobicContact CG2-CD2 4.35Å; L745-V747 HydrophobicContact CD2-CG2 4.32Å; L745-V747 HydrophobicContact CG-CG2 4.13Å; L745-F761 HydrophobicContact CD2-CD1 4.45Å; L745-F761 HydrophobicContact CD2-CE1 3.89Å; L745-F761 HydrophobicContact CD2-CZ 4.23Å
746	I	93.9	Very high	83.9	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.8	174.2	-55.5	178.5	0	0	0	107.9	V610 L616 V618 I630 L634 I713 I714 M715 L716 T748	V610-I746 HydrophobicContact CG1-CD1 4.14Å; V610-I746 HydrophobicContact CG2-CD1 3.75Å; V610-I746 HydrophobicContact CG2-CG1 4.44Å; L616-I746 WeakPolarHBondContact O-CA 3.45Å; V618-I746 HydrophobicContact CG2-CG2 3.9Å; I630-I746 HydrophobicContact CG2-CD1 4.25Å; L634-I746 HydrophobicContact CD1-CD1 3.49Å; L634-I746 VanDerWaalsContact CD1-CD1 3.49Å; I713-I746 HydrophobicContact CG2-CD1 3.96Å; I713-I746 HydrophobicContact CG2-CG1 4.18Å; I714-I746 PolarHBondContact O-N 3.08Å; M715-I746 CarbonylContact C-O 3.57Å; M715-I746 VanDerWaalsContact CA-O 3.31Å; M715-I746 WeakPolarHBondContact CA-O 3.24Å; M715-I746 HydrophobicContact CB-CB 4.42Å; L716-I746 PolarHBondContact N-O 3.44Å; I746-T748 HydrophobicContact CG2-CG2 3.61Å
747	V	92.7	Very high	83.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	111.9	177.5	-176.6	0	0	0	0	108.1	L616 I617 V618 A719 F730 L745 F757 F761	L616-V747 PolarHBondContact O-N 2.71Å; I617-V747 CarbonylContact C-O 3.52Å; I617-V747 WeakPolarHBondContact CA-O 3.3Å; I617-V747 HydrophobicContact CG1-CB 4.44Å; V618-V747 PolarHBondContact N-O 3.4Å; A719-V747 HydrophobicContact CB-CG1 3.7Å; F730-V747 HydrophobicContact CE1-CG1 4.25Å; L745-V747 HydrophobicContact CD2-CG2 4.32Å; L745-V747 HydrophobicContact CG-CG2 4.13Å; V747-F757 HydrophobicContact CG1-CD1 4.04Å; V747-F757 HydrophobicContact CG1-CE1 4.36Å; V747-F761 HydrophobicContact CG2-CD2 4.38Å; V747-F761 HydrophobicContact CG2-CE2 3.84Å; V747-F761 HydrophobicContact CG2-CZ 4.25Å
748	T	89.4	Confident	83.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133	-173.8	57.8	0	0	0	0	112.2	V618 I630 M715 L716 D717 E718 A719 I746	V618-T748 HydrophobicContact CB-CG2 3.69Å; V618-T748 HydrophobicContact CG1-CG2 4.47Å; V618-T748 HydrophobicContact CG2-CG2 4.1Å; V618-T748 WeakPolarHBondContact O-CA 3.36Å; I630-T748 HydrophobicContact CD1-CG2 4.07Å; M715-T748 HydrophobicContact CE-CG2 3.83Å; M715-T748 WeakPolarHBondContact CE-OG1 3.41Å; M715-T748 HydrophobicContact CG-CG2 4.28Å; L716-T748 PolarHBondContact O-N 3.22Å; L716-T748 PolarHBondContact O-OG1 2.72Å; D717-T748 WeakPolarHBondContact CA-OG1 3.47Å; D717-T748 WeakPolarHBondContact CB-OG1 3.42Å; D717-T748 WeakPolarHBondContact OD1-CB 3.39Å; D717-T748 PolarHBondContact OD1-OG1 3.39Å; E718-T748 PolarHBondContact N-O 2.85Å; A719-T748 PolarHBondContact N-O 3.41Å; I746-T748 HydrophobicContact CG2-CG2 3.61Å
749	S	83.2	Confident	83.8	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	153.5	-173.2	-177.8	0	0	0	0	111.9	V618 G620 T751	V618-S749 PolarHBondContact O-N 2.91Å; G620-S749 PolarHBondContact N-O 2.73Å; S749-T751 PolarHBondContact OG-N 3.19Å; S749-T751 PolarHBondContact OG-OG1 3.08Å
750	A	73.9	Confident	83.9	Confident	26 Å²	26	38.9 Å²	38.9	22%	0.215	21%	0.208	C	C	.	.	S	Bend	trans	-102.7	3.2	170.5	0	0	0	0	0	112.9	T622	T622-A750 HydrophobicContact CG2-CB 4.1Å
751	T	68.3	Low	84	Confident	26 Å²	26	37.3 Å²	37.3	16%	0.16	20%	0.202	C	C	.	.	S	Bend	trans	-120.9	159.1	-174.2	66.2	0	0	0	0	113.1	H720 S749 D753	H720-T751 HydrophobicContact CB-CG2 3.75Å; H720-T751 WeakPolarHBondContact CB-OG1 3.47Å; S749-T751 PolarHBondContact OG-N 3.19Å; S749-T751 PolarHBondContact OG-OG1 3.08Å; T751-D753 VanDerWaalsContact C-N 3.28Å; T751-D753 PolarHBondContact O-N 3.05Å
752	L	57.7	Low	84.2	Confident	129 Å²	129	37.6 Å²	37.6	68%	0.675	19%	0.191	S	C	*	.	S	Bend	trans	-78.8	-0.1	-176.2	-77.1	160.4	0	0	0	114.7	A754	L752-A754 PolarHBondContact O-N 3.41Å
753	D	67.9	Low	84.3	Confident	39 Å²	39	41.3 Å²	41.3	21%	0.209	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	14.1	-177.6	-154.1	24.5	0	0	0	113.3	T751 V755 K756 F757	T751-D753 VanDerWaalsContact C-N 3.28Å; T751-D753 PolarHBondContact O-N 3.05Å; D753-V755 PolarHBondContact O-N 3Å; D753-K756 PolarHBondContact O-N 2.93Å; D753-K756 WeakPolarHBondContact OD1-CD 3.48Å; D753-K756 WeakPolarHBondContact OD1-CE 3.36Å; D753-K756 WeakPolarHBondContact OD1-CG 3.43Å; D753-K756 IonicContact OD1-NZ 3.25Å; D753-K756 PolarHBondContact OD1-NZ 2.36Å; D753-K756 WeakPolarHBondContact OD2-CD 3.42Å; D753-K756 WeakPolarHBondContact OD2-CE 3.35Å; D753-K756 IonicContact OD2-NZ 2.76Å; D753-K756 PolarHBondContact OD2-NZ 3.24Å; D753-F757 WeakPolarHBondContact O-CD2 3.29Å
754	A	73.2	Confident	84.2	Confident	2 Å²	2	41.7 Å²	41.7	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-56.4	-20.8	-179.3	0	0	0	0	0	114.2	I617 I619 L752 F757 S758 I766	I617-A754 HydrophobicContact CG2-CB 4.15Å; I619-A754 HydrophobicContact CD1-CB 3.47Å; I619-A754 VanDerWaalsContact CD1-CB 3.47Å; I619-A754 HydrophobicContact CG1-CB 3.73Å; L752-A754 PolarHBondContact O-N 3.41Å; A754-F757 PolarHBondContact O-N 3.31Å; A754-S758 WeakPolarHBondContact O-CB 3.37Å; A754-S758 PolarHBondContact O-N 3.31Å; A754-I766 HydrophobicContact CB-CD1 4.01Å; A754-I766 HydrophobicContact CB-CG2 4.24Å
755	V	84.4	Confident	84.2	Confident	86 Å²	86	42.9 Å²	42.9	52%	0.521	22%	0.219	S	C	.	.	H	α-helix	trans	-61.7	-43.8	173.7	-177.3	0	0	0	0	111.1	D753 S758 Q759	D753-V755 PolarHBondContact O-N 3Å; V755-S758 PolarHBondContact O-N 3.45Å; V755-Q759 WeakPolarHBondContact O-CB 3.47Å; V755-Q759 WeakPolarHBondContact O-CG 3.49Å; V755-Q759 PolarHBondContact O-N 3.19Å
756	K	85.6	Confident	84.1	Confident	68 Å²	68	46.1 Å²	46.1	30%	0.296	24%	0.236	S	C	.	.	H	α-helix	trans	-65.8	-42.6	175.7	-64.8	-175.1	-160.4	150.5	0	111.6	D753 S758 Q759 Y760	D753-K756 PolarHBondContact O-N 2.93Å; D753-K756 WeakPolarHBondContact OD1-CD 3.48Å; D753-K756 WeakPolarHBondContact OD1-CE 3.36Å; D753-K756 WeakPolarHBondContact OD1-CG 3.43Å; D753-K756 IonicContact OD1-NZ 3.25Å; D753-K756 PolarHBondContact OD1-NZ 2.36Å; D753-K756 WeakPolarHBondContact OD2-CD 3.42Å; D753-K756 WeakPolarHBondContact OD2-CE 3.35Å; D753-K756 IonicContact OD2-NZ 2.76Å; D753-K756 PolarHBondContact OD2-NZ 3.24Å; K756-S758 VanDerWaalsContact C-N 3.31Å; K756-S758 PolarHBondContact O-N 3.11Å; K756-Q759 PolarHBondContact O-N 3.35Å; K756-Y760 VanDerWaalsContact O-CB 3.25Å; K756-Y760 WeakPolarHBondContact O-CB 3.29Å; K756-Y760 PolarHBondContact O-N 2.74Å
757	F	86.8	Confident	84	Confident	5 Å²	5	47.4 Å²	47.4	2%	0.022	24%	0.241	C	C	.	.	H	α-helix	trans	-59.3	-43.3	175.5	-70.4	-83.8	0	0	0	111	I617 A719 F730 V747 D753 A754 Y760 F761 M978	I617-F757 VanDerWaalsContact CD1-C 3.43Å; I617-F757 HydrophobicContact CD1-CB 3.8Å; I617-F757 HydrophobicContact CG1-CB 4.42Å; A719-F757 HydrophobicContact CB-CE1 4.01Å; A719-F757 HydrophobicContact CB-CZ 4.21Å; F730-F757 AromaticContact CE2-CE1 3.93Å; F730-F757 HydrophobicContact CE2-CE1 3.93Å; F730-F757 HydrophobicContact CZ-CD1 4.49Å; F730-F757 AromaticContact CZ-CE1 3.74Å; F730-F757 HydrophobicContact CZ-CE1 3.74Å; V747-F757 HydrophobicContact CG1-CD1 4.04Å; V747-F757 HydrophobicContact CG1-CE1 4.36Å; D753-F757 WeakPolarHBondContact O-CD2 3.29Å; A754-F757 PolarHBondContact O-N 3.31Å; F757-Y760 PolarHBondContact O-N 2.69Å; F757-F761 WeakPolarHBondContact O-CB 3.45Å; F757-F761 VanDerWaalsContact O-CD2 3.25Å; F757-F761 WeakPolarHBondContact O-CD2 3.49Å; F757-F761 PolarHBondContact O-N 2.9Å; F757-M978 HydrophobicContact CD1-CE 3.61Å; F757-M978 HydrophobicContact CD1-SD 4.32Å; F757-M978 HydrophobicContact CE1-CE 3.88Å; F757-M978 HydrophobicContact CE1-SD 4.23Å; F757-M978 HydrophobicContact CG-CE 4.35Å
758	S	89	Confident	83.8	Confident	19 Å²	19	51.5 Å²	51.5	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-51.7	178.1	-178.3	0	0	0	0	111.4	A754 V755 K756 Y760 F761 Y762 E763 A764	A754-S758 WeakPolarHBondContact O-CB 3.37Å; A754-S758 PolarHBondContact O-N 3.31Å; V755-S758 PolarHBondContact O-N 3.45Å; K756-S758 VanDerWaalsContact C-N 3.31Å; K756-S758 PolarHBondContact O-N 3.11Å; S758-Y760 VanDerWaalsContact C-N 3.3Å; S758-Y760 PolarHBondContact O-N 2.84Å; S758-F761 CarbonylContact O-C 3.58Å; S758-F761 VanDerWaalsContact O-C 3.32Å; S758-F761 PolarHBondContact O-N 2.65Å; S758-F761 VanDerWaalsContact O-N 3.09Å; S758-Y762 PolarHBondContact O-N 3.26Å; S758-E763 WeakPolarHBondContact O-CA 3.35Å; S758-E763 PolarHBondContact O-N 2.91Å; S758-E763 VanDerWaalsContact OG-C 3.3Å; S758-A764 WeakPolarHBondContact CB-O 3.46Å; S758-A764 PolarHBondContact O-N 2.81Å; S758-A764 PolarHBondContact OG-O 3.35Å
759	Q	89.8	Confident	83.7	Confident	130 Å²	130	51.7 Å²	51.7	61%	0.607	27%	0.268	S	S	*	.	H	α-helix	trans	-56.1	-42.6	175.7	-72.9	172.8	-16.3	0	0	112.5	V755 K756	V755-Q759 WeakPolarHBondContact O-CB 3.47Å; V755-Q759 WeakPolarHBondContact O-CG 3.49Å; V755-Q759 PolarHBondContact O-N 3.19Å; K756-Q759 PolarHBondContact O-N 3.35Å
760	Y	89.6	Confident	83.5	Confident	21 Å²	21	55.8 Å²	55.8	8%	0.082	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-35.8	177.4	178.3	-94.5	0	0	0	112.8	F730 G731 K734 K756 F757 S758 Y762 D976 M978	F730-Y760 HydrophobicContact CB-CE1 3.86Å; G731-Y760 VanDerWaalsContact CA-OH 3.22Å; G731-Y760 WeakPolarHBondContact CA-OH 3.5Å; G731-Y760 PolarHBondContact N-OH 2.93Å; K734-Y760 HydrophobicContact CD-CD1 4.27Å; K734-Y760 HydrophobicContact CD-CE1 3.62Å; K734-Y760 HydrophobicContact CD-CE2 4.25Å; K734-Y760 WeakPolarHBondContact CE-O 3.45Å; K734-Y760 PolarHBondContact NZ-O 3.03Å; K756-Y760 VanDerWaalsContact O-CB 3.25Å; K756-Y760 WeakPolarHBondContact O-CB 3.29Å; K756-Y760 PolarHBondContact O-N 2.74Å; F757-Y760 PolarHBondContact O-N 2.69Å; S758-Y760 VanDerWaalsContact C-N 3.3Å; S758-Y760 PolarHBondContact O-N 2.84Å; Y760-Y762 PolarHBondContact O-N 2.77Å; Y760-D976 WeakPolarHBondContact CE2-OD1 3.29Å; Y760-D976 PolarHBondContact OH-O 3.01Å; Y760-M978 HydrophobicContact CD1-CE 3.59Å; Y760-M978 HydrophobicContact CD2-CB 3.79Å; Y760-M978 HydrophobicContact CD2-CE 4.44Å; Y760-M978 HydrophobicContact CD2-CG 4.04Å; Y760-M978 HydrophobicContact CE1-CE 4.23Å; Y760-M978 HydrophobicContact CE2-CB 3.89Å; Y760-M978 HydrophobicContact CG-CB 4.2Å; Y760-M978 HydrophobicContact CG-CE 3.71Å; Y760-M978 HydrophobicContact CG-CG 4.13Å
761	F	90.4	Very high	83.2	Confident	2 Å²	2	56 Å²	56	1%	0.009	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	45.2	178.9	-71.6	-63.9	0	0	0	113.2	I615 F730 K734 L745 V747 F757 S758 E763 A764 M978	I615-F761 HydrophobicContact CD1-CB 4.11Å; I615-F761 HydrophobicContact CD1-CD1 4.03Å; I615-F761 HydrophobicContact CD1-CG 4.44Å; I615-F761 HydrophobicContact CG2-CB 4.07Å; I615-F761 HydrophobicContact CG2-CD1 4.47Å; I615-F761 HydrophobicContact CG2-CG 4.19Å; F730-F761 HydrophobicContact CB-CZ 3.96Å; F730-F761 HydrophobicContact CD1-CE2 4.18Å; F730-F761 AromaticContact CD1-CZ 3.76Å; F730-F761 HydrophobicContact CD1-CZ 3.76Å; F730-F761 HydrophobicContact CG-CZ 4.06Å; K734-F761 HydrophobicContact CB-CD1 4.49Å; K734-F761 HydrophobicContact CB-CE1 4.13Å; K734-F761 HydrophobicContact CG-CD1 4.48Å; L745-F761 HydrophobicContact CD2-CD1 4.45Å; L745-F761 HydrophobicContact CD2-CE1 3.89Å; L745-F761 HydrophobicContact CD2-CZ 4.23Å; V747-F761 HydrophobicContact CG2-CD2 4.38Å; V747-F761 HydrophobicContact CG2-CE2 3.84Å; V747-F761 HydrophobicContact CG2-CZ 4.25Å; F757-F761 WeakPolarHBondContact O-CB 3.45Å; F757-F761 VanDerWaalsContact O-CD2 3.25Å; F757-F761 WeakPolarHBondContact O-CD2 3.49Å; F757-F761 PolarHBondContact O-N 2.9Å; S758-F761 CarbonylContact O-C 3.58Å; S758-F761 VanDerWaalsContact O-C 3.32Å; S758-F761 PolarHBondContact O-N 2.65Å; S758-F761 VanDerWaalsContact O-N 3.09Å; F761-E763 PolarHBondContact O-N 3.21Å; F761-A764 HydrophobicContact CB-CB 3.89Å; F761-A764 VanDerWaalsContact O-CB 3.23Å; F761-A764 WeakPolarHBondContact O-CB 3.38Å; F761-A764 PolarHBondContact O-N 3.12Å; F761-A764 VanDerWaalsContact O-N 3.14Å; F761-M978 HydrophobicContact CE2-CE 4.49Å
762	Y	88.2	Confident	83.1	Confident	121 Å²	121	61.7 Å²	61.7	48%	0.475	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	42	173.6	-46.3	-69.5	0	0	0	114.5	I615 K734 Q738 S758 Y760 A764	I615-Y762 HydrophobicContact CD1-CD2 4.37Å; K734-Y762 HydrophobicContact CD-CE2 4.42Å; K734-Y762 VanDerWaalsContact CE-CZ 3.44Å; K734-Y762 VanDerWaalsContact CE-OH 3.24Å; K734-Y762 WeakPolarHBondContact CE-OH 3.37Å; K734-Y762 HydrophobicContact CG-CE2 3.81Å; K734-Y762 WeakPolarHBondContact CG-OH 3.42Å; Q738-Y762 HydrophobicContact CG-CE2 4.38Å; Q738-Y762 PolarHBondContact NE2-OH 3.48Å; Q738-Y762 VanDerWaalsContact NE2-OH 3.08Å; S758-Y762 PolarHBondContact O-N 3.26Å; Y760-Y762 PolarHBondContact O-N 2.77Å; Y762-A764 VanDerWaalsContact C-N 3.27Å; Y762-A764 PolarHBondContact O-N 3.4Å
763	E	89.1	Confident	83.6	Confident	161 Å²	161	58.7 Å²	58.7	75%	0.752	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	32.7	-175.5	-53.9	-169.6	148.8	0	0	113.3	S758 F761	S758-E763 WeakPolarHBondContact O-CA 3.35Å; S758-E763 PolarHBondContact O-N 2.91Å; S758-E763 VanDerWaalsContact OG-C 3.3Å; F761-E763 PolarHBondContact O-N 3.21Å
764	A	89.1	Confident	84.2	Confident	7 Å²	7	62.4 Å²	62.4	6%	0.058	32%	0.316	C	S	.	.			trans	-51.5	139.3	179.4	0	0	0	0	0	112.8	I615 I617 S758 F761 Y762	I615-A764 HydrophobicContact CB-CB 4.06Å; I615-A764 HydrophobicContact CG2-CB 3.88Å; I617-A764 HydrophobicContact CD1-CB 3.99Å; I617-A764 HydrophobicContact CG1-CB 4.4Å; S758-A764 WeakPolarHBondContact CB-O 3.46Å; S758-A764 PolarHBondContact O-N 2.81Å; S758-A764 PolarHBondContact OG-O 3.35Å; F761-A764 HydrophobicContact CB-CB 3.89Å; F761-A764 VanDerWaalsContact O-CB 3.23Å; F761-A764 WeakPolarHBondContact O-CB 3.38Å; F761-A764 PolarHBondContact O-N 3.12Å; F761-A764 VanDerWaalsContact O-N 3.14Å; Y762-A764 VanDerWaalsContact C-N 3.27Å; Y762-A764 PolarHBondContact O-N 3.4Å
765	P	92.9	Very high	84.9	Confident	53 Å²	53	67.3 Å²	67.3	34%	0.344	35%	0.348	S	S	.	.			trans	-67.2	146.8	-174.4	24.9	-32.9	0	0	0	112.9	N613 L616 I617	N613-P765 HydrophobicContact CB-CG 4.19Å; N613-P765 WeakPolarHBondContact OD1-CG 3.18Å; L616-P765 HydrophobicContact CD1-CB 4.46Å; L616-P765 HydrophobicContact CD1-CG 4.03Å; I617-P765 PolarHBondContact N-O 3.25Å
766	I	91.7	Very high	85.1	Confident	69 Å²	69	65 Å²	65	35%	0.354	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.8	-175.7	-58.1	176.9	0	0	0	109.4	I617 I619 A754	I617-I766 HydrophobicContact CB-CG1 4.48Å; I617-I766 CarbonylContact O-C 3.59Å; I617-I766 WeakPolarHBondContact O-CA 3.5Å; I619-I766 HydrophobicContact CD1-CG2 3.44Å; I619-I766 VanDerWaalsContact CD1-CG2 3.44Å; I619-I766 HydrophobicContact CG1-CG2 3.77Å; A754-I766 HydrophobicContact CB-CD1 4.01Å; A754-I766 HydrophobicContact CB-CG2 4.24Å
767	F	90.7	Very high	85.5	Confident	29 Å²	29	66.8 Å²	66.8	13%	0.127	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.8	173.8	-167.7	-93.2	0	0	0	109.7	L602 Q605 L606 A609 L616 I617 V618 I619 I769	L602-F767 HydrophobicContact CB-CE1 4.37Å; L602-F767 HydrophobicContact CB-CZ 4.09Å; L602-F767 HydrophobicContact CD1-CE1 4.33Å; L602-F767 HydrophobicContact CD1-CZ 4.43Å; Q605-F767 HydrophobicContact CB-CE2 4.12Å; Q605-F767 HydrophobicContact CB-CZ 4.21Å; L606-F767 HydrophobicContact CB-CE1 4.13Å; L606-F767 HydrophobicContact CB-CZ 3.92Å; L606-F767 HydrophobicContact CD1-CD1 4.04Å; L606-F767 HydrophobicContact CD1-CE1 3.97Å; L606-F767 HydrophobicContact CD1-CZ 4.41Å; A609-F767 HydrophobicContact CB-CD2 4.02Å; A609-F767 HydrophobicContact CB-CE2 4.28Å; L616-F767 HydrophobicContact CD1-CB 4.19Å; L616-F767 HydrophobicContact CD2-CB 4.43Å; L616-F767 HydrophobicContact CG-CB 4.41Å; I617-F767 PolarHBondContact O-N 3.5Å; V618-F767 CarbonylContact C-O 3.56Å; V618-F767 WeakPolarHBondContact CA-O 3.17Å; V618-F767 HydrophobicContact CG1-CD1 4.26Å; V618-F767 HydrophobicContact CG2-CB 4.39Å; I619-F767 PolarHBondContact N-O 2.91Å; F767-I769 HydrophobicContact CD1-CG1 4.02Å; F767-I769 HydrophobicContact CE1-CG1 3.9Å
768	T	89.4	Confident	85.8	Confident	88 Å²	88	69.1 Å²	69.1	54%	0.54	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	114.5	-178.4	-57.3	0	0	0	0	111	I619 P770	I619-T768 HydrophobicContact CB-CG2 4.44Å; T768-P770 WeakPolarHBondContact O-CD 3.19Å
769	I	86.3	Confident	86.1	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.021	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	115.9	171.1	-60	166.3	0	0	0	107.9	I599 V618 I619 K626 F767 G771	I599-I769 HydrophobicContact CB-CD1 4.46Å; I599-I769 HydrophobicContact CD1-CD1 3.67Å; I599-I769 HydrophobicContact CG1-CD1 3.85Å; V618-I769 HydrophobicContact CG1-CD1 3.54Å; V618-I769 HydrophobicContact CG1-CG1 4.09Å; I619-I769 PolarHBondContact O-N 3.03Å; K626-I769 HydrophobicContact CG-CD1 4.29Å; F767-I769 HydrophobicContact CD1-CG1 4.02Å; F767-I769 HydrophobicContact CE1-CG1 3.9Å; I769-G771 PolarHBondContact O-N 3.38Å
770	P	79.6	Confident	86.3	Confident	86 Å²	86	68.2 Å²	68.2	56%	0.558	35%	0.351	S	S	*	.			trans	-65	128.5	173.3	29.2	-32.3	0	0	0	108.5	L602 T768	L602-P770 HydrophobicContact CD1-CG 4.42Å; T768-P770 WeakPolarHBondContact O-CD 3.19Å
771	G	67	Low	86.5	Confident	30 Å²	30	68.6 Å²	68.6	31%	0.309	36%	0.355	S	S	.	.			trans	-85.8	-154.7	-174.5	0	0	0	0	0	113.6	E621 I769	E621-G771 WeakPolarHBondContact OE2-CA 3.45Å; I769-G771 PolarHBondContact O-N 3.38Å
772	R	66.2	Low	86.4	Confident	147 Å²	147	78.2 Å²	78.2	56%	0.555	40%	0.397	S	S	*	.			trans	-135.2	10.6	-173.6	-115.1	-174.5	-172.8	151.5	9.8	112.6	S596 P598 E621 Y774	S596-R772 PolarHBondContact O-NH1 3.37Å; S596-R772 PolarHBondContact O-NH2 2.98Å; P598-R772 HydrophobicContact CG-CB 4.28Å; P598-R772 HydrophobicContact CG-CG 4Å; E621-R772 PolarHBondContact OE2-N 3Å; R772-Y774 PolarHBondContact O-N 3.01Å
773	T	68	Low	86.4	Confident	65 Å²	65	79.4 Å²	79.4	40%	0.399	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-63.1	128.9	177.1	53.1	0	0	0	0	111.4	E621 G924	E621-T773 PolarHBondContact OE1-OG1 3.28Å; E621-T773 VanDerWaalsContact OE1-OG1 3.12Å; E621-T773 WeakPolarHBondContact OE2-CG2 3.49Å; E621-T773 PolarHBondContact OE2-N 3.27Å; E621-T773 PolarHBondContact OE2-OG1 2.87Å; T773-G924 CarbonylContact C-O 3.51Å; T773-G924 VanDerWaalsContact CA-O 3.25Å; T773-G924 WeakPolarHBondContact CA-O 3.45Å
774	Y	82	Confident	86.1	Confident	118 Å²	118	75.2 Å²	75.2	46%	0.463	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-70.7	154.6	161.5	-64.4	-92.9	0	0	0	109.5	R772 G924 G927	R772-Y774 PolarHBondContact O-N 3.01Å; Y774-G924 PolarHBondContact N-O 3.48Å; Y774-G927 WeakPolarHBondContact CB-O 3.35Å; Y774-G927 VanDerWaalsContact CD2-CA 3.49Å
775	P	86.3	Confident	85.8	Confident	104 Å²	104	78.9 Å²	78.9	68%	0.675	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-59.7	141.1	177.3	25.2	-34.6	0	0	0	111.4	P928 G929	P775-P928 HydrophobicContact CG-CB 4.45Å; P775-P928 WeakPolarHBondContact O-CA 3.42Å; P775-G929 PolarHBondContact O-N 3.02Å
776	V	89.7	Confident	85.1	Confident	38 Å²	38	80.3 Å²	80.3	23%	0.23	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	121.8	174.8	-179.9	0	0	0	0	108.4	A923 G924 G929 C931	V776-A923 HydrophobicContact CG1-CB 4.08Å; V776-A923 HydrophobicContact CG2-CB 4.07Å; V776-G924 VanDerWaalsContact CG2-CA 3.41Å; V776-G924 VanDerWaalsContact CG2-N 3.27Å; V776-G929 CarbonylContact C-O 3.49Å; V776-G929 VanDerWaalsContact CA-O 3.3Å; V776-G929 WeakPolarHBondContact CA-O 3.5Å; V776-C931 HydrophobicContact CG1-CB 3.84Å
777	E	93.7	Very high	84.8	Confident	106 Å²	106	78.3 Å²	78.3	50%	0.495	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.5	170.9	-177.1	176.5	-155.7	0	0	109.3	L779 G929 K930 C931	E777-L779 HydrophobicContact CG-CD2 4.37Å; E777-L779 HydrophobicContact CG-CG 4.43Å; E777-G929 PolarHBondContact N-O 2.89Å; E777-K930 HydrophobicContact CB-CG 4.26Å; E777-K930 CarbonylContact O-C 3.55Å; E777-K930 WeakPolarHBondContact O-CA 3.49Å; E777-K930 WeakPolarHBondContact OE2-CE 3.4Å; E777-C931 PolarHBondContact O-N 3.02Å
778	V	94.3	Very high	84.7	Confident	54 Å²	54	77 Å²	77	33%	0.327	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114.8	-177.1	-177.7	0	0	0	0	109.4	Y780 C931 R933	V778-Y780 HydrophobicContact CG1-CD2 4.45Å; V778-Y780 HydrophobicContact CG1-CE1 4.47Å; V778-Y780 HydrophobicContact CG1-CE2 3.83Å; V778-C931 HydrophobicContact CG2-CB 4.5Å; V778-R933 HydrophobicContact CG1-CG 4.34Å
779	L	94.3	Very high	84.7	Confident	61 Å²	61	73.2 Å²	73.2	32%	0.319	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.2	-179.2	-60.4	168.2	0	0	0	108.9	E777 C931 Y932 R933	E777-L779 HydrophobicContact CG-CD2 4.37Å; E777-L779 HydrophobicContact CG-CG 4.43Å; L779-C931 PolarHBondContact N-O 3.5Å; L779-Y932 HydrophobicContact CB-CD1 4.41Å; L779-Y932 HydrophobicContact CD1-CD1 3.77Å; L779-Y932 HydrophobicContact CD1-CE1 3.44Å; L779-Y932 VanDerWaalsContact CD1-CE1 3.44Å; L779-Y932 HydrophobicContact CD1-CG 4.44Å; L779-R933 WeakPolarHBondContact O-CB 3.42Å; L779-R933 PolarHBondContact O-N 3.12Å
780	Y	94.3	Very high	84.8	Confident	69 Å²	69	75 Å²	75	27%	0.271	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.2	178.1	-60.6	-93.3	0	0	0	109.8	V778 R933 Y935 E937 Y940	V778-Y780 HydrophobicContact CG1-CD2 4.45Å; V778-Y780 HydrophobicContact CG1-CE1 4.47Å; V778-Y780 HydrophobicContact CG1-CE2 3.83Å; Y780-R933 WeakPolarHBondContact CA-O 3.35Å; Y780-R933 HydrophobicContact CD1-CB 4.01Å; Y780-R933 HydrophobicContact CE1-CB 4.49Å; Y780-R933 VanDerWaalsContact CE1-CD 3.48Å; Y780-R933 PolarHBondContact OH-NH1 3.27Å; Y780-Y935 HydrophobicContact CD1-CD2 4.48Å; Y780-Y935 WeakPolarHBondContact CD1-O 3.47Å; Y780-Y935 HydrophobicContact CE1-CE2 4.38Å; Y780-E937 HydrophobicContact CD1-CB 4.2Å; Y780-E937 HydrophobicContact CD2-CB 4.18Å; Y780-E937 HydrophobicContact CD2-CG 4.4Å; Y780-E937 HydrophobicContact CE1-CB 4.36Å; Y780-E937 HydrophobicContact CE1-CG 4.31Å; Y780-E937 HydrophobicContact CE2-CB 4.35Å; Y780-E937 HydrophobicContact CE2-CG 4.07Å; Y780-E937 HydrophobicContact CG-CB 4.1Å; Y780-Y940 HydrophobicContact CE1-CD1 4.27Å; Y780-Y940 HydrophobicContact CE1-CG 4.03Å
781	T	92.8	Very high	85.4	Confident	29 Å²	29	71.5 Å²	71.5	18%	0.178	37%	0.366	C	S	.	.			trans	-67.3	151.2	167.2	56.8	0	0	0	0	110.9	E783 E785 R933 L934 Y935 T936	T781-E783 VanDerWaalsContact CB-O 3.27Å; T781-E783 WeakPolarHBondContact CB-O 3.45Å; T781-E783 PolarHBondContact OG1-O 3.05Å; T781-E785 HydrophobicContact CG2-CG 4.26Å; T781-R933 PolarHBondContact N-O 3.17Å; T781-R933 VanDerWaalsContact N-O 3.11Å; T781-L934 HydrophobicContact CG2-CB 4.5Å; T781-L934 HydrophobicContact CG2-CD2 4.35Å; T781-Y935 WeakPolarHBondContact OG1-CA 3.29Å; T781-Y935 PolarHBondContact OG1-N 3.18Å; T781-T936 WeakPolarHBondContact O-CA 3.49Å
782	K	89.1	Confident	86.6	Confident	203 Å²	203	70.1 Å²	70.1	88%	0.883	35%	0.351	S	S	*	.	S	Bend	trans	-73.8	-35.3	175.1	-66.9	178.3	-179	173.7	0	111.6	T936	K782-T936 WeakPolarHBondContact O-CG2 3.38Å
783	E	87.4	Confident	87.8	Confident	147 Å²	147	63.4 Å²	63.4	69%	0.687	33%	0.326	S	S	*	.	S	Bend	trans	-125.4	157.6	-175.5	-68.7	175.7	-159.7	0	0	109.7	T781	T781-E783 VanDerWaalsContact CB-O 3.27Å; T781-E783 WeakPolarHBondContact CB-O 3.45Å; T781-E783 PolarHBondContact OG1-O 3.05Å
784	P	83.4	Confident	89	Confident	72 Å²	72	64.6 Å²	64.6	47%	0.468	33%	0.329	S	S	.	.			trans	-80.1	119.4	179.4	31	-32.3	0	0	0	111.3
785	E	82.4	Confident	89.5	Confident	85 Å²	85	59.8 Å²	59.8	40%	0.397	31%	0.313	S	S	.	.			trans	-72.9	125.3	176.6	-60.4	-61.8	161.5	0	0	111	T781 A791	T781-E785 HydrophobicContact CG2-CG 4.26Å; E785-A791 HydrophobicContact CB-CB 4.09Å; E785-A791 HydrophobicContact CG-CB 3.91Å
786	T	78.5	Confident	89.9	Confident	83 Å²	83	54.9 Å²	54.9	51%	0.509	28%	0.281	S	S	.	.	S	Bend	trans	-75.7	-40.6	179.8	51	0	0	0	0	112.3	M510	M510-T786 HydrophobicContact SD-CG2 4.3Å
787	D	86.3	Confident	89.9	Confident	27 Å²	27	54 Å²	54	14%	0.144	27%	0.274	C	S	.	.			trans	-104.8	84	170.1	-177.3	16.5	0	0	0	111.7	Q511 L514 R518 L789 D790 A791	Q511-D787 PolarHBondContact NE2-OD1 2.86Å; L514-D787 HydrophobicContact CD1-CB 4.19Å; R518-D787 IonicContact CZ-OD2 2.8Å; R518-D787 VanDerWaalsContact NH1-CG 3.31Å; R518-D787 IonicContact NH1-OD1 2.66Å; R518-D787 PolarHBondContact NH1-OD1 3.01Å; R518-D787 IonicContact NH1-OD2 2.78Å; R518-D787 PolarHBondContact NH1-OD2 3.37Å; R518-D787 IonicContact NH2-OD2 3.93Å; R518-D787 PolarHBondContact NH2-OD2 3.18Å; D787-L789 PolarHBondContact O-N 3.17Å; D787-L789 VanDerWaalsContact O-N 3.08Å; D787-L789 VanDerWaalsContact OD1-CB 3.3Å; D787-L789 WeakPolarHBondContact OD1-CB 3.25Å; D787-L789 PolarHBondContact OD1-N 3.28Å; D787-D790 PolarHBondContact O-N 3.37Å; D787-D790 WeakPolarHBondContact OD2-CB 3.29Å; D787-A791 PolarHBondContact O-N 3.39Å
788	Y	88.1	Confident	89.8	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-18.1	175.9	70.4	-101.9	0	0	0	114.3	Q511 S792 T813 P889 F891	Q511-Y788 HydrophobicContact CB-CD1 4.4Å; Q511-Y788 HydrophobicContact CB-CE1 3.66Å; Q511-Y788 HydrophobicContact CG-CD1 4.41Å; Q511-Y788 HydrophobicContact CG-CE1 3.6Å; Y788-S792 WeakPolarHBondContact O-CB 3.32Å; Y788-S792 PolarHBondContact O-N 2.89Å; Y788-S792 VanDerWaalsContact O-N 3.09Å; Y788-S792 PolarHBondContact O-OG 3.35Å; Y788-T813 HydrophobicContact CE2-CG2 4.34Å; Y788-T813 WeakPolarHBondContact OH-CG2 3.26Å; Y788-P889 HydrophobicContact CD2-CB 3.59Å; Y788-P889 HydrophobicContact CD2-CG 4Å; Y788-P889 HydrophobicContact CE2-CB 4.47Å; Y788-P889 HydrophobicContact CG-CB 3.94Å; Y788-F891 AromaticContact CD1-CD2 3.46Å; Y788-F891 HydrophobicContact CD1-CD2 3.46Å; Y788-F891 VanDerWaalsContact CD1-CD2 3.46Å; Y788-F891 AromaticContact CD1-CE2 3.37Å; Y788-F891 HydrophobicContact CD1-CE2 3.37Å; Y788-F891 HydrophobicContact CD1-CG 4.48Å; Y788-F891 HydrophobicContact CD1-CZ 4.35Å; Y788-F891 HydrophobicContact CD2-CD2 4.1Å; Y788-F891 AromaticContact CE1-CD2 3.53Å; Y788-F891 HydrophobicContact CE1-CD2 3.53Å; Y788-F891 AromaticContact CE1-CE2 3.8Å; Y788-F891 HydrophobicContact CE1-CE2 3.8Å; Y788-F891 HydrophobicContact CE1-CG 4.15Å; Y788-F891 HydrophobicContact CE2-CD2 4.19Å; Y788-F891 AromaticContact CG-CD2 3.74Å; Y788-F891 HydrophobicContact CG-CD2 3.74Å; Y788-F891 AromaticContact CG-CE2 3.84Å; Y788-F891 HydrophobicContact CG-CE2 3.84Å; Y788-F891 AromaticContact CZ-CD2 3.9Å
789	L	89.4	Confident	89.6	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-74.6	-50.5	-179.2	-175.9	65.6	0	0	0	110.4	D787 S792 L793 L812 E817 A821	D787-L789 PolarHBondContact O-N 3.17Å; D787-L789 VanDerWaalsContact O-N 3.08Å; D787-L789 VanDerWaalsContact OD1-CB 3.3Å; D787-L789 WeakPolarHBondContact OD1-CB 3.25Å; D787-L789 PolarHBondContact OD1-N 3.28Å; L789-S792 WeakPolarHBondContact O-CB 3.27Å; L789-S792 PolarHBondContact O-N 2.99Å; L789-L793 WeakPolarHBondContact O-CG 3.3Å; L789-L793 PolarHBondContact O-N 2.93Å; L789-L812 HydrophobicContact CD1-CD1 3.66Å; L789-L812 HydrophobicContact CD1-CD2 3.71Å; L789-L812 HydrophobicContact CD1-CG 4.36Å; L789-E817 HydrophobicContact CD1-CB 4.18Å; L789-A821 HydrophobicContact CD1-CB 4.27Å
790	D	88.9	Confident	89.4	Confident	41 Å²	41	49.2 Å²	49.2	22%	0.219	25%	0.247	C	C	.	.	H	α-helix	trans	-71.7	-38.6	178	-161.2	25.2	0	0	0	111.8	D787 S792 L793 I794 R828	D787-D790 PolarHBondContact O-N 3.37Å; D787-D790 WeakPolarHBondContact OD2-CB 3.29Å; D790-S792 PolarHBondContact O-N 3.47Å; D790-L793 PolarHBondContact O-N 2.94Å; D790-I794 WeakPolarHBondContact O-CG1 3.15Å; D790-I794 PolarHBondContact O-N 2.96Å; D790-R828 IonicContact OD1-CZ 2.61Å; D790-R828 IonicContact OD1-NH1 2.78Å; D790-R828 PolarHBondContact OD1-NH1 3.41Å; D790-R828 IonicContact OD1-NH2 2.77Å; D790-R828 PolarHBondContact OD1-NH2 3.02Å; D790-R828 IonicContact OD2-NH2 3.94Å; D790-R828 PolarHBondContact OD2-NH2 3.33Å
791	A	90.6	Very high	89.1	Confident	13 Å²	13	50.4 Å²	50.4	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-56.4	-36.6	171.7	0	0	0	0	0	112.3	E785 D787 T795 L934	E785-A791 HydrophobicContact CB-CB 4.09Å; E785-A791 HydrophobicContact CG-CB 3.91Å; D787-A791 PolarHBondContact O-N 3.39Å; A791-T795 VanDerWaalsContact O-CB 3.31Å; A791-T795 WeakPolarHBondContact O-CB 3.36Å; A791-T795 PolarHBondContact O-N 2.89Å; A791-T795 PolarHBondContact O-OG1 3.29Å; A791-L934 HydrophobicContact CB-CD1 4.07Å
792	S	93.3	Very high	88.9	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-64.2	-44.8	172.5	-63.8	0	0	0	0	112.1	Y788 L789 D790 T795 V796 L934	Y788-S792 WeakPolarHBondContact O-CB 3.32Å; Y788-S792 PolarHBondContact O-N 2.89Å; Y788-S792 VanDerWaalsContact O-N 3.09Å; Y788-S792 PolarHBondContact O-OG 3.35Å; L789-S792 WeakPolarHBondContact O-CB 3.27Å; L789-S792 PolarHBondContact O-N 2.99Å; D790-S792 PolarHBondContact O-N 3.47Å; S792-T795 PolarHBondContact O-N 2.93Å; S792-V796 VanDerWaalsContact O-CG2 3.24Å; S792-V796 WeakPolarHBondContact O-CG2 3.17Å; S792-V796 PolarHBondContact O-N 3.37Å; S792-L934 VanDerWaalsContact OG-CD1 3.22Å; S792-L934 WeakPolarHBondContact OG-CD1 3.4Å
793	L	92.1	Very high	88.9	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-41.5	-179.5	-66.3	171.7	0	0	0	112	L789 D790 V796 M797 A821 I824 L825	L789-L793 WeakPolarHBondContact O-CG 3.3Å; L789-L793 PolarHBondContact O-N 2.93Å; D790-L793 PolarHBondContact O-N 2.94Å; L793-V796 PolarHBondContact O-N 3.17Å; L793-M797 WeakPolarHBondContact O-CG 3.31Å; L793-M797 PolarHBondContact O-N 2.73Å; L793-A821 HydrophobicContact CD2-CB 4Å; L793-I824 HydrophobicContact CD1-CB 4.03Å; L793-I824 HydrophobicContact CD1-CD1 4.32Å; L793-I824 HydrophobicContact CD1-CG2 3.83Å; L793-L825 HydrophobicContact CB-CD1 4.49Å; L793-L825 HydrophobicContact CD2-CB 4.12Å; L793-L825 HydrophobicContact CD2-CD1 3.72Å
794	I	91.9	Very high	89	Confident	90 Å²	90	42.6 Å²	42.6	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-61.2	-46.5	174.4	-66.2	164.7	0	0	0	110	D790 V796 M797 Q798	D790-I794 WeakPolarHBondContact O-CG1 3.15Å; D790-I794 PolarHBondContact O-N 2.96Å; I794-V796 VanDerWaalsContact C-N 3.34Å; I794-V796 PolarHBondContact O-N 3.01Å; I794-M797 PolarHBondContact O-N 3.14Å; I794-Q798 PolarHBondContact O-N 3Å
795	T	93	Very high	89.1	Confident	18 Å²	18	45.1 Å²	45.1	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-41.7	176.6	-58.3	0	0	0	0	112	A791 S792 Q798 I799 V887 Y932	A791-T795 VanDerWaalsContact O-CB 3.31Å; A791-T795 WeakPolarHBondContact O-CB 3.36Å; A791-T795 PolarHBondContact O-N 2.89Å; A791-T795 PolarHBondContact O-OG1 3.29Å; S792-T795 PolarHBondContact O-N 2.93Å; T795-Q798 PolarHBondContact O-N 3.21Å; T795-I799 HydrophobicContact CG2-CD1 3.82Å; T795-I799 HydrophobicContact CG2-CG1 4.47Å; T795-I799 WeakPolarHBondContact O-CD1 3.36Å; T795-I799 VanDerWaalsContact O-CG1 3.24Å; T795-I799 WeakPolarHBondContact O-CG1 3.47Å; T795-I799 PolarHBondContact O-N 3.04Å; T795-V887 HydrophobicContact CG2-CG1 4.17Å; T795-V887 HydrophobicContact CG2-CG2 3.86Å; T795-Y932 HydrophobicContact CG2-CD1 4.16Å; T795-Y932 HydrophobicContact CG2-CG 4.05Å
796	V	94.1	Very high	89.3	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-45.4	175.4	170.6	0	0	0	0	111.7	S792 L793 I794 I799 H800 I808 V810 L825 V867 V887	S792-V796 VanDerWaalsContact O-CG2 3.24Å; S792-V796 WeakPolarHBondContact O-CG2 3.17Å; S792-V796 PolarHBondContact O-N 3.37Å; L793-V796 PolarHBondContact O-N 3.17Å; I794-V796 VanDerWaalsContact C-N 3.34Å; I794-V796 PolarHBondContact O-N 3.01Å; V796-I799 PolarHBondContact O-N 3.41Å; V796-H800 WeakPolarHBondContact O-CB 3.43Å; V796-H800 PolarHBondContact O-N 3.19Å; V796-I808 HydrophobicContact CG1-CD1 4.19Å; V796-I808 HydrophobicContact CG2-CG2 4.29Å; V796-V810 HydrophobicContact CG2-CG2 3.38Å; V796-L825 HydrophobicContact CB-CD1 4.25Å; V796-L825 HydrophobicContact CG1-CD1 3.86Å; V796-L825 HydrophobicContact CG1-CD2 4.22Å; V796-V867 HydrophobicContact CG1-CG1 4.18Å; V796-V867 HydrophobicContact CG1-CG2 3.79Å; V796-V887 HydrophobicContact CG2-CG2 4.21Å
797	M	90.6	Very high	90	Very high	18 Å²	18	38.3 Å²	38.3	9%	0.089	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-41.3	178.2	-67.1	-62.4	-70.1	0	0	111.4	L793 I794 H800 L801 L825 R828 M829 L832 L839	L793-M797 WeakPolarHBondContact O-CG 3.31Å; L793-M797 PolarHBondContact O-N 2.73Å; I794-M797 PolarHBondContact O-N 3.14Å; M797-H800 PolarHBondContact O-N 3.07Å; M797-L801 WeakPolarHBondContact O-CG 3.32Å; M797-L801 PolarHBondContact O-N 3.46Å; M797-L801 VanDerWaalsContact O-N 3.12Å; M797-L825 HydrophobicContact CG-CD1 4.1Å; M797-L825 HydrophobicContact SD-CD1 3.89Å; M797-L825 HydrophobicContact SD-CG 4.29Å; M797-R828 HydrophobicContact CE-CB 4.29Å; M797-M829 HydrophobicContact CE-CG 4.45Å; M797-M829 HydrophobicContact CE-SD 3.75Å; M797-M829 HydrophobicContact SD-CG 4.35Å; M797-M829 HydrophobicContact SD-SD 3.95Å; M797-L832 HydrophobicContact CE-CD1 3.86Å; M797-L832 HydrophobicContact CE-CD2 3.84Å; M797-L832 HydrophobicContact CE-CG 4.47Å; M797-L839 HydrophobicContact SD-CD2 4.45Å
798	Q	90.7	Very high	90.3	Very high	113 Å²	113	37 Å²	37	53%	0.528	21%	0.211	S	C	.	.	H	α-helix	trans	-59.9	-52.2	174.8	-174.5	179.5	1.9	0	0	111.4	I794 T795 H800 L801 T802	I794-Q798 PolarHBondContact O-N 3Å; T795-Q798 PolarHBondContact O-N 3.21Å; Q798-H800 VanDerWaalsContact C-N 3.26Å; Q798-H800 PolarHBondContact O-N 3.11Å; Q798-L801 PolarHBondContact O-N 3.44Å; Q798-T802 HydrophobicContact CG-CG2 4.49Å; Q798-T802 PolarHBondContact O-N 3.34Å; Q798-T802 PolarHBondContact O-OG1 2.97Å
799	I	91.8	Very high	90.6	Very high	2 Å²	2	37 Å²	37	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-57.8	-40.7	177.1	-66.6	163.3	0	0	0	110.9	T795 V796 L801 E803 I808 R865 Y885 V887 Y932	T795-I799 HydrophobicContact CG2-CD1 3.82Å; T795-I799 HydrophobicContact CG2-CG1 4.47Å; T795-I799 WeakPolarHBondContact O-CD1 3.36Å; T795-I799 VanDerWaalsContact O-CG1 3.24Å; T795-I799 WeakPolarHBondContact O-CG1 3.47Å; T795-I799 PolarHBondContact O-N 3.04Å; V796-I799 PolarHBondContact O-N 3.41Å; I799-L801 VanDerWaalsContact C-N 3.32Å; I799-L801 PolarHBondContact O-N 3.09Å; I799-E803 HydrophobicContact CG2-CB 4.1Å; I799-E803 HydrophobicContact CG2-CG 4.29Å; I799-E803 WeakPolarHBondContact O-CB 3.45Å; I799-E803 PolarHBondContact O-N 2.98Å; I799-E803 VanDerWaalsContact O-N 3.17Å; I799-I808 HydrophobicContact CB-CD1 4.04Å; I799-I808 HydrophobicContact CG2-CD1 3.61Å; I799-I808 HydrophobicContact CG2-CG1 4.02Å; I799-R865 PolarHBondContact O-NH2 2.94Å; I799-Y885 HydrophobicContact CG2-CD1 3.73Å; I799-Y885 HydrophobicContact CG2-CD2 3.93Å; I799-Y885 HydrophobicContact CG2-CE1 4.23Å; I799-Y885 HydrophobicContact CG2-CE2 4.43Å; I799-Y885 HydrophobicContact CG2-CG 3.57Å; I799-V887 HydrophobicContact CD1-CG2 3.79Å; I799-Y932 HydrophobicContact CD1-CD2 3.55Å; I799-Y932 HydrophobicContact CD1-CE1 4.44Å; I799-Y932 HydrophobicContact CD1-CE2 3.46Å; I799-Y932 VanDerWaalsContact CD1-CE2 3.46Å; I799-Y932 HydrophobicContact CD1-CG 4.13Å; I799-Y932 HydrophobicContact CG1-CD2 4.34Å; I799-Y932 HydrophobicContact CG1-CE1 4.32Å; I799-Y932 HydrophobicContact CG1-CE2 3.81Å
800	H	89.3	Confident	90.9	Very high	7 Å²	7	36.8 Å²	36.8	3%	0.032	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-39.4	179.9	-177	56.6	0	0	0	112.9	V796 M797 Q798 P837 E838 L839 R865	V796-H800 WeakPolarHBondContact O-CB 3.43Å; V796-H800 PolarHBondContact O-N 3.19Å; M797-H800 PolarHBondContact O-N 3.07Å; Q798-H800 VanDerWaalsContact C-N 3.26Å; Q798-H800 PolarHBondContact O-N 3.11Å; H800-P837 WeakPolarHBondContact NE2-CB 3.42Å; H800-P837 PolarHBondContact NE2-O 2.87Å; H800-P837 VanDerWaalsContact NE2-O 3.11Å; H800-E838 PolarHBondContact NE2-O 2.93Å; H800-L839 VanDerWaalsContact CE1-CD1 3.42Å; H800-L839 WeakPolarHBondContact CE1-CD1 3.34Å; H800-L839 WeakPolarHBondContact ND1-CD1 3.5Å; H800-R865 WeakPolarHBondContact CE1-CB 3.5Å; H800-R865 WeakPolarHBondContact CE1-CD 3.33Å; H800-R865 WeakPolarHBondContact CE1-CG 3.44Å; H800-R865 VanDerWaalsContact CE1-CZ 3.43Å; H800-R865 PolarHBondContact CE1-NE 3.33Å; H800-R865 PolarHBondContact ND1-NE 3.17Å; H800-R865 WeakPolarHBondContact NE2-CB 3.29Å; H800-R865 PolarHBondContact O-NH2 2.91Å
801	L	87.9	Confident	91.2	Very high	93 Å²	93	34.9 Å²	34.9	49%	0.487	20%	0.2	S	C	.	.	H	α-helix	trans	-85.4	-38	-177	-65.7	170.5	0	0	0	114.1	M797 Q798 I799 L832 V836	M797-L801 WeakPolarHBondContact O-CG 3.32Å; M797-L801 PolarHBondContact O-N 3.46Å; M797-L801 VanDerWaalsContact O-N 3.12Å; Q798-L801 PolarHBondContact O-N 3.44Å; I799-L801 VanDerWaalsContact C-N 3.32Å; I799-L801 PolarHBondContact O-N 3.09Å; L801-L832 HydrophobicContact CD1-CD2 4.01Å; L801-L832 HydrophobicContact CD2-CD2 4.24Å; L801-V836 HydrophobicContact CD2-CG1 3.73Å; L801-V836 HydrophobicContact CD2-CG2 3.97Å
802	T	88.8	Confident	91.3	Very high	97 Å²	97	34.6 Å²	34.6	60%	0.595	20%	0.196	S	C	*	.	H	α-helix	trans	-106.8	-21.6	-169.6	68.2	0	0	0	0	115.2	Q798	Q798-T802 HydrophobicContact CG-CG2 4.49Å; Q798-T802 PolarHBondContact O-N 3.34Å; Q798-T802 PolarHBondContact O-OG1 2.97Å
803	E	89.4	Confident	91.1	Very high	40 Å²	40	35.1 Å²	35.1	19%	0.187	20%	0.199	C	C	.	.	S	Bend	trans	-100	152	-174.8	-68.8	-81.3	171.9	0	0	112.3	I799 R865 Y885 K930 Y932	I799-E803 HydrophobicContact CG2-CB 4.1Å; I799-E803 HydrophobicContact CG2-CG 4.29Å; I799-E803 WeakPolarHBondContact O-CB 3.45Å; I799-E803 PolarHBondContact O-N 2.98Å; I799-E803 VanDerWaalsContact O-N 3.17Å; E803-R865 PolarHBondContact O-NH2 3.45Å; E803-Y885 HydrophobicContact CB-CE1 3.74Å; E803-Y885 HydrophobicContact CG-CE1 4.01Å; E803-K930 IonicContact OE1-NZ 3.58Å; E803-K930 PolarHBondContact OE1-NZ 2.92Å; E803-K930 IonicContact OE2-NZ 2.71Å; E803-K930 PolarHBondContact OE2-NZ 3.06Å; E803-Y932 PolarHBondContact OE1-OH 3.03Å
804	P	88	Confident	90.9	Very high	79 Å²	79	35.4 Å²	35.4	51%	0.513	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-53.2	167.7	176.8	-29.4	36.2	0	0	0	116	G806 R865 Y885	P804-G806 PolarHBondContact O-N 3.37Å; P804-R865 PolarHBondContact O-NH1 3.44Å; P804-R865 PolarHBondContact O-NH2 3.39Å; P804-Y885 WeakPolarHBondContact CD-OH 3.29Å; P804-Y885 WeakPolarHBondContact O-CE2 3.45Å; P804-Y885 PolarHBondContact O-OH 3.04Å; P804-Y885 VanDerWaalsContact O-OH 3.06Å
805	P	85.9	Confident	90.5	Very high	124 Å²	124	35.4 Å²	35.4	81%	0.805	20%	0.202	S	C	*	.	S	Bend	trans	-61.1	127.9	179.2	-24.1	35	0	0	0	113.4
806	G	88.1	Confident	90.1	Very high	11 Å²	11	40.4 Å²	40.4	11%	0.113	22%	0.224	C	C	.	.			trans	171.4	147.7	175.6	0	0	0	0	0	110.6	P804 R865 Y885	P804-G806 PolarHBondContact O-N 3.37Å; G806-R865 WeakPolarHBondContact O-CD 3.33Å; G806-R865 VanDerWaalsContact O-CG 3.27Å; G806-R865 WeakPolarHBondContact O-CG 3.17Å; G806-R865 PolarHBondContact O-NH1 3.42Å; G806-Y885 WeakPolarHBondContact O-CD2 3.32Å
807	D	91.8	Very high	89.7	Confident	14 Å²	14	41.2 Å²	41.2	8%	0.075	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	152	-175.1	-62	-30	0	0	0	111.5	K866 G882 I883 Y884 Y885	D807-K866 WeakPolarHBondContact CA-O 3.27Å; D807-K866 HydrophobicContact CB-CB 4.25Å; D807-K866 WeakPolarHBondContact CB-O 3.39Å; D807-K866 VanDerWaalsContact OD1-CB 3.31Å; D807-K866 WeakPolarHBondContact OD1-CB 3.35Å; D807-K866 PolarHBondContact OD1-N 3.06Å; D807-K866 WeakPolarHBondContact OD2-CE 3.47Å; D807-K866 IonicContact OD2-NZ 3.74Å; D807-G882 VanDerWaalsContact CB-O 3.28Å; D807-G882 WeakPolarHBondContact CB-O 3.33Å; D807-G882 PolarHBondContact N-O 3.28Å; D807-I883 WeakPolarHBondContact O-CA 3.49Å; D807-Y884 PolarHBondContact O-N 3.44Å; D807-Y885 PolarHBondContact O-N 3.04Å; D807-Y885 VanDerWaalsContact O-N 3.16Å
808	I	93.6	Very high	89.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.5	-175.5	-48.5	176.8	0	0	0	109.3	V796 I799 V810 K866 V867 V868 Y885 V887	V796-I808 HydrophobicContact CG1-CD1 4.19Å; V796-I808 HydrophobicContact CG2-CG2 4.29Å; I799-I808 HydrophobicContact CB-CD1 4.04Å; I799-I808 HydrophobicContact CG2-CD1 3.61Å; I799-I808 HydrophobicContact CG2-CG1 4.02Å; I808-V810 HydrophobicContact CG2-CG2 4.21Å; I808-K866 PolarHBondContact N-O 3.26Å; I808-V867 HydrophobicContact CB-CG2 4.07Å; I808-V867 HydrophobicContact CD1-CG2 4.01Å; I808-V867 HydrophobicContact CG1-CG2 4.35Å; I808-V867 WeakPolarHBondContact O-CA 3.3Å; I808-V868 PolarHBondContact O-N 2.83Å; I808-Y885 CarbonylContact C-O 3.59Å; I808-Y885 WeakPolarHBondContact CA-O 3.49Å; I808-Y885 HydrophobicContact CG1-CD2 4.37Å; I808-V887 HydrophobicContact CG2-CG2 4.25Å
809	L	94.1	Very high	89.5	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.2	170.6	178.2	66	0	0	0	110.2	F811 V868 A870 A874 I883 Y885 V886 V887 R922	L809-F811 HydrophobicContact CD2-CE1 4.44Å; L809-F811 HydrophobicContact CD2-CE2 3.71Å; L809-F811 HydrophobicContact CD2-CZ 3.58Å; L809-F811 HydrophobicContact CG-CE2 4.04Å; L809-F811 HydrophobicContact CG-CZ 4.22Å; L809-V868 WeakPolarHBondContact CA-O 3.37Å; L809-V868 HydrophobicContact CD1-CB 4Å; L809-V868 HydrophobicContact CD1-CG1 3.97Å; L809-A870 HydrophobicContact CD1-CB 3.81Å; L809-A874 HydrophobicContact CD1-CB 4.12Å; L809-A874 HydrophobicContact CD2-CB 4.2Å; L809-I883 HydrophobicContact CB-CD1 3.85Å; L809-I883 HydrophobicContact CB-CG1 4.28Å; L809-I883 HydrophobicContact CB-CG2 3.94Å; L809-I883 HydrophobicContact CD2-CD1 3.89Å; L809-I883 HydrophobicContact CG-CD1 4.31Å; L809-Y885 PolarHBondContact N-O 3.41Å; L809-V886 HydrophobicContact CB-CG2 4.37Å; L809-V886 CarbonylContact O-C 3.58Å; L809-V886 WeakPolarHBondContact O-CA 3.39Å; L809-V887 PolarHBondContact O-N 2.63Å; L809-R922 HydrophobicContact CD2-CB 3.91Å; L809-R922 HydrophobicContact CD2-CG 3.93Å
810	V	95.1	Very high	89.3	Confident	4 Å²	4	38 Å²	38	2%	0.024	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.7	178.1	-170.3	0	0	0	0	109.1	V796 I808 L812 V867 V868 I869 A870 V887	V796-V810 HydrophobicContact CG2-CG2 3.38Å; I808-V810 HydrophobicContact CG2-CG2 4.21Å; V810-L812 HydrophobicContact CG1-CD2 4.4Å; V810-L812 HydrophobicContact CG1-CG 4.27Å; V810-V867 HydrophobicContact CG2-CG1 4.25Å; V810-V868 PolarHBondContact N-O 3.47Å; V810-I869 HydrophobicContact CB-CG1 4.5Å; V810-I869 HydrophobicContact CB-CG2 4.3Å; V810-I869 HydrophobicContact CG2-CG1 4.5Å; V810-A870 PolarHBondContact O-N 3.08Å; V810-V887 HydrophobicContact CG1-CB 4.34Å; V810-V887 HydrophobicContact CG2-CB 4.42Å
811	F	94.9	Very high	89.3	Confident	1 Å²	1	37.6 Å²	37.6	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.9	174.5	-72.6	-82.6	0	0	0	111.4	L809 A870 A874 E875 V886 V887 P889 R919 R922	L809-F811 HydrophobicContact CD2-CE1 4.44Å; L809-F811 HydrophobicContact CD2-CE2 3.71Å; L809-F811 HydrophobicContact CD2-CZ 3.58Å; L809-F811 HydrophobicContact CG-CE2 4.04Å; L809-F811 HydrophobicContact CG-CZ 4.22Å; F811-A870 CarbonylContact C-O 3.57Å; F811-A870 WeakPolarHBondContact CA-O 3.48Å; F811-A874 HydrophobicContact CE1-CB 4.02Å; F811-A874 HydrophobicContact CZ-CB 4.41Å; F811-E875 HydrophobicContact CE1-CB 4.2Å; F811-V886 HydrophobicContact CD2-CG1 4.09Å; F811-V886 HydrophobicContact CE2-CG1 3.86Å; F811-V887 PolarHBondContact N-O 2.96Å; F811-P889 WeakPolarHBondContact O-CD 3.41Å; F811-P889 WeakPolarHBondContact O-CG 3.4Å; F811-R919 HydrophobicContact CD1-CG 4.25Å; F811-R919 HydrophobicContact CD2-CB 4.1Å; F811-R919 HydrophobicContact CD2-CG 3.95Å; F811-R919 HydrophobicContact CE1-CG 3.98Å; F811-R919 HydrophobicContact CE2-CB 3.64Å; F811-R919 HydrophobicContact CE2-CG 3.66Å; F811-R919 HydrophobicContact CG-CG 4.23Å; F811-R919 HydrophobicContact CZ-CB 4.02Å; F811-R919 HydrophobicContact CZ-CG 3.68Å; F811-R922 HydrophobicContact CZ-CG 4.19Å
812	L	92.9	Very high	89.4	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.037	19%	0.191	C	C	.	.			trans	-121.5	162.7	172.3	-64.2	-177.3	0	0	0	111.1	L789 V810 E817 I818 A821 I869 A870	L789-L812 HydrophobicContact CD1-CD1 3.66Å; L789-L812 HydrophobicContact CD1-CD2 3.71Å; L789-L812 HydrophobicContact CD1-CG 4.36Å; V810-L812 HydrophobicContact CG1-CD2 4.4Å; V810-L812 HydrophobicContact CG1-CG 4.27Å; L812-E817 HydrophobicContact CB-CB 4.44Å; L812-E817 HydrophobicContact CD1-CB 4.33Å; L812-I818 HydrophobicContact CB-CD1 4.47Å; L812-I818 HydrophobicContact CB-CG1 3.82Å; L812-I818 HydrophobicContact CD1-CG1 4.13Å; L812-A821 HydrophobicContact CD1-CB 3.56Å; L812-I869 HydrophobicContact CD1-CG2 3.47Å; L812-I869 VanDerWaalsContact CD1-CG2 3.47Å; L812-I869 HydrophobicContact CG-CG2 3.94Å; L812-A870 PolarHBondContact N-O 3.28Å
813	T	90.1	Very high	89.3	Confident	12 Å²	12	30.5 Å²	30.5	7%	0.074	17%	0.172	C	C	.	.	S	Bend	trans	-86.3	-25.4	-164.4	84.1	0	0	0	0	114.1	Y788 E817 F891 K893 V908	Y788-T813 HydrophobicContact CE2-CG2 4.34Å; Y788-T813 WeakPolarHBondContact OH-CG2 3.26Å; T813-E817 WeakPolarHBondContact CA-OE2 3.09Å; T813-E817 VanDerWaalsContact CB-OE2 3.26Å; T813-E817 WeakPolarHBondContact CB-OE2 3.32Å; T813-E817 PolarHBondContact N-OE2 3.03Å; T813-E817 PolarHBondContact OG1-OE1 3.39Å; T813-E817 PolarHBondContact OG1-OE2 2.8Å; T813-F891 HydrophobicContact CG2-CB 3.58Å; T813-K893 VanDerWaalsContact OG1-CD 3.32Å; T813-K893 WeakPolarHBondContact OG1-CD 3.37Å; T813-K893 WeakPolarHBondContact OG1-CE 3.28Å; T813-K893 PolarHBondContact OG1-NZ 3.12Å; T813-V908 HydrophobicContact CG2-CG1 4.41Å
814	G	87.3	Confident	89.3	Confident	12 Å²	12	30.4 Å²	30.4	12%	0.124	17%	0.172	C	C	.	.	S	Bend	trans	-163.5	172.3	-178.2	0	0	0	0	0	115.8	E816 E817 I818	G814-E816 VanDerWaalsContact C-N 3.31Å; G814-E816 PolarHBondContact O-N 3.11Å; G814-E817 PolarHBondContact N-OE2 3.16Å; G814-E817 PolarHBondContact O-N 3.4Å; G814-I818 WeakPolarHBondContact O-CG1 2.93Å; G814-I818 PolarHBondContact O-N 3.41Å; G814-I818 VanDerWaalsContact O-N 3.13Å
815	Q	84.5	Confident	89.3	Confident	89 Å²	89	26.7 Å²	26.7	42%	0.416	15%	0.148	S	C	.	.	H	α-helix	trans	-55.3	-39.6	-174	172.5	170.1	13.1	0	0	114	I818 D819 Y845	Q815-I818 PolarHBondContact O-N 2.85Å; Q815-D819 WeakPolarHBondContact O-CB 3.4Å; Q815-D819 PolarHBondContact O-N 2.92Å; Q815-Y845 HydrophobicContact CB-CD1 4.23Å; Q815-Y845 HydrophobicContact CB-CD2 4.32Å; Q815-Y845 HydrophobicContact CB-CE1 4.34Å; Q815-Y845 HydrophobicContact CB-CE2 4.45Å; Q815-Y845 HydrophobicContact CB-CG 4.19Å; Q815-Y845 VanDerWaalsContact CD-CE2 3.47Å; Q815-Y845 HydrophobicContact CG-CD1 4.19Å; Q815-Y845 HydrophobicContact CG-CD2 4.14Å; Q815-Y845 HydrophobicContact CG-CE1 3.81Å; Q815-Y845 HydrophobicContact CG-CE2 3.78Å; Q815-Y845 HydrophobicContact CG-CG 4.33Å; Q815-Y845 VanDerWaalsContact NE2-CE2 3.31Å; Q815-Y845 PolarHBondContact NE2-OH 2.91Å; Q815-Y845 VanDerWaalsContact NE2-OH 3.15Å
816	E	82.7	Confident	89.4	Confident	124 Å²	124	23.6 Å²	23.6	58%	0.579	12%	0.121	S	C	*	.	H	α-helix	trans	-69	-44.7	-175.9	-57.7	-168.4	168.7	0	0	112	R519 G814 I818 T820	R519-E816 IonicContact CZ-OE1 2.65Å; R519-E816 IonicContact CZ-OE2 2.8Å; R519-E816 IonicContact NH2-OE1 3.69Å; R519-E816 PolarHBondContact NH2-OE1 2.98Å; R519-E816 IonicContact NH2-OE2 2.92Å; R519-E816 PolarHBondContact NH2-OE2 3.3Å; G814-E816 VanDerWaalsContact C-N 3.31Å; G814-E816 PolarHBondContact O-N 3.11Å; E816-I818 VanDerWaalsContact C-N 3.3Å; E816-I818 PolarHBondContact O-N 3.47Å; E816-T820 WeakPolarHBondContact O-CB 3.43Å; E816-T820 PolarHBondContact O-N 2.91Å; E816-T820 PolarHBondContact O-OG1 2.81Å
817	E	87	Confident	89.3	Confident	18 Å²	18	28.2 Å²	28.2	8%	0.084	14%	0.139	C	C	.	.	H	α-helix	trans	-59.1	-41.4	171.2	-72.1	137.1	-116.8	0	0	111.6	L789 L812 T813 G814 T820 A821 K893	L789-E817 HydrophobicContact CD1-CB 4.18Å; L812-E817 HydrophobicContact CB-CB 4.44Å; L812-E817 HydrophobicContact CD1-CB 4.33Å; T813-E817 WeakPolarHBondContact CA-OE2 3.09Å; T813-E817 VanDerWaalsContact CB-OE2 3.26Å; T813-E817 WeakPolarHBondContact CB-OE2 3.32Å; T813-E817 PolarHBondContact N-OE2 3.03Å; T813-E817 PolarHBondContact OG1-OE1 3.39Å; T813-E817 PolarHBondContact OG1-OE2 2.8Å; G814-E817 PolarHBondContact N-OE2 3.16Å; G814-E817 PolarHBondContact O-N 3.4Å; E817-T820 PolarHBondContact O-N 3.38Å; E817-A821 WeakPolarHBondContact O-CB 3.4Å; E817-A821 PolarHBondContact O-N 3.16Å; E817-K893 IonicContact OE1-NZ 3.55Å; E817-K893 PolarHBondContact OE1-NZ 3.37Å
818	I	90.2	Very high	89.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.6	-48.1	-179	-66.9	171.6	0	0	0	111.3	L812 G814 Q815 E816 T820 A821 C822 P843 Y845 I869 T871	L812-I818 HydrophobicContact CB-CD1 4.47Å; L812-I818 HydrophobicContact CB-CG1 3.82Å; L812-I818 HydrophobicContact CD1-CG1 4.13Å; G814-I818 WeakPolarHBondContact O-CG1 2.93Å; G814-I818 PolarHBondContact O-N 3.41Å; G814-I818 VanDerWaalsContact O-N 3.13Å; Q815-I818 PolarHBondContact O-N 2.85Å; E816-I818 VanDerWaalsContact C-N 3.3Å; E816-I818 PolarHBondContact O-N 3.47Å; I818-T820 VanDerWaalsContact C-N 3.29Å; I818-T820 PolarHBondContact O-N 3.38Å; I818-A821 PolarHBondContact O-N 2.6Å; I818-C822 PolarHBondContact O-N 3.03Å; I818-C822 PolarHBondContact O-SG 3.07Å; I818-P843 HydrophobicContact CG2-CB 3.46Å; I818-P843 VanDerWaalsContact CG2-CB 3.46Å; I818-Y845 HydrophobicContact CB-CD1 4.19Å; I818-Y845 HydrophobicContact CB-CE1 4.39Å; I818-Y845 HydrophobicContact CD1-CD1 4.1Å; I818-Y845 HydrophobicContact CG2-CD1 3.94Å; I818-Y845 HydrophobicContact CG2-CE1 4.01Å; I818-I869 HydrophobicContact CB-CG2 4.47Å; I818-I869 HydrophobicContact CG1-CG2 4.06Å; I818-I869 HydrophobicContact CG2-CB 4.29Å; I818-I869 HydrophobicContact CG2-CG2 4.14Å; I818-T871 HydrophobicContact CD1-CG2 3.64Å
819	D	87.1	Confident	88.6	Confident	19 Å²	19	32.6 Å²	32.6	10%	0.102	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-37.6	178.2	-98.8	33.3	0	0	0	111.3	W570 K571 Q815 E823 Y845	W570-D819 HydrophobicContact CZ2-CB 4.41Å; W570-D819 WeakPolarHBondContact CZ2-O 3.31Å; K571-D819 IonicContact NZ-OD1 3.11Å; K571-D819 IonicContact NZ-OD2 3.46Å; K571-D819 PolarHBondContact NZ-OD2 3.06Å; Q815-D819 WeakPolarHBondContact O-CB 3.4Å; Q815-D819 PolarHBondContact O-N 2.92Å; D819-E823 WeakPolarHBondContact O-CB 3.35Å; D819-E823 PolarHBondContact O-N 3.03Å; D819-Y845 WeakPolarHBondContact OD1-CE1 3.24Å; D819-Y845 PolarHBondContact OD1-OH 3.06Å
820	T	86.4	Confident	88.2	Confident	45 Å²	45	38.9 Å²	38.9	28%	0.276	18%	0.184	S	C	.	.	H	α-helix	trans	-75.4	-36.6	175.3	-73.3	0	0	0	0	112.9	E816 E817 I818 E823 I824	E816-T820 WeakPolarHBondContact O-CB 3.43Å; E816-T820 PolarHBondContact O-N 2.91Å; E816-T820 PolarHBondContact O-OG1 2.81Å; E817-T820 PolarHBondContact O-N 3.38Å; I818-T820 VanDerWaalsContact C-N 3.29Å; I818-T820 PolarHBondContact O-N 3.38Å; T820-E823 WeakPolarHBondContact O-CB 3.5Å; T820-E823 PolarHBondContact O-N 3.18Å; T820-I824 HydrophobicContact CG2-CD1 3.68Å; T820-I824 HydrophobicContact CG2-CG1 4.33Å; T820-I824 WeakPolarHBondContact O-CG1 3.47Å; T820-I824 PolarHBondContact O-N 2.7Å
821	A	89.9	Confident	87.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-44.6	174.4	0	0	0	0	0	111.7	L789 L793 L812 E817 I818 E823 L825 I869	L789-A821 HydrophobicContact CD1-CB 4.27Å; L793-A821 HydrophobicContact CD2-CB 4Å; L812-A821 HydrophobicContact CD1-CB 3.56Å; E817-A821 WeakPolarHBondContact O-CB 3.4Å; E817-A821 PolarHBondContact O-N 3.16Å; I818-A821 PolarHBondContact O-N 2.6Å; A821-E823 VanDerWaalsContact C-N 3.29Å; A821-E823 PolarHBondContact O-N 3.21Å; A821-L825 VanDerWaalsContact O-CB 3.26Å; A821-L825 WeakPolarHBondContact O-CB 3.47Å; A821-L825 PolarHBondContact O-N 3.22Å; A821-I869 HydrophobicContact CB-CD1 4.11Å; A821-I869 HydrophobicContact CB-CG2 4.45Å
822	C	89.8	Confident	86.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-36.7	174.9	-68	0	0	0	0	112.5	W570 I818 Y826 I841	W570-C822 HydrophobicContact CD2-CB 4.04Å; W570-C822 HydrophobicContact CE3-CB 3.71Å; W570-C822 HydrophobicContact CH2-CB 3.41Å; W570-C822 VanDerWaalsContact CH2-CB 3.41Å; W570-C822 HydrophobicContact CZ2-CB 3.77Å; W570-C822 HydrophobicContact CZ3-CB 3.39Å; I818-C822 PolarHBondContact O-N 3.03Å; I818-C822 PolarHBondContact O-SG 3.07Å; C822-Y826 VanDerWaalsContact O-CB 3.28Å; C822-Y826 WeakPolarHBondContact O-CB 2.53Å; C822-Y826 PolarHBondContact O-N 3.36Å; C822-Y826 VanDerWaalsContact O-N 3.09Å; C822-I841 HydrophobicContact CB-CG2 3.89Å; C822-I841 VanDerWaalsContact SG-CG2 3.54Å
823	E	86.9	Confident	85.8	Confident	40 Å²	40	47.7 Å²	47.7	19%	0.187	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-53.4	178.3	-164.3	173.4	-149	0	0	111.1	K522 D819 T820 A821 L825 Y826 E827	K522-E823 IonicContact NZ-OE1 2.72Å; K522-E823 PolarHBondContact NZ-OE1 2.91Å; K522-E823 IonicContact NZ-OE2 3.76Å; K522-E823 PolarHBondContact NZ-OE2 3.36Å; D819-E823 WeakPolarHBondContact O-CB 3.35Å; D819-E823 PolarHBondContact O-N 3.03Å; T820-E823 WeakPolarHBondContact O-CB 3.5Å; T820-E823 PolarHBondContact O-N 3.18Å; A821-E823 VanDerWaalsContact C-N 3.29Å; A821-E823 PolarHBondContact O-N 3.21Å; E823-L825 PolarHBondContact O-N 3.14Å; E823-Y826 PolarHBondContact O-N 3.28Å; E823-E827 WeakPolarHBondContact O-CG 3.31Å; E823-E827 PolarHBondContact O-N 3.18Å
824	I	88.9	Confident	84.9	Confident	39 Å²	39	53 Å²	53	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-40.9	178.7	-64	167.3	0	0	0	111.6	L793 T820 Y826 E827 R828	L793-I824 HydrophobicContact CD1-CB 4.03Å; L793-I824 HydrophobicContact CD1-CD1 4.32Å; L793-I824 HydrophobicContact CD1-CG2 3.83Å; T820-I824 HydrophobicContact CG2-CD1 3.68Å; T820-I824 HydrophobicContact CG2-CG1 4.33Å; T820-I824 WeakPolarHBondContact O-CG1 3.47Å; T820-I824 PolarHBondContact O-N 2.7Å; I824-Y826 VanDerWaalsContact C-N 3.34Å; I824-Y826 PolarHBondContact O-N 3.36Å; I824-E827 PolarHBondContact O-N 3.07Å; I824-R828 HydrophobicContact CG2-CG 4.44Å; I824-R828 WeakPolarHBondContact O-CB 3.48Å; I824-R828 WeakPolarHBondContact O-CG 3.43Å; I824-R828 PolarHBondContact O-N 3.35Å
825	L	88.9	Confident	84.1	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-37.2	178.2	-159.1	91.8	0	0	0	111.4	L793 V796 M797 A821 E823 M829 L839 I841 V867	L793-L825 HydrophobicContact CB-CD1 4.49Å; L793-L825 HydrophobicContact CD2-CB 4.12Å; L793-L825 HydrophobicContact CD2-CD1 3.72Å; V796-L825 HydrophobicContact CB-CD1 4.25Å; V796-L825 HydrophobicContact CG1-CD1 3.86Å; V796-L825 HydrophobicContact CG1-CD2 4.22Å; M797-L825 HydrophobicContact CG-CD1 4.1Å; M797-L825 HydrophobicContact SD-CD1 3.89Å; M797-L825 HydrophobicContact SD-CG 4.29Å; A821-L825 VanDerWaalsContact O-CB 3.26Å; A821-L825 WeakPolarHBondContact O-CB 3.47Å; A821-L825 PolarHBondContact O-N 3.22Å; E823-L825 PolarHBondContact O-N 3.14Å; L825-M829 WeakPolarHBondContact O-CB 3.06Å; L825-M829 VanDerWaalsContact O-CG 3.32Å; L825-M829 WeakPolarHBondContact O-CG 3.44Å; L825-M829 PolarHBondContact O-N 3.49Å; L825-L839 HydrophobicContact CD2-CD2 3.8Å; L825-L839 HydrophobicContact CG-CD2 4.42Å; L825-I841 HydrophobicContact CB-CD1 4.1Å; L825-I841 HydrophobicContact CD2-CD1 3.85Å; L825-I841 HydrophobicContact CD2-CG1 3.93Å; L825-I841 HydrophobicContact CG-CD1 4.36Å; L825-V867 HydrophobicContact CD2-CG1 4.23Å
826	Y	87.4	Confident	83.7	Confident	59 Å²	59	57.2 Å²	57.2	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-43.3	175.6	-173.7	-100.5	0	0	0	112	E569 W570 C822 E823 I824 M829 K830 I841	E569-Y826 HydrophobicContact CB-CE1 3.76Å; W570-Y826 HydrophobicContact CB-CD1 3.71Å; W570-Y826 HydrophobicContact CB-CD2 3.68Å; W570-Y826 HydrophobicContact CB-CE1 4.22Å; W570-Y826 HydrophobicContact CB-CE2 4.21Å; W570-Y826 HydrophobicContact CB-CG 3.4Å; W570-Y826 VanDerWaalsContact CB-CG 3.4Å; C822-Y826 VanDerWaalsContact O-CB 3.28Å; C822-Y826 WeakPolarHBondContact O-CB 2.53Å; C822-Y826 PolarHBondContact O-N 3.36Å; C822-Y826 VanDerWaalsContact O-N 3.09Å; E823-Y826 PolarHBondContact O-N 3.28Å; I824-Y826 VanDerWaalsContact C-N 3.34Å; I824-Y826 PolarHBondContact O-N 3.36Å; Y826-M829 PolarHBondContact O-N 3.13Å; Y826-K830 HydrophobicContact CE1-CD 4.48Å; Y826-K830 WeakPolarHBondContact O-CB 3.22Å; Y826-K830 PolarHBondContact O-N 3.01Å; Y826-I841 HydrophobicContact CD2-CD1 4.3Å
827	E	86.9	Confident	83.4	Confident	108 Å²	108	54.6 Å²	54.6	51%	0.505	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-45	174.9	-72.4	168	-173.1	0	0	111.5	E823 I824 K830 S831	E823-E827 WeakPolarHBondContact O-CG 3.31Å; E823-E827 PolarHBondContact O-N 3.18Å; I824-E827 PolarHBondContact O-N 3.07Å; E827-K830 PolarHBondContact O-N 3.23Å; E827-S831 PolarHBondContact O-N 3.33Å; E827-S831 VanDerWaalsContact O-N 3.08Å
828	R	86.8	Confident	83.2	Confident	77 Å²	77	58.6 Å²	58.6	29%	0.291	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-50.1	173.9	-74	177.7	177.1	169.4	2.1	111.4	D790 M797 I824 K830 S831 L832	D790-R828 IonicContact OD1-CZ 2.61Å; D790-R828 IonicContact OD1-NH1 2.78Å; D790-R828 PolarHBondContact OD1-NH1 3.41Å; D790-R828 IonicContact OD1-NH2 2.77Å; D790-R828 PolarHBondContact OD1-NH2 3.02Å; D790-R828 IonicContact OD2-NH2 3.94Å; D790-R828 PolarHBondContact OD2-NH2 3.33Å; M797-R828 HydrophobicContact CE-CB 4.29Å; I824-R828 HydrophobicContact CG2-CG 4.44Å; I824-R828 WeakPolarHBondContact O-CB 3.48Å; I824-R828 WeakPolarHBondContact O-CG 3.43Å; I824-R828 PolarHBondContact O-N 3.35Å; R828-K830 VanDerWaalsContact C-N 3.29Å; R828-K830 PolarHBondContact O-N 3.18Å; R828-S831 PolarHBondContact O-N 3.09Å; R828-S831 PolarHBondContact O-OG 3.29Å; R828-L832 WeakPolarHBondContact O-CD1 3.49Å; R828-L832 PolarHBondContact O-N 3.02Å
829	M	83.6	Confident	83	Confident	29 Å²	29	59.1 Å²	59.1	14%	0.143	32%	0.319	C	S	.	.	H	α-helix	trans	-57.3	-40.5	175.4	-75.3	-60.8	-55.5	0	0	112.8	M797 L825 Y826 S831 L832 V836 L839	M797-M829 HydrophobicContact CE-CG 4.45Å; M797-M829 HydrophobicContact CE-SD 3.75Å; M797-M829 HydrophobicContact SD-CG 4.35Å; M797-M829 HydrophobicContact SD-SD 3.95Å; L825-M829 WeakPolarHBondContact O-CB 3.06Å; L825-M829 VanDerWaalsContact O-CG 3.32Å; L825-M829 WeakPolarHBondContact O-CG 3.44Å; L825-M829 PolarHBondContact O-N 3.49Å; Y826-M829 PolarHBondContact O-N 3.13Å; M829-S831 PolarHBondContact O-N 3.35Å; M829-L832 PolarHBondContact O-N 2.91Å; M829-V836 HydrophobicContact CE-CG1 3.92Å; M829-L839 HydrophobicContact CE-CB 3.66Å; M829-L839 HydrophobicContact CE-CD2 4.5Å; M829-L839 HydrophobicContact CG-CB 4.05Å; M829-L839 HydrophobicContact CG-CD2 3.84Å; M829-L839 HydrophobicContact SD-CB 3.84Å; M829-L839 HydrophobicContact SD-CD2 3.57Å; M829-L839 VanDerWaalsContact SD-CD2 3.57Å; M829-L839 HydrophobicContact SD-CG 4.37Å
830	K	84	Confident	83.1	Confident	134 Å²	134	59.5 Å²	59.5	58%	0.583	32%	0.321	S	S	*	.	H	α-helix	trans	-63.9	-28.4	176.8	-163.9	173.6	-174	179.2	0	112.6	E569 Y826 E827 R828	E569-K830 IonicContact OE1-NZ 3.21Å; E569-K830 IonicContact OE2-NZ 2.65Å; E569-K830 PolarHBondContact OE2-NZ 3.39Å; Y826-K830 HydrophobicContact CE1-CD 4.48Å; Y826-K830 WeakPolarHBondContact O-CB 3.22Å; Y826-K830 PolarHBondContact O-N 3.01Å; E827-K830 PolarHBondContact O-N 3.23Å; R828-K830 VanDerWaalsContact C-N 3.29Å; R828-K830 PolarHBondContact O-N 3.18Å
831	S	84	Confident	83.2	Confident	92 Å²	92	57.9 Å²	57.9	64%	0.643	31%	0.311	S	S	*	.	H	α-helix	trans	-81.5	-23.2	175.3	69.1	0	0	0	0	115.4	E827 R828 M829 G833	E827-S831 PolarHBondContact O-N 3.33Å; E827-S831 VanDerWaalsContact O-N 3.08Å; R828-S831 PolarHBondContact O-N 3.09Å; R828-S831 PolarHBondContact O-OG 3.29Å; M829-S831 PolarHBondContact O-N 3.35Å; S831-G833 VanDerWaalsContact C-N 3.31Å; S831-G833 PolarHBondContact O-N 3.21Å
832	L	79.4	Confident	83.2	Confident	69 Å²	69	58.4 Å²	58.4	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-78.8	-11.1	-178.7	-93.2	79.8	0	0	0	114.1	M797 L801 R828 M829 V836	M797-L832 HydrophobicContact CE-CD1 3.86Å; M797-L832 HydrophobicContact CE-CD2 3.84Å; M797-L832 HydrophobicContact CE-CG 4.47Å; L801-L832 HydrophobicContact CD1-CD2 4.01Å; L801-L832 HydrophobicContact CD2-CD2 4.24Å; R828-L832 WeakPolarHBondContact O-CD1 3.49Å; R828-L832 PolarHBondContact O-N 3.02Å; M829-L832 PolarHBondContact O-N 2.91Å; L832-V836 HydrophobicContact CB-CG2 4.05Å; L832-V836 HydrophobicContact CD2-CG2 4.09Å
833	G	70.4	Confident	83.2	Confident	36 Å²	36	58.6 Å²	58.6	37%	0.371	32%	0.315	S	S	.	.			trans	79.3	-173.2	173.9	0	0	0	0	0	115	S831	S831-G833 VanDerWaalsContact C-N 3.31Å; S831-G833 PolarHBondContact O-N 3.21Å
834	P	71.7	Confident	83.2	Confident	124 Å²	124	56.8 Å²	56.8	81%	0.805	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.1	-168.2	33.7	-37.1	0	0	0	115.1	V836	P834-V836 PolarHBondContact O-N 2.98Å
835	D	70.1	Confident	82.9	Confident	159 Å²	159	55.7 Å²	55.7	85%	0.85	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.6	-179	-61.9	-46.8	0	0	0	113
836	V	75.1	Confident	82.2	Confident	29 Å²	29	60 Å²	60	18%	0.176	33%	0.33	C	S	.	.	S	Bend	trans	-97.7	134.4	178.9	-178.4	0	0	0	0	110.5	L801 M829 L832 P834	L801-V836 HydrophobicContact CD2-CG1 3.73Å; L801-V836 HydrophobicContact CD2-CG2 3.97Å; M829-V836 HydrophobicContact CE-CG1 3.92Å; L832-V836 HydrophobicContact CB-CG2 4.05Å; L832-V836 HydrophobicContact CD2-CG2 4.09Å; P834-V836 PolarHBondContact O-N 2.98Å
837	P	76.6	Confident	81.4	Confident	70 Å²	70	60.4 Å²	60.4	46%	0.455	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-53.4	150.1	175.6	-28.6	36.5	0	0	0	114.3	H800 L839	H800-P837 WeakPolarHBondContact NE2-CB 3.42Å; H800-P837 PolarHBondContact NE2-O 2.87Å; H800-P837 VanDerWaalsContact NE2-O 3.11Å; P837-L839 PolarHBondContact O-N 2.81Å
838	E	83.3	Confident	80.6	Confident	101 Å²	101	55.6 Å²	55.6	47%	0.472	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-67.4	133.4	-176.7	-164.4	-167.5	141.7	0	0	112.2	H573 H800 S864 R865	H573-E838 IonicContact CE1-OE1 2.77Å; H573-E838 PolarHBondContact CE1-OE1 3.07Å; H800-E838 PolarHBondContact NE2-O 2.93Å; E838-S864 WeakPolarHBondContact O-CA 3.39Å; E838-S864 WeakPolarHBondContact O-CB 3.31Å; E838-R865 PolarHBondContact O-N 2.91Å
839	L	86.4	Confident	79.6	Confident	11 Å²	11	55 Å²	55	6%	0.058	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	106.1	-178.8	-164.8	57.5	0	0	0	111.5	M797 H800 L825 M829 P837 I841 R865 V867	M797-L839 HydrophobicContact SD-CD2 4.45Å; H800-L839 VanDerWaalsContact CE1-CD1 3.42Å; H800-L839 WeakPolarHBondContact CE1-CD1 3.34Å; H800-L839 WeakPolarHBondContact ND1-CD1 3.5Å; L825-L839 HydrophobicContact CD2-CD2 3.8Å; L825-L839 HydrophobicContact CG-CD2 4.42Å; M829-L839 HydrophobicContact CE-CB 3.66Å; M829-L839 HydrophobicContact CE-CD2 4.5Å; M829-L839 HydrophobicContact CG-CB 4.05Å; M829-L839 HydrophobicContact CG-CD2 3.84Å; M829-L839 HydrophobicContact SD-CB 3.84Å; M829-L839 HydrophobicContact SD-CD2 3.57Å; M829-L839 VanDerWaalsContact SD-CD2 3.57Å; M829-L839 HydrophobicContact SD-CG 4.37Å; P837-L839 PolarHBondContact O-N 2.81Å; L839-I841 PolarHBondContact O-N 3.42Å; L839-R865 WeakPolarHBondContact CA-O 3.4Å; L839-R865 HydrophobicContact CD1-CB 4.01Å; L839-R865 HydrophobicContact CD1-CG 4.47Å; L839-V867 HydrophobicContact CD1-CB 4.4Å; L839-V867 HydrophobicContact CD1-CG2 3.38Å; L839-V867 HydrophobicContact CD2-CG2 4.12Å; L839-V867 HydrophobicContact CG-CG2 3.86Å
840	I	87.8	Confident	78.6	Confident	28 Å²	28	55.5 Å²	55.5	14%	0.144	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	104.6	-176	-58.4	177	0	0	0	109.8	L842 P861 R865 K866 V867	I840-L842 HydrophobicContact CG2-CD2 4.4Å; I840-L842 HydrophobicContact CG2-CG 4.27Å; I840-P861 HydrophobicContact CD1-CG 4.16Å; I840-R865 PolarHBondContact N-O 2.95Å; I840-K866 WeakPolarHBondContact O-CA 3.44Å; I840-V867 PolarHBondContact O-N 3.25Å
841	I	89.8	Confident	77.8	Confident	11 Å²	11	56.9 Å²	56.9	6%	0.056	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	-176.1	-45.6	175.2	0	0	0	110.6	C822 L825 Y826 L839 I869	C822-I841 HydrophobicContact CB-CG2 3.89Å; C822-I841 VanDerWaalsContact SG-CG2 3.54Å; L825-I841 HydrophobicContact CB-CD1 4.1Å; L825-I841 HydrophobicContact CD2-CD1 3.85Å; L825-I841 HydrophobicContact CD2-CG1 3.93Å; L825-I841 HydrophobicContact CG-CD1 4.36Å; Y826-I841 HydrophobicContact CD2-CD1 4.3Å; L839-I841 PolarHBondContact O-N 3.42Å; I841-I869 HydrophobicContact CG2-CD1 4.22Å
842	L	89.3	Confident	77	Confident	10 Å²	10	55 Å²	55	5%	0.052	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	113.9	178.6	-62.2	179.3	0	0	0	112	I840 I856 K866 V867 V868 I869	I840-L842 HydrophobicContact CG2-CD2 4.4Å; I840-L842 HydrophobicContact CG2-CG 4.27Å; L842-I856 HydrophobicContact CB-CG2 4.41Å; L842-I856 HydrophobicContact CD1-CG2 4.29Å; L842-K866 HydrophobicContact CD1-CD 3.78Å; L842-K866 HydrophobicContact CD1-CG 4.02Å; L842-V867 PolarHBondContact N-O 3.32Å; L842-V868 WeakPolarHBondContact O-CA 3.48Å; L842-I869 PolarHBondContact O-N 3.49Å
843	P	89.9	Confident	76.5	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.032	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	146.5	175.5	32	-35.4	0	0	0	112.5	W570 I818 Y845 L848 I869	W570-P843 HydrophobicContact CZ3-CG 4.17Å; I818-P843 HydrophobicContact CG2-CB 3.46Å; I818-P843 VanDerWaalsContact CG2-CB 3.46Å; P843-Y845 HydrophobicContact CB-CD1 4.48Å; P843-Y845 HydrophobicContact CB-CE1 4.07Å; P843-L848 WeakPolarHBondContact O-CD2 3.37Å; P843-I869 CarbonylContact C-O 3.5Å; P843-I869 WeakPolarHBondContact CA-O 3.38Å
844	V	86.1	Confident	76.5	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	106.4	177.8	-175.9	0	0	0	0	112.8	I856 V868 I869 A870 T871 L878	V844-I856 HydrophobicContact CG2-CD1 4.21Å; V844-I856 HydrophobicContact CG2-CG2 3.71Å; V844-V868 HydrophobicContact CB-CG1 4.48Å; V844-V868 HydrophobicContact CG2-CG1 3.57Å; V844-I869 PolarHBondContact N-O 2.84Å; V844-A870 HydrophobicContact CB-CB 3.95Å; V844-A870 WeakPolarHBondContact O-CA 3.42Å; V844-T871 PolarHBondContact O-N 2.92Å; V844-T871 PolarHBondContact O-OG1 3.05Å; V844-T871 VanDerWaalsContact O-OG1 3.06Å; V844-L878 HydrophobicContact CG1-CD1 4.26Å
845	Y	83.9	Confident	76.8	Confident	15 Å²	15	50.5 Å²	50.5	6%	0.059	28%	0.281	C	S	.	.			trans	-145	162.9	174.5	47	-106	0	0	0	112.6	Q815 I818 D819 P843 A847 L848 Q853 I873	Q815-Y845 HydrophobicContact CB-CD1 4.23Å; Q815-Y845 HydrophobicContact CB-CD2 4.32Å; Q815-Y845 HydrophobicContact CB-CE1 4.34Å; Q815-Y845 HydrophobicContact CB-CE2 4.45Å; Q815-Y845 HydrophobicContact CB-CG 4.19Å; Q815-Y845 VanDerWaalsContact CD-CE2 3.47Å; Q815-Y845 HydrophobicContact CG-CD1 4.19Å; Q815-Y845 HydrophobicContact CG-CD2 4.14Å; Q815-Y845 HydrophobicContact CG-CE1 3.81Å; Q815-Y845 HydrophobicContact CG-CE2 3.78Å; Q815-Y845 HydrophobicContact CG-CG 4.33Å; Q815-Y845 VanDerWaalsContact NE2-CE2 3.31Å; Q815-Y845 PolarHBondContact NE2-OH 2.91Å; Q815-Y845 VanDerWaalsContact NE2-OH 3.15Å; I818-Y845 HydrophobicContact CB-CD1 4.19Å; I818-Y845 HydrophobicContact CB-CE1 4.39Å; I818-Y845 HydrophobicContact CD1-CD1 4.1Å; I818-Y845 HydrophobicContact CG2-CD1 3.94Å; I818-Y845 HydrophobicContact CG2-CE1 4.01Å; D819-Y845 WeakPolarHBondContact OD1-CE1 3.24Å; D819-Y845 PolarHBondContact OD1-OH 3.06Å; P843-Y845 HydrophobicContact CB-CD1 4.48Å; P843-Y845 HydrophobicContact CB-CE1 4.07Å; Y845-A847 VanDerWaalsContact C-N 3.27Å; Y845-A847 HydrophobicContact CD2-CB 4.25Å; Y845-A847 PolarHBondContact O-N 3.25Å; Y845-L848 HydrophobicContact CD2-CB 3.95Å; Y845-L848 HydrophobicContact CD2-CD1 4.39Å; Y845-L848 HydrophobicContact CE1-CD1 4.45Å; Y845-L848 HydrophobicContact CE2-CB 4.07Å; Y845-L848 HydrophobicContact CE2-CD1 3.76Å; Y845-L848 WeakPolarHBondContact O-CB 3.3Å; Y845-L848 PolarHBondContact O-N 2.88Å; Y845-Q853 PolarHBondContact O-NE2 3.43Å; Y845-I873 VanDerWaalsContact C-CD1 3.5Å
846	S	73.6	Confident	77.3	Confident	91 Å²	91	43.1 Å²	43.1	64%	0.636	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-27.7	-167.1	-53	0	0	0	0	114.3	L848 I873	S846-L848 VanDerWaalsContact C-N 3.32Å; S846-I873 VanDerWaalsContact N-CD1 3.29Å; S846-I873 WeakPolarHBondContact OG-CD1 3.32Å
847	A	69.9	Low	77.5	Confident	67 Å²	67	45.7 Å²	45.7	55%	0.554	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.2	177.9	0	0	0	0	0	113.8	Y845	Y845-A847 VanDerWaalsContact C-N 3.27Å; Y845-A847 HydrophobicContact CD2-CB 4.25Å; Y845-A847 PolarHBondContact O-N 3.25Å
848	L	71.2	Confident	77.6	Confident	8 Å²	8	45 Å²	45	4%	0.042	24%	0.243	C	C	.	.	S	Bend	trans	-71.7	137.9	-176	-161.9	76.8	0	0	0	111.3	P843 Y845 S846 S850 M852 Q853	P843-L848 WeakPolarHBondContact O-CD2 3.37Å; Y845-L848 HydrophobicContact CD2-CB 3.95Å; Y845-L848 HydrophobicContact CD2-CD1 4.39Å; Y845-L848 HydrophobicContact CE1-CD1 4.45Å; Y845-L848 HydrophobicContact CE2-CB 4.07Å; Y845-L848 HydrophobicContact CE2-CD1 3.76Å; Y845-L848 WeakPolarHBondContact O-CB 3.3Å; Y845-L848 PolarHBondContact O-N 2.88Å; S846-L848 VanDerWaalsContact C-N 3.32Å; L848-S850 PolarHBondContact O-N 3.37Å; L848-M852 HydrophobicContact CD1-SD 3.63Å; L848-M852 HydrophobicContact CD2-CB 3.69Å; L848-M852 HydrophobicContact CD2-SD 4.45Å; L848-M852 HydrophobicContact CG-CB 3.91Å; L848-M852 HydrophobicContact CG-SD 3.84Å; L848-Q853 HydrophobicContact CB-CG 4.09Å; L848-Q853 HydrophobicContact CD2-CG 3.97Å; L848-Q853 HydrophobicContact CG-CG 4.4Å; L848-Q853 PolarHBondContact O-NE2 3.5Å
849	P	66.4	Low	77.4	Confident	63 Å²	63	44.7 Å²	44.7	41%	0.409	25%	0.249	S	C	.	.			trans	-52.7	137.7	172	-29.5	35.7	0	0	0	113.4	E851 M852 Q853	P849-E851 PolarHBondContact O-N 3.34Å; P849-M852 HydrophobicContact CB-CE 4.48Å; P849-M852 HydrophobicContact CB-CG 4.35Å; P849-M852 HydrophobicContact CB-SD 4.19Å; P849-M852 HydrophobicContact CG-CE 4.07Å; P849-M852 HydrophobicContact CG-SD 3.97Å; P849-M852 WeakPolarHBondContact O-CB 3.42Å; P849-M852 PolarHBondContact O-N 3.13Å; P849-Q853 PolarHBondContact O-N 2.76Å; P849-Q853 VanDerWaalsContact O-N 3.14Å
850	S	61.9	Low	77.1	Confident	41 Å²	41	45.6 Å²	45.6	29%	0.287	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-30.2	-173.6	-54.3	0	0	0	0	113.8	L848 M852 Q853 T854 R1102	L848-S850 PolarHBondContact O-N 3.37Å; S850-M852 VanDerWaalsContact C-N 3.34Å; S850-M852 PolarHBondContact O-N 2.88Å; S850-Q853 CarbonylContact O-C 3.59Å; S850-Q853 PolarHBondContact O-N 3.29Å; S850-T854 PolarHBondContact O-N 3.47Å; S850-T854 PolarHBondContact O-OG1 2.84Å; S850-T854 VanDerWaalsContact O-OG1 3.06Å; S850-R1102 PolarHBondContact OG-NH1 3.3Å; S850-R1102 PolarHBondContact OG-NH2 3.49Å
851	E	66.6	Low	76.7	Confident	162 Å²	162	47.6 Å²	47.6	76%	0.757	27%	0.274	S	S	*	.	H	α-helix	trans	-62.5	-40.3	175.8	-68.4	160.7	-158.4	0	0	111.6	P849 T854 R855	P849-E851 PolarHBondContact O-N 3.34Å; E851-T854 PolarHBondContact O-N 3.06Å; E851-R855 PolarHBondContact O-N 3.37Å
852	M	67.3	Low	76	Confident	52 Å²	52	53.8 Å²	53.8	26%	0.256	31%	0.314	S	S	.	.	H	α-helix	trans	-69.3	-39.6	173.4	-57.1	171.4	-179.8	0	0	111.2	F575 L848 P849 S850 T854 R855	F575-M852 HydrophobicContact CD1-CE 3.68Å; F575-M852 HydrophobicContact CD1-CG 3.82Å; F575-M852 HydrophobicContact CD1-SD 3.78Å; F575-M852 HydrophobicContact CD2-CE 3.68Å; F575-M852 HydrophobicContact CE1-CE 3.65Å; F575-M852 HydrophobicContact CE1-CG 3.91Å; F575-M852 HydrophobicContact CE1-SD 3.35Å; F575-M852 WeakPolarHBondContact CE1-SD 3.47Å; F575-M852 HydrophobicContact CE2-CE 3.59Å; F575-M852 HydrophobicContact CE2-SD 4.27Å; F575-M852 HydrophobicContact CG-CE 3.75Å; F575-M852 HydrophobicContact CG-SD 4.45Å; F575-M852 HydrophobicContact CZ-CE 3.6Å; F575-M852 HydrophobicContact CZ-SD 3.64Å; L848-M852 HydrophobicContact CD1-SD 3.63Å; L848-M852 HydrophobicContact CD2-CB 3.69Å; L848-M852 HydrophobicContact CD2-SD 4.45Å; L848-M852 HydrophobicContact CG-CB 3.91Å; L848-M852 HydrophobicContact CG-SD 3.84Å; P849-M852 HydrophobicContact CB-CE 4.48Å; P849-M852 HydrophobicContact CB-CG 4.35Å; P849-M852 HydrophobicContact CB-SD 4.19Å; P849-M852 HydrophobicContact CG-CE 4.07Å; P849-M852 HydrophobicContact CG-SD 3.97Å; P849-M852 WeakPolarHBondContact O-CB 3.42Å; P849-M852 PolarHBondContact O-N 3.13Å; S850-M852 VanDerWaalsContact C-N 3.34Å; S850-M852 PolarHBondContact O-N 2.88Å; M852-T854 PolarHBondContact O-N 3.27Å; M852-R855 WeakPolarHBondContact O-CB 3.47Å; M852-R855 PolarHBondContact O-N 2.71Å; M852-R855 VanDerWaalsContact O-N 3.13Å
853	Q	69.2	Low	75.5	Confident	53 Å²	53	56.7 Å²	56.7	25%	0.248	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-27.3	175.4	-65.5	178.4	-20.7	0	0	112.4	Y845 L848 P849 S850 I856	Y845-Q853 PolarHBondContact O-NE2 3.43Å; L848-Q853 HydrophobicContact CB-CG 4.09Å; L848-Q853 HydrophobicContact CD2-CG 3.97Å; L848-Q853 HydrophobicContact CG-CG 4.4Å; L848-Q853 PolarHBondContact O-NE2 3.5Å; P849-Q853 PolarHBondContact O-N 2.76Å; P849-Q853 VanDerWaalsContact O-N 3.14Å; S850-Q853 CarbonylContact O-C 3.59Å; S850-Q853 PolarHBondContact O-N 3.29Å; Q853-I856 WeakPolarHBondContact O-CD1 3.34Å; Q853-I856 VanDerWaalsContact O-CG1 3.3Å; Q853-I856 WeakPolarHBondContact O-CG1 3.47Å
854	T	71.6	Confident	75.2	Confident	14 Å²	14	57.5 Å²	57.5	9%	0.086	35%	0.352	C	S	.	.	H	α-helix	trans	-72.1	-35.8	172.3	-53.8	0	0	0	0	112.1	A580 Y582 S850 E851 M852 I856 F857	A580-T854 HydrophobicContact CB-CG2 4.02Å; Y582-T854 HydrophobicContact CD1-CG2 4.45Å; Y582-T854 HydrophobicContact CE1-CG2 4.27Å; S850-T854 PolarHBondContact O-N 3.47Å; S850-T854 PolarHBondContact O-OG1 2.84Å; S850-T854 VanDerWaalsContact O-OG1 3.06Å; E851-T854 PolarHBondContact O-N 3.06Å; M852-T854 PolarHBondContact O-N 3.27Å; T854-I856 PolarHBondContact O-N 2.93Å; T854-F857 WeakPolarHBondContact O-CD2 3.33Å; T854-F857 PolarHBondContact O-N 3.39Å; T854-F857 VanDerWaalsContact O-N 3.07Å
855	R	76.3	Confident	75.3	Confident	69 Å²	69	58.3 Å²	58.3	26%	0.26	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-61.2	-16.1	-176.5	-155	-179.1	-176.5	-164.9	-1.6	114.2	H573 A574 E851 M852 F857 D858	H573-R855 PolarHBondContact O-NH1 3.27Å; H573-R855 VanDerWaalsContact O-NH1 3.11Å; A574-R855 PolarHBondContact O-NH1 3.01Å; E851-R855 PolarHBondContact O-N 3.37Å; M852-R855 WeakPolarHBondContact O-CB 3.47Å; M852-R855 PolarHBondContact O-N 2.71Å; M852-R855 VanDerWaalsContact O-N 3.13Å; R855-F857 VanDerWaalsContact C-N 3.31Å; R855-F857 PolarHBondContact O-N 3.49Å; R855-D858 WeakPolarHBondContact CA-OD2 3.34Å; R855-D858 WeakPolarHBondContact CG-OD2 3.34Å; R855-D858 PolarHBondContact O-N 3.01Å
856	I	80.6	Confident	75.6	Confident	3 Å²	3	58 Å²	58	2%	0.015	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-71.7	-24.8	176.8	78.5	-169.2	0	0	0	113.2	L842 V844 Q853 T854 D858 K866 L878 I880	L842-I856 HydrophobicContact CB-CG2 4.41Å; L842-I856 HydrophobicContact CD1-CG2 4.29Å; V844-I856 HydrophobicContact CG2-CD1 4.21Å; V844-I856 HydrophobicContact CG2-CG2 3.71Å; Q853-I856 WeakPolarHBondContact O-CD1 3.34Å; Q853-I856 VanDerWaalsContact O-CG1 3.3Å; Q853-I856 WeakPolarHBondContact O-CG1 3.47Å; T854-I856 PolarHBondContact O-N 2.93Å; I856-D858 VanDerWaalsContact C-N 3.33Å; I856-K866 PolarHBondContact O-NZ 3.08Å; I856-L878 HydrophobicContact CD1-CD1 4.17Å; I856-I880 HydrophobicContact CD1-CD1 3.86Å; I856-I880 HydrophobicContact CD1-CG1 4.09Å; I856-I880 HydrophobicContact CG1-CD1 4.21Å; I856-I880 HydrophobicContact CG1-CG1 4.2Å
857	F	79.3	Confident	76.5	Confident	83 Å²	83	53.6 Å²	53.6	36%	0.364	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-83.1	-12.3	178.6	-56.4	-69.9	0	0	0	112.7	T854 R855 L878 T879 I880	T854-F857 WeakPolarHBondContact O-CD2 3.33Å; T854-F857 PolarHBondContact O-N 3.39Å; T854-F857 VanDerWaalsContact O-N 3.07Å; R855-F857 VanDerWaalsContact C-N 3.31Å; R855-F857 PolarHBondContact O-N 3.49Å; F857-L878 HydrophobicContact CZ-CD2 4.13Å; F857-T879 WeakPolarHBondContact CE1-O 3.07Å; F857-I880 HydrophobicContact CE1-CG1 4.48Å
858	D	80.1	Confident	77.6	Confident	56 Å²	56	50.4 Å²	50.4	30%	0.299	30%	0.297	S	S	.	.	S	Bend	trans	-66.1	138.3	174	-65	-36.5	0	0	0	109.7	R855 I856 K866	R855-D858 WeakPolarHBondContact CA-OD2 3.34Å; R855-D858 WeakPolarHBondContact CG-OD2 3.34Å; R855-D858 PolarHBondContact O-N 3.01Å; I856-D858 VanDerWaalsContact C-N 3.33Å; D858-K866 PolarHBondContact O-NZ 2.93Å
859	P	78.8	Confident	78.6	Confident	94 Å²	94	50.1 Å²	50.1	61%	0.61	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-70.7	145.9	174.8	30.3	-34.2	0	0	0	110.7
860	A	79.8	Confident	79.8	Confident	30 Å²	30	47.1 Å²	47.1	25%	0.248	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-62.8	138.4	172.1	0	0	0	0	0	111.3	K866	A860-K866 HydrophobicContact CB-CB 4.38Å
861	P	79.8	Confident	81.2	Confident	71 Å²	71	45.7 Å²	45.7	46%	0.461	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-52.2	144.6	166.6	-27.9	34.4	0	0	0	112.8	I840 G863 S864	I840-P861 HydrophobicContact CD1-CG 4.16Å; P861-G863 PolarHBondContact O-N 3.32Å; P861-S864 VanDerWaalsContact CD-OG 3.29Å; P861-S864 WeakPolarHBondContact CD-OG 3.48Å; P861-S864 PolarHBondContact O-N 3.4Å; P861-S864 PolarHBondContact O-OG 2.84Å
862	P	75.3	Confident	82.1	Confident	141 Å²	141	41 Å²	41	92%	0.916	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	128.3	178.4	-25.3	34.5	0	0	0	112.2
863	G	78.3	Confident	82.8	Confident	71 Å²	71	40 Å²	40	73%	0.732	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	88	-9.1	-177.6	0	0	0	0	0	115.4	P861	P861-G863 PolarHBondContact O-N 3.32Å
864	S	83.4	Confident	83.5	Confident	21 Å²	21	37.6 Å²	37.6	15%	0.147	23%	0.23	C	C	.	.			trans	-99.3	162.7	171.8	72.1	0	0	0	0	112	E838 P861	E838-S864 WeakPolarHBondContact O-CA 3.39Å; E838-S864 WeakPolarHBondContact O-CB 3.31Å; P861-S864 VanDerWaalsContact CD-OG 3.29Å; P861-S864 WeakPolarHBondContact CD-OG 3.48Å; P861-S864 PolarHBondContact O-N 3.4Å; P861-S864 PolarHBondContact O-OG 2.84Å
865	R	88.8	Confident	83.9	Confident	20 Å²	20	37.4 Å²	37.4	8%	0.075	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.7	174.6	-164	-172.4	-60.1	-121.7	12.8	110	I799 H800 E803 P804 G806 E838 L839 I840	I799-R865 PolarHBondContact O-NH2 2.94Å; H800-R865 WeakPolarHBondContact CE1-CB 3.5Å; H800-R865 WeakPolarHBondContact CE1-CD 3.33Å; H800-R865 WeakPolarHBondContact CE1-CG 3.44Å; H800-R865 VanDerWaalsContact CE1-CZ 3.43Å; H800-R865 PolarHBondContact CE1-NE 3.33Å; H800-R865 PolarHBondContact ND1-NE 3.17Å; H800-R865 WeakPolarHBondContact NE2-CB 3.29Å; H800-R865 PolarHBondContact O-NH2 2.91Å; E803-R865 PolarHBondContact O-NH2 3.45Å; P804-R865 PolarHBondContact O-NH1 3.44Å; P804-R865 PolarHBondContact O-NH2 3.39Å; G806-R865 WeakPolarHBondContact O-CD 3.33Å; G806-R865 VanDerWaalsContact O-CG 3.27Å; G806-R865 WeakPolarHBondContact O-CG 3.17Å; G806-R865 PolarHBondContact O-NH1 3.42Å; E838-R865 PolarHBondContact O-N 2.91Å; L839-R865 WeakPolarHBondContact CA-O 3.4Å; L839-R865 HydrophobicContact CD1-CB 4.01Å; L839-R865 HydrophobicContact CD1-CG 4.47Å; I840-R865 PolarHBondContact N-O 2.95Å
866	K	90.6	Very high	83.4	Confident	7 Å²	7	34.4 Å²	34.4	3%	0.03	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.3	175.4	-178.6	176.7	49.9	178.8	0	110.7	D807 I808 I840 L842 I856 D858 A860 V868	D807-K866 WeakPolarHBondContact CA-O 3.27Å; D807-K866 HydrophobicContact CB-CB 4.25Å; D807-K866 WeakPolarHBondContact CB-O 3.39Å; D807-K866 VanDerWaalsContact OD1-CB 3.31Å; D807-K866 WeakPolarHBondContact OD1-CB 3.35Å; D807-K866 PolarHBondContact OD1-N 3.06Å; D807-K866 WeakPolarHBondContact OD2-CE 3.47Å; D807-K866 IonicContact OD2-NZ 3.74Å; I808-K866 PolarHBondContact N-O 3.26Å; I840-K866 WeakPolarHBondContact O-CA 3.44Å; L842-K866 HydrophobicContact CD1-CD 3.78Å; L842-K866 HydrophobicContact CD1-CG 4.02Å; I856-K866 PolarHBondContact O-NZ 3.08Å; D858-K866 PolarHBondContact O-NZ 2.93Å; A860-K866 HydrophobicContact CB-CB 4.38Å; K866-V868 HydrophobicContact CD-CG2 4.18Å; K866-V868 HydrophobicContact CG-CG2 4.01Å
867	V	92	Very high	82.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112.2	169.9	169.6	0	0	0	0	108.1	V796 I808 V810 L825 L839 I840 L842 I869	V796-V867 HydrophobicContact CG1-CG1 4.18Å; V796-V867 HydrophobicContact CG1-CG2 3.79Å; I808-V867 HydrophobicContact CB-CG2 4.07Å; I808-V867 HydrophobicContact CD1-CG2 4.01Å; I808-V867 HydrophobicContact CG1-CG2 4.35Å; I808-V867 WeakPolarHBondContact O-CA 3.3Å; V810-V867 HydrophobicContact CG2-CG1 4.25Å; L825-V867 HydrophobicContact CD2-CG1 4.23Å; L839-V867 HydrophobicContact CD1-CB 4.4Å; L839-V867 HydrophobicContact CD1-CG2 3.38Å; L839-V867 HydrophobicContact CD2-CG2 4.12Å; L839-V867 HydrophobicContact CG-CG2 3.86Å; I840-V867 PolarHBondContact O-N 3.25Å; L842-V867 PolarHBondContact N-O 3.32Å; V867-I869 HydrophobicContact CG1-CD1 4.16Å; V867-I869 HydrophobicContact CG1-CG1 3.69Å
868	V	92.3	Very high	81.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115	173.6	-174.2	0	0	0	0	108.4	I808 L809 V810 L842 V844 K866 A870 I880	I808-V868 PolarHBondContact O-N 2.83Å; L809-V868 WeakPolarHBondContact CA-O 3.37Å; L809-V868 HydrophobicContact CD1-CB 4Å; L809-V868 HydrophobicContact CD1-CG1 3.97Å; V810-V868 PolarHBondContact N-O 3.47Å; L842-V868 WeakPolarHBondContact O-CA 3.48Å; V844-V868 HydrophobicContact CB-CG1 4.48Å; V844-V868 HydrophobicContact CG2-CG1 3.57Å; K866-V868 HydrophobicContact CD-CG2 4.18Å; K866-V868 HydrophobicContact CG-CG2 4.01Å; V868-A870 HydrophobicContact CG1-CB 4.39Å; V868-I880 HydrophobicContact CG1-CD1 4.01Å; V868-I880 HydrophobicContact CG2-CD1 4.47Å
869	I	92.9	Very high	81.5	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	105.8	177.5	-47.8	-169.3	0	0	0	108.4	V810 L812 I818 A821 I841 L842 P843 V844 V867	V810-I869 HydrophobicContact CB-CG1 4.5Å; V810-I869 HydrophobicContact CB-CG2 4.3Å; V810-I869 HydrophobicContact CG2-CG1 4.5Å; L812-I869 HydrophobicContact CD1-CG2 3.47Å; L812-I869 VanDerWaalsContact CD1-CG2 3.47Å; L812-I869 HydrophobicContact CG-CG2 3.94Å; I818-I869 HydrophobicContact CB-CG2 4.47Å; I818-I869 HydrophobicContact CG1-CG2 4.06Å; I818-I869 HydrophobicContact CG2-CB 4.29Å; I818-I869 HydrophobicContact CG2-CG2 4.14Å; A821-I869 HydrophobicContact CB-CD1 4.11Å; A821-I869 HydrophobicContact CB-CG2 4.45Å; I841-I869 HydrophobicContact CG2-CD1 4.22Å; L842-I869 PolarHBondContact O-N 3.49Å; P843-I869 CarbonylContact C-O 3.5Å; P843-I869 WeakPolarHBondContact CA-O 3.38Å; V844-I869 PolarHBondContact N-O 2.84Å; V867-I869 HydrophobicContact CG1-CD1 4.16Å; V867-I869 HydrophobicContact CG1-CG1 3.69Å
870	A	91.6	Very high	81.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153.3	-164.1	0	0	0	0	0	114	L809 V810 F811 L812 V844 V868 A874	L809-A870 HydrophobicContact CD1-CB 3.81Å; V810-A870 PolarHBondContact O-N 3.08Å; F811-A870 CarbonylContact C-O 3.57Å; F811-A870 WeakPolarHBondContact CA-O 3.48Å; L812-A870 PolarHBondContact N-O 3.28Å; V844-A870 HydrophobicContact CB-CB 3.95Å; V844-A870 WeakPolarHBondContact O-CA 3.42Å; V868-A870 HydrophobicContact CG1-CB 4.39Å; A870-A874 HydrophobicContact CB-CB 3.77Å
871	T	91	Very high	81.4	Confident	11 Å²	11	33.5 Å²	33.5	7%	0.067	21%	0.214	C	C	.	.			trans	-81.5	179.8	161	45.3	0	0	0	0	111.4	I818 V844 I873 A874	I818-T871 HydrophobicContact CD1-CG2 3.64Å; V844-T871 PolarHBondContact O-N 2.92Å; V844-T871 PolarHBondContact O-OG1 3.05Å; V844-T871 VanDerWaalsContact O-OG1 3.06Å; T871-I873 PolarHBondContact O-N 3.48Å; T871-I873 VanDerWaalsContact OG1-CD1 3.27Å; T871-I873 WeakPolarHBondContact OG1-CD1 3.38Å; T871-I873 WeakPolarHBondContact OG1-CG1 3.36Å; T871-A874 PolarHBondContact O-N 3.29Å; T871-A874 VanDerWaalsContact O-N 3.14Å
872	N	86.1	Confident	81.6	Confident	64 Å²	64	31.1 Å²	31.1	34%	0.342	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-55	-4.7	174.2	69.2	-23	0	0	0	115.7	A874 E875 V892	N872-A874 PolarHBondContact O-N 2.87Å; N872-E875 HydrophobicContact CB-CB 4.34Å; N872-E875 WeakPolarHBondContact O-CB 3.47Å; N872-E875 PolarHBondContact O-N 2.87Å; N872-E875 VanDerWaalsContact O-N 3.08Å; N872-V892 HydrophobicContact CB-CG2 4.35Å
873	I	82.3	Confident	82.3	Confident	30 Å²	30	24.6 Å²	24.6	15%	0.154	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-56.1	-38.9	168.9	-51.9	169	0	0	0	110.7	R651 Y845 S846 T871 E875 L878	R651-I873 PolarHBondContact NH1-O 3.03Å; Y845-I873 VanDerWaalsContact C-CD1 3.5Å; S846-I873 VanDerWaalsContact N-CD1 3.29Å; S846-I873 WeakPolarHBondContact OG-CD1 3.32Å; T871-I873 PolarHBondContact O-N 3.48Å; T871-I873 VanDerWaalsContact OG1-CD1 3.27Å; T871-I873 WeakPolarHBondContact OG1-CD1 3.38Å; T871-I873 WeakPolarHBondContact OG1-CG1 3.36Å; I873-E875 VanDerWaalsContact C-N 3.28Å; I873-E875 PolarHBondContact O-N 2.86Å; I873-L878 HydrophobicContact CB-CD1 4.49Å; I873-L878 HydrophobicContact CG2-CD1 3.73Å; I873-L878 HydrophobicContact CG2-CG 4.13Å
874	A	82.9	Confident	82.9	Confident	2 Å²	2	24.9 Å²	24.9	2%	0.017	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-74.3	-14.9	178.2	0	0	0	0	0	114	L809 F811 A870 T871 N872 T876 R922	L809-A874 HydrophobicContact CD1-CB 4.12Å; L809-A874 HydrophobicContact CD2-CB 4.2Å; F811-A874 HydrophobicContact CE1-CB 4.02Å; F811-A874 HydrophobicContact CZ-CB 4.41Å; A870-A874 HydrophobicContact CB-CB 3.77Å; T871-A874 PolarHBondContact O-N 3.29Å; T871-A874 VanDerWaalsContact O-N 3.14Å; N872-A874 PolarHBondContact O-N 2.87Å; A874-T876 PolarHBondContact O-N 3.25Å; A874-R922 VanDerWaalsContact O-CD 3.29Å; A874-R922 WeakPolarHBondContact O-CD 3.32Å; A874-R922 PolarHBondContact O-NE 2.92Å; A874-R922 PolarHBondContact O-NH1 3.02Å
875	E	79.4	Confident	83.5	Confident	11 Å²	11	24.6 Å²	24.6	5%	0.051	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-68.3	-32.9	-172	-165.5	168	109.5	0	0	113.4	F811 N872 I873 Q915 R919 R922	F811-E875 HydrophobicContact CE1-CB 4.2Å; N872-E875 HydrophobicContact CB-CB 4.34Å; N872-E875 WeakPolarHBondContact O-CB 3.47Å; N872-E875 PolarHBondContact O-N 2.87Å; N872-E875 VanDerWaalsContact O-N 3.08Å; I873-E875 VanDerWaalsContact C-N 3.28Å; I873-E875 PolarHBondContact O-N 2.86Å; E875-Q915 VanDerWaalsContact OE1-CG 3.28Å; E875-Q915 WeakPolarHBondContact OE1-CG 3.36Å; E875-Q915 PolarHBondContact OE1-NE2 3.3Å; E875-R919 HydrophobicContact CG-CG 4Å; E875-R919 IonicContact OE2-CZ 3.79Å; E875-R919 VanDerWaalsContact OE2-CZ 3.23Å; E875-R919 IonicContact OE2-NE 2.76Å; E875-R919 PolarHBondContact OE2-NE 2.88Å; E875-R919 IonicContact OE2-NH2 2.68Å; E875-R919 PolarHBondContact OE2-NH2 2.62Å; E875-R922 VanDerWaalsContact C-CZ 3.43Å; E875-R922 PolarHBondContact O-NE 3.43Å; E875-R922 PolarHBondContact O-NH2 2.97Å
876	T	66.6	Low	83.8	Confident	6 Å²	6	23.6 Å²	23.6	4%	0.037	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125	-69.2	-178.2	57.9	0	0	0	0	112	R651 H720 E721 A874 L878 R922	R651-T876 PolarHBondContact NH1-OG1 2.98Å; R651-T876 PolarHBondContact NH2-OG1 3.48Å; H720-T876 WeakPolarHBondContact NE2-CG2 3.47Å; E721-T876 VanDerWaalsContact OE1-CB 3.23Å; E721-T876 WeakPolarHBondContact OE1-CB 3.25Å; E721-T876 WeakPolarHBondContact OE1-CG2 3.29Å; E721-T876 PolarHBondContact OE1-OG1 3.3Å; A874-T876 PolarHBondContact O-N 3.25Å; T876-L878 PolarHBondContact O-N 3.34Å; T876-R922 VanDerWaalsContact C-NH1 3.34Å; T876-R922 VanDerWaalsContact O-CZ 3.32Å; T876-R922 PolarHBondContact O-NH1 3.5Å; T876-R922 PolarHBondContact O-NH2 3.5Å
877	S	60.4	Low	84	Confident	49 Å²	49	23.3 Å²	23.3	34%	0.343	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.5	-160.1	-31.4	0	0	0	0	117.7	R651	R651-S877 WeakPolarHBondContact CD-OG 3.15Å; R651-S877 VanDerWaalsContact CZ-OG 3.29Å; R651-S877 PolarHBondContact NE-OG 3.13Å; R651-S877 PolarHBondContact NH1-OG 3.19Å; R651-S877 VanDerWaalsContact NH1-OG 3.11Å
878	L	68.7	Low	84.1	Confident	37 Å²	37	23.3 Å²	23.3	19%	0.194	13%	0.13	C	C	.	.			trans	-101.8	128	176.7	-62.7	178.7	0	0	0	111.9	V844 I856 F857 I873 T876 R922 R925	V844-L878 HydrophobicContact CG1-CD1 4.26Å; I856-L878 HydrophobicContact CD1-CD1 4.17Å; F857-L878 HydrophobicContact CZ-CD2 4.13Å; I873-L878 HydrophobicContact CB-CD1 4.49Å; I873-L878 HydrophobicContact CG2-CD1 3.73Å; I873-L878 HydrophobicContact CG2-CG 4.13Å; T876-L878 PolarHBondContact O-N 3.34Å; L878-R922 PolarHBondContact O-NH1 2.86Å; L878-R925 PolarHBondContact O-NH1 3.49Å
879	T	71.4	Confident	84.1	Confident	77 Å²	77	23.3 Å²	23.3	47%	0.472	13%	0.13	S	C	.	.			trans	-102.7	96.2	166.4	47.5	0	0	0	0	109.2	F857	F857-T879 WeakPolarHBondContact CE1-O 3.07Å
880	I	79.1	Confident	84.1	Confident	9 Å²	9	23.2 Å²	23.2	5%	0.046	13%	0.13	C	C	.	.			trans	-94.5	116.6	172	-56.6	172.4	0	0	0	106.8	I856 F857 V868 I883	I856-I880 HydrophobicContact CD1-CD1 3.86Å; I856-I880 HydrophobicContact CD1-CG1 4.09Å; I856-I880 HydrophobicContact CG1-CD1 4.21Å; I856-I880 HydrophobicContact CG1-CG1 4.2Å; F857-I880 HydrophobicContact CE1-CG1 4.48Å; V868-I880 HydrophobicContact CG1-CD1 4.01Å; V868-I880 HydrophobicContact CG2-CD1 4.47Å; I880-I883 HydrophobicContact CB-CD1 3.71Å; I880-I883 HydrophobicContact CB-CG1 4.37Å; I880-I883 HydrophobicContact CD1-CD1 4.41Å; I880-I883 HydrophobicContact CG2-CD1 4Å; I880-I883 HydrophobicContact CG2-CG1 4.18Å
881	D	76.7	Confident	84.1	Confident	74 Å²	74	23.5 Å²	23.5	40%	0.396	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	145	173.4	-78.8	13	0	0	0	110.8	K584	K584-D881 IonicContact NZ-OD2 2.78Å; K584-D881 PolarHBondContact NZ-OD2 3Å
882	G	83.9	Confident	84.1	Confident	22 Å²	22	23.2 Å²	23.2	23%	0.227	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	-2.2	168.7	0	0	0	0	0	115.6	D807 Y884	D807-G882 VanDerWaalsContact CB-O 3.28Å; D807-G882 WeakPolarHBondContact CB-O 3.33Å; D807-G882 PolarHBondContact N-O 3.28Å; G882-Y884 VanDerWaalsContact O-CD2 3.24Å; G882-Y884 WeakPolarHBondContact O-CD2 3.4Å; G882-Y884 PolarHBondContact O-N 3.04Å
883	I	89.9	Confident	84.1	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.015	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	123.8	173.8	-60.2	165.7	0	0	0	109.6	D807 L809 I880 Y885 V886 T926	D807-I883 WeakPolarHBondContact O-CA 3.49Å; L809-I883 HydrophobicContact CB-CD1 3.85Å; L809-I883 HydrophobicContact CB-CG1 4.28Å; L809-I883 HydrophobicContact CB-CG2 3.94Å; L809-I883 HydrophobicContact CD2-CD1 3.89Å; L809-I883 HydrophobicContact CG-CD1 4.31Å; I880-I883 HydrophobicContact CB-CD1 3.71Å; I880-I883 HydrophobicContact CB-CG1 4.37Å; I880-I883 HydrophobicContact CD1-CD1 4.41Å; I880-I883 HydrophobicContact CG2-CD1 4Å; I880-I883 HydrophobicContact CG2-CG1 4.18Å; I883-Y885 WeakPolarHBondContact CG2-O 3.15Å; I883-V886 HydrophobicContact CG2-CG2 4.16Å; I883-T926 PolarHBondContact O-OG1 3.17Å
884	Y	91.9	Very high	84.2	Confident	77 Å²	77	23.5 Å²	23.5	30%	0.302	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-21.3	169.2	-74.7	-95.7	0	0	0	112.3	D807 G882 P928 G929 K930	D807-Y884 PolarHBondContact O-N 3.44Å; G882-Y884 VanDerWaalsContact O-CD2 3.24Å; G882-Y884 WeakPolarHBondContact O-CD2 3.4Å; G882-Y884 PolarHBondContact O-N 3.04Å; Y884-P928 WeakPolarHBondContact CD1-O 3.49Å; Y884-G929 CarbonylContact O-C 3.44Å; Y884-G929 WeakPolarHBondContact O-CA 3.45Å; Y884-K930 PolarHBondContact O-N 2.65Å
885	Y	94.2	Very high	84.2	Confident	15 Å²	15	28.2 Å²	28.2	6%	0.059	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.7	-174.5	-55.9	-79.1	0	0	0	110.5	I799 E803 P804 G806 D807 I808 L809 I883 K930 Y932	I799-Y885 HydrophobicContact CG2-CD1 3.73Å; I799-Y885 HydrophobicContact CG2-CD2 3.93Å; I799-Y885 HydrophobicContact CG2-CE1 4.23Å; I799-Y885 HydrophobicContact CG2-CE2 4.43Å; I799-Y885 HydrophobicContact CG2-CG 3.57Å; E803-Y885 HydrophobicContact CB-CE1 3.74Å; E803-Y885 HydrophobicContact CG-CE1 4.01Å; P804-Y885 WeakPolarHBondContact CD-OH 3.29Å; P804-Y885 WeakPolarHBondContact O-CE2 3.45Å; P804-Y885 PolarHBondContact O-OH 3.04Å; P804-Y885 VanDerWaalsContact O-OH 3.06Å; G806-Y885 WeakPolarHBondContact O-CD2 3.32Å; D807-Y885 PolarHBondContact O-N 3.04Å; D807-Y885 VanDerWaalsContact O-N 3.16Å; I808-Y885 CarbonylContact C-O 3.59Å; I808-Y885 WeakPolarHBondContact CA-O 3.49Å; I808-Y885 HydrophobicContact CG1-CD2 4.37Å; L809-Y885 PolarHBondContact N-O 3.41Å; I883-Y885 WeakPolarHBondContact CG2-O 3.15Å; Y885-K930 WeakPolarHBondContact CA-O 3.43Å; Y885-K930 HydrophobicContact CD1-CB 4.12Å; Y885-K930 HydrophobicContact CE1-CB 4.44Å; Y885-K930 HydrophobicContact CE1-CD 4.26Å; Y885-Y932 HydrophobicContact CD1-CE2 4.17Å
886	V	95.1	Very high	84.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.5	174.4	168.5	0	0	0	0	109.7	L809 F811 I883 R922 A923 K930 C931 Y932	L809-V886 HydrophobicContact CB-CG2 4.37Å; L809-V886 CarbonylContact O-C 3.58Å; L809-V886 WeakPolarHBondContact O-CA 3.39Å; F811-V886 HydrophobicContact CD2-CG1 4.09Å; F811-V886 HydrophobicContact CE2-CG1 3.86Å; I883-V886 HydrophobicContact CG2-CG2 4.16Å; V886-R922 HydrophobicContact CG2-CB 4Å; V886-A923 HydrophobicContact CG2-CB 3.92Å; V886-K930 PolarHBondContact N-O 2.96Å; V886-C931 HydrophobicContact CB-CB 4.36Å; V886-C931 CarbonylContact O-C 3.54Å; V886-C931 WeakPolarHBondContact O-CA 3.27Å; V886-Y932 PolarHBondContact O-N 3.34Å
887	V	95.4	Very high	85.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117	170.3	-176.5	0	0	0	0	108.4	T795 V796 I799 I808 L809 V810 F811 L934	T795-V887 HydrophobicContact CG2-CG1 4.17Å; T795-V887 HydrophobicContact CG2-CG2 3.86Å; V796-V887 HydrophobicContact CG2-CG2 4.21Å; I799-V887 HydrophobicContact CD1-CG2 3.79Å; I808-V887 HydrophobicContact CG2-CG2 4.25Å; L809-V887 PolarHBondContact O-N 2.63Å; V810-V887 HydrophobicContact CG1-CB 4.34Å; V810-V887 HydrophobicContact CG2-CB 4.42Å; F811-V887 PolarHBondContact N-O 2.96Å; V887-L934 HydrophobicContact CG1-CD1 4.13Å; V887-L934 HydrophobicContact CG1-CG 4.41Å
888	D	94.9	Very high	86.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	106	-177.4	178.4	33.4	0	0	0	110.8	G890 I911 R919 Y932 R933 L934 Y935	D888-G890 PolarHBondContact O-N 3.29Å; D888-G890 PolarHBondContact OD1-N 2.91Å; D888-I911 WeakPolarHBondContact OD2-CD1 3.37Å; D888-R919 WeakPolarHBondContact OD1-CD 3.46Å; D888-R919 IonicContact OD1-CZ 2.74Å; D888-R919 IonicContact OD1-NE 3.33Å; D888-R919 IonicContact OD1-NH1 2.73Å; D888-R919 PolarHBondContact OD1-NH1 3.49Å; D888-Y932 PolarHBondContact N-O 2.85Å; D888-R933 WeakPolarHBondContact O-CA 3.39Å; D888-L934 PolarHBondContact O-N 3.27Å; D888-Y935 WeakPolarHBondContact O-CE1 3.46Å; D888-Y935 WeakPolarHBondContact OD2-CE1 3.42Å; D888-Y935 PolarHBondContact OD2-OH 3.22Å
889	P	92.5	Very high	86.4	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.006	15%	0.146	C	C	.	.			trans	-76.4	-3.7	172.7	31	-34.2	0	0	0	113.5	Y788 F811 F891 L934	Y788-P889 HydrophobicContact CD2-CB 3.59Å; Y788-P889 HydrophobicContact CD2-CG 4Å; Y788-P889 HydrophobicContact CE2-CB 4.47Å; Y788-P889 HydrophobicContact CG-CB 3.94Å; F811-P889 WeakPolarHBondContact O-CD 3.41Å; F811-P889 WeakPolarHBondContact O-CG 3.4Å; P889-F891 HydrophobicContact CB-CD2 4.3Å; P889-F891 WeakPolarHBondContact O-CD2 3.44Å; P889-F891 VanDerWaalsContact O-CE2 3.26Å; P889-F891 WeakPolarHBondContact O-CE2 3.28Å; P889-L934 HydrophobicContact CB-CD1 4.26Å
890	G	91.9	Very high	86.4	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	83.6	10.1	173.4	0	0	0	0	0	115.5	D888 P910 I911	D888-G890 PolarHBondContact O-N 3.29Å; D888-G890 PolarHBondContact OD1-N 2.91Å; G890-P910 CarbonylContact O-C 3.54Å; G890-P910 WeakPolarHBondContact O-CA 3.43Å; G890-I911 WeakPolarHBondContact O-CG1 3.48Å; G890-I911 PolarHBondContact O-N 3.04Å
891	F	91.7	Very high	86	Confident	5 Å²	5	29.9 Å²	29.9	2%	0.022	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	159.8	-177.3	-63.1	-70.3	0	0	0	114.5	L504 A507 A508 Y788 T813 P889 V908 T909 R919	L504-F891 HydrophobicContact CB-CE1 4.28Å; L504-F891 HydrophobicContact CB-CZ 4.36Å; L504-F891 HydrophobicContact CD2-CE1 4.46Å; L504-F891 HydrophobicContact CD2-CZ 3.95Å; L504-F891 VanDerWaalsContact O-CE1 3.28Å; L504-F891 WeakPolarHBondContact O-CE1 3.24Å; L504-F891 WeakPolarHBondContact O-CZ 3.4Å; A507-F891 HydrophobicContact CB-CZ 4.07Å; A508-F891 HydrophobicContact CB-CD1 4.21Å; A508-F891 HydrophobicContact CB-CE1 3.89Å; Y788-F891 AromaticContact CD1-CD2 3.46Å; Y788-F891 HydrophobicContact CD1-CD2 3.46Å; Y788-F891 VanDerWaalsContact CD1-CD2 3.46Å; Y788-F891 AromaticContact CD1-CE2 3.37Å; Y788-F891 HydrophobicContact CD1-CE2 3.37Å; Y788-F891 HydrophobicContact CD1-CG 4.48Å; Y788-F891 HydrophobicContact CD1-CZ 4.35Å; Y788-F891 HydrophobicContact CD2-CD2 4.1Å; Y788-F891 AromaticContact CE1-CD2 3.53Å; Y788-F891 HydrophobicContact CE1-CD2 3.53Å; Y788-F891 AromaticContact CE1-CE2 3.8Å; Y788-F891 HydrophobicContact CE1-CE2 3.8Å; Y788-F891 HydrophobicContact CE1-CG 4.15Å; Y788-F891 HydrophobicContact CE2-CD2 4.19Å; Y788-F891 AromaticContact CG-CD2 3.74Å; Y788-F891 HydrophobicContact CG-CD2 3.74Å; Y788-F891 AromaticContact CG-CE2 3.84Å; Y788-F891 HydrophobicContact CG-CE2 3.84Å; Y788-F891 AromaticContact CZ-CD2 3.9Å; T813-F891 HydrophobicContact CG2-CB 3.58Å; P889-F891 HydrophobicContact CB-CD2 4.3Å; P889-F891 WeakPolarHBondContact O-CD2 3.44Å; P889-F891 VanDerWaalsContact O-CE2 3.26Å; P889-F891 WeakPolarHBondContact O-CE2 3.28Å; F891-V908 HydrophobicContact CB-CG1 4.27Å; F891-V908 HydrophobicContact CD1-CG1 4.19Å; F891-V908 HydrophobicContact CG-CG1 4.42Å; F891-T909 WeakPolarHBondContact CA-O 3.46Å; F891-R919 PolarHBondContact O-NH1 2.86Å; F891-R919 PolarHBondContact O-NH2 2.62Å
892	V	90.3	Very high	85.8	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.03	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	144.1	174.4	59.4	0	0	0	0	110.4	N872 Q894 T909 I911	N872-V892 HydrophobicContact CB-CG2 4.35Å; V892-Q894 HydrophobicContact CG1-CG 3.89Å; V892-Q894 HydrophobicContact CG2-CG 4.18Å; V892-T909 PolarHBondContact N-O 3.34Å; V892-T909 PolarHBondContact O-N 3.21Å; V892-T909 VanDerWaalsContact O-O 3.14Å; V892-T909 PolarHBondContact O-OG1 3.19Å; V892-I911 HydrophobicContact CB-CG2 3.93Å; V892-I911 HydrophobicContact CG1-CG2 3.68Å
893	K	87.4	Confident	85.5	Confident	79 Å²	79	27.4 Å²	27.4	34%	0.343	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	124.2	168.4	-84.1	168.6	178.9	161.2	0	109.8	T813 E817 V907 V908	T813-K893 VanDerWaalsContact OG1-CD 3.32Å; T813-K893 WeakPolarHBondContact OG1-CD 3.37Å; T813-K893 WeakPolarHBondContact OG1-CE 3.28Å; T813-K893 PolarHBondContact OG1-NZ 3.12Å; E817-K893 IonicContact OE1-NZ 3.55Å; E817-K893 PolarHBondContact OE1-NZ 3.37Å; K893-V907 WeakPolarHBondContact CA-O 3.47Å; K893-V908 HydrophobicContact CD-CG2 4.31Å; K893-V908 VanDerWaalsContact CE-CG2 3.4Å; K893-V908 HydrophobicContact CG-CG2 3.83Å
894	Q	83.7	Confident	85	Confident	22 Å²	22	29.6 Å²	29.6	10%	0.103	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.9	-177.4	-69.1	-178	-19.3	0	0	110.6	V892 L906 V907 T909 N948 R954	V892-Q894 HydrophobicContact CG1-CG 3.89Å; V892-Q894 HydrophobicContact CG2-CG 4.18Å; Q894-L906 WeakPolarHBondContact O-CA 3.43Å; Q894-V907 PolarHBondContact N-O 2.98Å; Q894-V907 PolarHBondContact O-N 3.4Å; Q894-T909 WeakPolarHBondContact CG-OG1 3.15Å; Q894-T909 PolarHBondContact OE1-OG1 2.93Å; Q894-N948 PolarHBondContact NE2-OD1 3.1Å; Q894-R954 VanDerWaalsContact CD-NH1 3.31Å
895	K	83	Confident	84.4	Confident	101 Å²	101	28.2 Å²	28.2	44%	0.439	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133	173.8	-165.1	-177.8	-179.4	-161.8	0	109	D904 Q905 L906	K895-D904 VanDerWaalsContact CE-CB 3.41Å; K895-D904 WeakPolarHBondContact CE-OD1 3.16Å; K895-D904 WeakPolarHBondContact CE-OD2 3.17Å; K895-D904 IonicContact NZ-OD1 3.93Å; K895-D904 PolarHBondContact NZ-OD1 3.13Å; K895-D904 IonicContact NZ-OD2 2.69Å; K895-D904 PolarHBondContact NZ-OD2 2.69Å; K895-Q905 CarbonylContact C-O 3.54Å; K895-Q905 WeakPolarHBondContact CA-O 3.24Å; K895-L906 HydrophobicContact CB-CD2 4.06Å; K895-L906 HydrophobicContact CG-CD2 4.4Å
896	V	84.4	Confident	83.8	Confident	29 Å²	29	33.6 Å²	33.6	18%	0.176	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	113.1	-176.3	-177.2	0	0	0	0	108.8	I496 Q905 V907	I496-V896 HydrophobicContact CD1-CB 4.12Å; I496-V896 HydrophobicContact CD1-CG1 3.54Å; I496-V896 HydrophobicContact CD1-CG2 3.51Å; V896-Q905 PolarHBondContact N-O 2.66Å; V896-Q905 PolarHBondContact O-N 3.48Å; V896-V907 HydrophobicContact CB-CG2 4.46Å; V896-V907 HydrophobicContact CG2-CB 4.33Å; V896-V907 HydrophobicContact CG2-CG2 4.2Å
897	Y	83.2	Confident	83.2	Confident	22 Å²	22	36.3 Å²	36.3	9%	0.086	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	127.7	172.1	-179.4	-111.5	0	0	0	110.6	G902 D904 R954 N956 T985	Y897-G902 WeakPolarHBondContact CE2-O 3.44Å; Y897-D904 WeakPolarHBondContact CB-OD1 3.25Å; Y897-D904 WeakPolarHBondContact CD2-OD1 3.3Å; Y897-R954 WeakPolarHBondContact CB-O 3.42Å; Y897-R954 PolarHBondContact N-O 3.04Å; Y897-N956 HydrophobicContact CD1-CB 4.2Å; Y897-N956 HydrophobicContact CD2-CB 3.87Å; Y897-N956 HydrophobicContact CE1-CB 4.13Å; Y897-N956 HydrophobicContact CE2-CB 3.81Å; Y897-N956 HydrophobicContact CG-CB 4.06Å; Y897-T985 HydrophobicContact CD1-CG2 4.07Å; Y897-T985 HydrophobicContact CE1-CG2 4.2Å
898	N	79.7	Confident	82.8	Confident	49 Å²	49	37.4 Å²	37.4	26%	0.262	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	105.9	170.2	-177.2	-1.1	0	0	0	110.2	K900 T901 G902 I903	N898-K900 PolarHBondContact O-N 3.49Å; N898-K900 PolarHBondContact OD1-N 3.33Å; N898-K900 VanDerWaalsContact OD1-N 3.12Å; N898-T901 PolarHBondContact ND2-OG1 3.3Å; N898-T901 PolarHBondContact O-N 3.17Å; N898-G902 WeakPolarHBondContact O-CA 3.5Å; N898-G902 PolarHBondContact O-N 2.94Å; N898-I903 PolarHBondContact N-O 3.4Å
899	S	73.2	Confident	82.5	Confident	11 Å²	11	37.7 Å²	37.7	8%	0.077	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.4	-178.9	-52.4	0	0	0	0	114	T985	S899-T985 WeakPolarHBondContact OG-CA 3.35Å; S899-T985 PolarHBondContact OG-OG1 3.35Å
900	K	72.1	Confident	82.4	Confident	81 Å²	81	38.6 Å²	38.6	35%	0.352	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-24.8	-179.4	-62.9	-168	-177.7	-179.7	0	113.8	M489 M491 N898 E984	M489-K900 PolarHBondContact O-NZ 3.49Å; M491-K900 PolarHBondContact O-NZ 2.53Å; N898-K900 PolarHBondContact O-N 3.49Å; N898-K900 PolarHBondContact OD1-N 3.33Å; N898-K900 VanDerWaalsContact OD1-N 3.12Å; K900-E984 WeakPolarHBondContact CE-OE1 3.33Å; K900-E984 WeakPolarHBondContact CG-OE1 3.42Å; K900-E984 IonicContact NZ-OE1 2.65Å
901	T	71.4	Confident	82.4	Confident	31 Å²	31	38.6 Å²	38.6	19%	0.19	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-5.4	-179.8	67.4	0	0	0	0	113.1	N898 I903	N898-T901 PolarHBondContact ND2-OG1 3.3Å; N898-T901 PolarHBondContact O-N 3.17Å; T901-I903 WeakPolarHBondContact O-CG1 3.41Å; T901-I903 PolarHBondContact O-N 3.49Å; T901-I903 VanDerWaalsContact O-N 3.11Å; T901-I903 WeakPolarHBondContact OG1-CG1 3.27Å; T901-I903 PolarHBondContact OG1-N 3.09Å
902	G	72.2	Confident	82.3	Confident	39 Å²	39	38.5 Å²	38.5	40%	0.402	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	6.6	-174.1	0	0	0	0	0	115.1	Y897 N898	Y897-G902 WeakPolarHBondContact CE2-O 3.44Å; N898-G902 WeakPolarHBondContact O-CA 3.5Å; N898-G902 PolarHBondContact O-N 2.94Å
903	I	76.5	Confident	82.2	Confident	6 Å²	6	40.3 Å²	40.3	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.5	-174.1	-52.1	177.9	0	0	0	111	N898 T901 Q905 L1186	N898-I903 PolarHBondContact N-O 3.4Å; T901-I903 WeakPolarHBondContact O-CG1 3.41Å; T901-I903 PolarHBondContact O-N 3.49Å; T901-I903 VanDerWaalsContact O-N 3.11Å; T901-I903 WeakPolarHBondContact OG1-CG1 3.27Å; T901-I903 PolarHBondContact OG1-N 3.09Å; I903-Q905 HydrophobicContact CB-CG 4.35Å; I903-Q905 HydrophobicContact CG2-CG 3.71Å; I903-L1186 HydrophobicContact CD1-CD2 3.77Å; I903-L1186 HydrophobicContact CG1-CD2 3.98Å
904	D	80	Confident	82.1	Confident	48 Å²	48	38 Å²	38	26%	0.257	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115.3	163.7	-87.1	-44.3	0	0	0	110.6	K895 Y897	K895-D904 VanDerWaalsContact CE-CB 3.41Å; K895-D904 WeakPolarHBondContact CE-OD1 3.16Å; K895-D904 WeakPolarHBondContact CE-OD2 3.17Å; K895-D904 IonicContact NZ-OD1 3.93Å; K895-D904 PolarHBondContact NZ-OD1 3.13Å; K895-D904 IonicContact NZ-OD2 2.69Å; K895-D904 PolarHBondContact NZ-OD2 2.69Å; Y897-D904 WeakPolarHBondContact CB-OD1 3.25Å; Y897-D904 WeakPolarHBondContact CD2-OD1 3.3Å
905	Q	79.6	Confident	82.3	Confident	48 Å²	48	37.5 Å²	37.5	22%	0.224	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.9	-177.7	-57.4	-174.5	-0.9	0	0	111.3	K895 V896 I903 V907 L1188	K895-Q905 CarbonylContact C-O 3.54Å; K895-Q905 WeakPolarHBondContact CA-O 3.24Å; V896-Q905 PolarHBondContact N-O 2.66Å; V896-Q905 PolarHBondContact O-N 3.48Å; I903-Q905 HydrophobicContact CB-CG 4.35Å; I903-Q905 HydrophobicContact CG2-CG 3.71Å; Q905-V907 HydrophobicContact CB-CG2 4.1Å; Q905-L1188 HydrophobicContact CG-CB 4.25Å; Q905-L1188 HydrophobicContact CG-CD2 4.13Å
906	L	81.9	Confident	82.6	Confident	128 Å²	128	32.7 Å²	32.7	67%	0.67	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108	98.5	174.2	-77.5	169.7	0	0	0	109.6	Q894 K895	Q894-L906 WeakPolarHBondContact O-CA 3.43Å; K895-L906 HydrophobicContact CB-CD2 4.06Å; K895-L906 HydrophobicContact CG-CD2 4.4Å
907	V	83.3	Confident	82.8	Confident	58 Å²	58	37.5 Å²	37.5	35%	0.352	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	141.2	-170.6	-174.7	0	0	0	0	110.4	K893 Q894 V896 Q905 T909	K893-V907 WeakPolarHBondContact CA-O 3.47Å; Q894-V907 PolarHBondContact N-O 2.98Å; Q894-V907 PolarHBondContact O-N 3.4Å; V896-V907 HydrophobicContact CB-CG2 4.46Å; V896-V907 HydrophobicContact CG2-CB 4.33Å; V896-V907 HydrophobicContact CG2-CG2 4.2Å; Q905-V907 HydrophobicContact CB-CG2 4.1Å; V907-T909 HydrophobicContact CB-CG2 4.5Å; V907-T909 HydrophobicContact CG1-CG2 4.27Å
908	V	86.8	Confident	82.9	Confident	22 Å²	22	37.8 Å²	37.8	13%	0.133	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	125.5	168.6	-177.4	0	0	0	0	108.5	A508 T813 F891 K893	A508-V908 HydrophobicContact CB-CB 4.31Å; A508-V908 HydrophobicContact CB-CG1 3.9Å; T813-V908 HydrophobicContact CG2-CG1 4.41Å; F891-V908 HydrophobicContact CB-CG1 4.27Å; F891-V908 HydrophobicContact CD1-CG1 4.19Å; F891-V908 HydrophobicContact CG-CG1 4.42Å; K893-V908 HydrophobicContact CD-CG2 4.31Å; K893-V908 VanDerWaalsContact CE-CG2 3.4Å; K893-V908 HydrophobicContact CG-CG2 3.83Å
909	T	87	Confident	83.4	Confident	6 Å²	6	35.6 Å²	35.6	4%	0.037	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.6	-175.1	50.3	0	0	0	0	110.3	I496 F891 V892 Q894 V907	I496-T909 HydrophobicContact CG2-CG2 4.07Å; F891-T909 WeakPolarHBondContact CA-O 3.46Å; V892-T909 PolarHBondContact N-O 3.34Å; V892-T909 PolarHBondContact O-N 3.21Å; V892-T909 VanDerWaalsContact O-O 3.14Å; V892-T909 PolarHBondContact O-OG1 3.19Å; Q894-T909 WeakPolarHBondContact CG-OG1 3.15Å; Q894-T909 PolarHBondContact OE1-OG1 2.93Å; V907-T909 HydrophobicContact CB-CG2 4.5Å; V907-T909 HydrophobicContact CG1-CG2 4.27Å
910	P	91.1	Very high	84.1	Confident	20 Å²	20	35.4 Å²	35.4	13%	0.13	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	147.1	167.3	28.5	-33.6	0	0	0	110.5	V497 L504 G890	V497-P910 HydrophobicContact CG1-CG 4.21Å; V497-P910 HydrophobicContact CG2-CG 4.41Å; L504-P910 HydrophobicContact CB-CB 4.14Å; L504-P910 HydrophobicContact CD1-CB 4.09Å; G890-P910 CarbonylContact O-C 3.54Å; G890-P910 WeakPolarHBondContact O-CA 3.43Å
911	I	91.8	Very high	84.8	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-74	162.2	176.4	65.7	-175.6	0	0	0	112.5	D888 G890 V892 Q915 A916 M944	D888-I911 WeakPolarHBondContact OD2-CD1 3.37Å; G890-I911 WeakPolarHBondContact O-CG1 3.48Å; G890-I911 PolarHBondContact O-N 3.04Å; V892-I911 HydrophobicContact CB-CG2 3.93Å; V892-I911 HydrophobicContact CG1-CG2 3.68Å; I911-Q915 HydrophobicContact CB-CB 4.2Å; I911-A916 HydrophobicContact CD1-CB 3.63Å; I911-A916 HydrophobicContact CG1-CB 4.19Å; I911-M944 HydrophobicContact CG1-CE 4.04Å; I911-M944 HydrophobicContact CG1-SD 4.19Å; I911-M944 WeakPolarHBondContact O-CG 3.42Å
912	S	89.9	Confident	85.5	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.021	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-80.1	155.5	165.8	61.3	0	0	0	0	112.5	A914 Q915 A916 L945 N948	S912-A914 PolarHBondContact O-N 3.47Å; S912-Q915 VanDerWaalsContact N-OE1 3.11Å; S912-Q915 WeakPolarHBondContact O-CB 3.49Å; S912-Q915 PolarHBondContact O-N 3.28Å; S912-Q915 WeakPolarHBondContact OG-CG 3.46Å; S912-Q915 PolarHBondContact OG-OE1 2.75Å; S912-A916 PolarHBondContact O-N 2.88Å; S912-L945 CarbonylContact C-O 3.51Å; S912-L945 WeakPolarHBondContact CA-O 3.3Å; S912-L945 WeakPolarHBondContact CB-O 3.41Å; S912-N948 PolarHBondContact OG-N 2.89Å
913	Q	88.9	Confident	86.2	Confident	42 Å²	42	29.8 Å²	29.8	20%	0.196	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-36.9	175.3	-64.7	171.8	-3.1	0	0	111.9	A916 K917 Y940 R941 M944 L945	Q913-A916 PolarHBondContact O-N 2.87Å; Q913-K917 WeakPolarHBondContact O-CB 3.29Å; Q913-K917 PolarHBondContact O-N 2.63Å; Q913-Y940 HydrophobicContact CB-CE2 3.94Å; Q913-Y940 HydrophobicContact CG-CD2 4.23Å; Q913-Y940 HydrophobicContact CG-CE2 3.8Å; Q913-Y940 WeakPolarHBondContact CG-O 3.08Å; Q913-Y940 PolarHBondContact NE2-O 2.67Å; Q913-R941 PolarHBondContact NE2-O 2.76Å; Q913-M944 HydrophobicContact CG-CB 4.1Å; Q913-L945 PolarHBondContact N-O 2.68Å
914	A	85.3	Confident	86.5	Confident	30 Å²	30	29.5 Å²	29.5	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-57	-47.5	173.1	0	0	0	0	0	112.4	S912 K917 Q918 T946	S912-A914 PolarHBondContact O-N 3.47Å; A914-K917 PolarHBondContact O-N 2.92Å; A914-Q918 WeakPolarHBondContact O-CG 3.45Å; A914-Q918 PolarHBondContact O-N 3.46Å; A914-Q918 VanDerWaalsContact O-N 3.08Å; A914-T946 PolarHBondContact N-O 2.76Å; A914-T946 VanDerWaalsContact N-O 3.09Å
915	Q	86.9	Confident	86.5	Confident	13 Å²	13	29.5 Å²	29.5	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-68.2	-43.4	177.2	-66.2	170.1	-86.7	0	0	111.5	E875 I911 S912 K917 Q918 R919	E875-Q915 VanDerWaalsContact OE1-CG 3.28Å; E875-Q915 WeakPolarHBondContact OE1-CG 3.36Å; E875-Q915 PolarHBondContact OE1-NE2 3.3Å; I911-Q915 HydrophobicContact CB-CB 4.2Å; S912-Q915 VanDerWaalsContact N-OE1 3.11Å; S912-Q915 WeakPolarHBondContact O-CB 3.49Å; S912-Q915 PolarHBondContact O-N 3.28Å; S912-Q915 WeakPolarHBondContact OG-CG 3.46Å; S912-Q915 PolarHBondContact OG-OE1 2.75Å; Q915-K917 PolarHBondContact O-N 2.95Å; Q915-Q918 CarbonylContact O-C 3.6Å; Q915-Q918 WeakPolarHBondContact O-CA 3.35Å; Q915-Q918 WeakPolarHBondContact O-CB 3.28Å; Q915-Q918 PolarHBondContact O-N 2.93Å; Q915-R919 WeakPolarHBondContact O-CG 3.45Å; Q915-R919 PolarHBondContact O-N 3.31Å
916	A	90.1	Very high	86.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.1	-33.1	174.8	0	0	0	0	0	112.3	I911 S912 Q913 A920 R933 Y940	I911-A916 HydrophobicContact CD1-CB 3.63Å; I911-A916 HydrophobicContact CG1-CB 4.19Å; S912-A916 PolarHBondContact O-N 2.88Å; Q913-A916 PolarHBondContact O-N 2.87Å; A916-A920 WeakPolarHBondContact O-CB 3.26Å; A916-A920 PolarHBondContact O-N 2.97Å; A916-R933 PolarHBondContact O-NH2 3.07Å; A916-Y940 HydrophobicContact CB-CD2 4.39Å; A916-Y940 HydrophobicContact CB-CE2 3.86Å
917	K	86.8	Confident	86.4	Confident	130 Å²	130	23.8 Å²	23.8	57%	0.565	13%	0.133	S	C	*	.	H	α-helix	trans	-73	-38.4	172.3	-173.6	169.7	-179.3	172.3	0	112.3	Q913 A914 Q915 G921	Q913-K917 WeakPolarHBondContact O-CB 3.29Å; Q913-K917 PolarHBondContact O-N 2.63Å; A914-K917 PolarHBondContact O-N 2.92Å; Q915-K917 PolarHBondContact O-N 2.95Å; K917-G921 PolarHBondContact O-N 2.91Å
918	Q	85.8	Confident	86.7	Confident	27 Å²	27	25.1 Å²	25.1	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-67.4	-35.5	174.7	-71	-175.5	-26.4	0	0	113.6	H720 A914 Q915 R922	H720-Q918 PolarHBondContact CD2-NE2 3.47Å; H720-Q918 PolarHBondContact NE2-NE2 3.29Å; A914-Q918 WeakPolarHBondContact O-CG 3.45Å; A914-Q918 PolarHBondContact O-N 3.46Å; A914-Q918 VanDerWaalsContact O-N 3.08Å; Q915-Q918 CarbonylContact O-C 3.6Å; Q915-Q918 WeakPolarHBondContact O-CA 3.35Å; Q915-Q918 WeakPolarHBondContact O-CB 3.28Å; Q915-Q918 PolarHBondContact O-N 2.93Å; Q918-R922 PolarHBondContact O-NE 3.31Å
919	R	89.9	Confident	86.9	Confident	3 Å²	3	24.5 Å²	24.5	1%	0.011	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-53.4	171.9	-69	-174.9	179.6	-170.7	-1.7	111	F811 E875 D888 F891 Q915 G921 R922	F811-R919 HydrophobicContact CD1-CG 4.25Å; F811-R919 HydrophobicContact CD2-CB 4.1Å; F811-R919 HydrophobicContact CD2-CG 3.95Å; F811-R919 HydrophobicContact CE1-CG 3.98Å; F811-R919 HydrophobicContact CE2-CB 3.64Å; F811-R919 HydrophobicContact CE2-CG 3.66Å; F811-R919 HydrophobicContact CG-CG 4.23Å; F811-R919 HydrophobicContact CZ-CB 4.02Å; F811-R919 HydrophobicContact CZ-CG 3.68Å; E875-R919 HydrophobicContact CG-CG 4Å; E875-R919 IonicContact OE2-CZ 3.79Å; E875-R919 VanDerWaalsContact OE2-CZ 3.23Å; E875-R919 IonicContact OE2-NE 2.76Å; E875-R919 PolarHBondContact OE2-NE 2.88Å; E875-R919 IonicContact OE2-NH2 2.68Å; E875-R919 PolarHBondContact OE2-NH2 2.62Å; D888-R919 WeakPolarHBondContact OD1-CD 3.46Å; D888-R919 IonicContact OD1-CZ 2.74Å; D888-R919 IonicContact OD1-NE 3.33Å; D888-R919 IonicContact OD1-NH1 2.73Å; D888-R919 PolarHBondContact OD1-NH1 3.49Å; F891-R919 PolarHBondContact O-NH1 2.86Å; F891-R919 PolarHBondContact O-NH2 2.62Å; Q915-R919 WeakPolarHBondContact O-CG 3.45Å; Q915-R919 PolarHBondContact O-N 3.31Å; R919-G921 VanDerWaalsContact C-N 3.28Å; R919-G921 PolarHBondContact O-N 2.91Å; R919-R922 VanDerWaalsContact O-CB 3.29Å; R919-R922 WeakPolarHBondContact O-CB 3.23Å; R919-R922 VanDerWaalsContact O-CG 3.3Å; R919-R922 WeakPolarHBondContact O-CG 3.44Å; R919-R922 PolarHBondContact O-N 3.11Å
920	A	89.1	Confident	87.3	Confident	8 Å²	8	26.6 Å²	26.6	7%	0.066	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-41.5	175.4	0	0	0	0	0	112.3	A916 R922 A923 C931	A916-A920 WeakPolarHBondContact O-CB 3.26Å; A916-A920 PolarHBondContact O-N 2.97Å; A920-R922 PolarHBondContact O-N 3.03Å; A920-A923 PolarHBondContact O-N 3.15Å; A920-A923 VanDerWaalsContact O-N 3.14Å; A920-C931 HydrophobicContact CB-CB 3.94Å
921	G	85.7	Confident	87.5	Confident	25 Å²	25	25.6 Å²	25.6	26%	0.258	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-5.2	176	0	0	0	0	0	115.7	K917 R919	K917-G921 PolarHBondContact O-N 2.91Å; R919-G921 VanDerWaalsContact C-N 3.28Å; R919-G921 PolarHBondContact O-N 2.91Å
922	R	86.5	Confident	87.6	Confident	8 Å²	8	27 Å²	27	3%	0.03	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-34.2	170.9	-60	-66.6	133.5	163.1	-16	112.5	L809 F811 A874 E875 T876 L878 V886 Q918 R919 A920 R925	L809-R922 HydrophobicContact CD2-CB 3.91Å; L809-R922 HydrophobicContact CD2-CG 3.93Å; F811-R922 HydrophobicContact CZ-CG 4.19Å; A874-R922 VanDerWaalsContact O-CD 3.29Å; A874-R922 WeakPolarHBondContact O-CD 3.32Å; A874-R922 PolarHBondContact O-NE 2.92Å; A874-R922 PolarHBondContact O-NH1 3.02Å; E875-R922 VanDerWaalsContact C-CZ 3.43Å; E875-R922 PolarHBondContact O-NE 3.43Å; E875-R922 PolarHBondContact O-NH2 2.97Å; T876-R922 VanDerWaalsContact C-NH1 3.34Å; T876-R922 VanDerWaalsContact O-CZ 3.32Å; T876-R922 PolarHBondContact O-NH1 3.5Å; T876-R922 PolarHBondContact O-NH2 3.5Å; L878-R922 PolarHBondContact O-NH1 2.86Å; V886-R922 HydrophobicContact CG2-CB 4Å; Q918-R922 PolarHBondContact O-NE 3.31Å; R919-R922 VanDerWaalsContact O-CB 3.29Å; R919-R922 WeakPolarHBondContact O-CB 3.23Å; R919-R922 VanDerWaalsContact O-CG 3.3Å; R919-R922 WeakPolarHBondContact O-CG 3.44Å; R919-R922 PolarHBondContact O-N 3.11Å; A920-R922 PolarHBondContact O-N 3.03Å; R922-R925 VanDerWaalsContact CZ-CZ 3.48Å; R922-R925 VanDerWaalsContact NH1-NH1 3.17Å; R922-R925 VanDerWaalsContact NH1-NH2 3.12Å; R922-R925 VanDerWaalsContact NH2-NH2 3.15Å
923	A	87.2	Confident	87.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-69.5	-39.9	179.2	0	0	0	0	0	112.5	V776 V886 A920 R925	V776-A923 HydrophobicContact CG1-CB 4.08Å; V776-A923 HydrophobicContact CG2-CB 4.07Å; V886-A923 HydrophobicContact CG2-CB 3.92Å; A920-A923 PolarHBondContact O-N 3.15Å; A920-A923 VanDerWaalsContact O-N 3.14Å; A923-R925 PolarHBondContact O-N 3.2Å
924	G	82.5	Confident	88	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-75.3	11.8	-173.7	0	0	0	0	0	115.8	T773 Y774 V776	T773-G924 CarbonylContact C-O 3.51Å; T773-G924 VanDerWaalsContact CA-O 3.25Å; T773-G924 WeakPolarHBondContact CA-O 3.45Å; Y774-G924 PolarHBondContact N-O 3.48Å; V776-G924 VanDerWaalsContact CG2-CA 3.41Å; V776-G924 VanDerWaalsContact CG2-N 3.27Å
925	R	79.6	Confident	88.4	Confident	47 Å²	47	24.6 Å²	24.6	18%	0.177	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-84.7	-39.7	-170.7	-80	174.3	162.1	-177	-10.2	114.5	T622 L878 R922 A923	T622-R925 VanDerWaalsContact CB-NH2 3.32Å; T622-R925 PolarHBondContact OG1-NE 3.37Å; T622-R925 PolarHBondContact OG1-NH2 2.97Å; L878-R925 PolarHBondContact O-NH1 3.49Å; R922-R925 VanDerWaalsContact CZ-CZ 3.48Å; R922-R925 VanDerWaalsContact NH1-NH1 3.17Å; R922-R925 VanDerWaalsContact NH1-NH2 3.12Å; R922-R925 VanDerWaalsContact NH2-NH2 3.15Å; A923-R925 PolarHBondContact O-N 3.2Å
926	T	77.3	Confident	88.7	Confident	53 Å²	53	25 Å²	25	33%	0.325	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-21.7	-178.4	35.1	0	0	0	0	113.7	I883	I883-T926 PolarHBondContact O-OG1 3.17Å
927	G	83.8	Confident	88.7	Confident	4 Å²	4	29.1 Å²	29.1	4%	0.041	15%	0.154	C	C	.	.	S	Bend	trans	-175	179.6	179.3	0	0	0	0	0	110.7	Y774	Y774-G927 WeakPolarHBondContact CB-O 3.35Å; Y774-G927 VanDerWaalsContact CD2-CA 3.49Å
928	P	89.1	Confident	88.9	Confident	85 Å²	85	32.6 Å²	32.6	55%	0.552	16%	0.163	S	C	*	.	S	Bend	trans	-66.1	134.1	176.5	28.8	-34.3	0	0	0	110.2	P775 Y884	P775-P928 HydrophobicContact CG-CB 4.45Å; P775-P928 WeakPolarHBondContact O-CA 3.42Å; Y884-P928 WeakPolarHBondContact CD1-O 3.49Å
929	G	91.1	Very high	89	Confident	9 Å²	9	31.3 Å²	31.3	9%	0.093	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	-179.3	-169.9	0	0	0	0	0	114.4	P775 V776 E777 Y884	P775-G929 PolarHBondContact O-N 3.02Å; V776-G929 CarbonylContact C-O 3.49Å; V776-G929 VanDerWaalsContact CA-O 3.3Å; V776-G929 WeakPolarHBondContact CA-O 3.5Å; E777-G929 PolarHBondContact N-O 2.89Å; Y884-G929 CarbonylContact O-C 3.44Å; Y884-G929 WeakPolarHBondContact O-CA 3.45Å
930	K	94.3	Very high	89.1	Confident	50 Å²	50	33.1 Å²	33.1	22%	0.217	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.3	180	-66.2	-177.9	172.6	166.4	0	111.6	E777 E803 Y884 Y885 V886 Y932	E777-K930 HydrophobicContact CB-CG 4.26Å; E777-K930 CarbonylContact O-C 3.55Å; E777-K930 WeakPolarHBondContact O-CA 3.49Å; E777-K930 WeakPolarHBondContact OE2-CE 3.4Å; E803-K930 IonicContact OE1-NZ 3.58Å; E803-K930 PolarHBondContact OE1-NZ 2.92Å; E803-K930 IonicContact OE2-NZ 2.71Å; E803-K930 PolarHBondContact OE2-NZ 3.06Å; Y884-K930 PolarHBondContact O-N 2.65Å; Y885-K930 WeakPolarHBondContact CA-O 3.43Å; Y885-K930 HydrophobicContact CD1-CB 4.12Å; Y885-K930 HydrophobicContact CE1-CB 4.44Å; Y885-K930 HydrophobicContact CE1-CD 4.26Å; V886-K930 PolarHBondContact N-O 2.96Å; K930-Y932 HydrophobicContact CB-CD2 4.42Å; K930-Y932 HydrophobicContact CB-CE2 3.67Å; K930-Y932 HydrophobicContact CD-CE2 4.4Å; K930-Y932 WeakPolarHBondContact CD-OH 3.28Å
931	C	95.3	Very high	89.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	115.4	174	-179.2	0	0	0	0	110.1	V776 E777 V778 L779 V886 A920	V776-C931 HydrophobicContact CG1-CB 3.84Å; E777-C931 PolarHBondContact O-N 3.02Å; V778-C931 HydrophobicContact CG2-CB 4.5Å; L779-C931 PolarHBondContact N-O 3.5Å; V886-C931 HydrophobicContact CB-CB 4.36Å; V886-C931 CarbonylContact O-C 3.54Å; V886-C931 WeakPolarHBondContact O-CA 3.27Å; A920-C931 HydrophobicContact CB-CB 3.94Å
932	Y	95	Very high	89.1	Confident	30 Å²	30	42.9 Å²	42.9	12%	0.118	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.1	178.3	-58.4	-105.2	0	0	0	108.4	L779 T795 I799 E803 Y885 V886 D888 K930	L779-Y932 HydrophobicContact CB-CD1 4.41Å; L779-Y932 HydrophobicContact CD1-CD1 3.77Å; L779-Y932 HydrophobicContact CD1-CE1 3.44Å; L779-Y932 VanDerWaalsContact CD1-CE1 3.44Å; L779-Y932 HydrophobicContact CD1-CG 4.44Å; T795-Y932 HydrophobicContact CG2-CD1 4.16Å; T795-Y932 HydrophobicContact CG2-CG 4.05Å; I799-Y932 HydrophobicContact CD1-CD2 3.55Å; I799-Y932 HydrophobicContact CD1-CE1 4.44Å; I799-Y932 HydrophobicContact CD1-CE2 3.46Å; I799-Y932 VanDerWaalsContact CD1-CE2 3.46Å; I799-Y932 HydrophobicContact CD1-CG 4.13Å; I799-Y932 HydrophobicContact CG1-CD2 4.34Å; I799-Y932 HydrophobicContact CG1-CE1 4.32Å; I799-Y932 HydrophobicContact CG1-CE2 3.81Å; E803-Y932 PolarHBondContact OE1-OH 3.03Å; Y885-Y932 HydrophobicContact CD1-CE2 4.17Å; V886-Y932 PolarHBondContact O-N 3.34Å; D888-Y932 PolarHBondContact N-O 2.85Å; K930-Y932 HydrophobicContact CB-CD2 4.42Å; K930-Y932 HydrophobicContact CB-CE2 3.67Å; K930-Y932 HydrophobicContact CD-CE2 4.4Å; K930-Y932 WeakPolarHBondContact CD-OH 3.28Å
933	R	94.8	Very high	89.2	Confident	9 Å²	9	44 Å²	44	3%	0.034	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.3	179.2	-67.6	176.1	166.4	-169.3	-11.3	109.3	V778 L779 Y780 T781 D888 A916 Y935	V778-R933 HydrophobicContact CG1-CG 4.34Å; L779-R933 WeakPolarHBondContact O-CB 3.42Å; L779-R933 PolarHBondContact O-N 3.12Å; Y780-R933 WeakPolarHBondContact CA-O 3.35Å; Y780-R933 HydrophobicContact CD1-CB 4.01Å; Y780-R933 HydrophobicContact CE1-CB 4.49Å; Y780-R933 VanDerWaalsContact CE1-CD 3.48Å; Y780-R933 PolarHBondContact OH-NH1 3.27Å; T781-R933 PolarHBondContact N-O 3.17Å; T781-R933 VanDerWaalsContact N-O 3.11Å; D888-R933 WeakPolarHBondContact O-CA 3.39Å; A916-R933 PolarHBondContact O-NH2 3.07Å; R933-Y935 HydrophobicContact CB-CD1 4.18Å; R933-Y935 HydrophobicContact CB-CD2 4.22Å; R933-Y935 HydrophobicContact CB-CE1 3.8Å; R933-Y935 HydrophobicContact CB-CE2 3.86Å; R933-Y935 HydrophobicContact CB-CG 4.39Å; R933-Y935 WeakPolarHBondContact CD-OH 3.29Å; R933-Y935 HydrophobicContact CG-CE1 4.11Å; R933-Y935 HydrophobicContact CG-CE2 4.1Å; R933-Y935 WeakPolarHBondContact CG-OH 3.48Å; R933-Y935 PolarHBondContact NE-OH 2.86Å; R933-Y935 PolarHBondContact O-N 2.81Å
934	L	92.9	Very high	89.2	Confident	12 Å²	12	44 Å²	44	6%	0.063	21%	0.205	C	C	.	.	S	Bend	trans	-84.3	35.7	-176.3	-46.6	-179.3	0	0	0	112.5	T781 A791 S792 V887 D888 P889	T781-L934 HydrophobicContact CG2-CB 4.5Å; T781-L934 HydrophobicContact CG2-CD2 4.35Å; A791-L934 HydrophobicContact CB-CD1 4.07Å; S792-L934 VanDerWaalsContact OG-CD1 3.22Å; S792-L934 WeakPolarHBondContact OG-CD1 3.4Å; V887-L934 HydrophobicContact CG1-CD1 4.13Å; V887-L934 HydrophobicContact CG1-CG 4.41Å; D888-L934 PolarHBondContact O-N 3.27Å; P889-L934 HydrophobicContact CB-CD1 4.26Å
935	Y	92.4	Very high	89.5	Confident	3 Å²	3	46.4 Å²	46.4	1%	0.012	22%	0.217	C	C	.	.	S	Bend	trans	-147.3	148.4	-178.4	48.8	-93.9	0	0	0	109.5	Y780 T781 D888 R933 Y940 M944	Y780-Y935 HydrophobicContact CD1-CD2 4.48Å; Y780-Y935 WeakPolarHBondContact CD1-O 3.47Å; Y780-Y935 HydrophobicContact CE1-CE2 4.38Å; T781-Y935 WeakPolarHBondContact OG1-CA 3.29Å; T781-Y935 PolarHBondContact OG1-N 3.18Å; D888-Y935 WeakPolarHBondContact O-CE1 3.46Å; D888-Y935 WeakPolarHBondContact OD2-CE1 3.42Å; D888-Y935 PolarHBondContact OD2-OH 3.22Å; R933-Y935 HydrophobicContact CB-CD1 4.18Å; R933-Y935 HydrophobicContact CB-CD2 4.22Å; R933-Y935 HydrophobicContact CB-CE1 3.8Å; R933-Y935 HydrophobicContact CB-CE2 3.86Å; R933-Y935 HydrophobicContact CB-CG 4.39Å; R933-Y935 WeakPolarHBondContact CD-OH 3.29Å; R933-Y935 HydrophobicContact CG-CE1 4.11Å; R933-Y935 HydrophobicContact CG-CE2 4.1Å; R933-Y935 WeakPolarHBondContact CG-OH 3.48Å; R933-Y935 PolarHBondContact NE-OH 2.86Å; R933-Y935 PolarHBondContact O-N 2.81Å; Y935-Y940 AromaticContact CE2-CD2 3.93Å; Y935-Y940 HydrophobicContact CE2-CD2 3.93Å; Y935-Y940 HydrophobicContact CE2-CG 4.34Å; Y935-M944 HydrophobicContact CD1-CE 4.1Å; Y935-M944 HydrophobicContact CD2-CE 3.72Å; Y935-M944 HydrophobicContact CE1-CE 3.98Å; Y935-M944 HydrophobicContact CE2-CE 3.57Å; Y935-M944 HydrophobicContact CE2-SD 4.16Å; Y935-M944 HydrophobicContact CG-CE 3.98Å
936	T	92.6	Very high	89.8	Confident	23 Å²	23	48.5 Å²	48.5	14%	0.141	24%	0.235	C	C	.	.			trans	-68.9	154.1	-176.4	73.9	0	0	0	0	112	T781 K782 R938 A939 Y940	T781-T936 WeakPolarHBondContact O-CA 3.49Å; K782-T936 WeakPolarHBondContact O-CG2 3.38Å; T936-R938 PolarHBondContact O-N 2.95Å; T936-A939 PolarHBondContact O-N 3.43Å; T936-A939 VanDerWaalsContact O-N 3.14Å; T936-A939 PolarHBondContact OG1-N 2.81Å; T936-A939 VanDerWaalsContact OG1-N 3.14Å; T936-Y940 PolarHBondContact O-N 3.15Å
937	E	91.1	Very high	90.1	Very high	85 Å²	85	48 Å²	48	40%	0.397	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-30.1	175.5	-166.8	-176.3	-163.1	0	0	112.1	Y780 Y940 R941	Y780-E937 HydrophobicContact CD1-CB 4.2Å; Y780-E937 HydrophobicContact CD2-CB 4.18Å; Y780-E937 HydrophobicContact CD2-CG 4.4Å; Y780-E937 HydrophobicContact CE1-CB 4.36Å; Y780-E937 HydrophobicContact CE1-CG 4.31Å; Y780-E937 HydrophobicContact CE2-CB 4.35Å; Y780-E937 HydrophobicContact CE2-CG 4.07Å; Y780-E937 HydrophobicContact CG-CB 4.1Å; E937-Y940 PolarHBondContact O-N 3.11Å; E937-R941 VanDerWaalsContact CD-NH2 3.33Å; E937-R941 WeakPolarHBondContact O-CG 3.48Å; E937-R941 PolarHBondContact O-N 2.72Å; E937-R941 IonicContact OE1-CZ 2.88Å; E937-R941 IonicContact OE1-NE 3.36Å; E937-R941 PolarHBondContact OE1-NE 2.68Å; E937-R941 IonicContact OE1-NH2 2.73Å; E937-R941 PolarHBondContact OE1-NH2 2.66Å; E937-R941 IonicContact OE2-NH2 3.29Å
938	R	90.2	Very high	90	Very high	203 Å²	203	50 Å²	50	77%	0.766	24%	0.242	S	C	*	.	H	α-helix	trans	-63.3	-49.5	172.8	-66.5	-176.8	-177.2	172	1.3	111	T936 Y940 R941 D942	T936-R938 PolarHBondContact O-N 2.95Å; R938-Y940 VanDerWaalsContact C-N 3.29Å; R938-Y940 PolarHBondContact O-N 2.75Å; R938-R941 PolarHBondContact O-N 2.76Å; R938-R941 VanDerWaalsContact O-N 3.13Å; R938-D942 WeakPolarHBondContact O-CB 3.41Å; R938-D942 PolarHBondContact O-N 3.42Å
939	A	89.1	Confident	89.9	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	22%	0.221	C	C	.	.	I	π-helix	trans	-59.4	-40	176.8	0	0	0	0	0	111.9	L504 T936 R941 E943 M944	L504-A939 HydrophobicContact CD1-CB 4.04Å; L504-A939 HydrophobicContact CG-CB 4.15Å; T936-A939 PolarHBondContact O-N 3.43Å; T936-A939 VanDerWaalsContact O-N 3.14Å; T936-A939 PolarHBondContact OG1-N 2.81Å; T936-A939 VanDerWaalsContact OG1-N 3.14Å; A939-R941 PolarHBondContact O-N 3Å; A939-E943 HydrophobicContact CB-CB 4.46Å; A939-E943 HydrophobicContact CB-CG 4.42Å; A939-E943 WeakPolarHBondContact O-CA 3.21Å; A939-E943 WeakPolarHBondContact O-CB 3.34Å; A939-E943 PolarHBondContact O-N 2.65Å; A939-M944 PolarHBondContact O-N 2.63Å
940	Y	90.7	Very high	89.6	Confident	40 Å²	40	46.7 Å²	46.7	16%	0.157	22%	0.218	C	C	.	.	I	π-helix	trans	-59.9	-41	174.4	174.6	-103.2	0	0	0	113.5	Y780 Q913 A916 Y935 T936 E937 R938 M944	Y780-Y940 HydrophobicContact CE1-CD1 4.27Å; Y780-Y940 HydrophobicContact CE1-CG 4.03Å; Q913-Y940 HydrophobicContact CB-CE2 3.94Å; Q913-Y940 HydrophobicContact CG-CD2 4.23Å; Q913-Y940 HydrophobicContact CG-CE2 3.8Å; Q913-Y940 WeakPolarHBondContact CG-O 3.08Å; Q913-Y940 PolarHBondContact NE2-O 2.67Å; A916-Y940 HydrophobicContact CB-CD2 4.39Å; A916-Y940 HydrophobicContact CB-CE2 3.86Å; Y935-Y940 AromaticContact CE2-CD2 3.93Å; Y935-Y940 HydrophobicContact CE2-CD2 3.93Å; Y935-Y940 HydrophobicContact CE2-CG 4.34Å; T936-Y940 PolarHBondContact O-N 3.15Å; E937-Y940 PolarHBondContact O-N 3.11Å; R938-Y940 VanDerWaalsContact C-N 3.29Å; R938-Y940 PolarHBondContact O-N 2.75Å; Y940-M944 HydrophobicContact CD2-SD 3.82Å
941	R	89	Confident	89.2	Confident	143 Å²	143	48 Å²	48	54%	0.54	23%	0.226	S	C	.	.	I	π-helix	trans	-80.3	-45	-179.8	-66.6	175.2	-176.4	-153.8	6.3	112.3	K498 Q913 E937 R938 A939	K498-R941 PolarHBondContact NZ-O 2.78Å; Q913-R941 PolarHBondContact NE2-O 2.76Å; E937-R941 VanDerWaalsContact CD-NH2 3.33Å; E937-R941 WeakPolarHBondContact O-CG 3.48Å; E937-R941 PolarHBondContact O-N 2.72Å; E937-R941 IonicContact OE1-CZ 2.88Å; E937-R941 IonicContact OE1-NE 3.36Å; E937-R941 PolarHBondContact OE1-NE 2.68Å; E937-R941 IonicContact OE1-NH2 2.73Å; E937-R941 PolarHBondContact OE1-NH2 2.66Å; E937-R941 IonicContact OE2-NH2 3.29Å; R938-R941 PolarHBondContact O-N 2.76Å; R938-R941 VanDerWaalsContact O-N 3.13Å; A939-R941 PolarHBondContact O-N 3Å
942	D	87.6	Confident	88.9	Confident	96 Å²	96	48.1 Å²	48.1	51%	0.513	23%	0.226	S	C	.	.	I	π-helix	trans	-105.4	-32.3	-162	-58.6	-38.3	0	0	0	113.8	K498 R938	K498-D942 WeakPolarHBondContact CD-O 3.2Å; K498-D942 WeakPolarHBondContact CE-O 3.37Å; K498-D942 VanDerWaalsContact NZ-C 3.35Å; K498-D942 PolarHBondContact NZ-O 2.88Å; R938-D942 WeakPolarHBondContact O-CB 3.41Å; R938-D942 PolarHBondContact O-N 3.42Å
943	E	86.7	Confident	88.6	Confident	31 Å²	31	48.9 Å²	48.9	15%	0.145	23%	0.231	C	C	.	.	I	π-helix	trans	-92.4	-37.2	176.8	-64.3	-174.6	-160.8	0	0	113.3	K498 S503 L504 A939	K498-E943 WeakPolarHBondContact CB-O 3.47Å; S503-E943 WeakPolarHBondContact CB-OE1 3.46Å; S503-E943 VanDerWaalsContact N-CD 3.27Å; S503-E943 PolarHBondContact N-OE1 3.29Å; S503-E943 PolarHBondContact N-OE2 3.26Å; S503-E943 VanDerWaalsContact OG-CD 3.3Å; S503-E943 PolarHBondContact OG-OE1 3.44Å; S503-E943 PolarHBondContact OG-OE2 3.09Å; L504-E943 WeakPolarHBondContact CB-OE2 3.47Å; L504-E943 HydrophobicContact CD1-CB 4.15Å; L504-E943 WeakPolarHBondContact CG-OE2 3.45Å; L504-E943 PolarHBondContact N-OE2 3.32Å; A939-E943 HydrophobicContact CB-CB 4.46Å; A939-E943 HydrophobicContact CB-CG 4.42Å; A939-E943 WeakPolarHBondContact O-CA 3.21Å; A939-E943 WeakPolarHBondContact O-CB 3.34Å; A939-E943 PolarHBondContact O-N 2.65Å
944	M	88.4	Confident	88.2	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	23%	0.233	C	C	.	.	S	Bend	trans	-72.7	149.9	179.7	-65.3	-174	173.8	0	0	112.7	K498 L504 I911 Q913 Y935 A939 Y940	K498-M944 WeakPolarHBondContact CD-O 3.29Å; K498-M944 PolarHBondContact NZ-O 2.73Å; L504-M944 HydrophobicContact CD1-CE 3.71Å; L504-M944 HydrophobicContact CD1-CG 3.84Å; I911-M944 HydrophobicContact CG1-CE 4.04Å; I911-M944 HydrophobicContact CG1-SD 4.19Å; I911-M944 WeakPolarHBondContact O-CG 3.42Å; Q913-M944 HydrophobicContact CG-CB 4.1Å; Y935-M944 HydrophobicContact CD1-CE 4.1Å; Y935-M944 HydrophobicContact CD2-CE 3.72Å; Y935-M944 HydrophobicContact CE1-CE 3.98Å; Y935-M944 HydrophobicContact CE2-CE 3.57Å; Y935-M944 HydrophobicContact CE2-SD 4.16Å; Y935-M944 HydrophobicContact CG-CE 3.98Å; A939-M944 PolarHBondContact O-N 2.63Å; Y940-M944 HydrophobicContact CD2-SD 3.82Å
945	L	88.1	Confident	87.9	Confident	50 Å²	50	49.5 Å²	49.5	26%	0.262	23%	0.233	S	C	.	.			trans	-74.8	148	168.4	-69.5	174.3	0	0	0	110.5	I496 K498 S912 Q913 V949	I496-L945 WeakPolarHBondContact O-CD1 3.46Å; K498-L945 HydrophobicContact CB-CD2 3.9Å; K498-L945 HydrophobicContact CB-CG 4.4Å; K498-L945 HydrophobicContact CD-CD2 4.49Å; K498-L945 HydrophobicContact CG-CD2 4.3Å; S912-L945 CarbonylContact C-O 3.51Å; S912-L945 WeakPolarHBondContact CA-O 3.3Å; S912-L945 WeakPolarHBondContact CB-O 3.41Å; Q913-L945 PolarHBondContact N-O 2.68Å; L945-V949 HydrophobicContact CD1-CG2 3.71Å
946	T	86.4	Confident	87.5	Confident	90 Å²	90	51.3 Å²	51.3	55%	0.552	24%	0.244	S	C	*	.	S	Bend	trans	-67	-47.5	178.6	49.1	0	0	0	0	111.8	A914	A914-T946 PolarHBondContact N-O 2.76Å; A914-T946 VanDerWaalsContact N-O 3.09Å
947	T	83.4	Confident	87.3	Confident	42 Å²	42	50.4 Å²	50.4	26%	0.258	24%	0.238	S	C	.	.	S	Bend	trans	-121.8	155.5	177.4	54.9	0	0	0	0	111.1
948	N	82.9	Confident	87.3	Confident	46 Å²	46	46.5 Å²	46.5	25%	0.246	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-62.1	143	171.8	-176.8	30.8	0	0	0	109.5	Q894 S912 R954	Q894-N948 PolarHBondContact NE2-OD1 3.1Å; S912-N948 PolarHBondContact OG-N 2.89Å; N948-R954 PolarHBondContact OD1-NH2 3.23Å
949	V	85.3	Confident	87.2	Confident	18 Å²	18	39.2 Å²	39.2	11%	0.109	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-68	135.2	172.9	-178	0	0	0	0	108.3	L945 Q953 R954	L945-V949 HydrophobicContact CD1-CG2 3.71Å; V949-Q953 HydrophobicContact CG1-CB 4.16Å; V949-R954 HydrophobicContact CG1-CG 3.89Å; V949-R954 VanDerWaalsContact O-CZ 3.29Å; V949-R954 PolarHBondContact O-NE 3.17Å; V949-R954 PolarHBondContact O-NH2 3.14Å
950	P	86.2	Confident	87.2	Confident	7 Å²	7	39.5 Å²	39.5	5%	0.045	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-55.2	152.2	176.6	-29	38	0	0	0	113	R722 I952 Q953 R954 D979	R722-P950 HydrophobicContact CB-CB 4.47Å; P950-I952 VanDerWaalsContact C-N 3.33Å; P950-I952 HydrophobicContact CB-CG2 3.99Å; P950-Q953 PolarHBondContact O-N 2.72Å; P950-R954 PolarHBondContact O-NE 3.29Å; P950-D979 HydrophobicContact CG-CB 3.89Å
951	E	86.2	Confident	87.2	Confident	79 Å²	79	37.7 Å²	37.7	37%	0.369	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-67.2	-37.7	179.4	-165.5	-177.4	-154	0	0	111.2	R722 T723 I724 Q953 R954 T955	R722-E951 WeakPolarHBondContact O-CB 3.2Å; R722-E951 PolarHBondContact O-N 3.3Å; T723-E951 WeakPolarHBondContact CA-OE2 3.31Å; T723-E951 WeakPolarHBondContact CB-OE2 3.34Å; I724-E951 HydrophobicContact CD1-CG 4.06Å; I724-E951 HydrophobicContact CG1-CB 3.94Å; I724-E951 HydrophobicContact CG1-CG 3.68Å; I724-E951 WeakPolarHBondContact CG1-OE2 3.39Å; I724-E951 PolarHBondContact N-OE2 3.01Å; E951-Q953 PolarHBondContact O-N 2.96Å; E951-R954 PolarHBondContact O-N 2.98Å; E951-T955 HydrophobicContact CG-CG2 3.77Å; E951-T955 PolarHBondContact O-N 3.43Å; E951-T955 PolarHBondContact O-OG1 2.89Å
952	I	87.9	Confident	87.4	Confident	2 Å²	2	31 Å²	31	1%	0.01	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-57.6	-21.6	179.5	-161.7	173.2	0	0	0	114.3	I724 V728 P950 L957 F977 P981	I724-I952 HydrophobicContact CG2-CG1 4.35Å; V728-I952 HydrophobicContact CG2-CD1 4.46Å; P950-I952 VanDerWaalsContact C-N 3.33Å; P950-I952 HydrophobicContact CB-CG2 3.99Å; I952-L957 HydrophobicContact CG1-CD2 3.74Å; I952-F977 HydrophobicContact CD1-CD1 3.67Å; I952-F977 HydrophobicContact CD1-CE1 3.48Å; I952-F977 VanDerWaalsContact CD1-CE1 3.48Å; I952-F977 HydrophobicContact CD1-CZ 4.23Å; I952-P981 HydrophobicContact CG1-CB 4.36Å
953	Q	87.9	Confident	87.4	Confident	46 Å²	46	27.7 Å²	27.7	22%	0.215	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-88.1	-4	177.1	-67.6	-175.2	-25.1	0	0	113.7	V949 P950 E951 A980	V949-Q953 HydrophobicContact CG1-CB 4.16Å; P950-Q953 PolarHBondContact O-N 2.72Å; E951-Q953 PolarHBondContact O-N 2.96Å; Q953-A980 PolarHBondContact NE2-O 3.44Å
954	R	86.2	Confident	87.5	Confident	21 Å²	21	26.3 Å²	26.3	8%	0.079	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.4	3.7	-163.5	-58.1	-168.9	-72.6	168.3	-7.3	115.3	I496 Q894 Y897 N948 V949 P950 E951	I496-R954 HydrophobicContact CD1-CG 4.2Å; I496-R954 HydrophobicContact CG1-CG 4.4Å; Q894-R954 VanDerWaalsContact CD-NH1 3.31Å; Y897-R954 WeakPolarHBondContact CB-O 3.42Å; Y897-R954 PolarHBondContact N-O 3.04Å; N948-R954 PolarHBondContact OD1-NH2 3.23Å; V949-R954 HydrophobicContact CG1-CG 3.89Å; V949-R954 VanDerWaalsContact O-CZ 3.29Å; V949-R954 PolarHBondContact O-NE 3.17Å; V949-R954 PolarHBondContact O-NH2 3.14Å; P950-R954 PolarHBondContact O-NE 3.29Å; E951-R954 PolarHBondContact O-N 2.98Å
955	T	86.8	Confident	87.6	Confident	12 Å²	12	27 Å²	27	7%	0.074	15%	0.151	C	C	.	.	S	Bend	trans	-131.6	156	-174.8	55.2	0	0	0	0	111.5	I724 E951 L957	I724-T955 HydrophobicContact CD1-CG2 4.2Å; I724-T955 WeakPolarHBondContact CD1-OG1 3.19Å; E951-T955 HydrophobicContact CG-CG2 3.77Å; E951-T955 PolarHBondContact O-N 3.43Å; E951-T955 PolarHBondContact O-OG1 2.89Å; T955-L957 PolarHBondContact O-N 3.39Å
956	N	85.4	Confident	87.6	Confident	42 Å²	42	26.1 Å²	26.1	23%	0.225	15%	0.151	C	C	.	.			trans	-58.9	127.9	171.2	-173.1	-21.1	0	0	0	111	Y897 A958 Q992	Y897-N956 HydrophobicContact CD1-CB 4.2Å; Y897-N956 HydrophobicContact CD2-CB 3.87Å; Y897-N956 HydrophobicContact CE1-CB 4.13Å; Y897-N956 HydrophobicContact CE2-CB 3.81Å; Y897-N956 HydrophobicContact CG-CB 4.06Å; N956-A958 WeakPolarHBondContact OD1-CB 3.47Å; N956-A958 PolarHBondContact OD1-N 3.21Å; N956-Q992 PolarHBondContact ND2-OE1 3.22Å; N956-Q992 VanDerWaalsContact ND2-OE1 3.16Å
957	L	88.6	Confident	87.5	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.016	13%	0.134	C	C	.	.			trans	-95.4	-2.5	-175.7	-62.6	176.8	0	0	0	114.5	I724 I952 T955 S959 T960 V961 P981 T985 A989	I724-L957 HydrophobicContact CG2-CD2 4.5Å; I952-L957 HydrophobicContact CG1-CD2 3.74Å; T955-L957 PolarHBondContact O-N 3.39Å; L957-S959 VanDerWaalsContact C-N 3.33Å; L957-S959 PolarHBondContact O-N 3.5Å; L957-T960 CarbonylContact O-C 3.6Å; L957-T960 WeakPolarHBondContact O-CA 3.5Å; L957-T960 WeakPolarHBondContact O-CB 3.46Å; L957-T960 PolarHBondContact O-N 3.38Å; L957-V961 HydrophobicContact CB-CG2 4.11Å; L957-V961 WeakPolarHBondContact O-CG2 3.35Å; L957-V961 PolarHBondContact O-N 3.29Å; L957-P981 HydrophobicContact CD1-CB 3.47Å; L957-P981 VanDerWaalsContact CD1-CB 3.47Å; L957-P981 HydrophobicContact CD1-CG 4.05Å; L957-T985 HydrophobicContact CD1-CG2 3.94Å; L957-T985 HydrophobicContact CG-CG2 3.99Å; L957-A989 HydrophobicContact CB-CB 4.12Å
958	A	89.6	Confident	87.5	Confident	3 Å²	3	24.1 Å²	24.1	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-54.7	-40.2	-172.2	0	0	0	0	0	114.4	N956 L962 A989 P1019	N956-A958 WeakPolarHBondContact OD1-CB 3.47Å; N956-A958 PolarHBondContact OD1-N 3.21Å; A958-L962 VanDerWaalsContact O-CB 3.25Å; A958-L962 WeakPolarHBondContact O-CB 3.34Å; A958-L962 PolarHBondContact O-N 3.2Å; A958-L962 VanDerWaalsContact O-N 3.08Å; A958-A989 HydrophobicContact CB-CB 4.34Å; A958-P1019 HydrophobicContact CB-CG 4.28Å
959	S	89.3	Confident	87.6	Confident	51 Å²	51	23.2 Å²	23.2	36%	0.357	14%	0.141	S	C	.	.	H	α-helix	trans	-68.8	-33.5	175.1	55.7	0	0	0	0	113.1	L957 S963	L957-S959 VanDerWaalsContact C-N 3.33Å; L957-S959 PolarHBondContact O-N 3.5Å; S959-S963 PolarHBondContact O-N 2.92Å; S959-S963 VanDerWaalsContact O-N 3.16Å; S959-S963 PolarHBondContact O-OG 3.32Å
960	T	89.1	Confident	87.4	Confident	6 Å²	6	26.6 Å²	26.6	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-76.7	-44.9	179.6	-63.9	0	0	0	0	111.4	I724 V728 L957 L962 S963 L964	I724-T960 HydrophobicContact CG2-CG2 4.06Å; I724-T960 WeakPolarHBondContact CG2-OG1 3.46Å; V728-T960 HydrophobicContact CG2-CG2 3.57Å; L957-T960 CarbonylContact O-C 3.6Å; L957-T960 WeakPolarHBondContact O-CA 3.5Å; L957-T960 WeakPolarHBondContact O-CB 3.46Å; L957-T960 PolarHBondContact O-N 3.38Å; T960-L962 VanDerWaalsContact C-N 3.32Å; T960-L962 PolarHBondContact O-N 2.8Å; T960-S963 WeakPolarHBondContact O-CB 3.43Å; T960-S963 PolarHBondContact O-N 3.03Å; T960-S963 VanDerWaalsContact O-N 3.14Å; T960-L964 HydrophobicContact CG2-CD1 4.01Å; T960-L964 HydrophobicContact CG2-CG 4.48Å; T960-L964 WeakPolarHBondContact O-CG 3.38Å; T960-L964 PolarHBondContact O-N 2.65Å
961	V	91.1	Very high	87.2	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-43.7	173.4	170.7	0	0	0	0	110.9	L957 S963 L964 K965 L972 L986 A989 M990 L993	L957-V961 HydrophobicContact CB-CG2 4.11Å; L957-V961 WeakPolarHBondContact O-CG2 3.35Å; L957-V961 PolarHBondContact O-N 3.29Å; V961-S963 VanDerWaalsContact C-N 3.32Å; V961-S963 PolarHBondContact O-N 3.08Å; V961-L964 PolarHBondContact O-N 2.81Å; V961-K965 WeakPolarHBondContact O-CB 3.34Å; V961-K965 WeakPolarHBondContact O-CG 3.18Å; V961-K965 PolarHBondContact O-N 3.28Å; V961-L972 HydrophobicContact CG1-CD1 3.75Å; V961-L986 HydrophobicContact CG2-CD1 3.75Å; V961-A989 HydrophobicContact CG2-CB 4.03Å; V961-M990 HydrophobicContact CG1-CG 3.94Å; V961-L993 HydrophobicContact CB-CD1 3.95Å; V961-L993 HydrophobicContact CG1-CD1 3.55Å
962	L	91.4	Very high	86.9	Confident	4 Å²	4	27 Å²	27	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-42.4	174.6	-179.9	59.7	0	0	0	111.9	A958 T960 A966 L993 A998 L1005 M1012 A1013 P1019	A958-L962 VanDerWaalsContact O-CB 3.25Å; A958-L962 WeakPolarHBondContact O-CB 3.34Å; A958-L962 PolarHBondContact O-N 3.2Å; A958-L962 VanDerWaalsContact O-N 3.08Å; T960-L962 VanDerWaalsContact C-N 3.32Å; T960-L962 PolarHBondContact O-N 2.8Å; L962-A966 WeakPolarHBondContact O-CB 3.04Å; L962-A966 PolarHBondContact O-N 3.09Å; L962-L993 HydrophobicContact CB-CD1 3.99Å; L962-L993 HydrophobicContact CB-CD2 3.99Å; L962-L993 HydrophobicContact CD1-CD2 4.34Å; L962-L993 HydrophobicContact CD2-CD2 4.3Å; L962-L993 HydrophobicContact CG-CD2 4.44Å; L962-A998 HydrophobicContact CD1-CB 4.3Å; L962-L1005 HydrophobicContact CD1-CD1 3.58Å; L962-M1012 HydrophobicContact CD2-CB 3.96Å; L962-A1013 HydrophobicContact CD1-CB 4.23Å; L962-A1013 HydrophobicContact CD2-CB 4.48Å; L962-A1013 HydrophobicContact CG-CB 3.95Å; L962-P1019 HydrophobicContact CD2-CB 4.35Å; L962-P1019 HydrophobicContact CD2-CG 3.94Å
963	S	88.8	Confident	86.5	Confident	25 Å²	25	32.7 Å²	32.7	18%	0.175	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-45.7	177.4	-57	0	0	0	0	112	L703 S959 T960 V961 A966 M967	L703-S963 WeakPolarHBondContact CD2-O 3.4Å; S959-S963 PolarHBondContact O-N 2.92Å; S959-S963 VanDerWaalsContact O-N 3.16Å; S959-S963 PolarHBondContact O-OG 3.32Å; T960-S963 WeakPolarHBondContact O-CB 3.43Å; T960-S963 PolarHBondContact O-N 3.03Å; T960-S963 VanDerWaalsContact O-N 3.14Å; V961-S963 VanDerWaalsContact C-N 3.32Å; V961-S963 PolarHBondContact O-N 3.08Å; S963-A966 WeakPolarHBondContact O-CB 3.29Å; S963-A966 PolarHBondContact O-N 3.44Å; S963-M967 WeakPolarHBondContact O-CG 3.46Å; S963-M967 PolarHBondContact O-N 2.74Å
964	L	89	Confident	86.1	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-46.3	177.5	-72.1	166.4	0	0	0	111.7	V728 T960 V961 A966 M967 G968 I969 L972 F975 F977	V728-L964 HydrophobicContact CG1-CD2 3.92Å; T960-L964 HydrophobicContact CG2-CD1 4.01Å; T960-L964 HydrophobicContact CG2-CG 4.48Å; T960-L964 WeakPolarHBondContact O-CG 3.38Å; T960-L964 PolarHBondContact O-N 2.65Å; V961-L964 PolarHBondContact O-N 2.81Å; L964-A966 VanDerWaalsContact C-N 3.29Å; L964-A966 PolarHBondContact O-N 3.19Å; L964-M967 WeakPolarHBondContact O-CB 3.39Å; L964-M967 PolarHBondContact O-N 3.31Å; L964-M967 VanDerWaalsContact O-N 3.14Å; L964-G968 PolarHBondContact O-N 3.37Å; L964-I969 HydrophobicContact CB-CB 4.45Å; L964-I969 HydrophobicContact CB-CD1 4.48Å; L964-I969 HydrophobicContact CD2-CD1 3.62Å; L964-I969 WeakPolarHBondContact O-CB 3.18Å; L964-I969 PolarHBondContact O-N 2.78Å; L964-I969 VanDerWaalsContact O-N 3.1Å; L964-L972 HydrophobicContact CB-CD2 3.69Å; L964-L972 HydrophobicContact CD1-CD2 3.89Å; L964-L972 HydrophobicContact CG-CD2 4.4Å; L964-F975 HydrophobicContact CD2-CE2 4.35Å; L964-F975 HydrophobicContact CD2-CZ 4.29Å; L964-F977 HydrophobicContact CD1-CZ 4.08Å
965	K	89.1	Confident	86	Confident	15 Å²	15	33.9 Å²	33.9	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-62.4	-35.1	174.9	-72.5	-81.8	-177.8	170.3	0	111.8	V961 M967 G968 N970 L972 L999 G1003 L1005	V961-K965 WeakPolarHBondContact O-CB 3.34Å; V961-K965 WeakPolarHBondContact O-CG 3.18Å; V961-K965 PolarHBondContact O-N 3.28Å; K965-M967 VanDerWaalsContact C-N 3.33Å; K965-M967 PolarHBondContact O-N 3.25Å; K965-G968 PolarHBondContact O-N 2.94Å; K965-N970 WeakPolarHBondContact CE-O 3.26Å; K965-N970 PolarHBondContact NZ-O 2.75Å; K965-L972 HydrophobicContact CG-CD1 4.36Å; K965-L999 HydrophobicContact CD-CD2 4.45Å; K965-L999 HydrophobicContact CG-CD2 4.32Å; K965-G1003 WeakPolarHBondContact CE-O 3.48Å; K965-G1003 PolarHBondContact NZ-O 3.03Å; K965-L1005 HydrophobicContact CB-CD1 4.41Å
966	A	88.6	Confident	85.9	Confident	32 Å²	32	36 Å²	36	26%	0.264	22%	0.219	S	C	.	.	H	α-helix	trans	-67.7	-29.3	174.6	0	0	0	0	0	113.7	L703 L962 S963 L964 G968 L1005 A1013	L703-A966 HydrophobicContact CD2-CB 3.93Å; L962-A966 WeakPolarHBondContact O-CB 3.04Å; L962-A966 PolarHBondContact O-N 3.09Å; S963-A966 WeakPolarHBondContact O-CB 3.29Å; S963-A966 PolarHBondContact O-N 3.44Å; L964-A966 VanDerWaalsContact C-N 3.29Å; L964-A966 PolarHBondContact O-N 3.19Å; A966-G968 PolarHBondContact O-N 3.46Å; A966-L1005 HydrophobicContact CB-CD2 3.84Å; A966-A1013 HydrophobicContact CB-CB 3.51Å
967	M	84.4	Confident	85.9	Confident	38 Å²	38	35 Å²	35	19%	0.187	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	0.2	169.4	-62.1	175.2	179.2	0	0	113.6	L699 C702 L703 L732 S963 L964 K965 I969	L699-M967 HydrophobicContact CD1-CE 3.76Å; L699-M967 HydrophobicContact CG-CE 4.28Å; L699-M967 WeakPolarHBondContact O-CE 3.29Å; C702-M967 HydrophobicContact CB-CE 3.76Å; L703-M967 HydrophobicContact CD2-CE 3.67Å; L703-M967 HydrophobicContact CD2-CG 3.63Å; L703-M967 HydrophobicContact CD2-SD 4.49Å; L703-M967 HydrophobicContact CG-CE 3.63Å; L703-M967 HydrophobicContact CG-CG 4.49Å; L732-M967 HydrophobicContact CD1-CE 3.81Å; L732-M967 HydrophobicContact CD1-SD 3.51Å; L732-M967 VanDerWaalsContact CD1-SD 3.51Å; L732-M967 HydrophobicContact CD2-SD 3.53Å; L732-M967 VanDerWaalsContact CD2-SD 3.53Å; L732-M967 HydrophobicContact CG-SD 4.17Å; S963-M967 WeakPolarHBondContact O-CG 3.46Å; S963-M967 PolarHBondContact O-N 2.74Å; L964-M967 WeakPolarHBondContact O-CB 3.39Å; L964-M967 PolarHBondContact O-N 3.31Å; L964-M967 VanDerWaalsContact O-N 3.14Å; K965-M967 VanDerWaalsContact C-N 3.33Å; K965-M967 PolarHBondContact O-N 3.25Å; M967-I969 HydrophobicContact CB-CD1 4.15Å; M967-I969 HydrophobicContact CB-CG1 4.45Å
968	G	82.9	Confident	85.8	Confident	52 Å²	52	36.4 Å²	36.4	54%	0.536	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	14.5	-177.3	0	0	0	0	0	114.6	L964 K965 A966 N970	L964-G968 PolarHBondContact O-N 3.37Å; K965-G968 PolarHBondContact O-N 2.94Å; A966-G968 PolarHBondContact O-N 3.46Å; G968-N970 PolarHBondContact O-N 2.93Å; G968-N970 VanDerWaalsContact O-N 3.07Å
969	I	85.4	Confident	85.6	Confident	26 Å²	26	38.6 Å²	38.6	13%	0.133	23%	0.231	C	C	.	.			trans	-81	90.1	175.1	-61.7	159.1	0	0	0	107.9	L732 L964 M967 D971 L972 F975	L732-I969 HydrophobicContact CD2-CD1 3.64Å; L964-I969 HydrophobicContact CB-CB 4.45Å; L964-I969 HydrophobicContact CB-CD1 4.48Å; L964-I969 HydrophobicContact CD2-CD1 3.62Å; L964-I969 WeakPolarHBondContact O-CB 3.18Å; L964-I969 PolarHBondContact O-N 2.78Å; L964-I969 VanDerWaalsContact O-N 3.1Å; M967-I969 HydrophobicContact CB-CD1 4.15Å; M967-I969 HydrophobicContact CB-CG1 4.45Å; I969-D971 VanDerWaalsContact CG2-O 3.25Å; I969-D971 WeakPolarHBondContact CG2-O 3.42Å; I969-L972 HydrophobicContact CG2-CD2 4.05Å; I969-F975 HydrophobicContact CD1-CD2 4.13Å; I969-F975 HydrophobicContact CD1-CE2 3.61Å; I969-F975 HydrophobicContact CD1-CZ 4.48Å; I969-F975 HydrophobicContact CG1-CE2 4.37Å; I969-F975 HydrophobicContact CG2-CD2 3.65Å; I969-F975 HydrophobicContact CG2-CE2 4.28Å
970	N	80.6	Confident	85.4	Confident	90 Å²	90	39 Å²	39	48%	0.481	24%	0.238	S	C	.	.			trans	-76.4	-40.6	-176.5	-70.6	-15	0	0	0	112.5	K965 G968 L1004	K965-N970 WeakPolarHBondContact CE-O 3.26Å; K965-N970 PolarHBondContact NZ-O 2.75Å; G968-N970 PolarHBondContact O-N 2.93Å; G968-N970 VanDerWaalsContact O-N 3.07Å; N970-L1004 HydrophobicContact CB-CD2 4.46Å
971	D	81.9	Confident	85.3	Confident	86 Å²	86	39.5 Å²	39.5	46%	0.46	24%	0.241	S	C	.	.			trans	-90.7	119	171.2	-165.8	-23.1	0	0	0	110.1	I969 L973 S974	I969-D971 VanDerWaalsContact CG2-O 3.25Å; I969-D971 WeakPolarHBondContact CG2-O 3.42Å; D971-L973 WeakPolarHBondContact OD1-CA 3.36Å; D971-L973 PolarHBondContact OD1-N 2.69Å; D971-S974 PolarHBondContact OD1-N 2.91Å; D971-S974 WeakPolarHBondContact OD2-CB 3.46Å; D971-S974 PolarHBondContact OD2-OG 3.38Å
972	L	81.5	Confident	85	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.037	25%	0.25	C	C	.	.	S	Bend	trans	-103.3	-16.8	179.5	-61.4	168.7	0	0	0	112.2	V961 L964 K965 I969 L986 M990	V961-L972 HydrophobicContact CG1-CD1 3.75Å; L964-L972 HydrophobicContact CB-CD2 3.69Å; L964-L972 HydrophobicContact CD1-CD2 3.89Å; L964-L972 HydrophobicContact CG-CD2 4.4Å; K965-L972 HydrophobicContact CG-CD1 4.36Å; I969-L972 HydrophobicContact CG2-CD2 4.05Å; L972-L986 HydrophobicContact CB-CD1 4.26Å; L972-L986 HydrophobicContact CB-CD2 4.03Å; L972-L986 HydrophobicContact CD1-CD1 4.39Å; L972-M990 HydrophobicContact CD1-CG 4.42Å; L972-M990 HydrophobicContact CD1-SD 3.96Å
973	L	78.6	Confident	84.6	Confident	122 Å²	122	46.1 Å²	46.1	64%	0.639	28%	0.276	S	S	*	.	S	Bend	trans	-83.6	-36.2	177.7	-68.6	167.4	0	0	0	110.4	D971 F975 M983 L986	D971-L973 WeakPolarHBondContact OD1-CA 3.36Å; D971-L973 PolarHBondContact OD1-N 2.69Å; L973-F975 PolarHBondContact O-N 3.05Å; L973-M983 HydrophobicContact CD2-CG 4.19Å; L973-L986 HydrophobicContact CD2-CD2 3.73Å; L973-L986 HydrophobicContact CG-CD2 4.18Å
974	S	79.1	Confident	84.3	Confident	83 Å²	83	46.1 Å²	46.1	58%	0.58	27%	0.273	S	S	*	.	S	Bend	trans	-84.3	10.7	170.5	96.8	0	0	0	0	113.4	D971	D971-S974 PolarHBondContact OD1-N 2.91Å; D971-S974 WeakPolarHBondContact OD2-CB 3.46Å; D971-S974 PolarHBondContact OD2-OG 3.38Å
975	F	84.4	Confident	84.1	Confident	10 Å²	10	46.4 Å²	46.4	4%	0.044	28%	0.275	C	S	.	.	S	Bend	trans	-77.7	132.4	178.1	-170.5	-89.8	0	0	0	110.8	K735 L964 I969 L973 F977	K735-F975 HydrophobicContact CD-CE2 4.48Å; L964-F975 HydrophobicContact CD2-CE2 4.35Å; L964-F975 HydrophobicContact CD2-CZ 4.29Å; I969-F975 HydrophobicContact CD1-CD2 4.13Å; I969-F975 HydrophobicContact CD1-CE2 3.61Å; I969-F975 HydrophobicContact CD1-CZ 4.48Å; I969-F975 HydrophobicContact CG1-CE2 4.37Å; I969-F975 HydrophobicContact CG2-CD2 3.65Å; I969-F975 HydrophobicContact CG2-CE2 4.28Å; L973-F975 PolarHBondContact O-N 3.05Å; F975-F977 HydrophobicContact CB-CD2 4.19Å; F975-F977 HydrophobicContact CB-CE2 3.82Å; F975-F977 HydrophobicContact CB-CZ 4.32Å; F975-F977 AromaticContact CD1-CD1 3.68Å; F975-F977 HydrophobicContact CD1-CD1 3.68Å; F975-F977 AromaticContact CD1-CD2 3.74Å; F975-F977 HydrophobicContact CD1-CD2 3.74Å; F975-F977 AromaticContact CD1-CE1 3.53Å; F975-F977 HydrophobicContact CD1-CE1 3.53Å; F975-F977 AromaticContact CD1-CE2 3.61Å; F975-F977 HydrophobicContact CD1-CE2 3.61Å; F975-F977 AromaticContact CD1-CG 3.79Å; F975-F977 HydrophobicContact CD1-CG 3.79Å; F975-F977 AromaticContact CD1-CZ 3.5Å; F975-F977 HydrophobicContact CD1-CZ 3.5Å; F975-F977 VanDerWaalsContact CD1-CZ 3.5Å; F975-F977 AromaticContact CE1-CD1 3.9Å; F975-F977 HydrophobicContact CE1-CD1 3.9Å; F975-F977 AromaticContact CE1-CE1 3.75Å; F975-F977 HydrophobicContact CE1-CE1 3.75Å; F975-F977 HydrophobicContact CE1-CG 4.39Å; F975-F977 HydrophobicContact CE1-CZ 4.14Å; F975-F977 HydrophobicContact CG-CD2 4.46Å; F975-F977 HydrophobicContact CG-CE2 4.11Å; F975-F977 HydrophobicContact CG-CZ 4.18Å; F975-F977 WeakPolarHBondContact O-CD2 3.37Å; F975-F977 PolarHBondContact O-N 3.48Å
976	D	84.3	Confident	84	Confident	55 Å²	55	46.1 Å²	46.1	29%	0.294	27%	0.274	S	S	.	.			trans	-75.1	67.6	-174.3	-171.3	-4.3	0	0	0	111.3	K734 Y760	K734-D976 WeakPolarHBondContact CD-OD2 3.35Å; K734-D976 WeakPolarHBondContact CE-OD2 3.43Å; K734-D976 IonicContact NZ-OD1 2.74Å; K734-D976 PolarHBondContact NZ-OD1 2.94Å; K734-D976 IonicContact NZ-OD2 3.16Å; K734-D976 PolarHBondContact NZ-OD2 2.88Å; Y760-D976 WeakPolarHBondContact CE2-OD1 3.29Å; Y760-D976 PolarHBondContact OH-O 3.01Å
977	F	86.8	Confident	83.8	Confident	23 Å²	23	45.9 Å²	45.9	10%	0.101	27%	0.268	C	S	.	.			trans	-76.6	141.7	168.8	-64.7	-70.2	0	0	0	110.3	V728 I952 L964 F975 A980 P981	V728-F977 HydrophobicContact CG2-CE1 4.39Å; I952-F977 HydrophobicContact CD1-CD1 3.67Å; I952-F977 HydrophobicContact CD1-CE1 3.48Å; I952-F977 VanDerWaalsContact CD1-CE1 3.48Å; I952-F977 HydrophobicContact CD1-CZ 4.23Å; L964-F977 HydrophobicContact CD1-CZ 4.08Å; F975-F977 HydrophobicContact CB-CD2 4.19Å; F975-F977 HydrophobicContact CB-CE2 3.82Å; F975-F977 HydrophobicContact CB-CZ 4.32Å; F975-F977 AromaticContact CD1-CD1 3.68Å; F975-F977 HydrophobicContact CD1-CD1 3.68Å; F975-F977 AromaticContact CD1-CD2 3.74Å; F975-F977 HydrophobicContact CD1-CD2 3.74Å; F975-F977 AromaticContact CD1-CE1 3.53Å; F975-F977 HydrophobicContact CD1-CE1 3.53Å; F975-F977 AromaticContact CD1-CE2 3.61Å; F975-F977 HydrophobicContact CD1-CE2 3.61Å; F975-F977 AromaticContact CD1-CG 3.79Å; F975-F977 HydrophobicContact CD1-CG 3.79Å; F975-F977 AromaticContact CD1-CZ 3.5Å; F975-F977 HydrophobicContact CD1-CZ 3.5Å; F975-F977 VanDerWaalsContact CD1-CZ 3.5Å; F975-F977 AromaticContact CE1-CD1 3.9Å; F975-F977 HydrophobicContact CE1-CD1 3.9Å; F975-F977 AromaticContact CE1-CE1 3.75Å; F975-F977 HydrophobicContact CE1-CE1 3.75Å; F975-F977 HydrophobicContact CE1-CG 4.39Å; F975-F977 HydrophobicContact CE1-CZ 4.14Å; F975-F977 HydrophobicContact CG-CD2 4.46Å; F975-F977 HydrophobicContact CG-CE2 4.11Å; F975-F977 HydrophobicContact CG-CZ 4.18Å; F975-F977 WeakPolarHBondContact O-CD2 3.37Å; F975-F977 PolarHBondContact O-N 3.48Å; F977-A980 HydrophobicContact CB-CB 4.43Å; F977-P981 HydrophobicContact CD2-CG 4.39Å; F977-P981 HydrophobicContact CE2-CG 4.14Å
978	M	84.9	Confident	83.8	Confident	31 Å²	31	45 Å²	45	15%	0.153	26%	0.264	C	S	.	.	S	Bend	trans	-64.6	-42.8	174.6	-176.1	-178.2	-65.6	0	0	112	F730 F757 Y760 F761	F730-M978 HydrophobicContact CD2-CE 3.88Å; F730-M978 HydrophobicContact CE2-CE 4.13Å; F730-M978 HydrophobicContact CG-CE 4.5Å; F757-M978 HydrophobicContact CD1-CE 3.61Å; F757-M978 HydrophobicContact CD1-SD 4.32Å; F757-M978 HydrophobicContact CE1-CE 3.88Å; F757-M978 HydrophobicContact CE1-SD 4.23Å; F757-M978 HydrophobicContact CG-CE 4.35Å; Y760-M978 HydrophobicContact CD1-CE 3.59Å; Y760-M978 HydrophobicContact CD2-CB 3.79Å; Y760-M978 HydrophobicContact CD2-CE 4.44Å; Y760-M978 HydrophobicContact CD2-CG 4.04Å; Y760-M978 HydrophobicContact CE1-CE 4.23Å; Y760-M978 HydrophobicContact CE2-CB 3.89Å; Y760-M978 HydrophobicContact CG-CB 4.2Å; Y760-M978 HydrophobicContact CG-CE 3.71Å; Y760-M978 HydrophobicContact CG-CG 4.13Å; F761-M978 HydrophobicContact CE2-CE 4.49Å
979	D	85.6	Confident	84.1	Confident	50 Å²	50	42.5 Å²	42.5	27%	0.267	24%	0.239	S	C	.	.	S	Bend	trans	-129.6	112.9	166.7	-64.2	-82.9	0	0	0	106.7	R722 P950	R722-D979 IonicContact CZ-OD2 2.85Å; R722-D979 IonicContact NH1-OD2 2.63Å; R722-D979 PolarHBondContact NH1-OD2 3.02Å; R722-D979 IonicContact NH2-OD2 3.28Å; R722-D979 PolarHBondContact NH2-OD2 2.89Å; P950-D979 HydrophobicContact CG-CB 3.89Å
980	A	85.8	Confident	84.2	Confident	60 Å²	60	42.4 Å²	42.4	50%	0.496	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-67.6	146.2	-174.7	0	0	0	0	0	112.4	Q953 F977	Q953-A980 PolarHBondContact NE2-O 3.44Å; F977-A980 HydrophobicContact CB-CB 4.43Å
981	P	86.6	Confident	84.5	Confident	15 Å²	15	40.8 Å²	40.8	10%	0.097	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-67.5	157.2	170.2	28.6	-33.9	0	0	0	111.8	I952 L957 F977 M983	I952-P981 HydrophobicContact CG1-CB 4.36Å; L957-P981 HydrophobicContact CD1-CB 3.47Å; L957-P981 VanDerWaalsContact CD1-CB 3.47Å; L957-P981 HydrophobicContact CD1-CG 4.05Å; F977-P981 HydrophobicContact CD2-CG 4.39Å; F977-P981 HydrophobicContact CE2-CG 4.14Å; P981-M983 PolarHBondContact O-N 2.77Å
982	P	85.1	Confident	84.7	Confident	30 Å²	30	37.3 Å²	37.3	20%	0.195	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-59.3	135.3	171	-20.4	32.1	0	0	0	111.2	V494 E984 T985 L986	V494-P982 HydrophobicContact CG2-CB 4.35Å; V494-P982 HydrophobicContact CG2-CG 3.32Å; P982-E984 PolarHBondContact O-N 3.21Å; P982-T985 PolarHBondContact O-N 2.8Å; P982-T985 VanDerWaalsContact O-N 3.16Å; P982-L986 PolarHBondContact O-N 3.09Å; P982-L986 VanDerWaalsContact O-N 3.15Å
983	M	82.6	Confident	85.1	Confident	116 Å²	116	37 Å²	37	57%	0.571	21%	0.207	S	C	*	.	H	α-helix	trans	-57.4	-35.8	178.4	-64.8	-174.9	-66.8	0	0	112.1	L973 P981 L986 I987	L973-M983 HydrophobicContact CD2-CG 4.19Å; P981-M983 PolarHBondContact O-N 2.77Å; M983-L986 WeakPolarHBondContact O-CB 3.42Å; M983-L986 PolarHBondContact O-N 3.01Å; M983-I987 WeakPolarHBondContact O-CB 3.32Å; M983-I987 WeakPolarHBondContact O-CD1 3.22Å; M983-I987 VanDerWaalsContact O-CG1 3.22Å; M983-I987 WeakPolarHBondContact O-CG1 3.43Å; M983-I987 PolarHBondContact O-N 3.02Å
984	E	82.1	Confident	85.5	Confident	24 Å²	24	34 Å²	34	11%	0.112	19%	0.188	C	C	.	.	H	α-helix	trans	-56.4	-55.4	174.2	-179.9	179.7	-156.4	0	0	112.1	K900 P982 L986 I987 T988	K900-E984 WeakPolarHBondContact CE-OE1 3.33Å; K900-E984 WeakPolarHBondContact CG-OE1 3.42Å; K900-E984 IonicContact NZ-OE1 2.65Å; P982-E984 PolarHBondContact O-N 3.21Å; E984-L986 PolarHBondContact O-N 2.78Å; E984-I987 PolarHBondContact O-N 2.88Å; E984-I987 VanDerWaalsContact O-N 3.08Å; E984-T988 PolarHBondContact O-N 3.24Å; E984-T988 PolarHBondContact O-OG1 3.47Å; E984-T988 VanDerWaalsContact O-OG1 3.13Å
985	T	85.3	Confident	85.8	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.055	17%	0.17	C	C	.	.	H	α-helix	trans	-60.2	-33	179	-46.2	0	0	0	0	112.2	Y897 S899 L957 P982 A989	Y897-T985 HydrophobicContact CD1-CG2 4.07Å; Y897-T985 HydrophobicContact CE1-CG2 4.2Å; S899-T985 WeakPolarHBondContact OG-CA 3.35Å; S899-T985 PolarHBondContact OG-OG1 3.35Å; L957-T985 HydrophobicContact CD1-CG2 3.94Å; L957-T985 HydrophobicContact CG-CG2 3.99Å; P982-T985 PolarHBondContact O-N 2.8Å; P982-T985 VanDerWaalsContact O-N 3.16Å; T985-A989 VanDerWaalsContact O-CB 3.22Å; T985-A989 WeakPolarHBondContact O-CB 3.28Å; T985-A989 PolarHBondContact O-N 2.93Å; T985-A989 VanDerWaalsContact O-N 3.12Å
986	L	86.8	Confident	86	Confident	10 Å²	10	31.2 Å²	31.2	5%	0.052	17%	0.168	C	C	.	.	H	α-helix	trans	-69.3	-44	174.4	-167.3	73.5	0	0	0	111.9	V961 L972 L973 P982 M983 E984 A989 M990	V961-L986 HydrophobicContact CG2-CD1 3.75Å; L972-L986 HydrophobicContact CB-CD1 4.26Å; L972-L986 HydrophobicContact CB-CD2 4.03Å; L972-L986 HydrophobicContact CD1-CD1 4.39Å; L973-L986 HydrophobicContact CD2-CD2 3.73Å; L973-L986 HydrophobicContact CG-CD2 4.18Å; P982-L986 PolarHBondContact O-N 3.09Å; P982-L986 VanDerWaalsContact O-N 3.15Å; M983-L986 WeakPolarHBondContact O-CB 3.42Å; M983-L986 PolarHBondContact O-N 3.01Å; E984-L986 PolarHBondContact O-N 2.78Å; L986-A989 PolarHBondContact O-N 2.66Å; L986-M990 WeakPolarHBondContact O-CG 3.12Å; L986-M990 PolarHBondContact O-N 3.28Å
987	I	85.6	Confident	86.1	Confident	27 Å²	27	30 Å²	30	14%	0.138	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-49.8	177.6	-70.4	163	0	0	0	110.5	L481 H484 M983 E984 A989 M990 E991	L481-I987 HydrophobicContact CD1-CG2 4.24Å; L481-I987 HydrophobicContact CD2-CG2 4.31Å; H484-I987 HydrophobicContact CB-CD1 4.35Å; M983-I987 WeakPolarHBondContact O-CB 3.32Å; M983-I987 WeakPolarHBondContact O-CD1 3.22Å; M983-I987 VanDerWaalsContact O-CG1 3.22Å; M983-I987 WeakPolarHBondContact O-CG1 3.43Å; M983-I987 PolarHBondContact O-N 3.02Å; E984-I987 PolarHBondContact O-N 2.88Å; E984-I987 VanDerWaalsContact O-N 3.08Å; I987-A989 VanDerWaalsContact C-N 3.27Å; I987-A989 PolarHBondContact O-N 2.86Å; I987-M990 PolarHBondContact O-N 2.9Å; I987-M990 VanDerWaalsContact O-N 3.1Å; I987-E991 WeakPolarHBondContact O-CB 3.24Å; I987-E991 PolarHBondContact O-N 2.93Å
988	T	84.7	Confident	86.3	Confident	18 Å²	18	28.9 Å²	28.9	11%	0.11	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-37.3	176.9	-51.3	0	0	0	0	111.8	E984 Q992	E984-T988 PolarHBondContact O-N 3.24Å; E984-T988 PolarHBondContact O-OG1 3.47Å; E984-T988 VanDerWaalsContact O-OG1 3.13Å; T988-Q992 WeakPolarHBondContact O-CB 3.4Å; T988-Q992 PolarHBondContact O-N 2.94Å
989	A	88.8	Confident	86.6	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-40	174.4	0	0	0	0	0	112.7	L957 A958 V961 T985 L986 I987 Q992 L993	L957-A989 HydrophobicContact CB-CB 4.12Å; A958-A989 HydrophobicContact CB-CB 4.34Å; V961-A989 HydrophobicContact CG2-CB 4.03Å; T985-A989 VanDerWaalsContact O-CB 3.22Å; T985-A989 WeakPolarHBondContact O-CB 3.28Å; T985-A989 PolarHBondContact O-N 2.93Å; T985-A989 VanDerWaalsContact O-N 3.12Å; L986-A989 PolarHBondContact O-N 2.66Å; I987-A989 VanDerWaalsContact C-N 3.27Å; I987-A989 PolarHBondContact O-N 2.86Å; A989-Q992 PolarHBondContact O-N 3.1Å; A989-L993 VanDerWaalsContact O-CG 3.31Å; A989-L993 WeakPolarHBondContact O-CG 3.29Å; A989-L993 PolarHBondContact O-N 3.16Å; A989-L993 VanDerWaalsContact O-N 3.1Å
990	M	87.8	Confident	86.7	Confident	24 Å²	24	27.7 Å²	27.7	12%	0.118	16%	0.158	C	C	.	.	H	α-helix	trans	-68.4	-40.6	175.1	-71.1	178.9	71.6	0	0	112	F480 V961 L972 L986 I987 L993 Y994 L999	F480-M990 HydrophobicContact CD2-CE 4.32Å; F480-M990 HydrophobicContact CE2-CB 4.45Å; F480-M990 HydrophobicContact CE2-CE 3.92Å; V961-M990 HydrophobicContact CG1-CG 3.94Å; L972-M990 HydrophobicContact CD1-CG 4.42Å; L972-M990 HydrophobicContact CD1-SD 3.96Å; L986-M990 WeakPolarHBondContact O-CG 3.12Å; L986-M990 PolarHBondContact O-N 3.28Å; I987-M990 PolarHBondContact O-N 2.9Å; I987-M990 VanDerWaalsContact O-N 3.1Å; M990-L993 PolarHBondContact O-N 3Å; M990-Y994 WeakPolarHBondContact O-CB 3.38Å; M990-Y994 PolarHBondContact O-N 2.84Å; M990-L999 HydrophobicContact CB-CD1 4.32Å; M990-L999 HydrophobicContact CG-CD1 4.48Å
991	E	85.6	Confident	86.7	Confident	56 Å²	56	29.6 Å²	29.6	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-60.3	-44.4	172.3	-178.5	-159	-119.8	0	0	111.7	L481 I987 L993 Y994 T995 R1145	L481-E991 HydrophobicContact CD1-CB 4.37Å; I987-E991 WeakPolarHBondContact O-CB 3.24Å; I987-E991 PolarHBondContact O-N 2.93Å; E991-L993 VanDerWaalsContact C-N 3.3Å; E991-L993 PolarHBondContact O-N 3.32Å; E991-Y994 PolarHBondContact O-N 3.2Å; E991-T995 WeakPolarHBondContact O-CG2 3.43Å; E991-T995 PolarHBondContact O-N 3.32Å; E991-T995 PolarHBondContact O-OG1 3.16Å; E991-R1145 IonicContact OE2-CZ 3.17Å; E991-R1145 IonicContact OE2-NH1 3.19Å; E991-R1145 PolarHBondContact OE2-NH1 3.06Å; E991-R1145 IonicContact OE2-NH2 3.18Å; E991-R1145 PolarHBondContact OE2-NH2 3.43Å; E991-R1145 VanDerWaalsContact OE2-NH2 3.16Å
992	Q	86.7	Confident	86.6	Confident	13 Å²	13	36.2 Å²	36.2	6%	0.061	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-38.9	175.5	-170.1	177.3	13.1	0	0	111.5	N956 T988 A989 T995 L996	N956-Q992 PolarHBondContact ND2-OE1 3.22Å; N956-Q992 VanDerWaalsContact ND2-OE1 3.16Å; T988-Q992 WeakPolarHBondContact O-CB 3.4Å; T988-Q992 PolarHBondContact O-N 2.94Å; A989-Q992 PolarHBondContact O-N 3.1Å; Q992-T995 WeakPolarHBondContact CA-OG1 3.38Å; Q992-T995 PolarHBondContact O-OG1 2.85Å; Q992-T995 VanDerWaalsContact O-OG1 3.12Å; Q992-L996 HydrophobicContact CG-CD1 4.25Å; Q992-L996 WeakPolarHBondContact O-CB 3.42Å; Q992-L996 VanDerWaalsContact O-CD1 3.31Å; Q992-L996 WeakPolarHBondContact O-CD1 3.2Å; Q992-L996 WeakPolarHBondContact O-CG 3.41Å; Q992-L996 PolarHBondContact O-N 2.95Å; Q992-L996 VanDerWaalsContact O-N 3.12Å
993	L	89.4	Confident	86.5	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-74.3	-34.6	177.5	-68.4	172.8	0	0	0	113.3	V961 L962 A989 M990 E991 L996 G997 A998 L999 P1019	V961-L993 HydrophobicContact CB-CD1 3.95Å; V961-L993 HydrophobicContact CG1-CD1 3.55Å; L962-L993 HydrophobicContact CB-CD1 3.99Å; L962-L993 HydrophobicContact CB-CD2 3.99Å; L962-L993 HydrophobicContact CD1-CD2 4.34Å; L962-L993 HydrophobicContact CD2-CD2 4.3Å; L962-L993 HydrophobicContact CG-CD2 4.44Å; A989-L993 VanDerWaalsContact O-CG 3.31Å; A989-L993 WeakPolarHBondContact O-CG 3.29Å; A989-L993 PolarHBondContact O-N 3.16Å; A989-L993 VanDerWaalsContact O-N 3.1Å; M990-L993 PolarHBondContact O-N 3Å; E991-L993 VanDerWaalsContact C-N 3.3Å; E991-L993 PolarHBondContact O-N 3.32Å; L993-L996 PolarHBondContact O-N 3.02Å; L993-G997 PolarHBondContact O-N 2.94Å; L993-A998 HydrophobicContact CB-CB 4.26Å; L993-A998 HydrophobicContact CD2-CB 4.16Å; L993-A998 WeakPolarHBondContact O-CA 3.4Å; L993-A998 WeakPolarHBondContact O-CB 3.43Å; L993-A998 PolarHBondContact O-N 2.98Å; L993-L999 HydrophobicContact CB-CD1 3.87Å; L993-L999 HydrophobicContact CB-CG 3.88Å; L993-L999 HydrophobicContact CD1-CD1 4.47Å; L993-L999 PolarHBondContact O-N 3.15Å; L993-P1019 HydrophobicContact CD2-CB 3.78Å; L993-P1019 HydrophobicContact CD2-CG 3.72Å
994	Y	88.5	Confident	86.8	Confident	58 Å²	58	32.1 Å²	32.1	23%	0.227	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-48.9	173.7	173	-101.2	0	0	0	111.7	P478 F480 M990 E991 L996 G997	P478-Y994 HydrophobicContact CB-CD1 3.84Å; P478-Y994 HydrophobicContact CB-CE1 3.66Å; P478-Y994 HydrophobicContact CB-CE2 4.49Å; P478-Y994 HydrophobicContact CB-CG 4.34Å; P478-Y994 HydrophobicContact CG-CD1 3.56Å; P478-Y994 HydrophobicContact CG-CE1 3.59Å; P478-Y994 HydrophobicContact CG-CG 4.38Å; F480-Y994 AromaticContact CE1-CD2 3.62Å; F480-Y994 HydrophobicContact CE1-CD2 3.62Å; F480-Y994 HydrophobicContact CE1-CE2 4.08Å; F480-Y994 AromaticContact CE1-CG 3.94Å; F480-Y994 HydrophobicContact CE1-CG 3.94Å; F480-Y994 HydrophobicContact CZ-CD2 4.28Å; F480-Y994 HydrophobicContact CZ-CG 4.22Å; M990-Y994 WeakPolarHBondContact O-CB 3.38Å; M990-Y994 PolarHBondContact O-N 2.84Å; E991-Y994 PolarHBondContact O-N 3.2Å; Y994-L996 PolarHBondContact O-N 3.11Å; Y994-G997 WeakPolarHBondContact O-CA 3.22Å; Y994-G997 PolarHBondContact O-N 3.17Å
995	T	85.5	Confident	87.2	Confident	32 Å²	32	32.5 Å²	32.5	20%	0.196	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-28.5	175.6	50.4	0	0	0	0	112.8	E991 Q992 G997 F1144 F1212	E991-T995 WeakPolarHBondContact O-CG2 3.43Å; E991-T995 PolarHBondContact O-N 3.32Å; E991-T995 PolarHBondContact O-OG1 3.16Å; Q992-T995 WeakPolarHBondContact CA-OG1 3.38Å; Q992-T995 PolarHBondContact O-OG1 2.85Å; Q992-T995 VanDerWaalsContact O-OG1 3.12Å; T995-G997 VanDerWaalsContact C-N 3.28Å; T995-G997 PolarHBondContact O-N 3.06Å; T995-F1144 VanDerWaalsContact O-CZ 3.3Å; T995-F1144 WeakPolarHBondContact O-CZ 3.46Å; T995-F1212 HydrophobicContact CG2-CD2 3.82Å; T995-F1212 HydrophobicContact CG2-CE2 4.32Å
996	L	87.4	Confident	87.6	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-16.7	169.5	-75.9	167.4	0	0	0	114	Q992 L993 Y994 M1012 P1019 M1020 K1023 F1144	Q992-L996 HydrophobicContact CG-CD1 4.25Å; Q992-L996 WeakPolarHBondContact O-CB 3.42Å; Q992-L996 VanDerWaalsContact O-CD1 3.31Å; Q992-L996 WeakPolarHBondContact O-CD1 3.2Å; Q992-L996 WeakPolarHBondContact O-CG 3.41Å; Q992-L996 PolarHBondContact O-N 2.95Å; Q992-L996 VanDerWaalsContact O-N 3.12Å; L993-L996 PolarHBondContact O-N 3.02Å; Y994-L996 PolarHBondContact O-N 3.11Å; L996-M1012 HydrophobicContact CB-CE 4.43Å; L996-M1012 HydrophobicContact CD1-CE 4.47Å; L996-P1019 HydrophobicContact CD1-CB 3.45Å; L996-P1019 VanDerWaalsContact CD1-CB 3.45Å; L996-M1020 HydrophobicContact CD1-CG 4.23Å; L996-M1020 HydrophobicContact CD2-CG 4.15Å; L996-K1023 HydrophobicContact CB-CD 4.29Å; L996-K1023 HydrophobicContact CD2-CB 4.13Å; L996-K1023 HydrophobicContact CD2-CD 3.5Å; L996-K1023 HydrophobicContact CD2-CG 4.45Å; L996-K1023 VanDerWaalsContact O-CD 3.27Å; L996-K1023 WeakPolarHBondContact O-CD 3.35Å; L996-K1023 VanDerWaalsContact O-CE 3.25Å; L996-K1023 WeakPolarHBondContact O-CE 3.48Å; L996-K1023 PolarHBondContact O-NZ 3.11Å; L996-F1144 HydrophobicContact CD2-CE1 3.99Å; L996-F1144 HydrophobicContact CD2-CZ 4.48Å
997	G	87.4	Confident	87.7	Confident	29 Å²	29	43.3 Å²	43.3	30%	0.299	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	16.1	-172.3	0	0	0	0	0	113.9	L993 Y994 T995 T1006	L993-G997 PolarHBondContact O-N 2.94Å; Y994-G997 WeakPolarHBondContact O-CA 3.22Å; Y994-G997 PolarHBondContact O-N 3.17Å; T995-G997 VanDerWaalsContact C-N 3.28Å; T995-G997 PolarHBondContact O-N 3.06Å; G997-T1006 WeakPolarHBondContact O-CG2 3.43Å; G997-T1006 PolarHBondContact O-OG1 2.89Å
998	A	90.8	Very high	87.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-81.2	-31.7	175.4	0	0	0	0	0	112.1	L962 L993 L1005 T1006 M1012	L962-A998 HydrophobicContact CD1-CB 4.3Å; L993-A998 HydrophobicContact CB-CB 4.26Å; L993-A998 HydrophobicContact CD2-CB 4.16Å; L993-A998 WeakPolarHBondContact O-CA 3.4Å; L993-A998 WeakPolarHBondContact O-CB 3.43Å; L993-A998 PolarHBondContact O-N 2.98Å; A998-L1005 WeakPolarHBondContact O-CD1 3.44Å; A998-T1006 PolarHBondContact O-N 2.9Å; A998-T1006 PolarHBondContact O-OG1 2.61Å; A998-M1012 HydrophobicContact CB-CE 3.96Å; A998-M1012 HydrophobicContact CB-SD 3.79Å
999	L	90.8	Very high	88.2	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-106.6	155.9	169.6	-59.6	176.7	0	0	0	111.3	K965 M990 L993 L1004 L1005 T1006	K965-L999 HydrophobicContact CD-CD2 4.45Å; K965-L999 HydrophobicContact CG-CD2 4.32Å; M990-L999 HydrophobicContact CB-CD1 4.32Å; M990-L999 HydrophobicContact CG-CD1 4.48Å; L993-L999 HydrophobicContact CB-CD1 3.87Å; L993-L999 HydrophobicContact CB-CG 3.88Å; L993-L999 HydrophobicContact CD1-CD1 4.47Å; L993-L999 PolarHBondContact O-N 3.15Å; L999-L1004 WeakPolarHBondContact CA-O 3.45Å; L999-L1004 WeakPolarHBondContact CD2-O 3.4Å; L999-L1005 HydrophobicContact CD2-CD1 4.23Å; L999-T1006 VanDerWaalsContact C-CG2 3.46Å
1000	D	88.4	Confident	88.2	Confident	52 Å²	52	51.3 Å²	51.3	28%	0.278	24%	0.244	S	C	.	.			trans	-100	-179.1	171.4	53.2	41.8	0	0	0	112.5	E1002 G1003 L1004 T1006	D1000-E1002 PolarHBondContact O-N 2.76Å; D1000-E1002 VanDerWaalsContact O-N 3.17Å; D1000-E1002 PolarHBondContact OD1-N 2.81Å; D1000-E1002 VanDerWaalsContact OD1-N 3.16Å; D1000-G1003 PolarHBondContact O-N 3.3Å; D1000-G1003 PolarHBondContact OD1-N 3.01Å; D1000-L1004 PolarHBondContact N-O 2.86Å; D1000-L1004 WeakPolarHBondContact OD1-CA 3.41Å; D1000-L1004 WeakPolarHBondContact OD1-CB 3.34Å; D1000-L1004 PolarHBondContact OD1-N 2.92Å; D1000-T1006 HydrophobicContact CB-CG2 4.04Å
1001	D	85.4	Confident	88.2	Confident	100 Å²	100	53.9 Å²	53.9	54%	0.535	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.5	-179.5	-56.6	6.4	0	0	0	113.9	P479 F480	P479-D1001 HydrophobicContact CG-CB 4.3Å; F480-D1001 WeakPolarHBondContact CD1-O 3.06Å
1002	E	83.8	Confident	88.5	Confident	154 Å²	154	51.2 Å²	51.2	72%	0.72	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-3.1	174.3	-61.1	-172.9	175.3	0	0	112.2	D1000 L1004	D1000-E1002 PolarHBondContact O-N 2.76Å; D1000-E1002 VanDerWaalsContact O-N 3.17Å; D1000-E1002 PolarHBondContact OD1-N 2.81Å; D1000-E1002 VanDerWaalsContact OD1-N 3.16Å; E1002-L1004 VanDerWaalsContact C-N 3.3Å; E1002-L1004 HydrophobicContact CB-CD1 4.44Å; E1002-L1004 HydrophobicContact CB-CG 4.31Å
1003	G	83.1	Confident	88.6	Confident	2 Å²	2	51 Å²	51	2%	0.021	24%	0.24	C	C	.	.	S	Bend	trans	73.5	19.4	-175.5	0	0	0	0	0	113.7	K965 D1000	K965-G1003 WeakPolarHBondContact CE-O 3.48Å; K965-G1003 PolarHBondContact NZ-O 3.03Å; D1000-G1003 PolarHBondContact O-N 3.3Å; D1000-G1003 PolarHBondContact OD1-N 3.01Å
1004	L	88.9	Confident	88.4	Confident	59 Å²	59	54.6 Å²	54.6	31%	0.309	26%	0.257	S	S	.	.			trans	-91.4	168.9	172.4	-61.6	177.8	0	0	0	110.8	N970 L999 D1000 E1002	N970-L1004 HydrophobicContact CB-CD2 4.46Å; L999-L1004 WeakPolarHBondContact CA-O 3.45Å; L999-L1004 WeakPolarHBondContact CD2-O 3.4Å; D1000-L1004 PolarHBondContact N-O 2.86Å; D1000-L1004 WeakPolarHBondContact OD1-CA 3.41Å; D1000-L1004 WeakPolarHBondContact OD1-CB 3.34Å; D1000-L1004 PolarHBondContact OD1-N 2.92Å; E1002-L1004 VanDerWaalsContact C-N 3.3Å; E1002-L1004 HydrophobicContact CB-CD1 4.44Å; E1002-L1004 HydrophobicContact CB-CG 4.31Å
1005	L	91.3	Very high	88.3	Confident	32 Å²	32	52.2 Å²	52.2	17%	0.168	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-91.9	115.9	-170.1	-169.8	73.1	0	0	0	112.1	L962 K965 A966 A998 L999 R1010	L962-L1005 HydrophobicContact CD1-CD1 3.58Å; K965-L1005 HydrophobicContact CB-CD1 4.41Å; A966-L1005 HydrophobicContact CB-CD2 3.84Å; A998-L1005 WeakPolarHBondContact O-CD1 3.44Å; L999-L1005 HydrophobicContact CD2-CD1 4.23Å; L1005-R1010 HydrophobicContact CD2-CB 4Å; L1005-R1010 HydrophobicContact CD2-CG 4.47Å; L1005-R1010 HydrophobicContact CG-CB 4.44Å
1006	T	92.3	Very high	88.2	Confident	31 Å²	31	51.8 Å²	51.8	19%	0.19	25%	0.245	C	C	.	.			trans	-68.1	167.4	-178.3	77.7	0	0	0	0	112.4	G997 A998 L999 D1000 L1008 G1009 R1010	G997-T1006 WeakPolarHBondContact O-CG2 3.43Å; G997-T1006 PolarHBondContact O-OG1 2.89Å; A998-T1006 PolarHBondContact O-N 2.9Å; A998-T1006 PolarHBondContact O-OG1 2.61Å; L999-T1006 VanDerWaalsContact C-CG2 3.46Å; D1000-T1006 HydrophobicContact CB-CG2 4.04Å; T1006-L1008 PolarHBondContact O-N 3.47Å; T1006-L1008 PolarHBondContact OG1-N 2.58Å; T1006-L1008 VanDerWaalsContact OG1-N 3.16Å; T1006-G1009 PolarHBondContact O-N 2.98Å; T1006-G1009 VanDerWaalsContact O-N 3.13Å; T1006-G1009 PolarHBondContact OG1-N 2.76Å; T1006-R1010 PolarHBondContact O-N 3.42Å
1007	R	89.1	Confident	88.2	Confident	214 Å²	214	52.3 Å²	52.3	81%	0.808	25%	0.248	S	C	*	.	H	α-helix	trans	-59.5	-26.7	170.7	-168.8	-178.9	69.6	171.8	-0.6	112.6
1008	L	90.1	Very high	88.2	Confident	52 Å²	52	55.2 Å²	55.2	27%	0.272	25%	0.254	S	S	.	.	H	α-helix	trans	-74.9	-50.7	172	177.3	60.3	0	0	0	109.9	T1006 R1010 R1011 M1012 I1026	T1006-L1008 PolarHBondContact O-N 3.47Å; T1006-L1008 PolarHBondContact OG1-N 2.58Å; T1006-L1008 VanDerWaalsContact OG1-N 3.16Å; L1008-R1010 VanDerWaalsContact C-N 3.34Å; L1008-R1010 PolarHBondContact O-N 2.9Å; L1008-R1011 WeakPolarHBondContact O-CB 3.44Å; L1008-R1011 PolarHBondContact O-N 2.79Å; L1008-R1011 VanDerWaalsContact O-N 3.1Å; L1008-M1012 HydrophobicContact CD1-CG 4.29Å; L1008-M1012 HydrophobicContact CD1-SD 4.19Å; L1008-M1012 HydrophobicContact CD2-SD 4.36Å; L1008-M1012 HydrophobicContact CG-CG 4.37Å; L1008-M1012 HydrophobicContact CG-SD 3.73Å; L1008-M1012 VanDerWaalsContact O-CG 3.29Å; L1008-M1012 WeakPolarHBondContact O-CG 3.42Å; L1008-M1012 PolarHBondContact O-N 3.02Å; L1008-I1026 HydrophobicContact CD1-CB 4.22Å; L1008-I1026 HydrophobicContact CD1-CD1 3.88Å; L1008-I1026 HydrophobicContact CD1-CG2 3.71Å
1009	G	91	Very high	88.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-55.7	-42.5	177.8	0	0	0	0	0	113.8	T1006 R1011 M1012 A1013	T1006-G1009 PolarHBondContact O-N 2.98Å; T1006-G1009 VanDerWaalsContact O-N 3.13Å; T1006-G1009 PolarHBondContact OG1-N 2.76Å; G1009-R1011 VanDerWaalsContact C-N 3.34Å; G1009-R1011 PolarHBondContact O-N 3.48Å; G1009-M1012 WeakPolarHBondContact O-CB 3.34Å; G1009-M1012 PolarHBondContact O-N 2.87Å; G1009-M1012 VanDerWaalsContact O-N 3.11Å; G1009-A1013 PolarHBondContact O-N 3.1Å
1010	R	89.1	Confident	88.2	Confident	163 Å²	163	56.1 Å²	56.1	62%	0.615	26%	0.259	S	S	*	.	H	α-helix	trans	-60.7	-41.9	176.6	-169.8	179.3	-71.1	-140.1	-0.8	112.1	L1005 T1006 L1008 A1013	L1005-R1010 HydrophobicContact CD2-CB 4Å; L1005-R1010 HydrophobicContact CD2-CG 4.47Å; L1005-R1010 HydrophobicContact CG-CB 4.44Å; T1006-R1010 PolarHBondContact O-N 3.42Å; L1008-R1010 VanDerWaalsContact C-N 3.34Å; L1008-R1010 PolarHBondContact O-N 2.9Å; R1010-A1013 PolarHBondContact O-N 3.45Å
1011	R	88.6	Confident	88.3	Confident	77 Å²	77	54 Å²	54	29%	0.291	25%	0.247	S	C	.	.	H	α-helix	trans	-65.5	-39	173.2	-72.3	175	167.3	-166.8	-8.6	112.1	L1008 G1009 A1013 E1014 F1015 I1026	L1008-R1011 WeakPolarHBondContact O-CB 3.44Å; L1008-R1011 PolarHBondContact O-N 2.79Å; L1008-R1011 VanDerWaalsContact O-N 3.1Å; G1009-R1011 VanDerWaalsContact C-N 3.34Å; G1009-R1011 PolarHBondContact O-N 3.48Å; R1011-A1013 VanDerWaalsContact C-N 3.32Å; R1011-A1013 PolarHBondContact O-N 2.85Å; R1011-E1014 WeakPolarHBondContact CA-OE2 3.48Å; R1011-E1014 PolarHBondContact O-N 3.49Å; R1011-F1015 WeakPolarHBondContact O-CD2 3.41Å; R1011-I1026 HydrophobicContact CB-CD1 3.86Å
1012	M	90.6	Very high	88.6	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-36.4	179.4	-66.5	166.1	64.7	0	0	112.4	L962 L996 A998 L1008 G1009 E1014 F1015 P1019 C1022 K1023 I1026	L962-M1012 HydrophobicContact CD2-CB 3.96Å; L996-M1012 HydrophobicContact CB-CE 4.43Å; L996-M1012 HydrophobicContact CD1-CE 4.47Å; A998-M1012 HydrophobicContact CB-CE 3.96Å; A998-M1012 HydrophobicContact CB-SD 3.79Å; L1008-M1012 HydrophobicContact CD1-CG 4.29Å; L1008-M1012 HydrophobicContact CD1-SD 4.19Å; L1008-M1012 HydrophobicContact CD2-SD 4.36Å; L1008-M1012 HydrophobicContact CG-CG 4.37Å; L1008-M1012 HydrophobicContact CG-SD 3.73Å; L1008-M1012 VanDerWaalsContact O-CG 3.29Å; L1008-M1012 WeakPolarHBondContact O-CG 3.42Å; L1008-M1012 PolarHBondContact O-N 3.02Å; G1009-M1012 WeakPolarHBondContact O-CB 3.34Å; G1009-M1012 PolarHBondContact O-N 2.87Å; G1009-M1012 VanDerWaalsContact O-N 3.11Å; M1012-E1014 VanDerWaalsContact C-N 3.29Å; M1012-E1014 PolarHBondContact O-N 2.92Å; M1012-F1015 PolarHBondContact O-N 3.17Å; M1012-P1019 HydrophobicContact CE-CB 3.88Å; M1012-P1019 WeakPolarHBondContact CE-O 3.29Å; M1012-C1022 HydrophobicContact CB-CB 3.76Å; M1012-C1022 HydrophobicContact CE-CB 4.23Å; M1012-C1022 HydrophobicContact CG-CB 3.76Å; M1012-C1022 PolarHBondContact O-SG 2.78Å; M1012-K1023 HydrophobicContact CE-CB 4.27Å; M1012-I1026 HydrophobicContact CG-CD1 3.68Å
1013	A	88.9	Confident	88.9	Confident	9 Å²	9	42.7 Å²	42.7	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-68.8	-22.6	179.8	0	0	0	0	0	114	L962 A966 G1009 R1010 R1011	L962-A1013 HydrophobicContact CD1-CB 4.23Å; L962-A1013 HydrophobicContact CD2-CB 4.48Å; L962-A1013 HydrophobicContact CG-CB 3.95Å; A966-A1013 HydrophobicContact CB-CB 3.51Å; G1009-A1013 PolarHBondContact O-N 3.1Å; R1010-A1013 PolarHBondContact O-N 3.45Å; R1011-A1013 VanDerWaalsContact C-N 3.32Å; R1011-A1013 PolarHBondContact O-N 2.85Å
1014	E	84.9	Confident	89.3	Confident	74 Å²	74	42.6 Å²	42.6	35%	0.346	19%	0.19	S	C	.	.	H	α-helix	trans	-75	-27.2	-180	-66.7	169.4	130.1	0	0	111.8	R700 R1011 M1012 H1121	R700-E1014 PolarHBondContact NH2-O 3.31Å; R1011-E1014 WeakPolarHBondContact CA-OE2 3.48Å; R1011-E1014 PolarHBondContact O-N 3.49Å; M1012-E1014 VanDerWaalsContact C-N 3.29Å; M1012-E1014 PolarHBondContact O-N 2.92Å; E1014-H1121 IonicContact OE1-CE1 2.94Å; E1014-H1121 PolarHBondContact OE1-CE1 3.44Å; E1014-H1121 IonicContact OE1-ND1 3.3Å; E1014-H1121 IonicContact OE2-CE1 2.67Å; E1014-H1121 PolarHBondContact OE2-CE1 2.91Å; E1014-H1121 IonicContact OE2-ND1 3Å; E1014-H1121 PolarHBondContact OE2-ND1 3.22Å; E1014-H1121 IonicContact OE2-NE2 2.73Å
1015	F	86.9	Confident	89.4	Confident	8 Å²	8	39.8 Å²	39.8	4%	0.035	18%	0.175	C	C	.	.	S	Bend	trans	-81.3	141.3	175.6	-66.3	-83.6	0	0	0	112	R1011 M1012 L1017 L1025 I1026 M1114 I1117 M1118 L1123	R1011-F1015 WeakPolarHBondContact O-CD2 3.41Å; M1012-F1015 PolarHBondContact O-N 3.17Å; F1015-L1017 HydrophobicContact CB-CD1 4.32Å; F1015-L1017 HydrophobicContact CB-CG 4.4Å; F1015-L1017 PolarHBondContact O-N 2.98Å; F1015-L1025 HydrophobicContact CD1-CD2 4.06Å; F1015-L1025 HydrophobicContact CE1-CD2 3.76Å; F1015-L1025 HydrophobicContact CZ-CD2 4.25Å; F1015-I1026 HydrophobicContact CE2-CD1 4.27Å; F1015-I1026 HydrophobicContact CE2-CG1 4.22Å; F1015-M1114 HydrophobicContact CD1-SD 4.01Å; F1015-I1117 HydrophobicContact CD1-CB 4.21Å; F1015-I1117 HydrophobicContact CD1-CD1 4.25Å; F1015-I1117 HydrophobicContact CD1-CG2 3.66Å; F1015-I1117 HydrophobicContact CE1-CB 3.89Å; F1015-I1117 HydrophobicContact CE1-CG2 3.38Å; F1015-I1117 HydrophobicContact CE2-CG2 4.43Å; F1015-I1117 HydrophobicContact CG-CG2 4.31Å; F1015-I1117 HydrophobicContact CZ-CG2 3.8Å; F1015-M1118 HydrophobicContact CE1-CG 4.08Å; F1015-M1118 HydrophobicContact CZ-CG 4.13Å; F1015-L1123 HydrophobicContact CZ-CD1 4.14Å
1016	P	84.4	Confident	89.4	Confident	23 Å²	23	38.5 Å²	38.5	15%	0.149	17%	0.169	C	C	.	.	S	Bend	trans	-81.9	31.1	179	35.6	-32.3	0	0	0	113	R679 R700 M1114	R679-P1016 PolarHBondContact NH1-O 3.12Å; R679-P1016 PolarHBondContact NH2-O 3.13Å; R700-P1016 VanDerWaalsContact NH2-CD 3.28Å; P1016-M1114 HydrophobicContact CG-CE 3.45Å; P1016-M1114 VanDerWaalsContact CG-CE 3.45Å; P1016-M1114 HydrophobicContact CG-SD 4.09Å
1017	L	86.4	Confident	89.2	Confident	14 Å²	14	39.4 Å²	39.4	7%	0.073	17%	0.171	C	C	.	.	S	Bend	trans	-112.5	168.4	-170.2	-58	169.3	0	0	0	109.9	F1015 L1021 L1025 V1041 S1045 M1114	F1015-L1017 HydrophobicContact CB-CD1 4.32Å; F1015-L1017 HydrophobicContact CB-CG 4.4Å; F1015-L1017 PolarHBondContact O-N 2.98Å; L1017-L1021 HydrophobicContact CB-CB 4.09Å; L1017-L1025 HydrophobicContact CD1-CD2 4.27Å; L1017-V1041 HydrophobicContact CD1-CG1 3.47Å; L1017-V1041 VanDerWaalsContact CD1-CG1 3.47Å; L1017-V1041 HydrophobicContact CD2-CG1 4.03Å; L1017-V1041 HydrophobicContact CG-CG1 4.38Å; L1017-S1045 WeakPolarHBondContact CD2-OG 3.39Å; L1017-M1114 HydrophobicContact CD1-CG 4.45Å; L1017-M1114 HydrophobicContact CD1-SD 3.83Å; L1017-M1114 HydrophobicContact CD2-SD 4.35Å; L1017-M1114 HydrophobicContact CG-SD 4.05Å
1018	E	87.6	Confident	89.3	Confident	91 Å²	91	29.2 Å²	29.2	43%	0.425	13%	0.133	S	C	.	.			trans	-67.8	147.3	171.8	-60.3	-170.4	158.8	0	0	110.5	M1020 L1021 C1022	E1018-M1020 PolarHBondContact O-N 2.87Å; E1018-M1020 VanDerWaalsContact O-N 3.09Å; E1018-L1021 HydrophobicContact CB-CD1 4.26Å; E1018-L1021 HydrophobicContact CB-CG 4.41Å; E1018-L1021 HydrophobicContact CG-CD1 4.45Å; E1018-L1021 WeakPolarHBondContact O-CA 3.31Å; E1018-L1021 WeakPolarHBondContact O-CB 3.45Å; E1018-L1021 PolarHBondContact O-N 2.86Å; E1018-C1022 PolarHBondContact O-N 3.42Å; E1018-C1022 PolarHBondContact O-SG 2.89Å; E1018-C1022 VanDerWaalsContact O-SG 3.41Å
1019	P	90.7	Very high	89.3	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.032	13%	0.129	C	C	.	.	H	α-helix	trans	-51.7	-36.6	-178.9	-30.3	36.9	0	0	0	114.3	A958 L962 L993 L996 M1012 C1022 K1023	A958-P1019 HydrophobicContact CB-CG 4.28Å; L962-P1019 HydrophobicContact CD2-CB 4.35Å; L962-P1019 HydrophobicContact CD2-CG 3.94Å; L993-P1019 HydrophobicContact CD2-CB 3.78Å; L993-P1019 HydrophobicContact CD2-CG 3.72Å; L996-P1019 HydrophobicContact CD1-CB 3.45Å; L996-P1019 VanDerWaalsContact CD1-CB 3.45Å; M1012-P1019 HydrophobicContact CE-CB 3.88Å; M1012-P1019 WeakPolarHBondContact CE-O 3.29Å; P1019-C1022 PolarHBondContact O-N 2.9Å; P1019-K1023 PolarHBondContact O-N 3.29Å
1020	M	90.6	Very high	89.1	Confident	18 Å²	18	34.9 Å²	34.9	9%	0.089	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-45.1	176	-63.5	177.4	-67.7	0	0	112	L996 E1018 K1023 M1024 G1142 F1143	L996-M1020 HydrophobicContact CD1-CG 4.23Å; L996-M1020 HydrophobicContact CD2-CG 4.15Å; E1018-M1020 PolarHBondContact O-N 2.87Å; E1018-M1020 VanDerWaalsContact O-N 3.09Å; M1020-K1023 PolarHBondContact O-N 3.27Å; M1020-M1024 WeakPolarHBondContact O-CB 3.3Å; M1020-M1024 PolarHBondContact O-N 2.77Å; M1020-G1142 WeakPolarHBondContact CB-O 3.42Å; M1020-F1143 HydrophobicContact CB-CD1 4.03Å; M1020-F1143 HydrophobicContact CB-CE1 3.71Å; M1020-F1143 HydrophobicContact CB-CZ 4Å; M1020-F1143 HydrophobicContact CE-CD1 4.5Å; M1020-F1143 HydrophobicContact CE-CE1 4.04Å; M1020-F1143 HydrophobicContact CG-CE1 4.46Å; M1020-F1143 HydrophobicContact SD-CD1 3.95Å; M1020-F1143 HydrophobicContact SD-CE1 4.04Å
1021	L	91.6	Very high	89	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-65.2	-37.7	174.1	-65.4	173	0	0	0	111.9	L1017 E1018 M1024 L1025 L1044 F1143	L1017-L1021 HydrophobicContact CB-CB 4.09Å; E1018-L1021 HydrophobicContact CB-CD1 4.26Å; E1018-L1021 HydrophobicContact CB-CG 4.41Å; E1018-L1021 HydrophobicContact CG-CD1 4.45Å; E1018-L1021 WeakPolarHBondContact O-CA 3.31Å; E1018-L1021 WeakPolarHBondContact O-CB 3.45Å; E1018-L1021 PolarHBondContact O-N 2.86Å; L1021-M1024 HydrophobicContact CD2-CE 3.56Å; L1021-L1025 WeakPolarHBondContact O-CB 3.25Å; L1021-L1025 PolarHBondContact O-N 2.87Å; L1021-L1044 HydrophobicContact CD2-CD1 3.68Å; L1021-F1143 HydrophobicContact CD2-CE2 3.83Å; L1021-F1143 HydrophobicContact CD2-CZ 3.65Å; L1021-F1143 HydrophobicContact CG-CZ 4.09Å
1022	C	91.2	Very high	89	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-46	174.6	-64.2	0	0	0	0	111.8	M1012 E1018 P1019 L1025 I1026	M1012-C1022 HydrophobicContact CB-CB 3.76Å; M1012-C1022 HydrophobicContact CE-CB 4.23Å; M1012-C1022 HydrophobicContact CG-CB 3.76Å; M1012-C1022 PolarHBondContact O-SG 2.78Å; E1018-C1022 PolarHBondContact O-N 3.42Å; E1018-C1022 PolarHBondContact O-SG 2.89Å; E1018-C1022 VanDerWaalsContact O-SG 3.41Å; P1019-C1022 PolarHBondContact O-N 2.9Å; C1022-L1025 PolarHBondContact O-N 3.21Å; C1022-I1026 VanDerWaalsContact O-CG1 3.32Å; C1022-I1026 WeakPolarHBondContact O-CG1 3.48Å; C1022-I1026 PolarHBondContact O-N 2.82Å
1023	K	90.5	Very high	89	Confident	16 Å²	16	26.2 Å²	26.2	7%	0.07	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-46.7	177.7	-173.9	177.8	-177.9	-171.6	0	110.9	L996 M1012 P1019 M1020 L1025 I1026 M1027 S1141 F1144	L996-K1023 HydrophobicContact CB-CD 4.29Å; L996-K1023 HydrophobicContact CD2-CB 4.13Å; L996-K1023 HydrophobicContact CD2-CD 3.5Å; L996-K1023 HydrophobicContact CD2-CG 4.45Å; L996-K1023 VanDerWaalsContact O-CD 3.27Å; L996-K1023 WeakPolarHBondContact O-CD 3.35Å; L996-K1023 VanDerWaalsContact O-CE 3.25Å; L996-K1023 WeakPolarHBondContact O-CE 3.48Å; L996-K1023 PolarHBondContact O-NZ 3.11Å; M1012-K1023 HydrophobicContact CE-CB 4.27Å; P1019-K1023 PolarHBondContact O-N 3.29Å; M1020-K1023 PolarHBondContact O-N 3.27Å; K1023-L1025 PolarHBondContact O-N 3.4Å; K1023-I1026 PolarHBondContact O-N 3.4Å; K1023-M1027 WeakPolarHBondContact O-CB 3.37Å; K1023-M1027 PolarHBondContact O-N 3.43Å; K1023-S1141 WeakPolarHBondContact CD-O 3.36Å; K1023-S1141 WeakPolarHBondContact CE-O 3.46Å; K1023-S1141 PolarHBondContact NZ-O 2.81Å; K1023-F1144 HydrophobicContact CD-CE1 4.48Å
1024	M	91.6	Very high	89	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-45.8	175.7	-180	170.5	78.6	0	0	112.5	M1020 L1021 S1028 M1037 V1041 L1044 I1139 F1143	M1020-M1024 WeakPolarHBondContact O-CB 3.3Å; M1020-M1024 PolarHBondContact O-N 2.77Å; L1021-M1024 HydrophobicContact CD2-CE 3.56Å; M1024-S1028 PolarHBondContact O-N 3.01Å; M1024-M1037 HydrophobicContact CE-SD 3.62Å; M1024-M1037 HydrophobicContact CG-CE 3.76Å; M1024-M1037 HydrophobicContact CG-CG 3.89Å; M1024-M1037 HydrophobicContact CG-SD 3.45Å; M1024-M1037 WeakPolarHBondContact CG-SD 3.27Å; M1024-M1037 HydrophobicContact SD-CE 4.07Å; M1024-M1037 HydrophobicContact SD-SD 3.58Å; M1024-V1041 HydrophobicContact CE-CG2 3.46Å; M1024-V1041 VanDerWaalsContact CE-CG2 3.46Å; M1024-L1044 HydrophobicContact CE-CD1 4.15Å; M1024-I1139 HydrophobicContact SD-CB 4.14Å; M1024-I1139 HydrophobicContact SD-CG1 3.76Å; M1024-I1139 HydrophobicContact SD-CG2 4.43Å; M1024-F1143 HydrophobicContact CE-CE2 3.97Å; M1024-F1143 HydrophobicContact SD-CD2 3.99Å; M1024-F1143 HydrophobicContact SD-CE2 3.81Å
1025	L	90.9	Very high	89.3	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-44.3	178	-173.4	61.4	0	0	0	112.1	F1015 L1017 L1021 C1022 K1023 S1028 L1038 V1041 M1118	F1015-L1025 HydrophobicContact CD1-CD2 4.06Å; F1015-L1025 HydrophobicContact CE1-CD2 3.76Å; F1015-L1025 HydrophobicContact CZ-CD2 4.25Å; L1017-L1025 HydrophobicContact CD1-CD2 4.27Å; L1021-L1025 WeakPolarHBondContact O-CB 3.25Å; L1021-L1025 PolarHBondContact O-N 2.87Å; C1022-L1025 PolarHBondContact O-N 3.21Å; K1023-L1025 PolarHBondContact O-N 3.4Å; L1025-S1028 PolarHBondContact O-N 3.13Å; L1025-S1028 PolarHBondContact O-OG 3.19Å; L1025-L1038 HydrophobicContact CD1-CB 4.25Å; L1025-L1038 HydrophobicContact CD1-CD1 4.25Å; L1025-V1041 HydrophobicContact CB-CG2 4.47Å; L1025-M1118 HydrophobicContact CD1-SD 4.02Å; L1025-M1118 HydrophobicContact CD2-SD 4.31Å; L1025-M1118 HydrophobicContact CG-SD 4.25Å
1026	I	90.6	Very high	89.5	Confident	5 Å²	5	25 Å²	25	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-68.2	-39.6	179.5	-64.7	166.6	0	0	0	111	L1008 R1011 M1012 F1015 C1022 K1023 S1028 V1029 H1030	L1008-I1026 HydrophobicContact CD1-CB 4.22Å; L1008-I1026 HydrophobicContact CD1-CD1 3.88Å; L1008-I1026 HydrophobicContact CD1-CG2 3.71Å; R1011-I1026 HydrophobicContact CB-CD1 3.86Å; M1012-I1026 HydrophobicContact CG-CD1 3.68Å; F1015-I1026 HydrophobicContact CE2-CD1 4.27Å; F1015-I1026 HydrophobicContact CE2-CG1 4.22Å; C1022-I1026 VanDerWaalsContact O-CG1 3.32Å; C1022-I1026 WeakPolarHBondContact O-CG1 3.48Å; C1022-I1026 PolarHBondContact O-N 2.82Å; K1023-I1026 PolarHBondContact O-N 3.4Å; I1026-S1028 VanDerWaalsContact C-N 3.31Å; I1026-S1028 PolarHBondContact O-N 3.36Å; I1026-V1029 WeakPolarHBondContact O-CB 3.38Å; I1026-V1029 PolarHBondContact O-N 2.54Å; I1026-H1030 PolarHBondContact O-CD2 3.14Å
1027	M	88.3	Confident	89.9	Confident	50 Å²	50	24 Å²	24	25%	0.246	12%	0.121	C	C	.	.	H	α-helix	trans	-66.2	-32.4	176.1	-167	62.3	74.6	0	0	112.4	K1023 V1029 H1030 L1031 S1141	K1023-M1027 WeakPolarHBondContact O-CB 3.37Å; K1023-M1027 PolarHBondContact O-N 3.43Å; M1027-V1029 PolarHBondContact O-N 2.91Å; M1027-H1030 WeakPolarHBondContact O-CB 3.47Å; M1027-H1030 PolarHBondContact O-N 3.04Å; M1027-H1030 HydrophobicContact SD-CB 4.16Å; M1027-L1031 HydrophobicContact CG-CD1 3.94Å; M1027-L1031 HydrophobicContact CG-CG 4.38Å; M1027-L1031 PolarHBondContact O-N 2.96Å; M1027-S1141 WeakPolarHBondContact CB-OG 3.42Å; M1027-S1141 WeakPolarHBondContact CG-OG 3.49Å
1028	S	90.6	Very high	90.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.6	-25.2	176.4	77.8	0	0	0	0	114.2	M1024 L1025 I1026 G1032 C1033 M1037	M1024-S1028 PolarHBondContact O-N 3.01Å; L1025-S1028 PolarHBondContact O-N 3.13Å; L1025-S1028 PolarHBondContact O-OG 3.19Å; I1026-S1028 VanDerWaalsContact C-N 3.31Å; I1026-S1028 PolarHBondContact O-N 3.36Å; S1028-G1032 PolarHBondContact O-N 3.45Å; S1028-C1033 PolarHBondContact O-N 3.22Å; S1028-M1037 VanDerWaalsContact CB-CB 3.41Å; S1028-M1037 WeakPolarHBondContact OG-CB 3.44Å
1029	V	89.8	Confident	90.4	Very high	31 Å²	31	19 Å²	19	19%	0.188	10%	0.098	C	C	.	.	H	α-helix	trans	-70.5	-42	173.2	-176.4	0	0	0	0	110.4	I1026 M1027 L1031 G1032 M1118 L1123	I1026-V1029 WeakPolarHBondContact O-CB 3.38Å; I1026-V1029 PolarHBondContact O-N 2.54Å; M1027-V1029 PolarHBondContact O-N 2.91Å; V1029-L1031 VanDerWaalsContact C-N 3.32Å; V1029-L1031 PolarHBondContact O-N 3.47Å; V1029-G1032 PolarHBondContact O-N 2.78Å; V1029-M1118 HydrophobicContact CG2-CE 3.59Å; V1029-L1123 HydrophobicContact CG1-CB 4.44Å; V1029-L1123 HydrophobicContact CG1-CD2 4.46Å; V1029-L1123 HydrophobicContact CG2-CB 4.09Å
1030	H	87.7	Confident	90.5	Very high	139 Å²	139	18.8 Å²	18.8	64%	0.644	10%	0.096	S	C	*	.	H	α-helix	trans	-68.4	-29.5	175.9	-69.8	-75.9	0	0	0	112.9	I1026 M1027	I1026-H1030 PolarHBondContact O-CD2 3.14Å; M1027-H1030 WeakPolarHBondContact O-CB 3.47Å; M1027-H1030 PolarHBondContact O-N 3.04Å; M1027-H1030 HydrophobicContact SD-CB 4.16Å
1031	L	87.6	Confident	90.6	Very high	42 Å²	42	17.9 Å²	17.9	22%	0.22	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-2.5	177.6	-66.6	170.1	0	0	0	114	M1027 V1029 K1137 A1138 F1208	M1027-L1031 HydrophobicContact CG-CD1 3.94Å; M1027-L1031 HydrophobicContact CG-CG 4.38Å; M1027-L1031 PolarHBondContact O-N 2.96Å; V1029-L1031 VanDerWaalsContact C-N 3.32Å; V1029-L1031 PolarHBondContact O-N 3.47Å; L1031-K1137 HydrophobicContact CD1-CB 4.18Å; L1031-A1138 HydrophobicContact CD1-CB 3.85Å; L1031-F1208 HydrophobicContact CD1-CZ 4.31Å
1032	G	87.6	Confident	90.7	Very high	17 Å²	17	17.6 Å²	17.6	18%	0.175	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	35.5	179.2	0	0	0	0	0	114.5	S1028 V1029	S1028-G1032 PolarHBondContact O-N 3.45Å; V1029-G1032 PolarHBondContact O-N 2.78Å
1033	C	90.6	Very high	90.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.			trans	-130	34.5	-179.4	67.6	0	0	0	0	112.2	S1028 M1037 V1126 C1128 R1134 V1135	S1028-C1033 PolarHBondContact O-N 3.22Å; C1033-M1037 WeakPolarHBondContact O-CB 3.39Å; C1033-M1037 PolarHBondContact O-N 3.5Å; C1033-M1037 VanDerWaalsContact O-N 3.09Å; C1033-V1126 CarbonylContact C-O 3.45Å; C1033-C1128 HydrophobicContact CB-CB 3.65Å; C1033-C1128 VanDerWaalsContact CB-SG 3.53Å; C1033-R1134 HydrophobicContact CB-CB 4.33Å; C1033-V1135 HydrophobicContact CB-CG2 4.19Å
1034	S	89.8	Confident	90.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-76.1	-27.8	-170.7	34.5	0	0	0	0	114.3	L1038 D1124 V1125 V1126	S1034-L1038 WeakPolarHBondContact O-CB 3.25Å; S1034-L1038 PolarHBondContact O-N 3.35Å; S1034-D1124 PolarHBondContact OG-O 3.36Å; S1034-V1125 WeakPolarHBondContact OG-CA 3.43Å; S1034-V1126 PolarHBondContact N-O 3.42Å; S1034-V1126 PolarHBondContact OG-N 3.15Å; S1034-V1126 PolarHBondContact OG-O 3.48Å
1035	E	90.7	Very high	90.5	Very high	51 Å²	51	19.3 Å²	19.3	24%	0.238	10%	0.102	C	C	.	.	H	α-helix	trans	-67.6	-45	171.3	170.2	158.5	-158.1	0	0	111.7	T1039 K1085 R1111 V1125 V1126	E1035-T1039 WeakPolarHBondContact O-CB 3.08Å; E1035-T1039 PolarHBondContact O-N 2.97Å; E1035-T1039 PolarHBondContact O-OG1 3.23Å; E1035-K1085 IonicContact OE1-NZ 2.64Å; E1035-K1085 PolarHBondContact OE1-NZ 2.81Å; E1035-R1111 VanDerWaalsContact CD-NH2 3.32Å; E1035-R1111 IonicContact OE1-CZ 2.95Å; E1035-R1111 IonicContact OE1-NH2 3.54Å; E1035-R1111 PolarHBondContact OE1-NH2 2.89Å; E1035-V1125 HydrophobicContact CB-CG1 4.19Å; E1035-V1126 PolarHBondContact N-O 3.43Å
1036	E	91.4	Very high	90.2	Very high	16 Å²	16	20 Å²	20	8%	0.075	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-47.5	178.9	-66.3	75.3	-163	0	0	110.2	T1039 I1040 L1078 S1127 C1128 G1129 V1135	E1036-T1039 WeakPolarHBondContact O-CB 3.49Å; E1036-T1039 PolarHBondContact O-N 3.46Å; E1036-T1039 VanDerWaalsContact O-N 3.16Å; E1036-I1040 WeakPolarHBondContact O-CG1 3.04Å; E1036-I1040 PolarHBondContact O-N 3.48Å; E1036-L1078 HydrophobicContact CB-CD1 4.49Å; E1036-L1078 HydrophobicContact CB-CD2 3.93Å; E1036-L1078 HydrophobicContact CG-CD2 3.9Å; E1036-S1127 WeakPolarHBondContact OE1-CA 3.45Å; E1036-S1127 VanDerWaalsContact OE1-CB 3.31Å; E1036-S1127 WeakPolarHBondContact OE1-CB 3.34Å; E1036-S1127 PolarHBondContact OE1-OG 3.23Å; E1036-S1127 WeakPolarHBondContact OE2-CA 3.45Å; E1036-C1128 VanDerWaalsContact CD-SG 3.5Å; E1036-C1128 PolarHBondContact OE1-N 3.28Å; E1036-C1128 VanDerWaalsContact OE1-N 3.13Å; E1036-C1128 PolarHBondContact OE2-N 3.29Å; E1036-C1128 PolarHBondContact OE2-SG 3.08Å; E1036-G1129 PolarHBondContact OE1-N 3.48Å; E1036-V1135 HydrophobicContact CB-CG2 4.02Å; E1036-V1135 HydrophobicContact CG-CG2 4.38Å
1037	M	92.4	Very high	89.4	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-41.1	-176.3	-164.8	53.7	73.7	0	0	113.1	M1024 S1028 C1033 T1039 I1040 V1041 V1135 A1138 I1139	M1024-M1037 HydrophobicContact CE-SD 3.62Å; M1024-M1037 HydrophobicContact CG-CE 3.76Å; M1024-M1037 HydrophobicContact CG-CG 3.89Å; M1024-M1037 HydrophobicContact CG-SD 3.45Å; M1024-M1037 WeakPolarHBondContact CG-SD 3.27Å; M1024-M1037 HydrophobicContact SD-CE 4.07Å; M1024-M1037 HydrophobicContact SD-SD 3.58Å; S1028-M1037 VanDerWaalsContact CB-CB 3.41Å; S1028-M1037 WeakPolarHBondContact OG-CB 3.44Å; C1033-M1037 WeakPolarHBondContact O-CB 3.39Å; C1033-M1037 PolarHBondContact O-N 3.5Å; C1033-M1037 VanDerWaalsContact O-N 3.09Å; M1037-T1039 PolarHBondContact O-N 3.49Å; M1037-I1040 PolarHBondContact O-N 2.84Å; M1037-I1040 VanDerWaalsContact O-N 3.16Å; M1037-I1040 HydrophobicContact SD-CB 4.17Å; M1037-I1040 HydrophobicContact SD-CD1 4.49Å; M1037-I1040 HydrophobicContact SD-CG2 4.24Å; M1037-V1041 HydrophobicContact CG-CG2 4.2Å; M1037-V1041 WeakPolarHBondContact O-CB 3.13Å; M1037-V1041 VanDerWaalsContact O-CG2 3.29Å; M1037-V1041 WeakPolarHBondContact O-CG2 3.48Å; M1037-V1041 PolarHBondContact O-N 2.94Å; M1037-V1041 HydrophobicContact SD-CG2 4.37Å; M1037-V1135 HydrophobicContact CE-CG1 3.74Å; M1037-V1135 WeakPolarHBondContact CE-O 3.34Å; M1037-A1138 HydrophobicContact CE-CB 3.48Å; M1037-A1138 VanDerWaalsContact CE-CB 3.48Å; M1037-I1139 HydrophobicContact CE-CG1 3.73Å; M1037-I1139 HydrophobicContact SD-CG1 4.46Å
1038	L	92.3	Very high	88.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-53.8	-38.6	171.8	-177.6	72.4	0	0	0	111.3	L1025 S1034 S1042 R1111 M1114 L1115 M1118	L1025-L1038 HydrophobicContact CD1-CB 4.25Å; L1025-L1038 HydrophobicContact CD1-CD1 4.25Å; S1034-L1038 WeakPolarHBondContact O-CB 3.25Å; S1034-L1038 PolarHBondContact O-N 3.35Å; L1038-S1042 VanDerWaalsContact O-CB 3.31Å; L1038-S1042 WeakPolarHBondContact O-CB 3.41Å; L1038-S1042 PolarHBondContact O-N 3.16Å; L1038-S1042 PolarHBondContact O-OG 2.93Å; L1038-R1111 HydrophobicContact CD2-CG 3.9Å; L1038-R1111 HydrophobicContact CG-CG 3.79Å; L1038-M1114 HydrophobicContact CD1-CB 3.34Å; L1038-M1114 HydrophobicContact CD1-CG 4.47Å; L1038-L1115 HydrophobicContact CD2-CB 4.14Å; L1038-L1115 HydrophobicContact CD2-CD1 4.04Å; L1038-M1118 HydrophobicContact CD1-SD 3.87Å
1039	T	92.6	Very high	88.6	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-72.9	-43.1	178.7	-54.1	0	0	0	0	111.7	E1035 E1036 M1037 S1042 M1043 L1078 Y1081 R1111	E1035-T1039 WeakPolarHBondContact O-CB 3.08Å; E1035-T1039 PolarHBondContact O-N 2.97Å; E1035-T1039 PolarHBondContact O-OG1 3.23Å; E1036-T1039 WeakPolarHBondContact O-CB 3.49Å; E1036-T1039 PolarHBondContact O-N 3.46Å; E1036-T1039 VanDerWaalsContact O-N 3.16Å; M1037-T1039 PolarHBondContact O-N 3.49Å; T1039-S1042 PolarHBondContact O-N 3.07Å; T1039-M1043 VanDerWaalsContact O-CG 3.29Å; T1039-M1043 WeakPolarHBondContact O-CG 3.43Å; T1039-M1043 PolarHBondContact O-N 2.87Å; T1039-M1043 VanDerWaalsContact O-N 3.1Å; T1039-L1078 HydrophobicContact CG2-CD1 3.77Å; T1039-Y1081 HydrophobicContact CG2-CD1 3.3Å; T1039-Y1081 HydrophobicContact CG2-CD2 4.35Å; T1039-Y1081 HydrophobicContact CG2-CE1 3.84Å; T1039-Y1081 HydrophobicContact CG2-CG 3.59Å; T1039-R1111 PolarHBondContact OG1-NE 3.31Å
1040	I	93	Very high	88.4	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-52.9	176.4	-70.3	168.9	0	0	0	111.2	E1036 M1037 S1042 M1043 L1044 H1074 L1078 V1135	E1036-I1040 WeakPolarHBondContact O-CG1 3.04Å; E1036-I1040 PolarHBondContact O-N 3.48Å; M1037-I1040 PolarHBondContact O-N 2.84Å; M1037-I1040 VanDerWaalsContact O-N 3.16Å; M1037-I1040 HydrophobicContact SD-CB 4.17Å; M1037-I1040 HydrophobicContact SD-CD1 4.49Å; M1037-I1040 HydrophobicContact SD-CG2 4.24Å; I1040-S1042 PolarHBondContact O-N 3.04Å; I1040-M1043 PolarHBondContact O-N 3.42Å; I1040-L1044 HydrophobicContact CG2-CD1 4.18Å; I1040-L1044 HydrophobicContact CG2-CG 4.34Å; I1040-L1044 WeakPolarHBondContact O-CG 3.37Å; I1040-L1044 PolarHBondContact O-N 3.46Å; I1040-H1074 HydrophobicContact CD1-CB 4.49Å; I1040-H1074 HydrophobicContact CG2-CB 4.15Å; I1040-L1078 HydrophobicContact CD1-CB 4.41Å; I1040-L1078 HydrophobicContact CD1-CD2 4.37Å; I1040-L1078 HydrophobicContact CG1-CB 4.06Å; I1040-V1135 HydrophobicContact CD1-CG1 3.47Å; I1040-V1135 VanDerWaalsContact CD1-CG1 3.47Å
1041	V	92.9	Very high	88.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-52.5	-40.3	175.8	168.9	0	0	0	0	111.7	L1017 M1024 L1025 M1037 M1043 S1045	L1017-V1041 HydrophobicContact CD1-CG1 3.47Å; L1017-V1041 VanDerWaalsContact CD1-CG1 3.47Å; L1017-V1041 HydrophobicContact CD2-CG1 4.03Å; L1017-V1041 HydrophobicContact CG-CG1 4.38Å; M1024-V1041 HydrophobicContact CE-CG2 3.46Å; M1024-V1041 VanDerWaalsContact CE-CG2 3.46Å; L1025-V1041 HydrophobicContact CB-CG2 4.47Å; M1037-V1041 HydrophobicContact CG-CG2 4.2Å; M1037-V1041 WeakPolarHBondContact O-CB 3.13Å; M1037-V1041 VanDerWaalsContact O-CG2 3.29Å; M1037-V1041 WeakPolarHBondContact O-CG2 3.48Å; M1037-V1041 PolarHBondContact O-N 2.94Å; M1037-V1041 HydrophobicContact SD-CG2 4.37Å; V1041-M1043 VanDerWaalsContact C-N 3.34Å; V1041-S1045 VanDerWaalsContact O-CB 3.3Å; V1041-S1045 WeakPolarHBondContact O-CB 3.3Å; V1041-S1045 PolarHBondContact O-N 2.75Å; V1041-S1045 PolarHBondContact O-OG 2.9Å
1042	S	92.4	Very high	87.7	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-71.6	-26.2	179.2	-58.6	0	0	0	0	113.8	L1038 T1039 I1040 V1046 A1107 R1111	L1038-S1042 VanDerWaalsContact O-CB 3.31Å; L1038-S1042 WeakPolarHBondContact O-CB 3.41Å; L1038-S1042 PolarHBondContact O-N 3.16Å; L1038-S1042 PolarHBondContact O-OG 2.93Å; T1039-S1042 PolarHBondContact O-N 3.07Å; I1040-S1042 PolarHBondContact O-N 3.04Å; S1042-V1046 WeakPolarHBondContact O-CG2 3.44Å; S1042-A1107 WeakPolarHBondContact CB-O 3.48Å; S1042-A1107 WeakPolarHBondContact O-CB 3.38Å; S1042-R1111 WeakPolarHBondContact OG-CA 3.38Å; S1042-R1111 WeakPolarHBondContact OG-CB 3.48Å; S1042-R1111 PolarHBondContact OG-N 3.44Å
1043	M	91.1	Very high	86.9	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.015	15%	0.153	C	C	.	.	H	α-helix	trans	-81.9	-40.4	175.1	-69	-74.7	-77.8	0	0	111.8	T1039 I1040 V1041 S1045 V1046 V1049 L1077 V1080 Y1081 L1104 A1107	T1039-M1043 VanDerWaalsContact O-CG 3.29Å; T1039-M1043 WeakPolarHBondContact O-CG 3.43Å; T1039-M1043 PolarHBondContact O-N 2.87Å; T1039-M1043 VanDerWaalsContact O-N 3.1Å; I1040-M1043 PolarHBondContact O-N 3.42Å; V1041-M1043 VanDerWaalsContact C-N 3.34Å; M1043-S1045 VanDerWaalsContact C-N 3.3Å; M1043-S1045 PolarHBondContact O-N 3.49Å; M1043-V1046 PolarHBondContact O-N 3.36Å; M1043-V1049 HydrophobicContact CE-CB 4.47Å; M1043-V1049 HydrophobicContact CE-CG1 4.12Å; M1043-V1049 HydrophobicContact CE-CG2 3.93Å; M1043-V1049 HydrophobicContact SD-CG2 4.43Å; M1043-L1077 HydrophobicContact CB-CB 4.16Å; M1043-L1077 HydrophobicContact CB-CD1 4.35Å; M1043-L1077 HydrophobicContact CE-CB 4.21Å; M1043-L1077 HydrophobicContact CE-CD2 4.18Å; M1043-V1080 HydrophobicContact CE-CG1 4.27Å; M1043-Y1081 HydrophobicContact SD-CD2 3.86Å; M1043-Y1081 HydrophobicContact SD-CG 4.41Å; M1043-L1104 HydrophobicContact CE-CD2 3.74Å; M1043-L1104 HydrophobicContact SD-CD2 3.82Å; M1043-A1107 HydrophobicContact CG-CB 4.46Å; M1043-A1107 HydrophobicContact SD-CB 3.68Å
1044	L	90.6	Very high	85.9	Confident	23 Å²	23	40.1 Å²	40.1	12%	0.12	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-37.9	172.5	-63.1	178.1	0	0	0	111.8	L1021 M1024 I1040 V1046 L1077 E1196	L1021-L1044 HydrophobicContact CD2-CD1 3.68Å; M1024-L1044 HydrophobicContact CE-CD1 4.15Å; I1040-L1044 HydrophobicContact CG2-CD1 4.18Å; I1040-L1044 HydrophobicContact CG2-CG 4.34Å; I1040-L1044 WeakPolarHBondContact O-CG 3.37Å; I1040-L1044 PolarHBondContact O-N 3.46Å; L1044-V1046 PolarHBondContact O-N 3.29Å; L1044-L1077 HydrophobicContact CD2-CD1 3.94Å; L1044-E1196 HydrophobicContact CD2-CB 4.15Å; L1044-E1196 HydrophobicContact CD2-CG 3.84Å
1045	S	87	Confident	85	Confident	26 Å²	26	44.9 Å²	44.9	18%	0.182	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	9.4	178	-62.4	0	0	0	0	114.9	L1017 V1041 M1043	L1017-S1045 WeakPolarHBondContact CD2-OG 3.39Å; V1041-S1045 VanDerWaalsContact O-CB 3.3Å; V1041-S1045 WeakPolarHBondContact O-CB 3.3Å; V1041-S1045 PolarHBondContact O-N 2.75Å; V1041-S1045 PolarHBondContact O-OG 2.9Å; M1043-S1045 VanDerWaalsContact C-N 3.3Å; M1043-S1045 PolarHBondContact O-N 3.49Å
1046	V	84.6	Confident	84.5	Confident	15 Å²	15	45.9 Å²	45.9	9%	0.091	21%	0.213	C	C	.	.	S	Bend	trans	-132.9	142.4	-179	-173.9	0	0	0	0	110.7	S1042 M1043 L1044 R1106 A1107 I1110	S1042-V1046 WeakPolarHBondContact O-CG2 3.44Å; M1043-V1046 PolarHBondContact O-N 3.36Å; L1044-V1046 PolarHBondContact O-N 3.29Å; V1046-R1106 HydrophobicContact CG2-CB 4.36Å; V1046-R1106 HydrophobicContact CG2-CG 4.07Å; V1046-A1107 HydrophobicContact CG2-CB 4.09Å; V1046-I1110 HydrophobicContact CG2-CD1 3.28Å
1047	Q	74.5	Confident	83.7	Confident	134 Å²	134	48.3 Å²	48.3	63%	0.626	22%	0.224	S	C	*	.	S	Bend	trans	-54.7	141.8	173.7	-67.3	169	-32.7	0	0	112.3	V1049	Q1047-V1049 PolarHBondContact O-N 2.91Å
1048	N	78.5	Confident	83.3	Confident	95 Å²	95	52.1 Å²	52.1	51%	0.508	26%	0.255	S	S	.	.			trans	-13.5	103.8	176.5	-83	-40.2	0	0	0	115.4	F1050 Q1100	N1048-F1050 VanDerWaalsContact C-N 3.31Å; N1048-F1050 PolarHBondContact O-N 3.16Å; N1048-Q1100 PolarHBondContact O-NE2 3.09Å
1049	V	83.9	Confident	82.9	Confident	4 Å²	4	56 Å²	56	2%	0.024	28%	0.276	C	S	.	.			trans	-67.6	-30.7	-176.6	172	0	0	0	0	112.5	M1043 Q1047 V1080 I1099 Q1100 L1104	M1043-V1049 HydrophobicContact CE-CB 4.47Å; M1043-V1049 HydrophobicContact CE-CG1 4.12Å; M1043-V1049 HydrophobicContact CE-CG2 3.93Å; M1043-V1049 HydrophobicContact SD-CG2 4.43Å; Q1047-V1049 PolarHBondContact O-N 2.91Å; V1049-V1080 HydrophobicContact CG1-CG1 4.28Å; V1049-I1099 HydrophobicContact CG1-CG2 3.57Å; V1049-Q1100 PolarHBondContact O-N 3.39Å; V1049-L1104 HydrophobicContact CG1-CD2 3.79Å; V1049-L1104 HydrophobicContact CG1-CG 4.16Å
1050	F	85.6	Confident	82.4	Confident	43 Å²	43	56.3 Å²	56.3	19%	0.189	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-79.1	143.5	177.4	-57.7	-72.4	0	0	0	111.9	N1048 K1064 T1076 L1077 V1080	N1048-F1050 VanDerWaalsContact C-N 3.31Å; N1048-F1050 PolarHBondContact O-N 3.16Å; F1050-K1064 HydrophobicContact CD1-CD 4.04Å; F1050-K1064 HydrophobicContact CD1-CG 3.94Å; F1050-K1064 HydrophobicContact CD2-CD 4.26Å; F1050-K1064 HydrophobicContact CE1-CD 4.14Å; F1050-K1064 HydrophobicContact CE1-CG 3.69Å; F1050-K1064 HydrophobicContact CE2-CD 4.35Å; F1050-K1064 HydrophobicContact CG-CD 4.1Å; F1050-K1064 HydrophobicContact CG-CG 4.5Å; F1050-K1064 HydrophobicContact CZ-CD 4.28Å; F1050-K1064 HydrophobicContact CZ-CG 4.04Å; F1050-T1076 HydrophobicContact CZ-CG2 4.4Å; F1050-L1077 HydrophobicContact CE2-CD2 4.19Å; F1050-V1080 HydrophobicContact CE1-CG2 3.93Å; F1050-V1080 HydrophobicContact CZ-CG2 3.93Å
1051	Y	80.4	Confident	82	Confident	135 Å²	135	59.1 Å²	59.1	53%	0.529	29%	0.293	S	S	.	.			trans	-113.6	124.1	173.8	178.1	-122.3	0	0	0	109.3	P1053 F1098	Y1051-P1053 HydrophobicContact CD1-CG 4.16Å; Y1051-P1053 HydrophobicContact CE1-CB 3.89Å; Y1051-P1053 HydrophobicContact CE1-CG 3.82Å; Y1051-P1053 WeakPolarHBondContact O-CD 3.4Å; Y1051-F1098 PolarHBondContact N-O 2.8Å; Y1051-F1098 WeakPolarHBondContact O-CB 3.28Å
1052	R	79	Confident	81.7	Confident	134 Å²	134	64.6 Å²	64.6	51%	0.506	32%	0.319	S	S	.	.			trans	-121.2	74.8	-175.5	-166.1	170.7	-173.3	-102.8	-2.2	110.9	Q1057 D1061	R1052-Q1057 HydrophobicContact CG-CB 4.46Å; R1052-Q1057 HydrophobicContact CG-CG 4.05Å; R1052-D1061 WeakPolarHBondContact CD-OD1 3.31Å; R1052-D1061 IonicContact CZ-OD1 2.67Å; R1052-D1061 IonicContact CZ-OD2 2.95Å; R1052-D1061 VanDerWaalsContact CZ-OD2 3.3Å; R1052-D1061 IonicContact NE-OD1 3.44Å; R1052-D1061 PolarHBondContact NE-OD1 3.32Å; R1052-D1061 IonicContact NE-OD2 2.65Å; R1052-D1061 PolarHBondContact NE-OD2 2.99Å; R1052-D1061 VanDerWaalsContact NE-OD2 3.09Å; R1052-D1061 IonicContact NH2-OD1 3.77Å; R1052-D1061 IonicContact NH2-OD2 2.67Å; R1052-D1061 PolarHBondContact NH2-OD2 2.97Å
1053	P	72.3	Confident	81.4	Confident	16 Å²	16	66.6 Å²	66.6	10%	0.104	33%	0.327	C	S	.	.			trans	-62.8	140.4	178.5	26.6	-33.6	0	0	0	110.8	Y1051 D1055 K1056 Q1057 F1098	Y1051-P1053 HydrophobicContact CD1-CG 4.16Å; Y1051-P1053 HydrophobicContact CE1-CB 3.89Å; Y1051-P1053 HydrophobicContact CE1-CG 3.82Å; Y1051-P1053 WeakPolarHBondContact O-CD 3.4Å; P1053-D1055 PolarHBondContact O-N 3.45Å; P1053-D1055 VanDerWaalsContact O-N 3.14Å; P1053-K1056 HydrophobicContact CG-CB 4.2Å; P1053-K1056 PolarHBondContact O-N 2.85Å; P1053-Q1057 WeakPolarHBondContact O-CG 3.39Å; P1053-Q1057 PolarHBondContact O-N 3.02Å; P1053-F1098 HydrophobicContact CG-CD1 3.94Å; P1053-F1098 HydrophobicContact CG-CE1 3.93Å
1054	K	69.1	Low	81.2	Confident	146 Å²	146	67.6 Å²	67.6	64%	0.635	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-30.7	-171.4	-71.1	-178.7	178.5	174.8	0	113.5	Q1057	K1054-Q1057 WeakPolarHBondContact O-CG 3.49Å
1055	D	71.2	Confident	81	Confident	99 Å²	99	69.1 Å²	69.1	53%	0.529	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-12	-168.4	-9.9	-71.5	0	0	0	111.8	P1053	P1053-D1055 PolarHBondContact O-N 3.45Å; P1053-D1055 VanDerWaalsContact O-N 3.14Å
1056	K	79	Confident	81	Confident	73 Å²	73	74.4 Å²	74.4	32%	0.317	37%	0.367	S	S	.	.	S	Bend	trans	-131.7	25.4	-178.1	-59.6	177.5	-175.1	173.2	0	112.2	N565 P1053 A1058 L1059 A1060 F1098	N565-K1056 PolarHBondContact OD1-NZ 3.49Å; P1053-K1056 HydrophobicContact CG-CB 4.2Å; P1053-K1056 PolarHBondContact O-N 2.85Å; K1056-A1058 PolarHBondContact O-N 3.29Å; K1056-L1059 PolarHBondContact O-N 3.19Å; K1056-A1060 PolarHBondContact O-N 3.24Å; K1056-F1098 HydrophobicContact CB-CE1 4.13Å; K1056-F1098 HydrophobicContact CB-CZ 4.26Å
1057	Q	75.3	Confident	81.1	Confident	67 Å²	67	74.5 Å²	74.5	31%	0.313	37%	0.367	S	S	.	.	H	α-helix	trans	-53.9	-54.5	-176.6	-67.7	-169	-3.9	0	0	112.4	R1052 P1053 K1054 L1059 A1060 D1061	R1052-Q1057 HydrophobicContact CG-CB 4.46Å; R1052-Q1057 HydrophobicContact CG-CG 4.05Å; P1053-Q1057 WeakPolarHBondContact O-CG 3.39Å; P1053-Q1057 PolarHBondContact O-N 3.02Å; K1054-Q1057 WeakPolarHBondContact O-CG 3.49Å; Q1057-L1059 PolarHBondContact O-N 2.92Å; Q1057-A1060 CarbonylContact O-C 3.49Å; Q1057-A1060 WeakPolarHBondContact O-CB 3.39Å; Q1057-A1060 PolarHBondContact O-N 2.92Å; Q1057-D1061 WeakPolarHBondContact O-CB 3.35Å; Q1057-D1061 PolarHBondContact O-N 3.11Å; Q1057-D1061 VanDerWaalsContact O-OD2 3.12Å
1058	A	83.2	Confident	81.8	Confident	80 Å²	80	71.3 Å²	71.3	66%	0.661	35%	0.351	S	S	*	.	H	α-helix	trans	-57.7	-34.7	-178.6	0	0	0	0	0	113.4	K1056 Q1062	K1056-A1058 PolarHBondContact O-N 3.29Å; A1058-Q1062 VanDerWaalsContact O-CB 3.27Å; A1058-Q1062 WeakPolarHBondContact O-CB 3.4Å; A1058-Q1062 PolarHBondContact O-N 3.48Å
1059	L	84.5	Confident	82.1	Confident	82 Å²	82	70 Å²	70	43%	0.429	34%	0.342	S	S	.	.	H	α-helix	trans	-75.1	-38.9	176.4	-175	63.2	0	0	0	111.9	K1056 Q1057 K1063 F1098	K1056-L1059 PolarHBondContact O-N 3.19Å; Q1057-L1059 PolarHBondContact O-N 2.92Å; L1059-K1063 WeakPolarHBondContact O-CB 3.45Å; L1059-K1063 WeakPolarHBondContact O-CG 3.43Å; L1059-K1063 PolarHBondContact O-N 2.85Å; L1059-F1098 HydrophobicContact CB-CE2 4.48Å; L1059-F1098 HydrophobicContact CD2-CE2 4.05Å; L1059-F1098 HydrophobicContact CD2-CZ 3.99Å; L1059-F1098 HydrophobicContact CG-CE2 3.9Å; L1059-F1098 HydrophobicContact CG-CZ 4.21Å
1060	A	82	Confident	82.1	Confident	7 Å²	7	73.3 Å²	73.3	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-41.9	173.1	0	0	0	0	0	111.4	K1056 Q1057 K1063 K1064 F1098	K1056-A1060 PolarHBondContact O-N 3.24Å; Q1057-A1060 CarbonylContact O-C 3.49Å; Q1057-A1060 WeakPolarHBondContact O-CB 3.39Å; Q1057-A1060 PolarHBondContact O-N 2.92Å; A1060-K1063 PolarHBondContact O-N 3.1Å; A1060-K1064 VanDerWaalsContact O-CB 3.28Å; A1060-K1064 WeakPolarHBondContact O-CB 3.3Å; A1060-K1064 PolarHBondContact O-N 3.03Å; A1060-F1098 HydrophobicContact CB-CB 3.97Å; A1060-F1098 HydrophobicContact CB-CD1 4.01Å; A1060-F1098 HydrophobicContact CB-CD2 4Å; A1060-F1098 HydrophobicContact CB-CG 3.72Å
1061	D	84.9	Confident	82	Confident	58 Å²	58	73.7 Å²	73.7	31%	0.31	37%	0.366	S	S	.	.	H	α-helix	trans	-69.4	-40.4	178	-60.6	-32.6	0	0	0	111.3	R1052 Q1057 K1063 K1064 A1065	R1052-D1061 WeakPolarHBondContact CD-OD1 3.31Å; R1052-D1061 IonicContact CZ-OD1 2.67Å; R1052-D1061 IonicContact CZ-OD2 2.95Å; R1052-D1061 VanDerWaalsContact CZ-OD2 3.3Å; R1052-D1061 IonicContact NE-OD1 3.44Å; R1052-D1061 PolarHBondContact NE-OD1 3.32Å; R1052-D1061 IonicContact NE-OD2 2.65Å; R1052-D1061 PolarHBondContact NE-OD2 2.99Å; R1052-D1061 VanDerWaalsContact NE-OD2 3.09Å; R1052-D1061 IonicContact NH2-OD1 3.77Å; R1052-D1061 IonicContact NH2-OD2 2.67Å; R1052-D1061 PolarHBondContact NH2-OD2 2.97Å; Q1057-D1061 WeakPolarHBondContact O-CB 3.35Å; Q1057-D1061 PolarHBondContact O-N 3.11Å; Q1057-D1061 VanDerWaalsContact O-OD2 3.12Å; D1061-K1063 PolarHBondContact O-N 2.91Å; D1061-K1064 PolarHBondContact O-N 3.05Å; D1061-A1065 WeakPolarHBondContact O-CB 3.38Å; D1061-A1065 PolarHBondContact O-N 2.78Å
1062	Q	86.3	Confident	82.4	Confident	116 Å²	116	67.2 Å²	67.2	54%	0.542	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-41.4	171.8	-171.1	-160.7	73.5	0	0	111.9	A1058	A1058-Q1062 VanDerWaalsContact O-CB 3.27Å; A1058-Q1062 WeakPolarHBondContact O-CB 3.4Å; A1058-Q1062 PolarHBondContact O-N 3.48Å
1063	K	86.9	Confident	82.9	Confident	43 Å²	43	61.4 Å²	61.4	19%	0.187	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-42.1	174.7	-75.6	-81.4	-174	143.8	0	111.1	L1059 A1060 D1061 K1066 F1067 E1096 N1097 F1098	L1059-K1063 WeakPolarHBondContact O-CB 3.45Å; L1059-K1063 WeakPolarHBondContact O-CG 3.43Å; L1059-K1063 PolarHBondContact O-N 2.85Å; A1060-K1063 PolarHBondContact O-N 3.1Å; D1061-K1063 PolarHBondContact O-N 2.91Å; K1063-K1066 WeakPolarHBondContact O-CB 3.42Å; K1063-K1066 PolarHBondContact O-N 3.18Å; K1063-F1067 WeakPolarHBondContact O-CD2 3.41Å; K1063-F1067 WeakPolarHBondContact O-CE2 2.85Å; K1063-E1096 WeakPolarHBondContact CD-O 3.46Å; K1063-E1096 WeakPolarHBondContact CE-O 3.46Å; K1063-E1096 PolarHBondContact NZ-O 3.36Å; K1063-N1097 WeakPolarHBondContact CD-OD1 3.46Å; K1063-F1098 HydrophobicContact CB-CD2 4.34Å; K1063-F1098 HydrophobicContact CG-CD2 4.15Å; K1063-F1098 HydrophobicContact CG-CE2 4.31Å
1064	K	85.8	Confident	83.8	Confident	23 Å²	23	60.7 Å²	60.7	10%	0.1	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-41.7	177.1	-171.2	-178.1	169.8	175.6	0	112.5	F1050 A1060 D1061 K1066 F1067 H1068 S1170	F1050-K1064 HydrophobicContact CD1-CD 4.04Å; F1050-K1064 HydrophobicContact CD1-CG 3.94Å; F1050-K1064 HydrophobicContact CD2-CD 4.26Å; F1050-K1064 HydrophobicContact CE1-CD 4.14Å; F1050-K1064 HydrophobicContact CE1-CG 3.69Å; F1050-K1064 HydrophobicContact CE2-CD 4.35Å; F1050-K1064 HydrophobicContact CG-CD 4.1Å; F1050-K1064 HydrophobicContact CG-CG 4.5Å; F1050-K1064 HydrophobicContact CZ-CD 4.28Å; F1050-K1064 HydrophobicContact CZ-CG 4.04Å; A1060-K1064 VanDerWaalsContact O-CB 3.28Å; A1060-K1064 WeakPolarHBondContact O-CB 3.3Å; A1060-K1064 PolarHBondContact O-N 3.03Å; D1061-K1064 PolarHBondContact O-N 3.05Å; K1064-K1066 PolarHBondContact O-N 3.29Å; K1064-K1066 VanDerWaalsContact O-N 3.09Å; K1064-F1067 PolarHBondContact O-N 3.41Å; K1064-H1068 PolarHBondContact O-CD2 2.83Å; K1064-H1068 PolarHBondContact O-N 2.86Å; K1064-S1170 PolarHBondContact NZ-O 3.33Å
1065	A	86.3	Confident	84.8	Confident	55 Å²	55	54.1 Å²	54.1	46%	0.455	29%	0.287	S	S	.	.	H	α-helix	trans	-56.6	-26.3	177.4	0	0	0	0	0	113.2	D1061 F1067 H1068	D1061-A1065 WeakPolarHBondContact O-CB 3.38Å; D1061-A1065 PolarHBondContact O-N 2.78Å; A1065-F1067 PolarHBondContact O-N 3.17Å; A1065-H1068 PolarHBondContact O-N 2.62Å
1066	K	87.8	Confident	85.8	Confident	138 Å²	138	49.5 Å²	49.5	60%	0.6	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.7	174.3	-55.3	-168.6	-179.7	-164.1	0	114.1	K1063 K1064	K1063-K1066 WeakPolarHBondContact O-CB 3.42Å; K1063-K1066 PolarHBondContact O-N 3.18Å; K1064-K1066 PolarHBondContact O-N 3.29Å; K1064-K1066 VanDerWaalsContact O-N 3.09Å
1067	F	87.8	Confident	86.4	Confident	17 Å²	17	46.7 Å²	46.7	8%	0.075	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-16.2	178.4	-58.2	-74.3	0	0	0	113.4	K1063 K1064 A1065 Q1069 T1076 V1080 W1093 N1097 I1099	K1063-F1067 WeakPolarHBondContact O-CD2 3.41Å; K1063-F1067 WeakPolarHBondContact O-CE2 2.85Å; K1064-F1067 PolarHBondContact O-N 3.41Å; A1065-F1067 PolarHBondContact O-N 3.17Å; F1067-Q1069 PolarHBondContact O-N 3.31Å; F1067-Q1069 PolarHBondContact O-NE2 3.25Å; F1067-T1076 HydrophobicContact CB-CG2 4.28Å; F1067-V1080 HydrophobicContact CB-CG2 3.79Å; F1067-V1080 HydrophobicContact CD1-CG2 3.92Å; F1067-V1080 HydrophobicContact CD2-CG2 4.1Å; F1067-V1080 HydrophobicContact CG-CG2 3.66Å; F1067-W1093 HydrophobicContact CE1-CH2 4.12Å; F1067-W1093 AromaticContact CE1-CZ2 3.88Å; F1067-W1093 HydrophobicContact CE1-CZ2 3.88Å; F1067-W1093 AromaticContact CZ-CH2 3.98Å; F1067-W1093 HydrophobicContact CZ-CH2 3.98Å; F1067-W1093 AromaticContact CZ-CZ2 3.73Å; F1067-W1093 HydrophobicContact CZ-CZ2 3.73Å; F1067-N1097 HydrophobicContact CE2-CB 4.2Å; F1067-N1097 HydrophobicContact CZ-CB 4.28Å; F1067-I1099 HydrophobicContact CE2-CD1 4.3Å; F1067-I1099 HydrophobicContact CZ-CD1 4.39Å
1068	H	87.4	Confident	87.1	Confident	66 Å²	66	44.3 Å²	44.3	31%	0.306	24%	0.24	S	C	.	.			trans	-54.6	121.8	-177	-73.5	-168.3	0	0	0	111	K1064 A1065 A1172	K1064-H1068 PolarHBondContact O-CD2 2.83Å; K1064-H1068 PolarHBondContact O-N 2.86Å; A1065-H1068 PolarHBondContact O-N 2.62Å; H1068-A1172 HydrophobicContact CB-CB 3.98Å
1069	Q	86.5	Confident	87.5	Confident	69 Å²	69	41.6 Å²	41.6	32%	0.322	22%	0.217	S	C	.	.			trans	-97.6	130.4	170.2	-60.3	-49	-72.9	0	0	109	F1067 E1071 G1072 L1075 T1076 A1079	F1067-Q1069 PolarHBondContact O-N 3.31Å; F1067-Q1069 PolarHBondContact O-NE2 3.25Å; Q1069-E1071 WeakPolarHBondContact CB-OE2 3.35Å; Q1069-E1071 PolarHBondContact O-N 3.35Å; Q1069-E1071 VanDerWaalsContact O-N 3.09Å; Q1069-G1072 PolarHBondContact O-N 3.09Å; Q1069-G1072 VanDerWaalsContact O-N 3.11Å; Q1069-L1075 HydrophobicContact CB-CB 3.99Å; Q1069-L1075 HydrophobicContact CG-CB 4.15Å; Q1069-T1076 PolarHBondContact N-OG1 3.13Å; Q1069-A1079 HydrophobicContact CG-CB 4.13Å
1070	P	82.9	Confident	87.8	Confident	73 Å²	73	37.7 Å²	37.7	47%	0.474	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.7	-174.8	26.3	-35.1	0	0	0	114.4	R1176	P1070-R1176 PolarHBondContact O-NH1 3.23Å
1071	E	84	Confident	88.3	Confident	50 Å²	50	37.8 Å²	37.8	23%	0.234	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-21.5	176.6	-54.9	87.3	166.9	0	0	113.6	Q1069 L1075 T1199	Q1069-E1071 WeakPolarHBondContact CB-OE2 3.35Å; Q1069-E1071 PolarHBondContact O-N 3.35Å; Q1069-E1071 VanDerWaalsContact O-N 3.09Å; E1071-L1075 HydrophobicContact CB-CD1 3.6Å; E1071-L1075 HydrophobicContact CG-CD1 4.34Å; E1071-T1199 PolarHBondContact O-N 2.67Å; E1071-T1199 VanDerWaalsContact O-N 3.1Å; E1071-T1199 PolarHBondContact O-OG1 3.23Å
1072	G	87.7	Confident	88.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	148.4	179	172	0	0	0	0	0	118.1	Q1069 L1075 T1076 V1197	Q1069-G1072 PolarHBondContact O-N 3.09Å; Q1069-G1072 VanDerWaalsContact O-N 3.11Å; G1072-L1075 PolarHBondContact O-N 3.14Å; G1072-T1076 PolarHBondContact O-N 3.14Å; G1072-T1076 VanDerWaalsContact O-N 3.07Å; G1072-T1076 PolarHBondContact O-OG1 3.37Å; G1072-V1197 WeakPolarHBondContact CA-O 3.38Å
1073	D	89.6	Confident	88.8	Confident	11 Å²	11	33.8 Å²	33.8	6%	0.059	18%	0.181	C	C	.	.	H	α-helix	trans	-67.9	-39.5	-177.3	-71.5	-42	0	0	0	112.8	L1075 T1076 L1077 S1171 A1172 E1196 V1197	D1073-L1075 VanDerWaalsContact C-N 3.27Å; D1073-L1075 PolarHBondContact O-N 2.87Å; D1073-T1076 CarbonylContact O-C 3.49Å; D1073-T1076 WeakPolarHBondContact O-CA 3.33Å; D1073-T1076 VanDerWaalsContact O-CB 3.3Å; D1073-T1076 WeakPolarHBondContact O-CB 3.45Å; D1073-T1076 PolarHBondContact O-N 2.75Å; D1073-L1077 WeakPolarHBondContact O-CG 3.32Å; D1073-L1077 PolarHBondContact O-N 2.65Å; D1073-S1171 WeakPolarHBondContact OD1-CA 3.34Å; D1073-S1171 PolarHBondContact OD1-OG 3.31Å; D1073-S1171 VanDerWaalsContact OD2-CB 3.25Å; D1073-S1171 WeakPolarHBondContact OD2-CB 3.48Å; D1073-S1171 PolarHBondContact OD2-OG 2.83Å; D1073-A1172 WeakPolarHBondContact OD1-CB 3.31Å; D1073-A1172 PolarHBondContact OD1-N 3.09Å; D1073-E1196 HydrophobicContact CB-CB 4.31Å; D1073-V1197 PolarHBondContact N-O 2.96Å; D1073-V1197 PolarHBondContact OD2-N 3.18Å
1074	H	91	Very high	89	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-55.5	-42.9	176.8	-70.7	95.6	0	0	0	111.9	I1040 L1077 L1078 I1139 E1196 T1198	I1040-H1074 HydrophobicContact CD1-CB 4.49Å; I1040-H1074 HydrophobicContact CG2-CB 4.15Å; H1074-L1077 PolarHBondContact O-N 3.12Å; H1074-L1078 PolarHBondContact O-N 2.84Å; H1074-L1078 VanDerWaalsContact O-N 3.16Å; H1074-I1139 HydrophobicContact CB-CD1 3.64Å; H1074-E1196 PolarHBondContact CE1-O 3.33Å; H1074-E1196 PolarHBondContact ND1-O 3.23Å; H1074-T1198 PolarHBondContact ND1-OG1 3.26Å
1075	L	90.9	Very high	89.2	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-77	-28.1	177.4	-70	166.3	0	0	0	112.2	Q1069 E1071 G1072 D1073 L1078 A1079 T1132 V1135 Q1136	Q1069-L1075 HydrophobicContact CB-CB 3.99Å; Q1069-L1075 HydrophobicContact CG-CB 4.15Å; E1071-L1075 HydrophobicContact CB-CD1 3.6Å; E1071-L1075 HydrophobicContact CG-CD1 4.34Å; G1072-L1075 PolarHBondContact O-N 3.14Å; D1073-L1075 VanDerWaalsContact C-N 3.27Å; D1073-L1075 PolarHBondContact O-N 2.87Å; L1075-L1078 HydrophobicContact CD2-CD2 3.98Å; L1075-L1078 PolarHBondContact O-N 3.43Å; L1075-A1079 WeakPolarHBondContact O-CB 3.44Å; L1075-A1079 PolarHBondContact O-N 2.97Å; L1075-T1132 HydrophobicContact CD1-CG2 4.02Å; L1075-T1132 HydrophobicContact CD2-CG2 4.35Å; L1075-V1135 HydrophobicContact CD2-CB 4.36Å; L1075-V1135 HydrophobicContact CD2-CG1 4.11Å; L1075-Q1136 HydrophobicContact CD1-CG 4.3Å
1076	T	91.4	Very high	89.5	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-41.2	168.9	-59.7	0	0	0	0	111.7	F1050 F1067 Q1069 G1072 D1073 A1079 V1080	F1050-T1076 HydrophobicContact CZ-CG2 4.4Å; F1067-T1076 HydrophobicContact CB-CG2 4.28Å; Q1069-T1076 PolarHBondContact N-OG1 3.13Å; G1072-T1076 PolarHBondContact O-N 3.14Å; G1072-T1076 VanDerWaalsContact O-N 3.07Å; G1072-T1076 PolarHBondContact O-OG1 3.37Å; D1073-T1076 CarbonylContact O-C 3.49Å; D1073-T1076 WeakPolarHBondContact O-CA 3.33Å; D1073-T1076 VanDerWaalsContact O-CB 3.3Å; D1073-T1076 WeakPolarHBondContact O-CB 3.45Å; D1073-T1076 PolarHBondContact O-N 2.75Å; T1076-A1079 PolarHBondContact O-N 3.06Å; T1076-V1080 WeakPolarHBondContact O-CG2 3.41Å; T1076-V1080 PolarHBondContact O-N 2.88Å
1077	L	91.3	Very high	89.6	Confident	15 Å²	15	34.8 Å²	34.8	8%	0.079	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-41.6	173.6	-66.6	172.9	0	0	0	111.7	M1043 L1044 F1050 D1073 H1074 A1079 V1080 Y1081 E1196	M1043-L1077 HydrophobicContact CB-CB 4.16Å; M1043-L1077 HydrophobicContact CB-CD1 4.35Å; M1043-L1077 HydrophobicContact CE-CB 4.21Å; M1043-L1077 HydrophobicContact CE-CD2 4.18Å; L1044-L1077 HydrophobicContact CD2-CD1 3.94Å; F1050-L1077 HydrophobicContact CE2-CD2 4.19Å; D1073-L1077 WeakPolarHBondContact O-CG 3.32Å; D1073-L1077 PolarHBondContact O-N 2.65Å; H1074-L1077 PolarHBondContact O-N 3.12Å; L1077-A1079 PolarHBondContact O-N 2.89Å; L1077-V1080 PolarHBondContact O-N 3.33Å; L1077-Y1081 PolarHBondContact O-N 2.86Å; L1077-E1196 HydrophobicContact CD1-CG 4.36Å
1078	L	91.4	Very high	89.7	Confident	17 Å²	17	42.9 Å²	42.9	9%	0.089	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-43.7	173.5	-179	64.2	0	0	0	111.8	E1036 T1039 I1040 H1074 L1075 V1080 Y1081 N1082	E1036-L1078 HydrophobicContact CB-CD1 4.49Å; E1036-L1078 HydrophobicContact CB-CD2 3.93Å; E1036-L1078 HydrophobicContact CG-CD2 3.9Å; T1039-L1078 HydrophobicContact CG2-CD1 3.77Å; I1040-L1078 HydrophobicContact CD1-CB 4.41Å; I1040-L1078 HydrophobicContact CD1-CD2 4.37Å; I1040-L1078 HydrophobicContact CG1-CB 4.06Å; H1074-L1078 PolarHBondContact O-N 2.84Å; H1074-L1078 VanDerWaalsContact O-N 3.16Å; L1075-L1078 HydrophobicContact CD2-CD2 3.98Å; L1075-L1078 PolarHBondContact O-N 3.43Å; L1078-V1080 PolarHBondContact O-N 2.88Å; L1078-Y1081 PolarHBondContact O-N 3.23Å; L1078-N1082 WeakPolarHBondContact O-CB 3.32Å; L1078-N1082 PolarHBondContact O-N 3.07Å; L1078-N1082 PolarHBondContact O-ND2 3.1Å
1079	A	90.8	Very high	89.7	Confident	22 Å²	22	43.2 Å²	43.2	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-39.7	176.8	0	0	0	0	0	112.6	Q1069 L1075 T1076 L1077 S1083	Q1069-A1079 HydrophobicContact CG-CB 4.13Å; L1075-A1079 WeakPolarHBondContact O-CB 3.44Å; L1075-A1079 PolarHBondContact O-N 2.97Å; T1076-A1079 PolarHBondContact O-N 3.06Å; L1077-A1079 PolarHBondContact O-N 2.89Å; A1079-S1083 VanDerWaalsContact O-CB 3.3Å; A1079-S1083 WeakPolarHBondContact O-CB 3.19Å; A1079-S1083 PolarHBondContact O-N 3.39Å; A1079-S1083 PolarHBondContact O-OG 3.47Å
1080	V	92.1	Very high	89.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-51.1	172.7	166.4	0	0	0	0	111.3	M1043 V1049 F1050 F1067 T1076 L1077 L1078 N1082 S1083 W1084 I1099 L1104	M1043-V1080 HydrophobicContact CE-CG1 4.27Å; V1049-V1080 HydrophobicContact CG1-CG1 4.28Å; F1050-V1080 HydrophobicContact CE1-CG2 3.93Å; F1050-V1080 HydrophobicContact CZ-CG2 3.93Å; F1067-V1080 HydrophobicContact CB-CG2 3.79Å; F1067-V1080 HydrophobicContact CD1-CG2 3.92Å; F1067-V1080 HydrophobicContact CD2-CG2 4.1Å; F1067-V1080 HydrophobicContact CG-CG2 3.66Å; T1076-V1080 WeakPolarHBondContact O-CG2 3.41Å; T1076-V1080 PolarHBondContact O-N 2.88Å; L1077-V1080 PolarHBondContact O-N 3.33Å; L1078-V1080 PolarHBondContact O-N 2.88Å; V1080-N1082 PolarHBondContact O-N 3.11Å; V1080-S1083 PolarHBondContact O-N 2.95Å; V1080-W1084 PolarHBondContact O-N 3.2Å; V1080-I1099 HydrophobicContact CG1-CD1 3.9Å; V1080-L1104 HydrophobicContact CG1-CD2 4.34Å
1081	Y	91.6	Very high	89.8	Confident	10 Å²	10	42.1 Å²	42.1	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-42.3	-178.2	-175	-87.5	0	0	0	112	T1039 M1043 L1077 L1078 S1083 W1084 K1085 Q1108	T1039-Y1081 HydrophobicContact CG2-CD1 3.3Å; T1039-Y1081 HydrophobicContact CG2-CD2 4.35Å; T1039-Y1081 HydrophobicContact CG2-CE1 3.84Å; T1039-Y1081 HydrophobicContact CG2-CG 3.59Å; M1043-Y1081 HydrophobicContact SD-CD2 3.86Å; M1043-Y1081 HydrophobicContact SD-CG 4.41Å; L1077-Y1081 PolarHBondContact O-N 2.86Å; L1078-Y1081 PolarHBondContact O-N 3.23Å; Y1081-S1083 PolarHBondContact O-N 3.43Å; Y1081-W1084 HydrophobicContact CD2-CE3 4.24Å; Y1081-W1084 HydrophobicContact CE2-CE3 4.14Å; Y1081-W1084 HydrophobicContact CE2-CZ3 4.06Å; Y1081-W1084 PolarHBondContact O-N 3.48Å; Y1081-K1085 HydrophobicContact CE1-CD 4.46Å; Y1081-K1085 WeakPolarHBondContact O-CB 3.49Å; Y1081-K1085 PolarHBondContact O-N 3.23Å; Y1081-Q1108 HydrophobicContact CE2-CB 4.31Å
1082	N	90.8	Very high	90	Very high	54 Å²	54	43.6 Å²	43.6	29%	0.289	23%	0.229	S	C	.	.	H	α-helix	trans	-66.5	-36.4	177	-76	-23.9	0	0	0	112.1	L1078 V1080 W1084 K1085 N1086	L1078-N1082 WeakPolarHBondContact O-CB 3.32Å; L1078-N1082 PolarHBondContact O-N 3.07Å; L1078-N1082 PolarHBondContact O-ND2 3.1Å; V1080-N1082 PolarHBondContact O-N 3.11Å; N1082-W1084 VanDerWaalsContact C-N 3.33Å; N1082-W1084 PolarHBondContact O-N 2.8Å; N1082-K1085 PolarHBondContact O-N 2.87Å; N1082-N1086 WeakPolarHBondContact O-CB 3.49Å; N1082-N1086 PolarHBondContact O-N 3.26Å; N1082-N1086 PolarHBondContact O-ND2 2.98Å; N1082-N1086 PolarHBondContact O-OD1 3Å
1083	S	91	Very high	90	Very high	35 Å²	35	45 Å²	45	25%	0.245	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-38	173	-60.3	0	0	0	0	112	A1079 V1080 Y1081 N1087 W1093	A1079-S1083 VanDerWaalsContact O-CB 3.3Å; A1079-S1083 WeakPolarHBondContact O-CB 3.19Å; A1079-S1083 PolarHBondContact O-N 3.39Å; A1079-S1083 PolarHBondContact O-OG 3.47Å; V1080-S1083 PolarHBondContact O-N 2.95Å; Y1081-S1083 PolarHBondContact O-N 3.43Å; S1083-N1087 PolarHBondContact O-N 3.09Å; S1083-N1087 VanDerWaalsContact O-N 3.1Å; S1083-N1087 PolarHBondContact O-ND2 3.41Å; S1083-W1093 VanDerWaalsContact CB-CZ2 3.5Å
1084	W	91.8	Very high	89.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-70.8	-40.9	175.2	-175.6	57.1	0	0	0	113.2	V1080 Y1081 N1082 N1086 N1087 K1088 F1089 S1090 W1093 C1094 L1104 R1105 Q1108	V1080-W1084 PolarHBondContact O-N 3.2Å; Y1081-W1084 HydrophobicContact CD2-CE3 4.24Å; Y1081-W1084 HydrophobicContact CE2-CE3 4.14Å; Y1081-W1084 HydrophobicContact CE2-CZ3 4.06Å; Y1081-W1084 PolarHBondContact O-N 3.48Å; N1082-W1084 VanDerWaalsContact C-N 3.33Å; N1082-W1084 PolarHBondContact O-N 2.8Å; W1084-N1086 VanDerWaalsContact C-N 3.33Å; W1084-N1086 PolarHBondContact O-N 3.28Å; W1084-N1087 CarbonylContact O-C 3.54Å; W1084-N1087 PolarHBondContact O-N 3.14Å; W1084-K1088 PolarHBondContact O-N 3.1Å; W1084-F1089 HydrophobicContact CD2-CB 4.47Å; W1084-F1089 AromaticContact CD2-CD1 3.77Å; W1084-F1089 HydrophobicContact CD2-CD1 3.77Å; W1084-F1089 AromaticContact CE2-CD1 3.95Å; W1084-F1089 AromaticContact CE3-CD1 3.57Å; W1084-F1089 HydrophobicContact CE3-CD1 3.57Å; W1084-F1089 HydrophobicContact CE3-CE1 4.1Å; W1084-F1089 HydrophobicContact CH2-CB 4.2Å; W1084-F1089 AromaticContact CH2-CD1 3.72Å; W1084-F1089 HydrophobicContact CH2-CD1 3.72Å; W1084-F1089 HydrophobicContact CH2-CG 4.33Å; W1084-F1089 HydrophobicContact CZ2-CB 3.7Å; W1084-F1089 AromaticContact CZ2-CD1 3.94Å; W1084-F1089 HydrophobicContact CZ2-CD1 3.94Å; W1084-F1089 HydrophobicContact CZ2-CG 4.28Å; W1084-F1089 AromaticContact CZ3-CD1 3.54Å; W1084-F1089 HydrophobicContact CZ3-CD1 3.54Å; W1084-F1089 HydrophobicContact CZ3-CE1 4.07Å; W1084-F1089 PolarHBondContact NE1-O 2.93Å; W1084-F1089 PolarHBondContact O-N 3.47Å; W1084-S1090 PolarHBondContact NE1-O 3.03Å; W1084-W1093 HydrophobicContact CB-CE3 4.14Å; W1084-W1093 HydrophobicContact CB-CH2 4.17Å; W1084-W1093 HydrophobicContact CB-CZ3 3.63Å; W1084-W1093 AromaticContact CD1-CE3 3.69Å; W1084-W1093 AromaticContact CD1-CZ3 3.95Å; W1084-W1093 HydrophobicContact CG-CE3 4.29Å; W1084-W1093 HydrophobicContact CG-CZ3 4.13Å; W1084-C1094 VanDerWaalsContact CD1-SG 3.5Å; W1084-C1094 PolarHBondContact NE1-SG 3.29Å; W1084-L1104 HydrophobicContact CB-CD1 4.01Å; W1084-L1104 HydrophobicContact CD2-CB 3.96Å; W1084-L1104 HydrophobicContact CD2-CD1 3.61Å; W1084-L1104 HydrophobicContact CD2-CG 4.35Å; W1084-L1104 HydrophobicContact CE3-CB 3.76Å; W1084-L1104 HydrophobicContact CE3-CD1 4.03Å; W1084-L1104 HydrophobicContact CE3-CD2 4.44Å; W1084-L1104 HydrophobicContact CE3-CG 4.32Å; W1084-L1104 HydrophobicContact CG-CD1 3.6Å; W1084-L1104 HydrophobicContact CH2-CB 3.84Å; W1084-L1104 HydrophobicContact CZ2-CB 3.99Å; W1084-L1104 HydrophobicContact CZ3-CB 3.7Å; W1084-L1104 VanDerWaalsContact CZ3-O 3.3Å; W1084-L1104 WeakPolarHBondContact CZ3-O 3.41Å; W1084-R1105 HydrophobicContact CH2-CG 3.96Å; W1084-R1105 HydrophobicContact CZ2-CG 4.1Å; W1084-Q1108 HydrophobicContact CH2-CB 4.47Å; W1084-Q1108 HydrophobicContact CZ3-CB 4.16Å
1085	K	89.9	Confident	89.5	Confident	78 Å²	78	53.2 Å²	53.2	34%	0.339	27%	0.267	S	S	.	.	H	α-helix	trans	-55.7	-46.7	172	-174.7	-177.7	178.6	-173.5	0	110.6	E1035 Y1081 N1082 N1087 K1088 F1089	E1035-K1085 IonicContact OE1-NZ 2.64Å; E1035-K1085 PolarHBondContact OE1-NZ 2.81Å; Y1081-K1085 HydrophobicContact CE1-CD 4.46Å; Y1081-K1085 WeakPolarHBondContact O-CB 3.49Å; Y1081-K1085 PolarHBondContact O-N 3.23Å; N1082-K1085 PolarHBondContact O-N 2.87Å; K1085-N1087 PolarHBondContact O-N 3.46Å; K1085-K1088 PolarHBondContact O-N 3.01Å; K1085-F1089 HydrophobicContact CB-CE1 4.13Å; K1085-F1089 HydrophobicContact CB-CZ 4.47Å; K1085-F1089 HydrophobicContact CG-CE1 4.33Å; K1085-F1089 HydrophobicContact CG-CZ 4.19Å
1086	N	91.3	Very high	89.2	Confident	126 Å²	126	58.1 Å²	58.1	67%	0.674	29%	0.289	S	S	*	.	H	α-helix	trans	-65.1	-37	177.4	-68.4	-11.1	0	0	0	112.6	N1082 W1084 K1088	N1082-N1086 WeakPolarHBondContact O-CB 3.49Å; N1082-N1086 PolarHBondContact O-N 3.26Å; N1082-N1086 PolarHBondContact O-ND2 2.98Å; N1082-N1086 PolarHBondContact O-OD1 3Å; W1084-N1086 VanDerWaalsContact C-N 3.33Å; W1084-N1086 PolarHBondContact O-N 3.28Å; N1086-K1088 PolarHBondContact O-N 2.95Å; N1086-K1088 VanDerWaalsContact O-N 3.14Å
1087	N	90.5	Very high	89	Confident	75 Å²	75	58.9 Å²	58.9	40%	0.401	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	30	174.9	-73.3	-78.8	0	0	0	113.3	S1083 W1084 K1085 F1089 S1090 W1093	S1083-N1087 PolarHBondContact O-N 3.09Å; S1083-N1087 VanDerWaalsContact O-N 3.1Å; S1083-N1087 PolarHBondContact O-ND2 3.41Å; W1084-N1087 CarbonylContact O-C 3.54Å; W1084-N1087 PolarHBondContact O-N 3.14Å; K1085-N1087 PolarHBondContact O-N 3.46Å; N1087-F1089 PolarHBondContact O-N 3.2Å; N1087-F1089 VanDerWaalsContact O-N 3.09Å; N1087-S1090 WeakPolarHBondContact O-CB 3.16Å; N1087-S1090 PolarHBondContact O-N 3.31Å; N1087-W1093 HydrophobicContact CB-CB 4.36Å; N1087-W1093 HydrophobicContact CB-CD2 4.32Å; N1087-W1093 HydrophobicContact CB-CG 3.94Å; N1087-W1093 PolarHBondContact ND2-NE1 2.93Å
1088	K	88.8	Confident	88.7	Confident	186 Å²	186	59.7 Å²	59.7	81%	0.809	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	36.9	175.3	-58.2	-174.7	-179.4	-179	0	114.2	W1084 K1085 N1086 S1090	W1084-K1088 PolarHBondContact O-N 3.1Å; K1085-K1088 PolarHBondContact O-N 3.01Å; N1086-K1088 PolarHBondContact O-N 2.95Å; N1086-K1088 VanDerWaalsContact O-N 3.14Å; K1088-S1090 PolarHBondContact O-N 3.4Å
1089	F	88.2	Confident	88.4	Confident	73 Å²	73	59.3 Å²	59.3	32%	0.32	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	25.7	-179.3	-48	-66.7	0	0	0	114.9	W1084 K1085 N1087 N1091 Q1108	W1084-F1089 HydrophobicContact CD2-CB 4.47Å; W1084-F1089 AromaticContact CD2-CD1 3.77Å; W1084-F1089 HydrophobicContact CD2-CD1 3.77Å; W1084-F1089 AromaticContact CE2-CD1 3.95Å; W1084-F1089 AromaticContact CE3-CD1 3.57Å; W1084-F1089 HydrophobicContact CE3-CD1 3.57Å; W1084-F1089 HydrophobicContact CE3-CE1 4.1Å; W1084-F1089 HydrophobicContact CH2-CB 4.2Å; W1084-F1089 AromaticContact CH2-CD1 3.72Å; W1084-F1089 HydrophobicContact CH2-CD1 3.72Å; W1084-F1089 HydrophobicContact CH2-CG 4.33Å; W1084-F1089 HydrophobicContact CZ2-CB 3.7Å; W1084-F1089 AromaticContact CZ2-CD1 3.94Å; W1084-F1089 HydrophobicContact CZ2-CD1 3.94Å; W1084-F1089 HydrophobicContact CZ2-CG 4.28Å; W1084-F1089 AromaticContact CZ3-CD1 3.54Å; W1084-F1089 HydrophobicContact CZ3-CD1 3.54Å; W1084-F1089 HydrophobicContact CZ3-CE1 4.07Å; W1084-F1089 PolarHBondContact NE1-O 2.93Å; W1084-F1089 PolarHBondContact O-N 3.47Å; K1085-F1089 HydrophobicContact CB-CE1 4.13Å; K1085-F1089 HydrophobicContact CB-CZ 4.47Å; K1085-F1089 HydrophobicContact CG-CE1 4.33Å; K1085-F1089 HydrophobicContact CG-CZ 4.19Å; N1087-F1089 PolarHBondContact O-N 3.2Å; N1087-F1089 VanDerWaalsContact O-N 3.09Å; F1089-N1091 PolarHBondContact O-N 2.71Å; F1089-Q1108 VanDerWaalsContact CE1-NE2 3.27Å
1090	S	86.6	Confident	88.1	Confident	41 Å²	41	62 Å²	62	29%	0.287	30%	0.303	S	S	.	.			trans	-56.6	129.7	-176.8	175.6	0	0	0	0	114.1	W1084 N1087 K1088 P1092 W1093 C1094	W1084-S1090 PolarHBondContact NE1-O 3.03Å; N1087-S1090 WeakPolarHBondContact O-CB 3.16Å; N1087-S1090 PolarHBondContact O-N 3.31Å; K1088-S1090 PolarHBondContact O-N 3.4Å; S1090-P1092 WeakPolarHBondContact OG-CD 2.96Å; S1090-W1093 PolarHBondContact OG-N 2.92Å; S1090-C1094 PolarHBondContact O-SG 2.89Å
1091	N	85.5	Confident	87.6	Confident	78 Å²	78	63 Å²	63	42%	0.417	31%	0.311	S	S	.	.	H	α-helix	trans	-69	-47.6	172.5	-77.5	5.8	0	0	0	112.3	F1089 W1093 C1094 Y1095 R1105	F1089-N1091 PolarHBondContact O-N 2.71Å; N1091-W1093 VanDerWaalsContact C-N 3.3Å; N1091-W1093 PolarHBondContact O-N 2.79Å; N1091-C1094 WeakPolarHBondContact O-CB 3.25Å; N1091-C1094 PolarHBondContact O-N 3.25Å; N1091-Y1095 PolarHBondContact O-N 3.05Å; N1091-R1105 PolarHBondContact ND2-NH2 2.8Å; N1091-R1105 PolarHBondContact OD1-NH2 3.18Å
1092	P	87.3	Confident	87.2	Confident	81 Å²	81	70 Å²	70	53%	0.526	34%	0.337	S	S	.	.	H	α-helix	trans	-52.2	-42.8	174	-31.1	35.4	0	0	0	114.3	S1090 C1094 Y1095 E1096	S1090-P1092 WeakPolarHBondContact OG-CD 2.96Å; P1092-C1094 PolarHBondContact O-N 3.38Å; P1092-Y1095 WeakPolarHBondContact O-CB 3.45Å; P1092-Y1095 PolarHBondContact O-N 3.16Å; P1092-E1096 PolarHBondContact O-N 3.32Å
1093	W	88.6	Confident	86.9	Confident	30 Å²	30	67.8 Å²	67.8	11%	0.114	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-34.8	177.7	-179.9	90.9	0	0	0	112.5	F1067 S1083 W1084 N1087 S1090 N1091 N1097 I1099	F1067-W1093 HydrophobicContact CE1-CH2 4.12Å; F1067-W1093 AromaticContact CE1-CZ2 3.88Å; F1067-W1093 HydrophobicContact CE1-CZ2 3.88Å; F1067-W1093 AromaticContact CZ-CH2 3.98Å; F1067-W1093 HydrophobicContact CZ-CH2 3.98Å; F1067-W1093 AromaticContact CZ-CZ2 3.73Å; F1067-W1093 HydrophobicContact CZ-CZ2 3.73Å; S1083-W1093 VanDerWaalsContact CB-CZ2 3.5Å; W1084-W1093 HydrophobicContact CB-CE3 4.14Å; W1084-W1093 HydrophobicContact CB-CH2 4.17Å; W1084-W1093 HydrophobicContact CB-CZ3 3.63Å; W1084-W1093 AromaticContact CD1-CE3 3.69Å; W1084-W1093 AromaticContact CD1-CZ3 3.95Å; W1084-W1093 HydrophobicContact CG-CE3 4.29Å; W1084-W1093 HydrophobicContact CG-CZ3 4.13Å; N1087-W1093 HydrophobicContact CB-CB 4.36Å; N1087-W1093 HydrophobicContact CB-CD2 4.32Å; N1087-W1093 HydrophobicContact CB-CG 3.94Å; N1087-W1093 PolarHBondContact ND2-NE1 2.93Å; S1090-W1093 PolarHBondContact OG-N 2.92Å; N1091-W1093 VanDerWaalsContact C-N 3.3Å; N1091-W1093 PolarHBondContact O-N 2.79Å; W1093-N1097 PolarHBondContact NE1-ND2 3.2Å; W1093-N1097 PolarHBondContact O-N 2.95Å; W1093-N1097 PolarHBondContact O-ND2 3.09Å; W1093-I1099 HydrophobicContact CH2-CD1 3.73Å; W1093-I1099 HydrophobicContact CZ3-CD1 3.68Å
1094	C	85.6	Confident	86.8	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-44.1	175.3	-58.6	0	0	0	0	111	W1084 S1090 N1091 P1092 N1097 F1098 I1099 A1101	W1084-C1094 VanDerWaalsContact CD1-SG 3.5Å; W1084-C1094 PolarHBondContact NE1-SG 3.29Å; S1090-C1094 PolarHBondContact O-SG 2.89Å; N1091-C1094 WeakPolarHBondContact O-CB 3.25Å; N1091-C1094 PolarHBondContact O-N 3.25Å; P1092-C1094 PolarHBondContact O-N 3.38Å; C1094-N1097 PolarHBondContact O-N 3.06Å; C1094-F1098 PolarHBondContact O-N 3.47Å; C1094-F1098 VanDerWaalsContact O-N 3.13Å; C1094-I1099 HydrophobicContact CB-CB 4.4Å; C1094-I1099 WeakPolarHBondContact CB-O 3.35Å; C1094-I1099 PolarHBondContact O-N 3.21Å; C1094-A1101 HydrophobicContact CB-CB 3.88Å
1095	Y	84.1	Confident	86.6	Confident	184 Å²	184	71.9 Å²	71.9	72%	0.722	34%	0.337	S	S	*	.	H	α-helix	trans	-63.1	-47	179.2	-175.2	-101.2	0	0	0	111.9	N1091 P1092 N1097 F1098	N1091-Y1095 PolarHBondContact O-N 3.05Å; P1092-Y1095 WeakPolarHBondContact O-CB 3.45Å; P1092-Y1095 PolarHBondContact O-N 3.16Å; Y1095-N1097 PolarHBondContact O-N 3.13Å; Y1095-N1097 VanDerWaalsContact O-N 3.16Å; Y1095-F1098 PolarHBondContact O-N 3.26Å
1096	E	85.5	Confident	86.3	Confident	111 Å²	111	72.6 Å²	72.6	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-60.6	-24.4	177.9	-73.7	176.7	-156.3	0	0	114.3	K1063 P1092	K1063-E1096 WeakPolarHBondContact CD-O 3.46Å; K1063-E1096 WeakPolarHBondContact CE-O 3.46Å; K1063-E1096 PolarHBondContact NZ-O 3.36Å; P1092-E1096 PolarHBondContact O-N 3.32Å
1097	N	86.1	Confident	86.2	Confident	17 Å²	17	66.6 Å²	66.6	9%	0.091	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	10.4	-178	-64.9	-68.3	0	0	0	113	K1063 F1067 W1093 C1094 Y1095 I1099	K1063-N1097 WeakPolarHBondContact CD-OD1 3.46Å; F1067-N1097 HydrophobicContact CE2-CB 4.2Å; F1067-N1097 HydrophobicContact CZ-CB 4.28Å; W1093-N1097 PolarHBondContact NE1-ND2 3.2Å; W1093-N1097 PolarHBondContact O-N 2.95Å; W1093-N1097 PolarHBondContact O-ND2 3.09Å; C1094-N1097 PolarHBondContact O-N 3.06Å; Y1095-N1097 PolarHBondContact O-N 3.13Å; Y1095-N1097 VanDerWaalsContact O-N 3.16Å; N1097-I1099 HydrophobicContact CB-CD1 3.81Å; N1097-I1099 HydrophobicContact CB-CG1 4.35Å; N1097-I1099 PolarHBondContact O-N 2.85Å
1098	F	84.8	Confident	86.2	Confident	32 Å²	32	64.8 Å²	64.8	14%	0.14	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	45	-179.6	-60.2	-94.1	0	0	0	113.4	Y1051 P1053 K1056 L1059 A1060 K1063 C1094 Y1095	Y1051-F1098 PolarHBondContact N-O 2.8Å; Y1051-F1098 WeakPolarHBondContact O-CB 3.28Å; P1053-F1098 HydrophobicContact CG-CD1 3.94Å; P1053-F1098 HydrophobicContact CG-CE1 3.93Å; K1056-F1098 HydrophobicContact CB-CE1 4.13Å; K1056-F1098 HydrophobicContact CB-CZ 4.26Å; L1059-F1098 HydrophobicContact CB-CE2 4.48Å; L1059-F1098 HydrophobicContact CD2-CE2 4.05Å; L1059-F1098 HydrophobicContact CD2-CZ 3.99Å; L1059-F1098 HydrophobicContact CG-CE2 3.9Å; L1059-F1098 HydrophobicContact CG-CZ 4.21Å; A1060-F1098 HydrophobicContact CB-CB 3.97Å; A1060-F1098 HydrophobicContact CB-CD1 4.01Å; A1060-F1098 HydrophobicContact CB-CD2 4Å; A1060-F1098 HydrophobicContact CB-CG 3.72Å; K1063-F1098 HydrophobicContact CB-CD2 4.34Å; K1063-F1098 HydrophobicContact CG-CD2 4.15Å; K1063-F1098 HydrophobicContact CG-CE2 4.31Å; C1094-F1098 PolarHBondContact O-N 3.47Å; C1094-F1098 VanDerWaalsContact O-N 3.13Å; Y1095-F1098 PolarHBondContact O-N 3.26Å
1099	I	86.2	Confident	86.1	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.051	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-115.3	139	-179.4	-63.8	160.6	0	0	0	110.6	V1049 F1067 V1080 W1093 C1094 N1097 A1101 L1104	V1049-I1099 HydrophobicContact CG1-CG2 3.57Å; F1067-I1099 HydrophobicContact CE2-CD1 4.3Å; F1067-I1099 HydrophobicContact CZ-CD1 4.39Å; V1080-I1099 HydrophobicContact CG1-CD1 3.9Å; W1093-I1099 HydrophobicContact CH2-CD1 3.73Å; W1093-I1099 HydrophobicContact CZ3-CD1 3.68Å; C1094-I1099 HydrophobicContact CB-CB 4.4Å; C1094-I1099 WeakPolarHBondContact CB-O 3.35Å; C1094-I1099 PolarHBondContact O-N 3.21Å; N1097-I1099 HydrophobicContact CB-CD1 3.81Å; N1097-I1099 HydrophobicContact CB-CG1 4.35Å; N1097-I1099 PolarHBondContact O-N 2.85Å; I1099-A1101 PolarHBondContact O-N 3.28Å; I1099-L1104 HydrophobicContact CG2-CD1 3.43Å; I1099-L1104 VanDerWaalsContact CG2-CD1 3.43Å; I1099-L1104 HydrophobicContact CG2-CD2 4.45Å; I1099-L1104 HydrophobicContact CG2-CG 3.8Å
1100	Q	83.1	Confident	86.2	Confident	78 Å²	78	55.3 Å²	55.3	36%	0.364	26%	0.256	S	S	.	.			trans	-78.6	99.5	179.9	-59.5	-169.1	43.8	0	0	111.4	N1048 V1049 R1102 S1103 L1104	N1048-Q1100 PolarHBondContact O-NE2 3.09Å; V1049-Q1100 PolarHBondContact O-N 3.39Å; Q1100-R1102 PolarHBondContact O-N 2.83Å; Q1100-R1102 VanDerWaalsContact O-N 3.15Å; Q1100-S1103 WeakPolarHBondContact O-CB 3.38Å; Q1100-S1103 PolarHBondContact O-N 3.35Å; Q1100-L1104 PolarHBondContact O-N 3.18Å; Q1100-L1104 VanDerWaalsContact O-N 3.11Å
1101	A	83.4	Confident	86.4	Confident	21 Å²	21	54.9 Å²	54.9	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-31.2	179.5	0	0	0	0	0	113.7	C1094 I1099 R1105	C1094-A1101 HydrophobicContact CB-CB 3.88Å; I1099-A1101 PolarHBondContact O-N 3.28Å; A1101-R1105 WeakPolarHBondContact O-CG 3.41Å; A1101-R1105 PolarHBondContact O-N 2.68Å
1102	R	81.8	Confident	86.5	Confident	156 Å²	156	56.6 Å²	56.6	59%	0.589	25%	0.251	S	S	*	.	H	α-helix	trans	-63.2	-44.2	173.8	-177.9	-176.1	-78	-155.4	-8.7	111.6	S850 Q1100 R1106	S850-R1102 PolarHBondContact OG-NH1 3.3Å; S850-R1102 PolarHBondContact OG-NH2 3.49Å; Q1100-R1102 PolarHBondContact O-N 2.83Å; Q1100-R1102 VanDerWaalsContact O-N 3.15Å; R1102-R1106 PolarHBondContact O-N 3.04Å; R1102-R1106 VanDerWaalsContact O-N 3.11Å
1103	S	85.7	Confident	86.5	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-66.1	-43	177.8	-57.7	0	0	0	0	111.5	Q1100 R1106 A1107	Q1100-S1103 WeakPolarHBondContact O-CB 3.38Å; Q1100-S1103 PolarHBondContact O-N 3.35Å; S1103-R1106 PolarHBondContact O-N 2.98Å; S1103-A1107 PolarHBondContact O-N 3.21Å
1104	L	87.6	Confident	86.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-40.1	177	-74.2	-175.5	0	0	0	113.6	M1043 V1049 V1080 W1084 I1099 Q1100 A1107 Q1108	M1043-L1104 HydrophobicContact CE-CD2 3.74Å; M1043-L1104 HydrophobicContact SD-CD2 3.82Å; V1049-L1104 HydrophobicContact CG1-CD2 3.79Å; V1049-L1104 HydrophobicContact CG1-CG 4.16Å; V1080-L1104 HydrophobicContact CG1-CD2 4.34Å; W1084-L1104 HydrophobicContact CB-CD1 4.01Å; W1084-L1104 HydrophobicContact CD2-CB 3.96Å; W1084-L1104 HydrophobicContact CD2-CD1 3.61Å; W1084-L1104 HydrophobicContact CD2-CG 4.35Å; W1084-L1104 HydrophobicContact CE3-CB 3.76Å; W1084-L1104 HydrophobicContact CE3-CD1 4.03Å; W1084-L1104 HydrophobicContact CE3-CD2 4.44Å; W1084-L1104 HydrophobicContact CE3-CG 4.32Å; W1084-L1104 HydrophobicContact CG-CD1 3.6Å; W1084-L1104 HydrophobicContact CH2-CB 3.84Å; W1084-L1104 HydrophobicContact CZ2-CB 3.99Å; W1084-L1104 HydrophobicContact CZ3-CB 3.7Å; W1084-L1104 VanDerWaalsContact CZ3-O 3.3Å; W1084-L1104 WeakPolarHBondContact CZ3-O 3.41Å; I1099-L1104 HydrophobicContact CG2-CD1 3.43Å; I1099-L1104 VanDerWaalsContact CG2-CD1 3.43Å; I1099-L1104 HydrophobicContact CG2-CD2 4.45Å; I1099-L1104 HydrophobicContact CG2-CG 3.8Å; Q1100-L1104 PolarHBondContact O-N 3.18Å; Q1100-L1104 VanDerWaalsContact O-N 3.11Å; L1104-A1107 PolarHBondContact O-N 3.45Å; L1104-Q1108 PolarHBondContact O-N 3.19Å
1105	R	87.4	Confident	86.7	Confident	123 Å²	123	56.2 Å²	56.2	46%	0.464	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-48.1	172.1	-72.4	175.8	-174.9	-128.9	-0.1	111.3	W1084 N1091 A1101 A1107 Q1108 D1109	W1084-R1105 HydrophobicContact CH2-CG 3.96Å; W1084-R1105 HydrophobicContact CZ2-CG 4.1Å; N1091-R1105 PolarHBondContact ND2-NH2 2.8Å; N1091-R1105 PolarHBondContact OD1-NH2 3.18Å; A1101-R1105 WeakPolarHBondContact O-CG 3.41Å; A1101-R1105 PolarHBondContact O-N 2.68Å; R1105-A1107 VanDerWaalsContact C-N 3.29Å; R1105-A1107 PolarHBondContact O-N 2.81Å; R1105-Q1108 WeakPolarHBondContact O-CA 3.15Å; R1105-Q1108 VanDerWaalsContact O-CB 3.31Å; R1105-Q1108 WeakPolarHBondContact O-CB 3.48Å; R1105-Q1108 PolarHBondContact O-N 2.83Å; R1105-D1109 PolarHBondContact O-N 2.89Å; R1105-D1109 VanDerWaalsContact O-OD2 3.11Å
1106	R	84.9	Confident	86.8	Confident	92 Å²	92	49 Å²	49	35%	0.347	23%	0.226	S	C	.	.	H	α-helix	trans	-58	-39.9	175.2	-174.6	175.8	169.5	-178.1	-5.8	112.4	V1046 R1102 S1103 D1109 I1110	V1046-R1106 HydrophobicContact CG2-CB 4.36Å; V1046-R1106 HydrophobicContact CG2-CG 4.07Å; R1102-R1106 PolarHBondContact O-N 3.04Å; R1102-R1106 VanDerWaalsContact O-N 3.11Å; S1103-R1106 PolarHBondContact O-N 2.98Å; R1106-D1109 PolarHBondContact O-N 3.24Å; R1106-I1110 HydrophobicContact CG-CD1 4.04Å; R1106-I1110 WeakPolarHBondContact O-CD1 3.33Å; R1106-I1110 WeakPolarHBondContact O-CG1 3.3Å; R1106-I1110 PolarHBondContact O-N 3.33Å
1107	A	89.6	Confident	86.9	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.4	-40.9	173.9	0	0	0	0	0	112	S1042 M1043 V1046 S1103 L1104 R1105 D1109 I1110 R1111	S1042-A1107 WeakPolarHBondContact CB-O 3.48Å; S1042-A1107 WeakPolarHBondContact O-CB 3.38Å; M1043-A1107 HydrophobicContact CG-CB 4.46Å; M1043-A1107 HydrophobicContact SD-CB 3.68Å; V1046-A1107 HydrophobicContact CG2-CB 4.09Å; S1103-A1107 PolarHBondContact O-N 3.21Å; L1104-A1107 PolarHBondContact O-N 3.45Å; R1105-A1107 VanDerWaalsContact C-N 3.29Å; R1105-A1107 PolarHBondContact O-N 2.81Å; A1107-D1109 VanDerWaalsContact C-N 3.33Å; A1107-D1109 PolarHBondContact O-N 2.67Å; A1107-I1110 PolarHBondContact O-N 3.23Å; A1107-R1111 WeakPolarHBondContact O-CB 3.38Å; A1107-R1111 PolarHBondContact O-N 3.26Å
1108	Q	89.6	Confident	86.9	Confident	37 Å²	37	43.1 Å²	43.1	17%	0.173	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-40.9	173.1	-175	-174.1	52.3	0	0	112	Y1081 W1084 F1089 L1104 R1105 R1111 K1112	Y1081-Q1108 HydrophobicContact CE2-CB 4.31Å; W1084-Q1108 HydrophobicContact CH2-CB 4.47Å; W1084-Q1108 HydrophobicContact CZ3-CB 4.16Å; F1089-Q1108 VanDerWaalsContact CE1-NE2 3.27Å; L1104-Q1108 PolarHBondContact O-N 3.19Å; R1105-Q1108 WeakPolarHBondContact O-CA 3.15Å; R1105-Q1108 VanDerWaalsContact O-CB 3.31Å; R1105-Q1108 WeakPolarHBondContact O-CB 3.48Å; R1105-Q1108 PolarHBondContact O-N 2.83Å; Q1108-R1111 WeakPolarHBondContact O-CB 3.46Å; Q1108-R1111 PolarHBondContact O-N 3.24Å; Q1108-K1112 WeakPolarHBondContact O-CG 3.28Å; Q1108-K1112 PolarHBondContact O-N 3.34Å
1109	D	87.4	Confident	87.1	Confident	60 Å²	60	46.1 Å²	46.1	32%	0.321	22%	0.216	S	C	.	.	H	α-helix	trans	-73.9	-35.4	-179	-61.1	-39.1	0	0	0	112.5	R1105 R1106 A1107 R1111 K1112 Q1113	R1105-D1109 PolarHBondContact O-N 2.89Å; R1105-D1109 VanDerWaalsContact O-OD2 3.11Å; R1106-D1109 PolarHBondContact O-N 3.24Å; A1107-D1109 VanDerWaalsContact C-N 3.33Å; A1107-D1109 PolarHBondContact O-N 2.67Å; D1109-R1111 VanDerWaalsContact C-N 3.34Å; D1109-K1112 PolarHBondContact O-N 2.96Å; D1109-K1112 IonicContact OD1-NZ 2.83Å; D1109-K1112 PolarHBondContact OD1-NZ 2.87Å; D1109-Q1113 PolarHBondContact O-N 3.09Å
1110	I	88.7	Confident	87.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-48.5	165.9	-65.6	157.7	0	0	0	110	F680 V1046 R1106 A1107 K1112 Q1113 M1114	F680-I1110 HydrophobicContact CD1-CG1 3.76Å; F680-I1110 HydrophobicContact CD2-CG1 4.14Å; F680-I1110 HydrophobicContact CE1-CB 4.28Å; F680-I1110 HydrophobicContact CE1-CD1 4.42Å; F680-I1110 HydrophobicContact CE1-CG1 3.46Å; F680-I1110 VanDerWaalsContact CE1-CG1 3.46Å; F680-I1110 HydrophobicContact CE1-CG2 4.33Å; F680-I1110 HydrophobicContact CE2-CD1 4.06Å; F680-I1110 HydrophobicContact CE2-CG1 3.83Å; F680-I1110 HydrophobicContact CG-CG1 4.09Å; F680-I1110 HydrophobicContact CZ-CD1 3.93Å; F680-I1110 HydrophobicContact CZ-CG1 3.45Å; F680-I1110 VanDerWaalsContact CZ-CG1 3.45Å; V1046-I1110 HydrophobicContact CG2-CD1 3.28Å; R1106-I1110 HydrophobicContact CG-CD1 4.04Å; R1106-I1110 WeakPolarHBondContact O-CD1 3.33Å; R1106-I1110 WeakPolarHBondContact O-CG1 3.3Å; R1106-I1110 PolarHBondContact O-N 3.33Å; A1107-I1110 PolarHBondContact O-N 3.23Å; I1110-K1112 VanDerWaalsContact C-N 3.32Å; I1110-K1112 PolarHBondContact O-N 3.32Å; I1110-Q1113 PolarHBondContact O-N 2.88Å; I1110-Q1113 VanDerWaalsContact O-N 3.12Å; I1110-M1114 HydrophobicContact CG2-CG 4.1Å; I1110-M1114 WeakPolarHBondContact O-CG 3.42Å; I1110-M1114 PolarHBondContact O-N 3.38Å
1111	R	90.7	Very high	87	Confident	33 Å²	33	52.3 Å²	52.3	13%	0.125	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-39.3	-179.5	-161.2	-164.3	167.8	-74	10.7	112	E1035 L1038 T1039 S1042 A1107 Q1108 D1109 L1115	E1035-R1111 VanDerWaalsContact CD-NH2 3.32Å; E1035-R1111 IonicContact OE1-CZ 2.95Å; E1035-R1111 IonicContact OE1-NH2 3.54Å; E1035-R1111 PolarHBondContact OE1-NH2 2.89Å; L1038-R1111 HydrophobicContact CD2-CG 3.9Å; L1038-R1111 HydrophobicContact CG-CG 3.79Å; T1039-R1111 PolarHBondContact OG1-NE 3.31Å; S1042-R1111 WeakPolarHBondContact OG-CA 3.38Å; S1042-R1111 WeakPolarHBondContact OG-CB 3.48Å; S1042-R1111 PolarHBondContact OG-N 3.44Å; A1107-R1111 WeakPolarHBondContact O-CB 3.38Å; A1107-R1111 PolarHBondContact O-N 3.26Å; Q1108-R1111 WeakPolarHBondContact O-CB 3.46Å; Q1108-R1111 PolarHBondContact O-N 3.24Å; D1109-R1111 VanDerWaalsContact C-N 3.34Å; R1111-L1115 VanDerWaalsContact O-CB 3.29Å; R1111-L1115 WeakPolarHBondContact O-CB 3.47Å; R1111-L1115 PolarHBondContact O-N 2.92Å
1112	K	89.4	Confident	87.1	Confident	113 Å²	113	59.8 Å²	59.8	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-63.3	-47.1	172.4	-70.1	168.5	-167.9	153.2	0	111.6	Q1108 D1109 I1110 L1115 G1116	Q1108-K1112 WeakPolarHBondContact O-CG 3.28Å; Q1108-K1112 PolarHBondContact O-N 3.34Å; D1109-K1112 PolarHBondContact O-N 2.96Å; D1109-K1112 IonicContact OD1-NZ 2.83Å; D1109-K1112 PolarHBondContact OD1-NZ 2.87Å; I1110-K1112 VanDerWaalsContact C-N 3.32Å; I1110-K1112 PolarHBondContact O-N 3.32Å; K1112-L1115 WeakPolarHBondContact O-CB 3.49Å; K1112-L1115 PolarHBondContact O-N 2.73Å; K1112-G1116 PolarHBondContact O-N 2.92Å
1113	Q	85.9	Confident	87.1	Confident	55 Å²	55	53 Å²	53	26%	0.257	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-43.2	180	-171.1	-177.6	49	0	0	111.3	F680 D1109 I1110 L1115 G1116 I1117	F680-Q1113 VanDerWaalsContact CD1-OE1 3.29Å; D1109-Q1113 PolarHBondContact O-N 3.09Å; I1110-Q1113 PolarHBondContact O-N 2.88Å; I1110-Q1113 VanDerWaalsContact O-N 3.12Å; Q1113-L1115 VanDerWaalsContact C-N 3.34Å; Q1113-G1116 PolarHBondContact O-N 3.29Å; Q1113-I1117 HydrophobicContact CG-CD1 4.44Å; Q1113-I1117 WeakPolarHBondContact O-CG1 3.07Å; Q1113-I1117 PolarHBondContact O-N 3.42Å
1114	M	87.9	Confident	87	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-36.9	-179.3	-65.9	-48.5	98.8	0	0	111	F1015 P1016 L1017 L1038 I1110 I1117 M1118	F1015-M1114 HydrophobicContact CD1-SD 4.01Å; P1016-M1114 HydrophobicContact CG-CE 3.45Å; P1016-M1114 VanDerWaalsContact CG-CE 3.45Å; P1016-M1114 HydrophobicContact CG-SD 4.09Å; L1017-M1114 HydrophobicContact CD1-CG 4.45Å; L1017-M1114 HydrophobicContact CD1-SD 3.83Å; L1017-M1114 HydrophobicContact CD2-SD 4.35Å; L1017-M1114 HydrophobicContact CG-SD 4.05Å; L1038-M1114 HydrophobicContact CD1-CB 3.34Å; L1038-M1114 HydrophobicContact CD1-CG 4.47Å; I1110-M1114 HydrophobicContact CG2-CG 4.1Å; I1110-M1114 WeakPolarHBondContact O-CG 3.42Å; I1110-M1114 PolarHBondContact O-N 3.38Å; M1114-I1117 HydrophobicContact CE-CD1 3.7Å; M1114-I1117 PolarHBondContact O-N 3.35Å; M1114-I1117 HydrophobicContact SD-CD1 4.08Å; M1114-M1118 WeakPolarHBondContact O-CG 3.32Å; M1114-M1118 PolarHBondContact O-N 2.84Å
1115	L	90	Very high	86.9	Confident	50 Å²	50	61 Å²	61	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-52.5	170.8	-173	66.2	0	0	0	111.3	L1038 R1111 K1112 Q1113 I1117 M1118 D1119 V1125	L1038-L1115 HydrophobicContact CD2-CB 4.14Å; L1038-L1115 HydrophobicContact CD2-CD1 4.04Å; R1111-L1115 VanDerWaalsContact O-CB 3.29Å; R1111-L1115 WeakPolarHBondContact O-CB 3.47Å; R1111-L1115 PolarHBondContact O-N 2.92Å; K1112-L1115 WeakPolarHBondContact O-CB 3.49Å; K1112-L1115 PolarHBondContact O-N 2.73Å; Q1113-L1115 VanDerWaalsContact C-N 3.34Å; L1115-I1117 PolarHBondContact O-N 3.48Å; L1115-I1117 VanDerWaalsContact O-N 3.11Å; L1115-M1118 WeakPolarHBondContact O-CA 3.33Å; L1115-M1118 WeakPolarHBondContact O-CB 3.48Å; L1115-M1118 PolarHBondContact O-N 2.67Å; L1115-D1119 VanDerWaalsContact O-CG 3.27Å; L1115-D1119 PolarHBondContact O-N 2.86Å; L1115-V1125 HydrophobicContact CD1-CG1 4.43Å; L1115-V1125 HydrophobicContact CD1-CG2 3.78Å
1116	G	87.5	Confident	86.9	Confident	31 Å²	31	58.6 Å²	58.6	32%	0.32	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-12.1	177.2	0	0	0	0	0	115	K1112 Q1113 R1120	K1112-G1116 PolarHBondContact O-N 2.92Å; Q1113-G1116 PolarHBondContact O-N 3.29Å; G1116-R1120 VanDerWaalsContact O-CG 3.3Å; G1116-R1120 WeakPolarHBondContact O-CG 3.4Å; G1116-R1120 PolarHBondContact O-NE 2.93Å
1117	I	86.2	Confident	86.8	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-81.9	-52.5	164.8	-64.2	167.2	0	0	0	109	F1015 Q1113 M1114 L1115 D1119 R1120 H1121	F1015-I1117 HydrophobicContact CD1-CB 4.21Å; F1015-I1117 HydrophobicContact CD1-CD1 4.25Å; F1015-I1117 HydrophobicContact CD1-CG2 3.66Å; F1015-I1117 HydrophobicContact CE1-CB 3.89Å; F1015-I1117 HydrophobicContact CE1-CG2 3.38Å; F1015-I1117 HydrophobicContact CE2-CG2 4.43Å; F1015-I1117 HydrophobicContact CG-CG2 4.31Å; F1015-I1117 HydrophobicContact CZ-CG2 3.8Å; Q1113-I1117 HydrophobicContact CG-CD1 4.44Å; Q1113-I1117 WeakPolarHBondContact O-CG1 3.07Å; Q1113-I1117 PolarHBondContact O-N 3.42Å; M1114-I1117 HydrophobicContact CE-CD1 3.7Å; M1114-I1117 PolarHBondContact O-N 3.35Å; M1114-I1117 HydrophobicContact SD-CD1 4.08Å; L1115-I1117 PolarHBondContact O-N 3.48Å; L1115-I1117 VanDerWaalsContact O-N 3.11Å; I1117-D1119 VanDerWaalsContact C-N 3.32Å; I1117-D1119 PolarHBondContact O-N 3.43Å; I1117-R1120 PolarHBondContact O-N 3.29Å; I1117-R1120 VanDerWaalsContact O-N 3.09Å; I1117-H1121 PolarHBondContact O-CD2 3.18Å; I1117-H1121 PolarHBondContact O-N 2.98Å; I1117-H1121 VanDerWaalsContact O-N 3.14Å
1118	M	87.4	Confident	86.2	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-53.9	-43.9	178.9	-70.3	-177.1	70.7	0	0	113.2	F1015 L1025 V1029 L1038 M1114 L1115 R1120 H1121 K1122 L1123 V1125	F1015-M1118 HydrophobicContact CE1-CG 4.08Å; F1015-M1118 HydrophobicContact CZ-CG 4.13Å; L1025-M1118 HydrophobicContact CD1-SD 4.02Å; L1025-M1118 HydrophobicContact CD2-SD 4.31Å; L1025-M1118 HydrophobicContact CG-SD 4.25Å; V1029-M1118 HydrophobicContact CG2-CE 3.59Å; L1038-M1118 HydrophobicContact CD1-SD 3.87Å; M1114-M1118 WeakPolarHBondContact O-CG 3.32Å; M1114-M1118 PolarHBondContact O-N 2.84Å; L1115-M1118 WeakPolarHBondContact O-CA 3.33Å; L1115-M1118 WeakPolarHBondContact O-CB 3.48Å; L1115-M1118 PolarHBondContact O-N 2.67Å; M1118-R1120 PolarHBondContact O-N 2.82Å; M1118-H1121 CarbonylContact O-C 3.43Å; M1118-H1121 PolarHBondContact O-N 3.27Å; M1118-K1122 PolarHBondContact O-N 3.48Å; M1118-L1123 HydrophobicContact CB-CB 4.09Å; M1118-L1123 HydrophobicContact CE-CB 3.91Å; M1118-L1123 HydrophobicContact CG-CB 4.39Å; M1118-L1123 HydrophobicContact CG-CD1 4.24Å; M1118-L1123 PolarHBondContact O-N 3.44Å; M1118-V1125 HydrophobicContact CE-CG2 4.05Å
1119	D	87.8	Confident	85.6	Confident	95 Å²	95	59 Å²	59	51%	0.508	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-44.2	177.3	-64.1	-28.1	0	0	0	111.7	L1115 I1117 H1121 K1122	L1115-D1119 VanDerWaalsContact O-CG 3.27Å; L1115-D1119 PolarHBondContact O-N 2.86Å; I1117-D1119 VanDerWaalsContact C-N 3.32Å; I1117-D1119 PolarHBondContact O-N 3.43Å; D1119-H1121 VanDerWaalsContact C-N 3.31Å; D1119-H1121 PolarHBondContact O-N 3.09Å; D1119-K1122 PolarHBondContact O-N 2.86Å
1120	R	86.2	Confident	85	Confident	168 Å²	168	65.3 Å²	65.3	63%	0.634	34%	0.339	S	S	*	.	H	α-helix	trans	-65.5	-32.9	178.3	-70.1	-176.5	-54.3	147.1	18.8	112.5	G1116 I1117 M1118	G1116-R1120 VanDerWaalsContact O-CG 3.3Å; G1116-R1120 WeakPolarHBondContact O-CG 3.4Å; G1116-R1120 PolarHBondContact O-NE 2.93Å; I1117-R1120 PolarHBondContact O-N 3.29Å; I1117-R1120 VanDerWaalsContact O-N 3.09Å; M1118-R1120 PolarHBondContact O-N 2.82Å
1121	H	82.3	Confident	84.7	Confident	49 Å²	49	67 Å²	67	23%	0.227	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	4.6	176.7	-60.3	-69.4	0	0	0	113.9	E1014 I1117 M1118 D1119 L1123	E1014-H1121 IonicContact OE1-CE1 2.94Å; E1014-H1121 PolarHBondContact OE1-CE1 3.44Å; E1014-H1121 IonicContact OE1-ND1 3.3Å; E1014-H1121 IonicContact OE2-CE1 2.67Å; E1014-H1121 PolarHBondContact OE2-CE1 2.91Å; E1014-H1121 IonicContact OE2-ND1 3Å; E1014-H1121 PolarHBondContact OE2-ND1 3.22Å; E1014-H1121 IonicContact OE2-NE2 2.73Å; I1117-H1121 PolarHBondContact O-CD2 3.18Å; I1117-H1121 PolarHBondContact O-N 2.98Å; I1117-H1121 VanDerWaalsContact O-N 3.14Å; M1118-H1121 CarbonylContact O-C 3.43Å; M1118-H1121 PolarHBondContact O-N 3.27Å; D1119-H1121 VanDerWaalsContact C-N 3.31Å; D1119-H1121 PolarHBondContact O-N 3.09Å; H1121-L1123 HydrophobicContact CB-CD1 4.42Å; H1121-L1123 HydrophobicContact CB-CG 4.27Å
1122	K	84.1	Confident	84.3	Confident	179 Å²	179	67.5 Å²	67.5	78%	0.778	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	53.3	-179.4	-54.7	-179.6	-177.2	-179.4	0	112.1	M1118 D1119	M1118-K1122 PolarHBondContact O-N 3.48Å; D1119-K1122 PolarHBondContact O-N 2.86Å
1123	L	83.3	Confident	84.3	Confident	14 Å²	14	65.5 Å²	65.5	7%	0.073	36%	0.357	C	S	.	.			trans	-103.3	109.7	174.7	-64.5	177.8	0	0	0	109.2	F1015 V1029 M1118 H1121 V1125	F1015-L1123 HydrophobicContact CZ-CD1 4.14Å; V1029-L1123 HydrophobicContact CG1-CB 4.44Å; V1029-L1123 HydrophobicContact CG1-CD2 4.46Å; V1029-L1123 HydrophobicContact CG2-CB 4.09Å; M1118-L1123 HydrophobicContact CB-CB 4.09Å; M1118-L1123 HydrophobicContact CE-CB 3.91Å; M1118-L1123 HydrophobicContact CG-CB 4.39Å; M1118-L1123 HydrophobicContact CG-CD1 4.24Å; M1118-L1123 PolarHBondContact O-N 3.44Å; H1121-L1123 HydrophobicContact CB-CD1 4.42Å; H1121-L1123 HydrophobicContact CB-CG 4.27Å; L1123-V1125 PolarHBondContact O-N 3.4Å
1124	D	83.3	Confident	84.5	Confident	122 Å²	122	69.2 Å²	69.2	65%	0.652	37%	0.368	S	S	*	.			trans	-64.7	133.3	-173.6	-61.4	-51.6	0	0	0	112.4	S1034	S1034-D1124 PolarHBondContact OG-O 3.36Å
1125	V	84.3	Confident	84.6	Confident	54 Å²	54	69.3 Å²	69.3	33%	0.327	37%	0.369	S	S	.	.			trans	-101.2	104.4	-177.7	-177.4	0	0	0	0	109.3	S1034 E1035 L1115 M1118 L1123	S1034-V1125 WeakPolarHBondContact OG-CA 3.43Å; E1035-V1125 HydrophobicContact CB-CG1 4.19Å; L1115-V1125 HydrophobicContact CD1-CG1 4.43Å; L1115-V1125 HydrophobicContact CD1-CG2 3.78Å; M1118-V1125 HydrophobicContact CE-CG2 4.05Å; L1123-V1125 PolarHBondContact O-N 3.4Å
1126	V	87.3	Confident	84.7	Confident	73 Å²	73	67.4 Å²	67.4	44%	0.442	36%	0.359	S	S	.	.			trans	-121.1	139.7	-176.9	-176.5	0	0	0	0	108.8	C1033 S1034 E1035	C1033-V1126 CarbonylContact C-O 3.45Å; S1034-V1126 PolarHBondContact N-O 3.42Å; S1034-V1126 PolarHBondContact OG-N 3.15Å; S1034-V1126 PolarHBondContact OG-O 3.48Å; E1035-V1126 PolarHBondContact N-O 3.43Å
1127	S	84.4	Confident	84.8	Confident	62 Å²	62	68.1 Å²	68.1	43%	0.434	35%	0.353	S	S	.	.			trans	-92.2	132.9	172.3	168.2	0	0	0	0	110.1	E1036 G1129	E1036-S1127 WeakPolarHBondContact OE1-CA 3.45Å; E1036-S1127 VanDerWaalsContact OE1-CB 3.31Å; E1036-S1127 WeakPolarHBondContact OE1-CB 3.34Å; E1036-S1127 PolarHBondContact OE1-OG 3.23Å; E1036-S1127 WeakPolarHBondContact OE2-CA 3.45Å; S1127-G1129 VanDerWaalsContact C-N 3.28Å; S1127-G1129 PolarHBondContact OG-N 2.88Å
1128	C	76.8	Confident	85	Confident	18 Å²	18	67.9 Å²	67.9	12%	0.122	35%	0.351	C	S	.	.			trans	-85	2.9	173.4	67.6	0	0	0	0	113.9	C1033 E1036 K1130 A1131 V1135	C1033-C1128 HydrophobicContact CB-CB 3.65Å; C1033-C1128 VanDerWaalsContact CB-SG 3.53Å; E1036-C1128 VanDerWaalsContact CD-SG 3.5Å; E1036-C1128 PolarHBondContact OE1-N 3.28Å; E1036-C1128 VanDerWaalsContact OE1-N 3.13Å; E1036-C1128 PolarHBondContact OE2-N 3.29Å; E1036-C1128 PolarHBondContact OE2-SG 3.08Å; C1128-K1130 PolarHBondContact O-N 2.91Å; C1128-A1131 HydrophobicContact CB-CB 4.33Å; C1128-A1131 PolarHBondContact O-N 2.85Å; C1128-V1135 VanDerWaalsContact SG-CG2 3.54Å
1129	G	77.6	Confident	85.2	Confident	58 Å²	58	67.9 Å²	67.9	60%	0.598	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	-91	173.8	0	0	0	0	0	114.1	E1036 S1127	E1036-G1129 PolarHBondContact OE1-N 3.48Å; S1127-G1129 VanDerWaalsContact C-N 3.28Å; S1127-G1129 PolarHBondContact OG-N 2.88Å
1130	K	74.3	Confident	85.4	Confident	192 Å²	192	63.3 Å²	63.3	84%	0.835	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-0.1	179.3	-66.4	178.9	-173.6	162.6	0	113.9	C1128 T1132	C1128-K1130 PolarHBondContact O-N 2.91Å; K1130-T1132 PolarHBondContact O-N 3.12Å
1131	A	81.7	Confident	85.5	Confident	35 Å²	35	55.3 Å²	55.3	29%	0.289	30%	0.297	S	S	.	.			trans	-78.6	67.4	-175.5	0	0	0	0	0	112.1	C1128 V1133 R1134	C1128-A1131 HydrophobicContact CB-CB 4.33Å; C1128-A1131 PolarHBondContact O-N 2.85Å; A1131-V1133 PolarHBondContact O-N 2.94Å; A1131-V1133 VanDerWaalsContact O-N 3.14Å; A1131-R1134 HydrophobicContact CB-CG 4.13Å; A1131-R1134 WeakPolarHBondContact O-CB 3.19Å; A1131-R1134 PolarHBondContact O-N 2.9Å
1132	T	83.8	Confident	85.7	Confident	43 Å²	43	53 Å²	53	26%	0.264	29%	0.287	S	S	.	.	H	α-helix	trans	-50.3	-37.7	-179	46	0	0	0	0	113.1	L1075 K1130 R1134 V1135 Q1136	L1075-T1132 HydrophobicContact CD1-CG2 4.02Å; L1075-T1132 HydrophobicContact CD2-CG2 4.35Å; K1130-T1132 PolarHBondContact O-N 3.12Å; T1132-R1134 VanDerWaalsContact C-N 3.26Å; T1132-R1134 PolarHBondContact O-N 2.85Å; T1132-V1135 WeakPolarHBondContact O-CA 3.47Å; T1132-V1135 WeakPolarHBondContact O-CB 3.19Å; T1132-V1135 PolarHBondContact O-N 3.13Å; T1132-Q1136 PolarHBondContact O-N 3.01Å
1133	V	88.8	Confident	86	Confident	72 Å²	72	44.5 Å²	44.5	44%	0.436	25%	0.25	S	C	.	.	H	α-helix	trans	-54	-37.3	176	-179.7	0	0	0	0	112.8	A1131 V1135 Q1136 K1137 W1204	A1131-V1133 PolarHBondContact O-N 2.94Å; A1131-V1133 VanDerWaalsContact O-N 3.14Å; V1133-V1135 VanDerWaalsContact C-N 3.34Å; V1133-V1135 PolarHBondContact O-N 2.95Å; V1133-Q1136 PolarHBondContact O-N 2.83Å; V1133-K1137 WeakPolarHBondContact O-CB 3.27Å; V1133-K1137 PolarHBondContact O-N 3.18Å; V1133-W1204 HydrophobicContact CG1-CH2 4.05Å; V1133-W1204 HydrophobicContact CG1-CZ2 3.75Å
1134	R	89.8	Confident	86.2	Confident	132 Å²	132	44 Å²	44	50%	0.498	25%	0.247	S	C	.	.	H	α-helix	trans	-67.2	-36.4	177.2	-62.2	-174.1	-174.8	-179.1	1.6	111.7	C1033 A1131 T1132 A1138	C1033-R1134 HydrophobicContact CB-CB 4.33Å; A1131-R1134 HydrophobicContact CB-CG 4.13Å; A1131-R1134 WeakPolarHBondContact O-CB 3.19Å; A1131-R1134 PolarHBondContact O-N 2.9Å; T1132-R1134 VanDerWaalsContact C-N 3.26Å; T1132-R1134 PolarHBondContact O-N 2.85Å; R1134-A1138 WeakPolarHBondContact O-CB 3.47Å; R1134-A1138 PolarHBondContact O-N 2.95Å
1135	V	90.6	Very high	86.3	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-41.8	174.6	-172.4	0	0	0	0	110.6	C1033 E1036 M1037 I1040 L1075 C1128 T1132 V1133 A1138 I1139	C1033-V1135 HydrophobicContact CB-CG2 4.19Å; E1036-V1135 HydrophobicContact CB-CG2 4.02Å; E1036-V1135 HydrophobicContact CG-CG2 4.38Å; M1037-V1135 HydrophobicContact CE-CG1 3.74Å; M1037-V1135 WeakPolarHBondContact CE-O 3.34Å; I1040-V1135 HydrophobicContact CD1-CG1 3.47Å; I1040-V1135 VanDerWaalsContact CD1-CG1 3.47Å; L1075-V1135 HydrophobicContact CD2-CB 4.36Å; L1075-V1135 HydrophobicContact CD2-CG1 4.11Å; C1128-V1135 VanDerWaalsContact SG-CG2 3.54Å; T1132-V1135 WeakPolarHBondContact O-CA 3.47Å; T1132-V1135 WeakPolarHBondContact O-CB 3.19Å; T1132-V1135 PolarHBondContact O-N 3.13Å; V1133-V1135 VanDerWaalsContact C-N 3.34Å; V1133-V1135 PolarHBondContact O-N 2.95Å; V1135-A1138 PolarHBondContact O-N 2.95Å; V1135-I1139 HydrophobicContact CG1-CD1 4.25Å; V1135-I1139 WeakPolarHBondContact O-CG1 3.43Å; V1135-I1139 PolarHBondContact O-N 3.09Å
1136	Q	90.7	Very high	86.5	Confident	11 Å²	11	39 Å²	39	5%	0.051	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-43.1	176.5	-64.6	170.5	-82.8	0	0	112.1	L1075 T1132 V1133 A1138 I1139 C1140 T1198 T1199 W1204	L1075-Q1136 HydrophobicContact CD1-CG 4.3Å; T1132-Q1136 PolarHBondContact O-N 3.01Å; V1133-Q1136 PolarHBondContact O-N 2.83Å; Q1136-A1138 VanDerWaalsContact C-N 3.34Å; Q1136-A1138 PolarHBondContact O-N 3.17Å; Q1136-I1139 PolarHBondContact O-N 3.22Å; Q1136-C1140 WeakPolarHBondContact O-CB 3.43Å; Q1136-C1140 PolarHBondContact O-N 2.8Å; Q1136-T1198 HydrophobicContact CG-CG2 4.09Å; Q1136-T1199 PolarHBondContact NE2-O 3.13Å; Q1136-T1199 PolarHBondContact NE2-OG1 3.09Å; Q1136-T1199 VanDerWaalsContact NE2-OG1 3.16Å; Q1136-W1204 HydrophobicContact CB-CH2 4.17Å; Q1136-W1204 HydrophobicContact CB-CZ3 3.66Å
1137	K	90.4	Very high	86.6	Confident	46 Å²	46	35.6 Å²	35.6	20%	0.2	19%	0.194	C	C	.	.	H	α-helix	trans	-57.6	-44.5	170.6	-81.3	-158.2	173.9	-156	0	111.8	L1031 V1133 I1139 C1140 S1141 W1204 E1207 F1208	L1031-K1137 HydrophobicContact CD1-CB 4.18Å; V1133-K1137 WeakPolarHBondContact O-CB 3.27Å; V1133-K1137 PolarHBondContact O-N 3.18Å; K1137-I1139 PolarHBondContact O-N 3.42Å; K1137-C1140 WeakPolarHBondContact O-CB 3.18Å; K1137-C1140 PolarHBondContact O-N 3.07Å; K1137-S1141 PolarHBondContact O-N 3.39Å; K1137-W1204 HydrophobicContact CD-CG 4.49Å; K1137-W1204 VanDerWaalsContact CE-CD1 3.44Å; K1137-W1204 HydrophobicContact CG-CD2 3.75Å; K1137-W1204 HydrophobicContact CG-CE3 4.09Å; K1137-W1204 HydrophobicContact CG-CG 4Å; K1137-E1207 WeakPolarHBondContact CE-OE2 3.13Å; K1137-E1207 IonicContact NZ-OE1 3.84Å; K1137-E1207 PolarHBondContact NZ-OE1 2.92Å; K1137-E1207 IonicContact NZ-OE2 3.67Å; K1137-E1207 PolarHBondContact NZ-OE2 3.28Å; K1137-F1208 HydrophobicContact CB-CE2 3.64Å; K1137-F1208 HydrophobicContact CB-CZ 3.82Å; K1137-F1208 HydrophobicContact CD-CE2 3.93Å; K1137-F1208 HydrophobicContact CD-CZ 3.97Å; K1137-F1208 HydrophobicContact CG-CE2 3.85Å; K1137-F1208 HydrophobicContact CG-CZ 4.24Å; K1137-F1208 WeakPolarHBondContact O-CE2 3.15Å
1138	A	91.4	Very high	86.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-41.8	175.6	0	0	0	0	0	112.6	L1031 M1037 R1134 V1135 Q1136 S1141 G1142	L1031-A1138 HydrophobicContact CD1-CB 3.85Å; M1037-A1138 HydrophobicContact CE-CB 3.48Å; M1037-A1138 VanDerWaalsContact CE-CB 3.48Å; R1134-A1138 WeakPolarHBondContact O-CB 3.47Å; R1134-A1138 PolarHBondContact O-N 2.95Å; V1135-A1138 PolarHBondContact O-N 2.95Å; Q1136-A1138 VanDerWaalsContact C-N 3.34Å; Q1136-A1138 PolarHBondContact O-N 3.17Å; A1138-S1141 PolarHBondContact O-N 3.4Å; A1138-S1141 PolarHBondContact O-OG 3.25Å; A1138-G1142 PolarHBondContact O-N 2.58Å
1139	I	91.5	Very high	87.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-50.1	173.7	-66.6	160.7	0	0	0	110.7	M1024 M1037 H1074 V1135 Q1136 K1137 S1141 G1142 F1143 V1182 T1198	M1024-I1139 HydrophobicContact SD-CB 4.14Å; M1024-I1139 HydrophobicContact SD-CG1 3.76Å; M1024-I1139 HydrophobicContact SD-CG2 4.43Å; M1037-I1139 HydrophobicContact CE-CG1 3.73Å; M1037-I1139 HydrophobicContact SD-CG1 4.46Å; H1074-I1139 HydrophobicContact CB-CD1 3.64Å; V1135-I1139 HydrophobicContact CG1-CD1 4.25Å; V1135-I1139 WeakPolarHBondContact O-CG1 3.43Å; V1135-I1139 PolarHBondContact O-N 3.09Å; Q1136-I1139 PolarHBondContact O-N 3.22Å; K1137-I1139 PolarHBondContact O-N 3.42Å; I1139-S1141 VanDerWaalsContact C-N 3.28Å; I1139-S1141 PolarHBondContact O-N 2.95Å; I1139-G1142 PolarHBondContact O-N 3.34Å; I1139-G1142 VanDerWaalsContact O-N 3.09Å; I1139-F1143 HydrophobicContact CG2-CD2 4.35Å; I1139-F1143 PolarHBondContact O-N 3.15Å; I1139-V1182 HydrophobicContact CG2-CG1 4.11Å; I1139-T1198 HydrophobicContact CD1-CG2 4.32Å
1140	C	90.4	Very high	88	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-53.7	-45	177	-169.7	0	0	0	0	111.4	Q1136 K1137 G1142 F1143 F1144 I1200 F1208	Q1136-C1140 WeakPolarHBondContact O-CB 3.43Å; Q1136-C1140 PolarHBondContact O-N 2.8Å; K1137-C1140 WeakPolarHBondContact O-CB 3.18Å; K1137-C1140 PolarHBondContact O-N 3.07Å; C1140-G1142 PolarHBondContact O-N 3.31Å; C1140-G1142 VanDerWaalsContact O-N 3.13Å; C1140-F1143 PolarHBondContact O-N 3.14Å; C1140-F1144 WeakPolarHBondContact O-CB 3.49Å; C1140-F1144 PolarHBondContact O-N 3.26Å; C1140-I1200 HydrophobicContact CB-CG2 4.38Å; C1140-F1208 HydrophobicContact CB-CD2 4.46Å
1141	S	88.4	Confident	88.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.1	-26.4	-180	81.1	0	0	0	0	115.2	K1023 M1027 K1137 A1138 I1139 F1144	K1023-S1141 WeakPolarHBondContact CD-O 3.36Å; K1023-S1141 WeakPolarHBondContact CE-O 3.46Å; K1023-S1141 PolarHBondContact NZ-O 2.81Å; M1027-S1141 WeakPolarHBondContact CB-OG 3.42Å; M1027-S1141 WeakPolarHBondContact CG-OG 3.49Å; K1137-S1141 PolarHBondContact O-N 3.39Å; A1138-S1141 PolarHBondContact O-N 3.4Å; A1138-S1141 PolarHBondContact O-OG 3.25Å; I1139-S1141 VanDerWaalsContact C-N 3.28Å; I1139-S1141 PolarHBondContact O-N 2.95Å; S1141-F1144 WeakPolarHBondContact O-CD1 3.32Å
1142	G	87.4	Confident	88.3	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-94.1	-35.8	176.9	0	0	0	0	0	114.2	M1020 A1138 I1139 C1140	M1020-G1142 WeakPolarHBondContact CB-O 3.42Å; A1138-G1142 PolarHBondContact O-N 2.58Å; I1139-G1142 PolarHBondContact O-N 3.34Å; I1139-G1142 VanDerWaalsContact O-N 3.09Å; C1140-G1142 PolarHBondContact O-N 3.31Å; C1140-G1142 VanDerWaalsContact O-N 3.13Å
1143	F	89.8	Confident	87.9	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-113.3	20	-171.6	-71.6	-78.1	0	0	0	114.4	M1020 L1021 M1024 I1139 C1140 R1145 N1146 V1182 H1184	M1020-F1143 HydrophobicContact CB-CD1 4.03Å; M1020-F1143 HydrophobicContact CB-CE1 3.71Å; M1020-F1143 HydrophobicContact CB-CZ 4Å; M1020-F1143 HydrophobicContact CE-CD1 4.5Å; M1020-F1143 HydrophobicContact CE-CE1 4.04Å; M1020-F1143 HydrophobicContact CG-CE1 4.46Å; M1020-F1143 HydrophobicContact SD-CD1 3.95Å; M1020-F1143 HydrophobicContact SD-CE1 4.04Å; L1021-F1143 HydrophobicContact CD2-CE2 3.83Å; L1021-F1143 HydrophobicContact CD2-CZ 3.65Å; L1021-F1143 HydrophobicContact CG-CZ 4.09Å; M1024-F1143 HydrophobicContact CE-CE2 3.97Å; M1024-F1143 HydrophobicContact SD-CD2 3.99Å; M1024-F1143 HydrophobicContact SD-CE2 3.81Å; I1139-F1143 HydrophobicContact CG2-CD2 4.35Å; I1139-F1143 PolarHBondContact O-N 3.15Å; C1140-F1143 PolarHBondContact O-N 3.14Å; F1143-R1145 PolarHBondContact O-N 2.91Å; F1143-R1145 VanDerWaalsContact O-N 3.11Å; F1143-N1146 HydrophobicContact CB-CB 4.47Å; F1143-N1146 HydrophobicContact CD1-CB 4.44Å; F1143-N1146 CarbonylContact O-C 3.59Å; F1143-N1146 WeakPolarHBondContact O-CA 3.31Å; F1143-N1146 PolarHBondContact O-N 3.22Å; F1143-V1182 HydrophobicContact CB-CG1 3.43Å; F1143-V1182 VanDerWaalsContact CB-CG1 3.43Å; F1143-V1182 HydrophobicContact CG-CG1 4.47Å; F1143-H1184 AromaticContact CE1-ND1 3.4Å; F1143-H1184 WeakPolarHBondContact CE1-ND1 3.39Å; F1143-H1184 AromaticContact CZ-CE1 3.79Å; F1143-H1184 AromaticContact CZ-ND1 3.28Å; F1143-H1184 VanDerWaalsContact CZ-ND1 3.28Å; F1143-H1184 WeakPolarHBondContact CZ-ND1 3.36Å
1144	F	87.5	Confident	87.2	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-31	175.7	66.4	-84.6	0	0	0	113.9	T995 L996 K1023 C1140 S1141 N1146 L1205 A1209 F1212 F1213	T995-F1144 VanDerWaalsContact O-CZ 3.3Å; T995-F1144 WeakPolarHBondContact O-CZ 3.46Å; L996-F1144 HydrophobicContact CD2-CE1 3.99Å; L996-F1144 HydrophobicContact CD2-CZ 4.48Å; K1023-F1144 HydrophobicContact CD-CE1 4.48Å; C1140-F1144 WeakPolarHBondContact O-CB 3.49Å; C1140-F1144 PolarHBondContact O-N 3.26Å; S1141-F1144 WeakPolarHBondContact O-CD1 3.32Å; F1144-N1146 VanDerWaalsContact C-N 3.29Å; F1144-N1146 PolarHBondContact O-N 3.32Å; F1144-L1205 HydrophobicContact CB-CD2 3.88Å; F1144-A1209 HydrophobicContact CB-CB 4.29Å; F1144-A1209 HydrophobicContact CD1-CB 4.35Å; F1144-A1209 HydrophobicContact CD2-CB 3.46Å; F1144-A1209 VanDerWaalsContact CD2-CB 3.46Å; F1144-A1209 HydrophobicContact CE2-CB 3.87Å; F1144-A1209 HydrophobicContact CG-CB 3.75Å; F1144-A1209 HydrophobicContact CZ-CB 4.48Å; F1144-F1212 HydrophobicContact CD2-CD1 4.21Å; F1144-F1212 HydrophobicContact CE2-CB 4.39Å; F1144-F1212 HydrophobicContact CE2-CD1 4.3Å; F1144-F1212 HydrophobicContact CE2-CG 4.3Å; F1144-F1213 HydrophobicContact CB-CE2 4.05Å; F1144-F1213 HydrophobicContact CD2-CE2 4.05Å; F1144-F1213 VanDerWaalsContact O-CE2 3.29Å; F1144-F1213 WeakPolarHBondContact O-CE2 3.44Å; F1144-F1213 WeakPolarHBondContact O-CZ 3.49Å
1145	R	85.3	Confident	86.9	Confident	46 Å²	46	33.5 Å²	33.5	17%	0.174	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.9	173.1	-163.2	-179.9	177.7	139.8	4.1	112.2	E991 F1143 A1147 I1160	E991-R1145 IonicContact OE2-CZ 3.17Å; E991-R1145 IonicContact OE2-NH1 3.19Å; E991-R1145 PolarHBondContact OE2-NH1 3.06Å; E991-R1145 IonicContact OE2-NH2 3.18Å; E991-R1145 PolarHBondContact OE2-NH2 3.43Å; E991-R1145 VanDerWaalsContact OE2-NH2 3.16Å; F1143-R1145 PolarHBondContact O-N 2.91Å; F1143-R1145 VanDerWaalsContact O-N 3.11Å; R1145-A1147 PolarHBondContact O-N 3.47Å; R1145-I1160 HydrophobicContact CB-CD1 4.4Å; R1145-I1160 HydrophobicContact CG-CD1 3.32Å; R1145-I1160 VanDerWaalsContact O-CD1 3.32Å; R1145-I1160 WeakPolarHBondContact O-CD1 3.34Å
1146	N	88.8	Confident	86.9	Confident	26 Å²	26	33.9 Å²	33.9	14%	0.139	17%	0.173	C	C	.	.	S	Bend	trans	-99.1	54.3	-177.5	-65	15.1	0	0	0	110.8	F1143 F1144 V1182 Y1183 H1184	F1143-N1146 HydrophobicContact CB-CB 4.47Å; F1143-N1146 HydrophobicContact CD1-CB 4.44Å; F1143-N1146 CarbonylContact O-C 3.59Å; F1143-N1146 WeakPolarHBondContact O-CA 3.31Å; F1143-N1146 PolarHBondContact O-N 3.22Å; F1144-N1146 VanDerWaalsContact C-N 3.29Å; F1144-N1146 PolarHBondContact O-N 3.32Å; N1146-V1182 WeakPolarHBondContact O-CA 3.47Å; N1146-Y1183 HydrophobicContact CB-CD1 4.46Å; N1146-Y1183 HydrophobicContact CB-CD2 3.93Å; N1146-Y1183 HydrophobicContact CB-CE1 4.24Å; N1146-Y1183 HydrophobicContact CB-CE2 3.67Å; N1146-Y1183 HydrophobicContact CB-CG 4.31Å; N1146-Y1183 VanDerWaalsContact CB-O 3.24Å; N1146-Y1183 WeakPolarHBondContact CB-O 3.5Å; N1146-Y1183 WeakPolarHBondContact O-CD1 3.27Å; N1146-Y1183 WeakPolarHBondContact O-CE1 3.45Å; N1146-Y1183 PolarHBondContact O-N 3.48Å; N1146-H1184 PolarHBondContact ND2-O 3.5Å
1147	A	89.4	Confident	86.8	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	145.6	178.6	0	0	0	0	0	111.4	R1145 L1159 V1181 V1182 L1205	R1145-A1147 PolarHBondContact O-N 3.47Å; A1147-L1159 HydrophobicContact CB-CD1 3.66Å; A1147-L1159 HydrophobicContact CB-CG 4.2Å; A1147-L1159 PolarHBondContact O-N 3.21Å; A1147-V1181 WeakPolarHBondContact CA-O 3.5Å; A1147-V1182 HydrophobicContact CB-CG2 4.16Å; A1147-L1205 HydrophobicContact CB-CD1 4.24Å; A1147-L1205 HydrophobicContact CB-CD2 4.09Å
1148	A	90.4	Very high	86.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.9	177.2	0	0	0	0	0	111.6	R1157 V1165 V1181 Y1183 M1194	A1148-R1157 CarbonylContact C-O 3.44Å; A1148-R1157 WeakPolarHBondContact CA-O 3.23Å; A1148-R1157 VanDerWaalsContact CB-O 3.29Å; A1148-R1157 WeakPolarHBondContact CB-O 3.5Å; A1148-V1165 HydrophobicContact CB-CG2 4.29Å; A1148-V1181 HydrophobicContact CB-CG2 3.98Å; A1148-V1181 PolarHBondContact N-O 2.95Å; A1148-V1181 PolarHBondContact O-N 3.47Å; A1148-Y1183 HydrophobicContact CB-CD1 4.44Å; A1148-Y1183 HydrophobicContact CB-CE1 4.21Å; A1148-M1194 HydrophobicContact CB-SD 3.79Å
1149	K	89.4	Confident	86.1	Confident	62 Å²	62	36.3 Å²	36.3	27%	0.27	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	141	172.7	175.7	167.1	174.5	137.5	0	109.7	D468 Y1156 R1157 L1159 E1179 W1180	D468-K1149 IonicContact OD1-NZ 2.88Å; K1149-Y1156 CarbonylContact O-C 3.54Å; K1149-Y1156 WeakPolarHBondContact O-CA 3.41Å; K1149-R1157 PolarHBondContact N-O 3.37Å; K1149-R1157 PolarHBondContact O-N 2.6Å; K1149-L1159 HydrophobicContact CB-CD2 4.08Å; K1149-E1179 CarbonylContact C-O 3.6Å; K1149-E1179 WeakPolarHBondContact CA-O 3.47Å; K1149-E1179 WeakPolarHBondContact CE-OE1 3.39Å; K1149-E1179 HydrophobicContact CG-CG 4.47Å; K1149-E1179 IonicContact NZ-OE1 3.63Å; K1149-E1179 PolarHBondContact NZ-OE1 3.36Å; K1149-W1180 HydrophobicContact CB-CD2 4.44Å; K1149-W1180 HydrophobicContact CB-CE3 4.3Å; K1149-W1180 HydrophobicContact CB-CZ3 4.38Å; K1149-W1180 HydrophobicContact CD-CH2 4.08Å; K1149-W1180 HydrophobicContact CD-CZ2 3.66Å; K1149-W1180 HydrophobicContact CG-CZ2 4.45Å
1150	K	88.3	Confident	85.5	Confident	63 Å²	63	38.5 Å²	38.5	27%	0.274	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	131.9	175.5	-169	-177.9	-176.4	179	0	110.6	G1155 Y1156 Q1177 E1179	K1150-G1155 WeakPolarHBondContact CA-O 3.31Å; K1150-G1155 WeakPolarHBondContact CG-O 3.42Å; K1150-Y1156 HydrophobicContact CB-CD1 3.89Å; K1150-Y1156 HydrophobicContact CB-CE1 3.72Å; K1150-Y1156 HydrophobicContact CG-CD1 4.41Å; K1150-Y1156 HydrophobicContact CG-CE1 4.12Å; K1150-Q1177 HydrophobicContact CD-CB 4.42Å; K1150-Q1177 VanDerWaalsContact CE-OE1 3.23Å; K1150-Q1177 VanDerWaalsContact NZ-CB 3.29Å; K1150-Q1177 PolarHBondContact NZ-O 3.38Å; K1150-E1179 HydrophobicContact CB-CG 4.33Å; K1150-E1179 WeakPolarHBondContact CB-O 3.41Å; K1150-E1179 PolarHBondContact N-O 2.72Å
1151	D	83.4	Confident	84.7	Confident	30 Å²	30	41.5 Å²	41.5	16%	0.16	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.5	170.9	-174.2	-53.2	0	0	0	108.6	Q1153 E1154 G1155 R1157	D1151-Q1153 PolarHBondContact O-N 2.87Å; D1151-Q1153 VanDerWaalsContact O-N 3.1Å; D1151-Q1153 WeakPolarHBondContact OD1-CA 3.24Å; D1151-Q1153 PolarHBondContact OD1-N 3.29Å; D1151-E1154 PolarHBondContact OD1-N 3.39Å; D1151-G1155 PolarHBondContact N-O 3.35Å; D1151-G1155 PolarHBondContact O-N 3.49Å; D1151-G1155 VanDerWaalsContact O-O 3.14Å; D1151-R1157 HydrophobicContact CB-CG 4.31Å; D1151-R1157 IonicContact OD2-CZ 3.23Å; D1151-R1157 IonicContact OD2-NE 3.66Å; D1151-R1157 PolarHBondContact OD2-NE 3.41Å; D1151-R1157 IonicContact OD2-NH2 2.78Å; D1151-R1157 PolarHBondContact OD2-NH2 2.95Å
1152	P	78.7	Confident	84.2	Confident	131 Å²	131	45.8 Å²	45.8	85%	0.851	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.7	178.9	-27.2	35.8	0	0	0	115.7
1153	Q	75.6	Confident	84	Confident	172 Å²	172	48 Å²	48	80%	0.804	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-49.6	-178.2	-59.5	-172.5	4.1	0	0	112.8	D1151	D1151-Q1153 PolarHBondContact O-N 2.87Å; D1151-Q1153 VanDerWaalsContact O-N 3.1Å; D1151-Q1153 WeakPolarHBondContact OD1-CA 3.24Å; D1151-Q1153 PolarHBondContact OD1-N 3.29Å
1154	E	74.4	Confident	83.9	Confident	90 Å²	90	50 Å²	50	42%	0.421	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-17.8	-166.8	-61.6	-163.6	134	0	0	115	D1151 R1157 V1164 Y1166	D1151-E1154 PolarHBondContact OD1-N 3.39Å; E1154-R1157 IonicContact OE2-CZ 3.19Å; E1154-R1157 IonicContact OE2-NH1 3.96Å; E1154-R1157 PolarHBondContact OE2-NH1 3.31Å; E1154-R1157 IonicContact OE2-NH2 2.81Å; E1154-R1157 PolarHBondContact OE2-NH2 2.88Å; E1154-V1164 HydrophobicContact CB-CG1 3.92Å; E1154-V1164 HydrophobicContact CB-CG2 4.06Å; E1154-V1164 WeakPolarHBondContact O-CG1 3.19Å; E1154-V1164 WeakPolarHBondContact OE2-CG2 3.23Å; E1154-Y1166 WeakPolarHBondContact O-CE1 3.23Å; E1154-Y1166 PolarHBondContact O-OH 3.41Å
1155	G	84	Confident	84	Confident	21 Å²	21	49.9 Å²	49.9	22%	0.216	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.2	-98.8	178.3	0	0	0	0	0	112.9	K1150 D1151	K1150-G1155 WeakPolarHBondContact CA-O 3.31Å; K1150-G1155 WeakPolarHBondContact CG-O 3.42Å; D1151-G1155 PolarHBondContact N-O 3.35Å; D1151-G1155 PolarHBondContact O-N 3.49Å; D1151-G1155 VanDerWaalsContact O-O 3.14Å
1156	Y	89.4	Confident	84.2	Confident	10 Å²	10	51 Å²	51	4%	0.039	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	150.8	166.7	-67.1	-100.5	0	0	0	109.2	K1149 K1150 V1164 V1165 I1167 Q1177 P1178 V1181 M1194	K1149-Y1156 CarbonylContact O-C 3.54Å; K1149-Y1156 WeakPolarHBondContact O-CA 3.41Å; K1150-Y1156 HydrophobicContact CB-CD1 3.89Å; K1150-Y1156 HydrophobicContact CB-CE1 3.72Å; K1150-Y1156 HydrophobicContact CG-CD1 4.41Å; K1150-Y1156 HydrophobicContact CG-CE1 4.12Å; Y1156-V1164 CarbonylContact O-C 3.56Å; Y1156-V1164 WeakPolarHBondContact O-CA 3.26Å; Y1156-V1165 WeakPolarHBondContact CB-O 3.43Å; Y1156-V1165 PolarHBondContact N-O 2.82Å; Y1156-V1165 PolarHBondContact O-N 2.96Å; Y1156-I1167 HydrophobicContact CD2-CG1 4.41Å; Y1156-I1167 HydrophobicContact CE2-CD1 3.74Å; Y1156-I1167 HydrophobicContact CE2-CG1 3.86Å; Y1156-I1167 WeakPolarHBondContact OH-CD1 3.34Å; Y1156-Q1177 VanDerWaalsContact OH-CA 3.32Å; Y1156-Q1177 WeakPolarHBondContact OH-CA 3.21Å; Y1156-P1178 WeakPolarHBondContact CE1-O 3.35Å; Y1156-P1178 PolarHBondContact OH-O 2.9Å; Y1156-V1181 HydrophobicContact CD1-CG2 4.06Å; Y1156-V1181 HydrophobicContact CE1-CG1 4.24Å; Y1156-V1181 HydrophobicContact CE1-CG2 4.11Å; Y1156-M1194 HydrophobicContact CD1-CE 4.28Å; Y1156-M1194 HydrophobicContact CD2-CE 3.9Å; Y1156-M1194 HydrophobicContact CG-CE 3.77Å
1157	R	87.8	Confident	84.3	Confident	69 Å²	69	50.3 Å²	50.3	26%	0.26	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.8	168	-65.1	-172.5	-162.1	-84.1	-5.3	110.7	A1148 K1149 D1151 E1154 Q1163	A1148-R1157 CarbonylContact C-O 3.44Å; A1148-R1157 WeakPolarHBondContact CA-O 3.23Å; A1148-R1157 VanDerWaalsContact CB-O 3.29Å; A1148-R1157 WeakPolarHBondContact CB-O 3.5Å; K1149-R1157 PolarHBondContact N-O 3.37Å; K1149-R1157 PolarHBondContact O-N 2.6Å; D1151-R1157 HydrophobicContact CB-CG 4.31Å; D1151-R1157 IonicContact OD2-CZ 3.23Å; D1151-R1157 IonicContact OD2-NE 3.66Å; D1151-R1157 PolarHBondContact OD2-NE 3.41Å; D1151-R1157 IonicContact OD2-NH2 2.78Å; D1151-R1157 PolarHBondContact OD2-NH2 2.95Å; E1154-R1157 IonicContact OE2-CZ 3.19Å; E1154-R1157 IonicContact OE2-NH1 3.96Å; E1154-R1157 PolarHBondContact OE2-NH1 3.31Å; E1154-R1157 IonicContact OE2-NH2 2.81Å; E1154-R1157 PolarHBondContact OE2-NH2 2.88Å; R1157-Q1163 VanDerWaalsContact CA-O 3.27Å; R1157-Q1163 WeakPolarHBondContact CA-O 3.34Å
1158	T	86.8	Confident	84.2	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.4	166.5	58.4	0	0	0	0	110.2	I1160 Q1162 Q1163 V1165 Y1183	T1158-I1160 VanDerWaalsContact C-N 3.26Å; T1158-I1160 PolarHBondContact O-N 3.15Å; T1158-Q1162 VanDerWaalsContact O-CA 3.25Å; T1158-Q1162 WeakPolarHBondContact O-CA 3.35Å; T1158-Q1162 PolarHBondContact O-N 3.14Å; T1158-Q1162 PolarHBondContact OG1-N 3.06Å; T1158-Q1163 PolarHBondContact N-O 3.15Å; T1158-Q1163 VanDerWaalsContact N-O 3.09Å; T1158-Q1163 PolarHBondContact OG1-N 2.88Å; T1158-V1165 HydrophobicContact CG2-CG1 3.8Å; T1158-V1165 HydrophobicContact CG2-CG2 4.07Å; T1158-Y1183 HydrophobicContact CG2-CE1 4.47Å
1159	L	81.9	Confident	83.9	Confident	33 Å²	33	56 Å²	56	17%	0.173	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.2	-178.7	-65.4	-176.7	0	0	0	113.3	A1147 K1149 W1180 L1205 F1213	A1147-L1159 HydrophobicContact CB-CD1 3.66Å; A1147-L1159 HydrophobicContact CB-CG 4.2Å; A1147-L1159 PolarHBondContact O-N 3.21Å; K1149-L1159 HydrophobicContact CB-CD2 4.08Å; L1159-W1180 HydrophobicContact CD1-CZ3 3.9Å; L1159-W1180 HydrophobicContact CD2-CH2 4.4Å; L1159-W1180 HydrophobicContact CD2-CZ3 3.8Å; L1159-W1180 HydrophobicContact CG-CZ3 4.46Å; L1159-L1205 HydrophobicContact CD1-CD1 4.01Å; L1159-F1213 HydrophobicContact CB-CE1 4.36Å; L1159-F1213 HydrophobicContact CD1-CE1 3.75Å; L1159-F1213 HydrophobicContact CD1-CZ 3.79Å
1160	I	78.3	Confident	83.6	Confident	45 Å²	45	55.4 Å²	55.4	23%	0.231	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-64.9	-173.4	-58.4	174.4	0	0	0	110.5	L473 R1145 T1158 F1212	L473-I1160 HydrophobicContact CD2-CG1 4.48Å; R1145-I1160 HydrophobicContact CB-CD1 4.4Å; R1145-I1160 HydrophobicContact CG-CD1 3.32Å; R1145-I1160 VanDerWaalsContact O-CD1 3.32Å; R1145-I1160 WeakPolarHBondContact O-CD1 3.34Å; T1158-I1160 VanDerWaalsContact C-N 3.26Å; T1158-I1160 PolarHBondContact O-N 3.15Å; I1160-F1212 HydrophobicContact CD1-CE1 4.17Å; I1160-F1212 HydrophobicContact CD1-CZ 3.79Å; I1160-F1212 HydrophobicContact CG1-CE1 4.29Å; I1160-F1212 HydrophobicContact CG1-CZ 4.06Å
1161	D	72.9	Confident	83.4	Confident	64 Å²	64	52.8 Å²	52.8	34%	0.342	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-4.2	-172.7	-55.2	-50.5	0	0	0	113.7	Q1163	D1161-Q1163 HydrophobicContact CB-CB 4.49Å; D1161-Q1163 HydrophobicContact CB-CG 3.77Å; D1161-Q1163 PolarHBondContact O-N 3.03Å; D1161-Q1163 VanDerWaalsContact O-N 3.09Å
1162	Q	78.6	Confident	83.4	Confident	90 Å²	90	52.1 Å²	52.1	42%	0.421	28%	0.277	S	S	.	.			trans	57.1	20.2	-176.5	-55.2	-178.1	43.5	0	0	114.3	T1158	T1158-Q1162 VanDerWaalsContact O-CA 3.25Å; T1158-Q1162 WeakPolarHBondContact O-CA 3.35Å; T1158-Q1162 PolarHBondContact O-N 3.14Å; T1158-Q1162 PolarHBondContact OG1-N 3.06Å
1163	Q	82.6	Confident	83.7	Confident	46 Å²	46	46 Å²	46	22%	0.215	24%	0.237	C	C	.	.			trans	-71	141.6	-178.4	-73.8	165	5.9	0	0	111.6	R1157 T1158 D1161 V1165	R1157-Q1163 VanDerWaalsContact CA-O 3.27Å; R1157-Q1163 WeakPolarHBondContact CA-O 3.34Å; T1158-Q1163 PolarHBondContact N-O 3.15Å; T1158-Q1163 VanDerWaalsContact N-O 3.09Å; T1158-Q1163 PolarHBondContact OG1-N 2.88Å; D1161-Q1163 HydrophobicContact CB-CB 4.49Å; D1161-Q1163 HydrophobicContact CB-CG 3.77Å; D1161-Q1163 PolarHBondContact O-N 3.03Å; D1161-Q1163 VanDerWaalsContact O-N 3.09Å; Q1163-V1165 PolarHBondContact O-N 3.3Å
1164	V	88	Confident	84.1	Confident	42 Å²	42	42.4 Å²	42.4	26%	0.255	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	106.2	-174.3	-179.3	0	0	0	0	110.6	E1154 Y1156 Y1166	E1154-V1164 HydrophobicContact CB-CG1 3.92Å; E1154-V1164 HydrophobicContact CB-CG2 4.06Å; E1154-V1164 WeakPolarHBondContact O-CG1 3.19Å; E1154-V1164 WeakPolarHBondContact OE2-CG2 3.23Å; Y1156-V1164 CarbonylContact O-C 3.56Å; Y1156-V1164 WeakPolarHBondContact O-CA 3.26Å; V1164-Y1166 HydrophobicContact CG1-CE2 4.08Å; V1164-Y1166 WeakPolarHBondContact CG1-OH 3.49Å
1165	V	89.5	Confident	84.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	154.4	-173	-62	0	0	0	0	111.8	A1148 Y1156 T1158 Q1163 L1186 E1192 M1194	A1148-V1165 HydrophobicContact CB-CG2 4.29Å; Y1156-V1165 WeakPolarHBondContact CB-O 3.43Å; Y1156-V1165 PolarHBondContact N-O 2.82Å; Y1156-V1165 PolarHBondContact O-N 2.96Å; T1158-V1165 HydrophobicContact CG2-CG1 3.8Å; T1158-V1165 HydrophobicContact CG2-CG2 4.07Å; Q1163-V1165 PolarHBondContact O-N 3.3Å; V1165-L1186 HydrophobicContact CB-CD1 3.92Å; V1165-L1186 HydrophobicContact CG1-CD1 3.59Å; V1165-L1186 HydrophobicContact CG1-CD2 3.83Å; V1165-L1186 HydrophobicContact CG1-CG 4.37Å; V1165-E1192 HydrophobicContact CG1-CB 4.02Å; V1165-M1194 HydrophobicContact CB-CG 4.16Å; V1165-M1194 HydrophobicContact CG2-CE 3.92Å; V1165-M1194 HydrophobicContact CG2-CG 4.01Å; V1165-M1194 HydrophobicContact CG2-SD 3.73Å
1166	Y	90.1	Very high	84.1	Confident	70 Å²	70	51 Å²	51	28%	0.275	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.5	-176.7	-61.3	-79.1	0	0	0	111.8	E1154 V1164 H1168 K1191 E1192 Y1193 M1194	E1154-Y1166 WeakPolarHBondContact O-CE1 3.23Å; E1154-Y1166 PolarHBondContact O-OH 3.41Å; V1164-Y1166 HydrophobicContact CG1-CE2 4.08Å; V1164-Y1166 WeakPolarHBondContact CG1-OH 3.49Å; Y1166-H1168 PolarHBondContact O-N 2.89Å; Y1166-K1191 HydrophobicContact CD2-CB 4.13Å; Y1166-K1191 HydrophobicContact CD2-CD 3.81Å; Y1166-K1191 HydrophobicContact CE2-CD 3.74Å; Y1166-E1192 PolarHBondContact N-O 3.37Å; Y1166-Y1193 CarbonylContact O-C 3.57Å; Y1166-Y1193 VanDerWaalsContact O-CA 3.29Å; Y1166-Y1193 WeakPolarHBondContact O-CA 3.33Å; Y1166-M1194 PolarHBondContact O-N 3.07Å
1167	I	90.3	Very high	83.7	Confident	11 Å²	11	56.3 Å²	56.3	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	128.8	170.4	-65.3	177.3	0	0	0	108.7	Y1156 S1171 L1173 F1174 M1194 V1197	Y1156-I1167 HydrophobicContact CD2-CG1 4.41Å; Y1156-I1167 HydrophobicContact CE2-CD1 3.74Å; Y1156-I1167 HydrophobicContact CE2-CG1 3.86Å; Y1156-I1167 WeakPolarHBondContact OH-CD1 3.34Å; I1167-S1171 VanDerWaalsContact CG2-CB 3.45Å; I1167-L1173 HydrophobicContact CD1-CB 4.37Å; I1167-F1174 HydrophobicContact CG2-CB 4.41Å; I1167-F1174 HydrophobicContact CG2-CD2 4.49Å; I1167-M1194 HydrophobicContact CG1-CE 3.84Å; I1167-V1197 HydrophobicContact CG2-CG2 4.36Å
1168	H	87.9	Confident	83.6	Confident	47 Å²	47	54.2 Å²	54.2	22%	0.218	27%	0.273	C	S	.	.			trans	-62.6	136.7	177.6	-169.2	-112.4	0	0	0	111.2	Y1166 S1170 S1171 Y1193 M1194 R1195	Y1166-H1168 PolarHBondContact O-N 2.89Å; H1168-S1170 PolarHBondContact CE1-OG 3.37Å; H1168-S1170 PolarHBondContact ND1-N 3.26Å; H1168-S1170 PolarHBondContact ND1-OG 3.22Å; H1168-S1170 PolarHBondContact O-N 3.05Å; H1168-S1171 WeakPolarHBondContact O-CB 3.45Å; H1168-S1171 PolarHBondContact O-N 3.4Å; H1168-Y1193 HydrophobicContact CB-CD1 4.43Å; H1168-Y1193 HydrophobicContact CB-CG 4.49Å; H1168-Y1193 AromaticContact CD2-CG 3.83Å; H1168-M1194 VanDerWaalsContact CB-O 3.26Å; H1168-M1194 WeakPolarHBondContact CB-O 3.47Å; H1168-M1194 PolarHBondContact N-O 3.39Å; H1168-R1195 HydrophobicContact CB-CG 4.31Å
1169	P	84.1	Confident	83.6	Confident	75 Å²	75	57.7 Å²	57.7	49%	0.487	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-8.5	-178.7	-27	35.8	0	0	0	116.3	F1174	P1169-F1174 HydrophobicContact CB-CD2 4.29Å; P1169-F1174 HydrophobicContact CB-CE2 4.2Å; P1169-F1174 HydrophobicContact CB-CZ 4.41Å; P1169-F1174 HydrophobicContact CG-CD2 4.36Å; P1169-F1174 HydrophobicContact CG-CE2 3.96Å; P1169-F1174 HydrophobicContact CG-CZ 4.36Å
1170	S	82.4	Confident	84	Confident	48 Å²	48	56.9 Å²	56.9	34%	0.336	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.6	170.5	77.4	0	0	0	0	114.4	K1064 H1168	K1064-S1170 PolarHBondContact NZ-O 3.33Å; H1168-S1170 PolarHBondContact CE1-OG 3.37Å; H1168-S1170 PolarHBondContact ND1-N 3.26Å; H1168-S1170 PolarHBondContact ND1-OG 3.22Å; H1168-S1170 PolarHBondContact O-N 3.05Å
1171	S	85.2	Confident	84.7	Confident	8 Å²	8	54.7 Å²	54.7	6%	0.056	27%	0.273	C	S	.	.	S	Bend	trans	-77.4	143.7	175.7	-178.4	0	0	0	0	111.3	D1073 I1167 H1168 L1173 F1174	D1073-S1171 WeakPolarHBondContact OD1-CA 3.34Å; D1073-S1171 PolarHBondContact OD1-OG 3.31Å; D1073-S1171 VanDerWaalsContact OD2-CB 3.25Å; D1073-S1171 WeakPolarHBondContact OD2-CB 3.48Å; D1073-S1171 PolarHBondContact OD2-OG 2.83Å; I1167-S1171 VanDerWaalsContact CG2-CB 3.45Å; H1168-S1171 WeakPolarHBondContact O-CB 3.45Å; H1168-S1171 PolarHBondContact O-N 3.4Å; S1171-L1173 PolarHBondContact O-N 3.1Å; S1171-L1173 PolarHBondContact OG-N 3.24Å; S1171-F1174 WeakPolarHBondContact O-CB 3.45Å; S1171-F1174 PolarHBondContact O-N 3.1Å
1172	A	83.8	Confident	85.6	Confident	16 Å²	16	51.7 Å²	51.7	13%	0.132	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.4	166.7	0	0	0	0	0	112.2	H1068 D1073	H1068-A1172 HydrophobicContact CB-CB 3.98Å; D1073-A1172 WeakPolarHBondContact OD1-CB 3.31Å; D1073-A1172 PolarHBondContact OD1-N 3.09Å
1173	L	84.6	Confident	86.2	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	6.9	177.2	-64.5	175.8	0	0	0	113.8	I1167 S1171 N1175 R1176 V1197 T1199	I1167-L1173 HydrophobicContact CD1-CB 4.37Å; S1171-L1173 PolarHBondContact O-N 3.1Å; S1171-L1173 PolarHBondContact OG-N 3.24Å; L1173-N1175 VanDerWaalsContact C-N 3.32Å; L1173-N1175 PolarHBondContact O-N 3.35Å; L1173-R1176 HydrophobicContact CD2-CB 4.42Å; L1173-R1176 CarbonylContact O-C 3.58Å; L1173-R1176 PolarHBondContact O-N 2.98Å; L1173-V1197 HydrophobicContact CD1-CB 4.14Å; L1173-V1197 HydrophobicContact CD1-CG1 3.94Å; L1173-T1199 HydrophobicContact CD1-CG2 3.93Å; L1173-T1199 HydrophobicContact CD2-CG2 4.02Å
1174	F	84.2	Confident	86.5	Confident	98 Å²	98	46.9 Å²	46.9	43%	0.43	23%	0.234	S	C	.	.	S	Bend	trans	-60.8	-39.8	178.2	-176.2	-105.9	0	0	0	112.9	I1167 P1169 S1171	I1167-F1174 HydrophobicContact CG2-CB 4.41Å; I1167-F1174 HydrophobicContact CG2-CD2 4.49Å; P1169-F1174 HydrophobicContact CB-CD2 4.29Å; P1169-F1174 HydrophobicContact CB-CE2 4.2Å; P1169-F1174 HydrophobicContact CB-CZ 4.41Å; P1169-F1174 HydrophobicContact CG-CD2 4.36Å; P1169-F1174 HydrophobicContact CG-CE2 3.96Å; P1169-F1174 HydrophobicContact CG-CZ 4.36Å; S1171-F1174 WeakPolarHBondContact O-CB 3.45Å; S1171-F1174 PolarHBondContact O-N 3.1Å
1175	N	79.6	Confident	86.3	Confident	153 Å²	153	49.1 Å²	49.1	82%	0.818	24%	0.241	S	C	*	.	S	Bend	trans	-86.1	-11.1	178.7	-68.7	1	0	0	0	113.9	L1173	L1173-N1175 VanDerWaalsContact C-N 3.32Å; L1173-N1175 PolarHBondContact O-N 3.35Å
1176	R	79	Confident	86.1	Confident	139 Å²	139	50 Å²	50	53%	0.525	25%	0.246	S	C	.	.			trans	-122.4	106.9	-178	-176.5	-174.3	-170	-164.3	4.1	108.2	P1070 L1173 P1178	P1070-R1176 PolarHBondContact O-NH1 3.23Å; L1173-R1176 HydrophobicContact CD2-CB 4.42Å; L1173-R1176 CarbonylContact O-C 3.58Å; L1173-R1176 PolarHBondContact O-N 2.98Å; R1176-P1178 VanDerWaalsContact C-CD 3.5Å; R1176-P1178 WeakPolarHBondContact O-CD 3.43Å
1177	Q	80.3	Confident	85.6	Confident	121 Å²	121	48 Å²	48	57%	0.565	24%	0.24	S	C	*	.			trans	-97	84.1	-175.7	-61.7	176.1	-3.7	0	0	112.1	K1150 Y1156	K1150-Q1177 HydrophobicContact CD-CB 4.42Å; K1150-Q1177 VanDerWaalsContact CE-OE1 3.23Å; K1150-Q1177 VanDerWaalsContact NZ-CB 3.29Å; K1150-Q1177 PolarHBondContact NZ-O 3.38Å; Y1156-Q1177 VanDerWaalsContact OH-CA 3.32Å; Y1156-Q1177 WeakPolarHBondContact OH-CA 3.21Å
1178	P	86.4	Confident	85	Confident	25 Å²	25	50.4 Å²	50.4	16%	0.162	25%	0.253	C	S	.	.			trans	-60.6	164.3	170.2	34.1	-42.5	0	0	0	110.9	Y1156 R1176 V1181 T1199	Y1156-P1178 WeakPolarHBondContact CE1-O 3.35Å; Y1156-P1178 PolarHBondContact OH-O 2.9Å; R1176-P1178 VanDerWaalsContact C-CD 3.5Å; R1176-P1178 WeakPolarHBondContact O-CD 3.43Å; P1178-V1181 HydrophobicContact CB-CG1 4.42Å; P1178-V1181 HydrophobicContact CG-CG1 3.36Å; P1178-T1199 HydrophobicContact CB-CG2 4.04Å; P1178-T1199 HydrophobicContact CG-CG2 4.02Å
1179	E	86.8	Confident	84.3	Confident	78 Å²	78	51.9 Å²	51.9	36%	0.364	27%	0.266	S	S	.	.	S	Bend	trans	-77.1	-46	175.5	-167.3	-158.5	147.9	0	0	112.4	K1149 K1150	K1149-E1179 CarbonylContact C-O 3.6Å; K1149-E1179 WeakPolarHBondContact CA-O 3.47Å; K1149-E1179 WeakPolarHBondContact CE-OE1 3.39Å; K1149-E1179 HydrophobicContact CG-CG 4.47Å; K1149-E1179 IonicContact NZ-OE1 3.63Å; K1149-E1179 PolarHBondContact NZ-OE1 3.36Å; K1150-E1179 HydrophobicContact CB-CG 4.33Å; K1150-E1179 WeakPolarHBondContact CB-O 3.41Å; K1150-E1179 PolarHBondContact N-O 2.72Å
1180	W	89.9	Confident	83.7	Confident	16 Å²	16	53.3 Å²	53.3	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131	-177.3	-65.6	83.5	0	0	0	111.7	L469 I471 K1149 L1159 I1200 P1202 L1205	L469-W1180 WeakPolarHBondContact O-CZ2 3.18Å; I471-W1180 HydrophobicContact CB-CH2 4.25Å; I471-W1180 HydrophobicContact CD1-CH2 3.92Å; I471-W1180 HydrophobicContact CD1-CZ3 3.94Å; I471-W1180 HydrophobicContact CG1-CH2 3.93Å; I471-W1180 HydrophobicContact CG1-CZ3 4.42Å; K1149-W1180 HydrophobicContact CB-CD2 4.44Å; K1149-W1180 HydrophobicContact CB-CE3 4.3Å; K1149-W1180 HydrophobicContact CB-CZ3 4.38Å; K1149-W1180 HydrophobicContact CD-CH2 4.08Å; K1149-W1180 HydrophobicContact CD-CZ2 3.66Å; K1149-W1180 HydrophobicContact CG-CZ2 4.45Å; L1159-W1180 HydrophobicContact CD1-CZ3 3.9Å; L1159-W1180 HydrophobicContact CD2-CH2 4.4Å; L1159-W1180 HydrophobicContact CD2-CZ3 3.8Å; L1159-W1180 HydrophobicContact CG-CZ3 4.46Å; W1180-I1200 HydrophobicContact CB-CD1 4.39Å; W1180-I1200 HydrophobicContact CB-CG1 4.02Å; W1180-I1200 PolarHBondContact O-N 2.78Å; W1180-P1202 HydrophobicContact CD2-CB 4.07Å; W1180-P1202 HydrophobicContact CE3-CB 4.38Å; W1180-P1202 HydrophobicContact CH2-CB 4.34Å; W1180-P1202 HydrophobicContact CZ2-CB 4.03Å; W1180-L1205 HydrophobicContact CE3-CD1 4.18Å; W1180-L1205 HydrophobicContact CZ3-CD1 4.14Å
1181	V	92	Very high	83.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.4	179.3	-63.3	0	0	0	0	112.8	A1147 A1148 Y1156 P1178 M1194 V1197 T1198	A1147-V1181 WeakPolarHBondContact CA-O 3.5Å; A1148-V1181 HydrophobicContact CB-CG2 3.98Å; A1148-V1181 PolarHBondContact N-O 2.95Å; A1148-V1181 PolarHBondContact O-N 3.47Å; Y1156-V1181 HydrophobicContact CD1-CG2 4.06Å; Y1156-V1181 HydrophobicContact CE1-CG1 4.24Å; Y1156-V1181 HydrophobicContact CE1-CG2 4.11Å; P1178-V1181 HydrophobicContact CB-CG1 4.42Å; P1178-V1181 HydrophobicContact CG-CG1 3.36Å; V1181-M1194 HydrophobicContact CG2-CE 4.17Å; V1181-M1194 HydrophobicContact CG2-SD 4.01Å; V1181-V1197 HydrophobicContact CB-CG1 3.62Å; V1181-V1197 HydrophobicContact CG1-CG1 3.71Å; V1181-V1197 HydrophobicContact CG2-CG1 4.12Å; V1181-T1198 WeakPolarHBondContact CA-O 3.43Å
1182	V	92.8	Very high	83.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.3	162.7	166.1	0	0	0	0	108.7	I1139 F1143 N1146 A1147 V1197 T1198 I1200	I1139-V1182 HydrophobicContact CG2-CG1 4.11Å; F1143-V1182 HydrophobicContact CB-CG1 3.43Å; F1143-V1182 VanDerWaalsContact CB-CG1 3.43Å; F1143-V1182 HydrophobicContact CG-CG1 4.47Å; N1146-V1182 WeakPolarHBondContact O-CA 3.47Å; A1147-V1182 HydrophobicContact CB-CG2 4.16Å; V1182-V1197 WeakPolarHBondContact O-CA 3.08Å; V1182-T1198 PolarHBondContact N-O 2.66Å; V1182-T1198 PolarHBondContact O-N 3.28Å; V1182-I1200 HydrophobicContact CB-CG2 4.16Å; V1182-I1200 HydrophobicContact CG2-CD1 3.75Å; V1182-I1200 HydrophobicContact CG2-CG1 4.06Å; V1182-I1200 HydrophobicContact CG2-CG2 3.81Å
1183	Y	91.8	Very high	83.8	Confident	18 Å²	18	58.7 Å²	58.7	7%	0.071	29%	0.286	C	S	.	.			trans	-122.6	152.7	-179.7	59.2	-91.8	0	0	0	111.4	N1146 A1148 T1158 L1186 M1194	N1146-Y1183 HydrophobicContact CB-CD1 4.46Å; N1146-Y1183 HydrophobicContact CB-CD2 3.93Å; N1146-Y1183 HydrophobicContact CB-CE1 4.24Å; N1146-Y1183 HydrophobicContact CB-CE2 3.67Å; N1146-Y1183 HydrophobicContact CB-CG 4.31Å; N1146-Y1183 VanDerWaalsContact CB-O 3.24Å; N1146-Y1183 WeakPolarHBondContact CB-O 3.5Å; N1146-Y1183 WeakPolarHBondContact O-CD1 3.27Å; N1146-Y1183 WeakPolarHBondContact O-CE1 3.45Å; N1146-Y1183 PolarHBondContact O-N 3.48Å; A1148-Y1183 HydrophobicContact CB-CD1 4.44Å; A1148-Y1183 HydrophobicContact CB-CE1 4.21Å; T1158-Y1183 HydrophobicContact CG2-CE1 4.47Å; Y1183-L1186 HydrophobicContact CD2-CB 4.38Å; Y1183-L1186 HydrophobicContact CE2-CB 3.9Å; Y1183-M1194 HydrophobicContact CD1-CG 3.82Å; Y1183-M1194 HydrophobicContact CD1-SD 3.51Å; Y1183-M1194 VanDerWaalsContact CD1-SD 3.51Å; Y1183-M1194 HydrophobicContact CD2-CG 4.44Å; Y1183-M1194 HydrophobicContact CE1-CG 4.39Å; Y1183-M1194 HydrophobicContact CE1-SD 4.12Å; Y1183-M1194 HydrophobicContact CG-CB 4.16Å; Y1183-M1194 HydrophobicContact CG-CG 3.85Å; Y1183-M1194 HydrophobicContact CG-SD 4.08Å
1184	H	88.4	Confident	84.1	Confident	18 Å²	18	58.6 Å²	58.6	8%	0.083	29%	0.286	C	S	.	.	S	Bend	trans	-81.1	-62.7	178	-177.6	25.1	0	0	0	111.2	F1143 N1146 R1195 E1196	F1143-H1184 AromaticContact CE1-ND1 3.4Å; F1143-H1184 WeakPolarHBondContact CE1-ND1 3.39Å; F1143-H1184 AromaticContact CZ-CE1 3.79Å; F1143-H1184 AromaticContact CZ-ND1 3.28Å; F1143-H1184 VanDerWaalsContact CZ-ND1 3.28Å; F1143-H1184 WeakPolarHBondContact CZ-ND1 3.36Å; N1146-H1184 PolarHBondContact ND2-O 3.5Å; H1184-R1195 PolarHBondContact N-O 3.03Å; H1184-E1196 HydrophobicContact CB-CB 3.81Å; H1184-E1196 IonicContact CD2-OE2 2.75Å
1185	E	84.4	Confident	84.2	Confident	88 Å²	88	56.7 Å²	56.7	41%	0.411	28%	0.276	S	S	.	.			trans	-114.9	147.6	177.2	-63.2	-174.3	153.8	0	0	110.5	V1187 R1195	E1185-V1187 HydrophobicContact CB-CG2 4.19Å; E1185-R1195 HydrophobicContact CB-CB 4.44Å; E1185-R1195 PolarHBondContact O-N 3.13Å; E1185-R1195 IonicContact OE2-NH1 3.09Å
1186	L	85	Confident	84.7	Confident	20 Å²	20	51 Å²	51	11%	0.105	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.6	159.7	-167.4	76.7	0	0	0	108.6	I903 V1165 Y1183 E1192 M1194	I903-L1186 HydrophobicContact CD1-CD2 3.77Å; I903-L1186 HydrophobicContact CG1-CD2 3.98Å; V1165-L1186 HydrophobicContact CB-CD1 3.92Å; V1165-L1186 HydrophobicContact CG1-CD1 3.59Å; V1165-L1186 HydrophobicContact CG1-CD2 3.83Å; V1165-L1186 HydrophobicContact CG1-CG 4.37Å; Y1183-L1186 HydrophobicContact CD2-CB 4.38Å; Y1183-L1186 HydrophobicContact CE2-CB 3.9Å; L1186-E1192 HydrophobicContact CD1-CB 4.45Å; L1186-E1192 HydrophobicContact CD2-CB 4.36Å; L1186-E1192 HydrophobicContact CG-CB 4.49Å; L1186-M1194 HydrophobicContact CD1-CB 4.42Å; L1186-M1194 HydrophobicContact CD1-CG 3.66Å
1187	V	79.9	Confident	85.4	Confident	26 Å²	26	44.4 Å²	44.4	16%	0.158	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	113.8	-177	-175.5	0	0	0	0	110.1	E1185 T1189 Y1193 R1195	E1185-V1187 HydrophobicContact CB-CG2 4.19Å; V1187-T1189 HydrophobicContact CG1-CG2 4.17Å; V1187-Y1193 PolarHBondContact N-O 3.5Å; V1187-Y1193 PolarHBondContact O-N 3.48Å; V1187-R1195 HydrophobicContact CG2-CG 4.44Å
1188	L	75.8	Confident	85.9	Confident	62 Å²	62	38.6 Å²	38.6	33%	0.325	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130.9	170	179.4	64.8	0	0	0	110.1	Q905 E1192	Q905-L1188 HydrophobicContact CG-CB 4.25Å; Q905-L1188 HydrophobicContact CG-CD2 4.13Å; L1188-E1192 HydrophobicContact CB-CG 4.45Å; L1188-E1192 HydrophobicContact CD1-CG 3.61Å
1189	T	73.9	Confident	86.2	Confident	79 Å²	79	38.6 Å²	38.6	49%	0.485	19%	0.192	S	C	.	.	S	Bend	trans	-135.2	-113.9	172	56.8	0	0	0	0	109.3	V1187 K1191 Y1193	V1187-T1189 HydrophobicContact CG1-CG2 4.17Å; T1189-K1191 VanDerWaalsContact C-N 3.34Å; T1189-K1191 PolarHBondContact N-O 2.83Å; T1189-K1191 PolarHBondContact OG1-O 2.96Å; T1189-K1191 VanDerWaalsContact OG1-O 3.06Å; T1189-Y1193 WeakPolarHBondContact OG1-CD2 3.42Å; T1189-Y1193 WeakPolarHBondContact OG1-CE2 3.44Å
1190	T	72.6	Confident	86.4	Confident	105 Å²	105	35.7 Å²	35.7	64%	0.644	18%	0.179	S	C	*	.	S	Bend	trans	-80.3	-20.6	162.4	52.5	0	0	0	0	112.2	K516	K516-T1190 HydrophobicContact CD-CG2 4.45Å
1191	K	80.5	Confident	86.3	Confident	99 Å²	99	37.3 Å²	37.3	43%	0.43	19%	0.188	S	C	.	.	S	Bend	trans	-140.9	166.3	168.7	-67.3	-168.6	168.6	-155.8	0	109	Y1166 T1189 Y1193	Y1166-K1191 HydrophobicContact CD2-CB 4.13Å; Y1166-K1191 HydrophobicContact CD2-CD 3.81Å; Y1166-K1191 HydrophobicContact CE2-CD 3.74Å; T1189-K1191 VanDerWaalsContact C-N 3.34Å; T1189-K1191 PolarHBondContact N-O 2.83Å; T1189-K1191 PolarHBondContact OG1-O 2.96Å; T1189-K1191 VanDerWaalsContact OG1-O 3.06Å; K1191-Y1193 HydrophobicContact CB-CD2 4.47Å; K1191-Y1193 HydrophobicContact CB-CE2 3.92Å; K1191-Y1193 WeakPolarHBondContact O-CD2 3.4Å
1192	E	85	Confident	85.9	Confident	39 Å²	39	38.2 Å²	38.2	18%	0.182	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	119.2	171.8	-66.3	178.4	-179.8	0	0	110	V1165 Y1166 L1186 L1188	V1165-E1192 HydrophobicContact CG1-CB 4.02Å; Y1166-E1192 PolarHBondContact N-O 3.37Å; L1186-E1192 HydrophobicContact CD1-CB 4.45Å; L1186-E1192 HydrophobicContact CD2-CB 4.36Å; L1186-E1192 HydrophobicContact CG-CB 4.49Å; L1188-E1192 HydrophobicContact CB-CG 4.45Å; L1188-E1192 HydrophobicContact CD1-CG 3.61Å
1193	Y	87.4	Confident	85.6	Confident	46 Å²	46	43.5 Å²	43.5	18%	0.18	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.5	-178.3	-71.1	-71.2	0	0	0	112.1	Y1166 H1168 V1187 T1189 K1191	Y1166-Y1193 CarbonylContact O-C 3.57Å; Y1166-Y1193 VanDerWaalsContact O-CA 3.29Å; Y1166-Y1193 WeakPolarHBondContact O-CA 3.33Å; H1168-Y1193 HydrophobicContact CB-CD1 4.43Å; H1168-Y1193 HydrophobicContact CB-CG 4.49Å; H1168-Y1193 AromaticContact CD2-CG 3.83Å; V1187-Y1193 PolarHBondContact N-O 3.5Å; V1187-Y1193 PolarHBondContact O-N 3.48Å; T1189-Y1193 WeakPolarHBondContact OG1-CD2 3.42Å; T1189-Y1193 WeakPolarHBondContact OG1-CE2 3.44Å; K1191-Y1193 HydrophobicContact CB-CD2 4.47Å; K1191-Y1193 HydrophobicContact CB-CE2 3.92Å; K1191-Y1193 WeakPolarHBondContact O-CD2 3.4Å
1194	M	89.6	Confident	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.1	167.6	-66.3	-178	-70.5	0	0	110.2	A1148 Y1156 V1165 Y1166 I1167 H1168 V1181 Y1183 L1186 V1197	A1148-M1194 HydrophobicContact CB-SD 3.79Å; Y1156-M1194 HydrophobicContact CD1-CE 4.28Å; Y1156-M1194 HydrophobicContact CD2-CE 3.9Å; Y1156-M1194 HydrophobicContact CG-CE 3.77Å; V1165-M1194 HydrophobicContact CB-CG 4.16Å; V1165-M1194 HydrophobicContact CG2-CE 3.92Å; V1165-M1194 HydrophobicContact CG2-CG 4.01Å; V1165-M1194 HydrophobicContact CG2-SD 3.73Å; Y1166-M1194 PolarHBondContact O-N 3.07Å; I1167-M1194 HydrophobicContact CG1-CE 3.84Å; H1168-M1194 VanDerWaalsContact CB-O 3.26Å; H1168-M1194 WeakPolarHBondContact CB-O 3.47Å; H1168-M1194 PolarHBondContact N-O 3.39Å; V1181-M1194 HydrophobicContact CG2-CE 4.17Å; V1181-M1194 HydrophobicContact CG2-SD 4.01Å; Y1183-M1194 HydrophobicContact CD1-CG 3.82Å; Y1183-M1194 HydrophobicContact CD1-SD 3.51Å; Y1183-M1194 VanDerWaalsContact CD1-SD 3.51Å; Y1183-M1194 HydrophobicContact CD2-CG 4.44Å; Y1183-M1194 HydrophobicContact CE1-CG 4.39Å; Y1183-M1194 HydrophobicContact CE1-SD 4.12Å; Y1183-M1194 HydrophobicContact CG-CB 4.16Å; Y1183-M1194 HydrophobicContact CG-CG 3.85Å; Y1183-M1194 HydrophobicContact CG-SD 4.08Å; L1186-M1194 HydrophobicContact CD1-CB 4.42Å; L1186-M1194 HydrophobicContact CD1-CG 3.66Å; M1194-V1197 HydrophobicContact CB-CG2 3.95Å
1195	R	88.1	Confident	85.3	Confident	59 Å²	59	43 Å²	43	22%	0.223	21%	0.211	C	C	.	.			trans	-115.6	158.8	175.2	-64.6	-172.6	172.2	165	0.8	112.5	H1168 H1184 E1185 V1187 V1197	H1168-R1195 HydrophobicContact CB-CG 4.31Å; H1184-R1195 PolarHBondContact N-O 3.03Å; E1185-R1195 HydrophobicContact CB-CB 4.44Å; E1185-R1195 PolarHBondContact O-N 3.13Å; E1185-R1195 IonicContact OE2-NH1 3.09Å; V1187-R1195 HydrophobicContact CG2-CG 4.44Å; R1195-V1197 PolarHBondContact O-N 2.67Å
1196	E	89.4	Confident	85.3	Confident	33 Å²	33	40.4 Å²	40.4	15%	0.154	20%	0.201	C	C	.	.	S	Bend	trans	41.9	65.9	-175.2	-65.6	64.3	-110.4	0	0	112.2	L1044 D1073 H1074 L1077 H1184	L1044-E1196 HydrophobicContact CD2-CB 4.15Å; L1044-E1196 HydrophobicContact CD2-CG 3.84Å; D1073-E1196 HydrophobicContact CB-CB 4.31Å; H1074-E1196 PolarHBondContact CE1-O 3.33Å; H1074-E1196 PolarHBondContact ND1-O 3.23Å; L1077-E1196 HydrophobicContact CD1-CG 4.36Å; H1184-E1196 HydrophobicContact CB-CB 3.81Å; H1184-E1196 IonicContact CD2-OE2 2.75Å
1197	V	92.6	Very high	85.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-84.9	146.1	-169.9	-170.8	0	0	0	0	110.5	G1072 D1073 I1167 L1173 V1181 V1182 M1194 R1195	G1072-V1197 WeakPolarHBondContact CA-O 3.38Å; D1073-V1197 PolarHBondContact N-O 2.96Å; D1073-V1197 PolarHBondContact OD2-N 3.18Å; I1167-V1197 HydrophobicContact CG2-CG2 4.36Å; L1173-V1197 HydrophobicContact CD1-CB 4.14Å; L1173-V1197 HydrophobicContact CD1-CG1 3.94Å; V1181-V1197 HydrophobicContact CB-CG1 3.62Å; V1181-V1197 HydrophobicContact CG1-CG1 3.71Å; V1181-V1197 HydrophobicContact CG2-CG1 4.12Å; V1182-V1197 WeakPolarHBondContact O-CA 3.08Å; M1194-V1197 HydrophobicContact CB-CG2 3.95Å; R1195-V1197 PolarHBondContact O-N 2.67Å
1198	T	92.1	Very high	85.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	138.8	177.4	-69.6	0	0	0	0	111.2	H1074 Q1136 I1139 V1181 V1182	H1074-T1198 PolarHBondContact ND1-OG1 3.26Å; Q1136-T1198 HydrophobicContact CG-CG2 4.09Å; I1139-T1198 HydrophobicContact CD1-CG2 4.32Å; V1181-T1198 WeakPolarHBondContact CA-O 3.43Å; V1182-T1198 PolarHBondContact N-O 2.66Å; V1182-T1198 PolarHBondContact O-N 3.28Å
1199	T	92.1	Very high	85.4	Confident	25 Å²	25	42 Å²	42	15%	0.153	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.1	179.3	66.9	0	0	0	0	109.9	E1071 Q1136 L1173 P1178	E1071-T1199 PolarHBondContact O-N 2.67Å; E1071-T1199 VanDerWaalsContact O-N 3.1Å; E1071-T1199 PolarHBondContact O-OG1 3.23Å; Q1136-T1199 PolarHBondContact NE2-O 3.13Å; Q1136-T1199 PolarHBondContact NE2-OG1 3.09Å; Q1136-T1199 VanDerWaalsContact NE2-OG1 3.16Å; L1173-T1199 HydrophobicContact CD1-CG2 3.93Å; L1173-T1199 HydrophobicContact CD2-CG2 4.02Å; P1178-T1199 HydrophobicContact CB-CG2 4.04Å; P1178-T1199 HydrophobicContact CG-CG2 4.02Å
1200	I	90.6	Very high	85.6	Confident	17 Å²	17	42.6 Å²	42.6	9%	0.087	21%	0.211	C	C	.	.			trans	-128.6	159.3	174.5	56.1	146.6	0	0	0	111.5	C1140 W1180 V1182 W1204 L1205	C1140-I1200 HydrophobicContact CB-CG2 4.38Å; W1180-I1200 HydrophobicContact CB-CD1 4.39Å; W1180-I1200 HydrophobicContact CB-CG1 4.02Å; W1180-I1200 PolarHBondContact O-N 2.78Å; V1182-I1200 HydrophobicContact CB-CG2 4.16Å; V1182-I1200 HydrophobicContact CG2-CD1 3.75Å; V1182-I1200 HydrophobicContact CG2-CG1 4.06Å; V1182-I1200 HydrophobicContact CG2-CG2 3.81Å; I1200-W1204 HydrophobicContact CB-CE3 4.21Å; I1200-W1204 HydrophobicContact CB-CZ3 4.33Å; I1200-W1204 HydrophobicContact CG2-CE3 4.35Å; I1200-W1204 HydrophobicContact CG2-CZ3 4.4Å; I1200-L1205 HydrophobicContact CD1-CD1 3.65Å; I1200-L1205 HydrophobicContact CD1-CD2 4.06Å; I1200-L1205 HydrophobicContact CD1-CG 3.77Å
1201	D	88.3	Confident	85.5	Confident	49 Å²	49	41.6 Å²	41.6	26%	0.262	21%	0.214	S	C	.	.			trans	-93.4	131.8	165.1	155.8	15.2	0	0	0	108.5	R1203 W1204	D1201-R1203 PolarHBondContact O-N 3.14Å; D1201-R1203 VanDerWaalsContact OD1-CB 3.25Å; D1201-R1203 WeakPolarHBondContact OD1-CB 3.49Å; D1201-R1203 VanDerWaalsContact OD1-CG 3.27Å; D1201-R1203 WeakPolarHBondContact OD1-CG 3.37Å; D1201-R1203 PolarHBondContact OD1-N 3.41Å; D1201-W1204 HydrophobicContact CB-CD2 3.91Å; D1201-W1204 HydrophobicContact CB-CE3 4.35Å; D1201-W1204 HydrophobicContact CB-CG 4.36Å; D1201-W1204 HydrophobicContact CB-CH2 4.18Å; D1201-W1204 HydrophobicContact CB-CZ2 3.72Å; D1201-W1204 HydrophobicContact CB-CZ3 4.46Å; D1201-W1204 PolarHBondContact O-N 2.99Å; D1201-W1204 PolarHBondContact OD2-NE1 2.83Å
1202	P	84.2	Confident	85.2	Confident	19 Å²	19	38.3 Å²	38.3	12%	0.123	20%	0.199	C	C	.	.	H	α-helix	trans	-55.3	-32	-179.9	20.9	-32.6	0	0	0	113.6	L469 I471 W1180 W1204 L1205	L469-P1202 HydrophobicContact CB-CG 4.18Å; I471-P1202 HydrophobicContact CD1-CB 3.74Å; I471-P1202 WeakPolarHBondContact CD1-O 3.47Å; I471-P1202 HydrophobicContact CG1-CB 4.37Å; W1180-P1202 HydrophobicContact CD2-CB 4.07Å; W1180-P1202 HydrophobicContact CE3-CB 4.38Å; W1180-P1202 HydrophobicContact CH2-CB 4.34Å; W1180-P1202 HydrophobicContact CZ2-CB 4.03Å; P1202-W1204 PolarHBondContact O-N 3.44Å; P1202-W1204 VanDerWaalsContact O-N 3.11Å; P1202-L1205 WeakPolarHBondContact O-CB 3.3Å; P1202-L1205 PolarHBondContact O-N 3.36Å; P1202-L1205 VanDerWaalsContact O-N 3.07Å
1203	R	86.6	Confident	85	Confident	111 Å²	111	36.6 Å²	36.6	42%	0.419	19%	0.191	S	C	.	.	H	α-helix	trans	-57.5	-30.8	-179.5	-60.9	173.9	175.4	-165.1	-1.9	111.9	E464 L469 D1201 E1207	E464-R1203 PolarHBondContact O-NH2 3.15Å; L469-R1203 HydrophobicContact CD1-CG 3.79Å; L469-R1203 VanDerWaalsContact CD1-NE 3.31Å; D1201-R1203 PolarHBondContact O-N 3.14Å; D1201-R1203 VanDerWaalsContact OD1-CB 3.25Å; D1201-R1203 WeakPolarHBondContact OD1-CB 3.49Å; D1201-R1203 VanDerWaalsContact OD1-CG 3.27Å; D1201-R1203 WeakPolarHBondContact OD1-CG 3.37Å; D1201-R1203 PolarHBondContact OD1-N 3.41Å; R1203-E1207 PolarHBondContact O-N 3.04Å; R1203-E1207 VanDerWaalsContact O-N 3.17Å
1204	W	88.6	Confident	84.6	Confident	26 Å²	26	40 Å²	40	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-73.8	-27.4	-179.2	-51.1	-13.5	0	0	0	113.3	V1133 Q1136 K1137 I1200 D1201 P1202 V1206 E1207 F1208	V1133-W1204 HydrophobicContact CG1-CH2 4.05Å; V1133-W1204 HydrophobicContact CG1-CZ2 3.75Å; Q1136-W1204 HydrophobicContact CB-CH2 4.17Å; Q1136-W1204 HydrophobicContact CB-CZ3 3.66Å; K1137-W1204 HydrophobicContact CD-CG 4.49Å; K1137-W1204 VanDerWaalsContact CE-CD1 3.44Å; K1137-W1204 HydrophobicContact CG-CD2 3.75Å; K1137-W1204 HydrophobicContact CG-CE3 4.09Å; K1137-W1204 HydrophobicContact CG-CG 4Å; I1200-W1204 HydrophobicContact CB-CE3 4.21Å; I1200-W1204 HydrophobicContact CB-CZ3 4.33Å; I1200-W1204 HydrophobicContact CG2-CE3 4.35Å; I1200-W1204 HydrophobicContact CG2-CZ3 4.4Å; D1201-W1204 HydrophobicContact CB-CD2 3.91Å; D1201-W1204 HydrophobicContact CB-CE3 4.35Å; D1201-W1204 HydrophobicContact CB-CG 4.36Å; D1201-W1204 HydrophobicContact CB-CH2 4.18Å; D1201-W1204 HydrophobicContact CB-CZ2 3.72Å; D1201-W1204 HydrophobicContact CB-CZ3 4.46Å; D1201-W1204 PolarHBondContact O-N 2.99Å; D1201-W1204 PolarHBondContact OD2-NE1 2.83Å; P1202-W1204 PolarHBondContact O-N 3.44Å; P1202-W1204 VanDerWaalsContact O-N 3.11Å; W1204-V1206 VanDerWaalsContact C-N 3.32Å; W1204-E1207 PolarHBondContact O-N 2.96Å; W1204-F1208 HydrophobicContact CB-CD2 4.26Å; W1204-F1208 HydrophobicContact CB-CE2 4.3Å; W1204-F1208 WeakPolarHBondContact O-CD2 3.24Å; W1204-F1208 PolarHBondContact O-N 3.36Å
1205	L	84.5	Confident	83.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-40.8	177.4	-72	169.1	0	0	0	110.7	I471 F1144 A1147 L1159 W1180 I1200 P1202 A1209 F1213	I471-L1205 HydrophobicContact CD1-CB 3.96Å; I471-L1205 HydrophobicContact CD1-CD1 3.78Å; I471-L1205 HydrophobicContact CD1-CG 4.49Å; F1144-L1205 HydrophobicContact CB-CD2 3.88Å; A1147-L1205 HydrophobicContact CB-CD1 4.24Å; A1147-L1205 HydrophobicContact CB-CD2 4.09Å; L1159-L1205 HydrophobicContact CD1-CD1 4.01Å; W1180-L1205 HydrophobicContact CE3-CD1 4.18Å; W1180-L1205 HydrophobicContact CZ3-CD1 4.14Å; I1200-L1205 HydrophobicContact CD1-CD1 3.65Å; I1200-L1205 HydrophobicContact CD1-CD2 4.06Å; I1200-L1205 HydrophobicContact CD1-CG 3.77Å; P1202-L1205 WeakPolarHBondContact O-CB 3.3Å; P1202-L1205 PolarHBondContact O-N 3.36Å; P1202-L1205 VanDerWaalsContact O-N 3.07Å; L1205-A1209 PolarHBondContact O-N 3.17Å; L1205-F1213 HydrophobicContact CB-CD2 3.83Å; L1205-F1213 HydrophobicContact CB-CE2 4.15Å; L1205-F1213 HydrophobicContact CB-CG 4.42Å; L1205-F1213 HydrophobicContact CD2-CD2 4.36Å; L1205-F1213 HydrophobicContact CD2-CE2 3.85Å; L1205-F1213 HydrophobicContact CG-CE2 4.43Å
1206	V	83.8	Confident	82.9	Confident	33 Å²	33	40.9 Å²	40.9	20%	0.2	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-39.1	175.9	-172.3	0	0	0	0	111.2	I471 W1204 F1208 P1210 F1213 V1215	I471-V1206 HydrophobicContact CD1-CG2 4.25Å; I471-V1206 HydrophobicContact CG1-CG2 4.39Å; I471-V1206 HydrophobicContact CG2-CG2 4.34Å; W1204-V1206 VanDerWaalsContact C-N 3.32Å; V1206-F1208 PolarHBondContact O-N 2.87Å; V1206-P1210 WeakPolarHBondContact O-CB 3.35Å; V1206-P1210 VanDerWaalsContact O-CD 3.29Å; V1206-P1210 WeakPolarHBondContact O-CD 3.27Å; V1206-F1213 HydrophobicContact CG2-CB 4.39Å; V1206-V1215 HydrophobicContact CG1-CG2 4.21Å; V1206-V1215 HydrophobicContact CG2-CG2 3.96Å
1207	E	83.8	Confident	81.8	Confident	100 Å²	100	42.2 Å²	42.2	47%	0.467	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-43.9	176.2	-175.2	-174.4	175.3	0	0	112.8	K1137 R1203 W1204	K1137-E1207 WeakPolarHBondContact CE-OE2 3.13Å; K1137-E1207 IonicContact NZ-OE1 3.84Å; K1137-E1207 PolarHBondContact NZ-OE1 2.92Å; K1137-E1207 IonicContact NZ-OE2 3.67Å; K1137-E1207 PolarHBondContact NZ-OE2 3.28Å; R1203-E1207 PolarHBondContact O-N 3.04Å; R1203-E1207 VanDerWaalsContact O-N 3.17Å; W1204-E1207 PolarHBondContact O-N 2.96Å
1208	F	80.8	Confident	80.3	Confident	34 Å²	34	47.3 Å²	47.3	15%	0.149	26%	0.261	C	S	.	.	H	α-helix	trans	-95.3	-13.7	-175.1	-68.1	-62.7	0	0	0	115.5	L1031 K1137 C1140 W1204 V1206	L1031-F1208 HydrophobicContact CD1-CZ 4.31Å; K1137-F1208 HydrophobicContact CB-CE2 3.64Å; K1137-F1208 HydrophobicContact CB-CZ 3.82Å; K1137-F1208 HydrophobicContact CD-CE2 3.93Å; K1137-F1208 HydrophobicContact CD-CZ 3.97Å; K1137-F1208 HydrophobicContact CG-CE2 3.85Å; K1137-F1208 HydrophobicContact CG-CZ 4.24Å; K1137-F1208 WeakPolarHBondContact O-CE2 3.15Å; C1140-F1208 HydrophobicContact CB-CD2 4.46Å; W1204-F1208 HydrophobicContact CB-CD2 4.26Å; W1204-F1208 HydrophobicContact CB-CE2 4.3Å; W1204-F1208 WeakPolarHBondContact O-CD2 3.24Å; W1204-F1208 PolarHBondContact O-N 3.36Å; V1206-F1208 PolarHBondContact O-N 2.87Å
1209	A	79.9	Confident	78.9	Confident	9 Å²	9	53 Å²	53	7%	0.074	30%	0.295	C	S	.	.			trans	-144	55.1	179.8	0	0	0	0	0	113.7	F1144 L1205 A1211 F1212 F1213	F1144-A1209 HydrophobicContact CB-CB 4.29Å; F1144-A1209 HydrophobicContact CD1-CB 4.35Å; F1144-A1209 HydrophobicContact CD2-CB 3.46Å; F1144-A1209 VanDerWaalsContact CD2-CB 3.46Å; F1144-A1209 HydrophobicContact CE2-CB 3.87Å; F1144-A1209 HydrophobicContact CG-CB 3.75Å; F1144-A1209 HydrophobicContact CZ-CB 4.48Å; L1205-A1209 PolarHBondContact O-N 3.17Å; A1209-A1211 PolarHBondContact O-N 2.98Å; A1209-A1211 VanDerWaalsContact O-N 3.09Å; A1209-F1212 HydrophobicContact CB-CB 4.29Å; A1209-F1212 PolarHBondContact O-N 3.45Å; A1209-F1213 HydrophobicContact CB-CD2 4.22Å; A1209-F1213 PolarHBondContact O-N 2.87Å
1210	P	76.9	Confident	77.5	Confident	91 Å²	91	60.6 Å²	60.6	59%	0.591	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.3	-177.6	28.7	-36.3	0	0	0	114.2	V1206 F1212	V1206-P1210 WeakPolarHBondContact O-CB 3.35Å; V1206-P1210 VanDerWaalsContact O-CD 3.29Å; V1206-P1210 WeakPolarHBondContact O-CD 3.27Å; P1210-F1212 VanDerWaalsContact C-N 3.32Å
1211	A	70.8	Confident	76.1	Confident	84 Å²	84	65.1 Å²	65.1	69%	0.694	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-6.6	172.7	0	0	0	0	0	113.6	A1209	A1209-A1211 PolarHBondContact O-N 2.98Å; A1209-A1211 VanDerWaalsContact O-N 3.09Å
1212	F	74.7	Confident	75	Confident	29 Å²	29	63 Å²	63	13%	0.127	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-34.3	-177.7	-170.2	-97.8	0	0	0	112	L473 V474 T995 F1144 I1160 A1209 P1210	L473-F1212 WeakPolarHBondContact CA-O 3.45Å; L473-F1212 HydrophobicContact CD2-CD1 4.14Å; L473-F1212 HydrophobicContact CD2-CE1 3.55Å; L473-F1212 HydrophobicContact CD2-CZ 3.92Å; V474-F1212 PolarHBondContact N-O 2.98Å; T995-F1212 HydrophobicContact CG2-CD2 3.82Å; T995-F1212 HydrophobicContact CG2-CE2 4.32Å; F1144-F1212 HydrophobicContact CD2-CD1 4.21Å; F1144-F1212 HydrophobicContact CE2-CB 4.39Å; F1144-F1212 HydrophobicContact CE2-CD1 4.3Å; F1144-F1212 HydrophobicContact CE2-CG 4.3Å; I1160-F1212 HydrophobicContact CD1-CE1 4.17Å; I1160-F1212 HydrophobicContact CD1-CZ 3.79Å; I1160-F1212 HydrophobicContact CG1-CE1 4.29Å; I1160-F1212 HydrophobicContact CG1-CZ 4.06Å; A1209-F1212 HydrophobicContact CB-CB 4.29Å; A1209-F1212 PolarHBondContact O-N 3.45Å; P1210-F1212 VanDerWaalsContact C-N 3.32Å
1213	F	80.6	Confident	74.3	Confident	3 Å²	3	67.7 Å²	67.7	1%	0.013	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.4	178.5	-70.7	-55	0	0	0	111.7	I471 L473 F1144 L1159 L1205 V1206 A1209	I471-F1213 HydrophobicContact CG2-CB 3.61Å; I471-F1213 HydrophobicContact CG2-CD1 3.5Å; I471-F1213 HydrophobicContact CG2-CE1 4.42Å; I471-F1213 HydrophobicContact CG2-CG 3.82Å; L473-F1213 HydrophobicContact CD2-CD1 3.99Å; L473-F1213 HydrophobicContact CD2-CE1 3.59Å; F1144-F1213 HydrophobicContact CB-CE2 4.05Å; F1144-F1213 HydrophobicContact CD2-CE2 4.05Å; F1144-F1213 VanDerWaalsContact O-CE2 3.29Å; F1144-F1213 WeakPolarHBondContact O-CE2 3.44Å; F1144-F1213 WeakPolarHBondContact O-CZ 3.49Å; L1159-F1213 HydrophobicContact CB-CE1 4.36Å; L1159-F1213 HydrophobicContact CD1-CE1 3.75Å; L1159-F1213 HydrophobicContact CD1-CZ 3.79Å; L1205-F1213 HydrophobicContact CB-CD2 3.83Å; L1205-F1213 HydrophobicContact CB-CE2 4.15Å; L1205-F1213 HydrophobicContact CB-CG 4.42Å; L1205-F1213 HydrophobicContact CD2-CD2 4.36Å; L1205-F1213 HydrophobicContact CD2-CE2 3.85Å; L1205-F1213 HydrophobicContact CG-CE2 4.43Å; V1206-F1213 HydrophobicContact CG2-CB 4.39Å; A1209-F1213 HydrophobicContact CB-CD2 4.22Å; A1209-F1213 PolarHBondContact O-N 2.87Å
1214	K	78.8	Confident	73.4	Confident	119 Å²	119	65.7 Å²	65.7	52%	0.517	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141	175.5	-169.5	-162.1	167.4	-166.1	0	109.6	I471 E472 V474 S1216	I471-K1214 CarbonylContact C-O 3.57Å; I471-K1214 WeakPolarHBondContact CA-O 3.43Å; E472-K1214 PolarHBondContact N-O 3.24Å; E472-K1214 PolarHBondContact O-N 2.97Å; V474-K1214 HydrophobicContact CG2-CB 4.07Å; K1214-S1216 PolarHBondContact O-N 2.89Å
1215	V	75.1	Confident	72.6	Confident	65 Å²	65	68.4 Å²	68.4	39%	0.394	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	130.2	166.9	-175.5	0	0	0	0	108.8	L469 V1206	L469-V1215 HydrophobicContact CD2-CG1 3.92Å; V1206-V1215 HydrophobicContact CG1-CG2 4.21Å; V1206-V1215 HydrophobicContact CG2-CG2 3.96Å
1216	S	66.8	Low	72.2	Confident	12 Å²	12	75.2 Å²	75.2	8%	0.084	39%	0.39	C	S	.	.			trans	-62.4	141.6	173.4	69.9	0	0	0	0	110.2	E470 K1214 P1218	E470-S1216 WeakPolarHBondContact CB-OG 3.19Å; E470-S1216 WeakPolarHBondContact O-CB 3.34Å; E470-S1216 PolarHBondContact O-N 3.09Å; E470-S1216 PolarHBondContact O-OG 2.86Å; K1214-S1216 PolarHBondContact O-N 2.89Å; S1216-P1218 WeakPolarHBondContact O-CD 3.26Å
1217	D	65.7	Low	71.8	Confident	60 Å²	60	80.8 Å²	80.8	32%	0.321	41%	0.414	S	S	.	.			trans	-72.4	115	173.5	176.2	-14.2	0	0	0	109	T1219 R1220	D1217-T1219 VanDerWaalsContact CG-OG1 3.28Å; D1217-T1219 PolarHBondContact O-N 2.73Å; D1217-T1219 WeakPolarHBondContact OD1-CB 3.21Å; D1217-T1219 PolarHBondContact OD1-N 3.23Å; D1217-T1219 PolarHBondContact OD1-OG1 2.58Å; D1217-T1219 PolarHBondContact OD2-OG1 3.25Å; D1217-R1220 HydrophobicContact CB-CB 4.26Å; D1217-R1220 CarbonylContact O-C 3.56Å; D1217-R1220 PolarHBondContact O-N 2.92Å
1218	P	62.3	Low	71.5	Confident	108 Å²	108	81.8 Å²	81.8	70%	0.701	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-16.7	-175.3	25.6	-34.4	0	0	0	112.9	S1216 R1220	S1216-P1218 WeakPolarHBondContact O-CD 3.26Å; P1218-R1220 VanDerWaalsContact C-N 3.29Å; P1218-R1220 PolarHBondContact O-N 3.17Å
1219	T	61.6	Low	71.4	Confident	118 Å²	118	89.8 Å²	89.8	72%	0.724	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-8.2	173.6	75.5	0	0	0	0	113.6	D1217	D1217-T1219 VanDerWaalsContact CG-OG1 3.28Å; D1217-T1219 PolarHBondContact O-N 2.73Å; D1217-T1219 WeakPolarHBondContact OD1-CB 3.21Å; D1217-T1219 PolarHBondContact OD1-N 3.23Å; D1217-T1219 PolarHBondContact OD1-OG1 2.58Å; D1217-T1219 PolarHBondContact OD2-OG1 3.25Å
1220	R	62.3	Low	71.4	Confident	185 Å²	185	97.4 Å²	97.4	70%	0.698	49%	0.486	S	S	*	.	S	Bend	trans	-133.5	103.9	-171.8	-74.3	179.8	161	-168.2	-3.7	112.5	D1217 P1218 S1222	D1217-R1220 HydrophobicContact CB-CB 4.26Å; D1217-R1220 CarbonylContact O-C 3.56Å; D1217-R1220 PolarHBondContact O-N 2.92Å; P1218-R1220 VanDerWaalsContact C-N 3.29Å; P1218-R1220 PolarHBondContact O-N 3.17Å; R1220-S1222 PolarHBondContact O-N 3.15Å; R1220-S1222 VanDerWaalsContact O-N 3.16Å
1221	L	61.3	Low	71.5	Confident	113 Å²	113	98.5 Å²	98.5	59%	0.592	48%	0.484	S	S	*	.			trans	-44.4	120.4	168.1	-84.5	164.1	0	0	0	112.2	K1225 K1226	L1221-K1225 HydrophobicContact CD2-CB 3.79Å; L1221-K1225 HydrophobicContact CD2-CD 4.16Å; L1221-K1226 HydrophobicContact CB-CD 4.47Å; L1221-K1226 HydrophobicContact CB-CG 4.18Å; L1221-K1226 VanDerWaalsContact O-CE 3.28Å; L1221-K1226 WeakPolarHBondContact O-CE 2.92Å; L1221-K1226 PolarHBondContact O-NZ 2.92Å
1222	S	65.9	Low	72	Confident	3 Å²	3	98 Å²	98	2%	0.021	47%	0.473	C	S	.	.			trans	-58.1	161.7	178.5	66.8	0	0	0	0	112.5	E470 E472 R1220 Q1224 K1225 K1226	E470-S1222 VanDerWaalsContact OE1-CB 3.24Å; E470-S1222 WeakPolarHBondContact OE1-CB 3.44Å; E470-S1222 PolarHBondContact OE1-OG 3.39Å; E472-S1222 WeakPolarHBondContact OE1-CA 3.36Å; E472-S1222 WeakPolarHBondContact OE1-CB 3.06Å; R1220-S1222 PolarHBondContact O-N 3.15Å; R1220-S1222 VanDerWaalsContact O-N 3.16Å; S1222-Q1224 PolarHBondContact O-N 2.82Å; S1222-K1225 WeakPolarHBondContact OG-CB 3.31Å; S1222-K1225 PolarHBondContact OG-N 2.58Å; S1222-K1226 WeakPolarHBondContact O-CG 3.15Å; S1222-K1226 PolarHBondContact O-N 2.9Å
1223	K	70	Confident	72.3	Confident	118 Å²	118	104.7 Å²	104.7	51%	0.513	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.2	172.1	-65	-174.7	-167.8	176.2	0	111.1	E475 Q1227	E475-K1223 IonicContact OE1-NZ 2.72Å; E475-K1223 PolarHBondContact OE1-NZ 3.39Å; E475-K1223 IonicContact OE2-NZ 3.85Å; E475-K1223 PolarHBondContact OE2-NZ 2.87Å; K1223-Q1227 WeakPolarHBondContact O-CG 3.14Å; K1223-Q1227 PolarHBondContact O-N 2.68Å
1224	Q	67.6	Low	72.5	Confident	70 Å²	70	113.2 Å²	113.2	33%	0.327	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-51	-177.1	-161.1	-177.4	27.6	0	0	111.7	S1222 K1226 Q1227 Q1228	S1222-Q1224 PolarHBondContact O-N 2.82Å; Q1224-K1226 PolarHBondContact O-N 2.93Å; Q1224-Q1227 PolarHBondContact O-N 3.12Å; Q1224-Q1228 WeakPolarHBondContact O-CG 3.31Å; Q1224-Q1228 PolarHBondContact O-N 3.49Å
1225	K	71.7	Confident	72.7	Confident	83 Å²	83	110.6 Å²	110.6	36%	0.361	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.9	175.8	-77.1	177	175.1	164.6	0	112.9	E470 L1221 S1222	E470-K1225 VanDerWaalsContact OE2-CD 3.29Å; E470-K1225 WeakPolarHBondContact OE2-CD 3.35Å; E470-K1225 WeakPolarHBondContact OE2-CE 3.38Å; E470-K1225 IonicContact OE2-NZ 2.7Å; E470-K1225 PolarHBondContact OE2-NZ 3.17Å; L1221-K1225 HydrophobicContact CD2-CB 3.79Å; L1221-K1225 HydrophobicContact CD2-CD 4.16Å; S1222-K1225 WeakPolarHBondContact OG-CB 3.31Å; S1222-K1225 PolarHBondContact OG-N 2.58Å
1226	K	76.1	Confident	73.1	Confident	142 Å²	142	117.5 Å²	117.5	62%	0.617	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-21.3	172.9	-75.6	166.8	175.9	145.6	0	114.8	L1221 S1222 Q1224	L1221-K1226 HydrophobicContact CB-CD 4.47Å; L1221-K1226 HydrophobicContact CB-CG 4.18Å; L1221-K1226 VanDerWaalsContact O-CE 3.28Å; L1221-K1226 WeakPolarHBondContact O-CE 2.92Å; L1221-K1226 PolarHBondContact O-NZ 2.92Å; S1222-K1226 WeakPolarHBondContact O-CG 3.15Å; S1222-K1226 PolarHBondContact O-N 2.9Å; Q1224-K1226 PolarHBondContact O-N 2.93Å
1227	Q	75.8	Confident	73.7	Confident	150 Å²	150	127 Å²	127	70%	0.701	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-21.1	179.6	-70.2	178	8.7	0	0	113	K1223 Q1224	K1223-Q1227 WeakPolarHBondContact O-CG 3.14Å; K1223-Q1227 PolarHBondContact O-N 2.68Å; Q1224-Q1227 PolarHBondContact O-N 3.12Å
1228	Q	77.4	Confident	74.4	Confident	122 Å²	122	129.6 Å²	129.6	57%	0.57	60%	0.599	S	S	*	*			trans	-57.1	141.9	173.1	-75.1	172.2	-1.7	0	0	111.4	Q1224	Q1224-Q1228 WeakPolarHBondContact O-CG 3.31Å; Q1224-Q1228 PolarHBondContact O-N 3.49Å
1229	R	77.4	Confident	75	Confident	201 Å²	201	128.8 Å²	128.8	76%	0.758	59%	0.586	S	S	*	*			trans	-127.2	126.9	-179.1	-54.6	-177.7	74.9	172.7	7.9	108.7
1230	L	80.5	Confident	75.6	Confident	170 Å²	170	127.2 Å²	127.2	89%	0.89	58%	0.578	S	S	*	*			trans	-86.7	130.1	174.6	-60.3	174.6	0	0	0	109.4
1231	E	78.6	Confident	76.4	Confident	114 Å²	114	120.8 Å²	120.8	53%	0.533	56%	0.557	S	S	.	*			trans	-112	146.1	167.3	-54.3	-141.5	154.7	0	0	109	R1244	E1231-R1244 VanDerWaalsContact CD-NH2 3.28Å; E1231-R1244 IonicContact OE1-CZ 3.3Å; E1231-R1244 IonicContact OE1-NH2 3.81Å; E1231-R1244 PolarHBondContact OE1-NH2 2.85Å; E1231-R1244 IonicContact OE2-NH2 3.87Å
1232	P	82.1	Confident	77.1	Confident	72 Å²	72	116.7 Å²	116.7	47%	0.468	54%	0.54	S	S	.	.			trans	-69.3	159.2	178.8	30.1	-35.2	0	0	0	111.5	W1243	P1232-W1243 HydrophobicContact CG-CD2 3.97Å; P1232-W1243 VanDerWaalsContact CG-CE2 3.47Å; P1232-W1243 HydrophobicContact CG-CG 4.25Å; P1232-W1243 HydrophobicContact CG-CZ2 3.8Å
1233	L	81.7	Confident	77.8	Confident	170 Å²	170	122.8 Å²	122.8	89%	0.89	56%	0.562	S	S	*	*			trans	-53.2	139	178.7	-64.7	174.8	0	0	0	111.9	N1235	L1233-N1235 PolarHBondContact O-N 3.08Å; L1233-N1235 VanDerWaalsContact O-N 3.12Å
1234	Y	82.8	Confident	78.4	Confident	182 Å²	182	120.1 Å²	120.1	71%	0.714	55%	0.549	S	S	*	.			trans	-65.8	111.1	-177.4	176.4	-100.1	0	0	0	112.1	R1236 P1240	Y1234-R1236 HydrophobicContact CE1-CB 4.2Å; Y1234-P1240 HydrophobicContact CE2-CG 4.5Å
1235	N	84.5	Confident	79.1	Confident	65 Å²	65	123 Å²	123	35%	0.348	57%	0.566	S	S	.	*			trans	-95	113.2	173.3	-178.4	2.9	0	0	0	110.4	L1233 Y1237 E1238	L1233-N1235 PolarHBondContact O-N 3.08Å; L1233-N1235 VanDerWaalsContact O-N 3.12Å; N1235-Y1237 PolarHBondContact O-N 3.28Å; N1235-Y1237 VanDerWaalsContact O-N 3.1Å; N1235-Y1237 PolarHBondContact OD1-N 3.04Å; N1235-Y1237 VanDerWaalsContact OD1-N 3.07Å; N1235-E1238 HydrophobicContact CB-CB 4.42Å; N1235-E1238 VanDerWaalsContact ND2-CD 3.33Å; N1235-E1238 WeakPolarHBondContact ND2-CG 3.36Å; N1235-E1238 PolarHBondContact ND2-OE2 2.84Å; N1235-E1238 PolarHBondContact O-N 3.45Å
1236	R	82.1	Confident	79.6	Confident	209 Å²	209	123.2 Å²	123.2	79%	0.789	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-20.9	179.4	-175.3	175.9	179.9	-179.8	2.3	113.9	Y1234	Y1234-R1236 HydrophobicContact CE1-CB 4.2Å
1237	Y	80.8	Confident	79.5	Confident	212 Å²	212	120.7 Å²	120.7	83%	0.831	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-9.6	-176.6	-60	-78	0	0	0	114.1	N1235	N1235-Y1237 PolarHBondContact O-N 3.28Å; N1235-Y1237 VanDerWaalsContact O-N 3.1Å; N1235-Y1237 PolarHBondContact OD1-N 3.04Å; N1235-Y1237 VanDerWaalsContact OD1-N 3.07Å
1238	E	78.9	Confident	79.2	Confident	114 Å²	114	116 Å²	116	53%	0.533	55%	0.55	S	S	.	*	S	Bend	trans	-115.7	144.8	179.3	-71.5	179.2	135	0	0	110.9	N1235	N1235-E1238 HydrophobicContact CB-CB 4.42Å; N1235-E1238 VanDerWaalsContact ND2-CD 3.33Å; N1235-E1238 WeakPolarHBondContact ND2-CG 3.36Å; N1235-E1238 PolarHBondContact ND2-OE2 2.84Å; N1235-E1238 PolarHBondContact O-N 3.45Å
1239	E	74.9	Confident	78.7	Confident	91 Å²	91	117.5 Å²	117.5	43%	0.425	56%	0.555	S	S	.	*			trans	-64.9	136.4	173	-66.1	169.6	171.9	0	0	110.1	N1241 A1242 R1247 R1251	E1239-N1241 PolarHBondContact O-N 2.86Å; E1239-A1242 HydrophobicContact CB-CB 4.17Å; E1239-A1242 VanDerWaalsContact O-CB 3.22Å; E1239-A1242 WeakPolarHBondContact O-CB 3.4Å; E1239-A1242 PolarHBondContact O-N 3.36Å; E1239-R1247 IonicContact OE2-CZ 3.14Å; E1239-R1247 IonicContact OE2-NH2 3.16Å; E1239-R1247 PolarHBondContact OE2-NH2 2.87Å; E1239-R1251 IonicContact OE1-CZ 2.75Å; E1239-R1251 IonicContact OE1-NH2 3.54Å; E1239-R1251 PolarHBondContact OE1-NH2 2.98Å; E1239-R1251 IonicContact OE2-CZ 3.03Å; E1239-R1251 IonicContact OE2-NH1 2.67Å; E1239-R1251 PolarHBondContact OE2-NH1 2.82Å; E1239-R1251 IonicContact OE2-NH2 2.72Å; E1239-R1251 PolarHBondContact OE2-NH2 2.78Å
1240	P	75.3	Confident	77.9	Confident	85 Å²	85	118.4 Å²	118.4	55%	0.552	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.6	128.1	174.3	-29.6	35.7	0	0	0	111.5	Y1234 A1242 R1247	Y1234-P1240 HydrophobicContact CE2-CG 4.5Å; P1240-A1242 VanDerWaalsContact C-N 3.3Å; P1240-A1242 PolarHBondContact O-N 2.84Å; P1240-R1247 PolarHBondContact O-NH1 2.8Å
1241	N	78.6	Confident	76.7	Confident	50 Å²	50	117.7 Å²	117.7	27%	0.267	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	13.2	-178	-58.1	-47.8	0	0	0	117	E1239 W1243 R1244 R1247	E1239-N1241 PolarHBondContact O-N 2.86Å; N1241-W1243 VanDerWaalsContact C-N 3.26Å; N1241-W1243 PolarHBondContact O-N 2.85Å; N1241-R1244 HydrophobicContact CB-CG 4.2Å; N1241-R1244 VanDerWaalsContact CG-NE 3.29Å; N1241-R1244 PolarHBondContact O-N 3.33Å; N1241-R1244 PolarHBondContact OD1-NE 2.85Å; N1241-R1244 PolarHBondContact OD1-NH2 2.88Å; N1241-R1247 WeakPolarHBondContact O-CD 3.39Å
1242	A	77.1	Confident	75.3	Confident	28 Å²	28	125.3 Å²	125.3	23%	0.231	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	-32.5	169.7	0	0	0	0	0	113.3	E1239 P1240 R1244	E1239-A1242 HydrophobicContact CB-CB 4.17Å; E1239-A1242 VanDerWaalsContact O-CB 3.22Å; E1239-A1242 WeakPolarHBondContact O-CB 3.4Å; E1239-A1242 PolarHBondContact O-N 3.36Å; P1240-A1242 VanDerWaalsContact C-N 3.3Å; P1240-A1242 PolarHBondContact O-N 2.84Å; A1242-R1244 PolarHBondContact O-N 2.75Å
1243	W	79.3	Confident	75	Confident	130 Å²	130	128 Å²	128	49%	0.492	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-17.1	176.1	62.9	-97.9	0	0	0	114.2	P1232 N1241 I1245	P1232-W1243 HydrophobicContact CG-CD2 3.97Å; P1232-W1243 VanDerWaalsContact CG-CE2 3.47Å; P1232-W1243 HydrophobicContact CG-CG 4.25Å; P1232-W1243 HydrophobicContact CG-CZ2 3.8Å; N1241-W1243 VanDerWaalsContact C-N 3.26Å; N1241-W1243 PolarHBondContact O-N 2.85Å; W1243-I1245 PolarHBondContact O-N 3.46Å
1244	R	83.1	Confident	74.6	Confident	62 Å²	62	125.7 Å²	125.7	23%	0.234	56%	0.556	C	S	.	*			trans	-73.1	124	-178.4	-61.5	-167.6	-166.5	-151.7	2.2	110.2	E1231 N1241 A1242 S1246 R1247 A1248	E1231-R1244 VanDerWaalsContact CD-NH2 3.28Å; E1231-R1244 IonicContact OE1-CZ 3.3Å; E1231-R1244 IonicContact OE1-NH2 3.81Å; E1231-R1244 PolarHBondContact OE1-NH2 2.85Å; E1231-R1244 IonicContact OE2-NH2 3.87Å; N1241-R1244 HydrophobicContact CB-CG 4.2Å; N1241-R1244 VanDerWaalsContact CG-NE 3.29Å; N1241-R1244 PolarHBondContact O-N 3.33Å; N1241-R1244 PolarHBondContact OD1-NE 2.85Å; N1241-R1244 PolarHBondContact OD1-NH2 2.88Å; A1242-R1244 PolarHBondContact O-N 2.75Å; R1244-S1246 PolarHBondContact O-N 2.88Å; R1244-S1246 VanDerWaalsContact O-N 3.08Å; R1244-R1247 WeakPolarHBondContact O-CA 3.09Å; R1244-R1247 PolarHBondContact O-N 3.14Å; R1244-A1248 PolarHBondContact O-N 3.19Å; R1244-A1248 VanDerWaalsContact O-N 3.09Å
1245	I	82.4	Confident	74.2	Confident	132 Å²	132	122.6 Å²	122.6	68%	0.677	55%	0.548	S	S	*	.	H	α-helix	trans	-51.7	-36.6	179.2	-61.4	171.5	0	0	0	111.9	W1243 R1247 A1248 F1249	W1243-I1245 PolarHBondContact O-N 3.46Å; I1245-R1247 VanDerWaalsContact C-N 3.28Å; I1245-R1247 PolarHBondContact O-N 2.92Å; I1245-A1248 PolarHBondContact O-N 2.83Å; I1245-F1249 HydrophobicContact CG2-CD2 4.02Å; I1245-F1249 HydrophobicContact CG2-CE2 4.41Å; I1245-F1249 PolarHBondContact O-N 2.86Å
1246	S	83.1	Confident	73.6	Confident	86 Å²	86	126 Å²	126	60%	0.601	56%	0.559	S	S	*	*	H	α-helix	trans	-65.1	-22.5	176.3	55.1	0	0	0	0	115	R1244	R1244-S1246 PolarHBondContact O-N 2.88Å; R1244-S1246 VanDerWaalsContact O-N 3.08Å
1247	R	73.1	Confident	73	Confident	90 Å²	90	120.8 Å²	120.8	34%	0.34	55%	0.545	S	S	.	.	H	α-helix	trans	-92.1	-32.9	171.8	-175.4	170	172.7	174.2	-5.7	111.8	E1239 P1240 N1241 R1244 I1245 F1249 R1250 R1251	E1239-R1247 IonicContact OE2-CZ 3.14Å; E1239-R1247 IonicContact OE2-NH2 3.16Å; E1239-R1247 PolarHBondContact OE2-NH2 2.87Å; P1240-R1247 PolarHBondContact O-NH1 2.8Å; N1241-R1247 WeakPolarHBondContact O-CD 3.39Å; R1244-R1247 WeakPolarHBondContact O-CA 3.09Å; R1244-R1247 PolarHBondContact O-N 3.14Å; I1245-R1247 VanDerWaalsContact C-N 3.28Å; I1245-R1247 PolarHBondContact O-N 2.92Å; R1247-F1249 VanDerWaalsContact C-N 3.3Å; R1247-F1249 PolarHBondContact O-N 3.02Å; R1247-R1250 CarbonylContact O-C 3.58Å; R1247-R1250 PolarHBondContact O-N 3.45Å; R1247-R1251 PolarHBondContact O-N 3.35Å
1248	A	69.8	Low	72.5	Confident	50 Å²	50	114.7 Å²	114.7	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-59.9	-41.2	170.2	0	0	0	0	0	111.7	R1244 I1245 R1250 R1251 R1252	R1244-A1248 PolarHBondContact O-N 3.19Å; R1244-A1248 VanDerWaalsContact O-N 3.09Å; I1245-A1248 PolarHBondContact O-N 2.83Å; A1248-R1250 PolarHBondContact O-N 2.7Å; A1248-R1251 PolarHBondContact O-N 3.25Å; A1248-R1251 VanDerWaalsContact O-N 3.08Å; A1248-R1252 PolarHBondContact O-N 3.14Å
1249	F	65.8	Low	72.1	Confident	154 Å²	154	114.8 Å²	114.8	68%	0.675	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.2	172.7	-102.3	-80.1	0	0	0	115.1	I1245 R1247	I1245-F1249 HydrophobicContact CG2-CD2 4.02Å; I1245-F1249 HydrophobicContact CG2-CE2 4.41Å; I1245-F1249 PolarHBondContact O-N 2.86Å; R1247-F1249 VanDerWaalsContact C-N 3.3Å; R1247-F1249 PolarHBondContact O-N 3.02Å
1250	R	61.8	Low	71.8	Confident	221 Å²	221	116.6 Å²	116.6	83%	0.834	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	3.9	170.4	-71.1	-178.8	174.4	-170.5	-1.5	112.9	R1247 A1248	R1247-R1250 CarbonylContact O-C 3.58Å; R1247-R1250 PolarHBondContact O-N 3.45Å; A1248-R1250 PolarHBondContact O-N 2.7Å
1251	R	56	Low	71.5	Confident	155 Å²	155	119.3 Å²	119.3	59%	0.585	53%	0.532	S	S	*	.			trans	-113.2	1.5	175.7	-90.5	-172.7	158.9	149.4	2.2	113.1	E1239 R1247 A1248	E1239-R1251 IonicContact OE1-CZ 2.75Å; E1239-R1251 IonicContact OE1-NH2 3.54Å; E1239-R1251 PolarHBondContact OE1-NH2 2.98Å; E1239-R1251 IonicContact OE2-CZ 3.03Å; E1239-R1251 IonicContact OE2-NH1 2.67Å; E1239-R1251 PolarHBondContact OE2-NH1 2.82Å; E1239-R1251 IonicContact OE2-NH2 2.72Å; E1239-R1251 PolarHBondContact OE2-NH2 2.78Å; R1247-R1251 PolarHBondContact O-N 3.35Å; A1248-R1251 PolarHBondContact O-N 3.25Å; A1248-R1251 VanDerWaalsContact O-N 3.08Å
1252	R	48.6	Very low	70.9	Confident	273 Å²	273	125.5 Å²	125.5	100%	1.03	56%	0.556	S	S	*	*			trans	-108.4	0	164.1	-71.9	-175.7	173.9	-173.8	-1.8	108.5	A1248	A1248-R1252 PolarHBondContact O-N 3.14Å

Retrieved 1,252 of 1,252 residues in 1151 ms (Link to these results)

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