A0A3Q0KQQ4_SCHMA Loading...

Agrin, putative

AlphaFold DB , UniProt , Accession A0A3Q0KQQ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,874 aa.

						>A0A3Q0KQQ4_SCHMA|A0A3Q0KQQ4
MTNQGSIMFYSPYSLLTLSSYMSMINVVITIIIIISSTYHSTISATWICLSREQLIALSNSKNTYHFEAEIIQLDKPLEFIKHTTDNNIDKSGINAFVKITKILKQPQIGKFSNLLQMNELVHVNQIKSRDDLQDMMVRNVPGNRNSDDDDNDNEQCLPKLERGETYEWITYALDNTNILHNNEQKQLILMPGGIFPLLSHQSLIQLKSSNNNNNLKNDGCSKRECRFGAICEEWLSKDSDQLIGVCVCPTLMDMAKNHMCNMNSGTICTVNGLFYLNECVMLHQACLKQTELKPMNLNVFSRILSQNDCSQLIEKMSLSSASTTSVHITNDQTSTNQIIPQVQPNRNSPSLTQIHQNTHHIKMDENLQHDSPQLSQLIHSPTIEFNPYKCSLKMCPNELNPICDSEGTIYLNDCLLKKYSCRKIGTGELPRIISCNSTLQKYKPKAELCGNGNLCLYGGKCYDPLDHYYRSKMIMKKILPLYSNCICEHINCLNDWPDPVCADDGETYTNQCFLKRAICETQSLKRILYRGNCASNPCLHHKCRWQGEKCQVDVNGQAKCTCPEPCPSAVSPVCGSDGVTYDSICHLERTACQKMREIRVIYSGECSEPKDCILLNQPCQGYEICSRIKNPMVYTSINRKLDASVYDLSNSFEDTIPECICPTCPEYGLGGQVCGSDGQTYRSECHLRSSACQRHSTDLTVKSRGKCDACQTKQCKYYAICQLSAFGEPQCICPTDCLYVRKPVCGTDGKTYENECFLKVKSCADQREVHVAQEGYCRPCTAGCPLGFQCRNGQCVCRDACPPKHPTELDVCGTDGKLYSSECELKRQACIHQTNIDVDLTGVRCRSKHPTVLQDTNMKTSGNIQADGVRLSSCTCNKLGALSEECDYLGNCRCKWGVGGLKCDQCLANYWGIQNNHECIPCSCHPLGSTDTTCNQATGQCNCRTGVVGRQCSMCPDGSQVTENGCSVKRQSEDIKFESNEQQYSPGATELNKTNTFISQLPDKLTAENNKEEDGRLFTETTTLLVRIPFHIDQPTEIQMILGLDKGNGMLLHYRAPPSEQEQMISRDTQDHQFSMAISNWRVVLKYIDGSVPNRILLVYSKHNLTRNTKHNIQAGIISGTPWIKIDKFSRTTNQDVIEKWADTHQSDNQPTAGSLETIIIGRQIKIGGQSISDMKERADLHDDYGFSGCLNKMIINAGSPTKHFSLDLLEAINTKLAWLGIEPNPSTGHSEAPLCSSSIKALSSPTNDISNSNTIENIPPLLQSDQVQRHDNIINQNVQTLSSHIQTKKCENYGIESIGSDGKYTCICQPGWQGGVCEQAVTIIPQFSGNGFIRLAGPTGKYAIKRRKLHIELIFLVTQPSGLLFFIPPKSPHNGPFIAAYLDEQNYLNVVCRTGKGKLVNENLIQLRYNEPVQLNQWNTLLIDKLQKVLRVKVNGNKRQRVSLIPSRFLHIQNHLLKELTNFDLSSSPIYLGGYGFYDQSILNYIPIRHGFYGAIQRININEAEVVLAGPSLADMMNTPEEQGKLPHLFEKWANVSQWQGLPCGPQYSPCQLNQPYSICRPNIQHATCACTTPLQLMHLMKGRLDEETDEVEQQACLQRKMELSRLNSALSSRNDGQLQYDGPNRAPSREIYNEPDEELPPVDLARQILINFGGLTVYTYRGLIRFTSDFNIRLRLRTNKMDGIILLMVEQTSLNHPHDLSSSSSSSLILNQPVTQITTNSEFVLIVLRNGRVELLLNLVTSRKKKDQSWDVNNNDNGNPEYNRLMPIQARHKVNDGEWHMIQAMGNKQRATLFVDNHMVSGEFAGVADYDTPPVRDVYLGGTIFNIVGLSADYQQNFTGCIADMLIQEKIIPILSEATEIHGPIERCKTP
					

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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	32.2	Very low	31.3	Very low	237 Å²	237	145.9 Å²	145.9	100%	1.167	78%	0.783	S	S	*	*				0	133.7	0	-68.2	167.5	171	0	0	108.6
2	T	28.8	Very low	32.8	Very low	119 Å²	119	142.7 Å²	142.7	73%	0.73	78%	0.776	S	S	*	*			cis	-171.6	139.9	-38.9	7.4	0	0	0	0	108.6
3	N	32.6	Very low	33.5	Very low	137 Å²	137	148.7 Å²	148.7	73%	0.733	78%	0.783	S	S	*	*			trans	66.1	135.3	172.3	-53.1	-1.3	0	0	0	115.3
4	Q	30.8	Very low	33.7	Very low	191 Å²	191	144.7 Å²	144.7	89%	0.893	77%	0.774	S	S	*	*			cis	87.4	123.7	28.1	-68.2	-170	-28.2	0	0	116.5
5	G	33.7	Very low	33.7	Very low	70 Å²	70	145.3 Å²	145.3	72%	0.722	78%	0.775	S	S	*	*			trans	126.1	155.3	139.4	0	0	0	0	0	117
6	S	30.7	Very low	33.9	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	78%	0.779	S	S	*	*			cis	177.8	143.3	-22.4	-113.8	0	0	0	0	112.4
7	I	30.7	Very low	33.9	Very low	149 Å²	149	145.1 Å²	145.1	76%	0.764	78%	0.78	S	S	*	*			trans	66.4	164.1	146.2	-65.9	169.5	0	0	0	114.9
8	M	27.7	Very low	33.7	Very low	133 Å²	133	145.9 Å²	145.9	66%	0.655	78%	0.783	S	S	*	*			cis	-144.5	172.6	4.4	-121.2	-133.3	168.7	0	0	106.6	Y10	M8-Y10 HydrophobicContact SD-CE2 3.81Å
9	F	29.2	Very low	33.3	Very low	168 Å²	168	142.9 Å²	142.9	74%	0.737	78%	0.775	S	S	*	*			cis	-176.6	-162.8	-35.2	-128.3	-132.4	0	0	0	108.9
10	Y	34.6	Very low	33.2	Very low	191 Å²	191	140.8 Å²	140.8	75%	0.749	77%	0.771	S	S	*	*			trans	78.8	140.8	169.7	-58.9	-77.5	0	0	0	117.4	M8	M8-Y10 HydrophobicContact SD-CE2 3.81Å
11	S	33.2	Very low	32.9	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	78%	0.776	S	S	*	*			cis	-149.7	153.6	-0.2	-157.1	0	0	0	0	112.7
12	P	50	Low	32.7	Very low	107 Å²	107	141.4 Å²	141.4	70%	0.695	76%	0.759	S	S	*	*			trans	-121.3	173.6	-175.6	43.1	-32.7	0	0	0	116.5
13	Y	41.4	Very low	32.6	Very low	221 Å²	221	140.4 Å²	140.4	87%	0.867	76%	0.757	S	S	*	*			trans	-139.3	125.3	154.9	-91.1	-98.3	0	0	0	107
14	S	35.9	Very low	32.4	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	76%	0.758	S	S	*	*				84.7	135.7	68.9	-66.4	0	0	0	0	113
15	L	34.3	Very low	32.3	Very low	153 Å²	153	137.8 Å²	137.8	80%	0.801	75%	0.745	S	S	*	*			cis	-166.9	-170.3	-5.7	-122.1	169.4	0	0	0	110
16	L	36.4	Very low	31.9	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	75%	0.745	S	S	*	*			trans	81.1	80.4	166.5	-60.7	174.8	0	0	0	119
17	T	34.8	Very low	31.8	Very low	129 Å²	129	140.7 Å²	140.7	79%	0.791	74%	0.739	S	S	*	*			trans	-72.1	152.1	148.9	51.5	0	0	0	0	112.6
18	L	30.2	Very low	31.6	Very low	159 Å²	159	137 Å²	137	83%	0.832	72%	0.723	S	S	*	*			trans	-172.8	107.4	147.3	-95.9	160.4	0	0	0	105.9
19	S	26.2	Very low	31.7	Very low	90 Å²	90	134.7 Å²	134.7	63%	0.629	71%	0.713	S	S	*	*				71.2	128.2	79.8	97.7	0	0	0	0	115.8
20	S	30	Very low	31.7	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	71%	0.705	S	S	*	*			trans	58.6	110.3	143.7	-49.4	0	0	0	0	119.7
21	Y	27	Very low	31.6	Very low	225 Å²	225	126 Å²	126	88%	0.882	69%	0.689	S	S	*	*				-174.8	108.8	119.1	-101	-76.1	0	0	0	106.9
22	M	28.2	Very low	31.5	Very low	165 Å²	165	128.1 Å²	128.1	81%	0.813	69%	0.691	S	S	*	*				67.8	125.6	64.6	-80.1	-71	-176.7	0	0	115.5
23	S	26.1	Very low	30.6	Very low	98 Å²	98	128.5 Å²	128.5	69%	0.685	69%	0.686	S	S	*	*			trans	70.2	155.3	164	-104.7	0	0	0	0	116.7
24	M	29.1	Very low	30.2	Very low	152 Å²	152	124.1 Å²	124.1	75%	0.749	68%	0.677	S	S	*	*			cis	-133.9	149.8	20.1	-86.6	-61.7	-178.9	0	0	114.1
25	I	28.9	Very low	30.1	Very low	122 Å²	122	125.7 Å²	125.7	63%	0.626	68%	0.676	S	S	*	*			trans	63.6	106.5	135.5	-66.3	170.4	0	0	0	119
26	N	26.2	Very low	30.1	Very low	133 Å²	133	123.2 Å²	123.2	71%	0.711	67%	0.672	S	S	*	*				55.4	173.5	114.2	-45	-19.2	0	0	0	119.6
27	V	26.8	Very low	30	Very low	103 Å²	103	119.8 Å²	119.8	62%	0.624	66%	0.661	S	S	*	*			cis	-149.2	166.8	-10.7	101.4	0	0	0	0	110.1	Y167	V27-Y167 VanDerWaalsContact CG1-O 3.25Å; V27-Y167 WeakPolarHBondContact CG1-O 3.48Å
28	V	28.3	Very low	30.1	Very low	70 Å²	70	119.9 Å²	119.9	42%	0.424	66%	0.662	S	S	.	*			trans	-15.9	124.8	163.9	-173.4	0	0	0	0	118.1	Y167	V28-Y167 CarbonylContact O-C 3.19Å; V28-Y167 VanDerWaalsContact O-C 3.29Å
29	I	28.4	Very low	30.3	Very low	85 Å²	85	121.1 Å²	121.1	44%	0.436	66%	0.657	S	S	.	*				-174.7	129.8	121.7	-101.1	-178.2	0	0	0	106.6	Y167 E168	I29-Y167 VanDerWaalsContact CD1-CA 3.48Å; I29-E168 HydrophobicContact CD1-CB 4.43Å; I29-E168 HydrophobicContact CD1-CG 4.43Å
30	T	29.4	Very low	30.8	Very low	93 Å²	93	124.7 Å²	124.7	57%	0.571	66%	0.663	S	S	*	*			cis	70.9	172.3	46.8	-28	0	0	0	0	112.3
31	I	32.9	Very low	31.1	Very low	83 Å²	83	124 Å²	124	43%	0.426	66%	0.659	S	S	.	*			trans	49.8	84.8	158.3	-63.8	157.3	0	0	0	113.2	I33	I31-I33 HydrophobicContact CG1-CD1 4.39Å; I31-I33 HydrophobicContact CG2-CB 3.92Å; I31-I33 HydrophobicContact CG2-CD1 4.03Å; I31-I33 HydrophobicContact CG2-CG2 3.94Å
32	I	31	Very low	31.4	Very low	150 Å²	150	119.2 Å²	119.2	77%	0.769	65%	0.652	S	S	*	*				58.5	-172.8	65.4	-38.8	152.9	0	0	0	109.7
33	I	31.8	Very low	31.8	Very low	116 Å²	116	118.9 Å²	118.9	60%	0.595	65%	0.652	S	S	*	*			trans	79.1	129.4	146.1	-85.7	156.8	0	0	0	116.3	I31	I31-I33 HydrophobicContact CG1-CD1 4.39Å; I31-I33 HydrophobicContact CG2-CB 3.92Å; I31-I33 HydrophobicContact CG2-CD1 4.03Å; I31-I33 HydrophobicContact CG2-CG2 3.94Å
34	I	33.4	Very low	32.2	Very low	129 Å²	129	119.9 Å²	119.9	66%	0.662	66%	0.659	S	S	*	*			cis	-168.3	171.3	-7.9	-146.1	-174.7	0	0	0	112.1
35	I	33.5	Very low	32.3	Very low	125 Å²	125	116.4 Å²	116.4	64%	0.641	66%	0.655	S	S	*	*			trans	62.9	118.5	158.9	-66.3	168.1	0	0	0	117
36	S	32.8	Very low	32.4	Very low	102 Å²	102	116.3 Å²	116.3	71%	0.713	66%	0.66	S	S	*	*			cis	88.4	174.4	17.1	102.5	0	0	0	0	117.8
37	S	34.8	Very low	32.5	Very low	87 Å²	87	120.6 Å²	120.6	61%	0.608	67%	0.667	S	S	*	*			trans	75	140.2	-174.7	78.6	0	0	0	0	114.3
38	T	37.7	Very low	32.4	Very low	130 Å²	130	122.5 Å²	122.5	80%	0.798	67%	0.672	S	S	*	*			cis	-149.1	170	38.3	38.1	0	0	0	0	112.1
39	Y	34.4	Very low	32.2	Very low	186 Å²	186	125.2 Å²	125.2	73%	0.729	69%	0.692	S	S	*	*			cis	-167.7	176.3	-38.1	-139.1	-93.8	0	0	0	109.3
40	H	37.1	Very low	32.1	Very low	164 Å²	164	126.8 Å²	126.8	76%	0.759	70%	0.701	S	S	*	*			trans	71.3	155.4	165.3	-75.1	-76.2	0	0	0	120.6
41	S	35.7	Very low	32	Very low	87 Å²	87	125 Å²	125	61%	0.608	69%	0.693	S	S	*	*			cis	168.1	160.1	-36.8	56	0	0	0	0	109.9
42	T	33.1	Very low	31.8	Very low	123 Å²	123	131 Å²	131	76%	0.755	71%	0.71	S	S	*	*			cis	-173.4	176.2	-23.2	35	0	0	0	0	107
43	I	37.2	Very low	32	Very low	158 Å²	158	132.7 Å²	132.7	81%	0.81	72%	0.715	S	S	*	*			trans	148.8	122.2	139.8	-77	160.5	0	0	0	115.2
44	S	33.4	Very low	32	Very low	119 Å²	119	133.8 Å²	133.8	83%	0.832	72%	0.717	S	S	*	*			trans	53.4	143.1	148.2	-160.6	0	0	0	0	122.5
45	A	32.6	Very low	31.8	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	72%	0.716	S	S	*	*			cis	-179.1	-177.4	-24.1	0	0	0	0	0	107.2
46	T	30.8	Very low	31.8	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	72%	0.724	S	S	*	*			cis	-164.3	176.7	1.3	-12	0	0	0	0	110.7
47	W	26.8	Very low	31.5	Very low	222 Å²	222	134.3 Å²	134.3	84%	0.841	72%	0.724	S	S	*	*			trans	75.4	119.7	160.4	-69.9	108.6	0	0	0	122.1
48	I	25.3	Very low	31.3	Very low	144 Å²	144	138.3 Å²	138.3	74%	0.738	74%	0.738	S	S	*	*	S	Bend	trans	84.6	129.7	149.8	-59.5	165.6	0	0	0	119.2
49	C	24.4	Very low	30.8	Very low	126 Å²	126	137.1 Å²	137.1	85%	0.851	74%	0.735	S	S	*	*			trans	34.1	106.9	167.4	-66.3	0	0	0	0	118.9
50	L	26.2	Very low	30.5	Very low	118 Å²	118	135.6 Å²	135.6	62%	0.618	74%	0.739	S	S	*	*			trans	-84.3	122.8	-173	-67.9	163.4	0	0	0	113.5	Q54	L50-Q54 HydrophobicContact CD2-CB 4.45Å
51	S	26.7	Very low	30.1	Very low	56 Å²	56	132.1 Å²	132.1	39%	0.392	73%	0.733	S	S	.	*			trans	-77.8	158.8	163.6	70.6	0	0	0	0	111.6	E53 Q54	S51-E53 PolarHBondContact O-N 3.42Å; S51-Q54 PolarHBondContact O-N 2.82Å
52	R	28.7	Very low	29.7	Very low	210 Å²	210	136.3 Å²	136.3	79%	0.792	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-58.1	-19	-177.6	-169.9	172.3	177.1	179.2	-1.5	114.6	Q54	R52-Q54 VanDerWaalsContact C-N 3.33Å; R52-Q54 PolarHBondContact O-N 3.43Å
53	E	36.4	Very low	29.8	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.864	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-77.2	-12.7	-176.7	-58.7	-170	124.2	0	0	114.3	S51	S51-E53 PolarHBondContact O-N 3.42Å
54	Q	31.5	Very low	29.5	Very low	139 Å²	139	133.4 Å²	133.4	65%	0.65	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-107.2	-1.6	-175.3	-61.9	-168.9	-2.8	0	0	115	L50 S51 R52	L50-Q54 HydrophobicContact CD2-CB 4.45Å; S51-Q54 PolarHBondContact O-N 2.82Å; R52-Q54 VanDerWaalsContact C-N 3.33Å; R52-Q54 PolarHBondContact O-N 3.43Å
55	L	29.6	Very low	29.7	Very low	122 Å²	122	131.2 Å²	131.2	64%	0.639	70%	0.7	S	S	*	*	S	Bend	trans	-97	3.1	-166	-113.7	166.8	0	0	0	116.5
56	I	31.7	Very low	30.1	Very low	159 Å²	159	132.4 Å²	132.4	82%	0.815	69%	0.691	S	S	*	*			trans	-126.4	66.4	176.8	-46.4	-177.7	0	0	0	111.1
57	A	27.7	Very low	30.8	Very low	86 Å²	86	130.9 Å²	130.9	71%	0.711	68%	0.675	S	S	*	*			trans	-115.6	14.3	173.6	0	0	0	0	0	113.5
58	L	29.5	Very low	31.8	Very low	171 Å²	171	124.2 Å²	124.2	90%	0.895	65%	0.653	S	S	*	*	S	Bend	trans	-124.4	11.8	-170.8	-79.9	170	0	0	0	115.4
59	S	28	Very low	33	Very low	105 Å²	105	119.8 Å²	119.8	73%	0.734	64%	0.638	S	S	*	*			trans	-115.8	104.2	169.2	-169.5	0	0	0	0	110.3	S61	S59-S61 PolarHBondContact O-N 3.21Å
60	N	28.5	Very low	34.3	Very low	153 Å²	153	117 Å²	117	82%	0.818	61%	0.613	S	S	*	*			trans	-88.5	93.8	-177.8	-87.1	-74.9	0	0	0	111.7
61	S	28.2	Very low	35.7	Very low	91 Å²	91	113.8 Å²	113.8	64%	0.636	60%	0.595	S	S	*	*			trans	-136.5	138.4	152	141.2	0	0	0	0	107.7	S59	S59-S61 PolarHBondContact O-N 3.21Å
62	K	28.3	Very low	37	Very low	176 Å²	176	113.9 Å²	113.9	77%	0.765	59%	0.591	S	S	*	*			trans	-100	146.6	-170.2	-63.1	176.1	-178.3	177.4	0	109.7
63	N	33.4	Very low	38	Very low	123 Å²	123	108.8 Å²	108.8	66%	0.658	58%	0.576	S	S	*	*			trans	76.1	42.9	172.9	-44.9	-18.5	0	0	0	116.2
64	T	32.2	Very low	39.2	Very low	96 Å²	96	101.4 Å²	101.4	59%	0.589	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-77.1	120.9	164	38.1	0	0	0	0	111.4
65	Y	36.6	Very low	40.4	Very low	74 Å²	74	97.9 Å²	97.9	29%	0.29	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-80.2	135.3	162.7	-67.5	-97.5	0	0	0	108.8	I103 Q106 L116	Y65-I103 HydrophobicContact CD1-CG2 4.41Å; Y65-Q106 HydrophobicContact CD1-CG 4.29Å; Y65-Q106 HydrophobicContact CE1-CG 4.2Å; Y65-L116 HydrophobicContact CD1-CD1 3.67Å; Y65-L116 HydrophobicContact CD2-CD1 3.34Å; Y65-L116 HydrophobicContact CE1-CB 4.39Å; Y65-L116 HydrophobicContact CE1-CD1 3.78Å; Y65-L116 HydrophobicContact CE2-CD1 3.46Å; Y65-L116 VanDerWaalsContact CE2-CD1 3.46Å; Y65-L116 HydrophobicContact CG-CD1 3.43Å; Y65-L116 VanDerWaalsContact CG-CD1 3.43Å
66	H	41.2	Very low	41.6	Very low	105 Å²	105	93.9 Å²	93.9	49%	0.486	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	140.7	164.8	-73	-84.6	0	0	0	109.2	I103 L104 K105	H66-I103 CarbonylContact O-C 3.35Å; H66-L104 HydrophobicContact CB-CB 3.8Å; H66-L104 PolarHBondContact O-N 3.49Å; H66-K105 HydrophobicContact CB-CB 4.09Å; H66-K105 PolarHBondContact N-O 2.93Å; H66-K105 PolarHBondContact O-N 2.89Å
67	F	46.5	Very low	42.4	Very low	87 Å²	87	90.2 Å²	90.2	38%	0.382	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	148.8	177.7	42.1	-92.6	0	0	0	111.9	A69 I100 K102	F67-A69 HydrophobicContact CD2-CB 4.19Å; F67-I100 HydrophobicContact CB-CG1 4.4Å; F67-I100 HydrophobicContact CB-CG2 3.94Å; F67-I100 HydrophobicContact CD1-CD1 4.23Å; F67-I100 HydrophobicContact CD2-CD1 4.25Å; F67-I100 HydrophobicContact CD2-CG1 3.89Å; F67-I100 HydrophobicContact CE1-CD1 4.44Å; F67-I100 HydrophobicContact CE2-CD1 4.45Å; F67-I100 HydrophobicContact CE2-CG1 4.31Å; F67-I100 HydrophobicContact CG-CD1 4.14Å; F67-I100 HydrophobicContact CG-CG1 4.08Å; F67-K102 CarbonylContact C-O 3.54Å; F67-K102 WeakPolarHBondContact CA-O 3.39Å; F67-K102 WeakPolarHBondContact CB-O 3.43Å
68	E	47.8	Very low	43.4	Very low	82 Å²	82	89.8 Å²	89.8	38%	0.383	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	146.3	158.3	-62.6	173.1	-173.7	0	0	107.9	T101 K102 L104	E68-T101 VanDerWaalsContact C-OG1 3.25Å; E68-T101 WeakPolarHBondContact CB-OG1 3.37Å; E68-T101 PolarHBondContact O-N 3.46Å; E68-T101 PolarHBondContact O-OG1 2.83Å; E68-T101 VanDerWaalsContact O-OG1 3.13Å; E68-K102 HydrophobicContact CB-CB 4Å; E68-K102 HydrophobicContact CG-CB 4.25Å; E68-K102 HydrophobicContact CG-CD 4.04Å; E68-K102 PolarHBondContact N-O 3.31Å; E68-K102 VanDerWaalsContact OE1-CD 3.3Å; E68-K102 WeakPolarHBondContact OE1-CD 3.49Å; E68-K102 IonicContact OE1-NZ 3.56Å; E68-K102 PolarHBondContact OE1-NZ 2.92Å; E68-K102 WeakPolarHBondContact OE2-CD 3.27Å; E68-K102 IonicContact OE2-NZ 2.62Å; E68-K102 PolarHBondContact OE2-NZ 3.37Å; E68-L104 HydrophobicContact CG-CD1 3.87Å; E68-L104 HydrophobicContact CG-CD2 4.07Å; E68-L104 HydrophobicContact CG-CG 4.02Å
69	A	49.7	Very low	43.9	Very low	52 Å²	52	86.7 Å²	86.7	43%	0.43	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.4	-171.1	0	0	0	0	0	111.1	F67 V98 K99	F67-A69 HydrophobicContact CD2-CB 4.19Å; A69-V98 HydrophobicContact CB-CG1 3.47Å; A69-V98 VanDerWaalsContact CB-CG1 3.47Å; A69-K99 CarbonylContact C-O 3.58Å; A69-K99 VanDerWaalsContact CA-O 3.24Å; A69-K99 WeakPolarHBondContact CA-O 3.39Å
70	E	51.4	Low	44.8	Very low	68 Å²	68	88.1 Å²	88.1	32%	0.318	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	119.6	-177.4	171.5	-175.1	-146.6	0	0	108.8	I72 V98 K99 T101	E70-I72 PolarHBondContact O-N 3.16Å; E70-I72 VanDerWaalsContact O-N 3.15Å; E70-V98 CarbonylContact O-C 3.59Å; E70-V98 WeakPolarHBondContact O-CA 3.46Å; E70-V98 WeakPolarHBondContact O-CG1 3.01Å; E70-K99 HydrophobicContact CB-CB 4.33Å; E70-K99 PolarHBondContact N-O 2.91Å; E70-K99 PolarHBondContact O-N 2.76Å; E70-K99 WeakPolarHBondContact OE2-CD 3.08Å; E70-K99 WeakPolarHBondContact OE2-CE 3.04Å; E70-K99 IonicContact OE2-NZ 3.33Å; E70-K99 PolarHBondContact OE2-NZ 3Å; E70-T101 HydrophobicContact CB-CG2 3.45Å; E70-T101 VanDerWaalsContact CB-CG2 3.45Å; E70-T101 HydrophobicContact CG-CG2 4.41Å; E70-T101 WeakPolarHBondContact OE2-CG2 3.28Å
71	I	56	Low	45.8	Very low	49 Å²	49	82.4 Å²	82.4	25%	0.251	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	113.1	177.9	-59.2	173.2	0	0	0	108.2	L74 A96 V98 M136 M137	I71-L74 HydrophobicContact CG2-CD2 3.92Å; I71-L74 HydrophobicContact CG2-CG 4.23Å; I71-A96 HydrophobicContact CG2-CB 4.32Å; I71-V98 HydrophobicContact CG1-CG1 4.38Å; I71-V98 HydrophobicContact CG1-CG2 4.25Å; I71-M136 HydrophobicContact CD1-CB 4.43Å; I71-M136 HydrophobicContact CD1-CE 4.16Å; I71-M136 HydrophobicContact CG1-CE 4.19Å; I71-M137 HydrophobicContact CD1-CE 4.27Å
72	I	53.9	Low	46.3	Very low	58 Å²	58	81.4 Å²	81.4	30%	0.297	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-44.6	-179.4	-42.8	-180	0	0	0	110.5	E70 F97 K99 L121 E667	E70-I72 PolarHBondContact O-N 3.16Å; E70-I72 VanDerWaalsContact O-N 3.15Å; I72-F97 HydrophobicContact CB-CB 4.41Å; I72-F97 PolarHBondContact N-O 2.88Å; I72-K99 HydrophobicContact CD1-CB 3.59Å; I72-K99 HydrophobicContact CD1-CG 4.43Å; I72-K99 HydrophobicContact CG1-CB 3.63Å; I72-L121 HydrophobicContact CD1-CD2 3.55Å; I72-L121 HydrophobicContact CD1-CG 4.09Å; I72-E667 WeakPolarHBondContact CD1-OE2 2.86Å; I72-E667 HydrophobicContact CG2-CG 4.16Å
73	Q	51.1	Low	46.9	Very low	104 Å²	104	78.4 Å²	78.4	49%	0.486	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	137.2	-171.3	179.5	174.1	-8.7	0	0	109.9	A96 F97	Q73-A96 CarbonylContact O-C 3.54Å; Q73-A96 WeakPolarHBondContact O-CA 3.25Å; Q73-F97 HydrophobicContact CB-CB 4.19Å; Q73-F97 HydrophobicContact CB-CD2 3.99Å; Q73-F97 HydrophobicContact CB-CG 4.43Å; Q73-F97 HydrophobicContact CG-CD2 4.14Å; Q73-F97 PolarHBondContact N-O 2.03Å; Q73-F97 PolarHBondContact O-N 2.91Å
74	L	59.6	Low	47.3	Very low	29 Å²	29	75.4 Å²	75.4	15%	0.152	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	142.6	163.9	-60.7	172.2	0	0	0	108.1	I71 K76 L78 I81 I94 A96 L133	I71-L74 HydrophobicContact CG2-CD2 3.92Å; I71-L74 HydrophobicContact CG2-CG 4.23Å; L74-K76 WeakPolarHBondContact CB-O 3.25Å; L74-K76 PolarHBondContact O-N 2.8Å; L74-L78 HydrophobicContact CD1-CD1 3.57Å; L74-I81 HydrophobicContact CD1-CD1 4.16Å; L74-I94 HydrophobicContact CB-CG2 4.12Å; L74-I94 HydrophobicContact CD2-CG2 3.88Å; L74-I94 HydrophobicContact CG-CG2 4.46Å; L74-A96 HydrophobicContact CD2-CB 3.7Å; L74-L133 HydrophobicContact CD1-CD1 4.42Å
75	D	57.9	Low	47.7	Very low	65 Å²	65	77.5 Å²	77.5	35%	0.348	39%	0.392	S	S	.	.	S	Bend	trans	-72	-14.3	176	72.7	-21.6	0	0	0	113.7	I94 N95	D75-I94 WeakPolarHBondContact OD1-CA 3.48Å; D75-I94 WeakPolarHBondContact OD1-CG2 3.32Å; D75-N95 HydrophobicContact CB-CB 4.22Å; D75-N95 PolarHBondContact N-O 3.17Å; D75-N95 PolarHBondContact OD1-N 3.28Å; D75-N95 WeakPolarHBondContact OD2-CB 3.37Å; D75-N95 PolarHBondContact OD2-N 3Å; D75-N95 PolarHBondContact OD2-ND2 3.16Å
76	K	55	Low	47.7	Very low	38 Å²	38	79.6 Å²	79.6	17%	0.165	41%	0.408	C	S	.	.	S	Bend	trans	-119.2	132.8	172.8	-70.2	174.4	-180	172.3	0	109.9	L74 S92 G93 I94	L74-K76 WeakPolarHBondContact CB-O 3.25Å; L74-K76 PolarHBondContact O-N 2.8Å; K76-S92 PolarHBondContact NZ-OG 3.34Å; K76-G93 VanDerWaalsContact CE-O 3.31Å; K76-G93 WeakPolarHBondContact CE-O 3.29Å; K76-G93 PolarHBondContact NZ-O 3.43Å; K76-I94 HydrophobicContact CB-CG1 4.46Å; K76-I94 HydrophobicContact CD-CG1 4.07Å
77	P	47.8	Very low	47.9	Very low	82 Å²	82	82.6 Å²	82.6	53%	0.532	43%	0.428	S	S	.	.			trans	-57.6	144.3	-179.5	-25.9	34.2	0	0	0	112.9	E79 F80 I81	P77-E79 PolarHBondContact O-N 2.94Å; P77-F80 HydrophobicContact CB-CB 4.29Å; P77-F80 VanDerWaalsContact O-CB 3.31Å; P77-F80 WeakPolarHBondContact O-CB 3.23Å; P77-F80 PolarHBondContact O-N 3.23Å; P77-I81 PolarHBondContact O-N 3.02Å
78	L	47.9	Very low	47.6	Very low	77 Å²	77	84.5 Å²	84.5	40%	0.403	44%	0.442	S	S	.	.	H	α-helix	trans	-61.7	-28.3	178.9	-150.9	75.6	0	0	0	111.9	L74 I81 K82	L74-L78 HydrophobicContact CD1-CD1 3.57Å; L78-I81 HydrophobicContact CD1-CD1 4.48Å; L78-K82 WeakPolarHBondContact O-CD 3.38Å; L78-K82 WeakPolarHBondContact O-CE 3.46Å; L78-K82 WeakPolarHBondContact O-CG 3.08Å; L78-K82 PolarHBondContact O-N 3.46Å; L78-K82 VanDerWaalsContact O-N 3.16Å
79	E	41.1	Very low	47.6	Very low	107 Å²	107	82.3 Å²	82.3	50%	0.5	43%	0.433	S	S	.	.	H	α-helix	trans	-67.9	-36.7	168.8	-90.1	87	-116.1	0	0	114.2	P77 I81 K82 H83	P77-E79 PolarHBondContact O-N 2.94Å; E79-I81 PolarHBondContact O-N 3.22Å; E79-K82 HydrophobicContact CG-CD 4.47Å; E79-K82 PolarHBondContact O-N 3.18Å; E79-K82 IonicContact OE1-NZ 3.81Å; E79-K82 PolarHBondContact OE1-NZ 3.35Å; E79-H83 PolarHBondContact O-CD2 2.69Å; E79-H83 VanDerWaalsContact O-CD2 3.26Å; E79-H83 PolarHBondContact O-N 3.41Å
80	F	46	Very low	47.3	Very low	134 Å²	134	85.2 Å²	85.2	59%	0.588	44%	0.441	S	S	*	.	H	α-helix	trans	-61	-38.8	177	-155.8	-90.2	0	0	0	110.2	P77 K82 T84	P77-F80 HydrophobicContact CB-CB 4.29Å; P77-F80 VanDerWaalsContact O-CB 3.31Å; P77-F80 WeakPolarHBondContact O-CB 3.23Å; P77-F80 PolarHBondContact O-N 3.23Å; F80-K82 VanDerWaalsContact C-N 3.34Å; F80-T84 HydrophobicContact CD1-CG2 4.39Å; F80-T84 HydrophobicContact CE1-CG2 4.39Å; F80-T84 WeakPolarHBondContact O-CG2 3.04Å; F80-T84 PolarHBondContact O-N 2.05Å; F80-T84 PolarHBondContact O-OG1 2.77Å
81	I	50.2	Low	46.9	Very low	33 Å²	33	91.5 Å²	91.5	17%	0.169	47%	0.468	C	S	.	.	H	α-helix	trans	-72.3	-24.2	175.6	-57.4	160.7	0	0	0	112.3	L74 P77 L78 E79 T84 I94 L133	L74-I81 HydrophobicContact CD1-CD1 4.16Å; P77-I81 PolarHBondContact O-N 3.02Å; L78-I81 HydrophobicContact CD1-CD1 4.48Å; E79-I81 PolarHBondContact O-N 3.22Å; I81-T84 PolarHBondContact O-OG1 2.74Å; I81-I94 HydrophobicContact CD1-CD1 3.58Å; I81-I94 HydrophobicContact CD1-CG1 4.21Å; I81-I94 HydrophobicContact CG1-CD1 3.85Å; I81-L133 HydrophobicContact CD1-CD1 4.48Å
82	K	39	Very low	46.2	Very low	71 Å²	71	92.1 Å²	92.1	31%	0.309	48%	0.476	S	S	.	.	H	α-helix	trans	-82.4	-25.8	176.3	-68.8	160.5	-158.9	169.3	0	113.2	L78 E79 F80 K630	L78-K82 WeakPolarHBondContact O-CD 3.38Å; L78-K82 WeakPolarHBondContact O-CE 3.46Å; L78-K82 WeakPolarHBondContact O-CG 3.08Å; L78-K82 PolarHBondContact O-N 3.46Å; L78-K82 VanDerWaalsContact O-N 3.16Å; E79-K82 HydrophobicContact CG-CD 4.47Å; E79-K82 PolarHBondContact O-N 3.18Å; E79-K82 IonicContact OE1-NZ 3.81Å; E79-K82 PolarHBondContact OE1-NZ 3.35Å; F80-K82 VanDerWaalsContact C-N 3.34Å; K82-K630 HydrophobicContact CD-CD 3.9Å; K82-K630 HydrophobicContact CD-CG 4.4Å
83	H	41.1	Very low	46	Very low	112 Å²	112	89.7 Å²	89.7	52%	0.519	47%	0.465	S	S	.	.	H	α-helix	trans	-103.2	-11.1	-177.6	-70	-68.9	0	0	0	115	E79 T85 E654	E79-H83 PolarHBondContact O-CD2 2.69Å; E79-H83 VanDerWaalsContact O-CD2 3.26Å; E79-H83 PolarHBondContact O-N 3.41Å; H83-T85 PolarHBondContact O-N 3.49Å; H83-T85 VanDerWaalsContact O-N 3.1Å; H83-E654 IonicContact CE1-OE1 3.16Å; H83-E654 PolarHBondContact CE1-OE1 2.86Å; H83-E654 VanDerWaalsContact CE1-OE1 3.23Å; H83-E654 IonicContact NE2-OE1 3.89Å
84	T	41.1	Very low	46.4	Very low	61 Å²	61	84.7 Å²	84.7	37%	0.374	44%	0.442	S	S	.	.			trans	-66.2	105.4	165.1	42.4	0	0	0	0	110.3	F80 I81 D86	F80-T84 HydrophobicContact CD1-CG2 4.39Å; F80-T84 HydrophobicContact CE1-CG2 4.39Å; F80-T84 WeakPolarHBondContact O-CG2 3.04Å; F80-T84 PolarHBondContact O-N 2.05Å; F80-T84 PolarHBondContact O-OG1 2.77Å; I81-T84 PolarHBondContact O-OG1 2.74Å; T84-D86 VanDerWaalsContact C-N 3.27Å; T84-D86 PolarHBondContact O-N 3.42Å
85	T	40	Very low	46.3	Very low	139 Å²	139	84.6 Å²	84.6	85%	0.853	44%	0.441	S	S	*	.			trans	-79.4	-5.8	177.1	49.1	0	0	0	0	114.2	H83	H83-T85 PolarHBondContact O-N 3.49Å; H83-T85 VanDerWaalsContact O-N 3.1Å
86	D	36.2	Very low	46.4	Very low	118 Å²	118	81.5 Å²	81.5	63%	0.631	43%	0.425	S	S	*	.	S	Bend	trans	-95.7	141.4	174.4	-88.4	-59.9	0	0	0	111.7	T84 N88	T84-D86 VanDerWaalsContact C-N 3.27Å; T84-D86 PolarHBondContact O-N 3.42Å; D86-N88 PolarHBondContact O-N 3.26Å
87	N	47.2	Very low	46.3	Very low	169 Å²	169	82.8 Å²	82.8	90%	0.904	43%	0.431	S	S	*	.	S	Bend	trans	-69.7	6.2	174.7	-70.7	-30.6	0	0	0	114
88	N	40.2	Very low	46.7	Very low	127 Å²	127	79.1 Å²	79.1	68%	0.679	41%	0.406	S	S	*	.			trans	-99.6	99.9	173.2	-73.9	-61.3	0	0	0	109.8	D86 D90	D86-N88 PolarHBondContact O-N 3.26Å; N88-D90 PolarHBondContact O-N 2.98Å; N88-D90 VanDerWaalsContact O-N 3.15Å
89	I	46.6	Very low	46.9	Very low	35 Å²	35	77 Å²	77	18%	0.179	39%	0.394	C	S	.	.			trans	-59.2	115.8	150	-68	158.4	0	0	0	105.7	I94	I89-I94 HydrophobicContact CD1-CD1 3.66Å; I89-I94 HydrophobicContact CG1-CD1 4.05Å; I89-I94 HydrophobicContact CG2-CD1 4.12Å; I89-I94 HydrophobicContact CG2-CG1 3.84Å
90	D	43.1	Very low	47.5	Very low	113 Å²	113	72 Å²	72	60%	0.604	37%	0.37	S	S	*	.			trans	-52.7	152.8	-174.2	-175.2	24.8	0	0	0	112.2	N88 S92 G93	N88-D90 PolarHBondContact O-N 2.98Å; N88-D90 VanDerWaalsContact O-N 3.15Å; D90-S92 PolarHBondContact O-N 3.2Å; D90-S92 PolarHBondContact O-OG 2.87Å; D90-G93 PolarHBondContact O-N 2.83Å
91	K	43.2	Very low	47.5	Very low	201 Å²	201	68 Å²	68	87%	0.874	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-12.7	-162.5	-72.9	-176.7	175.4	179.5	0	117.1	G93	K91-G93 VanDerWaalsContact C-N 3.32Å
92	S	42.3	Very low	47.3	Very low	62 Å²	62	70.9 Å²	70.9	43%	0.434	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.5	168.9	34.3	0	0	0	0	114.5	K76 D90	K76-S92 PolarHBondContact NZ-OG 3.34Å; D90-S92 PolarHBondContact O-N 3.2Å; D90-S92 PolarHBondContact O-OG 2.87Å
93	G	50	Low	47.7	Very low	6 Å²	6	69 Å²	69	6%	0.062	36%	0.362	C	S	.	.			trans	70.9	-166.3	-171.3	0	0	0	0	0	112.5	K76 D90 K91	K76-G93 VanDerWaalsContact CE-O 3.31Å; K76-G93 WeakPolarHBondContact CE-O 3.29Å; K76-G93 PolarHBondContact NZ-O 3.43Å; D90-G93 PolarHBondContact O-N 2.83Å; K91-G93 VanDerWaalsContact C-N 3.32Å
94	I	59.1	Low	48	Very low	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.5	161.5	-60.3	152.2	0	0	0	106.8	L74 D75 K76 I81 I89 I127 L133	L74-I94 HydrophobicContact CB-CG2 4.12Å; L74-I94 HydrophobicContact CD2-CG2 3.88Å; L74-I94 HydrophobicContact CG-CG2 4.46Å; D75-I94 WeakPolarHBondContact OD1-CA 3.48Å; D75-I94 WeakPolarHBondContact OD1-CG2 3.32Å; K76-I94 HydrophobicContact CB-CG1 4.46Å; K76-I94 HydrophobicContact CD-CG1 4.07Å; I81-I94 HydrophobicContact CD1-CD1 3.58Å; I81-I94 HydrophobicContact CD1-CG1 4.21Å; I81-I94 HydrophobicContact CG1-CD1 3.85Å; I89-I94 HydrophobicContact CD1-CD1 3.66Å; I89-I94 HydrophobicContact CG1-CD1 4.05Å; I89-I94 HydrophobicContact CG2-CD1 4.12Å; I89-I94 HydrophobicContact CG2-CG1 3.84Å; I94-I127 HydrophobicContact CB-CB 4.27Å; I94-I127 PolarHBondContact N-O 3.27Å; I94-I127 WeakPolarHBondContact O-CB 3.5Å; I94-I127 WeakPolarHBondContact O-CG1 3.35Å; I94-I127 PolarHBondContact O-N 2.66Å; I94-L133 HydrophobicContact CD1-CD1 3.93Å
95	N	56.9	Low	47.9	Very low	26 Å²	26	72.1 Å²	72.1	14%	0.139	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.4	173.7	-53.9	-61.8	0	0	0	109	D75 V124 N125 Q126	D75-N95 HydrophobicContact CB-CB 4.22Å; D75-N95 PolarHBondContact N-O 3.17Å; D75-N95 PolarHBondContact OD1-N 3.28Å; D75-N95 WeakPolarHBondContact OD2-CB 3.37Å; D75-N95 PolarHBondContact OD2-N 3Å; D75-N95 PolarHBondContact OD2-ND2 3.16Å; N95-V124 WeakPolarHBondContact CA-O 3.46Å; N95-N125 WeakPolarHBondContact OD1-CA 3.37Å; N95-N125 PolarHBondContact OD1-OD1 3.31Å; N95-Q126 PolarHBondContact OD1-N 2.82Å
96	A	59.4	Low	48	Very low	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.2	177.8	0	0	0	0	0	110.9	I71 Q73 L74 V98 V124 I127	I71-A96 HydrophobicContact CG2-CB 4.32Å; Q73-A96 CarbonylContact O-C 3.54Å; Q73-A96 WeakPolarHBondContact O-CA 3.25Å; L74-A96 HydrophobicContact CD2-CB 3.7Å; A96-V98 HydrophobicContact CB-CG2 3.81Å; A96-V124 HydrophobicContact CB-CB 4.29Å; A96-V124 PolarHBondContact N-O 3.12Å; A96-V124 WeakPolarHBondContact O-CA 3.11Å; A96-V124 WeakPolarHBondContact O-CB 3.39Å; A96-V124 PolarHBondContact O-N 3.36Å; A96-I127 HydrophobicContact CB-CD1 3.68Å
97	F	54.5	Low	48	Very low	66 Å²	66	69 Å²	69	29%	0.289	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.8	162.3	-63.3	-95.1	0	0	0	107.6	I72 Q73 L121 H123	I72-F97 HydrophobicContact CB-CB 4.41Å; I72-F97 PolarHBondContact N-O 2.88Å; Q73-F97 HydrophobicContact CB-CB 4.19Å; Q73-F97 HydrophobicContact CB-CD2 3.99Å; Q73-F97 HydrophobicContact CB-CG 4.43Å; Q73-F97 HydrophobicContact CG-CD2 4.14Å; Q73-F97 PolarHBondContact N-O 2.03Å; Q73-F97 PolarHBondContact O-N 2.91Å; F97-L121 HydrophobicContact CB-CD2 3.94Å; F97-L121 HydrophobicContact CD1-CD2 3.88Å; F97-L121 HydrophobicContact CG-CD2 4.38Å; F97-H123 AromaticContact CD1-CD2 3.61Å; F97-H123 AromaticContact CE1-CD2 3.34Å; F97-H123 WeakPolarHBondContact CE1-CD2 3.02Å; F97-H123 AromaticContact CE1-NE2 3.92Å; F97-H123 AromaticContact CE2-CD2 3.81Å; F97-H123 AromaticContact CE2-NE2 3.76Å; F97-H123 AromaticContact CG-CD2 3.98Å; F97-H123 AromaticContact CZ-CD2 3.44Å; F97-H123 VanDerWaalsContact CZ-CD2 3.44Å; F97-H123 WeakPolarHBondContact CZ-CD2 3.38Å; F97-H123 AromaticContact CZ-NE2 3.51Å
98	V	56.3	Low	47.2	Very low	4 Å²	4	70 Å²	70	2%	0.024	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121.8	-173.6	-163.5	0	0	0	0	110.1	A69 E70 I71 A96 V122 V124 M136	A69-V98 HydrophobicContact CB-CG1 3.47Å; A69-V98 VanDerWaalsContact CB-CG1 3.47Å; E70-V98 CarbonylContact O-C 3.59Å; E70-V98 WeakPolarHBondContact O-CA 3.46Å; E70-V98 WeakPolarHBondContact O-CG1 3.01Å; I71-V98 HydrophobicContact CG1-CG1 4.38Å; I71-V98 HydrophobicContact CG1-CG2 4.25Å; A96-V98 HydrophobicContact CB-CG2 3.81Å; V98-V122 PolarHBondContact N-O 3.45Å; V98-V122 WeakPolarHBondContact O-CB 3.36Å; V98-V122 PolarHBondContact O-N 3Å; V98-V124 HydrophobicContact CB-CG2 4.2Å; V98-V124 HydrophobicContact CG2-CB 4.09Å; V98-V124 HydrophobicContact CG2-CG2 3.56Å; V98-M136 HydrophobicContact CG2-CE 4.32Å
99	K	52	Low	46.7	Very low	32 Å²	32	72.1 Å²	72.1	14%	0.139	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	128	-179.9	-176.6	170.9	148.2	-142.1	0	110	A69 E70 I72 T101 N119	A69-K99 CarbonylContact C-O 3.58Å; A69-K99 VanDerWaalsContact CA-O 3.24Å; A69-K99 WeakPolarHBondContact CA-O 3.39Å; E70-K99 HydrophobicContact CB-CB 4.33Å; E70-K99 PolarHBondContact N-O 2.91Å; E70-K99 PolarHBondContact O-N 2.76Å; E70-K99 WeakPolarHBondContact OE2-CD 3.08Å; E70-K99 WeakPolarHBondContact OE2-CE 3.04Å; E70-K99 IonicContact OE2-NZ 3.33Å; E70-K99 PolarHBondContact OE2-NZ 3Å; I72-K99 HydrophobicContact CD1-CB 3.59Å; I72-K99 HydrophobicContact CD1-CG 4.43Å; I72-K99 HydrophobicContact CG1-CB 3.63Å; K99-T101 HydrophobicContact CG-CG2 4.3Å; K99-T101 PolarHBondContact O-N 3.29Å; K99-T101 VanDerWaalsContact O-N 3.13Å; K99-N119 WeakPolarHBondContact CE-OD1 3.23Å
100	I	53.7	Low	45.7	Very low	2 Å²	2	73.6 Å²	73.6	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	105.3	165.8	-70	176.4	0	0	0	108.5	F67 I103 L116 N119 E120 V122	F67-I100 HydrophobicContact CB-CG1 4.4Å; F67-I100 HydrophobicContact CB-CG2 3.94Å; F67-I100 HydrophobicContact CD1-CD1 4.23Å; F67-I100 HydrophobicContact CD2-CD1 4.25Å; F67-I100 HydrophobicContact CD2-CG1 3.89Å; F67-I100 HydrophobicContact CE1-CD1 4.44Å; F67-I100 HydrophobicContact CE2-CD1 4.45Å; F67-I100 HydrophobicContact CE2-CG1 4.31Å; F67-I100 HydrophobicContact CG-CD1 4.14Å; F67-I100 HydrophobicContact CG-CG1 4.08Å; I100-I103 HydrophobicContact CG2-CG1 4Å; I100-L116 HydrophobicContact CD1-CD2 3.35Å; I100-N119 PolarHBondContact O-N 3.34Å; I100-E120 PolarHBondContact N-O 2.94Å; I100-V122 HydrophobicContact CD1-CG2 3.65Å; I100-V122 HydrophobicContact CG1-CG2 3.8Å
101	T	44.8	Very low	45	Very low	52 Å²	52	78 Å²	78	32%	0.319	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-27.9	-178.4	48.6	0	0	0	0	112.8	E68 E70 K99	E68-T101 VanDerWaalsContact C-OG1 3.25Å; E68-T101 WeakPolarHBondContact CB-OG1 3.37Å; E68-T101 PolarHBondContact O-N 3.46Å; E68-T101 PolarHBondContact O-OG1 2.83Å; E68-T101 VanDerWaalsContact O-OG1 3.13Å; E70-T101 HydrophobicContact CB-CG2 3.45Å; E70-T101 VanDerWaalsContact CB-CG2 3.45Å; E70-T101 HydrophobicContact CG-CG2 4.41Å; E70-T101 WeakPolarHBondContact OE2-CG2 3.28Å; K99-T101 HydrophobicContact CG-CG2 4.3Å; K99-T101 PolarHBondContact O-N 3.29Å; K99-T101 VanDerWaalsContact O-N 3.13Å
102	K	47.1	Very low	44.1	Very low	93 Å²	93	77.4 Å²	77.4	40%	0.404	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	137.5	-178.5	-170.6	-172.9	-174.7	177.7	0	109.5	F67 E68 L104	F67-K102 CarbonylContact C-O 3.54Å; F67-K102 WeakPolarHBondContact CA-O 3.39Å; F67-K102 WeakPolarHBondContact CB-O 3.43Å; E68-K102 HydrophobicContact CB-CB 4Å; E68-K102 HydrophobicContact CG-CB 4.25Å; E68-K102 HydrophobicContact CG-CD 4.04Å; E68-K102 PolarHBondContact N-O 3.31Å; E68-K102 VanDerWaalsContact OE1-CD 3.3Å; E68-K102 WeakPolarHBondContact OE1-CD 3.49Å; E68-K102 IonicContact OE1-NZ 3.56Å; E68-K102 PolarHBondContact OE1-NZ 2.92Å; E68-K102 WeakPolarHBondContact OE2-CD 3.27Å; E68-K102 IonicContact OE2-NZ 2.62Å; E68-K102 PolarHBondContact OE2-NZ 3.37Å; K102-L104 HydrophobicContact CD-CD2 3.88Å; K102-L104 HydrophobicContact CG-CD2 4.45Å
103	I	47.9	Very low	43.4	Very low	32 Å²	32	79.7 Å²	79.7	16%	0.164	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	111.3	169.9	-59.7	173.6	0	0	0	107.4	Y65 H66 I100 Q106 L116	Y65-I103 HydrophobicContact CD1-CG2 4.41Å; H66-I103 CarbonylContact O-C 3.35Å; I100-I103 HydrophobicContact CG2-CG1 4Å; I103-Q106 HydrophobicContact CG2-CG 3.79Å; I103-L116 HydrophobicContact CD1-CB 4.15Å
104	L	45.5	Very low	42.5	Very low	93 Å²	93	86.9 Å²	86.9	49%	0.487	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-24.4	-176.9	-70.6	172.4	0	0	0	113.1	H66 E68 K102	H66-L104 HydrophobicContact CB-CB 3.8Å; H66-L104 PolarHBondContact O-N 3.49Å; E68-L104 HydrophobicContact CG-CD1 3.87Å; E68-L104 HydrophobicContact CG-CD2 4.07Å; E68-L104 HydrophobicContact CG-CG 4.02Å; K102-L104 HydrophobicContact CD-CD2 3.88Å; K102-L104 HydrophobicContact CG-CD2 4.45Å
105	K	39.9	Very low	41.2	Very low	144 Å²	144	92.6 Å²	92.6	63%	0.626	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.4	130.6	177.6	-138.6	167.7	-173.7	171.8	0	111.6	H66	H66-K105 HydrophobicContact CB-CB 4.09Å; H66-K105 PolarHBondContact N-O 2.93Å; H66-K105 PolarHBondContact O-N 2.89Å
106	Q	42	Very low	39.9	Very low	132 Å²	132	93.5 Å²	93.5	62%	0.617	48%	0.481	S	S	*	.			trans	-111.3	137.1	168.2	-70.8	-175	-23	0	0	109.9	Y65 I103	Y65-Q106 HydrophobicContact CD1-CG 4.29Å; Y65-Q106 HydrophobicContact CE1-CG 4.2Å; I103-Q106 HydrophobicContact CG2-CG 3.79Å
107	P	35.5	Very low	38.7	Very low	60 Å²	60	100 Å²	100	39%	0.39	51%	0.512	S	S	.	.			trans	-79.8	142.5	175	32.1	-33.8	0	0	0	111.9
108	Q	31.7	Very low	37.8	Very low	191 Å²	191	102.3 Å²	102.3	89%	0.893	53%	0.525	S	S	*	.			trans	-97.7	112.7	174.6	-65.9	-162.4	6.9	0	0	111.9
109	I	29.1	Very low	37.2	Very low	171 Å²	171	106.9 Å²	106.9	88%	0.877	55%	0.549	S	S	*	.			trans	-170.9	145.7	149.9	-98.4	149.4	0	0	0	107.1
110	G	26.6	Very low	36.7	Very low	66 Å²	66	108.7 Å²	108.7	68%	0.68	56%	0.558	S	S	*	*	S	Bend	trans	-77.4	171.8	-161.5	0	0	0	0	0	117.6
111	K	26.8	Very low	36.1	Very low	205 Å²	205	113 Å²	113	89%	0.891	58%	0.581	S	S	*	*	S	Bend	trans	79.5	12.2	172.9	-61.9	-169.5	176	-175.9	0	119.3
112	F	26.1	Very low	36.1	Very low	188 Å²	188	112.9 Å²	112.9	83%	0.825	58%	0.58	S	S	*	*			trans	-137.5	98.1	161.2	-84.4	-84.2	0	0	0	110.9
113	S	26.4	Very low	36.3	Very low	111 Å²	111	112.1 Å²	112.1	78%	0.776	58%	0.578	S	S	*	*			trans	-145.3	61.1	-174	62.2	0	0	0	0	112.2
114	N	31.6	Very low	36.4	Very low	157 Å²	157	112.8 Å²	112.8	84%	0.84	58%	0.583	S	S	*	*	S	Bend	trans	-150.7	8.3	176.4	-107.3	-4.6	0	0	0	114
115	L	31.4	Very low	36.7	Very low	120 Å²	120	113.2 Å²	113.2	63%	0.628	59%	0.586	S	S	*	*	S	Bend	trans	-136.9	77.7	-171.9	-80.6	163.6	0	0	0	110.8
116	L	30.1	Very low	37.2	Very low	44 Å²	44	111.4 Å²	111.4	23%	0.23	58%	0.58	C	S	.	*			trans	170.9	98.5	148	-100.8	152.6	0	0	0	109.1	Y65 I100 I103 E120	Y65-L116 HydrophobicContact CD1-CD1 3.67Å; Y65-L116 HydrophobicContact CD2-CD1 3.34Å; Y65-L116 HydrophobicContact CE1-CB 4.39Å; Y65-L116 HydrophobicContact CE1-CD1 3.78Å; Y65-L116 HydrophobicContact CE2-CD1 3.46Å; Y65-L116 VanDerWaalsContact CE2-CD1 3.46Å; Y65-L116 HydrophobicContact CG-CD1 3.43Å; Y65-L116 VanDerWaalsContact CG-CD1 3.43Å; I100-L116 HydrophobicContact CD1-CD2 3.35Å; I103-L116 HydrophobicContact CD1-CB 4.15Å; L116-E120 WeakPolarHBondContact CA-OE2 3.06Å; L116-E120 WeakPolarHBondContact CD2-OE2 3.38Å
117	Q	34.6	Very low	38	Very low	138 Å²	138	105.5 Å²	105.5	65%	0.645	55%	0.552	S	S	*	*			trans	-98.3	144.5	177.5	-63	-169.6	7.1	0	0	111.1	N119 E120	Q117-N119 PolarHBondContact O-N 3.39Å; Q117-E120 HydrophobicContact CB-CG 4.46Å; Q117-E120 PolarHBondContact N-OE2 2.04Å; Q117-E120 WeakPolarHBondContact O-CB 3.22Å; Q117-E120 PolarHBondContact O-N 3.01Å
118	M	35.4	Very low	38.5	Very low	114 Å²	114	108.9 Å²	108.9	56%	0.562	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	137.6	168	-70.6	178.4	174.8	0	0	109.3
119	N	42.1	Very low	39.4	Very low	99 Å²	99	101.5 Å²	101.5	53%	0.529	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	16.9	-165.6	-43	-85.4	0	0	0	116.2	K99 I100 Q117	K99-N119 WeakPolarHBondContact CE-OD1 3.23Å; I100-N119 PolarHBondContact O-N 3.34Å; Q117-N119 PolarHBondContact O-N 3.39Å
120	E	41.5	Very low	40.4	Very low	70 Å²	70	101.4 Å²	101.4	33%	0.327	52%	0.519	S	S	.	.			trans	-65.8	137.5	164.3	-92.4	178.7	174.8	0	0	112.1	I100 L116 Q117	I100-E120 PolarHBondContact N-O 2.94Å; L116-E120 WeakPolarHBondContact CA-OE2 3.06Å; L116-E120 WeakPolarHBondContact CD2-OE2 3.38Å; Q117-E120 HydrophobicContact CB-CG 4.46Å; Q117-E120 PolarHBondContact N-OE2 2.04Å; Q117-E120 WeakPolarHBondContact O-CB 3.22Å; Q117-E120 PolarHBondContact O-N 3.01Å
121	L	41.5	Very low	41.7	Very low	92 Å²	92	103.6 Å²	103.6	48%	0.482	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	101.7	176.7	-99.9	156.1	0	0	0	109.7	I72 F97 E667	I72-L121 HydrophobicContact CD1-CD2 3.55Å; I72-L121 HydrophobicContact CD1-CG 4.09Å; F97-L121 HydrophobicContact CB-CD2 3.94Å; F97-L121 HydrophobicContact CD1-CD2 3.88Å; F97-L121 HydrophobicContact CG-CD2 4.38Å; L121-E667 WeakPolarHBondContact CD1-OE2 3.46Å; L121-E667 WeakPolarHBondContact CD2-OE2 3.43Å
122	V	46.1	Very low	42.7	Very low	50 Å²	50	97.5 Å²	97.5	30%	0.303	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	114.4	172.4	-176.8	0	0	0	0	108.8	V98 I100 V124	V98-V122 PolarHBondContact N-O 3.45Å; V98-V122 WeakPolarHBondContact O-CB 3.36Å; V98-V122 PolarHBondContact O-N 3Å; I100-V122 HydrophobicContact CD1-CG2 3.65Å; I100-V122 HydrophobicContact CG1-CG2 3.8Å; V122-V124 HydrophobicContact CG1-CG2 3.97Å; V122-V124 PolarHBondContact O-N 2.04Å
123	H	49.9	Very low	43.8	Very low	78 Å²	78	89.3 Å²	89.3	36%	0.361	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	92.7	172.4	-166	-113.3	0	0	0	109.8	F97 N125	F97-H123 AromaticContact CD1-CD2 3.61Å; F97-H123 AromaticContact CE1-CD2 3.34Å; F97-H123 WeakPolarHBondContact CE1-CD2 3.02Å; F97-H123 AromaticContact CE1-NE2 3.92Å; F97-H123 AromaticContact CE2-CD2 3.81Å; F97-H123 AromaticContact CE2-NE2 3.76Å; F97-H123 AromaticContact CG-CD2 3.98Å; F97-H123 AromaticContact CZ-CD2 3.44Å; F97-H123 VanDerWaalsContact CZ-CD2 3.44Å; F97-H123 WeakPolarHBondContact CZ-CD2 3.38Å; F97-H123 AromaticContact CZ-NE2 3.51Å; H123-N125 VanDerWaalsContact C-N 3.35Å; H123-N125 PolarHBondContact CE1-OD1 2.92Å; H123-N125 PolarHBondContact ND1-OD1 3.46Å; H123-N125 PolarHBondContact O-N 3.43Å
124	V	51.8	Low	44.9	Very low	45 Å²	45	88.2 Å²	88.2	27%	0.273	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	89.2	175.1	179.2	0	0	0	0	108.3	N95 A96 V98 V122 I127	N95-V124 WeakPolarHBondContact CA-O 3.46Å; A96-V124 HydrophobicContact CB-CB 4.29Å; A96-V124 PolarHBondContact N-O 3.12Å; A96-V124 WeakPolarHBondContact O-CA 3.11Å; A96-V124 WeakPolarHBondContact O-CB 3.39Å; A96-V124 PolarHBondContact O-N 3.36Å; V98-V124 HydrophobicContact CB-CG2 4.2Å; V98-V124 HydrophobicContact CG2-CB 4.09Å; V98-V124 HydrophobicContact CG2-CG2 3.56Å; V122-V124 HydrophobicContact CG1-CG2 3.97Å; V122-V124 PolarHBondContact O-N 2.04Å; V124-I127 HydrophobicContact CG1-CG1 4.24Å
125	N	50.8	Low	45.6	Very low	102 Å²	102	86.8 Å²	86.8	55%	0.545	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.6	175.3	-80.2	-52.8	0	0	0	111.7	N95 H123	N95-N125 WeakPolarHBondContact OD1-CA 3.37Å; N95-N125 PolarHBondContact OD1-OD1 3.31Å; H123-N125 VanDerWaalsContact C-N 3.35Å; H123-N125 PolarHBondContact CE1-OD1 2.92Å; H123-N125 PolarHBondContact ND1-OD1 3.46Å; H123-N125 PolarHBondContact O-N 3.43Å
126	Q	50.8	Low	46.1	Very low	107 Å²	107	85.3 Å²	85.3	50%	0.5	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	60.4	167.7	-48.8	175.6	3.2	0	0	116.1	N95 K128	N95-Q126 PolarHBondContact OD1-N 2.82Å; Q126-K128 VanDerWaalsContact CB-CE 3.48Å; Q126-K128 HydrophobicContact CB-CG 4.43Å; Q126-K128 WeakPolarHBondContact O-CG 3.48Å; Q126-K128 PolarHBondContact O-N 3.5Å
127	I	58	Low	46.4	Very low	7 Å²	7	88.2 Å²	88.2	4%	0.036	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	123.1	152.4	-55.6	178.5	0	0	0	106.9	I94 A96 V124 D132 L133 M136	I94-I127 HydrophobicContact CB-CB 4.27Å; I94-I127 PolarHBondContact N-O 3.27Å; I94-I127 WeakPolarHBondContact O-CB 3.5Å; I94-I127 WeakPolarHBondContact O-CG1 3.35Å; I94-I127 PolarHBondContact O-N 2.66Å; A96-I127 HydrophobicContact CB-CD1 3.68Å; V124-I127 HydrophobicContact CG1-CG1 4.24Å; I127-D132 HydrophobicContact CG2-CB 3.63Å; I127-L133 HydrophobicContact CG2-CB 4.03Å; I127-L133 HydrophobicContact CG2-CD1 4.32Å; I127-M136 HydrophobicContact CD1-SD 4.39Å
128	K	46.7	Very low	46.4	Very low	132 Å²	132	85.9 Å²	85.9	57%	0.574	43%	0.431	S	S	*	.			trans	-110.6	-26.7	-164.8	-81.7	163.6	-166	179.6	0	114.1	Q126 D132	Q126-K128 VanDerWaalsContact CB-CE 3.48Å; Q126-K128 HydrophobicContact CB-CG 4.43Å; Q126-K128 WeakPolarHBondContact O-CG 3.48Å; Q126-K128 PolarHBondContact O-N 3.5Å; K128-D132 PolarHBondContact N-OD2 2.68Å
129	S	51	Low	46.1	Very low	35 Å²	35	91 Å²	91	25%	0.245	44%	0.444	C	S	.	.	S	Bend	trans	-123.5	162.2	179.5	67.1	0	0	0	0	111.3	D131 D132	S129-D131 PolarHBondContact O-N 3.24Å; S129-D131 PolarHBondContact OG-N 3.48Å; S129-D132 WeakPolarHBondContact CB-OD2 3.47Å; S129-D132 PolarHBondContact N-OD2 2.67Å; S129-D132 PolarHBondContact OG-N 3.12Å; S129-D132 PolarHBondContact OG-OD2 2.86Å
130	R	49.6	Very low	45.5	Very low	169 Å²	169	92.9 Å²	92.9	64%	0.638	45%	0.454	S	S	*	.	H	α-helix	trans	-63.7	-28.6	167.2	-177.7	176.1	176.4	141.3	-1.9	111.5	L133 Q134	R130-L133 PolarHBondContact O-N 3.42Å; R130-Q134 WeakPolarHBondContact O-CB 3.16Å; R130-Q134 WeakPolarHBondContact O-CG 3.04Å; R130-Q134 PolarHBondContact O-N 2.81Å
131	D	52.7	Low	45.1	Very low	112 Å²	112	95.4 Å²	95.4	60%	0.599	48%	0.475	S	S	*	.	H	α-helix	trans	-72.2	-42.5	-179.8	-55.5	-49.9	0	0	0	111.6	S129 L133 Q134 D135	S129-D131 PolarHBondContact O-N 3.24Å; S129-D131 PolarHBondContact OG-N 3.48Å; D131-L133 PolarHBondContact O-N 2.99Å; D131-Q134 PolarHBondContact O-N 2.79Å; D131-D135 PolarHBondContact O-N 3.5Å
132	D	49.4	Very low	44.7	Very low	77 Å²	77	97 Å²	97	41%	0.412	49%	0.491	S	S	.	.	H	α-helix	trans	-53.2	-41.7	171.2	-62.5	-55	0	0	0	111.2	I127 K128 S129 M136	I127-D132 HydrophobicContact CG2-CB 3.63Å; K128-D132 PolarHBondContact N-OD2 2.68Å; S129-D132 WeakPolarHBondContact CB-OD2 3.47Å; S129-D132 PolarHBondContact N-OD2 2.67Å; S129-D132 PolarHBondContact OG-N 3.12Å; S129-D132 PolarHBondContact OG-OD2 2.86Å; D132-M136 WeakPolarHBondContact O-CG 3.49Å; D132-M136 PolarHBondContact O-N 2.03Å
133	L	49	Very low	43.9	Very low	17 Å²	17	98.6 Å²	98.6	9%	0.089	52%	0.516	C	S	.	.	H	α-helix	trans	-76.4	-28.3	-179.1	-158	143.9	0	0	0	112.2	L74 I81 I94 I127 R130 D131 M137	L74-L133 HydrophobicContact CD1-CD1 4.42Å; I81-L133 HydrophobicContact CD1-CD1 4.48Å; I94-L133 HydrophobicContact CD1-CD1 3.93Å; I127-L133 HydrophobicContact CG2-CB 4.03Å; I127-L133 HydrophobicContact CG2-CD1 4.32Å; R130-L133 PolarHBondContact O-N 3.42Å; D131-L133 PolarHBondContact O-N 2.99Å; L133-M137 HydrophobicContact CD2-CE 4.13Å; L133-M137 HydrophobicContact CD2-SD 3.77Å; L133-M137 WeakPolarHBondContact O-CB 3.5Å; L133-M137 VanDerWaalsContact O-CG 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.24Å
134	Q	49.4	Very low	42.8	Very low	88 Å²	88	101.9 Å²	101.9	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-79.5	-37.3	174.8	-78.3	-178	-143.8	0	0	112.9	R130 D131 M136 M137 V138	R130-Q134 WeakPolarHBondContact O-CB 3.16Å; R130-Q134 WeakPolarHBondContact O-CG 3.04Å; R130-Q134 PolarHBondContact O-N 2.81Å; D131-Q134 PolarHBondContact O-N 2.79Å; Q134-M136 VanDerWaalsContact C-N 3.26Å; Q134-M136 PolarHBondContact O-N 2.93Å; Q134-M137 PolarHBondContact O-N 3.23Å; Q134-V138 WeakPolarHBondContact O-CG2 3.17Å; Q134-V138 PolarHBondContact O-N 3.03Å; Q134-V138 VanDerWaalsContact O-N 3.16Å
135	D	46.9	Very low	41.6	Very low	127 Å²	127	110.9 Å²	110.9	68%	0.679	57%	0.566	S	S	*	*	H	α-helix	trans	-68	-26.6	176	-112.2	-2	0	0	0	112	D131 M137	D131-D135 PolarHBondContact O-N 3.5Å; D135-M137 VanDerWaalsContact C-N 3.3Å
136	M	40.8	Very low	40.4	Very low	88 Å²	88	112.8 Å²	112.8	43%	0.433	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.8	-8.2	168.5	-69.9	-173.5	71.1	0	0	114.4	I71 V98 I127 D132 Q134	I71-M136 HydrophobicContact CD1-CB 4.43Å; I71-M136 HydrophobicContact CD1-CE 4.16Å; I71-M136 HydrophobicContact CG1-CE 4.19Å; V98-M136 HydrophobicContact CG2-CE 4.32Å; I127-M136 HydrophobicContact CD1-SD 4.39Å; D132-M136 WeakPolarHBondContact O-CG 3.49Å; D132-M136 PolarHBondContact O-N 2.03Å; Q134-M136 VanDerWaalsContact C-N 3.26Å; Q134-M136 PolarHBondContact O-N 2.93Å
137	M	37.5	Very low	39.2	Very low	106 Å²	106	112 Å²	112	52%	0.522	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120.2	-6.1	-172.2	-77.6	-170.5	164.6	0	0	115.5	I71 L133 Q134 D135	I71-M137 HydrophobicContact CD1-CE 4.27Å; L133-M137 HydrophobicContact CD2-CE 4.13Å; L133-M137 HydrophobicContact CD2-SD 3.77Å; L133-M137 WeakPolarHBondContact O-CB 3.5Å; L133-M137 VanDerWaalsContact O-CG 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.24Å; Q134-M137 PolarHBondContact O-N 3.23Å; D135-M137 VanDerWaalsContact C-N 3.3Å
138	V	33.6	Very low	37.7	Very low	89 Å²	89	118.4 Å²	118.4	54%	0.539	62%	0.617	S	S	.	*			trans	-131.2	107.2	-168.4	-175.9	0	0	0	0	115.4	Q134	Q134-V138 WeakPolarHBondContact O-CG2 3.17Å; Q134-V138 PolarHBondContact O-N 3.03Å; Q134-V138 VanDerWaalsContact O-N 3.16Å
139	R	29.6	Very low	36.9	Very low	220 Å²	220	119.2 Å²	119.2	83%	0.83	63%	0.627	S	S	*	*				-159.3	142.6	118.6	-122.6	155.9	-73.6	-145.2	-1.8	113.2
140	N	28	Very low	35.9	Very low	139 Å²	139	124.7 Å²	124.7	74%	0.743	65%	0.654	S	S	*	*			trans	-156.1	161.8	-169.6	-169.3	-1.7	0	0	0	109.1
141	V	33.6	Very low	35.2	Very low	124 Å²	124	123.4 Å²	123.4	75%	0.752	66%	0.659	S	S	*	*			trans	55.5	170.8	169	-89.6	0	0	0	0	118.1
142	P	33.8	Very low	34.1	Very low	126 Å²	126	124.2 Å²	124.2	82%	0.818	66%	0.664	S	S	*	*			cis	-128	178.1	-16.8	28.3	-7.8	0	0	0	114
143	G	28.6	Very low	33.3	Very low	82 Å²	82	127.4 Å²	127.4	85%	0.845	68%	0.681	S	S	*	*			trans	166.1	84.2	162	0	0	0	0	0	116.9
144	N	27.3	Very low	32.4	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	72%	0.718	S	S	*	*			trans	-105.9	122	173.8	170.2	14.5	0	0	0	111
145	R	26.4	Very low	31.6	Very low	235 Å²	235	136 Å²	136	89%	0.887	73%	0.726	S	S	*	*			trans	-166.2	168.2	149.1	-107.6	154.7	-151.7	-150.7	3.9	113.7
146	N	25.1	Very low	30.7	Very low	141 Å²	141	138 Å²	138	75%	0.754	73%	0.731	S	S	*	*			trans	-85.9	-179.2	-175.7	-48.8	-54.3	0	0	0	112.6
147	S	25.5	Very low	30.2	Very low	91 Å²	91	139.1 Å²	139.1	64%	0.636	75%	0.746	S	S	*	*			trans	64.3	115.5	156.1	52.4	0	0	0	0	118.2
148	D	27.4	Very low	29.9	Very low	142 Å²	142	141.6 Å²	141.6	76%	0.759	76%	0.761	S	S	*	*				59.5	117.8	123.3	-39.9	-28.5	0	0	0	119.5
149	D	29.3	Very low	29.9	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	77%	0.768	S	S	*	*			trans	67.8	125.1	150.7	-49.3	-22	0	0	0	122.2
150	D	31.4	Very low	29.9	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	77%	0.766	S	S	*	*			trans	59.8	134.4	147.9	-55.9	-17.8	0	0	0	126
151	D	32.9	Very low	30.1	Very low	141 Å²	141	140 Å²	140	75%	0.754	76%	0.762	S	S	*	*			trans	75.4	122.1	140.5	-80.9	8.6	0	0	0	128.1
152	N	30.7	Very low	30.2	Very low	129 Å²	129	140 Å²	140	69%	0.69	75%	0.754	S	S	*	*			trans	74.3	105.6	135.7	-63.4	-50.1	0	0	0	127.6
153	D	32.4	Very low	30	Very low	144 Å²	144	143.2 Å²	143.2	77%	0.77	75%	0.75	S	S	*	*				47.5	146.7	129.7	-65.3	-1.3	0	0	0	129.9
154	N	30.3	Very low	30.2	Very low	164 Å²	164	142 Å²	142	88%	0.877	74%	0.738	S	S	*	*			trans	119.7	-179.1	156.3	-67.9	-90	0	0	0	119.7
155	E	31.7	Very low	30.4	Very low	122 Å²	122	141.5 Å²	141.5	57%	0.57	73%	0.73	S	S	*	*				-152.9	-167.3	-98.9	-132.7	-74.5	135.8	0	0	113.3
156	Q	29.6	Very low	30.5	Very low	169 Å²	169	133.3 Å²	133.3	79%	0.79	71%	0.707	S	S	*	*			trans	77.9	154.1	167.2	-78.5	-177.6	92.8	0	0	120.9
157	C	29	Very low	30.6	Very low	111 Å²	111	133.2 Å²	133.2	75%	0.75	70%	0.697	S	S	*	*			cis	-156.6	-151.5	-11.5	-160.7	0	0	0	0	113.3
158	L	31.9	Very low	30.8	Very low	158 Å²	158	133.7 Å²	133.7	83%	0.827	69%	0.689	S	S	*	*			trans	-148.1	-164.2	-170.7	-78.6	174.7	0	0	0	112
159	P	33.4	Very low	30.7	Very low	106 Å²	106	136.7 Å²	136.7	69%	0.688	69%	0.69	S	S	*	*			cis	-150.6	-176.6	4.5	49	-29.2	0	0	0	120.7
160	K	29.5	Very low	30.6	Very low	184 Å²	184	137.1 Å²	137.1	80%	0.8	69%	0.69	S	S	*	*			trans	71	166.6	153	-74.1	-179.4	157.9	-166.4	0	119.8
161	L	32	Very low	30.3	Very low	124 Å²	124	135.2 Å²	135.2	65%	0.649	68%	0.684	S	S	*	*			cis	-162.8	-178.4	-4.6	-137.2	66.3	0	0	0	109.5
162	E	35.4	Very low	30	Very low	124 Å²	124	139.2 Å²	139.2	58%	0.579	69%	0.69	S	S	*	*			cis	-166.4	163.1	-9.1	-148.2	178.7	-142.6	0	0	113.4
163	R	30.8	Very low	29.8	Very low	195 Å²	195	136.1 Å²	136.1	74%	0.736	68%	0.683	S	S	*	*			trans	54.8	149.5	152.3	-87.1	167.9	-178.6	127.9	1.3	123.7	E165	R163-E165 IonicContact NE-OE2 2.94Å
164	G	31.7	Very low	29.6	Very low	57 Å²	57	136.7 Å²	136.7	59%	0.588	69%	0.685	S	S	*	*			cis	173.1	164.7	-6.2	0	0	0	0	0	117
165	E	32.3	Very low	29.4	Very low	135 Å²	135	134.5 Å²	134.5	63%	0.631	67%	0.674	S	S	*	*			trans	62.1	158.9	147.9	-69.9	68.3	-78.1	0	0	121	R163	R163-E165 IonicContact NE-OE2 2.94Å
166	T	28.2	Very low	29.1	Very low	64 Å²	64	134.1 Å²	134.1	39%	0.393	68%	0.675	S	S	.	*			cis	-169.6	165.9	-16.4	29.2	0	0	0	0	113.2
167	Y	27.9	Very low	28.9	Very low	138 Å²	138	131 Å²	131	54%	0.541	67%	0.668	S	S	.	*			trans	68.7	147	160.4	-55.3	-67.5	0	0	0	123.2	V27 V28 I29	V27-Y167 VanDerWaalsContact CG1-O 3.25Å; V27-Y167 WeakPolarHBondContact CG1-O 3.48Å; V28-Y167 CarbonylContact O-C 3.19Å; V28-Y167 VanDerWaalsContact O-C 3.29Å; I29-Y167 VanDerWaalsContact CD1-CA 3.48Å
168	E	28.5	Very low	28.8	Very low	102 Å²	102	132 Å²	132	48%	0.477	67%	0.666	S	S	.	*			cis	180	179.3	-28	-148.8	164.6	-90.7	0	0	113.9	I29	I29-E168 HydrophobicContact CD1-CB 4.43Å; I29-E168 HydrophobicContact CD1-CG 4.43Å
169	W	25.2	Very low	28.6	Very low	204 Å²	204	129.3 Å²	129.3	77%	0.773	65%	0.651	S	S	*	*			trans	83.3	155.5	160.5	-45.3	-45.8	0	0	0	119.7
170	I	27	Very low	28.4	Very low	159 Å²	159	131 Å²	131	82%	0.815	65%	0.654	S	S	*	*			cis	-151.2	-157.4	-3.1	-133.6	169.6	0	0	0	114.7
171	T	26.8	Very low	28.4	Very low	110 Å²	110	125.4 Å²	125.4	68%	0.675	63%	0.63	S	S	*	*			trans	-115.1	146.4	-161.6	55.3	0	0	0	0	120
172	Y	25.3	Very low	28.1	Very low	224 Å²	224	123.1 Å²	123.1	88%	0.878	62%	0.619	S	S	*	*				163.2	142.9	124.8	-114.4	-111.8	0	0	0	110.3
173	A	27.7	Very low	27.7	Very low	65 Å²	65	123.1 Å²	123.1	54%	0.537	62%	0.623	S	S	.	*			cis	-166.4	158.1	-21.6	0	0	0	0	0	110.2
174	L	27.4	Very low	27.6	Very low	156 Å²	156	122.3 Å²	122.3	82%	0.817	63%	0.628	S	S	*	*			trans	34.2	140.4	139.2	-52.5	172	0	0	0	120.1
175	D	25.3	Very low	27.2	Very low	118 Å²	118	125.7 Å²	125.7	63%	0.631	63%	0.628	S	S	*	*			cis	-159.3	165.2	22.2	-148.4	16.3	0	0	0	116.9
176	N	25.3	Very low	27	Very low	113 Å²	113	127.8 Å²	127.8	60%	0.604	64%	0.635	S	S	*	*			trans	19	103.8	152.6	-75.4	-48.4	0	0	0	119.5
177	T	26	Very low	26.7	Very low	104 Å²	104	132.1 Å²	132.1	64%	0.638	65%	0.651	S	S	*	*				89.8	146.1	61.4	65.8	0	0	0	0	116.1
178	N	27.9	Very low	26.4	Very low	133 Å²	133	130 Å²	130	71%	0.711	65%	0.649	S	S	*	*			trans	75.3	106.1	150.6	-65.7	-27.1	0	0	0	120.5
179	I	27.7	Very low	26.1	Very low	101 Å²	101	126.7 Å²	126.7	52%	0.518	63%	0.634	S	S	.	*			trans	72.6	50.6	151.3	-40.2	157.4	0	0	0	113.3	K208	I179-K208 PolarHBondContact O-NZ 3.49Å; I179-K208 VanDerWaalsContact O-NZ 3.17Å
180	L	27.8	Very low	25.9	Very low	142 Å²	142	121.7 Å²	121.7	74%	0.743	62%	0.622	S	S	*	*				-56.4	119.2	128	-78.2	158	0	0	0	107.8
181	H	30.3	Very low	26.2	Very low	65 Å²	65	115.1 Å²	115.1	30%	0.301	59%	0.588	S	S	.	*				72.8	119.3	88.8	-89.3	-110.8	0	0	0	113.2	N183 I205 Q206 L207 K208	H181-N183 PolarHBondContact O-N 2.98Å; H181-I205 CarbonylContact C-O 3.46Å; H181-I205 VanDerWaalsContact CA-O 3.29Å; H181-I205 WeakPolarHBondContact CA-O 3.46Å; H181-I205 PolarHBondContact N-O 3.31Å; H181-I205 VanDerWaalsContact O-O 3.13Å; H181-Q206 VanDerWaalsContact CA-O 3.28Å; H181-Q206 WeakPolarHBondContact CA-O 3.36Å; H181-Q206 PolarHBondContact N-O 2.78Å; H181-L207 PolarHBondContact CD2-O 2.95Å; H181-K208 PolarHBondContact CE1-O 3.15Å; H181-K208 PolarHBondContact NE2-N 3.32Å; H181-K208 PolarHBondContact NE2-O 3.16Å
182	N	25.3	Very low	26.1	Very low	77 Å²	77	113.3 Å²	113.3	41%	0.412	58%	0.577	S	S	.	*			trans	-65.1	125.9	170.2	-114.5	-15.5	0	0	0	104.5	E184 L204 I205 Q206	N182-E184 PolarHBondContact O-N 2.87Å; N182-L204 WeakPolarHBondContact OD1-CA 3.29Å; N182-I205 VanDerWaalsContact CA-C 3.42Å; N182-I205 PolarHBondContact N-O 3.25Å; N182-I205 WeakPolarHBondContact OD1-CA 3.36Å; N182-I205 PolarHBondContact OD1-N 3.01Å; N182-I205 VanDerWaalsContact OD1-N 3.13Å; N182-Q206 PolarHBondContact ND2-N 2.68Å; N182-Q206 PolarHBondContact OD1-N 3.36Å
183	N	27.9	Very low	26.2	Very low	124 Å²	124	104.9 Å²	104.9	66%	0.663	56%	0.559	S	S	*	*			trans	-73.6	70.9	-178	-72.4	-35.2	0	0	0	111.4	H181 Q185	H181-N183 PolarHBondContact O-N 2.98Å; N183-Q185 PolarHBondContact O-N 2.97Å; N183-Q185 VanDerWaalsContact O-N 3.1Å
184	E	28.6	Very low	26.8	Very low	178 Å²	178	105.4 Å²	105.4	83%	0.832	57%	0.57	S	S	*	*			trans	-68.8	72.4	136	-73.7	-168.2	165.7	0	0	108.8	N182	N182-E184 PolarHBondContact O-N 2.87Å
185	Q	23.6	Very low	26.7	Very low	128 Å²	128	100.5 Å²	100.5	60%	0.598	54%	0.544	S	S	*	.			trans	-155.8	125.6	159.4	-108.7	133.6	97.1	0	0	104.6	N183	N183-Q185 PolarHBondContact O-N 2.97Å; N183-Q185 VanDerWaalsContact O-N 3.1Å
186	K	26.9	Very low	26.6	Very low	178 Å²	178	102.8 Å²	102.8	77%	0.774	55%	0.549	S	S	*	.				55.4	151.8	55.3	-57.8	-178.3	175.8	176	0	109.7
187	Q	21.8	Very low	26.6	Very low	155 Å²	155	102.1 Å²	102.1	72%	0.724	55%	0.551	S	S	*	*			trans	74.5	152.9	-165.8	-48.7	-162.8	-13.2	0	0	112.4
188	L	21.2	Very low	26.5	Very low	95 Å²	95	104.4 Å²	104.4	50%	0.497	56%	0.559	S	S	.	*			cis	-156.9	128.9	-11.5	-125.5	52.1	0	0	0	104.4	M317	L188-M317 HydrophobicContact CD1-CG 4.22Å; L188-M317 HydrophobicContact CD1-SD 3.39Å; L188-M317 WeakPolarHBondContact CD1-SD 3.03Å; L188-M317 HydrophobicContact CD2-CB 4.45Å; L188-M317 HydrophobicContact CD2-CG 3.85Å; L188-M317 HydrophobicContact CD2-SD 3.99Å; L188-M317 HydrophobicContact CG-CG 3.94Å; L188-M317 HydrophobicContact CG-SD 3.39Å; L188-M317 WeakPolarHBondContact CG-SD 3.3Å
189	I	22.8	Very low	26.3	Very low	32 Å²	32	104.7 Å²	104.7	16%	0.164	56%	0.559	C	S	.	*				62.6	94.6	92.3	-61.3	112.8	0	0	0	116.5	N272 M317	I189-N272 WeakPolarHBondContact CA-O 3.44Å; I189-N272 WeakPolarHBondContact CB-O 3.31Å; I189-N272 HydrophobicContact CG1-CB 4.37Å; I189-N272 WeakPolarHBondContact CG1-O 3.42Å; I189-N272 WeakPolarHBondContact CG2-O 3.09Å; I189-M317 HydrophobicContact CB-CE 4.06Å; I189-M317 HydrophobicContact CB-SD 3.5Å; I189-M317 WeakPolarHBondContact CB-SD 3.04Å; I189-M317 HydrophobicContact CD1-CE 3.72Å; I189-M317 HydrophobicContact CD1-SD 3.21Å; I189-M317 WeakPolarHBondContact CD1-SD 3.29Å; I189-M317 HydrophobicContact CG1-CE 3.67Å; I189-M317 HydrophobicContact CG1-SD 3.44Å; I189-M317 WeakPolarHBondContact CG1-SD 3.41Å; I189-M317 HydrophobicContact CG2-CB 3.81Å; I189-M317 HydrophobicContact CG2-CE 3.62Å; I189-M317 HydrophobicContact CG2-CG 4.25Å; I189-M317 HydrophobicContact CG2-SD 3.5Å; I189-M317 VanDerWaalsContact CG2-SD 3.5Å
190	L	22	Very low	26.2	Very low	99 Å²	99	104.2 Å²	104.2	52%	0.518	57%	0.565	S	S	.	*			trans	159.3	139.4	135.7	-78.8	146.6	0	0	0	115.3	L274	L190-L274 HydrophobicContact CB-CD2 4.5Å; L190-L274 HydrophobicContact CD2-CD2 3.74Å; L190-L274 HydrophobicContact CD2-CG 4.17Å; L190-L274 HydrophobicContact CG-CD2 4.31Å; L190-L274 HydrophobicContact CG-CG 4.3Å; L190-L274 VanDerWaalsContact N-CD1 3.25Å
191	M	32.6	Very low	26.1	Very low	21 Å²	21	106.2 Å²	106.2	10%	0.103	57%	0.57	C	S	.	*			trans	-171.6	157.7	-171.1	59.1	88.2	-178.4	0	0	109.5	I195 T270 L274 Y276	M191-I195 HydrophobicContact CB-CG2 4.17Å; M191-T270 HydrophobicContact CE-CG2 4.37Å; M191-L274 HydrophobicContact CB-CD1 4.2Å; M191-L274 HydrophobicContact CE-CB 3.54Å; M191-L274 HydrophobicContact CE-CD1 3.84Å; M191-L274 HydrophobicContact CE-CD2 3.77Å; M191-L274 HydrophobicContact CE-CG 3.95Å; M191-L274 HydrophobicContact CG-CD1 3.3Å; M191-L274 HydrophobicContact CG-CD2 3.68Å; M191-L274 HydrophobicContact CG-CG 4Å; M191-L274 WeakPolarHBondContact O-CD2 3.35Å; M191-L274 HydrophobicContact SD-CD1 4.4Å; M191-L274 HydrophobicContact SD-CD2 4.04Å; M191-Y276 HydrophobicContact CB-CE1 4.3Å; M191-Y276 VanDerWaalsContact CE-CA 3.5Å; M191-Y276 HydrophobicContact CE-CD1 3.65Å; M191-Y276 HydrophobicContact CE-CD2 3.28Å; M191-Y276 HydrophobicContact CE-CE1 3.88Å; M191-Y276 HydrophobicContact CE-CE2 3.52Å; M191-Y276 HydrophobicContact CE-CG 3.27Å; M191-Y276 HydrophobicContact CG-CD1 4.31Å; M191-Y276 HydrophobicContact CG-CE1 3.75Å; M191-Y276 HydrophobicContact CG-CE2 4.3Å; M191-Y276 HydrophobicContact SD-CD1 3.15Å; M191-Y276 WeakPolarHBondContact SD-CD1 3.41Å; M191-Y276 HydrophobicContact SD-CD2 3.96Å; M191-Y276 HydrophobicContact SD-CE1 3.19Å; M191-Y276 WeakPolarHBondContact SD-CE1 3.27Å; M191-Y276 HydrophobicContact SD-CE2 3.98Å; M191-Y276 HydrophobicContact SD-CG 3.5Å; M191-Y276 VanDerWaalsContact SD-CZ 3.58Å
192	P	25.1	Very low	25.9	Very low	71 Å²	71	111.2 Å²	111.2	46%	0.461	59%	0.593	S	S	.	*				-163.7	151.1	103.2	40.6	-20.2	0	0	0	118.9	I195	P192-I195 VanDerWaalsContact C-CB 3.4Å; P192-I195 WeakPolarHBondContact O-CB 3.3Å; P192-I195 WeakPolarHBondContact O-CG2 3.32Å
193	G	27.1	Very low	25.9	Very low	47 Å²	47	112.3 Å²	112.3	49%	0.485	61%	0.607	S	S	.	*	S	Bend	trans	54.6	92.3	161.5	0	0	0	0	0	119.1	I195	G193-I195 VanDerWaalsContact C-CB 3.49Å
194	G	40.3	Very low	25.7	Very low	76 Å²	76	112 Å²	112	78%	0.784	61%	0.605	S	S	*	*	S	Bend	cis	-46.5	-58.8	6.9	0	0	0	0	0	115.9
195	I	24.4	Very low	25.5	Very low	53 Å²	53	107.7 Å²	107.7	27%	0.272	59%	0.587	S	S	.	*			cis	-145.5	140.6	-12.7	-132.8	179.5	0	0	0	106.4	M191 P192 G193	M191-I195 HydrophobicContact CB-CG2 4.17Å; P192-I195 VanDerWaalsContact C-CB 3.4Å; P192-I195 WeakPolarHBondContact O-CB 3.3Å; P192-I195 WeakPolarHBondContact O-CG2 3.32Å; G193-I195 VanDerWaalsContact C-CB 3.49Å
196	F	23.9	Very low	25.6	Very low	167 Å²	167	107.4 Å²	107.4	73%	0.732	59%	0.585	S	S	*	*			trans	57.5	168.7	152.2	-60.2	178.6	0	0	0	118.9
197	P	26.3	Very low	25.4	Very low	99 Å²	99	103.8 Å²	103.8	64%	0.643	57%	0.574	S	S	*	*			cis	-134.8	162.3	-47.8	37.9	-24.2	0	0	0	114.5
198	L	22.6	Very low	25.5	Very low	152 Å²	152	102.7 Å²	102.7	80%	0.796	57%	0.567	S	S	*	*			trans	20.9	143.8	131.6	-58.8	167.8	0	0	0	121.7
199	L	24	Very low	25.6	Very low	138 Å²	138	102.9 Å²	102.9	72%	0.723	58%	0.576	S	S	*	*			trans	64.9	107.3	152.3	-59.3	155.6	0	0	0	115.9
200	S	25.8	Very low	25.7	Very low	91 Å²	91	106.1 Å²	106.1	64%	0.636	60%	0.602	S	S	*	*				60.3	112.4	67.1	84.4	0	0	0	0	115.5
201	H	25.6	Very low	25.8	Very low	185 Å²	185	107.4 Å²	107.4	86%	0.856	61%	0.609	S	S	*	*				-162.1	147.1	124.5	-128	-90.5	0	0	0	113.3
202	Q	26.8	Very low	25.4	Very low	169 Å²	169	112.1 Å²	112.1	79%	0.79	64%	0.635	S	S	*	*			trans	-83.3	160.3	157.4	-65.5	166.2	-72.5	0	0	109.3
203	S	24.1	Very low	25.5	Very low	100 Å²	100	114.7 Å²	114.7	70%	0.699	64%	0.644	S	S	*	*			trans	101	130.1	149.1	-43.6	0	0	0	0	119.5
204	L	23.9	Very low	25.4	Very low	118 Å²	118	118.6 Å²	118.6	62%	0.618	65%	0.654	S	S	*	*			trans	75.9	156.8	136	-66.5	167.8	0	0	0	119	N182	N182-L204 WeakPolarHBondContact OD1-CA 3.29Å
205	I	24.2	Very low	24.8	Very low	87 Å²	87	122.3 Å²	122.3	45%	0.446	66%	0.656	S	S	.	*			cis	-134.6	129.6	-12.1	-98.4	137.3	0	0	0	110.7	H181 N182	H181-I205 CarbonylContact C-O 3.46Å; H181-I205 VanDerWaalsContact CA-O 3.29Å; H181-I205 WeakPolarHBondContact CA-O 3.46Å; H181-I205 PolarHBondContact N-O 3.31Å; H181-I205 VanDerWaalsContact O-O 3.13Å; N182-I205 VanDerWaalsContact CA-C 3.42Å; N182-I205 PolarHBondContact N-O 3.25Å; N182-I205 WeakPolarHBondContact OD1-CA 3.36Å; N182-I205 PolarHBondContact OD1-N 3.01Å; N182-I205 VanDerWaalsContact OD1-N 3.13Å
206	Q	25.3	Very low	25.2	Very low	122 Å²	122	127.5 Å²	127.5	57%	0.57	68%	0.684	S	S	*	*			trans	-7.7	174.1	167	-47.8	179.5	-37.6	0	0	122.8	H181 N182	H181-Q206 VanDerWaalsContact CA-O 3.28Å; H181-Q206 WeakPolarHBondContact CA-O 3.36Å; H181-Q206 PolarHBondContact N-O 2.78Å; N182-Q206 PolarHBondContact ND2-N 2.68Å; N182-Q206 PolarHBondContact OD1-N 3.36Å
207	L	23	Very low	25.6	Very low	103 Å²	103	128.4 Å²	128.4	54%	0.539	69%	0.687	S	S	.	*			trans	81.9	98.5	153.4	-58.1	142.8	0	0	0	118.6	H181	H181-L207 PolarHBondContact CD2-O 2.95Å
208	K	23.9	Very low	26.6	Very low	131 Å²	131	126.8 Å²	126.8	57%	0.57	67%	0.673	S	S	*	*				162.5	164.8	113	-83.6	148.4	-161.7	159.2	0	109.7	I179 H181	I179-K208 PolarHBondContact O-NZ 3.49Å; I179-K208 VanDerWaalsContact O-NZ 3.17Å; H181-K208 PolarHBondContact CE1-O 3.15Å; H181-K208 PolarHBondContact NE2-N 3.32Å; H181-K208 PolarHBondContact NE2-O 3.16Å
209	S	24	Very low	28	Very low	100 Å²	100	122.9 Å²	122.9	70%	0.699	65%	0.653	S	S	*	*			cis	-172.6	131.9	-33.7	175.4	0	0	0	0	106.5
210	S	24	Very low	29.6	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	62%	0.624	S	S	*	*			trans	62.6	132.3	166	-139.8	0	0	0	0	116
211	N	25	Very low	31.3	Very low	127 Å²	127	113.9 Å²	113.9	68%	0.679	60%	0.603	S	S	*	*			cis	-159	153.9	26.4	-146.6	-11.7	0	0	0	111.5
212	N	25.3	Very low	32.9	Very low	119 Å²	119	108.8 Å²	108.8	64%	0.636	59%	0.588	S	S	*	*			trans	59.6	112.2	158.1	-65.3	-32.1	0	0	0	121.3
213	N	25.7	Very low	34	Very low	125 Å²	125	110.2 Å²	110.2	67%	0.668	59%	0.592	S	S	*	*				82.7	96.6	129	-58.3	-17.6	0	0	0	121.2
214	N	25.7	Very low	35.4	Very low	129 Å²	129	111.8 Å²	111.8	69%	0.69	58%	0.582	S	S	*	*				76.1	129.2	126.8	-53.6	-24	0	0	0	120.5
215	N	27.1	Very low	36.9	Very low	154 Å²	154	115 Å²	115	82%	0.824	59%	0.594	S	S	*	*			trans	70	47.5	149.8	-57	-15.1	0	0	0	119.5
216	L	33.8	Very low	38.6	Very low	163 Å²	163	112.8 Å²	112.8	85%	0.853	59%	0.586	S	S	*	*			trans	-123.4	76.5	144.6	-77	95.7	0	0	0	110.6
217	K	32	Very low	40.3	Very low	186 Å²	186	114.8 Å²	114.8	81%	0.809	59%	0.589	S	S	*	*			trans	-67.5	150.6	143.2	-67.9	176	-178.9	174.9	0	106.2
218	N	46.9	Very low	41.8	Very low	65 Å²	65	115.2 Å²	115.2	35%	0.348	59%	0.586	S	S	.	*			trans	86.4	118.4	-178.5	-46.1	-25	0	0	0	114.4	D241 Q242 L243	N218-D241 PolarHBondContact ND2-O 3.41Å; N218-D241 PolarHBondContact OD1-O 3.29Å; N218-Q242 WeakPolarHBondContact OD1-CA 3.39Å; N218-L243 HydrophobicContact CB-CB 3.8Å; N218-L243 HydrophobicContact CB-CD1 3.8Å; N218-L243 HydrophobicContact CB-CG 3.73Å
219	D	53	Low	43.5	Very low	69 Å²	69	110.1 Å²	110.1	37%	0.369	57%	0.571	S	S	.	*			trans	-143.1	129.4	150.7	161.8	-9.4	0	0	0	104.1	C221 S222 E234	D219-C221 PolarHBondContact OD1-N 2.58Å; D219-S222 PolarHBondContact OD1-N 2.86Å; D219-S222 PolarHBondContact OD1-OG 3.02Å; D219-S222 WeakPolarHBondContact OD2-CB 3.36Å; D219-S222 PolarHBondContact OD2-OG 3.1Å; D219-E234 VanDerWaalsContact CA-OE2 3.26Å; D219-E234 WeakPolarHBondContact CA-OE2 3.18Å
220	G	55.8	Low	45.5	Very low	10 Å²	10	106.2 Å²	106.2	10%	0.103	54%	0.544	C	S	.	.	S	Bend	trans	-83	-31.2	-175	0	0	0	0	0	114.1	E234 L243 G245	G220-E234 PolarHBondContact N-OE2 3.38Å; G220-L243 VanDerWaalsContact CA-C 3.49Å; G220-L243 VanDerWaalsContact CA-O 3.3Å; G220-L243 WeakPolarHBondContact CA-O 3.43Å; G220-G245 WeakPolarHBondContact O-CA 3.29Å; G220-G245 PolarHBondContact O-N 3.13Å
221	C	62.8	Low	47.5	Very low	30 Å²	30	104.1 Å²	104.1	20%	0.203	53%	0.525	C	S	.	.	S	Bend	trans	-98.9	-19.4	-165.9	-77.9	0	0	0	0	113.7	D219 K223 R224 C232 E233 E234 G245	D219-C221 PolarHBondContact OD1-N 2.58Å; C221-K223 PolarHBondContact O-N 3.08Å; C221-R224 PolarHBondContact O-N 3.1Å; C221-R224 VanDerWaalsContact O-N 3.15Å; C221-C232 WeakPolarHBondContact CA-SG 3.36Å; C221-C232 HydrophobicContact CB-CB 3.8Å; C221-C232 WeakPolarHBondContact CB-SG 3.42Å; C221-C232 WeakPolarHBondContact SG-CB 3.45Å; C221-C232 CovalentContact SG-SG 2.04Å; C221-C232 PolarHBondContact SG-SG 2.97Å; C221-E233 PolarHBondContact SG-O 3.1Å; C221-E234 HydrophobicContact CB-CG 3.91Å; C221-G245 VanDerWaalsContact SG-CA 3.6Å
222	S	57.8	Low	49.7	Very low	79 Å²	79	99.7 Å²	99.7	55%	0.552	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	0.8	174.7	46	0	0	0	0	115.8	D219	D219-S222 PolarHBondContact OD1-N 2.86Å; D219-S222 PolarHBondContact OD1-OG 3.02Å; D219-S222 WeakPolarHBondContact OD2-CB 3.36Å; D219-S222 PolarHBondContact OD2-OG 3.1Å
223	K	51.2	Low	51.3	Low	199 Å²	199	94.7 Å²	94.7	87%	0.865	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.8	8.2	171.5	-65.2	-173.1	179.9	178.5	0	115.5	C221	C221-K223 PolarHBondContact O-N 3.08Å
224	R	53.7	Low	53.2	Low	132 Å²	132	93.3 Å²	93.3	50%	0.498	47%	0.466	S	S	.	.			trans	-117.4	98.8	-175	-159.6	170.5	-165.6	170.7	5.4	112.4	C221 C226 G245	C221-R224 PolarHBondContact O-N 3.1Å; C221-R224 VanDerWaalsContact O-N 3.15Å; R224-C226 PolarHBondContact O-N 2.87Å; R224-G245 WeakPolarHBondContact CD-O 3.41Å; R224-G245 PolarHBondContact NH1-O 3.16Å
225	E	55.5	Low	54.5	Low	186 Å²	186	91.5 Å²	91.5	87%	0.869	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-66.6	127.2	170	-67.5	-173.8	162.9	0	0	110.7
226	C	59.3	Low	55.8	Low	41 Å²	41	89.9 Å²	89.9	28%	0.277	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-101.7	140.6	177.2	-66.4	0	0	0	0	111.2	R224 A230 C232 C247	R224-C226 PolarHBondContact O-N 2.87Å; C226-A230 HydrophobicContact CB-CB 3.98Å; C226-A230 WeakPolarHBondContact CB-O 3.44Å; C226-C232 VanDerWaalsContact SG-CB 3.59Å; C226-C247 WeakPolarHBondContact CA-SG 3.36Å; C226-C247 HydrophobicContact CB-CB 3.78Å; C226-C247 WeakPolarHBondContact CB-SG 3.22Å; C226-C247 VanDerWaalsContact SG-CA 3.56Å; C226-C247 WeakPolarHBondContact SG-CB 3.35Å; C226-C247 CovalentContact SG-SG 2.04Å; C226-C247 PolarHBondContact SG-SG 2.03Å
227	R	60.1	Low	56.4	Low	163 Å²	163	83 Å²	83	62%	0.615	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-69.3	165.7	-179.3	-70.2	-177.4	172.7	-176.1	-3.4	111.9	G229 A230 Q290 T291	R227-G229 PolarHBondContact O-N 3.05Å; R227-G229 VanDerWaalsContact O-N 3.1Å; R227-A230 WeakPolarHBondContact O-CB 2.99Å; R227-A230 PolarHBondContact O-N 3.31Å; R227-Q290 HydrophobicContact CB-CB 4.05Å; R227-Q290 WeakPolarHBondContact CD-O 3.05Å; R227-Q290 PolarHBondContact NH1-O 2.82Å; R227-T291 HydrophobicContact CB-CG2 3.86Å; R227-T291 HydrophobicContact CG-CG2 4.3Å
228	F	54.7	Low	56.8	Low	113 Å²	113	80.3 Å²	80.3	50%	0.496	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	114.1	-162.1	-157.5	-102	0	0	0	112.6	L283 A286 C287	F228-L283 HydrophobicContact CD1-CD1 3.78Å; F228-L283 HydrophobicContact CE1-CD1 3.52Å; F228-L283 HydrophobicContact CZ-CD1 4.35Å; F228-A286 HydrophobicContact CD1-CB 4.41Å; F228-C287 WeakPolarHBondContact O-CA 3.28Å; F228-C287 PolarHBondContact O-N 3.1Å
229	G	59.7	Low	56.7	Low	23 Å²	23	82.7 Å²	82.7	24%	0.237	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	0.7	-177.1	0	0	0	0	0	115.9	R227 P250 C287	R227-G229 PolarHBondContact O-N 3.05Å; R227-G229 VanDerWaalsContact O-N 3.1Å; G229-P250 WeakPolarHBondContact O-CD 3.36Å; G229-C287 PolarHBondContact O-SG 3.17Å; G229-C287 VanDerWaalsContact O-SG 3.36Å
230	A	65.7	Low	56.6	Low	18 Å²	18	82 Å²	82	15%	0.149	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-95.4	144.1	173.7	0	0	0	0	0	112.4	C226 R227 C247 V248 C287	C226-A230 HydrophobicContact CB-CB 3.98Å; C226-A230 WeakPolarHBondContact CB-O 3.44Å; R227-A230 WeakPolarHBondContact O-CB 2.99Å; R227-A230 PolarHBondContact O-N 3.31Å; A230-C247 HydrophobicContact CB-CB 4.14Å; A230-V248 CarbonylContact C-O 3.58Å; A230-V248 WeakPolarHBondContact CA-O 3.5Å; A230-C287 VanDerWaalsContact CA-SG 3.55Å; A230-C287 VanDerWaalsContact CB-SG 3.55Å
231	I	67.2	Low	56.5	Low	56 Å²	56	87.5 Å²	87.5	29%	0.287	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	145.4	177	-59.4	168.9	0	0	0	108.5	C247 V248 P250 M260	I231-C247 CarbonylContact O-C 3.59Å; I231-C247 VanDerWaalsContact O-CA 3.24Å; I231-C247 WeakPolarHBondContact O-CA 3.36Å; I231-V248 HydrophobicContact CB-CG2 4.39Å; I231-V248 PolarHBondContact N-O 2.73Å; I231-V248 PolarHBondContact O-N 2.86Å; I231-P250 HydrophobicContact CD1-CB 4.06Å; I231-P250 HydrophobicContact CD1-CG 3.94Å; I231-M260 HydrophobicContact CD1-CE 4.41Å
232	C	70.7	Confident	56	Low	34 Å²	34	90.9 Å²	90.9	23%	0.23	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125.4	171.4	-166.9	0	0	0	0	111.5	C221 C226 V246	C221-C232 WeakPolarHBondContact CA-SG 3.36Å; C221-C232 HydrophobicContact CB-CB 3.8Å; C221-C232 WeakPolarHBondContact CB-SG 3.42Å; C221-C232 WeakPolarHBondContact SG-CB 3.45Å; C221-C232 CovalentContact SG-SG 2.04Å; C221-C232 PolarHBondContact SG-SG 2.97Å; C226-C232 VanDerWaalsContact SG-CB 3.59Å; C232-V246 WeakPolarHBondContact CA-O 3.42Å
233	E	60	Low	56	Low	14 Å²	14	89.2 Å²	89.2	7%	0.065	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.7	168	-67.6	-178	164.2	0	0	110.5	C221 W235 G245 V246 V248 M296 F301	C221-E233 PolarHBondContact SG-O 3.1Å; E233-W235 PolarHBondContact OE2-NE1 3.49Å; E233-G245 CarbonylContact O-C 3.6Å; E233-G245 VanDerWaalsContact O-CA 3.31Å; E233-G245 WeakPolarHBondContact O-CA 2.97Å; E233-V246 PolarHBondContact N-O 3.1Å; E233-V246 PolarHBondContact O-N 2.93Å; E233-V248 HydrophobicContact CG-CG2 3.71Å; E233-M296 WeakPolarHBondContact OE1-CE 3.22Å; E233-M296 WeakPolarHBondContact OE1-CG 2.99Å; E233-F301 HydrophobicContact CG-CE2 3.94Å
234	E	64.7	Low	56.2	Low	95 Å²	95	83.4 Å²	83.4	44%	0.444	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.4	173.3	-61.5	-176.9	-114.9	0	0	110.9	D219 G220 C221 L243	D219-E234 VanDerWaalsContact CA-OE2 3.26Å; D219-E234 WeakPolarHBondContact CA-OE2 3.18Å; G220-E234 PolarHBondContact N-OE2 3.38Å; C221-E234 HydrophobicContact CB-CG 3.91Å; E234-L243 HydrophobicContact CB-CD2 4.25Å; E234-L243 WeakPolarHBondContact OE2-CD1 3.28Å
235	W	52.4	Low	56.5	Low	91 Å²	91	77.3 Å²	77.3	35%	0.345	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.5	179.2	-71	22.4	0	0	0	110.4	E233 S237 L243 I244 V246 N401	E233-W235 PolarHBondContact OE2-NE1 3.49Å; W235-S237 PolarHBondContact O-N 2.81Å; W235-L243 CarbonylContact O-C 3.55Å; W235-L243 VanDerWaalsContact O-CA 3.32Å; W235-L243 WeakPolarHBondContact O-CA 3.5Å; W235-I244 HydrophobicContact CB-CG1 4.36Å; W235-I244 PolarHBondContact N-O 2.77Å; W235-I244 VanDerWaalsContact O-CG1 3.24Å; W235-I244 WeakPolarHBondContact O-CG1 3.49Å; W235-I244 PolarHBondContact O-N 3.48Å; W235-V246 HydrophobicContact CB-CG2 4.05Å; W235-V246 HydrophobicContact CD2-CB 4.02Å; W235-V246 HydrophobicContact CD2-CG1 4.33Å; W235-V246 HydrophobicContact CD2-CG2 3.58Å; W235-V246 HydrophobicContact CE3-CG2 3.84Å; W235-V246 HydrophobicContact CG-CB 4.15Å; W235-V246 HydrophobicContact CG-CG2 3.67Å; W235-V246 HydrophobicContact CH2-CG1 4.29Å; W235-V246 HydrophobicContact CZ2-CB 4.46Å; W235-V246 HydrophobicContact CZ2-CG1 4Å; W235-V246 HydrophobicContact CZ3-CG2 4.48Å; W235-N401 VanDerWaalsContact CZ3-ND2 3.34Å; W235-N401 WeakPolarHBondContact CZ3-ND2 3.5Å
236	L	53.9	Low	56.9	Low	121 Å²	121	69.2 Å²	69.2	63%	0.634	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.6	171	-90.6	88.4	0	0	0	111.5	K238 L243	L236-K238 PolarHBondContact O-N 3.47Å; L236-L243 HydrophobicContact CD1-CD2 3.49Å; L236-L243 VanDerWaalsContact CD1-CD2 3.49Å; L236-L243 HydrophobicContact CG-CD2 3.92Å
237	S	48.3	Very low	57.4	Low	18 Å²	18	67.6 Å²	67.6	13%	0.126	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	112.9	163.2	174.2	0	0	0	0	109.9	W235 D239 S240 D241 Q242	W235-S237 PolarHBondContact O-N 2.81Å; S237-D239 PolarHBondContact O-N 2.88Å; S237-D239 VanDerWaalsContact O-N 3.1Å; S237-D239 PolarHBondContact OG-N 2.86Å; S237-S240 VanDerWaalsContact CB-OG 3.28Å; S237-S240 WeakPolarHBondContact CB-OG 3.41Å; S237-S240 PolarHBondContact OG-N 3.17Å; S237-S240 PolarHBondContact OG-OG 3.42Å; S237-D241 PolarHBondContact O-N 3.41Å; S237-Q242 WeakPolarHBondContact CB-O 3.4Å; S237-Q242 PolarHBondContact N-O 3.26Å
238	K	40.3	Very low	57.7	Low	130 Å²	130	60.5 Å²	60.5	57%	0.565	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-4.7	176.9	-69.8	179.7	176.8	176.7	0	114.2	L236 E399	L236-K238 PolarHBondContact O-N 3.47Å; K238-E399 IonicContact NZ-OE2 2.65Å; K238-E399 PolarHBondContact NZ-OE2 2.71Å
239	D	43.9	Very low	58.6	Low	115 Å²	115	55.1 Å²	55.1	62%	0.615	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-25	-178.1	-81.5	14	0	0	0	115.1	S237 K418	S237-D239 PolarHBondContact O-N 2.88Å; S237-D239 VanDerWaalsContact O-N 3.1Å; S237-D239 PolarHBondContact OG-N 2.86Å; D239-K418 VanDerWaalsContact OD1-CD 3.28Å; D239-K418 WeakPolarHBondContact OD1-CD 3.32Å; D239-K418 WeakPolarHBondContact OD1-CE 3.26Å; D239-K418 IonicContact OD1-NZ 3.86Å; D239-K418 PolarHBondContact OD1-NZ 3.34Å; D239-K418 WeakPolarHBondContact OD2-CD 3.43Å; D239-K418 WeakPolarHBondContact OD2-CE 3.4Å; D239-K418 IonicContact OD2-NZ 3.63Å; D239-K418 PolarHBondContact OD2-NZ 2.77Å
240	S	51.5	Low	59	Low	54 Å²	54	54.5 Å²	54.5	38%	0.378	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-0.6	-174.6	54.5	0	0	0	0	114.2	S237 Q242	S237-S240 VanDerWaalsContact CB-OG 3.28Å; S237-S240 WeakPolarHBondContact CB-OG 3.41Å; S237-S240 PolarHBondContact OG-N 3.17Å; S237-S240 PolarHBondContact OG-OG 3.42Å; S240-Q242 PolarHBondContact O-N 3.48Å; S240-Q242 WeakPolarHBondContact OG-CB 3.49Å; S240-Q242 PolarHBondContact OG-OE1 2.95Å
241	D	54	Low	59.4	Low	125 Å²	125	55.4 Å²	55.4	67%	0.668	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.5	44	-166.7	-80.8	-30.2	0	0	0	111.1	N218 S237	N218-D241 PolarHBondContact ND2-O 3.41Å; N218-D241 PolarHBondContact OD1-O 3.29Å; S237-D241 PolarHBondContact O-N 3.41Å
242	Q	51.8	Low	59.5	Low	101 Å²	101	54.8 Å²	54.8	47%	0.472	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	141.4	177.7	-73.2	167.7	-11.5	0	0	110.8	N218 S237 S240 I244	N218-Q242 WeakPolarHBondContact OD1-CA 3.39Å; S237-Q242 WeakPolarHBondContact CB-O 3.4Å; S237-Q242 PolarHBondContact N-O 3.26Å; S240-Q242 PolarHBondContact O-N 3.48Å; S240-Q242 WeakPolarHBondContact OG-CB 3.49Å; S240-Q242 PolarHBondContact OG-OE1 2.95Å; Q242-I244 PolarHBondContact O-N 3.27Å
243	L	57.4	Low	59.3	Low	45 Å²	45	60.3 Å²	60.3	24%	0.236	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130.5	165.6	-68.6	165.3	0	0	0	107.9	N218 G220 E234 W235 L236	N218-L243 HydrophobicContact CB-CB 3.8Å; N218-L243 HydrophobicContact CB-CD1 3.8Å; N218-L243 HydrophobicContact CB-CG 3.73Å; G220-L243 VanDerWaalsContact CA-C 3.49Å; G220-L243 VanDerWaalsContact CA-O 3.3Å; G220-L243 WeakPolarHBondContact CA-O 3.43Å; E234-L243 HydrophobicContact CB-CD2 4.25Å; E234-L243 WeakPolarHBondContact OE2-CD1 3.28Å; W235-L243 CarbonylContact O-C 3.55Å; W235-L243 VanDerWaalsContact O-CA 3.32Å; W235-L243 WeakPolarHBondContact O-CA 3.5Å; L236-L243 HydrophobicContact CD1-CD2 3.49Å; L236-L243 VanDerWaalsContact CD1-CD2 3.49Å; L236-L243 HydrophobicContact CG-CD2 3.92Å
244	I	55.7	Low	59.5	Low	77 Å²	77	59.9 Å²	59.9	40%	0.395	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.8	175.4	41.9	171.9	0	0	0	106.8	W235 Q242	W235-I244 HydrophobicContact CB-CG1 4.36Å; W235-I244 PolarHBondContact N-O 2.77Å; W235-I244 VanDerWaalsContact O-CG1 3.24Å; W235-I244 WeakPolarHBondContact O-CG1 3.49Å; W235-I244 PolarHBondContact O-N 3.48Å; Q242-I244 PolarHBondContact O-N 3.27Å
245	G	59.9	Low	59.7	Low	3 Å²	3	55.5 Å²	55.5	3%	0.031	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	146.9	177.5	0	0	0	0	0	109.6	G220 C221 R224 E233	G220-G245 WeakPolarHBondContact O-CA 3.29Å; G220-G245 PolarHBondContact O-N 3.13Å; C221-G245 VanDerWaalsContact SG-CA 3.6Å; R224-G245 WeakPolarHBondContact CD-O 3.41Å; R224-G245 PolarHBondContact NH1-O 3.16Å; E233-G245 CarbonylContact O-C 3.6Å; E233-G245 VanDerWaalsContact O-CA 3.31Å; E233-G245 WeakPolarHBondContact O-CA 2.97Å
246	V	63	Low	60.5	Low	16 Å²	16	52.5 Å²	52.5	10%	0.097	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	124.5	-179.1	178.7	0	0	0	0	108.2	C232 E233 W235 V248	C232-V246 WeakPolarHBondContact CA-O 3.42Å; E233-V246 PolarHBondContact N-O 3.1Å; E233-V246 PolarHBondContact O-N 2.93Å; W235-V246 HydrophobicContact CB-CG2 4.05Å; W235-V246 HydrophobicContact CD2-CB 4.02Å; W235-V246 HydrophobicContact CD2-CG1 4.33Å; W235-V246 HydrophobicContact CD2-CG2 3.58Å; W235-V246 HydrophobicContact CE3-CG2 3.84Å; W235-V246 HydrophobicContact CG-CB 4.15Å; W235-V246 HydrophobicContact CG-CG2 3.67Å; W235-V246 HydrophobicContact CH2-CG1 4.29Å; W235-V246 HydrophobicContact CZ2-CB 4.46Å; W235-V246 HydrophobicContact CZ2-CG1 4Å; W235-V246 HydrophobicContact CZ3-CG2 4.48Å; V246-V248 HydrophobicContact CG1-CG1 4.5Å
247	C	69.6	Low	61.1	Low	8 Å²	8	52.1 Å²	52.1	5%	0.054	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	141.4	178	-56.4	0	0	0	0	110.5	C226 A230 I231 L293	C226-C247 WeakPolarHBondContact CA-SG 3.36Å; C226-C247 HydrophobicContact CB-CB 3.78Å; C226-C247 WeakPolarHBondContact CB-SG 3.22Å; C226-C247 VanDerWaalsContact SG-CA 3.56Å; C226-C247 WeakPolarHBondContact SG-CB 3.35Å; C226-C247 CovalentContact SG-SG 2.04Å; C226-C247 PolarHBondContact SG-SG 2.03Å; A230-C247 HydrophobicContact CB-CB 4.14Å; I231-C247 CarbonylContact O-C 3.59Å; I231-C247 VanDerWaalsContact O-CA 3.24Å; I231-C247 WeakPolarHBondContact O-CA 3.36Å; C247-L293 HydrophobicContact CB-CD1 3.58Å; C247-L293 WeakPolarHBondContact O-CB 3.39Å; C247-L293 WeakPolarHBondContact O-CD1 3.39Å; C247-L293 WeakPolarHBondContact O-CD2 3.47Å; C247-L293 WeakPolarHBondContact O-CG 3.4Å
248	V	67.6	Low	61.7	Low	13 Å²	13	52.8 Å²	52.8	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.4	179.5	-69.1	0	0	0	0	111.2	A230 I231 E233 V246	A230-V248 CarbonylContact C-O 3.58Å; A230-V248 WeakPolarHBondContact CA-O 3.5Å; I231-V248 HydrophobicContact CB-CG2 4.39Å; I231-V248 PolarHBondContact N-O 2.73Å; I231-V248 PolarHBondContact O-N 2.86Å; E233-V248 HydrophobicContact CG-CG2 3.71Å; V246-V248 HydrophobicContact CG1-CG1 4.5Å
249	C	72.3	Confident	62.8	Low	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-88.9	126.8	174.8	-61.3	0	0	0	0	111.1	C287 L288 P295 M296	C249-C287 WeakPolarHBondContact CA-SG 3.23Å; C249-C287 HydrophobicContact CB-CB 3.97Å; C249-C287 WeakPolarHBondContact CB-SG 3.28Å; C249-C287 WeakPolarHBondContact SG-CB 3.12Å; C249-C287 CovalentContact SG-SG 2.03Å; C249-C287 PolarHBondContact SG-SG 2.98Å; C249-L288 HydrophobicContact CB-CD2 3.91Å; C249-L288 HydrophobicContact CB-CG 4.23Å; C249-P295 WeakPolarHBondContact O-CA 3.3Å; C249-P295 WeakPolarHBondContact O-CB 3.19Å; C249-M296 PolarHBondContact O-N 3.49Å
250	P	69.4	Low	63.5	Low	11 Å²	11	45.6 Å²	45.6	7%	0.071	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-67.2	147.9	166.4	30.2	-33.9	0	0	0	110	G229 I231 M255 M260 H284	G229-P250 WeakPolarHBondContact O-CD 3.36Å; I231-P250 HydrophobicContact CD1-CB 4.06Å; I231-P250 HydrophobicContact CD1-CG 3.94Å; P250-M255 HydrophobicContact CB-CG 3.93Å; P250-M255 HydrophobicContact CG-CG 3.84Å; P250-M255 HydrophobicContact CG-SD 4.22Å; P250-M260 HydrophobicContact CB-CE 4.06Å; P250-M260 HydrophobicContact CG-CE 4.46Å; P250-H284 PolarHBondContact O-CE1 3.2Å; P250-H284 PolarHBondContact O-ND1 2.89Å
251	T	73.7	Confident	64.4	Low	36 Å²	36	43.2 Å²	43.2	22%	0.221	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-74.2	159.6	171.1	78.5	0	0	0	0	111.1	M253 D254 M255 P295	T251-M253 PolarHBondContact O-N 3.23Å; T251-M253 PolarHBondContact OG1-N 2.97Å; T251-D254 VanDerWaalsContact CB-OD2 3.3Å; T251-D254 WeakPolarHBondContact CB-OD2 3.47Å; T251-D254 VanDerWaalsContact CG2-OD2 3.25Å; T251-D254 WeakPolarHBondContact CG2-OD2 3.17Å; T251-D254 CarbonylContact O-C 3.6Å; T251-D254 PolarHBondContact O-N 2.83Å; T251-D254 VanDerWaalsContact OG1-CG 3.28Å; T251-D254 PolarHBondContact OG1-N 3.23Å; T251-D254 PolarHBondContact OG1-OD2 2.66Å; T251-M255 VanDerWaalsContact O-CG 3.32Å; T251-M255 WeakPolarHBondContact O-CG 3.35Å; T251-M255 PolarHBondContact O-N 3.37Å; T251-P295 HydrophobicContact CG2-CB 3.91Å
252	L	69.8	Low	65.3	Low	43 Å²	43	40.2 Å²	40.2	23%	0.225	21%	0.207	C	C	.	.	H	α-helix	trans	-52.6	-39.6	168	-90.6	159.1	0	0	0	112.8	M255 A256 M263 C280 V281 H284	L252-M255 PolarHBondContact O-N 3.05Å; L252-A256 WeakPolarHBondContact O-CB 3.27Å; L252-A256 PolarHBondContact O-N 3.26Å; L252-M263 HydrophobicContact CD2-SD 4.18Å; L252-C280 HydrophobicContact CD2-CB 3.67Å; L252-V281 HydrophobicContact CD1-CG2 4.14Å; L252-V281 HydrophobicContact CD2-CG2 4.08Å; L252-H284 HydrophobicContact CD1-CB 4.46Å; L252-H284 HydrophobicContact CD2-CB 4.48Å; L252-H284 HydrophobicContact CG-CB 3.96Å
253	M	66.7	Low	66.1	Low	151 Å²	151	40.6 Å²	40.6	74%	0.744	21%	0.211	S	C	*	.	H	α-helix	trans	-65.6	-40.1	175	-82.4	-70.9	-166	0	0	112	T251 A256 K257	T251-M253 PolarHBondContact O-N 3.23Å; T251-M253 PolarHBondContact OG1-N 2.97Å; M253-A256 PolarHBondContact O-N 3.44Å; M253-K257 WeakPolarHBondContact O-CB 3.3Å; M253-K257 PolarHBondContact O-N 2.96Å
254	D	63.3	Low	66.6	Low	5 Å²	5	46 Å²	46	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-73.3	-33	178	-63.6	-64.3	0	0	0	111.9	T251 N258 L298	T251-D254 VanDerWaalsContact CB-OD2 3.3Å; T251-D254 WeakPolarHBondContact CB-OD2 3.47Å; T251-D254 VanDerWaalsContact CG2-OD2 3.25Å; T251-D254 WeakPolarHBondContact CG2-OD2 3.17Å; T251-D254 CarbonylContact O-C 3.6Å; T251-D254 PolarHBondContact O-N 2.83Å; T251-D254 VanDerWaalsContact OG1-CG 3.28Å; T251-D254 PolarHBondContact OG1-N 3.23Å; T251-D254 PolarHBondContact OG1-OD2 2.66Å; D254-N258 WeakPolarHBondContact O-CB 3.38Å; D254-N258 PolarHBondContact O-N 3.22Å; D254-N258 VanDerWaalsContact O-N 3.14Å; D254-N258 PolarHBondContact O-ND2 3.46Å; D254-L298 HydrophobicContact CB-CB 3.99Å; D254-L298 HydrophobicContact CB-CD1 4.15Å; D254-L298 WeakPolarHBondContact OD1-CB 3.37Å; D254-L298 PolarHBondContact OD1-N 3.09Å
255	M	69.4	Low	67	Low	3 Å²	3	45.1 Å²	45.1	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-64.8	-42.1	170.4	-64.9	170.8	68.9	0	0	111	P250 T251 L252 N258 H259 M260 C261 I268 C280 L283 H284	P250-M255 HydrophobicContact CB-CG 3.93Å; P250-M255 HydrophobicContact CG-CG 3.84Å; P250-M255 HydrophobicContact CG-SD 4.22Å; T251-M255 VanDerWaalsContact O-CG 3.32Å; T251-M255 WeakPolarHBondContact O-CG 3.35Å; T251-M255 PolarHBondContact O-N 3.37Å; L252-M255 PolarHBondContact O-N 3.05Å; M255-N258 CarbonylContact O-C 3.6Å; M255-H259 CarbonylContact O-C 3.45Å; M255-H259 WeakPolarHBondContact O-CA 3.29Å; M255-H259 PolarHBondContact O-N 2.8Å; M255-H259 VanDerWaalsContact O-N 3.08Å; M255-M260 HydrophobicContact CB-CB 4.35Å; M255-M260 HydrophobicContact CG-CE 4.24Å; M255-M260 CarbonylContact O-C 3.56Å; M255-M260 PolarHBondContact O-N 2.9Å; M255-C261 HydrophobicContact CB-CB 3.57Å; M255-C261 HydrophobicContact CE-CB 4.37Å; M255-C261 PolarHBondContact O-N 2.82Å; M255-I268 HydrophobicContact CE-CG1 4.26Å; M255-I268 HydrophobicContact CE-CG2 4.39Å; M255-C280 HydrophobicContact CE-CB 4.2Å; M255-L283 HydrophobicContact CE-CB 4.46Å; M255-L283 HydrophobicContact CE-CD2 3.59Å; M255-H284 HydrophobicContact SD-CB 4.15Å
256	A	69.6	Low	67.3	Low	27 Å²	27	46 Å²	46	22%	0.223	25%	0.249	C	C	.	.	H	α-helix	trans	-72.8	-48.1	179.2	0	0	0	0	0	113.1	L252 M253 N258 H259 M263	L252-A256 WeakPolarHBondContact O-CB 3.27Å; L252-A256 PolarHBondContact O-N 3.26Å; M253-A256 PolarHBondContact O-N 3.44Å; A256-N258 VanDerWaalsContact C-N 3.26Å; A256-N258 PolarHBondContact O-N 3Å; A256-H259 PolarHBondContact O-N 2.82Å; A256-M263 HydrophobicContact CB-CG 3.53Å; A256-M263 HydrophobicContact CB-SD 4.11Å
257	K	65.9	Low	67.4	Low	114 Å²	114	46.2 Å²	46.2	50%	0.496	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-31.7	-179.7	177.5	-175.9	169.4	-167.3	0	112.8	M253 N299	M253-K257 WeakPolarHBondContact O-CB 3.3Å; M253-K257 PolarHBondContact O-N 2.96Å; K257-N299 PolarHBondContact NZ-OD1 3.35Å
258	N	61.4	Low	67.3	Low	31 Å²	31	46 Å²	46	17%	0.166	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	25.6	174.4	-48.4	-79.8	0	0	0	110.8	D254 M255 A256 M260	D254-N258 WeakPolarHBondContact O-CB 3.38Å; D254-N258 PolarHBondContact O-N 3.22Å; D254-N258 VanDerWaalsContact O-N 3.14Å; D254-N258 PolarHBondContact O-ND2 3.46Å; M255-N258 CarbonylContact O-C 3.6Å; A256-N258 VanDerWaalsContact C-N 3.26Å; A256-N258 PolarHBondContact O-N 3Å; N258-M260 PolarHBondContact O-N 2.93Å
259	H	62.2	Low	67.1	Low	68 Å²	68	45.6 Å²	45.6	32%	0.315	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	7.8	168.2	-47.6	-95.1	0	0	0	118.2	M255 A256 C261 Q307	M255-H259 CarbonylContact O-C 3.45Å; M255-H259 WeakPolarHBondContact O-CA 3.29Å; M255-H259 PolarHBondContact O-N 2.8Å; M255-H259 VanDerWaalsContact O-N 3.08Å; A256-H259 PolarHBondContact O-N 2.82Å; H259-C261 PolarHBondContact O-N 3.44Å; H259-C261 VanDerWaalsContact O-N 3.14Å; H259-Q307 HydrophobicContact CB-CB 3.66Å; H259-Q307 HydrophobicContact CB-CG 4.16Å; H259-Q307 PolarHBondContact CD2-N 3.45Å; H259-Q307 VanDerWaalsContact CD2-N 3.3Å; H259-Q307 PolarHBondContact ND1-OE1 3.05Å
260	M	59	Low	66.3	Low	26 Å²	26	46.6 Å²	46.6	13%	0.128	25%	0.253	C	S	.	.	S	Bend	trans	-61.6	-10.8	164	-56.3	-173.7	-65.5	0	0	112.2	I231 P250 M255 N258 I268 C269 L298	I231-M260 HydrophobicContact CD1-CE 4.41Å; P250-M260 HydrophobicContact CB-CE 4.06Å; P250-M260 HydrophobicContact CG-CE 4.46Å; M255-M260 HydrophobicContact CB-CB 4.35Å; M255-M260 HydrophobicContact CG-CE 4.24Å; M255-M260 CarbonylContact O-C 3.56Å; M255-M260 PolarHBondContact O-N 2.9Å; N258-M260 PolarHBondContact O-N 2.93Å; M260-I268 CarbonylContact O-C 3.29Å; M260-I268 VanDerWaalsContact O-CA 3.24Å; M260-I268 WeakPolarHBondContact O-CA 3.36Å; M260-I268 WeakPolarHBondContact O-CG2 3.09Å; M260-C269 WeakPolarHBondContact CA-O 3.3Å; M260-C269 PolarHBondContact O-N 3.28Å; M260-L298 HydrophobicContact CE-CD1 4.25Å
261	C	70.3	Confident	65.3	Low	5 Å²	5	51.6 Å²	51.6	3%	0.034	28%	0.283	C	S	.	.	S	Bend	trans	-136.4	134.4	171.2	167	0	0	0	0	110.2	M255 H259 T267 C280	M255-C261 HydrophobicContact CB-CB 3.57Å; M255-C261 HydrophobicContact CE-CB 4.37Å; M255-C261 PolarHBondContact O-N 2.82Å; H259-C261 PolarHBondContact O-N 3.44Å; H259-C261 VanDerWaalsContact O-N 3.14Å; C261-T267 CarbonylContact C-O 3.42Å; C261-T267 WeakPolarHBondContact CA-O 3.31Å; C261-C280 VanDerWaalsContact CA-SG 3.6Å; C261-C280 HydrophobicContact CB-CB 3.71Å; C261-C280 WeakPolarHBondContact CB-SG 3.23Å; C261-C280 WeakPolarHBondContact SG-CB 3Å; C261-C280 CovalentContact SG-SG 2.01Å; C261-C280 PolarHBondContact SG-SG 3.21Å
262	N	74.1	Confident	64.2	Low	61 Å²	61	53.5 Å²	53.5	33%	0.326	29%	0.292	S	S	.	.			trans	-96.8	103.5	159.2	179.8	-11.7	0	0	0	109.2	N264 S265 G266 T267	N262-N264 PolarHBondContact O-N 3.07Å; N262-N264 VanDerWaalsContact O-N 3.09Å; N262-N264 WeakPolarHBondContact OD1-CB 3.13Å; N262-N264 PolarHBondContact OD1-N 2.61Å; N262-S265 WeakPolarHBondContact CB-OG 3.39Å; N262-S265 PolarHBondContact ND2-OG 3Å; N262-S265 PolarHBondContact O-N 3.15Å; N262-S265 PolarHBondContact OD1-N 3.24Å; N262-G266 WeakPolarHBondContact O-CA 3.31Å; N262-G266 PolarHBondContact O-N 2.85Å; N262-T267 PolarHBondContact N-O 2.9Å
263	M	67.3	Low	63.4	Low	110 Å²	110	51.5 Å²	51.5	54%	0.542	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.1	-178.9	-67.3	-68.8	-68	0	0	114.1	L252 A256	L252-M263 HydrophobicContact CD2-SD 4.18Å; A256-M263 HydrophobicContact CB-CG 3.53Å; A256-M263 HydrophobicContact CB-SD 4.11Å
264	N	68	Low	62.6	Low	157 Å²	157	44.6 Å²	44.6	84%	0.84	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-30.5	-177	-61.7	-6	0	0	0	112.9	N262	N262-N264 PolarHBondContact O-N 3.07Å; N262-N264 VanDerWaalsContact O-N 3.09Å; N262-N264 WeakPolarHBondContact OD1-CB 3.13Å; N262-N264 PolarHBondContact OD1-N 2.61Å
265	S	64.5	Low	62.3	Low	60 Å²	60	48.3 Å²	48.3	42%	0.42	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-4.4	176.4	58.3	0	0	0	0	113.1	N262 T267	N262-S265 WeakPolarHBondContact CB-OG 3.39Å; N262-S265 PolarHBondContact ND2-OG 3Å; N262-S265 PolarHBondContact O-N 3.15Å; N262-S265 PolarHBondContact OD1-N 3.24Å; S265-T267 PolarHBondContact O-N 3.33Å; S265-T267 VanDerWaalsContact O-N 3.08Å; S265-T267 PolarHBondContact OG-OG1 3.4Å
266	G	65.5	Low	61.7	Low	21 Å²	21	50.1 Å²	50.1	22%	0.216	27%	0.271	C	S	.	.			trans	68.9	-7	-172.1	0	0	0	0	0	114.6	N262 E279 C280	N262-G266 WeakPolarHBondContact O-CA 3.31Å; N262-G266 PolarHBondContact O-N 2.85Å; G266-E279 CarbonylContact O-C 3.5Å; G266-E279 VanDerWaalsContact O-CA 3.3Å; G266-E279 WeakPolarHBondContact O-CA 3.45Å; G266-C280 PolarHBondContact O-N 3.02Å; G266-C280 PolarHBondContact O-SG 3.38Å
267	T	66.2	Low	60.8	Low	21 Å²	21	55.3 Å²	55.3	13%	0.129	29%	0.294	C	S	.	.			trans	-73.7	147.1	-171.1	58.1	0	0	0	0	113.5	C261 N262 S265 Y276 L277	C261-T267 CarbonylContact C-O 3.42Å; C261-T267 WeakPolarHBondContact CA-O 3.31Å; N262-T267 PolarHBondContact N-O 2.9Å; S265-T267 PolarHBondContact O-N 3.33Å; S265-T267 VanDerWaalsContact O-N 3.08Å; S265-T267 PolarHBondContact OG-OG1 3.4Å; T267-Y276 WeakPolarHBondContact CA-O 3.04Å; T267-L277 HydrophobicContact CG2-CD2 4.42Å; T267-L277 HydrophobicContact CG2-CG 4.44Å
268	I	66.9	Low	60.3	Low	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118	-175.3	-63.9	157	0	0	0	109.6	M255 M260 T270 F275 Y276 N278 C280 L283	M255-I268 HydrophobicContact CE-CG1 4.26Å; M255-I268 HydrophobicContact CE-CG2 4.39Å; M260-I268 CarbonylContact O-C 3.29Å; M260-I268 VanDerWaalsContact O-CA 3.24Å; M260-I268 WeakPolarHBondContact O-CA 3.36Å; M260-I268 WeakPolarHBondContact O-CG2 3.09Å; I268-T270 HydrophobicContact CG2-CG2 3.9Å; I268-T270 PolarHBondContact O-N 3.48Å; I268-F275 VanDerWaalsContact O-CA 3.29Å; I268-F275 WeakPolarHBondContact O-CA 3.4Å; I268-Y276 PolarHBondContact N-O 3.38Å; I268-Y276 PolarHBondContact O-N 2.58Å; I268-Y276 VanDerWaalsContact O-N 3.12Å; I268-N278 HydrophobicContact CD1-CB 4.1Å; I268-N278 WeakPolarHBondContact CD1-O 3.28Å; I268-N278 WeakPolarHBondContact CG1-O 3.18Å; I268-C280 HydrophobicContact CG1-CB 4.41Å; I268-L283 HydrophobicContact CD1-CB 3.38Å; I268-L283 HydrophobicContact CD1-CD1 4.12Å; I268-L283 HydrophobicContact CD1-CD2 4.1Å; I268-L283 HydrophobicContact CD1-CG 4.05Å; I268-L283 HydrophobicContact CG1-CB 4.49Å; I268-L283 HydrophobicContact CG2-CD2 4.09Å
269	C	64.3	Low	60.4	Low	4 Å²	4	56 Å²	56	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	108.1	161.8	180	0	0	0	0	108.8	M260 L274 F275 C310	M260-C269 WeakPolarHBondContact CA-O 3.3Å; M260-C269 PolarHBondContact O-N 3.28Å; C269-L274 CarbonylContact C-O 3.53Å; C269-L274 WeakPolarHBondContact CA-O 3.13Å; C269-F275 HydrophobicContact CB-CD1 4.24Å; C269-F275 HydrophobicContact CB-CE1 3.8Å; C269-F275 HydrophobicContact CB-CZ 4.48Å; C269-C310 HydrophobicContact CB-CB 4.28Å; C269-C310 WeakPolarHBondContact CB-SG 3.4Å; C269-C310 WeakPolarHBondContact SG-CB 3.01Å; C269-C310 CovalentContact SG-SG 2.06Å; C269-C310 PolarHBondContact SG-SG 3.09Å
270	T	54.2	Low	60.9	Low	21 Å²	21	53 Å²	53	13%	0.129	29%	0.286	C	S	.	.			trans	-81.6	170.4	-177.5	52.8	0	0	0	0	112.7	M191 I268 N272 G273 L274 Y276	M191-T270 HydrophobicContact CE-CG2 4.37Å; I268-T270 HydrophobicContact CG2-CG2 3.9Å; I268-T270 PolarHBondContact O-N 3.48Å; T270-N272 PolarHBondContact O-N 2.86Å; T270-N272 VanDerWaalsContact O-N 3.16Å; T270-N272 WeakPolarHBondContact OG1-CA 3.45Å; T270-N272 WeakPolarHBondContact OG1-CB 3.4Å; T270-N272 PolarHBondContact OG1-N 2.93Å; T270-G273 PolarHBondContact O-N 2.97Å; T270-L274 PolarHBondContact N-O 3.33Å; T270-L274 VanDerWaalsContact OG1-CB 3.28Å; T270-L274 WeakPolarHBondContact OG1-CB 3.25Å; T270-L274 PolarHBondContact OG1-O 3.38Å; T270-Y276 HydrophobicContact CG2-CD2 3.64Å; T270-Y276 HydrophobicContact CG2-CE2 3.98Å
271	V	48.3	Very low	61.4	Low	116 Å²	116	54.5 Å²	54.5	70%	0.703	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.8	159.6	-72.1	0	0	0	0	111.9	G273	V271-G273 PolarHBondContact O-N 3.17Å
272	N	51.1	Low	61	Low	75 Å²	75	58.9 Å²	58.9	40%	0.401	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	16.4	167.3	-52.3	24.8	0	0	0	112.3	I189 T270 L274	I189-N272 WeakPolarHBondContact CA-O 3.44Å; I189-N272 WeakPolarHBondContact CB-O 3.31Å; I189-N272 HydrophobicContact CG1-CB 4.37Å; I189-N272 WeakPolarHBondContact CG1-O 3.42Å; I189-N272 WeakPolarHBondContact CG2-O 3.09Å; T270-N272 PolarHBondContact O-N 2.86Å; T270-N272 VanDerWaalsContact O-N 3.16Å; T270-N272 WeakPolarHBondContact OG1-CA 3.45Å; T270-N272 WeakPolarHBondContact OG1-CB 3.4Å; T270-N272 PolarHBondContact OG1-N 2.93Å; N272-L274 HydrophobicContact CB-CB 4.36Å; N272-L274 HydrophobicContact CB-CD1 3.54Å; N272-L274 WeakPolarHBondContact O-CB 3.36Å; N272-L274 WeakPolarHBondContact O-CD1 3.29Å; N272-L274 WeakPolarHBondContact O-CG 3.36Å; N272-L274 PolarHBondContact O-N 2.8Å
273	G	53	Low	60.7	Low	1 Å²	1	57 Å²	57	1%	0.01	31%	0.307	C	S	.	.	S	Bend	trans	55.6	55.1	168.4	0	0	0	0	0	114.7	T270 V271 I314	T270-G273 PolarHBondContact O-N 2.97Å; V271-G273 PolarHBondContact O-N 3.17Å; G273-I314 WeakPolarHBondContact O-CG1 3.03Å
274	L	49.3	Very low	61	Low	7 Å²	7	53 Å²	53	4%	0.037	29%	0.287	C	S	.	.	S	Bend	trans	-171.2	143.8	-146.1	-114.5	177.6	0	0	0	114.2	L190 M191 C269 T270 N272	L190-L274 HydrophobicContact CB-CD2 4.5Å; L190-L274 HydrophobicContact CD2-CD2 3.74Å; L190-L274 HydrophobicContact CD2-CG 4.17Å; L190-L274 HydrophobicContact CG-CD2 4.31Å; L190-L274 HydrophobicContact CG-CG 4.3Å; L190-L274 VanDerWaalsContact N-CD1 3.25Å; M191-L274 HydrophobicContact CB-CD1 4.2Å; M191-L274 HydrophobicContact CE-CB 3.54Å; M191-L274 HydrophobicContact CE-CD1 3.84Å; M191-L274 HydrophobicContact CE-CD2 3.77Å; M191-L274 HydrophobicContact CE-CG 3.95Å; M191-L274 HydrophobicContact CG-CD1 3.3Å; M191-L274 HydrophobicContact CG-CD2 3.68Å; M191-L274 HydrophobicContact CG-CG 4Å; M191-L274 WeakPolarHBondContact O-CD2 3.35Å; M191-L274 HydrophobicContact SD-CD1 4.4Å; M191-L274 HydrophobicContact SD-CD2 4.04Å; C269-L274 CarbonylContact C-O 3.53Å; C269-L274 WeakPolarHBondContact CA-O 3.13Å; T270-L274 PolarHBondContact N-O 3.33Å; T270-L274 VanDerWaalsContact OG1-CB 3.28Å; T270-L274 WeakPolarHBondContact OG1-CB 3.25Å; T270-L274 PolarHBondContact OG1-O 3.38Å; N272-L274 HydrophobicContact CB-CB 4.36Å; N272-L274 HydrophobicContact CB-CD1 3.54Å; N272-L274 WeakPolarHBondContact O-CB 3.36Å; N272-L274 WeakPolarHBondContact O-CD1 3.29Å; N272-L274 WeakPolarHBondContact O-CG 3.36Å; N272-L274 PolarHBondContact O-N 2.8Å
275	F	58.7	Low	60.9	Low	83 Å²	83	49 Å²	49	36%	0.364	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	104.7	-179.5	-61.1	-69.5	0	0	0	115	I268 C269 I314	I268-F275 VanDerWaalsContact O-CA 3.29Å; I268-F275 WeakPolarHBondContact O-CA 3.4Å; C269-F275 HydrophobicContact CB-CD1 4.24Å; C269-F275 HydrophobicContact CB-CE1 3.8Å; C269-F275 HydrophobicContact CB-CZ 4.48Å; F275-I314 HydrophobicContact CD2-CD1 4.07Å; F275-I314 HydrophobicContact CE2-CD1 3.42Å; F275-I314 VanDerWaalsContact CE2-CD1 3.42Å; F275-I314 HydrophobicContact CZ-CD1 4.12Å
276	Y	55.2	Low	60.7	Low	41 Å²	41	47.1 Å²	47.1	16%	0.161	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	134.3	169.3	-92.1	-59.9	0	0	0	108.7	M191 T267 I268 T270 N278	M191-Y276 HydrophobicContact CB-CE1 4.3Å; M191-Y276 VanDerWaalsContact CE-CA 3.5Å; M191-Y276 HydrophobicContact CE-CD1 3.65Å; M191-Y276 HydrophobicContact CE-CD2 3.28Å; M191-Y276 HydrophobicContact CE-CE1 3.88Å; M191-Y276 HydrophobicContact CE-CE2 3.52Å; M191-Y276 HydrophobicContact CE-CG 3.27Å; M191-Y276 HydrophobicContact CG-CD1 4.31Å; M191-Y276 HydrophobicContact CG-CE1 3.75Å; M191-Y276 HydrophobicContact CG-CE2 4.3Å; M191-Y276 HydrophobicContact SD-CD1 3.15Å; M191-Y276 WeakPolarHBondContact SD-CD1 3.41Å; M191-Y276 HydrophobicContact SD-CD2 3.96Å; M191-Y276 HydrophobicContact SD-CE1 3.19Å; M191-Y276 WeakPolarHBondContact SD-CE1 3.27Å; M191-Y276 HydrophobicContact SD-CE2 3.98Å; M191-Y276 HydrophobicContact SD-CG 3.5Å; M191-Y276 VanDerWaalsContact SD-CZ 3.58Å; T267-Y276 WeakPolarHBondContact CA-O 3.04Å; I268-Y276 PolarHBondContact N-O 3.38Å; I268-Y276 PolarHBondContact O-N 2.58Å; I268-Y276 VanDerWaalsContact O-N 3.12Å; T270-Y276 HydrophobicContact CG2-CD2 3.64Å; T270-Y276 HydrophobicContact CG2-CE2 3.98Å; Y276-N278 PolarHBondContact O-N 3.46Å
277	L	51.2	Low	60.9	Low	136 Å²	136	46.2 Å²	46.2	71%	0.712	24%	0.242	S	C	*	.	S	Bend	trans	-73.4	69.8	155.8	-95.4	161.7	0	0	0	109.5	T267	T267-L277 HydrophobicContact CG2-CD2 4.42Å; T267-L277 HydrophobicContact CG2-CG 4.44Å
278	N	55.8	Low	60.9	Low	54 Å²	54	46.9 Å²	46.9	29%	0.289	24%	0.244	S	C	.	.	S	Bend	trans	-140.9	127.9	170.1	-82.6	-65.6	0	0	0	105.7	I268 Y276 C280	I268-N278 HydrophobicContact CD1-CB 4.1Å; I268-N278 WeakPolarHBondContact CD1-O 3.28Å; I268-N278 WeakPolarHBondContact CG1-O 3.18Å; Y276-N278 PolarHBondContact O-N 3.46Å; N278-C280 PolarHBondContact O-N 3.27Å
279	E	63.9	Low	60.3	Low	106 Å²	106	54.2 Å²	54.2	50%	0.495	28%	0.276	S	S	.	.			trans	-55.1	137.4	-178.7	-54.8	176.4	163.4	0	0	110.9	G266 V281 M282 L283	G266-E279 CarbonylContact O-C 3.5Å; G266-E279 VanDerWaalsContact O-CA 3.3Å; G266-E279 WeakPolarHBondContact O-CA 3.45Å; E279-V281 HydrophobicContact CB-CB 4.31Å; E279-V281 PolarHBondContact O-N 3.45Å; E279-M282 HydrophobicContact CB-CB 4.13Å; E279-M282 HydrophobicContact CB-CG 3.95Å; E279-M282 HydrophobicContact CG-CG 4.23Å; E279-M282 WeakPolarHBondContact O-CA 3.5Å; E279-M282 WeakPolarHBondContact O-CB 3.47Å; E279-M282 PolarHBondContact O-N 3.16Å; E279-L283 PolarHBondContact O-N 2.87Å
280	C	72.1	Confident	59.7	Low	3 Å²	3	57.6 Å²	57.6	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-51.5	-33	169.5	-45.9	0	0	0	0	112.1	L252 M255 C261 G266 I268 N278 L283 H284	L252-C280 HydrophobicContact CD2-CB 3.67Å; M255-C280 HydrophobicContact CE-CB 4.2Å; C261-C280 VanDerWaalsContact CA-SG 3.6Å; C261-C280 HydrophobicContact CB-CB 3.71Å; C261-C280 WeakPolarHBondContact CB-SG 3.23Å; C261-C280 WeakPolarHBondContact SG-CB 3Å; C261-C280 CovalentContact SG-SG 2.01Å; C261-C280 PolarHBondContact SG-SG 3.21Å; G266-C280 PolarHBondContact O-N 3.02Å; G266-C280 PolarHBondContact O-SG 3.38Å; I268-C280 HydrophobicContact CG1-CB 4.41Å; N278-C280 PolarHBondContact O-N 3.27Å; C280-L283 PolarHBondContact O-N 2.61Å; C280-H284 VanDerWaalsContact O-CB 3.24Å; C280-H284 WeakPolarHBondContact O-CB 3.43Å; C280-H284 PolarHBondContact O-N 3.3Å
281	V	70.1	Confident	59	Low	58 Å²	58	57.8 Å²	57.8	35%	0.352	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-44.9	174.1	-179.6	0	0	0	0	111	L252 E279 Q285	L252-V281 HydrophobicContact CD1-CG2 4.14Å; L252-V281 HydrophobicContact CD2-CG2 4.08Å; E279-V281 HydrophobicContact CB-CB 4.31Å; E279-V281 PolarHBondContact O-N 3.45Å; V281-Q285 VanDerWaalsContact O-CB 3.25Å; V281-Q285 WeakPolarHBondContact O-CB 3.44Å; V281-Q285 VanDerWaalsContact O-CG 3.23Å; V281-Q285 WeakPolarHBondContact O-CG 3.25Å; V281-Q285 PolarHBondContact O-N 2.95Å
282	M	62.2	Low	58.9	Low	97 Å²	97	57.7 Å²	57.7	48%	0.478	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-42.7	175.7	-72.7	-126.7	-72	0	0	112.4	E279 Q285 A286	E279-M282 HydrophobicContact CB-CB 4.13Å; E279-M282 HydrophobicContact CB-CG 3.95Å; E279-M282 HydrophobicContact CG-CG 4.23Å; E279-M282 WeakPolarHBondContact O-CA 3.5Å; E279-M282 WeakPolarHBondContact O-CB 3.47Å; E279-M282 PolarHBondContact O-N 3.16Å; M282-Q285 CarbonylContact O-C 3.49Å; M282-Q285 PolarHBondContact O-N 2.95Å; M282-A286 VanDerWaalsContact O-CB 3.32Å; M282-A286 WeakPolarHBondContact O-CB 3.47Å; M282-A286 PolarHBondContact O-N 2.62Å
283	L	67	Low	58.3	Low	21 Å²	21	56.5 Å²	56.5	11%	0.11	28%	0.278	C	S	.	.	H	α-helix	trans	-71.5	-43.6	178.8	-170.3	101.4	0	0	0	112.7	F228 M255 I268 E279 C280 Q285 A286 C287	F228-L283 HydrophobicContact CD1-CD1 3.78Å; F228-L283 HydrophobicContact CE1-CD1 3.52Å; F228-L283 HydrophobicContact CZ-CD1 4.35Å; M255-L283 HydrophobicContact CE-CB 4.46Å; M255-L283 HydrophobicContact CE-CD2 3.59Å; I268-L283 HydrophobicContact CD1-CB 3.38Å; I268-L283 HydrophobicContact CD1-CD1 4.12Å; I268-L283 HydrophobicContact CD1-CD2 4.1Å; I268-L283 HydrophobicContact CD1-CG 4.05Å; I268-L283 HydrophobicContact CG1-CB 4.49Å; I268-L283 HydrophobicContact CG2-CD2 4.09Å; E279-L283 PolarHBondContact O-N 2.87Å; C280-L283 PolarHBondContact O-N 2.61Å; L283-Q285 VanDerWaalsContact C-N 3.27Å; L283-Q285 PolarHBondContact O-N 3.07Å; L283-A286 WeakPolarHBondContact O-CB 2.98Å; L283-A286 PolarHBondContact O-N 3.02Å; L283-C287 PolarHBondContact O-N 2.87Å
284	H	74.8	Confident	57.8	Low	26 Å²	26	59 Å²	59	12%	0.12	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-39.7	173.9	179.1	68.5	0	0	0	111	P250 L252 M255 C280 L288	P250-H284 PolarHBondContact O-CE1 3.2Å; P250-H284 PolarHBondContact O-ND1 2.89Å; L252-H284 HydrophobicContact CD1-CB 4.46Å; L252-H284 HydrophobicContact CD2-CB 4.48Å; L252-H284 HydrophobicContact CG-CB 3.96Å; M255-H284 HydrophobicContact SD-CB 4.15Å; C280-H284 VanDerWaalsContact O-CB 3.24Å; C280-H284 WeakPolarHBondContact O-CB 3.43Å; C280-H284 PolarHBondContact O-N 3.3Å; H284-L288 VanDerWaalsContact CE1-CD1 3.45Å; H284-L288 WeakPolarHBondContact CE1-CD1 3.45Å; H284-L288 WeakPolarHBondContact NE2-CD1 3.46Å; H284-L288 WeakPolarHBondContact O-CD1 3.42Å; H284-L288 VanDerWaalsContact O-CG 3.3Å; H284-L288 WeakPolarHBondContact O-CG 3.46Å; H284-L288 PolarHBondContact O-N 3.05Å
285	Q	64.2	Low	57.5	Low	75 Å²	75	59.4 Å²	59.4	35%	0.35	29%	0.292	S	S	.	.	H	α-helix	trans	-67.3	-35.9	170.2	-75.8	-171.7	37.8	0	0	113.5	V281 M282 L283 L288 K289	V281-Q285 VanDerWaalsContact O-CB 3.25Å; V281-Q285 WeakPolarHBondContact O-CB 3.44Å; V281-Q285 VanDerWaalsContact O-CG 3.23Å; V281-Q285 WeakPolarHBondContact O-CG 3.25Å; V281-Q285 PolarHBondContact O-N 2.95Å; M282-Q285 CarbonylContact O-C 3.49Å; M282-Q285 PolarHBondContact O-N 2.95Å; L283-Q285 VanDerWaalsContact C-N 3.27Å; L283-Q285 PolarHBondContact O-N 3.07Å; Q285-L288 PolarHBondContact O-N 3.26Å; Q285-K289 VanDerWaalsContact O-CB 3.28Å; Q285-K289 WeakPolarHBondContact O-CB 3.42Å; Q285-K289 WeakPolarHBondContact O-CD 3.33Å; Q285-K289 WeakPolarHBondContact O-CG 3.48Å; Q285-K289 PolarHBondContact O-N 2.96Å; Q285-K289 VanDerWaalsContact OE1-NZ 3.1Å
286	A	61	Low	56.5	Low	20 Å²	20	57.5 Å²	57.5	17%	0.165	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-47.4	178.7	0	0	0	0	0	110.9	F228 M282 L283 L288 K289 Q290	F228-A286 HydrophobicContact CD1-CB 4.41Å; M282-A286 VanDerWaalsContact O-CB 3.32Å; M282-A286 WeakPolarHBondContact O-CB 3.47Å; M282-A286 PolarHBondContact O-N 2.62Å; L283-A286 WeakPolarHBondContact O-CB 2.98Å; L283-A286 PolarHBondContact O-N 3.02Å; A286-L288 PolarHBondContact O-N 3.37Å; A286-K289 PolarHBondContact O-N 3.18Å; A286-K289 VanDerWaalsContact O-N 3.16Å; A286-Q290 WeakPolarHBondContact O-CB 3.45Å; A286-Q290 WeakPolarHBondContact O-CG 3.29Å; A286-Q290 PolarHBondContact O-N 2.83Å; A286-Q290 VanDerWaalsContact O-N 3.09Å
287	C	70.6	Confident	55.7	Low	1 Å²	1	60 Å²	60	1%	0.007	30%	0.301	C	S	.	.	H	α-helix	trans	-55.5	-50.4	175.6	-172.1	0	0	0	0	111.7	F228 G229 A230 C249 L283 K289 Q290 T291	F228-C287 WeakPolarHBondContact O-CA 3.28Å; F228-C287 PolarHBondContact O-N 3.1Å; G229-C287 PolarHBondContact O-SG 3.17Å; G229-C287 VanDerWaalsContact O-SG 3.36Å; A230-C287 VanDerWaalsContact CA-SG 3.55Å; A230-C287 VanDerWaalsContact CB-SG 3.55Å; C249-C287 WeakPolarHBondContact CA-SG 3.23Å; C249-C287 HydrophobicContact CB-CB 3.97Å; C249-C287 WeakPolarHBondContact CB-SG 3.28Å; C249-C287 WeakPolarHBondContact SG-CB 3.12Å; C249-C287 CovalentContact SG-SG 2.03Å; C249-C287 PolarHBondContact SG-SG 2.98Å; L283-C287 PolarHBondContact O-N 2.87Å; C287-K289 VanDerWaalsContact C-N 3.27Å; C287-K289 PolarHBondContact O-N 3.25Å; C287-Q290 PolarHBondContact O-N 3.02Å; C287-T291 PolarHBondContact O-N 2.04Å; C287-T291 VanDerWaalsContact O-N 3.11Å; C287-T291 PolarHBondContact O-OG1 3.27Å
288	L	65.1	Low	55.1	Low	35 Å²	35	54.8 Å²	54.8	18%	0.183	27%	0.273	C	S	.	.	H	α-helix	trans	-74.3	-11.6	-178.4	-64.5	168.3	0	0	0	114.1	C249 H284 Q285 A286 K442	C249-L288 HydrophobicContact CB-CD2 3.91Å; C249-L288 HydrophobicContact CB-CG 4.23Å; H284-L288 VanDerWaalsContact CE1-CD1 3.45Å; H284-L288 WeakPolarHBondContact CE1-CD1 3.45Å; H284-L288 WeakPolarHBondContact NE2-CD1 3.46Å; H284-L288 WeakPolarHBondContact O-CD1 3.42Å; H284-L288 VanDerWaalsContact O-CG 3.3Å; H284-L288 WeakPolarHBondContact O-CG 3.46Å; H284-L288 PolarHBondContact O-N 3.05Å; Q285-L288 PolarHBondContact O-N 3.26Å; A286-L288 PolarHBondContact O-N 3.37Å; L288-K442 HydrophobicContact CD1-CD 4.47Å; L288-K442 VanDerWaalsContact CD1-CE 3.48Å; L288-K442 HydrophobicContact CD1-CG 4.19Å
289	K	55.3	Low	54.3	Low	159 Å²	159	57.9 Å²	57.9	69%	0.691	29%	0.29	S	S	*	.	H	α-helix	trans	-91.7	-12.7	168.5	-77.3	169.8	-177.5	166.9	0	112.6	Q285 A286 C287	Q285-K289 VanDerWaalsContact O-CB 3.28Å; Q285-K289 WeakPolarHBondContact O-CB 3.42Å; Q285-K289 WeakPolarHBondContact O-CD 3.33Å; Q285-K289 WeakPolarHBondContact O-CG 3.48Å; Q285-K289 PolarHBondContact O-N 2.96Å; Q285-K289 VanDerWaalsContact OE1-NZ 3.1Å; A286-K289 PolarHBondContact O-N 3.18Å; A286-K289 VanDerWaalsContact O-N 3.16Å; C287-K289 VanDerWaalsContact C-N 3.27Å; C287-K289 PolarHBondContact O-N 3.25Å
290	Q	50	Low	53	Low	74 Å²	74	58 Å²	58	35%	0.346	30%	0.297	S	S	.	.	H	α-helix	trans	-110.8	-15.4	-172.7	-73.3	179.8	35.6	0	0	114.2	R227 A286 C287	R227-Q290 HydrophobicContact CB-CB 4.05Å; R227-Q290 WeakPolarHBondContact CD-O 3.05Å; R227-Q290 PolarHBondContact NH1-O 2.82Å; A286-Q290 WeakPolarHBondContact O-CB 3.45Å; A286-Q290 WeakPolarHBondContact O-CG 3.29Å; A286-Q290 PolarHBondContact O-N 2.83Å; A286-Q290 VanDerWaalsContact O-N 3.09Å; C287-Q290 PolarHBondContact O-N 3.02Å
291	T	41.2	Very low	51.2	Low	25 Å²	25	61.6 Å²	61.6	15%	0.153	31%	0.313	C	S	.	.			trans	-144.2	144.2	-173.7	56.8	0	0	0	0	114.3	R227 C287 L293	R227-T291 HydrophobicContact CB-CG2 3.86Å; R227-T291 HydrophobicContact CG-CG2 4.3Å; C287-T291 PolarHBondContact O-N 2.04Å; C287-T291 VanDerWaalsContact O-N 3.11Å; C287-T291 PolarHBondContact O-OG1 3.27Å; T291-L293 HydrophobicContact CG2-CD1 3.86Å; T291-L293 PolarHBondContact O-N 2.96Å
292	E	44.4	Very low	49.4	Very low	114 Å²	114	64 Å²	64	53%	0.533	33%	0.332	S	S	.	.			trans	-77.1	40.3	174.1	-82.5	-170.9	-140.3	0	0	113.2	Q441	E292-Q441 VanDerWaalsContact CB-NE2 3.26Å; E292-Q441 WeakPolarHBondContact O-CG 3.18Å; E292-Q441 PolarHBondContact O-NE2 2.96Å
293	L	40	Very low	48.3	Very low	50 Å²	50	70.7 Å²	70.7	26%	0.262	35%	0.352	S	S	.	.			trans	-123.1	116.7	-159.8	-61.8	167.1	0	0	0	111.9	C247 T291	C247-L293 HydrophobicContact CB-CD1 3.58Å; C247-L293 WeakPolarHBondContact O-CB 3.39Å; C247-L293 WeakPolarHBondContact O-CD1 3.39Å; C247-L293 WeakPolarHBondContact O-CD2 3.47Å; C247-L293 WeakPolarHBondContact O-CG 3.4Å; T291-L293 HydrophobicContact CG2-CD1 3.86Å; T291-L293 PolarHBondContact O-N 2.96Å
294	K	41.6	Very low	46.9	Very low	55 Å²	55	73.7 Å²	73.7	24%	0.239	37%	0.367	C	S	.	.			trans	-61	135.1	-176.1	-86.3	172.2	169.2	175.5	0	111.2	Q441 K444	K294-Q441 HydrophobicContact CG-CB 4.06Å; K294-Q441 HydrophobicContact CG-CG 4.29Å; K294-Q441 WeakPolarHBondContact CG-O 3.36Å; K294-K444 HydrophobicContact CB-CG 4.14Å; K294-K444 HydrophobicContact CD-CG 4.21Å; K294-K444 HydrophobicContact CG-CG 4.39Å
295	P	43.5	Very low	45.6	Very low	15 Å²	15	73.6 Å²	73.6	10%	0.097	37%	0.368	C	S	.	.			trans	-70.9	144.2	179.5	28.9	-33.8	0	0	0	112.6	C249 T251 Q441 K444	C249-P295 WeakPolarHBondContact O-CA 3.3Å; C249-P295 WeakPolarHBondContact O-CB 3.19Å; T251-P295 HydrophobicContact CG2-CB 3.91Å; P295-Q441 VanDerWaalsContact CD-O 3.27Å; P295-Q441 WeakPolarHBondContact CD-O 3.02Å; P295-K444 WeakPolarHBondContact O-CD 3.48Å; P295-K444 WeakPolarHBondContact O-CE 3.4Å
296	M	37.7	Very low	44.7	Very low	42 Å²	42	72 Å²	72	21%	0.207	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-111.8	126.5	-171.2	-173.2	72.9	142.8	0	0	111.3	E233 C249 K444	E233-M296 WeakPolarHBondContact OE1-CE 3.22Å; E233-M296 WeakPolarHBondContact OE1-CG 2.99Å; C249-M296 PolarHBondContact O-N 3.49Å; M296-K444 PolarHBondContact SD-NZ 3.17Å
297	N	38.2	Very low	44.1	Very low	95 Å²	95	75.9 Å²	75.9	51%	0.508	38%	0.379	S	S	.	.			trans	-75.5	124.8	173.5	179.9	-56.8	0	0	0	109.3	N299	N297-N299 PolarHBondContact O-N 3.18Å; N297-N299 PolarHBondContact OD1-N 2.04Å
298	L	39.5	Very low	43.2	Very low	25 Å²	25	81.2 Å²	81.2	13%	0.131	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-81.3	13.2	-160.4	-141.9	134.3	0	0	0	114.9	D254 M260 V300 F301	D254-L298 HydrophobicContact CB-CB 3.99Å; D254-L298 HydrophobicContact CB-CD1 4.15Å; D254-L298 WeakPolarHBondContact OD1-CB 3.37Å; D254-L298 PolarHBondContact OD1-N 3.09Å; M260-L298 HydrophobicContact CE-CD1 4.25Å; L298-V300 PolarHBondContact O-N 3.25Å; L298-F301 HydrophobicContact CD2-CB 3.69Å; L298-F301 WeakPolarHBondContact CD2-O 3.12Å; L298-F301 HydrophobicContact CG-CB 3.96Å; L298-F301 PolarHBondContact O-N 3.48Å; L298-F301 VanDerWaalsContact O-N 3.12Å
299	N	38.5	Very low	42.6	Very low	120 Å²	120	82.7 Å²	82.7	64%	0.642	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-61.2	-2	172.1	-74.2	-4.1	0	0	0	114.3	K257 N297	K257-N299 PolarHBondContact NZ-OD1 3.35Å; N297-N299 PolarHBondContact O-N 3.18Å; N297-N299 PolarHBondContact OD1-N 2.04Å
300	V	37	Very low	42.4	Very low	107 Å²	107	75.1 Å²	75.1	65%	0.648	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-103.2	-18.5	177.7	-176.7	0	0	0	0	112.8	L298	L298-V300 PolarHBondContact O-N 3.25Å
301	F	34.4	Very low	42.7	Very low	80 Å²	80	74.2 Å²	74.2	35%	0.351	39%	0.385	S	S	.	.			trans	-116.5	47.3	-168.1	-116.9	-80.6	0	0	0	113.4	E233 L298 R303 I304	E233-F301 HydrophobicContact CG-CE2 3.94Å; L298-F301 HydrophobicContact CD2-CB 3.69Å; L298-F301 WeakPolarHBondContact CD2-O 3.12Å; L298-F301 HydrophobicContact CG-CB 3.96Å; L298-F301 PolarHBondContact O-N 3.48Å; L298-F301 VanDerWaalsContact O-N 3.12Å; F301-R303 PolarHBondContact O-N 2.73Å; F301-I304 HydrophobicContact CD1-CD1 3.7Å; F301-I304 HydrophobicContact CD1-CG1 4.23Å; F301-I304 HydrophobicContact CE1-CD1 3.66Å
302	S	31.9	Very low	43.3	Very low	108 Å²	108	76.6 Å²	76.6	76%	0.755	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	41.4	-168.5	69.5	0	0	0	0	116.1
303	R	38.8	Very low	43.7	Very low	237 Å²	237	74 Å²	74	89%	0.894	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.7	5.3	-176.8	-71.9	-167.4	174.8	-178.6	-1.5	115.9	F301	F301-R303 PolarHBondContact O-N 2.73Å
304	I	38.3	Very low	44.2	Very low	84 Å²	84	73.6 Å²	73.6	43%	0.431	38%	0.381	S	S	.	.	S	Bend	trans	-122.9	112	-172.3	-60.4	-173.9	0	0	0	111.8	F301	F301-I304 HydrophobicContact CD1-CD1 3.7Å; F301-I304 HydrophobicContact CD1-CG1 4.23Å; F301-I304 HydrophobicContact CE1-CD1 3.66Å
305	L	46	Very low	44.5	Very low	24 Å²	24	76 Å²	76	13%	0.126	39%	0.394	C	S	.	.			trans	58.3	75.2	160.3	-89.5	156.6	0	0	0	117.4	D309 C310 L313	L305-D309 HydrophobicContact CD2-CB 4.37Å; L305-C310 HydrophobicContact CD2-CB 3.77Å; L305-L313 HydrophobicContact CD1-CD1 4.36Å; L305-L313 HydrophobicContact CD2-CD1 3.47Å; L305-L313 VanDerWaalsContact CD2-CD1 3.47Å; L305-L313 HydrophobicContact CG-CD1 3.87Å
306	S	46.9	Very low	44.7	Very low	41 Å²	41	82 Å²	82	29%	0.287	42%	0.418	S	S	.	.			trans	-67.9	175.2	158.6	73.1	0	0	0	0	112.2	N308 D309 C310	S306-N308 PolarHBondContact O-N 2.71Å; S306-N308 PolarHBondContact OG-N 3.11Å; S306-D309 WeakPolarHBondContact CB-OD2 3.02Å; S306-D309 PolarHBondContact N-OD2 3.05Å; S306-D309 CarbonylContact O-C 3.53Å; S306-D309 PolarHBondContact O-N 3.48Å; S306-D309 VanDerWaalsContact O-N 3.16Å; S306-D309 PolarHBondContact OG-N 2.71Å; S306-D309 VanDerWaalsContact OG-N 3.09Å; S306-D309 PolarHBondContact OG-OD2 3.25Å; S306-C310 WeakPolarHBondContact O-CB 3.08Å; S306-C310 PolarHBondContact O-N 3.28Å
307	Q	46.5	Very low	44.6	Very low	102 Å²	102	81.6 Å²	81.6	48%	0.477	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-35.5	174.1	-153.1	162.7	-28.2	0	0	111.8	H259 D309 C310 S311	H259-Q307 HydrophobicContact CB-CB 3.66Å; H259-Q307 HydrophobicContact CB-CG 4.16Å; H259-Q307 PolarHBondContact CD2-N 3.45Å; H259-Q307 VanDerWaalsContact CD2-N 3.3Å; H259-Q307 PolarHBondContact ND1-OE1 3.05Å; Q307-D309 VanDerWaalsContact C-N 3.34Å; Q307-C310 PolarHBondContact O-N 3.23Å; Q307-S311 WeakPolarHBondContact O-CB 3.44Å; Q307-S311 PolarHBondContact O-N 3.1Å; Q307-S311 PolarHBondContact O-OG 3.09Å; Q307-S311 VanDerWaalsContact O-OG 3.14Å
308	N	52.6	Low	44.5	Very low	114 Å²	114	80.7 Å²	80.7	61%	0.61	42%	0.418	S	S	*	.	H	α-helix	trans	-68.2	-37.5	176.3	-126.7	34.1	0	0	0	110.7	S306 Q312	S306-N308 PolarHBondContact O-N 2.71Å; S306-N308 PolarHBondContact OG-N 3.11Å; N308-Q312 WeakPolarHBondContact O-CB 3.05Å; N308-Q312 VanDerWaalsContact O-CG 3.31Å; N308-Q312 WeakPolarHBondContact O-CG 3.21Å; N308-Q312 PolarHBondContact O-N 2.9Å
309	D	52.4	Low	44	Very low	65 Å²	65	85.5 Å²	85.5	35%	0.348	44%	0.443	S	S	.	.	H	α-helix	trans	-70.2	-37.4	173.1	-57.8	-56.1	0	0	0	111.7	L305 S306 Q307 Q312 L313	L305-D309 HydrophobicContact CD2-CB 4.37Å; S306-D309 WeakPolarHBondContact CB-OD2 3.02Å; S306-D309 PolarHBondContact N-OD2 3.05Å; S306-D309 CarbonylContact O-C 3.53Å; S306-D309 PolarHBondContact O-N 3.48Å; S306-D309 VanDerWaalsContact O-N 3.16Å; S306-D309 PolarHBondContact OG-N 2.71Å; S306-D309 VanDerWaalsContact OG-N 3.09Å; S306-D309 PolarHBondContact OG-OD2 3.25Å; Q307-D309 VanDerWaalsContact C-N 3.34Å; D309-Q312 PolarHBondContact O-N 3.01Å; D309-L313 WeakPolarHBondContact O-CB 3.38Å; D309-L313 WeakPolarHBondContact O-CG 3.03Å; D309-L313 PolarHBondContact O-N 3.44Å
310	C	50.3	Low	43.3	Very low	1 Å²	1	84.3 Å²	84.3	1%	0.007	44%	0.444	C	S	.	.	H	α-helix	trans	-65.6	-41.5	175.7	-177.2	0	0	0	0	110.3	C269 L305 S306 Q307 L313 I314	C269-C310 HydrophobicContact CB-CB 4.28Å; C269-C310 WeakPolarHBondContact CB-SG 3.4Å; C269-C310 WeakPolarHBondContact SG-CB 3.01Å; C269-C310 CovalentContact SG-SG 2.06Å; C269-C310 PolarHBondContact SG-SG 3.09Å; L305-C310 HydrophobicContact CD2-CB 3.77Å; S306-C310 WeakPolarHBondContact O-CB 3.08Å; S306-C310 PolarHBondContact O-N 3.28Å; Q307-C310 PolarHBondContact O-N 3.23Å; C310-L313 PolarHBondContact O-N 2.95Å; C310-I314 WeakPolarHBondContact O-CB 3.04Å; C310-I314 VanDerWaalsContact O-CG1 3.27Å; C310-I314 WeakPolarHBondContact O-CG1 3.38Å; C310-I314 PolarHBondContact O-N 2.9Å
311	S	58.1	Low	42.8	Very low	55 Å²	55	84.4 Å²	84.4	39%	0.385	45%	0.449	S	S	.	.	H	α-helix	trans	-63.2	-48.7	170.6	-65	0	0	0	0	112.3	Q307 L313 I314 E315	Q307-S311 WeakPolarHBondContact O-CB 3.44Å; Q307-S311 PolarHBondContact O-N 3.1Å; Q307-S311 PolarHBondContact O-OG 3.09Å; Q307-S311 VanDerWaalsContact O-OG 3.14Å; S311-L313 VanDerWaalsContact C-N 3.26Å; S311-L313 PolarHBondContact O-N 3.43Å; S311-I314 PolarHBondContact O-N 3.49Å; S311-E315 WeakPolarHBondContact O-CG 3.02Å; S311-E315 PolarHBondContact O-N 3.37Å
312	Q	53.8	Low	42.4	Very low	75 Å²	75	85 Å²	85	35%	0.35	47%	0.469	S	S	.	.	H	α-helix	trans	-64.6	-30.1	177	-79.2	-177.7	37.8	0	0	113.1	N308 D309 K316	N308-Q312 WeakPolarHBondContact O-CB 3.05Å; N308-Q312 VanDerWaalsContact O-CG 3.31Å; N308-Q312 WeakPolarHBondContact O-CG 3.21Å; N308-Q312 PolarHBondContact O-N 2.9Å; D309-Q312 PolarHBondContact O-N 3.01Å; Q312-K316 VanDerWaalsContact O-CB 3.31Å; Q312-K316 WeakPolarHBondContact O-CB 3.46Å; Q312-K316 WeakPolarHBondContact O-CD 3.29Å; Q312-K316 WeakPolarHBondContact O-CG 3.49Å; Q312-K316 PolarHBondContact O-N 3.26Å
313	L	51.9	Low	42.1	Very low	60 Å²	60	84.5 Å²	84.5	31%	0.314	47%	0.465	S	S	.	.	H	α-helix	trans	-71.3	-50	173.8	-89.4	162	0	0	0	108.7	L305 D309 C310 S311 E315 K316 M317	L305-L313 HydrophobicContact CD1-CD1 4.36Å; L305-L313 HydrophobicContact CD2-CD1 3.47Å; L305-L313 VanDerWaalsContact CD2-CD1 3.47Å; L305-L313 HydrophobicContact CG-CD1 3.87Å; D309-L313 WeakPolarHBondContact O-CB 3.38Å; D309-L313 WeakPolarHBondContact O-CG 3.03Å; D309-L313 PolarHBondContact O-N 3.44Å; C310-L313 PolarHBondContact O-N 2.95Å; S311-L313 VanDerWaalsContact C-N 3.26Å; S311-L313 PolarHBondContact O-N 3.43Å; L313-E315 VanDerWaalsContact C-N 3.31Å; L313-E315 PolarHBondContact O-N 2.94Å; L313-K316 CarbonylContact O-C 3.39Å; L313-K316 PolarHBondContact O-N 2.96Å; L313-K316 VanDerWaalsContact O-N 3.1Å; L313-M317 HydrophobicContact CB-CE 3.38Å; L313-M317 HydrophobicContact CD2-CE 3.61Å; L313-M317 HydrophobicContact CD2-SD 4.38Å; L313-M317 HydrophobicContact CG-CE 4.1Å; L313-M317 WeakPolarHBondContact O-CB 3.41Å; L313-M317 WeakPolarHBondContact O-CE 3.14Å; L313-M317 WeakPolarHBondContact O-CG 3.21Å; L313-M317 PolarHBondContact O-N 2.98Å; L313-M317 VanDerWaalsContact O-N 3.17Å
314	I	50.6	Low	41.5	Very low	40 Å²	40	79.1 Å²	79.1	21%	0.205	46%	0.459	C	S	.	.	H	α-helix	trans	-52.3	-49.2	171.7	-72.3	164	0	0	0	110.6	G273 F275 C310 S311 K316 M317 S318	G273-I314 WeakPolarHBondContact O-CG1 3.03Å; F275-I314 HydrophobicContact CD2-CD1 4.07Å; F275-I314 HydrophobicContact CE2-CD1 3.42Å; F275-I314 VanDerWaalsContact CE2-CD1 3.42Å; F275-I314 HydrophobicContact CZ-CD1 4.12Å; C310-I314 WeakPolarHBondContact O-CB 3.04Å; C310-I314 VanDerWaalsContact O-CG1 3.27Å; C310-I314 WeakPolarHBondContact O-CG1 3.38Å; C310-I314 PolarHBondContact O-N 2.9Å; S311-I314 PolarHBondContact O-N 3.49Å; I314-K316 PolarHBondContact O-N 3.29Å; I314-M317 CarbonylContact O-C 3.46Å; I314-M317 WeakPolarHBondContact O-CA 3.39Å; I314-M317 PolarHBondContact O-N 3.01Å; I314-S318 PolarHBondContact O-N 3.33Å; I314-S318 PolarHBondContact O-OG 3.17Å; I314-S318 VanDerWaalsContact O-OG 3.06Å
315	E	48.5	Very low	40.8	Very low	107 Å²	107	80.8 Å²	80.8	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-55	-49.4	174.6	-75.4	178.6	143.3	0	0	112.4	S311 L313 M317 S318 L319	S311-E315 WeakPolarHBondContact O-CG 3.02Å; S311-E315 PolarHBondContact O-N 3.37Å; L313-E315 VanDerWaalsContact C-N 3.31Å; L313-E315 PolarHBondContact O-N 2.94Å; E315-M317 PolarHBondContact O-N 2.95Å; E315-S318 PolarHBondContact O-N 2.98Å; E315-L319 HydrophobicContact CB-CD1 4.12Å; E315-L319 WeakPolarHBondContact O-CB 3.08Å; E315-L319 WeakPolarHBondContact O-CG 3.45Å; E315-L319 PolarHBondContact O-N 3.14Å
316	K	46	Very low	39.8	Very low	141 Å²	141	85 Å²	85	61%	0.613	51%	0.505	S	S	*	.	H	α-helix	trans	-63.4	-5.1	176.7	-76.2	164.2	-174.7	154.7	0	114.4	Q312 L313 I314	Q312-K316 VanDerWaalsContact O-CB 3.31Å; Q312-K316 WeakPolarHBondContact O-CB 3.46Å; Q312-K316 WeakPolarHBondContact O-CD 3.29Å; Q312-K316 WeakPolarHBondContact O-CG 3.49Å; Q312-K316 PolarHBondContact O-N 3.26Å; L313-K316 CarbonylContact O-C 3.39Å; L313-K316 PolarHBondContact O-N 2.96Å; L313-K316 VanDerWaalsContact O-N 3.1Å; I314-K316 PolarHBondContact O-N 3.29Å
317	M	37.4	Very low	38.9	Very low	32 Å²	32	89.2 Å²	89.2	16%	0.158	53%	0.528	C	S	.	.	H	α-helix	trans	-130.1	-9.9	-171.9	-59.8	-175.6	-76.3	0	0	113	L188 I189 L313 I314 E315	L188-M317 HydrophobicContact CD1-CG 4.22Å; L188-M317 HydrophobicContact CD1-SD 3.39Å; L188-M317 WeakPolarHBondContact CD1-SD 3.03Å; L188-M317 HydrophobicContact CD2-CB 4.45Å; L188-M317 HydrophobicContact CD2-CG 3.85Å; L188-M317 HydrophobicContact CD2-SD 3.99Å; L188-M317 HydrophobicContact CG-CG 3.94Å; L188-M317 HydrophobicContact CG-SD 3.39Å; L188-M317 WeakPolarHBondContact CG-SD 3.3Å; I189-M317 HydrophobicContact CB-CE 4.06Å; I189-M317 HydrophobicContact CB-SD 3.5Å; I189-M317 WeakPolarHBondContact CB-SD 3.04Å; I189-M317 HydrophobicContact CD1-CE 3.72Å; I189-M317 HydrophobicContact CD1-SD 3.21Å; I189-M317 WeakPolarHBondContact CD1-SD 3.29Å; I189-M317 HydrophobicContact CG1-CE 3.67Å; I189-M317 HydrophobicContact CG1-SD 3.44Å; I189-M317 WeakPolarHBondContact CG1-SD 3.41Å; I189-M317 HydrophobicContact CG2-CB 3.81Å; I189-M317 HydrophobicContact CG2-CE 3.62Å; I189-M317 HydrophobicContact CG2-CG 4.25Å; I189-M317 HydrophobicContact CG2-SD 3.5Å; I189-M317 VanDerWaalsContact CG2-SD 3.5Å; L313-M317 HydrophobicContact CB-CE 3.38Å; L313-M317 HydrophobicContact CD2-CE 3.61Å; L313-M317 HydrophobicContact CD2-SD 4.38Å; L313-M317 HydrophobicContact CG-CE 4.1Å; L313-M317 WeakPolarHBondContact O-CB 3.41Å; L313-M317 WeakPolarHBondContact O-CE 3.14Å; L313-M317 WeakPolarHBondContact O-CG 3.21Å; L313-M317 PolarHBondContact O-N 2.98Å; L313-M317 VanDerWaalsContact O-N 3.17Å; I314-M317 CarbonylContact O-C 3.46Å; I314-M317 WeakPolarHBondContact O-CA 3.39Å; I314-M317 PolarHBondContact O-N 3.01Å; E315-M317 PolarHBondContact O-N 2.95Å
318	S	35.2	Very low	38	Very low	77 Å²	77	92.6 Å²	92.6	54%	0.538	54%	0.544	S	S	.	.	H	α-helix	trans	-114.2	-0.6	166.3	68.3	0	0	0	0	113.6	I314 E315	I314-S318 PolarHBondContact O-N 3.33Å; I314-S318 PolarHBondContact O-OG 3.17Å; I314-S318 VanDerWaalsContact O-OG 3.06Å; E315-S318 PolarHBondContact O-N 2.98Å
319	L	28.4	Very low	36.7	Very low	126 Å²	126	93.9 Å²	93.9	66%	0.66	55%	0.549	S	S	*	.			trans	-99.6	106.4	170.5	-73.7	166.2	0	0	0	112.2	E315	E315-L319 HydrophobicContact CB-CD1 4.12Å; E315-L319 WeakPolarHBondContact O-CB 3.08Å; E315-L319 WeakPolarHBondContact O-CG 3.45Å; E315-L319 PolarHBondContact O-N 3.14Å
320	S	25	Very low	35.3	Very low	95 Å²	95	95.6 Å²	95.6	66%	0.664	56%	0.562	S	S	*	*			trans	-66.4	148.6	159.5	52.7	0	0	0	0	112.3
321	S	24.8	Very low	34.2	Very low	109 Å²	109	102.3 Å²	102.3	76%	0.762	60%	0.598	S	S	*	*			trans	40	118.1	143.6	62.9	0	0	0	0	120.5
322	A	27.1	Very low	32.6	Very low	93 Å²	93	105.1 Å²	105.1	77%	0.769	61%	0.609	S	S	*	*				172.2	140.7	120.1	0	0	0	0	0	115.6
323	S	26.5	Very low	31.3	Very low	97 Å²	97	108.3 Å²	108.3	68%	0.678	62%	0.624	S	S	*	*			trans	54.2	104	137.3	70.7	0	0	0	0	123.8
324	T	25	Very low	30	Very low	123 Å²	123	111.1 Å²	111.1	76%	0.755	64%	0.644	S	S	*	*				77.5	134.4	118	56.2	0	0	0	0	125.4
325	T	24.9	Very low	28.7	Very low	119 Å²	119	113.5 Å²	113.5	73%	0.73	66%	0.663	S	S	*	*			trans	78.1	112.7	138.4	45.9	0	0	0	0	123.3
326	S	24.7	Very low	27.6	Very low	114 Å²	114	113.5 Å²	113.5	80%	0.797	67%	0.671	S	S	*	*			trans	68.3	150.1	146.4	68.4	0	0	0	0	117.3
327	V	27.1	Very low	26.7	Very low	128 Å²	128	112.6 Å²	112.6	78%	0.776	67%	0.673	S	S	*	*			cis	-134.1	160.4	33	169	0	0	0	0	113
328	H	27.1	Very low	26.2	Very low	173 Å²	173	117.8 Å²	117.8	80%	0.801	70%	0.697	S	S	*	*			trans	-72.2	-163.8	175.2	-102.1	-97.1	0	0	0	113.5
329	I	25	Very low	25.8	Very low	142 Å²	142	120.1 Å²	120.1	73%	0.728	70%	0.702	S	S	*	*			trans	90.8	79.1	169	-52.3	170.1	0	0	0	111.9
330	T	24.9	Very low	25.7	Very low	100 Å²	100	121.3 Å²	121.3	61%	0.613	71%	0.708	S	S	*	*				78.1	134	69.9	65	0	0	0	0	114.9
331	N	25.7	Very low	26	Very low	143 Å²	143	122 Å²	122	77%	0.765	71%	0.71	S	S	*	*			trans	69.5	152.8	163.6	-61.5	17.7	0	0	0	114.5
332	D	25.6	Very low	26.1	Very low	114 Å²	114	125 Å²	125	61%	0.61	71%	0.712	S	S	*	*			cis	-152.1	177.4	0.5	-142.2	-21.5	0	0	0	112.3
333	Q	25.3	Very low	26	Very low	142 Å²	142	125.6 Å²	125.6	66%	0.664	71%	0.705	S	S	*	*			trans	64.4	109.5	143.6	-80.3	165.1	63.2	0	0	118
334	T	25	Very low	25.9	Very low	119 Å²	119	129.3 Å²	129.3	73%	0.73	71%	0.712	S	S	*	*				63.1	139.6	89.7	66.3	0	0	0	0	114.6
335	S	24.8	Very low	26.2	Very low	89 Å²	89	128 Å²	128	62%	0.622	71%	0.706	S	S	*	*			cis	-177.2	-157.1	-6.3	53.6	0	0	0	0	108.5
336	T	25.1	Very low	26.2	Very low	108 Å²	108	128.8 Å²	128.8	66%	0.663	71%	0.705	S	S	*	*			trans	15.8	127.8	140	69.4	0	0	0	0	117.8
337	N	27	Very low	26.4	Very low	121 Å²	121	133.3 Å²	133.3	65%	0.647	71%	0.705	S	S	*	*				154.7	164.4	79.6	-106.8	-6.7	0	0	0	107.1
338	Q	26.6	Very low	26.7	Very low	141 Å²	141	133.7 Å²	133.7	66%	0.659	70%	0.702	S	S	*	*			cis	-174.4	165.3	-19.1	-123.1	172.2	4.8	0	0	107.6
339	I	25.8	Very low	26.7	Very low	127 Å²	127	130.4 Å²	130.4	65%	0.651	70%	0.699	S	S	*	*			trans	52.3	129.2	139	-67.5	164	0	0	0	117.9
340	I	27.6	Very low	27.1	Very low	151 Å²	151	128.7 Å²	128.7	77%	0.774	70%	0.697	S	S	*	*			cis	-141.4	125.3	45.1	-53.4	161.8	0	0	0	112.6
341	P	30.7	Very low	27.1	Very low	109 Å²	109	129 Å²	129	71%	0.708	70%	0.703	S	S	*	*			trans	-100.8	147.1	147.1	35.7	-29.3	0	0	0	111.4
342	Q	26.1	Very low	27.3	Very low	172 Å²	172	129.5 Å²	129.5	80%	0.804	71%	0.705	S	S	*	*			trans	-176.8	170.4	159.8	-89.6	-124.5	13	0	0	111.1
343	V	24.8	Very low	27.2	Very low	105 Å²	105	128.9 Å²	128.9	64%	0.636	71%	0.706	S	S	*	*				-167.5	125.9	-60.7	126.6	0	0	0	0	111
344	Q	25.7	Very low	27.3	Very low	176 Å²	176	129.6 Å²	129.6	82%	0.822	71%	0.709	S	S	*	*			trans	60.6	-179.7	156	-75.5	-170.7	8.3	0	0	119.4
345	P	31	Very low	27.3	Very low	96 Å²	96	130.4 Å²	130.4	62%	0.623	71%	0.707	S	S	*	*			cis	-138.6	-179.1	-40.5	34.9	-16.5	0	0	0	116.1
346	N	25.5	Very low	27.4	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	71%	0.711	S	S	*	*			trans	65.8	116	137	-93.7	-29.5	0	0	0	123.4
347	R	28.9	Very low	27.4	Very low	210 Å²	210	135.1 Å²	135.1	79%	0.792	71%	0.712	S	S	*	*				158.7	138.8	98.9	-96	154.6	-178.3	-162.5	0.7	116.9
348	N	31.8	Very low	27.5	Very low	135 Å²	135	135.8 Å²	135.8	72%	0.722	72%	0.716	S	S	*	*			trans	66.3	102.6	138.9	-58.6	3.6	0	0	0	123.8
349	S	27.2	Very low	27.4	Very low	104 Å²	104	134.8 Å²	134.8	73%	0.727	72%	0.719	S	S	*	*				35.5	162.5	105.1	68	0	0	0	0	122.8
350	P	34	Very low	27.6	Very low	106 Å²	106	136.1 Å²	136.1	69%	0.688	72%	0.722	S	S	*	*			cis	-142.9	177	-13.9	35	-13.6	0	0	0	117.8
351	S	25.6	Very low	27.7	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	72%	0.719	S	S	*	*			trans	63.3	169.4	143.4	66.5	0	0	0	0	120.9
352	L	28.5	Very low	27.5	Very low	155 Å²	155	137.7 Å²	137.7	81%	0.812	72%	0.72	S	S	*	*			cis	-149.4	-176.1	5.3	-155.9	72.8	0	0	0	111.7
353	T	24.7	Very low	27.5	Very low	101 Å²	101	137.4 Å²	137.4	62%	0.62	72%	0.716	S	S	*	*			trans	-66.5	178.4	173	54.3	0	0	0	0	114.3
354	Q	26.5	Very low	27.7	Very low	157 Å²	157	138.8 Å²	138.8	73%	0.734	72%	0.717	S	S	*	*			cis	-167.5	142.8	39	-124.7	142	8.8	0	0	109.3
355	I	24.5	Very low	27.9	Very low	135 Å²	135	136.7 Å²	136.7	69%	0.692	71%	0.711	S	S	*	*				67.7	127.2	97.1	-58.2	-171.7	0	0	0	118.5
356	H	27.5	Very low	28	Very low	149 Å²	149	139.8 Å²	139.8	69%	0.69	72%	0.718	S	S	*	*			trans	88.7	125.5	153.1	-83.1	6.7	0	0	0	124.8
357	Q	26.1	Very low	28.3	Very low	148 Å²	148	138.8 Å²	138.8	69%	0.692	71%	0.712	S	S	*	*				71.4	123.5	128.9	-66.1	174.1	-4.3	0	0	124
358	N	27.5	Very low	28.4	Very low	135 Å²	135	135 Å²	135	72%	0.722	71%	0.707	S	S	*	*			trans	56.5	115.9	133.4	-61.7	8.2	0	0	0	123.4
359	T	25.7	Very low	28.2	Very low	120 Å²	120	135.9 Å²	135.9	74%	0.736	71%	0.707	S	S	*	*			trans	70.4	129.9	134.2	51.9	0	0	0	0	123.3
360	H	30.3	Very low	28.4	Very low	154 Å²	154	137.3 Å²	137.3	71%	0.713	70%	0.701	S	S	*	*			trans	72.2	116.7	150.1	-75.5	-70.6	0	0	0	122.4
361	H	29.7	Very low	28.1	Very low	153 Å²	153	136.7 Å²	136.7	71%	0.708	69%	0.692	S	S	*	*			trans	84.9	121.8	131.7	-78.1	-47.4	0	0	0	124.3
362	I	26	Very low	28.2	Very low	140 Å²	140	134.6 Å²	134.6	72%	0.718	68%	0.678	S	S	*	*			trans	97.2	100.7	132.2	-67.2	167.4	0	0	0	120.3
363	K	26.6	Very low	28.5	Very low	167 Å²	167	131 Å²	131	73%	0.726	66%	0.664	S	S	*	*			trans	70.8	122.9	131.6	-73.8	-173.5	157.7	-155.6	0	124.7
364	M	29	Very low	28.7	Very low	134 Å²	134	135.6 Å²	135.6	66%	0.66	68%	0.678	S	S	*	*				97.8	113.2	121.4	-76.8	171.7	134.6	0	0	122.6
365	D	29.9	Very low	28.6	Very low	132 Å²	132	136 Å²	136	71%	0.706	68%	0.684	S	S	*	*				104.5	123.5	119.4	-66.9	-5.3	0	0	0	124.7
366	E	33	Very low	28.6	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	68%	0.684	S	S	*	*			trans	82	107.4	139.9	-70.3	-154.1	135.8	0	0	125.5
367	N	32.3	Very low	28.4	Very low	113 Å²	113	135.7 Å²	135.7	60%	0.604	69%	0.691	S	S	*	*				101.5	115.7	112	-70.6	-12.1	0	0	0	125.6
368	L	29.3	Very low	28.5	Very low	131 Å²	131	136.3 Å²	136.3	69%	0.686	70%	0.699	S	S	*	*				87.1	122.6	128	-91.6	69.1	0	0	0	125.1
369	Q	28	Very low	28.4	Very low	152 Å²	152	136.6 Å²	136.6	71%	0.71	70%	0.698	S	S	*	*				103.7	125.2	126.9	-80.7	179.4	-17.3	0	0	125.9
370	H	31.3	Very low	28.5	Very low	134 Å²	134	139.7 Å²	139.7	62%	0.62	70%	0.704	S	S	*	*			trans	63.9	138.1	144.6	-74.2	-64.9	0	0	0	125.1	K473	H370-K473 PolarHBondContact O-NZ 3.27Å
371	D	28.6	Very low	28.3	Very low	93 Å²	93	137.7 Å²	137.7	50%	0.497	71%	0.707	S	S	.	*			trans	35.6	170.3	142.2	-70.6	75.5	0	0	0	124.5	K473	D371-K473 VanDerWaalsContact C-NZ 3.26Å; D371-K473 VanDerWaalsContact CA-CE 3.46Å; D371-K473 VanDerWaalsContact O-CE 3.22Å; D371-K473 WeakPolarHBondContact O-CE 3.44Å; D371-K473 PolarHBondContact O-NZ 2.76Å
372	S	26.9	Very low	28.3	Very low	62 Å²	62	136.1 Å²	136.1	43%	0.434	71%	0.711	S	S	.	*			cis	-157.4	137.9	-49.5	-96.8	0	0	0	0	111.9	S472	S372-S472 WeakPolarHBondContact OG-CB 3.28Å
373	P	35.8	Very low	28.1	Very low	80 Å²	80	136 Å²	136	52%	0.519	72%	0.717	S	S	.	*			trans	-112.2	152.1	-173	39.2	-32.7	0	0	0	116.5
374	Q	29	Very low	28.1	Very low	197 Å²	197	135.4 Å²	135.4	92%	0.921	72%	0.72	S	S	*	*			trans	-128.9	156	177.3	-72	-174.3	-12.3	0	0	114.6
375	L	24.2	Very low	27.9	Very low	165 Å²	165	137.2 Å²	137.2	86%	0.864	73%	0.727	S	S	*	*			trans	-29.3	133.2	169.4	-160.5	76.5	0	0	0	119.2
376	S	23.8	Very low	27.7	Very low	98 Å²	98	140.9 Å²	140.9	69%	0.685	74%	0.737	S	S	*	*				163.9	131.4	129.6	-77.6	0	0	0	0	118
377	Q	23.7	Very low	27.5	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	73%	0.726	S	S	*	*			trans	67.6	172	145.4	-61.3	179.2	1.9	0	0	122.2
378	L	28.5	Very low	27.4	Very low	161 Å²	161	138.1 Å²	138.1	84%	0.843	73%	0.734	S	S	*	*			trans	71.6	123.9	-171.1	-54.4	170.7	0	0	0	115
379	I	23.9	Very low	27.4	Very low	140 Å²	140	141.5 Å²	141.5	72%	0.718	74%	0.739	S	S	*	*			cis	93	126.5	13.2	-40.3	170.3	0	0	0	116.6
380	H	29.3	Very low	27.8	Very low	186 Å²	186	141.8 Å²	141.8	86%	0.861	74%	0.738	S	S	*	*			trans	90.9	154.2	170.7	-67.3	117	0	0	0	121
381	S	25.3	Very low	28.4	Very low	111 Å²	111	138.9 Å²	138.9	78%	0.776	73%	0.731	S	S	*	*			trans	-104.5	169.5	-159.2	-41.3	0	0	0	0	114.2
382	P	29.3	Very low	29	Very low	120 Å²	120	138.7 Å²	138.7	78%	0.779	74%	0.738	S	S	*	*				-147.6	175	98.7	40	-25.6	0	0	0	116.6
383	T	23.5	Very low	29.7	Very low	137 Å²	137	138.8 Å²	138.8	84%	0.84	73%	0.733	S	S	*	*			trans	-84.8	126.9	175.9	47.6	0	0	0	0	113.4
384	I	25.3	Very low	30.2	Very low	155 Å²	155	144.2 Å²	144.2	80%	0.795	75%	0.748	S	S	*	*			trans	-139.6	110.4	155.6	-57.9	-175.8	0	0	0	110.9
385	E	25.1	Very low	31.3	Very low	172 Å²	172	142 Å²	142	80%	0.804	74%	0.74	S	S	*	*			trans	18.5	124.8	148.9	-61.4	173.9	138.5	0	0	122.3
386	F	24.8	Very low	32.5	Very low	210 Å²	210	134.9 Å²	134.9	92%	0.921	70%	0.703	S	S	*	*			trans	22.2	105.2	148.9	-74.7	-86.5	0	0	0	120.3
387	N	29.4	Very low	33.9	Very low	96 Å²	96	132.7 Å²	132.7	51%	0.513	69%	0.687	S	S	.	*			trans	-143	119	154.1	-174	-30.7	0	0	0	109.7	Y389	N387-Y389 PolarHBondContact O-N 2.96Å; N387-Y389 WeakPolarHBondContact OD1-CB 3.42Å; N387-Y389 WeakPolarHBondContact OD1-CD2 3.31Å; N387-Y389 PolarHBondContact OD1-N 3.47Å
388	P	30.1	Very low	35	Very low	119 Å²	119	128.5 Å²	128.5	77%	0.773	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-13	179.6	-25.2	35.4	0	0	0	115.6
389	Y	30.5	Very low	35.9	Very low	203 Å²	203	126.4 Å²	126.4	80%	0.796	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	32.5	-172.3	-60	-80.3	0	0	0	114	N387	N387-Y389 PolarHBondContact O-N 2.96Å; N387-Y389 WeakPolarHBondContact OD1-CB 3.42Å; N387-Y389 WeakPolarHBondContact OD1-CD2 3.31Å; N387-Y389 PolarHBondContact OD1-N 3.47Å
390	K	36.2	Very low	37.1	Very low	158 Å²	158	121.5 Å²	121.5	69%	0.687	63%	0.632	S	S	*	*			trans	-127.6	65.9	-175.8	-105.3	-174.8	177.6	176.2	0	115.2	S392	K390-S392 PolarHBondContact O-N 2.68Å
391	C	42.8	Very low	38.3	Very low	72 Å²	72	116 Å²	116	49%	0.486	61%	0.609	S	S	.	*			trans	-71.3	51.9	166.4	-52.7	0	0	0	0	112.4	L393 C422	C391-L393 PolarHBondContact O-N 3.25Å; C391-C422 HydrophobicContact CB-CB 3.92Å; C391-C422 PolarHBondContact SG-O 3.21Å
392	S	40.7	Very low	39.8	Very low	90 Å²	90	113.2 Å²	113.2	63%	0.629	59%	0.588	S	S	*	*			trans	-83.7	48.1	-170.8	-62.1	0	0	0	0	114	K390 K394	K390-S392 PolarHBondContact O-N 2.68Å; S392-K394 PolarHBondContact O-N 3.23Å
393	L	42.2	Very low	41.1	Very low	64 Å²	64	109.9 Å²	109.9	34%	0.335	56%	0.563	S	S	.	*			trans	-67.4	99.5	166.2	-80.2	160.2	0	0	0	109.1	C391 K418 K419 C422	C391-L393 PolarHBondContact O-N 3.25Å; L393-K418 HydrophobicContact CD1-CB 4.11Å; L393-K419 HydrophobicContact CB-CG 4.46Å; L393-K419 VanDerWaalsContact CD1-CA 3.43Å; L393-K419 HydrophobicContact CD1-CB 3.83Å; L393-K419 HydrophobicContact CD1-CG 4.26Å; L393-C422 HydrophobicContact CD1-CB 4.42Å
394	K	46.3	Very low	42.7	Very low	194 Å²	194	105.8 Å²	105.8	84%	0.843	54%	0.539	S	S	*	.			trans	-50.1	155	163.6	-74.5	-179.3	175.8	176.9	0	109.4	S392 C396	S392-K394 PolarHBondContact O-N 3.23Å; K394-C396 PolarHBondContact O-N 3.04Å; K394-C396 VanDerWaalsContact O-N 3.1Å
395	M	51.8	Low	44.4	Very low	150 Å²	150	99.8 Å²	99.8	74%	0.739	51%	0.509	S	S	*	.			trans	-29.7	113.7	-178.1	-71.3	169	59.9	0	0	112.5
396	C	49.7	Very low	45.9	Very low	15 Å²	15	97.3 Å²	97.3	10%	0.101	51%	0.511	C	S	.	.			trans	-57.7	135.6	170.7	-67.7	0	0	0	0	108.5	K394 C415 L416	K394-C396 PolarHBondContact O-N 3.04Å; K394-C396 VanDerWaalsContact O-N 3.1Å; C396-C415 WeakPolarHBondContact CA-SG 3.36Å; C396-C415 HydrophobicContact CB-CB 3.54Å; C396-C415 WeakPolarHBondContact CB-SG 3.37Å; C396-C415 WeakPolarHBondContact SG-CB 3.27Å; C396-C415 PolarHBondContact SG-O 3Å; C396-C415 VanDerWaalsContact SG-O 3.42Å; C396-C415 CovalentContact SG-SG 2.05Å; C396-C415 PolarHBondContact SG-SG 2.67Å; C396-L416 HydrophobicContact CB-CG 4.14Å
397	P	53.3	Low	47.2	Very low	53 Å²	53	93.5 Å²	93.5	34%	0.344	50%	0.495	S	S	.	.			trans	-61.6	150.8	-179.5	27.8	-35.3	0	0	0	109.7	E399 N413	P397-E399 HydrophobicContact CB-CB 4.23Å; P397-E399 HydrophobicContact CB-CG 4.08Å; P397-E399 HydrophobicContact CG-CB 4.28Å; P397-E399 HydrophobicContact CG-CG 4.44Å; P397-E399 PolarHBondContact O-N 3.43Å; P397-E399 VanDerWaalsContact O-N 3.1Å; P397-N413 PolarHBondContact O-ND2 3.36Å
398	N	47.8	Very low	48.3	Very low	93 Å²	93	90.3 Å²	90.3	50%	0.497	49%	0.485	S	S	.	.	S	Bend	trans	-71.6	3.1	173.8	-63.7	27.9	0	0	0	112.3	L400 L449	N398-L400 PolarHBondContact O-N 3.32Å; N398-L449 HydrophobicContact CB-CB 3.88Å; N398-L449 PolarHBondContact ND2-O 3.46Å
399	E	46.9	Very low	49.6	Very low	116 Å²	116	85.8 Å²	85.8	54%	0.542	46%	0.455	S	S	.	.			trans	-54.7	130.6	167.9	-69.4	-173.7	128.4	0	0	110.6	K238 P397 N413	K238-E399 IonicContact NZ-OE2 2.65Å; K238-E399 PolarHBondContact NZ-OE2 2.71Å; P397-E399 HydrophobicContact CB-CB 4.23Å; P397-E399 HydrophobicContact CB-CG 4.08Å; P397-E399 HydrophobicContact CG-CB 4.28Å; P397-E399 HydrophobicContact CG-CG 4.44Å; P397-E399 PolarHBondContact O-N 3.43Å; P397-E399 VanDerWaalsContact O-N 3.1Å; E399-N413 VanDerWaalsContact O-CB 3.32Å; E399-N413 WeakPolarHBondContact O-CB 3.45Å; E399-N413 PolarHBondContact O-ND2 2.75Å
400	L	48.1	Very low	50.9	Low	38 Å²	38	77.2 Å²	77.2	20%	0.199	42%	0.423	C	S	.	.			trans	-112.1	95.1	-176.3	-103.5	149	0	0	0	111.6	N398 L412 A447 E448 L449 L455	N398-L400 PolarHBondContact O-N 3.32Å; L400-L412 HydrophobicContact CD2-CB 3.84Å; L400-L412 HydrophobicContact CD2-CD2 4.31Å; L400-L412 WeakPolarHBondContact CD2-O 3.47Å; L400-A447 HydrophobicContact CB-CB 3.95Å; L400-A447 HydrophobicContact CD1-CB 3.92Å; L400-A447 VanDerWaalsContact CD1-O 3.26Å; L400-A447 WeakPolarHBondContact CD1-O 3.46Å; L400-A447 HydrophobicContact CD2-CB 4.43Å; L400-A447 HydrophobicContact CG-CB 4.32Å; L400-E448 WeakPolarHBondContact CD1-O 3.27Å; L400-L449 HydrophobicContact CD1-CB 3.79Å; L400-L449 HydrophobicContact CD1-CD1 4.03Å; L400-L449 HydrophobicContact CD1-CG 4.47Å; L400-L449 HydrophobicContact CD2-CD1 4.3Å; L400-L449 HydrophobicContact CG-CB 4.46Å; L400-L449 HydrophobicContact CG-CD1 3.91Å; L400-L455 HydrophobicContact CD1-CD1 3.25Å; L400-L455 HydrophobicContact CD2-CD1 3.34Å; L400-L455 HydrophobicContact CD2-CD2 4.35Å; L400-L455 HydrophobicContact CD2-CG 4.49Å; L400-L455 HydrophobicContact CG-CD1 3.91Å
401	N	54.7	Low	52.3	Low	71 Å²	71	69.8 Å²	69.8	38%	0.38	39%	0.391	S	S	.	.			trans	-128.8	74.5	-178.1	-167.2	14.9	0	0	0	108	W235 I403 L412 N413	W235-N401 VanDerWaalsContact CZ3-ND2 3.34Å; W235-N401 WeakPolarHBondContact CZ3-ND2 3.5Å; N401-I403 VanDerWaalsContact O-CG1 3.31Å; N401-I403 WeakPolarHBondContact O-CG1 3.19Å; N401-I403 PolarHBondContact O-N 2.92Å; N401-L412 CarbonylContact C-O 3.57Å; N401-L412 PolarHBondContact N-O 2.84Å; N401-N413 WeakPolarHBondContact O-CA 3.45Å
402	P	56.6	Low	53.1	Low	52 Å²	52	66.4 Å²	66.4	34%	0.338	37%	0.368	S	S	.	.			trans	-64.4	131.4	-165.4	23.2	-33.5	0	0	0	111.9	I410 Y411 L412	P402-I410 HydrophobicContact CB-CG2 3.69Å; P402-Y411 CarbonylContact C-O 3.41Å; P402-Y411 WeakPolarHBondContact CA-O 3.21Å; P402-L412 WeakPolarHBondContact CA-O 3.05Å
403	I	56.6	Low	54.1	Low	50 Å²	50	62.3 Å²	62.3	26%	0.256	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.3	-178.7	-50.7	-162.4	0	0	0	109	N401 I410 Y411 D414 L417	N401-I403 VanDerWaalsContact O-CG1 3.31Å; N401-I403 WeakPolarHBondContact O-CG1 3.19Å; N401-I403 PolarHBondContact O-N 2.92Å; I403-I410 WeakPolarHBondContact O-CA 3.31Å; I403-Y411 PolarHBondContact N-O 3.48Å; I403-Y411 PolarHBondContact O-N 3.46Å; I403-D414 HydrophobicContact CD1-CB 3.8Å; I403-L417 HydrophobicContact CB-CD2 4.19Å; I403-L417 HydrophobicContact CG2-CD2 3.71Å
404	C	58.4	Low	55.4	Low	51 Å²	51	61 Å²	61	35%	0.345	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	132	168.2	-166.5	0	0	0	0	109.2	T409 C436	C404-T409 WeakPolarHBondContact CA-O 3.49Å; C404-C436 HydrophobicContact CB-CB 4.16Å; C404-C436 WeakPolarHBondContact CB-SG 3.36Å; C404-C436 WeakPolarHBondContact SG-CB 3.46Å; C404-C436 CovalentContact SG-SG 2.03Å; C404-C436 PolarHBondContact SG-SG 3.14Å
405	D	60.1	Low	56.6	Low	28 Å²	28	52.7 Å²	52.7	15%	0.15	30%	0.299	C	S	.	.			trans	-83.1	-179	166.6	67.5	11.2	0	0	0	112.5	E407 G408 T409 Y411 L417	D405-E407 PolarHBondContact O-N 2.91Å; D405-E407 WeakPolarHBondContact OD1-CA 3.24Å; D405-E407 WeakPolarHBondContact OD1-CB 3.45Å; D405-E407 PolarHBondContact OD1-N 3.27Å; D405-G408 PolarHBondContact O-N 2.03Å; D405-G408 PolarHBondContact OD1-N 2.04Å; D405-T409 PolarHBondContact N-O 3.17Å; D405-T409 WeakPolarHBondContact OD1-CB 3.35Å; D405-T409 PolarHBondContact OD1-N 3.02Å; D405-T409 WeakPolarHBondContact OD2-CB 3.4Å; D405-Y411 HydrophobicContact CB-CD2 4.49Å; D405-Y411 HydrophobicContact CB-CE2 3.71Å; D405-Y411 WeakPolarHBondContact OD2-CE2 3.49Å; D405-Y411 VanDerWaalsContact OD2-CZ 3.31Å; D405-Y411 PolarHBondContact OD2-OH 2.84Å; D405-L417 HydrophobicContact CB-CD1 4.02Å
406	S	57.1	Low	57.5	Low	121 Å²	121	46 Å²	46	85%	0.846	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.2	174.5	43	0	0	0	0	114.5
407	E	52.6	Low	58.6	Low	129 Å²	129	46.9 Å²	46.9	60%	0.603	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-7.5	176.8	-56	-170.2	155.6	0	0	112.3	D405	D405-E407 PolarHBondContact O-N 2.91Å; D405-E407 WeakPolarHBondContact OD1-CA 3.24Å; D405-E407 WeakPolarHBondContact OD1-CB 3.45Å; D405-E407 PolarHBondContact OD1-N 3.27Å
408	G	52.1	Low	59.2	Low	29 Å²	29	45.8 Å²	45.8	30%	0.299	26%	0.259	S	S	.	.	S	Bend	trans	86.5	14.7	-175.5	0	0	0	0	0	114	D405 C436	D405-G408 PolarHBondContact O-N 2.03Å; D405-G408 PolarHBondContact OD1-N 2.04Å; G408-C436 PolarHBondContact O-N 3.2Å; G408-C436 PolarHBondContact O-SG 2.99Å
409	T	56.4	Low	60	Low	24 Å²	24	44.2 Å²	44.2	15%	0.147	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-89.5	128.1	177.1	-53.5	0	0	0	0	110.2	C404 D405 Y411 R432	C404-T409 WeakPolarHBondContact CA-O 3.49Å; D405-T409 PolarHBondContact N-O 3.17Å; D405-T409 WeakPolarHBondContact OD1-CB 3.35Å; D405-T409 PolarHBondContact OD1-N 3.02Å; D405-T409 WeakPolarHBondContact OD2-CB 3.4Å; T409-Y411 HydrophobicContact CG2-CE1 4.33Å; T409-Y411 HydrophobicContact CG2-CE2 3.94Å; T409-Y411 WeakPolarHBondContact O-CE2 3.42Å; T409-R432 HydrophobicContact CG2-CB 3.85Å; T409-R432 HydrophobicContact CG2-CG 4.13Å
410	I	58.1	Low	60.9	Low	23 Å²	23	42.3 Å²	42.3	12%	0.118	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.6	172.6	-54.9	173.1	0	0	0	110	P402 I403 I433 C436	P402-I410 HydrophobicContact CB-CG2 3.69Å; I403-I410 WeakPolarHBondContact O-CA 3.31Å; I410-I433 HydrophobicContact CB-CB 4.05Å; I410-I433 HydrophobicContact CD1-CB 4.35Å; I410-I433 HydrophobicContact CD1-CG2 4.15Å; I410-I433 PolarHBondContact N-O 3.3Å; I410-I433 PolarHBondContact O-N 3.37Å; I410-C436 HydrophobicContact CG1-CB 4.31Å; I410-C436 WeakPolarHBondContact CG1-SG 3.36Å
411	Y	65.3	Low	61.5	Low	2 Å²	2	44.7 Å²	44.7	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.1	165.7	-55.2	-91.1	0	0	0	109.3	P402 I403 D405 T409 N413 L417 Y420	P402-Y411 CarbonylContact C-O 3.41Å; P402-Y411 WeakPolarHBondContact CA-O 3.21Å; I403-Y411 PolarHBondContact N-O 3.48Å; I403-Y411 PolarHBondContact O-N 3.46Å; D405-Y411 HydrophobicContact CB-CD2 4.49Å; D405-Y411 HydrophobicContact CB-CE2 3.71Å; D405-Y411 WeakPolarHBondContact OD2-CE2 3.49Å; D405-Y411 VanDerWaalsContact OD2-CZ 3.31Å; D405-Y411 PolarHBondContact OD2-OH 2.84Å; T409-Y411 HydrophobicContact CG2-CE1 4.33Å; T409-Y411 HydrophobicContact CG2-CE2 3.94Å; T409-Y411 WeakPolarHBondContact O-CE2 3.42Å; Y411-N413 PolarHBondContact O-N 2.87Å; Y411-L417 HydrophobicContact CD2-CB 3.93Å; Y411-L417 HydrophobicContact CD2-CD1 3.66Å; Y411-L417 HydrophobicContact CD2-CG 4.34Å; Y411-L417 HydrophobicContact CE2-CD1 3.7Å; Y411-L417 HydrophobicContact CG-CB 3.85Å; Y411-L417 HydrophobicContact CG-CD1 4.31Å; Y411-Y420 AromaticContact CE1-CD1 3.79Å; Y411-Y420 HydrophobicContact CE1-CD1 3.79Å; Y411-Y420 HydrophobicContact CE1-CD2 4.12Å; Y411-Y420 HydrophobicContact CE1-CE1 4.49Å; Y411-Y420 AromaticContact CE1-CG 3.55Å; Y411-Y420 HydrophobicContact CE1-CG 3.55Å; Y411-Y420 AromaticContact CZ-CD1 3.7Å; Y411-Y420 AromaticContact CZ-CG 3.98Å; Y411-Y420 WeakPolarHBondContact OH-CD1 3.04Å; Y411-Y420 WeakPolarHBondContact OH-CE1 3.46Å
412	L	60.8	Low	61.7	Low	1 Å²	1	43.8 Å²	43.8	1%	0.005	26%	0.255	C	S	.	.	S	Bend	trans	-60.2	-30.5	-177	-55.1	-176.9	0	0	0	113.2	L400 N401 P402 L416 P431 I433 L449 G453 L455	L400-L412 HydrophobicContact CD2-CB 3.84Å; L400-L412 HydrophobicContact CD2-CD2 4.31Å; L400-L412 WeakPolarHBondContact CD2-O 3.47Å; N401-L412 CarbonylContact C-O 3.57Å; N401-L412 PolarHBondContact N-O 2.84Å; P402-L412 WeakPolarHBondContact CA-O 3.05Å; L412-L416 HydrophobicContact CB-CD1 3.73Å; L412-L416 HydrophobicContact CD1-CD1 4.3Å; L412-L416 HydrophobicContact CG-CD1 4.3Å; L412-P431 HydrophobicContact CD1-CB 3.81Å; L412-P431 HydrophobicContact CD1-CG 3.47Å; L412-P431 VanDerWaalsContact CD1-CG 3.47Å; L412-P431 HydrophobicContact CG-CB 4.23Å; L412-P431 HydrophobicContact CG-CG 4.01Å; L412-I433 HydrophobicContact CD2-CD1 3.85Å; L412-I433 HydrophobicContact CD2-CG1 4.36Å; L412-L449 HydrophobicContact CB-CD1 3.62Å; L412-L449 HydrophobicContact CD1-CD1 3.53Å; L412-L449 HydrophobicContact CD1-CG 4.15Å; L412-L449 HydrophobicContact CG-CD1 4.23Å; L412-G453 WeakPolarHBondContact CD1-O 3.39Å; L412-L455 HydrophobicContact CD2-CB 4.16Å; L412-L455 HydrophobicContact CD2-CD1 4.33Å; L412-L455 HydrophobicContact CD2-CD2 3.82Å; L412-L455 HydrophobicContact CD2-CG 4.32Å
413	N	61.5	Low	61.6	Low	5 Å²	5	46.3 Å²	46.3	3%	0.027	26%	0.257	C	S	.	.	S	Bend	trans	-154.9	167.4	168.8	59.4	50.5	0	0	0	113.7	P397 E399 N401 Y411 C415 L416 L417	P397-N413 PolarHBondContact O-ND2 3.36Å; E399-N413 VanDerWaalsContact O-CB 3.32Å; E399-N413 WeakPolarHBondContact O-CB 3.45Å; E399-N413 PolarHBondContact O-ND2 2.75Å; N401-N413 WeakPolarHBondContact O-CA 3.45Å; Y411-N413 PolarHBondContact O-N 2.87Å; N413-C415 PolarHBondContact O-N 2.04Å; N413-C415 WeakPolarHBondContact OD1-CB 3.5Å; N413-C415 PolarHBondContact OD1-N 3.3Å; N413-C415 VanDerWaalsContact OD1-N 3.15Å; N413-L416 WeakPolarHBondContact O-CA 3.16Å; N413-L416 WeakPolarHBondContact O-CB 3.29Å; N413-L416 PolarHBondContact O-N 3.41Å; N413-L416 PolarHBondContact OD1-N 2.91Å; N413-L417 PolarHBondContact O-N 3.31Å
414	D	69.4	Low	60.9	Low	37 Å²	37	52.6 Å²	52.6	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-38.6	-45.5	169.6	-177.7	60.1	0	0	0	114.6	I403 K418	I403-D414 HydrophobicContact CD1-CB 3.8Å; D414-K418 VanDerWaalsContact CG-CE 3.45Å; D414-K418 VanDerWaalsContact O-CD 3.31Å; D414-K418 WeakPolarHBondContact O-CD 3.48Å; D414-K418 VanDerWaalsContact O-CG 3.25Å; D414-K418 WeakPolarHBondContact O-CG 3.46Å; D414-K418 PolarHBondContact O-N 2.83Å; D414-K418 VanDerWaalsContact O-N 3.07Å; D414-K418 WeakPolarHBondContact OD1-CE 3.34Å; D414-K418 IonicContact OD1-NZ 3.1Å; D414-K418 PolarHBondContact OD1-NZ 3.45Å; D414-K418 WeakPolarHBondContact OD2-CE 3.41Å; D414-K418 IonicContact OD2-NZ 3.94Å; D414-K418 PolarHBondContact OD2-NZ 3.43Å
415	C	71	Confident	59.6	Low	19 Å²	19	57.7 Å²	57.7	13%	0.128	31%	0.305	C	S	.	.	H	α-helix	trans	-71	-35.8	178.2	175.6	0	0	0	0	112.5	C396 N413 K418 K419	C396-C415 WeakPolarHBondContact CA-SG 3.36Å; C396-C415 HydrophobicContact CB-CB 3.54Å; C396-C415 WeakPolarHBondContact CB-SG 3.37Å; C396-C415 WeakPolarHBondContact SG-CB 3.27Å; C396-C415 PolarHBondContact SG-O 3Å; C396-C415 VanDerWaalsContact SG-O 3.42Å; C396-C415 CovalentContact SG-SG 2.05Å; C396-C415 PolarHBondContact SG-SG 2.67Å; N413-C415 PolarHBondContact O-N 2.04Å; N413-C415 WeakPolarHBondContact OD1-CB 3.5Å; N413-C415 PolarHBondContact OD1-N 3.3Å; N413-C415 VanDerWaalsContact OD1-N 3.15Å; C415-K418 CarbonylContact O-C 3.5Å; C415-K418 PolarHBondContact O-N 3.45Å; C415-K419 WeakPolarHBondContact O-CB 3.32Å; C415-K419 PolarHBondContact O-N 2.94Å
416	L	70.4	Confident	58.4	Low	9 Å²	9	59.1 Å²	59.1	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-70.1	-36.2	177.6	-76.4	161.9	0	0	0	112.1	C396 L412 N413 K419 Y420 L430 P431 L449	C396-L416 HydrophobicContact CB-CG 4.14Å; L412-L416 HydrophobicContact CB-CD1 3.73Å; L412-L416 HydrophobicContact CD1-CD1 4.3Å; L412-L416 HydrophobicContact CG-CD1 4.3Å; N413-L416 WeakPolarHBondContact O-CA 3.16Å; N413-L416 WeakPolarHBondContact O-CB 3.29Å; N413-L416 PolarHBondContact O-N 3.41Å; N413-L416 PolarHBondContact OD1-N 2.91Å; L416-K419 HydrophobicContact CD2-CD 4.34Å; L416-K419 PolarHBondContact O-N 2.91Å; L416-Y420 PolarHBondContact O-N 3.07Å; L416-L430 HydrophobicContact CD2-CD2 4.05Å; L416-P431 HydrophobicContact CD1-CG 4.39Å; L416-L449 HydrophobicContact CD1-CD1 4.1Å
417	L	73.4	Confident	57	Low	34 Å²	34	60.1 Å²	60.1	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-48.7	167.2	171.3	59.8	0	0	0	111.2	I403 D405 Y411 N413 K419 Y420 S421	I403-L417 HydrophobicContact CB-CD2 4.19Å; I403-L417 HydrophobicContact CG2-CD2 3.71Å; D405-L417 HydrophobicContact CB-CD1 4.02Å; Y411-L417 HydrophobicContact CD2-CB 3.93Å; Y411-L417 HydrophobicContact CD2-CD1 3.66Å; Y411-L417 HydrophobicContact CD2-CG 4.34Å; Y411-L417 HydrophobicContact CE2-CD1 3.7Å; Y411-L417 HydrophobicContact CG-CB 3.85Å; Y411-L417 HydrophobicContact CG-CD1 4.31Å; N413-L417 PolarHBondContact O-N 3.31Å; L417-K419 VanDerWaalsContact C-N 3.29Å; L417-K419 PolarHBondContact O-N 3.04Å; L417-Y420 PolarHBondContact O-N 2.84Å; L417-S421 WeakPolarHBondContact O-CB 3.05Å; L417-S421 PolarHBondContact O-N 3.13Å; L417-S421 PolarHBondContact O-OG 3.37Å
418	K	65.3	Low	56.2	Low	30 Å²	30	56.5 Å²	56.5	13%	0.13	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-33.1	177.5	-69	161.9	-170.6	-174.6	0	112.7	D239 L393 D414 C415 S421 C422	D239-K418 VanDerWaalsContact OD1-CD 3.28Å; D239-K418 WeakPolarHBondContact OD1-CD 3.32Å; D239-K418 WeakPolarHBondContact OD1-CE 3.26Å; D239-K418 IonicContact OD1-NZ 3.86Å; D239-K418 PolarHBondContact OD1-NZ 3.34Å; D239-K418 WeakPolarHBondContact OD2-CD 3.43Å; D239-K418 WeakPolarHBondContact OD2-CE 3.4Å; D239-K418 IonicContact OD2-NZ 3.63Å; D239-K418 PolarHBondContact OD2-NZ 2.77Å; L393-K418 HydrophobicContact CD1-CB 4.11Å; D414-K418 VanDerWaalsContact CG-CE 3.45Å; D414-K418 VanDerWaalsContact O-CD 3.31Å; D414-K418 WeakPolarHBondContact O-CD 3.48Å; D414-K418 VanDerWaalsContact O-CG 3.25Å; D414-K418 WeakPolarHBondContact O-CG 3.46Å; D414-K418 PolarHBondContact O-N 2.83Å; D414-K418 VanDerWaalsContact O-N 3.07Å; D414-K418 WeakPolarHBondContact OD1-CE 3.34Å; D414-K418 IonicContact OD1-NZ 3.1Å; D414-K418 PolarHBondContact OD1-NZ 3.45Å; D414-K418 WeakPolarHBondContact OD2-CE 3.41Å; D414-K418 IonicContact OD2-NZ 3.94Å; D414-K418 PolarHBondContact OD2-NZ 3.43Å; C415-K418 CarbonylContact O-C 3.5Å; C415-K418 PolarHBondContact O-N 3.45Å; K418-S421 PolarHBondContact O-N 3.24Å; K418-C422 WeakPolarHBondContact O-CB 3.18Å; K418-C422 PolarHBondContact O-N 3.18Å; K418-C422 PolarHBondContact O-SG 3.17Å
419	K	66.1	Low	55.7	Low	60 Å²	60	62.1 Å²	62.1	26%	0.261	34%	0.344	S	S	.	.	H	α-helix	trans	-73.1	-33.1	177.5	-163.2	-177.4	177.4	-172.6	0	112.4	L393 C415 L416 L417 R423 L430	L393-K419 HydrophobicContact CB-CG 4.46Å; L393-K419 VanDerWaalsContact CD1-CA 3.43Å; L393-K419 HydrophobicContact CD1-CB 3.83Å; L393-K419 HydrophobicContact CD1-CG 4.26Å; C415-K419 WeakPolarHBondContact O-CB 3.32Å; C415-K419 PolarHBondContact O-N 2.94Å; L416-K419 HydrophobicContact CD2-CD 4.34Å; L416-K419 PolarHBondContact O-N 2.91Å; L417-K419 VanDerWaalsContact C-N 3.29Å; L417-K419 PolarHBondContact O-N 3.04Å; K419-R423 WeakPolarHBondContact O-CB 3.46Å; K419-R423 PolarHBondContact O-N 2.95Å; K419-L430 HydrophobicContact CB-CD1 4.01Å; K419-L430 HydrophobicContact CD-CD1 3.89Å; K419-L430 HydrophobicContact CD-CD2 3.89Å; K419-L430 HydrophobicContact CG-CD1 3.79Å
420	Y	64.6	Low	55.4	Low	76 Å²	76	62.2 Å²	62.2	30%	0.298	34%	0.343	S	S	.	.	H	α-helix	trans	-67.5	-51.3	167.5	-175.2	-106.5	0	0	0	110.8	Y411 L416 L417 C422 R423 R432	Y411-Y420 AromaticContact CE1-CD1 3.79Å; Y411-Y420 HydrophobicContact CE1-CD1 3.79Å; Y411-Y420 HydrophobicContact CE1-CD2 4.12Å; Y411-Y420 HydrophobicContact CE1-CE1 4.49Å; Y411-Y420 AromaticContact CE1-CG 3.55Å; Y411-Y420 HydrophobicContact CE1-CG 3.55Å; Y411-Y420 AromaticContact CZ-CD1 3.7Å; Y411-Y420 AromaticContact CZ-CG 3.98Å; Y411-Y420 WeakPolarHBondContact OH-CD1 3.04Å; Y411-Y420 WeakPolarHBondContact OH-CE1 3.46Å; L416-Y420 PolarHBondContact O-N 3.07Å; L417-Y420 PolarHBondContact O-N 2.84Å; Y420-C422 PolarHBondContact O-N 2.94Å; Y420-C422 VanDerWaalsContact O-N 3.09Å; Y420-R423 PolarHBondContact O-N 2.98Å; Y420-R432 PolarHBondContact OH-NH1 3.04Å
421	S	60.7	Low	54.8	Low	87 Å²	87	62.3 Å²	62.3	61%	0.608	35%	0.345	S	S	*	.	H	α-helix	trans	-56.3	-28.6	177	-54.9	0	0	0	0	113.5	L417 K418	L417-S421 WeakPolarHBondContact O-CB 3.05Å; L417-S421 PolarHBondContact O-N 3.13Å; L417-S421 PolarHBondContact O-OG 3.37Å; K418-S421 PolarHBondContact O-N 3.24Å
422	C	58.4	Low	54.1	Low	53 Å²	53	67 Å²	67	36%	0.358	36%	0.363	S	S	.	.	H	α-helix	trans	-76.5	-37.6	171	-74.8	0	0	0	0	114.2	C391 L393 K418 Y420 K424	C391-C422 HydrophobicContact CB-CB 3.92Å; C391-C422 PolarHBondContact SG-O 3.21Å; L393-C422 HydrophobicContact CD1-CB 4.42Å; K418-C422 WeakPolarHBondContact O-CB 3.18Å; K418-C422 PolarHBondContact O-N 3.18Å; K418-C422 PolarHBondContact O-SG 3.17Å; Y420-C422 PolarHBondContact O-N 2.94Å; Y420-C422 VanDerWaalsContact O-N 3.09Å; C422-K424 PolarHBondContact O-N 3.01Å; C422-K424 VanDerWaalsContact O-N 3.07Å
423	R	54.5	Low	53.6	Low	104 Å²	104	69.6 Å²	69.6	39%	0.392	38%	0.376	S	S	.	.			trans	-85.7	75.6	-169.5	-87.8	-177.1	154.7	-161.8	-10.4	112.5	K419 Y420 I425 G428	K419-R423 WeakPolarHBondContact O-CB 3.46Å; K419-R423 PolarHBondContact O-N 2.95Å; Y420-R423 PolarHBondContact O-N 2.98Å; R423-I425 VanDerWaalsContact C-N 3.31Å; R423-G428 PolarHBondContact NH1-O 3.39Å
424	K	43.2	Very low	53	Low	183 Å²	183	77.1 Å²	77.1	80%	0.796	42%	0.415	S	S	*	.	S	Bend	trans	-77.1	-8.8	169.3	-104.2	-180	177.3	175.6	0	115.2	C422	C422-K424 PolarHBondContact O-N 3.01Å; C422-K424 VanDerWaalsContact O-N 3.07Å
425	I	30.4	Very low	51.7	Low	157 Å²	157	77.8 Å²	77.8	81%	0.805	42%	0.422	S	S	*	.	S	Bend	trans	-148	137.6	177.3	-51.4	177.8	0	0	0	109.3	R423	R423-I425 VanDerWaalsContact C-N 3.31Å
426	G	34.4	Very low	50.6	Low	58 Å²	58	77.7 Å²	77.7	60%	0.598	42%	0.421	S	S	*	.			trans	122.7	130.8	162.8	0	0	0	0	0	115.5
427	T	29.2	Very low	49.2	Very low	143 Å²	143	84.8 Å²	84.8	88%	0.877	46%	0.459	S	S	*	.	S	Bend	trans	-62.2	149.5	-177.5	47.5	0	0	0	0	114.4
428	G	35.8	Very low	47.7	Very low	53 Å²	53	85.9 Å²	85.9	55%	0.546	47%	0.47	S	S	.	.	S	Bend	trans	110.9	100.7	174.8	0	0	0	0	0	111.3	R423	R423-G428 PolarHBondContact NH1-O 3.39Å
429	E	41.7	Very low	46.3	Very low	147 Å²	147	90.2 Å²	90.2	69%	0.687	50%	0.499	S	S	*	.			trans	-60	151.8	-175.4	-68	-145.5	96.3	0	0	113.6	R432	E429-R432 IonicContact OE1-CZ 3.73Å; E429-R432 IonicContact OE1-NE 3.88Å; E429-R432 IonicContact OE1-NH2 3.9Å; E429-R432 PolarHBondContact OE1-NH2 3.4Å
430	L	50	Low	45.1	Very low	25 Å²	25	90.1 Å²	90.1	13%	0.131	50%	0.501	C	S	.	.			trans	-105.3	147.3	164	-66.6	169.9	0	0	0	107.2	L416 K419 R432	L416-L430 HydrophobicContact CD2-CD2 4.05Å; K419-L430 HydrophobicContact CB-CD1 4.01Å; K419-L430 HydrophobicContact CD-CD1 3.89Å; K419-L430 HydrophobicContact CD-CD2 3.89Å; K419-L430 HydrophobicContact CG-CD1 3.79Å; L430-R432 WeakPolarHBondContact O-CG 3.48Å; L430-R432 PolarHBondContact O-N 3.47Å
431	P	45.5	Very low	43.8	Very low	25 Å²	25	88.9 Å²	88.9	16%	0.162	50%	0.498	C	S	.	.			trans	-62.2	134.3	-176	26.7	-37.5	0	0	0	112.5	L412 L416 G453	L412-P431 HydrophobicContact CD1-CB 3.81Å; L412-P431 HydrophobicContact CD1-CG 3.47Å; L412-P431 VanDerWaalsContact CD1-CG 3.47Å; L412-P431 HydrophobicContact CG-CB 4.23Å; L412-P431 HydrophobicContact CG-CG 4.01Å; L416-P431 HydrophobicContact CD1-CG 4.39Å; P431-G453 WeakPolarHBondContact CB-O 3.04Å; P431-G453 VanDerWaalsContact CG-CA 3.45Å
432	R	49.7	Very low	42.8	Very low	102 Å²	102	89.3 Å²	89.3	39%	0.385	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.9	174.5	-44	-174.6	-149.5	-143.4	9.1	108.3	T409 Y420 E429 L430	T409-R432 HydrophobicContact CG2-CB 3.85Å; T409-R432 HydrophobicContact CG2-CG 4.13Å; Y420-R432 PolarHBondContact OH-NH1 3.04Å; E429-R432 IonicContact OE1-CZ 3.73Å; E429-R432 IonicContact OE1-NE 3.88Å; E429-R432 IonicContact OE1-NH2 3.9Å; E429-R432 PolarHBondContact OE1-NH2 3.4Å; L430-R432 WeakPolarHBondContact O-CG 3.48Å; L430-R432 PolarHBondContact O-N 3.47Å
433	I	50.8	Low	41.7	Very low	54 Å²	54	91.4 Å²	91.4	28%	0.277	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128	163.8	-61.8	169.3	0	0	0	107.5	I410 L412 S435 L455	I410-I433 HydrophobicContact CB-CB 4.05Å; I410-I433 HydrophobicContact CD1-CB 4.35Å; I410-I433 HydrophobicContact CD1-CG2 4.15Å; I410-I433 PolarHBondContact N-O 3.3Å; I410-I433 PolarHBondContact O-N 3.37Å; L412-I433 HydrophobicContact CD2-CD1 3.85Å; L412-I433 HydrophobicContact CD2-CG1 4.36Å; I433-S435 VanDerWaalsContact C-N 3.26Å; I433-S435 PolarHBondContact O-N 3.09Å; I433-S435 VanDerWaalsContact O-N 3.11Å; I433-L455 HydrophobicContact CD1-CD2 3.51Å
434	I	48.3	Very low	40.9	Very low	164 Å²	164	91.8 Å²	91.8	84%	0.841	49%	0.494	S	S	*	.	S	Bend	trans	-76.4	-3.9	-150.2	-65.8	171.3	0	0	0	114.1
435	S	42.8	Very low	40.9	Very low	51 Å²	51	84 Å²	84	36%	0.357	46%	0.462	S	S	.	.			trans	-161.7	126	175.1	-173.1	0	0	0	0	114	I433 N437 S438	I433-S435 VanDerWaalsContact C-N 3.26Å; I433-S435 PolarHBondContact O-N 3.09Å; I433-S435 VanDerWaalsContact O-N 3.11Å; S435-N437 PolarHBondContact O-N 2.89Å; S435-N437 VanDerWaalsContact OG-CB 3.23Å; S435-N437 WeakPolarHBondContact OG-CB 3.08Å; S435-N437 PolarHBondContact OG-N 2.66Å; S435-S438 PolarHBondContact O-OG 3.46Å
436	C	48.2	Very low	41.6	Very low	16 Å²	16	84.9 Å²	84.9	11%	0.108	46%	0.46	C	S	.	.	S	Bend	trans	-65.9	-13.3	163.6	-53	0	0	0	0	113.1	C404 G408 I410 S438	C404-C436 HydrophobicContact CB-CB 4.16Å; C404-C436 WeakPolarHBondContact CB-SG 3.36Å; C404-C436 WeakPolarHBondContact SG-CB 3.46Å; C404-C436 CovalentContact SG-SG 2.03Å; C404-C436 PolarHBondContact SG-SG 3.14Å; G408-C436 PolarHBondContact O-N 3.2Å; G408-C436 PolarHBondContact O-SG 2.99Å; I410-C436 HydrophobicContact CG1-CB 4.31Å; I410-C436 WeakPolarHBondContact CG1-SG 3.36Å; C436-S438 VanDerWaalsContact C-N 3.26Å; C436-S438 PolarHBondContact O-N 2.85Å
437	N	41.2	Very low	42.4	Very low	159 Å²	159	83.4 Å²	83.4	85%	0.85	44%	0.443	S	S	*	.	S	Bend	trans	-87.7	40.9	-171.3	-143.3	-6.9	0	0	0	113	S435	S435-N437 PolarHBondContact O-N 2.89Å; S435-N437 VanDerWaalsContact OG-CB 3.23Å; S435-N437 WeakPolarHBondContact OG-CB 3.08Å; S435-N437 PolarHBondContact OG-N 2.66Å
438	S	40.4	Very low	43.7	Very low	56 Å²	56	80.1 Å²	80.1	39%	0.392	42%	0.418	S	S	.	.	S	Bend	trans	-144	158.6	-175.6	67.9	0	0	0	0	113.6	S435 C436 L440	S435-S438 PolarHBondContact O-OG 3.46Å; C436-S438 VanDerWaalsContact C-N 3.26Å; C436-S438 PolarHBondContact O-N 2.85Å; S438-L440 PolarHBondContact O-N 3.06Å
439	T	37.4	Very low	44.4	Very low	121 Å²	121	78.8 Å²	78.8	74%	0.742	40%	0.398	S	S	*	.	S	Bend	trans	-74.6	39.3	-157	-30	0	0	0	0	116.5
440	L	41	Very low	45.3	Very low	58 Å²	58	72 Å²	72	30%	0.304	37%	0.366	S	S	.	.			trans	-93.2	-9.9	-159.8	-96	163.5	0	0	0	117.7	S438	S438-L440 PolarHBondContact O-N 3.06Å
441	Q	37.1	Very low	45.2	Very low	51 Å²	51	71.9 Å²	71.9	24%	0.238	37%	0.371	C	S	.	.	S	Bend	trans	-82.9	-17	-177.2	-65.3	101.1	-3.1	0	0	116.2	E292 K294 P295 Y443	E292-Q441 VanDerWaalsContact CB-NE2 3.26Å; E292-Q441 WeakPolarHBondContact O-CG 3.18Å; E292-Q441 PolarHBondContact O-NE2 2.96Å; K294-Q441 HydrophobicContact CG-CB 4.06Å; K294-Q441 HydrophobicContact CG-CG 4.29Å; K294-Q441 WeakPolarHBondContact CG-O 3.36Å; P295-Q441 VanDerWaalsContact CD-O 3.27Å; P295-Q441 WeakPolarHBondContact CD-O 3.02Å; Q441-Y443 VanDerWaalsContact C-N 3.31Å; Q441-Y443 PolarHBondContact O-N 3.47Å
442	K	38	Very low	45.3	Very low	95 Å²	95	75 Å²	75	41%	0.413	39%	0.387	S	S	.	.	S	Bend	trans	-74	-17.3	-163.1	-144.4	-179.4	-172.7	-172.9	0	115.2	L288	L288-K442 HydrophobicContact CD1-CD 4.47Å; L288-K442 VanDerWaalsContact CD1-CE 3.48Å; L288-K442 HydrophobicContact CD1-CG 4.19Å
443	Y	35.7	Very low	45.2	Very low	97 Å²	97	70.9 Å²	70.9	38%	0.38	38%	0.376	S	S	.	.	S	Bend	trans	-114.3	143	165.5	-82.1	-142.7	0	0	0	107.5	Q441 P445 L525 K526	Q441-Y443 VanDerWaalsContact C-N 3.31Å; Q441-Y443 PolarHBondContact O-N 3.47Å; Y443-P445 WeakPolarHBondContact O-CD 3.45Å; Y443-L525 HydrophobicContact CD1-CD1 3.39Å; Y443-L525 HydrophobicContact CD2-CD1 3.5Å; Y443-L525 VanDerWaalsContact CD2-CD1 3.5Å; Y443-L525 HydrophobicContact CD2-CD2 4.19Å; Y443-L525 HydrophobicContact CD2-CG 4.45Å; Y443-L525 HydrophobicContact CE1-CD1 3.51Å; Y443-L525 HydrophobicContact CE2-CD1 3.65Å; Y443-L525 HydrophobicContact CE2-CD2 4.33Å; Y443-L525 HydrophobicContact CE2-CG 4.43Å; Y443-L525 HydrophobicContact CG-CD1 3.36Å; Y443-K526 PolarHBondContact OH-O 3.13Å
444	K	37.6	Very low	45.3	Very low	112 Å²	112	71.9 Å²	71.9	49%	0.487	38%	0.382	S	S	.	.			trans	-83.3	103.2	157.2	-84.4	-170.8	174	-174.2	0	107	K294 P295 M296	K294-K444 HydrophobicContact CB-CG 4.14Å; K294-K444 HydrophobicContact CD-CG 4.21Å; K294-K444 HydrophobicContact CG-CG 4.39Å; P295-K444 WeakPolarHBondContact O-CD 3.48Å; P295-K444 WeakPolarHBondContact O-CE 3.4Å; M296-K444 PolarHBondContact SD-NZ 3.17Å
445	P	44.3	Very low	45.8	Very low	20 Å²	20	65.5 Å²	65.5	13%	0.13	35%	0.349	C	S	.	.			trans	-72.9	143.1	170.4	-0.5	22	0	0	0	106.6	Y443 A447 L457 Y458	Y443-P445 WeakPolarHBondContact O-CD 3.45Å; P445-A447 PolarHBondContact O-N 2.02Å; P445-A447 VanDerWaalsContact O-N 3.12Å; P445-L457 HydrophobicContact CB-CD2 4.44Å; P445-L457 HydrophobicContact CG-CD2 4.21Å; P445-Y458 HydrophobicContact CB-CD1 4.06Å; P445-Y458 HydrophobicContact CB-CE1 4.48Å; P445-Y458 HydrophobicContact CB-CG 4.25Å; P445-Y458 HydrophobicContact CG-CD1 4.38Å; P445-Y458 HydrophobicContact CG-CE1 4.31Å
446	K	45.5	Very low	47	Very low	175 Å²	175	63.1 Å²	63.1	76%	0.761	33%	0.332	S	S	*	.			trans	-63.2	117	153	-87.5	-173.3	178.2	-177.1	0	104.9	L457 Y458 G459	K446-L457 CarbonylContact O-C 3.55Å; K446-Y458 PolarHBondContact O-N 2.84Å; K446-G459 PolarHBondContact O-N 2.89Å
447	A	50.3	Low	47.8	Very low	28 Å²	28	63.7 Å²	63.7	23%	0.231	33%	0.334	C	S	.	.			trans	-119.8	123	-174.1	0	0	0	0	0	106.8	L400 P445 L455 C456 L457	L400-A447 HydrophobicContact CB-CB 3.95Å; L400-A447 HydrophobicContact CD1-CB 3.92Å; L400-A447 VanDerWaalsContact CD1-O 3.26Å; L400-A447 WeakPolarHBondContact CD1-O 3.46Å; L400-A447 HydrophobicContact CD2-CB 4.43Å; L400-A447 HydrophobicContact CG-CB 4.32Å; P445-A447 PolarHBondContact O-N 2.02Å; P445-A447 VanDerWaalsContact O-N 3.12Å; A447-L455 HydrophobicContact CB-CD1 4.24Å; A447-C456 CarbonylContact C-O 3.42Å; A447-C456 VanDerWaalsContact CA-O 3.25Å; A447-C456 WeakPolarHBondContact CA-O 3.43Å; A447-L457 HydrophobicContact CB-CD2 4.1Å
448	E	55.7	Low	49.3	Very low	74 Å²	74	57.4 Å²	57.4	35%	0.346	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.8	-179.6	-142	176.3	90.7	0	0	110.9	L400 C450 C456 K461 C462	L400-E448 WeakPolarHBondContact CD1-O 3.27Å; E448-C450 PolarHBondContact O-N 2.85Å; E448-C456 HydrophobicContact CB-CB 3.97Å; E448-C456 PolarHBondContact N-O 3.11Å; E448-C456 VanDerWaalsContact O-CB 3.3Å; E448-C456 WeakPolarHBondContact O-CB 3.2Å; E448-C456 PolarHBondContact O-N 2.83Å; E448-K461 WeakPolarHBondContact OE1-CA 3.37Å; E448-C462 PolarHBondContact OE1-N 3.12Å; E448-C462 PolarHBondContact OE1-SG 2.98Å
449	L	50.7	Low	50.5	Low	24 Å²	24	55.3 Å²	55.3	13%	0.126	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	93	-168.8	-160.6	116	0	0	0	110.1	N398 L400 L412 L416 C462	N398-L449 HydrophobicContact CB-CB 3.88Å; N398-L449 PolarHBondContact ND2-O 3.46Å; L400-L449 HydrophobicContact CD1-CB 3.79Å; L400-L449 HydrophobicContact CD1-CD1 4.03Å; L400-L449 HydrophobicContact CD1-CG 4.47Å; L400-L449 HydrophobicContact CD2-CD1 4.3Å; L400-L449 HydrophobicContact CG-CB 4.46Å; L400-L449 HydrophobicContact CG-CD1 3.91Å; L412-L449 HydrophobicContact CB-CD1 3.62Å; L412-L449 HydrophobicContact CD1-CD1 3.53Å; L412-L449 HydrophobicContact CD1-CG 4.15Å; L412-L449 HydrophobicContact CG-CD1 4.23Å; L416-L449 HydrophobicContact CD1-CD1 4.1Å; L449-C462 VanDerWaalsContact C-SG 3.5Å
450	C	60.4	Low	52.3	Low	4 Å²	4	49.6 Å²	49.6	3%	0.027	25%	0.252	C	S	.	.			trans	-79.6	165.2	-174.6	6.9	0	0	0	0	111.9	E448 G453 N454 C456 C462	E448-C450 PolarHBondContact O-N 2.85Å; C450-G453 PolarHBondContact O-N 2.76Å; C450-N454 HydrophobicContact CB-CB 4.27Å; C450-N454 PolarHBondContact N-O 2.96Å; C450-N454 PolarHBondContact SG-O 3.34Å; C450-C456 WeakPolarHBondContact CB-SG 3.39Å; C450-C456 WeakPolarHBondContact SG-CB 3.06Å; C450-C456 PolarHBondContact SG-N 2.88Å; C450-C456 CovalentContact SG-SG 2.05Å; C450-C456 PolarHBondContact SG-SG 2.82Å; C450-C462 WeakPolarHBondContact CA-SG 3.41Å; C450-C462 HydrophobicContact CB-CB 4.06Å; C450-C462 PolarHBondContact N-SG 2.84Å
451	G	49	Very low	53.7	Low	23 Å²	23	51.1 Å²	51.1	24%	0.237	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-59.9	156.6	-179.2	0	0	0	0	0	112.8	G453 N454 Y483	G451-G453 PolarHBondContact O-N 3.1Å; G451-N454 PolarHBondContact O-N 2.87Å; G451-Y483 CarbonylContact C-O 3.58Å; G451-Y483 WeakPolarHBondContact CA-O 3.3Å; G451-Y483 PolarHBondContact N-O 2.65Å
452	N	47.2	Very low	55.2	Low	92 Å²	92	49.8 Å²	49.8	49%	0.492	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	57.6	10	-172.3	-60.2	-1.5	0	0	0	114.6	P481	N452-P481 VanDerWaalsContact CG-O 3.3Å; N452-P481 PolarHBondContact ND2-O 3.28Å; N452-P481 WeakPolarHBondContact OD1-CA 3.04Å; N452-P481 VanDerWaalsContact OD1-CB 3.3Å; N452-P481 WeakPolarHBondContact OD1-CB 3.32Å; N452-P481 PolarHBondContact OD1-O 3.35Å
453	G	47.5	Very low	56.4	Low	15 Å²	15	50.7 Å²	50.7	16%	0.155	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	88	10	178.8	0	0	0	0	0	114.2	L412 P431 C450 G451	L412-G453 WeakPolarHBondContact CD1-O 3.39Å; P431-G453 WeakPolarHBondContact CB-O 3.04Å; P431-G453 VanDerWaalsContact CG-CA 3.45Å; C450-G453 PolarHBondContact O-N 2.76Å; G451-G453 PolarHBondContact O-N 3.1Å
454	N	53.1	Low	57.3	Low	74 Å²	74	50.4 Å²	50.4	40%	0.396	26%	0.258	S	S	.	.			trans	-62	150.8	172	-72.6	6.9	0	0	0	110.1	C450 G451 S484	C450-N454 HydrophobicContact CB-CB 4.27Å; C450-N454 PolarHBondContact N-O 2.96Å; C450-N454 PolarHBondContact SG-O 3.34Å; G451-N454 PolarHBondContact O-N 2.87Å; N454-S484 WeakPolarHBondContact CB-O 3.48Å; N454-S484 WeakPolarHBondContact ND2-CB 3.02Å; N454-S484 PolarHBondContact ND2-O 3.12Å
455	L	59.1	Low	57.8	Low	31 Å²	31	47.9 Å²	47.9	16%	0.162	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.3	-175.5	179.3	57.3	0	0	0	110.8	L400 L412 I433 A447 L457 Q523	L400-L455 HydrophobicContact CD1-CD1 3.25Å; L400-L455 HydrophobicContact CD2-CD1 3.34Å; L400-L455 HydrophobicContact CD2-CD2 4.35Å; L400-L455 HydrophobicContact CD2-CG 4.49Å; L400-L455 HydrophobicContact CG-CD1 3.91Å; L412-L455 HydrophobicContact CD2-CB 4.16Å; L412-L455 HydrophobicContact CD2-CD1 4.33Å; L412-L455 HydrophobicContact CD2-CD2 3.82Å; L412-L455 HydrophobicContact CD2-CG 4.32Å; I433-L455 HydrophobicContact CD1-CD2 3.51Å; A447-L455 HydrophobicContact CB-CD1 4.24Å; L455-L457 HydrophobicContact CD1-CD2 4.33Å; L455-L457 HydrophobicContact CD2-CD1 4.41Å; L455-L457 HydrophobicContact CD2-CD2 3.38Å; L455-L457 HydrophobicContact CD2-CG 3.81Å; L455-L457 HydrophobicContact CG-CD2 3.7Å; L455-L457 HydrophobicContact CG-CG 3.82Å; L455-L457 PolarHBondContact O-N 3.05Å; L455-L457 VanDerWaalsContact O-N 3.15Å; L455-Q523 PolarHBondContact O-OE1 2.77Å; L455-Q523 VanDerWaalsContact O-OE1 3.1Å
456	C	66.8	Low	57.8	Low	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	80.5	-179.5	-63	0	0	0	0	108.4	A447 E448 C450 G460 K461 C486	A447-C456 CarbonylContact C-O 3.42Å; A447-C456 VanDerWaalsContact CA-O 3.25Å; A447-C456 WeakPolarHBondContact CA-O 3.43Å; E448-C456 HydrophobicContact CB-CB 3.97Å; E448-C456 PolarHBondContact N-O 3.11Å; E448-C456 VanDerWaalsContact O-CB 3.3Å; E448-C456 WeakPolarHBondContact O-CB 3.2Å; E448-C456 PolarHBondContact O-N 2.83Å; C450-C456 WeakPolarHBondContact CB-SG 3.39Å; C450-C456 WeakPolarHBondContact SG-CB 3.06Å; C450-C456 PolarHBondContact SG-N 2.88Å; C450-C456 CovalentContact SG-SG 2.05Å; C450-C456 PolarHBondContact SG-SG 2.82Å; C456-G460 WeakPolarHBondContact CB-O 3.06Å; C456-K461 PolarHBondContact SG-O 3.05Å; C456-K461 VanDerWaalsContact SG-O 3.41Å; C456-C486 HydrophobicContact CB-CB 4.12Å; C456-C486 PolarHBondContact SG-SG 3Å
457	L	66.2	Low	57.6	Low	28 Å²	28	51.4 Å²	51.4	15%	0.147	28%	0.279	C	S	.	.			trans	-73.5	175.7	179.1	-66.8	178.9	0	0	0	112.7	P445 K446 A447 L455 G459 G460 Q523	P445-L457 HydrophobicContact CB-CD2 4.44Å; P445-L457 HydrophobicContact CG-CD2 4.21Å; K446-L457 CarbonylContact O-C 3.55Å; A447-L457 HydrophobicContact CB-CD2 4.1Å; L455-L457 HydrophobicContact CD1-CD2 4.33Å; L455-L457 HydrophobicContact CD2-CD1 4.41Å; L455-L457 HydrophobicContact CD2-CD2 3.38Å; L455-L457 HydrophobicContact CD2-CG 3.81Å; L455-L457 HydrophobicContact CG-CD2 3.7Å; L455-L457 HydrophobicContact CG-CG 3.82Å; L455-L457 PolarHBondContact O-N 3.05Å; L455-L457 VanDerWaalsContact O-N 3.15Å; L457-G459 PolarHBondContact O-N 3.08Å; L457-G460 PolarHBondContact O-N 3.18Å; L457-Q523 VanDerWaalsContact CB-OE1 3.3Å; L457-Q523 PolarHBondContact O-NE2 3.2Å
458	Y	72.5	Confident	57.1	Low	27 Å²	27	58.7 Å²	58.7	11%	0.106	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	16	160.5	-67.9	-69.1	0	0	0	117.4	P445 K446 I519 Q523 L525	P445-Y458 HydrophobicContact CB-CD1 4.06Å; P445-Y458 HydrophobicContact CB-CE1 4.48Å; P445-Y458 HydrophobicContact CB-CG 4.25Å; P445-Y458 HydrophobicContact CG-CD1 4.38Å; P445-Y458 HydrophobicContact CG-CE1 4.31Å; K446-Y458 PolarHBondContact O-N 2.84Å; Y458-I519 WeakPolarHBondContact CB-O 3.46Å; Y458-I519 HydrophobicContact CD1-CG2 3.43Å; Y458-I519 VanDerWaalsContact CD1-CG2 3.43Å; Y458-I519 HydrophobicContact CE1-CG2 4.32Å; Y458-I519 HydrophobicContact CG-CG2 3.82Å; Y458-Q523 WeakPolarHBondContact CD2-O 3.11Å; Y458-Q523 VanDerWaalsContact CE2-C 3.43Å; Y458-Q523 WeakPolarHBondContact CE2-O 3.42Å; Y458-L525 HydrophobicContact CE1-CB 4.3Å; Y458-L525 HydrophobicContact CE1-CD1 3.91Å
459	G	66.5	Low	56	Low	13 Å²	13	64.1 Å²	64.1	13%	0.134	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	119.2	-20.8	-175.9	0	0	0	0	0	112.8	K446 L457 H490	K446-G459 PolarHBondContact O-N 2.89Å; L457-G459 PolarHBondContact O-N 3.08Å; G459-H490 PolarHBondContact O-CE1 2.77Å; G459-H490 PolarHBondContact O-NE2 2.77Å
460	G	73.3	Confident	55.3	Low	1 Å²	1	72.4 Å²	72.4	1%	0.01	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-59.1	136.9	-174.9	0	0	0	0	0	112.4	C456 L457 C520	C456-G460 WeakPolarHBondContact CB-O 3.06Å; L457-G460 PolarHBondContact O-N 3.18Å; G460-C520 WeakPolarHBondContact CA-SG 3.44Å; G460-C520 PolarHBondContact N-SG 3.04Å
461	K	71.5	Confident	53.7	Low	89 Å²	89	83.3 Å²	83.3	39%	0.387	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	164.4	167.1	-64.8	177.7	179.4	-179.8	0	110.2	E448 C456 C486 I487	E448-K461 WeakPolarHBondContact OE1-CA 3.37Å; C456-K461 PolarHBondContact SG-O 3.05Å; C456-K461 VanDerWaalsContact SG-O 3.41Å; K461-C486 CarbonylContact O-C 3.58Å; K461-C486 WeakPolarHBondContact O-CA 3.34Å; K461-I487 HydrophobicContact CB-CD1 4.5Å; K461-I487 HydrophobicContact CB-CG1 4.05Å; K461-I487 PolarHBondContact N-O 3.42Å; K461-I487 WeakPolarHBondContact O-CG1 3.34Å; K461-I487 PolarHBondContact O-N 2.04Å
462	C	67.5	Low	52.7	Low	24 Å²	24	86.4 Å²	86.4	16%	0.162	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.5	168.2	-48	0	0	0	0	109.7	E448 L449 C450 D464	E448-C462 PolarHBondContact OE1-N 3.12Å; E448-C462 PolarHBondContact OE1-SG 2.98Å; L449-C462 VanDerWaalsContact C-SG 3.5Å; C450-C462 WeakPolarHBondContact CA-SG 3.41Å; C450-C462 HydrophobicContact CB-CB 4.06Å; C450-C462 PolarHBondContact N-SG 2.84Å; C462-D464 PolarHBondContact O-N 3.44Å; C462-D464 VanDerWaalsContact O-N 3.15Å
463	Y	64.1	Low	51.9	Low	114 Å²	114	87.5 Å²	87.5	45%	0.447	42%	0.416	S	S	.	.			trans	-68.8	107.1	166.4	-178.7	-106.9	0	0	0	110.4	P465 N485 I487	Y463-P465 HydrophobicContact CD1-CG 4.38Å; Y463-P465 HydrophobicContact CE1-CB 3.72Å; Y463-P465 HydrophobicContact CE1-CG 3.94Å; Y463-P465 WeakPolarHBondContact O-CD 3.49Å; Y463-N485 PolarHBondContact N-O 3.04Å; Y463-I487 HydrophobicContact CD2-CG2 4.04Å
464	D	54.2	Low	51	Low	90 Å²	90	94.2 Å²	94.2	48%	0.481	45%	0.446	S	S	.	.			trans	-105.8	101.5	171	-168.4	-17	0	0	0	110	C462 L466 D467	C462-D464 PolarHBondContact O-N 3.44Å; C462-D464 VanDerWaalsContact O-N 3.15Å; D464-L466 PolarHBondContact O-N 2.93Å; D464-L466 VanDerWaalsContact O-N 3.1Å; D464-L466 VanDerWaalsContact OD1-CB 3.31Å; D464-L466 WeakPolarHBondContact OD1-CB 3.28Å; D464-L466 PolarHBondContact OD1-N 2.04Å; D464-D467 PolarHBondContact O-N 2.86Å
465	P	47.6	Very low	49.8	Very low	59 Å²	59	98 Å²	98	38%	0.383	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	2.3	179.4	26.9	-31.3	0	0	0	114.3	Y463 Y483	Y463-P465 HydrophobicContact CD1-CG 4.38Å; Y463-P465 HydrophobicContact CE1-CB 3.72Å; Y463-P465 HydrophobicContact CE1-CG 3.94Å; Y463-P465 WeakPolarHBondContact O-CD 3.49Å; P465-Y483 HydrophobicContact CG-CD1 3.93Å; P465-Y483 HydrophobicContact CG-CE1 3.41Å; P465-Y483 VanDerWaalsContact CG-CE1 3.41Å
466	L	44.8	Very low	48.4	Very low	118 Å²	118	103.3 Å²	103.3	62%	0.618	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-14.1	176	-59.5	170.5	0	0	0	113.3	D464 H468 Y469	D464-L466 PolarHBondContact O-N 2.93Å; D464-L466 VanDerWaalsContact O-N 3.1Å; D464-L466 VanDerWaalsContact OD1-CB 3.31Å; D464-L466 WeakPolarHBondContact OD1-CB 3.28Å; D464-L466 PolarHBondContact OD1-N 2.04Å; L466-H468 PolarHBondContact O-N 3.27Å; L466-Y469 PolarHBondContact O-N 3.28Å
467	D	42	Very low	46.7	Very low	152 Å²	152	112 Å²	112	81%	0.813	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	14.6	-174.7	-155.3	30.3	0	0	0	114.4	D464	D464-D467 PolarHBondContact O-N 2.86Å
468	H	39.6	Very low	45	Very low	181 Å²	181	120.3 Å²	120.3	84%	0.838	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	-1.2	176.7	-145.4	-60	0	0	0	114.9	L466	L466-H468 PolarHBondContact O-N 3.27Å
469	Y	33.5	Very low	43	Very low	187 Å²	187	125.4 Å²	125.4	73%	0.733	59%	0.591	S	S	*	*	S	Bend	trans	-151.7	106.7	174.3	-151.1	-101.4	0	0	0	114.8	L466	L466-Y469 PolarHBondContact O-N 3.28Å
470	Y	34	Very low	41.2	Very low	199 Å²	199	129.9 Å²	129.9	78%	0.78	61%	0.611	S	S	*	*			trans	65.9	121.7	162.9	-85.9	-96.1	0	0	0	121.2
471	R	28.8	Very low	39.1	Very low	232 Å²	232	134.4 Å²	134.4	88%	0.875	64%	0.64	S	S	*	*			trans	-56.7	150.8	159.4	-69.9	168	162.2	161.6	-7.5	111.9
472	S	26.9	Very low	37.2	Very low	88 Å²	88	135.7 Å²	135.7	62%	0.615	65%	0.651	S	S	*	*			trans	105.8	154.3	148.8	-59.7	0	0	0	0	119.4	S372	S372-S472 WeakPolarHBondContact OG-CB 3.28Å
473	K	30.8	Very low	36.4	Very low	115 Å²	115	139.1 Å²	139.1	50%	0.5	66%	0.661	S	S	.	*			trans	55.5	106.3	-178	-94	-176.7	170	173.1	0	118.8	H370 D371	H370-K473 PolarHBondContact O-NZ 3.27Å; D371-K473 VanDerWaalsContact C-NZ 3.26Å; D371-K473 VanDerWaalsContact CA-CE 3.46Å; D371-K473 VanDerWaalsContact O-CE 3.22Å; D371-K473 WeakPolarHBondContact O-CE 3.44Å; D371-K473 PolarHBondContact O-NZ 2.76Å
474	M	27.7	Very low	35.8	Very low	157 Å²	157	136.2 Å²	136.2	77%	0.773	66%	0.657	S	S	*	*			trans	-57.2	134	163.2	-50.3	171	-173.5	0	0	111.3
475	I	28.5	Very low	36.2	Very low	153 Å²	153	136.4 Å²	136.4	79%	0.785	66%	0.658	S	S	*	*			trans	-162.4	-43.7	152.2	-103.9	146.6	0	0	0	111.6	K477	I475-K477 PolarHBondContact O-N 2.7Å
476	M	29.3	Very low	37.3	Very low	142 Å²	142	135.7 Å²	135.7	70%	0.7	65%	0.654	S	S	*	*			trans	-78.1	27.2	-172.3	-70.6	-64.2	-82.8	0	0	116.4	K478	M476-K478 VanDerWaalsContact C-N 3.34Å; M476-K478 PolarHBondContact O-N 3.01Å
477	K	31.8	Very low	38.9	Very low	182 Å²	182	131.9 Å²	131.9	79%	0.791	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	35.8	-172.6	-150.2	167.2	-170.9	167.1	0	114.5	I475	I475-K477 PolarHBondContact O-N 2.7Å
478	K	29.7	Very low	40.8	Very low	203 Å²	203	124.9 Å²	124.9	88%	0.883	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.9	-0.2	-169.8	-132.8	-180	-176.5	-175.9	0	116.1	M476	M476-K478 VanDerWaalsContact C-N 3.34Å; M476-K478 PolarHBondContact O-N 3.01Å
479	I	30.9	Very low	42.2	Very low	135 Å²	135	121.4 Å²	121.4	69%	0.692	58%	0.581	S	S	*	*	S	Bend	trans	-140.8	158.6	179.5	-49.8	179.2	0	0	0	106.2
480	L	28.8	Very low	44	Very low	106 Å²	106	116 Å²	116	56%	0.555	56%	0.562	S	S	*	*			trans	79.3	103.2	179.8	-54.8	158.8	0	0	0	116.1	L482	L480-L482 HydrophobicContact CD2-CD1 3.96Å
481	P	29.2	Very low	46	Very low	96 Å²	96	108 Å²	108	62%	0.623	53%	0.532	S	S	*	.			trans	-100.6	83.6	161.6	36.1	-26	0	0	0	109.7	N452	N452-P481 VanDerWaalsContact CG-O 3.3Å; N452-P481 PolarHBondContact ND2-O 3.28Å; N452-P481 WeakPolarHBondContact OD1-CA 3.04Å; N452-P481 VanDerWaalsContact OD1-CB 3.3Å; N452-P481 WeakPolarHBondContact OD1-CB 3.32Å; N452-P481 PolarHBondContact OD1-O 3.35Å
482	L	31.6	Very low	48.2	Very low	117 Å²	117	103.2 Å²	103.2	61%	0.613	52%	0.524	S	S	*	.			trans	-150.2	58.5	-169.7	-71.3	179	0	0	0	115.1	L480	L480-L482 HydrophobicContact CD2-CD1 3.96Å
483	Y	50.4	Low	50.5	Low	95 Å²	95	100 Å²	100	37%	0.373	50%	0.501	S	S	.	.			trans	-138.1	74.9	171.7	-58.6	-58.2	0	0	0	112.5	G451 P465	G451-Y483 CarbonylContact C-O 3.58Å; G451-Y483 WeakPolarHBondContact CA-O 3.3Å; G451-Y483 PolarHBondContact N-O 2.65Å; P465-Y483 HydrophobicContact CG-CD1 3.93Å; P465-Y483 HydrophobicContact CG-CE1 3.41Å; P465-Y483 VanDerWaalsContact CG-CE1 3.41Å
484	S	52.1	Low	52.6	Low	53 Å²	53	100.3 Å²	100.3	37%	0.371	51%	0.508	S	S	.	.			trans	-84.3	-14.9	-166	47.6	0	0	0	0	117	N454	N454-S484 WeakPolarHBondContact CB-O 3.48Å; N454-S484 WeakPolarHBondContact ND2-CB 3.02Å; N454-S484 PolarHBondContact ND2-O 3.12Å
485	N	62.4	Low	54.2	Low	95 Å²	95	96.8 Å²	96.8	51%	0.508	49%	0.492	S	S	.	.			trans	-103.5	143.2	-157.7	-64	7.6	0	0	0	113.8	Y463	Y463-N485 PolarHBondContact N-O 3.04Å
486	C	70.8	Confident	55.6	Low	43 Å²	43	94.9 Å²	94.9	29%	0.291	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	129.5	174.1	-43.9	0	0	0	0	109.6	C456 K461	C456-C486 HydrophobicContact CB-CB 4.12Å; C456-C486 PolarHBondContact SG-SG 3Å; K461-C486 CarbonylContact O-C 3.58Å; K461-C486 WeakPolarHBondContact O-CA 3.34Å
487	I	78.7	Confident	57	Low	39 Å²	39	97.9 Å²	97.9	20%	0.2	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129	178	50.7	166	0	0	0	112.6	K461 Y463	K461-I487 HydrophobicContact CB-CD1 4.5Å; K461-I487 HydrophobicContact CB-CG1 4.05Å; K461-I487 PolarHBondContact N-O 3.42Å; K461-I487 WeakPolarHBondContact O-CG1 3.34Å; K461-I487 PolarHBondContact O-N 2.04Å; Y463-I487 HydrophobicContact CD2-CG2 4.04Å
488	C	80.9	Confident	58.6	Low	4 Å²	4	93.1 Å²	93.1	3%	0.027	48%	0.475	C	S	.	.			trans	-101.7	-1.8	177.1	-61	0	0	0	0	113.2	H490 I491 C520 E521	C488-H490 PolarHBondContact O-N 2.83Å; C488-I491 WeakPolarHBondContact O-CB 3.47Å; C488-I491 PolarHBondContact O-N 3.42Å; C488-C520 HydrophobicContact CB-CB 3.98Å; C488-C520 WeakPolarHBondContact CB-SG 3.41Å; C488-C520 WeakPolarHBondContact SG-CB 3.45Å; C488-C520 CovalentContact SG-SG 2.04Å; C488-C520 PolarHBondContact SG-SG 3.44Å; C488-E521 HydrophobicContact CB-CG 4.09Å; C488-E521 PolarHBondContact SG-N 2.66Å
489	E	70.2	Confident	60.7	Low	109 Å²	109	86.8 Å²	86.8	51%	0.509	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-14.1	-175.1	-60.2	-175.2	126.1	0	0	116.1	N492	E489-N492 PolarHBondContact O-OD1 3.07Å
490	H	71.5	Confident	63	Low	73 Å²	73	81.9 Å²	81.9	34%	0.338	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.8	176.2	71.3	-80.6	0	0	0	113.5	G459 C488 N492	G459-H490 PolarHBondContact O-CE1 2.77Å; G459-H490 PolarHBondContact O-NE2 2.77Å; C488-H490 PolarHBondContact O-N 2.83Å; H490-N492 VanDerWaalsContact C-N 3.31Å; H490-N492 PolarHBondContact O-N 2.85Å
491	I	74.1	Confident	65.3	Low	31 Å²	31	77 Å²	77	16%	0.159	40%	0.402	C	S	.	.			trans	-90.9	70.6	176.1	-53.4	178.7	0	0	0	108	C488 C493 R517 C520	C488-I491 WeakPolarHBondContact O-CB 3.47Å; C488-I491 PolarHBondContact O-N 3.42Å; I491-C493 PolarHBondContact O-N 2.78Å; I491-R517 HydrophobicContact CB-CG 4.06Å; I491-R517 HydrophobicContact CG2-CB 4.06Å; I491-R517 HydrophobicContact CG2-CG 3.98Å; I491-C520 HydrophobicContact CD1-CB 3.55Å
492	N	75.4	Confident	67.8	Low	132 Å²	132	72.5 Å²	72.5	71%	0.706	37%	0.373	S	S	*	.			trans	-72.2	108.3	177.8	-72.6	-24.4	0	0	0	110.3	E489 H490	E489-N492 PolarHBondContact O-OD1 3.07Å; H490-N492 VanDerWaalsContact C-N 3.31Å; H490-N492 PolarHBondContact O-N 2.85Å
493	C	76.3	Confident	69.9	Low	19 Å²	19	67 Å²	67	13%	0.128	34%	0.344	C	S	.	.			trans	-100.5	128.2	174.2	-61.6	0	0	0	0	110.5	I491 C513 F514	I491-C493 PolarHBondContact O-N 2.78Å; C493-C513 WeakPolarHBondContact CA-SG 3.28Å; C493-C513 HydrophobicContact CB-CB 3.69Å; C493-C513 WeakPolarHBondContact CB-SG 3.42Å; C493-C513 WeakPolarHBondContact SG-CB 3.49Å; C493-C513 PolarHBondContact SG-O 2.89Å; C493-C513 VanDerWaalsContact SG-O 3.36Å; C493-C513 CovalentContact SG-SG 2.04Å; C493-C513 PolarHBondContact SG-SG 3.22Å; C493-F514 HydrophobicContact CB-CD1 4.19Å; C493-F514 HydrophobicContact CB-CD2 3.95Å; C493-F514 HydrophobicContact CB-CE1 3.88Å; C493-F514 HydrophobicContact CB-CE2 3.63Å; C493-F514 HydrophobicContact CB-CG 4.22Å; C493-F514 HydrophobicContact CB-CZ 3.58Å
494	L	74.7	Confident	70.8	Confident	122 Å²	122	65.8 Å²	65.8	64%	0.639	34%	0.344	S	S	*	.			trans	-88.7	141.5	174.8	-65.4	170.3	0	0	0	110.1	D496 N511	L494-D496 VanDerWaalsContact C-N 3.27Å; L494-N511 PolarHBondContact O-ND2 2.87Å
495	N	60.5	Low	71.7	Confident	84 Å²	84	66.3 Å²	66.3	45%	0.449	34%	0.343	S	S	.	.	S	Bend	trans	-80.8	-4.5	175.5	-74.1	-38	0	0	0	113.2	W497 F514	N495-W497 PolarHBondContact O-N 3.12Å; N495-F514 WeakPolarHBondContact OD1-CE2 3.1Å; N495-F514 WeakPolarHBondContact OD1-CZ 3.31Å
496	D	59	Low	72	Confident	113 Å²	113	63.2 Å²	63.2	60%	0.604	33%	0.334	S	S	*	.	S	Bend	trans	-64.4	-10.8	-172.7	-51.9	-40.3	0	0	0	114.9	L494	L494-D496 VanDerWaalsContact C-N 3.27Å
497	W	58.7	Low	72.4	Confident	205 Å²	205	62.7 Å²	62.7	78%	0.777	33%	0.327	S	S	*	.			trans	-137.9	89.4	-177.9	-61.3	85.8	0	0	0	111.3	N495 D499 N511	N495-W497 PolarHBondContact O-N 3.12Å; W497-D499 PolarHBondContact O-N 3.41Å; W497-D499 VanDerWaalsContact O-N 3.08Å; W497-N511 VanDerWaalsContact O-CB 3.31Å; W497-N511 WeakPolarHBondContact O-CB 3.33Å; W497-N511 PolarHBondContact O-ND2 3.12Å
498	P	65.6	Low	72.5	Confident	82 Å²	82	60.8 Å²	60.8	53%	0.532	32%	0.317	S	S	.	.			trans	-76.6	86.2	168.6	30.7	-32.8	0	0	0	110.2	P500	P498-P500 VanDerWaalsContact O-CD 3.25Å; P498-P500 WeakPolarHBondContact O-CD 3.4Å
499	D	73.4	Confident	72.7	Confident	70 Å²	70	61.4 Å²	61.4	37%	0.374	32%	0.319	S	S	.	.			trans	-101.1	89.7	165.2	-179.9	23.7	0	0	0	108.3	W497 N511 R531	W497-D499 PolarHBondContact O-N 3.41Å; W497-D499 VanDerWaalsContact O-N 3.08Å; D499-N511 WeakPolarHBondContact O-CA 3.28Å; D499-R531 VanDerWaalsContact CG-NH1 3.27Å; D499-R531 IonicContact OD1-CZ 3.19Å; D499-R531 IonicContact OD1-NH1 3.83Å; D499-R531 PolarHBondContact OD1-NH1 3.12Å; D499-R531 IonicContact OD2-CZ 3.82Å; D499-R531 IonicContact OD2-NH1 2.93Å; D499-R531 PolarHBondContact OD2-NH1 2.88Å
500	P	78.7	Confident	73.2	Confident	31 Å²	31	56.6 Å²	56.6	20%	0.201	30%	0.297	C	S	.	.			trans	-67.4	132.2	-162.3	26.3	-37.5	0	0	0	113.5	P498 R531 G532 T1145 H1146	P498-P500 VanDerWaalsContact O-CD 3.25Å; P498-P500 WeakPolarHBondContact O-CD 3.4Å; P500-R531 CarbonylContact O-C 3.39Å; P500-R531 WeakPolarHBondContact O-CA 2.99Å; P500-R531 WeakPolarHBondContact O-CB 3.37Å; P500-G532 PolarHBondContact O-N 2.57Å; P500-T1145 HydrophobicContact CB-CG2 4.06Å; P500-T1145 WeakPolarHBondContact CB-OG1 3.44Å; P500-T1145 HydrophobicContact CG-CG2 4.45Å; P500-H1146 VanDerWaalsContact C-CD2 3.47Å; P500-H1146 WeakPolarHBondContact CA-CD2 3.48Å; P500-H1146 WeakPolarHBondContact CA-NE2 3.14Å; P500-H1146 WeakPolarHBondContact CB-CD2 3.36Å; P500-H1146 WeakPolarHBondContact CB-NE2 3.46Å
501	V	78.1	Confident	73.6	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.024	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	112.4	173.7	-62.2	0	0	0	0	115.1	Y509 L515 I528 R531 H1146	V501-Y509 PolarHBondContact N-O 2.94Å; V501-Y509 PolarHBondContact O-N 2.73Å; V501-Y509 VanDerWaalsContact O-N 3.15Å; V501-L515 HydrophobicContact CG2-CB 4.23Å; V501-L515 HydrophobicContact CG2-CD2 4.14Å; V501-I528 HydrophobicContact CB-CD1 3.99Å; V501-I528 HydrophobicContact CB-CG1 4.02Å; V501-I528 HydrophobicContact CB-CG2 4.08Å; V501-I528 HydrophobicContact CG1-CD1 3.84Å; V501-I528 HydrophobicContact CG1-CG1 4.41Å; V501-I528 HydrophobicContact CG1-CG2 4.36Å; V501-I528 HydrophobicContact CG2-CD1 4.4Å; V501-I528 HydrophobicContact CG2-CG1 4.44Å; V501-R531 HydrophobicContact CG1-CG 4.44Å; V501-H1146 WeakPolarHBondContact CA-NE2 3.32Å; V501-H1146 PolarHBondContact N-CD2 3.05Å; V501-H1146 PolarHBondContact N-NE2 3.05Å; V501-H1146 PolarHBondContact O-CE1 2.99Å
502	C	79.8	Confident	74.1	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.014	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	141.1	172.5	169.8	0	0	0	0	110.3	I528 L529 Y530 G532 C534 H1146	C502-I528 CarbonylContact O-C 3.47Å; C502-I528 VanDerWaalsContact O-CA 3.25Å; C502-I528 WeakPolarHBondContact O-CA 3.47Å; C502-I528 WeakPolarHBondContact O-CG2 3.45Å; C502-L529 PolarHBondContact O-N 3.08Å; C502-Y530 HydrophobicContact CB-CD1 4.26Å; C502-Y530 HydrophobicContact CB-CD2 4.21Å; C502-Y530 HydrophobicContact CB-CE1 4.16Å; C502-Y530 HydrophobicContact CB-CE2 4.11Å; C502-Y530 HydrophobicContact CB-CG 4.29Å; C502-Y530 PolarHBondContact N-O 2.79Å; C502-Y530 VanDerWaalsContact SG-CE1 3.56Å; C502-G532 VanDerWaalsContact CB-O 3.32Å; C502-G532 WeakPolarHBondContact CB-O 3.21Å; C502-C534 WeakPolarHBondContact CA-SG 3.17Å; C502-C534 HydrophobicContact CB-CB 4.03Å; C502-C534 WeakPolarHBondContact CB-SG 3.46Å; C502-C534 WeakPolarHBondContact SG-CA 3.13Å; C502-C534 WeakPolarHBondContact SG-CB 3.3Å; C502-C534 CovalentContact SG-SG 2.03Å; C502-C534 PolarHBondContact SG-SG 3.26Å; C502-H1146 WeakPolarHBondContact CA-CE1 3.38Å; C502-H1146 PolarHBondContact N-CE1 2.7Å; C502-H1146 PolarHBondContact N-NE2 3.5Å
503	A	75.8	Confident	74.6	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	165.7	-173.7	0	0	0	0	0	115.6	D505 G506 E507 Y509 L515 R527 L529 C534	A503-D505 WeakPolarHBondContact CB-OD1 3.42Å; A503-D505 PolarHBondContact O-N 3.25Å; A503-G506 PolarHBondContact O-N 3.21Å; A503-E507 WeakPolarHBondContact CB-O 3.03Å; A503-E507 PolarHBondContact N-O 2.82Å; A503-Y509 HydrophobicContact CB-CD2 4Å; A503-Y509 HydrophobicContact CB-CE2 3.68Å; A503-L515 HydrophobicContact CB-CD1 4.24Å; A503-R527 CarbonylContact C-O 3.46Å; A503-R527 WeakPolarHBondContact CA-O 3.36Å; A503-R527 WeakPolarHBondContact CB-O 3.43Å; A503-L529 VanDerWaalsContact O-CD1 3.23Å; A503-L529 WeakPolarHBondContact O-CD1 2.99Å; A503-C534 PolarHBondContact N-SG 3.17Å; A503-C534 VanDerWaalsContact N-SG 3.4Å
504	D	69.8	Low	75.1	Confident	69 Å²	69	53.2 Å²	53.2	37%	0.369	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.6	-171.4	69.6	-22.1	0	0	0	115.1	G506 R527 L529	D504-G506 VanDerWaalsContact C-N 3.3Å; D504-R527 HydrophobicContact CB-CB 4.34Å; D504-R527 PolarHBondContact N-O 3.33Å; D504-R527 PolarHBondContact OD1-N 3.33Å; D504-R527 WeakPolarHBondContact OD2-CB 3.33Å; D504-R527 WeakPolarHBondContact OD2-CD 3.15Å; D504-R527 WeakPolarHBondContact OD2-CG 3.01Å; D504-R527 IonicContact OD2-NE 2.66Å; D504-L529 HydrophobicContact CB-CD2 4.08Å; D504-L529 HydrophobicContact CB-CG 4.28Å
505	D	70.5	Confident	75.7	Confident	64 Å²	64	47.8 Å²	47.8	34%	0.342	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.1	163.2	55.3	-7.2	0	0	0	113.1	A503 E507 Y509 K526	A503-D505 WeakPolarHBondContact CB-OD1 3.42Å; A503-D505 PolarHBondContact O-N 3.25Å; D505-E507 PolarHBondContact O-N 2.83Å; D505-E507 VanDerWaalsContact O-N 3.12Å; D505-E507 PolarHBondContact OD1-N 2.71Å; D505-Y509 PolarHBondContact OD2-OH 3.23Å; D505-K526 WeakPolarHBondContact OD2-CD 3.35Å; D505-K526 WeakPolarHBondContact OD2-CE 3.34Å; D505-K526 IonicContact OD2-NZ 2.99Å; D505-K526 PolarHBondContact OD2-NZ 3.04Å
506	G	69.9	Low	76.7	Confident	31 Å²	31	48.7 Å²	48.7	32%	0.32	25%	0.25	S	S	.	.	S	Bend	trans	74.5	-13.4	-172.5	0	0	0	0	0	113.2	A503 D504	A503-G506 PolarHBondContact O-N 3.21Å; D504-G506 VanDerWaalsContact C-N 3.3Å
507	E	78.8	Confident	78.1	Confident	31 Å²	31	45.1 Å²	45.1	15%	0.145	23%	0.228	C	C	.	.			trans	-80.2	179.5	162.2	-73.3	-70.7	-174.7	0	0	110.6	A503 D505 Y509 C534 S1148 N1150	A503-E507 WeakPolarHBondContact CB-O 3.03Å; A503-E507 PolarHBondContact N-O 2.82Å; D505-E507 PolarHBondContact O-N 2.83Å; D505-E507 VanDerWaalsContact O-N 3.12Å; D505-E507 PolarHBondContact OD1-N 2.71Å; E507-Y509 HydrophobicContact CB-CE2 4.48Å; E507-Y509 VanDerWaalsContact CB-OH 3.32Å; E507-Y509 WeakPolarHBondContact CB-OH 3.13Å; E507-C534 PolarHBondContact O-SG 3.35Å; E507-S1148 VanDerWaalsContact OE1-O 3.07Å; E507-S1148 PolarHBondContact OE2-N 2.92Å; E507-N1150 PolarHBondContact OE1-N 2.88Å
508	T	81	Confident	79.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	140.4	-139	34.3	0	0	0	0	110.5	C534 H1146 Q1147 S1148	T508-C534 HydrophobicContact CG2-CB 3.19Å; T508-C534 WeakPolarHBondContact CG2-SG 3.34Å; T508-H1146 CarbonylContact C-O 3.5Å; T508-H1146 VanDerWaalsContact CB-CA 3.46Å; T508-H1146 WeakPolarHBondContact CB-ND1 3.4Å; T508-H1146 WeakPolarHBondContact CG2-ND1 3.47Å; T508-H1146 CarbonylContact O-C 3.6Å; T508-Q1147 VanDerWaalsContact OG1-CA 3.23Å; T508-Q1147 WeakPolarHBondContact OG1-CA 3.5Å; T508-Q1147 PolarHBondContact OG1-N 3.1Å; T508-S1148 PolarHBondContact OG1-N 3.22Å; T508-S1148 VanDerWaalsContact OG1-N 3.15Å
509	Y	84	Confident	80	Confident	17 Å²	17	32.4 Å²	32.4	7%	0.067	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	124.6	-169.5	-53	-79.5	0	0	0	115.3	V501 A503 D505 E507 N511 L515 A518 K526 H1146	V501-Y509 PolarHBondContact N-O 2.94Å; V501-Y509 PolarHBondContact O-N 2.73Å; V501-Y509 VanDerWaalsContact O-N 3.15Å; A503-Y509 HydrophobicContact CB-CD2 4Å; A503-Y509 HydrophobicContact CB-CE2 3.68Å; D505-Y509 PolarHBondContact OD2-OH 3.23Å; E507-Y509 HydrophobicContact CB-CE2 4.48Å; E507-Y509 VanDerWaalsContact CB-OH 3.32Å; E507-Y509 WeakPolarHBondContact CB-OH 3.13Å; Y509-N511 PolarHBondContact O-N 2.04Å; Y509-L515 HydrophobicContact CD2-CB 4.03Å; Y509-L515 HydrophobicContact CD2-CD1 3.37Å; Y509-L515 HydrophobicContact CD2-CG 4.27Å; Y509-L515 HydrophobicContact CE2-CD1 3.71Å; Y509-L515 VanDerWaalsContact CG-CA 3.46Å; Y509-L515 HydrophobicContact CG-CB 3.79Å; Y509-L515 HydrophobicContact CG-CD1 3.99Å; Y509-A518 HydrophobicContact CD1-CB 3.83Å; Y509-A518 HydrophobicContact CE1-CB 3.27Å; Y509-K526 HydrophobicContact CE1-CD 4.49Å; Y509-K526 HydrophobicContact CE2-CD 4.09Å; Y509-K526 WeakPolarHBondContact OH-CD 3.16Å; Y509-K526 PolarHBondContact OH-NZ 2.78Å; Y509-H1146 VanDerWaalsContact N-CB 3.26Å; Y509-H1146 PolarHBondContact O-CD2 3.16Å
510	T	81.4	Confident	80.5	Confident	8 Å²	8	29 Å²	29	5%	0.049	15%	0.154	C	C	.	.	S	Bend	trans	-46.3	-38.1	-173.5	-44.2	0	0	0	0	113.5
511	N	80.5	Confident	80.6	Confident	15 Å²	15	30.6 Å²	30.6	8%	0.08	16%	0.159	C	C	.	.	S	Bend	trans	-153.2	178.8	160.9	62.4	44.5	0	0	0	110.6	L494 W497 D499 Y509 C513 F514 L515	L494-N511 PolarHBondContact O-ND2 2.87Å; W497-N511 VanDerWaalsContact O-CB 3.31Å; W497-N511 WeakPolarHBondContact O-CB 3.33Å; W497-N511 PolarHBondContact O-ND2 3.12Å; D499-N511 WeakPolarHBondContact O-CA 3.28Å; Y509-N511 PolarHBondContact O-N 2.04Å; N511-C513 PolarHBondContact O-N 3Å; N511-C513 WeakPolarHBondContact OD1-CA 3.34Å; N511-C513 WeakPolarHBondContact OD1-CB 3.29Å; N511-C513 PolarHBondContact OD1-N 3.28Å; N511-F514 PolarHBondContact O-N 2.85Å; N511-F514 WeakPolarHBondContact OD1-CD2 3.5Å; N511-F514 PolarHBondContact OD1-N 2.83Å; N511-L515 PolarHBondContact O-N 3.12Å
512	Q	83.9	Confident	80.4	Confident	94 Å²	94	31.5 Å²	31.5	44%	0.439	16%	0.164	S	C	.	.	H	α-helix	trans	-63.6	-8.1	-179.7	-148	-156.4	40.3	0	0	114.8	L515 K516 I528	Q512-L515 HydrophobicContact CG-CD2 4.26Å; Q512-K516 VanDerWaalsContact O-CD 3.23Å; Q512-K516 WeakPolarHBondContact O-CD 3.12Å; Q512-K516 VanDerWaalsContact O-CE 3.26Å; Q512-K516 WeakPolarHBondContact O-CE 3.22Å; Q512-K516 VanDerWaalsContact O-CG 3.3Å; Q512-K516 WeakPolarHBondContact O-CG 3.49Å; Q512-I528 HydrophobicContact CG-CD1 4.25Å
513	C	86	Confident	80.1	Confident	38 Å²	38	34 Å²	34	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-78.9	-49.4	168.3	-170.5	0	0	0	0	110.8	C493 N511 L515 K516 R517	C493-C513 WeakPolarHBondContact CA-SG 3.28Å; C493-C513 HydrophobicContact CB-CB 3.69Å; C493-C513 WeakPolarHBondContact CB-SG 3.42Å; C493-C513 WeakPolarHBondContact SG-CB 3.49Å; C493-C513 PolarHBondContact SG-O 2.89Å; C493-C513 VanDerWaalsContact SG-O 3.36Å; C493-C513 CovalentContact SG-SG 2.04Å; C493-C513 PolarHBondContact SG-SG 3.22Å; N511-C513 PolarHBondContact O-N 3Å; N511-C513 WeakPolarHBondContact OD1-CA 3.34Å; N511-C513 WeakPolarHBondContact OD1-CB 3.29Å; N511-C513 PolarHBondContact OD1-N 3.28Å; C513-L515 PolarHBondContact O-N 2.86Å; C513-K516 CarbonylContact O-C 3.51Å; C513-K516 WeakPolarHBondContact O-CA 3.2Å; C513-K516 WeakPolarHBondContact O-CB 3.35Å; C513-K516 PolarHBondContact O-N 2.83Å; C513-R517 PolarHBondContact O-N 2.91Å
514	F	88.1	Confident	79.6	Confident	37 Å²	37	36.2 Å²	36.2	16%	0.162	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-35.4	177.5	-71.4	-83.4	0	0	0	112.1	C493 N495 N511 K516 R517 A518	C493-F514 HydrophobicContact CB-CD1 4.19Å; C493-F514 HydrophobicContact CB-CD2 3.95Å; C493-F514 HydrophobicContact CB-CE1 3.88Å; C493-F514 HydrophobicContact CB-CE2 3.63Å; C493-F514 HydrophobicContact CB-CG 4.22Å; C493-F514 HydrophobicContact CB-CZ 3.58Å; N495-F514 WeakPolarHBondContact OD1-CE2 3.1Å; N495-F514 WeakPolarHBondContact OD1-CZ 3.31Å; N511-F514 PolarHBondContact O-N 2.85Å; N511-F514 WeakPolarHBondContact OD1-CD2 3.5Å; N511-F514 PolarHBondContact OD1-N 2.83Å; F514-K516 VanDerWaalsContact C-N 3.32Å; F514-K516 PolarHBondContact O-N 3.4Å; F514-R517 PolarHBondContact O-N 2.77Å; F514-A518 WeakPolarHBondContact O-CB 3.3Å; F514-A518 PolarHBondContact O-N 3.07Å
515	L	87.3	Confident	79.6	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-57.3	-42.6	169.8	176.5	65.4	0	0	0	112.2	V501 A503 Y509 N511 Q512 C513 I519 K526 I528	V501-L515 HydrophobicContact CG2-CB 4.23Å; V501-L515 HydrophobicContact CG2-CD2 4.14Å; A503-L515 HydrophobicContact CB-CD1 4.24Å; Y509-L515 HydrophobicContact CD2-CB 4.03Å; Y509-L515 HydrophobicContact CD2-CD1 3.37Å; Y509-L515 HydrophobicContact CD2-CG 4.27Å; Y509-L515 HydrophobicContact CE2-CD1 3.71Å; Y509-L515 VanDerWaalsContact CG-CA 3.46Å; Y509-L515 HydrophobicContact CG-CB 3.79Å; Y509-L515 HydrophobicContact CG-CD1 3.99Å; N511-L515 PolarHBondContact O-N 3.12Å; Q512-L515 HydrophobicContact CG-CD2 4.26Å; C513-L515 PolarHBondContact O-N 2.86Å; L515-I519 HydrophobicContact CD1-CD1 4.03Å; L515-I519 HydrophobicContact CD1-CG1 4.49Å; L515-I519 HydrophobicContact CG-CD1 3.93Å; L515-I519 WeakPolarHBondContact O-CB 3.08Å; L515-I519 WeakPolarHBondContact O-CD1 3.35Å; L515-I519 WeakPolarHBondContact O-CG1 3.48Å; L515-I519 PolarHBondContact O-N 3.22Å; L515-K526 HydrophobicContact CD1-CB 3.77Å; L515-K526 HydrophobicContact CD1-CD 4.47Å; L515-I528 HydrophobicContact CD2-CD1 3.9Å; L515-I528 HydrophobicContact CD2-CG1 3.55Å
516	K	81.5	Confident	79.8	Confident	102 Å²	102	32.8 Å²	32.8	44%	0.443	17%	0.171	S	C	.	.	H	α-helix	trans	-71.9	-34.9	178.4	-67.4	162.1	-168.4	154	0	111.9	Q512 C513 F514 I519 C520	Q512-K516 VanDerWaalsContact O-CD 3.23Å; Q512-K516 WeakPolarHBondContact O-CD 3.12Å; Q512-K516 VanDerWaalsContact O-CE 3.26Å; Q512-K516 WeakPolarHBondContact O-CE 3.22Å; Q512-K516 VanDerWaalsContact O-CG 3.3Å; Q512-K516 WeakPolarHBondContact O-CG 3.49Å; C513-K516 CarbonylContact O-C 3.51Å; C513-K516 WeakPolarHBondContact O-CA 3.2Å; C513-K516 WeakPolarHBondContact O-CB 3.35Å; C513-K516 PolarHBondContact O-N 2.83Å; F514-K516 VanDerWaalsContact C-N 3.32Å; F514-K516 PolarHBondContact O-N 3.4Å; K516-I519 PolarHBondContact O-N 2.96Å; K516-C520 PolarHBondContact O-N 3.37Å
517	R	86.7	Confident	79.8	Confident	39 Å²	39	36.8 Å²	36.8	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-64.6	-50.4	175.3	-150.2	-160.4	175.8	126.7	8.6	110.8	I491 C513 F514 I519 C520 E521 D1175	I491-R517 HydrophobicContact CB-CG 4.06Å; I491-R517 HydrophobicContact CG2-CB 4.06Å; I491-R517 HydrophobicContact CG2-CG 3.98Å; C513-R517 PolarHBondContact O-N 2.91Å; F514-R517 PolarHBondContact O-N 2.77Å; R517-I519 PolarHBondContact O-N 3.12Å; R517-C520 CarbonylContact O-C 3.57Å; R517-C520 WeakPolarHBondContact O-CA 3.41Å; R517-C520 WeakPolarHBondContact O-CB 3.48Å; R517-C520 PolarHBondContact O-N 2.84Å; R517-E521 WeakPolarHBondContact CD-OE1 3.46Å; R517-E521 WeakPolarHBondContact CG-OE1 3.45Å; R517-E521 IonicContact NE-OE1 2.72Å; R517-E521 PolarHBondContact NE-OE1 2.95Å; R517-E521 WeakPolarHBondContact O-CG 3.32Å; R517-E521 PolarHBondContact O-N 3.34Å; R517-D1175 VanDerWaalsContact CZ-CG 3.49Å; R517-D1175 IonicContact CZ-OD1 3.07Å; R517-D1175 IonicContact CZ-OD2 2.8Å; R517-D1175 IonicContact NE-OD2 3.09Å; R517-D1175 PolarHBondContact NE-OD2 3.47Å; R517-D1175 IonicContact NH2-OD1 3.26Å; R517-D1175 PolarHBondContact NH2-OD1 2.97Å; R517-D1175 IonicContact NH2-OD2 2.71Å; R517-D1175 PolarHBondContact NH2-OD2 2.76Å
518	A	83.3	Confident	79.6	Confident	8 Å²	8	38.6 Å²	38.6	7%	0.066	19%	0.187	C	C	.	.	H	α-helix	trans	-62.4	-38.3	174.8	0	0	0	0	0	113	Y509 F514 C520 E521 T522 K526	Y509-A518 HydrophobicContact CD1-CB 3.83Å; Y509-A518 HydrophobicContact CE1-CB 3.27Å; F514-A518 WeakPolarHBondContact O-CB 3.3Å; F514-A518 PolarHBondContact O-N 3.07Å; A518-C520 VanDerWaalsContact C-N 3.27Å; A518-C520 PolarHBondContact O-N 3.21Å; A518-E521 PolarHBondContact O-N 2.97Å; A518-T522 WeakPolarHBondContact O-CB 3.44Å; A518-T522 VanDerWaalsContact O-CG2 3.28Å; A518-T522 WeakPolarHBondContact O-CG2 3.13Å; A518-T522 PolarHBondContact O-N 2.97Å; A518-T522 PolarHBondContact O-OG1 3.39Å; A518-K526 HydrophobicContact CB-CD 4.24Å
519	I	82.3	Confident	78.6	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.056	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-40.8	171.8	-77.7	166.7	0	0	0	110.8	Y458 L515 K516 R517 S524 K526	Y458-I519 WeakPolarHBondContact CB-O 3.46Å; Y458-I519 HydrophobicContact CD1-CG2 3.43Å; Y458-I519 VanDerWaalsContact CD1-CG2 3.43Å; Y458-I519 HydrophobicContact CE1-CG2 4.32Å; Y458-I519 HydrophobicContact CG-CG2 3.82Å; L515-I519 HydrophobicContact CD1-CD1 4.03Å; L515-I519 HydrophobicContact CD1-CG1 4.49Å; L515-I519 HydrophobicContact CG-CD1 3.93Å; L515-I519 WeakPolarHBondContact O-CB 3.08Å; L515-I519 WeakPolarHBondContact O-CD1 3.35Å; L515-I519 WeakPolarHBondContact O-CG1 3.48Å; L515-I519 PolarHBondContact O-N 3.22Å; K516-I519 PolarHBondContact O-N 2.96Å; R517-I519 PolarHBondContact O-N 3.12Å; I519-S524 PolarHBondContact O-N 2.89Å; I519-K526 HydrophobicContact CD1-CB 4.04Å; I519-K526 WeakPolarHBondContact CD1-O 3Å; I519-K526 HydrophobicContact CG1-CB 3.73Å; I519-K526 HydrophobicContact CG1-CD 3.96Å; I519-K526 HydrophobicContact CG1-CG 3.88Å
520	C	82.6	Confident	77.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-57.3	172.2	-179.4	0	0	0	0	112.3	G460 C488 I491 K516 R517 A518 T522 Q523	G460-C520 WeakPolarHBondContact CA-SG 3.44Å; G460-C520 PolarHBondContact N-SG 3.04Å; C488-C520 HydrophobicContact CB-CB 3.98Å; C488-C520 WeakPolarHBondContact CB-SG 3.41Å; C488-C520 WeakPolarHBondContact SG-CB 3.45Å; C488-C520 CovalentContact SG-SG 2.04Å; C488-C520 PolarHBondContact SG-SG 3.44Å; I491-C520 HydrophobicContact CD1-CB 3.55Å; K516-C520 PolarHBondContact O-N 3.37Å; R517-C520 CarbonylContact O-C 3.57Å; R517-C520 WeakPolarHBondContact O-CA 3.41Å; R517-C520 WeakPolarHBondContact O-CB 3.48Å; R517-C520 PolarHBondContact O-N 2.84Å; A518-C520 VanDerWaalsContact C-N 3.27Å; A518-C520 PolarHBondContact O-N 3.21Å; C520-T522 PolarHBondContact O-N 3.1Å; C520-Q523 PolarHBondContact O-N 2.82Å; C520-Q523 PolarHBondContact O-NE2 2.95Å
521	E	80.9	Confident	77.1	Confident	64 Å²	64	55 Å²	55	30%	0.299	26%	0.256	S	S	.	.	H	α-helix	trans	-59.1	-46.8	-173.7	-67.7	153.5	-159.2	0	0	112.4	C488 R517 A518 Q523	C488-E521 HydrophobicContact CB-CG 4.09Å; C488-E521 PolarHBondContact SG-N 2.66Å; R517-E521 WeakPolarHBondContact CD-OE1 3.46Å; R517-E521 WeakPolarHBondContact CG-OE1 3.45Å; R517-E521 IonicContact NE-OE1 2.72Å; R517-E521 PolarHBondContact NE-OE1 2.95Å; R517-E521 WeakPolarHBondContact O-CG 3.32Å; R517-E521 PolarHBondContact O-N 3.34Å; A518-E521 PolarHBondContact O-N 2.97Å; E521-Q523 PolarHBondContact O-N 3.14Å
522	T	74.2	Confident	76.6	Confident	22 Å²	22	55.1 Å²	55.1	14%	0.135	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.1	-176.5	64.3	0	0	0	0	113.7	A518 C520 S524 K526 Q1171	A518-T522 WeakPolarHBondContact O-CB 3.44Å; A518-T522 VanDerWaalsContact O-CG2 3.28Å; A518-T522 WeakPolarHBondContact O-CG2 3.13Å; A518-T522 PolarHBondContact O-N 2.97Å; A518-T522 PolarHBondContact O-OG1 3.39Å; C520-T522 PolarHBondContact O-N 3.1Å; T522-S524 WeakPolarHBondContact CB-OG 3.19Å; T522-S524 WeakPolarHBondContact O-CB 3.38Å; T522-S524 PolarHBondContact O-N 2.7Å; T522-S524 PolarHBondContact OG1-OG 2.05Å; T522-K526 VanDerWaalsContact OG1-CE 3.27Å; T522-K526 WeakPolarHBondContact OG1-CE 3.24Å; T522-Q1171 HydrophobicContact CG2-CG 4.15Å
523	Q	72.8	Confident	76.2	Confident	55 Å²	55	53.3 Å²	53.3	26%	0.257	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	32.8	-172.6	-64	-71.8	-75.6	0	0	112.7	L455 L457 Y458 C520 E521	L455-Q523 PolarHBondContact O-OE1 2.77Å; L455-Q523 VanDerWaalsContact O-OE1 3.1Å; L457-Q523 VanDerWaalsContact CB-OE1 3.3Å; L457-Q523 PolarHBondContact O-NE2 3.2Å; Y458-Q523 WeakPolarHBondContact CD2-O 3.11Å; Y458-Q523 VanDerWaalsContact CE2-C 3.43Å; Y458-Q523 WeakPolarHBondContact CE2-O 3.42Å; C520-Q523 PolarHBondContact O-N 2.82Å; C520-Q523 PolarHBondContact O-NE2 2.95Å; E521-Q523 PolarHBondContact O-N 3.14Å
524	S	67.2	Low	75.2	Confident	47 Å²	47	52 Å²	52	33%	0.329	25%	0.245	S	C	.	.	S	Bend	trans	-140	161	-169.2	81	0	0	0	0	112.5	I519 T522	I519-S524 PolarHBondContact O-N 2.89Å; T522-S524 WeakPolarHBondContact CB-OG 3.19Å; T522-S524 WeakPolarHBondContact O-CB 3.38Å; T522-S524 PolarHBondContact O-N 2.7Å; T522-S524 PolarHBondContact OG1-OG 2.05Å
525	L	67.9	Low	73.8	Confident	48 Å²	48	51.3 Å²	51.3	25%	0.251	25%	0.246	S	C	.	.			trans	-95.7	126.8	-173.3	-172.1	69.3	0	0	0	112.5	Y443 Y458	Y443-L525 HydrophobicContact CD1-CD1 3.39Å; Y443-L525 HydrophobicContact CD2-CD1 3.5Å; Y443-L525 VanDerWaalsContact CD2-CD1 3.5Å; Y443-L525 HydrophobicContact CD2-CD2 4.19Å; Y443-L525 HydrophobicContact CD2-CG 4.45Å; Y443-L525 HydrophobicContact CE1-CD1 3.51Å; Y443-L525 HydrophobicContact CE2-CD1 3.65Å; Y443-L525 HydrophobicContact CE2-CD2 4.33Å; Y443-L525 HydrophobicContact CE2-CG 4.43Å; Y443-L525 HydrophobicContact CG-CD1 3.36Å; Y458-L525 HydrophobicContact CE1-CB 4.3Å; Y458-L525 HydrophobicContact CE1-CD1 3.91Å
526	K	75.3	Confident	72.3	Confident	13 Å²	13	52.2 Å²	52.2	6%	0.057	25%	0.253	C	S	.	.			trans	-125	138.4	177.6	-49.4	171.5	-177.4	-104.8	0	110	Y443 D505 Y509 L515 A518 I519 T522	Y443-K526 PolarHBondContact OH-O 3.13Å; D505-K526 WeakPolarHBondContact OD2-CD 3.35Å; D505-K526 WeakPolarHBondContact OD2-CE 3.34Å; D505-K526 IonicContact OD2-NZ 2.99Å; D505-K526 PolarHBondContact OD2-NZ 3.04Å; Y509-K526 HydrophobicContact CE1-CD 4.49Å; Y509-K526 HydrophobicContact CE2-CD 4.09Å; Y509-K526 WeakPolarHBondContact OH-CD 3.16Å; Y509-K526 PolarHBondContact OH-NZ 2.78Å; L515-K526 HydrophobicContact CD1-CB 3.77Å; L515-K526 HydrophobicContact CD1-CD 4.47Å; A518-K526 HydrophobicContact CB-CD 4.24Å; I519-K526 HydrophobicContact CD1-CB 4.04Å; I519-K526 WeakPolarHBondContact CD1-O 3Å; I519-K526 HydrophobicContact CG1-CB 3.73Å; I519-K526 HydrophobicContact CG1-CD 3.96Å; I519-K526 HydrophobicContact CG1-CG 3.88Å; T522-K526 VanDerWaalsContact OG1-CE 3.27Å; T522-K526 WeakPolarHBondContact OG1-CE 3.24Å
527	R	69.7	Low	71.1	Confident	116 Å²	116	51.1 Å²	51.1	44%	0.438	25%	0.252	S	S	.	.			trans	-125.3	147.8	-179.2	-49.2	178	-168.6	163.1	6.5	110.4	A503 D504 L529	A503-R527 CarbonylContact C-O 3.46Å; A503-R527 WeakPolarHBondContact CA-O 3.36Å; A503-R527 WeakPolarHBondContact CB-O 3.43Å; D504-R527 HydrophobicContact CB-CB 4.34Å; D504-R527 PolarHBondContact N-O 3.33Å; D504-R527 PolarHBondContact OD1-N 3.33Å; D504-R527 WeakPolarHBondContact OD2-CB 3.33Å; D504-R527 WeakPolarHBondContact OD2-CD 3.15Å; D504-R527 WeakPolarHBondContact OD2-CG 3.01Å; D504-R527 IonicContact OD2-NE 2.66Å; R527-L529 PolarHBondContact O-N 3Å
528	I	74.7	Confident	70	Confident	69 Å²	69	49.7 Å²	49.7	35%	0.354	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.6	178.3	-56.4	170.4	0	0	0	110.2	V501 C502 Q512 L515 Y530	V501-I528 HydrophobicContact CB-CD1 3.99Å; V501-I528 HydrophobicContact CB-CG1 4.02Å; V501-I528 HydrophobicContact CB-CG2 4.08Å; V501-I528 HydrophobicContact CG1-CD1 3.84Å; V501-I528 HydrophobicContact CG1-CG1 4.41Å; V501-I528 HydrophobicContact CG1-CG2 4.36Å; V501-I528 HydrophobicContact CG2-CD1 4.4Å; V501-I528 HydrophobicContact CG2-CG1 4.44Å; C502-I528 CarbonylContact O-C 3.47Å; C502-I528 VanDerWaalsContact O-CA 3.25Å; C502-I528 WeakPolarHBondContact O-CA 3.47Å; C502-I528 WeakPolarHBondContact O-CG2 3.45Å; Q512-I528 HydrophobicContact CG-CD1 4.25Å; L515-I528 HydrophobicContact CD2-CD1 3.9Å; L515-I528 HydrophobicContact CD2-CG1 3.55Å; I528-Y530 WeakPolarHBondContact CG2-O 3.25Å
529	L	61.2	Low	69.1	Low	107 Å²	107	50.9 Å²	50.9	56%	0.56	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	-51.2	168.2	-70.7	177.6	0	0	0	110.9	C502 A503 D504 R527	C502-L529 PolarHBondContact O-N 3.08Å; A503-L529 VanDerWaalsContact O-CD1 3.23Å; A503-L529 WeakPolarHBondContact O-CD1 2.99Å; D504-L529 HydrophobicContact CB-CD2 4.08Å; D504-L529 HydrophobicContact CB-CG 4.28Å; R527-L529 PolarHBondContact O-N 3Å
530	Y	65.9	Low	68	Low	88 Å²	88	56.5 Å²	56.5	35%	0.345	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	174.3	175.9	57.3	-90.6	0	0	0	111.2	C502 I528 G532 N533 C534 A535	C502-Y530 HydrophobicContact CB-CD1 4.26Å; C502-Y530 HydrophobicContact CB-CD2 4.21Å; C502-Y530 HydrophobicContact CB-CE1 4.16Å; C502-Y530 HydrophobicContact CB-CE2 4.11Å; C502-Y530 HydrophobicContact CB-CG 4.29Å; C502-Y530 PolarHBondContact N-O 2.79Å; C502-Y530 VanDerWaalsContact SG-CE1 3.56Å; I528-Y530 WeakPolarHBondContact CG2-O 3.25Å; Y530-G532 WeakPolarHBondContact CE2-O 3.17Å; Y530-N533 WeakPolarHBondContact CE2-O 3.44Å; Y530-N533 PolarHBondContact OH-O 2.85Å; Y530-C534 WeakPolarHBondContact OH-CA 3.24Å; Y530-A535 PolarHBondContact OH-N 3.25Å; Y530-A535 VanDerWaalsContact OH-N 3.08Å
531	R	67.9	Low	66.7	Low	174 Å²	174	62.1 Å²	62.1	66%	0.657	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.6	172.1	-61	-167	-171.8	-152.7	1.2	110.7	D499 P500 V501	D499-R531 VanDerWaalsContact CG-NH1 3.27Å; D499-R531 IonicContact OD1-CZ 3.19Å; D499-R531 IonicContact OD1-NH1 3.83Å; D499-R531 PolarHBondContact OD1-NH1 3.12Å; D499-R531 IonicContact OD2-CZ 3.82Å; D499-R531 IonicContact OD2-NH1 2.93Å; D499-R531 PolarHBondContact OD2-NH1 2.88Å; P500-R531 CarbonylContact O-C 3.39Å; P500-R531 WeakPolarHBondContact O-CA 2.99Å; P500-R531 WeakPolarHBondContact O-CB 3.37Å; V501-R531 HydrophobicContact CG1-CG 4.44Å
532	G	69	Low	66	Low	17 Å²	17	62.4 Å²	62.4	18%	0.175	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	96.2	165.1	-164.6	0	0	0	0	0	111.9	P500 C502 Y530 H1146	P500-G532 PolarHBondContact O-N 2.57Å; C502-G532 VanDerWaalsContact CB-O 3.32Å; C502-G532 WeakPolarHBondContact CB-O 3.21Å; Y530-G532 WeakPolarHBondContact CE2-O 3.17Å; G532-H1146 PolarHBondContact O-CE1 2.94Å; G532-H1146 PolarHBondContact O-NE2 2.78Å
533	N	75.8	Confident	65.5	Low	56 Å²	56	70.9 Å²	70.9	30%	0.299	35%	0.347	S	S	.	.			trans	-48.2	140.7	-168.5	-38.6	34.3	0	0	0	112.5	Y530 A535 N1095 T1145 H1146	Y530-N533 WeakPolarHBondContact CE2-O 3.44Å; Y530-N533 PolarHBondContact OH-O 2.85Å; N533-A535 VanDerWaalsContact C-N 3.32Å; N533-A535 PolarHBondContact O-N 3.04Å; N533-N1095 PolarHBondContact ND2-ND2 2.78Å; N533-N1095 VanDerWaalsContact ND2-ND2 3.13Å; N533-T1145 WeakPolarHBondContact CA-O 3.44Å; N533-T1145 WeakPolarHBondContact CB-O 3.33Å; N533-T1145 VanDerWaalsContact CG-CB 3.46Å; N533-T1145 WeakPolarHBondContact OD1-CB 3.42Å; N533-T1145 WeakPolarHBondContact OD1-CG2 3.46Å; N533-H1146 VanDerWaalsContact CA-CE1 3.41Å; N533-H1146 WeakPolarHBondContact CA-CE1 3.28Å
534	C	65.7	Low	65.7	Low	11 Å²	11	69.7 Å²	69.7	7%	0.074	34%	0.344	C	S	.	.			trans	-68.3	106.7	155.1	-65.9	0	0	0	0	106.4	C502 A503 E507 T508 Y530 H1146	C502-C534 WeakPolarHBondContact CA-SG 3.17Å; C502-C534 HydrophobicContact CB-CB 4.03Å; C502-C534 WeakPolarHBondContact CB-SG 3.46Å; C502-C534 WeakPolarHBondContact SG-CA 3.13Å; C502-C534 WeakPolarHBondContact SG-CB 3.3Å; C502-C534 CovalentContact SG-SG 2.03Å; C502-C534 PolarHBondContact SG-SG 3.26Å; A503-C534 PolarHBondContact N-SG 3.17Å; A503-C534 VanDerWaalsContact N-SG 3.4Å; E507-C534 PolarHBondContact O-SG 3.35Å; T508-C534 HydrophobicContact CG2-CB 3.19Å; T508-C534 WeakPolarHBondContact CG2-SG 3.34Å; Y530-C534 WeakPolarHBondContact OH-CA 3.24Å; C534-H1146 PolarHBondContact N-CE1 2.87Å
535	A	57.8	Low	65.8	Low	22 Å²	22	76.8 Å²	76.8	18%	0.182	36%	0.364	C	S	.	.			trans	-94.3	158.9	170.3	0	0	0	0	0	107.2	Y530 N533 N537 D1069	Y530-A535 PolarHBondContact OH-N 3.25Å; Y530-A535 VanDerWaalsContact OH-N 3.08Å; N533-A535 VanDerWaalsContact C-N 3.32Å; N533-A535 PolarHBondContact O-N 3.04Å; A535-N537 VanDerWaalsContact C-N 3.31Å; A535-N537 PolarHBondContact O-N 2.86Å; A535-D1069 HydrophobicContact CB-CB 3.9Å; A535-D1069 WeakPolarHBondContact CB-OD1 3.1Å; A535-D1069 WeakPolarHBondContact CB-OD2 3.26Å
536	S	56.3	Low	66	Low	27 Å²	27	77.2 Å²	77.2	19%	0.189	36%	0.362	C	S	.	.			trans	-76.1	75.2	-153.8	-11.8	0	0	0	0	112.8	P538 D1069 T1070 Q1071	S536-P538 VanDerWaalsContact O-N 3.13Å; S536-D1069 PolarHBondContact N-OD1 3.5Å; S536-D1069 PolarHBondContact OG-O 2.87Å; S536-T1070 WeakPolarHBondContact CB-O 3.14Å; S536-T1070 PolarHBondContact OG-N 3.24Å; S536-Q1071 WeakPolarHBondContact OG-CG 3.36Å; S536-Q1071 PolarHBondContact OG-N 3.39Å; S536-Q1071 VanDerWaalsContact OG-N 3.11Å
537	N	55.7	Low	65.2	Low	80 Å²	80	82.9 Å²	82.9	43%	0.428	39%	0.389	S	S	.	.			trans	-1	90.8	-172.5	-172.1	-1.9	0	0	0	115.1	A535 C539 L540	A535-N537 VanDerWaalsContact C-N 3.31Å; A535-N537 PolarHBondContact O-N 2.86Å; N537-C539 PolarHBondContact O-N 3.24Å; N537-C539 VanDerWaalsContact OD1-CB 3.31Å; N537-C539 WeakPolarHBondContact OD1-CB 2.87Å; N537-C539 PolarHBondContact OD1-N 3.46Å; N537-C539 VanDerWaalsContact OD1-N 3.1Å; N537-L540 HydrophobicContact CB-CD1 4.17Å; N537-L540 WeakPolarHBondContact O-CB 3.35Å; N537-L540 PolarHBondContact O-N 3.28Å
538	P	63.2	Low	64.8	Low	9 Å²	9	78.4 Å²	78.4	6%	0.058	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.7	-19.4	175.6	-38.5	39.8	0	0	0	116.5	S536 H542 V553 G557 A559 R1068 D1069	S536-P538 VanDerWaalsContact O-N 3.13Å; P538-H542 WeakPolarHBondContact O-CB 3.43Å; P538-V553 HydrophobicContact CB-CG2 4.26Å; P538-V553 HydrophobicContact CG-CG1 4.15Å; P538-V553 HydrophobicContact CG-CG2 3.9Å; P538-G557 VanDerWaalsContact CG-O 3.24Å; P538-G557 WeakPolarHBondContact CG-O 3Å; P538-A559 HydrophobicContact CB-CB 3.59Å; P538-A559 WeakPolarHBondContact O-CB 3.25Å; P538-R1068 VanDerWaalsContact CA-O 3.31Å; P538-R1068 WeakPolarHBondContact CA-O 3.43Å; P538-R1068 HydrophobicContact CB-CB 3.96Å; P538-R1068 HydrophobicContact CG-CB 4.09Å; P538-D1069 WeakPolarHBondContact CD-OD1 3.5Å; P538-D1069 WeakPolarHBondContact CG-OD1 3.19Å
539	C	65.7	Low	64.7	Low	33 Å²	33	77.2 Å²	77.2	22%	0.223	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-0.7	-176.9	-53.7	0	0	0	0	114.9	N537 H541 C551 Q552	N537-C539 PolarHBondContact O-N 3.24Å; N537-C539 VanDerWaalsContact OD1-CB 3.31Å; N537-C539 WeakPolarHBondContact OD1-CB 2.87Å; N537-C539 PolarHBondContact OD1-N 3.46Å; N537-C539 VanDerWaalsContact OD1-N 3.1Å; C539-H541 VanDerWaalsContact C-N 3.32Å; C539-H541 PolarHBondContact O-N 2.81Å; C539-C551 WeakPolarHBondContact CA-SG 3.21Å; C539-C551 HydrophobicContact CB-CB 3.45Å; C539-C551 VanDerWaalsContact CB-CB 3.45Å; C539-C551 WeakPolarHBondContact CB-SG 3.24Å; C539-C551 VanDerWaalsContact SG-CA 3.59Å; C539-C551 WeakPolarHBondContact SG-CB 3.49Å; C539-C551 PolarHBondContact SG-O 3.47Å; C539-C551 CovalentContact SG-SG 2.03Å; C539-C551 PolarHBondContact SG-SG 2.96Å; C539-Q552 PolarHBondContact SG-N 3.32Å
540	L	58.1	Low	65.2	Low	128 Å²	128	78 Å²	78	67%	0.67	37%	0.37	S	S	*	.	S	Bend	trans	-63.8	-37.6	179.2	-131.3	75.2	0	0	0	112.4	N537	N537-L540 HydrophobicContact CB-CD1 4.17Å; N537-L540 WeakPolarHBondContact O-CB 3.35Å; N537-L540 PolarHBondContact O-N 3.28Å
541	H	56.6	Low	65.6	Low	118 Å²	118	74.9 Å²	74.9	55%	0.546	36%	0.362	S	S	.	.	S	Bend	trans	-111	-14.7	-179.6	-60.7	115.7	0	0	0	113.7	C539 K543 Q1064	C539-H541 VanDerWaalsContact C-N 3.32Å; C539-H541 PolarHBondContact O-N 2.81Å; H541-K543 PolarHBondContact O-N 3.2Å; H541-Q1064 VanDerWaalsContact CG-OE1 3.22Å; H541-Q1064 PolarHBondContact ND1-OE1 3.36Å; H541-Q1064 VanDerWaalsContact ND1-OE1 3.16Å
542	H	64.6	Low	65.8	Low	71 Å²	71	70.9 Å²	70.9	33%	0.329	35%	0.351	S	S	.	.			trans	-81.8	81.4	-174.4	-156.3	47.7	0	0	0	113	P538 C544 C551 A559 C561 R1068	P538-H542 WeakPolarHBondContact O-CB 3.43Å; H542-C544 PolarHBondContact O-N 3.04Å; H542-C544 VanDerWaalsContact O-N 3.09Å; H542-C551 HydrophobicContact CB-CB 4.49Å; H542-A559 HydrophobicContact CB-CB 3.97Å; H542-A559 PolarHBondContact CD2-O 2.87Å; H542-A559 VanDerWaalsContact CD2-O 3.28Å; H542-A559 PolarHBondContact NE2-O 3.47Å; H542-C561 PolarHBondContact CD2-SG 3.03Å; H542-C561 PolarHBondContact NE2-SG 3.13Å; H542-C561 VanDerWaalsContact NE2-SG 3.45Å; H542-R1068 PolarHBondContact NE2-NH2 3.16Å; H542-R1068 VanDerWaalsContact NE2-NH2 3.2Å
543	K	64.9	Low	65.5	Low	200 Å²	200	73 Å²	73	87%	0.87	36%	0.36	S	S	*	.			trans	-67.2	103.6	167.8	-76.6	-179.7	-178.9	168.2	0	110.4	H541	H541-K543 PolarHBondContact O-N 3.2Å
544	C	76.3	Confident	64.7	Low	29 Å²	29	72.3 Å²	72.3	20%	0.196	36%	0.356	C	S	.	.			trans	-62.9	156.9	170	-58.3	0	0	0	0	111.8	H542 E549 C561	H542-C544 PolarHBondContact O-N 3.04Å; H542-C544 VanDerWaalsContact O-N 3.09Å; C544-E549 HydrophobicContact CB-CB 3.28Å; C544-E549 HydrophobicContact CB-CG 4.09Å; C544-E549 VanDerWaalsContact CB-OE2 3.31Å; C544-E549 WeakPolarHBondContact CB-OE2 3.48Å; C544-C561 WeakPolarHBondContact CA-SG 3.41Å; C544-C561 HydrophobicContact CB-CB 3.9Å; C544-C561 WeakPolarHBondContact CB-SG 3.35Å; C544-C561 VanDerWaalsContact SG-CA 3.57Å; C544-C561 WeakPolarHBondContact SG-CB 3.31Å; C544-C561 CovalentContact SG-SG 2.04Å; C544-C561 PolarHBondContact SG-SG 2.88Å
545	R	69.2	Low	64.3	Low	197 Å²	197	78.7 Å²	78.7	74%	0.743	40%	0.395	S	S	*	.	S	Bend	trans	-85.7	-25.9	-163.9	-177	175.5	174.8	170.8	0.3	113.7	E549	R545-E549 WeakPolarHBondContact CA-OE2 3.43Å; R545-E549 PolarHBondContact N-OE2 3.3Å
546	W	71.6	Confident	64.2	Low	57 Å²	57	83.1 Å²	83.1	22%	0.216	42%	0.415	C	S	.	.	S	Bend	trans	-119.2	143.3	-170.5	-52.1	108.3	0	0	0	111.7	G548 E549 M596	W546-G548 PolarHBondContact O-N 2.96Å; W546-E549 HydrophobicContact CB-CG 4.16Å; W546-E549 PolarHBondContact N-OE2 3.47Å; W546-E549 WeakPolarHBondContact O-CB 3.05Å; W546-E549 PolarHBondContact O-N 3.05Å; W546-E549 VanDerWaalsContact O-N 3.08Å; W546-M596 HydrophobicContact CD2-CB 4.25Å; W546-M596 VanDerWaalsContact CE2-CB 3.48Å; W546-M596 HydrophobicContact CH2-CB 4.48Å; W546-M596 WeakPolarHBondContact CH2-O 3.25Å; W546-M596 HydrophobicContact CZ2-CB 3.62Å; W546-M596 HydrophobicContact CZ2-CG 4.4Å; W546-M596 WeakPolarHBondContact CZ2-O 3.01Å; W546-M596 WeakPolarHBondContact CZ3-O 3.31Å; W546-M596 VanDerWaalsContact NE1-CG 3.28Å
547	Q	58.5	Low	64.2	Low	131 Å²	131	82.7 Å²	82.7	61%	0.612	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	129.1	175.2	-75.4	179.9	-15.7	0	0	109.9
548	G	62.5	Low	64.4	Low	22 Å²	22	83.3 Å²	83.3	23%	0.227	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	-18.5	-174.8	0	0	0	0	0	114.6	W546 K550 P564	W546-G548 PolarHBondContact O-N 2.96Å; G548-K550 PolarHBondContact O-N 2.04Å; G548-P564 WeakPolarHBondContact O-CD 3.31Å
549	E	72.7	Confident	64.6	Low	44 Å²	44	83 Å²	83	21%	0.206	41%	0.413	C	S	.	.			trans	-61.7	129.4	170.9	-82.8	179.7	138.7	0	0	110.6	C544 R545 W546 C593	C544-E549 HydrophobicContact CB-CB 3.28Å; C544-E549 HydrophobicContact CB-CG 4.09Å; C544-E549 VanDerWaalsContact CB-OE2 3.31Å; C544-E549 WeakPolarHBondContact CB-OE2 3.48Å; R545-E549 WeakPolarHBondContact CA-OE2 3.43Å; R545-E549 PolarHBondContact N-OE2 3.3Å; W546-E549 HydrophobicContact CB-CG 4.16Å; W546-E549 PolarHBondContact N-OE2 3.47Å; W546-E549 WeakPolarHBondContact O-CB 3.05Å; W546-E549 PolarHBondContact O-N 3.05Å; W546-E549 VanDerWaalsContact O-N 3.08Å; E549-C593 HydrophobicContact CG-CB 3.89Å; E549-C593 WeakPolarHBondContact CG-SG 3.21Å
550	K	72.3	Confident	65.1	Low	123 Å²	123	86.9 Å²	86.9	54%	0.535	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.2	167.5	-64.5	-178.4	-172.6	171.9	0	107	G548 Q552 T562 P564	G548-K550 PolarHBondContact O-N 2.04Å; K550-Q552 PolarHBondContact O-N 3.16Å; K550-T562 PolarHBondContact N-O 3.37Å; K550-T562 PolarHBondContact O-N 2.86Å; K550-T562 PolarHBondContact O-OG1 3.46Å; K550-P564 HydrophobicContact CD-CB 4.22Å
551	C	73.8	Confident	66.1	Low	24 Å²	24	82.6 Å²	82.6	16%	0.162	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	134.3	159.6	171.9	0	0	0	0	108.2	C539 H542 K560	C539-C551 WeakPolarHBondContact CA-SG 3.21Å; C539-C551 HydrophobicContact CB-CB 3.45Å; C539-C551 VanDerWaalsContact CB-CB 3.45Å; C539-C551 WeakPolarHBondContact CB-SG 3.24Å; C539-C551 VanDerWaalsContact SG-CA 3.59Å; C539-C551 WeakPolarHBondContact SG-CB 3.49Å; C539-C551 PolarHBondContact SG-O 3.47Å; C539-C551 CovalentContact SG-SG 2.03Å; C539-C551 PolarHBondContact SG-SG 2.96Å; H542-C551 HydrophobicContact CB-CB 4.49Å; C551-K560 WeakPolarHBondContact CA-O 3.3Å
552	Q	72.1	Confident	67.2	Low	90 Å²	90	78 Å²	78	42%	0.421	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.2	167	-73.6	177.4	-21.3	0	0	108.7	C539 K550 Q558 K560 T562	C539-Q552 PolarHBondContact SG-N 3.32Å; K550-Q552 PolarHBondContact O-N 3.16Å; Q552-Q558 VanDerWaalsContact O-O 3.07Å; Q552-K560 PolarHBondContact N-O 2.57Å; Q552-K560 PolarHBondContact O-N 2.86Å; Q552-T562 HydrophobicContact CB-CG2 4.42Å; Q552-T562 VanDerWaalsContact CG-OG1 3.29Å; Q552-T562 WeakPolarHBondContact CG-OG1 3.36Å; Q552-T562 PolarHBondContact OE1-OG1 3.09Å
553	V	61.8	Low	68	Low	62 Å²	62	75.6 Å²	75.6	38%	0.376	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.4	165	-169.5	0	0	0	0	107.3	P538	P538-V553 HydrophobicContact CB-CG2 4.26Å; P538-V553 HydrophobicContact CG-CG1 4.15Å; P538-V553 HydrophobicContact CG-CG2 3.9Å
554	D	60.3	Low	68.2	Low	40 Å²	40	66.7 Å²	66.7	21%	0.214	34%	0.341	C	S	.	.			trans	-83.3	176.8	171.6	80.1	3.2	0	0	0	112.2	N556 G557 Q558 K560	D554-N556 PolarHBondContact O-N 2.77Å; D554-N556 WeakPolarHBondContact OD1-CA 3.38Å; D554-N556 WeakPolarHBondContact OD1-CB 3.33Å; D554-N556 PolarHBondContact OD1-N 3.34Å; D554-G557 PolarHBondContact O-N 3.3Å; D554-G557 PolarHBondContact OD1-N 2.91Å; D554-Q558 PolarHBondContact N-O 2.9Å; D554-Q558 WeakPolarHBondContact OD1-CB 3.43Å; D554-Q558 PolarHBondContact OD1-N 3.01Å; D554-K560 HydrophobicContact CB-CB 4.17Å; D554-K560 HydrophobicContact CB-CD 3.97Å
555	V	57	Low	67.7	Low	146 Å²	146	70.2 Å²	70.2	89%	0.885	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.3	-179	-62.3	0	0	0	0	114.5
556	N	56.2	Low	67.5	Low	114 Å²	114	66.3 Å²	66.3	61%	0.61	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	12.9	178.3	-46.6	-58.2	0	0	0	112.6	D554 Q558	D554-N556 PolarHBondContact O-N 2.77Å; D554-N556 WeakPolarHBondContact OD1-CA 3.38Å; D554-N556 WeakPolarHBondContact OD1-CB 3.33Å; D554-N556 PolarHBondContact OD1-N 3.34Å; N556-Q558 VanDerWaalsContact C-N 3.35Å; N556-Q558 HydrophobicContact CB-CG 4.15Å
557	G	56.2	Low	67.6	Low	19 Å²	19	63.8 Å²	63.8	20%	0.196	35%	0.346	C	S	.	.	S	Bend	trans	77.8	13.6	-177.2	0	0	0	0	0	114.5	P538 D554	P538-G557 VanDerWaalsContact CG-O 3.24Å; P538-G557 WeakPolarHBondContact CG-O 3Å; D554-G557 PolarHBondContact O-N 3.3Å; D554-G557 PolarHBondContact OD1-N 2.91Å
558	Q	59.9	Low	68	Low	92 Å²	92	61.7 Å²	61.7	43%	0.43	34%	0.344	S	S	.	.			trans	-100.2	139.4	-169.2	-56.7	-167.7	17.4	0	0	113.5	Q552 D554 N556 K560	Q552-Q558 VanDerWaalsContact O-O 3.07Å; D554-Q558 PolarHBondContact N-O 2.9Å; D554-Q558 WeakPolarHBondContact OD1-CB 3.43Å; D554-Q558 PolarHBondContact OD1-N 3.01Å; N556-Q558 VanDerWaalsContact C-N 3.35Å; N556-Q558 HydrophobicContact CB-CG 4.15Å; Q558-K560 VanDerWaalsContact C-N 3.26Å; Q558-K560 PolarHBondContact O-N 3.31Å
559	A	66.1	Low	67.9	Low	2 Å²	2	66 Å²	66	2%	0.017	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	76.4	172.7	0	0	0	0	0	112.1	P538 H542 C561 R1068	P538-A559 HydrophobicContact CB-CB 3.59Å; P538-A559 WeakPolarHBondContact O-CB 3.25Å; H542-A559 HydrophobicContact CB-CB 3.97Å; H542-A559 PolarHBondContact CD2-O 2.87Å; H542-A559 VanDerWaalsContact CD2-O 3.28Å; H542-A559 PolarHBondContact NE2-O 3.47Å; A559-C561 PolarHBondContact O-N 2.95Å; A559-R1068 HydrophobicContact CB-CB 4.48Å; A559-R1068 HydrophobicContact CB-CG 3.91Å; A559-R1068 PolarHBondContact O-NH1 3.13Å; A559-R1068 VanDerWaalsContact O-NH1 3.08Å; A559-R1068 PolarHBondContact O-NH2 3.4Å
560	K	75.6	Confident	66.5	Low	115 Å²	115	66.8 Å²	66.8	50%	0.5	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	109.8	178	-165.2	175.4	-178.5	174.5	0	107.8	C551 Q552 D554 Q558 T562	C551-K560 WeakPolarHBondContact CA-O 3.3Å; Q552-K560 PolarHBondContact N-O 2.57Å; Q552-K560 PolarHBondContact O-N 2.86Å; D554-K560 HydrophobicContact CB-CB 4.17Å; D554-K560 HydrophobicContact CB-CD 3.97Å; Q558-K560 VanDerWaalsContact C-N 3.26Å; Q558-K560 PolarHBondContact O-N 3.31Å; K560-T562 VanDerWaalsContact C-N 3.34Å; K560-T562 HydrophobicContact CB-CG2 4.09Å; K560-T562 HydrophobicContact CD-CG2 3.84Å; K560-T562 HydrophobicContact CG-CG2 3.69Å; K560-T562 PolarHBondContact O-N 3.24Å
561	C	81	Confident	66.3	Low	38 Å²	38	65.6 Å²	65.6	26%	0.257	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	101.3	163.3	-72.7	0	0	0	0	107.7	H542 C544 A559	H542-C561 PolarHBondContact CD2-SG 3.03Å; H542-C561 PolarHBondContact NE2-SG 3.13Å; H542-C561 VanDerWaalsContact NE2-SG 3.45Å; C544-C561 WeakPolarHBondContact CA-SG 3.41Å; C544-C561 HydrophobicContact CB-CB 3.9Å; C544-C561 WeakPolarHBondContact CB-SG 3.35Å; C544-C561 VanDerWaalsContact SG-CA 3.57Å; C544-C561 WeakPolarHBondContact SG-CB 3.31Å; C544-C561 CovalentContact SG-SG 2.04Å; C544-C561 PolarHBondContact SG-SG 2.88Å; A559-C561 PolarHBondContact O-N 2.95Å
562	T	78.8	Confident	66	Low	22 Å²	22	65 Å²	65	14%	0.135	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140	176.4	55.1	0	0	0	0	109.2	K550 Q552 K560	K550-T562 PolarHBondContact N-O 3.37Å; K550-T562 PolarHBondContact O-N 2.86Å; K550-T562 PolarHBondContact O-OG1 3.46Å; Q552-T562 HydrophobicContact CB-CG2 4.42Å; Q552-T562 VanDerWaalsContact CG-OG1 3.29Å; Q552-T562 WeakPolarHBondContact CG-OG1 3.36Å; Q552-T562 PolarHBondContact OE1-OG1 3.09Å; K560-T562 VanDerWaalsContact C-N 3.34Å; K560-T562 HydrophobicContact CB-CG2 4.09Å; K560-T562 HydrophobicContact CD-CG2 3.84Å; K560-T562 HydrophobicContact CG-CG2 3.69Å; K560-T562 PolarHBondContact O-N 3.24Å
563	C	80.9	Confident	66.2	Low	20 Å²	20	61.5 Å²	61.5	14%	0.135	37%	0.368	C	S	.	.			trans	-65.7	137.1	157	-46.5	0	0	0	0	107	E565 R590 C593 Q594	C563-E565 WeakPolarHBondContact O-CG 3.43Å; C563-E565 PolarHBondContact O-N 2.91Å; C563-R590 HydrophobicContact CB-CB 4.47Å; C563-R590 HydrophobicContact CB-CG 3.83Å; C563-C593 WeakPolarHBondContact CA-SG 3.33Å; C563-C593 HydrophobicContact CB-CB 3.79Å; C563-C593 WeakPolarHBondContact CB-SG 3.23Å; C563-C593 PolarHBondContact N-SG 2.68Å; C563-C593 VanDerWaalsContact N-SG 3.38Å; C563-C593 VanDerWaalsContact SG-C 3.57Å; C563-C593 WeakPolarHBondContact SG-CB 3.43Å; C563-C593 CovalentContact SG-SG 2.02Å; C563-C593 PolarHBondContact SG-SG 3.45Å; C563-Q594 HydrophobicContact CB-CG 4.08Å; C563-Q594 WeakPolarHBondContact SG-CG 3.5Å; C563-Q594 PolarHBondContact SG-N 3.49Å
564	P	69.2	Low	67	Low	13 Å²	13	58.7 Å²	58.7	8%	0.084	35%	0.351	C	S	.	.			trans	-62.1	112.6	-178.9	21.9	-32.5	0	0	0	110.4	G548 K550	G548-P564 WeakPolarHBondContact O-CD 3.31Å; K550-P564 HydrophobicContact CD-CB 4.22Å
565	E	65.5	Low	68.1	Low	103 Å²	103	57 Å²	57	48%	0.481	34%	0.342	S	S	.	.	S	Bend	trans	-125.2	138.6	176	-37.8	-143.7	143.6	0	0	110	C563 R590 Q594	C563-E565 WeakPolarHBondContact O-CG 3.43Å; C563-E565 PolarHBondContact O-N 2.91Å; E565-R590 VanDerWaalsContact CD-NE 3.3Å; E565-R590 IonicContact OE1-CZ 2.7Å; E565-R590 VanDerWaalsContact OE1-CZ 3.27Å; E565-R590 IonicContact OE1-NE 3.68Å; E565-R590 PolarHBondContact OE1-NE 2.98Å; E565-R590 IonicContact OE1-NH2 2.66Å; E565-R590 PolarHBondContact OE1-NH2 3.45Å; E565-R590 IonicContact OE2-CZ 2.78Å; E565-R590 IonicContact OE2-NE 3.23Å; E565-R590 IonicContact OE2-NH2 3.96Å; E565-R590 PolarHBondContact OE2-NH2 2.04Å; E565-Q594 PolarHBondContact OE1-NE2 3.04Å
566	P	66.6	Low	69.2	Low	115 Å²	115	50 Å²	50	75%	0.747	30%	0.3	S	S	*	.	S	Bend	cis	-73.6	151.1	-13.6	33.8	-35	0	0	0	111.1
567	C	72.7	Confident	70	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.034	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-70.1	148.6	154.3	-72.2	0	0	0	0	108.9	S569 C586 H587	C567-S569 PolarHBondContact O-N 2.92Å; C567-C586 WeakPolarHBondContact CA-SG 3.26Å; C567-C586 HydrophobicContact CB-CB 3.69Å; C567-C586 WeakPolarHBondContact CB-SG 3.08Å; C567-C586 WeakPolarHBondContact SG-CB 3.03Å; C567-C586 PolarHBondContact SG-O 3.15Å; C567-C586 CovalentContact SG-SG 2.04Å; C567-C586 PolarHBondContact SG-SG 2.9Å; C567-H587 WeakPolarHBondContact CB-CE1 3.35Å
568	P	66.4	Low	71	Confident	87 Å²	87	49.4 Å²	49.4	57%	0.565	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-55.9	135.9	176.6	-23.6	33.4	0	0	0	110.7	A570	P568-A570 PolarHBondContact O-N 2.89Å
569	S	61	Low	71.8	Confident	112 Å²	112	45.9 Å²	45.9	78%	0.783	29%	0.286	S	S	*	.	S	Bend	trans	-65.5	7.2	178.7	-43	0	0	0	0	114.3	C567 V571	C567-S569 PolarHBondContact O-N 2.92Å; S569-V571 PolarHBondContact O-N 3.29Å
570	A	44.3	Very low	72.4	Confident	60 Å²	60	48.4 Å²	48.4	50%	0.496	30%	0.301	S	S	.	.			trans	-70	91.1	170.2	0	0	0	0	0	109.4	P568 S572	P568-A570 PolarHBondContact O-N 2.89Å; A570-S572 WeakPolarHBondContact O-CB 3.23Å
571	V	67.5	Low	72.7	Confident	98 Å²	98	45.2 Å²	45.2	59%	0.594	29%	0.291	S	S	*	.			trans	-61.3	134.7	171.2	-177.1	0	0	0	0	109.3	S569 D583	S569-V571 PolarHBondContact O-N 3.29Å; V571-D583 CarbonylContact C-O 3.58Å; V571-D583 WeakPolarHBondContact CA-O 3Å; V571-D583 HydrophobicContact CG1-CB 4.45Å
572	S	66.1	Low	72.9	Confident	13 Å²	13	44 Å²	44	9%	0.091	28%	0.281	C	S	.	.			trans	-176.4	65.2	-157.6	-93.4	0	0	0	0	108.3	A570 D583 S584 L670	A570-S572 WeakPolarHBondContact O-CB 3.23Å; S572-D583 CarbonylContact C-O 3.53Å; S572-D583 WeakPolarHBondContact CA-O 3.36Å; S572-D583 PolarHBondContact N-O 3.49Å; S572-S584 VanDerWaalsContact O-CA 3.3Å; S572-S584 WeakPolarHBondContact O-CA 3.32Å; S572-L670 VanDerWaalsContact C-CD1 3.44Å; S572-L670 VanDerWaalsContact CB-CD1 3.44Å; S572-L670 WeakPolarHBondContact O-CD1 3.37Å
573	P	77	Confident	72.9	Confident	16 Å²	16	46.8 Å²	46.8	10%	0.104	30%	0.295	C	S	.	.			trans	-60.9	149.3	-158.9	22.3	-33.7	0	0	0	113.4	T581 Y582 S604 G605 E606	P573-T581 HydrophobicContact CB-CG2 4.31Å; P573-Y582 CarbonylContact C-O 3.34Å; P573-Y582 VanDerWaalsContact CA-O 3.24Å; P573-Y582 WeakPolarHBondContact CA-O 3.28Å; P573-S604 CarbonylContact O-C 3.57Å; P573-S604 WeakPolarHBondContact O-CA 3.4Å; P573-G605 CarbonylContact C-O 3.54Å; P573-G605 PolarHBondContact O-N 3.43Å; P573-E606 HydrophobicContact CB-CG 3.8Å; P573-E606 HydrophobicContact CG-CG 3.98Å
574	V	78.2	Confident	72.9	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.3	168.6	-56.7	0	0	0	0	110.2	Y582 I585 L588 V601 Y603 G605	V574-Y582 PolarHBondContact N-O 2.86Å; V574-Y582 PolarHBondContact O-N 3.39Å; V574-I585 HydrophobicContact CG1-CB 4.41Å; V574-L588 HydrophobicContact CG2-CB 3.69Å; V574-L588 HydrophobicContact CG2-CD1 3.64Å; V574-L588 HydrophobicContact CG2-CG 4.33Å; V574-V601 HydrophobicContact CB-CG1 4.25Å; V574-V601 HydrophobicContact CB-CG2 4.2Å; V574-V601 HydrophobicContact CG1-CG1 4.48Å; V574-V601 HydrophobicContact CG1-CG2 4.41Å; V574-V601 HydrophobicContact CG2-CG2 4.22Å; V574-Y603 CarbonylContact C-O 3.16Å; V574-Y603 WeakPolarHBondContact CA-O 3.14Å; V574-G605 CarbonylContact C-O 3.56Å; V574-G605 WeakPolarHBondContact CA-O 3.28Å; V574-G605 PolarHBondContact N-O 2.88Å
575	C	83.3	Confident	73.5	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.027	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.3	174.8	176.1	0	0	0	0	110.2	I602 Y603 G605 C607	C575-I602 PolarHBondContact O-N 3.5Å; C575-Y603 HydrophobicContact CB-CD1 3.59Å; C575-Y603 HydrophobicContact CB-CD2 4.21Å; C575-Y603 HydrophobicContact CB-CE1 3.26Å; C575-Y603 HydrophobicContact CB-CE2 3.9Å; C575-Y603 HydrophobicContact CB-CG 4.07Å; C575-Y603 VanDerWaalsContact CB-CZ 3.43Å; C575-Y603 PolarHBondContact N-O 3.36Å; C575-Y603 WeakPolarHBondContact SG-CE1 3.39Å; C575-G605 PolarHBondContact N-O 2.96Å; C575-C607 VanDerWaalsContact C-SG 3.54Å; C575-C607 WeakPolarHBondContact CA-SG 3.29Å; C575-C607 HydrophobicContact CB-CB 3.87Å; C575-C607 WeakPolarHBondContact CB-SG 3.37Å; C575-C607 WeakPolarHBondContact SG-CA 3.34Å; C575-C607 WeakPolarHBondContact SG-CB 3.47Å; C575-C607 CovalentContact SG-SG 2.03Å; C575-C607 PolarHBondContact SG-SG 2.99Å
576	G	79.9	Confident	74.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	152.8	175.7	0	0	0	0	0	114	D578 G579 V580 R600 C607	G576-D578 PolarHBondContact O-N 3.3Å; G576-D578 VanDerWaalsContact O-N 3.09Å; G576-G579 PolarHBondContact O-N 2.9Å; G576-V580 PolarHBondContact N-O 2.78Å; G576-R600 CarbonylContact C-O 3.59Å; G576-C607 PolarHBondContact N-SG 3.07Å
577	S	74.6	Confident	75.4	Confident	65 Å²	65	41.8 Å²	41.8	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-1.6	172.5	64.9	0	0	0	0	114.5	I599 R600	S577-I599 WeakPolarHBondContact OG-CA 3.35Å; S577-R600 PolarHBondContact N-O 3.25Å; S577-R600 PolarHBondContact OG-N 2.98Å
578	D	77.3	Confident	76.1	Confident	54 Å²	54	41.8 Å²	41.8	29%	0.289	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	1.9	167.1	74.5	-34.3	0	0	0	113.1	G576 V580 Y582 K595 I599	G576-D578 PolarHBondContact O-N 3.3Å; G576-D578 VanDerWaalsContact O-N 3.09Å; D578-V580 PolarHBondContact OD1-N 3.33Å; D578-V580 WeakPolarHBondContact OD2-CG2 3.16Å; D578-Y582 PolarHBondContact OD2-OH 2.7Å; D578-K595 IonicContact OD2-NZ 2.72Å; D578-K595 PolarHBondContact OD2-NZ 2.73Å; D578-I599 HydrophobicContact CB-CD1 4.44Å; D578-I599 HydrophobicContact CB-CG1 4.44Å; D578-I599 HydrophobicContact CB-CG2 4.47Å; D578-I599 WeakPolarHBondContact OD1-CG2 3.44Å
579	G	75	Confident	76.9	Confident	18 Å²	18	41.4 Å²	41.4	19%	0.186	25%	0.254	C	S	.	.	S	Bend	trans	85	14.4	178	0	0	0	0	0	115.3	G576 C607 P610	G576-G579 PolarHBondContact O-N 2.9Å; G579-C607 WeakPolarHBondContact O-CB 3.41Å; G579-P610 WeakPolarHBondContact O-CD 3.37Å
580	V	79.2	Confident	78	Confident	56 Å²	56	38.7 Å²	38.7	34%	0.339	23%	0.227	S	C	.	.			trans	-109.2	135.6	-176.1	178.7	0	0	0	0	111.6	G576 D578 Y582 C607	G576-V580 PolarHBondContact N-O 2.78Å; D578-V580 PolarHBondContact OD1-N 3.33Å; D578-V580 WeakPolarHBondContact OD2-CG2 3.16Å; V580-Y582 HydrophobicContact CB-CE2 3.83Å; V580-Y582 HydrophobicContact CG1-CE1 3.98Å; V580-Y582 HydrophobicContact CG1-CE2 4.04Å; V580-Y582 WeakPolarHBondContact O-CD2 3.46Å; V580-Y582 VanDerWaalsContact O-CE2 3.26Å; V580-Y582 WeakPolarHBondContact O-CE2 3.3Å; V580-C607 PolarHBondContact N-SG 3.32Å; V580-C607 PolarHBondContact O-SG 3.16Å
581	T	82.2	Confident	79.9	Confident	48 Å²	48	37 Å²	37	29%	0.294	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.4	169.3	-62	0	0	0	0	110.8	P573 E606 C607	P573-T581 HydrophobicContact CB-CG2 4.31Å; T581-E606 HydrophobicContact CG2-CB 3.8Å; T581-E606 HydrophobicContact CG2-CG 3.74Å; T581-C607 PolarHBondContact OG1-N 2.96Å
582	Y	84.2	Confident	80.6	Confident	11 Å²	11	32.4 Å²	32.4	4%	0.043	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.5	177.3	-69.8	-67.7	0	0	0	111.6	P573 V574 D578 V580 S584 H587 L588 T591 K595 I599	P573-Y582 CarbonylContact C-O 3.34Å; P573-Y582 VanDerWaalsContact CA-O 3.24Å; P573-Y582 WeakPolarHBondContact CA-O 3.28Å; V574-Y582 PolarHBondContact N-O 2.86Å; V574-Y582 PolarHBondContact O-N 3.39Å; D578-Y582 PolarHBondContact OD2-OH 2.7Å; V580-Y582 HydrophobicContact CB-CE2 3.83Å; V580-Y582 HydrophobicContact CG1-CE1 3.98Å; V580-Y582 HydrophobicContact CG1-CE2 4.04Å; V580-Y582 WeakPolarHBondContact O-CD2 3.46Å; V580-Y582 VanDerWaalsContact O-CE2 3.26Å; V580-Y582 WeakPolarHBondContact O-CE2 3.3Å; Y582-S584 PolarHBondContact O-N 3.31Å; Y582-H587 HydrophobicContact CD1-CB 4.49Å; Y582-L588 HydrophobicContact CD1-CB 4.49Å; Y582-L588 HydrophobicContact CD2-CB 3.69Å; Y582-L588 HydrophobicContact CD2-CD1 3.87Å; Y582-L588 HydrophobicContact CD2-CG 3.78Å; Y582-L588 HydrophobicContact CE2-CB 4.43Å; Y582-L588 HydrophobicContact CE2-CD1 4.45Å; Y582-L588 HydrophobicContact CE2-CG 4.18Å; Y582-L588 HydrophobicContact CG-CB 3.7Å; Y582-L588 HydrophobicContact CG-CG 4.32Å; Y582-T591 HydrophobicContact CE1-CG2 3.51Å; Y582-T591 VanDerWaalsContact CE1-OG1 3.26Å; Y582-T591 WeakPolarHBondContact CE1-OG1 3.43Å; Y582-T591 VanDerWaalsContact OH-CG2 3.28Å; Y582-T591 WeakPolarHBondContact OH-CG2 3.19Å; Y582-K595 PolarHBondContact OH-NZ 3.1Å; Y582-I599 HydrophobicContact CE2-CD1 4.48Å; Y582-I599 HydrophobicContact CE2-CG2 4.14Å; Y582-I599 WeakPolarHBondContact OH-CD1 3.48Å
583	D	79.7	Confident	81.5	Confident	81 Å²	81	31.9 Å²	31.9	43%	0.433	18%	0.179	S	C	.	.	S	Bend	trans	-58.9	-18	-172.5	-43.9	-35.9	0	0	0	114.3	V571 S572 H587	V571-D583 CarbonylContact C-O 3.58Å; V571-D583 WeakPolarHBondContact CA-O 3Å; V571-D583 HydrophobicContact CG1-CB 4.45Å; S572-D583 CarbonylContact C-O 3.53Å; S572-D583 WeakPolarHBondContact CA-O 3.36Å; S572-D583 PolarHBondContact N-O 3.49Å; D583-H587 HydrophobicContact CB-CB 4.41Å; D583-H587 IonicContact OD2-CD2 2.63Å
584	S	81	Confident	81.8	Confident	10 Å²	10	35.7 Å²	35.7	7%	0.07	20%	0.196	C	C	.	.	S	Bend	trans	-160.1	173.9	161.4	67.9	0	0	0	0	111.9	S572 Y582 C586 H587 L588	S572-S584 VanDerWaalsContact O-CA 3.3Å; S572-S584 WeakPolarHBondContact O-CA 3.32Å; Y582-S584 PolarHBondContact O-N 3.31Å; S584-C586 PolarHBondContact O-N 2.77Å; S584-C586 PolarHBondContact OG-N 2.86Å; S584-H587 PolarHBondContact N-ND1 3.27Å; S584-H587 WeakPolarHBondContact O-CA 3.35Å; S584-H587 WeakPolarHBondContact O-CB 3.01Å; S584-H587 PolarHBondContact O-N 2.78Å; S584-H587 PolarHBondContact OG-N 3.5Å; S584-H587 PolarHBondContact OG-ND1 2.98Å; S584-L588 PolarHBondContact O-N 2.96Å
585	I	82.9	Confident	81.9	Confident	84 Å²	84	39.3 Å²	39.3	43%	0.431	21%	0.211	S	C	.	.	H	α-helix	trans	-53.5	-33.7	169.4	-170.3	169.3	0	0	0	112	V574 L588 E589 V601	V574-I585 HydrophobicContact CG1-CB 4.41Å; I585-L588 PolarHBondContact O-N 3.46Å; I585-E589 HydrophobicContact CG1-CG 4.49Å; I585-E589 WeakPolarHBondContact O-CB 3Å; I585-E589 WeakPolarHBondContact O-CG 3.41Å; I585-E589 PolarHBondContact O-N 2.8Å; I585-V601 HydrophobicContact CD1-CG2 4.09Å; I585-V601 HydrophobicContact CG1-CG2 3.99Å
586	C	84.2	Confident	81.5	Confident	24 Å²	24	44.7 Å²	44.7	16%	0.162	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-40.9	172.1	-178.3	0	0	0	0	111.7	C567 S584 L588 E589 R590	C567-C586 WeakPolarHBondContact CA-SG 3.26Å; C567-C586 HydrophobicContact CB-CB 3.69Å; C567-C586 WeakPolarHBondContact CB-SG 3.08Å; C567-C586 WeakPolarHBondContact SG-CB 3.03Å; C567-C586 PolarHBondContact SG-O 3.15Å; C567-C586 CovalentContact SG-SG 2.04Å; C567-C586 PolarHBondContact SG-SG 2.9Å; S584-C586 PolarHBondContact O-N 2.77Å; S584-C586 PolarHBondContact OG-N 2.86Å; C586-L588 VanDerWaalsContact C-N 3.3Å; C586-L588 PolarHBondContact O-N 2.94Å; C586-E589 PolarHBondContact O-N 3.13Å; C586-R590 WeakPolarHBondContact O-CB 3.43Å; C586-R590 PolarHBondContact O-N 2.94Å
587	H	86.4	Confident	81.4	Confident	29 Å²	29	52 Å²	52	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-66.4	-33.3	176	-66.6	89.9	0	0	0	112.2	C567 Y582 D583 S584 T591	C567-H587 WeakPolarHBondContact CB-CE1 3.35Å; Y582-H587 HydrophobicContact CD1-CB 4.49Å; D583-H587 HydrophobicContact CB-CB 4.41Å; D583-H587 IonicContact OD2-CD2 2.63Å; S584-H587 PolarHBondContact N-ND1 3.27Å; S584-H587 WeakPolarHBondContact O-CA 3.35Å; S584-H587 WeakPolarHBondContact O-CB 3.01Å; S584-H587 PolarHBondContact O-N 2.78Å; S584-H587 PolarHBondContact OG-N 3.5Å; S584-H587 PolarHBondContact OG-ND1 2.98Å; H587-T591 VanDerWaalsContact O-CB 3.27Å; H587-T591 WeakPolarHBondContact O-CB 3.32Å; H587-T591 PolarHBondContact O-N 2.76Å; H587-T591 PolarHBondContact O-OG1 2.75Å
588	L	88.4	Confident	81	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-49	172.1	-179.2	155.4	0	0	0	111.3	V574 Y582 S584 I585 C586 T591 A592 I599 V601	V574-L588 HydrophobicContact CG2-CB 3.69Å; V574-L588 HydrophobicContact CG2-CD1 3.64Å; V574-L588 HydrophobicContact CG2-CG 4.33Å; Y582-L588 HydrophobicContact CD1-CB 4.49Å; Y582-L588 HydrophobicContact CD2-CB 3.69Å; Y582-L588 HydrophobicContact CD2-CD1 3.87Å; Y582-L588 HydrophobicContact CD2-CG 3.78Å; Y582-L588 HydrophobicContact CE2-CB 4.43Å; Y582-L588 HydrophobicContact CE2-CD1 4.45Å; Y582-L588 HydrophobicContact CE2-CG 4.18Å; Y582-L588 HydrophobicContact CG-CB 3.7Å; Y582-L588 HydrophobicContact CG-CG 4.32Å; S584-L588 PolarHBondContact O-N 2.96Å; I585-L588 PolarHBondContact O-N 3.46Å; C586-L588 VanDerWaalsContact C-N 3.3Å; C586-L588 PolarHBondContact O-N 2.94Å; L588-T591 CarbonylContact O-C 3.54Å; L588-T591 PolarHBondContact O-N 2.89Å; L588-A592 VanDerWaalsContact O-CB 3.31Å; L588-A592 WeakPolarHBondContact O-CB 3.37Å; L588-A592 PolarHBondContact O-N 2.64Å; L588-I599 HydrophobicContact CD1-CG2 4.16Å; L588-I599 HydrophobicContact CD2-CB 4.29Å; L588-I599 HydrophobicContact CD2-CG2 4.22Å; L588-I599 WeakPolarHBondContact CD2-O 3.42Å; L588-I599 HydrophobicContact CG-CB 4.45Å; L588-I599 HydrophobicContact CG-CG2 3.96Å; L588-V601 HydrophobicContact CD1-CB 4.47Å; L588-V601 HydrophobicContact CD1-CG2 3.82Å; L588-V601 HydrophobicContact CD2-CG2 4.49Å
589	E	82	Confident	80.9	Confident	80 Å²	80	51.6 Å²	51.6	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.6	-74	173.7	178.1	0	0	111.7	I585 C586 T591 A592 C593	I585-E589 HydrophobicContact CG1-CG 4.49Å; I585-E589 WeakPolarHBondContact O-CB 3Å; I585-E589 WeakPolarHBondContact O-CG 3.41Å; I585-E589 PolarHBondContact O-N 2.8Å; C586-E589 PolarHBondContact O-N 3.13Å; E589-T591 VanDerWaalsContact C-N 3.3Å; E589-T591 PolarHBondContact O-N 3.43Å; E589-A592 PolarHBondContact O-N 3.09Å; E589-C593 VanDerWaalsContact O-CB 3.31Å; E589-C593 WeakPolarHBondContact O-CB 3.19Å; E589-C593 PolarHBondContact O-N 3.44Å
590	R	83.9	Confident	80.9	Confident	55 Å²	55	57.7 Å²	57.7	21%	0.208	27%	0.272	C	S	.	.	H	α-helix	trans	-59.9	-39.2	173.4	-179.3	-177	176.3	-162	0.7	111.1	C563 E565 C586 C593 Q594	C563-R590 HydrophobicContact CB-CB 4.47Å; C563-R590 HydrophobicContact CB-CG 3.83Å; E565-R590 VanDerWaalsContact CD-NE 3.3Å; E565-R590 IonicContact OE1-CZ 2.7Å; E565-R590 VanDerWaalsContact OE1-CZ 3.27Å; E565-R590 IonicContact OE1-NE 3.68Å; E565-R590 PolarHBondContact OE1-NE 2.98Å; E565-R590 IonicContact OE1-NH2 2.66Å; E565-R590 PolarHBondContact OE1-NH2 3.45Å; E565-R590 IonicContact OE2-CZ 2.78Å; E565-R590 IonicContact OE2-NE 3.23Å; E565-R590 IonicContact OE2-NH2 3.96Å; E565-R590 PolarHBondContact OE2-NH2 2.04Å; C586-R590 WeakPolarHBondContact O-CB 3.43Å; C586-R590 PolarHBondContact O-N 2.94Å; R590-C593 WeakPolarHBondContact O-CB 3.42Å; R590-Q594 WeakPolarHBondContact O-CB 3.33Å; R590-Q594 VanDerWaalsContact O-CG 3.24Å; R590-Q594 WeakPolarHBondContact O-CG 3.23Å; R590-Q594 PolarHBondContact O-N 3.12Å
591	T	84.8	Confident	80.5	Confident	23 Å²	23	57.2 Å²	57.2	14%	0.141	27%	0.269	C	S	.	.	H	α-helix	trans	-83.8	-28	179.2	-50.7	0	0	0	0	113.3	Y582 H587 L588 E589 C593 Q594 K595	Y582-T591 HydrophobicContact CE1-CG2 3.51Å; Y582-T591 VanDerWaalsContact CE1-OG1 3.26Å; Y582-T591 WeakPolarHBondContact CE1-OG1 3.43Å; Y582-T591 VanDerWaalsContact OH-CG2 3.28Å; Y582-T591 WeakPolarHBondContact OH-CG2 3.19Å; H587-T591 VanDerWaalsContact O-CB 3.27Å; H587-T591 WeakPolarHBondContact O-CB 3.32Å; H587-T591 PolarHBondContact O-N 2.76Å; H587-T591 PolarHBondContact O-OG1 2.75Å; L588-T591 CarbonylContact O-C 3.54Å; L588-T591 PolarHBondContact O-N 2.89Å; E589-T591 VanDerWaalsContact C-N 3.3Å; E589-T591 PolarHBondContact O-N 3.43Å; T591-C593 VanDerWaalsContact C-N 3.29Å; T591-Q594 PolarHBondContact O-N 3.31Å; T591-K595 HydrophobicContact CG2-CD 3.64Å; T591-K595 VanDerWaalsContact CG2-CE 3.42Å; T591-K595 HydrophobicContact CG2-CG 3.7Å; T591-K595 WeakPolarHBondContact O-CB 3.39Å; T591-K595 WeakPolarHBondContact O-CG 3.48Å; T591-K595 PolarHBondContact O-N 3.19Å
592	A	82.4	Confident	79.4	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-46.2	167.7	0	0	0	0	0	110	L588 E589 M596 R597 I599	L588-A592 VanDerWaalsContact O-CB 3.31Å; L588-A592 WeakPolarHBondContact O-CB 3.37Å; L588-A592 PolarHBondContact O-N 2.64Å; E589-A592 PolarHBondContact O-N 3.09Å; A592-M596 PolarHBondContact O-N 2.95Å; A592-M596 VanDerWaalsContact O-N 3.13Å; A592-R597 CarbonylContact C-O 3.55Å; A592-R597 WeakPolarHBondContact CA-O 3.35Å; A592-R597 WeakPolarHBondContact CB-O 3.41Å; A592-R597 PolarHBondContact O-N 3.05Å; A592-R597 VanDerWaalsContact O-O 3.08Å; A592-I599 HydrophobicContact CB-CB 3.95Å; A592-I599 HydrophobicContact CB-CD1 4.21Å; A592-I599 HydrophobicContact CB-CG1 3.99Å
593	C	84.7	Confident	78.3	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.014	27%	0.273	C	S	.	.	H	α-helix	trans	-56.9	-62.2	167.7	170.7	0	0	0	0	112.6	E549 C563 E589 R590 T591 K595 M596	E549-C593 HydrophobicContact CG-CB 3.89Å; E549-C593 WeakPolarHBondContact CG-SG 3.21Å; C563-C593 WeakPolarHBondContact CA-SG 3.33Å; C563-C593 HydrophobicContact CB-CB 3.79Å; C563-C593 WeakPolarHBondContact CB-SG 3.23Å; C563-C593 PolarHBondContact N-SG 2.68Å; C563-C593 VanDerWaalsContact N-SG 3.38Å; C563-C593 VanDerWaalsContact SG-C 3.57Å; C563-C593 WeakPolarHBondContact SG-CB 3.43Å; C563-C593 CovalentContact SG-SG 2.02Å; C563-C593 PolarHBondContact SG-SG 3.45Å; E589-C593 VanDerWaalsContact O-CB 3.31Å; E589-C593 WeakPolarHBondContact O-CB 3.19Å; E589-C593 PolarHBondContact O-N 3.44Å; R590-C593 WeakPolarHBondContact O-CB 3.42Å; T591-C593 VanDerWaalsContact C-N 3.29Å; C593-K595 VanDerWaalsContact C-N 3.34Å; C593-K595 PolarHBondContact O-N 2.74Å; C593-M596 PolarHBondContact O-N 2.82Å
594	Q	83.1	Confident	77.4	Confident	95 Å²	95	55.4 Å²	55.4	44%	0.444	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-38.3	-174.8	-73.4	171.4	-12.4	0	0	113.1	C563 E565 R590 T591 M596	C563-Q594 HydrophobicContact CB-CG 4.08Å; C563-Q594 WeakPolarHBondContact SG-CG 3.5Å; C563-Q594 PolarHBondContact SG-N 3.49Å; E565-Q594 PolarHBondContact OE1-NE2 3.04Å; R590-Q594 WeakPolarHBondContact O-CB 3.33Å; R590-Q594 VanDerWaalsContact O-CG 3.24Å; R590-Q594 WeakPolarHBondContact O-CG 3.23Å; R590-Q594 PolarHBondContact O-N 3.12Å; T591-Q594 PolarHBondContact O-N 3.31Å; Q594-M596 VanDerWaalsContact C-N 3.3Å
595	K	79.6	Confident	76.3	Confident	80 Å²	80	55.2 Å²	55.2	35%	0.348	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-7.1	177	-68.7	179.1	-179.2	169.2	0	113.2	D578 Y582 T591 C593 R597 I599	D578-K595 IonicContact OD2-NZ 2.72Å; D578-K595 PolarHBondContact OD2-NZ 2.73Å; Y582-K595 PolarHBondContact OH-NZ 3.1Å; T591-K595 HydrophobicContact CG2-CD 3.64Å; T591-K595 VanDerWaalsContact CG2-CE 3.42Å; T591-K595 HydrophobicContact CG2-CG 3.7Å; T591-K595 WeakPolarHBondContact O-CB 3.39Å; T591-K595 WeakPolarHBondContact O-CG 3.48Å; T591-K595 PolarHBondContact O-N 3.19Å; C593-K595 VanDerWaalsContact C-N 3.34Å; C593-K595 PolarHBondContact O-N 2.74Å; K595-R597 HydrophobicContact CB-CG 4.46Å; K595-I599 HydrophobicContact CD-CD1 4.14Å
596	M	75.4	Confident	76	Confident	116 Å²	116	57.3 Å²	57.3	57%	0.571	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	53.7	-174	-66.1	-163.1	-85.7	0	0	112.8	W546 A592 C593 Q594	W546-M596 HydrophobicContact CD2-CB 4.25Å; W546-M596 VanDerWaalsContact CE2-CB 3.48Å; W546-M596 HydrophobicContact CH2-CB 4.48Å; W546-M596 WeakPolarHBondContact CH2-O 3.25Å; W546-M596 HydrophobicContact CZ2-CB 3.62Å; W546-M596 HydrophobicContact CZ2-CG 4.4Å; W546-M596 WeakPolarHBondContact CZ2-O 3.01Å; W546-M596 WeakPolarHBondContact CZ3-O 3.31Å; W546-M596 VanDerWaalsContact NE1-CG 3.28Å; A592-M596 PolarHBondContact O-N 2.95Å; A592-M596 VanDerWaalsContact O-N 3.13Å; C593-M596 PolarHBondContact O-N 2.82Å; Q594-M596 VanDerWaalsContact C-N 3.3Å
597	R	77.4	Confident	75.1	Confident	154 Å²	154	56.9 Å²	56.9	58%	0.581	26%	0.262	S	S	*	.	S	Bend	trans	-144.1	148.8	-175.9	-70.9	178.6	-174.7	-163.9	-2.1	111.7	A592 K595 I599	A592-R597 CarbonylContact C-O 3.55Å; A592-R597 WeakPolarHBondContact CA-O 3.35Å; A592-R597 WeakPolarHBondContact CB-O 3.41Å; A592-R597 PolarHBondContact O-N 3.05Å; A592-R597 VanDerWaalsContact O-O 3.08Å; K595-R597 HydrophobicContact CB-CG 4.46Å; R597-I599 HydrophobicContact CB-CG1 4.28Å; R597-I599 PolarHBondContact O-N 3.39Å
598	E	67.6	Low	73.7	Confident	103 Å²	103	57 Å²	57	48%	0.481	27%	0.266	S	S	.	.			trans	-74.2	112.6	165.2	-169.8	179.9	-162.7	0	0	109.4	R600	E598-R600 HydrophobicContact CG-CG 4.31Å; E598-R600 IonicContact OE1-CZ 2.82Å; E598-R600 IonicContact OE1-NE 3.77Å; E598-R600 PolarHBondContact OE1-NE 2.75Å; E598-R600 IonicContact OE1-NH2 2.65Å; E598-R600 PolarHBondContact OE1-NH2 3.25Å; E598-R600 IonicContact OE2-CZ 3.55Å; E598-R600 IonicContact OE2-NE 2.74Å; E598-R600 IonicContact OE2-NH2 2.68Å; E598-R600 PolarHBondContact OE2-NH2 3.37Å
599	I	74.9	Confident	72.1	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.036	29%	0.291	C	S	.	.			trans	-119.8	130.6	171.9	-47.6	177.4	0	0	0	106.7	S577 D578 Y582 L588 A592 K595 R597	S577-I599 WeakPolarHBondContact OG-CA 3.35Å; D578-I599 HydrophobicContact CB-CD1 4.44Å; D578-I599 HydrophobicContact CB-CG1 4.44Å; D578-I599 HydrophobicContact CB-CG2 4.47Å; D578-I599 WeakPolarHBondContact OD1-CG2 3.44Å; Y582-I599 HydrophobicContact CE2-CD1 4.48Å; Y582-I599 HydrophobicContact CE2-CG2 4.14Å; Y582-I599 WeakPolarHBondContact OH-CD1 3.48Å; L588-I599 HydrophobicContact CD1-CG2 4.16Å; L588-I599 HydrophobicContact CD2-CB 4.29Å; L588-I599 HydrophobicContact CD2-CG2 4.22Å; L588-I599 WeakPolarHBondContact CD2-O 3.42Å; L588-I599 HydrophobicContact CG-CB 4.45Å; L588-I599 HydrophobicContact CG-CG2 3.96Å; A592-I599 HydrophobicContact CB-CB 3.95Å; A592-I599 HydrophobicContact CB-CD1 4.21Å; A592-I599 HydrophobicContact CB-CG1 3.99Å; K595-I599 HydrophobicContact CD-CD1 4.14Å; R597-I599 HydrophobicContact CB-CG1 4.28Å; R597-I599 PolarHBondContact O-N 3.39Å
600	R	75.9	Confident	70.4	Confident	147 Å²	147	61 Å²	61	56%	0.555	29%	0.289	S	S	*	.			trans	-118.7	148.7	178.9	-57.3	-177.7	-172.7	151.2	4.4	109.8	G576 S577 E598 I602	G576-R600 CarbonylContact C-O 3.59Å; S577-R600 PolarHBondContact N-O 3.25Å; S577-R600 PolarHBondContact OG-N 2.98Å; E598-R600 HydrophobicContact CG-CG 4.31Å; E598-R600 IonicContact OE1-CZ 2.82Å; E598-R600 IonicContact OE1-NE 3.77Å; E598-R600 PolarHBondContact OE1-NE 2.75Å; E598-R600 IonicContact OE1-NH2 2.65Å; E598-R600 PolarHBondContact OE1-NH2 3.25Å; E598-R600 IonicContact OE2-CZ 3.55Å; E598-R600 IonicContact OE2-NE 2.74Å; E598-R600 IonicContact OE2-NH2 2.68Å; E598-R600 PolarHBondContact OE2-NH2 3.37Å; R600-I602 PolarHBondContact O-N 3.21Å
601	V	70.8	Confident	68.7	Low	45 Å²	45	66.2 Å²	66.2	27%	0.273	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	116.4	170.9	176.8	0	0	0	0	109.1	V574 I585 L588 Y603	V574-V601 HydrophobicContact CB-CG1 4.25Å; V574-V601 HydrophobicContact CB-CG2 4.2Å; V574-V601 HydrophobicContact CG1-CG1 4.48Å; V574-V601 HydrophobicContact CG1-CG2 4.41Å; V574-V601 HydrophobicContact CG2-CG2 4.22Å; I585-V601 HydrophobicContact CD1-CG2 4.09Å; I585-V601 HydrophobicContact CG1-CG2 3.99Å; L588-V601 HydrophobicContact CD1-CB 4.47Å; L588-V601 HydrophobicContact CD1-CG2 3.82Å; L588-V601 HydrophobicContact CD2-CG2 4.49Å; V601-Y603 WeakPolarHBondContact CG1-O 3.42Å
602	I	59	Low	67.3	Low	80 Å²	80	66.7 Å²	66.7	41%	0.41	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-52	164.3	-48.4	-177.1	0	0	0	108	C575 R600 I625	C575-I602 PolarHBondContact O-N 3.5Å; R600-I602 PolarHBondContact O-N 3.21Å; I602-I625 HydrophobicContact CG2-CG2 4.05Å
603	Y	61.3	Low	66.3	Low	8 Å²	8	66.9 Å²	66.9	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	161.4	177.2	57.6	-78.1	0	0	0	111.8	V574 C575 V601 E606 C607 S608 I625 P663	V574-Y603 CarbonylContact C-O 3.16Å; V574-Y603 WeakPolarHBondContact CA-O 3.14Å; C575-Y603 HydrophobicContact CB-CD1 3.59Å; C575-Y603 HydrophobicContact CB-CD2 4.21Å; C575-Y603 HydrophobicContact CB-CE1 3.26Å; C575-Y603 HydrophobicContact CB-CE2 3.9Å; C575-Y603 HydrophobicContact CB-CG 4.07Å; C575-Y603 VanDerWaalsContact CB-CZ 3.43Å; C575-Y603 PolarHBondContact N-O 3.36Å; C575-Y603 WeakPolarHBondContact SG-CE1 3.39Å; V601-Y603 WeakPolarHBondContact CG1-O 3.42Å; Y603-E606 WeakPolarHBondContact CE2-O 3.49Å; Y603-E606 PolarHBondContact OH-O 2.74Å; Y603-C607 WeakPolarHBondContact OH-CA 3.46Å; Y603-S608 PolarHBondContact OH-N 3.2Å; Y603-S608 VanDerWaalsContact OH-N 3.08Å; Y603-I625 HydrophobicContact CD1-CB 4.04Å; Y603-I625 HydrophobicContact CD1-CD1 4.3Å; Y603-I625 HydrophobicContact CD1-CG2 3.22Å; Y603-I625 HydrophobicContact CD2-CD1 4.42Å; Y603-I625 HydrophobicContact CE1-CB 3.63Å; Y603-I625 HydrophobicContact CE1-CD1 3.63Å; Y603-I625 HydrophobicContact CE1-CG1 4.21Å; Y603-I625 HydrophobicContact CE1-CG2 3.37Å; Y603-I625 HydrophobicContact CE2-CD1 3.8Å; Y603-I625 HydrophobicContact CG-CG2 3.99Å; Y603-I625 WeakPolarHBondContact OH-CD1 3.31Å; Y603-P663 HydrophobicContact CD1-CB 4.38Å; Y603-P663 HydrophobicContact CD2-CB 3.9Å; Y603-P663 HydrophobicContact CG-CB 3.67Å
604	S	59.2	Low	65.1	Low	15 Å²	15	74 Å²	74	11%	0.105	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.6	161.1	-50.1	0	0	0	0	108.4	P573 T664 C665 P666 C686	P573-S604 CarbonylContact O-C 3.57Å; P573-S604 WeakPolarHBondContact O-CA 3.4Å; S604-T664 VanDerWaalsContact O-O 3.1Å; S604-C665 WeakPolarHBondContact O-CA 3.13Å; S604-P666 VanDerWaalsContact C-CD 3.47Å; S604-P666 WeakPolarHBondContact O-CD 3.38Å; S604-C686 PolarHBondContact N-SG 3.3Å; S604-C686 PolarHBondContact O-SG 2.98Å
605	G	59.3	Low	63.7	Low	5 Å²	5	76.2 Å²	76.2	5%	0.052	37%	0.367	C	S	.	.	S	Bend	trans	131.1	165.5	-160.9	0	0	0	0	0	109.9	P573 V574 C575 T664	P573-G605 CarbonylContact C-O 3.54Å; P573-G605 PolarHBondContact O-N 3.43Å; V574-G605 CarbonylContact C-O 3.56Å; V574-G605 WeakPolarHBondContact CA-O 3.28Å; V574-G605 PolarHBondContact N-O 2.88Å; C575-G605 PolarHBondContact N-O 2.96Å; G605-T664 WeakPolarHBondContact CA-O 3.39Å
606	E	75.4	Confident	62.5	Low	128 Å²	128	76.7 Å²	76.7	60%	0.598	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-77.6	144.5	176	-57.6	-167.3	154.4	0	0	110.8	P573 T581 Y603 S608	P573-E606 HydrophobicContact CB-CG 3.8Å; P573-E606 HydrophobicContact CG-CG 3.98Å; T581-E606 HydrophobicContact CG2-CB 3.8Å; T581-E606 HydrophobicContact CG2-CG 3.74Å; Y603-E606 WeakPolarHBondContact CE2-O 3.49Å; Y603-E606 PolarHBondContact OH-O 2.74Å; E606-S608 PolarHBondContact O-N 3.23Å
607	C	65	Low	61.4	Low	16 Å²	16	78.5 Å²	78.5	11%	0.108	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-65.5	120.6	171.7	-81.8	0	0	0	0	110.4	C575 G576 G579 V580 T581 Y603	C575-C607 VanDerWaalsContact C-SG 3.54Å; C575-C607 WeakPolarHBondContact CA-SG 3.29Å; C575-C607 HydrophobicContact CB-CB 3.87Å; C575-C607 WeakPolarHBondContact CB-SG 3.37Å; C575-C607 WeakPolarHBondContact SG-CA 3.34Å; C575-C607 WeakPolarHBondContact SG-CB 3.47Å; C575-C607 CovalentContact SG-SG 2.03Å; C575-C607 PolarHBondContact SG-SG 2.99Å; G576-C607 PolarHBondContact N-SG 3.07Å; G579-C607 WeakPolarHBondContact O-CB 3.41Å; V580-C607 PolarHBondContact N-SG 3.32Å; V580-C607 PolarHBondContact O-SG 3.16Å; T581-C607 PolarHBondContact OG1-N 2.96Å; Y603-C607 WeakPolarHBondContact OH-CA 3.46Å
608	S	57.2	Low	60.4	Low	30 Å²	30	77.4 Å²	77.4	21%	0.21	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-64.5	134.5	158.9	-55.6	0	0	0	0	109.4	Y603 E606 P610 S627	Y603-S608 PolarHBondContact OH-N 3.2Å; Y603-S608 VanDerWaalsContact OH-N 3.08Å; E606-S608 PolarHBondContact O-N 3.23Å; S608-P610 WeakPolarHBondContact O-CD 3.34Å; S608-P610 WeakPolarHBondContact O-CG 3.5Å; S608-S627 VanDerWaalsContact CB-CB 3.42Å; S608-S627 WeakPolarHBondContact CB-OG 3.49Å; S608-S627 WeakPolarHBondContact OG-CB 3.49Å; S608-S627 PolarHBondContact OG-OG 2.79Å
609	E	55	Low	60.2	Low	119 Å²	119	77.7 Å²	77.7	56%	0.556	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-52.2	116.4	-174.2	-78.5	-158.7	133	0	0	113.4	R628	E609-R628 HydrophobicContact CB-CB 4.27Å; E609-R628 HydrophobicContact CB-CG 4.3Å; E609-R628 WeakPolarHBondContact O-CG 3.4Å; E609-R628 IonicContact OE1-NH1 2.87Å; E609-R628 VanDerWaalsContact OE2-CD 3.24Å; E609-R628 WeakPolarHBondContact OE2-CD 2.96Å; E609-R628 IonicContact OE2-CZ 3.06Å; E609-R628 IonicContact OE2-NE 2.65Å; E609-R628 IonicContact OE2-NH1 2.98Å; E609-R628 PolarHBondContact OE2-NH1 2.03Å
610	P	47.7	Very low	59.9	Low	50 Å²	50	79.3 Å²	79.3	33%	0.325	41%	0.408	S	S	.	.			trans	-123.9	101.9	-169.4	38	-23.3	0	0	0	113.9	G579 S608 C626	G579-P610 WeakPolarHBondContact O-CD 3.37Å; S608-P610 WeakPolarHBondContact O-CD 3.34Å; S608-P610 WeakPolarHBondContact O-CG 3.5Å; P610-C626 HydrophobicContact CB-CB 4.39Å
611	K	48	Very low	59.4	Low	165 Å²	165	79.1 Å²	79.1	72%	0.717	41%	0.414	S	S	*	.	S	Bend	trans	-127.4	-13.1	154.2	-82.8	-172.5	177.3	175.9	0	114.2
612	D	53.7	Low	59.3	Low	32 Å²	32	80.4 Å²	80.4	17%	0.171	44%	0.436	C	S	.	.	S	Bend	trans	-107.4	-24.2	-152.7	-47.3	-18	0	0	0	113.9	I614 L615 L616 R628 P658	D612-I614 PolarHBondContact O-N 3.14Å; D612-L615 WeakPolarHBondContact O-CA 3.44Å; D612-L615 WeakPolarHBondContact O-CB 3.46Å; D612-L615 PolarHBondContact O-N 3.38Å; D612-L616 PolarHBondContact O-N 2.95Å; D612-R628 VanDerWaalsContact CG-NH2 3.35Å; D612-R628 IonicContact OD1-CZ 2.7Å; D612-R628 IonicContact OD1-NH2 3.29Å; D612-R628 PolarHBondContact OD1-NH2 3.25Å; D612-R628 IonicContact OD2-CZ 3.54Å; D612-R628 VanDerWaalsContact OD2-CZ 3.23Å; D612-R628 IonicContact OD2-NE 3.98Å; D612-R628 PolarHBondContact OD2-NE 3.19Å; D612-R628 IonicContact OD2-NH2 2.69Å; D612-R628 PolarHBondContact OD2-NH2 2.62Å; D612-P658 VanDerWaalsContact C-CB 3.48Å; D612-P658 VanDerWaalsContact C-CG 3.47Å; D612-P658 HydrophobicContact CB-CB 3.71Å; D612-P658 HydrophobicContact CB-CG 3.44Å; D612-P658 VanDerWaalsContact CB-CG 3.44Å
613	C	62.9	Low	59.9	Low	7 Å²	7	80.4 Å²	80.4	5%	0.047	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-31.8	178.7	-48.9	0	0	0	0	112.4	L615 L616 C626 P658	C613-L615 VanDerWaalsContact C-N 3.28Å; C613-L615 PolarHBondContact O-N 2.89Å; C613-L616 PolarHBondContact O-N 3.36Å; C613-C626 HydrophobicContact CB-CB 3.88Å; C613-C626 WeakPolarHBondContact CB-SG 3.48Å; C613-C626 WeakPolarHBondContact SG-CA 3.45Å; C613-C626 WeakPolarHBondContact SG-CB 3.48Å; C613-C626 CovalentContact SG-SG 2.03Å; C613-C626 PolarHBondContact SG-SG 3.32Å; C613-P658 HydrophobicContact CB-CB 4.03Å; C613-P658 WeakPolarHBondContact SG-CB 3.39Å
614	I	58.5	Low	60.5	Low	153 Å²	153	82.6 Å²	82.6	79%	0.785	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-29.8	175.8	-58.9	176.7	0	0	0	110.7	D612	D612-I614 PolarHBondContact O-N 3.14Å
615	L	53.4	Low	60.7	Low	141 Å²	141	82 Å²	82	74%	0.738	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-22.7	173.2	-70.8	164.6	0	0	0	112.8	D612 C613 N617	D612-L615 WeakPolarHBondContact O-CA 3.44Å; D612-L615 WeakPolarHBondContact O-CB 3.46Å; D612-L615 PolarHBondContact O-N 3.38Å; C613-L615 VanDerWaalsContact C-N 3.28Å; C613-L615 PolarHBondContact O-N 2.89Å; L615-N617 VanDerWaalsContact C-N 3.33Å
616	L	55.2	Low	61.1	Low	90 Å²	90	83.3 Å²	83.3	47%	0.471	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	7.1	173.3	-72.5	-162.3	0	0	0	114.9	D612 C613 Q618 I657 P658	D612-L616 PolarHBondContact O-N 2.95Å; C613-L616 PolarHBondContact O-N 3.36Å; L616-Q618 PolarHBondContact O-N 3.38Å; L616-Q618 VanDerWaalsContact O-N 3.09Å; L616-I657 HydrophobicContact CD1-CG2 4.46Å; L616-P658 HydrophobicContact CD1-CG 3.63Å; L616-P658 HydrophobicContact CG-CG 3.75Å
617	N	51.7	Low	60.4	Low	154 Å²	154	77.6 Å²	77.6	82%	0.824	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	14.7	-178.9	-99.7	-26.2	0	0	0	115.1	L615 P619	L615-N617 VanDerWaalsContact C-N 3.33Å; N617-P619 WeakPolarHBondContact O-CD 3.49Å
618	Q	57.1	Low	60.1	Low	131 Å²	131	80.6 Å²	80.6	61%	0.612	43%	0.429	S	S	*	.			trans	-111.7	96.4	179	-73.5	-173.6	-42	0	0	111.2	L616 C620	L616-Q618 PolarHBondContact O-N 3.38Å; L616-Q618 VanDerWaalsContact O-N 3.09Å; Q618-C620 PolarHBondContact O-N 2.76Å
619	P	62.2	Low	60.1	Low	108 Å²	108	82.3 Å²	82.3	70%	0.701	44%	0.435	S	S	*	.			trans	-73.3	122.1	168.1	29.8	-32.1	0	0	0	109.9	N617	N617-P619 WeakPolarHBondContact O-CD 3.49Å
620	C	68.6	Low	59.8	Low	42 Å²	42	80.2 Å²	80.2	28%	0.284	42%	0.424	S	S	.	.			trans	-57.3	143	178.4	-50.9	0	0	0	0	111.9	Q618 E624 C660	Q618-C620 PolarHBondContact O-N 2.76Å; C620-E624 HydrophobicContact CB-CB 3.67Å; C620-C660 WeakPolarHBondContact CA-SG 3.02Å; C620-C660 HydrophobicContact CB-CB 3.62Å; C620-C660 WeakPolarHBondContact CB-SG 3.02Å; C620-C660 WeakPolarHBondContact SG-CB 3.49Å; C620-C660 CovalentContact SG-SG 2.04Å; C620-C660 PolarHBondContact SG-SG 3.24Å
621	Q	66.3	Low	59.7	Low	143 Å²	143	81 Å²	81	67%	0.668	43%	0.425	S	S	*	.			trans	-108.2	151.3	-168.8	-58.3	-167	26.2	0	0	113.3	Y623 E624	Q621-Y623 PolarHBondContact O-N 2.82Å; Q621-E624 PolarHBondContact N-OE2 2.83Å; Q621-E624 VanDerWaalsContact O-CB 3.26Å; Q621-E624 WeakPolarHBondContact O-CB 3.22Å; Q621-E624 VanDerWaalsContact O-CD 3.28Å; Q621-E624 WeakPolarHBondContact O-CG 3.48Å; Q621-E624 PolarHBondContact O-N 3.28Å
622	G	69.2	Low	59.3	Low	72 Å²	72	77.7 Å²	77.7	74%	0.742	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	-101.9	178	0	0	0	0	0	113.2
623	Y	70.9	Confident	58.4	Low	80 Å²	80	84.9 Å²	84.9	31%	0.314	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	11.6	177.4	-61.5	-70.7	0	0	0	112.8	Q621 P663 R689 A692	Q621-Y623 PolarHBondContact O-N 2.82Å; Y623-P663 VanDerWaalsContact O-CD 3.3Å; Y623-P663 WeakPolarHBondContact O-CD 3.47Å; Y623-R689 HydrophobicContact CD1-CB 3.86Å; Y623-R689 HydrophobicContact CD1-CG 3.88Å; Y623-R689 HydrophobicContact CD2-CB 4.14Å; Y623-R689 WeakPolarHBondContact CD2-O 3.06Å; Y623-R689 HydrophobicContact CE1-CB 4.07Å; Y623-R689 HydrophobicContact CE1-CG 3.59Å; Y623-R689 HydrophobicContact CE2-CB 4.33Å; Y623-R689 HydrophobicContact CE2-CG 4.33Å; Y623-R689 HydrophobicContact CG-CB 3.89Å; Y623-R689 HydrophobicContact CG-CG 4.35Å; Y623-A692 HydrophobicContact CD2-CB 3.68Å; Y623-A692 HydrophobicContact CE2-CB 3.57Å
624	E	74.1	Confident	56.7	Low	54 Å²	54	90.3 Å²	90.3	25%	0.252	49%	0.488	S	S	.	.			trans	-63.3	155.6	177.7	-69.7	161.5	-161.8	0	0	112.9	C620 Q621 C660 I661	C620-E624 HydrophobicContact CB-CB 3.67Å; Q621-E624 PolarHBondContact N-OE2 2.83Å; Q621-E624 VanDerWaalsContact O-CB 3.26Å; Q621-E624 WeakPolarHBondContact O-CB 3.22Å; Q621-E624 VanDerWaalsContact O-CD 3.28Å; Q621-E624 WeakPolarHBondContact O-CG 3.48Å; Q621-E624 PolarHBondContact O-N 3.28Å; E624-C660 HydrophobicContact CB-CB 4.29Å; E624-I661 CarbonylContact C-O 3.49Å; E624-I661 WeakPolarHBondContact CA-O 3.31Å
625	I	64.4	Low	55.1	Low	3 Å²	3	92.9 Å²	92.9	2%	0.015	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137	-170.5	60.8	157.1	0	0	0	109.9	I602 Y603 S627 C660 I661 P663	I602-I625 HydrophobicContact CG2-CG2 4.05Å; Y603-I625 HydrophobicContact CD1-CB 4.04Å; Y603-I625 HydrophobicContact CD1-CD1 4.3Å; Y603-I625 HydrophobicContact CD1-CG2 3.22Å; Y603-I625 HydrophobicContact CD2-CD1 4.42Å; Y603-I625 HydrophobicContact CE1-CB 3.63Å; Y603-I625 HydrophobicContact CE1-CD1 3.63Å; Y603-I625 HydrophobicContact CE1-CG1 4.21Å; Y603-I625 HydrophobicContact CE1-CG2 3.37Å; Y603-I625 HydrophobicContact CE2-CD1 3.8Å; Y603-I625 HydrophobicContact CG-CG2 3.99Å; Y603-I625 WeakPolarHBondContact OH-CD1 3.31Å; I625-S627 PolarHBondContact O-N 2.65Å; I625-C660 WeakPolarHBondContact O-CA 3.31Å; I625-I661 HydrophobicContact CD1-CD1 4.31Å; I625-I661 HydrophobicContact CD1-CG1 3.9Å; I625-I661 HydrophobicContact CG1-CG1 3.63Å; I625-I661 WeakPolarHBondContact CG1-O 3.39Å; I625-I661 PolarHBondContact N-O 3.19Å; I625-I661 PolarHBondContact O-N 2.88Å; I625-P663 HydrophobicContact CG2-CB 4.05Å
626	C	66.2	Low	53.8	Low	31 Å²	31	90.7 Å²	90.7	21%	0.209	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.2	178.1	176.3	0	0	0	0	110.2	P610 C613	P610-C626 HydrophobicContact CB-CB 4.39Å; C613-C626 HydrophobicContact CB-CB 3.88Å; C613-C626 WeakPolarHBondContact CB-SG 3.48Å; C613-C626 WeakPolarHBondContact SG-CA 3.45Å; C613-C626 WeakPolarHBondContact SG-CB 3.48Å; C613-C626 CovalentContact SG-SG 2.03Å; C613-C626 PolarHBondContact SG-SG 3.32Å
627	S	61.2	Low	52.5	Low	9 Å²	9	92 Å²	92	6%	0.063	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.1	-174	-174.9	0	0	0	0	113.3	S608 I625 I629 P658 E659	S608-S627 VanDerWaalsContact CB-CB 3.42Å; S608-S627 WeakPolarHBondContact CB-OG 3.49Å; S608-S627 WeakPolarHBondContact OG-CB 3.49Å; S608-S627 PolarHBondContact OG-OG 2.79Å; I625-S627 PolarHBondContact O-N 2.65Å; S627-I629 PolarHBondContact O-N 2.82Å; S627-P658 CarbonylContact O-C 3.5Å; S627-P658 WeakPolarHBondContact O-CA 3.32Å; S627-E659 PolarHBondContact N-O 2.72Å; S627-E659 PolarHBondContact O-N 3.5Å
628	R	58.6	Low	51.3	Low	78 Å²	78	91 Å²	91	29%	0.294	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	106.2	167.6	-89.3	179.1	-178.2	168.4	-0.3	110.9	E609 D612 T656 I657	E609-R628 HydrophobicContact CB-CB 4.27Å; E609-R628 HydrophobicContact CB-CG 4.3Å; E609-R628 WeakPolarHBondContact O-CG 3.4Å; E609-R628 IonicContact OE1-NH1 2.87Å; E609-R628 VanDerWaalsContact OE2-CD 3.24Å; E609-R628 WeakPolarHBondContact OE2-CD 2.96Å; E609-R628 IonicContact OE2-CZ 3.06Å; E609-R628 IonicContact OE2-NE 2.65Å; E609-R628 IonicContact OE2-NH1 2.98Å; E609-R628 PolarHBondContact OE2-NH1 2.03Å; D612-R628 VanDerWaalsContact CG-NH2 3.35Å; D612-R628 IonicContact OD1-CZ 2.7Å; D612-R628 IonicContact OD1-NH2 3.29Å; D612-R628 PolarHBondContact OD1-NH2 3.25Å; D612-R628 IonicContact OD2-CZ 3.54Å; D612-R628 VanDerWaalsContact OD2-CZ 3.23Å; D612-R628 IonicContact OD2-NE 3.98Å; D612-R628 PolarHBondContact OD2-NE 3.19Å; D612-R628 IonicContact OD2-NH2 2.69Å; D612-R628 PolarHBondContact OD2-NH2 2.62Å; R628-T656 HydrophobicContact CB-CG2 3.93Å; R628-T656 VanDerWaalsContact CD-OG1 3.25Å; R628-T656 WeakPolarHBondContact CD-OG1 3.36Å; R628-T656 HydrophobicContact CG-CG2 4.42Å; R628-T656 WeakPolarHBondContact CG-OG1 3.27Å; R628-I657 WeakPolarHBondContact CA-O 3.44Å
629	I	56.5	Low	49.9	Very low	66 Å²	66	90.8 Å²	90.8	34%	0.338	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	141	171.6	-53.4	-172.3	0	0	0	107.9	S627 N631 T656 I657 E659 I661	S627-I629 PolarHBondContact O-N 2.82Å; I629-N631 PolarHBondContact O-N 3.43Å; I629-T656 CarbonylContact O-C 3.51Å; I629-T656 VanDerWaalsContact O-CA 3.25Å; I629-T656 WeakPolarHBondContact O-CA 3.43Å; I629-I657 PolarHBondContact N-O 3.29Å; I629-I657 PolarHBondContact O-N 2.87Å; I629-E659 HydrophobicContact CD1-CB 3.75Å; I629-E659 HydrophobicContact CD1-CG 4.23Å; I629-E659 HydrophobicContact CG1-CB 4.19Å; I629-I661 HydrophobicContact CD1-CG2 3.97Å
630	K	49.4	Very low	48.3	Very low	76 Å²	76	96 Å²	96	33%	0.33	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	133.5	-179.5	-86.7	-131.9	160.7	175.9	0	111.2	K82 P632 E654 D655 T656	K82-K630 HydrophobicContact CD-CD 3.9Å; K82-K630 HydrophobicContact CD-CG 4.4Å; K630-P632 VanDerWaalsContact O-CD 3.23Å; K630-P632 WeakPolarHBondContact O-CD 3.05Å; K630-E654 WeakPolarHBondContact CE-OE2 3.03Å; K630-E654 IonicContact NZ-OE2 3.23Å; K630-E654 PolarHBondContact NZ-OE2 2.02Å; K630-D655 WeakPolarHBondContact CG-O 3.19Å; K630-T656 HydrophobicContact CG-CG2 4.17Å
631	N	45.7	Very low	46.4	Very low	65 Å²	65	102.7 Å²	102.7	35%	0.348	53%	0.525	S	S	.	.			trans	-61.4	113.1	-175.7	-174.6	11.1	0	0	0	111	I629 M633 D655 I657	I629-N631 PolarHBondContact O-N 3.43Å; N631-M633 PolarHBondContact O-N 3.39Å; N631-D655 HydrophobicContact CB-CB 4.15Å; N631-D655 PolarHBondContact N-O 3.49Å; N631-D655 PolarHBondContact ND2-OD1 3.27Å; N631-I657 HydrophobicContact CB-CD1 4.39Å; N631-I657 HydrophobicContact CB-CG1 3.92Å; N631-I657 WeakPolarHBondContact OD1-CD1 3.45Å
632	P	40.6	Very low	44.7	Very low	97 Å²	97	102.2 Å²	102.2	63%	0.63	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-68	126.4	178	-17.9	32.7	0	0	0	110.1	K630 V634	K630-P632 VanDerWaalsContact O-CD 3.23Å; K630-P632 WeakPolarHBondContact O-CD 3.05Å; P632-V634 PolarHBondContact O-N 2.82Å
633	M	33.2	Very low	42.9	Very low	183 Å²	183	105.2 Å²	105.2	90%	0.901	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-52.1	130.5	-171.8	-87.3	-173.3	165.2	0	0	113.8	N631	N631-M633 PolarHBondContact O-N 3.39Å
634	V	28.6	Very low	40.9	Very low	120 Å²	120	105.8 Å²	105.8	73%	0.727	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-73.9	131.4	171.7	172.7	0	0	0	0	110.7	P632	P632-V634 PolarHBondContact O-N 2.82Å
635	Y	24.8	Very low	38.9	Very low	208 Å²	208	108.4 Å²	108.4	82%	0.816	57%	0.571	S	S	*	*			trans	-124.1	94.9	153.6	-104.2	-83	0	0	0	111.6
636	T	25.8	Very low	37.6	Very low	95 Å²	95	114.7 Å²	114.7	58%	0.583	61%	0.609	S	S	*	*			trans	51.8	108.4	144.8	57.6	0	0	0	0	120.3
637	S	26.9	Very low	35.9	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	64%	0.639	S	S	*	*				-174.5	70	120.8	35.8	0	0	0	0	115.5
638	I	26.3	Very low	34.4	Very low	133 Å²	133	129.2 Å²	129.2	68%	0.682	67%	0.669	S	S	*	*				40.9	108.2	122.6	-55	157.8	0	0	0	118.6
639	N	29.1	Very low	33.4	Very low	127 Å²	127	132.6 Å²	132.6	68%	0.679	69%	0.693	S	S	*	*				168.3	107.4	123.5	-90.1	-54.8	0	0	0	110.5
640	R	29.1	Very low	32.3	Very low	218 Å²	218	133.4 Å²	133.4	82%	0.823	70%	0.704	S	S	*	*				86.1	104.7	78.1	-85.5	-167	-177.4	159.1	-6.1	115.1
641	K	28.7	Very low	31.5	Very low	182 Å²	182	136.8 Å²	136.8	79%	0.791	73%	0.726	S	S	*	*				166.5	134.6	107.7	-98	-171.5	169.8	-172.4	0	115.6
642	L	29.5	Very low	30.9	Very low	133 Å²	133	138.7 Å²	138.7	70%	0.696	74%	0.744	S	S	*	*			trans	57.5	145	157.3	-72.7	73.6	0	0	0	118.8
643	D	32.4	Very low	30.5	Very low	135 Å²	135	143.9 Å²	143.9	72%	0.722	76%	0.757	S	S	*	*			cis	-154.7	147	-23.8	-86.2	-30.6	0	0	0	106.4
644	A	28.7	Very low	30.8	Very low	92 Å²	92	140.6 Å²	140.6	76%	0.76	74%	0.74	S	S	*	*			cis	97.2	80.3	15.8	0	0	0	0	0	117.1
645	S	31.7	Very low	31.6	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	73%	0.73	S	S	*	*			trans	-163.2	130.9	152.9	64.6	0	0	0	0	114.5
646	V	35.9	Very low	32.7	Very low	135 Å²	135	131.9 Å²	131.9	82%	0.818	71%	0.705	S	S	*	*			trans	56.4	109	163.4	-159.2	0	0	0	0	117.5
647	Y	31.1	Very low	34.4	Very low	212 Å²	212	130.4 Å²	130.4	83%	0.831	69%	0.693	S	S	*	*			cis	95.8	150.3	19.8	-86.5	-88	0	0	0	119.8
648	D	31	Very low	36	Very low	132 Å²	132	125.7 Å²	125.7	71%	0.706	66%	0.659	S	S	*	*			trans	76.5	135.7	171.4	-68.1	-1.2	0	0	0	119.2
649	L	36.6	Very low	38	Very low	150 Å²	150	124.6 Å²	124.6	79%	0.785	65%	0.651	S	S	*	*			cis	-163.3	160.3	-6.3	-97.7	165.4	0	0	0	106.7
650	S	33	Very low	40.1	Very low	82 Å²	82	120.1 Å²	120.1	57%	0.573	63%	0.63	S	S	*	*			cis	-164.5	-176	-10.1	71.7	0	0	0	0	111
651	N	34.1	Very low	42.5	Very low	148 Å²	148	112 Å²	112	79%	0.791	60%	0.602	S	S	*	*			trans	64.3	129.8	164.8	-54.1	4.1	0	0	0	118.8
652	S	32	Very low	45	Very low	104 Å²	104	105 Å²	105	73%	0.727	58%	0.575	S	S	*	*			cis	-165.2	113.7	-13.9	48.7	0	0	0	0	112.3
653	F	32.7	Very low	46.9	Very low	207 Å²	207	98.8 Å²	98.8	91%	0.908	54%	0.543	S	S	*	.			trans	33.3	117.8	152.7	-69.4	-93.3	0	0	0	123.2
654	E	38.4	Very low	48.9	Very low	114 Å²	114	96.8 Å²	96.8	53%	0.533	54%	0.536	S	S	.	.				-159	157.7	119.3	-125.3	-167.9	-127.7	0	0	113.4	H83 K630 T656	H83-E654 IonicContact CE1-OE1 3.16Å; H83-E654 PolarHBondContact CE1-OE1 2.86Å; H83-E654 VanDerWaalsContact CE1-OE1 3.23Å; H83-E654 IonicContact NE2-OE1 3.89Å; K630-E654 WeakPolarHBondContact CE-OE2 3.03Å; K630-E654 IonicContact NZ-OE2 3.23Å; K630-E654 PolarHBondContact NZ-OE2 2.02Å; E654-T656 PolarHBondContact O-N 3.19Å
655	D	45.3	Very low	50.9	Low	99 Å²	99	93.1 Å²	93.1	53%	0.529	51%	0.505	S	S	.	.			trans	-77.8	105.6	-164.9	-91.1	-63	0	0	0	116.2	K630 N631	K630-D655 WeakPolarHBondContact CG-O 3.19Å; N631-D655 HydrophobicContact CB-CB 4.15Å; N631-D655 PolarHBondContact N-O 3.49Å; N631-D655 PolarHBondContact ND2-OD1 3.27Å
656	T	49.1	Very low	52.5	Low	45 Å²	45	88.6 Å²	88.6	28%	0.276	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.6	171.6	49.6	0	0	0	0	112.9	R628 I629 K630 E654	R628-T656 HydrophobicContact CB-CG2 3.93Å; R628-T656 VanDerWaalsContact CD-OG1 3.25Å; R628-T656 WeakPolarHBondContact CD-OG1 3.36Å; R628-T656 HydrophobicContact CG-CG2 4.42Å; R628-T656 WeakPolarHBondContact CG-OG1 3.27Å; I629-T656 CarbonylContact O-C 3.51Å; I629-T656 VanDerWaalsContact O-CA 3.25Å; I629-T656 WeakPolarHBondContact O-CA 3.43Å; K630-T656 HydrophobicContact CG-CG2 4.17Å; E654-T656 PolarHBondContact O-N 3.19Å
657	I	60.7	Low	53.7	Low	65 Å²	65	84.1 Å²	84.1	33%	0.333	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.1	169.6	-47.2	170.9	0	0	0	108.2	L616 R628 I629 N631	L616-I657 HydrophobicContact CD1-CG2 4.46Å; R628-I657 WeakPolarHBondContact CA-O 3.44Å; I629-I657 PolarHBondContact N-O 3.29Å; I629-I657 PolarHBondContact O-N 2.87Å; N631-I657 HydrophobicContact CB-CD1 4.39Å; N631-I657 HydrophobicContact CB-CG1 3.92Å; N631-I657 WeakPolarHBondContact OD1-CD1 3.45Å
658	P	60.3	Low	54.7	Low	18 Å²	18	81.6 Å²	81.6	12%	0.117	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	132.1	164.3	25.7	-34.3	0	0	0	113.8	D612 C613 L616 S627	D612-P658 VanDerWaalsContact C-CB 3.48Å; D612-P658 VanDerWaalsContact C-CG 3.47Å; D612-P658 HydrophobicContact CB-CB 3.71Å; D612-P658 HydrophobicContact CB-CG 3.44Å; D612-P658 VanDerWaalsContact CB-CG 3.44Å; C613-P658 HydrophobicContact CB-CB 4.03Å; C613-P658 WeakPolarHBondContact SG-CB 3.39Å; L616-P658 HydrophobicContact CD1-CG 3.63Å; L616-P658 HydrophobicContact CG-CG 3.75Å; S627-P658 CarbonylContact O-C 3.5Å; S627-P658 WeakPolarHBondContact O-CA 3.32Å
659	E	68.8	Low	55.6	Low	109 Å²	109	76 Å²	76	51%	0.509	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.3	171.9	-165.6	170.3	136.8	0	0	110.7	S627 I629 I661	S627-E659 PolarHBondContact N-O 2.72Å; S627-E659 PolarHBondContact O-N 3.5Å; I629-E659 HydrophobicContact CD1-CB 3.75Å; I629-E659 HydrophobicContact CD1-CG 4.23Å; I629-E659 HydrophobicContact CG1-CB 4.19Å; E659-I661 HydrophobicContact CB-CG2 4.43Å; E659-I661 HydrophobicContact CG-CG2 4.24Å
660	C	73.9	Confident	56.2	Low	34 Å²	34	70.8 Å²	70.8	23%	0.23	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	107.7	175.2	-68.2	0	0	0	0	109.9	C620 E624 I625	C620-C660 WeakPolarHBondContact CA-SG 3.02Å; C620-C660 HydrophobicContact CB-CB 3.62Å; C620-C660 WeakPolarHBondContact CB-SG 3.02Å; C620-C660 WeakPolarHBondContact SG-CB 3.49Å; C620-C660 CovalentContact SG-SG 2.04Å; C620-C660 PolarHBondContact SG-SG 3.24Å; E624-C660 HydrophobicContact CB-CB 4.29Å; I625-C660 WeakPolarHBondContact O-CA 3.31Å
661	I	79.5	Confident	57.1	Low	48 Å²	48	69.2 Å²	69.2	25%	0.246	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	172.7	-176.6	67.4	176.4	0	0	0	111.8	E624 I625 I629 E659	E624-I661 CarbonylContact C-O 3.49Å; E624-I661 WeakPolarHBondContact CA-O 3.31Å; I625-I661 HydrophobicContact CD1-CD1 4.31Å; I625-I661 HydrophobicContact CD1-CG1 3.9Å; I625-I661 HydrophobicContact CG1-CG1 3.63Å; I625-I661 WeakPolarHBondContact CG1-O 3.39Å; I625-I661 PolarHBondContact N-O 3.19Å; I625-I661 PolarHBondContact O-N 2.88Å; I629-I661 HydrophobicContact CD1-CG2 3.97Å; E659-I661 HydrophobicContact CB-CG2 4.43Å; E659-I661 HydrophobicContact CG-CG2 4.24Å
662	C	80.8	Confident	58.4	Low	33 Å²	33	65.2 Å²	65.2	22%	0.223	37%	0.37	C	S	.	.			trans	-86.4	148.6	176.6	-69.2	0	0	0	0	113.1	T664 C693 Q694	C662-T664 PolarHBondContact O-N 2.78Å; C662-C693 WeakPolarHBondContact CA-SG 3.21Å; C662-C693 HydrophobicContact CB-CB 3.73Å; C662-C693 WeakPolarHBondContact CB-SG 3.2Å; C662-C693 WeakPolarHBondContact SG-CB 3.12Å; C662-C693 CovalentContact SG-SG 2.04Å; C662-C693 PolarHBondContact SG-SG 3.1Å; C662-Q694 HydrophobicContact CB-CG 4.04Å; C662-Q694 PolarHBondContact SG-N 2.7Å
663	P	69.4	Low	60.6	Low	4 Å²	4	64 Å²	64	3%	0.026	35%	0.353	C	S	.	.			trans	-70.5	129.5	-172.2	23.8	-32.2	0	0	0	113.7	Y603 Y623 I625 C665 S690	Y603-P663 HydrophobicContact CD1-CB 4.38Å; Y603-P663 HydrophobicContact CD2-CB 3.9Å; Y603-P663 HydrophobicContact CG-CB 3.67Å; Y623-P663 VanDerWaalsContact O-CD 3.3Å; Y623-P663 WeakPolarHBondContact O-CD 3.47Å; I625-P663 HydrophobicContact CG2-CB 4.05Å; P663-C665 PolarHBondContact O-N 2.83Å; P663-S690 VanDerWaalsContact O-CB 3.3Å; P663-S690 WeakPolarHBondContact O-CB 3.3Å; P663-S690 PolarHBondContact O-OG 3.15Å
664	T	74.2	Confident	62.8	Low	93 Å²	93	54.4 Å²	54.4	57%	0.571	31%	0.31	S	S	*	.			trans	-83.9	93.7	178.1	40.6	0	0	0	0	111.3	S604 G605 C662	S604-T664 VanDerWaalsContact O-O 3.1Å; G605-T664 WeakPolarHBondContact CA-O 3.39Å; C662-T664 PolarHBondContact O-N 2.78Å
665	C	70.6	Confident	65	Low	15 Å²	15	49 Å²	49	10%	0.101	29%	0.285	C	S	.	.			trans	-85.1	133.5	-172	-62.2	0	0	0	0	113.9	S604 P663 C686 H687	S604-C665 WeakPolarHBondContact O-CA 3.13Å; P663-C665 PolarHBondContact O-N 2.83Å; C665-C686 HydrophobicContact CB-CB 3.77Å; C665-C686 WeakPolarHBondContact CB-SG 3.36Å; C665-C686 WeakPolarHBondContact SG-CB 3.46Å; C665-C686 PolarHBondContact SG-O 2.97Å; C665-C686 CovalentContact SG-SG 2.04Å; C665-C686 PolarHBondContact SG-SG 3.03Å; C665-H687 VanDerWaalsContact CB-CD2 3.5Å; C665-H687 WeakPolarHBondContact CB-CD2 3.45Å; C665-H687 VanDerWaalsContact CB-CE1 3.48Å; C665-H687 WeakPolarHBondContact CB-CE1 3.5Å; C665-H687 WeakPolarHBondContact CB-NE2 3.24Å; C665-H687 PolarHBondContact O-NE2 2.78Å
666	P	65.3	Low	66.8	Low	13 Å²	13	44.2 Å²	44.2	8%	0.084	26%	0.26	C	S	.	.			trans	-69.3	137.1	-174.6	25.7	-33.5	0	0	0	112.7	S604 Y668 G669 L670 H687	S604-P666 VanDerWaalsContact C-CD 3.47Å; S604-P666 WeakPolarHBondContact O-CD 3.38Å; P666-Y668 VanDerWaalsContact C-N 3.31Å; P666-Y668 HydrophobicContact CB-CD2 4.23Å; P666-Y668 HydrophobicContact CB-CE2 3.78Å; P666-Y668 PolarHBondContact O-N 2.81Å; P666-G669 PolarHBondContact O-N 2.91Å; P666-G669 VanDerWaalsContact O-N 3.12Å; P666-L670 HydrophobicContact CG-CD1 3.58Å; P666-L670 HydrophobicContact CG-CG 4.33Å; P666-H687 PolarHBondContact O-CE1 2.84Å
667	E	62.1	Low	68.3	Low	41 Å²	41	44.8 Å²	44.8	19%	0.192	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-30.1	-158.8	-57.1	-135	87.1	0	0	115.3	I72 L121 G669 R683	I72-E667 WeakPolarHBondContact CD1-OE2 2.86Å; I72-E667 HydrophobicContact CG2-CG 4.16Å; L121-E667 WeakPolarHBondContact CD1-OE2 3.46Å; L121-E667 WeakPolarHBondContact CD2-OE2 3.43Å; E667-G669 PolarHBondContact O-N 3.15Å; E667-G669 VanDerWaalsContact O-N 3.16Å; E667-R683 WeakPolarHBondContact O-CD 3.42Å; E667-R683 IonicContact OE1-CZ 2.73Å; E667-R683 VanDerWaalsContact OE1-CZ 3.29Å; E667-R683 IonicContact OE1-NH1 3.68Å; E667-R683 PolarHBondContact OE1-NH1 2.86Å; E667-R683 IonicContact OE1-NH2 2.9Å; E667-R683 PolarHBondContact OE1-NH2 3.04Å
668	Y	50.2	Low	69.2	Low	160 Å²	160	44.9 Å²	44.9	63%	0.627	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-3.2	179.6	7.4	-76.4	0	0	0	113.2	P666	P666-Y668 VanDerWaalsContact C-N 3.31Å; P666-Y668 HydrophobicContact CB-CD2 4.23Å; P666-Y668 HydrophobicContact CB-CE2 3.78Å; P666-Y668 PolarHBondContact O-N 2.81Å
669	G	50.7	Low	70	Confident	15 Å²	15	45.9 Å²	45.9	16%	0.155	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	67.3	165.9	0	0	0	0	0	114.3	P666 E667 G671	P666-G669 PolarHBondContact O-N 2.91Å; P666-G669 VanDerWaalsContact O-N 3.12Å; E667-G669 PolarHBondContact O-N 3.15Å; E667-G669 VanDerWaalsContact O-N 3.16Å; G669-G671 PolarHBondContact O-N 3.09Å; G669-G671 VanDerWaalsContact O-O 3.14Å
670	L	48.4	Very low	70.6	Confident	40 Å²	40	45.5 Å²	45.5	21%	0.209	28%	0.279	C	S	.	.	S	Bend	trans	-64.9	122.8	176.2	-84.7	163.2	0	0	0	113.6	S572 P666 S684	S572-L670 VanDerWaalsContact C-CD1 3.44Å; S572-L670 VanDerWaalsContact CB-CD1 3.44Å; S572-L670 WeakPolarHBondContact O-CD1 3.37Å; P666-L670 HydrophobicContact CG-CD1 3.58Å; P666-L670 HydrophobicContact CG-CG 4.33Å; L670-S684 WeakPolarHBondContact O-CB 3.4Å; L670-S684 PolarHBondContact O-OG 3.32Å; L670-S684 VanDerWaalsContact O-OG 3.06Å
671	G	52.8	Low	70.9	Confident	49 Å²	49	46.7 Å²	46.7	51%	0.505	29%	0.285	S	S	.	.	S	Bend	trans	81.4	125.7	-165.8	0	0	0	0	0	109.6	G669 S684	G669-G671 PolarHBondContact O-N 3.09Å; G669-G671 VanDerWaalsContact O-O 3.14Å; G671-S684 WeakPolarHBondContact O-CB 3.47Å
672	G	61.5	Low	71.1	Confident	64 Å²	64	45.1 Å²	45.1	66%	0.66	28%	0.276	S	S	*	.			trans	-52.9	151.5	-173.6	0	0	0	0	0	113.3
673	Q	77.2	Confident	70.9	Confident	79 Å²	79	47.2 Å²	47.2	37%	0.369	28%	0.279	S	S	.	.			trans	-41.9	141.6	-178.6	-68.4	174.2	-49.5	0	0	112.1	T681 Y682 G706 K707	Q673-T681 HydrophobicContact CB-CG2 4.08Å; Q673-T681 HydrophobicContact CG-CG2 4.43Å; Q673-Y682 WeakPolarHBondContact CA-O 3.36Å; Q673-G706 CarbonylContact C-O 3.55Å; Q673-G706 CarbonylContact O-C 3.43Å; Q673-G706 WeakPolarHBondContact O-CA 3.3Å; Q673-G706 PolarHBondContact O-N 2.69Å; Q673-K707 HydrophobicContact CB-CG 4.4Å
674	V	79.6	Confident	71.4	Confident	4 Å²	4	47 Å²	47	2%	0.024	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.9	178.4	-62.5	0	0	0	0	110.7	Y682 E685 L688 V702 S704 G706	V674-Y682 PolarHBondContact N-O 3.09Å; V674-Y682 VanDerWaalsContact N-O 3.09Å; V674-Y682 PolarHBondContact O-N 3.06Å; V674-E685 HydrophobicContact CG1-CB 4.33Å; V674-E685 HydrophobicContact CG2-CB 4.49Å; V674-L688 HydrophobicContact CG2-CB 4.22Å; V674-L688 HydrophobicContact CG2-CD1 3.83Å; V674-V702 HydrophobicContact CB-CG1 4.1Å; V674-V702 HydrophobicContact CB-CG2 4.18Å; V674-V702 HydrophobicContact CG1-CG1 4.13Å; V674-V702 HydrophobicContact CG1-CG2 4.21Å; V674-V702 HydrophobicContact CG2-CG2 4.16Å; V674-S704 WeakPolarHBondContact CA-O 3.27Å; V674-G706 CarbonylContact C-O 3.41Å; V674-G706 WeakPolarHBondContact CA-O 3.49Å
675	C	84.5	Confident	71.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.8	166.8	-167.1	0	0	0	0	109	K703 S704 G706 C708	C675-K703 WeakPolarHBondContact O-CB 3.41Å; C675-K703 PolarHBondContact O-N 2.74Å; C675-S704 VanDerWaalsContact CB-OG 3.23Å; C675-S704 WeakPolarHBondContact CB-OG 3.31Å; C675-S704 PolarHBondContact N-O 3.16Å; C675-S704 PolarHBondContact O-N 2.04Å; C675-G706 PolarHBondContact N-O 3.32Å; C675-G706 VanDerWaalsContact N-O 3.15Å; C675-C708 WeakPolarHBondContact CA-SG 3.24Å; C675-C708 HydrophobicContact CB-CB 3.94Å; C675-C708 WeakPolarHBondContact CB-SG 3.41Å; C675-C708 WeakPolarHBondContact SG-CA 3.44Å; C675-C708 WeakPolarHBondContact SG-CB 3.29Å; C675-C708 CovalentContact SG-SG 2.04Å; C675-C708 PolarHBondContact SG-SG 2.9Å
676	G	82.6	Confident	72.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	164.6	174.4	0	0	0	0	0	113	D678 G679 Q680 T701 K703	G676-D678 WeakPolarHBondContact CA-OD1 3.35Å; G676-D678 PolarHBondContact O-N 3.3Å; G676-G679 PolarHBondContact O-N 3.15Å; G676-Q680 PolarHBondContact N-O 3.39Å; G676-T701 CarbonylContact C-O 3.43Å; G676-T701 WeakPolarHBondContact CA-O 3.11Å; G676-K703 VanDerWaalsContact O-CB 3.32Å; G676-K703 WeakPolarHBondContact O-CB 3.48Å
677	S	81	Confident	73.3	Confident	56 Å²	56	45.6 Å²	45.6	39%	0.392	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.6	170.8	48.2	0	0	0	0	112.5	G679 D699 L700 T701	S677-G679 VanDerWaalsContact C-N 3.29Å; S677-G679 PolarHBondContact O-N 2.84Å; S677-D699 PolarHBondContact OG-O 2.85Å; S677-L700 WeakPolarHBondContact OG-CA 3.47Å; S677-T701 PolarHBondContact N-O 2.67Å; S677-T701 PolarHBondContact OG-N 3.19Å
678	D	80.3	Confident	74.6	Confident	67 Å²	67	43.8 Å²	43.8	36%	0.358	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-4	170.7	67.6	-10.5	0	0	0	115	G676 Q680 Y682 R695 L700	G676-D678 WeakPolarHBondContact CA-OD1 3.35Å; G676-D678 PolarHBondContact O-N 3.3Å; D678-Q680 VanDerWaalsContact C-N 3.31Å; D678-Q680 PolarHBondContact O-N 3.4Å; D678-Q680 PolarHBondContact OD1-N 2.75Å; D678-Q680 PolarHBondContact OD2-NE2 2.85Å; D678-Y682 WeakPolarHBondContact OD1-CE2 3.48Å; D678-Y682 PolarHBondContact OD2-OH 2.84Å; D678-R695 IonicContact OD2-NH1 3.26Å; D678-L700 HydrophobicContact CB-CD1 4.01Å
679	G	76.3	Confident	76.2	Confident	39 Å²	39	40 Å²	40	40%	0.402	24%	0.239	S	C	.	.	S	Bend	trans	75.6	10.7	-176.6	0	0	0	0	0	115.4	G676 S677 C708	G676-G679 PolarHBondContact O-N 3.15Å; S677-G679 VanDerWaalsContact C-N 3.29Å; S677-G679 PolarHBondContact O-N 2.84Å; G679-C708 PolarHBondContact O-SG 2.9Å
680	Q	81.1	Confident	77.8	Confident	102 Å²	102	39.9 Å²	39.9	48%	0.477	24%	0.236	S	C	.	.			trans	-88.1	143.6	171.6	-64.4	-172.2	90.4	0	0	111.1	G676 D678 Y682 C708	G676-Q680 PolarHBondContact N-O 3.39Å; D678-Q680 VanDerWaalsContact C-N 3.31Å; D678-Q680 PolarHBondContact O-N 3.4Å; D678-Q680 PolarHBondContact OD1-N 2.75Å; D678-Q680 PolarHBondContact OD2-NE2 2.85Å; Q680-Y682 HydrophobicContact CB-CE2 3.81Å; Q680-Y682 PolarHBondContact NE2-OH 2.75Å; Q680-Y682 WeakPolarHBondContact O-CD2 3.34Å; Q680-Y682 PolarHBondContact O-N 2.96Å; Q680-C708 PolarHBondContact O-SG 2.86Å; Q680-C708 VanDerWaalsContact O-SG 3.37Å
681	T	81.4	Confident	79.6	Confident	59 Å²	59	38.8 Å²	38.8	36%	0.362	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.5	172.4	-62	0	0	0	0	109.5	Q673 K707 C708	Q673-T681 HydrophobicContact CB-CG2 4.08Å; Q673-T681 HydrophobicContact CG-CG2 4.43Å; T681-K707 HydrophobicContact CG2-CB 4.14Å; T681-K707 HydrophobicContact CG2-CG 4.15Å; T681-C708 WeakPolarHBondContact OG1-CB 3.46Å; T681-C708 PolarHBondContact OG1-N 3.49Å
682	Y	83.1	Confident	81.1	Confident	15 Å²	15	36.6 Å²	36.6	6%	0.059	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134.6	173.8	-68.3	-85.4	0	0	0	110	Q673 V674 D678 Q680 S684 H687 L688 S691 R695 L700	Q673-Y682 WeakPolarHBondContact CA-O 3.36Å; V674-Y682 PolarHBondContact N-O 3.09Å; V674-Y682 VanDerWaalsContact N-O 3.09Å; V674-Y682 PolarHBondContact O-N 3.06Å; D678-Y682 WeakPolarHBondContact OD1-CE2 3.48Å; D678-Y682 PolarHBondContact OD2-OH 2.84Å; Q680-Y682 HydrophobicContact CB-CE2 3.81Å; Q680-Y682 PolarHBondContact NE2-OH 2.75Å; Q680-Y682 WeakPolarHBondContact O-CD2 3.34Å; Q680-Y682 PolarHBondContact O-N 2.96Å; Y682-S684 PolarHBondContact O-N 3.1Å; Y682-S684 VanDerWaalsContact O-N 3.1Å; Y682-H687 HydrophobicContact CD1-CB 4.28Å; Y682-L688 HydrophobicContact CD1-CB 4.11Å; Y682-L688 HydrophobicContact CD2-CB 3.93Å; Y682-L688 HydrophobicContact CD2-CD1 3.82Å; Y682-L688 HydrophobicContact CD2-CG 3.93Å; Y682-L688 HydrophobicContact CE2-CD1 4.33Å; Y682-L688 HydrophobicContact CE2-CG 4.25Å; Y682-L688 HydrophobicContact CG-CB 3.68Å; Y682-L688 HydrophobicContact CG-CD1 4.39Å; Y682-L688 HydrophobicContact CG-CG 4.2Å; Y682-S691 WeakPolarHBondContact CE1-OG 3.42Å; Y682-R695 PolarHBondContact OH-NH1 2.64Å; Y682-L700 HydrophobicContact CE2-CD1 4.12Å
683	R	76.5	Confident	82.2	Confident	77 Å²	77	33.8 Å²	33.8	29%	0.291	18%	0.179	S	C	.	.	S	Bend	trans	-60.5	-22.9	-177.1	68.7	-170.7	-176.7	-177.5	1.1	113.1	E667 H687	E667-R683 WeakPolarHBondContact O-CD 3.42Å; E667-R683 IonicContact OE1-CZ 2.73Å; E667-R683 VanDerWaalsContact OE1-CZ 3.29Å; E667-R683 IonicContact OE1-NH1 3.68Å; E667-R683 PolarHBondContact OE1-NH1 2.86Å; E667-R683 IonicContact OE1-NH2 2.9Å; E667-R683 PolarHBondContact OE1-NH2 3.04Å; R683-H687 HydrophobicContact CG-CB 4.17Å; R683-H687 VanDerWaalsContact CG-CG 3.43Å; R683-H687 WeakPolarHBondContact CG-ND1 3.49Å; R683-H687 PolarHBondContact NE-CD2 2.89Å; R683-H687 PolarHBondContact NE-CE1 3.37Å; R683-H687 PolarHBondContact NE-NE2 3.15Å; R683-H687 PolarHBondContact NH2-NE2 3.4Å
684	S	79.8	Confident	82.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-158.9	177.7	155.1	69.9	0	0	0	0	112.4	L670 G671 Y682 C686 H687 L688	L670-S684 WeakPolarHBondContact O-CB 3.4Å; L670-S684 PolarHBondContact O-OG 3.32Å; L670-S684 VanDerWaalsContact O-OG 3.06Å; G671-S684 WeakPolarHBondContact O-CB 3.47Å; Y682-S684 PolarHBondContact O-N 3.1Å; Y682-S684 VanDerWaalsContact O-N 3.1Å; S684-C686 PolarHBondContact O-N 2.91Å; S684-C686 PolarHBondContact OG-N 3.16Å; S684-H687 PolarHBondContact N-ND1 2.79Å; S684-H687 WeakPolarHBondContact O-CB 3.47Å; S684-H687 PolarHBondContact O-N 2.89Å; S684-H687 PolarHBondContact OG-ND1 2.82Å; S684-L688 PolarHBondContact O-N 3.38Å
685	E	83.1	Confident	82.6	Confident	63 Å²	63	40 Å²	40	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-57.8	-33.3	174.1	-169.8	178.3	149.7	0	0	112.9	V674 H687 L688 R689 V702	V674-E685 HydrophobicContact CG1-CB 4.33Å; V674-E685 HydrophobicContact CG2-CB 4.49Å; E685-H687 VanDerWaalsContact C-N 3.28Å; E685-H687 PolarHBondContact O-N 2.7Å; E685-L688 WeakPolarHBondContact O-CB 3.36Å; E685-L688 PolarHBondContact O-N 2.84Å; E685-R689 WeakPolarHBondContact O-CG 3.48Å; E685-R689 PolarHBondContact O-N 2.65Å; E685-R689 IonicContact OE1-CZ 3.89Å; E685-R689 VanDerWaalsContact OE1-CZ 3.32Å; E685-R689 IonicContact OE1-NE 3.82Å; E685-R689 PolarHBondContact OE1-NE 2.99Å; E685-R689 VanDerWaalsContact OE1-NE 3.13Å; E685-R689 IonicContact OE1-NH2 3.43Å; E685-R689 PolarHBondContact OE1-NH2 2.9Å; E685-V702 HydrophobicContact CG-CG2 3.79Å
686	C	81.4	Confident	82.2	Confident	10 Å²	10	47.5 Å²	47.5	7%	0.068	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-43.9	173.6	-169.5	0	0	0	0	111.1	S604 C665 S684 L688 R689 S690	S604-C686 PolarHBondContact N-SG 3.3Å; S604-C686 PolarHBondContact O-SG 2.98Å; C665-C686 HydrophobicContact CB-CB 3.77Å; C665-C686 WeakPolarHBondContact CB-SG 3.36Å; C665-C686 WeakPolarHBondContact SG-CB 3.46Å; C665-C686 PolarHBondContact SG-O 2.97Å; C665-C686 CovalentContact SG-SG 2.04Å; C665-C686 PolarHBondContact SG-SG 3.03Å; S684-C686 PolarHBondContact O-N 2.91Å; S684-C686 PolarHBondContact OG-N 3.16Å; C686-L688 VanDerWaalsContact C-N 3.29Å; C686-L688 PolarHBondContact O-N 2.97Å; C686-R689 CarbonylContact O-C 3.55Å; C686-R689 PolarHBondContact O-N 3.06Å; C686-R689 VanDerWaalsContact O-N 3.09Å; C686-S690 WeakPolarHBondContact O-CB 3.42Å; C686-S690 PolarHBondContact O-N 3.42Å
687	H	86.4	Confident	81.7	Confident	18 Å²	18	49.2 Å²	49.2	8%	0.083	25%	0.25	C	C	.	.	H	α-helix	trans	-68.2	-30.4	-177.9	-62.4	87.9	0	0	0	113	C665 P666 Y682 R683 S684 E685 S691	C665-H687 VanDerWaalsContact CB-CD2 3.5Å; C665-H687 WeakPolarHBondContact CB-CD2 3.45Å; C665-H687 VanDerWaalsContact CB-CE1 3.48Å; C665-H687 WeakPolarHBondContact CB-CE1 3.5Å; C665-H687 WeakPolarHBondContact CB-NE2 3.24Å; C665-H687 PolarHBondContact O-NE2 2.78Å; P666-H687 PolarHBondContact O-CE1 2.84Å; Y682-H687 HydrophobicContact CD1-CB 4.28Å; R683-H687 HydrophobicContact CG-CB 4.17Å; R683-H687 VanDerWaalsContact CG-CG 3.43Å; R683-H687 WeakPolarHBondContact CG-ND1 3.49Å; R683-H687 PolarHBondContact NE-CD2 2.89Å; R683-H687 PolarHBondContact NE-CE1 3.37Å; R683-H687 PolarHBondContact NE-NE2 3.15Å; R683-H687 PolarHBondContact NH2-NE2 3.4Å; S684-H687 PolarHBondContact N-ND1 2.79Å; S684-H687 WeakPolarHBondContact O-CB 3.47Å; S684-H687 PolarHBondContact O-N 2.89Å; S684-H687 PolarHBondContact OG-ND1 2.82Å; E685-H687 VanDerWaalsContact C-N 3.28Å; E685-H687 PolarHBondContact O-N 2.7Å; H687-S691 VanDerWaalsContact O-CB 3.23Å; H687-S691 WeakPolarHBondContact O-CB 3.28Å; H687-S691 PolarHBondContact O-N 3.19Å; H687-S691 PolarHBondContact O-OG 3.04Å
688	L	88.4	Confident	81.1	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-47	169.8	-171.8	156.8	0	0	0	110.5	V674 Y682 S684 E685 C686 S691 A692 L700 V702	V674-L688 HydrophobicContact CG2-CB 4.22Å; V674-L688 HydrophobicContact CG2-CD1 3.83Å; Y682-L688 HydrophobicContact CD1-CB 4.11Å; Y682-L688 HydrophobicContact CD2-CB 3.93Å; Y682-L688 HydrophobicContact CD2-CD1 3.82Å; Y682-L688 HydrophobicContact CD2-CG 3.93Å; Y682-L688 HydrophobicContact CE2-CD1 4.33Å; Y682-L688 HydrophobicContact CE2-CG 4.25Å; Y682-L688 HydrophobicContact CG-CB 3.68Å; Y682-L688 HydrophobicContact CG-CD1 4.39Å; Y682-L688 HydrophobicContact CG-CG 4.2Å; S684-L688 PolarHBondContact O-N 3.38Å; E685-L688 WeakPolarHBondContact O-CB 3.36Å; E685-L688 PolarHBondContact O-N 2.84Å; C686-L688 VanDerWaalsContact C-N 3.29Å; C686-L688 PolarHBondContact O-N 2.97Å; L688-S691 PolarHBondContact O-N 2.05Å; L688-A692 WeakPolarHBondContact O-CB 3.19Å; L688-A692 PolarHBondContact O-N 3.19Å; L688-L700 HydrophobicContact CD2-CG 4.04Å; L688-L700 WeakPolarHBondContact CD2-O 3.48Å; L688-L700 HydrophobicContact CG-CD2 4.41Å; L688-L700 HydrophobicContact CG-CG 4.05Å; L688-L700 WeakPolarHBondContact O-CD2 3.33Å; L688-V702 HydrophobicContact CD1-CG2 3.94Å
689	R	85	Confident	80.6	Confident	80 Å²	80	54.6 Å²	54.6	30%	0.302	28%	0.278	S	S	.	.	H	α-helix	trans	-65.5	-39.3	177.2	-64.4	-179.8	-175.6	-166.1	3.3	113.3	Y623 E685 C686 A692 C693	Y623-R689 HydrophobicContact CD1-CB 3.86Å; Y623-R689 HydrophobicContact CD1-CG 3.88Å; Y623-R689 HydrophobicContact CD2-CB 4.14Å; Y623-R689 WeakPolarHBondContact CD2-O 3.06Å; Y623-R689 HydrophobicContact CE1-CB 4.07Å; Y623-R689 HydrophobicContact CE1-CG 3.59Å; Y623-R689 HydrophobicContact CE2-CB 4.33Å; Y623-R689 HydrophobicContact CE2-CG 4.33Å; Y623-R689 HydrophobicContact CG-CB 3.89Å; Y623-R689 HydrophobicContact CG-CG 4.35Å; E685-R689 WeakPolarHBondContact O-CG 3.48Å; E685-R689 PolarHBondContact O-N 2.65Å; E685-R689 IonicContact OE1-CZ 3.89Å; E685-R689 VanDerWaalsContact OE1-CZ 3.32Å; E685-R689 IonicContact OE1-NE 3.82Å; E685-R689 PolarHBondContact OE1-NE 2.99Å; E685-R689 VanDerWaalsContact OE1-NE 3.13Å; E685-R689 IonicContact OE1-NH2 3.43Å; E685-R689 PolarHBondContact OE1-NH2 2.9Å; C686-R689 CarbonylContact O-C 3.55Å; C686-R689 PolarHBondContact O-N 3.06Å; C686-R689 VanDerWaalsContact O-N 3.09Å; R689-A692 WeakPolarHBondContact O-CB 3.33Å; R689-A692 PolarHBondContact O-N 2.77Å; R689-C693 WeakPolarHBondContact O-CB 3.31Å; R689-C693 PolarHBondContact O-N 3.25Å
690	S	84.1	Confident	80.7	Confident	13 Å²	13	53 Å²	53	9%	0.091	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-43.3	174.7	-174.2	0	0	0	0	111.1	P663 C686 A692 C693 Q694	P663-S690 VanDerWaalsContact O-CB 3.3Å; P663-S690 WeakPolarHBondContact O-CB 3.3Å; P663-S690 PolarHBondContact O-OG 3.15Å; C686-S690 WeakPolarHBondContact O-CB 3.42Å; C686-S690 PolarHBondContact O-N 3.42Å; S690-A692 VanDerWaalsContact C-N 3.3Å; S690-A692 PolarHBondContact O-N 3.4Å; S690-C693 WeakPolarHBondContact O-CB 3.28Å; S690-C693 PolarHBondContact O-N 2.96Å; S690-Q694 WeakPolarHBondContact O-CB 3.44Å; S690-Q694 WeakPolarHBondContact O-CG 3.45Å; S690-Q694 PolarHBondContact O-N 2.04Å
691	S	85.7	Confident	80.7	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-32.2	172.4	-60.7	0	0	0	0	113	Y682 H687 L688 R695	Y682-S691 WeakPolarHBondContact CE1-OG 3.42Å; H687-S691 VanDerWaalsContact O-CB 3.23Å; H687-S691 WeakPolarHBondContact O-CB 3.28Å; H687-S691 PolarHBondContact O-N 3.19Å; H687-S691 PolarHBondContact O-OG 3.04Å; L688-S691 PolarHBondContact O-N 2.05Å; S691-R695 VanDerWaalsContact O-CB 3.3Å; S691-R695 WeakPolarHBondContact O-CB 3.24Å; S691-R695 WeakPolarHBondContact O-CD 3.03Å; S691-R695 WeakPolarHBondContact O-CG 3.03Å; S691-R695 PolarHBondContact O-N 3.45Å; S691-R695 VanDerWaalsContact O-N 3.16Å
692	A	84.4	Confident	80.7	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-67.6	-41	173.5	0	0	0	0	0	110.8	Y623 L688 R689 S690 H696 S697 L700	Y623-A692 HydrophobicContact CD2-CB 3.68Å; Y623-A692 HydrophobicContact CE2-CB 3.57Å; L688-A692 WeakPolarHBondContact O-CB 3.19Å; L688-A692 PolarHBondContact O-N 3.19Å; R689-A692 WeakPolarHBondContact O-CB 3.33Å; R689-A692 PolarHBondContact O-N 2.77Å; S690-A692 VanDerWaalsContact C-N 3.3Å; S690-A692 PolarHBondContact O-N 3.4Å; A692-H696 CarbonylContact O-C 3.58Å; A692-H696 PolarHBondContact O-N 2.98Å; A692-H696 VanDerWaalsContact O-N 3.15Å; A692-S697 WeakPolarHBondContact CB-O 3.41Å; A692-S697 PolarHBondContact O-N 2.8Å; A692-L700 HydrophobicContact CB-CB 4Å; A692-L700 HydrophobicContact CB-CD2 4.12Å; A692-L700 HydrophobicContact CB-CG 4.45Å
693	C	84.9	Confident	80.2	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.041	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-56.7	172.8	-172	0	0	0	0	111.9	C662 R689 S690 R695 H696	C662-C693 WeakPolarHBondContact CA-SG 3.21Å; C662-C693 HydrophobicContact CB-CB 3.73Å; C662-C693 WeakPolarHBondContact CB-SG 3.2Å; C662-C693 WeakPolarHBondContact SG-CB 3.12Å; C662-C693 CovalentContact SG-SG 2.04Å; C662-C693 PolarHBondContact SG-SG 3.1Å; R689-C693 WeakPolarHBondContact O-CB 3.31Å; R689-C693 PolarHBondContact O-N 3.25Å; S690-C693 WeakPolarHBondContact O-CB 3.28Å; S690-C693 PolarHBondContact O-N 2.96Å; C693-R695 PolarHBondContact O-N 3Å; C693-R695 VanDerWaalsContact O-N 3.09Å; C693-H696 PolarHBondContact O-N 3.02Å
694	Q	84.3	Confident	79.7	Confident	92 Å²	92	53 Å²	53	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-61.1	-21.7	-177.6	-71.7	-179.3	-25.8	0	0	113.8	C662 S690	C662-Q694 HydrophobicContact CB-CG 4.04Å; C662-Q694 PolarHBondContact SG-N 2.7Å; S690-Q694 WeakPolarHBondContact O-CB 3.44Å; S690-Q694 WeakPolarHBondContact O-CG 3.45Å; S690-Q694 PolarHBondContact O-N 2.04Å
695	R	81.2	Confident	79.4	Confident	122 Å²	122	63.5 Å²	63.5	46%	0.46	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	5.8	176.2	-59.1	172.7	-163.6	153.5	6.9	113.1	D678 Y682 S691 C693 S697	D678-R695 IonicContact OD2-NH1 3.26Å; Y682-R695 PolarHBondContact OH-NH1 2.64Å; S691-R695 VanDerWaalsContact O-CB 3.3Å; S691-R695 WeakPolarHBondContact O-CB 3.24Å; S691-R695 WeakPolarHBondContact O-CD 3.03Å; S691-R695 WeakPolarHBondContact O-CG 3.03Å; S691-R695 PolarHBondContact O-N 3.45Å; S691-R695 VanDerWaalsContact O-N 3.16Å; C693-R695 PolarHBondContact O-N 3Å; C693-R695 VanDerWaalsContact O-N 3.09Å; R695-S697 PolarHBondContact O-N 3.24Å
696	H	76.4	Confident	78.7	Confident	156 Å²	156	62.2 Å²	62.2	72%	0.722	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	32.9	-171.7	-53.5	-70.7	0	0	0	113.9	A692 C693	A692-H696 CarbonylContact O-C 3.58Å; A692-H696 PolarHBondContact O-N 2.98Å; A692-H696 VanDerWaalsContact O-N 3.15Å; C693-H696 PolarHBondContact O-N 3.02Å
697	S	71.4	Confident	78.1	Confident	37 Å²	37	68.3 Å²	68.3	26%	0.259	34%	0.341	S	S	.	.			trans	-106.9	99.7	-167	170.2	0	0	0	0	111.5	A692 R695 D699	A692-S697 WeakPolarHBondContact CB-O 3.41Å; A692-S697 PolarHBondContact O-N 2.8Å; R695-S697 PolarHBondContact O-N 3.24Å; S697-D699 PolarHBondContact O-N 3.36Å
698	T	67.7	Low	77.4	Confident	108 Å²	108	68.4 Å²	68.4	66%	0.663	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.7	176.3	50.9	0	0	0	0	114.5
699	D	70.1	Confident	76.5	Confident	127 Å²	127	72 Å²	72	68%	0.679	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-11.2	-177.4	-52.3	-64.7	0	0	0	113.4	S677 S697 T701	S677-D699 PolarHBondContact OG-O 2.85Å; S697-D699 PolarHBondContact O-N 3.36Å; D699-T701 PolarHBondContact O-N 2.79Å; D699-T701 PolarHBondContact O-OG1 2.92Å
700	L	79.5	Confident	75.6	Confident	7 Å²	7	70 Å²	70	4%	0.037	36%	0.364	C	S	.	.			trans	-75.8	108.2	176.9	-174.2	65.5	0	0	0	109.2	S677 D678 Y682 L688 A692	S677-L700 WeakPolarHBondContact OG-CA 3.47Å; D678-L700 HydrophobicContact CB-CD1 4.01Å; Y682-L700 HydrophobicContact CE2-CD1 4.12Å; L688-L700 HydrophobicContact CD2-CG 4.04Å; L688-L700 WeakPolarHBondContact CD2-O 3.48Å; L688-L700 HydrophobicContact CG-CD2 4.41Å; L688-L700 HydrophobicContact CG-CG 4.05Å; L688-L700 WeakPolarHBondContact O-CD2 3.33Å; A692-L700 HydrophobicContact CB-CB 4Å; A692-L700 HydrophobicContact CB-CD2 4.12Å; A692-L700 HydrophobicContact CB-CG 4.45Å
701	T	81.2	Confident	74.9	Confident	68 Å²	68	70.9 Å²	70.9	42%	0.417	37%	0.369	S	S	.	.			trans	-138.9	159.2	-169.2	47.9	0	0	0	0	111.5	G676 S677 D699 K703	G676-T701 CarbonylContact C-O 3.43Å; G676-T701 WeakPolarHBondContact CA-O 3.11Å; S677-T701 PolarHBondContact N-O 2.67Å; S677-T701 PolarHBondContact OG-N 3.19Å; D699-T701 PolarHBondContact O-N 2.79Å; D699-T701 PolarHBondContact O-OG1 2.92Å; T701-K703 PolarHBondContact O-N 3.46Å
702	V	81.3	Confident	74	Confident	54 Å²	54	73.5 Å²	73.5	33%	0.327	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	111.6	177.4	175.6	0	0	0	0	109.9	V674 E685 L688	V674-V702 HydrophobicContact CB-CG1 4.1Å; V674-V702 HydrophobicContact CB-CG2 4.18Å; V674-V702 HydrophobicContact CG1-CG1 4.13Å; V674-V702 HydrophobicContact CG1-CG2 4.21Å; V674-V702 HydrophobicContact CG2-CG2 4.16Å; E685-V702 HydrophobicContact CG-CG2 3.79Å; L688-V702 HydrophobicContact CD1-CG2 3.94Å
703	K	71.2	Confident	73	Confident	84 Å²	84	79.2 Å²	79.2	37%	0.365	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-39.1	173.9	-174.5	-172.8	-179.8	-165.4	0	111.8	C675 G676 T701	C675-K703 WeakPolarHBondContact O-CB 3.41Å; C675-K703 PolarHBondContact O-N 2.74Å; G676-K703 VanDerWaalsContact O-CB 3.32Å; G676-K703 WeakPolarHBondContact O-CB 3.48Å; T701-K703 PolarHBondContact O-N 3.46Å
704	S	67.2	Low	72.2	Confident	47 Å²	47	83.6 Å²	83.6	33%	0.329	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	154.5	171.7	64.3	0	0	0	0	111.7	V674 C675	V674-S704 WeakPolarHBondContact CA-O 3.27Å; C675-S704 VanDerWaalsContact CB-OG 3.23Å; C675-S704 WeakPolarHBondContact CB-OG 3.31Å; C675-S704 PolarHBondContact N-O 3.16Å; C675-S704 PolarHBondContact O-N 2.04Å
705	R	72.5	Confident	71.8	Confident	219 Å²	219	85.7 Å²	85.7	83%	0.826	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	145.3	164.1	-68.5	178.9	172.6	177.8	-3.6	109.1
706	G	68.1	Low	71.8	Confident	36 Å²	36	81.3 Å²	81.3	37%	0.371	43%	0.43	S	S	.	.	S	Bend	trans	94.1	171.3	-164.8	0	0	0	0	0	112.2	Q673 V674 C675	Q673-G706 CarbonylContact C-O 3.55Å; Q673-G706 CarbonylContact O-C 3.43Å; Q673-G706 WeakPolarHBondContact O-CA 3.3Å; Q673-G706 PolarHBondContact O-N 2.69Å; V674-G706 CarbonylContact C-O 3.41Å; V674-G706 WeakPolarHBondContact CA-O 3.49Å; C675-G706 PolarHBondContact N-O 3.32Å; C675-G706 VanDerWaalsContact N-O 3.15Å
707	K	70.1	Confident	72.1	Confident	138 Å²	138	80.7 Å²	80.7	60%	0.6	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-55.3	154.4	169.9	-62.1	-176.3	178.9	-178.2	0	110.2	Q673 T681 D709	Q673-K707 HydrophobicContact CB-CG 4.4Å; T681-K707 HydrophobicContact CG2-CB 4.14Å; T681-K707 HydrophobicContact CG2-CG 4.15Å; K707-D709 PolarHBondContact O-N 2.89Å
708	C	71.9	Confident	72.8	Confident	20 Å²	20	81.6 Å²	81.6	14%	0.135	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-59.4	131.1	154.5	-59.7	0	0	0	0	108	C675 G679 Q680 T681 A710	C675-C708 WeakPolarHBondContact CA-SG 3.24Å; C675-C708 HydrophobicContact CB-CB 3.94Å; C675-C708 WeakPolarHBondContact CB-SG 3.41Å; C675-C708 WeakPolarHBondContact SG-CA 3.44Å; C675-C708 WeakPolarHBondContact SG-CB 3.29Å; C675-C708 CovalentContact SG-SG 2.04Å; C675-C708 PolarHBondContact SG-SG 2.9Å; G679-C708 PolarHBondContact O-SG 2.9Å; Q680-C708 PolarHBondContact O-SG 2.86Å; Q680-C708 VanDerWaalsContact O-SG 3.37Å; T681-C708 WeakPolarHBondContact OG1-CB 3.46Å; T681-C708 PolarHBondContact OG1-N 3.49Å; C708-A710 PolarHBondContact O-N 2.96Å
709	D	68	Low	73.7	Confident	78 Å²	78	80 Å²	80	42%	0.417	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-62.7	123.8	178.5	154.8	28.9	0	0	0	109.7	K707 C711 Q712	K707-D709 PolarHBondContact O-N 2.89Å; D709-C711 VanDerWaalsContact C-N 3.27Å; D709-C711 PolarHBondContact O-N 3.47Å; D709-C711 WeakPolarHBondContact OD1-CA 3.19Å; D709-C711 WeakPolarHBondContact OD1-CB 3.44Å; D709-C711 PolarHBondContact OD1-N 3.3Å; D709-Q712 HydrophobicContact CB-CB 3.87Å; D709-Q712 WeakPolarHBondContact O-CB 3.35Å; D709-Q712 PolarHBondContact O-N 2.68Å; D709-Q712 PolarHBondContact OD1-N 3.19Å; D709-Q712 WeakPolarHBondContact OD2-CB 3.41Å; D709-Q712 PolarHBondContact OD2-N 3.07Å
710	A	66.2	Low	74.4	Confident	39 Å²	39	74.4 Å²	74.4	32%	0.322	38%	0.378	S	S	.	.	S	Bend	trans	-73.8	-17.4	-175.8	0	0	0	0	0	113.2	C708 L724 P730	C708-A710 PolarHBondContact O-N 2.96Å; A710-L724 HydrophobicContact CB-CD2 4.04Å; A710-P730 HydrophobicContact CB-CG 4.45Å; A710-P730 WeakPolarHBondContact O-CB 3.26Å
711	C	70.2	Confident	74.5	Confident	31 Å²	31	78.4 Å²	78.4	21%	0.209	40%	0.398	C	S	.	.	S	Bend	trans	-83.1	-19.6	167.2	-74.1	0	0	0	0	112.3	D709 T713 K714 C722	D709-C711 VanDerWaalsContact C-N 3.27Å; D709-C711 PolarHBondContact O-N 3.47Å; D709-C711 WeakPolarHBondContact OD1-CA 3.19Å; D709-C711 WeakPolarHBondContact OD1-CB 3.44Å; D709-C711 PolarHBondContact OD1-N 3.3Å; C711-T713 PolarHBondContact O-N 2.85Å; C711-K714 PolarHBondContact O-N 3.12Å; C711-C722 WeakPolarHBondContact CA-SG 2.96Å; C711-C722 HydrophobicContact CB-CB 3.66Å; C711-C722 WeakPolarHBondContact CB-SG 2.96Å; C711-C722 VanDerWaalsContact SG-C 3.6Å; C711-C722 WeakPolarHBondContact SG-CB 3.44Å; C711-C722 CovalentContact SG-SG 2.04Å; C711-C722 PolarHBondContact SG-SG 2.86Å
712	Q	66.4	Low	74.6	Confident	73 Å²	73	76.6 Å²	76.6	34%	0.341	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-11.6	179	-144.3	179.2	95.7	0	0	114.5	D709 R894	D709-Q712 HydrophobicContact CB-CB 3.87Å; D709-Q712 WeakPolarHBondContact O-CB 3.35Å; D709-Q712 PolarHBondContact O-N 2.68Å; D709-Q712 PolarHBondContact OD1-N 3.19Å; D709-Q712 WeakPolarHBondContact OD2-CB 3.41Å; D709-Q712 PolarHBondContact OD2-N 3.07Å; Q712-R894 PolarHBondContact O-NH2 3.13Å
713	T	62.9	Low	74.3	Confident	122 Å²	122	79.3 Å²	79.3	75%	0.748	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-5.2	174.5	56.6	0	0	0	0	113.4	C711	C711-T713 PolarHBondContact O-N 2.85Å
714	K	68.4	Low	74	Confident	97 Å²	97	80 Å²	80	42%	0.422	40%	0.404	S	S	.	.			trans	-102.9	90.2	-178	-171.9	85.7	172.5	-159.1	0	110.9	C711 C716 P730	C711-K714 PolarHBondContact O-N 3.12Å; K714-C716 PolarHBondContact O-N 3.28Å; K714-P730 HydrophobicContact CB-CB 3.79Å; K714-P730 HydrophobicContact CB-CG 4.2Å; K714-P730 HydrophobicContact CD-CB 4.21Å; K714-P730 HydrophobicContact CD-CG 4.1Å; K714-P730 VanDerWaalsContact CE-O 3.29Å; K714-P730 WeakPolarHBondContact CE-O 3.07Å; K714-P730 HydrophobicContact CG-CB 3.88Å; K714-P730 HydrophobicContact CG-CG 4.3Å; K714-P730 PolarHBondContact NZ-O 3.48Å
715	Q	75.5	Confident	73.8	Confident	137 Å²	137	78.4 Å²	78.4	64%	0.64	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-67.7	119.9	165.6	-74.2	180	-19.1	0	0	109.8
716	C	82.1	Confident	73	Confident	30 Å²	30	73 Å²	73	20%	0.203	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-96.4	132.5	175	-71.8	0	0	0	0	110.4	K714 A720 C732	K714-C716 PolarHBondContact O-N 3.28Å; C716-A720 HydrophobicContact CB-CB 4.05Å; C716-A720 WeakPolarHBondContact CB-O 3.17Å; C716-C732 WeakPolarHBondContact CA-SG 3.44Å; C716-C732 HydrophobicContact CB-CB 3.66Å; C716-C732 WeakPolarHBondContact CB-SG 3.48Å; C716-C732 WeakPolarHBondContact SG-CA 3.43Å; C716-C732 WeakPolarHBondContact SG-CB 3.3Å; C716-C732 CovalentContact SG-SG 2.04Å; C716-C732 PolarHBondContact SG-SG 2.99Å
717	K	82.1	Confident	72.5	Confident	142 Å²	142	79.4 Å²	79.4	62%	0.617	41%	0.413	S	S	*	.	S	Bend	trans	-83.7	164.4	-177	-67.5	-164.6	172.6	-162.5	0	112.2	Y719 A720	K717-Y719 PolarHBondContact O-N 2.88Å; K717-A720 VanDerWaalsContact O-CB 3.27Å; K717-A720 WeakPolarHBondContact O-CB 3.03Å; K717-A720 PolarHBondContact O-N 2.85Å
718	Y	87.1	Confident	71.8	Confident	57 Å²	57	74.9 Å²	74.9	22%	0.224	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	31.9	168.5	-37.5	-56.8	0	0	0	114.1	A720 C764 Q767 E769	Y718-A720 PolarHBondContact O-N 3.37Å; Y718-C764 WeakPolarHBondContact O-CA 2.84Å; Y718-C764 WeakPolarHBondContact O-CB 3.09Å; Y718-C764 PolarHBondContact O-N 2.97Å; Y718-C764 VanDerWaalsContact O-N 3.09Å; Y718-Q767 VanDerWaalsContact CD2-C 3.48Å; Y718-Q767 HydrophobicContact CD2-CB 3.92Å; Y718-Q767 HydrophobicContact CD2-CG 4.4Å; Y718-Q767 WeakPolarHBondContact CE1-O 3.44Å; Y718-Q767 HydrophobicContact CE2-CB 3.92Å; Y718-Q767 VanDerWaalsContact CE2-O 3.28Å; Y718-Q767 WeakPolarHBondContact CE2-O 3.5Å; Y718-E769 HydrophobicContact CD1-CG 4.06Å
719	Y	85.4	Confident	71.5	Confident	73 Å²	73	79 Å²	79	29%	0.286	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	19.8	-172.1	-44.9	-88.6	0	0	0	115.9	K717 P735 K760 S763 V770 H771	K717-Y719 PolarHBondContact O-N 2.88Å; Y719-P735 VanDerWaalsContact O-CD 3.28Å; Y719-P735 WeakPolarHBondContact O-CD 3.49Å; Y719-K760 HydrophobicContact CD1-CB 4.34Å; Y719-K760 HydrophobicContact CD1-CD 3.77Å; Y719-K760 HydrophobicContact CD1-CG 3.62Å; Y719-K760 HydrophobicContact CD2-CB 4.05Å; Y719-K760 HydrophobicContact CD2-CG 3.85Å; Y719-K760 HydrophobicContact CE1-CD 4.06Å; Y719-K760 HydrophobicContact CE1-CG 3.84Å; Y719-K760 HydrophobicContact CE2-CG 4.05Å; Y719-K760 HydrophobicContact CG-CB 3.86Å; Y719-K760 HydrophobicContact CG-CD 4.17Å; Y719-K760 HydrophobicContact CG-CG 3.6Å; Y719-S763 WeakPolarHBondContact CD2-OG 3.03Å; Y719-V770 VanDerWaalsContact CE2-O 3.3Å; Y719-V770 WeakPolarHBondContact CE2-O 3.21Å; Y719-V770 PolarHBondContact OH-O 3.35Å; Y719-H771 AromaticContact CZ-ND1 3.82Å; Y719-H771 PolarHBondContact OH-ND1 3.01Å
720	A	85.5	Confident	71.6	Confident	11 Å²	11	77.1 Å²	77.1	9%	0.091	42%	0.415	C	S	.	.			trans	-61.7	138.5	163.3	0	0	0	0	0	110.1	C716 K717 Y718 C732 I733 C764	C716-A720 HydrophobicContact CB-CB 4.05Å; C716-A720 WeakPolarHBondContact CB-O 3.17Å; K717-A720 VanDerWaalsContact O-CB 3.27Å; K717-A720 WeakPolarHBondContact O-CB 3.03Å; K717-A720 PolarHBondContact O-N 2.85Å; Y718-A720 PolarHBondContact O-N 3.37Å; A720-C732 HydrophobicContact CB-CB 3.81Å; A720-I733 CarbonylContact C-O 3.58Å; A720-I733 WeakPolarHBondContact CA-O 3.37Å; A720-I733 WeakPolarHBondContact CB-O 3.23Å; A720-C764 VanDerWaalsContact CB-SG 3.58Å
721	I	81.9	Confident	72.1	Confident	90 Å²	90	79.7 Å²	79.7	46%	0.462	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.4	176	-61.9	172.6	0	0	0	108.1	Q723 C732 I733 P735	I721-Q723 PolarHBondContact O-N 2.96Å; I721-C732 WeakPolarHBondContact O-CA 3.16Å; I721-I733 HydrophobicContact CB-CG1 4.48Å; I721-I733 PolarHBondContact N-O 3.37Å; I721-I733 WeakPolarHBondContact O-CG1 3.47Å; I721-I733 PolarHBondContact O-N 2.9Å; I721-P735 HydrophobicContact CD1-CB 3.96Å; I721-P735 HydrophobicContact CD1-CG 4.46Å
722	C	82.3	Confident	72.9	Confident	31 Å²	31	81 Å²	81	21%	0.209	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	113.2	169.6	-171.3	0	0	0	0	109.5	C711 Q731	C711-C722 WeakPolarHBondContact CA-SG 2.96Å; C711-C722 HydrophobicContact CB-CB 3.66Å; C711-C722 WeakPolarHBondContact CB-SG 2.96Å; C711-C722 VanDerWaalsContact SG-C 3.6Å; C711-C722 WeakPolarHBondContact SG-CB 3.44Å; C711-C722 CovalentContact SG-SG 2.04Å; C711-C722 PolarHBondContact SG-SG 2.86Å; C722-Q731 WeakPolarHBondContact CA-O 3.35Å
723	Q	76.1	Confident	73.8	Confident	111 Å²	111	80.4 Å²	80.4	52%	0.519	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	156.3	162.4	-79.4	-165.6	-6.8	0	0	109.5	I721 Q731 I733	I721-Q723 PolarHBondContact O-N 2.96Å; Q723-Q731 PolarHBondContact N-O 2.85Å; Q723-Q731 PolarHBondContact O-N 2.89Å; Q723-I733 HydrophobicContact CB-CD1 4.23Å; Q723-I733 HydrophobicContact CB-CG1 4.26Å; Q723-I733 HydrophobicContact CG-CD1 3.77Å; Q723-I733 HydrophobicContact CG-CG1 4.13Å
724	L	65.3	Low	74.8	Confident	98 Å²	98	76.6 Å²	76.6	51%	0.513	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.6	168.2	-56.9	-178.5	0	0	0	108.9	A710 E729	A710-L724 HydrophobicContact CB-CD2 4.04Å; L724-E729 CarbonylContact C-O 3.13Å; L724-E729 WeakPolarHBondContact CA-O 3.5Å
725	S	61.9	Low	75.4	Confident	13 Å²	13	73.2 Å²	73.2	9%	0.091	39%	0.393	C	S	.	.			trans	-61.4	169	169.6	78.9	0	0	0	0	110.7	F727 G728 E729	S725-F727 PolarHBondContact O-N 2.93Å; S725-F727 PolarHBondContact OG-N 3.02Å; S725-F727 VanDerWaalsContact OG-N 3.12Å; S725-G728 PolarHBondContact O-N 2.9Å; S725-G728 PolarHBondContact OG-N 2.9Å; S725-E729 PolarHBondContact N-O 2.92Å; S725-E729 WeakPolarHBondContact OG-CB 3.1Å; S725-E729 PolarHBondContact OG-N 3.3Å; S725-E729 VanDerWaalsContact OG-N 3.12Å; S725-E729 PolarHBondContact OG-OE2 2.94Å
726	A	56.7	Low	75.4	Confident	106 Å²	106	72 Å²	72	88%	0.876	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.9	169.9	0	0	0	0	0	112.8
727	F	57.2	Low	75	Confident	171 Å²	171	76.9 Å²	76.9	75%	0.75	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	1.1	178	-49	-66.5	0	0	0	113.8	S725 E729	S725-F727 PolarHBondContact O-N 2.93Å; S725-F727 PolarHBondContact OG-N 3.02Å; S725-F727 VanDerWaalsContact OG-N 3.12Å; F727-E729 HydrophobicContact CB-CG 4.31Å
728	G	55.6	Low	74.8	Confident	43 Å²	43	71.1 Å²	71.1	44%	0.443	40%	0.397	S	S	.	.	S	Bend	trans	81.9	10.6	-178.7	0	0	0	0	0	115.1	S725	S725-G728 PolarHBondContact O-N 2.9Å; S725-G728 PolarHBondContact OG-N 2.9Å
729	E	64.1	Low	74	Confident	107 Å²	107	74.7 Å²	74.7	50%	0.5	42%	0.419	S	S	.	.			trans	-84.5	143	178.6	-53.8	171.4	118.5	0	0	111.2	L724 S725 F727 Q731	L724-E729 CarbonylContact C-O 3.13Å; L724-E729 WeakPolarHBondContact CA-O 3.5Å; S725-E729 PolarHBondContact N-O 2.92Å; S725-E729 WeakPolarHBondContact OG-CB 3.1Å; S725-E729 PolarHBondContact OG-N 3.3Å; S725-E729 VanDerWaalsContact OG-N 3.12Å; S725-E729 PolarHBondContact OG-OE2 2.94Å; F727-E729 HydrophobicContact CB-CG 4.31Å; E729-Q731 PolarHBondContact O-N 2.86Å
730	P	69.9	Low	73.3	Confident	37 Å²	37	76.8 Å²	76.8	24%	0.24	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	100.5	178.4	30.6	-35.3	0	0	0	111.9	A710 K714	A710-P730 HydrophobicContact CB-CG 4.45Å; A710-P730 WeakPolarHBondContact O-CB 3.26Å; K714-P730 HydrophobicContact CB-CB 3.79Å; K714-P730 HydrophobicContact CB-CG 4.2Å; K714-P730 HydrophobicContact CD-CB 4.21Å; K714-P730 HydrophobicContact CD-CG 4.1Å; K714-P730 VanDerWaalsContact CE-O 3.29Å; K714-P730 WeakPolarHBondContact CE-O 3.07Å; K714-P730 HydrophobicContact CG-CB 3.88Å; K714-P730 HydrophobicContact CG-CG 4.3Å; K714-P730 PolarHBondContact NZ-O 3.48Å
731	Q	78.3	Confident	72.5	Confident	93 Å²	93	80.4 Å²	80.4	44%	0.435	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	139.2	175.7	-78.9	-177.7	-3.9	0	0	111.3	C722 Q723 E729	C722-Q731 WeakPolarHBondContact CA-O 3.35Å; Q723-Q731 PolarHBondContact N-O 2.85Å; Q723-Q731 PolarHBondContact O-N 2.89Å; E729-Q731 PolarHBondContact O-N 2.86Å
732	C	85.6	Confident	72.2	Confident	58 Å²	58	85.9 Å²	85.9	39%	0.392	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	102.8	175.4	-61.3	0	0	0	0	109.1	C716 A720 I721	C716-C732 WeakPolarHBondContact CA-SG 3.44Å; C716-C732 HydrophobicContact CB-CB 3.66Å; C716-C732 WeakPolarHBondContact CB-SG 3.48Å; C716-C732 WeakPolarHBondContact SG-CA 3.43Å; C716-C732 WeakPolarHBondContact SG-CB 3.3Å; C716-C732 CovalentContact SG-SG 2.04Å; C716-C732 PolarHBondContact SG-SG 2.99Å; A720-C732 HydrophobicContact CB-CB 3.81Å; I721-C732 WeakPolarHBondContact O-CA 3.16Å
733	I	85.3	Confident	72.1	Confident	61 Å²	61	89.8 Å²	89.8	31%	0.313	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.5	178	60.9	156.6	0	0	0	110.7	A720 I721 Q723	A720-I733 CarbonylContact C-O 3.58Å; A720-I733 WeakPolarHBondContact CA-O 3.37Å; A720-I733 WeakPolarHBondContact CB-O 3.23Å; I721-I733 HydrophobicContact CB-CG1 4.48Å; I721-I733 PolarHBondContact N-O 3.37Å; I721-I733 WeakPolarHBondContact O-CG1 3.47Å; I721-I733 PolarHBondContact O-N 2.9Å; Q723-I733 HydrophobicContact CB-CD1 4.23Å; Q723-I733 HydrophobicContact CB-CG1 4.26Å; Q723-I733 HydrophobicContact CG-CD1 3.77Å; Q723-I733 HydrophobicContact CG-CG1 4.13Å
734	C	84.9	Confident	72.7	Confident	42 Å²	42	85.9 Å²	85.9	28%	0.284	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-76.6	139.3	171.6	-63.7	0	0	0	0	111	T736 C764	C734-T736 PolarHBondContact O-N 2.98Å; C734-C764 WeakPolarHBondContact CA-SG 3.03Å; C734-C764 HydrophobicContact CB-CB 3.68Å; C734-C764 WeakPolarHBondContact CB-SG 3.18Å; C734-C764 WeakPolarHBondContact SG-CB 3.08Å; C734-C764 PolarHBondContact SG-O 3.17Å; C734-C764 CovalentContact SG-SG 2.04Å; C734-C764 PolarHBondContact SG-SG 3.34Å
735	P	79.9	Confident	73.8	Confident	26 Å²	26	81.5 Å²	81.5	17%	0.169	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-56.2	136.5	163.2	21.3	-28.1	0	0	0	109.2	Y719 I721 V761	Y719-P735 VanDerWaalsContact O-CD 3.28Å; Y719-P735 WeakPolarHBondContact O-CD 3.49Å; I721-P735 HydrophobicContact CD1-CB 3.96Å; I721-P735 HydrophobicContact CD1-CG 4.46Å; P735-V761 HydrophobicContact CB-CG2 4.2Å; P735-V761 HydrophobicContact CG-CG2 4.07Å; P735-V761 VanDerWaalsContact O-CG2 3.29Å; P735-V761 WeakPolarHBondContact O-CG2 3.32Å
736	T	77.1	Confident	75.1	Confident	111 Å²	111	81.4 Å²	81.4	68%	0.681	44%	0.437	S	S	*	.			trans	-105.6	-34.5	177	41.6	0	0	0	0	111.9	C734	C734-T736 PolarHBondContact O-N 2.98Å
737	D	72.6	Confident	76.4	Confident	133 Å²	133	76.4 Å²	76.4	71%	0.711	40%	0.396	S	S	*	.			trans	-99.6	108.7	-167.2	-57.4	-60.5	0	0	0	111.4
738	C	78.9	Confident	77.5	Confident	21 Å²	21	70.1 Å²	70.1	14%	0.142	37%	0.371	C	S	.	.			trans	-110	125.7	169.3	-67.3	0	0	0	0	110.6	Y740 C757 F758 V761	C738-Y740 PolarHBondContact O-N 3.48Å; C738-C757 WeakPolarHBondContact CA-SG 3.44Å; C738-C757 HydrophobicContact CB-CB 3.74Å; C738-C757 WeakPolarHBondContact CB-SG 3.34Å; C738-C757 WeakPolarHBondContact SG-CB 3.42Å; C738-C757 CovalentContact SG-SG 2.04Å; C738-C757 PolarHBondContact SG-SG 2.86Å; C738-F758 HydrophobicContact CB-CD1 4.22Å; C738-F758 HydrophobicContact CB-CD2 4.27Å; C738-F758 HydrophobicContact CB-CE1 3.94Å; C738-F758 HydrophobicContact CB-CE2 4Å; C738-F758 HydrophobicContact CB-CG 4.38Å; C738-F758 HydrophobicContact CB-CZ 3.82Å; C738-V761 WeakPolarHBondContact SG-CG2 3.43Å
739	L	70.4	Confident	78.7	Confident	133 Å²	133	69.5 Å²	69.5	70%	0.696	36%	0.358	S	S	*	.			trans	-59.2	130.6	164.3	-65.6	176.2	0	0	0	109	V741 N755	L739-V741 HydrophobicContact CB-CG2 4.13Å; L739-V741 PolarHBondContact O-N 2.69Å; L739-N755 PolarHBondContact O-ND2 3.36Å
740	Y	70.7	Confident	79.4	Confident	117 Å²	117	66.9 Å²	66.9	46%	0.459	36%	0.36	S	S	.	.			trans	-79.4	63.9	-177.1	-166.7	-91.8	0	0	0	110.7	C738 R742 E754 F758	C738-Y740 PolarHBondContact O-N 3.48Å; Y740-R742 HydrophobicContact CE1-CG 4.28Å; Y740-E754 WeakPolarHBondContact CE2-OE1 3.36Å; Y740-E754 WeakPolarHBondContact CE2-OE2 3.03Å; Y740-E754 PolarHBondContact OH-OE1 3.48Å; Y740-F758 HydrophobicContact CD2-CE2 4.17Å; Y740-F758 HydrophobicContact CD2-CZ 4.14Å
741	V	68.8	Low	80.2	Confident	87 Å²	87	70.3 Å²	70.3	53%	0.527	37%	0.371	S	S	.	.			trans	-91	122.3	174.8	-175	0	0	0	0	108.1	L739 K743 N755	L739-V741 HydrophobicContact CB-CG2 4.13Å; L739-V741 PolarHBondContact O-N 2.69Å; V741-K743 PolarHBondContact O-N 2.85Å; V741-N755 WeakPolarHBondContact O-CB 3.09Å; V741-N755 PolarHBondContact O-ND2 3.38Å
742	R	75.1	Confident	80.7	Confident	204 Å²	204	68.6 Å²	68.6	77%	0.77	37%	0.367	S	S	*	.			trans	-77.2	84.8	175.6	-74.5	-176.7	171.2	175.6	-1.6	110.8	Y740	Y740-R742 HydrophobicContact CE1-CG 4.28Å
743	K	79.5	Confident	80.8	Confident	114 Å²	114	66.9 Å²	66.9	50%	0.496	35%	0.352	S	S	.	.			trans	-133.4	76.8	170.2	-170.4	-167.7	173.3	-167.6	0	108.6	V741 E754 N755 E775	V741-K743 PolarHBondContact O-N 2.85Å; K743-E754 CarbonylContact C-O 3.57Å; K743-E754 PolarHBondContact N-O 3.47Å; K743-E754 VanDerWaalsContact N-O 3.1Å; K743-N755 VanDerWaalsContact O-CA 3.3Å; K743-N755 WeakPolarHBondContact O-CA 3.3Å; K743-E775 WeakPolarHBondContact CE-OE1 3.33Å; K743-E775 IonicContact NZ-OE1 3.77Å; K743-E775 PolarHBondContact NZ-OE1 3.01Å
744	P	88.2	Confident	80.9	Confident	29 Å²	29	67.9 Å²	67.9	19%	0.188	36%	0.356	C	S	.	.			trans	-62.5	149.1	-167.7	23.3	-33.1	0	0	0	112.8	T752 Y753 E754 G776 Y777	P744-T752 HydrophobicContact CB-CG2 3.97Å; P744-Y753 CarbonylContact C-O 3.45Å; P744-Y753 WeakPolarHBondContact CA-O 3.42Å; P744-E754 WeakPolarHBondContact CA-O 3.3Å; P744-G776 VanDerWaalsContact O-CA 3.23Å; P744-G776 WeakPolarHBondContact O-CA 3.17Å; P744-G776 PolarHBondContact O-N 2.77Å; P744-Y777 HydrophobicContact CB-CE1 4.45Å; P744-Y777 HydrophobicContact CB-CE2 4.3Å; P744-Y777 HydrophobicContact CG-CD2 4.19Å; P744-Y777 HydrophobicContact CG-CE2 3.66Å
745	V	89.4	Confident	80.9	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.03	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.3	178	-63.3	0	0	0	0	111	T752 Y753 L759 V772 G776	V745-T752 WeakPolarHBondContact O-CA 3.42Å; V745-Y753 PolarHBondContact N-O 3.15Å; V745-Y753 PolarHBondContact O-N 3.13Å; V745-L759 HydrophobicContact CG2-CB 4.17Å; V745-L759 HydrophobicContact CG2-CD1 3.82Å; V745-V772 HydrophobicContact CB-CG1 4.1Å; V745-V772 HydrophobicContact CB-CG2 4.06Å; V745-V772 HydrophobicContact CG1-CG1 4.26Å; V745-V772 HydrophobicContact CG1-CG2 4.21Å; V745-V772 HydrophobicContact CG2-CG2 4.12Å; V745-G776 CarbonylContact C-O 3.45Å; V745-G776 WeakPolarHBondContact CA-O 3.31Å; V745-G776 PolarHBondContact N-O 2.92Å
746	C	89.4	Confident	81.4	Confident	11 Å²	11	69.7 Å²	69.7	7%	0.074	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.3	171.1	-176.4	0	0	0	0	110.1	V772 A773 Q774 G776 C778	C746-V772 CarbonylContact O-C 3.5Å; C746-V772 WeakPolarHBondContact O-CA 3.21Å; C746-A773 PolarHBondContact O-N 2.77Å; C746-Q774 HydrophobicContact CB-CB 4.2Å; C746-Q774 WeakPolarHBondContact CB-O 3.18Å; C746-Q774 PolarHBondContact N-O 2.04Å; C746-Q774 PolarHBondContact O-N 3.12Å; C746-G776 PolarHBondContact N-O 3.34Å; C746-C778 WeakPolarHBondContact CA-SG 3.05Å; C746-C778 HydrophobicContact CB-CB 3.93Å; C746-C778 WeakPolarHBondContact CB-SG 3.17Å; C746-C778 WeakPolarHBondContact SG-CA 3.48Å; C746-C778 WeakPolarHBondContact SG-CB 3.23Å; C746-C778 CovalentContact SG-SG 2.03Å; C746-C778 PolarHBondContact SG-SG 3.37Å
747	G	84.6	Confident	82	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.01	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	156.9	172.7	0	0	0	0	0	113.2	D749 G750 K751 H771	G747-D749 PolarHBondContact O-N 2.87Å; G747-D749 VanDerWaalsContact O-N 3.1Å; G747-G750 PolarHBondContact O-N 3.31Å; G747-K751 PolarHBondContact N-O 2.98Å; G747-H771 CarbonylContact C-O 3.54Å; G747-H771 VanDerWaalsContact CA-O 3.3Å; G747-H771 WeakPolarHBondContact CA-O 3.39Å
748	T	79.9	Confident	82.9	Confident	39 Å²	39	62.8 Å²	62.8	24%	0.239	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-4.6	169.1	51.3	0	0	0	0	113.9	V770 H771 A773	T748-V770 WeakPolarHBondContact OG1-CA 2.92Å; T748-H771 HydrophobicContact CG2-CB 4.1Å; T748-H771 PolarHBondContact N-O 2.88Å; T748-H771 PolarHBondContact OG1-N 2.84Å; T748-A773 HydrophobicContact CG2-CB 3.99Å
749	D	80.5	Confident	83.6	Confident	31 Å²	31	61.8 Å²	61.8	17%	0.166	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1	168.7	81.4	-33.7	0	0	0	113.6	G747 K751 Y753 V770	G747-D749 PolarHBondContact O-N 2.87Å; G747-D749 VanDerWaalsContact O-N 3.1Å; D749-K751 WeakPolarHBondContact OD1-CB 3.41Å; D749-K751 PolarHBondContact OD1-N 2.85Å; D749-K751 WeakPolarHBondContact OD2-CD 3.32Å; D749-K751 VanDerWaalsContact OD2-CG 3.29Å; D749-K751 WeakPolarHBondContact OD2-CG 3.44Å; D749-K751 IonicContact OD2-NZ 2.74Å; D749-K751 PolarHBondContact OD2-NZ 2.9Å; D749-Y753 PolarHBondContact OD2-OH 2.78Å; D749-V770 HydrophobicContact CB-CG1 4.16Å; D749-V770 HydrophobicContact CB-CG2 4.13Å
750	G	79.7	Confident	84.6	Confident	52 Å²	52	58.3 Å²	58.3	54%	0.536	29%	0.289	S	S	.	.	S	Bend	trans	81.7	6.6	-179.1	0	0	0	0	0	115.2	G747 C778	G747-G750 PolarHBondContact O-N 3.31Å; G750-C778 PolarHBondContact O-SG 2.85Å
751	K	85.1	Confident	85.4	Confident	109 Å²	109	54.3 Å²	54.3	47%	0.474	28%	0.277	S	S	.	.			trans	-97.1	146.5	175.4	-59.9	-168.1	-160.4	94.6	0	111.8	G747 D749 Y753 C778	G747-K751 PolarHBondContact N-O 2.98Å; D749-K751 WeakPolarHBondContact OD1-CB 3.41Å; D749-K751 PolarHBondContact OD1-N 2.85Å; D749-K751 WeakPolarHBondContact OD2-CD 3.32Å; D749-K751 VanDerWaalsContact OD2-CG 3.29Å; D749-K751 WeakPolarHBondContact OD2-CG 3.44Å; D749-K751 IonicContact OD2-NZ 2.74Å; D749-K751 PolarHBondContact OD2-NZ 2.9Å; K751-Y753 HydrophobicContact CB-CE2 4.02Å; K751-Y753 WeakPolarHBondContact O-CD2 3.01Å; K751-Y753 WeakPolarHBondContact O-CE2 3.47Å; K751-C778 PolarHBondContact O-SG 3.42Å
752	T	88.3	Confident	86.4	Confident	57 Å²	57	54.1 Å²	54.1	35%	0.35	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	133.8	169.7	-51.8	0	0	0	0	110	P744 V745 Y777 C778	P744-T752 HydrophobicContact CB-CG2 3.97Å; V745-T752 WeakPolarHBondContact O-CA 3.42Å; T752-Y777 HydrophobicContact CG2-CD1 3.67Å; T752-Y777 HydrophobicContact CG2-CE1 4.23Å; T752-Y777 HydrophobicContact CG2-CG 4.18Å; T752-C778 PolarHBondContact OG1-N 3.03Å
753	Y	89.3	Confident	87.1	Confident	22 Å²	22	44.4 Å²	44.4	9%	0.086	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.6	174.3	-63.6	-90.1	0	0	0	109.4	P744 V745 D749 K751 N755 F758 L759 K762 V770	P744-Y753 CarbonylContact C-O 3.45Å; P744-Y753 WeakPolarHBondContact CA-O 3.42Å; V745-Y753 PolarHBondContact N-O 3.15Å; V745-Y753 PolarHBondContact O-N 3.13Å; D749-Y753 PolarHBondContact OD2-OH 2.78Å; K751-Y753 HydrophobicContact CB-CE2 4.02Å; K751-Y753 WeakPolarHBondContact O-CD2 3.01Å; K751-Y753 WeakPolarHBondContact O-CE2 3.47Å; Y753-N755 PolarHBondContact O-N 3.47Å; Y753-F758 HydrophobicContact CD1-CB 4.43Å; Y753-L759 HydrophobicContact CD1-CB 4.08Å; Y753-L759 HydrophobicContact CD2-CB 3.78Å; Y753-L759 HydrophobicContact CD2-CD1 3.81Å; Y753-L759 HydrophobicContact CD2-CG 4Å; Y753-L759 HydrophobicContact CE2-CB 4.34Å; Y753-L759 HydrophobicContact CE2-CD1 4.22Å; Y753-L759 HydrophobicContact CE2-CG 4.23Å; Y753-L759 HydrophobicContact CG-CB 3.62Å; Y753-L759 HydrophobicContact CG-CD1 4.46Å; Y753-L759 HydrophobicContact CG-CG 4.35Å; Y753-K762 HydrophobicContact CD1-CB 4.38Å; Y753-K762 HydrophobicContact CE1-CB 3.5Å; Y753-K762 VanDerWaalsContact CE1-CB 3.5Å; Y753-K762 HydrophobicContact CE1-CG 3.74Å; Y753-V770 HydrophobicContact CE2-CG1 4.19Å
754	E	86.1	Confident	87.7	Confident	82 Å²	82	39 Å²	39	38%	0.383	21%	0.209	S	C	.	.	S	Bend	trans	-65.8	-26.5	-176.7	-63.3	-178	125.8	0	0	113.3	Y740 K743 P744 F758	Y740-E754 WeakPolarHBondContact CE2-OE1 3.36Å; Y740-E754 WeakPolarHBondContact CE2-OE2 3.03Å; Y740-E754 PolarHBondContact OH-OE1 3.48Å; K743-E754 CarbonylContact C-O 3.57Å; K743-E754 PolarHBondContact N-O 3.47Å; K743-E754 VanDerWaalsContact N-O 3.1Å; P744-E754 WeakPolarHBondContact CA-O 3.3Å; E754-F758 HydrophobicContact CB-CD2 3.93Å; E754-F758 HydrophobicContact CB-CE2 4.31Å
755	N	85.5	Confident	87.5	Confident	13 Å²	13	40.7 Å²	40.7	7%	0.07	23%	0.225	C	C	.	.	S	Bend	trans	-160.6	174.6	164.5	59.9	51.9	0	0	0	111.3	L739 V741 K743 Y753 C757 F758 L759	L739-N755 PolarHBondContact O-ND2 3.36Å; V741-N755 WeakPolarHBondContact O-CB 3.09Å; V741-N755 PolarHBondContact O-ND2 3.38Å; K743-N755 VanDerWaalsContact O-CA 3.3Å; K743-N755 WeakPolarHBondContact O-CA 3.3Å; Y753-N755 PolarHBondContact O-N 3.47Å; N755-C757 PolarHBondContact O-N 2.83Å; N755-C757 WeakPolarHBondContact OD1-CA 3.48Å; N755-C757 VanDerWaalsContact OD1-CB 3.25Å; N755-C757 WeakPolarHBondContact OD1-CB 3.03Å; N755-C757 PolarHBondContact OD1-N 2.8Å; N755-F758 PolarHBondContact O-N 3.28Å; N755-F758 WeakPolarHBondContact OD1-CD2 3.42Å; N755-F758 PolarHBondContact OD1-N 2.8Å; N755-F758 VanDerWaalsContact OD1-N 3.17Å; N755-L759 PolarHBondContact O-N 3.47Å
756	E	90.6	Very high	87.4	Confident	92 Å²	92	43.9 Å²	43.9	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-58.6	-30.2	179.4	-168.3	-172.3	163.9	0	0	113.5	L759 K760 V772	E756-L759 WeakPolarHBondContact O-CB 3.42Å; E756-L759 PolarHBondContact O-N 3.4Å; E756-K760 HydrophobicContact CG-CD 4.42Å; E756-K760 VanDerWaalsContact O-CG 3.31Å; E756-K760 WeakPolarHBondContact O-CG 3.42Å; E756-K760 PolarHBondContact O-N 2.95Å; E756-K760 WeakPolarHBondContact OE1-CE 3.35Å; E756-K760 IonicContact OE1-NZ 2.79Å; E756-K760 PolarHBondContact OE1-NZ 3.32Å; E756-V772 HydrophobicContact CB-CG2 4.5Å; E756-V772 HydrophobicContact CG-CG2 3.88Å
757	C	90.2	Very high	87.1	Confident	38 Å²	38	48.6 Å²	48.6	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-48.2	175.4	-177.5	0	0	0	0	110.8	C738 N755 L759 K760 V761	C738-C757 WeakPolarHBondContact CA-SG 3.44Å; C738-C757 HydrophobicContact CB-CB 3.74Å; C738-C757 WeakPolarHBondContact CB-SG 3.34Å; C738-C757 WeakPolarHBondContact SG-CB 3.42Å; C738-C757 CovalentContact SG-SG 2.04Å; C738-C757 PolarHBondContact SG-SG 2.86Å; N755-C757 PolarHBondContact O-N 2.83Å; N755-C757 WeakPolarHBondContact OD1-CA 3.48Å; N755-C757 VanDerWaalsContact OD1-CB 3.25Å; N755-C757 WeakPolarHBondContact OD1-CB 3.03Å; N755-C757 PolarHBondContact OD1-N 2.8Å; C757-L759 PolarHBondContact O-N 3.44Å; C757-K760 PolarHBondContact O-N 2.04Å; C757-V761 WeakPolarHBondContact O-CG2 3.34Å; C757-V761 PolarHBondContact O-N 3.42Å
758	F	91.4	Very high	87	Confident	61 Å²	61	55.2 Å²	55.2	27%	0.268	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-32.5	176.7	-73.3	-69.5	0	0	0	113.1	C738 Y740 Y753 E754 N755 K762	C738-F758 HydrophobicContact CB-CD1 4.22Å; C738-F758 HydrophobicContact CB-CD2 4.27Å; C738-F758 HydrophobicContact CB-CE1 3.94Å; C738-F758 HydrophobicContact CB-CE2 4Å; C738-F758 HydrophobicContact CB-CG 4.38Å; C738-F758 HydrophobicContact CB-CZ 3.82Å; Y740-F758 HydrophobicContact CD2-CE2 4.17Å; Y740-F758 HydrophobicContact CD2-CZ 4.14Å; Y753-F758 HydrophobicContact CD1-CB 4.43Å; E754-F758 HydrophobicContact CB-CD2 3.93Å; E754-F758 HydrophobicContact CB-CE2 4.31Å; N755-F758 PolarHBondContact O-N 3.28Å; N755-F758 WeakPolarHBondContact OD1-CD2 3.42Å; N755-F758 PolarHBondContact OD1-N 2.8Å; N755-F758 VanDerWaalsContact OD1-N 3.17Å; F758-K762 WeakPolarHBondContact O-CB 3.24Å; F758-K762 PolarHBondContact O-N 3.14Å
759	L	92.4	Very high	86.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-46.4	171.1	175.1	152.3	0	0	0	111.8	V745 Y753 N755 E756 C757 K762 S763 V770 V772	V745-L759 HydrophobicContact CG2-CB 4.17Å; V745-L759 HydrophobicContact CG2-CD1 3.82Å; Y753-L759 HydrophobicContact CD1-CB 4.08Å; Y753-L759 HydrophobicContact CD2-CB 3.78Å; Y753-L759 HydrophobicContact CD2-CD1 3.81Å; Y753-L759 HydrophobicContact CD2-CG 4Å; Y753-L759 HydrophobicContact CE2-CB 4.34Å; Y753-L759 HydrophobicContact CE2-CD1 4.22Å; Y753-L759 HydrophobicContact CE2-CG 4.23Å; Y753-L759 HydrophobicContact CG-CB 3.62Å; Y753-L759 HydrophobicContact CG-CD1 4.46Å; Y753-L759 HydrophobicContact CG-CG 4.35Å; N755-L759 PolarHBondContact O-N 3.47Å; E756-L759 WeakPolarHBondContact O-CB 3.42Å; E756-L759 PolarHBondContact O-N 3.4Å; C757-L759 PolarHBondContact O-N 3.44Å; L759-K762 PolarHBondContact O-N 3.39Å; L759-S763 VanDerWaalsContact O-CB 3.27Å; L759-S763 WeakPolarHBondContact O-CB 3.41Å; L759-S763 PolarHBondContact O-N 2.94Å; L759-V770 HydrophobicContact CD1-CG1 4.38Å; L759-V770 WeakPolarHBondContact CD2-O 3.17Å; L759-V770 HydrophobicContact CG-CG1 4.23Å; L759-V772 HydrophobicContact CD1-CG2 3.94Å; L759-V772 HydrophobicContact CD2-CG2 4.44Å
760	K	91	Very high	87	Confident	61 Å²	61	57.2 Å²	57.2	27%	0.265	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-43.5	176.9	-70.3	176.6	178.3	164.9	0	112.5	Y719 E756 C757 K762 S763 C764	Y719-K760 HydrophobicContact CD1-CB 4.34Å; Y719-K760 HydrophobicContact CD1-CD 3.77Å; Y719-K760 HydrophobicContact CD1-CG 3.62Å; Y719-K760 HydrophobicContact CD2-CB 4.05Å; Y719-K760 HydrophobicContact CD2-CG 3.85Å; Y719-K760 HydrophobicContact CE1-CD 4.06Å; Y719-K760 HydrophobicContact CE1-CG 3.84Å; Y719-K760 HydrophobicContact CE2-CG 4.05Å; Y719-K760 HydrophobicContact CG-CB 3.86Å; Y719-K760 HydrophobicContact CG-CD 4.17Å; Y719-K760 HydrophobicContact CG-CG 3.6Å; E756-K760 HydrophobicContact CG-CD 4.42Å; E756-K760 VanDerWaalsContact O-CG 3.31Å; E756-K760 WeakPolarHBondContact O-CG 3.42Å; E756-K760 PolarHBondContact O-N 2.95Å; E756-K760 WeakPolarHBondContact OE1-CE 3.35Å; E756-K760 IonicContact OE1-NZ 2.79Å; E756-K760 PolarHBondContact OE1-NZ 3.32Å; C757-K760 PolarHBondContact O-N 2.04Å; K760-K762 VanDerWaalsContact C-N 3.35Å; K760-K762 PolarHBondContact O-N 3.02Å; K760-S763 PolarHBondContact O-N 2.79Å; K760-C764 PolarHBondContact O-N 3.17Å
761	V	89.2	Confident	87.2	Confident	32 Å²	32	58.7 Å²	58.7	19%	0.194	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-44.8	174.9	174.1	0	0	0	0	110.7	P735 C738 C757 C764 A765	P735-V761 HydrophobicContact CB-CG2 4.2Å; P735-V761 HydrophobicContact CG-CG2 4.07Å; P735-V761 VanDerWaalsContact O-CG2 3.29Å; P735-V761 WeakPolarHBondContact O-CG2 3.32Å; C738-V761 WeakPolarHBondContact SG-CG2 3.43Å; C757-V761 WeakPolarHBondContact O-CG2 3.34Å; C757-V761 PolarHBondContact O-N 3.42Å; V761-C764 PolarHBondContact O-N 3.21Å; V761-A765 VanDerWaalsContact O-CB 3.31Å; V761-A765 WeakPolarHBondContact O-CB 3.19Å; V761-A765 PolarHBondContact O-N 2.95Å
762	K	89.7	Confident	87.1	Confident	84 Å²	84	56 Å²	56	37%	0.365	28%	0.279	S	S	.	.	H	α-helix	trans	-70.1	-40	178.3	-171.2	54	164.7	157.5	0	112.7	Y753 F758 L759 K760 C764 A765 D766	Y753-K762 HydrophobicContact CD1-CB 4.38Å; Y753-K762 HydrophobicContact CE1-CB 3.5Å; Y753-K762 VanDerWaalsContact CE1-CB 3.5Å; Y753-K762 HydrophobicContact CE1-CG 3.74Å; F758-K762 WeakPolarHBondContact O-CB 3.24Å; F758-K762 PolarHBondContact O-N 3.14Å; L759-K762 PolarHBondContact O-N 3.39Å; K760-K762 VanDerWaalsContact C-N 3.35Å; K760-K762 PolarHBondContact O-N 3.02Å; K762-C764 VanDerWaalsContact C-N 3.27Å; K762-C764 PolarHBondContact O-N 2.96Å; K762-A765 PolarHBondContact O-N 2.81Å; K762-D766 WeakPolarHBondContact CD-OD2 3.21Å; K762-D766 WeakPolarHBondContact CE-OD1 3.38Å; K762-D766 WeakPolarHBondContact CE-OD2 3.33Å; K762-D766 VanDerWaalsContact NZ-CG 3.26Å; K762-D766 IonicContact NZ-OD1 3.27Å; K762-D766 PolarHBondContact NZ-OD1 3.38Å; K762-D766 IonicContact NZ-OD2 2.64Å; K762-D766 PolarHBondContact NZ-OD2 3.22Å; K762-D766 VanDerWaalsContact NZ-OD2 3.09Å; K762-D766 WeakPolarHBondContact O-CB 3.48Å; K762-D766 PolarHBondContact O-N 3.27Å
763	S	89.8	Confident	86.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-55	-44.5	172.2	180	0	0	0	0	111	Y719 L759 K760 Q767 R768 V770	Y719-S763 WeakPolarHBondContact CD2-OG 3.03Å; L759-S763 VanDerWaalsContact O-CB 3.27Å; L759-S763 WeakPolarHBondContact O-CB 3.41Å; L759-S763 PolarHBondContact O-N 2.94Å; K760-S763 PolarHBondContact O-N 2.79Å; S763-Q767 PolarHBondContact O-N 3.49Å; S763-R768 CarbonylContact C-O 3.12Å; S763-R768 VanDerWaalsContact CA-O 3.29Å; S763-R768 WeakPolarHBondContact CA-O 3.44Å; S763-R768 WeakPolarHBondContact CB-O 3.5Å; S763-R768 PolarHBondContact O-N 2.99Å; S763-R768 PolarHBondContact OG-O 3.23Å; S763-V770 PolarHBondContact OG-N 3.31Å; S763-V770 VanDerWaalsContact OG-N 3.15Å
764	C	91.1	Very high	86	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.2	-48.1	176.3	-169.8	0	0	0	0	113	Y718 A720 C734 K760 V761 K762 D766 Q767	Y718-C764 WeakPolarHBondContact O-CA 2.84Å; Y718-C764 WeakPolarHBondContact O-CB 3.09Å; Y718-C764 PolarHBondContact O-N 2.97Å; Y718-C764 VanDerWaalsContact O-N 3.09Å; A720-C764 VanDerWaalsContact CB-SG 3.58Å; C734-C764 WeakPolarHBondContact CA-SG 3.03Å; C734-C764 HydrophobicContact CB-CB 3.68Å; C734-C764 WeakPolarHBondContact CB-SG 3.18Å; C734-C764 WeakPolarHBondContact SG-CB 3.08Å; C734-C764 PolarHBondContact SG-O 3.17Å; C734-C764 CovalentContact SG-SG 2.04Å; C734-C764 PolarHBondContact SG-SG 3.34Å; K760-C764 PolarHBondContact O-N 3.17Å; V761-C764 PolarHBondContact O-N 3.21Å; K762-C764 VanDerWaalsContact C-N 3.27Å; K762-C764 PolarHBondContact O-N 2.96Å; C764-D766 VanDerWaalsContact C-N 3.27Å; C764-D766 PolarHBondContact O-N 3.09Å; C764-Q767 PolarHBondContact O-N 3.19Å; C764-Q767 PolarHBondContact O-NE2 2.9Å
765	A	85.1	Confident	85.8	Confident	65 Å²	65	59 Å²	59	54%	0.537	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-34	-178.3	0	0	0	0	0	112.6	V761 K762 Q767	V761-A765 VanDerWaalsContact O-CB 3.31Å; V761-A765 WeakPolarHBondContact O-CB 3.19Å; V761-A765 PolarHBondContact O-N 2.95Å; K762-A765 PolarHBondContact O-N 2.81Å; A765-Q767 VanDerWaalsContact C-N 3.33Å
766	D	86.5	Confident	85.7	Confident	72 Å²	72	59.6 Å²	59.6	39%	0.385	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	0.8	175.2	-67.7	-6.2	0	0	0	113	K762 C764 R768	K762-D766 WeakPolarHBondContact CD-OD2 3.21Å; K762-D766 WeakPolarHBondContact CE-OD1 3.38Å; K762-D766 WeakPolarHBondContact CE-OD2 3.33Å; K762-D766 VanDerWaalsContact NZ-CG 3.26Å; K762-D766 IonicContact NZ-OD1 3.27Å; K762-D766 PolarHBondContact NZ-OD1 3.38Å; K762-D766 IonicContact NZ-OD2 2.64Å; K762-D766 PolarHBondContact NZ-OD2 3.22Å; K762-D766 VanDerWaalsContact NZ-OD2 3.09Å; K762-D766 WeakPolarHBondContact O-CB 3.48Å; K762-D766 PolarHBondContact O-N 3.27Å; C764-D766 VanDerWaalsContact C-N 3.27Å; C764-D766 PolarHBondContact O-N 3.09Å; D766-R768 HydrophobicContact CB-CB 4.38Å; D766-R768 PolarHBondContact O-N 2.96Å
767	Q	82.3	Confident	85.4	Confident	110 Å²	110	63.1 Å²	63.1	51%	0.514	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	44.3	-175.4	-68.6	-71.9	-73.1	0	0	113	Y718 S763 C764 A765	Y718-Q767 VanDerWaalsContact CD2-C 3.48Å; Y718-Q767 HydrophobicContact CD2-CB 3.92Å; Y718-Q767 HydrophobicContact CD2-CG 4.4Å; Y718-Q767 WeakPolarHBondContact CE1-O 3.44Å; Y718-Q767 HydrophobicContact CE2-CB 3.92Å; Y718-Q767 VanDerWaalsContact CE2-O 3.28Å; Y718-Q767 WeakPolarHBondContact CE2-O 3.5Å; S763-Q767 PolarHBondContact O-N 3.49Å; C764-Q767 PolarHBondContact O-N 3.19Å; C764-Q767 PolarHBondContact O-NE2 2.9Å; A765-Q767 VanDerWaalsContact C-N 3.33Å
768	R	83.8	Confident	84.7	Confident	139 Å²	139	63 Å²	63	53%	0.525	32%	0.317	S	S	.	.	S	Bend	trans	-141.3	133.2	-172	178.3	-179	177.9	-168.4	-1.2	110.4	S763 D766 V770	S763-R768 CarbonylContact C-O 3.12Å; S763-R768 VanDerWaalsContact CA-O 3.29Å; S763-R768 WeakPolarHBondContact CA-O 3.44Å; S763-R768 WeakPolarHBondContact CB-O 3.5Å; S763-R768 PolarHBondContact O-N 2.99Å; S763-R768 PolarHBondContact OG-O 3.23Å; D766-R768 HydrophobicContact CB-CB 4.38Å; D766-R768 PolarHBondContact O-N 2.96Å; R768-V770 HydrophobicContact CG-CG2 4.46Å; R768-V770 PolarHBondContact O-N 3.36Å; R768-V770 VanDerWaalsContact O-N 3.07Å
769	E	76.7	Confident	83.5	Confident	111 Å²	111	67.5 Å²	67.5	52%	0.519	33%	0.332	S	S	.	.			trans	-65	109.8	173.3	-96.4	161.7	156.7	0	0	111.2	Y718	Y718-E769 HydrophobicContact CD1-CG 4.06Å
770	V	83.5	Confident	82.2	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.012	37%	0.368	C	S	.	.			trans	-120.3	115	167.4	-174.7	0	0	0	0	106.3	Y719 T748 D749 Y753 L759 S763 R768	Y719-V770 VanDerWaalsContact CE2-O 3.3Å; Y719-V770 WeakPolarHBondContact CE2-O 3.21Å; Y719-V770 PolarHBondContact OH-O 3.35Å; T748-V770 WeakPolarHBondContact OG1-CA 2.92Å; D749-V770 HydrophobicContact CB-CG1 4.16Å; D749-V770 HydrophobicContact CB-CG2 4.13Å; Y753-V770 HydrophobicContact CE2-CG1 4.19Å; L759-V770 HydrophobicContact CD1-CG1 4.38Å; L759-V770 WeakPolarHBondContact CD2-O 3.17Å; L759-V770 HydrophobicContact CG-CG1 4.23Å; S763-V770 PolarHBondContact OG-N 3.31Å; S763-V770 VanDerWaalsContact OG-N 3.15Å; R768-V770 HydrophobicContact CG-CG2 4.46Å; R768-V770 PolarHBondContact O-N 3.36Å; R768-V770 VanDerWaalsContact O-N 3.07Å
771	H	83.6	Confident	80.7	Confident	82 Å²	82	72.3 Å²	72.3	38%	0.38	37%	0.37	S	S	.	.			trans	-105	166	177.5	-51.7	-68.8	0	0	0	109.8	Y719 G747 T748 A773	Y719-H771 AromaticContact CZ-ND1 3.82Å; Y719-H771 PolarHBondContact OH-ND1 3.01Å; G747-H771 CarbonylContact C-O 3.54Å; G747-H771 VanDerWaalsContact CA-O 3.3Å; G747-H771 WeakPolarHBondContact CA-O 3.39Å; T748-H771 HydrophobicContact CG2-CB 4.1Å; T748-H771 PolarHBondContact N-O 2.88Å; T748-H771 PolarHBondContact OG1-N 2.84Å; H771-A773 PolarHBondContact O-N 3.09Å; H771-A773 VanDerWaalsContact O-N 3.16Å
772	V	83.7	Confident	79.3	Confident	53 Å²	53	75.5 Å²	75.5	32%	0.321	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	112.5	169.5	177.3	0	0	0	0	108.5	V745 C746 E756 L759	V745-V772 HydrophobicContact CB-CG1 4.1Å; V745-V772 HydrophobicContact CB-CG2 4.06Å; V745-V772 HydrophobicContact CG1-CG1 4.26Å; V745-V772 HydrophobicContact CG1-CG2 4.21Å; V745-V772 HydrophobicContact CG2-CG2 4.12Å; C746-V772 CarbonylContact O-C 3.5Å; C746-V772 WeakPolarHBondContact O-CA 3.21Å; E756-V772 HydrophobicContact CB-CG2 4.5Å; E756-V772 HydrophobicContact CG-CG2 3.88Å; L759-V772 HydrophobicContact CD1-CG2 3.94Å; L759-V772 HydrophobicContact CD2-CG2 4.44Å
773	A	75.5	Confident	77.7	Confident	47 Å²	47	74.5 Å²	74.5	39%	0.388	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-31.1	172.3	0	0	0	0	0	112	C746 T748 H771	C746-A773 PolarHBondContact O-N 2.77Å; T748-A773 HydrophobicContact CG2-CB 3.99Å; H771-A773 PolarHBondContact O-N 3.09Å; H771-A773 VanDerWaalsContact O-N 3.16Å
774	Q	78.3	Confident	76.3	Confident	52 Å²	52	77 Å²	77	24%	0.243	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	140.9	177.1	169.7	156.3	50.2	0	0	110.3	C746	C746-Q774 HydrophobicContact CB-CB 4.2Å; C746-Q774 WeakPolarHBondContact CB-O 3.18Å; C746-Q774 PolarHBondContact N-O 2.04Å; C746-Q774 PolarHBondContact O-N 3.12Å
775	E	81.9	Confident	75.2	Confident	126 Å²	126	78.6 Å²	78.6	59%	0.589	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	138	165.4	-67.5	-158.9	131.9	0	0	111.1	K743	K743-E775 WeakPolarHBondContact CE-OE1 3.33Å; K743-E775 IonicContact NZ-OE1 3.77Å; K743-E775 PolarHBondContact NZ-OE1 3.01Å
776	G	82.8	Confident	74	Confident	24 Å²	24	78 Å²	78	25%	0.247	42%	0.424	C	S	.	.	S	Bend	trans	95.8	-163.8	-172.1	0	0	0	0	0	113.4	P744 V745 C746	P744-G776 VanDerWaalsContact O-CA 3.23Å; P744-G776 WeakPolarHBondContact O-CA 3.17Å; P744-G776 PolarHBondContact O-N 2.77Å; V745-G776 CarbonylContact C-O 3.45Å; V745-G776 WeakPolarHBondContact CA-O 3.31Å; V745-G776 PolarHBondContact N-O 2.92Å; C746-G776 PolarHBondContact N-O 3.34Å
777	Y	85	Confident	73.1	Confident	167 Å²	167	78 Å²	78	66%	0.655	42%	0.424	S	S	*	.	S	Bend	trans	-77.8	147.6	179.7	-62.8	-95.9	0	0	0	111.8	P744 T752 R779	P744-Y777 HydrophobicContact CB-CE1 4.45Å; P744-Y777 HydrophobicContact CB-CE2 4.3Å; P744-Y777 HydrophobicContact CG-CD2 4.19Å; P744-Y777 HydrophobicContact CG-CE2 3.66Å; T752-Y777 HydrophobicContact CG2-CD1 3.67Å; T752-Y777 HydrophobicContact CG2-CE1 4.23Å; T752-Y777 HydrophobicContact CG2-CG 4.18Å; Y777-R779 PolarHBondContact O-N 3.28Å
778	C	74.9	Confident	72.1	Confident	36 Å²	36	74.8 Å²	74.8	24%	0.243	42%	0.42	C	S	.	.			trans	-60.6	135.4	175.5	-70.5	0	0	0	0	112.4	C746 G750 K751 T752	C746-C778 WeakPolarHBondContact CA-SG 3.05Å; C746-C778 HydrophobicContact CB-CB 3.93Å; C746-C778 WeakPolarHBondContact CB-SG 3.17Å; C746-C778 WeakPolarHBondContact SG-CA 3.48Å; C746-C778 WeakPolarHBondContact SG-CB 3.23Å; C746-C778 CovalentContact SG-SG 2.03Å; C746-C778 PolarHBondContact SG-SG 3.37Å; G750-C778 PolarHBondContact O-SG 2.85Å; K751-C778 PolarHBondContact O-SG 3.42Å; T752-C778 PolarHBondContact OG1-N 3.03Å
779	R	67.3	Low	71.7	Confident	154 Å²	154	70.3 Å²	70.3	58%	0.581	41%	0.405	S	S	*	.			trans	-110.3	146.7	178.2	-58.2	179.7	-172.8	-175.7	2.9	109.8	Y777 C781 T782	Y777-R779 PolarHBondContact O-N 3.28Å; R779-C781 PolarHBondContact O-N 3.13Å; R779-T782 VanDerWaalsContact CB-OG1 3.24Å; R779-T782 WeakPolarHBondContact CB-OG1 3.5Å; R779-T782 WeakPolarHBondContact CD-OG1 3.08Å
780	P	65	Low	71.4	Confident	119 Å²	119	69.3 Å²	69.3	77%	0.773	40%	0.4	S	S	*	.	S	Bend	trans	-60	101.9	176.6	-25.1	35.5	0	0	0	112.8	T782	P780-T782 PolarHBondContact O-N 3.06Å
781	C	60	Low	70.8	Confident	43 Å²	43	72 Å²	72	29%	0.291	42%	0.418	S	S	.	.	S	Bend	trans	50.9	5.5	176.1	-85.8	0	0	0	0	119.8	R779 A783 G784 C791 G794	R779-C781 PolarHBondContact O-N 3.13Å; C781-A783 PolarHBondContact O-N 2.04Å; C781-G784 PolarHBondContact O-N 3.32Å; C781-C791 HydrophobicContact CB-CB 3.93Å; C781-C791 WeakPolarHBondContact CB-SG 3.38Å; C781-C791 WeakPolarHBondContact SG-CB 3.39Å; C781-C791 CovalentContact SG-SG 2.03Å; C781-C791 PolarHBondContact SG-SG 3.21Å; C781-G794 VanDerWaalsContact SG-C 3.55Å
782	T	58.4	Low	70.3	Confident	100 Å²	100	74.9 Å²	74.9	61%	0.613	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	0.3	-177.4	60.6	0	0	0	0	115.3	R779 P780	R779-T782 VanDerWaalsContact CB-OG1 3.24Å; R779-T782 WeakPolarHBondContact CB-OG1 3.5Å; R779-T782 WeakPolarHBondContact CD-OG1 3.08Å; P780-T782 PolarHBondContact O-N 3.06Å
783	A	56.5	Low	69.5	Low	62 Å²	62	80.4 Å²	80.4	51%	0.512	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	8.6	-175.9	0	0	0	0	0	114.1	C781	C781-A783 PolarHBondContact O-N 2.04Å
784	G	60	Low	68.9	Low	54 Å²	54	80.8 Å²	80.8	56%	0.557	46%	0.462	S	S	*	.			trans	81.3	-169.3	-178.2	0	0	0	0	0	114.5	C781	C781-G784 PolarHBondContact O-N 3.32Å
785	C	67.8	Low	68.1	Low	33 Å²	33	85 Å²	85	22%	0.223	48%	0.482	C	S	.	.			trans	-134.4	143.6	-177.6	-74.7	0	0	0	0	110.4	F789 C796	C785-F789 HydrophobicContact CB-CB 3.94Å; C785-F789 VanDerWaalsContact CB-O 3.28Å; C785-F789 WeakPolarHBondContact CB-O 3.23Å; C785-C796 HydrophobicContact CB-CB 3.79Å; C785-C796 WeakPolarHBondContact CB-SG 3.19Å; C785-C796 VanDerWaalsContact SG-CA 3.53Å; C785-C796 WeakPolarHBondContact SG-CB 3.33Å; C785-C796 CovalentContact SG-SG 2.04Å; C785-C796 PolarHBondContact SG-SG 3.3Å
786	P	61.5	Low	67.6	Low	51 Å²	51	81.6 Å²	81.6	33%	0.331	47%	0.471	S	S	.	.	S	Bend	trans	-73.7	173.7	179.1	32.5	-37.2	0	0	0	112.6	G788 F789	P786-G788 PolarHBondContact O-N 2.71Å; P786-F789 WeakPolarHBondContact O-CB 3.43Å; P786-F789 WeakPolarHBondContact O-CD2 3.45Å; P786-F789 PolarHBondContact O-N 3.48Å
787	L	67.1	Low	67.5	Low	73 Å²	73	82.6 Å²	82.6	38%	0.382	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	29.3	164.3	-68.8	168.4	0	0	0	116.3	F789 C831 N836	L787-F789 HydrophobicContact CB-CD2 3.78Å; L787-F789 HydrophobicContact CB-CE2 3.77Å; L787-F789 PolarHBondContact O-N 3.41Å; L787-C831 WeakPolarHBondContact O-CB 3.45Å; L787-N836 HydrophobicContact CD2-CB 4.49Å
788	G	60.8	Low	67.4	Low	43 Å²	43	76.1 Å²	76.1	44%	0.443	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	8.8	-179.7	0	0	0	0	0	115.2	P786	P786-G788 PolarHBondContact O-N 2.71Å
789	F	74.7	Confident	67.6	Low	45 Å²	45	79.1 Å²	79.1	20%	0.197	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-67.4	147.1	170.3	-69.1	-114.9	0	0	0	110.2	C785 P786 L787 C796 V797 C831	C785-F789 HydrophobicContact CB-CB 3.94Å; C785-F789 VanDerWaalsContact CB-O 3.28Å; C785-F789 WeakPolarHBondContact CB-O 3.23Å; P786-F789 WeakPolarHBondContact O-CB 3.43Å; P786-F789 WeakPolarHBondContact O-CD2 3.45Å; P786-F789 PolarHBondContact O-N 3.48Å; L787-F789 HydrophobicContact CB-CD2 3.78Å; L787-F789 HydrophobicContact CB-CE2 3.77Å; L787-F789 PolarHBondContact O-N 3.41Å; F789-C796 HydrophobicContact CB-CB 3.85Å; F789-C796 HydrophobicContact CD1-CB 4.11Å; F789-C796 HydrophobicContact CG-CB 4.29Å; F789-V797 CarbonylContact C-O 3.58Å; F789-V797 WeakPolarHBondContact CA-O 3.38Å; F789-C831 HydrophobicContact CD2-CB 4.39Å; F789-C831 WeakPolarHBondContact CD2-SG 3.3Å; F789-C831 HydrophobicContact CE2-CB 4.34Å; F789-C831 WeakPolarHBondContact CE2-SG 3.36Å; F789-C831 WeakPolarHBondContact CG-SG 3.33Å
790	Q	71.8	Confident	68.3	Low	90 Å²	90	77.2 Å²	77.2	42%	0.421	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	139.2	172.7	-60.7	-175.8	-31.2	0	0	109.5	R792 C796 V797	Q790-R792 PolarHBondContact O-N 3.01Å; Q790-C796 WeakPolarHBondContact O-CA 3.3Å; Q790-V797 PolarHBondContact N-O 3.11Å; Q790-V797 PolarHBondContact O-N 3.06Å
791	C	69.7	Low	69.1	Low	58 Å²	58	74.5 Å²	74.5	39%	0.392	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	124	170.1	-178.3	0	0	0	0	110.5	C781 Q795	C781-C791 HydrophobicContact CB-CB 3.93Å; C781-C791 WeakPolarHBondContact CB-SG 3.38Å; C781-C791 WeakPolarHBondContact SG-CB 3.39Å; C781-C791 CovalentContact SG-SG 2.03Å; C781-C791 PolarHBondContact SG-SG 3.21Å; C791-Q795 WeakPolarHBondContact CA-O 3.27Å
792	R	73.6	Confident	70.1	Confident	142 Å²	142	73.7 Å²	73.7	54%	0.536	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	122	176.1	-155.1	173	-172.9	170.5	1.5	106.9	Q790 G794 Q795 V797 D800	Q790-R792 PolarHBondContact O-N 3.01Å; R792-G794 VanDerWaalsContact C-N 3.26Å; R792-G794 PolarHBondContact O-N 3.15Å; R792-Q795 PolarHBondContact N-O 3.2Å; R792-Q795 PolarHBondContact O-N 2.03Å; R792-V797 HydrophobicContact CB-CG2 3.65Å; R792-V797 HydrophobicContact CG-CG2 4.47Å; R792-D800 IonicContact NH1-OD2 2.85Å; R792-D800 PolarHBondContact NH1-OD2 2.98Å
793	N	66.5	Low	71.1	Confident	170 Å²	170	72.6 Å²	72.6	91%	0.909	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	34.2	-177.6	-57.8	-4.7	0	0	0	115.2	Q795	N793-Q795 VanDerWaalsContact C-N 3.31Å
794	G	62.8	Low	71.8	Confident	55 Å²	55	75.2 Å²	75.2	57%	0.567	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	4.1	-177.4	0	0	0	0	0	114.8	C781 R792	C781-G794 VanDerWaalsContact SG-C 3.55Å; R792-G794 VanDerWaalsContact C-N 3.26Å; R792-G794 PolarHBondContact O-N 3.15Å
795	Q	61.3	Low	71.9	Confident	141 Å²	141	76.7 Å²	76.7	66%	0.659	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.5	-176.1	-150.3	172.5	20.9	0	0	110.2	C791 R792 N793	C791-Q795 WeakPolarHBondContact CA-O 3.27Å; R792-Q795 PolarHBondContact N-O 3.2Å; R792-Q795 PolarHBondContact O-N 2.03Å; N793-Q795 VanDerWaalsContact C-N 3.31Å
796	C	71.8	Confident	71.8	Confident	53 Å²	53	81.1 Å²	81.1	36%	0.358	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	124.1	176.8	-62.2	0	0	0	0	110.4	C785 F789 Q790	C785-C796 HydrophobicContact CB-CB 3.79Å; C785-C796 WeakPolarHBondContact CB-SG 3.19Å; C785-C796 VanDerWaalsContact SG-CA 3.53Å; C785-C796 WeakPolarHBondContact SG-CB 3.33Å; C785-C796 CovalentContact SG-SG 2.04Å; C785-C796 PolarHBondContact SG-SG 3.3Å; F789-C796 HydrophobicContact CB-CB 3.85Å; F789-C796 HydrophobicContact CD1-CB 4.11Å; F789-C796 HydrophobicContact CG-CB 4.29Å; Q790-C796 WeakPolarHBondContact O-CA 3.3Å
797	V	82	Confident	72	Confident	45 Å²	45	85 Å²	85	27%	0.273	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149.8	-179.9	-62.3	0	0	0	0	111.9	F789 Q790 R792	F789-V797 CarbonylContact C-O 3.58Å; F789-V797 WeakPolarHBondContact CA-O 3.38Å; Q790-V797 PolarHBondContact N-O 3.11Å; Q790-V797 PolarHBondContact O-N 3.06Å; R792-V797 HydrophobicContact CB-CG2 3.65Å; R792-V797 HydrophobicContact CG-CG2 4.47Å
798	C	81.7	Confident	71.7	Confident	32 Å²	32	87.6 Å²	87.6	22%	0.216	50%	0.5	C	S	.	.			trans	-69.9	156.1	177.1	-66.2	0	0	0	0	112.7	D800 C831	C798-D800 PolarHBondContact O-N 3.27Å; C798-C831 WeakPolarHBondContact CA-SG 3.05Å; C798-C831 HydrophobicContact CB-CB 3.98Å; C798-C831 WeakPolarHBondContact CB-SG 3.4Å; C798-C831 WeakPolarHBondContact SG-CB 3.1Å; C798-C831 PolarHBondContact SG-O 3.49Å; C798-C831 CovalentContact SG-SG 2.04Å; C798-C831 PolarHBondContact SG-SG 3.06Å
799	R	79.7	Confident	71.6	Confident	98 Å²	98	89.5 Å²	89.5	37%	0.37	50%	0.497	S	S	.	.			trans	-74.3	115.6	177.7	-165.4	-174.4	-172.3	164.5	7.4	110.7	A801 C824 R828	R799-A801 VanDerWaalsContact C-N 3.3Å; R799-A801 WeakPolarHBondContact CD-O 3.39Å; R799-A801 WeakPolarHBondContact CG-O 3.31Å; R799-A801 PolarHBondContact NE-O 3.16Å; R799-A801 PolarHBondContact O-N 3.2Å; R799-C824 PolarHBondContact NH1-SG 3.12Å; R799-C824 VanDerWaalsContact NH1-SG 3.35Å; R799-R828 PolarHBondContact O-NE 3.16Å
800	D	81.2	Confident	71.4	Confident	115 Å²	115	94.5 Å²	94.5	62%	0.615	53%	0.525	S	S	*	.	S	Bend	trans	-50.4	-46.3	-175.8	-60.8	-48.7	0	0	0	112.7	R792 C798 R828	R792-D800 IonicContact NH1-OD2 2.85Å; R792-D800 PolarHBondContact NH1-OD2 2.98Å; C798-D800 PolarHBondContact O-N 3.27Å; D800-R828 PolarHBondContact O-NE 2.87Å; D800-R828 VanDerWaalsContact O-NE 3.16Å; D800-R828 PolarHBondContact O-NH2 3.21Å
801	A	82.6	Confident	72	Confident	61 Å²	61	94.4 Å²	94.4	50%	0.504	53%	0.528	S	S	.	.			trans	-147	155.4	176	0	0	0	0	0	112.4	R799	R799-A801 VanDerWaalsContact C-N 3.3Å; R799-A801 WeakPolarHBondContact CD-O 3.39Å; R799-A801 WeakPolarHBondContact CG-O 3.31Å; R799-A801 PolarHBondContact NE-O 3.16Å; R799-A801 PolarHBondContact O-N 3.2Å
802	C	81.2	Confident	72.7	Confident	27 Å²	27	93.2 Å²	93.2	18%	0.182	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-92.7	157.2	168.6	-78.3	0	0	0	0	111.8	C824 E825	C802-C824 HydrophobicContact CB-CB 3.88Å; C802-C824 WeakPolarHBondContact CB-SG 3.13Å; C802-C824 WeakPolarHBondContact SG-CB 3.45Å; C802-C824 PolarHBondContact SG-O 3.18Å; C802-C824 CovalentContact SG-SG 2.05Å; C802-C824 PolarHBondContact SG-SG 2.98Å; C802-E825 PolarHBondContact SG-N 2.97Å
803	P	78.7	Confident	73.3	Confident	76 Å²	76	87 Å²	87	49%	0.494	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-59.8	153.9	172.2	-20.3	33.2	0	0	0	111.8	K805	P803-K805 PolarHBondContact O-N 3.26Å
804	P	72.3	Confident	74.2	Confident	118 Å²	118	78.9 Å²	78.9	77%	0.766	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-62.3	132.3	169.3	27.7	-33.7	0	0	0	110.2	H806	P804-H806 PolarHBondContact O-N 2.81Å
805	K	60.3	Low	75.3	Confident	84 Å²	84	78 Å²	78	37%	0.365	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-53.4	128.3	-177.8	-173.7	-175.9	-177.2	-178.6	0	111.6	P803 E809 D811 S821	P803-K805 PolarHBondContact O-N 3.26Å; K805-E809 WeakPolarHBondContact CE-O 3.22Å; K805-E809 HydrophobicContact CG-CB 4Å; K805-E809 PolarHBondContact NZ-O 2.82Å; K805-D811 IonicContact NZ-OD1 3.41Å; K805-D811 PolarHBondContact NZ-OD1 2.85Å; K805-D811 IonicContact NZ-OD2 2.91Å; K805-D811 PolarHBondContact NZ-OD2 3.19Å; K805-S821 VanDerWaalsContact CD-O 3.23Å; K805-S821 WeakPolarHBondContact CD-O 3.27Å; K805-S821 VanDerWaalsContact CE-O 3.25Å; K805-S821 WeakPolarHBondContact CE-O 3.23Å
806	H	66.5	Low	76.4	Confident	127 Å²	127	74.1 Å²	74.1	59%	0.588	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-72.6	148.8	173.1	-97.5	-92.8	0	0	0	111.2	P804 T808 E809	P804-H806 PolarHBondContact O-N 2.81Å; H806-T808 PolarHBondContact O-N 2.97Å; H806-E809 HydrophobicContact CB-CG 4.26Å; H806-E809 PolarHBondContact N-OE2 3.41Å; H806-E809 PolarHBondContact O-N 3.11Å
807	P	65.5	Low	76.9	Confident	133 Å²	133	71.9 Å²	71.9	86%	0.864	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-13.8	-177.7	-25.9	35.4	0	0	0	115.7
808	T	60.9	Low	77.1	Confident	127 Å²	127	75.2 Å²	75.2	78%	0.779	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-5	-179.8	52.1	0	0	0	0	113.9	H806	H806-T808 PolarHBondContact O-N 2.97Å
809	E	59.4	Low	77.3	Confident	83 Å²	83	77.8 Å²	77.8	39%	0.388	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-78.3	131.7	174.9	-73	179.4	106.1	0	0	110.5	K805 H806	K805-E809 WeakPolarHBondContact CE-O 3.22Å; K805-E809 HydrophobicContact CG-CB 4Å; K805-E809 PolarHBondContact NZ-O 2.82Å; H806-E809 HydrophobicContact CB-CG 4.26Å; H806-E809 PolarHBondContact N-OE2 3.41Å; H806-E809 PolarHBondContact O-N 3.11Å
810	L	69.2	Low	77.6	Confident	150 Å²	150	74 Å²	74	79%	0.785	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-87.9	152	172	-66	172.7	0	0	0	110.5
811	D	84.7	Confident	77.8	Confident	88 Å²	88	71 Å²	71	47%	0.471	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-69.8	131.9	173.4	-60.4	-54.3	0	0	0	110.1	K805 L819 Y820 S821	K805-D811 IonicContact NZ-OD1 3.41Å; K805-D811 PolarHBondContact NZ-OD1 2.85Å; K805-D811 IonicContact NZ-OD2 2.91Å; K805-D811 PolarHBondContact NZ-OD2 3.19Å; D811-L819 HydrophobicContact CB-CB 4.47Å; D811-L819 HydrophobicContact CB-CD2 4.01Å; D811-Y820 CarbonylContact C-O 3.56Å; D811-Y820 WeakPolarHBondContact CA-O 3.45Å; D811-S821 WeakPolarHBondContact OD1-CA 3.26Å
812	V	84.5	Confident	77.9	Confident	33 Å²	33	68.5 Å²	68.5	20%	0.2	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.2	-178.5	-63	0	0	0	0	110.6	L819 Y820 L826 V839	V812-L819 WeakPolarHBondContact O-CA 3.47Å; V812-Y820 PolarHBondContact N-O 2.82Å; V812-Y820 PolarHBondContact O-N 2.89Å; V812-L826 HydrophobicContact CG2-CB 4.26Å; V812-L826 HydrophobicContact CG2-CD1 3.79Å; V812-V839 HydrophobicContact CB-CG1 4.47Å
813	C	87.8	Confident	78.1	Confident	11 Å²	11	71.7 Å²	71.7	7%	0.074	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.9	171.4	-173	0	0	0	0	109.3	L819 V839 D840 C846	C813-L819 HydrophobicContact CB-CD2 4.41Å; C813-V839 CarbonylContact O-C 3.52Å; C813-V839 WeakPolarHBondContact O-CA 3.37Å; C813-D840 HydrophobicContact CB-CB 4.3Å; C813-D840 PolarHBondContact O-N 2.92Å; C813-C846 VanDerWaalsContact CA-SG 3.54Å; C813-C846 HydrophobicContact CB-CB 3.93Å; C813-C846 WeakPolarHBondContact CB-SG 3.44Å; C813-C846 WeakPolarHBondContact SG-CB 3.47Å; C813-C846 PolarHBondContact SG-N 3.44Å; C813-C846 CovalentContact SG-SG 2.03Å; C813-C846 PolarHBondContact SG-SG 2.93Å
814	G	85.4	Confident	78.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-87.5	160.1	172.9	0	0	0	0	0	112.7	D816 G817 K818 D838	G814-D816 PolarHBondContact O-N 2.96Å; G814-G817 WeakPolarHBondContact O-CA 3.43Å; G814-G817 PolarHBondContact O-N 3.1Å; G814-K818 PolarHBondContact N-O 3.4Å; G814-D838 CarbonylContact C-O 3.52Å; G814-D838 VanDerWaalsContact CA-O 3.3Å; G814-D838 WeakPolarHBondContact CA-O 3.4Å
815	T	84.5	Confident	79.3	Confident	37 Å²	37	65.5 Å²	65.5	23%	0.227	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15	174.1	48.4	0	0	0	0	113.6	G817 D838 R845	T815-G817 PolarHBondContact O-N 2.8Å; T815-D838 HydrophobicContact CG2-CB 3.92Å; T815-D838 PolarHBondContact N-O 2.85Å; T815-D838 PolarHBondContact OG1-N 3.3Å; T815-D838 VanDerWaalsContact OG1-N 3.1Å; T815-D838 PolarHBondContact OG1-O 2.94Å; T815-R845 WeakPolarHBondContact O-CD 3.46Å; T815-R845 PolarHBondContact O-NH1 3.1Å
816	D	84.7	Confident	80.6	Confident	58 Å²	58	61.6 Å²	61.6	31%	0.31	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.4	168.1	75.8	-24.8	0	0	0	113.8	G814 K818 Y820	G814-D816 PolarHBondContact O-N 2.96Å; D816-K818 PolarHBondContact OD1-N 2.9Å; D816-K818 WeakPolarHBondContact OD2-CE 3.39Å; D816-K818 VanDerWaalsContact OD2-CG 3.32Å; D816-K818 WeakPolarHBondContact OD2-CG 3.46Å; D816-K818 IonicContact OD2-NZ 2.69Å; D816-K818 PolarHBondContact OD2-NZ 3.29Å; D816-Y820 WeakPolarHBondContact OD1-CE2 3.01Å; D816-Y820 PolarHBondContact OD1-OH 2.92Å; D816-Y820 PolarHBondContact OD2-OH 2.87Å
817	G	81.9	Confident	81.5	Confident	6 Å²	6	60 Å²	60	6%	0.062	33%	0.325	C	S	.	.	S	Bend	trans	69.8	32	-176.5	0	0	0	0	0	113.5	G814 T815 K849	G814-G817 WeakPolarHBondContact O-CA 3.43Å; G814-G817 PolarHBondContact O-N 3.1Å; T815-G817 PolarHBondContact O-N 2.8Å; G817-K849 PolarHBondContact O-NZ 2.72Å
818	K	86.1	Confident	82.6	Confident	116 Å²	116	56.5 Å²	56.5	50%	0.504	30%	0.295	S	S	.	.			trans	-102.5	156.5	160.3	-62.1	-167.1	-154.9	91.4	0	110.4	G814 D816 Y820 C846	G814-K818 PolarHBondContact N-O 3.4Å; D816-K818 PolarHBondContact OD1-N 2.9Å; D816-K818 WeakPolarHBondContact OD2-CE 3.39Å; D816-K818 VanDerWaalsContact OD2-CG 3.32Å; D816-K818 WeakPolarHBondContact OD2-CG 3.46Å; D816-K818 IonicContact OD2-NZ 2.69Å; D816-K818 PolarHBondContact OD2-NZ 3.29Å; K818-Y820 HydrophobicContact CB-CE2 3.89Å; K818-C846 PolarHBondContact O-SG 3.14Å
819	L	86.9	Confident	83.8	Confident	86 Å²	86	52.7 Å²	52.7	45%	0.45	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135	166.1	-75.9	155.4	0	0	0	109.3	D811 V812 C813 C846	D811-L819 HydrophobicContact CB-CB 4.47Å; D811-L819 HydrophobicContact CB-CD2 4.01Å; V812-L819 WeakPolarHBondContact O-CA 3.47Å; C813-L819 HydrophobicContact CB-CD2 4.41Å; L819-C846 HydrophobicContact CG-CB 4.33Å
820	Y	86.4	Confident	85.1	Confident	18 Å²	18	49 Å²	49	7%	0.071	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141	175.6	-64.8	-96.5	0	0	0	109.6	D811 V812 D816 K818 S822 L826 Q829 I837	D811-Y820 CarbonylContact C-O 3.56Å; D811-Y820 WeakPolarHBondContact CA-O 3.45Å; V812-Y820 PolarHBondContact N-O 2.82Å; V812-Y820 PolarHBondContact O-N 2.89Å; D816-Y820 WeakPolarHBondContact OD1-CE2 3.01Å; D816-Y820 PolarHBondContact OD1-OH 2.92Å; D816-Y820 PolarHBondContact OD2-OH 2.87Å; K818-Y820 HydrophobicContact CB-CE2 3.89Å; Y820-S822 PolarHBondContact O-N 2.89Å; Y820-S822 VanDerWaalsContact O-N 3.12Å; Y820-L826 HydrophobicContact CD1-CB 4.05Å; Y820-L826 HydrophobicContact CD2-CB 4.07Å; Y820-L826 HydrophobicContact CD2-CD1 3.83Å; Y820-L826 HydrophobicContact CD2-CG 3.98Å; Y820-L826 HydrophobicContact CE2-CD1 4.35Å; Y820-L826 HydrophobicContact CE2-CG 4.29Å; Y820-L826 HydrophobicContact CG-CB 3.73Å; Y820-L826 HydrophobicContact CG-CD1 4.32Å; Y820-L826 HydrophobicContact CG-CG 4.16Å; Y820-Q829 HydrophobicContact CD1-CG 4.36Å; Y820-Q829 HydrophobicContact CE1-CB 3.85Å; Y820-Q829 HydrophobicContact CE1-CG 3.92Å; Y820-I837 HydrophobicContact CE2-CG2 4.28Å
821	S	85.2	Confident	85.9	Confident	53 Å²	53	42 Å²	42	37%	0.371	22%	0.215	S	C	.	.	S	Bend	trans	-63.7	-19.4	-174.6	54.7	0	0	0	0	114.9	K805 D811	K805-S821 VanDerWaalsContact CD-O 3.23Å; K805-S821 WeakPolarHBondContact CD-O 3.27Å; K805-S821 VanDerWaalsContact CE-O 3.25Å; K805-S821 WeakPolarHBondContact CE-O 3.23Å; D811-S821 WeakPolarHBondContact OD1-CA 3.26Å
822	S	84.9	Confident	85.9	Confident	7 Å²	7	41.8 Å²	41.8	5%	0.049	21%	0.213	C	C	.	.	S	Bend	trans	-163	164.4	174	59.1	0	0	0	0	109.3	Y820 C824 E825 L826	Y820-S822 PolarHBondContact O-N 2.89Å; Y820-S822 VanDerWaalsContact O-N 3.12Å; S822-C824 PolarHBondContact O-N 2.97Å; S822-C824 PolarHBondContact OG-N 3.46Å; S822-E825 PolarHBondContact O-N 2.82Å; S822-E825 VanDerWaalsContact O-N 3.16Å; S822-E825 PolarHBondContact OG-N 3.16Å; S822-L826 PolarHBondContact O-N 2.83Å; S822-L826 VanDerWaalsContact O-N 3.17Å
823	E	84.3	Confident	85.7	Confident	94 Å²	94	45.5 Å²	45.5	44%	0.439	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-26.2	169.7	-157.8	-147.1	-163	0	0	112	K827 V839	E823-K827 HydrophobicContact CG-CD 4.44Å; E823-K827 WeakPolarHBondContact O-CB 3.04Å; E823-K827 WeakPolarHBondContact O-CG 3.47Å; E823-K827 PolarHBondContact O-N 3.31Å; E823-K827 WeakPolarHBondContact OE1-CE 3.39Å; E823-K827 IonicContact OE1-NZ 3.83Å; E823-K827 PolarHBondContact OE1-NZ 3.29Å; E823-K827 WeakPolarHBondContact OE2-CE 3.41Å; E823-K827 IonicContact OE2-NZ 3.42Å; E823-K827 PolarHBondContact OE2-NZ 2.78Å; E823-V839 HydrophobicContact CG-CG2 4.33Å
824	C	86.7	Confident	85	Confident	30 Å²	30	51.9 Å²	51.9	20%	0.203	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-48.6	172.2	-175.5	0	0	0	0	111.3	R799 C802 S822 L826 K827 R828	R799-C824 PolarHBondContact NH1-SG 3.12Å; R799-C824 VanDerWaalsContact NH1-SG 3.35Å; C802-C824 HydrophobicContact CB-CB 3.88Å; C802-C824 WeakPolarHBondContact CB-SG 3.13Å; C802-C824 WeakPolarHBondContact SG-CB 3.45Å; C802-C824 PolarHBondContact SG-O 3.18Å; C802-C824 CovalentContact SG-SG 2.05Å; C802-C824 PolarHBondContact SG-SG 2.98Å; S822-C824 PolarHBondContact O-N 2.97Å; S822-C824 PolarHBondContact OG-N 3.46Å; C824-L826 VanDerWaalsContact C-N 3.34Å; C824-L826 PolarHBondContact O-N 2.8Å; C824-K827 PolarHBondContact O-N 2.8Å; C824-R828 VanDerWaalsContact O-CB 3.29Å; C824-R828 WeakPolarHBondContact O-CB 2.98Å; C824-R828 PolarHBondContact O-N 3.41Å
825	E	88.7	Confident	84.5	Confident	34 Å²	34	55 Å²	55	16%	0.159	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-36.1	-177.8	-165.8	57.8	-141	0	0	111	C802 S822 R828 Q829	C802-E825 PolarHBondContact SG-N 2.97Å; S822-E825 PolarHBondContact O-N 2.82Å; S822-E825 VanDerWaalsContact O-N 3.16Å; S822-E825 PolarHBondContact OG-N 3.16Å; E825-R828 PolarHBondContact O-N 2.91Å; E825-R828 IonicContact OE1-CZ 3.26Å; E825-R828 IonicContact OE1-NH1 2.68Å; E825-R828 PolarHBondContact OE1-NH1 2.9Å; E825-R828 IonicContact OE2-NH1 2.78Å; E825-R828 PolarHBondContact OE2-NH1 2.77Å; E825-Q829 HydrophobicContact CG-CG 4.43Å; E825-Q829 WeakPolarHBondContact O-CB 3.21Å; E825-Q829 VanDerWaalsContact O-CG 3.27Å; E825-Q829 WeakPolarHBondContact O-CG 3.27Å; E825-Q829 PolarHBondContact O-N 3.17Å; E825-Q829 PolarHBondContact OE1-NE2 3.41Å
826	L	88.9	Confident	84	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-57.2	-50.9	171	-174.2	156.2	0	0	0	111.5	V812 Y820 S822 C824 R828 Q829 A830 I837 V839	V812-L826 HydrophobicContact CG2-CB 4.26Å; V812-L826 HydrophobicContact CG2-CD1 3.79Å; Y820-L826 HydrophobicContact CD1-CB 4.05Å; Y820-L826 HydrophobicContact CD2-CB 4.07Å; Y820-L826 HydrophobicContact CD2-CD1 3.83Å; Y820-L826 HydrophobicContact CD2-CG 3.98Å; Y820-L826 HydrophobicContact CE2-CD1 4.35Å; Y820-L826 HydrophobicContact CE2-CG 4.29Å; Y820-L826 HydrophobicContact CG-CB 3.73Å; Y820-L826 HydrophobicContact CG-CD1 4.32Å; Y820-L826 HydrophobicContact CG-CG 4.16Å; S822-L826 PolarHBondContact O-N 2.83Å; S822-L826 VanDerWaalsContact O-N 3.17Å; C824-L826 VanDerWaalsContact C-N 3.34Å; C824-L826 PolarHBondContact O-N 2.8Å; L826-R828 VanDerWaalsContact C-N 3.35Å; L826-R828 PolarHBondContact O-N 2.77Å; L826-Q829 PolarHBondContact O-N 2.74Å; L826-A830 WeakPolarHBondContact O-CB 3.34Å; L826-A830 PolarHBondContact O-N 3.06Å; L826-I837 HydrophobicContact CD2-CB 4.37Å; L826-I837 HydrophobicContact CD2-CG2 4.18Å; L826-I837 WeakPolarHBondContact CD2-O 3.34Å; L826-I837 HydrophobicContact CG-CG2 4.06Å; L826-V839 HydrophobicContact CD1-CG2 4.07Å
827	K	85.2	Confident	83.9	Confident	92 Å²	92	56.1 Å²	56.1	40%	0.4	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-34.6	176.9	-73.1	171.4	178.9	168.6	0	112.9	E823 C824 C831	E823-K827 HydrophobicContact CG-CD 4.44Å; E823-K827 WeakPolarHBondContact O-CB 3.04Å; E823-K827 WeakPolarHBondContact O-CG 3.47Å; E823-K827 PolarHBondContact O-N 3.31Å; E823-K827 WeakPolarHBondContact OE1-CE 3.39Å; E823-K827 IonicContact OE1-NZ 3.83Å; E823-K827 PolarHBondContact OE1-NZ 3.29Å; E823-K827 WeakPolarHBondContact OE2-CE 3.41Å; E823-K827 IonicContact OE2-NZ 3.42Å; E823-K827 PolarHBondContact OE2-NZ 2.78Å; C824-K827 PolarHBondContact O-N 2.8Å; K827-C831 WeakPolarHBondContact O-CB 3.44Å; K827-C831 PolarHBondContact O-N 2.86Å
828	R	87.6	Confident	83.7	Confident	61 Å²	61	59.1 Å²	59.1	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-45.4	175.3	179	173.2	176.6	-99.4	1.4	111.4	R799 D800 C824 E825 L826 C831 I832	R799-R828 PolarHBondContact O-NE 3.16Å; D800-R828 PolarHBondContact O-NE 2.87Å; D800-R828 VanDerWaalsContact O-NE 3.16Å; D800-R828 PolarHBondContact O-NH2 3.21Å; C824-R828 VanDerWaalsContact O-CB 3.29Å; C824-R828 WeakPolarHBondContact O-CB 2.98Å; C824-R828 PolarHBondContact O-N 3.41Å; E825-R828 PolarHBondContact O-N 2.91Å; E825-R828 IonicContact OE1-CZ 3.26Å; E825-R828 IonicContact OE1-NH1 2.68Å; E825-R828 PolarHBondContact OE1-NH1 2.9Å; E825-R828 IonicContact OE2-NH1 2.78Å; E825-R828 PolarHBondContact OE2-NH1 2.77Å; L826-R828 VanDerWaalsContact C-N 3.35Å; L826-R828 PolarHBondContact O-N 2.77Å; R828-C831 WeakPolarHBondContact O-CB 3.37Å; R828-C831 PolarHBondContact O-N 2.82Å; R828-I832 HydrophobicContact CG-CD1 3.8Å; R828-I832 WeakPolarHBondContact O-CB 3.37Å; R828-I832 VanDerWaalsContact O-CG1 3.25Å; R828-I832 WeakPolarHBondContact O-CG1 3.24Å; R828-I832 PolarHBondContact O-N 3.44Å
829	Q	87.8	Confident	83.4	Confident	47 Å²	47	55.6 Å²	55.6	22%	0.22	28%	0.283	C	S	.	.	H	α-helix	trans	-69.9	-36.3	176.8	-63.5	-61.2	-27.9	0	0	111.9	Y820 E825 L826 C831 I832 H833	Y820-Q829 HydrophobicContact CD1-CG 4.36Å; Y820-Q829 HydrophobicContact CE1-CB 3.85Å; Y820-Q829 HydrophobicContact CE1-CG 3.92Å; E825-Q829 HydrophobicContact CG-CG 4.43Å; E825-Q829 WeakPolarHBondContact O-CB 3.21Å; E825-Q829 VanDerWaalsContact O-CG 3.27Å; E825-Q829 WeakPolarHBondContact O-CG 3.27Å; E825-Q829 PolarHBondContact O-N 3.17Å; E825-Q829 PolarHBondContact OE1-NE2 3.41Å; L826-Q829 PolarHBondContact O-N 2.74Å; Q829-C831 VanDerWaalsContact C-N 3.34Å; Q829-C831 PolarHBondContact O-N 2.94Å; Q829-I832 PolarHBondContact O-N 2.04Å; Q829-H833 WeakPolarHBondContact O-CB 3.19Å; Q829-H833 PolarHBondContact O-CD2 3.49Å; Q829-H833 VanDerWaalsContact O-CD2 3.31Å; Q829-H833 PolarHBondContact O-N 2.99Å
830	A	85.5	Confident	83.1	Confident	6 Å²	6	52.2 Å²	52.2	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-57.2	-46.1	170.4	0	0	0	0	0	112	L826 Q834 T835 I837	L826-A830 WeakPolarHBondContact O-CB 3.34Å; L826-A830 PolarHBondContact O-N 3.06Å; A830-Q834 WeakPolarHBondContact O-CA 3.36Å; A830-Q834 PolarHBondContact O-N 2.89Å; A830-T835 VanDerWaalsContact CA-O 3.3Å; A830-T835 WeakPolarHBondContact CA-O 3Å; A830-T835 WeakPolarHBondContact CB-O 3.45Å; A830-T835 PolarHBondContact O-N 3.42Å; A830-T835 VanDerWaalsContact O-N 3.15Å; A830-I837 HydrophobicContact CB-CB 4.1Å; A830-I837 HydrophobicContact CB-CD1 4.44Å; A830-I837 HydrophobicContact CB-CG1 4.22Å
831	C	85.8	Confident	82.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.014	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-50.2	175.9	-167.7	0	0	0	0	112.4	L787 F789 C798 K827 R828 Q829 H833 Q834	L787-C831 WeakPolarHBondContact O-CB 3.45Å; F789-C831 HydrophobicContact CD2-CB 4.39Å; F789-C831 WeakPolarHBondContact CD2-SG 3.3Å; F789-C831 HydrophobicContact CE2-CB 4.34Å; F789-C831 WeakPolarHBondContact CE2-SG 3.36Å; F789-C831 WeakPolarHBondContact CG-SG 3.33Å; C798-C831 WeakPolarHBondContact CA-SG 3.05Å; C798-C831 HydrophobicContact CB-CB 3.98Å; C798-C831 WeakPolarHBondContact CB-SG 3.4Å; C798-C831 WeakPolarHBondContact SG-CB 3.1Å; C798-C831 PolarHBondContact SG-O 3.49Å; C798-C831 CovalentContact SG-SG 2.04Å; C798-C831 PolarHBondContact SG-SG 3.06Å; K827-C831 WeakPolarHBondContact O-CB 3.44Å; K827-C831 PolarHBondContact O-N 2.86Å; R828-C831 WeakPolarHBondContact O-CB 3.37Å; R828-C831 PolarHBondContact O-N 2.82Å; Q829-C831 VanDerWaalsContact C-N 3.34Å; Q829-C831 PolarHBondContact O-N 2.94Å; C831-H833 PolarHBondContact O-N 2.95Å; C831-Q834 PolarHBondContact O-N 2.76Å
832	I	84.2	Confident	81.5	Confident	83 Å²	83	56.6 Å²	56.6	43%	0.426	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-43.2	-178.5	-71.9	166.9	0	0	0	111.7	R828 Q829 Q834	R828-I832 HydrophobicContact CG-CD1 3.8Å; R828-I832 WeakPolarHBondContact O-CB 3.37Å; R828-I832 VanDerWaalsContact O-CG1 3.25Å; R828-I832 WeakPolarHBondContact O-CG1 3.24Å; R828-I832 PolarHBondContact O-N 3.44Å; Q829-I832 PolarHBondContact O-N 2.04Å; I832-Q834 VanDerWaalsContact C-N 3.35Å
833	H	82	Confident	80.6	Confident	112 Å²	112	57 Å²	57	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-83.7	-7.8	179.5	-69.2	-55.3	0	0	0	114	Q829 C831 T835	Q829-H833 WeakPolarHBondContact O-CB 3.19Å; Q829-H833 PolarHBondContact O-CD2 3.49Å; Q829-H833 VanDerWaalsContact O-CD2 3.31Å; Q829-H833 PolarHBondContact O-N 2.99Å; C831-H833 PolarHBondContact O-N 2.95Å; H833-T835 HydrophobicContact CB-CG2 4.3Å; H833-T835 WeakPolarHBondContact CB-OG1 3.49Å; H833-T835 PolarHBondContact O-N 2.92Å
834	Q	72	Confident	80	Confident	145 Å²	145	56.6 Å²	56.6	68%	0.678	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	32.6	-172.5	-56.5	-174.7	-4.9	0	0	113.4	A830 C831 I832	A830-Q834 WeakPolarHBondContact O-CA 3.36Å; A830-Q834 PolarHBondContact O-N 2.89Å; C831-Q834 PolarHBondContact O-N 2.76Å; I832-Q834 VanDerWaalsContact C-N 3.35Å
835	T	76.2	Confident	79.5	Confident	65 Å²	65	60 Å²	60	40%	0.399	31%	0.306	S	S	.	.			trans	-116.7	134.5	-179.6	48.7	0	0	0	0	108.9	A830 H833 I837	A830-T835 VanDerWaalsContact CA-O 3.3Å; A830-T835 WeakPolarHBondContact CA-O 3Å; A830-T835 WeakPolarHBondContact CB-O 3.45Å; A830-T835 PolarHBondContact O-N 3.42Å; A830-T835 VanDerWaalsContact O-N 3.15Å; H833-T835 HydrophobicContact CB-CG2 4.3Å; H833-T835 WeakPolarHBondContact CB-OG1 3.49Å; H833-T835 PolarHBondContact O-N 2.92Å; T835-I837 PolarHBondContact O-N 2.89Å; T835-I837 VanDerWaalsContact O-N 3.16Å
836	N	72.9	Confident	79	Confident	103 Å²	103	58.9 Å²	58.9	55%	0.551	30%	0.301	S	S	*	.			trans	-69.6	116.3	171.3	-155.7	54.2	0	0	0	109.2	L787 D838	L787-N836 HydrophobicContact CD2-CB 4.49Å; N836-D838 PolarHBondContact ND2-OD1 3.01Å; N836-D838 PolarHBondContact ND2-OD2 2.89Å
837	I	81.9	Confident	78	Confident	15 Å²	15	67 Å²	67	8%	0.077	33%	0.332	C	S	.	.			trans	-121.5	120.3	172.8	-50.8	175.3	0	0	0	104.6	Y820 L826 A830 T835	Y820-I837 HydrophobicContact CE2-CG2 4.28Å; L826-I837 HydrophobicContact CD2-CB 4.37Å; L826-I837 HydrophobicContact CD2-CG2 4.18Å; L826-I837 WeakPolarHBondContact CD2-O 3.34Å; L826-I837 HydrophobicContact CG-CG2 4.06Å; A830-I837 HydrophobicContact CB-CB 4.1Å; A830-I837 HydrophobicContact CB-CD1 4.44Å; A830-I837 HydrophobicContact CB-CG1 4.22Å; T835-I837 PolarHBondContact O-N 2.89Å; T835-I837 VanDerWaalsContact O-N 3.16Å
838	D	78.5	Confident	76.7	Confident	69 Å²	69	67.1 Å²	67.1	37%	0.369	34%	0.344	S	S	.	.			trans	-110.9	172.1	178.8	-51.8	-73.3	0	0	0	108.7	G814 T815 N836 D840	G814-D838 CarbonylContact C-O 3.52Å; G814-D838 VanDerWaalsContact CA-O 3.3Å; G814-D838 WeakPolarHBondContact CA-O 3.4Å; T815-D838 HydrophobicContact CG2-CB 3.92Å; T815-D838 PolarHBondContact N-O 2.85Å; T815-D838 PolarHBondContact OG1-N 3.3Å; T815-D838 VanDerWaalsContact OG1-N 3.1Å; T815-D838 PolarHBondContact OG1-O 2.94Å; N836-D838 PolarHBondContact ND2-OD1 3.01Å; N836-D838 PolarHBondContact ND2-OD2 2.89Å; D838-D840 PolarHBondContact O-N 2.92Å
839	V	80.1	Confident	75	Confident	42 Å²	42	70 Å²	70	26%	0.255	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-76.8	123.2	172.6	-178.2	0	0	0	0	109.3	V812 C813 E823 L826 L841	V812-V839 HydrophobicContact CB-CG1 4.47Å; C813-V839 CarbonylContact O-C 3.52Å; C813-V839 WeakPolarHBondContact O-CA 3.37Å; E823-V839 HydrophobicContact CG-CG2 4.33Å; L826-V839 HydrophobicContact CD1-CG2 4.07Å; V839-L841 VanDerWaalsContact C-N 3.26Å; V839-L841 HydrophobicContact CB-CD2 4.23Å; V839-L841 HydrophobicContact CB-CG 4.36Å; V839-L841 HydrophobicContact CG1-CD2 3.73Å; V839-L841 HydrophobicContact CG1-CG 4.13Å; V839-L841 PolarHBondContact O-N 2.85Å
840	D	80.2	Confident	73.5	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.08	38%	0.375	C	S	.	.			trans	-72.9	86.8	163.3	174.6	17.1	0	0	0	108.7	C813 D838 T842 G843 V844 R845	C813-D840 HydrophobicContact CB-CB 4.3Å; C813-D840 PolarHBondContact O-N 2.92Å; D838-D840 PolarHBondContact O-N 2.92Å; D840-T842 PolarHBondContact O-N 2.7Å; D840-T842 VanDerWaalsContact O-N 3.1Å; D840-T842 WeakPolarHBondContact OD1-CB 3.44Å; D840-T842 PolarHBondContact OD1-N 3.08Å; D840-T842 PolarHBondContact OD1-OG1 2.77Å; D840-T842 PolarHBondContact OD2-OG1 3.04Å; D840-G843 WeakPolarHBondContact O-CA 2.94Å; D840-G843 PolarHBondContact O-N 3.04Å; D840-G843 PolarHBondContact OD1-N 3.31Å; D840-V844 PolarHBondContact OD2-N 3.03Å; D840-V844 VanDerWaalsContact OD2-N 3.1Å; D840-R845 VanDerWaalsContact OD2-CB 3.29Å; D840-R845 WeakPolarHBondContact OD2-CB 3.32Å; D840-R845 WeakPolarHBondContact OD2-CG 3.32Å; D840-R845 PolarHBondContact OD2-N 3.28Å
841	L	69.5	Low	71.6	Confident	96 Å²	96	78.8 Å²	78.8	50%	0.503	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.3	178.7	-64.6	168.4	0	0	0	113.5	V839 L872	V839-L841 VanDerWaalsContact C-N 3.26Å; V839-L841 HydrophobicContact CB-CD2 4.23Å; V839-L841 HydrophobicContact CB-CG 4.36Å; V839-L841 HydrophobicContact CG1-CD2 3.73Å; V839-L841 HydrophobicContact CG1-CG 4.13Å; V839-L841 PolarHBondContact O-N 2.85Å; L841-L872 HydrophobicContact CB-CD1 3.71Å; L841-L872 HydrophobicContact CB-CD2 3.92Å; L841-L872 HydrophobicContact CB-CG 3.54Å; L841-L872 HydrophobicContact CD1-CD1 4.28Å; L841-L872 HydrophobicContact CD1-CG 3.85Å; L841-L872 HydrophobicContact CG-CD1 4.44Å; L841-L872 HydrophobicContact CG-CG 4.29Å
842	T	68.4	Low	69.6	Low	67 Å²	67	84.1 Å²	84.1	41%	0.411	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-23.9	169.6	78.9	0	0	0	0	111.9	D840 V844 R847	D840-T842 PolarHBondContact O-N 2.7Å; D840-T842 VanDerWaalsContact O-N 3.1Å; D840-T842 WeakPolarHBondContact OD1-CB 3.44Å; D840-T842 PolarHBondContact OD1-N 3.08Å; D840-T842 PolarHBondContact OD1-OG1 2.77Å; D840-T842 PolarHBondContact OD2-OG1 3.04Å; T842-V844 PolarHBondContact O-N 3.02Å; T842-V844 VanDerWaalsContact O-N 3.13Å; T842-V844 WeakPolarHBondContact OG1-CB 3Å; T842-V844 WeakPolarHBondContact OG1-CG2 3.41Å; T842-V844 PolarHBondContact OG1-N 3.2Å; T842-V844 VanDerWaalsContact OG1-N 3.08Å; T842-R847 PolarHBondContact O-NE 3.19Å; T842-R847 PolarHBondContact O-NH2 3.26Å
843	G	66.8	Low	67.7	Low	16 Å²	16	86.4 Å²	86.4	17%	0.165	46%	0.459	C	S	.	.			trans	63.1	1.8	-169.2	0	0	0	0	0	114.6	D840 R845 C846 R847	D840-G843 WeakPolarHBondContact O-CA 2.94Å; D840-G843 PolarHBondContact O-N 3.04Å; D840-G843 PolarHBondContact OD1-N 3.31Å; G843-R845 VanDerWaalsContact C-N 3.28Å; G843-R845 PolarHBondContact O-N 2.74Å; G843-C846 PolarHBondContact O-N 3.38Å; G843-R847 WeakPolarHBondContact O-CG 3.4Å; G843-R847 PolarHBondContact O-N 3.1Å
844	V	72.1	Confident	65.4	Low	85 Å²	85	87.5 Å²	87.5	52%	0.515	47%	0.467	S	S	.	.	H	α-helix	trans	-63.6	-34	-171.7	174	0	0	0	0	111.4	D840 T842 C846 R847 S848	D840-V844 PolarHBondContact OD2-N 3.03Å; D840-V844 VanDerWaalsContact OD2-N 3.1Å; T842-V844 PolarHBondContact O-N 3.02Å; T842-V844 VanDerWaalsContact O-N 3.13Å; T842-V844 WeakPolarHBondContact OG1-CB 3Å; T842-V844 WeakPolarHBondContact OG1-CG2 3.41Å; T842-V844 PolarHBondContact OG1-N 3.2Å; T842-V844 VanDerWaalsContact OG1-N 3.08Å; V844-C846 PolarHBondContact O-N 3.44Å; V844-R847 PolarHBondContact O-N 3.06Å; V844-S848 PolarHBondContact O-N 2.67Å; V844-S848 PolarHBondContact O-OG 2.97Å
845	R	75.9	Confident	63.5	Low	102 Å²	102	89 Å²	89	39%	0.385	47%	0.474	S	S	.	.	H	α-helix	trans	-68	-20.2	177	-59.3	-176.5	-173.7	-157.9	0.1	113.1	T815 D840 G843 S848	T815-R845 WeakPolarHBondContact O-CD 3.46Å; T815-R845 PolarHBondContact O-NH1 3.1Å; D840-R845 VanDerWaalsContact OD2-CB 3.29Å; D840-R845 WeakPolarHBondContact OD2-CB 3.32Å; D840-R845 WeakPolarHBondContact OD2-CG 3.32Å; D840-R845 PolarHBondContact OD2-N 3.28Å; G843-R845 VanDerWaalsContact C-N 3.28Å; G843-R845 PolarHBondContact O-N 2.74Å; R845-S848 PolarHBondContact O-OG 3.15Å
846	C	78.2	Confident	61.7	Low	10 Å²	10	93.1 Å²	93.1	7%	0.068	49%	0.494	C	S	.	.	H	α-helix	trans	-96.8	-37.2	173.3	-61.6	0	0	0	0	112.8	C813 K818 L819 G843 V844 S848 K849 H850	C813-C846 VanDerWaalsContact CA-SG 3.54Å; C813-C846 HydrophobicContact CB-CB 3.93Å; C813-C846 WeakPolarHBondContact CB-SG 3.44Å; C813-C846 WeakPolarHBondContact SG-CB 3.47Å; C813-C846 PolarHBondContact SG-N 3.44Å; C813-C846 CovalentContact SG-SG 2.03Å; C813-C846 PolarHBondContact SG-SG 2.93Å; K818-C846 PolarHBondContact O-SG 3.14Å; L819-C846 HydrophobicContact CG-CB 4.33Å; G843-C846 PolarHBondContact O-N 3.38Å; V844-C846 PolarHBondContact O-N 3.44Å; C846-S848 PolarHBondContact O-N 3.21Å; C846-K849 PolarHBondContact O-N 3.33Å; C846-H850 PolarHBondContact O-N 3.35Å
847	R	67.3	Low	59.9	Low	175 Å²	175	93.3 Å²	93.3	66%	0.66	50%	0.499	S	S	*	.	H	α-helix	trans	-56.4	-35.1	175.9	-70.4	-178.6	-141.5	-141.7	6.2	112.4	T842 G843 V844 K849	T842-R847 PolarHBondContact O-NE 3.19Å; T842-R847 PolarHBondContact O-NH2 3.26Å; G843-R847 WeakPolarHBondContact O-CG 3.4Å; G843-R847 PolarHBondContact O-N 3.1Å; V844-R847 PolarHBondContact O-N 3.06Å; R847-K849 PolarHBondContact O-N 3.07Å
848	S	57.6	Low	57.6	Low	94 Å²	94	100 Å²	100	66%	0.657	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.8	176.3	62.6	0	0	0	0	114.7	V844 R845 C846	V844-S848 PolarHBondContact O-N 2.67Å; V844-S848 PolarHBondContact O-OG 2.97Å; R845-S848 PolarHBondContact O-OG 3.15Å; C846-S848 PolarHBondContact O-N 3.21Å
849	K	53.3	Low	55.3	Low	121 Å²	121	105.5 Å²	105.5	53%	0.526	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.2	-24.6	179.6	-64.5	-179.6	-170.7	166.8	0	113.9	G817 C846 R847	G817-K849 PolarHBondContact O-NZ 2.72Å; C846-K849 PolarHBondContact O-N 3.33Å; R847-K849 PolarHBondContact O-N 3.07Å
850	H	54.4	Low	52.9	Low	121 Å²	121	113.3 Å²	113.3	56%	0.56	59%	0.591	S	S	*	*			trans	-130.5	87.7	177.7	-72.3	-77.6	0	0	0	111.9	C846 T852	C846-H850 PolarHBondContact O-N 3.35Å; H850-T852 VanDerWaalsContact C-N 3.33Å; H850-T852 PolarHBondContact O-N 2.95Å
851	P	46.8	Very low	50.7	Low	116 Å²	116	118.8 Å²	118.8	75%	0.753	63%	0.626	S	S	*	*			trans	-79.8	-3.5	-177.1	-16.5	32.9	0	0	0	115.7
852	T	44.4	Very low	49	Very low	114 Å²	114	120.9 Å²	120.9	70%	0.699	65%	0.648	S	S	*	*			trans	-106.6	8.4	-153.4	36.1	0	0	0	0	116.9	H850 L854	H850-T852 VanDerWaalsContact C-N 3.33Å; H850-T852 PolarHBondContact O-N 2.95Å; T852-L854 PolarHBondContact O-N 3.41Å; T852-L854 VanDerWaalsContact O-N 3.12Å
853	V	43	Very low	47	Very low	132 Å²	132	120.5 Å²	120.5	80%	0.8	66%	0.658	S	S	*	*			trans	-86.5	86.3	178.1	-172.2	0	0	0	0	110.9
854	L	35.1	Very low	45.2	Very low	135 Å²	135	127.6 Å²	127.6	71%	0.707	69%	0.692	S	S	*	*			trans	21.8	115.7	145.3	-59.2	163.3	0	0	0	116.8	T852	T852-L854 PolarHBondContact O-N 3.41Å; T852-L854 VanDerWaalsContact O-N 3.12Å
855	Q	31.9	Very low	43.2	Very low	176 Å²	176	130.6 Å²	130.6	82%	0.822	70%	0.704	S	S	*	*				51.3	94	73.4	-63.1	-174.6	-20	0	0	113.8
856	D	37	Very low	41	Very low	152 Å²	152	133.9 Å²	133.9	81%	0.813	72%	0.723	S	S	*	*				-163.8	153.5	119.9	-121.3	-31	0	0	0	116.4
857	T	36.1	Very low	38.7	Very low	107 Å²	107	137.2 Å²	137.2	66%	0.656	75%	0.752	S	S	*	*			trans	30	113.1	162.9	60.5	0	0	0	0	123.7
858	N	33.6	Very low	36.8	Very low	155 Å²	155	136.5 Å²	136.5	83%	0.829	76%	0.761	S	S	*	*				44.2	103.6	126.1	-63.5	-30.9	0	0	0	122.4
859	M	29.3	Very low	35.6	Very low	185 Å²	185	135.9 Å²	135.9	91%	0.911	77%	0.769	S	S	*	*				-156.7	122.8	125.4	-112.8	175.6	83.1	0	0	112.1
860	K	30.9	Very low	34.6	Very low	205 Å²	205	136.2 Å²	136.2	89%	0.891	78%	0.781	S	S	*	*			trans	-104.6	93.9	175.6	-81.3	-176.7	176.6	174.7	0	111.1
861	T	34.2	Very low	33.6	Very low	131 Å²	131	142 Å²	142	80%	0.804	80%	0.798	S	S	*	*	S	Bend	trans	173.7	132.2	146.4	20.8	0	0	0	0	108.4	G863	T861-G863 PolarHBondContact O-N 2.99Å
862	S	32.4	Very low	33.1	Very low	139 Å²	139	141.1 Å²	141.1	97%	0.972	79%	0.786	S	S	*	*			trans	-78.7	116.4	-165.3	-51.9	0	0	0	0	113.8
863	G	27.8	Very low	33.2	Very low	60 Å²	60	139.1 Å²	139.1	62%	0.619	78%	0.777	S	S	*	*			trans	177.4	123.9	166.5	0	0	0	0	0	113.6	T861	T861-G863 PolarHBondContact O-N 2.99Å
864	N	27.9	Very low	33.6	Very low	165 Å²	165	136.5 Å²	136.5	88%	0.882	77%	0.765	S	S	*	*			trans	64.7	163.7	176.6	-50.1	-24.1	0	0	0	112.6
865	I	31.1	Very low	34.9	Very low	148 Å²	148	132.3 Å²	132.3	76%	0.759	75%	0.746	S	S	*	*			cis	-139.7	160	30.1	-70.9	166.3	0	0	0	111.3
866	Q	27.9	Very low	37	Very low	170 Å²	170	124.9 Å²	124.9	79%	0.794	71%	0.713	S	S	*	*			trans	-41.9	168.4	168.4	-55	140.7	-62.6	0	0	115.3
867	A	30.2	Very low	39.2	Very low	81 Å²	81	117.9 Å²	117.9	67%	0.669	68%	0.676	S	S	*	*			cis	-153.1	171.2	17.2	0	0	0	0	0	114.3
868	D	28.7	Very low	41.5	Very low	160 Å²	160	113 Å²	113	86%	0.856	65%	0.646	S	S	*	*			trans	56.4	104.4	149.6	-55	-15.7	0	0	0	122.8
869	G	30.9	Very low	43.7	Very low	80 Å²	80	110.4 Å²	110.4	83%	0.825	63%	0.627	S	S	*	*	S	Bend	trans	78.7	118.3	145.8	0	0	0	0	0	118
870	V	33.3	Very low	46.2	Very low	129 Å²	129	103.9 Å²	103.9	78%	0.782	60%	0.596	S	S	*	*			cis	-131.6	137.5	-5	175.3	0	0	0	0	106.5	L872	V870-L872 PolarHBondContact O-N 2.99Å
871	R	33.2	Very low	48.5	Very low	241 Å²	241	94.1 Å²	94.1	91%	0.909	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-58.4	132.2	-171.7	-68.9	-178.2	177.8	171.1	0.6	111.4	S873	R871-S873 PolarHBondContact O-N 3.36Å
872	L	35.9	Very low	50.9	Low	98 Å²	98	88.1 Å²	88.1	51%	0.513	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-52.7	128	153	-65.8	79	0	0	0	106.3	L841 V870 S874	L841-L872 HydrophobicContact CB-CD1 3.71Å; L841-L872 HydrophobicContact CB-CD2 3.92Å; L841-L872 HydrophobicContact CB-CG 3.54Å; L841-L872 HydrophobicContact CD1-CD1 4.28Å; L841-L872 HydrophobicContact CD1-CG 3.85Å; L841-L872 HydrophobicContact CG-CD1 4.44Å; L841-L872 HydrophobicContact CG-CG 4.29Å; V870-L872 PolarHBondContact O-N 2.99Å; L872-S874 PolarHBondContact O-N 3.28Å
873	S	46	Very low	53	Low	72 Å²	72	85.8 Å²	85.8	50%	0.503	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-60.8	120.1	169.7	73.4	0	0	0	0	107.3	R871 K903	R871-S873 PolarHBondContact O-N 3.36Å; S873-K903 PolarHBondContact OG-NZ 3.31Å; S873-K903 VanDerWaalsContact OG-NZ 3.16Å
874	S	52.3	Low	55.2	Low	78 Å²	78	84.6 Å²	84.6	55%	0.545	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-46.4	147.4	158.8	22.7	0	0	0	0	108.7	L872 T876	L872-S874 PolarHBondContact O-N 3.28Å; S874-T876 WeakPolarHBondContact O-CG2 3.21Å; S874-T876 PolarHBondContact O-N 2.86Å; S874-T876 PolarHBondContact O-OG1 3Å
875	C	62.7	Low	57.2	Low	47 Å²	47	81.2 Å²	81.2	32%	0.318	45%	0.454	S	S	.	.			trans	-74.4	75.6	-174.7	-165.3	0	0	0	0	110.7	C877 E885 C887	C875-C877 PolarHBondContact O-N 3.03Å; C875-C877 PolarHBondContact SG-SG 3.07Å; C875-E885 PolarHBondContact SG-O 2.59Å; C875-C887 WeakPolarHBondContact CB-SG 3.13Å; C875-C887 WeakPolarHBondContact SG-CB 3.38Å; C875-C887 PolarHBondContact SG-N 3.38Å; C875-C887 CovalentContact SG-SG 2.04Å; C875-C887 PolarHBondContact SG-SG 3.2Å
876	T	76.7	Confident	58.8	Low	20 Å²	20	81.5 Å²	81.5	12%	0.123	45%	0.452	C	S	.	.			trans	-82.5	40.2	-168.5	51.3	0	0	0	0	112.9	S874 N878 K903 D1588	S874-T876 WeakPolarHBondContact O-CG2 3.21Å; S874-T876 PolarHBondContact O-N 2.86Å; S874-T876 PolarHBondContact O-OG1 3Å; T876-N878 PolarHBondContact O-N 3.35Å; T876-K903 WeakPolarHBondContact OG1-CE 3.3Å; T876-D1588 WeakPolarHBondContact CB-OD2 3.29Å; T876-D1588 WeakPolarHBondContact CG2-OD1 3.39Å; T876-D1588 VanDerWaalsContact CG2-OD2 3.29Å; T876-D1588 WeakPolarHBondContact CG2-OD2 3.34Å; T876-D1588 PolarHBondContact OG1-OD2 2.99Å
877	C	82.4	Confident	61	Low	5 Å²	5	75.4 Å²	75.4	3%	0.034	43%	0.428	C	S	.	.			trans	-57.5	126.6	174.4	-60.6	0	0	0	0	111	C875 K879 A882 S884 C893	C875-C877 PolarHBondContact O-N 3.03Å; C875-C877 PolarHBondContact SG-SG 3.07Å; C877-K879 PolarHBondContact O-N 3.07Å; C877-K879 VanDerWaalsContact O-N 3.08Å; C877-A882 HydrophobicContact CB-CB 3.8Å; C877-S884 WeakPolarHBondContact CB-O 3.46Å; C877-C893 WeakPolarHBondContact CA-SG 3.28Å; C877-C893 HydrophobicContact CB-CB 3.74Å; C877-C893 WeakPolarHBondContact CB-SG 3.48Å; C877-C893 WeakPolarHBondContact SG-CB 3.04Å; C877-C893 CovalentContact SG-SG 2.03Å; C877-C893 PolarHBondContact SG-SG 2.69Å
878	N	83.6	Confident	62.6	Low	5 Å²	5	73.4 Å²	73.4	3%	0.027	41%	0.406	C	S	.	.			trans	-61.5	113.2	175.1	-178	-45.5	0	0	0	109.1	T876 L880 G881 A882 K903 C904 L1587	T876-N878 PolarHBondContact O-N 3.35Å; N878-L880 PolarHBondContact O-N 2.55Å; N878-L880 PolarHBondContact OD1-N 3.22Å; N878-L880 VanDerWaalsContact OD1-N 3.08Å; N878-G881 PolarHBondContact O-N 3.01Å; N878-G881 PolarHBondContact OD1-N 3.21Å; N878-G881 VanDerWaalsContact OD1-N 3.13Å; N878-A882 WeakPolarHBondContact O-CB 3.17Å; N878-A882 PolarHBondContact O-N 3.24Å; N878-K903 WeakPolarHBondContact CB-O 3.4Å; N878-K903 PolarHBondContact N-O 3.33Å; N878-C904 VanDerWaalsContact CB-O 3.29Å; N878-C904 WeakPolarHBondContact CB-O 3.36Å; N878-L1587 HydrophobicContact CB-CD1 3.77Å
879	K	81.2	Confident	64.1	Low	99 Å²	99	73.5 Å²	73.5	43%	0.43	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.2	-170.8	-56	179.6	-172.1	-60.2	0	114.2	C877 E885	C877-K879 PolarHBondContact O-N 3.07Å; C877-K879 VanDerWaalsContact O-N 3.08Å; K879-E885 WeakPolarHBondContact CD-OE1 3.3Å; K879-E885 HydrophobicContact CG-CG 4.44Å; K879-E885 IonicContact NZ-OE1 2.61Å; K879-E885 PolarHBondContact NZ-OE1 3.38Å; K879-E885 IonicContact NZ-OE2 3.87Å; K879-E885 PolarHBondContact NZ-OE2 2.98Å
880	L	81.7	Confident	65.8	Low	49 Å²	49	74.3 Å²	74.3	26%	0.257	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-31.6	176.5	-78	154.8	0	0	0	112.2	N878 K896 N917 E919	N878-L880 PolarHBondContact O-N 2.55Å; N878-L880 PolarHBondContact OD1-N 3.22Å; N878-L880 VanDerWaalsContact OD1-N 3.08Å; L880-K896 WeakPolarHBondContact O-CD 3.06Å; L880-K896 VanDerWaalsContact O-CE 3.28Å; L880-K896 WeakPolarHBondContact O-CE 3.38Å; L880-K896 PolarHBondContact O-NZ 3.46Å; L880-N917 HydrophobicContact CD1-CB 4.31Å; L880-N917 VanDerWaalsContact CD1-O 3.23Å; L880-N917 WeakPolarHBondContact CD1-O 3.46Å; L880-N917 WeakPolarHBondContact CD1-OD1 3.2Å; L880-E919 HydrophobicContact CD2-CG 4.46Å
881	G	79.3	Confident	67.4	Low	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.7	179.6	0	0	0	0	0	115.8	N878 C895 K896 C904	N878-G881 PolarHBondContact O-N 3.01Å; N878-G881 PolarHBondContact OD1-N 3.21Å; N878-G881 VanDerWaalsContact OD1-N 3.13Å; G881-C895 CarbonylContact O-C 3.29Å; G881-C895 WeakPolarHBondContact O-CA 3.1Å; G881-K896 WeakPolarHBondContact O-CG 3.39Å; G881-K896 PolarHBondContact O-N 2.77Å; G881-C904 VanDerWaalsContact C-CB 3.49Å; G881-C904 WeakPolarHBondContact CA-O 3.19Å
882	A	84.4	Confident	69.5	Low	5 Å²	5	59.3 Å²	59.3	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	155.7	177.2	0	0	0	0	0	112.1	C877 N878 S884 C893 R894 K896 C904	C877-A882 HydrophobicContact CB-CB 3.8Å; N878-A882 WeakPolarHBondContact O-CB 3.17Å; N878-A882 PolarHBondContact O-N 3.24Å; A882-S884 VanDerWaalsContact C-N 3.32Å; A882-S884 WeakPolarHBondContact CB-O 3.43Å; A882-C893 HydrophobicContact CB-CB 4.2Å; A882-R894 CarbonylContact C-O 3.48Å; A882-R894 WeakPolarHBondContact CA-O 3.26Å; A882-K896 VanDerWaalsContact O-CE 3.29Å; A882-K896 WeakPolarHBondContact O-CE 3.44Å; A882-C904 HydrophobicContact CB-CB 3.97Å
883	L	75.9	Confident	71.7	Confident	90 Å²	90	55.2 Å²	55.2	47%	0.471	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-14.7	171.4	-67.8	166.6	0	0	0	112.4	R894 C895 K896	L883-R894 HydrophobicContact CB-CB 4.41Å; L883-R894 WeakPolarHBondContact CB-O 3.48Å; L883-R894 HydrophobicContact CD1-CB 4.18Å; L883-R894 PolarHBondContact N-O 2.04Å; L883-C895 WeakPolarHBondContact CD1-O 3.34Å; L883-K896 HydrophobicContact CD2-CG 3.81Å; L883-K896 HydrophobicContact CG-CG 4.2Å
884	S	74.1	Confident	73.5	Confident	35 Å²	35	56.8 Å²	56.8	25%	0.245	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	152.3	-174.5	45.9	0	0	0	0	110.8	C877 A882 E886	C877-S884 WeakPolarHBondContact CB-O 3.46Å; A882-S884 VanDerWaalsContact C-N 3.32Å; A882-S884 WeakPolarHBondContact CB-O 3.43Å; S884-E886 PolarHBondContact O-N 3.35Å; S884-E886 PolarHBondContact OG-O 2.95Å
885	E	69	Low	75.1	Confident	94 Å²	94	55.2 Å²	55.2	44%	0.439	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	1.2	162.5	-59.6	-166.1	-175.6	0	0	111.7	C875 K879	C875-E885 PolarHBondContact SG-O 2.59Å; K879-E885 WeakPolarHBondContact CD-OE1 3.3Å; K879-E885 HydrophobicContact CG-CG 4.44Å; K879-E885 IonicContact NZ-OE1 2.61Å; K879-E885 PolarHBondContact NZ-OE1 3.38Å; K879-E885 IonicContact NZ-OE2 3.87Å; K879-E885 PolarHBondContact NZ-OE2 2.98Å
886	E	64.5	Low	76.2	Confident	154 Å²	154	55.8 Å²	55.8	72%	0.72	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	136	172.2	-64.2	163.4	-167.6	0	0	110	S884	S884-E886 PolarHBondContact O-N 3.35Å; S884-E886 PolarHBondContact OG-O 2.95Å
887	C	74.6	Confident	76.5	Confident	41 Å²	41	65 Å²	65	28%	0.277	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	166.8	177.1	35.2	0	0	0	0	109.6	C875 N892	C875-C887 WeakPolarHBondContact CB-SG 3.13Å; C875-C887 WeakPolarHBondContact SG-CB 3.38Å; C875-C887 PolarHBondContact SG-N 3.38Å; C875-C887 CovalentContact SG-SG 2.04Å; C875-C887 PolarHBondContact SG-SG 3.2Å; C887-N892 CarbonylContact C-O 3.55Å; C887-N892 WeakPolarHBondContact CA-O 3.48Å; C887-N892 WeakPolarHBondContact CB-O 3.45Å
888	D	64.2	Low	76.6	Confident	40 Å²	40	64.8 Å²	64.8	21%	0.214	31%	0.308	C	S	.	.			trans	-67.6	175.4	167.5	72.8	10	0	0	0	111.7	L890 G891 N892	D888-L890 PolarHBondContact O-N 2.03Å; D888-L890 WeakPolarHBondContact OD1-CA 3.41Å; D888-L890 VanDerWaalsContact OD1-CB 3.31Å; D888-L890 WeakPolarHBondContact OD1-CB 3.07Å; D888-L890 PolarHBondContact OD1-N 2.78Å; D888-G891 PolarHBondContact O-N 3.45Å; D888-G891 PolarHBondContact OD1-N 2.75Å; D888-N892 PolarHBondContact N-O 3.26Å; D888-N892 WeakPolarHBondContact OD1-CB 3.23Å; D888-N892 PolarHBondContact OD1-N 2.85Å; D888-N892 PolarHBondContact OD2-ND2 2.8Å
889	Y	60.9	Low	76.8	Confident	162 Å²	162	65 Å²	65	64%	0.635	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-2.4	179.9	65.5	-85.5	0	0	0	114.3
890	L	65.4	Low	76.8	Confident	97 Å²	97	60.9 Å²	60.9	51%	0.508	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-2.9	172.5	-56.9	170.3	0	0	0	111.5	D888 N892	D888-L890 PolarHBondContact O-N 2.03Å; D888-L890 WeakPolarHBondContact OD1-CA 3.41Å; D888-L890 VanDerWaalsContact OD1-CB 3.31Å; D888-L890 WeakPolarHBondContact OD1-CB 3.07Å; D888-L890 PolarHBondContact OD1-N 2.78Å; L890-N892 WeakPolarHBondContact CB-ND2 3.2Å
891	G	67.8	Low	76.8	Confident	12 Å²	12	59.9 Å²	59.9	12%	0.124	30%	0.296	C	S	.	.	S	Bend	trans	82.6	10.7	-175	0	0	0	0	0	114.2	D888 K903	D888-G891 PolarHBondContact O-N 3.45Å; D888-G891 PolarHBondContact OD1-N 2.75Å; G891-K903 PolarHBondContact O-NZ 3.47Å
892	N	76.2	Confident	76.9	Confident	43 Å²	43	65.8 Å²	65.8	23%	0.23	33%	0.327	C	S	.	.			trans	-85.5	136.5	177.8	-53.3	-50.1	0	0	0	111.2	C887 D888 L890 L902	C887-N892 CarbonylContact C-O 3.55Å; C887-N892 WeakPolarHBondContact CA-O 3.48Å; C887-N892 WeakPolarHBondContact CB-O 3.45Å; D888-N892 PolarHBondContact N-O 3.26Å; D888-N892 WeakPolarHBondContact OD1-CB 3.23Å; D888-N892 PolarHBondContact OD1-N 2.85Å; D888-N892 PolarHBondContact OD2-ND2 2.8Å; L890-N892 WeakPolarHBondContact CB-ND2 3.2Å; N892-L902 WeakPolarHBondContact CA-O 3.4Å
893	C	83.1	Confident	76.9	Confident	12 Å²	12	67.3 Å²	67.3	8%	0.081	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	149.1	-179.8	-58.4	0	0	0	0	111.2	C877 A882 L902 C904	C877-C893 WeakPolarHBondContact CA-SG 3.28Å; C877-C893 HydrophobicContact CB-CB 3.74Å; C877-C893 WeakPolarHBondContact CB-SG 3.48Å; C877-C893 WeakPolarHBondContact SG-CB 3.04Å; C877-C893 CovalentContact SG-SG 2.03Å; C877-C893 PolarHBondContact SG-SG 2.69Å; A882-C893 HydrophobicContact CB-CB 4.2Å; C893-L902 PolarHBondContact N-O 2.8Å; C893-C904 HydrophobicContact CB-CB 4.36Å; C893-C904 WeakPolarHBondContact CB-SG 3.39Å; C893-C904 PolarHBondContact O-SG 3.38Å
894	R	82.7	Confident	77.6	Confident	105 Å²	105	63 Å²	63	40%	0.396	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.5	177.1	-60.9	-176.2	73.5	-177.7	10	109.6	Q712 A882 L883	Q712-R894 PolarHBondContact O-NH2 3.13Å; A882-R894 CarbonylContact C-O 3.48Å; A882-R894 WeakPolarHBondContact CA-O 3.26Å; L883-R894 HydrophobicContact CB-CB 4.41Å; L883-R894 WeakPolarHBondContact CB-O 3.48Å; L883-R894 HydrophobicContact CD1-CB 4.18Å; L883-R894 PolarHBondContact N-O 2.04Å
895	C	87.4	Confident	78.1	Confident	44 Å²	44	62.4 Å²	62.4	30%	0.297	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	153.1	-168.9	-49.8	0	0	0	0	114.2	G881 L883 V899 C904	G881-C895 CarbonylContact O-C 3.29Å; G881-C895 WeakPolarHBondContact O-CA 3.1Å; L883-C895 WeakPolarHBondContact CD1-O 3.34Å; C895-V899 HydrophobicContact CB-CB 3.98Å; C895-V899 HydrophobicContact CB-CG1 3.9Å; C895-C904 WeakPolarHBondContact CA-SG 3.31Å; C895-C904 HydrophobicContact CB-CB 3.77Å; C895-C904 WeakPolarHBondContact CB-SG 3.36Å; C895-C904 PolarHBondContact N-SG 3.35Å; C895-C904 WeakPolarHBondContact SG-CA 3.13Å; C895-C904 WeakPolarHBondContact SG-CB 3.03Å; C895-C904 CovalentContact SG-SG 2.04Å; C895-C904 PolarHBondContact SG-SG 2.87Å
896	K	84.9	Confident	78.9	Confident	60 Å²	60	62.5 Å²	62.5	26%	0.261	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-74.4	171.6	169.6	-67.1	-178.7	-170.7	166.8	0	111.1	L880 G881 A882 L883 V899 E919	L880-K896 WeakPolarHBondContact O-CD 3.06Å; L880-K896 VanDerWaalsContact O-CE 3.28Å; L880-K896 WeakPolarHBondContact O-CE 3.38Å; L880-K896 PolarHBondContact O-NZ 3.46Å; G881-K896 WeakPolarHBondContact O-CG 3.39Å; G881-K896 PolarHBondContact O-N 2.77Å; A882-K896 VanDerWaalsContact O-CE 3.29Å; A882-K896 WeakPolarHBondContact O-CE 3.44Å; L883-K896 HydrophobicContact CD2-CG 3.81Å; L883-K896 HydrophobicContact CG-CG 4.2Å; K896-V899 HydrophobicContact CB-CG2 3.94Å; K896-V899 WeakPolarHBondContact O-CB 3.32Å; K896-V899 PolarHBondContact O-N 2.95Å; K896-E919 IonicContact NZ-OE1 3.16Å; K896-E919 PolarHBondContact NZ-OE1 3.27Å
897	W	84.1	Confident	80.1	Confident	212 Å²	212	55.4 Å²	55.4	80%	0.803	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	140.6	173.2	-167	59.9	0	0	0	111.3	V899 Y911	W897-V899 VanDerWaalsContact C-N 3.29Å; W897-V899 PolarHBondContact O-N 3.48Å; W897-Y911 WeakPolarHBondContact CH2-OH 3.27Å; W897-Y911 WeakPolarHBondContact CZ2-OH 3.44Å; W897-Y911 HydrophobicContact CZ3-CE1 4.47Å
898	G	83.9	Confident	80.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.01	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	-0.4	-173.8	0	0	0	0	0	115.6	L908 C920	G898-L908 PolarHBondContact O-N 3.1Å; G898-C920 WeakPolarHBondContact O-CB 3.45Å; G898-C920 PolarHBondContact O-SG 2.96Å
899	V	87.2	Confident	81.5	Confident	10 Å²	10	58.8 Å²	58.8	6%	0.061	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.8	-171	-176.6	0	0	0	0	112.9	C895 K896 W897 C904 Q906 I914 C920	C895-V899 HydrophobicContact CB-CB 3.98Å; C895-V899 HydrophobicContact CB-CG1 3.9Å; K896-V899 HydrophobicContact CB-CG2 3.94Å; K896-V899 WeakPolarHBondContact O-CB 3.32Å; K896-V899 PolarHBondContact O-N 2.95Å; W897-V899 VanDerWaalsContact C-N 3.29Å; W897-V899 PolarHBondContact O-N 3.48Å; V899-C904 HydrophobicContact CG1-CB 3.71Å; V899-C904 WeakPolarHBondContact CG1-O 3.15Å; V899-Q906 WeakPolarHBondContact CG1-O 3.41Å; V899-I914 HydrophobicContact CB-CD1 4.04Å; V899-I914 HydrophobicContact CG1-CD1 3.45Å; V899-I914 VanDerWaalsContact CG1-CD1 3.45Å; V899-I914 HydrophobicContact CG2-CD1 3.5Å; V899-C920 HydrophobicContact CG2-CB 4.04Å
900	G	80.7	Confident	82.6	Confident	12 Å²	12	54.1 Å²	54.1	12%	0.124	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	-170.3	173.3	0	0	0	0	0	113.3	C904 D905 Q906	G900-C904 CarbonylContact O-C 3.19Å; G900-C904 VanDerWaalsContact O-C 3.23Å; G900-C904 VanDerWaalsContact O-CA 3.26Å; G900-C904 WeakPolarHBondContact O-CA 3.4Å; G900-D905 PolarHBondContact O-N 2.88Å; G900-D905 VanDerWaalsContact O-N 3.12Å; G900-Q906 PolarHBondContact N-O 3.32Å; G900-Q906 PolarHBondContact O-N 2.98Å; G900-Q906 VanDerWaalsContact O-O 3.12Å
901	G	82.8	Confident	83.7	Confident	28 Å²	28	51.3 Å²	51.3	29%	0.289	27%	0.266	S	S	.	.	S	Bend	trans	87.5	151.2	-172.1	0	0	0	0	0	112.7	K903 C904 D905	G901-K903 PolarHBondContact O-N 2.82Å; G901-C904 PolarHBondContact O-N 2.94Å; G901-D905 WeakPolarHBondContact CA-OD1 3.34Å
902	L	81.3	Confident	84.7	Confident	124 Å²	124	52.6 Å²	52.6	65%	0.649	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-24.2	-176.3	-60.1	-178.3	0	0	0	112.6	N892 C893 D905	N892-L902 WeakPolarHBondContact CA-O 3.4Å; C893-L902 PolarHBondContact N-O 2.8Å; L902-D905 PolarHBondContact N-OD1 2.79Å
903	K	84	Confident	85	Confident	38 Å²	38	50.5 Å²	50.5	17%	0.165	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	12	173.2	-57.8	-59.2	-175.2	-178	0	112.3	S873 T876 N878 G891 G901 D905	S873-K903 PolarHBondContact OG-NZ 3.31Å; S873-K903 VanDerWaalsContact OG-NZ 3.16Å; T876-K903 WeakPolarHBondContact OG1-CE 3.3Å; N878-K903 WeakPolarHBondContact CB-O 3.4Å; N878-K903 PolarHBondContact N-O 3.33Å; G891-K903 PolarHBondContact O-NZ 3.47Å; G901-K903 PolarHBondContact O-N 2.82Å; K903-D905 WeakPolarHBondContact CA-OD1 3.41Å; K903-D905 HydrophobicContact CB-CB 4.16Å; K903-D905 WeakPolarHBondContact CB-OD1 3.28Å; K903-D905 PolarHBondContact N-OD1 3.21Å; K903-D905 PolarHBondContact O-N 3.42Å
904	C	89.8	Confident	84.8	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	57	35.9	-171.4	-53.2	0	0	0	0	112.9	N878 G881 A882 C893 C895 V899 G900 G901	N878-C904 VanDerWaalsContact CB-O 3.29Å; N878-C904 WeakPolarHBondContact CB-O 3.36Å; G881-C904 VanDerWaalsContact C-CB 3.49Å; G881-C904 WeakPolarHBondContact CA-O 3.19Å; A882-C904 HydrophobicContact CB-CB 3.97Å; C893-C904 HydrophobicContact CB-CB 4.36Å; C893-C904 WeakPolarHBondContact CB-SG 3.39Å; C893-C904 PolarHBondContact O-SG 3.38Å; C895-C904 WeakPolarHBondContact CA-SG 3.31Å; C895-C904 HydrophobicContact CB-CB 3.77Å; C895-C904 WeakPolarHBondContact CB-SG 3.36Å; C895-C904 PolarHBondContact N-SG 3.35Å; C895-C904 WeakPolarHBondContact SG-CA 3.13Å; C895-C904 WeakPolarHBondContact SG-CB 3.03Å; C895-C904 CovalentContact SG-SG 2.04Å; C895-C904 PolarHBondContact SG-SG 2.87Å; V899-C904 HydrophobicContact CG1-CB 3.71Å; V899-C904 WeakPolarHBondContact CG1-O 3.15Å; G900-C904 CarbonylContact O-C 3.19Å; G900-C904 VanDerWaalsContact O-C 3.23Å; G900-C904 VanDerWaalsContact O-CA 3.26Å; G900-C904 WeakPolarHBondContact O-CA 3.4Å; G901-C904 PolarHBondContact O-N 2.94Å
905	D	85.2	Confident	84.3	Confident	21 Å²	21	47.5 Å²	47.5	11%	0.112	25%	0.246	C	C	.	.			trans	-93.1	-7	-165.9	51.2	-71	0	0	0	114.3	G900 G901 L902 K903 I914	G900-D905 PolarHBondContact O-N 2.88Å; G900-D905 VanDerWaalsContact O-N 3.12Å; G901-D905 WeakPolarHBondContact CA-OD1 3.34Å; L902-D905 PolarHBondContact N-OD1 2.79Å; K903-D905 WeakPolarHBondContact CA-OD1 3.41Å; K903-D905 HydrophobicContact CB-CB 4.16Å; K903-D905 WeakPolarHBondContact CB-OD1 3.28Å; K903-D905 PolarHBondContact N-OD1 3.21Å; K903-D905 PolarHBondContact O-N 3.42Å; D905-I914 WeakPolarHBondContact O-CG2 3.43Å
906	Q	87	Confident	83.3	Confident	96 Å²	96	46.5 Å²	46.5	45%	0.449	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	157.7	-174.3	-67.3	160.5	40.9	0	0	110.9	V899 G900	V899-Q906 WeakPolarHBondContact CG1-O 3.41Å; G900-Q906 PolarHBondContact N-O 3.32Å; G900-Q906 PolarHBondContact O-N 2.98Å; G900-Q906 VanDerWaalsContact O-O 3.12Å
907	C	88.8	Confident	82.5	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.034	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	152.6	164.4	-75.5	0	0	0	0	110.9	Y911 W912 C920 Q937	C907-Y911 VanDerWaalsContact CB-O 3.28Å; C907-Y911 WeakPolarHBondContact CB-O 3.1Å; C907-W912 VanDerWaalsContact SG-CA 3.52Å; C907-C920 WeakPolarHBondContact CA-SG 3.09Å; C907-C920 HydrophobicContact CB-CB 4.19Å; C907-C920 WeakPolarHBondContact CB-SG 3.22Å; C907-C920 WeakPolarHBondContact SG-CB 3.21Å; C907-C920 CovalentContact SG-SG 2.05Å; C907-C920 PolarHBondContact SG-SG 2.77Å; C907-Q937 HydrophobicContact CB-CB 4.46Å; C907-Q937 HydrophobicContact CB-CG 4.3Å; C907-Q937 VanDerWaalsContact O-CD 3.29Å; C907-Q937 PolarHBondContact O-NE2 2.95Å; C907-Q937 PolarHBondContact O-OE1 3.4Å
908	L	86.3	Confident	82.1	Confident	82 Å²	82	43 Å²	43	43%	0.429	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-67.4	159.1	163.9	-61.7	176.3	0	0	0	109.6	G898 N910 Y911	G898-L908 PolarHBondContact O-N 3.1Å; L908-N910 PolarHBondContact O-N 3Å; L908-Y911 HydrophobicContact CB-CD2 4.28Å; L908-Y911 WeakPolarHBondContact O-CB 3.19Å; L908-Y911 PolarHBondContact O-N 3.33Å
909	A	81.6	Confident	81.7	Confident	71 Å²	71	48 Å²	48	59%	0.587	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	143.4	171.9	0	0	0	0	0	110.6	Y911	A909-Y911 VanDerWaalsContact C-N 3.28Å; A909-Y911 PolarHBondContact O-N 3.09Å
910	N	84.4	Confident	81.6	Confident	64 Å²	64	48.1 Å²	48.1	34%	0.342	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	14.6	-171.3	-46.8	-21	0	0	0	115.1	L908 P922 C923 T933 T934	L908-N910 PolarHBondContact O-N 3Å; N910-P922 CarbonylContact O-C 3.54Å; N910-P922 WeakPolarHBondContact O-CA 3.25Å; N910-C923 VanDerWaalsContact CA-SG 3.55Å; N910-C923 PolarHBondContact O-N 3.44Å; N910-C923 PolarHBondContact O-SG 3.01Å; N910-C923 VanDerWaalsContact O-SG 3.39Å; N910-T933 PolarHBondContact ND2-OG1 3.47Å; N910-T933 PolarHBondContact OD1-O 3.05Å; N910-T933 VanDerWaalsContact OD1-O 3.04Å; N910-T933 PolarHBondContact OD1-OG1 2.7Å; N910-T934 PolarHBondContact OD1-N 2.75Å
911	Y	88	Confident	81.7	Confident	37 Å²	37	51.1 Å²	51.1	15%	0.145	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.1	170.1	-66	-106.9	0	0	0	112.5	W897 C907 L908 A909 C920 I921 P922	W897-Y911 WeakPolarHBondContact CH2-OH 3.27Å; W897-Y911 WeakPolarHBondContact CZ2-OH 3.44Å; W897-Y911 HydrophobicContact CZ3-CE1 4.47Å; C907-Y911 VanDerWaalsContact CB-O 3.28Å; C907-Y911 WeakPolarHBondContact CB-O 3.1Å; L908-Y911 HydrophobicContact CB-CD2 4.28Å; L908-Y911 WeakPolarHBondContact O-CB 3.19Å; L908-Y911 PolarHBondContact O-N 3.33Å; A909-Y911 VanDerWaalsContact C-N 3.28Å; A909-Y911 PolarHBondContact O-N 3.09Å; Y911-C920 HydrophobicContact CD1-CB 4.16Å; Y911-C920 HydrophobicContact CG-CB 4.43Å; Y911-I921 CarbonylContact C-O 3.51Å; Y911-I921 VanDerWaalsContact CA-O 3.26Å; Y911-I921 WeakPolarHBondContact CA-O 3.01Å; Y911-P922 HydrophobicContact CD1-CG 4.1Å; Y911-P922 HydrophobicContact CE1-CB 4.49Å; Y911-P922 HydrophobicContact CE1-CG 3.73Å
912	W	89.1	Confident	81.7	Confident	39 Å²	39	52.2 Å²	52.2	15%	0.148	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	171.4	178.5	68.8	-75.1	0	0	0	112.2	C907 C920 I921 P922 N936 Q937 A938	C907-W912 VanDerWaalsContact SG-CA 3.52Å; W912-C920 CarbonylContact O-C 3.53Å; W912-C920 WeakPolarHBondContact O-CA 3.39Å; W912-I921 PolarHBondContact N-O 3.38Å; W912-I921 PolarHBondContact O-N 3.33Å; W912-P922 PolarHBondContact NE1-O 2.92Å; W912-N936 WeakPolarHBondContact CB-O 2.99Å; W912-Q937 CarbonylContact C-O 3.4Å; W912-Q937 WeakPolarHBondContact CA-O 3.21Å; W912-A938 VanDerWaalsContact CE3-O 3.26Å
913	G	82.3	Confident	82	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.			trans	103.7	-13.2	171.7	0	0	0	0	0	114.8	Q915 N916 H918 Q937 K1584	G913-Q915 PolarHBondContact O-N 3.16Å; G913-Q915 VanDerWaalsContact O-N 3.14Å; G913-N916 PolarHBondContact O-N 3.45Å; G913-H918 CarbonylContact O-C 2.76Å; G913-H918 PolarHBondContact O-N 3.3Å; G913-Q937 PolarHBondContact N-O 3.35Å; G913-K1584 PolarHBondContact O-NZ 3.08Å
914	I	80.4	Confident	82.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-10.8	169.4	-102	-176.5	0	0	0	113.5	V899 D905 C920 K1584	V899-I914 HydrophobicContact CB-CD1 4.04Å; V899-I914 HydrophobicContact CG1-CD1 3.45Å; V899-I914 VanDerWaalsContact CG1-CD1 3.45Å; V899-I914 HydrophobicContact CG2-CD1 3.5Å; D905-I914 WeakPolarHBondContact O-CG2 3.43Å; I914-C920 VanDerWaalsContact CB-SG 3.56Å; I914-C920 WeakPolarHBondContact CD1-SG 3.17Å; I914-C920 WeakPolarHBondContact CG1-SG 3.4Å; I914-K1584 WeakPolarHBondContact O-CD 3.41Å; I914-K1584 WeakPolarHBondContact O-CE 3.34Å; I914-K1584 WeakPolarHBondContact O-CG 3.47Å; I914-K1584 PolarHBondContact O-NZ 3.35Å
915	Q	71.6	Confident	81.9	Confident	54 Å²	54	49 Å²	49	25%	0.252	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.3	168.9	-44	-162.6	-89.8	0	0	112.5	G913 A938 H1581 K1584	G913-Q915 PolarHBondContact O-N 3.16Å; G913-Q915 VanDerWaalsContact O-N 3.14Å; Q915-A938 HydrophobicContact CB-CB 3.81Å; Q915-A938 HydrophobicContact CG-CB 4.28Å; Q915-H1581 VanDerWaalsContact O-CA 3.32Å; Q915-H1581 WeakPolarHBondContact O-CA 3.35Å; Q915-K1584 WeakPolarHBondContact O-CB 3.35Å
916	N	65.6	Low	81.9	Confident	22 Å²	22	50.8 Å²	50.8	12%	0.118	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	31	-167.5	-49.6	21.2	0	0	0	113.7	G913 H918 A938 H1581	G913-N916 PolarHBondContact O-N 3.45Å; N916-H918 PolarHBondContact O-CD2 3.01Å; N916-H918 PolarHBondContact O-N 3.49Å; N916-A938 PolarHBondContact ND2-O 3.1Å; N916-A938 WeakPolarHBondContact OD1-CA 3.4Å; N916-A938 PolarHBondContact OD1-O 3.34Å; N916-H1581 VanDerWaalsContact CG-CD2 3.48Å; N916-H1581 PolarHBondContact ND2-NE2 3.35Å; N916-H1581 PolarHBondContact OD1-CD2 3.26Å; N916-H1581 VanDerWaalsContact OD1-CD2 3.25Å; N916-H1581 PolarHBondContact OD1-NE2 3.33Å
917	N	69.2	Low	81.5	Confident	90 Å²	90	51.1 Å²	51.1	48%	0.481	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	9.1	-167.3	-98.5	-4	0	0	0	118.2	L880 M1580 K1584	L880-N917 HydrophobicContact CD1-CB 4.31Å; L880-N917 VanDerWaalsContact CD1-O 3.23Å; L880-N917 WeakPolarHBondContact CD1-O 3.46Å; L880-N917 WeakPolarHBondContact CD1-OD1 3.2Å; N917-M1580 HydrophobicContact CB-CE 3.94Å; N917-M1580 HydrophobicContact CB-SD 4.11Å; N917-M1580 PolarHBondContact ND2-SD 2.83Å; N917-M1580 VanDerWaalsContact ND2-SD 3.37Å; N917-K1584 VanDerWaalsContact CA-CE 3.46Å; N917-K1584 VanDerWaalsContact CA-NZ 3.26Å; N917-K1584 HydrophobicContact CB-CD 4.48Å; N917-K1584 WeakPolarHBondContact OD1-CD 3.5Å; N917-K1584 VanDerWaalsContact OD1-CE 3.31Å; N917-K1584 WeakPolarHBondContact OD1-CE 3.34Å
918	H	74.6	Confident	81.2	Confident	108 Å²	108	54.4 Å²	54.4	50%	0.5	30%	0.299	S	S	.	.	S	Bend	trans	-90.3	174	166.5	-64.2	-72.5	0	0	0	112.8	G913 N916 I921 K1584	G913-H918 CarbonylContact O-C 2.76Å; G913-H918 PolarHBondContact O-N 3.3Å; N916-H918 PolarHBondContact O-CD2 3.01Å; N916-H918 PolarHBondContact O-N 3.49Å; H918-I921 HydrophobicContact CB-CD1 4.46Å; H918-K1584 PolarHBondContact O-NZ 2.64Å
919	E	75.3	Confident	80.9	Confident	106 Å²	106	50.5 Å²	50.5	50%	0.495	28%	0.279	S	S	.	.			trans	-78.2	173.4	161.5	-55.9	-169.8	138.6	0	0	109.8	L880 K896 I921	L880-E919 HydrophobicContact CD2-CG 4.46Å; K896-E919 IonicContact NZ-OE1 3.16Å; K896-E919 PolarHBondContact NZ-OE1 3.27Å; E919-I921 PolarHBondContact O-N 3.41Å
920	C	85.2	Confident	81.1	Confident	13 Å²	13	47.2 Å²	47.2	9%	0.088	25%	0.251	C	S	.	.			trans	-75.7	112.7	176.9	-76.3	0	0	0	0	111.7	G898 V899 C907 Y911 W912 I914	G898-C920 WeakPolarHBondContact O-CB 3.45Å; G898-C920 PolarHBondContact O-SG 2.96Å; V899-C920 HydrophobicContact CG2-CB 4.04Å; C907-C920 WeakPolarHBondContact CA-SG 3.09Å; C907-C920 HydrophobicContact CB-CB 4.19Å; C907-C920 WeakPolarHBondContact CB-SG 3.22Å; C907-C920 WeakPolarHBondContact SG-CB 3.21Å; C907-C920 CovalentContact SG-SG 2.05Å; C907-C920 PolarHBondContact SG-SG 2.77Å; Y911-C920 HydrophobicContact CD1-CB 4.16Å; Y911-C920 HydrophobicContact CG-CB 4.43Å; W912-C920 CarbonylContact O-C 3.53Å; W912-C920 WeakPolarHBondContact O-CA 3.39Å; I914-C920 VanDerWaalsContact CB-SG 3.56Å; I914-C920 WeakPolarHBondContact CD1-SG 3.17Å; I914-C920 WeakPolarHBondContact CG1-SG 3.4Å
921	I	82.6	Confident	81	Confident	76 Å²	76	48.2 Å²	48.2	39%	0.39	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.7	178.2	-59.3	169.5	0	0	0	108.3	Y911 W912 H918 E919	Y911-I921 CarbonylContact C-O 3.51Å; Y911-I921 VanDerWaalsContact CA-O 3.26Å; Y911-I921 WeakPolarHBondContact CA-O 3.01Å; W912-I921 PolarHBondContact N-O 3.38Å; W912-I921 PolarHBondContact O-N 3.33Å; H918-I921 HydrophobicContact CB-CD1 4.46Å; E919-I921 PolarHBondContact O-N 3.41Å
922	P	83.4	Confident	80.7	Confident	51 Å²	51	49 Å²	49	33%	0.331	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	142.9	174.5	-26.7	34.8	0	0	0	113.3	N910 Y911 W912	N910-P922 CarbonylContact O-C 3.54Å; N910-P922 WeakPolarHBondContact O-CA 3.25Å; Y911-P922 HydrophobicContact CD1-CG 4.1Å; Y911-P922 HydrophobicContact CE1-CB 4.49Å; Y911-P922 HydrophobicContact CE1-CG 3.73Å; W912-P922 PolarHBondContact NE1-O 2.92Å
923	C	86.9	Confident	80.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.284	C	S	.	.			trans	-60.3	-46.8	172.8	-65.9	0	0	0	0	111.2	N910 C935 R951	N910-C923 VanDerWaalsContact CA-SG 3.55Å; N910-C923 PolarHBondContact O-N 3.44Å; N910-C923 PolarHBondContact O-SG 3.01Å; N910-C923 VanDerWaalsContact O-SG 3.39Å; C923-C935 VanDerWaalsContact CA-SG 3.56Å; C923-C935 HydrophobicContact CB-CB 3.62Å; C923-C935 WeakPolarHBondContact CB-SG 3.48Å; C923-C935 WeakPolarHBondContact SG-CB 3.08Å; C923-C935 PolarHBondContact SG-N 2.94Å; C923-C935 CovalentContact SG-SG 2.02Å; C923-C935 PolarHBondContact SG-SG 2.8Å; C923-R951 PolarHBondContact O-NH1 3.47Å; C923-R951 PolarHBondContact O-NH2 3.1Å
924	S	86.6	Confident	80.4	Confident	74 Å²	74	53.7 Å²	53.7	52%	0.517	30%	0.3	S	S	.	.			trans	51.5	50.2	-174.4	-58.7	0	0	0	0	112.7	Q952	S924-Q952 WeakPolarHBondContact O-CB 3.4Å; S924-Q952 VanDerWaalsContact O-CG 3.24Å; S924-Q952 WeakPolarHBondContact O-CG 3.49Å; S924-Q952 PolarHBondContact O-NE2 3.26Å; S924-Q952 VanDerWaalsContact O-NE2 3.17Å
925	C	87	Confident	80.8	Confident	19 Å²	19	54.3 Å²	54.3	13%	0.128	30%	0.304	C	S	.	.			trans	-66.2	140.1	175.2	-52	0	0	0	0	111.3	T933 T934 C942	C925-T933 PolarHBondContact SG-O 2.84Å; C925-T934 PolarHBondContact SG-O 2.81Å; C925-C942 WeakPolarHBondContact CA-SG 3.18Å; C925-C942 HydrophobicContact CB-CB 3.68Å; C925-C942 WeakPolarHBondContact CB-SG 3.27Å; C925-C942 WeakPolarHBondContact SG-CB 3.33Å; C925-C942 CovalentContact SG-SG 2.03Å; C925-C942 PolarHBondContact SG-SG 3.25Å
926	H	83.6	Confident	81.4	Confident	60 Å²	60	55.6 Å²	55.6	28%	0.278	31%	0.313	S	S	.	.			trans	-70.5	124.1	178.8	-171.6	-109.5	0	0	0	110.1	L928 G929 S930 Q952 C953 V962	H926-L928 VanDerWaalsContact C-N 3.3Å; H926-L928 PolarHBondContact O-N 2.03Å; H926-G929 PolarHBondContact ND1-N 2.71Å; H926-G929 PolarHBondContact O-N 3.36Å; H926-G929 VanDerWaalsContact O-N 3.09Å; H926-S930 WeakPolarHBondContact O-CB 3.4Å; H926-S930 PolarHBondContact O-N 2.83Å; H926-Q952 VanDerWaalsContact CB-O 3.3Å; H926-Q952 WeakPolarHBondContact CB-O 3.48Å; H926-Q952 PolarHBondContact N-O 3.1Å; H926-C953 VanDerWaalsContact CB-O 3.27Å; H926-C953 WeakPolarHBondContact CB-O 3.44Å; H926-V962 WeakPolarHBondContact ND1-CG1 3.47Å
927	P	79.2	Confident	82.2	Confident	103 Å²	103	57.4 Å²	57.4	67%	0.669	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-30.2	-166.5	23.7	-34.2	0	0	0	114
928	L	81.8	Confident	82.5	Confident	73 Å²	73	53.8 Å²	53.8	38%	0.382	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-29.2	175.9	-59.1	176.6	0	0	0	112.7	H926 R945 V962 T963 E964	H926-L928 VanDerWaalsContact C-N 3.3Å; H926-L928 PolarHBondContact O-N 2.03Å; L928-R945 VanDerWaalsContact O-CD 3.32Å; L928-R945 WeakPolarHBondContact O-CD 3.36Å; L928-R945 PolarHBondContact O-NE 2.03Å; L928-V962 HydrophobicContact CB-CG1 4.36Å; L928-V962 WeakPolarHBondContact CD1-O 3.45Å; L928-T963 VanDerWaalsContact O-O 3.1Å; L928-E964 HydrophobicContact CD2-CG 3.76Å
929	G	80.9	Confident	82.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-19.8	-169	0	0	0	0	0	115.3	H926 R945 C953	H926-G929 PolarHBondContact ND1-N 2.71Å; H926-G929 PolarHBondContact O-N 3.36Å; H926-G929 VanDerWaalsContact O-N 3.09Å; G929-R945 PolarHBondContact O-N 2.85Å; G929-C953 WeakPolarHBondContact CA-O 3.5Å; G929-C953 VanDerWaalsContact O-CB 3.31Å; G929-C953 WeakPolarHBondContact O-CB 3.25Å
930	S	86.1	Confident	83.3	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.014	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	157.6	171.7	-164.2	0	0	0	0	110.8	H926 D932 N943 R945	H926-S930 WeakPolarHBondContact O-CB 3.4Å; H926-S930 PolarHBondContact O-N 2.83Å; S930-D932 VanDerWaalsContact C-N 3.31Å; S930-D932 WeakPolarHBondContact CB-O 3.47Å; S930-D932 PolarHBondContact OG-O 3.15Å; S930-N943 CarbonylContact C-O 3.23Å; S930-N943 VanDerWaalsContact CA-O 3.3Å; S930-N943 WeakPolarHBondContact CA-O 3.24Å; S930-N943 PolarHBondContact OG-O 3.1Å; S930-R945 PolarHBondContact O-NE 3.39Å; S930-R945 PolarHBondContact O-NH2 3.15Å
931	T	82.1	Confident	83.6	Confident	85 Å²	85	50 Å²	50	52%	0.521	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-25.4	168.4	52.6	0	0	0	0	112.1	N943 R945	T931-N943 PolarHBondContact N-O 2.89Å; T931-N943 WeakPolarHBondContact OG1-CB 3.28Å; T931-N943 PolarHBondContact OG1-O 3.01Å; T931-R945 HydrophobicContact CG2-CG 4.12Å
932	D	81.9	Confident	83.9	Confident	55 Å²	55	46.5 Å²	46.5	29%	0.294	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	173.5	-175.4	61	89.8	0	0	0	111.4	S930 T934 N943	S930-D932 VanDerWaalsContact C-N 3.31Å; S930-D932 WeakPolarHBondContact CB-O 3.47Å; S930-D932 PolarHBondContact OG-O 3.15Å; D932-T934 VanDerWaalsContact C-N 3.34Å; D932-T934 WeakPolarHBondContact OD1-CA 3.39Å; D932-T934 VanDerWaalsContact OD1-CB 3.22Å; D932-T934 WeakPolarHBondContact OD1-CB 3Å; D932-T934 PolarHBondContact OD1-N 3.31Å; D932-T934 PolarHBondContact OD1-OG1 3.12Å; D932-N943 PolarHBondContact OD2-ND2 3.23Å
933	T	81.6	Confident	84.2	Confident	82 Å²	82	47.8 Å²	47.8	50%	0.503	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-4.8	-179.5	55.8	0	0	0	0	114.3	N910 C925	N910-T933 PolarHBondContact ND2-OG1 3.47Å; N910-T933 PolarHBondContact OD1-O 3.05Å; N910-T933 VanDerWaalsContact OD1-O 3.04Å; N910-T933 PolarHBondContact OD1-OG1 2.7Å; C925-T933 PolarHBondContact SG-O 2.84Å
934	T	82.5	Confident	84.2	Confident	54 Å²	54	49.9 Å²	49.9	33%	0.331	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	160.2	-179.3	81.7	0	0	0	0	110.6	N910 C925 D932	N910-T934 PolarHBondContact OD1-N 2.75Å; C925-T934 PolarHBondContact SG-O 2.81Å; D932-T934 VanDerWaalsContact C-N 3.34Å; D932-T934 WeakPolarHBondContact OD1-CA 3.39Å; D932-T934 VanDerWaalsContact OD1-CB 3.22Å; D932-T934 WeakPolarHBondContact OD1-CB 3Å; D932-T934 PolarHBondContact OD1-N 3.31Å; D932-T934 PolarHBondContact OD1-OG1 3.12Å
935	C	88.5	Confident	84.1	Confident	13 Å²	13	49.7 Å²	49.7	9%	0.088	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164.1	172.5	68.8	0	0	0	0	109.4	C923 Q937 G940 Q941 C942	C923-C935 VanDerWaalsContact CA-SG 3.56Å; C923-C935 HydrophobicContact CB-CB 3.62Å; C923-C935 WeakPolarHBondContact CB-SG 3.48Å; C923-C935 WeakPolarHBondContact SG-CB 3.08Å; C923-C935 PolarHBondContact SG-N 2.94Å; C923-C935 CovalentContact SG-SG 2.02Å; C923-C935 PolarHBondContact SG-SG 2.8Å; C935-Q937 PolarHBondContact O-N 2.75Å; C935-G940 WeakPolarHBondContact CB-O 3.46Å; C935-Q941 VanDerWaalsContact CA-O 3.28Å; C935-Q941 WeakPolarHBondContact CA-O 3.33Å; C935-Q941 VanDerWaalsContact CB-O 3.28Å; C935-Q941 WeakPolarHBondContact CB-O 3.39Å; C935-C942 HydrophobicContact CB-CB 4.48Å
936	N	84.5	Confident	83.6	Confident	82 Å²	82	55.1 Å²	55.1	44%	0.439	31%	0.311	S	S	.	.			trans	-56.4	120.3	172.7	-177	-55.8	0	0	0	110.1	W912 A938 T939 G940 Q941	W912-N936 WeakPolarHBondContact CB-O 2.99Å; N936-A938 PolarHBondContact O-N 3.42Å; N936-A938 VanDerWaalsContact O-N 3.1Å; N936-A938 WeakPolarHBondContact OD1-CA 3.48Å; N936-A938 WeakPolarHBondContact OD1-CB 3.39Å; N936-A938 PolarHBondContact OD1-N 2.85Å; N936-T939 WeakPolarHBondContact CB-OG1 3.41Å; N936-T939 PolarHBondContact O-N 3.06Å; N936-T939 PolarHBondContact OD1-N 3.23Å; N936-G940 WeakPolarHBondContact O-CA 3.5Å; N936-G940 PolarHBondContact O-N 2.8Å; N936-Q941 PolarHBondContact N-O 2.79Å
937	Q	82.1	Confident	83.3	Confident	60 Å²	60	54.3 Å²	54.3	28%	0.28	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.7	-174.2	-63	-165.1	10.9	0	0	113.9	C907 W912 G913 C935	C907-Q937 HydrophobicContact CB-CB 4.46Å; C907-Q937 HydrophobicContact CB-CG 4.3Å; C907-Q937 VanDerWaalsContact O-CD 3.29Å; C907-Q937 PolarHBondContact O-NE2 2.95Å; C907-Q937 PolarHBondContact O-OE1 3.4Å; W912-Q937 CarbonylContact C-O 3.4Å; W912-Q937 WeakPolarHBondContact CA-O 3.21Å; G913-Q937 PolarHBondContact N-O 3.35Å; C935-Q937 PolarHBondContact O-N 2.75Å
938	A	76.4	Confident	83.6	Confident	14 Å²	14	49.9 Å²	49.9	12%	0.116	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-70.4	167.9	0	0	0	0	0	111.1	W912 Q915 N916 N936 G940	W912-A938 VanDerWaalsContact CE3-O 3.26Å; Q915-A938 HydrophobicContact CB-CB 3.81Å; Q915-A938 HydrophobicContact CG-CB 4.28Å; N916-A938 PolarHBondContact ND2-O 3.1Å; N916-A938 WeakPolarHBondContact OD1-CA 3.4Å; N916-A938 PolarHBondContact OD1-O 3.34Å; N936-A938 PolarHBondContact O-N 3.42Å; N936-A938 VanDerWaalsContact O-N 3.1Å; N936-A938 WeakPolarHBondContact OD1-CA 3.48Å; N936-A938 WeakPolarHBondContact OD1-CB 3.39Å; N936-A938 PolarHBondContact OD1-N 2.85Å; A938-G940 VanDerWaalsContact C-N 3.28Å; A938-G940 PolarHBondContact O-N 2.79Å
939	T	81.9	Confident	83.5	Confident	75 Å²	75	49.3 Å²	49.3	46%	0.46	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.3	-166.8	65.6	0	0	0	0	114.9	N936 Q941	N936-T939 WeakPolarHBondContact CB-OG1 3.41Å; N936-T939 PolarHBondContact O-N 3.06Å; N936-T939 PolarHBondContact OD1-N 3.23Å; T939-Q941 PolarHBondContact O-N 3.11Å; T939-Q941 WeakPolarHBondContact OG1-CB 3.47Å; T939-Q941 PolarHBondContact OG1-N 2.88Å
940	G	85.4	Confident	83.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.304	C	S	.	.			trans	69.5	3.6	-172.2	0	0	0	0	0	114.4	C935 N936 A938 C942 R951	C935-G940 WeakPolarHBondContact CB-O 3.46Å; N936-G940 WeakPolarHBondContact O-CA 3.5Å; N936-G940 PolarHBondContact O-N 2.8Å; A938-G940 VanDerWaalsContact C-N 3.28Å; A938-G940 PolarHBondContact O-N 2.79Å; G940-C942 PolarHBondContact O-N 2.85Å; G940-R951 VanDerWaalsContact O-CG 3.29Å; G940-R951 WeakPolarHBondContact O-CG 3.47Å; G940-R951 PolarHBondContact O-NH1 3.33Å
941	Q	89.4	Confident	83.7	Confident	73 Å²	73	54.2 Å²	54.2	34%	0.341	32%	0.317	S	S	.	.			trans	-70.8	121.2	-178.5	-178	57.8	57.4	0	0	110.8	C935 N936 T939 C944 G950 R951	C935-Q941 VanDerWaalsContact CA-O 3.28Å; C935-Q941 WeakPolarHBondContact CA-O 3.33Å; C935-Q941 VanDerWaalsContact CB-O 3.28Å; C935-Q941 WeakPolarHBondContact CB-O 3.39Å; N936-Q941 PolarHBondContact N-O 2.79Å; T939-Q941 PolarHBondContact O-N 3.11Å; T939-Q941 WeakPolarHBondContact OG1-CB 3.47Å; T939-Q941 PolarHBondContact OG1-N 2.88Å; Q941-C944 PolarHBondContact NE2-SG 2.89Å; Q941-C944 VanDerWaalsContact NE2-SG 3.42Å; Q941-G950 PolarHBondContact NE2-O 2.95Å; Q941-R951 PolarHBondContact NE2-O 2.93Å
942	C	89.7	Confident	83.9	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	155.4	171.7	-61.8	0	0	0	0	111.2	C925 C935 G940 C944 R951 C953	C925-C942 WeakPolarHBondContact CA-SG 3.18Å; C925-C942 HydrophobicContact CB-CB 3.68Å; C925-C942 WeakPolarHBondContact CB-SG 3.27Å; C925-C942 WeakPolarHBondContact SG-CB 3.33Å; C925-C942 CovalentContact SG-SG 2.03Å; C925-C942 PolarHBondContact SG-SG 3.25Å; C935-C942 HydrophobicContact CB-CB 4.48Å; G940-C942 PolarHBondContact O-N 2.85Å; C942-C944 PolarHBondContact O-N 3.46Å; C942-C944 VanDerWaalsContact O-N 3.14Å; C942-R951 WeakPolarHBondContact CB-O 3.24Å; C942-R951 PolarHBondContact N-O 2.8Å; C942-R951 PolarHBondContact SG-O 2.86Å; C942-R951 VanDerWaalsContact SG-O 3.39Å; C942-C953 VanDerWaalsContact CB-SG 3.55Å; C942-C953 PolarHBondContact O-SG 2.92Å; C942-C953 VanDerWaalsContact O-SG 3.38Å
943	N	89	Confident	84.3	Confident	78 Å²	78	51 Å²	51	42%	0.417	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	92.3	-179.2	-65	-35.4	0	0	0	110.8	S930 T931 D932	S930-N943 CarbonylContact C-O 3.23Å; S930-N943 VanDerWaalsContact CA-O 3.3Å; S930-N943 WeakPolarHBondContact CA-O 3.24Å; S930-N943 PolarHBondContact OG-O 3.1Å; T931-N943 PolarHBondContact N-O 2.89Å; T931-N943 WeakPolarHBondContact OG1-CB 3.28Å; T931-N943 PolarHBondContact OG1-O 3.01Å; D932-N943 PolarHBondContact OD2-ND2 3.23Å
944	C	88.2	Confident	84.4	Confident	44 Å²	44	49.5 Å²	49.5	30%	0.297	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.9	-171.9	-53.7	0	0	0	0	113.9	Q941 C942 V948 C953	Q941-C944 PolarHBondContact NE2-SG 2.89Å; Q941-C944 VanDerWaalsContact NE2-SG 3.42Å; C942-C944 PolarHBondContact O-N 3.46Å; C942-C944 VanDerWaalsContact O-N 3.14Å; C944-V948 HydrophobicContact CB-CB 4.35Å; C944-V948 VanDerWaalsContact CB-O 3.24Å; C944-V948 WeakPolarHBondContact CB-O 3.38Å; C944-C953 WeakPolarHBondContact CA-SG 3.48Å; C944-C953 HydrophobicContact CB-CB 3.68Å; C944-C953 WeakPolarHBondContact CB-SG 3.48Å; C944-C953 PolarHBondContact N-SG 2.79Å; C944-C953 VanDerWaalsContact SG-CA 3.55Å; C944-C953 WeakPolarHBondContact SG-CB 3.39Å; C944-C953 CovalentContact SG-SG 2.04Å; C944-C953 PolarHBondContact SG-SG 3.1Å
945	R	84.1	Confident	84.2	Confident	69 Å²	69	51.7 Å²	51.7	26%	0.26	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-67.3	153	166.9	-59.6	-167.4	-168.7	-156	6.3	109.7	L928 G929 S930 T931 G947 V948 E964	L928-R945 VanDerWaalsContact O-CD 3.32Å; L928-R945 WeakPolarHBondContact O-CD 3.36Å; L928-R945 PolarHBondContact O-NE 2.03Å; G929-R945 PolarHBondContact O-N 2.85Å; S930-R945 PolarHBondContact O-NE 3.39Å; S930-R945 PolarHBondContact O-NH2 3.15Å; T931-R945 HydrophobicContact CG2-CG 4.12Å; R945-G947 PolarHBondContact O-N 3.5Å; R945-V948 HydrophobicContact CB-CG2 4.34Å; R945-V948 WeakPolarHBondContact O-CB 3.18Å; R945-V948 WeakPolarHBondContact O-CG2 3.48Å; R945-V948 PolarHBondContact O-N 2.81Å; R945-E964 WeakPolarHBondContact CD-O 3.41Å; R945-E964 PolarHBondContact NH1-O 2.83Å
946	T	77	Confident	83.7	Confident	133 Å²	133	51.7 Å²	51.7	82%	0.816	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	129.4	-172.9	-51.7	0	0	0	0	112.5	V948	T946-V948 VanDerWaalsContact C-N 3.28Å; T946-V948 PolarHBondContact O-N 2.79Å
947	G	77.8	Confident	82.9	Confident	44 Å²	44	52.7 Å²	52.7	45%	0.454	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-22.1	-177.2	0	0	0	0	0	114.9	R945 P957 C967	R945-G947 PolarHBondContact O-N 3.5Å; G947-P957 WeakPolarHBondContact O-CD 3.29Å; G947-C967 PolarHBondContact O-SG 3.03Å
948	V	84.1	Confident	81.8	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	32%	0.316	C	S	.	.			trans	-82.4	141.1	-178.6	-168.4	0	0	0	0	110.8	C944 R945 T946 C953 M955 V962 G966	C944-V948 HydrophobicContact CB-CB 4.35Å; C944-V948 VanDerWaalsContact CB-O 3.24Å; C944-V948 WeakPolarHBondContact CB-O 3.38Å; R945-V948 HydrophobicContact CB-CG2 4.34Å; R945-V948 WeakPolarHBondContact O-CB 3.18Å; R945-V948 WeakPolarHBondContact O-CG2 3.48Å; R945-V948 PolarHBondContact O-N 2.81Å; T946-V948 VanDerWaalsContact C-N 3.28Å; T946-V948 PolarHBondContact O-N 2.79Å; V948-C953 VanDerWaalsContact CG1-C 3.44Å; V948-C953 HydrophobicContact CG1-CB 3.9Å; V948-C953 WeakPolarHBondContact CG1-O 3.31Å; V948-M955 WeakPolarHBondContact CG1-O 3.45Å; V948-V962 HydrophobicContact CG1-CG1 3.91Å; V948-V962 HydrophobicContact CG1-CG2 4.05Å; V948-V962 HydrophobicContact CG2-CG1 4.09Å; V948-G966 VanDerWaalsContact CG2-CA 3.43Å
949	V	80.8	Confident	81	Confident	61 Å²	61	56.9 Å²	56.9	37%	0.37	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-134.1	175.2	-173.8	-59.9	0	0	0	0	113.3	C953 S954 M955 P957	V949-C953 CarbonylContact O-C 3.47Å; V949-C953 WeakPolarHBondContact O-CA 3.35Å; V949-S954 PolarHBondContact O-N 3.23Å; V949-M955 HydrophobicContact CG2-CB 4.04Å; V949-M955 PolarHBondContact N-O 2.92Å; V949-M955 PolarHBondContact O-N 3.34Å; V949-P957 HydrophobicContact CG1-CG 3.76Å; V949-P957 HydrophobicContact CG2-CG 3.95Å
950	G	81.2	Confident	80.3	Confident	30 Å²	30	54.3 Å²	54.3	31%	0.309	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	161.2	-176.9	0	0	0	0	0	113	Q941 Q952 C953	Q941-G950 PolarHBondContact NE2-O 2.95Å; G950-Q952 PolarHBondContact O-N 2.84Å; G950-Q952 VanDerWaalsContact O-N 3.14Å; G950-C953 PolarHBondContact O-N 2.97Å
951	R	88.2	Confident	79.5	Confident	76 Å²	76	61.8 Å²	61.8	29%	0.287	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37.4	-175.6	-165	-166.4	63.3	68.5	-3.3	112.8	C923 G940 Q941 C942	C923-R951 PolarHBondContact O-NH1 3.47Å; C923-R951 PolarHBondContact O-NH2 3.1Å; G940-R951 VanDerWaalsContact O-CG 3.29Å; G940-R951 WeakPolarHBondContact O-CG 3.47Å; G940-R951 PolarHBondContact O-NH1 3.33Å; Q941-R951 PolarHBondContact NE2-O 2.93Å; C942-R951 WeakPolarHBondContact CB-O 3.24Å; C942-R951 PolarHBondContact N-O 2.8Å; C942-R951 PolarHBondContact SG-O 2.86Å; C942-R951 VanDerWaalsContact SG-O 3.39Å
952	Q	87.5	Confident	78.9	Confident	72 Å²	72	59.2 Å²	59.2	34%	0.336	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.6	-179.3	-63.7	176	-49	0	0	113.5	S924 H926 G950 S954	S924-Q952 WeakPolarHBondContact O-CB 3.4Å; S924-Q952 VanDerWaalsContact O-CG 3.24Å; S924-Q952 WeakPolarHBondContact O-CG 3.49Å; S924-Q952 PolarHBondContact O-NE2 3.26Å; S924-Q952 VanDerWaalsContact O-NE2 3.17Å; H926-Q952 VanDerWaalsContact CB-O 3.3Å; H926-Q952 WeakPolarHBondContact CB-O 3.48Å; H926-Q952 PolarHBondContact N-O 3.1Å; G950-Q952 PolarHBondContact O-N 2.84Å; G950-Q952 VanDerWaalsContact O-N 3.14Å; Q952-S954 VanDerWaalsContact C-N 3.31Å; Q952-S954 PolarHBondContact O-N 3.04Å
953	C	90.1	Very high	78.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	43.1	-169.7	-44.3	0	0	0	0	112.7	H926 G929 C942 C944 V948 V949 G950	H926-C953 VanDerWaalsContact CB-O 3.27Å; H926-C953 WeakPolarHBondContact CB-O 3.44Å; G929-C953 WeakPolarHBondContact CA-O 3.5Å; G929-C953 VanDerWaalsContact O-CB 3.31Å; G929-C953 WeakPolarHBondContact O-CB 3.25Å; C942-C953 VanDerWaalsContact CB-SG 3.55Å; C942-C953 PolarHBondContact O-SG 2.92Å; C942-C953 VanDerWaalsContact O-SG 3.38Å; C944-C953 WeakPolarHBondContact CA-SG 3.48Å; C944-C953 HydrophobicContact CB-CB 3.68Å; C944-C953 WeakPolarHBondContact CB-SG 3.48Å; C944-C953 PolarHBondContact N-SG 2.79Å; C944-C953 VanDerWaalsContact SG-CA 3.55Å; C944-C953 WeakPolarHBondContact SG-CB 3.39Å; C944-C953 CovalentContact SG-SG 2.04Å; C944-C953 PolarHBondContact SG-SG 3.1Å; V948-C953 VanDerWaalsContact CG1-C 3.44Å; V948-C953 HydrophobicContact CG1-CB 3.9Å; V948-C953 WeakPolarHBondContact CG1-O 3.31Å; V949-C953 CarbonylContact O-C 3.47Å; V949-C953 WeakPolarHBondContact O-CA 3.35Å; G950-C953 PolarHBondContact O-N 2.97Å
954	S	83.4	Confident	77.3	Confident	50 Å²	50	63 Å²	63	35%	0.35	37%	0.372	S	S	.	.			trans	-104.3	0.5	-174.7	47.9	0	0	0	0	113.8	V949 Q952	V949-S954 PolarHBondContact O-N 3.23Å; Q952-S954 VanDerWaalsContact C-N 3.31Å; Q952-S954 PolarHBondContact O-N 3.04Å
955	M	79.3	Confident	76.5	Confident	101 Å²	101	68.1 Å²	68.1	50%	0.498	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-129.4	151.5	-172.7	-60.3	175.4	71.7	0	0	111.6	V948 V949	V948-M955 WeakPolarHBondContact CG1-O 3.45Å; V949-M955 HydrophobicContact CG2-CB 4.04Å; V949-M955 PolarHBondContact N-O 2.92Å; V949-M955 PolarHBondContact O-N 3.34Å
956	C	77	Confident	75.9	Confident	12 Å²	12	64.9 Å²	64.9	8%	0.081	38%	0.384	C	S	.	.			trans	-112.8	138.1	166.7	-72.2	0	0	0	0	110	D958 G959 S960 C967	C956-D958 VanDerWaalsContact CB-OD1 3.27Å; C956-D958 WeakPolarHBondContact CB-OD1 3.26Å; C956-D958 PolarHBondContact O-N 3.32Å; C956-D958 VanDerWaalsContact O-N 3.16Å; C956-G959 PolarHBondContact O-N 2.96Å; C956-S960 VanDerWaalsContact CB-O 3.32Å; C956-S960 WeakPolarHBondContact CB-O 3.48Å; C956-S960 VanDerWaalsContact CB-OG 3.32Å; C956-S960 WeakPolarHBondContact CB-OG 3.19Å; C956-C967 WeakPolarHBondContact CA-SG 3.4Å; C956-C967 HydrophobicContact CB-CB 3.81Å; C956-C967 WeakPolarHBondContact CB-SG 3.14Å; C956-C967 WeakPolarHBondContact SG-CA 3.29Å; C956-C967 WeakPolarHBondContact SG-CB 3.38Å; C956-C967 CovalentContact SG-SG 2.03Å; C956-C967 PolarHBondContact SG-SG 2.85Å
957	P	67.9	Low	75.7	Confident	103 Å²	103	59.4 Å²	59.4	67%	0.669	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.6	-177.4	-26.3	34.6	0	0	0	114.8	G947 V949	G947-P957 WeakPolarHBondContact O-CD 3.29Å; V949-P957 HydrophobicContact CG1-CG 3.76Å; V949-P957 HydrophobicContact CG2-CG 3.95Å
958	D	58.9	Low	75.1	Confident	93 Å²	93	59.5 Å²	59.5	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	2.7	178.5	64.4	-12.5	0	0	0	113.4	C956 S960	C956-D958 VanDerWaalsContact CB-OD1 3.27Å; C956-D958 WeakPolarHBondContact CB-OD1 3.26Å; C956-D958 PolarHBondContact O-N 3.32Å; C956-D958 VanDerWaalsContact O-N 3.16Å; D958-S960 VanDerWaalsContact CG-OG 3.31Å; D958-S960 PolarHBondContact O-N 3.28Å; D958-S960 WeakPolarHBondContact OD1-CB 3.42Å; D958-S960 PolarHBondContact OD1-N 2.92Å; D958-S960 PolarHBondContact OD1-OG 3.16Å; D958-S960 WeakPolarHBondContact OD2-CB 3.41Å; D958-S960 PolarHBondContact OD2-OG 2.95Å
959	G	59.5	Low	73.4	Confident	69 Å²	69	64.7 Å²	64.7	71%	0.711	38%	0.376	S	S	*	.	S	Bend	trans	72.3	9.9	-173.6	0	0	0	0	0	115	C956	C956-G959 PolarHBondContact O-N 2.96Å
960	S	67.5	Low	71.3	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.154	39%	0.387	C	S	.	.			trans	-67.8	167	175	66.6	0	0	0	0	112.5	C956 D958 C967 S968	C956-S960 VanDerWaalsContact CB-O 3.32Å; C956-S960 WeakPolarHBondContact CB-O 3.48Å; C956-S960 VanDerWaalsContact CB-OG 3.32Å; C956-S960 WeakPolarHBondContact CB-OG 3.19Å; D958-S960 VanDerWaalsContact CG-OG 3.31Å; D958-S960 PolarHBondContact O-N 3.28Å; D958-S960 WeakPolarHBondContact OD1-CB 3.42Å; D958-S960 PolarHBondContact OD1-N 2.92Å; D958-S960 PolarHBondContact OD1-OG 3.16Å; D958-S960 WeakPolarHBondContact OD2-CB 3.41Å; D958-S960 PolarHBondContact OD2-OG 2.95Å; S960-C967 WeakPolarHBondContact OG-CB 3.25Å; S960-S968 PolarHBondContact OG-N 2.8Å
961	Q	69.7	Low	68.8	Low	156 Å²	156	78.1 Å²	78.1	73%	0.729	41%	0.414	S	S	*	.			trans	-77.6	138.7	178.2	-71.7	-171.6	-11.1	0	0	111.3	T963 S968	Q961-T963 PolarHBondContact O-N 2.82Å; Q961-S968 PolarHBondContact N-OG 3.02Å; Q961-S968 PolarHBondContact O-N 2.79Å; Q961-S968 PolarHBondContact O-OG 2.85Å
962	V	75.1	Confident	66	Low	19 Å²	19	80.7 Å²	80.7	12%	0.115	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	103.9	175	-178.3	0	0	0	0	109.7	H926 L928 V948	H926-V962 WeakPolarHBondContact ND1-CG1 3.47Å; L928-V962 HydrophobicContact CB-CG1 4.36Å; L928-V962 WeakPolarHBondContact CD1-O 3.45Å; V948-V962 HydrophobicContact CG1-CG1 3.91Å; V948-V962 HydrophobicContact CG1-CG2 4.05Å; V948-V962 HydrophobicContact CG2-CG1 4.09Å
963	T	75	Confident	63.2	Low	45 Å²	45	82.2 Å²	82.2	28%	0.276	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	173	177.3	74.6	0	0	0	0	111.2	L928 Q961 N965 G966	L928-T963 VanDerWaalsContact O-O 3.1Å; Q961-T963 PolarHBondContact O-N 2.82Å; T963-N965 PolarHBondContact O-N 3.02Å; T963-N965 PolarHBondContact OG1-N 3.29Å; T963-G966 WeakPolarHBondContact CA-O 3.28Å; T963-G966 PolarHBondContact N-O 3.02Å; T963-G966 WeakPolarHBondContact O-CA 3.35Å; T963-G966 PolarHBondContact O-N 3.24Å; T963-G966 PolarHBondContact OG1-O 2.84Å
964	E	71.2	Confident	60.1	Low	116 Å²	116	90.9 Å²	90.9	54%	0.542	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.8	171.2	-68.7	-157.5	105	0	0	113.8	L928 R945 G966	L928-E964 HydrophobicContact CD2-CG 3.76Å; R945-E964 WeakPolarHBondContact CD-O 3.41Å; R945-E964 PolarHBondContact NH1-O 2.83Å; E964-G966 PolarHBondContact O-N 3.03Å
965	N	71.2	Confident	57.6	Low	151 Å²	151	96.5 Å²	96.5	81%	0.807	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	9.9	177.7	-67.6	-38.4	0	0	0	112.7	T963	T963-N965 PolarHBondContact O-N 3.02Å; T963-N965 PolarHBondContact OG1-N 3.29Å
966	G	70.6	Confident	55.1	Low	0 Å²	0	98 Å²	98	0%	0	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	85.5	-143.5	-167.3	0	0	0	0	0	111.3	V948 T963 E964	V948-G966 VanDerWaalsContact CG2-CA 3.43Å; T963-G966 WeakPolarHBondContact CA-O 3.28Å; T963-G966 PolarHBondContact N-O 3.02Å; T963-G966 WeakPolarHBondContact O-CA 3.35Å; T963-G966 PolarHBondContact O-N 3.24Å; T963-G966 PolarHBondContact OG1-O 2.84Å; E964-G966 PolarHBondContact O-N 3.03Å
967	C	73.6	Confident	52.6	Low	19 Å²	19	105.5 Å²	105.5	13%	0.128	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.3	138.2	-176.1	-66.3	0	0	0	0	112.7	G947 C956 S960 V969	G947-C967 PolarHBondContact O-SG 3.03Å; C956-C967 WeakPolarHBondContact CA-SG 3.4Å; C956-C967 HydrophobicContact CB-CB 3.81Å; C956-C967 WeakPolarHBondContact CB-SG 3.14Å; C956-C967 WeakPolarHBondContact SG-CA 3.29Å; C956-C967 WeakPolarHBondContact SG-CB 3.38Å; C956-C967 CovalentContact SG-SG 2.03Å; C956-C967 PolarHBondContact SG-SG 2.85Å; S960-C967 WeakPolarHBondContact OG-CB 3.25Å; C967-V969 PolarHBondContact O-N 2.84Å
968	S	64.6	Low	50.6	Low	45 Å²	45	107.2 Å²	107.2	32%	0.315	55%	0.552	S	S	.	*			trans	-78.4	84.5	-175.6	35.6	0	0	0	0	111.2	S960 Q961 K970	S960-S968 PolarHBondContact OG-N 2.8Å; Q961-S968 PolarHBondContact N-OG 3.02Å; Q961-S968 PolarHBondContact O-N 2.79Å; Q961-S968 PolarHBondContact O-OG 2.85Å; S968-K970 PolarHBondContact O-N 3.4Å
969	V	48.8	Very low	49	Very low	118 Å²	118	109.8 Å²	109.8	72%	0.715	56%	0.561	S	S	*	*			trans	-51.2	107.6	176.8	-178.3	0	0	0	0	110.6	C967 R971	C967-V969 PolarHBondContact O-N 2.84Å; V969-R971 PolarHBondContact O-N 3.28Å
970	K	36.6	Very low	47.3	Very low	139 Å²	139	110.8 Å²	110.8	60%	0.604	56%	0.557	S	S	*	*			trans	-64.5	99.1	168.4	-78.5	-172.5	173.8	-175.3	0	109.4	S968 Q972 E1224	S968-K970 PolarHBondContact O-N 3.4Å; K970-Q972 PolarHBondContact O-N 2.83Å; K970-E1224 IonicContact NZ-OE1 2.78Å; K970-E1224 PolarHBondContact NZ-OE1 3.3Å
971	R	30.4	Very low	45.3	Very low	234 Å²	234	115.6 Å²	115.6	88%	0.883	58%	0.581	S	S	*	*			trans	-73.8	103.2	164.6	-62.3	-172.6	-168.3	178.5	3.5	108.8	V969	V969-R971 PolarHBondContact O-N 3.28Å
972	Q	28.8	Very low	43.1	Very low	131 Å²	131	114.9 Å²	114.9	61%	0.612	58%	0.578	S	S	*	*			trans	-98	162.6	152.3	-68.9	-178.7	-1.5	0	0	108.3	K970 E1224	K970-Q972 PolarHBondContact O-N 2.83Å; Q972-E1224 PolarHBondContact NE2-OE1 2.98Å; Q972-E1224 PolarHBondContact NE2-OE2 2.79Å
973	S	27.7	Very low	40.7	Very low	104 Å²	104	120 Å²	120	73%	0.727	60%	0.6	S	S	*	*	S	Bend	trans	62.4	107.8	-160.4	62.7	0	0	0	0	114.8
974	E	26.6	Very low	38.3	Very low	182 Å²	182	124.1 Å²	124.1	85%	0.85	62%	0.617	S	S	*	*				37.9	112.5	122.5	-62.4	168.6	-175.6	0	0	118.3
975	D	30.3	Very low	36.2	Very low	167 Å²	167	128.9 Å²	128.9	89%	0.893	63%	0.631	S	S	*	*			trans	-145.4	137.2	133.6	-137.5	-23.4	0	0	0	110.9
976	I	26	Very low	34.1	Very low	134 Å²	134	126.5 Å²	126.5	69%	0.687	63%	0.626	S	S	*	*			trans	-98.8	153.7	-170.3	-49.2	162.6	0	0	0	107.8
977	K	24.9	Very low	32.2	Very low	169 Å²	169	132.9 Å²	132.9	74%	0.735	67%	0.667	S	S	*	*				152.4	122.2	121.7	-79.2	177	-176.4	175.9	0	116.7
978	F	25.8	Very low	29.9	Very low	139 Å²	139	135.4 Å²	135.4	61%	0.61	70%	0.697	S	S	*	*			trans	69.8	148.2	139.5	-72.7	-128.7	0	0	0	116.2
979	E	25	Very low	28.2	Very low	147 Å²	147	137.3 Å²	137.3	69%	0.687	72%	0.716	S	S	*	*			cis	-150.1	163.9	5.5	-148.2	164.7	-161.4	0	0	114.5
980	S	24.8	Very low	27.2	Very low	90 Å²	90	137 Å²	137	63%	0.629	71%	0.714	S	S	*	*			trans	72.8	114.7	151.7	67.9	0	0	0	0	120.1
981	N	24.9	Very low	26.7	Very low	123 Å²	123	138.4 Å²	138.4	66%	0.658	72%	0.723	S	S	*	*			trans	71.7	110.3	132.2	-63.7	49.4	0	0	0	117.9
982	E	23.4	Very low	26.7	Very low	141 Å²	141	133.6 Å²	133.6	66%	0.659	71%	0.714	S	S	*	*				77.2	134.8	89.9	-70.6	-177.3	137.9	0	0	112.3
983	Q	24.2	Very low	26.6	Very low	125 Å²	125	134.3 Å²	134.3	58%	0.584	72%	0.722	S	S	*	*			cis	-158.4	-179.6	-4.5	-121.1	157.6	20.6	0	0	108.2
984	Q	24.5	Very low	26.8	Very low	133 Å²	133	138 Å²	138	62%	0.621	73%	0.725	S	S	*	*			trans	20.7	137.3	143.8	-60.9	149.1	-4.8	0	0	118.5
985	Y	27.2	Very low	27	Very low	216 Å²	216	134.8 Å²	134.8	85%	0.847	72%	0.717	S	S	*	*				-151.8	132.5	61	-104.8	-98.7	0	0	0	114
986	S	27.6	Very low	26.8	Very low	101 Å²	101	134 Å²	134	71%	0.706	71%	0.713	S	S	*	*			trans	-77.7	166.3	149.4	-40.2	0	0	0	0	109.1
987	P	30.1	Very low	26.9	Very low	133 Å²	133	133.2 Å²	133.2	86%	0.864	72%	0.715	S	S	*	*				-136.4	147.3	71.8	33.4	-16.4	0	0	0	112
988	G	26.6	Very low	27.1	Very low	72 Å²	72	133.9 Å²	133.9	74%	0.742	72%	0.718	S	S	*	*				128.4	167.6	66	0	0	0	0	0	107.4
989	A	27.5	Very low	27.3	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	72%	0.721	S	S	*	*			cis	-153.6	177.5	0.4	0	0	0	0	0	110.1
990	T	27.8	Very low	27.3	Very low	111 Å²	111	131.5 Å²	131.5	68%	0.681	72%	0.724	S	S	*	*			trans	58.2	105.2	157.8	49.3	0	0	0	0	117.9
991	E	27.8	Very low	27.7	Very low	169 Å²	169	136.2 Å²	136.2	79%	0.79	74%	0.736	S	S	*	*				97.5	153.5	90.5	-82.9	178	-178.7	0	0	112.1
992	L	28.7	Very low	27.9	Very low	133 Å²	133	137.8 Å²	137.8	70%	0.696	74%	0.743	S	S	*	*			cis	-143.7	153.4	2	-162.4	67.1	0	0	0	111.2
993	N	27.6	Very low	28.3	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	75%	0.748	S	S	*	*			trans	-74.7	152.3	169.6	-73.9	-47.5	0	0	0	113.7
994	K	32.2	Very low	28.4	Very low	182 Å²	182	137.7 Å²	137.7	79%	0.791	76%	0.757	S	S	*	*			trans	-167.3	100.2	145.2	-102.6	147.7	-175.1	177.4	0	109.5
995	T	29.5	Very low	28.5	Very low	114 Å²	114	140.8 Å²	140.8	70%	0.699	77%	0.769	S	S	*	*				56.6	108.6	91.7	62.5	0	0	0	0	113.3
996	N	26.7	Very low	28.6	Very low	150 Å²	150	139 Å²	139	80%	0.802	77%	0.773	S	S	*	*				100.1	150	61.5	-107.6	-3.5	0	0	0	112.6
997	T	27.3	Very low	28.4	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	78%	0.779	S	S	*	*			trans	60.4	123.5	169.1	54.4	0	0	0	0	118.2
998	F	29.6	Very low	28.2	Very low	182 Å²	182	138.6 Å²	138.6	80%	0.798	77%	0.774	S	S	*	*				-163	112.7	101.7	-120	-110.7	0	0	0	112.5
999	I	30.3	Very low	28.1	Very low	132 Å²	132	143.7 Å²	143.7	68%	0.677	78%	0.778	S	S	*	*			trans	61.5	130.8	131.6	-60.4	-167.7	0	0	0	121.6
1000	S	25.2	Very low	27.9	Very low	105 Å²	105	146.9 Å²	146.9	73%	0.734	78%	0.783	S	S	*	*			trans	-83.8	141.6	169.9	52.7	0	0	0	0	114.3
1001	Q	33.6	Very low	28	Very low	188 Å²	188	148 Å²	148	88%	0.879	79%	0.785	S	S	*	*			trans	-140.1	154.3	157	-71.5	-164.1	-27.4	0	0	111.8
1002	L	28.9	Very low	28.1	Very low	157 Å²	157	149.9 Å²	149.9	82%	0.822	79%	0.79	S	S	*	*			trans	-83.3	-177.5	-174.9	-77	77.4	0	0	0	111.3
1003	P	31.3	Very low	28.7	Very low	116 Å²	116	150.9 Å²	150.9	75%	0.753	79%	0.792	S	S	*	*			cis	-139.9	-174	9.8	42.9	-23.4	0	0	0	117.3
1004	D	26.6	Very low	29.8	Very low	147 Å²	147	149 Å²	149	79%	0.786	78%	0.778	S	S	*	*			trans	-61.9	171.3	169.9	-57.5	-84.8	0	0	0	116
1005	K	26.4	Very low	31.1	Very low	199 Å²	199	142.3 Å²	142.3	87%	0.865	75%	0.751	S	S	*	*			trans	86.5	93.3	171.8	-60.1	-177	175.3	-179.9	0	117.2
1006	L	29	Very low	33.2	Very low	178 Å²	178	136.9 Å²	136.9	93%	0.932	72%	0.718	S	S	*	*			trans	-141.6	105.7	130.5	-112.5	168	0	0	0	109.8
1007	T	24.8	Very low	35.9	Very low	134 Å²	134	130.4 Å²	130.4	82%	0.822	68%	0.682	S	S	*	*			trans	-85.3	113.9	174	47.1	0	0	0	0	110
1008	A	24.6	Very low	38.5	Very low	92 Å²	92	126.4 Å²	126.4	76%	0.76	66%	0.656	S	S	*	*			trans	-174.8	145.7	151.2	0	0	0	0	0	110.9
1009	E	23.9	Very low	41.3	Very low	178 Å²	178	117.8 Å²	117.8	83%	0.832	62%	0.618	S	S	*	*			trans	-42.8	127	170.6	-57.4	145.6	144.6	0	0	113.4
1010	N	24.9	Very low	43.8	Very low	154 Å²	154	113.9 Å²	113.9	82%	0.824	60%	0.601	S	S	*	*			trans	170.9	175.4	137.5	-94.7	-62.7	0	0	0	110.7
1011	N	29.5	Very low	46.4	Very low	133 Å²	133	111.9 Å²	111.9	71%	0.711	58%	0.58	S	S	*	*			trans	64.4	74.3	174.9	-57.3	-0.8	0	0	0	115.9	E1013	N1011-E1013 VanDerWaalsContact C-N 3.28Å; N1011-E1013 HydrophobicContact CB-CG 4.24Å; N1011-E1013 PolarHBondContact O-N 2.83Å; N1011-E1013 VanDerWaalsContact O-N 3.13Å
1012	K	29.2	Very low	48.4	Very low	209 Å²	209	106.5 Å²	106.5	91%	0.909	56%	0.56	S	S	*	*			trans	-66.4	97.9	138.2	-77.7	-174.4	176.5	-177.4	0	106.6	E1014	K1012-E1014 PolarHBondContact O-N 2.96Å
1013	E	41.8	Very low	50.8	Low	154 Å²	154	99 Å²	99	72%	0.72	52%	0.521	S	S	*	.			trans	-69.1	106.1	173.9	-72.6	-157.7	110	0	0	109.5	N1011 D1015	N1011-E1013 VanDerWaalsContact C-N 3.28Å; N1011-E1013 HydrophobicContact CB-CG 4.24Å; N1011-E1013 PolarHBondContact O-N 2.83Å; N1011-E1013 VanDerWaalsContact O-N 3.13Å; E1013-D1015 PolarHBondContact O-N 3Å; E1013-D1015 VanDerWaalsContact O-N 3.08Å
1014	E	50.8	Low	53.1	Low	106 Å²	106	93.5 Å²	93.5	50%	0.495	49%	0.485	S	S	.	.			trans	-52.7	112.1	168.9	-66.4	164.8	167.7	0	0	109.1	K1012 K1111 N1193 L1211	K1012-E1014 PolarHBondContact O-N 2.96Å; E1014-K1111 PolarHBondContact O-NZ 3.4Å; E1014-N1193 PolarHBondContact O-ND2 3.44Å; E1014-L1211 HydrophobicContact CB-CD1 3.82Å; E1014-L1211 HydrophobicContact CG-CD1 4.43Å
1015	D	59.9	Low	55.8	Low	41 Å²	41	86.5 Å²	86.5	22%	0.219	45%	0.447	C	S	.	.			trans	-61	-177.9	173.6	-166.5	12.7	0	0	0	111.5	E1013 N1193 L1211 C1237 S1238	E1013-D1015 PolarHBondContact O-N 3Å; E1013-D1015 VanDerWaalsContact O-N 3.08Å; D1015-N1193 WeakPolarHBondContact O-CB 3.43Å; D1015-N1193 PolarHBondContact O-ND2 2.99Å; D1015-L1211 HydrophobicContact CB-CD2 3.98Å; D1015-L1211 WeakPolarHBondContact O-CD1 3.27Å; D1015-C1237 WeakPolarHBondContact OD1-CB 3.47Å; D1015-S1238 PolarHBondContact OD1-N 3.46Å; D1015-S1238 VanDerWaalsContact OD1-N 3.14Å; D1015-S1238 WeakPolarHBondContact OD2-CB 3.28Å; D1015-S1238 PolarHBondContact OD2-N 3.2Å; D1015-S1238 PolarHBondContact OD2-OG 3.31Å
1016	G	72.9	Confident	58.2	Low	0 Å²	0	78.8 Å²	78.8	0%	0	42%	0.415	C	S	.	.			trans	-131.9	175.2	175.4	0	0	0	0	0	113.4	L1236 C1237	G1016-L1236 CarbonylContact O-C 3.4Å; G1016-L1236 WeakPolarHBondContact O-CA 3.07Å; G1016-C1237 PolarHBondContact O-N 3.43Å
1017	R	82.6	Confident	60.5	Low	14 Å²	14	70.5 Å²	70.5	5%	0.053	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	136.7	163.3	-67.7	-69.3	-172.3	138.4	12.9	109.2	F1019 L1192 L1210 W1220 E1233 A1234	R1017-F1019 PolarHBondContact O-N 2.91Å; R1017-L1192 PolarHBondContact N-O 3.23Å; R1017-L1192 PolarHBondContact O-N 2.95Å; R1017-L1210 HydrophobicContact CB-CB 4.24Å; R1017-L1210 HydrophobicContact CG-CB 3.7Å; R1017-L1210 VanDerWaalsContact CG-O 3.27Å; R1017-L1210 WeakPolarHBondContact CG-O 3.2Å; R1017-L1210 PolarHBondContact NE-O 3.45Å; R1017-W1220 HydrophobicContact CB-CH2 4.03Å; R1017-W1220 HydrophobicContact CG-CH2 4.32Å; R1017-W1220 HydrophobicContact CG-CZ2 4.47Å; R1017-E1233 IonicContact CZ-OE2 3.33Å; R1017-E1233 IonicContact NH1-OE2 2.72Å; R1017-E1233 PolarHBondContact NH1-OE2 2.91Å; R1017-E1233 IonicContact NH2-OE2 3.2Å; R1017-E1233 PolarHBondContact NH2-OE2 2.99Å; R1017-A1234 HydrophobicContact CB-CB 3.95Å; R1017-A1234 VanDerWaalsContact CD-O 3.29Å; R1017-A1234 WeakPolarHBondContact CD-O 3.27Å; R1017-A1234 PolarHBondContact NH1-O 2.71Å
1018	L	83.5	Confident	62.5	Low	36 Å²	36	69.5 Å²	69.5	19%	0.188	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	118.2	-179.8	-172.3	80.1	0	0	0	111.1	A1234 P1235	L1018-A1234 VanDerWaalsContact O-CB 3.3Å; L1018-A1234 WeakPolarHBondContact O-CB 3.31Å; L1018-P1235 HydrophobicContact CB-CG 4.09Å; L1018-P1235 HydrophobicContact CD2-CG 4.15Å; L1018-P1235 PolarHBondContact N-O 3.21Å
1019	F	88.2	Confident	64.6	Low	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.1	166.6	-79	-110.2	0	0	0	110.2	R1017 T1023 L1025 I1162 F1188 S1189 G1190 L1192 L1210 W1220	R1017-F1019 PolarHBondContact O-N 2.91Å; F1019-T1023 HydrophobicContact CB-CG2 4.5Å; F1019-T1023 HydrophobicContact CD1-CG2 3.48Å; F1019-T1023 VanDerWaalsContact CD1-CG2 3.48Å; F1019-T1023 HydrophobicContact CE1-CG2 3.8Å; F1019-T1023 HydrophobicContact CG-CG2 4.03Å; F1019-L1025 HydrophobicContact CE1-CB 3.83Å; F1019-L1025 HydrophobicContact CZ-CB 3.81Å; F1019-L1025 HydrophobicContact CZ-CD2 3.76Å; F1019-L1025 HydrophobicContact CZ-CG 4.42Å; F1019-I1162 HydrophobicContact CE1-CB 4.46Å; F1019-I1162 HydrophobicContact CE1-CG2 3.76Å; F1019-I1162 HydrophobicContact CZ-CG2 3.91Å; F1019-F1188 HydrophobicContact CB-CD1 4.48Å; F1019-F1188 HydrophobicContact CB-CD2 4.13Å; F1019-F1188 HydrophobicContact CB-CE1 3.96Å; F1019-F1188 HydrophobicContact CB-CE2 3.57Å; F1019-F1188 HydrophobicContact CB-CZ 3.47Å; F1019-F1188 VanDerWaalsContact CB-CZ 3.47Å; F1019-F1188 HydrophobicContact CD1-CD1 4.4Å; F1019-F1188 AromaticContact CD1-CE1 3.52Å; F1019-F1188 HydrophobicContact CD1-CE1 3.52Å; F1019-F1188 AromaticContact CD1-CZ 3.6Å; F1019-F1188 HydrophobicContact CD1-CZ 3.6Å; F1019-F1188 HydrophobicContact CD2-CE1 4.3Å; F1019-F1188 HydrophobicContact CD2-CE2 4.17Å; F1019-F1188 AromaticContact CD2-CZ 3.53Å; F1019-F1188 HydrophobicContact CD2-CZ 3.53Å; F1019-F1188 HydrophobicContact CE1-CE1 4.05Å; F1019-F1188 HydrophobicContact CE1-CZ 4.2Å; F1019-F1188 HydrophobicContact CE2-CZ 4.13Å; F1019-F1188 AromaticContact CG-CE1 3.67Å; F1019-F1188 HydrophobicContact CG-CE1 3.67Å; F1019-F1188 AromaticContact CG-CE2 3.87Å; F1019-F1188 HydrophobicContact CG-CE2 3.87Å; F1019-F1188 AromaticContact CG-CZ 3.23Å; F1019-F1188 HydrophobicContact CG-CZ 3.23Å; F1019-F1188 HydrophobicContact CZ-CZ 4.43Å; F1019-S1189 WeakPolarHBondContact O-CA 3.27Å; F1019-G1190 PolarHBondContact N-O 3.42Å; F1019-G1190 PolarHBondContact O-N 3.41Å; F1019-L1192 HydrophobicContact CD2-CB 3.93Å; F1019-L1192 HydrophobicContact CE2-CB 3.86Å; F1019-L1192 HydrophobicContact CE2-CD2 3.88Å; F1019-L1192 HydrophobicContact CE2-CG 4.45Å; F1019-L1192 HydrophobicContact CZ-CD2 4.04Å; F1019-L1210 HydrophobicContact CE2-CD1 4.24Å; F1019-W1220 HydrophobicContact CD2-CZ3 4.43Å; F1019-W1220 HydrophobicContact CE1-CZ3 4.01Å; F1019-W1220 AromaticContact CE2-CH2 3.82Å; F1019-W1220 HydrophobicContact CE2-CH2 3.82Å; F1019-W1220 AromaticContact CE2-CZ3 3.7Å; F1019-W1220 HydrophobicContact CE2-CZ3 3.7Å; F1019-W1220 AromaticContact CZ-CH2 3.85Å; F1019-W1220 HydrophobicContact CZ-CH2 3.85Å; F1019-W1220 AromaticContact CZ-CZ3 3.46Å; F1019-W1220 HydrophobicContact CZ-CZ3 3.46Å; F1019-W1220 VanDerWaalsContact CZ-CZ3 3.46Å
1020	T	83	Confident	66.6	Low	50 Å²	50	59.8 Å²	59.8	31%	0.307	30%	0.298	S	S	.	.			trans	-114	167.8	169.8	68.8	0	0	0	0	109.4	T1022 T1023 F1188	T1020-T1022 PolarHBondContact O-N 3.49Å; T1020-T1022 PolarHBondContact OG1-N 3.43Å; T1020-T1022 PolarHBondContact OG1-OG1 3.35Å; T1020-T1022 VanDerWaalsContact OG1-OG1 3.07Å; T1020-T1023 PolarHBondContact N-OG1 2.98Å; T1020-T1023 WeakPolarHBondContact O-CB 3.39Å; T1020-T1023 PolarHBondContact O-N 3.25Å; T1020-T1023 PolarHBondContact OG1-N 2.63Å; T1020-T1023 PolarHBondContact OG1-OG1 3.1Å; T1020-F1188 CarbonylContact C-O 3.5Å
1021	E	80.1	Confident	68.8	Low	64 Å²	64	53.6 Å²	53.6	30%	0.299	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.9	175.5	-71.8	159.9	153.5	0	0	114.1	K1047 R1164 Y1186 G1187	E1021-K1047 HydrophobicContact CG-CD 4.41Å; E1021-K1047 WeakPolarHBondContact OE1-CD 3.32Å; E1021-K1047 WeakPolarHBondContact OE1-CE 3.34Å; E1021-K1047 IonicContact OE1-NZ 2.69Å; E1021-K1047 PolarHBondContact OE1-NZ 2.62Å; E1021-K1047 IonicContact OE2-NZ 3.18Å; E1021-K1047 PolarHBondContact OE2-NZ 3.25Å; E1021-R1164 WeakPolarHBondContact O-CD 3.47Å; E1021-Y1186 HydrophobicContact CB-CD1 3.99Å; E1021-Y1186 HydrophobicContact CB-CG 4.43Å; E1021-G1187 WeakPolarHBondContact CA-O 3.42Å; E1021-G1187 PolarHBondContact O-N 2.83Å
1022	T	74.8	Confident	70.4	Confident	74 Å²	74	50.5 Å²	50.5	45%	0.454	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-18.4	174.5	49.9	0	0	0	0	114.1	T1020 T1024 R1164 G1222	T1020-T1022 PolarHBondContact O-N 3.49Å; T1020-T1022 PolarHBondContact OG1-N 3.43Å; T1020-T1022 PolarHBondContact OG1-OG1 3.35Å; T1020-T1022 VanDerWaalsContact OG1-OG1 3.07Å; T1022-T1024 PolarHBondContact O-N 3.39Å; T1022-R1164 PolarHBondContact O-NE 2.87Å; T1022-R1164 VanDerWaalsContact O-NE 3.15Å; T1022-G1222 PolarHBondContact OG1-O 2.69Å
1023	T	78.9	Confident	72.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	21%	0.208	C	C	.	.			trans	-66.7	124.7	-176.4	-57	0	0	0	0	110.9	F1019 T1020 R1164 W1220 L1221 I1223	F1019-T1023 HydrophobicContact CB-CG2 4.5Å; F1019-T1023 HydrophobicContact CD1-CG2 3.48Å; F1019-T1023 VanDerWaalsContact CD1-CG2 3.48Å; F1019-T1023 HydrophobicContact CE1-CG2 3.8Å; F1019-T1023 HydrophobicContact CG-CG2 4.03Å; T1020-T1023 PolarHBondContact N-OG1 2.98Å; T1020-T1023 WeakPolarHBondContact O-CB 3.39Å; T1020-T1023 PolarHBondContact O-N 3.25Å; T1020-T1023 PolarHBondContact OG1-N 2.63Å; T1020-T1023 PolarHBondContact OG1-OG1 3.1Å; T1023-R1164 PolarHBondContact O-N 2.95Å; T1023-W1220 HydrophobicContact CG2-CE3 3.91Å; T1023-W1220 HydrophobicContact CG2-CZ3 3.97Å; T1023-L1221 WeakPolarHBondContact CA-O 3Å; T1023-I1223 HydrophobicContact CG2-CD1 3.66Å; T1023-I1223 HydrophobicContact CG2-CG1 4.32Å
1024	T	79.2	Confident	73.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.6	163.5	-51.1	0	0	0	0	108.7	T1022 L1026 I1161 I1162 R1164 I1166 W1220 L1221	T1022-T1024 PolarHBondContact O-N 3.39Å; T1024-L1026 HydrophobicContact CG2-CD2 4.36Å; T1024-I1161 HydrophobicContact CG2-CG2 3.51Å; T1024-I1162 CarbonylContact C-O 3.47Å; T1024-I1162 WeakPolarHBondContact CA-O 3.41Å; T1024-R1164 WeakPolarHBondContact CB-O 3.02Å; T1024-R1164 WeakPolarHBondContact CG2-O 3.42Å; T1024-R1164 PolarHBondContact OG1-O 3.16Å; T1024-I1166 HydrophobicContact CG2-CD1 3.95Å; T1024-I1166 HydrophobicContact CG2-CG1 3.83Å; T1024-W1220 CarbonylContact O-C 3.49Å; T1024-W1220 WeakPolarHBondContact O-CA 3.31Å; T1024-L1221 PolarHBondContact N-O 3.06Å; T1024-L1221 PolarHBondContact O-N 2.74Å
1025	L	83.2	Confident	74.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.4	169.3	164.1	61.3	0	0	0	108.5	F1019 V1027 I1162 L1208 L1210 L1218 W1220	F1019-L1025 HydrophobicContact CE1-CB 3.83Å; F1019-L1025 HydrophobicContact CZ-CB 3.81Å; F1019-L1025 HydrophobicContact CZ-CD2 3.76Å; F1019-L1025 HydrophobicContact CZ-CG 4.42Å; L1025-V1027 HydrophobicContact CD1-CG2 4.16Å; L1025-V1027 HydrophobicContact CD2-CG2 3.98Å; L1025-V1027 HydrophobicContact CG-CG2 3.71Å; L1025-I1162 HydrophobicContact CB-CB 4.15Å; L1025-I1162 HydrophobicContact CD2-CD1 4.17Å; L1025-I1162 HydrophobicContact CG-CB 4.42Å; L1025-I1162 PolarHBondContact N-O 2.96Å; L1025-I1162 PolarHBondContact O-N 3.5Å; L1025-L1208 HydrophobicContact CD2-CD2 4.26Å; L1025-L1210 HydrophobicContact CD2-CD2 3.79Å; L1025-L1218 HydrophobicContact CD1-CB 3.61Å; L1025-L1218 HydrophobicContact CD1-CD1 3.99Å; L1025-L1218 HydrophobicContact CD1-CD2 4.14Å; L1025-L1218 HydrophobicContact CD1-CG 4.1Å; L1025-W1220 HydrophobicContact CB-CD2 4.44Å; L1025-W1220 HydrophobicContact CB-CE3 3.9Å; L1025-W1220 HydrophobicContact CB-CZ3 3.99Å; L1025-W1220 HydrophobicContact CD1-CD2 4.02Å; L1025-W1220 HydrophobicContact CD1-CE3 4.31Å; L1025-W1220 HydrophobicContact CD1-CG 4.45Å; L1025-W1220 HydrophobicContact CD1-CZ2 4.34Å; L1025-W1220 HydrophobicContact CD2-CH2 4.01Å; L1025-W1220 HydrophobicContact CD2-CZ2 4.29Å; L1025-W1220 HydrophobicContact CD2-CZ3 4.23Å; L1025-W1220 HydrophobicContact CG-CZ3 4.49Å
1026	L	76.7	Confident	76	Confident	37 Å²	37	37.2 Å²	37.2	19%	0.194	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126	172.1	-63	177.5	0	0	0	110.8	T1024 T1159 I1161 I1166 A1219	T1024-L1026 HydrophobicContact CG2-CD2 4.36Å; L1026-T1159 HydrophobicContact CB-CG2 4.28Å; L1026-T1159 HydrophobicContact CD2-CG2 4.01Å; L1026-I1161 HydrophobicContact CD2-CB 4.15Å; L1026-I1161 HydrophobicContact CD2-CD1 4.41Å; L1026-I1161 HydrophobicContact CD2-CG1 3.73Å; L1026-I1161 HydrophobicContact CD2-CG2 4.01Å; L1026-I1166 HydrophobicContact CD1-CD1 3.84Å; L1026-I1166 HydrophobicContact CD2-CD1 3.76Å; L1026-I1166 HydrophobicContact CG-CD1 4.03Å; L1026-A1219 HydrophobicContact CB-CB 4.11Å; L1026-A1219 HydrophobicContact CD1-CB 4.33Å; L1026-A1219 PolarHBondContact N-O 3.43Å
1027	V	76.9	Confident	76.5	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	112.2	-178.2	-172.2	0	0	0	0	109	L1025 I1160 I1162 F1206 L1208 L1218	L1025-V1027 HydrophobicContact CD1-CG2 4.16Å; L1025-V1027 HydrophobicContact CD2-CG2 3.98Å; L1025-V1027 HydrophobicContact CG-CG2 3.71Å; V1027-I1160 HydrophobicContact CB-CB 4.49Å; V1027-I1160 PolarHBondContact N-O 3.21Å; V1027-I1160 PolarHBondContact O-N 2.97Å; V1027-I1162 HydrophobicContact CG2-CD1 3.6Å; V1027-I1162 HydrophobicContact CG2-CG1 4.21Å; V1027-F1206 HydrophobicContact CG1-CE1 3.65Å; V1027-F1206 HydrophobicContact CG1-CZ 3.51Å; V1027-L1208 HydrophobicContact CB-CD2 4.47Å; V1027-L1208 HydrophobicContact CG1-CD2 3.96Å; V1027-L1208 HydrophobicContact CG2-CD2 3.64Å; V1027-L1218 HydrophobicContact CG2-CD2 4.5Å
1028	R	68.4	Low	76.8	Confident	112 Å²	112	39.1 Å²	39.1	42%	0.423	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.1	170.8	-171.3	178	-173.4	151.7	3.4	110.2	E1158 E1523	R1028-E1158 HydrophobicContact CG-CB 4.42Å; R1028-E1158 IonicContact CZ-OE2 3.03Å; R1028-E1158 IonicContact NE-OE2 2.72Å; R1028-E1158 PolarHBondContact NE-OE2 3.01Å; R1028-E1158 IonicContact NH2-OE2 3.8Å; R1028-E1158 PolarHBondContact NH2-OE2 3.19Å; R1028-E1523 IonicContact CZ-OE1 2.76Å; R1028-E1523 VanDerWaalsContact CZ-OE1 3.26Å; R1028-E1523 IonicContact CZ-OE2 2.88Å; R1028-E1523 IonicContact NH1-OE1 3.14Å; R1028-E1523 PolarHBondContact NH1-OE1 3.09Å; R1028-E1523 IonicContact NH1-OE2 3.75Å; R1028-E1523 PolarHBondContact NH1-OE2 3.47Å; R1028-E1523 IonicContact NH2-OE1 3.67Å; R1028-E1523 PolarHBondContact NH2-OE1 3Å
1029	I	69.2	Low	77.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.			trans	-86.2	138.6	172.7	-40.2	172.9	0	0	0	108.5	F1031 I1033 Y1055 E1158 I1160 I1197 F1206	I1029-F1031 WeakPolarHBondContact CB-O 3.38Å; I1029-F1031 HydrophobicContact CG2-CD1 4.2Å; I1029-F1031 HydrophobicContact CG2-CD2 3.68Å; I1029-F1031 HydrophobicContact CG2-CE1 4.13Å; I1029-F1031 HydrophobicContact CG2-CE2 3.6Å; I1029-F1031 HydrophobicContact CG2-CG 3.98Å; I1029-F1031 HydrophobicContact CG2-CZ 3.83Å; I1029-F1031 VanDerWaalsContact CG2-O 3.28Å; I1029-F1031 WeakPolarHBondContact CG2-O 3.11Å; I1029-F1031 PolarHBondContact O-N 3.19Å; I1029-F1031 VanDerWaalsContact O-N 3.14Å; I1029-I1033 HydrophobicContact CD1-CD1 3.53Å; I1029-I1033 HydrophobicContact CD1-CG1 3.46Å; I1029-I1033 VanDerWaalsContact CD1-CG1 3.46Å; I1029-Y1055 HydrophobicContact CD1-CD2 3.98Å; I1029-Y1055 HydrophobicContact CD1-CE2 3.5Å; I1029-E1158 PolarHBondContact N-O 3.21Å; I1029-I1160 HydrophobicContact CD1-CD1 3.72Å; I1029-I1160 HydrophobicContact CD1-CG1 3.7Å; I1029-I1160 HydrophobicContact CG1-CD1 4.01Å; I1029-I1160 HydrophobicContact CG1-CG1 3.87Å; I1029-I1197 HydrophobicContact CD1-CD1 4.22Å; I1029-I1197 HydrophobicContact CG1-CD1 4.32Å; I1029-F1206 HydrophobicContact CG2-CB 4.47Å
1030	P	65.4	Low	77.3	Confident	66 Å²	66	39.4 Å²	39.4	43%	0.429	20%	0.204	S	C	.	.	S	Bend	trans	-75	10.9	173.9	30.4	-35	0	0	0	114.3	F1206	P1030-F1206 VanDerWaalsContact CD-CD2 3.49Å; P1030-F1206 HydrophobicContact CG-CD2 4.09Å
1031	F	69.6	Low	77.8	Confident	24 Å²	24	37 Å²	37	11%	0.105	19%	0.189	C	C	.	.	S	Bend	trans	-158	153.9	178.9	50.6	-102.1	0	0	0	112.2	I1029 I1033 A1199 K1204 H1205 F1206	I1029-F1031 WeakPolarHBondContact CB-O 3.38Å; I1029-F1031 HydrophobicContact CG2-CD1 4.2Å; I1029-F1031 HydrophobicContact CG2-CD2 3.68Å; I1029-F1031 HydrophobicContact CG2-CE1 4.13Å; I1029-F1031 HydrophobicContact CG2-CE2 3.6Å; I1029-F1031 HydrophobicContact CG2-CG 3.98Å; I1029-F1031 HydrophobicContact CG2-CZ 3.83Å; I1029-F1031 VanDerWaalsContact CG2-O 3.28Å; I1029-F1031 WeakPolarHBondContact CG2-O 3.11Å; I1029-F1031 PolarHBondContact O-N 3.19Å; I1029-F1031 VanDerWaalsContact O-N 3.14Å; F1031-I1033 PolarHBondContact O-N 2.03Å; F1031-A1199 HydrophobicContact CD2-CB 4.47Å; F1031-A1199 HydrophobicContact CE2-CB 3.93Å; F1031-K1204 HydrophobicContact CB-CD 4.21Å; F1031-K1204 HydrophobicContact CB-CG 4.12Å; F1031-K1204 HydrophobicContact CD1-CB 4.26Å; F1031-K1204 HydrophobicContact CD1-CG 4.24Å; F1031-K1204 HydrophobicContact CD2-CB 3.89Å; F1031-K1204 HydrophobicContact CD2-CD 4.02Å; F1031-K1204 HydrophobicContact CD2-CG 3.97Å; F1031-K1204 HydrophobicContact CE1-CB 4.25Å; F1031-K1204 HydrophobicContact CE2-CB 3.88Å; F1031-K1204 HydrophobicContact CE2-CG 4.47Å; F1031-K1204 HydrophobicContact CG-CB 4.1Å; F1031-K1204 HydrophobicContact CG-CD 4.2Å; F1031-K1204 HydrophobicContact CG-CG 3.86Å; F1031-K1204 HydrophobicContact CZ-CB 4.06Å; F1031-K1204 WeakPolarHBondContact CZ-O 3.34Å; F1031-H1205 WeakPolarHBondContact CE1-O 3.26Å; F1031-F1206 HydrophobicContact CE1-CB 3.89Å; F1031-F1206 HydrophobicContact CZ-CB 3.65Å
1032	H	65.1	Low	78.3	Confident	69 Å²	69	35.7 Å²	35.7	32%	0.319	18%	0.184	S	C	.	.			trans	-61.1	131.8	162.4	-80.3	-104.8	0	0	0	111	D1034 E1158 K1204	H1032-D1034 PolarHBondContact O-N 2.85Å; H1032-E1158 IonicContact CD2-OE1 3.77Å; H1032-K1204 PolarHBondContact O-NZ 2.73Å
1033	I	71.7	Confident	79	Confident	24 Å²	24	32.1 Å²	32.1	12%	0.123	16%	0.162	C	C	.	.			trans	-69.5	106.7	169.6	-58.9	-174.2	0	0	0	109.6	I1029 F1031 T1037 Y1055 I1160 I1197 A1199	I1029-I1033 HydrophobicContact CD1-CD1 3.53Å; I1029-I1033 HydrophobicContact CD1-CG1 3.46Å; I1029-I1033 VanDerWaalsContact CD1-CG1 3.46Å; F1031-I1033 PolarHBondContact O-N 2.03Å; I1033-T1037 HydrophobicContact CG2-CG2 3.37Å; I1033-T1037 WeakPolarHBondContact CG2-OG1 3.44Å; I1033-Y1055 HydrophobicContact CB-CE1 3.74Å; I1033-Y1055 HydrophobicContact CD1-CD1 3.83Å; I1033-Y1055 HydrophobicContact CD1-CD2 4.3Å; I1033-Y1055 HydrophobicContact CD1-CE1 3.67Å; I1033-Y1055 HydrophobicContact CD1-CE2 4.15Å; I1033-Y1055 HydrophobicContact CD1-CG 4.12Å; I1033-Y1055 HydrophobicContact CG1-CD1 4.47Å; I1033-Y1055 HydrophobicContact CG1-CE1 3.81Å; I1033-Y1055 HydrophobicContact CG1-CE2 4.25Å; I1033-Y1055 PolarHBondContact N-OH 3.22Å; I1033-Y1055 VanDerWaalsContact N-OH 3.15Å; I1033-I1160 HydrophobicContact CD1-CD1 4.39Å; I1033-I1197 HydrophobicContact CD1-CG2 4.17Å; I1033-I1197 HydrophobicContact CG1-CG2 4.39Å; I1033-A1199 HydrophobicContact CB-CB 4.23Å; I1033-A1199 HydrophobicContact CG2-CB 3.79Å
1034	D	69.9	Low	79.4	Confident	70 Å²	70	32.7 Å²	32.7	37%	0.374	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-91.7	165.8	169	-52.7	-9	0	0	0	110.5	H1032 T1037 A1199 G1200 K1204	H1032-D1034 PolarHBondContact O-N 2.85Å; D1034-T1037 PolarHBondContact O-OG1 2.03Å; D1034-A1199 CarbonylContact O-C 3.52Å; D1034-A1199 WeakPolarHBondContact O-CA 3.49Å; D1034-G1200 PolarHBondContact O-N 2.79Å; D1034-K1204 IonicContact OD1-NZ 3.66Å; D1034-K1204 PolarHBondContact OD1-NZ 3.33Å; D1034-K1204 IonicContact OD2-NZ 3.89Å; D1034-K1204 PolarHBondContact OD2-NZ 2.99Å
1035	Q	73.5	Confident	79.6	Confident	66 Å²	66	32.7 Å²	32.7	31%	0.308	17%	0.168	S	C	.	.	S	Bend	trans	-90.1	149.1	168.6	-60.1	-173.3	28.5	0	0	111.3	Y1088 I1118 G1200	Q1035-Y1088 PolarHBondContact NE2-OH 3.31Å; Q1035-Y1088 VanDerWaalsContact NE2-OH 3.15Å; Q1035-I1118 HydrophobicContact CG-CB 4.29Å; Q1035-I1118 HydrophobicContact CG-CG2 4.27Å; Q1035-G1200 WeakPolarHBondContact O-CA 3.42Å
1036	P	82.8	Confident	79.5	Confident	70 Å²	70	35 Å²	35	46%	0.455	18%	0.18	S	C	.	.	S	Bend	cis	-67.8	133.6	-4	28.2	-37.1	0	0	0	112.9	I1119 G1200	P1036-I1119 HydrophobicContact CB-CD1 4.38Å; P1036-I1119 HydrophobicContact CB-CG1 3.81Å; P1036-I1119 HydrophobicContact CB-CG2 4.43Å; P1036-G1200 PolarHBondContact O-N 2.01Å
1037	T	83.6	Confident	79.6	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.031	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.9	179	-47	0	0	0	0	110.4	I1033 D1034 I1039 G1117 I1118 N1198	I1033-T1037 HydrophobicContact CG2-CG2 3.37Å; I1033-T1037 WeakPolarHBondContact CG2-OG1 3.44Å; D1034-T1037 PolarHBondContact O-OG1 2.03Å; T1037-I1039 HydrophobicContact CG2-CG1 4.37Å; T1037-G1117 VanDerWaalsContact O-CA 3.31Å; T1037-G1117 WeakPolarHBondContact O-CA 3.24Å; T1037-I1118 PolarHBondContact N-O 3.31Å; T1037-I1118 PolarHBondContact O-N 2.78Å; T1037-N1198 CarbonylContact C-O 3.45Å; T1037-N1198 WeakPolarHBondContact CA-O 3.36Å
1038	E	88.7	Confident	79.5	Confident	49 Å²	49	37.7 Å²	37.7	23%	0.229	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.2	164.5	174.9	176.3	-143	0	0	109.2	Q1115 W1124 I1197 N1198	E1038-Q1115 PolarHBondContact OE1-NE2 2.9Å; E1038-W1124 HydrophobicContact CB-CH2 4.4Å; E1038-W1124 HydrophobicContact CB-CZ2 3.99Å; E1038-W1124 HydrophobicContact CG-CH2 3.86Å; E1038-W1124 HydrophobicContact CG-CZ2 3.97Å; E1038-I1197 CarbonylContact O-C 3.58Å; E1038-I1197 WeakPolarHBondContact O-CA 3.38Å; E1038-N1198 HydrophobicContact CB-CB 4.31Å; E1038-N1198 PolarHBondContact N-O 3.39Å; E1038-N1198 PolarHBondContact O-N 3.24Å; E1038-N1198 PolarHBondContact OE2-ND2 2.97Å; E1038-N1198 VanDerWaalsContact OE2-ND2 3.1Å
1039	I	91.3	Very high	80.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.3	169.9	-64.9	-179.6	0	0	0	107.8	T1037 M1041 L1053 F1075 M1077 Q1115 A1116 M1195 I1196 I1197	T1037-I1039 HydrophobicContact CG2-CG1 4.37Å; I1039-M1041 HydrophobicContact CG2-CG 4.15Å; I1039-L1053 HydrophobicContact CG2-CD2 4.27Å; I1039-F1075 HydrophobicContact CD1-CD1 4.17Å; I1039-F1075 HydrophobicContact CD1-CE1 3.7Å; I1039-F1075 HydrophobicContact CD1-CZ 4.22Å; I1039-M1077 HydrophobicContact CG2-CE 3.98Å; I1039-Q1115 CarbonylContact O-C 3.47Å; I1039-Q1115 WeakPolarHBondContact O-CA 3.43Å; I1039-A1116 WeakPolarHBondContact CA-O 3.43Å; I1039-A1116 PolarHBondContact N-O 2.85Å; I1039-A1116 PolarHBondContact O-N 3.14Å; I1039-A1116 VanDerWaalsContact O-O 3.09Å; I1039-M1195 HydrophobicContact CD1-CE 4.43Å; I1039-M1195 HydrophobicContact CG2-CE 3.83Å; I1039-M1195 HydrophobicContact CG2-CG 4.46Å; I1039-I1196 CarbonylContact C-O 3.06Å; I1039-I1196 VanDerWaalsContact CA-O 3.29Å; I1039-I1196 WeakPolarHBondContact CA-O 2.97Å; I1039-I1197 HydrophobicContact CG1-CG1 4.33Å; I1039-I1197 HydrophobicContact CG1-CG2 4.16Å
1040	Q	92.2	Very high	80.8	Confident	42 Å²	42	34.6 Å²	34.6	20%	0.196	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.6	175.5	-178.5	-177.8	-5.8	0	0	109	N1113 I1114 Q1115 M1195 I1196	Q1040-N1113 WeakPolarHBondContact CG-OD1 3.44Å; Q1040-N1113 PolarHBondContact NE2-ND2 3.08Å; Q1040-N1113 PolarHBondContact NE2-OD1 3.1Å; Q1040-I1114 CarbonylContact C-O 3.42Å; Q1040-I1114 WeakPolarHBondContact CA-O 3.37Å; Q1040-Q1115 HydrophobicContact CB-CG 4.2Å; Q1040-Q1115 HydrophobicContact CG-CG 3.9Å; Q1040-M1195 CarbonylContact O-C 3.42Å; Q1040-M1195 VanDerWaalsContact O-CA 3.28Å; Q1040-M1195 WeakPolarHBondContact O-CA 3.38Å; Q1040-I1196 HydrophobicContact CB-CB 4.24Å; Q1040-I1196 PolarHBondContact N-O 2.94Å; Q1040-I1196 PolarHBondContact O-N 2.83Å
1041	M	92.5	Very high	81.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.2	174.6	-60.8	179.6	77.7	0	0	109.9	I1039 L1043 L1052 L1053 M1077 I1114 L1192 M1195	I1039-M1041 HydrophobicContact CG2-CG 4.15Å; M1041-L1043 HydrophobicContact CB-CD2 4.09Å; M1041-L1043 HydrophobicContact CE-CD2 4.2Å; M1041-L1052 HydrophobicContact CE-CB 4.42Å; M1041-L1052 HydrophobicContact CE-CD2 4.31Å; M1041-L1052 HydrophobicContact SD-CB 4.39Å; M1041-L1053 HydrophobicContact CE-CD2 4.42Å; M1041-L1053 HydrophobicContact SD-CD2 3.84Å; M1041-L1053 HydrophobicContact SD-CG 4.46Å; M1041-M1077 HydrophobicContact CG-CE 4.4Å; M1041-M1077 HydrophobicContact SD-CE 3.58Å; M1041-M1077 VanDerWaalsContact SD-CE 3.58Å; M1041-I1114 PolarHBondContact N-O 2.76Å; M1041-I1114 PolarHBondContact O-N 2.76Å; M1041-L1192 HydrophobicContact CB-CD1 4.29Å; M1041-L1192 HydrophobicContact CE-CD1 3.81Å; M1041-L1192 HydrophobicContact CE-CD2 4.03Å; M1041-M1195 HydrophobicContact CG-CG 4.19Å
1042	I	90.2	Very high	82.7	Confident	35 Å²	35	30.5 Å²	30.5	18%	0.179	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	109.7	176.1	-58.3	179.6	0	0	0	107.9	K1111 H1112 N1193 K1194	I1042-K1111 HydrophobicContact CG2-CD 4.3Å; I1042-K1111 HydrophobicContact CG2-CG 4.02Å; I1042-H1112 WeakPolarHBondContact CA-O 3.31Å; I1042-N1193 HydrophobicContact CG2-CB 4.34Å; I1042-N1193 PolarHBondContact O-N 2.84Å; I1042-N1193 PolarHBondContact O-OD1 2.95Å; I1042-K1194 HydrophobicContact CB-CB 4.37Å; I1042-K1194 HydrophobicContact CD1-CB 4.32Å; I1042-K1194 PolarHBondContact N-O 3.25Å
1043	L	90.7	Very high	83.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	157.6	-171.6	60.7	84.1	0	0	0	114	M1041 L1045 L1052 H1112 I1114 C1191 L1192	M1041-L1043 HydrophobicContact CB-CD2 4.09Å; M1041-L1043 HydrophobicContact CE-CD2 4.2Å; L1043-L1045 HydrophobicContact CD1-CD1 4.01Å; L1043-L1045 HydrophobicContact CD1-CD2 3.84Å; L1043-L1045 HydrophobicContact CD1-CG 3.64Å; L1043-L1052 HydrophobicContact CD2-CD2 3.45Å; L1043-L1052 VanDerWaalsContact CD2-CD2 3.45Å; L1043-H1112 PolarHBondContact N-O 2.84Å; L1043-H1112 PolarHBondContact O-N 3.07Å; L1043-I1114 HydrophobicContact CD1-CD1 3.9Å; L1043-I1114 HydrophobicContact CD2-CD1 4.09Å; L1043-I1114 HydrophobicContact CG-CD1 4.08Å; L1043-C1191 CarbonylContact C-O 3.53Å; L1043-C1191 WeakPolarHBondContact CA-O 3.3Å; L1043-C1191 WeakPolarHBondContact CB-O 2.92Å; L1043-L1192 HydrophobicContact CB-CD1 3.79Å; L1043-L1192 HydrophobicContact CD2-CD1 3.93Å; L1043-L1192 HydrophobicContact CG-CD1 4.46Å
1044	G	85.7	Confident	84.5	Confident	12 Å²	12	26.5 Å²	26.5	12%	0.124	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152.9	167	0	0	0	0	0	111	T1110 G1190 C1191	G1044-T1110 WeakPolarHBondContact CA-O 3.19Å; G1044-G1190 CarbonylContact O-C 3.58Å; G1044-G1190 WeakPolarHBondContact O-CA 3.44Å; G1044-C1191 PolarHBondContact N-O 3.01Å; G1044-C1191 PolarHBondContact O-N 3.22Å
1045	L	84.7	Confident	85.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.1	-168	-66.9	174.1	0	0	0	114.6	L1043 I1079 W1082 L1106 N1109 F1188	L1043-L1045 HydrophobicContact CD1-CD1 4.01Å; L1043-L1045 HydrophobicContact CD1-CD2 3.84Å; L1043-L1045 HydrophobicContact CD1-CG 3.64Å; L1045-I1079 HydrophobicContact CD1-CD1 3.47Å; L1045-I1079 VanDerWaalsContact CD1-CD1 3.47Å; L1045-I1079 HydrophobicContact CD1-CG1 3.9Å; L1045-I1079 HydrophobicContact CD1-CG2 4.31Å; L1045-I1079 HydrophobicContact CD2-CD1 3.6Å; L1045-I1079 HydrophobicContact CG-CD1 4.19Å; L1045-W1082 HydrophobicContact CB-CZ3 4.24Å; L1045-L1106 HydrophobicContact CD1-CB 4.47Å; L1045-L1106 HydrophobicContact CD1-CD1 3.55Å; L1045-N1109 PolarHBondContact O-N 3.03Å; L1045-N1109 PolarHBondContact O-OD1 3.42Å; L1045-F1188 HydrophobicContact CD2-CB 4.23Å; L1045-F1188 HydrophobicContact CD2-CD2 3.75Å; L1045-F1188 HydrophobicContact CD2-CG 4.42Å
1046	D	80.2	Confident	85.1	Confident	50 Å²	50	22.5 Å²	22.5	27%	0.267	12%	0.119	S	C	.	.	S	Bend	trans	-87	-28.1	173.7	-54.1	-44	0	0	0	112.2	R1108 S1189 G1190	D1046-R1108 PolarHBondContact O-NE 3Å; D1046-R1108 PolarHBondContact O-NH2 3.48Å; D1046-R1108 VanDerWaalsContact O-NH2 3.14Å; D1046-S1189 PolarHBondContact N-O 3.04Å; D1046-G1190 WeakPolarHBondContact OD2-CA 3.31Å; D1046-G1190 PolarHBondContact OD2-N 2.92Å
1047	K	80.1	Confident	84.4	Confident	85 Å²	85	19.5 Å²	19.5	37%	0.37	10%	0.099	S	C	.	.	S	Bend	trans	-128.1	145.6	-175.1	-62.9	-171.6	-179.8	-167.6	0	111.4	E1021 N1049	E1021-K1047 HydrophobicContact CG-CD 4.41Å; E1021-K1047 WeakPolarHBondContact OE1-CD 3.32Å; E1021-K1047 WeakPolarHBondContact OE1-CE 3.34Å; E1021-K1047 IonicContact OE1-NZ 2.69Å; E1021-K1047 PolarHBondContact OE1-NZ 2.62Å; E1021-K1047 IonicContact OE2-NZ 3.18Å; E1021-K1047 PolarHBondContact OE2-NZ 3.25Å; K1047-N1049 PolarHBondContact O-N 2.84Å
1048	G	74.8	Confident	83.4	Confident	11 Å²	11	20.8 Å²	20.8	11%	0.113	11%	0.108	C	C	.	.	S	Bend	trans	-87.5	9.8	-174.4	0	0	0	0	0	116.4	I1079 N1081 W1082	G1048-I1079 WeakPolarHBondContact O-CG2 3.35Å; G1048-N1081 PolarHBondContact O-N 3.33Å; G1048-W1082 VanDerWaalsContact CA-CD2 3.48Å; G1048-W1082 PolarHBondContact O-N 3.08Å
1049	N	81.6	Confident	82.2	Confident	45 Å²	45	18.7 Å²	18.7	24%	0.241	10%	0.099	C	C	.	.			trans	-142.2	153.4	-179.9	-72.8	-27.4	0	0	0	109.9	K1047 I1079 N1081	K1047-N1049 PolarHBondContact O-N 2.84Å; N1049-I1079 CarbonylContact C-O 3.55Å; N1049-I1079 WeakPolarHBondContact CA-O 3.17Å; N1049-N1081 PolarHBondContact OD1-N 2.8Å
1050	G	81.8	Confident	80.7	Confident	2 Å²	2	21.1 Å²	21.1	2%	0.021	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139.4	154.5	167.7	0	0	0	0	0	113.9	I1079	G1050-I1079 PolarHBondContact N-O 3.37Å; G1050-I1079 PolarHBondContact O-N 3.36Å
1051	M	85.8	Confident	79.2	Confident	4 Å²	4	27 Å²	27	2%	0.02	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.4	178.4	-171	65.3	55	0	0	111.3	M1077 A1078 G1163 Q1165 D1184 Y1186 F1188	M1051-M1077 VanDerWaalsContact SD-O 3.34Å; M1051-A1078 HydrophobicContact CE-CB 4.35Å; M1051-A1078 HydrophobicContact SD-CB 4.13Å; M1051-G1163 WeakPolarHBondContact CB-O 3.24Å; M1051-G1163 WeakPolarHBondContact CG-O 3.25Å; M1051-Q1165 HydrophobicContact CE-CG 4.39Å; M1051-Q1165 HydrophobicContact CG-CG 4.01Å; M1051-D1184 HydrophobicContact CE-CB 4.37Å; M1051-D1184 WeakPolarHBondContact CE-OD1 3.08Å; M1051-Y1186 PolarHBondContact N-O 3Å; M1051-F1188 WeakPolarHBondContact O-CD1 3.43Å; M1051-F1188 PolarHBondContact O-N 3.3Å
1052	L	90	Very high	77.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-58.1	174	-78	172.3	0	0	0	110.8	M1041 L1043 M1077 I1079 I1114 I1162 G1163 F1188	M1041-L1052 HydrophobicContact CE-CB 4.42Å; M1041-L1052 HydrophobicContact CE-CD2 4.31Å; M1041-L1052 HydrophobicContact SD-CB 4.39Å; L1043-L1052 HydrophobicContact CD2-CD2 3.45Å; L1043-L1052 VanDerWaalsContact CD2-CD2 3.45Å; L1052-M1077 WeakPolarHBondContact CA-O 2.99Å; L1052-M1077 HydrophobicContact CB-CB 4.17Å; L1052-M1077 WeakPolarHBondContact CB-O 3.17Å; L1052-M1077 HydrophobicContact CD1-CB 4.5Å; L1052-M1077 PolarHBondContact N-O 3.37Å; L1052-I1079 HydrophobicContact CD1-CD1 4.24Å; L1052-I1079 HydrophobicContact CD1-CG1 3.91Å; L1052-I1079 HydrophobicContact CD2-CD1 3.69Å; L1052-I1079 HydrophobicContact CD2-CG1 4.3Å; L1052-I1079 HydrophobicContact CG-CD1 3.79Å; L1052-I1079 HydrophobicContact CG-CG1 3.93Å; L1052-I1114 HydrophobicContact CD1-CD1 4.23Å; L1052-I1162 WeakPolarHBondContact O-CA 3.48Å; L1052-G1163 PolarHBondContact O-N 3.25Å; L1052-F1188 HydrophobicContact CD2-CB 4.11Å; L1052-F1188 HydrophobicContact CD2-CD1 3.84Å; L1052-F1188 HydrophobicContact CD2-CD2 4.31Å; L1052-F1188 HydrophobicContact CD2-CE1 4.33Å; L1052-F1188 HydrophobicContact CD2-CG 3.83Å
1053	L	90.4	Very high	76.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	163	174.2	69.5	75.4	0	0	0	113.9	I1039 M1041 F1075 S1076 M1077 I1160 I1161 I1162 M1195	I1039-L1053 HydrophobicContact CG2-CD2 4.27Å; M1041-L1053 HydrophobicContact CE-CD2 4.42Å; M1041-L1053 HydrophobicContact SD-CD2 3.84Å; M1041-L1053 HydrophobicContact SD-CG 4.46Å; L1053-F1075 HydrophobicContact CD1-CD1 3.78Å; L1053-F1075 HydrophobicContact CD1-CE1 3.93Å; L1053-S1076 CarbonylContact O-C 3.55Å; L1053-S1076 WeakPolarHBondContact O-CA 3.25Å; L1053-M1077 HydrophobicContact CD1-CE 4.29Å; L1053-M1077 HydrophobicContact CD2-CE 3.75Å; L1053-M1077 HydrophobicContact CG-CB 4.46Å; L1053-M1077 HydrophobicContact CG-CE 3.84Å; L1053-M1077 PolarHBondContact N-O 3.44Å; L1053-M1077 PolarHBondContact O-N 2.77Å; L1053-I1160 HydrophobicContact CB-CG2 3.98Å; L1053-I1160 HydrophobicContact CD1-CG2 4.35Å; L1053-I1160 HydrophobicContact CD2-CG2 4.21Å; L1053-I1160 HydrophobicContact CG-CG2 4.43Å; L1053-I1161 CarbonylContact C-O 3.59Å; L1053-I1161 WeakPolarHBondContact CA-O 3.11Å; L1053-I1161 WeakPolarHBondContact CB-O 3.42Å; L1053-I1162 HydrophobicContact CB-CG1 4.21Å; L1053-M1195 HydrophobicContact CD2-CE 3.46Å; L1053-M1195 VanDerWaalsContact CD2-CE 3.46Å; L1053-M1195 HydrophobicContact CD2-SD 4.01Å
1054	H	85	Confident	74.9	Confident	10 Å²	10	37 Å²	37	5%	0.046	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.8	173.1	174.2	83.6	0	0	0	110.3	F1075 S1076 I1161 Q1165	H1054-F1075 CarbonylContact C-O 3.59Å; H1054-F1075 WeakPolarHBondContact CA-O 3.38Å; H1054-S1076 PolarHBondContact ND1-OG 2.82Å; H1054-I1161 PolarHBondContact N-O 3.07Å; H1054-I1161 PolarHBondContact O-N 3.18Å; H1054-Q1165 HydrophobicContact CB-CG 4.45Å
1055	Y	82.5	Confident	73.2	Confident	8 Å²	8	44.3 Å²	44.3	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.7	178.1	172.9	-105.5	0	0	0	110.4	I1029 I1033 A1057 Q1074 F1075 I1160	I1029-Y1055 HydrophobicContact CD1-CD2 3.98Å; I1029-Y1055 HydrophobicContact CD1-CE2 3.5Å; I1033-Y1055 HydrophobicContact CB-CE1 3.74Å; I1033-Y1055 HydrophobicContact CD1-CD1 3.83Å; I1033-Y1055 HydrophobicContact CD1-CD2 4.3Å; I1033-Y1055 HydrophobicContact CD1-CE1 3.67Å; I1033-Y1055 HydrophobicContact CD1-CE2 4.15Å; I1033-Y1055 HydrophobicContact CD1-CG 4.12Å; I1033-Y1055 HydrophobicContact CG1-CD1 4.47Å; I1033-Y1055 HydrophobicContact CG1-CE1 3.81Å; I1033-Y1055 HydrophobicContact CG1-CE2 4.25Å; I1033-Y1055 PolarHBondContact N-OH 3.22Å; I1033-Y1055 VanDerWaalsContact N-OH 3.15Å; Y1055-A1057 HydrophobicContact CE1-CB 3.64Å; Y1055-Q1074 WeakPolarHBondContact O-CA 3.3Å; Y1055-F1075 HydrophobicContact CD1-CB 4.48Å; Y1055-F1075 PolarHBondContact N-O 2.94Å; Y1055-F1075 PolarHBondContact O-N 2.7Å; Y1055-I1160 HydrophobicContact CD2-CG1 3.7Å; Y1055-I1160 HydrophobicContact CG-CG1 4.25Å
1056	R	73.3	Confident	72	Confident	44 Å²	44	51.2 Å²	51.2	17%	0.166	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.2	-178.4	-178.2	178.1	180	141.3	8.1	109.3	D1072 N1150	R1056-D1072 HydrophobicContact CG-CB 3.95Å; R1056-D1072 IonicContact CZ-OD2 3.88Å; R1056-D1072 IonicContact NE-OD2 3.23Å; R1056-D1072 PolarHBondContact NE-OD2 2.63Å; R1056-D1072 IonicContact NH2-OD2 2.87Å; R1056-D1072 PolarHBondContact NH2-OD2 2.9Å; R1056-N1150 PolarHBondContact NH2-OD1 3.18Å
1057	A	66.9	Low	70.5	Confident	6 Å²	6	50.3 Å²	50.3	5%	0.05	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.2	175.5	0	0	0	0	0	110.8	Y1055 D1072 H1073	Y1055-A1057 HydrophobicContact CE1-CB 3.64Å; A1057-D1072 CarbonylContact O-C 3.55Å; A1057-D1072 VanDerWaalsContact O-CA 3.29Å; A1057-D1072 WeakPolarHBondContact O-CA 3.25Å; A1057-D1072 WeakPolarHBondContact O-CB 3.2Å; A1057-H1073 HydrophobicContact CB-CB 4.38Å; A1057-H1073 PolarHBondContact N-O 2.92Å; A1057-H1073 PolarHBondContact O-N 3.5Å
1058	P	63	Low	69.2	Low	32 Å²	32	50.3 Å²	50.3	21%	0.208	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-71.5	154.7	173.1	34.9	-34.6	0	0	0	110.2	D1072 L1157	P1058-D1072 WeakPolarHBondContact CA-OD1 3.27Å; P1058-L1157 HydrophobicContact CG-CD1 4.24Å
1059	P	62.8	Low	68.1	Low	6 Å²	6	50.8 Å²	50.8	4%	0.039	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-62.7	142.4	170.1	29.4	-36.5	0	0	0	110.4	E1063 Q1064 T1070 D1072	P1059-E1063 HydrophobicContact CB-CB 4.25Å; P1059-Q1064 HydrophobicContact CB-CG 4.16Å; P1059-Q1064 HydrophobicContact CG-CG 3.89Å; P1059-Q1064 PolarHBondContact O-NE2 3.1Å; P1059-T1070 HydrophobicContact CB-CG2 3.9Å; P1059-T1070 HydrophobicContact CG-CG2 4.49Å; P1059-D1072 WeakPolarHBondContact CD-OD1 3.38Å
1060	S	61.2	Low	67.2	Low	52 Å²	52	49.4 Å²	49.4	36%	0.364	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.4	160.9	179	63.8	0	0	0	0	112.6	Q1062 E1063 Q1064	S1060-Q1062 PolarHBondContact O-N 3.01Å; S1060-E1063 WeakPolarHBondContact CB-OE2 3.44Å; S1060-E1063 PolarHBondContact N-OE2 2.91Å; S1060-E1063 PolarHBondContact O-N 3.1Å; S1060-E1063 VanDerWaalsContact OG-CD 3.23Å; S1060-E1063 WeakPolarHBondContact OG-CG 3.11Å; S1060-E1063 PolarHBondContact OG-N 2.05Å; S1060-E1063 PolarHBondContact OG-OE2 3Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.49Å; S1060-Q1064 PolarHBondContact O-N 3.15Å
1061	E	59.4	Low	66.4	Low	164 Å²	164	50.2 Å²	50.2	77%	0.766	25%	0.249	S	C	*	.	H	α-helix	trans	-55.8	-34.4	176.1	-68.8	-170.2	145.9	0	0	112.4	M1065	E1061-M1065 WeakPolarHBondContact O-CB 3.3Å; E1061-M1065 WeakPolarHBondContact O-CG 3.47Å; E1061-M1065 PolarHBondContact O-N 3.2Å
1062	Q	58.4	Low	65.6	Low	146 Å²	146	51.8 Å²	51.8	68%	0.682	26%	0.258	S	S	*	.	H	α-helix	trans	-68.3	-42.6	175.6	-68.5	-173.9	-9.3	0	0	111.9	S1060 M1065 I1066	S1060-Q1062 PolarHBondContact O-N 3.01Å; Q1062-M1065 WeakPolarHBondContact O-CB 3.39Å; Q1062-M1065 PolarHBondContact O-N 3.26Å; Q1062-I1066 WeakPolarHBondContact O-CD1 3.45Å; Q1062-I1066 VanDerWaalsContact O-CG1 3.22Å; Q1062-I1066 WeakPolarHBondContact O-CG1 3.24Å; Q1062-I1066 PolarHBondContact O-N 3.32Å
1063	E	63.4	Low	65	Low	49 Å²	49	53 Å²	53	23%	0.229	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-40.4	176.8	-67.2	164.5	133.2	0	0	111	P1059 S1060 M1065 I1066 S1067 T1070 H1073 S1092	P1059-E1063 HydrophobicContact CB-CB 4.25Å; S1060-E1063 WeakPolarHBondContact CB-OE2 3.44Å; S1060-E1063 PolarHBondContact N-OE2 2.91Å; S1060-E1063 PolarHBondContact O-N 3.1Å; S1060-E1063 VanDerWaalsContact OG-CD 3.23Å; S1060-E1063 WeakPolarHBondContact OG-CG 3.11Å; S1060-E1063 PolarHBondContact OG-N 2.05Å; S1060-E1063 PolarHBondContact OG-OE2 3Å; E1063-M1065 VanDerWaalsContact C-N 3.26Å; E1063-M1065 PolarHBondContact O-N 3.02Å; E1063-I1066 PolarHBondContact O-N 3.49Å; E1063-I1066 VanDerWaalsContact O-N 3.13Å; E1063-S1067 PolarHBondContact O-N 3.16Å; E1063-T1070 HydrophobicContact CB-CG2 4.06Å; E1063-T1070 WeakPolarHBondContact O-CG2 3.37Å; E1063-H1073 IonicContact OE1-CE1 3.84Å; E1063-H1073 PolarHBondContact OE1-CE1 3.3Å; E1063-H1073 VanDerWaalsContact OE1-CE1 3.26Å; E1063-H1073 IonicContact OE1-NE2 3.07Å; E1063-H1073 PolarHBondContact OE1-NE2 3.19Å; E1063-H1073 VanDerWaalsContact OE1-NE2 3.09Å; E1063-H1073 IonicContact OE2-NE2 2.72Å; E1063-H1073 PolarHBondContact OE2-NE2 3.1Å; E1063-S1092 WeakPolarHBondContact CG-OG 3.47Å; E1063-S1092 PolarHBondContact OE1-OG 2.06Å
1064	Q	61.9	Low	64.5	Low	52 Å²	52	53.5 Å²	53.5	24%	0.243	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-25	172.6	-64.8	177.7	29.9	0	0	113.5	H541 P1059 S1060	H541-Q1064 VanDerWaalsContact CG-OE1 3.22Å; H541-Q1064 PolarHBondContact ND1-OE1 3.36Å; H541-Q1064 VanDerWaalsContact ND1-OE1 3.16Å; P1059-Q1064 HydrophobicContact CB-CG 4.16Å; P1059-Q1064 HydrophobicContact CG-CG 3.89Å; P1059-Q1064 PolarHBondContact O-NE2 3.1Å; S1060-Q1064 WeakPolarHBondContact O-CG 3.49Å; S1060-Q1064 PolarHBondContact O-N 3.15Å
1065	M	49.7	Very low	64.4	Low	164 Å²	164	53.4 Å²	53.4	81%	0.808	27%	0.265	S	S	*	.	H	α-helix	trans	-81	-28.4	171.7	-77	174.6	64.5	0	0	112.9	E1061 Q1062 E1063	E1061-M1065 WeakPolarHBondContact O-CB 3.3Å; E1061-M1065 WeakPolarHBondContact O-CG 3.47Å; E1061-M1065 PolarHBondContact O-N 3.2Å; Q1062-M1065 WeakPolarHBondContact O-CB 3.39Å; Q1062-M1065 PolarHBondContact O-N 3.26Å; E1063-M1065 VanDerWaalsContact C-N 3.26Å; E1063-M1065 PolarHBondContact O-N 3.02Å
1066	I	60.2	Low	64.6	Low	145 Å²	145	53.5 Å²	53.5	74%	0.744	27%	0.267	S	S	*	.	H	α-helix	trans	-86.8	-52.6	-178.2	-69.9	162.6	0	0	0	111.3	Q1062 E1063	Q1062-I1066 WeakPolarHBondContact O-CD1 3.45Å; Q1062-I1066 VanDerWaalsContact O-CG1 3.22Å; Q1062-I1066 WeakPolarHBondContact O-CG1 3.24Å; Q1062-I1066 PolarHBondContact O-N 3.32Å; E1063-I1066 PolarHBondContact O-N 3.49Å; E1063-I1066 VanDerWaalsContact O-N 3.13Å
1067	S	49	Very low	65.5	Low	31 Å²	31	51.4 Å²	51.4	22%	0.217	26%	0.259	C	S	.	.			trans	-114.2	127.2	177	178.1	0	0	0	0	110.5	E1063 D1069 T1070	E1063-S1067 PolarHBondContact O-N 3.16Å; S1067-D1069 PolarHBondContact OG-N 3.41Å; S1067-D1069 PolarHBondContact OG-O 3.12Å; S1067-T1070 WeakPolarHBondContact O-CG2 3.46Å; S1067-T1070 PolarHBondContact O-OG1 2.78Å
1068	R	52.8	Low	66.6	Low	86 Å²	86	51.3 Å²	51.3	33%	0.325	26%	0.258	S	S	.	.	S	Bend	trans	-76.1	-29.9	176	-83.9	153.3	159.9	-137.8	-22.3	111.3	P538 H542 A559 T1070	P538-R1068 VanDerWaalsContact CA-O 3.31Å; P538-R1068 WeakPolarHBondContact CA-O 3.43Å; P538-R1068 HydrophobicContact CB-CB 3.96Å; P538-R1068 HydrophobicContact CG-CB 4.09Å; H542-R1068 PolarHBondContact NE2-NH2 3.16Å; H542-R1068 VanDerWaalsContact NE2-NH2 3.2Å; A559-R1068 HydrophobicContact CB-CB 4.48Å; A559-R1068 HydrophobicContact CB-CG 3.91Å; A559-R1068 PolarHBondContact O-NH1 3.13Å; A559-R1068 VanDerWaalsContact O-NH1 3.08Å; A559-R1068 PolarHBondContact O-NH2 3.4Å; R1068-T1070 PolarHBondContact O-N 3.04Å
1069	D	51.3	Low	67.8	Low	21 Å²	21	49.8 Å²	49.8	11%	0.112	25%	0.248	C	C	.	.	S	Bend	trans	-94.4	78	167.2	-68.7	-52.8	0	0	0	110	A535 S536 P538 S1067 P1094	A535-D1069 HydrophobicContact CB-CB 3.9Å; A535-D1069 WeakPolarHBondContact CB-OD1 3.1Å; A535-D1069 WeakPolarHBondContact CB-OD2 3.26Å; S536-D1069 PolarHBondContact N-OD1 3.5Å; S536-D1069 PolarHBondContact OG-O 2.87Å; P538-D1069 WeakPolarHBondContact CD-OD1 3.5Å; P538-D1069 WeakPolarHBondContact CG-OD1 3.19Å; S1067-D1069 PolarHBondContact OG-N 3.41Å; S1067-D1069 PolarHBondContact OG-O 3.12Å; D1069-P1094 HydrophobicContact CB-CB 4.2Å; D1069-P1094 HydrophobicContact CB-CG 3.83Å; D1069-P1094 WeakPolarHBondContact O-CD 3.17Å
1070	T	62.8	Low	68.8	Low	16 Å²	16	49.6 Å²	49.6	10%	0.098	25%	0.247	C	C	.	.			trans	-103.9	113.7	171.4	31.9	0	0	0	0	111.8	S536 P1059 E1063 S1067 R1068 G1091	S536-T1070 WeakPolarHBondContact CB-O 3.14Å; S536-T1070 PolarHBondContact OG-N 3.24Å; P1059-T1070 HydrophobicContact CB-CG2 3.9Å; P1059-T1070 HydrophobicContact CG-CG2 4.49Å; E1063-T1070 HydrophobicContact CB-CG2 4.06Å; E1063-T1070 WeakPolarHBondContact O-CG2 3.37Å; S1067-T1070 WeakPolarHBondContact O-CG2 3.46Å; S1067-T1070 PolarHBondContact O-OG1 2.78Å; R1068-T1070 PolarHBondContact O-N 3.04Å; T1070-G1091 CarbonylContact C-O 3.59Å; T1070-G1091 WeakPolarHBondContact CA-O 3.34Å
1071	Q	64.6	Low	69.9	Low	18 Å²	18	51.4 Å²	51.4	8%	0.084	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-79.5	164.5	173.4	-64.1	-176.5	-27.2	0	0	109.5	S536 H1073 G1091 P1094 N1095 S1148	S536-Q1071 WeakPolarHBondContact OG-CG 3.36Å; S536-Q1071 PolarHBondContact OG-N 3.39Å; S536-Q1071 VanDerWaalsContact OG-N 3.11Å; Q1071-H1073 PolarHBondContact O-N 3.05Å; Q1071-G1091 PolarHBondContact N-O 3.46Å; Q1071-G1091 CarbonylContact O-C 3.47Å; Q1071-G1091 WeakPolarHBondContact O-CA 3.3Å; Q1071-P1094 HydrophobicContact CG-CB 4.14Å; Q1071-N1095 PolarHBondContact NE2-OD1 2.86Å; Q1071-S1148 PolarHBondContact NE2-OG 2.89Å; Q1071-S1148 VanDerWaalsContact NE2-OG 3.12Å
1072	D	70.1	Confident	71.3	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.203	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-66.8	130.5	167.4	-69.7	-19.5	0	0	0	109.3	R1056 A1057 P1058 P1059 Q1074	R1056-D1072 HydrophobicContact CG-CB 3.95Å; R1056-D1072 IonicContact CZ-OD2 3.88Å; R1056-D1072 IonicContact NE-OD2 3.23Å; R1056-D1072 PolarHBondContact NE-OD2 2.63Å; R1056-D1072 IonicContact NH2-OD2 2.87Å; R1056-D1072 PolarHBondContact NH2-OD2 2.9Å; A1057-D1072 CarbonylContact O-C 3.55Å; A1057-D1072 VanDerWaalsContact O-CA 3.29Å; A1057-D1072 WeakPolarHBondContact O-CA 3.25Å; A1057-D1072 WeakPolarHBondContact O-CB 3.2Å; P1058-D1072 WeakPolarHBondContact CA-OD1 3.27Å; P1059-D1072 WeakPolarHBondContact CD-OD1 3.38Å; D1072-Q1074 WeakPolarHBondContact O-CG 3.25Å; D1072-Q1074 PolarHBondContact O-N 3.49Å
1073	H	75.7	Confident	72.8	Confident	24 Å²	24	45.7 Å²	45.7	11%	0.111	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	120.2	171.2	-63.8	-77.9	0	0	0	108.9	A1057 E1063 Q1071 Y1088 I1089 G1091	A1057-H1073 HydrophobicContact CB-CB 4.38Å; A1057-H1073 PolarHBondContact N-O 2.92Å; A1057-H1073 PolarHBondContact O-N 3.5Å; E1063-H1073 IonicContact OE1-CE1 3.84Å; E1063-H1073 PolarHBondContact OE1-CE1 3.3Å; E1063-H1073 VanDerWaalsContact OE1-CE1 3.26Å; E1063-H1073 IonicContact OE1-NE2 3.07Å; E1063-H1073 PolarHBondContact OE1-NE2 3.19Å; E1063-H1073 VanDerWaalsContact OE1-NE2 3.09Å; E1063-H1073 IonicContact OE2-NE2 2.72Å; E1063-H1073 PolarHBondContact OE2-NE2 3.1Å; Q1071-H1073 PolarHBondContact O-N 3.05Å; H1073-Y1088 PolarHBondContact ND1-OH 3.28Å; H1073-I1089 WeakPolarHBondContact CA-O 3.43Å; H1073-G1091 WeakPolarHBondContact ND1-CA 3.45Å; H1073-G1091 PolarHBondContact ND1-N 3.32Å
1074	Q	80.1	Confident	74.1	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.7	178.1	-51.3	-167.2	13.3	0	0	111.1	Y1055 D1072 Y1088 I1089 D1149	Y1055-Q1074 WeakPolarHBondContact O-CA 3.3Å; D1072-Q1074 WeakPolarHBondContact O-CG 3.25Å; D1072-Q1074 PolarHBondContact O-N 3.49Å; Q1074-Y1088 CarbonylContact O-C 3.54Å; Q1074-Y1088 WeakPolarHBondContact O-CA 3.23Å; Q1074-Y1088 WeakPolarHBondContact O-CD2 3.29Å; Q1074-I1089 HydrophobicContact CB-CB 3.96Å; Q1074-I1089 HydrophobicContact CB-CD1 4.08Å; Q1074-I1089 HydrophobicContact CB-CG1 4Å; Q1074-I1089 HydrophobicContact CG-CB 4.34Å; Q1074-I1089 HydrophobicContact CG-CD1 4.16Å; Q1074-I1089 PolarHBondContact N-O 3.38Å; Q1074-I1089 VanDerWaalsContact N-O 3.08Å; Q1074-I1089 PolarHBondContact O-N 2.85Å; Q1074-D1149 PolarHBondContact NE2-O 3.09Å
1075	F	84.1	Confident	75.5	Confident	7 Å²	7	41 Å²	41	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.3	176.7	-178.3	-84.3	0	0	0	109	I1039 L1053 H1054 Y1055 M1077 L1086 I1118	I1039-F1075 HydrophobicContact CD1-CD1 4.17Å; I1039-F1075 HydrophobicContact CD1-CE1 3.7Å; I1039-F1075 HydrophobicContact CD1-CZ 4.22Å; L1053-F1075 HydrophobicContact CD1-CD1 3.78Å; L1053-F1075 HydrophobicContact CD1-CE1 3.93Å; H1054-F1075 CarbonylContact C-O 3.59Å; H1054-F1075 WeakPolarHBondContact CA-O 3.38Å; Y1055-F1075 HydrophobicContact CD1-CB 4.48Å; Y1055-F1075 PolarHBondContact N-O 2.94Å; Y1055-F1075 PolarHBondContact O-N 2.7Å; F1075-M1077 HydrophobicContact CD1-CG 4.49Å; F1075-M1077 HydrophobicContact CE1-CE 4.07Å; F1075-M1077 HydrophobicContact CE1-CG 3.64Å; F1075-M1077 HydrophobicContact CE1-SD 3.9Å; F1075-M1077 HydrophobicContact CZ-CG 3.99Å; F1075-M1077 HydrophobicContact CZ-SD 3.95Å; F1075-L1086 HydrophobicContact CD2-CD2 4.25Å; F1075-L1086 HydrophobicContact CE2-CD1 3.57Å; F1075-L1086 HydrophobicContact CE2-CD2 3.96Å; F1075-L1086 HydrophobicContact CE2-CG 3.86Å; F1075-L1086 HydrophobicContact CZ-CD1 3.62Å; F1075-L1086 HydrophobicContact CZ-CG 3.96Å; F1075-I1118 HydrophobicContact CD2-CD1 3.84Å; F1075-I1118 HydrophobicContact CD2-CG1 3.85Å; F1075-I1118 HydrophobicContact CE2-CD1 4.4Å; F1075-I1118 HydrophobicContact CE2-CG1 3.96Å
1076	S	86.6	Confident	77.5	Confident	10 Å²	10	33.2 Å²	33.2	7%	0.07	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.3	178.6	-49.4	0	0	0	0	110.7	L1053 H1054 L1086 K1087	L1053-S1076 CarbonylContact O-C 3.55Å; L1053-S1076 WeakPolarHBondContact O-CA 3.25Å; H1054-S1076 PolarHBondContact ND1-OG 2.82Å; S1076-L1086 CarbonylContact O-C 3.57Å; S1076-L1086 WeakPolarHBondContact O-CA 3.4Å; S1076-K1087 PolarHBondContact N-O 3.05Å; S1076-K1087 PolarHBondContact O-N 3.38Å
1077	M	91.2	Very high	78.9	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139	171.3	-65.1	-166.4	-62	0	0	110.2	I1039 M1041 M1051 L1052 L1053 F1075 V1085 L1086 A1116	I1039-M1077 HydrophobicContact CG2-CE 3.98Å; M1041-M1077 HydrophobicContact CG-CE 4.4Å; M1041-M1077 HydrophobicContact SD-CE 3.58Å; M1041-M1077 VanDerWaalsContact SD-CE 3.58Å; M1051-M1077 VanDerWaalsContact SD-O 3.34Å; L1052-M1077 WeakPolarHBondContact CA-O 2.99Å; L1052-M1077 HydrophobicContact CB-CB 4.17Å; L1052-M1077 WeakPolarHBondContact CB-O 3.17Å; L1052-M1077 HydrophobicContact CD1-CB 4.5Å; L1052-M1077 PolarHBondContact N-O 3.37Å; L1053-M1077 HydrophobicContact CD1-CE 4.29Å; L1053-M1077 HydrophobicContact CD2-CE 3.75Å; L1053-M1077 HydrophobicContact CG-CB 4.46Å; L1053-M1077 HydrophobicContact CG-CE 3.84Å; L1053-M1077 PolarHBondContact N-O 3.44Å; L1053-M1077 PolarHBondContact O-N 2.77Å; F1075-M1077 HydrophobicContact CD1-CG 4.49Å; F1075-M1077 HydrophobicContact CE1-CE 4.07Å; F1075-M1077 HydrophobicContact CE1-CG 3.64Å; F1075-M1077 HydrophobicContact CE1-SD 3.9Å; F1075-M1077 HydrophobicContact CZ-CG 3.99Å; F1075-M1077 HydrophobicContact CZ-SD 3.95Å; M1077-V1085 WeakPolarHBondContact CA-O 3.31Å; M1077-L1086 HydrophobicContact CG-CB 4.24Å; M1077-L1086 HydrophobicContact CG-CD1 4.46Å; M1077-L1086 HydrophobicContact CG-CG 4.07Å; M1077-L1086 HydrophobicContact SD-CD1 4.47Å; M1077-A1116 HydrophobicContact SD-CB 3.63Å
1078	A	90.3	Very high	80.7	Confident	3 Å²	3	27.4 Å²	27.4	3%	0.025	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	166	176.4	0	0	0	0	0	111	M1051 V1084 V1085 L1182	M1051-A1078 HydrophobicContact CE-CB 4.35Å; M1051-A1078 HydrophobicContact SD-CB 4.13Å; A1078-V1084 WeakPolarHBondContact O-CA 3.47Å; A1078-V1085 PolarHBondContact N-O 2.93Å; A1078-V1085 PolarHBondContact O-N 3.04Å; A1078-L1182 HydrophobicContact CB-CD2 3.72Å; A1078-L1182 HydrophobicContact CB-CG 3.95Å
1079	I	88.3	Confident	82.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	134.6	166.8	-52.8	134	0	0	0	108.4	L1045 G1048 N1049 G1050 L1052 R1083 L1106 F1188	L1045-I1079 HydrophobicContact CD1-CD1 3.47Å; L1045-I1079 VanDerWaalsContact CD1-CD1 3.47Å; L1045-I1079 HydrophobicContact CD1-CG1 3.9Å; L1045-I1079 HydrophobicContact CD1-CG2 4.31Å; L1045-I1079 HydrophobicContact CD2-CD1 3.6Å; L1045-I1079 HydrophobicContact CG-CD1 4.19Å; G1048-I1079 WeakPolarHBondContact O-CG2 3.35Å; N1049-I1079 CarbonylContact C-O 3.55Å; N1049-I1079 WeakPolarHBondContact CA-O 3.17Å; G1050-I1079 PolarHBondContact N-O 3.37Å; G1050-I1079 PolarHBondContact O-N 3.36Å; L1052-I1079 HydrophobicContact CD1-CD1 4.24Å; L1052-I1079 HydrophobicContact CD1-CG1 3.91Å; L1052-I1079 HydrophobicContact CD2-CD1 3.69Å; L1052-I1079 HydrophobicContact CD2-CG1 4.3Å; L1052-I1079 HydrophobicContact CG-CD1 3.79Å; L1052-I1079 HydrophobicContact CG-CG1 3.93Å; I1079-R1083 CarbonylContact C-O 3.56Å; I1079-R1083 VanDerWaalsContact CA-O 3.3Å; I1079-R1083 WeakPolarHBondContact CA-O 3.13Å; I1079-L1106 HydrophobicContact CG1-CD1 4.18Å; I1079-L1106 HydrophobicContact CG2-CD1 4.22Å; I1079-F1188 HydrophobicContact CD1-CB 3.66Å
1080	S	83.4	Confident	83.5	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.014	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	107.3	-172	-173.7	0	0	0	0	108.2	W1082 R1083 D1181	S1080-W1082 VanDerWaalsContact C-N 3.28Å; S1080-W1082 PolarHBondContact O-N 3.04Å; S1080-R1083 PolarHBondContact N-O 2.54Å; S1080-R1083 WeakPolarHBondContact O-CB 3.09Å; S1080-R1083 PolarHBondContact O-N 3.28Å; S1080-D1181 WeakPolarHBondContact CA-O 3.25Å; S1080-D1181 WeakPolarHBondContact OG-CA 3.48Å; S1080-D1181 WeakPolarHBondContact OG-CB 3.43Å; S1080-D1181 PolarHBondContact OG-O 2.87Å; S1080-D1181 PolarHBondContact OG-OD1 3.38Å
1081	N	85.6	Confident	83.9	Confident	91 Å²	91	22.5 Å²	22.5	49%	0.487	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	49	-177.7	-72.9	-57.3	0	0	0	113.2	G1048 N1049 R1083 D1181	G1048-N1081 PolarHBondContact O-N 3.33Å; N1049-N1081 PolarHBondContact OD1-N 2.8Å; N1081-R1083 VanDerWaalsContact C-N 3.26Å; N1081-R1083 PolarHBondContact O-N 2.87Å; N1081-D1181 PolarHBondContact ND2-OD1 3.47Å
1082	W	88.6	Confident	84.1	Confident	73 Å²	73	23.2 Å²	23.2	28%	0.277	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	11.1	-174.6	-57	93.5	0	0	0	116.3	L1045 G1048 S1080 N1105 L1106 R1108	L1045-W1082 HydrophobicContact CB-CZ3 4.24Å; G1048-W1082 VanDerWaalsContact CA-CD2 3.48Å; G1048-W1082 PolarHBondContact O-N 3.08Å; S1080-W1082 VanDerWaalsContact C-N 3.28Å; S1080-W1082 PolarHBondContact O-N 3.04Å; W1082-N1105 HydrophobicContact CB-CB 4.26Å; W1082-N1105 CarbonylContact O-C 3.59Å; W1082-N1105 VanDerWaalsContact O-CA 3.27Å; W1082-N1105 WeakPolarHBondContact O-CA 3.24Å; W1082-L1106 PolarHBondContact O-N 3.21Å; W1082-R1108 HydrophobicContact CH2-CB 3.53Å; W1082-R1108 HydrophobicContact CH2-CG 3.7Å; W1082-R1108 HydrophobicContact CZ2-CB 4.22Å; W1082-R1108 HydrophobicContact CZ2-CG 4.45Å; W1082-R1108 HydrophobicContact CZ3-CB 3.86Å; W1082-R1108 HydrophobicContact CZ3-CG 4.37Å
1083	R	89.6	Confident	84.2	Confident	117 Å²	117	23.7 Å²	23.7	44%	0.442	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	149.3	169.7	-68	179.7	177.1	167.6	-2.7	111.3	I1079 S1080 N1081 N1105	I1079-R1083 CarbonylContact C-O 3.56Å; I1079-R1083 VanDerWaalsContact CA-O 3.3Å; I1079-R1083 WeakPolarHBondContact CA-O 3.13Å; S1080-R1083 PolarHBondContact N-O 2.54Å; S1080-R1083 WeakPolarHBondContact O-CB 3.09Å; S1080-R1083 PolarHBondContact O-N 3.28Å; N1081-R1083 VanDerWaalsContact C-N 3.26Å; N1081-R1083 PolarHBondContact O-N 2.87Å; R1083-N1105 VanDerWaalsContact CG-OD1 3.27Å; R1083-N1105 WeakPolarHBondContact CG-OD1 3.47Å; R1083-N1105 PolarHBondContact NE-OD1 3.23Å
1084	V	90.4	Very high	83.7	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.9	165.7	-177.3	0	0	0	0	107.9	A1078 Y1101 S1102 L1106 I1114 I1125 I1127	A1078-V1084 WeakPolarHBondContact O-CA 3.47Å; V1084-Y1101 WeakPolarHBondContact O-CA 3.32Å; V1084-S1102 PolarHBondContact N-OG 3.14Å; V1084-S1102 PolarHBondContact O-N 2.87Å; V1084-L1106 HydrophobicContact CG2-CD1 3.78Å; V1084-L1106 HydrophobicContact CG2-CD2 4.43Å; V1084-L1106 HydrophobicContact CG2-CG 4.28Å; V1084-I1114 HydrophobicContact CG1-CG2 4.08Å; V1084-I1114 HydrophobicContact CG2-CD1 3.7Å; V1084-I1114 HydrophobicContact CG2-CG1 4.05Å; V1084-I1114 HydrophobicContact CG2-CG2 3.98Å; V1084-I1125 HydrophobicContact CB-CD1 4.27Å; V1084-I1125 HydrophobicContact CB-CG2 4.28Å; V1084-I1125 HydrophobicContact CG1-CD1 3.97Å; V1084-I1125 HydrophobicContact CG1-CG1 4.44Å; V1084-I1125 HydrophobicContact CG1-CG2 4.33Å; V1084-I1125 WeakPolarHBondContact O-CD1 3.46Å; V1084-I1127 HydrophobicContact CB-CD1 4.45Å; V1084-I1127 HydrophobicContact CG2-CD1 3.8Å; V1084-I1127 HydrophobicContact CG2-CG1 4.43Å
1085	V	90.2	Very high	83.1	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.012	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.2	173.2	-171.4	0	0	0	0	108.1	M1077 A1078 L1099 V1100 Y1101 L1182	M1077-V1085 WeakPolarHBondContact CA-O 3.31Å; A1078-V1085 PolarHBondContact N-O 2.93Å; A1078-V1085 PolarHBondContact O-N 3.04Å; V1085-L1099 HydrophobicContact CG1-CD2 4.06Å; V1085-V1100 WeakPolarHBondContact CA-O 3.48Å; V1085-Y1101 HydrophobicContact CB-CD1 4.47Å; V1085-Y1101 HydrophobicContact CB-CE1 4.44Å; V1085-Y1101 HydrophobicContact CG1-CD1 4.26Å; V1085-Y1101 HydrophobicContact CG1-CE1 3.96Å; V1085-Y1101 HydrophobicContact CG1-CE2 4.37Å; V1085-Y1101 HydrophobicContact CG2-CD1 3.54Å; V1085-Y1101 HydrophobicContact CG2-CE1 3.58Å; V1085-Y1101 HydrophobicContact CG2-CG 4.39Å; V1085-L1182 HydrophobicContact CB-CD1 4.23Å; V1085-L1182 HydrophobicContact CG1-CD1 4.23Å; V1085-L1182 HydrophobicContact CG2-CD1 4.24Å
1086	L	91.9	Very high	82.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.9	175.6	-177	173.1	0	0	0	108.2	F1075 S1076 M1077 L1099 V1100 A1116 P1123 I1125	F1075-L1086 HydrophobicContact CD2-CD2 4.25Å; F1075-L1086 HydrophobicContact CE2-CD1 3.57Å; F1075-L1086 HydrophobicContact CE2-CD2 3.96Å; F1075-L1086 HydrophobicContact CE2-CG 3.86Å; F1075-L1086 HydrophobicContact CZ-CD1 3.62Å; F1075-L1086 HydrophobicContact CZ-CG 3.96Å; S1076-L1086 CarbonylContact O-C 3.57Å; S1076-L1086 WeakPolarHBondContact O-CA 3.4Å; M1077-L1086 HydrophobicContact CG-CB 4.24Å; M1077-L1086 HydrophobicContact CG-CD1 4.46Å; M1077-L1086 HydrophobicContact CG-CG 4.07Å; M1077-L1086 HydrophobicContact SD-CD1 4.47Å; L1086-L1099 WeakPolarHBondContact O-CA 3.38Å; L1086-V1100 HydrophobicContact CB-CG1 3.85Å; L1086-V1100 HydrophobicContact CD1-CG1 4.38Å; L1086-V1100 HydrophobicContact CD2-CG1 4.39Å; L1086-V1100 HydrophobicContact CG-CG1 4.44Å; L1086-V1100 PolarHBondContact N-O 3.38Å; L1086-V1100 PolarHBondContact O-N 3.09Å; L1086-A1116 HydrophobicContact CD1-CB 3.84Å; L1086-P1123 HydrophobicContact CD1-CB 4.39Å; L1086-P1123 HydrophobicContact CD2-CB 3.61Å; L1086-I1125 HydrophobicContact CB-CD1 3.88Å; L1086-I1125 HydrophobicContact CB-CG1 4.05Å; L1086-I1125 HydrophobicContact CD1-CG1 4.25Å
1087	K	89.4	Confident	82.7	Confident	51 Å²	51	26 Å²	26	22%	0.222	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	109.4	172.7	178.4	-169.4	173.8	-169.5	0	107.7	S1076 I1097 L1099 D1149	S1076-K1087 PolarHBondContact N-O 3.05Å; S1076-K1087 PolarHBondContact O-N 3.38Å; K1087-I1097 HydrophobicContact CG-CG2 3.79Å; K1087-L1099 HydrophobicContact CB-CD2 3.76Å; K1087-L1099 HydrophobicContact CG-CD2 4.15Å; K1087-D1149 IonicContact NZ-OD2 3.48Å; K1087-D1149 PolarHBondContact NZ-OD2 2.71Å
1088	Y	88.5	Confident	82.5	Confident	4 Å²	4	26.1 Å²	26.1	2%	0.016	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	121.4	170.9	173	-115.7	0	0	0	109.1	Q1035 H1073 Q1074 D1090 I1097 L1098 I1118	Q1035-Y1088 PolarHBondContact NE2-OH 3.31Å; Q1035-Y1088 VanDerWaalsContact NE2-OH 3.15Å; H1073-Y1088 PolarHBondContact ND1-OH 3.28Å; Q1074-Y1088 CarbonylContact O-C 3.54Å; Q1074-Y1088 WeakPolarHBondContact O-CA 3.23Å; Q1074-Y1088 WeakPolarHBondContact O-CD2 3.29Å; Y1088-D1090 HydrophobicContact CD1-CB 4.19Å; Y1088-D1090 HydrophobicContact CE1-CB 3.52Å; Y1088-D1090 WeakPolarHBondContact CE1-OD1 3.33Å; Y1088-D1090 PolarHBondContact OH-OD1 2.92Å; Y1088-I1097 CarbonylContact O-C 3.6Å; Y1088-I1097 WeakPolarHBondContact O-CA 3.24Å; Y1088-L1098 HydrophobicContact CD1-CB 4.42Å; Y1088-L1098 HydrophobicContact CD1-CD1 4.2Å; Y1088-L1098 PolarHBondContact N-O 3.35Å; Y1088-L1098 PolarHBondContact O-N 3.12Å; Y1088-I1118 HydrophobicContact CD1-CG2 4.37Å; Y1088-I1118 HydrophobicContact CD2-CD1 3.51Å; Y1088-I1118 HydrophobicContact CD2-CG1 4.01Å; Y1088-I1118 HydrophobicContact CE1-CG2 4.11Å; Y1088-I1118 HydrophobicContact CE2-CD1 3.38Å; Y1088-I1118 HydrophobicContact CE2-CG1 4.21Å; Y1088-I1118 HydrophobicContact CG-CD1 4.26Å; Y1088-I1118 HydrophobicContact CG-CG1 4.28Å
1089	I	83.6	Confident	82.4	Confident	8 Å²	8	26.7 Å²	26.7	4%	0.041	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.5	168.5	-49.6	-173.4	0	0	0	106.7	H1073 Q1074 G1091 R1096 I1097	H1073-I1089 WeakPolarHBondContact CA-O 3.43Å; Q1074-I1089 HydrophobicContact CB-CB 3.96Å; Q1074-I1089 HydrophobicContact CB-CD1 4.08Å; Q1074-I1089 HydrophobicContact CB-CG1 4Å; Q1074-I1089 HydrophobicContact CG-CB 4.34Å; Q1074-I1089 HydrophobicContact CG-CD1 4.16Å; Q1074-I1089 PolarHBondContact N-O 3.38Å; Q1074-I1089 VanDerWaalsContact N-O 3.08Å; Q1074-I1089 PolarHBondContact O-N 2.85Å; I1089-G1091 PolarHBondContact O-N 3.42Å; I1089-R1096 WeakPolarHBondContact CA-O 3.39Å; I1089-I1097 HydrophobicContact CD1-CD1 4.45Å; I1089-I1097 HydrophobicContact CG1-CD1 4.5Å; I1089-I1097 HydrophobicContact CG1-CG1 4.19Å
1090	D	77.5	Confident	82.6	Confident	12 Å²	12	26.7 Å²	26.7	6%	0.064	13%	0.128	C	C	.	.			trans	-82.5	95.3	-175	-164.4	20.9	0	0	0	109	Y1088 S1092 V1093 R1096	Y1088-D1090 HydrophobicContact CD1-CB 4.19Å; Y1088-D1090 HydrophobicContact CE1-CB 3.52Å; Y1088-D1090 WeakPolarHBondContact CE1-OD1 3.33Å; Y1088-D1090 PolarHBondContact OH-OD1 2.92Å; D1090-S1092 PolarHBondContact O-N 3.14Å; D1090-V1093 CarbonylContact O-C 3.56Å; D1090-V1093 PolarHBondContact O-N 2.72Å; D1090-R1096 HydrophobicContact CB-CB 4.21Å; D1090-R1096 HydrophobicContact CB-CG 4.33Å; D1090-R1096 PolarHBondContact N-O 2.76Å; D1090-R1096 IonicContact OD2-CZ 2.72Å; D1090-R1096 IonicContact OD2-NH1 3.04Å; D1090-R1096 PolarHBondContact OD2-NH1 2.89Å
1091	G	72	Confident	82.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.5	-171.8	0	0	0	0	0	113.8	T1070 Q1071 H1073 I1089 V1093	T1070-G1091 CarbonylContact C-O 3.59Å; T1070-G1091 WeakPolarHBondContact CA-O 3.34Å; Q1071-G1091 PolarHBondContact N-O 3.46Å; Q1071-G1091 CarbonylContact O-C 3.47Å; Q1071-G1091 WeakPolarHBondContact O-CA 3.3Å; H1073-G1091 WeakPolarHBondContact ND1-CA 3.45Å; H1073-G1091 PolarHBondContact ND1-N 3.32Å; I1089-G1091 PolarHBondContact O-N 3.42Å; G1091-V1093 VanDerWaalsContact C-N 3.31Å; G1091-V1093 PolarHBondContact O-N 3.3Å
1092	S	70.1	Confident	83.2	Confident	33 Å²	33	25.6 Å²	25.6	23%	0.231	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9	176.2	-73.1	0	0	0	0	115.1	E1063 D1090	E1063-S1092 WeakPolarHBondContact CG-OG 3.47Å; E1063-S1092 PolarHBondContact OE1-OG 2.06Å; D1090-S1092 PolarHBondContact O-N 3.14Å
1093	V	70.7	Confident	83.1	Confident	48 Å²	48	26.4 Å²	26.4	29%	0.291	12%	0.123	S	C	.	.	S	Bend	trans	-133.2	98.4	173.7	-170.3	0	0	0	0	108.9	D1090 G1091 N1095 R1096 W1142	D1090-V1093 CarbonylContact O-C 3.56Å; D1090-V1093 PolarHBondContact O-N 2.72Å; G1091-V1093 VanDerWaalsContact C-N 3.31Å; G1091-V1093 PolarHBondContact O-N 3.3Å; V1093-N1095 PolarHBondContact O-N 3.16Å; V1093-R1096 HydrophobicContact CB-CB 3.84Å; V1093-R1096 HydrophobicContact CB-CG 4.42Å; V1093-R1096 HydrophobicContact CG1-CB 3.95Å; V1093-R1096 HydrophobicContact CG1-CG 4.47Å; V1093-R1096 WeakPolarHBondContact O-CB 3.39Å; V1093-R1096 PolarHBondContact O-N 2.87Å; V1093-W1142 HydrophobicContact CG1-CH2 3.45Å; V1093-W1142 VanDerWaalsContact CG1-CH2 3.45Å; V1093-W1142 HydrophobicContact CG1-CZ2 4.43Å; V1093-W1142 HydrophobicContact CG1-CZ3 3.86Å
1094	P	64.9	Low	82.9	Confident	29 Å²	29	24 Å²	24	19%	0.188	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	130.6	-166.1	25.5	-35.8	0	0	0	112	D1069 Q1071 R1096	D1069-P1094 HydrophobicContact CB-CB 4.2Å; D1069-P1094 HydrophobicContact CB-CG 3.83Å; D1069-P1094 WeakPolarHBondContact O-CD 3.17Å; Q1071-P1094 HydrophobicContact CG-CB 4.14Å; P1094-R1096 VanDerWaalsContact C-N 3.3Å
1095	N	67.6	Low	82.8	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.011	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	7.7	-175.8	-46.1	-69.7	0	0	0	115.6	N533 Q1071 V1093 I1097 W1142 A1143	N533-N1095 PolarHBondContact ND2-ND2 2.78Å; N533-N1095 VanDerWaalsContact ND2-ND2 3.13Å; Q1071-N1095 PolarHBondContact NE2-OD1 2.86Å; V1093-N1095 PolarHBondContact O-N 3.16Å; N1095-I1097 PolarHBondContact O-N 3.14Å; N1095-W1142 CarbonylContact O-C 3.47Å; N1095-W1142 WeakPolarHBondContact O-CA 3.36Å; N1095-A1143 HydrophobicContact CB-CB 3.94Å; N1095-A1143 PolarHBondContact O-N 3.36Å
1096	R	80.4	Confident	82.7	Confident	49 Å²	49	27.9 Å²	27.9	19%	0.185	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.2	176.2	-171.7	179.7	-170.6	-131.4	-4.1	111.1	I1089 D1090 V1093 P1094 L1098 E1140 W1142	I1089-R1096 WeakPolarHBondContact CA-O 3.39Å; D1090-R1096 HydrophobicContact CB-CB 4.21Å; D1090-R1096 HydrophobicContact CB-CG 4.33Å; D1090-R1096 PolarHBondContact N-O 2.76Å; D1090-R1096 IonicContact OD2-CZ 2.72Å; D1090-R1096 IonicContact OD2-NH1 3.04Å; D1090-R1096 PolarHBondContact OD2-NH1 2.89Å; V1093-R1096 HydrophobicContact CB-CB 3.84Å; V1093-R1096 HydrophobicContact CB-CG 4.42Å; V1093-R1096 HydrophobicContact CG1-CB 3.95Å; V1093-R1096 HydrophobicContact CG1-CG 4.47Å; V1093-R1096 WeakPolarHBondContact O-CB 3.39Å; V1093-R1096 PolarHBondContact O-N 2.87Å; P1094-R1096 VanDerWaalsContact C-N 3.3Å; R1096-L1098 HydrophobicContact CG-CD2 4.11Å; R1096-L1098 HydrophobicContact CG-CG 4.4Å; R1096-E1140 IonicContact CZ-OE1 2.73Å; R1096-E1140 IonicContact CZ-OE2 2.76Å; R1096-E1140 VanDerWaalsContact NE-CD 3.34Å; R1096-E1140 IonicContact NE-OE1 3.09Å; R1096-E1140 PolarHBondContact NE-OE1 3.44Å; R1096-E1140 IonicContact NE-OE2 3.19Å; R1096-E1140 PolarHBondContact NE-OE2 3.35Å; R1096-E1140 IonicContact NH2-OE1 3.56Å; R1096-E1140 IonicContact NH2-OE2 2.77Å; R1096-E1140 PolarHBondContact NH2-OE2 3.04Å; R1096-W1142 HydrophobicContact CB-CH2 4.38Å; R1096-W1142 HydrophobicContact CB-CZ3 4.35Å; R1096-W1142 HydrophobicContact CG-CZ2 4.3Å
1097	I	82	Confident	82.3	Confident	22 Å²	22	31.7 Å²	31.7	11%	0.113	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	104.8	-179.8	-56	-170.9	0	0	0	109.9	K1087 Y1088 I1089 N1095 L1099 K1141 A1143	K1087-I1097 HydrophobicContact CG-CG2 3.79Å; Y1088-I1097 CarbonylContact O-C 3.6Å; Y1088-I1097 WeakPolarHBondContact O-CA 3.24Å; I1089-I1097 HydrophobicContact CD1-CD1 4.45Å; I1089-I1097 HydrophobicContact CG1-CD1 4.5Å; I1089-I1097 HydrophobicContact CG1-CG1 4.19Å; N1095-I1097 PolarHBondContact O-N 3.14Å; I1097-L1099 HydrophobicContact CG2-CG 4.25Å; I1097-K1141 CarbonylContact C-O 3.53Å; I1097-K1141 WeakPolarHBondContact CA-O 3.16Å; I1097-K1141 HydrophobicContact CB-CB 4.41Å; I1097-K1141 PolarHBondContact N-O 2.58Å; I1097-K1141 CarbonylContact O-C 3.6Å; I1097-K1141 WeakPolarHBondContact O-CA 3.14Å; I1097-K1141 PolarHBondContact O-N 3.21Å; I1097-A1143 HydrophobicContact CD1-CB 3.67Å; I1097-A1143 HydrophobicContact CG1-CB 4.16Å
1098	L	87.1	Confident	82	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	112.5	175.9	-54.9	-174.6	0	0	0	109.7	Y1088 R1096 G1121 P1123 V1138 E1140	Y1088-L1098 HydrophobicContact CD1-CB 4.42Å; Y1088-L1098 HydrophobicContact CD1-CD1 4.2Å; Y1088-L1098 PolarHBondContact N-O 3.35Å; Y1088-L1098 PolarHBondContact O-N 3.12Å; R1096-L1098 HydrophobicContact CG-CD2 4.11Å; R1096-L1098 HydrophobicContact CG-CG 4.4Å; L1098-G1121 WeakPolarHBondContact CD1-O 3.5Å; L1098-P1123 HydrophobicContact CB-CG 3.58Å; L1098-P1123 HydrophobicContact CD1-CG 4.4Å; L1098-V1138 HydrophobicContact CB-CG1 4.06Å; L1098-V1138 HydrophobicContact CD2-CG1 4.44Å; L1098-E1140 HydrophobicContact CD2-CB 3.57Å; L1098-E1140 HydrophobicContact CD2-CG 3.49Å; L1098-E1140 VanDerWaalsContact CD2-CG 3.49Å; L1098-E1140 WeakPolarHBondContact CD2-OE2 3.19Å
1099	L	88.7	Confident	81.2	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.079	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.2	175.5	-77.6	161.2	0	0	0	110.2	V1085 L1086 K1087 I1097 Y1101 I1139 K1141	V1085-L1099 HydrophobicContact CG1-CD2 4.06Å; L1086-L1099 WeakPolarHBondContact O-CA 3.38Å; K1087-L1099 HydrophobicContact CB-CD2 3.76Å; K1087-L1099 HydrophobicContact CG-CD2 4.15Å; I1097-L1099 HydrophobicContact CG2-CG 4.25Å; L1099-Y1101 HydrophobicContact CB-CE2 4.34Å; L1099-I1139 HydrophobicContact CB-CB 4.4Å; L1099-I1139 PolarHBondContact N-O 3.04Å; L1099-I1139 PolarHBondContact O-N 2.99Å; L1099-K1141 HydrophobicContact CD1-CD 3.62Å; L1099-K1141 HydrophobicContact CD1-CG 4.12Å
1100	V	91.5	Very high	81	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.7	171.8	61.7	0	0	0	0	110.3	V1085 L1086 P1123 I1125 T1133 D1137 V1138	V1085-V1100 WeakPolarHBondContact CA-O 3.48Å; L1086-V1100 HydrophobicContact CB-CG1 3.85Å; L1086-V1100 HydrophobicContact CD1-CG1 4.38Å; L1086-V1100 HydrophobicContact CD2-CG1 4.39Å; L1086-V1100 HydrophobicContact CG-CG1 4.44Å; L1086-V1100 PolarHBondContact N-O 3.38Å; L1086-V1100 PolarHBondContact O-N 3.09Å; V1100-P1123 HydrophobicContact CG1-CB 3.93Å; V1100-P1123 HydrophobicContact CG1-CG 4.12Å; V1100-I1125 HydrophobicContact CG1-CD1 3.96Å; V1100-I1125 HydrophobicContact CG1-CG1 4.02Å; V1100-I1125 VanDerWaalsContact O-CD1 3.25Å; V1100-I1125 WeakPolarHBondContact O-CD1 3.44Å; V1100-T1133 HydrophobicContact CG2-CG2 3.78Å; V1100-T1133 WeakPolarHBondContact CG2-OG1 3.1Å; V1100-D1137 HydrophobicContact CG2-CB 4.46Å; V1100-V1138 HydrophobicContact CB-CG2 4.33Å; V1100-V1138 HydrophobicContact CG2-CG2 4.32Å
1101	Y	91.2	Very high	81.3	Confident	65 Å²	65	47.8 Å²	47.8	26%	0.255	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	144.9	-175.9	-66.8	-106.1	0	0	0	109.8	V1084 V1085 L1099 K1103 T1133 I1139	V1084-Y1101 WeakPolarHBondContact O-CA 3.32Å; V1085-Y1101 HydrophobicContact CB-CD1 4.47Å; V1085-Y1101 HydrophobicContact CB-CE1 4.44Å; V1085-Y1101 HydrophobicContact CG1-CD1 4.26Å; V1085-Y1101 HydrophobicContact CG1-CE1 3.96Å; V1085-Y1101 HydrophobicContact CG1-CE2 4.37Å; V1085-Y1101 HydrophobicContact CG2-CD1 3.54Å; V1085-Y1101 HydrophobicContact CG2-CE1 3.58Å; V1085-Y1101 HydrophobicContact CG2-CG 4.39Å; L1099-Y1101 HydrophobicContact CB-CE2 4.34Å; Y1101-K1103 PolarHBondContact O-N 2.85Å; Y1101-T1133 WeakPolarHBondContact O-CG2 3.3Å; Y1101-I1139 HydrophobicContact CD2-CD1 4.17Å; Y1101-I1139 HydrophobicContact CE2-CD1 3.97Å
1102	S	90.9	Very high	82.2	Confident	6 Å²	6	48.4 Å²	48.4	4%	0.042	24%	0.238	C	C	.	.			trans	-66.8	133.5	175.1	63	0	0	0	0	112.3	V1084 H1104	V1084-S1102 PolarHBondContact N-OG 3.14Å; V1084-S1102 PolarHBondContact O-N 2.87Å; S1102-H1104 WeakPolarHBondContact CB-O 3.23Å; S1102-H1104 PolarHBondContact O-N 3.24Å; S1102-H1104 PolarHBondContact OG-O 2.75Å
1103	K	85.9	Confident	83.2	Confident	90 Å²	90	48.5 Å²	48.5	39%	0.391	24%	0.237	S	C	.	.	S	Bend	trans	-62.1	-22.3	173.9	-82.9	172.3	158.1	150.7	0	114.1	Y1101 D1137	Y1101-K1103 PolarHBondContact O-N 2.85Å; K1103-D1137 VanDerWaalsContact CE-CG 3.48Å; K1103-D1137 WeakPolarHBondContact CE-OD1 3.31Å; K1103-D1137 VanDerWaalsContact CE-OD2 3.24Å; K1103-D1137 WeakPolarHBondContact CE-OD2 3.4Å; K1103-D1137 VanDerWaalsContact NZ-CG 3.28Å; K1103-D1137 IonicContact NZ-OD1 3.15Å; K1103-D1137 PolarHBondContact NZ-OD1 3.06Å; K1103-D1137 VanDerWaalsContact NZ-OD1 3.15Å; K1103-D1137 IonicContact NZ-OD2 2.62Å; K1103-D1137 PolarHBondContact NZ-OD2 2.83Å
1104	H	87.2	Confident	84.3	Confident	67 Å²	67	46.3 Å²	46.3	31%	0.31	22%	0.223	S	C	.	.	S	Bend	trans	-122.2	147.3	179.7	-62.9	-89.4	0	0	0	109.4	S1102 F1130	S1102-H1104 WeakPolarHBondContact CB-O 3.23Å; S1102-H1104 PolarHBondContact O-N 3.24Å; S1102-H1104 PolarHBondContact OG-O 2.75Å; H1104-F1130 HydrophobicContact CB-CD2 3.89Å; H1104-F1130 HydrophobicContact CB-CE2 4.07Å; H1104-F1130 HydrophobicContact CB-CG 4.28Å; H1104-F1130 WeakPolarHBondContact CD2-CB 3.16Å; H1104-F1130 AromaticContact CD2-CD1 3.64Å; H1104-F1130 AromaticContact CD2-CD2 3.87Å; H1104-F1130 AromaticContact CD2-CG 3.35Å; H1104-F1130 WeakPolarHBondContact CD2-CG 3.38Å; H1104-F1130 AromaticContact CE1-CD1 3.32Å; H1104-F1130 WeakPolarHBondContact CE1-CD1 3.26Å; H1104-F1130 AromaticContact CE1-CE1 3.58Å; H1104-F1130 AromaticContact CE1-CG 3.89Å; H1104-F1130 AromaticContact CG-CD1 3.76Å; H1104-F1130 AromaticContact CG-CD2 3.66Å; H1104-F1130 AromaticContact CG-CE2 3.96Å; H1104-F1130 AromaticContact CG-CG 3.55Å; H1104-F1130 AromaticContact ND1-CD1 3.56Å; H1104-F1130 AromaticContact ND1-CE1 3.53Å; H1104-F1130 AromaticContact ND1-CG 3.87Å; H1104-F1130 AromaticContact ND1-CZ 3.82Å; H1104-F1130 AromaticContact NE2-CD1 3.37Å; H1104-F1130 WeakPolarHBondContact NE2-CD1 3.39Å; H1104-F1130 AromaticContact NE2-CG 3.59Å
1105	N	87	Confident	85.6	Confident	79 Å²	79	46.2 Å²	46.2	42%	0.422	22%	0.22	S	C	.	.			trans	-84.1	146.4	171.8	-68.5	27.9	0	0	0	109.3	W1082 R1083	W1082-N1105 HydrophobicContact CB-CB 4.26Å; W1082-N1105 CarbonylContact O-C 3.59Å; W1082-N1105 VanDerWaalsContact O-CA 3.27Å; W1082-N1105 WeakPolarHBondContact O-CA 3.24Å; R1083-N1105 VanDerWaalsContact CG-OD1 3.27Å; R1083-N1105 WeakPolarHBondContact CG-OD1 3.47Å; R1083-N1105 PolarHBondContact NE-OD1 3.23Å
1106	L	88.1	Confident	86.8	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	22%	0.22	C	C	.	.			trans	-69.9	150.4	165.5	-59.3	167.3	0	0	0	109.4	L1045 I1079 W1082 V1084 H1112 I1114 I1127	L1045-L1106 HydrophobicContact CD1-CB 4.47Å; L1045-L1106 HydrophobicContact CD1-CD1 3.55Å; I1079-L1106 HydrophobicContact CG1-CD1 4.18Å; I1079-L1106 HydrophobicContact CG2-CD1 4.22Å; W1082-L1106 PolarHBondContact O-N 3.21Å; V1084-L1106 HydrophobicContact CG2-CD1 3.78Å; V1084-L1106 HydrophobicContact CG2-CD2 4.43Å; V1084-L1106 HydrophobicContact CG2-CG 4.28Å; L1106-H1112 HydrophobicContact CD2-CB 3.78Å; L1106-I1114 HydrophobicContact CD1-CD1 4.12Å; L1106-I1114 HydrophobicContact CD2-CD1 4.05Å; L1106-I1114 HydrophobicContact CD2-CG1 4.13Å; L1106-I1127 HydrophobicContact CD2-CD1 3.86Å; L1106-I1127 HydrophobicContact CD2-CG2 4.08Å; L1106-I1127 HydrophobicContact CG-CD1 4.25Å
1107	T	84	Confident	87.3	Confident	79 Å²	79	43.8 Å²	43.8	49%	0.485	21%	0.211	S	C	.	.			trans	-105.5	153.4	173.7	35.8	0	0	0	0	111.4	T1110 H1112	T1107-T1110 WeakPolarHBondContact CB-OG1 3.45Å; T1107-T1110 PolarHBondContact O-OG1 2.76Å; T1107-T1110 PolarHBondContact OG1-OG1 3.1Å; T1107-H1112 PolarHBondContact N-NE2 3.04Å; T1107-H1112 PolarHBondContact O-NE2 2.85Å; T1107-H1112 PolarHBondContact OG1-CE1 2.77Å; T1107-H1112 PolarHBondContact OG1-NE2 2.92Å
1108	R	83	Confident	87.6	Confident	160 Å²	160	43.2 Å²	43.2	60%	0.604	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	136.1	-176.8	-174.7	164.4	-163.6	-119.6	-5.7	111	D1046 W1082 T1110	D1046-R1108 PolarHBondContact O-NE 3Å; D1046-R1108 PolarHBondContact O-NH2 3.48Å; D1046-R1108 VanDerWaalsContact O-NH2 3.14Å; W1082-R1108 HydrophobicContact CH2-CB 3.53Å; W1082-R1108 HydrophobicContact CH2-CG 3.7Å; W1082-R1108 HydrophobicContact CZ2-CB 4.22Å; W1082-R1108 HydrophobicContact CZ2-CG 4.45Å; W1082-R1108 HydrophobicContact CZ3-CB 3.86Å; W1082-R1108 HydrophobicContact CZ3-CG 4.37Å; R1108-T1110 PolarHBondContact O-N 3.11Å; R1108-T1110 VanDerWaalsContact O-N 3.16Å
1109	N	71.6	Confident	87.4	Confident	108 Å²	108	46 Å²	46	58%	0.578	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	19.4	178.4	-60.4	27.4	0	0	0	115.1	L1045	L1045-N1109 PolarHBondContact O-N 3.03Å; L1045-N1109 PolarHBondContact O-OD1 3.42Å
1110	T	79.9	Confident	87	Confident	57 Å²	57	50.4 Å²	50.4	35%	0.35	25%	0.254	S	S	.	.			trans	-107.7	140.1	175.1	47.1	0	0	0	0	111.8	G1044 T1107 R1108 H1112	G1044-T1110 WeakPolarHBondContact CA-O 3.19Å; T1107-T1110 WeakPolarHBondContact CB-OG1 3.45Å; T1107-T1110 PolarHBondContact O-OG1 2.76Å; T1107-T1110 PolarHBondContact OG1-OG1 3.1Å; R1108-T1110 PolarHBondContact O-N 3.11Å; R1108-T1110 VanDerWaalsContact O-N 3.16Å; T1110-H1112 PolarHBondContact O-CD2 2.75Å; T1110-H1112 PolarHBondContact O-N 3.26Å; T1110-H1112 PolarHBondContact OG1-NE2 3.17Å
1111	K	84	Confident	86.3	Confident	88 Å²	88	51 Å²	51	38%	0.383	26%	0.26	S	S	.	.			trans	-75	115.3	177.2	-169.3	168.7	-178.7	172.6	0	109.9	E1014 I1042 N1193	E1014-K1111 PolarHBondContact O-NZ 3.4Å; I1042-K1111 HydrophobicContact CG2-CD 4.3Å; I1042-K1111 HydrophobicContact CG2-CG 4.02Å; K1111-N1193 WeakPolarHBondContact CE-ND2 3.3Å; K1111-N1193 PolarHBondContact NZ-ND2 2.97Å
1112	H	89.8	Confident	85.9	Confident	13 Å²	13	49.3 Å²	49.3	6%	0.06	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.6	177.6	-68.5	-73.8	0	0	0	111.6	I1042 L1043 L1106 T1107 T1110 D1128	I1042-H1112 WeakPolarHBondContact CA-O 3.31Å; L1043-H1112 PolarHBondContact N-O 2.84Å; L1043-H1112 PolarHBondContact O-N 3.07Å; L1106-H1112 HydrophobicContact CD2-CB 3.78Å; T1107-H1112 PolarHBondContact N-NE2 3.04Å; T1107-H1112 PolarHBondContact O-NE2 2.85Å; T1107-H1112 PolarHBondContact OG1-CE1 2.77Å; T1107-H1112 PolarHBondContact OG1-NE2 2.92Å; T1110-H1112 PolarHBondContact O-CD2 2.75Å; T1110-H1112 PolarHBondContact O-N 3.26Å; T1110-H1112 PolarHBondContact OG1-NE2 3.17Å; H1112-D1128 WeakPolarHBondContact CA-OD1 3.49Å; H1112-D1128 IonicContact CE1-OD2 2.74Å; H1112-D1128 IonicContact CG-OD2 3.39Å; H1112-D1128 IonicContact ND1-OD1 3.54Å; H1112-D1128 IonicContact ND1-OD2 3.65Å; H1112-D1128 PolarHBondContact ND1-OD2 3.45Å
1113	N	91.5	Very high	86	Confident	36 Å²	36	49 Å²	49	19%	0.193	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	99.5	170.8	-175.5	39	0	0	0	109.6	Q1040 D1128	Q1040-N1113 WeakPolarHBondContact CG-OD1 3.44Å; Q1040-N1113 PolarHBondContact NE2-ND2 3.08Å; Q1040-N1113 PolarHBondContact NE2-OD1 3.1Å; N1113-D1128 PolarHBondContact N-OD1 3.09Å; N1113-D1128 PolarHBondContact O-N 2.92Å
1114	I	93.4	Very high	86.3	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	108.3	179.2	-60.7	166.8	0	0	0	107.9	Q1040 M1041 L1043 L1052 V1084 L1106	Q1040-I1114 CarbonylContact C-O 3.42Å; Q1040-I1114 WeakPolarHBondContact CA-O 3.37Å; M1041-I1114 PolarHBondContact N-O 2.76Å; M1041-I1114 PolarHBondContact O-N 2.76Å; L1043-I1114 HydrophobicContact CD1-CD1 3.9Å; L1043-I1114 HydrophobicContact CD2-CD1 4.09Å; L1043-I1114 HydrophobicContact CG-CD1 4.08Å; L1052-I1114 HydrophobicContact CD1-CD1 4.23Å; V1084-I1114 HydrophobicContact CG1-CG2 4.08Å; V1084-I1114 HydrophobicContact CG2-CD1 3.7Å; V1084-I1114 HydrophobicContact CG2-CG1 4.05Å; V1084-I1114 HydrophobicContact CG2-CG2 3.98Å; L1106-I1114 HydrophobicContact CD1-CD1 4.12Å; L1106-I1114 HydrophobicContact CD2-CD1 4.05Å; L1106-I1114 HydrophobicContact CD2-CG1 4.13Å
1115	Q	92.9	Very high	86.6	Confident	28 Å²	28	42.2 Å²	42.2	13%	0.131	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.9	171	-68.5	177.5	-91	0	0	109	E1038 I1039 Q1040 W1124 I1125 K1126	E1038-Q1115 PolarHBondContact OE1-NE2 2.9Å; I1039-Q1115 CarbonylContact O-C 3.47Å; I1039-Q1115 WeakPolarHBondContact O-CA 3.43Å; Q1040-Q1115 HydrophobicContact CB-CG 4.2Å; Q1040-Q1115 HydrophobicContact CG-CG 3.9Å; Q1115-W1124 HydrophobicContact CB-CH2 4.19Å; Q1115-W1124 HydrophobicContact CB-CZ3 3.97Å; Q1115-W1124 WeakPolarHBondContact O-CZ3 3.27Å; Q1115-I1125 CarbonylContact O-C 3.59Å; Q1115-K1126 HydrophobicContact CB-CB 4.3Å; Q1115-K1126 PolarHBondContact N-O 2.87Å; Q1115-K1126 PolarHBondContact O-N 3.11Å
1116	A	92.8	Very high	86.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	158.7	179.3	0	0	0	0	0	111.2	I1039 M1077 L1086 W1124 I1125	I1039-A1116 WeakPolarHBondContact CA-O 3.43Å; I1039-A1116 PolarHBondContact N-O 2.85Å; I1039-A1116 PolarHBondContact O-N 3.14Å; I1039-A1116 VanDerWaalsContact O-O 3.09Å; M1077-A1116 HydrophobicContact SD-CB 3.63Å; L1086-A1116 HydrophobicContact CD1-CB 3.84Å; A1116-W1124 CarbonylContact C-O 3.49Å; A1116-W1124 WeakPolarHBondContact CA-O 3.46Å; A1116-W1124 VanDerWaalsContact CB-O 3.27Å; A1116-W1124 WeakPolarHBondContact CB-O 3.31Å; A1116-I1125 HydrophobicContact CB-CB 4.38Å; A1116-I1125 HydrophobicContact CB-CG1 3.95Å
1117	G	89.9	Confident	87.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.2	-160.1	-174.9	0	0	0	0	0	114.1	T1037 P1123 W1124	T1037-G1117 VanDerWaalsContact O-CA 3.31Å; T1037-G1117 WeakPolarHBondContact O-CA 3.24Å; G1117-P1123 CarbonylContact O-C 3.19Å; G1117-P1123 WeakPolarHBondContact O-CA 3.48Å; G1117-W1124 VanDerWaalsContact C-CD1 3.42Å; G1117-W1124 VanDerWaalsContact C-NE1 3.32Å; G1117-W1124 PolarHBondContact N-O 2.86Å; G1117-W1124 VanDerWaalsContact O-CD1 3.24Å; G1117-W1124 PolarHBondContact O-N 3.25Å
1118	I	88.1	Confident	87.3	Confident	10 Å²	10	39.6 Å²	39.6	5%	0.051	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	130.6	-177.6	-41.7	153	0	0	0	108.8	Q1035 T1037 F1075 Y1088 T1122	Q1035-I1118 HydrophobicContact CG-CB 4.29Å; Q1035-I1118 HydrophobicContact CG-CG2 4.27Å; T1037-I1118 PolarHBondContact N-O 3.31Å; T1037-I1118 PolarHBondContact O-N 2.78Å; F1075-I1118 HydrophobicContact CD2-CD1 3.84Å; F1075-I1118 HydrophobicContact CD2-CG1 3.85Å; F1075-I1118 HydrophobicContact CE2-CD1 4.4Å; F1075-I1118 HydrophobicContact CE2-CG1 3.96Å; Y1088-I1118 HydrophobicContact CD1-CG2 4.37Å; Y1088-I1118 HydrophobicContact CD2-CD1 3.51Å; Y1088-I1118 HydrophobicContact CD2-CG1 4.01Å; Y1088-I1118 HydrophobicContact CE1-CG2 4.11Å; Y1088-I1118 HydrophobicContact CE2-CD1 3.38Å; Y1088-I1118 HydrophobicContact CE2-CG1 4.21Å; Y1088-I1118 HydrophobicContact CG-CD1 4.26Å; Y1088-I1118 HydrophobicContact CG-CG1 4.28Å; I1118-T1122 WeakPolarHBondContact CA-O 3.42Å
1119	I	85	Confident	87.3	Confident	60 Å²	60	41.9 Å²	41.9	31%	0.308	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	122.6	171.9	-62.4	-178.6	0	0	0	108.3	P1036 G1121 T1122	P1036-I1119 HydrophobicContact CB-CD1 4.38Å; P1036-I1119 HydrophobicContact CB-CG1 3.81Å; P1036-I1119 HydrophobicContact CB-CG2 4.43Å; I1119-G1121 PolarHBondContact O-N 3.22Å; I1119-T1122 PolarHBondContact N-O 2.75Å; I1119-T1122 WeakPolarHBondContact O-CB 3.47Å; I1119-T1122 PolarHBondContact O-N 2.72Å
1120	S	78.7	Confident	88	Confident	108 Å²	108	41.3 Å²	41.3	76%	0.755	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	53.7	-179.8	-56.1	0	0	0	0	112.3	T1122	S1120-T1122 PolarHBondContact O-N 2.92Å; S1120-T1122 PolarHBondContact O-OG1 2.93Å
1121	G	76.5	Confident	88.2	Confident	11 Å²	11	42.1 Å²	42.1	11%	0.113	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	-1.8	-177.3	0	0	0	0	0	115.1	L1098 I1119	L1098-G1121 WeakPolarHBondContact CD1-O 3.5Å; I1119-G1121 PolarHBondContact O-N 3.22Å
1122	T	83.8	Confident	88.4	Confident	30 Å²	30	42.5 Å²	42.5	18%	0.184	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.3	-175.2	-50.8	0	0	0	0	111.1	I1118 I1119 S1120 N1135 V1138	I1118-T1122 WeakPolarHBondContact CA-O 3.42Å; I1119-T1122 PolarHBondContact N-O 2.75Å; I1119-T1122 WeakPolarHBondContact O-CB 3.47Å; I1119-T1122 PolarHBondContact O-N 2.72Å; S1120-T1122 PolarHBondContact O-N 2.92Å; S1120-T1122 PolarHBondContact O-OG1 2.93Å; T1122-N1135 HydrophobicContact CG2-CB 4.45Å; T1122-V1138 HydrophobicContact CG2-CG2 4.04Å
1123	P	91.8	Very high	88.4	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	158.9	176.3	33.1	-37.4	0	0	0	112.2	L1086 L1098 V1100 G1117 V1138	L1086-P1123 HydrophobicContact CD1-CB 4.39Å; L1086-P1123 HydrophobicContact CD2-CB 3.61Å; L1098-P1123 HydrophobicContact CB-CG 3.58Å; L1098-P1123 HydrophobicContact CD1-CG 4.4Å; V1100-P1123 HydrophobicContact CG1-CB 3.93Å; V1100-P1123 HydrophobicContact CG1-CG 4.12Å; G1117-P1123 CarbonylContact O-C 3.19Å; G1117-P1123 WeakPolarHBondContact O-CA 3.48Å; P1123-V1138 HydrophobicContact CG-CG1 3.95Å; P1123-V1138 HydrophobicContact CG-CG2 4.36Å
1124	W	93.6	Very high	88.2	Confident	12 Å²	12	43.3 Å²	43.3	5%	0.045	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	154.8	177.5	61.5	-84.6	0	0	0	113	E1038 Q1115 A1116 G1117 K1126 R1132 T1133	E1038-W1124 HydrophobicContact CB-CH2 4.4Å; E1038-W1124 HydrophobicContact CB-CZ2 3.99Å; E1038-W1124 HydrophobicContact CG-CH2 3.86Å; E1038-W1124 HydrophobicContact CG-CZ2 3.97Å; Q1115-W1124 HydrophobicContact CB-CH2 4.19Å; Q1115-W1124 HydrophobicContact CB-CZ3 3.97Å; Q1115-W1124 WeakPolarHBondContact O-CZ3 3.27Å; A1116-W1124 CarbonylContact C-O 3.49Å; A1116-W1124 WeakPolarHBondContact CA-O 3.46Å; A1116-W1124 VanDerWaalsContact CB-O 3.27Å; A1116-W1124 WeakPolarHBondContact CB-O 3.31Å; G1117-W1124 VanDerWaalsContact C-CD1 3.42Å; G1117-W1124 VanDerWaalsContact C-NE1 3.32Å; G1117-W1124 PolarHBondContact N-O 2.86Å; G1117-W1124 VanDerWaalsContact O-CD1 3.24Å; G1117-W1124 PolarHBondContact O-N 3.25Å; W1124-K1126 HydrophobicContact CE3-CB 4.42Å; W1124-K1126 HydrophobicContact CZ3-CB 4.1Å; W1124-R1132 HydrophobicContact CB-CG 4.12Å; W1124-R1132 VanDerWaalsContact CB-NE 3.27Å; W1124-R1132 VanDerWaalsContact CD1-NH2 3.3Å; W1124-R1132 HydrophobicContact CD2-CG 4.31Å; W1124-R1132 HydrophobicContact CE3-CG 3.83Å; W1124-R1132 HydrophobicContact CG-CG 4.47Å; W1124-T1133 VanDerWaalsContact CA-OG1 3.31Å; W1124-T1133 WeakPolarHBondContact CA-OG1 3.24Å
1125	I	94	Very high	87.7	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.6	172.1	-60.4	163.6	0	0	0	109.3	V1084 L1086 V1100 Q1115 A1116 I1127 R1132 T1133	V1084-I1125 HydrophobicContact CB-CD1 4.27Å; V1084-I1125 HydrophobicContact CB-CG2 4.28Å; V1084-I1125 HydrophobicContact CG1-CD1 3.97Å; V1084-I1125 HydrophobicContact CG1-CG1 4.44Å; V1084-I1125 HydrophobicContact CG1-CG2 4.33Å; V1084-I1125 WeakPolarHBondContact O-CD1 3.46Å; L1086-I1125 HydrophobicContact CB-CD1 3.88Å; L1086-I1125 HydrophobicContact CB-CG1 4.05Å; L1086-I1125 HydrophobicContact CD1-CG1 4.25Å; V1100-I1125 HydrophobicContact CG1-CD1 3.96Å; V1100-I1125 HydrophobicContact CG1-CG1 4.02Å; V1100-I1125 VanDerWaalsContact O-CD1 3.25Å; V1100-I1125 WeakPolarHBondContact O-CD1 3.44Å; Q1115-I1125 CarbonylContact O-C 3.59Å; A1116-I1125 HydrophobicContact CB-CB 4.38Å; A1116-I1125 HydrophobicContact CB-CG1 3.95Å; I1125-I1127 HydrophobicContact CG2-CG1 4.23Å; I1125-R1132 CarbonylContact O-C 3.42Å; I1125-R1132 WeakPolarHBondContact O-CA 3.37Å; I1125-T1133 HydrophobicContact CB-CG2 4.31Å; I1125-T1133 PolarHBondContact N-OG1 3.02Å; I1125-T1133 PolarHBondContact O-N 3.44Å; I1125-T1133 PolarHBondContact O-OG1 3.14Å
1126	K	92.4	Very high	87.3	Confident	57 Å²	57	56 Å²	56	25%	0.248	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	134.4	168.2	179.7	-163	163.3	-145.9	0	107.5	Q1115 W1124 D1128 F1130 R1132	Q1115-K1126 HydrophobicContact CB-CB 4.3Å; Q1115-K1126 PolarHBondContact N-O 2.87Å; Q1115-K1126 PolarHBondContact O-N 3.11Å; W1124-K1126 HydrophobicContact CE3-CB 4.42Å; W1124-K1126 HydrophobicContact CZ3-CB 4.1Å; K1126-D1128 VanDerWaalsContact CE-O 3.24Å; K1126-D1128 WeakPolarHBondContact CE-O 2.97Å; K1126-D1128 PolarHBondContact NZ-O 3.33Å; K1126-F1130 WeakPolarHBondContact CG-O 3.17Å; K1126-R1132 HydrophobicContact CB-CB 4.13Å; K1126-R1132 HydrophobicContact CG-CB 4.49Å
1127	I	91.4	Very high	87.1	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.8	174.6	-62.5	178.2	0	0	0	108.4	V1084 L1106 I1125 K1129 F1130	V1084-I1127 HydrophobicContact CB-CD1 4.45Å; V1084-I1127 HydrophobicContact CG2-CD1 3.8Å; V1084-I1127 HydrophobicContact CG2-CG1 4.43Å; L1106-I1127 HydrophobicContact CD2-CD1 3.86Å; L1106-I1127 HydrophobicContact CD2-CG2 4.08Å; L1106-I1127 HydrophobicContact CG-CD1 4.25Å; I1125-I1127 HydrophobicContact CG2-CG1 4.23Å; I1127-K1129 PolarHBondContact O-N 2.86Å; I1127-F1130 WeakPolarHBondContact O-CB 3.48Å; I1127-F1130 WeakPolarHBondContact O-CD2 3.31Å; I1127-F1130 PolarHBondContact O-N 3.49Å
1128	D	89	Confident	86.9	Confident	44 Å²	44	59.4 Å²	59.4	24%	0.235	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	-114.9	175.2	-57.2	-41.1	0	0	0	113.5	H1112 N1113 K1126 F1130	H1112-D1128 WeakPolarHBondContact CA-OD1 3.49Å; H1112-D1128 IonicContact CE1-OD2 2.74Å; H1112-D1128 IonicContact CG-OD2 3.39Å; H1112-D1128 IonicContact ND1-OD1 3.54Å; H1112-D1128 IonicContact ND1-OD2 3.65Å; H1112-D1128 PolarHBondContact ND1-OD2 3.45Å; N1113-D1128 PolarHBondContact N-OD1 3.09Å; N1113-D1128 PolarHBondContact O-N 2.92Å; K1126-D1128 VanDerWaalsContact CE-O 3.24Å; K1126-D1128 WeakPolarHBondContact CE-O 2.97Å; K1126-D1128 PolarHBondContact NZ-O 3.33Å; D1128-F1130 HydrophobicContact CB-CD2 4.47Å
1129	K	83.3	Confident	86.9	Confident	209 Å²	209	63 Å²	63	91%	0.909	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	4.9	179.4	-61	-179.4	-177.1	176.3	0	112.6	I1127	I1127-K1129 PolarHBondContact O-N 2.86Å
1130	F	86.9	Confident	86.9	Confident	95 Å²	95	64.2 Å²	64.2	42%	0.417	33%	0.33	S	S	.	.	S	Bend	trans	-75	170	-179.2	-62.1	-67	0	0	0	112.3	H1104 K1126 I1127 D1128	H1104-F1130 HydrophobicContact CB-CD2 3.89Å; H1104-F1130 HydrophobicContact CB-CE2 4.07Å; H1104-F1130 HydrophobicContact CB-CG 4.28Å; H1104-F1130 WeakPolarHBondContact CD2-CB 3.16Å; H1104-F1130 AromaticContact CD2-CD1 3.64Å; H1104-F1130 AromaticContact CD2-CD2 3.87Å; H1104-F1130 AromaticContact CD2-CG 3.35Å; H1104-F1130 WeakPolarHBondContact CD2-CG 3.38Å; H1104-F1130 AromaticContact CE1-CD1 3.32Å; H1104-F1130 WeakPolarHBondContact CE1-CD1 3.26Å; H1104-F1130 AromaticContact CE1-CE1 3.58Å; H1104-F1130 AromaticContact CE1-CG 3.89Å; H1104-F1130 AromaticContact CG-CD1 3.76Å; H1104-F1130 AromaticContact CG-CD2 3.66Å; H1104-F1130 AromaticContact CG-CE2 3.96Å; H1104-F1130 AromaticContact CG-CG 3.55Å; H1104-F1130 AromaticContact ND1-CD1 3.56Å; H1104-F1130 AromaticContact ND1-CE1 3.53Å; H1104-F1130 AromaticContact ND1-CG 3.87Å; H1104-F1130 AromaticContact ND1-CZ 3.82Å; H1104-F1130 AromaticContact NE2-CD1 3.37Å; H1104-F1130 WeakPolarHBondContact NE2-CD1 3.39Å; H1104-F1130 AromaticContact NE2-CG 3.59Å; K1126-F1130 WeakPolarHBondContact CG-O 3.17Å; I1127-F1130 WeakPolarHBondContact O-CB 3.48Å; I1127-F1130 WeakPolarHBondContact O-CD2 3.31Å; I1127-F1130 PolarHBondContact O-N 3.49Å; D1128-F1130 HydrophobicContact CB-CD2 4.47Å
1131	S	83.4	Confident	86.8	Confident	74 Å²	74	64.3 Å²	64.3	52%	0.517	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-69.6	141.4	177.3	54.6	0	0	0	0	111.5
1132	R	87.8	Confident	86.6	Confident	96 Å²	96	70.5 Å²	70.5	36%	0.362	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-64.9	146.7	169.7	169.8	177.5	160.9	-177.9	0.3	110	W1124 I1125 K1126	W1124-R1132 HydrophobicContact CB-CG 4.12Å; W1124-R1132 VanDerWaalsContact CB-NE 3.27Å; W1124-R1132 VanDerWaalsContact CD1-NH2 3.3Å; W1124-R1132 HydrophobicContact CD2-CG 4.31Å; W1124-R1132 HydrophobicContact CE3-CG 3.83Å; W1124-R1132 HydrophobicContact CG-CG 4.47Å; I1125-R1132 CarbonylContact O-C 3.42Å; I1125-R1132 WeakPolarHBondContact O-CA 3.37Å; K1126-R1132 HydrophobicContact CB-CB 4.13Å; K1126-R1132 HydrophobicContact CG-CB 4.49Å
1133	T	90.1	Very high	85.5	Confident	4 Å²	4	69.7 Å²	69.7	3%	0.025	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-64.1	129.6	169.5	57.9	0	0	0	0	111.1	V1100 Y1101 W1124 I1125 D1137	V1100-T1133 HydrophobicContact CG2-CG2 3.78Å; V1100-T1133 WeakPolarHBondContact CG2-OG1 3.1Å; Y1101-T1133 WeakPolarHBondContact O-CG2 3.3Å; W1124-T1133 VanDerWaalsContact CA-OG1 3.31Å; W1124-T1133 WeakPolarHBondContact CA-OG1 3.24Å; I1125-T1133 HydrophobicContact CB-CG2 4.31Å; I1125-T1133 PolarHBondContact N-OG1 3.02Å; I1125-T1133 PolarHBondContact O-N 3.44Å; I1125-T1133 PolarHBondContact O-OG1 3.14Å; T1133-D1137 WeakPolarHBondContact CA-OD2 3.1Å; T1133-D1137 HydrophobicContact CG2-CB 4.24Å
1134	T	87.9	Confident	83.4	Confident	62 Å²	62	73.8 Å²	73.8	38%	0.38	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-86.8	172	175	70.9	0	0	0	0	110	Q1136 D1137	T1134-Q1136 PolarHBondContact O-N 3.08Å; T1134-Q1136 PolarHBondContact OG1-N 2.97Å; T1134-D1137 PolarHBondContact N-OD2 3.36Å; T1134-D1137 PolarHBondContact O-N 3.21Å; T1134-D1137 PolarHBondContact OG1-OD2 2.6Å
1135	N	83	Confident	80.7	Confident	113 Å²	113	74.6 Å²	74.6	60%	0.604	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.1	175.6	-56.4	35.6	0	0	0	113.3	T1122	T1122-N1135 HydrophobicContact CG2-CB 4.45Å
1136	Q	84.7	Confident	77.9	Confident	183 Å²	183	74.5 Å²	74.5	86%	0.855	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.6	175.1	-64.8	174.1	-35.3	0	0	113.2	T1134	T1134-Q1136 PolarHBondContact O-N 3.08Å; T1134-Q1136 PolarHBondContact OG1-N 2.97Å
1137	D	87.3	Confident	75.1	Confident	46 Å²	46	76.1 Å²	76.1	25%	0.246	37%	0.37	C	S	.	.	S	Bend	trans	-90.3	-4.2	176	-49.9	-64.4	0	0	0	112.4	V1100 K1103 T1133 T1134	V1100-D1137 HydrophobicContact CG2-CB 4.46Å; K1103-D1137 VanDerWaalsContact CE-CG 3.48Å; K1103-D1137 WeakPolarHBondContact CE-OD1 3.31Å; K1103-D1137 VanDerWaalsContact CE-OD2 3.24Å; K1103-D1137 WeakPolarHBondContact CE-OD2 3.4Å; K1103-D1137 VanDerWaalsContact NZ-CG 3.28Å; K1103-D1137 IonicContact NZ-OD1 3.15Å; K1103-D1137 PolarHBondContact NZ-OD1 3.06Å; K1103-D1137 VanDerWaalsContact NZ-OD1 3.15Å; K1103-D1137 IonicContact NZ-OD2 2.62Å; K1103-D1137 PolarHBondContact NZ-OD2 2.83Å; T1133-D1137 WeakPolarHBondContact CA-OD2 3.1Å; T1133-D1137 HydrophobicContact CG2-CB 4.24Å; T1134-D1137 PolarHBondContact N-OD2 3.36Å; T1134-D1137 PolarHBondContact O-N 3.21Å; T1134-D1137 PolarHBondContact OG1-OD2 2.6Å
1138	V	87.1	Confident	72.2	Confident	26 Å²	26	76.4 Å²	76.4	16%	0.158	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	117.5	-179.6	-177.9	0	0	0	0	109.3	L1098 V1100 T1122 P1123 E1140	L1098-V1138 HydrophobicContact CB-CG1 4.06Å; L1098-V1138 HydrophobicContact CD2-CG1 4.44Å; V1100-V1138 HydrophobicContact CB-CG2 4.33Å; V1100-V1138 HydrophobicContact CG2-CG2 4.32Å; T1122-V1138 HydrophobicContact CG2-CG2 4.04Å; P1123-V1138 HydrophobicContact CG-CG1 3.95Å; P1123-V1138 HydrophobicContact CG-CG2 4.36Å; V1138-E1140 PolarHBondContact O-N 2.95Å
1139	I	87.5	Confident	69.7	Low	85 Å²	85	77.3 Å²	77.3	44%	0.436	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	97	174.6	-59.2	173.8	0	0	0	107.5	L1099 Y1101 K1141	L1099-I1139 HydrophobicContact CB-CB 4.4Å; L1099-I1139 PolarHBondContact N-O 3.04Å; L1099-I1139 PolarHBondContact O-N 2.99Å; Y1101-I1139 HydrophobicContact CD2-CD1 4.17Å; Y1101-I1139 HydrophobicContact CE2-CD1 3.97Å; I1139-K1141 HydrophobicContact CG2-CG 4.23Å; I1139-K1141 PolarHBondContact O-N 3.24Å
1140	E	84.6	Confident	67.4	Low	86 Å²	86	70.7 Å²	70.7	40%	0.402	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	106.8	169.2	-179.5	152.2	173.8	0	0	109.6	R1096 L1098 V1138 W1142	R1096-E1140 IonicContact CZ-OE1 2.73Å; R1096-E1140 IonicContact CZ-OE2 2.76Å; R1096-E1140 VanDerWaalsContact NE-CD 3.34Å; R1096-E1140 IonicContact NE-OE1 3.09Å; R1096-E1140 PolarHBondContact NE-OE1 3.44Å; R1096-E1140 IonicContact NE-OE2 3.19Å; R1096-E1140 PolarHBondContact NE-OE2 3.35Å; R1096-E1140 IonicContact NH2-OE1 3.56Å; R1096-E1140 IonicContact NH2-OE2 2.77Å; R1096-E1140 PolarHBondContact NH2-OE2 3.04Å; L1098-E1140 HydrophobicContact CD2-CB 3.57Å; L1098-E1140 HydrophobicContact CD2-CG 3.49Å; L1098-E1140 VanDerWaalsContact CD2-CG 3.49Å; L1098-E1140 WeakPolarHBondContact CD2-OE2 3.19Å; V1138-E1140 PolarHBondContact O-N 2.95Å; E1140-W1142 WeakPolarHBondContact OE1-CZ2 3.38Å; E1140-W1142 PolarHBondContact OE1-NE1 3.27Å
1141	K	77.1	Confident	65	Low	110 Å²	110	69.7 Å²	69.7	48%	0.478	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	154.3	163.1	-65.9	-169.1	-173	173.8	0	108.8	I1097 L1099 I1139	I1097-K1141 CarbonylContact C-O 3.53Å; I1097-K1141 WeakPolarHBondContact CA-O 3.16Å; I1097-K1141 HydrophobicContact CB-CB 4.41Å; I1097-K1141 PolarHBondContact N-O 2.58Å; I1097-K1141 CarbonylContact O-C 3.6Å; I1097-K1141 WeakPolarHBondContact O-CA 3.14Å; I1097-K1141 PolarHBondContact O-N 3.21Å; L1099-K1141 HydrophobicContact CD1-CD 3.62Å; L1099-K1141 HydrophobicContact CD1-CG 4.12Å; I1139-K1141 HydrophobicContact CG2-CG 4.23Å; I1139-K1141 PolarHBondContact O-N 3.24Å
1142	W	72	Confident	62.5	Low	140 Å²	140	69.6 Å²	69.6	53%	0.53	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.9	160.9	-67.2	69.6	0	0	0	105.9	V1093 N1095 R1096 E1140 D1144	V1093-W1142 HydrophobicContact CG1-CH2 3.45Å; V1093-W1142 VanDerWaalsContact CG1-CH2 3.45Å; V1093-W1142 HydrophobicContact CG1-CZ2 4.43Å; V1093-W1142 HydrophobicContact CG1-CZ3 3.86Å; N1095-W1142 CarbonylContact O-C 3.47Å; N1095-W1142 WeakPolarHBondContact O-CA 3.36Å; R1096-W1142 HydrophobicContact CB-CH2 4.38Å; R1096-W1142 HydrophobicContact CB-CZ3 4.35Å; R1096-W1142 HydrophobicContact CG-CZ2 4.3Å; E1140-W1142 WeakPolarHBondContact OE1-CZ2 3.38Å; E1140-W1142 PolarHBondContact OE1-NE1 3.27Å; W1142-D1144 PolarHBondContact O-N 2.65Å
1143	A	59.7	Low	60	Low	14 Å²	14	66.3 Å²	66.3	12%	0.116	34%	0.337	C	S	.	.			trans	-53.8	128.6	162.9	0	0	0	0	0	106.5	N1095 I1097 T1145 Q1147	N1095-A1143 HydrophobicContact CB-CB 3.94Å; N1095-A1143 PolarHBondContact O-N 3.36Å; I1097-A1143 HydrophobicContact CD1-CB 3.67Å; I1097-A1143 HydrophobicContact CG1-CB 4.16Å; A1143-T1145 PolarHBondContact O-N 3.46Å; A1143-Q1147 WeakPolarHBondContact CB-O 3.42Å
1144	D	48.7	Very low	57.4	Low	86 Å²	86	67.1 Å²	67.1	46%	0.46	34%	0.344	S	S	.	.			trans	-78	66	-154.3	-170.6	14.5	0	0	0	111.3	W1142 H1146	W1142-D1144 PolarHBondContact O-N 2.65Å; D1144-H1146 WeakPolarHBondContact O-CB 3.48Å; D1144-H1146 PolarHBondContact O-N 2.75Å
1145	T	37	Very low	54.9	Low	30 Å²	30	66.2 Å²	66.2	18%	0.184	35%	0.347	C	S	.	.	S	Bend	trans	53.8	-20.6	-155.5	65.2	0	0	0	0	115.2	P500 N533 A1143	P500-T1145 HydrophobicContact CB-CG2 4.06Å; P500-T1145 WeakPolarHBondContact CB-OG1 3.44Å; P500-T1145 HydrophobicContact CG-CG2 4.45Å; N533-T1145 WeakPolarHBondContact CA-O 3.44Å; N533-T1145 WeakPolarHBondContact CB-O 3.33Å; N533-T1145 VanDerWaalsContact CG-CB 3.46Å; N533-T1145 WeakPolarHBondContact OD1-CB 3.42Å; N533-T1145 WeakPolarHBondContact OD1-CG2 3.46Å; A1143-T1145 PolarHBondContact O-N 3.46Å
1146	H	35.1	Very low	52.9	Low	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-155	55.4	-144.1	-83.9	-27.3	0	0	0	117.2	P500 V501 C502 T508 Y509 G532 N533 C534 D1144	P500-H1146 VanDerWaalsContact C-CD2 3.47Å; P500-H1146 WeakPolarHBondContact CA-CD2 3.48Å; P500-H1146 WeakPolarHBondContact CA-NE2 3.14Å; P500-H1146 WeakPolarHBondContact CB-CD2 3.36Å; P500-H1146 WeakPolarHBondContact CB-NE2 3.46Å; V501-H1146 WeakPolarHBondContact CA-NE2 3.32Å; V501-H1146 PolarHBondContact N-CD2 3.05Å; V501-H1146 PolarHBondContact N-NE2 3.05Å; V501-H1146 PolarHBondContact O-CE1 2.99Å; C502-H1146 WeakPolarHBondContact CA-CE1 3.38Å; C502-H1146 PolarHBondContact N-CE1 2.7Å; C502-H1146 PolarHBondContact N-NE2 3.5Å; T508-H1146 CarbonylContact C-O 3.5Å; T508-H1146 VanDerWaalsContact CB-CA 3.46Å; T508-H1146 WeakPolarHBondContact CB-ND1 3.4Å; T508-H1146 WeakPolarHBondContact CG2-ND1 3.47Å; T508-H1146 CarbonylContact O-C 3.6Å; Y509-H1146 VanDerWaalsContact N-CB 3.26Å; Y509-H1146 PolarHBondContact O-CD2 3.16Å; G532-H1146 PolarHBondContact O-CE1 2.94Å; G532-H1146 PolarHBondContact O-NE2 2.78Å; N533-H1146 VanDerWaalsContact CA-CE1 3.41Å; N533-H1146 WeakPolarHBondContact CA-CE1 3.28Å; C534-H1146 PolarHBondContact N-CE1 2.87Å; D1144-H1146 WeakPolarHBondContact O-CB 3.48Å; D1144-H1146 PolarHBondContact O-N 2.75Å
1147	Q	33.7	Very low	51.5	Low	90 Å²	90	58.8 Å²	58.8	42%	0.421	32%	0.316	S	S	.	.			trans	-153.2	124.8	140.5	-85.9	111.5	32.5	0	0	104	T508 A1143	T508-Q1147 VanDerWaalsContact OG1-CA 3.23Å; T508-Q1147 WeakPolarHBondContact OG1-CA 3.5Å; T508-Q1147 PolarHBondContact OG1-N 3.1Å; A1143-Q1147 WeakPolarHBondContact CB-O 3.42Å
1148	S	30.2	Very low	50.2	Low	12 Å²	12	58.6 Å²	58.6	8%	0.084	31%	0.314	C	S	.	.			trans	-132.5	86	-176.4	-177.4	0	0	0	0	107.7	E507 T508 Q1071 N1150	E507-S1148 VanDerWaalsContact OE1-O 3.07Å; E507-S1148 PolarHBondContact OE2-N 2.92Å; T508-S1148 PolarHBondContact OG1-N 3.22Å; T508-S1148 VanDerWaalsContact OG1-N 3.15Å; Q1071-S1148 PolarHBondContact NE2-OG 2.89Å; Q1071-S1148 VanDerWaalsContact NE2-OG 3.12Å; S1148-N1150 WeakPolarHBondContact O-CA 3.34Å; S1148-N1150 WeakPolarHBondContact O-CB 3.35Å; S1148-N1150 VanDerWaalsContact O-CG 3.31Å; S1148-N1150 PolarHBondContact O-N 3.03Å; S1148-N1150 PolarHBondContact O-ND2 2.82Å; S1148-N1150 PolarHBondContact OG-ND2 3.38Å
1149	D	37.5	Very low	49.1	Very low	63 Å²	63	58.2 Å²	58.2	34%	0.337	31%	0.312	S	S	.	.			trans	-38.9	77	-171	-69.5	-62.9	0	0	0	113.9	Q1074 K1087	Q1074-D1149 PolarHBondContact NE2-O 3.09Å; K1087-D1149 IonicContact NZ-OD2 3.48Å; K1087-D1149 PolarHBondContact NZ-OD2 2.71Å
1150	N	34.2	Very low	48.7	Very low	70 Å²	70	54.2 Å²	54.2	37%	0.374	29%	0.291	S	S	.	.			trans	-117.4	9	-174.8	-85.6	-58.7	0	0	0	111.7	E507 R1056 S1148	E507-N1150 PolarHBondContact OE1-N 2.88Å; R1056-N1150 PolarHBondContact NH2-OD1 3.18Å; S1148-N1150 WeakPolarHBondContact O-CA 3.34Å; S1148-N1150 WeakPolarHBondContact O-CB 3.35Å; S1148-N1150 VanDerWaalsContact O-CG 3.31Å; S1148-N1150 PolarHBondContact O-N 3.03Å; S1148-N1150 PolarHBondContact O-ND2 2.82Å; S1148-N1150 PolarHBondContact OG-ND2 3.38Å
1151	Q	36.6	Very low	48.6	Very low	73 Å²	73	50.3 Å²	50.3	34%	0.341	27%	0.273	S	S	.	.	S	Bend	trans	-46.3	130.6	155.4	-66.3	-162.2	-5.5	0	0	109.3	T1153	Q1151-T1153 VanDerWaalsContact C-N 3.35Å; Q1151-T1153 PolarHBondContact O-N 3.36Å
1152	P	30.3	Very low	49	Very low	73 Å²	73	45.1 Å²	45.1	47%	0.474	25%	0.25	S	S	.	.			trans	-68.7	94.8	174.4	24.2	-29.4	0	0	0	109.3	I1168	P1152-I1168 HydrophobicContact CB-CB 4.29Å; P1152-I1168 HydrophobicContact CG-CB 4.07Å; P1152-I1168 VanDerWaalsContact O-CB 3.27Å; P1152-I1168 WeakPolarHBondContact O-CB 3.46Å; P1152-I1168 WeakPolarHBondContact O-CG1 3.42Å; P1152-I1168 PolarHBondContact O-N 2.89Å
1153	T	36.7	Very low	49.7	Very low	27 Å²	27	38.4 Å²	38.4	17%	0.166	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-65	134.3	164.8	35.3	0	0	0	0	109	Q1151 G1155 I1166	Q1151-T1153 VanDerWaalsContact C-N 3.35Å; Q1151-T1153 PolarHBondContact O-N 3.36Å; T1153-G1155 PolarHBondContact O-N 3.32Å; T1153-I1166 CarbonylContact C-O 3.57Å; T1153-I1166 VanDerWaalsContact CA-O 3.27Å; T1153-I1166 WeakPolarHBondContact CA-O 3.05Å
1154	A	33.9	Very low	50.8	Low	21 Å²	21	41.8 Å²	41.8	17%	0.174	24%	0.235	C	C	.	.	S	Bend	trans	-76.3	95.5	-175.2	0	0	0	0	0	111.3	I1166 I1168	A1154-I1166 HydrophobicContact CB-CB 3.62Å; A1154-I1166 HydrophobicContact CB-CD1 3.97Å; A1154-I1166 HydrophobicContact CB-CG1 4.42Å; A1154-I1166 HydrophobicContact CB-CG2 3.45Å; A1154-I1166 VanDerWaalsContact CB-CG2 3.45Å; A1154-I1166 PolarHBondContact N-O 2.92Å; A1154-I1168 HydrophobicContact CB-CD1 3.68Å; A1154-I1168 HydrophobicContact CB-CG1 3.65Å
1155	G	36.2	Very low	51.7	Low	43 Å²	43	39.2 Å²	39.2	44%	0.443	22%	0.22	S	C	.	.	S	Bend	trans	-169.7	152.9	171.8	0	0	0	0	0	109.4	T1153	T1153-G1155 PolarHBondContact O-N 3.32Å
1156	S	41.2	Very low	52.8	Low	48 Å²	48	39.2 Å²	39.2	34%	0.336	22%	0.218	S	C	.	.			trans	-68.2	162.7	164.5	70.2	0	0	0	0	109.4	E1158 T1159	S1156-E1158 PolarHBondContact O-N 2.89Å; S1156-T1159 PolarHBondContact N-OG1 2.72Å; S1156-T1159 WeakPolarHBondContact O-CB 3.45Å; S1156-T1159 PolarHBondContact O-N 3.34Å; S1156-T1159 PolarHBondContact O-OG1 3.29Å; S1156-T1159 PolarHBondContact OG-OG1 2.96Å
1157	L	54.3	Low	53.4	Low	92 Å²	92	43 Å²	43	48%	0.482	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	140.7	150.8	-53.6	176.5	0	0	0	107.4	P1058	P1058-L1157 HydrophobicContact CG-CD1 4.24Å
1158	E	60.1	Low	53.5	Low	42 Å²	42	43.8 Å²	43.8	20%	0.196	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	2.8	-167.9	-43.2	175.1	134.9	0	0	117	R1028 I1029 H1032 S1156	R1028-E1158 HydrophobicContact CG-CB 4.42Å; R1028-E1158 IonicContact CZ-OE2 3.03Å; R1028-E1158 IonicContact NE-OE2 2.72Å; R1028-E1158 PolarHBondContact NE-OE2 3.01Å; R1028-E1158 IonicContact NH2-OE2 3.8Å; R1028-E1158 PolarHBondContact NH2-OE2 3.19Å; I1029-E1158 PolarHBondContact N-O 3.21Å; H1032-E1158 IonicContact CD2-OE1 3.77Å; S1156-E1158 PolarHBondContact O-N 2.89Å
1159	T	65.3	Low	53.5	Low	18 Å²	18	45.9 Å²	45.9	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.4	175.4	-61.2	0	0	0	0	112.9	L1026 S1156	L1026-T1159 HydrophobicContact CB-CG2 4.28Å; L1026-T1159 HydrophobicContact CD2-CG2 4.01Å; S1156-T1159 PolarHBondContact N-OG1 2.72Å; S1156-T1159 WeakPolarHBondContact O-CB 3.45Å; S1156-T1159 PolarHBondContact O-N 3.34Å; S1156-T1159 PolarHBondContact O-OG1 3.29Å; S1156-T1159 PolarHBondContact OG-OG1 2.96Å
1160	I	78.4	Confident	53	Low	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.5	161.9	-56.2	-173.6	0	0	0	109.3	V1027 I1029 I1033 L1053 Y1055 I1162 M1195 I1197	V1027-I1160 HydrophobicContact CB-CB 4.49Å; V1027-I1160 PolarHBondContact N-O 3.21Å; V1027-I1160 PolarHBondContact O-N 2.97Å; I1029-I1160 HydrophobicContact CD1-CD1 3.72Å; I1029-I1160 HydrophobicContact CD1-CG1 3.7Å; I1029-I1160 HydrophobicContact CG1-CD1 4.01Å; I1029-I1160 HydrophobicContact CG1-CG1 3.87Å; I1033-I1160 HydrophobicContact CD1-CD1 4.39Å; L1053-I1160 HydrophobicContact CB-CG2 3.98Å; L1053-I1160 HydrophobicContact CD1-CG2 4.35Å; L1053-I1160 HydrophobicContact CD2-CG2 4.21Å; L1053-I1160 HydrophobicContact CG-CG2 4.43Å; Y1055-I1160 HydrophobicContact CD2-CG1 3.7Å; Y1055-I1160 HydrophobicContact CG-CG1 4.25Å; I1160-I1162 HydrophobicContact CG2-CG1 3.86Å; I1160-M1195 HydrophobicContact CD1-CE 3.66Å; I1160-I1197 HydrophobicContact CD1-CD1 3.47Å; I1160-I1197 VanDerWaalsContact CD1-CD1 3.47Å
1161	I	82	Confident	52.9	Low	5 Å²	5	48.9 Å²	48.9	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	119.9	167.9	-46	-175.3	0	0	0	107.7	T1024 L1026 L1053 H1054	T1024-I1161 HydrophobicContact CG2-CG2 3.51Å; L1026-I1161 HydrophobicContact CD2-CB 4.15Å; L1026-I1161 HydrophobicContact CD2-CD1 4.41Å; L1026-I1161 HydrophobicContact CD2-CG1 3.73Å; L1026-I1161 HydrophobicContact CD2-CG2 4.01Å; L1053-I1161 CarbonylContact C-O 3.59Å; L1053-I1161 WeakPolarHBondContact CA-O 3.11Å; L1053-I1161 WeakPolarHBondContact CB-O 3.42Å; H1054-I1161 PolarHBondContact N-O 3.07Å; H1054-I1161 PolarHBondContact O-N 3.18Å
1162	I	87	Confident	52.3	Low	0 Å²	0	49.9 Å²	49.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.1	175.9	-57.9	178.9	0	0	0	108.8	F1019 T1024 L1025 V1027 L1052 L1053 I1160 F1188 L1192 M1195 L1208	F1019-I1162 HydrophobicContact CE1-CB 4.46Å; F1019-I1162 HydrophobicContact CE1-CG2 3.76Å; F1019-I1162 HydrophobicContact CZ-CG2 3.91Å; T1024-I1162 CarbonylContact C-O 3.47Å; T1024-I1162 WeakPolarHBondContact CA-O 3.41Å; L1025-I1162 HydrophobicContact CB-CB 4.15Å; L1025-I1162 HydrophobicContact CD2-CD1 4.17Å; L1025-I1162 HydrophobicContact CG-CB 4.42Å; L1025-I1162 PolarHBondContact N-O 2.96Å; L1025-I1162 PolarHBondContact O-N 3.5Å; V1027-I1162 HydrophobicContact CG2-CD1 3.6Å; V1027-I1162 HydrophobicContact CG2-CG1 4.21Å; L1052-I1162 WeakPolarHBondContact O-CA 3.48Å; L1053-I1162 HydrophobicContact CB-CG1 4.21Å; I1160-I1162 HydrophobicContact CG2-CG1 3.86Å; I1162-F1188 HydrophobicContact CG2-CE1 4.14Å; I1162-L1192 HydrophobicContact CG2-CD2 3.77Å; I1162-M1195 HydrophobicContact CD1-SD 3.48Å; I1162-M1195 WeakPolarHBondContact CD1-SD 3.26Å; I1162-M1195 HydrophobicContact CG1-SD 4.33Å; I1162-L1208 HydrophobicContact CD1-CD2 4.32Å
1163	G	86.1	Confident	52.2	Low	0 Å²	0	52.2 Å²	52.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.5	-139.1	-172.5	0	0	0	0	0	112.2	M1051 L1052 Q1165	M1051-G1163 WeakPolarHBondContact CB-O 3.24Å; M1051-G1163 WeakPolarHBondContact CG-O 3.25Å; L1052-G1163 PolarHBondContact O-N 3.25Å; G1163-Q1165 PolarHBondContact O-N 3.49Å
1164	R	82.1	Confident	51.6	Low	85 Å²	85	53.4 Å²	53.4	32%	0.321	33%	0.33	S	S	.	.	S	Bend	trans	-65.9	131.3	-173.7	-172	-179.1	63.1	117.2	9.2	111.8	E1021 T1022 T1023 T1024 D1185	E1021-R1164 WeakPolarHBondContact O-CD 3.47Å; T1022-R1164 PolarHBondContact O-NE 2.87Å; T1022-R1164 VanDerWaalsContact O-NE 3.15Å; T1023-R1164 PolarHBondContact O-N 2.95Å; T1024-R1164 WeakPolarHBondContact CB-O 3.02Å; T1024-R1164 WeakPolarHBondContact CG2-O 3.42Å; T1024-R1164 PolarHBondContact OG1-O 3.16Å; R1164-D1185 WeakPolarHBondContact CD-O 3.47Å; R1164-D1185 WeakPolarHBondContact CG-O 3.19Å
1165	Q	68.4	Low	51.3	Low	31 Å²	31	54.6 Å²	54.6	15%	0.145	33%	0.333	C	S	.	.			trans	-66	150.7	175.8	-63.3	-171.1	-12.1	0	0	112.5	M1051 H1054 G1163	M1051-Q1165 HydrophobicContact CE-CG 4.39Å; M1051-Q1165 HydrophobicContact CG-CG 4.01Å; H1054-Q1165 HydrophobicContact CB-CG 4.45Å; G1163-Q1165 PolarHBondContact O-N 3.49Å
1166	I	59.2	Low	50.9	Low	31 Å²	31	61.2 Å²	61.2	16%	0.159	36%	0.355	C	S	.	.			trans	-107.9	112.3	174.2	-43.4	169.9	0	0	0	108.9	T1024 L1026 T1153 A1154 L1221	T1024-I1166 HydrophobicContact CG2-CD1 3.95Å; T1024-I1166 HydrophobicContact CG2-CG1 3.83Å; L1026-I1166 HydrophobicContact CD1-CD1 3.84Å; L1026-I1166 HydrophobicContact CD2-CD1 3.76Å; L1026-I1166 HydrophobicContact CG-CD1 4.03Å; T1153-I1166 CarbonylContact C-O 3.57Å; T1153-I1166 VanDerWaalsContact CA-O 3.27Å; T1153-I1166 WeakPolarHBondContact CA-O 3.05Å; A1154-I1166 HydrophobicContact CB-CB 3.62Å; A1154-I1166 HydrophobicContact CB-CD1 3.97Å; A1154-I1166 HydrophobicContact CB-CG1 4.42Å; A1154-I1166 HydrophobicContact CB-CG2 3.45Å; A1154-I1166 VanDerWaalsContact CB-CG2 3.45Å; A1154-I1166 PolarHBondContact N-O 2.92Å; I1166-L1221 HydrophobicContact CD1-CD1 3.39Å; I1166-L1221 HydrophobicContact CG1-CD1 4.1Å
1167	K	49.2	Very low	50.2	Low	80 Å²	80	68.1 Å²	68.1	35%	0.348	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-96.7	115.8	176.4	-60.9	173.7	-178.4	173.7	0	108.8	G1169 D1185	K1167-G1169 PolarHBondContact O-N 2.73Å; K1167-D1185 IonicContact NZ-OD1 2.66Å; K1167-D1185 PolarHBondContact NZ-OD1 3.15Å
1168	I	35.7	Very low	49.1	Very low	105 Å²	105	71 Å²	71	54%	0.538	39%	0.39	S	S	.	.	S	Bend	trans	-82.5	111.6	175.3	-58	176.6	0	0	0	109.1	P1152 A1154	P1152-I1168 HydrophobicContact CB-CB 4.29Å; P1152-I1168 HydrophobicContact CG-CB 4.07Å; P1152-I1168 VanDerWaalsContact O-CB 3.27Å; P1152-I1168 WeakPolarHBondContact O-CB 3.46Å; P1152-I1168 WeakPolarHBondContact O-CG1 3.42Å; P1152-I1168 PolarHBondContact O-N 2.89Å; A1154-I1168 HydrophobicContact CB-CD1 3.68Å; A1154-I1168 HydrophobicContact CB-CG1 3.65Å
1169	G	28.9	Very low	47.6	Very low	57 Å²	57	80.5 Å²	80.5	59%	0.588	42%	0.424	S	S	*	.	S	Bend	trans	115.3	127	-179.8	0	0	0	0	0	111.4	K1167 Q1171	K1167-G1169 PolarHBondContact O-N 2.73Å; G1169-Q1171 PolarHBondContact O-N 3.23Å
1170	G	26.9	Very low	45.7	Very low	89 Å²	89	84.2 Å²	84.2	92%	0.918	46%	0.457	S	S	*	.			trans	-74.9	106.4	-176.1	0	0	0	0	0	112.5
1171	Q	32	Very low	43.7	Very low	106 Å²	106	87.3 Å²	87.3	50%	0.495	47%	0.473	S	S	.	.			trans	-113.6	140.2	159.5	-74.2	174.2	16.6	0	0	109	T522 G1169	T522-Q1171 HydrophobicContact CG2-CG 4.15Å; G1169-Q1171 PolarHBondContact O-N 3.23Å
1172	S	25.3	Very low	41.8	Very low	95 Å²	95	90 Å²	90	66%	0.664	49%	0.487	S	S	*	.			trans	-81.3	141.5	-179.9	-175.2	0	0	0	0	110.8	S1174	S1172-S1174 PolarHBondContact O-N 2.84Å
1173	I	28.3	Very low	40.1	Very low	121 Å²	121	95 Å²	95	62%	0.621	51%	0.51	S	S	*	.	S	Bend	trans	-78.2	92	178.8	-58	162.8	0	0	0	109.3	D1185	I1173-D1185 HydrophobicContact CD1-CB 3.84Å; I1173-D1185 WeakPolarHBondContact CD1-OD2 3.46Å
1174	S	23.8	Very low	38.5	Very low	52 Å²	52	97.8 Å²	97.8	36%	0.364	53%	0.525	S	S	.	.			trans	-160.1	104.3	165	54.9	0	0	0	0	109.5	S1172	S1172-S1174 PolarHBondContact O-N 2.84Å
1175	D	26.4	Very low	37.1	Very low	46 Å²	46	96.1 Å²	96.1	25%	0.246	52%	0.523	C	S	.	.			trans	153.9	-2.2	146.9	-77.5	-24.6	0	0	0	116.2	R517 K1177	R517-D1175 VanDerWaalsContact CZ-CG 3.49Å; R517-D1175 IonicContact CZ-OD1 3.07Å; R517-D1175 IonicContact CZ-OD2 2.8Å; R517-D1175 IonicContact NE-OD2 3.09Å; R517-D1175 PolarHBondContact NE-OD2 3.47Å; R517-D1175 IonicContact NH2-OD1 3.26Å; R517-D1175 PolarHBondContact NH2-OD1 2.97Å; R517-D1175 IonicContact NH2-OD2 2.71Å; R517-D1175 PolarHBondContact NH2-OD2 2.76Å; D1175-K1177 PolarHBondContact O-N 2.9Å
1176	M	29.1	Very low	37.1	Very low	182 Å²	182	100.2 Å²	100.2	90%	0.897	54%	0.538	S	S	*	.			trans	-77.1	87.2	165.1	-83.5	-163.3	164.2	0	0	112
1177	K	25.6	Very low	38.1	Very low	193 Å²	193	98.8 Å²	98.8	84%	0.839	53%	0.53	S	S	*	.			trans	-133.2	36.7	-174.5	-148.2	178.8	-172	175.9	0	114.7	D1175	D1175-K1177 PolarHBondContact O-N 2.9Å
1178	E	30.9	Very low	40	Very low	154 Å²	154	95 Å²	95	72%	0.72	51%	0.514	S	S	*	.	S	Bend	trans	-137.5	30.7	177.2	-144	174.7	-146.7	0	0	117.6
1179	R	28.9	Very low	42.3	Very low	241 Å²	241	90.7 Å²	90.7	91%	0.909	49%	0.493	S	S	*	.			trans	-175.9	123.4	130.7	-103.8	175.2	-177.6	104.3	-2.1	109.2	D1181	R1179-D1181 PolarHBondContact O-N 3.36Å
1180	A	25.5	Very low	45.1	Very low	96 Å²	96	88 Å²	88	79%	0.793	47%	0.465	S	S	*	.			trans	-72.8	121.4	177.1	0	0	0	0	0	110.3
1181	D	36.4	Very low	48	Very low	64 Å²	64	85.1 Å²	85.1	34%	0.342	43%	0.431	S	S	.	.	S	Bend	trans	-162	-47.7	162.8	-112.6	-34	0	0	0	111.5	S1080 N1081 R1179	S1080-D1181 WeakPolarHBondContact CA-O 3.25Å; S1080-D1181 WeakPolarHBondContact OG-CA 3.48Å; S1080-D1181 WeakPolarHBondContact OG-CB 3.43Å; S1080-D1181 PolarHBondContact OG-O 2.87Å; S1080-D1181 PolarHBondContact OG-OD1 3.38Å; N1081-D1181 PolarHBondContact ND2-OD1 3.47Å; R1179-D1181 PolarHBondContact O-N 3.36Å
1182	L	42.8	Very low	50.7	Low	62 Å²	62	80.1 Å²	80.1	33%	0.325	41%	0.407	S	S	.	.			trans	-100.1	135.4	173.9	-82.3	73.2	0	0	0	112.5	A1078 V1085	A1078-L1182 HydrophobicContact CB-CD2 3.72Å; A1078-L1182 HydrophobicContact CB-CG 3.95Å; V1085-L1182 HydrophobicContact CB-CD1 4.23Å; V1085-L1182 HydrophobicContact CG1-CD1 4.23Å; V1085-L1182 HydrophobicContact CG2-CD1 4.24Å
1183	H	50.8	Low	53.5	Low	104 Å²	104	76 Å²	76	48%	0.481	38%	0.378	S	S	.	.			trans	-106	79.5	172.1	-83.2	-50.4	0	0	0	110.1	D1185 Y1186	H1183-D1185 PolarHBondContact O-N 3.1Å; H1183-D1185 VanDerWaalsContact O-N 3.12Å; H1183-Y1186 HydrophobicContact CB-CD2 4.3Å; H1183-Y1186 PolarHBondContact O-N 2.79Å; H1183-Y1186 VanDerWaalsContact O-N 3.17Å
1184	D	52.2	Low	56.2	Low	59 Å²	59	72.2 Å²	72.2	32%	0.316	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.4	-169.5	-65.1	-35.3	0	0	0	115.3	M1051	M1051-D1184 HydrophobicContact CE-CB 4.37Å; M1051-D1184 WeakPolarHBondContact CE-OD1 3.08Å
1185	D	52.9	Low	59.2	Low	51 Å²	51	69.9 Å²	69.9	27%	0.273	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.2	177.4	-62.7	-59.5	0	0	0	114.3	R1164 K1167 I1173 H1183	R1164-D1185 WeakPolarHBondContact CD-O 3.47Å; R1164-D1185 WeakPolarHBondContact CG-O 3.19Å; K1167-D1185 IonicContact NZ-OD1 2.66Å; K1167-D1185 PolarHBondContact NZ-OD1 3.15Å; I1173-D1185 HydrophobicContact CD1-CB 3.84Å; I1173-D1185 WeakPolarHBondContact CD1-OD2 3.46Å; H1183-D1185 PolarHBondContact O-N 3.1Å; H1183-D1185 VanDerWaalsContact O-N 3.12Å
1186	Y	69.5	Low	62.1	Low	117 Å²	117	68.9 Å²	68.9	46%	0.459	34%	0.335	S	S	.	.	S	Bend	trans	-126.4	135.5	-176.6	-61.2	-70.1	0	0	0	112	E1021 M1051 H1183	E1021-Y1186 HydrophobicContact CB-CD1 3.99Å; E1021-Y1186 HydrophobicContact CB-CG 4.43Å; M1051-Y1186 PolarHBondContact N-O 3Å; H1183-Y1186 HydrophobicContact CB-CD2 4.3Å; H1183-Y1186 PolarHBondContact O-N 2.79Å; H1183-Y1186 VanDerWaalsContact O-N 3.17Å
1187	G	79.4	Confident	64.8	Low	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-71.1	168.2	169.6	0	0	0	0	0	112.5	E1021	E1021-G1187 WeakPolarHBondContact CA-O 3.42Å; E1021-G1187 PolarHBondContact O-N 2.83Å
1188	F	88.5	Confident	67.6	Low	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.			trans	-64.8	153.2	168.1	76.2	-81.2	0	0	0	112	F1019 T1020 L1045 M1051 L1052 I1079 I1162 L1192	F1019-F1188 HydrophobicContact CB-CD1 4.48Å; F1019-F1188 HydrophobicContact CB-CD2 4.13Å; F1019-F1188 HydrophobicContact CB-CE1 3.96Å; F1019-F1188 HydrophobicContact CB-CE2 3.57Å; F1019-F1188 HydrophobicContact CB-CZ 3.47Å; F1019-F1188 VanDerWaalsContact CB-CZ 3.47Å; F1019-F1188 HydrophobicContact CD1-CD1 4.4Å; F1019-F1188 AromaticContact CD1-CE1 3.52Å; F1019-F1188 HydrophobicContact CD1-CE1 3.52Å; F1019-F1188 AromaticContact CD1-CZ 3.6Å; F1019-F1188 HydrophobicContact CD1-CZ 3.6Å; F1019-F1188 HydrophobicContact CD2-CE1 4.3Å; F1019-F1188 HydrophobicContact CD2-CE2 4.17Å; F1019-F1188 AromaticContact CD2-CZ 3.53Å; F1019-F1188 HydrophobicContact CD2-CZ 3.53Å; F1019-F1188 HydrophobicContact CE1-CE1 4.05Å; F1019-F1188 HydrophobicContact CE1-CZ 4.2Å; F1019-F1188 HydrophobicContact CE2-CZ 4.13Å; F1019-F1188 AromaticContact CG-CE1 3.67Å; F1019-F1188 HydrophobicContact CG-CE1 3.67Å; F1019-F1188 AromaticContact CG-CE2 3.87Å; F1019-F1188 HydrophobicContact CG-CE2 3.87Å; F1019-F1188 AromaticContact CG-CZ 3.23Å; F1019-F1188 HydrophobicContact CG-CZ 3.23Å; F1019-F1188 HydrophobicContact CZ-CZ 4.43Å; T1020-F1188 CarbonylContact C-O 3.5Å; L1045-F1188 HydrophobicContact CD2-CB 4.23Å; L1045-F1188 HydrophobicContact CD2-CD2 3.75Å; L1045-F1188 HydrophobicContact CD2-CG 4.42Å; M1051-F1188 WeakPolarHBondContact O-CD1 3.43Å; M1051-F1188 PolarHBondContact O-N 3.3Å; L1052-F1188 HydrophobicContact CD2-CB 4.11Å; L1052-F1188 HydrophobicContact CD2-CD1 3.84Å; L1052-F1188 HydrophobicContact CD2-CD2 4.31Å; L1052-F1188 HydrophobicContact CD2-CE1 4.33Å; L1052-F1188 HydrophobicContact CD2-CG 3.83Å; I1079-F1188 HydrophobicContact CD1-CB 3.66Å; I1162-F1188 HydrophobicContact CG2-CE1 4.14Å; F1188-L1192 HydrophobicContact CE2-CB 4.15Å; F1188-L1192 HydrophobicContact CZ-CB 3.78Å; F1188-L1192 HydrophobicContact CZ-CD2 4Å; F1188-L1192 HydrophobicContact CZ-CG 4.39Å
1189	S	84.7	Confident	70	Confident	15 Å²	15	46.3 Å²	46.3	11%	0.105	23%	0.232	C	C	.	.			trans	-114.2	121.9	173	-170.1	0	0	0	0	109.9	F1019 D1046	F1019-S1189 WeakPolarHBondContact O-CA 3.27Å; D1046-S1189 PolarHBondContact N-O 3.04Å
1190	G	87.5	Confident	72.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.9	-160.3	-179	0	0	0	0	0	113.5	F1019 G1044 D1046	F1019-G1190 PolarHBondContact N-O 3.42Å; F1019-G1190 PolarHBondContact O-N 3.41Å; G1044-G1190 CarbonylContact O-C 3.58Å; G1044-G1190 WeakPolarHBondContact O-CA 3.44Å; D1046-G1190 WeakPolarHBondContact OD2-CA 3.31Å; D1046-G1190 PolarHBondContact OD2-N 2.92Å
1191	C	87.2	Confident	74.2	Confident	30 Å²	30	34.1 Å²	34.1	20%	0.203	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126.4	-176.6	-60.7	0	0	0	0	110.7	L1043 G1044 C1237	L1043-C1191 CarbonylContact C-O 3.53Å; L1043-C1191 WeakPolarHBondContact CA-O 3.3Å; L1043-C1191 WeakPolarHBondContact CB-O 2.92Å; G1044-C1191 PolarHBondContact N-O 3.01Å; G1044-C1191 PolarHBondContact O-N 3.22Å; C1191-C1237 VanDerWaalsContact CA-SG 3.5Å; C1191-C1237 HydrophobicContact CB-CB 4.04Å; C1191-C1237 WeakPolarHBondContact CB-SG 3.28Å; C1191-C1237 WeakPolarHBondContact SG-CB 3.26Å; C1191-C1237 CovalentContact SG-SG 2.03Å; C1191-C1237 PolarHBondContact SG-SG 2.83Å
1192	L	89.3	Confident	75.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.2	169.6	-177.8	65.5	0	0	0	108.7	R1017 F1019 M1041 L1043 I1162 F1188 L1210	R1017-L1192 PolarHBondContact N-O 3.23Å; R1017-L1192 PolarHBondContact O-N 2.95Å; F1019-L1192 HydrophobicContact CD2-CB 3.93Å; F1019-L1192 HydrophobicContact CE2-CB 3.86Å; F1019-L1192 HydrophobicContact CE2-CD2 3.88Å; F1019-L1192 HydrophobicContact CE2-CG 4.45Å; F1019-L1192 HydrophobicContact CZ-CD2 4.04Å; M1041-L1192 HydrophobicContact CB-CD1 4.29Å; M1041-L1192 HydrophobicContact CE-CD1 3.81Å; M1041-L1192 HydrophobicContact CE-CD2 4.03Å; L1043-L1192 HydrophobicContact CB-CD1 3.79Å; L1043-L1192 HydrophobicContact CD2-CD1 3.93Å; L1043-L1192 HydrophobicContact CG-CD1 4.46Å; I1162-L1192 HydrophobicContact CG2-CD2 3.77Å; F1188-L1192 HydrophobicContact CE2-CB 4.15Å; F1188-L1192 HydrophobicContact CZ-CB 3.78Å; F1188-L1192 HydrophobicContact CZ-CD2 4Å; F1188-L1192 HydrophobicContact CZ-CG 4.39Å; L1192-L1210 HydrophobicContact CB-CD1 3.98Å; L1192-L1210 HydrophobicContact CD2-CD1 3.61Å; L1192-L1210 HydrophobicContact CG-CD1 3.55Å
1193	N	84.7	Confident	75.7	Confident	10 Å²	10	36 Å²	36	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-51.8	-172.9	-49.6	59	0	0	0	110.1	E1014 D1015 I1042 K1111 L1210	E1014-N1193 PolarHBondContact O-ND2 3.44Å; D1015-N1193 WeakPolarHBondContact O-CB 3.43Å; D1015-N1193 PolarHBondContact O-ND2 2.99Å; I1042-N1193 HydrophobicContact CG2-CB 4.34Å; I1042-N1193 PolarHBondContact O-N 2.84Å; I1042-N1193 PolarHBondContact O-OD1 2.95Å; K1111-N1193 WeakPolarHBondContact CE-ND2 3.3Å; K1111-N1193 PolarHBondContact NZ-ND2 2.97Å; N1193-L1210 WeakPolarHBondContact O-CB 3.25Å; N1193-L1210 PolarHBondContact O-N 3.46Å
1194	K	84.1	Confident	76.6	Confident	41 Å²	41	33 Å²	33	18%	0.178	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143.9	-173.5	-156.4	-178.1	-162.9	92.2	0	111.1	I1042 I1196 S1207 D1209	I1042-K1194 HydrophobicContact CB-CB 4.37Å; I1042-K1194 HydrophobicContact CD1-CB 4.32Å; I1042-K1194 PolarHBondContact N-O 3.25Å; K1194-I1196 HydrophobicContact CD-CD1 4.25Å; K1194-I1196 HydrophobicContact CD-CG1 4.4Å; K1194-I1196 HydrophobicContact CG-CG1 4.43Å; K1194-S1207 WeakPolarHBondContact CE-OG 3.33Å; K1194-D1209 HydrophobicContact CG-CB 4.22Å; K1194-D1209 IonicContact NZ-OD2 3.82Å; K1194-D1209 PolarHBondContact NZ-OD2 3.45Å
1195	M	87.9	Confident	77.8	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.8	168.8	179.1	175.6	166.5	0	0	109.7	I1039 Q1040 M1041 L1053 I1160 I1162 I1197 L1208	I1039-M1195 HydrophobicContact CD1-CE 4.43Å; I1039-M1195 HydrophobicContact CG2-CE 3.83Å; I1039-M1195 HydrophobicContact CG2-CG 4.46Å; Q1040-M1195 CarbonylContact O-C 3.42Å; Q1040-M1195 VanDerWaalsContact O-CA 3.28Å; Q1040-M1195 WeakPolarHBondContact O-CA 3.38Å; M1041-M1195 HydrophobicContact CG-CG 4.19Å; L1053-M1195 HydrophobicContact CD2-CE 3.46Å; L1053-M1195 VanDerWaalsContact CD2-CE 3.46Å; L1053-M1195 HydrophobicContact CD2-SD 4.01Å; I1160-M1195 HydrophobicContact CD1-CE 3.66Å; I1162-M1195 HydrophobicContact CD1-SD 3.48Å; I1162-M1195 WeakPolarHBondContact CD1-SD 3.26Å; I1162-M1195 HydrophobicContact CG1-SD 4.33Å; M1195-I1197 HydrophobicContact CE-CD1 3.91Å; M1195-I1197 HydrophobicContact CE-CG1 3.85Å; M1195-L1208 HydrophobicContact CB-CB 4.47Å; M1195-L1208 PolarHBondContact N-O 3.16Å; M1195-L1208 PolarHBondContact O-N 2.87Å
1196	I	86.8	Confident	79.1	Confident	26 Å²	26	33.8 Å²	33.8	13%	0.133	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.3	178.5	-51.4	178.3	0	0	0	108.5	I1039 Q1040 K1194 H1205 F1206	I1039-I1196 CarbonylContact C-O 3.06Å; I1039-I1196 VanDerWaalsContact CA-O 3.29Å; I1039-I1196 WeakPolarHBondContact CA-O 2.97Å; Q1040-I1196 HydrophobicContact CB-CB 4.24Å; Q1040-I1196 PolarHBondContact N-O 2.94Å; Q1040-I1196 PolarHBondContact O-N 2.83Å; K1194-I1196 HydrophobicContact CD-CD1 4.25Å; K1194-I1196 HydrophobicContact CD-CG1 4.4Å; K1194-I1196 HydrophobicContact CG-CG1 4.43Å; I1196-H1205 WeakPolarHBondContact CG2-CE1 3.44Å; I1196-F1206 CarbonylContact C-O 3.56Å; I1196-F1206 WeakPolarHBondContact CA-O 3.04Å
1197	I	86.2	Confident	79.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.5	175.7	-46.7	174.3	0	0	0	108.4	I1029 I1033 E1038 I1039 I1160 M1195 A1199 H1205 F1206	I1029-I1197 HydrophobicContact CD1-CD1 4.22Å; I1029-I1197 HydrophobicContact CG1-CD1 4.32Å; I1033-I1197 HydrophobicContact CD1-CG2 4.17Å; I1033-I1197 HydrophobicContact CG1-CG2 4.39Å; E1038-I1197 CarbonylContact O-C 3.58Å; E1038-I1197 WeakPolarHBondContact O-CA 3.38Å; I1039-I1197 HydrophobicContact CG1-CG1 4.33Å; I1039-I1197 HydrophobicContact CG1-CG2 4.16Å; I1160-I1197 HydrophobicContact CD1-CD1 3.47Å; I1160-I1197 VanDerWaalsContact CD1-CD1 3.47Å; M1195-I1197 HydrophobicContact CE-CD1 3.91Å; M1195-I1197 HydrophobicContact CE-CG1 3.85Å; I1197-A1199 HydrophobicContact CG2-CB 4.38Å; I1197-H1205 CarbonylContact O-C 3.49Å; I1197-H1205 WeakPolarHBondContact O-CA 3.39Å; I1197-F1206 HydrophobicContact CB-CB 4.3Å; I1197-F1206 HydrophobicContact CD1-CB 4.42Å; I1197-F1206 HydrophobicContact CD1-CD1 3.66Å; I1197-F1206 HydrophobicContact CD1-CE1 4.39Å; I1197-F1206 HydrophobicContact CD1-CG 4.41Å; I1197-F1206 HydrophobicContact CG1-CD1 4.09Å; I1197-F1206 PolarHBondContact N-O 3.17Å; I1197-F1206 PolarHBondContact O-N 2.91Å
1198	N	84.5	Confident	79.5	Confident	52 Å²	52	31 Å²	31	28%	0.278	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.8	166.5	-53.4	-41.7	0	0	0	107.4	T1037 E1038 H1205	T1037-N1198 CarbonylContact C-O 3.45Å; T1037-N1198 WeakPolarHBondContact CA-O 3.36Å; E1038-N1198 HydrophobicContact CB-CB 4.31Å; E1038-N1198 PolarHBondContact N-O 3.39Å; E1038-N1198 PolarHBondContact O-N 3.24Å; E1038-N1198 PolarHBondContact OE2-ND2 2.97Å; E1038-N1198 VanDerWaalsContact OE2-ND2 3.1Å; N1198-H1205 PolarHBondContact OD1-ND1 3.08Å
1199	A	80.9	Confident	78.7	Confident	2 Å²	2	31.6 Å²	31.6	2%	0.017	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	97.9	-171.3	0	0	0	0	0	114.9	F1031 I1033 D1034 I1197 S1201 K1204	F1031-A1199 HydrophobicContact CD2-CB 4.47Å; F1031-A1199 HydrophobicContact CE2-CB 3.93Å; I1033-A1199 HydrophobicContact CB-CB 4.23Å; I1033-A1199 HydrophobicContact CG2-CB 3.79Å; D1034-A1199 CarbonylContact O-C 3.52Å; D1034-A1199 WeakPolarHBondContact O-CA 3.49Å; I1197-A1199 HydrophobicContact CG2-CB 4.38Å; A1199-S1201 PolarHBondContact O-N 2.83Å; A1199-S1201 VanDerWaalsContact O-N 3.1Å; A1199-K1204 HydrophobicContact CB-CB 4.31Å; A1199-K1204 PolarHBondContact N-O 3Å; A1199-K1204 WeakPolarHBondContact O-CB 3.49Å; A1199-K1204 WeakPolarHBondContact O-CD 3.31Å
1200	G	75.6	Confident	78.1	Confident	30 Å²	30	30.9 Å²	30.9	31%	0.309	18%	0.181	S	C	.	.	S	Bend	trans	79.1	-90.6	177.4	0	0	0	0	0	112.6	D1034 Q1035 P1036	D1034-G1200 PolarHBondContact O-N 2.79Å; Q1035-G1200 WeakPolarHBondContact O-CA 3.42Å; P1036-G1200 PolarHBondContact O-N 2.01Å
1201	S	65.8	Low	76.9	Confident	51 Å²	51	32.9 Å²	32.9	36%	0.357	19%	0.192	S	C	.	.	S	Bend	trans	-79.6	144.7	176.1	179.1	0	0	0	0	110.8	A1199 T1203 K1204	A1199-S1201 PolarHBondContact O-N 2.83Å; A1199-S1201 VanDerWaalsContact O-N 3.1Å; S1201-T1203 WeakPolarHBondContact CB-OG1 2.98Å; S1201-T1203 PolarHBondContact O-N 3.08Å; S1201-T1203 PolarHBondContact OG-N 2.89Å; S1201-T1203 PolarHBondContact OG-OG1 3.09Å; S1201-K1204 PolarHBondContact O-N 2.81Å
1202	P	61	Low	75.3	Confident	120 Å²	120	38.3 Å²	38.3	78%	0.779	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.4	170.4	26.1	-35.5	0	0	0	113.8
1203	T	49.8	Very low	73	Confident	45 Å²	45	38.6 Å²	38.6	28%	0.276	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.1	171.7	59.2	0	0	0	0	114	S1201 H1205 R1664 T1862	S1201-T1203 WeakPolarHBondContact CB-OG1 2.98Å; S1201-T1203 PolarHBondContact O-N 3.08Å; S1201-T1203 PolarHBondContact OG-N 2.89Å; S1201-T1203 PolarHBondContact OG-OG1 3.09Å; T1203-H1205 VanDerWaalsContact C-N 3.32Å; T1203-H1205 PolarHBondContact O-N 3.31Å; T1203-R1664 HydrophobicContact CG2-CB 4.02Å; T1203-R1664 HydrophobicContact CG2-CG 3.95Å; T1203-T1862 HydrophobicContact CG2-CG2 3.99Å
1204	K	70.6	Confident	70.5	Confident	42 Å²	42	43 Å²	43	18%	0.183	24%	0.239	C	C	.	.			trans	-92.7	69.7	175.8	-77.5	-173.2	169.4	-169.4	0	109.2	F1031 H1032 D1034 A1199 S1201	F1031-K1204 HydrophobicContact CB-CD 4.21Å; F1031-K1204 HydrophobicContact CB-CG 4.12Å; F1031-K1204 HydrophobicContact CD1-CB 4.26Å; F1031-K1204 HydrophobicContact CD1-CG 4.24Å; F1031-K1204 HydrophobicContact CD2-CB 3.89Å; F1031-K1204 HydrophobicContact CD2-CD 4.02Å; F1031-K1204 HydrophobicContact CD2-CG 3.97Å; F1031-K1204 HydrophobicContact CE1-CB 4.25Å; F1031-K1204 HydrophobicContact CE2-CB 3.88Å; F1031-K1204 HydrophobicContact CE2-CG 4.47Å; F1031-K1204 HydrophobicContact CG-CB 4.1Å; F1031-K1204 HydrophobicContact CG-CD 4.2Å; F1031-K1204 HydrophobicContact CG-CG 3.86Å; F1031-K1204 HydrophobicContact CZ-CB 4.06Å; F1031-K1204 WeakPolarHBondContact CZ-O 3.34Å; H1032-K1204 PolarHBondContact O-NZ 2.73Å; D1034-K1204 IonicContact OD1-NZ 3.66Å; D1034-K1204 PolarHBondContact OD1-NZ 3.33Å; D1034-K1204 IonicContact OD2-NZ 3.89Å; D1034-K1204 PolarHBondContact OD2-NZ 2.99Å; A1199-K1204 HydrophobicContact CB-CB 4.31Å; A1199-K1204 PolarHBondContact N-O 3Å; A1199-K1204 WeakPolarHBondContact O-CB 3.49Å; A1199-K1204 WeakPolarHBondContact O-CD 3.31Å; S1201-K1204 PolarHBondContact O-N 2.81Å
1205	H	76.9	Confident	68.2	Low	92 Å²	92	44.2 Å²	44.2	43%	0.426	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	134	175.2	178.6	82.5	0	0	0	109.8	F1031 I1196 I1197 N1198 T1203	F1031-H1205 WeakPolarHBondContact CE1-O 3.26Å; I1196-H1205 WeakPolarHBondContact CG2-CE1 3.44Å; I1197-H1205 CarbonylContact O-C 3.49Å; I1197-H1205 WeakPolarHBondContact O-CA 3.39Å; N1198-H1205 PolarHBondContact OD1-ND1 3.08Å; T1203-H1205 VanDerWaalsContact C-N 3.32Å; T1203-H1205 PolarHBondContact O-N 3.31Å
1206	F	80.8	Confident	65.9	Low	34 Å²	34	47.6 Å²	47.6	15%	0.149	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	116.4	175.7	174.2	-94.6	0	0	0	109.4	V1027 I1029 P1030 F1031 I1196 I1197 L1208	V1027-F1206 HydrophobicContact CG1-CE1 3.65Å; V1027-F1206 HydrophobicContact CG1-CZ 3.51Å; I1029-F1206 HydrophobicContact CG2-CB 4.47Å; P1030-F1206 VanDerWaalsContact CD-CD2 3.49Å; P1030-F1206 HydrophobicContact CG-CD2 4.09Å; F1031-F1206 HydrophobicContact CE1-CB 3.89Å; F1031-F1206 HydrophobicContact CZ-CB 3.65Å; I1196-F1206 CarbonylContact C-O 3.56Å; I1196-F1206 WeakPolarHBondContact CA-O 3.04Å; I1197-F1206 HydrophobicContact CB-CB 4.3Å; I1197-F1206 HydrophobicContact CD1-CB 4.42Å; I1197-F1206 HydrophobicContact CD1-CD1 3.66Å; I1197-F1206 HydrophobicContact CD1-CE1 4.39Å; I1197-F1206 HydrophobicContact CD1-CG 4.41Å; I1197-F1206 HydrophobicContact CG1-CD1 4.09Å; I1197-F1206 PolarHBondContact N-O 3.17Å; I1197-F1206 PolarHBondContact O-N 2.91Å; F1206-L1208 HydrophobicContact CE1-CB 3.75Å; F1206-L1208 HydrophobicContact CZ-CB 4.14Å
1207	S	79.6	Confident	63.9	Low	46 Å²	46	56.7 Å²	56.7	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.1	173.4	-173.9	0	0	0	0	109.9	K1194	K1194-S1207 WeakPolarHBondContact CE-OG 3.33Å
1208	L	76.7	Confident	62.6	Low	12 Å²	12	58 Å²	58	6%	0.063	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	103.7	168.2	173.2	61.7	0	0	0	108.5	L1025 V1027 I1162 M1195 F1206 L1210 A1213 L1218	L1025-L1208 HydrophobicContact CD2-CD2 4.26Å; V1027-L1208 HydrophobicContact CB-CD2 4.47Å; V1027-L1208 HydrophobicContact CG1-CD2 3.96Å; V1027-L1208 HydrophobicContact CG2-CD2 3.64Å; I1162-L1208 HydrophobicContact CD1-CD2 4.32Å; M1195-L1208 HydrophobicContact CB-CB 4.47Å; M1195-L1208 PolarHBondContact N-O 3.16Å; M1195-L1208 PolarHBondContact O-N 2.87Å; F1206-L1208 HydrophobicContact CE1-CB 3.75Å; F1206-L1208 HydrophobicContact CZ-CB 4.14Å; L1208-L1210 HydrophobicContact CD1-CD2 4.26Å; L1208-L1210 HydrophobicContact CD2-CD2 4.19Å; L1208-L1210 HydrophobicContact CG-CD2 4.19Å; L1208-L1210 HydrophobicContact CG-CG 4.24Å; L1208-A1213 HydrophobicContact CD1-CB 4.3Å; L1208-L1218 HydrophobicContact CD1-CD1 4.09Å; L1208-L1218 HydrophobicContact CD1-CD2 4.45Å
1209	D	71.9	Confident	61.3	Low	14 Å²	14	58 Å²	58	8%	0.075	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.3	167.5	-165.5	-64.7	0	0	0	109.9	K1194 L1211 E1212 A1213	K1194-D1209 HydrophobicContact CG-CB 4.22Å; K1194-D1209 IonicContact NZ-OD2 3.82Å; K1194-D1209 PolarHBondContact NZ-OD2 3.45Å; D1209-L1211 VanDerWaalsContact C-N 3.34Å; D1209-L1211 WeakPolarHBondContact OD1-CB 3.33Å; D1209-L1211 PolarHBondContact OD1-N 3.09Å; D1209-E1212 HydrophobicContact CB-CB 4.07Å; D1209-E1212 HydrophobicContact CB-CG 3.99Å; D1209-E1212 PolarHBondContact O-N 2.89Å; D1209-E1212 PolarHBondContact OD1-N 3.24Å; D1209-A1213 VanDerWaalsContact O-CB 3.23Å; D1209-A1213 WeakPolarHBondContact O-CB 3.34Å; D1209-A1213 PolarHBondContact O-N 2.99Å
1210	L	71.8	Confident	60.8	Low	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-8.5	-172.2	-74	163.8	0	0	0	113.4	R1017 F1019 L1025 L1192 N1193 L1208 A1213 L1218 W1220	R1017-L1210 HydrophobicContact CB-CB 4.24Å; R1017-L1210 HydrophobicContact CG-CB 3.7Å; R1017-L1210 VanDerWaalsContact CG-O 3.27Å; R1017-L1210 WeakPolarHBondContact CG-O 3.2Å; R1017-L1210 PolarHBondContact NE-O 3.45Å; F1019-L1210 HydrophobicContact CE2-CD1 4.24Å; L1025-L1210 HydrophobicContact CD2-CD2 3.79Å; L1192-L1210 HydrophobicContact CB-CD1 3.98Å; L1192-L1210 HydrophobicContact CD2-CD1 3.61Å; L1192-L1210 HydrophobicContact CG-CD1 3.55Å; N1193-L1210 WeakPolarHBondContact O-CB 3.25Å; N1193-L1210 PolarHBondContact O-N 3.46Å; L1208-L1210 HydrophobicContact CD1-CD2 4.26Å; L1208-L1210 HydrophobicContact CD2-CD2 4.19Å; L1208-L1210 HydrophobicContact CG-CD2 4.19Å; L1208-L1210 HydrophobicContact CG-CG 4.24Å; L1210-A1213 HydrophobicContact CD2-CB 4.4Å; L1210-L1218 HydrophobicContact CD2-CD1 4.15Å; L1210-W1220 HydrophobicContact CD2-CH2 4.1Å; L1210-W1220 HydrophobicContact CD2-CZ2 4.03Å
1211	L	64	Low	60.3	Low	41 Å²	41	60.6 Å²	60.6	22%	0.215	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-40.1	164.4	-59.8	179.6	0	0	0	111.1	E1014 D1015 D1209 A1213 I1214 L1236	E1014-L1211 HydrophobicContact CB-CD1 3.82Å; E1014-L1211 HydrophobicContact CG-CD1 4.43Å; D1015-L1211 HydrophobicContact CB-CD2 3.98Å; D1015-L1211 WeakPolarHBondContact O-CD1 3.27Å; D1209-L1211 VanDerWaalsContact C-N 3.34Å; D1209-L1211 WeakPolarHBondContact OD1-CB 3.33Å; D1209-L1211 PolarHBondContact OD1-N 3.09Å; L1211-A1213 VanDerWaalsContact C-N 3.29Å; L1211-A1213 PolarHBondContact O-N 2.9Å; L1211-I1214 WeakPolarHBondContact O-CD1 3.39Å; L1211-I1214 WeakPolarHBondContact O-CG1 3.37Å; L1211-L1236 HydrophobicContact CD2-CD2 3.63Å
1212	E	52.1	Low	60	Low	144 Å²	144	60.2 Å²	60.2	67%	0.673	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-74.6	-21.6	176.8	-54.9	-168.5	120.4	0	0	112.3	D1209 I1214	D1209-E1212 HydrophobicContact CB-CB 4.07Å; D1209-E1212 HydrophobicContact CB-CG 3.99Å; D1209-E1212 PolarHBondContact O-N 2.89Å; D1209-E1212 PolarHBondContact OD1-N 3.24Å; E1212-I1214 PolarHBondContact O-N 2.78Å
1213	A	41.1	Very low	60.1	Low	6 Å²	6	56.2 Å²	56.2	5%	0.05	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-67.7	16.8	178.4	0	0	0	0	0	116.5	L1208 D1209 L1210 L1211 N1215 T1216 L1218	L1208-A1213 HydrophobicContact CD1-CB 4.3Å; D1209-A1213 VanDerWaalsContact O-CB 3.23Å; D1209-A1213 WeakPolarHBondContact O-CB 3.34Å; D1209-A1213 PolarHBondContact O-N 2.99Å; L1210-A1213 HydrophobicContact CD2-CB 4.4Å; L1211-A1213 VanDerWaalsContact C-N 3.29Å; L1211-A1213 PolarHBondContact O-N 2.9Å; A1213-N1215 PolarHBondContact O-N 3.48Å; A1213-T1216 WeakPolarHBondContact CB-OG1 3.36Å; A1213-T1216 PolarHBondContact O-OG1 3.11Å; A1213-L1218 HydrophobicContact CB-CD1 3.8Å
1214	I	33.1	Very low	60	Low	103 Å²	103	58.6 Å²	58.6	53%	0.528	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-61.6	-7.8	172.8	-67.5	163	0	0	0	112.4	L1211 E1212	L1211-I1214 WeakPolarHBondContact O-CD1 3.39Å; L1211-I1214 WeakPolarHBondContact O-CG1 3.37Å; E1212-I1214 PolarHBondContact O-N 2.78Å
1215	N	35.9	Very low	58.7	Low	67 Å²	67	59.7 Å²	59.7	36%	0.358	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-133.5	8.2	-170	-98.4	-33.9	0	0	0	115	A1213 L1647 A1648	A1213-N1215 PolarHBondContact O-N 3.48Å; N1215-L1647 PolarHBondContact ND2-O 3.44Å; N1215-L1647 PolarHBondContact OD1-O 2.9Å; N1215-A1648 HydrophobicContact CB-CB 4.38Å; N1215-A1648 WeakPolarHBondContact O-CB 3.4Å; N1215-A1648 WeakPolarHBondContact OD1-CA 3.27Å; N1215-A1648 PolarHBondContact OD1-N 3.08Å
1216	T	39.7	Very low	57.1	Low	73 Å²	73	58.6 Å²	58.6	45%	0.448	32%	0.318	S	S	.	.	S	Bend	trans	-103	135.3	176	41.7	0	0	0	0	110.4	A1213 L1218	A1213-T1216 WeakPolarHBondContact CB-OG1 3.36Å; A1213-T1216 PolarHBondContact O-OG1 3.11Å; T1216-L1218 PolarHBondContact O-N 3.12Å
1217	K	44.4	Very low	54.8	Low	216 Å²	216	63.4 Å²	63.4	94%	0.939	35%	0.353	S	S	*	.			trans	-73.1	61.1	172.4	-74.9	-171.6	175.1	-178.4	0	111.4
1218	L	58.8	Low	52.5	Low	29 Å²	29	65.9 Å²	65.9	15%	0.152	37%	0.37	C	S	.	.			trans	-67.6	127.8	169.7	-69.5	178.3	0	0	0	109	L1025 V1027 L1208 L1210 A1213 T1216 W1220	L1025-L1218 HydrophobicContact CD1-CB 3.61Å; L1025-L1218 HydrophobicContact CD1-CD1 3.99Å; L1025-L1218 HydrophobicContact CD1-CD2 4.14Å; L1025-L1218 HydrophobicContact CD1-CG 4.1Å; V1027-L1218 HydrophobicContact CG2-CD2 4.5Å; L1208-L1218 HydrophobicContact CD1-CD1 4.09Å; L1208-L1218 HydrophobicContact CD1-CD2 4.45Å; L1210-L1218 HydrophobicContact CD2-CD1 4.15Å; A1213-L1218 HydrophobicContact CB-CD1 3.8Å; T1216-L1218 PolarHBondContact O-N 3.12Å; L1218-W1220 VanDerWaalsContact O-CD1 3.31Å; L1218-W1220 PolarHBondContact O-N 2.93Å
1219	A	57.8	Low	50.7	Low	50 Å²	50	68.9 Å²	68.9	41%	0.413	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	89.1	179.3	0	0	0	0	0	109.7	L1026	L1026-A1219 HydrophobicContact CB-CB 4.11Å; L1026-A1219 HydrophobicContact CD1-CB 4.33Å; L1026-A1219 PolarHBondContact N-O 3.43Å
1220	W	68.7	Low	49	Very low	14 Å²	14	71 Å²	71	5%	0.053	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	136.7	170.3	-61.1	93.5	0	0	0	110.9	R1017 F1019 T1023 T1024 L1025 L1210 L1218 I1223 S1232 A1234	R1017-W1220 HydrophobicContact CB-CH2 4.03Å; R1017-W1220 HydrophobicContact CG-CH2 4.32Å; R1017-W1220 HydrophobicContact CG-CZ2 4.47Å; F1019-W1220 HydrophobicContact CD2-CZ3 4.43Å; F1019-W1220 HydrophobicContact CE1-CZ3 4.01Å; F1019-W1220 AromaticContact CE2-CH2 3.82Å; F1019-W1220 HydrophobicContact CE2-CH2 3.82Å; F1019-W1220 AromaticContact CE2-CZ3 3.7Å; F1019-W1220 HydrophobicContact CE2-CZ3 3.7Å; F1019-W1220 AromaticContact CZ-CH2 3.85Å; F1019-W1220 HydrophobicContact CZ-CH2 3.85Å; F1019-W1220 AromaticContact CZ-CZ3 3.46Å; F1019-W1220 HydrophobicContact CZ-CZ3 3.46Å; F1019-W1220 VanDerWaalsContact CZ-CZ3 3.46Å; T1023-W1220 HydrophobicContact CG2-CE3 3.91Å; T1023-W1220 HydrophobicContact CG2-CZ3 3.97Å; T1024-W1220 CarbonylContact O-C 3.49Å; T1024-W1220 WeakPolarHBondContact O-CA 3.31Å; L1025-W1220 HydrophobicContact CB-CD2 4.44Å; L1025-W1220 HydrophobicContact CB-CE3 3.9Å; L1025-W1220 HydrophobicContact CB-CZ3 3.99Å; L1025-W1220 HydrophobicContact CD1-CD2 4.02Å; L1025-W1220 HydrophobicContact CD1-CE3 4.31Å; L1025-W1220 HydrophobicContact CD1-CG 4.45Å; L1025-W1220 HydrophobicContact CD1-CZ2 4.34Å; L1025-W1220 HydrophobicContact CD2-CH2 4.01Å; L1025-W1220 HydrophobicContact CD2-CZ2 4.29Å; L1025-W1220 HydrophobicContact CD2-CZ3 4.23Å; L1025-W1220 HydrophobicContact CG-CZ3 4.49Å; L1210-W1220 HydrophobicContact CD2-CH2 4.1Å; L1210-W1220 HydrophobicContact CD2-CZ2 4.03Å; L1218-W1220 VanDerWaalsContact O-CD1 3.31Å; L1218-W1220 PolarHBondContact O-N 2.93Å; W1220-I1223 HydrophobicContact CB-CD1 4.06Å; W1220-I1223 HydrophobicContact CD2-CD1 4.1Å; W1220-I1223 HydrophobicContact CE3-CD1 3.57Å; W1220-I1223 HydrophobicContact CG-CD1 4.35Å; W1220-I1223 HydrophobicContact CZ3-CD1 4.3Å; W1220-S1232 WeakPolarHBondContact CB-O 3.47Å; W1220-A1234 HydrophobicContact CE3-CB 3.97Å; W1220-A1234 HydrophobicContact CH2-CB 3.52Å; W1220-A1234 HydrophobicContact CZ2-CB 4.11Å; W1220-A1234 HydrophobicContact CZ3-CB 3.43Å; W1220-A1234 VanDerWaalsContact CZ3-CB 3.43Å
1221	L	65.7	Low	47.7	Very low	74 Å²	74	76.5 Å²	76.5	39%	0.387	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	158.6	171.8	-50.4	171.8	0	0	0	110	T1023 T1024 I1166 I1223	T1023-L1221 WeakPolarHBondContact CA-O 3Å; T1024-L1221 PolarHBondContact N-O 3.06Å; T1024-L1221 PolarHBondContact O-N 2.74Å; I1166-L1221 HydrophobicContact CD1-CD1 3.39Å; I1166-L1221 HydrophobicContact CG1-CD1 4.1Å; L1221-I1223 VanDerWaalsContact C-N 3.26Å; L1221-I1223 PolarHBondContact O-N 2.79Å
1222	G	60.3	Low	47.2	Very low	42 Å²	42	76.6 Å²	76.6	43%	0.433	44%	0.444	S	S	.	.	S	Bend	trans	72.7	19.6	-178.7	0	0	0	0	0	114.1	T1022	T1022-G1222 PolarHBondContact OG1-O 2.69Å
1223	I	63.3	Low	47.6	Very low	36 Å²	36	72.3 Å²	72.3	19%	0.185	42%	0.424	C	S	.	.	S	Bend	trans	-125.7	141.8	173.3	-68.8	154.2	0	0	0	107.4	T1023 W1220 L1221 E1233 A1234	T1023-I1223 HydrophobicContact CG2-CD1 3.66Å; T1023-I1223 HydrophobicContact CG2-CG1 4.32Å; W1220-I1223 HydrophobicContact CB-CD1 4.06Å; W1220-I1223 HydrophobicContact CD2-CD1 4.1Å; W1220-I1223 HydrophobicContact CE3-CD1 3.57Å; W1220-I1223 HydrophobicContact CG-CD1 4.35Å; W1220-I1223 HydrophobicContact CZ3-CD1 4.3Å; L1221-I1223 VanDerWaalsContact C-N 3.26Å; L1221-I1223 PolarHBondContact O-N 2.79Å; I1223-E1233 WeakPolarHBondContact CG2-O 3.5Å; I1223-A1234 HydrophobicContact CD1-CB 3.94Å
1224	E	46.9	Very low	48.9	Very low	95 Å²	95	72 Å²	72	44%	0.444	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-80.8	135.2	175.5	-55.3	-164.2	126.8	0	0	110.2	K970 Q972 N1226	K970-E1224 IonicContact NZ-OE1 2.78Å; K970-E1224 PolarHBondContact NZ-OE1 3.3Å; Q972-E1224 PolarHBondContact NE2-OE1 2.98Å; Q972-E1224 PolarHBondContact NE2-OE2 2.79Å; E1224-N1226 PolarHBondContact O-N 3.14Å
1225	P	43.4	Very low	50.6	Low	65 Å²	65	70 Å²	70	42%	0.422	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-64.4	132.9	-179.3	25.9	-33.4	0	0	0	110.6	P1227	P1225-P1227 WeakPolarHBondContact O-CD 3.4Å
1226	N	42.7	Very low	52.3	Low	70 Å²	70	69.6 Å²	69.6	37%	0.374	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-62.6	120.5	179.1	172.6	-3.4	0	0	0	109.7	E1224 S1228 T1229 G1230 H1231	E1224-N1226 PolarHBondContact O-N 3.14Å; N1226-S1228 VanDerWaalsContact CG-OG 3.3Å; N1226-S1228 PolarHBondContact ND2-OG 2.9Å; N1226-S1228 PolarHBondContact O-N 3.15Å; N1226-S1228 PolarHBondContact OD1-N 3.11Å; N1226-S1228 PolarHBondContact OD1-OG 2.91Å; N1226-T1229 PolarHBondContact O-N 3.25Å; N1226-T1229 VanDerWaalsContact O-N 3.08Å; N1226-G1230 PolarHBondContact O-N 3.34Å; N1226-H1231 PolarHBondContact N-O 2.95Å
1227	P	32.9	Very low	53.8	Low	135 Å²	135	66.6 Å²	66.6	88%	0.877	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.2	-175	26	-35.3	0	0	0	114.2	P1225	P1225-P1227 WeakPolarHBondContact O-CD 3.4Å
1228	S	32.5	Very low	54.6	Low	97 Å²	97	59.1 Å²	59.1	68%	0.678	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-16.8	176.1	63	0	0	0	0	114.6	N1226	N1226-S1228 VanDerWaalsContact CG-OG 3.3Å; N1226-S1228 PolarHBondContact ND2-OG 2.9Å; N1226-S1228 PolarHBondContact O-N 3.15Å; N1226-S1228 PolarHBondContact OD1-N 3.11Å; N1226-S1228 PolarHBondContact OD1-OG 2.91Å
1229	T	37.8	Very low	54.3	Low	76 Å²	76	60.2 Å²	60.2	47%	0.466	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-19.2	-178.1	65.9	0	0	0	0	114.4	N1226 H1231	N1226-T1229 PolarHBondContact O-N 3.25Å; N1226-T1229 VanDerWaalsContact O-N 3.08Å; T1229-H1231 PolarHBondContact O-N 3.23Å; T1229-H1231 PolarHBondContact OG1-N 2.68Å
1230	G	36.9	Very low	53.5	Low	59 Å²	59	59.3 Å²	59.3	61%	0.608	37%	0.37	S	S	*	.			trans	71.2	9.8	-173.4	0	0	0	0	0	114.1	N1226	N1226-G1230 PolarHBondContact O-N 3.34Å
1231	H	43.4	Very low	51.9	Low	115 Å²	115	64.3 Å²	64.3	53%	0.532	40%	0.396	S	S	.	.			trans	-102	131.5	179.5	-61.8	-32.2	0	0	0	111.3	N1226 T1229 E1233	N1226-H1231 PolarHBondContact N-O 2.95Å; T1229-H1231 PolarHBondContact O-N 3.23Å; T1229-H1231 PolarHBondContact OG1-N 2.68Å; H1231-E1233 PolarHBondContact O-N 2.85Å
1232	S	54	Low	50.2	Low	42 Å²	42	69 Å²	69	29%	0.294	41%	0.414	S	S	.	.			trans	-82.4	103.6	164.1	-59	0	0	0	0	108.3	W1220	W1220-S1232 WeakPolarHBondContact CB-O 3.47Å
1233	E	61.5	Low	48.7	Very low	54 Å²	54	71.1 Å²	71.1	25%	0.252	43%	0.427	S	S	.	.			trans	-136.7	145.5	173.4	-79	-174	-145.3	0	0	109.7	R1017 I1223 H1231	R1017-E1233 IonicContact CZ-OE2 3.33Å; R1017-E1233 IonicContact NH1-OE2 2.72Å; R1017-E1233 PolarHBondContact NH1-OE2 2.91Å; R1017-E1233 IonicContact NH2-OE2 3.2Å; R1017-E1233 PolarHBondContact NH2-OE2 2.99Å; I1223-E1233 WeakPolarHBondContact CG2-O 3.5Å; H1231-E1233 PolarHBondContact O-N 2.85Å
1234	A	67.4	Low	47	Very low	1 Å²	1	76.6 Å²	76.6	1%	0.008	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-60.7	140.5	173.3	0	0	0	0	0	111.3	R1017 L1018 W1220 I1223	R1017-A1234 HydrophobicContact CB-CB 3.95Å; R1017-A1234 VanDerWaalsContact CD-O 3.29Å; R1017-A1234 WeakPolarHBondContact CD-O 3.27Å; R1017-A1234 PolarHBondContact NH1-O 2.71Å; L1018-A1234 VanDerWaalsContact O-CB 3.3Å; L1018-A1234 WeakPolarHBondContact O-CB 3.31Å; W1220-A1234 HydrophobicContact CE3-CB 3.97Å; W1220-A1234 HydrophobicContact CH2-CB 3.52Å; W1220-A1234 HydrophobicContact CZ2-CB 4.11Å; W1220-A1234 HydrophobicContact CZ3-CB 3.43Å; W1220-A1234 VanDerWaalsContact CZ3-CB 3.43Å; I1223-A1234 HydrophobicContact CD1-CB 3.94Å
1235	P	69.6	Low	46	Very low	59 Å²	59	76 Å²	76	38%	0.383	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-65.6	155.4	172.9	26.7	-31.1	0	0	0	111.1	L1018	L1018-P1235 HydrophobicContact CB-CG 4.09Å; L1018-P1235 HydrophobicContact CD2-CG 4.15Å; L1018-P1235 PolarHBondContact N-O 3.21Å
1236	L	71	Confident	45.1	Very low	60 Å²	60	78.2 Å²	78.2	31%	0.314	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-69.1	142.5	171.3	-71.9	171.1	0	0	0	110	G1016 L1211 S1238 S1239 S1240	G1016-L1236 CarbonylContact O-C 3.4Å; G1016-L1236 WeakPolarHBondContact O-CA 3.07Å; L1211-L1236 HydrophobicContact CD2-CD2 3.63Å; L1236-S1238 VanDerWaalsContact C-N 3.29Å; L1236-S1238 PolarHBondContact O-N 2.96Å; L1236-S1239 PolarHBondContact N-OG 3.38Å; L1236-S1239 WeakPolarHBondContact O-CA 3.34Å; L1236-S1239 WeakPolarHBondContact O-CB 3.42Å; L1236-S1239 PolarHBondContact O-N 3.28Å; L1236-S1239 PolarHBondContact O-OG 2.76Å; L1236-S1240 PolarHBondContact O-N 3.44Å
1237	C	71.5	Confident	44.3	Very low	10 Å²	10	80.1 Å²	80.1	7%	0.068	50%	0.496	C	S	.	.	H	α-helix	trans	-64.5	-31.8	-177.5	-84.1	0	0	0	0	113.3	D1015 G1016 C1191 S1239 S1240	D1015-C1237 WeakPolarHBondContact OD1-CB 3.47Å; G1016-C1237 PolarHBondContact O-N 3.43Å; C1191-C1237 VanDerWaalsContact CA-SG 3.5Å; C1191-C1237 HydrophobicContact CB-CB 4.04Å; C1191-C1237 WeakPolarHBondContact CB-SG 3.28Å; C1191-C1237 WeakPolarHBondContact SG-CB 3.26Å; C1191-C1237 CovalentContact SG-SG 2.03Å; C1191-C1237 PolarHBondContact SG-SG 2.83Å; C1237-S1239 VanDerWaalsContact C-N 3.28Å; C1237-S1239 PolarHBondContact O-N 2.65Å; C1237-S1240 PolarHBondContact O-N 3.41Å
1238	S	61.3	Low	43.9	Very low	59 Å²	59	79.3 Å²	79.3	41%	0.413	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-27.8	168.9	60.1	0	0	0	0	114.1	D1015 L1236 I1241	D1015-S1238 PolarHBondContact OD1-N 3.46Å; D1015-S1238 VanDerWaalsContact OD1-N 3.14Å; D1015-S1238 WeakPolarHBondContact OD2-CB 3.28Å; D1015-S1238 PolarHBondContact OD2-N 3.2Å; D1015-S1238 PolarHBondContact OD2-OG 3.31Å; L1236-S1238 VanDerWaalsContact C-N 3.29Å; L1236-S1238 PolarHBondContact O-N 2.96Å; S1238-I1241 PolarHBondContact O-N 3.41Å
1239	S	51.6	Low	43.6	Very low	52 Å²	52	81 Å²	81	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-73	-35.1	179.9	73.3	0	0	0	0	112.4	L1236 C1237 I1241 K1242 A1243	L1236-S1239 PolarHBondContact N-OG 3.38Å; L1236-S1239 WeakPolarHBondContact O-CA 3.34Å; L1236-S1239 WeakPolarHBondContact O-CB 3.42Å; L1236-S1239 PolarHBondContact O-N 3.28Å; L1236-S1239 PolarHBondContact O-OG 2.76Å; C1237-S1239 VanDerWaalsContact C-N 3.28Å; C1237-S1239 PolarHBondContact O-N 2.65Å; S1239-I1241 VanDerWaalsContact C-N 3.28Å; S1239-I1241 PolarHBondContact O-N 3.25Å; S1239-K1242 PolarHBondContact O-N 3.23Å; S1239-A1243 PolarHBondContact O-N 3.42Å
1240	S	42.1	Very low	43.1	Very low	30 Å²	30	83.7 Å²	83.7	21%	0.21	50%	0.501	C	S	.	.	H	α-helix	trans	-58.1	-39	173.8	-50.7	0	0	0	0	112.4	L1236 C1237 K1242 A1243 L1244	L1236-S1240 PolarHBondContact O-N 3.44Å; C1237-S1240 PolarHBondContact O-N 3.41Å; S1240-K1242 VanDerWaalsContact C-N 3.32Å; S1240-K1242 PolarHBondContact O-N 2.89Å; S1240-A1243 PolarHBondContact O-N 3.37Å; S1240-L1244 WeakPolarHBondContact O-CD1 3.27Å; S1240-L1244 PolarHBondContact O-N 3.45Å
1241	I	34.5	Very low	42.6	Very low	119 Å²	119	87.2 Å²	87.2	61%	0.61	50%	0.504	S	S	*	.	H	α-helix	trans	-69.2	-31.6	-178.4	-61	174.7	0	0	0	111.3	S1238 S1239 L1244 S1245	S1238-I1241 PolarHBondContact O-N 3.41Å; S1239-I1241 VanDerWaalsContact C-N 3.28Å; S1239-I1241 PolarHBondContact O-N 3.25Å; I1241-L1244 PolarHBondContact O-N 2.93Å; I1241-S1245 PolarHBondContact O-OG 2.75Å
1242	K	29.9	Very low	41.8	Very low	174 Å²	174	86.2 Å²	86.2	76%	0.757	51%	0.51	S	S	*	.	H	α-helix	trans	-77	-26.6	175.6	-69.2	-174.7	176.4	-178	0	113.4	S1239 S1240 L1244	S1239-K1242 PolarHBondContact O-N 3.23Å; S1240-K1242 VanDerWaalsContact C-N 3.32Å; S1240-K1242 PolarHBondContact O-N 2.89Å; K1242-L1244 PolarHBondContact O-N 2.75Å
1243	A	29.3	Very low	40.4	Very low	86 Å²	86	91 Å²	91	71%	0.711	53%	0.533	S	S	*	.	H	α-helix	trans	-72.7	-14.3	169.5	0	0	0	0	0	113.5	S1239 S1240	S1239-A1243 PolarHBondContact O-N 3.42Å; S1240-A1243 PolarHBondContact O-N 3.37Å
1244	L	27.7	Very low	38.8	Very low	151 Å²	151	94.1 Å²	94.1	79%	0.791	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	19.5	179.5	-87.6	122.9	0	0	0	113.6	S1240 I1241 K1242	S1240-L1244 WeakPolarHBondContact O-CD1 3.27Å; S1240-L1244 PolarHBondContact O-N 3.45Å; I1241-L1244 PolarHBondContact O-N 2.93Å; K1242-L1244 PolarHBondContact O-N 2.75Å
1245	S	24.6	Very low	36.8	Very low	81 Å²	81	100.8 Å²	100.8	57%	0.566	60%	0.596	S	S	*	*			trans	-140.8	63	-177.6	45.5	0	0	0	0	114.7	I1241	I1241-S1245 PolarHBondContact O-OG 2.75Å
1246	S	25.9	Very low	34.9	Very low	113 Å²	113	103.5 Å²	103.5	79%	0.79	61%	0.612	S	S	*	*			trans	-130.7	151.9	155.6	62.6	0	0	0	0	110.2
1247	P	25.5	Very low	32.8	Very low	110 Å²	110	106.4 Å²	106.4	71%	0.714	63%	0.626	S	S	*	*			trans	-114.3	142.4	-135.4	39.9	-33.3	0	0	0	116.6
1248	T	24.7	Very low	30.6	Very low	117 Å²	117	112.2 Å²	112.2	72%	0.718	65%	0.653	S	S	*	*			trans	51.2	142.9	136.2	63.1	0	0	0	0	122.7
1249	N	26	Very low	29.2	Very low	133 Å²	133	117 Å²	117	71%	0.711	67%	0.673	S	S	*	*			trans	85.9	153.1	144.6	-71.9	4.9	0	0	0	120.4
1250	D	26.1	Very low	28.2	Very low	132 Å²	132	121.6 Å²	121.6	71%	0.706	69%	0.692	S	S	*	*			trans	73.3	149.5	148.6	-65.8	-8	0	0	0	120.3
1251	I	27	Very low	27.8	Very low	133 Å²	133	125.3 Å²	125.3	68%	0.682	72%	0.716	S	S	*	*			cis	-160.6	133	-31.6	-120.1	166.4	0	0	0	107.2
1252	S	26.1	Very low	27.7	Very low	94 Å²	94	124.6 Å²	124.6	66%	0.657	72%	0.719	S	S	*	*			trans	57.8	162.7	159.6	79.5	0	0	0	0	121.5
1253	N	24.6	Very low	27.6	Very low	144 Å²	144	123.3 Å²	123.3	77%	0.77	72%	0.72	S	S	*	*			trans	13.8	122.1	139.7	-48.5	-16.8	0	0	0	118.2
1254	S	27.7	Very low	27.2	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	72%	0.723	S	S	*	*				174.4	161.8	83.7	50.1	0	0	0	0	115
1255	N	27.2	Very low	27.3	Very low	141 Å²	141	128 Å²	128	75%	0.754	73%	0.727	S	S	*	*			trans	-47.4	151.8	176.1	-58.2	-16.3	0	0	0	117.2
1256	T	28.9	Very low	27.3	Very low	116 Å²	116	128.5 Å²	128.5	71%	0.712	73%	0.73	S	S	*	*			trans	75.7	123.2	132.1	49.8	0	0	0	0	122.8
1257	I	27.2	Very low	27.3	Very low	120 Å²	120	129 Å²	129	62%	0.615	72%	0.724	S	S	*	*				83.4	118.6	126.8	-65.8	167.8	0	0	0	118.7
1258	E	25.8	Very low	27.3	Very low	133 Å²	133	131.8 Å²	131.8	62%	0.621	73%	0.727	S	S	*	*			trans	5.3	142	138.7	-42.4	172	102.4	0	0	119.4
1259	N	31.8	Very low	27.5	Very low	158 Å²	158	130.6 Å²	130.6	85%	0.845	72%	0.72	S	S	*	*				-160.6	171.8	118.5	-110	-74.7	0	0	0	111.2
1260	I	30.2	Very low	27.7	Very low	149 Å²	149	130.8 Å²	130.8	76%	0.764	72%	0.716	S	S	*	*			trans	-111.2	-155.1	-164.6	-29.1	-178.9	0	0	0	111.6
1261	P	32.9	Very low	27.6	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	71%	0.714	S	S	*	*			trans	-109.5	-142.3	-137.7	42.7	-22.2	0	0	0	111.1
1262	P	32	Very low	27.9	Very low	104 Å²	104	133.4 Å²	133.4	68%	0.675	71%	0.714	S	S	*	*			cis	-133.8	-159	-19.4	28	-2.1	0	0	0	113.4
1263	L	27.6	Very low	28.2	Very low	147 Å²	147	135.9 Å²	135.9	77%	0.77	72%	0.72	S	S	*	*			trans	105.5	104.1	150.4	-60.2	163.7	0	0	0	121.3
1264	L	22.6	Very low	28.3	Very low	151 Å²	151	136.2 Å²	136.2	79%	0.791	72%	0.721	S	S	*	*				35.6	147.9	111.9	-81	162.7	0	0	0	123.3
1265	Q	29.1	Very low	28.3	Very low	185 Å²	185	137.7 Å²	137.7	86%	0.864	72%	0.719	S	S	*	*			trans	81.1	153.4	167	-62.4	174	10.7	0	0	117
1266	S	25.1	Very low	28.5	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	72%	0.721	S	S	*	*			cis	-172.7	129.7	-24.1	165.7	0	0	0	0	110.1
1267	D	25.7	Very low	28.5	Very low	122 Å²	122	138.7 Å²	138.7	65%	0.652	72%	0.718	S	S	*	*			trans	51.7	166.6	149	-62.6	-82.3	0	0	0	123.5
1268	Q	26	Very low	28.6	Very low	169 Å²	169	142.1 Å²	142.1	79%	0.79	73%	0.731	S	S	*	*			trans	75.9	144.8	166.5	-48.1	-59.6	-67.5	0	0	114.4
1269	V	27.2	Very low	28.6	Very low	92 Å²	92	142.8 Å²	142.8	56%	0.558	74%	0.739	S	S	*	*			cis	-167.5	144.7	7.7	99.2	0	0	0	0	114.5
1270	Q	30	Very low	28.4	Very low	137 Å²	137	141.5 Å²	141.5	64%	0.64	74%	0.737	S	S	*	*			trans	68.9	156.7	147.5	-75.5	169	59.8	0	0	122
1271	R	26	Very low	28.2	Very low	172 Å²	172	142.3 Å²	142.3	65%	0.649	74%	0.737	S	S	*	*			cis	-169.1	166.2	-18.9	-161.6	-171.8	-59.7	-157.8	3	109
1272	H	32.4	Very low	27.7	Very low	148 Å²	148	142.9 Å²	142.9	69%	0.685	74%	0.739	S	S	*	*			trans	85.7	135	171	-48.7	106.7	0	0	0	114.6
1273	D	32.2	Very low	27.4	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	75%	0.747	S	S	*	*			cis	-135.3	154.9	-1.3	-97.2	-35	0	0	0	114.1
1274	N	27.8	Very low	27.4	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	75%	0.751	S	S	*	*			trans	-111.9	155.9	169.8	-78.4	-69.1	0	0	0	109.4
1275	I	27.8	Very low	27.7	Very low	151 Å²	151	141.5 Å²	141.5	77%	0.774	74%	0.743	S	S	*	*			trans	162	107.1	132	-83.3	152.9	0	0	0	109.1
1276	I	31.2	Very low	27.7	Very low	156 Å²	156	141.3 Å²	141.3	80%	0.8	74%	0.742	S	S	*	*			trans	-174.6	91.1	132.9	-92.3	153.4	0	0	0	108.9
1277	N	28.2	Very low	27.9	Very low	122 Å²	122	140.9 Å²	140.9	65%	0.652	73%	0.732	S	S	*	*			trans	32.9	94.9	138.6	-52.4	-15.2	0	0	0	119.5	N1279	N1277-N1279 PolarHBondContact O-N 3.22Å
1278	Q	28.9	Very low	28.5	Very low	191 Å²	191	144 Å²	144	89%	0.893	74%	0.742	S	S	*	*	S	Bend		39.8	5.8	110.6	-76.7	-174	-33	0	0	122.8
1279	N	25.7	Very low	29.3	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	74%	0.737	S	S	*	*			trans	-129.5	41.7	-172.3	-97.2	-21.7	0	0	0	114.4	N1277	N1277-N1279 PolarHBondContact O-N 3.22Å
1280	V	28.3	Very low	30.3	Very low	131 Å²	131	141.4 Å²	141.4	79%	0.794	73%	0.73	S	S	*	*			trans	-128.3	70.9	149.6	-169.5	0	0	0	0	108.9
1281	Q	25.2	Very low	31.5	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	73%	0.733	S	S	*	*			trans	-69.8	141.5	152.9	-71.3	-176.2	-20.2	0	0	108.1
1282	T	23.9	Very low	33.1	Very low	120 Å²	120	135.4 Å²	135.4	74%	0.736	71%	0.709	S	S	*	*	S	Bend	trans	70.4	128.9	174.1	70	0	0	0	0	117.6
1283	L	24.5	Very low	34.6	Very low	163 Å²	163	130.7 Å²	130.7	85%	0.853	69%	0.688	S	S	*	*			trans	59.2	98.7	167.5	-73.3	76.7	0	0	0	119
1284	S	28.1	Very low	36	Very low	122 Å²	122	126.3 Å²	126.3	85%	0.853	66%	0.664	S	S	*	*			trans	150.4	125.9	133	-173.5	0	0	0	0	111.6
1285	S	29.1	Very low	37.3	Very low	89 Å²	89	125 Å²	125	62%	0.622	65%	0.649	S	S	*	*			cis	-154.6	118.5	-21.6	62.4	0	0	0	0	108.9	I1287	S1285-I1287 PolarHBondContact O-N 2.81Å
1286	H	29.1	Very low	38.4	Very low	181 Å²	181	118.5 Å²	118.5	84%	0.838	62%	0.618	S	S	*	*			trans	-73.7	91.1	-173.4	-75.9	-57.2	0	0	0	114
1287	I	28.5	Very low	39.6	Very low	82 Å²	82	115.7 Å²	115.7	42%	0.421	60%	0.604	S	S	.	*			trans	-142.1	86.2	168.6	-50.8	175.5	0	0	0	111.2	S1285 K1305 Y1306	S1285-I1287 PolarHBondContact O-N 2.81Å; I1287-K1305 HydrophobicContact CB-CD 4.07Å; I1287-K1305 HydrophobicContact CD1-CD 3.45Å; I1287-K1305 VanDerWaalsContact CD1-CD 3.45Å; I1287-K1305 HydrophobicContact CG1-CD 4.31Å; I1287-K1305 HydrophobicContact CG2-CB 4.34Å; I1287-K1305 HydrophobicContact CG2-CD 3.84Å; I1287-K1305 HydrophobicContact CG2-CG 4.28Å; I1287-Y1306 HydrophobicContact CG2-CE1 4.26Å
1288	Q	39.6	Very low	40.8	Very low	186 Å²	186	114.5 Å²	114.5	87%	0.869	60%	0.595	S	S	*	*	S	Bend	trans	-167.9	135	172.5	-104.4	174.8	-5.3	0	0	109.4
1289	T	41.1	Very low	41.8	Very low	110 Å²	110	107 Å²	107	68%	0.675	56%	0.563	S	S	*	*				-119	67.2	-61.3	56	0	0	0	0	109.7	K1291 Y1306	T1289-K1291 PolarHBondContact O-N 3.03Å; T1289-Y1306 WeakPolarHBondContact CA-OH 3.45Å; T1289-Y1306 HydrophobicContact CG2-CE1 4.14Å
1290	K	48.1	Very low	42.7	Very low	98 Å²	98	104.4 Å²	104.4	43%	0.426	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-63.8	122.9	168.7	-101.6	-162.3	177.5	-170.2	0	109	E1293 Y1306 V1318	K1290-E1293 IonicContact NZ-OE1 2.7Å; K1290-E1293 PolarHBondContact NZ-OE1 2.95Å; K1290-Y1306 PolarHBondContact N-OH 3.41Å; K1290-Y1306 VanDerWaalsContact N-OH 3.1Å; K1290-Y1306 WeakPolarHBondContact O-CE2 3.44Å; K1290-Y1306 PolarHBondContact O-OH 2.86Å; K1290-V1318 HydrophobicContact CB-CG1 4Å; K1290-V1318 HydrophobicContact CD-CG2 4.26Å; K1290-V1318 WeakPolarHBondContact O-CG1 3.28Å
1291	K	56.5	Low	43.3	Very low	159 Å²	159	99.1 Å²	99.1	69%	0.691	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-59	159.9	167.6	-68.3	-165	175.3	-174.2	0	111.3	T1289 E1293 E1298	T1289-K1291 PolarHBondContact O-N 3.03Å; K1291-E1293 PolarHBondContact O-N 2.68Å; K1291-E1298 VanDerWaalsContact CA-OE1 3.27Å; K1291-E1298 WeakPolarHBondContact CA-OE1 3.39Å; K1291-E1298 WeakPolarHBondContact CB-OE1 3.34Å; K1291-E1298 WeakPolarHBondContact CG-OE1 3.16Å
1292	C	58.4	Low	43.8	Very low	23 Å²	23	97.1 Å²	97.1	16%	0.155	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-62.4	125	177.2	-53.4	0	0	0	0	111.5	G1296 E1298 C1308	C1292-G1296 VanDerWaalsContact CB-O 3.24Å; C1292-G1296 WeakPolarHBondContact CB-O 3.21Å; C1292-E1298 HydrophobicContact CB-CG 4.3Å; C1292-E1298 PolarHBondContact N-OE1 2.75Å; C1292-E1298 WeakPolarHBondContact SG-CG 3.43Å; C1292-C1308 WeakPolarHBondContact CA-SG 3.43Å; C1292-C1308 HydrophobicContact CB-CB 3.92Å; C1292-C1308 WeakPolarHBondContact CB-SG 3.08Å; C1292-C1308 WeakPolarHBondContact SG-CA 3.13Å; C1292-C1308 WeakPolarHBondContact SG-CB 3.32Å; C1292-C1308 CovalentContact SG-SG 2.03Å; C1292-C1308 PolarHBondContact SG-SG 2.78Å
1293	E	64.8	Low	44.7	Very low	50 Å²	50	95.9 Å²	95.9	23%	0.234	51%	0.514	C	S	.	.	S	Bend	trans	-75.9	169.8	168.8	-56.4	-175.2	-174.3	0	0	109.9	K1290 K1291 Y1295 G1296 V1318	K1290-E1293 IonicContact NZ-OE1 2.7Å; K1290-E1293 PolarHBondContact NZ-OE1 2.95Å; K1291-E1293 PolarHBondContact O-N 2.68Å; E1293-Y1295 VanDerWaalsContact C-N 3.29Å; E1293-Y1295 PolarHBondContact O-N 2.73Å; E1293-G1296 PolarHBondContact O-N 2.04Å; E1293-V1318 WeakPolarHBondContact CA-O 3.41Å; E1293-V1318 WeakPolarHBondContact CB-O 3.4Å; E1293-V1318 HydrophobicContact CG-CG2 4.22Å; E1293-V1318 PolarHBondContact N-O 2.75Å
1294	N	62	Low	45.6	Very low	54 Å²	54	91.2 Å²	91.2	29%	0.289	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	39.5	168.2	-54.2	-54.9	0	0	0	116.4	G1296 W1314 C1319	N1294-G1296 VanDerWaalsContact C-N 3.25Å; N1294-G1296 PolarHBondContact O-N 2.04Å; N1294-W1314 HydrophobicContact CB-CD2 3.5Å; N1294-W1314 VanDerWaalsContact CB-CD2 3.5Å; N1294-W1314 HydrophobicContact CB-CE3 3.77Å; N1294-W1314 HydrophobicContact CB-CG 3.92Å; N1294-W1314 HydrophobicContact CB-CH2 4.19Å; N1294-W1314 HydrophobicContact CB-CZ2 3.95Å; N1294-W1314 HydrophobicContact CB-CZ3 4.11Å; N1294-W1314 VanDerWaalsContact CG-CZ3 3.46Å; N1294-W1314 VanDerWaalsContact ND2-CZ3 3.28Å; N1294-W1314 WeakPolarHBondContact ND2-CZ3 3.01Å; N1294-C1319 PolarHBondContact ND2-O 2.75Å
1295	Y	54.8	Low	46.5	Very low	124 Å²	124	89.2 Å²	89.2	49%	0.486	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	20.9	179.4	-49.3	-88.9	0	0	0	115.4	E1293 Q1311 L1515 M1518 M1519	E1293-Y1295 VanDerWaalsContact C-N 3.29Å; E1293-Y1295 PolarHBondContact O-N 2.73Å; Y1295-Q1311 VanDerWaalsContact O-CG 3.25Å; Y1295-Q1311 WeakPolarHBondContact O-CG 3.46Å; Y1295-Q1311 PolarHBondContact O-NE2 3.32Å; Y1295-L1515 HydrophobicContact CE2-CD1 3.78Å; Y1295-M1518 HydrophobicContact CD1-CE 4.17Å; Y1295-M1518 HydrophobicContact CD2-CE 3.8Å; Y1295-M1518 HydrophobicContact CG-CE 3.59Å; Y1295-M1519 WeakPolarHBondContact OH-CE 3.37Å
1296	G	51.4	Low	47.6	Very low	13 Å²	13	87.3 Å²	87.3	13%	0.134	46%	0.461	C	S	.	.			trans	-58.3	142.1	167.5	0	0	0	0	0	111.7	C1292 E1293 N1294 I1309	C1292-G1296 VanDerWaalsContact CB-O 3.24Å; C1292-G1296 WeakPolarHBondContact CB-O 3.21Å; E1293-G1296 PolarHBondContact O-N 2.04Å; N1294-G1296 VanDerWaalsContact C-N 3.25Å; N1294-G1296 PolarHBondContact O-N 2.04Å; G1296-I1309 WeakPolarHBondContact CA-O 3.45Å
1297	I	54.5	Low	48.7	Very low	97 Å²	97	82.3 Å²	82.3	50%	0.497	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	122.5	-179.6	-61.6	170.1	0	0	0	109.1	S1299 I1309	I1297-S1299 PolarHBondContact O-N 3.41Å; I1297-I1309 HydrophobicContact CB-CB 4.32Å; I1297-I1309 PolarHBondContact N-O 2.89Å; I1297-I1309 PolarHBondContact O-N 2.78Å
1298	E	55	Low	50.2	Low	97 Å²	97	79.3 Å²	79.3	45%	0.453	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	112	174.3	-69.3	173.1	-179.5	0	0	109.9	K1291 C1292	K1291-E1298 VanDerWaalsContact CA-OE1 3.27Å; K1291-E1298 WeakPolarHBondContact CA-OE1 3.39Å; K1291-E1298 WeakPolarHBondContact CB-OE1 3.34Å; K1291-E1298 WeakPolarHBondContact CG-OE1 3.16Å; C1292-E1298 HydrophobicContact CB-CG 4.3Å; C1292-E1298 PolarHBondContact N-OE1 2.75Å; C1292-E1298 WeakPolarHBondContact SG-CG 3.43Å
1299	S	50	Low	51.4	Low	34 Å²	34	74.3 Å²	74.3	24%	0.238	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	131.1	169	60.4	0	0	0	0	109.4	I1297 G1301 Y1306 T1307	I1297-S1299 PolarHBondContact O-N 3.41Å; S1299-G1301 PolarHBondContact O-N 3.41Å; S1299-Y1306 CarbonylContact O-C 3.58Å; S1299-Y1306 WeakPolarHBondContact O-CA 3.35Å; S1299-T1307 PolarHBondContact N-O 2.86Å; S1299-T1307 PolarHBondContact O-N 2.85Å; S1299-T1307 PolarHBondContact O-OG1 2.99Å; S1299-T1307 PolarHBondContact OG-O 3.43Å; S1299-T1307 PolarHBondContact OG-OG1 3.45Å
1300	I	43.8	Very low	52.3	Low	93 Å²	93	69.2 Å²	69.2	48%	0.477	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	116.9	177.7	-63.2	174.8	0	0	0	108.5	L1647	I1300-L1647 HydrophobicContact CD1-CD1 3.83Å; I1300-L1647 HydrophobicContact CD1-CD2 4.1Å
1301	G	41.3	Very low	53.3	Low	20 Å²	20	66.6 Å²	66.6	21%	0.206	37%	0.365	C	S	.	.			trans	-72.2	160.2	170.6	0	0	0	0	0	112	S1299 D1303 G1304 K1305	S1299-G1301 PolarHBondContact O-N 3.41Å; G1301-D1303 PolarHBondContact O-N 3Å; G1301-G1304 PolarHBondContact O-N 2.98Å; G1301-G1304 VanDerWaalsContact O-N 3.09Å; G1301-K1305 PolarHBondContact N-O 3.49Å
1302	S	34.7	Very low	54.2	Low	125 Å²	125	59.5 Å²	59.5	87%	0.874	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-11.1	177.9	44.1	0	0	0	0	113.9	G1304	S1302-G1304 VanDerWaalsContact C-N 3.33Å
1303	D	44.1	Very low	55	Low	94 Å²	94	58.9 Å²	58.9	50%	0.503	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	10.7	173	72.5	-25.8	0	0	0	113.4	G1301 K1305	G1301-D1303 PolarHBondContact O-N 3Å; D1303-K1305 PolarHBondContact O-N 3.05Å; D1303-K1305 WeakPolarHBondContact OD1-CB 3.08Å; D1303-K1305 PolarHBondContact OD1-N 3.38Å; D1303-K1305 VanDerWaalsContact OD2-CD 3.31Å; D1303-K1305 WeakPolarHBondContact OD2-CD 3.21Å; D1303-K1305 WeakPolarHBondContact OD2-CE 3.38Å; D1303-K1305 WeakPolarHBondContact OD2-CG 3.37Å; D1303-K1305 IonicContact OD2-NZ 3.76Å; D1303-K1305 PolarHBondContact OD2-NZ 3.28Å
1304	G	43.4	Very low	55.4	Low	65 Å²	65	60.3 Å²	60.3	67%	0.67	34%	0.336	S	S	*	.	S	Bend	trans	74	-0.1	-178.4	0	0	0	0	0	114.4	G1301 S1302	G1301-G1304 PolarHBondContact O-N 2.98Å; G1301-G1304 VanDerWaalsContact O-N 3.09Å; S1302-G1304 VanDerWaalsContact C-N 3.33Å
1305	K	45.8	Very low	55.7	Low	80 Å²	80	57.8 Å²	57.8	35%	0.348	32%	0.323	S	S	.	.			trans	-87.5	144.5	175.6	-58	-172.9	-164.8	108.4	0	110.1	I1287 G1301 D1303	I1287-K1305 HydrophobicContact CB-CD 4.07Å; I1287-K1305 HydrophobicContact CD1-CD 3.45Å; I1287-K1305 VanDerWaalsContact CD1-CD 3.45Å; I1287-K1305 HydrophobicContact CG1-CD 4.31Å; I1287-K1305 HydrophobicContact CG2-CB 4.34Å; I1287-K1305 HydrophobicContact CG2-CD 3.84Å; I1287-K1305 HydrophobicContact CG2-CG 4.28Å; G1301-K1305 PolarHBondContact N-O 3.49Å; D1303-K1305 PolarHBondContact O-N 3.05Å; D1303-K1305 WeakPolarHBondContact OD1-CB 3.08Å; D1303-K1305 PolarHBondContact OD1-N 3.38Å; D1303-K1305 VanDerWaalsContact OD2-CD 3.31Å; D1303-K1305 WeakPolarHBondContact OD2-CD 3.21Å; D1303-K1305 WeakPolarHBondContact OD2-CE 3.38Å; D1303-K1305 WeakPolarHBondContact OD2-CG 3.37Å; D1303-K1305 IonicContact OD2-NZ 3.76Å; D1303-K1305 PolarHBondContact OD2-NZ 3.28Å
1306	Y	52.6	Low	56.4	Low	49 Å²	49	52.6 Å²	52.6	19%	0.192	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	132.3	169.8	63.8	-80.1	0	0	0	109	I1287 T1289 K1290 S1299 V1318	I1287-Y1306 HydrophobicContact CG2-CE1 4.26Å; T1289-Y1306 WeakPolarHBondContact CA-OH 3.45Å; T1289-Y1306 HydrophobicContact CG2-CE1 4.14Å; K1290-Y1306 PolarHBondContact N-OH 3.41Å; K1290-Y1306 VanDerWaalsContact N-OH 3.1Å; K1290-Y1306 WeakPolarHBondContact O-CE2 3.44Å; K1290-Y1306 PolarHBondContact O-OH 2.86Å; S1299-Y1306 CarbonylContact O-C 3.58Å; S1299-Y1306 WeakPolarHBondContact O-CA 3.35Å; Y1306-V1318 HydrophobicContact CE2-CG1 4.16Å
1307	T	52.9	Low	57	Low	75 Å²	75	54.5 Å²	54.5	46%	0.46	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.4	169.2	35.8	0	0	0	0	109.1	S1299 I1309	S1299-T1307 PolarHBondContact N-O 2.86Å; S1299-T1307 PolarHBondContact O-N 2.85Å; S1299-T1307 PolarHBondContact O-OG1 2.99Å; S1299-T1307 PolarHBondContact OG-O 3.43Å; S1299-T1307 PolarHBondContact OG-OG1 3.45Å; T1307-I1309 PolarHBondContact O-N 2.8Å
1308	C	60.5	Low	57.9	Low	19 Å²	19	50.7 Å²	50.7	13%	0.128	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	111.5	179.2	-68.3	0	0	0	0	111.2	C1292 C1310 C1319	C1292-C1308 WeakPolarHBondContact CA-SG 3.43Å; C1292-C1308 HydrophobicContact CB-CB 3.92Å; C1292-C1308 WeakPolarHBondContact CB-SG 3.08Å; C1292-C1308 WeakPolarHBondContact SG-CA 3.13Å; C1292-C1308 WeakPolarHBondContact SG-CB 3.32Å; C1292-C1308 CovalentContact SG-SG 2.03Å; C1292-C1308 PolarHBondContact SG-SG 2.78Å; C1308-C1310 PolarHBondContact O-N 2.87Å; C1308-C1310 VanDerWaalsContact O-N 3.15Å; C1308-C1319 VanDerWaalsContact CB-SG 3.58Å
1309	I	63	Low	58.5	Low	81 Å²	81	46 Å²	46	42%	0.415	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	98.8	169.2	-57.4	176.8	0	0	0	107.2	G1296 I1297 T1307	G1296-I1309 WeakPolarHBondContact CA-O 3.45Å; I1297-I1309 HydrophobicContact CB-CB 4.32Å; I1297-I1309 PolarHBondContact N-O 2.89Å; I1297-I1309 PolarHBondContact O-N 2.78Å; T1307-I1309 PolarHBondContact O-N 2.8Å
1310	C	61.7	Low	59.5	Low	4 Å²	4	48.6 Å²	48.6	3%	0.027	29%	0.294	C	S	.	.			trans	-74.4	137.8	-176.2	-56.6	0	0	0	0	112.9	C1308 W1314 C1319 Q1540	C1308-C1310 PolarHBondContact O-N 2.87Å; C1308-C1310 VanDerWaalsContact O-N 3.15Å; C1310-W1314 HydrophobicContact CB-CB 4.14Å; C1310-W1314 WeakPolarHBondContact CB-O 3.26Å; C1310-C1319 WeakPolarHBondContact CA-SG 3.44Å; C1310-C1319 HydrophobicContact CB-CB 3.87Å; C1310-C1319 WeakPolarHBondContact CB-SG 3.43Å; C1310-C1319 WeakPolarHBondContact SG-CA 3.47Å; C1310-C1319 WeakPolarHBondContact SG-CB 3.34Å; C1310-C1319 CovalentContact SG-SG 2.04Å; C1310-C1319 PolarHBondContact SG-SG 2.8Å; C1310-Q1540 PolarHBondContact O-N 3.17Å; C1310-Q1540 VanDerWaalsContact O-N 3.16Å
1311	Q	69.2	Low	60.7	Low	42 Å²	42	45.4 Å²	45.4	20%	0.196	28%	0.278	C	S	.	.			trans	-62	151.6	171.4	-58	-59.9	-23.7	0	0	110.3	Y1295 G1313 W1314 M1518	Y1295-Q1311 VanDerWaalsContact O-CG 3.25Å; Y1295-Q1311 WeakPolarHBondContact O-CG 3.46Å; Y1295-Q1311 PolarHBondContact O-NE2 3.32Å; Q1311-G1313 PolarHBondContact O-N 2.84Å; Q1311-W1314 PolarHBondContact O-N 2.72Å; Q1311-M1518 HydrophobicContact CG-CE 4.25Å
1312	P	75.1	Confident	62	Low	11 Å²	11	46.4 Å²	46.4	7%	0.071	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	123.2	174.5	-30.2	37.2	0	0	0	112.5	I1325 W1535 V1538	P1312-I1325 HydrophobicContact CB-CG2 3.95Å; P1312-W1535 HydrophobicContact CB-CE3 4.16Å; P1312-W1535 HydrophobicContact CB-CH2 4.23Å; P1312-W1535 HydrophobicContact CB-CZ3 3.57Å; P1312-W1535 HydrophobicContact CG-CE3 3.74Å; P1312-W1535 HydrophobicContact CG-CZ3 3.55Å; P1312-V1538 HydrophobicContact CG-CG1 4.08Å
1313	G	73.8	Confident	63.9	Low	9 Å²	9	40.7 Å²	40.7	9%	0.093	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.1	-8.2	-177.7	0	0	0	0	0	115.8	Q1311 A1322 V1323	Q1311-G1313 PolarHBondContact O-N 2.84Å; G1313-A1322 WeakPolarHBondContact O-CA 3.13Å; G1313-V1323 PolarHBondContact O-N 3.42Å
1314	W	74.8	Confident	65.6	Low	80 Å²	80	36.6 Å²	36.6	30%	0.303	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145	176.6	-59.5	97.9	0	0	0	112.1	N1294 C1310 Q1311 C1319 Q1321 A1322 Q1540	N1294-W1314 HydrophobicContact CB-CD2 3.5Å; N1294-W1314 VanDerWaalsContact CB-CD2 3.5Å; N1294-W1314 HydrophobicContact CB-CE3 3.77Å; N1294-W1314 HydrophobicContact CB-CG 3.92Å; N1294-W1314 HydrophobicContact CB-CH2 4.19Å; N1294-W1314 HydrophobicContact CB-CZ2 3.95Å; N1294-W1314 HydrophobicContact CB-CZ3 4.11Å; N1294-W1314 VanDerWaalsContact CG-CZ3 3.46Å; N1294-W1314 VanDerWaalsContact ND2-CZ3 3.28Å; N1294-W1314 WeakPolarHBondContact ND2-CZ3 3.01Å; C1310-W1314 HydrophobicContact CB-CB 4.14Å; C1310-W1314 WeakPolarHBondContact CB-O 3.26Å; Q1311-W1314 PolarHBondContact O-N 2.72Å; W1314-C1319 HydrophobicContact CB-CB 4.09Å; W1314-Q1321 CarbonylContact C-O 3.6Å; W1314-Q1321 WeakPolarHBondContact CA-O 3.35Å; W1314-A1322 HydrophobicContact CE3-CB 4.15Å; W1314-A1322 HydrophobicContact CH2-CB 4.31Å; W1314-A1322 HydrophobicContact CZ3-CB 3.84Å; W1314-Q1540 WeakPolarHBondContact O-CB 3.48Å; W1314-Q1540 VanDerWaalsContact O-CG 3.31Å; W1314-Q1540 WeakPolarHBondContact O-CG 3.43Å
1315	Q	68.2	Low	67.5	Low	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	176.1	172.6	78.3	174	19.1	0	0	111.2	C1319 E1320 Q1321 V1323 C1546 P1548	Q1315-C1319 CarbonylContact O-C 3.56Å; Q1315-C1319 VanDerWaalsContact O-C 3.31Å; Q1315-C1319 WeakPolarHBondContact O-CA 3.33Å; Q1315-E1320 PolarHBondContact O-N 3.37Å; Q1315-Q1321 HydrophobicContact CG-CB 3.99Å; Q1315-Q1321 HydrophobicContact CG-CG 4.29Å; Q1315-Q1321 PolarHBondContact N-O 2.78Å; Q1315-Q1321 WeakPolarHBondContact O-CB 3.43Å; Q1315-Q1321 PolarHBondContact O-N 3.33Å; Q1315-V1323 HydrophobicContact CB-CG2 4.03Å; Q1315-V1323 VanDerWaalsContact CD-CG1 3.47Å; Q1315-V1323 HydrophobicContact CG-CB 4.48Å; Q1315-V1323 HydrophobicContact CG-CG1 3.73Å; Q1315-V1323 HydrophobicContact CG-CG2 3.92Å; Q1315-C1546 PolarHBondContact OE1-O 3.17Å; Q1315-C1546 VanDerWaalsContact OE1-O 3.12Å; Q1315-P1548 HydrophobicContact CB-CG 4.06Å; Q1315-P1548 HydrophobicContact CG-CG 4.13Å
1316	G	68.1	Low	69.5	Low	16 Å²	16	31.1 Å²	31.1	17%	0.165	18%	0.181	C	C	.	.	S	Bend	trans	115.8	179.9	-179.9	0	0	0	0	0	111.7	V1318 E1320	G1316-V1318 VanDerWaalsContact C-N 3.26Å; G1316-V1318 PolarHBondContact O-N 3.01Å; G1316-E1320 VanDerWaalsContact C-OE2 3.31Å; G1316-E1320 VanDerWaalsContact CA-OE1 3.29Å; G1316-E1320 WeakPolarHBondContact CA-OE1 3.43Å; G1316-E1320 WeakPolarHBondContact CA-OE2 3.39Å
1317	G	65.8	Low	71.2	Confident	52 Å²	52	28.8 Å²	28.8	54%	0.536	17%	0.172	S	C	.	.	S	Bend	trans	-68.3	-29.6	-178.6	0	0	0	0	0	112.9	E1320	G1317-E1320 PolarHBondContact N-OE1 2.75Å; G1317-E1320 PolarHBondContact N-OE2 3.09Å
1318	V	72.7	Confident	72.9	Confident	17 Å²	17	27.7 Å²	27.7	10%	0.103	16%	0.161	C	C	.	.	S	Bend	trans	-130.5	25	179	-60.2	0	0	0	0	112.1	K1290 E1293 Y1306 G1316 E1320	K1290-V1318 HydrophobicContact CB-CG1 4Å; K1290-V1318 HydrophobicContact CD-CG2 4.26Å; K1290-V1318 WeakPolarHBondContact O-CG1 3.28Å; E1293-V1318 WeakPolarHBondContact CA-O 3.41Å; E1293-V1318 WeakPolarHBondContact CB-O 3.4Å; E1293-V1318 HydrophobicContact CG-CG2 4.22Å; E1293-V1318 PolarHBondContact N-O 2.75Å; Y1306-V1318 HydrophobicContact CE2-CG1 4.16Å; G1316-V1318 VanDerWaalsContact C-N 3.26Å; G1316-V1318 PolarHBondContact O-N 3.01Å; V1318-E1320 VanDerWaalsContact C-N 3.27Å; V1318-E1320 VanDerWaalsContact C-OE2 3.26Å; V1318-E1320 WeakPolarHBondContact CA-OE2 3.19Å; V1318-E1320 HydrophobicContact CG2-CB 4.17Å; V1318-E1320 WeakPolarHBondContact CG2-OE2 3.38Å; V1318-E1320 PolarHBondContact N-OE2 2.78Å; V1318-E1320 PolarHBondContact O-N 3.23Å
1319	C	68.2	Low	74.2	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	61.6	29.1	-178.4	-48.3	0	0	0	0	114.9	N1294 C1308 C1310 W1314 Q1315 Q1321	N1294-C1319 PolarHBondContact ND2-O 2.75Å; C1308-C1319 VanDerWaalsContact CB-SG 3.58Å; C1310-C1319 WeakPolarHBondContact CA-SG 3.44Å; C1310-C1319 HydrophobicContact CB-CB 3.87Å; C1310-C1319 WeakPolarHBondContact CB-SG 3.43Å; C1310-C1319 WeakPolarHBondContact SG-CA 3.47Å; C1310-C1319 WeakPolarHBondContact SG-CB 3.34Å; C1310-C1319 CovalentContact SG-SG 2.04Å; C1310-C1319 PolarHBondContact SG-SG 2.8Å; W1314-C1319 HydrophobicContact CB-CB 4.09Å; Q1315-C1319 CarbonylContact O-C 3.56Å; Q1315-C1319 VanDerWaalsContact O-C 3.31Å; Q1315-C1319 WeakPolarHBondContact O-CA 3.33Å; C1319-Q1321 PolarHBondContact O-N 3.44Å
1320	E	69.7	Low	74.8	Confident	87 Å²	87	25.9 Å²	25.9	41%	0.407	16%	0.155	S	C	.	.			trans	-70.4	-21.4	-177.6	66.3	-81.5	-168.9	0	0	114.8	Q1315 G1316 G1317 V1318	Q1315-E1320 PolarHBondContact O-N 3.37Å; G1316-E1320 VanDerWaalsContact C-OE2 3.31Å; G1316-E1320 VanDerWaalsContact CA-OE1 3.29Å; G1316-E1320 WeakPolarHBondContact CA-OE1 3.43Å; G1316-E1320 WeakPolarHBondContact CA-OE2 3.39Å; G1317-E1320 PolarHBondContact N-OE1 2.75Å; G1317-E1320 PolarHBondContact N-OE2 3.09Å; V1318-E1320 VanDerWaalsContact C-N 3.27Å; V1318-E1320 VanDerWaalsContact C-OE2 3.26Å; V1318-E1320 WeakPolarHBondContact CA-OE2 3.19Å; V1318-E1320 HydrophobicContact CG2-CB 4.17Å; V1318-E1320 WeakPolarHBondContact CG2-OE2 3.38Å; V1318-E1320 PolarHBondContact N-OE2 2.78Å; V1318-E1320 PolarHBondContact O-N 3.23Å
1321	Q	70.4	Confident	75.4	Confident	27 Å²	27	25.9 Å²	25.9	13%	0.126	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.5	-171.4	-173.1	-175	7.2	0	0	112.3	W1314 Q1315 C1319 V1323 L1555	W1314-Q1321 CarbonylContact C-O 3.6Å; W1314-Q1321 WeakPolarHBondContact CA-O 3.35Å; Q1315-Q1321 HydrophobicContact CG-CB 3.99Å; Q1315-Q1321 HydrophobicContact CG-CG 4.29Å; Q1315-Q1321 PolarHBondContact N-O 2.78Å; Q1315-Q1321 WeakPolarHBondContact O-CB 3.43Å; Q1315-Q1321 PolarHBondContact O-N 3.33Å; C1319-Q1321 PolarHBondContact O-N 3.44Å; Q1321-V1323 HydrophobicContact CG-CG1 4.24Å; Q1321-L1555 HydrophobicContact CG-CD2 4.01Å
1322	A	67.9	Low	75.5	Confident	41 Å²	41	26.4 Å²	26.4	34%	0.339	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.5	169	0	0	0	0	0	111.7	G1313 W1314	G1313-A1322 WeakPolarHBondContact O-CA 3.13Å; W1314-A1322 HydrophobicContact CE3-CB 4.15Å; W1314-A1322 HydrophobicContact CH2-CB 4.31Å; W1314-A1322 HydrophobicContact CZ3-CB 3.84Å
1323	V	73.9	Confident	75.4	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.024	16%	0.157	C	C	.	.			trans	-142.6	172.3	-177.8	-77.4	0	0	0	0	112.8	G1313 Q1315 Q1321 I1325 Q1540	G1313-V1323 PolarHBondContact O-N 3.42Å; Q1315-V1323 HydrophobicContact CB-CG2 4.03Å; Q1315-V1323 VanDerWaalsContact CD-CG1 3.47Å; Q1315-V1323 HydrophobicContact CG-CB 4.48Å; Q1315-V1323 HydrophobicContact CG-CG1 3.73Å; Q1315-V1323 HydrophobicContact CG-CG2 3.92Å; Q1321-V1323 HydrophobicContact CG-CG1 4.24Å; V1323-I1325 PolarHBondContact O-N 3.19Å; V1323-Q1540 HydrophobicContact CG2-CG 4.48Å
1324	T	80	Confident	76	Confident	9 Å²	9	26.7 Å²	26.7	6%	0.055	16%	0.158	C	C	.	.			trans	-61.4	129.3	167.8	-60.6	0	0	0	0	110	I1326 Q1540 C1562 P1564 P1576	T1324-I1326 PolarHBondContact O-N 2.94Å; T1324-Q1540 PolarHBondContact O-NE2 2.8Å; T1324-C1562 VanDerWaalsContact CB-O 3.24Å; T1324-C1562 WeakPolarHBondContact CB-O 3.49Å; T1324-C1562 PolarHBondContact OG1-O 3.14Å; T1324-P1564 HydrophobicContact CG2-CG 4.17Å; T1324-P1576 HydrophobicContact CG2-CG 3.79Å; T1324-P1576 WeakPolarHBondContact OG1-CD 3.28Å
1325	I	83.4	Confident	76.6	Confident	29 Å²	29	22.9 Å²	22.9	15%	0.149	14%	0.144	C	C	.	.			trans	-63.8	120.7	178.2	-66.8	160.3	0	0	0	109.5	P1312 V1323 P1327 L1510 A1511 W1535	P1312-I1325 HydrophobicContact CB-CG2 3.95Å; V1323-I1325 PolarHBondContact O-N 3.19Å; I1325-P1327 HydrophobicContact CG2-CG 3.77Å; I1325-L1510 WeakPolarHBondContact CB-O 3.31Å; I1325-L1510 WeakPolarHBondContact CD1-O 3.38Å; I1325-L1510 HydrophobicContact CG2-CB 4.34Å; I1325-L1510 WeakPolarHBondContact CG2-O 2.91Å; I1325-A1511 VanDerWaalsContact CD1-C 3.41Å; I1325-A1511 VanDerWaalsContact CD1-O 3.28Å; I1325-A1511 WeakPolarHBondContact CD1-O 3.3Å; I1325-W1535 HydrophobicContact CG2-CH2 3.77Å; I1325-W1535 HydrophobicContact CG2-CZ3 4.34Å
1326	I	88.1	Confident	77.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.151	C	C	.	.			trans	-128.1	93.7	173.1	-57.3	174.7	0	0	0	107	T1324 Q1328 W1420 A1497 W1541 C1546 P1564	T1324-I1326 PolarHBondContact O-N 2.94Å; I1326-Q1328 PolarHBondContact O-N 3.16Å; I1326-W1420 HydrophobicContact CG2-CH2 3.92Å; I1326-W1420 HydrophobicContact CG2-CZ2 4.41Å; I1326-A1497 HydrophobicContact CG2-CB 4.24Å; I1326-W1541 HydrophobicContact CB-CB 3.93Å; I1326-W1541 HydrophobicContact CG2-CB 3.59Å; I1326-W1541 HydrophobicContact CG2-CG 3.98Å; I1326-W1541 VanDerWaalsContact O-CB 3.27Å; I1326-W1541 WeakPolarHBondContact O-CB 3.45Å; I1326-W1541 PolarHBondContact O-N 2.8Å; I1326-C1546 HydrophobicContact CD1-CB 3.93Å; I1326-P1564 HydrophobicContact CD1-CB 3.85Å; I1326-P1564 HydrophobicContact CD1-CG 3.74Å; I1326-P1564 HydrophobicContact CG1-CG 4.03Å
1327	P	88.7	Confident	78.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	121.7	-173.8	-30.6	42.7	0	0	0	113.6	I1325 F1329 I1335 A1497 I1498 L1510 W1535 V1538	I1325-P1327 HydrophobicContact CG2-CG 3.77Å; P1327-F1329 HydrophobicContact CB-CE2 3.83Å; P1327-F1329 HydrophobicContact CB-CZ 4.1Å; P1327-F1329 WeakPolarHBondContact O-CD2 3.42Å; P1327-F1329 WeakPolarHBondContact O-CE2 3.47Å; P1327-I1335 HydrophobicContact CB-CD1 3.84Å; P1327-I1335 HydrophobicContact CG-CD1 3.91Å; P1327-A1497 CarbonylContact O-C 3.24Å; P1327-A1497 WeakPolarHBondContact O-CA 3.14Å; P1327-I1498 VanDerWaalsContact CD-O 3.23Å; P1327-I1498 WeakPolarHBondContact CD-O 3.12Å; P1327-I1498 PolarHBondContact O-N 2.78Å; P1327-L1510 HydrophobicContact CG-CB 4.36Å; P1327-L1510 HydrophobicContact CG-CD1 3.86Å; P1327-W1535 HydrophobicContact CB-CH2 4.3Å; P1327-W1535 HydrophobicContact CB-CZ3 3.91Å; P1327-W1535 HydrophobicContact CG-CH2 3.42Å; P1327-W1535 VanDerWaalsContact CG-CH2 3.42Å; P1327-W1535 HydrophobicContact CG-CZ3 3.49Å; P1327-W1535 VanDerWaalsContact CG-CZ3 3.49Å; P1327-V1538 HydrophobicContact CB-CG1 3.7Å
1328	Q	87.9	Confident	78.5	Confident	53 Å²	53	25 Å²	25	25%	0.248	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.1	171.3	175.3	174.1	-17.8	0	0	110.4	I1326 G1496 S1539 W1541	I1326-Q1328 PolarHBondContact O-N 3.16Å; Q1328-G1496 CarbonylContact C-O 3.42Å; Q1328-G1496 WeakPolarHBondContact CA-O 2.99Å; Q1328-S1539 PolarHBondContact N-O 2.96Å; Q1328-S1539 PolarHBondContact O-N 2.73Å; Q1328-S1539 PolarHBondContact O-OG 2.02Å; Q1328-W1541 HydrophobicContact CB-CB 4.19Å; Q1328-W1541 HydrophobicContact CB-CE3 4.47Å; Q1328-W1541 HydrophobicContact CG-CE3 4.29Å
1329	F	88.5	Confident	78.5	Confident	3 Å²	3	24.8 Å²	24.8	1%	0.013	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.2	-177.5	-60.9	-94	0	0	0	110.5	P1327 I1335 L1474 F1494 G1496 I1498 V1538	P1327-F1329 HydrophobicContact CB-CE2 3.83Å; P1327-F1329 HydrophobicContact CB-CZ 4.1Å; P1327-F1329 WeakPolarHBondContact O-CD2 3.42Å; P1327-F1329 WeakPolarHBondContact O-CE2 3.47Å; F1329-I1335 HydrophobicContact CE1-CD1 4.26Å; F1329-I1335 HydrophobicContact CE1-CG1 3.97Å; F1329-I1335 HydrophobicContact CZ-CD1 3.7Å; F1329-I1335 HydrophobicContact CZ-CG1 3.92Å; F1329-L1474 WeakPolarHBondContact CE1-O 3.45Å; F1329-L1474 HydrophobicContact CZ-CB 4.18Å; F1329-F1494 CarbonylContact C-O 3.31Å; F1329-F1494 HydrophobicContact CB-CB 4.4Å; F1329-F1494 HydrophobicContact CB-CD1 4.23Å; F1329-F1494 WeakPolarHBondContact CB-O 3.36Å; F1329-F1494 HydrophobicContact CD2-CD1 4.01Å; F1329-F1494 HydrophobicContact CG-CD1 4.33Å; F1329-G1496 PolarHBondContact N-O 3.15Å; F1329-G1496 PolarHBondContact O-N 2.87Å; F1329-G1496 VanDerWaalsContact O-N 3.1Å; F1329-I1498 HydrophobicContact CD2-CD1 4.41Å; F1329-I1498 HydrophobicContact CD2-CG1 4.36Å; F1329-I1498 HydrophobicContact CE2-CB 4.03Å; F1329-I1498 HydrophobicContact CE2-CD1 3.71Å; F1329-I1498 HydrophobicContact CE2-CG1 3.84Å; F1329-I1498 HydrophobicContact CZ-CD1 4.13Å; F1329-V1538 HydrophobicContact CD1-CG2 3.79Å; F1329-V1538 HydrophobicContact CE1-CG2 3.67Å; F1329-V1538 HydrophobicContact CZ-CG2 4.45Å
1330	S	74.7	Confident	78.5	Confident	58 Å²	58	26 Å²	26	41%	0.406	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	34.9	-176	-55.5	0	0	0	0	112.3	N1332 Y1495	S1330-N1332 PolarHBondContact O-N 3.05Å; S1330-N1332 VanDerWaalsContact O-N 3.11Å; S1330-Y1495 VanDerWaalsContact O-CE1 3.31Å; S1330-Y1495 WeakPolarHBondContact O-CE1 3.38Å
1331	G	73.9	Confident	78.2	Confident	4 Å²	4	26.2 Å²	26.2	4%	0.041	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.5	-20.2	176.2	0	0	0	0	0	117.1	G1493 F1494	G1331-G1493 WeakPolarHBondContact O-CA 3.37Å; G1331-G1493 PolarHBondContact O-N 2.68Å; G1331-F1494 WeakPolarHBondContact CA-O 3.32Å; G1331-F1494 PolarHBondContact N-O 2.64Å
1332	N	72.8	Confident	77.7	Confident	53 Å²	53	27.8 Å²	27.8	28%	0.283	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-1.9	167.9	68.4	-21.2	0	0	0	113.2	S1330 N1537 E1852	S1330-N1332 PolarHBondContact O-N 3.05Å; S1330-N1332 VanDerWaalsContact O-N 3.11Å; N1332-N1537 PolarHBondContact ND2-ND2 2.83Å; N1332-N1537 VanDerWaalsContact ND2-ND2 3.12Å; N1332-E1852 WeakPolarHBondContact CB-OE1 3.31Å; N1332-E1852 PolarHBondContact ND2-OE1 3.17Å
1333	G	72.1	Confident	77.1	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	141.1	177.1	0	0	0	0	0	113.2	G1475 G1476 A1536 N1537	G1333-G1475 CarbonylContact O-C 3.59Å; G1333-G1475 VanDerWaalsContact O-C 3.29Å; G1333-G1476 PolarHBondContact O-N 2.98Å; G1333-A1536 CarbonylContact C-O 3.28Å; G1333-A1536 VanDerWaalsContact CA-O 3.3Å; G1333-A1536 WeakPolarHBondContact CA-O 3.33Å; G1333-N1537 WeakPolarHBondContact CA-O 3.41Å
1334	F	86	Confident	76.6	Confident	26 Å²	26	38.3 Å²	38.3	11%	0.114	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.6	167	72.3	-90.1	0	0	0	113	R1336 Y1473 L1474 G1478 A1536	F1334-R1336 HydrophobicContact CD2-CB 4.4Å; F1334-R1336 HydrophobicContact CE2-CB 4.38Å; F1334-Y1473 HydrophobicContact CD2-CD1 4.46Å; F1334-L1474 WeakPolarHBondContact CA-O 3.46Å; F1334-G1478 VanDerWaalsContact CE1-CA 3.47Å; F1334-A1536 HydrophobicContact CD1-CB 4.07Å; F1334-A1536 HydrophobicContact CE1-CB 3.6Å; F1334-A1536 HydrophobicContact CZ-CB 3.84Å; F1334-A1536 PolarHBondContact N-O 2.95Å; F1334-A1536 PolarHBondContact O-N 3.39Å
1335	I	87.8	Confident	75.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127	165.1	-50	170.4	0	0	0	107.9	P1327 F1329 L1337 Y1473 L1474 K1534 W1535 V1538	P1327-I1335 HydrophobicContact CB-CD1 3.84Å; P1327-I1335 HydrophobicContact CG-CD1 3.91Å; F1329-I1335 HydrophobicContact CE1-CD1 4.26Å; F1329-I1335 HydrophobicContact CE1-CG1 3.97Å; F1329-I1335 HydrophobicContact CZ-CD1 3.7Å; F1329-I1335 HydrophobicContact CZ-CG1 3.92Å; I1335-L1337 HydrophobicContact CG2-CD2 3.53Å; I1335-L1337 HydrophobicContact CG2-CG 3.94Å; I1335-Y1473 CarbonylContact O-C 3.46Å; I1335-Y1473 VanDerWaalsContact O-CA 3.31Å; I1335-Y1473 WeakPolarHBondContact O-CA 3.41Å; I1335-L1474 HydrophobicContact CB-CB 4.3Å; I1335-L1474 PolarHBondContact N-O 2.72Å; I1335-L1474 PolarHBondContact O-N 2.74Å; I1335-K1534 CarbonylContact C-O 3.46Å; I1335-K1534 WeakPolarHBondContact CA-O 3.46Å; I1335-W1535 HydrophobicContact CD1-CD2 4Å; I1335-W1535 HydrophobicContact CD1-CE3 3.74Å; I1335-W1535 HydrophobicContact CD1-CH2 3.57Å; I1335-W1535 HydrophobicContact CD1-CZ2 3.79Å; I1335-W1535 HydrophobicContact CD1-CZ3 3.54Å; I1335-W1535 HydrophobicContact CG1-CD2 3.82Å; I1335-W1535 HydrophobicContact CG1-CE3 3.82Å; I1335-W1535 HydrophobicContact CG1-CG 4.33Å; I1335-W1535 HydrophobicContact CG1-CH2 4.47Å; I1335-W1535 HydrophobicContact CG1-CZ2 4.44Å; I1335-W1535 HydrophobicContact CG1-CZ3 4.16Å; I1335-W1535 HydrophobicContact CG2-CD2 4Å; I1335-W1535 HydrophobicContact CG2-CG 4.1Å; I1335-W1535 HydrophobicContact CG2-CZ2 4.18Å; I1335-V1538 HydrophobicContact CG1-CG2 4.1Å
1336	R	85.2	Confident	75.3	Confident	41 Å²	41	37.1 Å²	37.1	16%	0.155	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	105.1	172.4	-179.9	-169.5	174	-77.1	-0.7	109	F1334 P1471 I1472 Y1473 H1530 F1532 E1533 K1534	F1334-R1336 HydrophobicContact CD2-CB 4.4Å; F1334-R1336 HydrophobicContact CE2-CB 4.38Å; R1336-P1471 HydrophobicContact CG-CB 4.3Å; R1336-I1472 WeakPolarHBondContact CA-O 3.06Å; R1336-Y1473 HydrophobicContact CB-CD1 4.08Å; R1336-Y1473 HydrophobicContact CB-CE1 3.89Å; R1336-Y1473 WeakPolarHBondContact CD-OH 3.45Å; R1336-Y1473 HydrophobicContact CG-CD1 4.25Å; R1336-Y1473 HydrophobicContact CG-CE1 3.74Å; R1336-Y1473 HydrophobicContact CG-CE2 4.29Å; R1336-Y1473 PolarHBondContact NE-OH 3.02Å; R1336-H1530 PolarHBondContact NH2-O 2.76Å; R1336-F1532 PolarHBondContact NH1-O 2.67Å; R1336-E1533 WeakPolarHBondContact O-CA 3.19Å; R1336-K1534 HydrophobicContact CB-CB 4.39Å; R1336-K1534 PolarHBondContact N-O 3.39Å; R1336-K1534 PolarHBondContact O-N 2.83Å
1337	L	84.3	Confident	74.3	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	155.9	177.6	-54.6	175.6	0	0	0	111.4	I1335 P1471 I1472 L1474 V1508 L1510 E1533	I1335-L1337 HydrophobicContact CG2-CD2 3.53Å; I1335-L1337 HydrophobicContact CG2-CG 3.94Å; L1337-P1471 WeakPolarHBondContact O-CA 3.15Å; L1337-I1472 HydrophobicContact CB-CB 4.29Å; L1337-I1472 PolarHBondContact N-O 2.86Å; L1337-I1472 PolarHBondContact O-N 3.07Å; L1337-L1474 HydrophobicContact CD1-CD1 3.82Å; L1337-L1474 HydrophobicContact CD1-CG 4.36Å; L1337-V1508 HydrophobicContact CD1-CG1 3.68Å; L1337-L1510 HydrophobicContact CD1-CD2 3.85Å; L1337-E1533 VanDerWaalsContact CD2-CD 3.42Å; L1337-E1533 HydrophobicContact CD2-CG 3.86Å; L1337-E1533 VanDerWaalsContact CD2-OE1 3.27Å; L1337-E1533 WeakPolarHBondContact CD2-OE1 3.33Å
1338	A	72.8	Confident	72.9	Confident	68 Å²	68	50.7 Å²	50.7	56%	0.562	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-68.2	140.8	172.7	0	0	0	0	0	111.7
1339	G	71.7	Confident	71.7	Confident	12 Å²	12	56.9 Å²	56.9	12%	0.124	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-72.3	135	178.8	0	0	0	0	0	112.9	S1470	G1339-S1470 WeakPolarHBondContact CA-O 3.48Å
1340	P	68	Low	71	Confident	26 Å²	26	64.3 Å²	64.3	17%	0.169	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-62.1	142.2	-175.7	25.1	-35.7	0	0	0	112.7	I1346 S1469	P1340-I1346 HydrophobicContact CG-CD1 3.84Å; P1340-I1346 HydrophobicContact CG-CG1 3.88Å; P1340-S1469 PolarHBondContact O-N 3.31Å
1341	T	64.1	Low	71.5	Confident	90 Å²	90	61.7 Å²	61.7	55%	0.552	31%	0.305	S	S	*	.			trans	-123.3	-176.1	-178.4	64.7	0	0	0	0	110.7	K1343 Y1344 A1345	T1341-K1343 PolarHBondContact O-N 2.77Å; T1341-Y1344 PolarHBondContact O-N 2.74Å; T1341-A1345 PolarHBondContact O-N 2.76Å
1342	G	59.8	Low	72.1	Confident	60 Å²	60	63.8 Å²	63.8	62%	0.619	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	56.3	-130.5	177.2	0	0	0	0	0	113.5	Y1344 A1345	G1342-Y1344 VanDerWaalsContact C-N 3.34Å; G1342-Y1344 PolarHBondContact O-N 2.73Å; G1342-A1345 VanDerWaalsContact O-CB 3.32Å; G1342-A1345 WeakPolarHBondContact O-CB 3.38Å; G1342-A1345 PolarHBondContact O-N 2.85Å
1343	K	55.2	Low	73	Confident	155 Å²	155	61.3 Å²	61.3	67%	0.674	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-67.4	-28.5	-179.6	-171.4	173.7	-178.6	175.9	0	113.7	T1341	T1341-K1343 PolarHBondContact O-N 2.77Å
1344	Y	63.7	Low	74	Confident	111 Å²	111	63.5 Å²	63.5	44%	0.435	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-89.4	-5.5	-177.7	-51.7	-62.6	0	0	0	113.4	T1341 G1342 I1346 N1504 A1506	T1341-Y1344 PolarHBondContact O-N 2.74Å; G1342-Y1344 VanDerWaalsContact C-N 3.34Å; G1342-Y1344 PolarHBondContact O-N 2.73Å; Y1344-I1346 PolarHBondContact O-N 3.07Å; Y1344-N1504 PolarHBondContact O-ND2 3.02Å; Y1344-A1506 HydrophobicContact CD1-CB 3.69Å; Y1344-A1506 HydrophobicContact CE1-CB 3.82Å; Y1344-A1506 HydrophobicContact CG-CB 4.24Å
1345	A	63.6	Low	74.4	Confident	12 Å²	12	62.3 Å²	62.3	10%	0.099	31%	0.306	C	S	.	.			trans	-55.9	133.7	-177.9	0	0	0	0	0	112.7	T1341 G1342 K1347	T1341-A1345 PolarHBondContact O-N 2.76Å; G1342-A1345 VanDerWaalsContact O-CB 3.32Å; G1342-A1345 WeakPolarHBondContact O-CB 3.38Å; G1342-A1345 PolarHBondContact O-N 2.85Å; A1345-K1347 VanDerWaalsContact C-N 3.28Å; A1345-K1347 HydrophobicContact CB-CD 4.1Å; A1345-K1347 HydrophobicContact CB-CG 4.08Å; A1345-K1347 PolarHBondContact O-N 2.78Å
1346	I	73.2	Confident	74.7	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.307	C	S	.	.			trans	-76.2	75.4	-172.4	-57.3	166.5	0	0	0	110.2	P1340 Y1344 L1351 I1369 F1465 D1466 L1467 I1503	P1340-I1346 HydrophobicContact CG-CD1 3.84Å; P1340-I1346 HydrophobicContact CG-CG1 3.88Å; Y1344-I1346 PolarHBondContact O-N 3.07Å; I1346-L1351 HydrophobicContact CD1-CD1 4.49Å; I1346-L1351 HydrophobicContact CG1-CD1 4.25Å; I1346-L1351 HydrophobicContact CG2-CB 4.21Å; I1346-L1351 HydrophobicContact CG2-CD1 4.05Å; I1346-L1351 HydrophobicContact CG2-CD2 3.96Å; I1346-L1351 HydrophobicContact CG2-CG 4.3Å; I1346-I1369 HydrophobicContact CD1-CD1 4.14Å; I1346-F1465 HydrophobicContact CG2-CD1 4.39Å; I1346-F1465 HydrophobicContact CG2-CE1 4.07Å; I1346-D1466 WeakPolarHBondContact O-CA 3.26Å; I1346-L1467 HydrophobicContact CB-CB 4.03Å; I1346-L1467 HydrophobicContact CD1-CB 4.19Å; I1346-L1467 HydrophobicContact CG2-CB 3.97Å; I1346-L1467 HydrophobicContact CG2-CD1 4.47Å; I1346-L1467 HydrophobicContact CG2-CG 4.43Å; I1346-L1467 PolarHBondContact O-N 2.89Å; I1346-I1503 HydrophobicContact CD1-CG2 4.26Å; I1346-I1503 HydrophobicContact CG1-CG2 4.26Å
1347	K	66.8	Low	75.2	Confident	126 Å²	126	60.6 Å²	60.6	55%	0.548	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-109.6	110.9	-170.3	-69.9	-179.4	177.5	171.8	0	114.3	A1345 R1349 S1468	A1345-K1347 VanDerWaalsContact C-N 3.28Å; A1345-K1347 HydrophobicContact CB-CD 4.1Å; A1345-K1347 HydrophobicContact CB-CG 4.08Å; A1345-K1347 PolarHBondContact O-N 2.78Å; K1347-R1349 VanDerWaalsContact C-N 3.31Å; K1347-R1349 PolarHBondContact O-N 2.87Å; K1347-S1468 WeakPolarHBondContact CE-OG 3.02Å; K1347-S1468 WeakPolarHBondContact CG-OG 3.27Å
1348	R	59.8	Low	75.6	Confident	160 Å²	160	60.7 Å²	60.7	60%	0.604	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-32.9	151.2	-89.1	178.2	163.2	-179.6	-7.2	121.4	N1464 F1465	R1348-N1464 WeakPolarHBondContact CG-OD1 3.18Å; R1348-N1464 PolarHBondContact NE-OD1 2.81Å; R1348-F1465 WeakPolarHBondContact CA-O 3.5Å; R1348-F1465 PolarHBondContact N-O 2.98Å
1349	R	62.1	Low	76.5	Confident	182 Å²	182	57.5 Å²	57.5	69%	0.687	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-38	-166.2	-64.5	-169	-179.8	-174.2	3	115.9	K1347	K1347-R1349 VanDerWaalsContact C-N 3.31Å; K1347-R1349 PolarHBondContact O-N 2.87Å
1350	K	73.3	Confident	77.2	Confident	159 Å²	159	59.1 Å²	59.1	69%	0.691	28%	0.281	S	S	*	.			trans	-145.1	147.5	170.1	-64	-177.7	-175.1	174.4	0	109.1	K1427 L1428	K1350-K1427 CarbonylContact C-O 3.55Å; K1350-K1427 WeakPolarHBondContact CA-O 3.47Å; K1350-L1428 HydrophobicContact CG-CD2 4.21Å
1351	L	84.9	Confident	77.9	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.016	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.3	160.2	161.2	68.3	0	0	0	107.1	I1346 I1353 K1427 F1465 I1503 N1504	I1346-L1351 HydrophobicContact CD1-CD1 4.49Å; I1346-L1351 HydrophobicContact CG1-CD1 4.25Å; I1346-L1351 HydrophobicContact CG2-CB 4.21Å; I1346-L1351 HydrophobicContact CG2-CD1 4.05Å; I1346-L1351 HydrophobicContact CG2-CD2 3.96Å; I1346-L1351 HydrophobicContact CG2-CG 4.3Å; L1351-I1353 HydrophobicContact CD1-CD1 4.24Å; L1351-I1353 HydrophobicContact CD1-CG1 3.76Å; L1351-I1353 HydrophobicContact CD2-CD1 4.05Å; L1351-I1353 HydrophobicContact CD2-CG1 4.3Å; L1351-I1353 HydrophobicContact CG-CD1 4.37Å; L1351-I1353 HydrophobicContact CG-CG1 4.06Å; L1351-K1427 HydrophobicContact CB-CB 4.18Å; L1351-K1427 PolarHBondContact N-O 2.84Å; L1351-K1427 PolarHBondContact O-N 2.86Å; L1351-F1465 HydrophobicContact CD2-CE1 3.72Å; L1351-F1465 HydrophobicContact CD2-CZ 4.29Å; L1351-I1503 HydrophobicContact CD1-CG2 3.86Å; L1351-N1504 WeakPolarHBondContact CA-OD1 3.31Å
1352	H	87.9	Confident	78.5	Confident	49 Å²	49	57.6 Å²	57.6	23%	0.227	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.9	170.7	-177.5	74.7	0	0	0	108.5	I1425 D1426 I1503 N1504	H1352-I1425 WeakPolarHBondContact CA-O 3.36Å; H1352-D1426 IonicContact CE1-OD1 2.66Å; H1352-D1426 IonicContact CG-OD1 2.62Å; H1352-D1426 IonicContact ND1-OD1 3.98Å; H1352-D1426 PolarHBondContact ND1-OD1 2.92Å; H1352-I1503 WeakPolarHBondContact O-CA 3.42Å; H1352-N1504 PolarHBondContact N-OD1 3.43Å; H1352-N1504 PolarHBondContact O-N 3.34Å
1353	I	91.2	Very high	79.6	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.6	171.3	-59.2	178.8	0	0	0	108.4	L1351 F1367 I1369 L1424 I1425 N1502	L1351-I1353 HydrophobicContact CD1-CD1 4.24Å; L1351-I1353 HydrophobicContact CD1-CG1 3.76Å; L1351-I1353 HydrophobicContact CD2-CD1 4.05Å; L1351-I1353 HydrophobicContact CD2-CG1 4.3Å; L1351-I1353 HydrophobicContact CG-CD1 4.37Å; L1351-I1353 HydrophobicContact CG-CG1 4.06Å; I1353-F1367 HydrophobicContact CD1-CE2 3.84Å; I1353-F1367 HydrophobicContact CD1-CZ 3.75Å; I1353-F1367 HydrophobicContact CG2-CE1 4.45Å; I1353-I1369 HydrophobicContact CD1-CD1 4.39Å; I1353-L1424 CarbonylContact O-C 3.59Å; I1353-L1424 WeakPolarHBondContact O-CA 3.3Å; I1353-I1425 HydrophobicContact CB-CB 4.39Å; I1353-I1425 PolarHBondContact N-O 3.31Å; I1353-I1425 PolarHBondContact O-N 2.83Å; I1353-N1502 WeakPolarHBondContact CA-O 3.47Å
1354	E	92.6	Very high	81.1	Confident	46 Å²	46	47.4 Å²	47.4	22%	0.215	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132	164.9	179.3	171.8	-134.4	0	0	108.7	T1422 L1423 L1424 R1500 I1501 N1502	E1354-T1422 HydrophobicContact CG-CG2 4.32Å; E1354-L1423 CarbonylContact C-O 3.58Å; E1354-L1423 WeakPolarHBondContact CA-O 3.38Å; E1354-L1424 HydrophobicContact CB-CD2 3.62Å; E1354-L1424 HydrophobicContact CG-CD2 3.57Å; E1354-R1500 IonicContact OE2-NH1 2.77Å; E1354-I1501 CarbonylContact O-C 3.6Å; E1354-I1501 WeakPolarHBondContact O-CA 3.21Å; E1354-N1502 HydrophobicContact CB-CB 4.13Å; E1354-N1502 PolarHBondContact N-O 2.84Å; E1354-N1502 PolarHBondContact O-N 3.07Å; E1354-N1502 PolarHBondContact OE2-ND2 3.43Å
1355	L	94.5	Very high	82.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.1	177.5	-176	76.8	0	0	0	109	F1357 L1366 F1367 L1423 I1498 R1500 I1501	L1355-F1357 HydrophobicContact CD2-CB 4.34Å; L1355-F1357 HydrophobicContact CD2-CD1 4.04Å; L1355-F1357 HydrophobicContact CD2-CG 4.22Å; L1355-F1357 HydrophobicContact CG-CB 4.34Å; L1355-F1357 HydrophobicContact CG-CD1 4.18Å; L1355-L1366 HydrophobicContact CD2-CB 4.03Å; L1355-L1366 HydrophobicContact CD2-CD1 4.39Å; L1355-F1367 HydrophobicContact CD2-CD1 4.33Å; L1355-L1423 HydrophobicContact CB-CB 4.31Å; L1355-L1423 HydrophobicContact CD2-CD2 4.34Å; L1355-L1423 PolarHBondContact N-O 2.93Å; L1355-L1423 PolarHBondContact O-N 2.83Å; L1355-I1498 HydrophobicContact CD1-CD1 4.43Å; L1355-I1498 HydrophobicContact CD1-CG2 3.71Å; L1355-R1500 WeakPolarHBondContact CA-O 3.37Å; L1355-I1501 HydrophobicContact CD1-CB 3.98Å
1356	I	94.2	Very high	83.9	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.8	172.4	-51.7	172.9	0	0	0	107.9	W1420 N1421 T1422 Q1499 R1500 I1566	I1356-W1420 HydrophobicContact CG2-CE3 4.04Å; I1356-N1421 WeakPolarHBondContact CA-O 3.42Å; I1356-T1422 HydrophobicContact CG1-CG2 4.41Å; I1356-Q1499 HydrophobicContact CB-CB 4.22Å; I1356-Q1499 HydrophobicContact CB-CG 4.49Å; I1356-Q1499 HydrophobicContact CG2-CB 4.13Å; I1356-Q1499 HydrophobicContact CG2-CG 4.32Å; I1356-Q1499 PolarHBondContact O-N 2.84Å; I1356-R1500 HydrophobicContact CB-CB 4.14Å; I1356-R1500 HydrophobicContact CD1-CB 3.91Å; I1356-R1500 HydrophobicContact CD1-CG 4.44Å; I1356-R1500 HydrophobicContact CG1-CB 4.14Å; I1356-R1500 PolarHBondContact N-O 2.8Å; I1356-R1500 PolarHBondContact O-N 2.86Å; I1356-I1566 HydrophobicContact CD1-CG1 4.07Å; I1356-I1566 HydrophobicContact CG2-CG1 4.5Å; I1356-I1566 HydrophobicContact CG2-CG2 4.42Å
1357	F	95.3	Very high	84.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	147.5	-167.6	70.3	-70.5	0	0	0	112.7	L1355 V1359 L1366 L1384 V1415 W1420 N1421 L1423 F1494 A1497 I1498	L1355-F1357 HydrophobicContact CD2-CB 4.34Å; L1355-F1357 HydrophobicContact CD2-CD1 4.04Å; L1355-F1357 HydrophobicContact CD2-CG 4.22Å; L1355-F1357 HydrophobicContact CG-CB 4.34Å; L1355-F1357 HydrophobicContact CG-CD1 4.18Å; F1357-V1359 HydrophobicContact CD2-CG2 3.79Å; F1357-V1359 HydrophobicContact CE2-CG2 3.57Å; F1357-L1366 HydrophobicContact CD2-CD1 4.11Å; F1357-L1366 HydrophobicContact CD2-CD2 3.42Å; F1357-L1366 VanDerWaalsContact CD2-CD2 3.42Å; F1357-L1366 HydrophobicContact CD2-CG 4.43Å; F1357-L1366 HydrophobicContact CE2-CD1 3.68Å; F1357-L1366 HydrophobicContact CE2-CD2 3.73Å; F1357-L1366 HydrophobicContact CE2-CG 4.38Å; F1357-L1366 HydrophobicContact CG-CD2 4.15Å; F1357-L1366 HydrophobicContact CZ-CD1 3.96Å; F1357-L1384 HydrophobicContact CE2-CD2 4.5Å; F1357-V1415 HydrophobicContact CE2-CG1 3.75Å; F1357-V1415 HydrophobicContact CZ-CG1 3.74Å; F1357-W1420 VanDerWaalsContact C-CE3 3.47Å; F1357-N1421 HydrophobicContact CD1-CB 4.04Å; F1357-N1421 WeakPolarHBondContact CD1-O 3.23Å; F1357-N1421 HydrophobicContact CE1-CB 3.58Å; F1357-N1421 HydrophobicContact CE2-CB 4.23Å; F1357-N1421 HydrophobicContact CZ-CB 3.7Å; F1357-N1421 PolarHBondContact N-O 3.07Å; F1357-N1421 WeakPolarHBondContact O-CA 3.37Å; F1357-N1421 WeakPolarHBondContact O-CB 3.46Å; F1357-N1421 PolarHBondContact O-N 3.36Å; F1357-L1423 HydrophobicContact CD1-CB 4.35Å; F1357-L1423 HydrophobicContact CE1-CB 3.65Å; F1357-L1423 HydrophobicContact CZ-CB 4.47Å; F1357-F1494 HydrophobicContact CB-CZ 4.37Å; F1357-F1494 HydrophobicContact CD2-CE2 4.35Å; F1357-F1494 AromaticContact CD2-CZ 3.94Å; F1357-F1494 HydrophobicContact CD2-CZ 3.94Å; F1357-A1497 CarbonylContact C-O 3.46Å; F1357-A1497 VanDerWaalsContact CA-O 3.3Å; F1357-A1497 WeakPolarHBondContact CA-O 3.44Å; F1357-I1498 HydrophobicContact CB-CG1 4.31Å
1358	L	93.4	Very high	86	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.042	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.3	-178.9	170.8	64.6	0	0	0	108.7	Q1419 W1420 F1494 G1496 A1497 W1541	L1358-Q1419 VanDerWaalsContact CD1-N 3.3Å; L1358-Q1419 VanDerWaalsContact CD1-O 3.23Å; L1358-Q1419 WeakPolarHBondContact CD1-O 3.22Å; L1358-W1420 HydrophobicContact CB-CD2 3.84Å; L1358-W1420 HydrophobicContact CB-CE3 3.6Å; L1358-W1420 HydrophobicContact CB-CH2 3.73Å; L1358-W1420 HydrophobicContact CB-CZ2 3.96Å; L1358-W1420 HydrophobicContact CB-CZ3 3.54Å; L1358-W1420 HydrophobicContact CD2-CH2 4.4Å; L1358-W1420 HydrophobicContact CD2-CZ2 3.95Å; L1358-F1494 VanDerWaalsContact O-CZ 3.25Å; L1358-F1494 WeakPolarHBondContact O-CZ 3.01Å; L1358-G1496 CarbonylContact O-C 3.53Å; L1358-G1496 WeakPolarHBondContact O-CA 3.41Å; L1358-A1497 HydrophobicContact CB-CB 4.44Å; L1358-A1497 PolarHBondContact N-O 2.84Å; L1358-A1497 PolarHBondContact O-N 3.25Å; L1358-W1541 HydrophobicContact CD2-CD2 4.24Å; L1358-W1541 HydrophobicContact CD2-CE3 4.41Å; L1358-W1541 HydrophobicContact CD2-CH2 3.38Å; L1358-W1541 HydrophobicContact CD2-CZ2 3.08Å; L1358-W1541 HydrophobicContact CD2-CZ3 4.03Å
1359	V	91.7	Very high	87.4	Confident	1 Å²	1	28 Å²	28	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.7	-179.6	-168.7	0	0	0	0	109.6	F1357 Q1361 L1384 V1415 L1417 N1418 F1494	F1357-V1359 HydrophobicContact CD2-CG2 3.79Å; F1357-V1359 HydrophobicContact CE2-CG2 3.57Å; V1359-Q1361 WeakPolarHBondContact CG1-O 3.13Å; V1359-L1384 HydrophobicContact CB-CD1 4.2Å; V1359-L1384 HydrophobicContact CG1-CD1 3.52Å; V1359-L1384 HydrophobicContact CG2-CD1 3.54Å; V1359-V1415 HydrophobicContact CG2-CG1 3.65Å; V1359-L1417 HydrophobicContact CB-CD2 3.9Å; V1359-L1417 HydrophobicContact CG1-CD2 3.45Å; V1359-L1417 VanDerWaalsContact CG1-CD2 3.45Å; V1359-N1418 PolarHBondContact O-N 3.23Å; V1359-F1494 HydrophobicContact CB-CE2 4.34Å; V1359-F1494 HydrophobicContact CG1-CE2 4.22Å; V1359-F1494 HydrophobicContact CG2-CE2 4.09Å; V1359-F1494 HydrophobicContact CG2-CZ 4.41Å
1360	T	86.3	Confident	88.5	Confident	47 Å²	47	20 Å²	20	29%	0.288	10%	0.099	S	C	.	.	S	Bend	trans	-104.2	-27.8	177.9	56.9	0	0	0	0	113.4	Y1495 G1496 W1541	T1360-Y1495 PolarHBondContact N-O 2.7Å; T1360-Y1495 PolarHBondContact OG1-O 3.01Å; T1360-Y1495 VanDerWaalsContact OG1-O 3.09Å; T1360-G1496 PolarHBondContact OG1-N 3Å; T1360-W1541 HydrophobicContact CG2-CH2 4.43Å; T1360-W1541 HydrophobicContact CG2-CZ3 4.25Å
1361	Q	81.9	Confident	88.7	Confident	42 Å²	42	13 Å²	13	20%	0.196	7%	0.07	C	C	.	.	S	Bend	trans	-135.2	152	171.7	-50.6	-172.3	14.7	0	0	110.7	V1359 Y1495 M1802	V1359-Q1361 WeakPolarHBondContact CG1-O 3.13Å; Q1361-Y1495 HydrophobicContact CB-CD2 4.29Å; Q1361-Y1495 HydrophobicContact CB-CG 3.92Å; Q1361-Y1495 HydrophobicContact CG-CD1 4.33Å; Q1361-Y1495 HydrophobicContact CG-CG 4.13Å; Q1361-Y1495 PolarHBondContact N-O 3.39Å; Q1361-M1802 HydrophobicContact CB-CE 3.97Å
1362	P	77.8	Confident	88.1	Confident	41 Å²	41	19.6 Å²	19.6	27%	0.266	10%	0.099	S	C	.	.	S	Bend	trans	-66.9	150.2	-179.2	27.3	-35.8	0	0	0	113	N1388 M1802	P1362-N1388 VanDerWaalsContact CA-OD1 3.24Å; P1362-N1388 WeakPolarHBondContact CA-OD1 3.24Å; P1362-N1388 VanDerWaalsContact CB-OD1 3.31Å; P1362-N1388 WeakPolarHBondContact CB-OD1 3.45Å; P1362-M1802 HydrophobicContact CG-CE 3.98Å
1363	S	82	Confident	86.9	Confident	2 Å²	2	20.4 Å²	20.4	1%	0.014	11%	0.11	C	C	.	.			trans	69.4	150.7	-177.4	-153.7	0	0	0	0	115.1	L1384 D1385 I1490 H1492 R1793	S1363-L1384 VanDerWaalsContact CA-O 3.27Å; S1363-L1384 WeakPolarHBondContact CA-O 3.25Å; S1363-L1384 PolarHBondContact OG-O 3Å; S1363-L1384 VanDerWaalsContact OG-O 3.11Å; S1363-D1385 WeakPolarHBondContact CA-O 3.37Å; S1363-D1385 PolarHBondContact N-O 3.16Å; S1363-I1490 WeakPolarHBondContact OG-CD1 3.44Å; S1363-H1492 VanDerWaalsContact C-CE1 3.47Å; S1363-H1492 PolarHBondContact OG-NE2 3.42Å; S1363-R1793 PolarHBondContact OG-NH1 2.78Å
1364	G	86.8	Confident	85.3	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145	153.6	170.2	0	0	0	0	0	115	L1366 Y1383 L1384 I1490 G1493	G1364-L1366 PolarHBondContact O-N 3.03Å; G1364-Y1383 CarbonylContact O-C 3.52Å; G1364-Y1383 VanDerWaalsContact O-CA 3.26Å; G1364-Y1383 WeakPolarHBondContact O-CA 3.47Å; G1364-Y1383 WeakPolarHBondContact O-CB 3.33Å; G1364-L1384 PolarHBondContact N-O 3.12Å; G1364-L1384 VanDerWaalsContact N-O 3.1Å; G1364-L1384 PolarHBondContact O-N 2.68Å; G1364-I1490 VanDerWaalsContact CA-CD1 3.44Å; G1364-I1490 VanDerWaalsContact N-CD1 3.26Å; G1364-G1493 VanDerWaalsContact CA-O 3.31Å; G1364-G1493 WeakPolarHBondContact CA-O 3.46Å
1365	L	91.5	Very high	83.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	106.8	179.7	-175.9	64.9	0	0	0	112	F1368 G1475 Y1477 I1488 I1490 H1492	L1365-F1368 HydrophobicContact CD1-CB 4.31Å; L1365-F1368 HydrophobicContact CD2-CB 4.1Å; L1365-G1475 CarbonylContact O-C 3.57Å; L1365-G1475 WeakPolarHBondContact O-CA 3.35Å; L1365-Y1477 HydrophobicContact CD2-CD1 3.79Å; L1365-Y1477 HydrophobicContact CD2-CE1 4.35Å; L1365-I1488 HydrophobicContact CD1-CD1 3.9Å; L1365-I1488 HydrophobicContact CD2-CD1 4.27Å; L1365-I1490 HydrophobicContact CB-CG2 3.97Å; L1365-I1490 HydrophobicContact CD1-CG2 4.01Å; L1365-H1492 PolarHBondContact N-O 2.96Å
1366	L	93.7	Very high	82.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	-51.1	177.8	-64.4	171.3	0	0	0	111.4	L1355 F1357 G1364 A1382 L1384 L1390 L1423 G1475 F1494	L1355-L1366 HydrophobicContact CD2-CB 4.03Å; L1355-L1366 HydrophobicContact CD2-CD1 4.39Å; F1357-L1366 HydrophobicContact CD2-CD1 4.11Å; F1357-L1366 HydrophobicContact CD2-CD2 3.42Å; F1357-L1366 VanDerWaalsContact CD2-CD2 3.42Å; F1357-L1366 HydrophobicContact CD2-CG 4.43Å; F1357-L1366 HydrophobicContact CE2-CD1 3.68Å; F1357-L1366 HydrophobicContact CE2-CD2 3.73Å; F1357-L1366 HydrophobicContact CE2-CG 4.38Å; F1357-L1366 HydrophobicContact CG-CD2 4.15Å; F1357-L1366 HydrophobicContact CZ-CD1 3.96Å; G1364-L1366 PolarHBondContact O-N 3.03Å; L1366-A1382 WeakPolarHBondContact CB-O 3.33Å; L1366-A1382 PolarHBondContact N-O 3.13Å; L1366-L1384 HydrophobicContact CD1-CD2 4.21Å; L1366-L1384 HydrophobicContact CD1-CG 4.27Å; L1366-L1384 HydrophobicContact CD2-CD1 4.46Å; L1366-L1384 HydrophobicContact CG-CG 4.38Å; L1366-L1390 HydrophobicContact CD1-CD1 3.56Å; L1366-L1423 HydrophobicContact CD1-CD2 4.28Å; L1366-G1475 PolarHBondContact O-N 3.44Å; L1366-F1494 HydrophobicContact CD2-CD1 4.21Å; L1366-F1494 HydrophobicContact CD2-CD2 3.57Å; L1366-F1494 HydrophobicContact CD2-CE1 4.05Å; L1366-F1494 HydrophobicContact CD2-CE2 3.41Å; L1366-F1494 VanDerWaalsContact CD2-CE2 3.41Å; L1366-F1494 HydrophobicContact CD2-CG 3.98Å; L1366-F1494 HydrophobicContact CD2-CZ 3.66Å
1367	F	93.6	Very high	81.1	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	159.2	172.9	77.1	-94.1	0	0	0	112.6	I1353 L1355 I1369 I1380 A1381 A1382 I1425 Y1473 L1474	I1353-F1367 HydrophobicContact CD1-CE2 3.84Å; I1353-F1367 HydrophobicContact CD1-CZ 3.75Å; I1353-F1367 HydrophobicContact CG2-CE1 4.45Å; L1355-F1367 HydrophobicContact CD2-CD1 4.33Å; F1367-I1369 HydrophobicContact CD2-CG1 4.26Å; F1367-I1369 HydrophobicContact CE2-CG1 4.45Å; F1367-I1380 HydrophobicContact CE2-CG1 4.41Å; F1367-I1380 HydrophobicContact CE2-CG2 4.26Å; F1367-A1381 WeakPolarHBondContact O-CA 3.09Å; F1367-A1382 HydrophobicContact CD1-CB 3.74Å; F1367-A1382 HydrophobicContact CE1-CB 3.35Å; F1367-A1382 HydrophobicContact CZ-CB 3.92Å; F1367-A1382 PolarHBondContact N-O 2.94Å; F1367-A1382 PolarHBondContact O-N 2.97Å; F1367-I1425 HydrophobicContact CE1-CD1 3.79Å; F1367-I1425 HydrophobicContact CZ-CD1 3.71Å; F1367-Y1473 CarbonylContact C-O 3.57Å; F1367-Y1473 WeakPolarHBondContact CA-O 3.18Å; F1367-Y1473 WeakPolarHBondContact CB-O 3.29Å; F1367-L1474 HydrophobicContact CB-CD2 3.77Å
1368	F	90.9	Very high	80.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	138.3	172.7	173.6	-129.8	0	0	0	111.9	L1365 P1370 F1379 I1380 A1381 Y1473 I1484 I1488	L1365-F1368 HydrophobicContact CD1-CB 4.31Å; L1365-F1368 HydrophobicContact CD2-CB 4.1Å; F1368-P1370 HydrophobicContact CD1-CB 4.38Å; F1368-P1370 HydrophobicContact CD1-CG 4.37Å; F1368-P1370 HydrophobicContact CE1-CB 3.53Å; F1368-P1370 HydrophobicContact CE1-CG 3.94Å; F1368-P1370 HydrophobicContact CE2-CB 4.42Å; F1368-P1370 VanDerWaalsContact CZ-CA 3.43Å; F1368-P1370 HydrophobicContact CZ-CB 3.58Å; F1368-P1370 HydrophobicContact CZ-CG 4.41Å; F1368-F1379 HydrophobicContact CD2-CD2 4.34Å; F1368-F1379 HydrophobicContact CE2-CB 4.2Å; F1368-F1379 AromaticContact CE2-CD2 3.72Å; F1368-F1379 HydrophobicContact CE2-CD2 3.72Å; F1368-F1379 HydrophobicContact CE2-CE2 4.44Å; F1368-F1379 HydrophobicContact CE2-CG 4.22Å; F1368-I1380 WeakPolarHBondContact CD2-O 3.07Å; F1368-A1381 HydrophobicContact CD2-CB 3.92Å; F1368-Y1473 PolarHBondContact N-O 3.49Å; F1368-Y1473 PolarHBondContact O-N 2.9Å; F1368-I1484 HydrophobicContact CD1-CD1 4.28Å; F1368-I1484 HydrophobicContact CD1-CG2 3.97Å; F1368-I1484 HydrophobicContact CE1-CB 4.13Å; F1368-I1484 HydrophobicContact CE1-CD1 3.88Å; F1368-I1484 HydrophobicContact CE1-CG1 3.81Å; F1368-I1484 HydrophobicContact CE1-CG2 3.42Å; F1368-I1484 VanDerWaalsContact CE1-CG2 3.42Å; F1368-I1484 HydrophobicContact CZ-CG2 4.19Å; F1368-I1488 HydrophobicContact CB-CD1 3.96Å; F1368-I1488 HydrophobicContact CD1-CD1 4.04Å; F1368-I1488 HydrophobicContact CD2-CD1 3.53Å; F1368-I1488 HydrophobicContact CD2-CG1 4.19Å; F1368-I1488 HydrophobicContact CE1-CD1 4.37Å; F1368-I1488 HydrophobicContact CE2-CD1 3.88Å; F1368-I1488 HydrophobicContact CE2-CG1 4.11Å; F1368-I1488 HydrophobicContact CG-CD1 3.59Å; F1368-I1488 HydrophobicContact CZ-CD1 4.28Å
1369	I	89.8	Confident	80.2	Confident	1 Å²	1	33 Å²	33	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	98.4	171.5	-49.7	-179.8	0	0	0	107.6	I1346 I1353 F1367 F1379 I1380 L1467 I1472	I1346-I1369 HydrophobicContact CD1-CD1 4.14Å; I1353-I1369 HydrophobicContact CD1-CD1 4.39Å; F1367-I1369 HydrophobicContact CD2-CG1 4.26Å; F1367-I1369 HydrophobicContact CE2-CG1 4.45Å; I1369-F1379 WeakPolarHBondContact O-CB 3.41Å; I1369-I1380 HydrophobicContact CB-CG2 4.09Å; I1369-I1380 HydrophobicContact CD1-CG2 4.06Å; I1369-I1380 HydrophobicContact CG1-CG2 4.23Å; I1369-I1380 PolarHBondContact N-O 3.08Å; I1369-I1380 PolarHBondContact O-N 3.15Å; I1369-L1467 HydrophobicContact CB-CD1 4.07Å; I1369-L1467 HydrophobicContact CG2-CB 3.99Å; I1369-L1467 HydrophobicContact CG2-CD1 3.8Å; I1369-L1467 HydrophobicContact CG2-CD2 4.5Å; I1369-L1467 HydrophobicContact CG2-CG 4.32Å; I1369-I1472 HydrophobicContact CD1-CG1 4.09Å; I1369-I1472 HydrophobicContact CG1-CG1 4.09Å; I1369-I1472 HydrophobicContact CG1-CG2 4.38Å
1370	P	84.4	Confident	80.2	Confident	13 Å²	13	33 Å²	33	8%	0.084	18%	0.179	C	C	.	.			trans	-63.7	163.6	-178.8	20	-31.2	0	0	0	114.3	F1368 S1470 P1471 Y1473	F1368-P1370 HydrophobicContact CD1-CB 4.38Å; F1368-P1370 HydrophobicContact CD1-CG 4.37Å; F1368-P1370 HydrophobicContact CE1-CB 3.53Å; F1368-P1370 HydrophobicContact CE1-CG 3.94Å; F1368-P1370 HydrophobicContact CE2-CB 4.42Å; F1368-P1370 VanDerWaalsContact CZ-CA 3.43Å; F1368-P1370 HydrophobicContact CZ-CB 3.58Å; F1368-P1370 HydrophobicContact CZ-CG 4.41Å; P1370-S1470 VanDerWaalsContact O-CB 3.28Å; P1370-S1470 WeakPolarHBondContact O-CB 3.48Å; P1370-S1470 PolarHBondContact O-OG 2.91Å; P1370-P1471 WeakPolarHBondContact CD-O 3.32Å; P1370-P1471 HydrophobicContact CG-CG 4.01Å; P1370-Y1473 HydrophobicContact CG-CD2 4.13Å; P1370-Y1473 HydrophobicContact CG-CE2 3.89Å
1371	P	77.9	Confident	80.5	Confident	12 Å²	12	30.8 Å²	30.8	8%	0.078	17%	0.166	C	C	.	.			trans	-63.4	143	166.6	30.5	-34.9	0	0	0	110.5	S1373 P1378 Y1487	P1371-S1373 WeakPolarHBondContact CB-O 3.34Å; P1371-S1373 WeakPolarHBondContact CG-O 3.07Å; P1371-S1373 PolarHBondContact O-N 2.95Å; P1371-P1378 VanDerWaalsContact CA-O 3.25Å; P1371-P1378 WeakPolarHBondContact CA-O 3.23Å; P1371-P1378 WeakPolarHBondContact CB-O 3.17Å; P1371-Y1487 HydrophobicContact CG-CE1 3.88Å; P1371-Y1487 HydrophobicContact CG-CE2 4.27Å
1372	K	71.9	Confident	81.1	Confident	143 Å²	143	28.8 Å²	28.8	62%	0.622	16%	0.156	S	C	*	.	S	Bend	trans	-60.6	-11.1	177	-171.7	167.8	-171.4	160.9	0	114.5	S1468 S1469 S1470	K1372-S1468 WeakPolarHBondContact CD-O 3.19Å; K1372-S1468 PolarHBondContact NZ-O 2.98Å; K1372-S1469 PolarHBondContact NZ-OG 2.8Å; K1372-S1470 PolarHBondContact N-OG 2.81Å
1373	S	63.3	Low	81.8	Confident	65 Å²	65	27.5 Å²	27.5	46%	0.455	15%	0.146	S	C	.	.	S	Bend	trans	-138.1	139.5	176.6	53.6	0	0	0	0	109.2	P1371 H1375	P1371-S1373 WeakPolarHBondContact CB-O 3.34Å; P1371-S1373 WeakPolarHBondContact CG-O 3.07Å; P1371-S1373 PolarHBondContact O-N 2.95Å; S1373-H1375 PolarHBondContact O-N 2.98Å
1374	P	58.7	Low	82.3	Confident	72 Å²	72	27.4 Å²	27.4	47%	0.468	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-7.7	-167.7	25.4	-35.7	0	0	0	115.4	Y1487	P1374-Y1487 PolarHBondContact O-OH 2.9Å
1375	H	58.4	Low	82.4	Confident	156 Å²	156	28.5 Å²	28.5	72%	0.722	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.4	122.9	177.4	-51.6	-53.5	0	0	0	111.9	S1373 G1377	S1373-H1375 PolarHBondContact O-N 2.98Å; H1375-G1377 VanDerWaalsContact C-N 3.3Å; H1375-G1377 PolarHBondContact O-N 2.88Å
1376	N	62.7	Low	82.1	Confident	81 Å²	81	31.3 Å²	31.3	43%	0.433	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	33.9	161.3	-77.5	-4.7	0	0	0	118	R1395 N1403 Y1487	N1376-R1395 PolarHBondContact OD1-NH1 3.05Å; N1376-N1403 PolarHBondContact ND2-OD1 2.81Å; N1376-Y1487 PolarHBondContact N-OH 2.76Å
1377	G	71.1	Confident	81.7	Confident	5 Å²	5	36.3 Å²	36.3	5%	0.052	19%	0.188	C	C	.	.			trans	-82	173.7	164.8	0	0	0	0	0	113.8	H1375	H1375-G1377 VanDerWaalsContact C-N 3.3Å; H1375-G1377 PolarHBondContact O-N 2.88Å
1378	P	82	Confident	81.4	Confident	12 Å²	12	37.5 Å²	37.5	8%	0.078	19%	0.194	C	C	.	.			trans	-67.9	153.5	166.8	31.7	-35.6	0	0	0	110.8	P1371 R1395 F1465 L1467	P1371-P1378 VanDerWaalsContact CA-O 3.25Å; P1371-P1378 WeakPolarHBondContact CA-O 3.23Å; P1371-P1378 WeakPolarHBondContact CB-O 3.17Å; P1378-R1395 VanDerWaalsContact CA-O 3.26Å; P1378-R1395 WeakPolarHBondContact CA-O 3.21Å; P1378-R1395 VanDerWaalsContact CB-O 3.29Å; P1378-R1395 WeakPolarHBondContact CB-O 3.45Å; P1378-F1465 HydrophobicContact CB-CD2 3.95Å; P1378-F1465 HydrophobicContact CB-CE2 4.39Å; P1378-L1467 HydrophobicContact CB-CD2 4.46Å; P1378-L1467 HydrophobicContact CG-CD2 4.24Å; P1378-L1467 VanDerWaalsContact O-CD2 3.29Å; P1378-L1467 WeakPolarHBondContact O-CD2 3.31Å
1379	F	87.9	Confident	81.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	166.5	174.9	79.9	-95.2	0	0	0	110.8	F1368 I1369 A1381 V1393 C1394 R1395 L1406 Y1487	F1368-F1379 HydrophobicContact CD2-CD2 4.34Å; F1368-F1379 HydrophobicContact CE2-CB 4.2Å; F1368-F1379 AromaticContact CE2-CD2 3.72Å; F1368-F1379 HydrophobicContact CE2-CD2 3.72Å; F1368-F1379 HydrophobicContact CE2-CE2 4.44Å; F1368-F1379 HydrophobicContact CE2-CG 4.22Å; I1369-F1379 WeakPolarHBondContact O-CB 3.41Å; F1379-A1381 HydrophobicContact CE2-CB 4.41Å; F1379-V1393 HydrophobicContact CE2-CG1 3.95Å; F1379-V1393 HydrophobicContact CZ-CG1 3.81Å; F1379-C1394 VanDerWaalsContact O-CA 3.24Å; F1379-C1394 WeakPolarHBondContact O-CA 3.44Å; F1379-C1394 WeakPolarHBondContact O-CB 3.49Å; F1379-R1395 HydrophobicContact CD1-CB 3.52Å; F1379-R1395 HydrophobicContact CE1-CB 3.58Å; F1379-R1395 HydrophobicContact CG-CB 4.46Å; F1379-R1395 PolarHBondContact N-O 2.78Å; F1379-R1395 PolarHBondContact O-N 3.31Å; F1379-L1406 HydrophobicContact CE1-CD1 4.03Å; F1379-L1406 HydrophobicContact CZ-CD1 3.75Å; F1379-Y1487 AromaticContact CD1-CD1 3.68Å; F1379-Y1487 HydrophobicContact CD1-CD1 3.68Å; F1379-Y1487 HydrophobicContact CD1-CE1 4.39Å; F1379-Y1487 AromaticContact CE1-CD1 3.83Å; F1379-Y1487 HydrophobicContact CE1-CD1 3.83Å; F1379-Y1487 HydrophobicContact CG-CD1 4.36Å; F1379-Y1487 WeakPolarHBondContact CZ-O 3.03Å
1380	I	91.1	Very high	81.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	141.4	165.4	-174	164.1	0	0	0	111.5	F1367 F1368 I1369 V1392 V1393 C1394 I1425 F1465 L1467	F1367-I1380 HydrophobicContact CE2-CG1 4.41Å; F1367-I1380 HydrophobicContact CE2-CG2 4.26Å; F1368-I1380 WeakPolarHBondContact CD2-O 3.07Å; I1369-I1380 HydrophobicContact CB-CG2 4.09Å; I1369-I1380 HydrophobicContact CD1-CG2 4.06Å; I1369-I1380 HydrophobicContact CG1-CG2 4.23Å; I1369-I1380 PolarHBondContact N-O 3.08Å; I1369-I1380 PolarHBondContact O-N 3.15Å; I1380-V1392 HydrophobicContact CD1-CG1 4.33Å; I1380-V1392 HydrophobicContact CG1-CG1 4.45Å; I1380-V1393 CarbonylContact C-O 3.6Å; I1380-V1393 WeakPolarHBondContact CA-O 3.49Å; I1380-C1394 HydrophobicContact CB-CB 4.06Å; I1380-C1394 HydrophobicContact CD1-CB 4.32Å; I1380-C1394 HydrophobicContact CG1-CB 4Å; I1380-I1425 HydrophobicContact CD1-CG2 4.24Å; I1380-F1465 HydrophobicContact CB-CZ 4.03Å; I1380-F1465 HydrophobicContact CG2-CZ 4.05Å; I1380-L1467 HydrophobicContact CG2-CD1 3.7Å
1381	A	92.4	Very high	82.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.7	175.4	0	0	0	0	0	110.3	F1367 F1368 F1379 V1392 V1393 I1488	F1367-A1381 WeakPolarHBondContact O-CA 3.09Å; F1368-A1381 HydrophobicContact CD2-CB 3.92Å; F1379-A1381 HydrophobicContact CE2-CB 4.41Å; A1381-V1392 WeakPolarHBondContact O-CA 3.47Å; A1381-V1393 PolarHBondContact N-O 2.96Å; A1381-V1393 PolarHBondContact O-N 3.28Å; A1381-I1488 HydrophobicContact CB-CD1 3.91Å; A1381-I1488 HydrophobicContact CB-CG1 4.19Å; A1381-I1488 HydrophobicContact CB-CG2 4.2Å
1382	A	94.5	Very high	82.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.3	163.3	0	0	0	0	0	109.8	L1366 F1367 L1390 N1391 V1392 L1423 I1425	L1366-A1382 WeakPolarHBondContact CB-O 3.33Å; L1366-A1382 PolarHBondContact N-O 3.13Å; F1367-A1382 HydrophobicContact CD1-CB 3.74Å; F1367-A1382 HydrophobicContact CE1-CB 3.35Å; F1367-A1382 HydrophobicContact CZ-CB 3.92Å; F1367-A1382 PolarHBondContact N-O 2.94Å; F1367-A1382 PolarHBondContact O-N 2.97Å; A1382-L1390 HydrophobicContact CB-CD1 4.38Å; A1382-N1391 WeakPolarHBondContact CA-O 3.5Å; A1382-V1392 HydrophobicContact CB-CG2 4.24Å; A1382-L1423 HydrophobicContact CB-CD2 4.22Å; A1382-I1425 HydrophobicContact CB-CD1 4.42Å
1383	Y	94.1	Very high	83.8	Confident	15 Å²	15	33.2 Å²	33.2	6%	0.059	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.2	178.3	66.3	-88.8	0	0	0	111.5	G1364 N1391 V1393 Q1408 I1488 P1489 I1490	G1364-Y1383 CarbonylContact O-C 3.52Å; G1364-Y1383 VanDerWaalsContact O-CA 3.26Å; G1364-Y1383 WeakPolarHBondContact O-CA 3.47Å; G1364-Y1383 WeakPolarHBondContact O-CB 3.33Å; Y1383-N1391 HydrophobicContact CD1-CB 4.14Å; Y1383-N1391 HydrophobicContact CD2-CB 4.06Å; Y1383-N1391 HydrophobicContact CE1-CB 3.69Å; Y1383-N1391 HydrophobicContact CE2-CB 3.59Å; Y1383-N1391 HydrophobicContact CG-CB 4.3Å; Y1383-N1391 PolarHBondContact N-O 2.97Å; Y1383-N1391 PolarHBondContact O-N 2.81Å; Y1383-V1393 HydrophobicContact CE1-CG2 3.71Å; Y1383-Q1408 PolarHBondContact OH-NE2 3.26Å; Y1383-I1488 HydrophobicContact CD1-CG2 3.81Å; Y1383-I1488 HydrophobicContact CE1-CG2 3.93Å; Y1383-P1489 HydrophobicContact CE1-CG 4.11Å; Y1383-P1489 HydrophobicContact CE2-CG 4.32Å; Y1383-P1489 VanDerWaalsContact OH-CG 3.26Å; Y1383-P1489 WeakPolarHBondContact OH-CG 3.12Å; Y1383-I1490 HydrophobicContact CD1-CG2 4.22Å; Y1383-I1490 HydrophobicContact CD2-CB 4.09Å; Y1383-I1490 HydrophobicContact CD2-CD1 4.04Å; Y1383-I1490 HydrophobicContact CD2-CG2 4.14Å; Y1383-I1490 HydrophobicContact CG-CB 4.23Å; Y1383-I1490 HydrophobicContact CG-CD1 4.49Å; Y1383-I1490 HydrophobicContact CG-CG2 3.76Å
1384	L	92.8	Very high	85	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	140.3	170.2	-56	174.6	0	0	0	109	F1357 V1359 S1363 G1364 L1366 L1390 V1415 I1490 F1494	F1357-L1384 HydrophobicContact CE2-CD2 4.5Å; V1359-L1384 HydrophobicContact CB-CD1 4.2Å; V1359-L1384 HydrophobicContact CG1-CD1 3.52Å; V1359-L1384 HydrophobicContact CG2-CD1 3.54Å; S1363-L1384 VanDerWaalsContact CA-O 3.27Å; S1363-L1384 WeakPolarHBondContact CA-O 3.25Å; S1363-L1384 PolarHBondContact OG-O 3Å; S1363-L1384 VanDerWaalsContact OG-O 3.11Å; G1364-L1384 PolarHBondContact N-O 3.12Å; G1364-L1384 VanDerWaalsContact N-O 3.1Å; G1364-L1384 PolarHBondContact O-N 2.68Å; L1366-L1384 HydrophobicContact CD1-CD2 4.21Å; L1366-L1384 HydrophobicContact CD1-CG 4.27Å; L1366-L1384 HydrophobicContact CD2-CD1 4.46Å; L1366-L1384 HydrophobicContact CG-CG 4.38Å; L1384-L1390 HydrophobicContact CD2-CB 4.31Å; L1384-L1390 HydrophobicContact CD2-CD1 3.98Å; L1384-V1415 HydrophobicContact CD2-CB 4.02Å; L1384-V1415 HydrophobicContact CD2-CG1 4.37Å; L1384-V1415 HydrophobicContact CD2-CG2 3.6Å; L1384-I1490 WeakPolarHBondContact O-CD1 3.3Å; L1384-F1494 HydrophobicContact CD1-CE2 4.19Å
1385	D	88.4	Confident	86.2	Confident	22 Å²	22	28 Å²	28	12%	0.118	13%	0.133	C	C	.	.			trans	-87.2	174.6	166.7	60.6	48.3	0	0	0	112.2	S1363 Q1387 N1388 Y1389 N1391 R1410	S1363-D1385 WeakPolarHBondContact CA-O 3.37Å; S1363-D1385 PolarHBondContact N-O 3.16Å; D1385-Q1387 PolarHBondContact O-N 2.84Å; D1385-Q1387 VanDerWaalsContact O-N 3.11Å; D1385-Q1387 WeakPolarHBondContact OD1-CA 3.4Å; D1385-Q1387 PolarHBondContact OD1-N 3.38Å; D1385-N1388 PolarHBondContact O-N 3.27Å; D1385-N1388 PolarHBondContact OD1-N 3.41Å; D1385-Y1389 PolarHBondContact N-O 3.26Å; D1385-Y1389 VanDerWaalsContact N-O 3.08Å; D1385-Y1389 PolarHBondContact OD1-N 2.82Å; D1385-Y1389 VanDerWaalsContact OD1-N 3.07Å; D1385-Y1389 WeakPolarHBondContact OD2-CB 3.23Å; D1385-N1391 PolarHBondContact OD2-ND2 2.91Å; D1385-R1410 IonicContact OD1-NH2 3.05Å; D1385-R1410 PolarHBondContact OD1-NH2 3.5Å; D1385-R1410 VanDerWaalsContact OD1-NH2 3.1Å; D1385-R1410 IonicContact OD2-CZ 3.42Å; D1385-R1410 IonicContact OD2-NE 3.24Å; D1385-R1410 PolarHBondContact OD2-NE 3.34Å; D1385-R1410 IonicContact OD2-NH2 2.95Å; D1385-R1410 PolarHBondContact OD2-NH2 2.77Å
1386	E	83.9	Confident	87.2	Confident	59 Å²	59	20.5 Å²	20.5	28%	0.276	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.3	-179.8	-63.6	-162.5	139	0	0	113.8	R1793 S1804	E1386-R1793 IonicContact OE1-CZ 2.64Å; E1386-R1793 IonicContact OE1-NE 3.98Å; E1386-R1793 PolarHBondContact OE1-NE 3.38Å; E1386-R1793 IonicContact OE1-NH1 2.99Å; E1386-R1793 IonicContact OE1-NH2 3.72Å; E1386-R1793 PolarHBondContact OE1-NH2 2.02Å; E1386-S1804 VanDerWaalsContact OE1-CB 3.28Å; E1386-S1804 WeakPolarHBondContact OE1-CB 3.29Å
1387	Q	85.8	Confident	87.3	Confident	105 Å²	105	16.7 Å²	16.7	49%	0.491	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	18.7	179.1	-53.5	99.1	45.7	0	0	112.4	D1385 Y1389	D1385-Q1387 PolarHBondContact O-N 2.84Å; D1385-Q1387 VanDerWaalsContact O-N 3.11Å; D1385-Q1387 WeakPolarHBondContact OD1-CA 3.4Å; D1385-Q1387 PolarHBondContact OD1-N 3.38Å; Q1387-Y1389 HydrophobicContact CB-CD2 3.75Å; Q1387-Y1389 HydrophobicContact CB-CE2 3.83Å; Q1387-Y1389 VanDerWaalsContact O-CD2 3.23Å; Q1387-Y1389 WeakPolarHBondContact O-CD2 3.41Å; Q1387-Y1389 WeakPolarHBondContact O-CE2 3.26Å; Q1387-Y1389 PolarHBondContact O-N 2.85Å
1388	N	88.1	Confident	86.8	Confident	26 Å²	26	23.6 Å²	23.6	14%	0.139	11%	0.107	C	C	.	.			trans	63.5	10.5	-179.2	-64.8	-55.1	0	0	0	116.1	P1362 D1385 P1414 V1415 L1417	P1362-N1388 VanDerWaalsContact CA-OD1 3.24Å; P1362-N1388 WeakPolarHBondContact CA-OD1 3.24Å; P1362-N1388 VanDerWaalsContact CB-OD1 3.31Å; P1362-N1388 WeakPolarHBondContact CB-OD1 3.45Å; D1385-N1388 PolarHBondContact O-N 3.27Å; D1385-N1388 PolarHBondContact OD1-N 3.41Å; N1388-P1414 HydrophobicContact CB-CB 4.14Å; N1388-V1415 WeakPolarHBondContact O-CB 3.22Å; N1388-V1415 PolarHBondContact O-N 3.19Å; N1388-L1417 WeakPolarHBondContact OD1-CD2 3.15Å
1389	Y	92.8	Very high	85.3	Confident	73 Å²	73	25.6 Å²	25.6	29%	0.286	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	135.3	175.1	-61.9	-94	0	0	0	110	D1385 Q1387 N1391 R1410 Y1411 P1414	D1385-Y1389 PolarHBondContact N-O 3.26Å; D1385-Y1389 VanDerWaalsContact N-O 3.08Å; D1385-Y1389 PolarHBondContact OD1-N 2.82Å; D1385-Y1389 VanDerWaalsContact OD1-N 3.07Å; D1385-Y1389 WeakPolarHBondContact OD2-CB 3.23Å; Q1387-Y1389 HydrophobicContact CB-CD2 3.75Å; Q1387-Y1389 HydrophobicContact CB-CE2 3.83Å; Q1387-Y1389 VanDerWaalsContact O-CD2 3.23Å; Q1387-Y1389 WeakPolarHBondContact O-CD2 3.41Å; Q1387-Y1389 WeakPolarHBondContact O-CE2 3.26Å; Q1387-Y1389 PolarHBondContact O-N 2.85Å; Y1389-N1391 PolarHBondContact O-N 2.64Å; Y1389-N1391 PolarHBondContact O-ND2 3.39Å; Y1389-N1391 VanDerWaalsContact O-ND2 3.14Å; Y1389-R1410 VanDerWaalsContact CD2-NH2 3.34Å; Y1389-Y1411 WeakPolarHBondContact CD1-O 3.47Å; Y1389-P1414 HydrophobicContact CD1-CB 4.44Å; Y1389-P1414 HydrophobicContact CE1-CB 4.35Å
1390	L	93.9	Very high	83.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.3	177.4	178.8	72.5	0	0	0	110.1	L1366 A1382 L1384 V1392 R1410 Y1411 V1415 L1423 V1434 V1436	L1366-L1390 HydrophobicContact CD1-CD1 3.56Å; A1382-L1390 HydrophobicContact CB-CD1 4.38Å; L1384-L1390 HydrophobicContact CD2-CB 4.31Å; L1384-L1390 HydrophobicContact CD2-CD1 3.98Å; L1390-V1392 HydrophobicContact CD2-CG2 4.12Å; L1390-V1392 HydrophobicContact CG-CG2 4.21Å; L1390-R1410 CarbonylContact O-C 3.59Å; L1390-R1410 WeakPolarHBondContact O-CA 3.38Å; L1390-Y1411 PolarHBondContact O-N 2.87Å; L1390-V1415 HydrophobicContact CB-CG2 3.88Å; L1390-L1423 HydrophobicContact CD1-CD2 3.97Å; L1390-L1423 HydrophobicContact CD2-CD1 3.37Å; L1390-L1423 HydrophobicContact CD2-CD2 3.72Å; L1390-L1423 HydrophobicContact CD2-CG 4.09Å; L1390-L1423 HydrophobicContact CG-CD2 4.49Å; L1390-V1434 HydrophobicContact CD2-CG1 3.94Å; L1390-V1436 HydrophobicContact CD2-CG2 3.75Å
1391	N	93.4	Very high	81.6	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	115.2	172.5	-70.7	-91.3	0	0	0	109.5	A1382 Y1383 D1385 Y1389 Q1408 L1409 R1410	A1382-N1391 WeakPolarHBondContact CA-O 3.5Å; Y1383-N1391 HydrophobicContact CD1-CB 4.14Å; Y1383-N1391 HydrophobicContact CD2-CB 4.06Å; Y1383-N1391 HydrophobicContact CE1-CB 3.69Å; Y1383-N1391 HydrophobicContact CE2-CB 3.59Å; Y1383-N1391 HydrophobicContact CG-CB 4.3Å; Y1383-N1391 PolarHBondContact N-O 2.97Å; Y1383-N1391 PolarHBondContact O-N 2.81Å; D1385-N1391 PolarHBondContact OD2-ND2 2.91Å; Y1389-N1391 PolarHBondContact O-N 2.64Å; Y1389-N1391 PolarHBondContact O-ND2 3.39Å; Y1389-N1391 VanDerWaalsContact O-ND2 3.14Å; N1391-Q1408 PolarHBondContact OD1-NE2 2.9Å; N1391-L1409 WeakPolarHBondContact CA-O 3.4Å; N1391-R1410 WeakPolarHBondContact OD1-CB 3.27Å
1392	V	93.9	Very high	79.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	120	169.5	-177.4	0	0	0	0	108.1	I1380 A1381 A1382 L1390 Q1408 L1409 I1425 L1432 V1434	I1380-V1392 HydrophobicContact CD1-CG1 4.33Å; I1380-V1392 HydrophobicContact CG1-CG1 4.45Å; A1381-V1392 WeakPolarHBondContact O-CA 3.47Å; A1382-V1392 HydrophobicContact CB-CG2 4.24Å; L1390-V1392 HydrophobicContact CD2-CG2 4.12Å; L1390-V1392 HydrophobicContact CG-CG2 4.21Å; V1392-Q1408 WeakPolarHBondContact O-CA 3.24Å; V1392-L1409 PolarHBondContact N-O 3.23Å; V1392-L1409 PolarHBondContact O-N 3.39Å; V1392-I1425 HydrophobicContact CG1-CD1 3.97Å; V1392-I1425 HydrophobicContact CG1-CG2 4.39Å; V1392-I1425 HydrophobicContact CG2-CD1 3.9Å; V1392-I1425 HydrophobicContact CG2-CG1 4.36Å; V1392-L1432 HydrophobicContact CG1-CD2 4.03Å; V1392-V1434 HydrophobicContact CB-CG2 4.08Å; V1392-V1434 HydrophobicContact CG1-CG2 4.43Å; V1392-V1434 HydrophobicContact CG2-CG1 4.16Å; V1392-V1434 HydrophobicContact CG2-CG2 3.79Å
1393	V	90.5	Very high	77.3	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	-178.7	178.6	0	0	0	0	109.2	F1379 I1380 A1381 Y1383 L1406 I1407 Q1408	F1379-V1393 HydrophobicContact CE2-CG1 3.95Å; F1379-V1393 HydrophobicContact CZ-CG1 3.81Å; I1380-V1393 CarbonylContact C-O 3.6Å; I1380-V1393 WeakPolarHBondContact CA-O 3.49Å; A1381-V1393 PolarHBondContact N-O 2.96Å; A1381-V1393 PolarHBondContact O-N 3.28Å; Y1383-V1393 HydrophobicContact CE1-CG2 3.71Å; V1393-L1406 HydrophobicContact CG1-CD1 3.55Å; V1393-L1406 HydrophobicContact CG1-CG 4.2Å; V1393-I1407 CarbonylContact C-O 3.57Å; V1393-I1407 WeakPolarHBondContact CA-O 3.48Å; V1393-Q1408 HydrophobicContact CG2-CB 4Å; V1393-Q1408 HydrophobicContact CG2-CG 3.78Å
1394	C	89.1	Confident	75.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.7	174.2	71.3	0	0	0	0	112.1	F1379 I1380 I1407	F1379-C1394 VanDerWaalsContact O-CA 3.24Å; F1379-C1394 WeakPolarHBondContact O-CA 3.44Å; F1379-C1394 WeakPolarHBondContact O-CB 3.49Å; I1380-C1394 HydrophobicContact CB-CB 4.06Å; I1380-C1394 HydrophobicContact CD1-CB 4.32Å; I1380-C1394 HydrophobicContact CG1-CB 4Å; C1394-I1407 PolarHBondContact N-O 2.94Å; C1394-I1407 PolarHBondContact O-N 2.77Å
1395	R	83.7	Confident	74	Confident	27 Å²	27	50.7 Å²	50.7	10%	0.102	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.4	174	-164.2	-171.6	-61.8	-178.6	2.7	109.3	N1376 P1378 F1379 V1402	N1376-R1395 PolarHBondContact OD1-NH1 3.05Å; P1378-R1395 VanDerWaalsContact CA-O 3.26Å; P1378-R1395 WeakPolarHBondContact CA-O 3.21Å; P1378-R1395 VanDerWaalsContact CB-O 3.29Å; P1378-R1395 WeakPolarHBondContact CB-O 3.45Å; F1379-R1395 HydrophobicContact CD1-CB 3.52Å; F1379-R1395 HydrophobicContact CE1-CB 3.58Å; F1379-R1395 HydrophobicContact CG-CB 4.46Å; F1379-R1395 PolarHBondContact N-O 2.78Å; F1379-R1395 PolarHBondContact O-N 3.31Å; R1395-V1402 HydrophobicContact CG-CG1 3.9Å
1396	T	79.2	Confident	73.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.268	C	S	.	.			trans	-117.7	148.7	177.8	60	0	0	0	0	112.2	I1407 L1446 L1462 F1465	T1396-I1407 HydrophobicContact CG2-CD1 4.37Å; T1396-L1446 HydrophobicContact CG2-CD2 4.09Å; T1396-L1462 CarbonylContact C-O 3.38Å; T1396-L1462 WeakPolarHBondContact CB-O 3.14Å; T1396-L1462 PolarHBondContact OG1-O 3.33Å; T1396-F1465 HydrophobicContact CG2-CD2 3.94Å
1397	G	65.6	Low	73.4	Confident	1 Å²	1	52 Å²	52	1%	0.01	26%	0.258	C	S	.	.			trans	94.1	-173.8	176	0	0	0	0	0	116.3	E1461 N1464	G1397-E1461 WeakPolarHBondContact CA-O 3.36Å; G1397-N1464 PolarHBondContact N-O 3.29Å
1398	K	58.8	Low	73.5	Confident	150 Å²	150	51.4 Å²	51.4	65%	0.652	26%	0.256	S	S	*	.			trans	-141.2	153.3	172.7	-68	-170.8	174.8	-170.9	0	108.7
1399	G	51.7	Low	73.6	Confident	53 Å²	53	50.8 Å²	50.8	55%	0.546	25%	0.253	S	S	.	.	S	Bend	trans	104.2	-179	173.8	0	0	0	0	0	115.3	L1401 V1402	G1399-L1401 VanDerWaalsContact C-N 3.29Å; G1399-L1401 PolarHBondContact O-N 3.4Å; G1399-V1402 VanDerWaalsContact O-CB 3.24Å; G1399-V1402 WeakPolarHBondContact O-CB 3.04Å; G1399-V1402 WeakPolarHBondContact O-CG2 3.39Å; G1399-V1402 PolarHBondContact O-N 2.81Å; G1399-V1402 VanDerWaalsContact O-N 3.14Å
1400	K	49.1	Very low	73.6	Confident	208 Å²	208	52.1 Å²	52.1	90%	0.904	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-63.6	-26.4	-171.6	-77.3	-173.8	174.6	-178.6	0	114.8	V1402	K1400-V1402 PolarHBondContact O-N 3.03Å
1401	L	51.1	Low	73.6	Confident	85 Å²	85	52.2 Å²	52.2	45%	0.445	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-70.6	-5.7	176.7	-63.9	173.3	0	0	0	113.8	G1399 L1458	G1399-L1401 VanDerWaalsContact C-N 3.29Å; G1399-L1401 PolarHBondContact O-N 3.4Å; L1401-L1458 HydrophobicContact CD1-CD2 4.19Å
1402	V	50.2	Low	73.5	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.018	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-83.1	-19.1	-170.5	172.6	0	0	0	0	114.1	R1395 G1399 K1400 E1404 N1405	R1395-V1402 HydrophobicContact CG-CG1 3.9Å; G1399-V1402 VanDerWaalsContact O-CB 3.24Å; G1399-V1402 WeakPolarHBondContact O-CB 3.04Å; G1399-V1402 WeakPolarHBondContact O-CG2 3.39Å; G1399-V1402 PolarHBondContact O-N 2.81Å; G1399-V1402 VanDerWaalsContact O-N 3.14Å; K1400-V1402 PolarHBondContact O-N 3.03Å; V1402-E1404 PolarHBondContact O-N 2.79Å; V1402-N1405 PolarHBondContact O-N 2.92Å
1403	N	47.4	Very low	73.3	Confident	122 Å²	122	61 Å²	61	65%	0.652	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-60	-20.6	178.9	-79.2	13.2	0	0	0	113.3	N1376	N1376-N1403 PolarHBondContact ND2-OD1 2.81Å
1404	E	53.4	Low	73.3	Confident	121 Å²	121	64.3 Å²	64.3	57%	0.565	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-108.5	6.1	178.7	-58.2	178.5	120.2	0	0	113.3	V1402 L1406 R1450	V1402-E1404 PolarHBondContact O-N 2.79Å; E1404-L1406 PolarHBondContact O-N 2.8Å; E1404-R1450 VanDerWaalsContact CB-NH2 3.28Å; E1404-R1450 VanDerWaalsContact CD-NH1 3.32Å; E1404-R1450 IonicContact OE1-NH1 2.7Å; E1404-R1450 PolarHBondContact OE1-NH1 2.76Å; E1404-R1450 IonicContact OE2-CZ 3.32Å; E1404-R1450 IonicContact OE2-NH1 3.13Å; E1404-R1450 PolarHBondContact OE2-NH1 3.43Å; E1404-R1450 IonicContact OE2-NH2 2.69Å; E1404-R1450 PolarHBondContact OE2-NH2 3.44Å
1405	N	64.1	Low	73.4	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.016	33%	0.325	C	S	.	.			trans	-99	39.7	179.7	-70.2	-15.1	0	0	0	112.2	V1402 I1407 L1462	V1402-N1405 PolarHBondContact O-N 2.92Å; N1405-I1407 WeakPolarHBondContact O-CD1 3.49Å; N1405-L1462 WeakPolarHBondContact ND2-CD2 3.47Å
1406	L	76.6	Confident	73.6	Confident	95 Å²	95	67.5 Å²	67.5	50%	0.497	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	108.3	169	-172.9	69.3	0	0	0	108.7	F1379 V1393 E1404	F1379-L1406 HydrophobicContact CE1-CD1 4.03Å; F1379-L1406 HydrophobicContact CZ-CD1 3.75Å; V1393-L1406 HydrophobicContact CG1-CD1 3.55Å; V1393-L1406 HydrophobicContact CG1-CG 4.2Å; E1404-L1406 PolarHBondContact O-N 2.8Å
1407	I	83.6	Confident	74.1	Confident	13 Å²	13	70.7 Å²	70.7	7%	0.067	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	112.7	178.4	-59	108.1	0	0	0	109	V1393 C1394 T1396 N1405 V1444 L1446	V1393-I1407 CarbonylContact C-O 3.57Å; V1393-I1407 WeakPolarHBondContact CA-O 3.48Å; C1394-I1407 PolarHBondContact N-O 2.94Å; C1394-I1407 PolarHBondContact O-N 2.77Å; T1396-I1407 HydrophobicContact CG2-CD1 4.37Å; N1405-I1407 WeakPolarHBondContact O-CD1 3.49Å; I1407-V1444 HydrophobicContact CG2-CB 4.43Å; I1407-V1444 HydrophobicContact CG2-CG1 3.46Å; I1407-V1444 VanDerWaalsContact CG2-CG1 3.46Å; I1407-V1444 HydrophobicContact CG2-CG2 4.07Å; I1407-L1446 HydrophobicContact CD1-CD2 3.95Å; I1407-L1446 HydrophobicContact CG1-CD2 4.31Å; I1407-L1446 HydrophobicContact CG2-CD2 4.4Å
1408	Q	86.7	Confident	75.1	Confident	94 Å²	94	76.1 Å²	76.1	44%	0.439	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.8	171.7	179	164.1	-7.9	0	0	110.3	Y1383 N1391 V1392 V1393	Y1383-Q1408 PolarHBondContact OH-NE2 3.26Å; N1391-Q1408 PolarHBondContact OD1-NE2 2.9Å; V1392-Q1408 WeakPolarHBondContact O-CA 3.24Å; V1393-Q1408 HydrophobicContact CG2-CB 4Å; V1393-Q1408 HydrophobicContact CG2-CG 3.78Å
1409	L	90.9	Very high	76.5	Confident	13 Å²	13	73 Å²	73	7%	0.068	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	107.5	168.4	-174	159.7	0	0	0	107.7	N1391 V1392 Y1411 V1434 V1444	N1391-L1409 WeakPolarHBondContact CA-O 3.4Å; V1392-L1409 PolarHBondContact N-O 3.23Å; V1392-L1409 PolarHBondContact O-N 3.39Å; L1409-Y1411 HydrophobicContact CD2-CD2 4.42Å; L1409-V1434 HydrophobicContact CD1-CB 4.29Å; L1409-V1434 HydrophobicContact CD1-CG2 4Å; L1409-V1434 HydrophobicContact CD2-CB 3.87Å; L1409-V1434 HydrophobicContact CD2-CG1 4.36Å; L1409-V1434 HydrophobicContact CD2-CG2 3.91Å; L1409-V1434 HydrophobicContact CG-CG2 4.44Å; L1409-V1444 HydrophobicContact CB-CG1 4.06Å; L1409-V1444 HydrophobicContact CD1-CB 4.12Å; L1409-V1444 HydrophobicContact CD1-CG1 3.89Å; L1409-V1444 HydrophobicContact CG-CG1 4.49Å
1410	R	93.2	Very high	78.4	Confident	101 Å²	101	71.1 Å²	71.1	38%	0.381	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	121.4	162.2	-166.7	179.6	-160.7	-161.9	3.9	107.3	D1385 Y1389 L1390 N1391	D1385-R1410 IonicContact OD1-NH2 3.05Å; D1385-R1410 PolarHBondContact OD1-NH2 3.5Å; D1385-R1410 VanDerWaalsContact OD1-NH2 3.1Å; D1385-R1410 IonicContact OD2-CZ 3.42Å; D1385-R1410 IonicContact OD2-NE 3.24Å; D1385-R1410 PolarHBondContact OD2-NE 3.34Å; D1385-R1410 IonicContact OD2-NH2 2.95Å; D1385-R1410 PolarHBondContact OD2-NH2 2.77Å; Y1389-R1410 VanDerWaalsContact CD2-NH2 3.34Å; L1390-R1410 CarbonylContact O-C 3.59Å; L1390-R1410 WeakPolarHBondContact O-CA 3.38Å; N1391-R1410 WeakPolarHBondContact OD1-CB 3.27Å
1411	Y	93.8	Very high	80.5	Confident	1 Å²	1	61.2 Å²	61.2	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	124.5	179	-167.6	-103.7	0	0	0	108.5	Y1389 L1390 L1409 E1413 V1434 V1436 K1440 Q1442	Y1389-Y1411 WeakPolarHBondContact CD1-O 3.47Å; L1390-Y1411 PolarHBondContact O-N 2.87Å; L1409-Y1411 HydrophobicContact CD2-CD2 4.42Å; Y1411-E1413 HydrophobicContact CD1-CB 4.06Å; Y1411-E1413 HydrophobicContact CE1-CB 3.95Å; Y1411-E1413 HydrophobicContact CE1-CG 4.45Å; Y1411-E1413 PolarHBondContact O-N 3.43Å; Y1411-V1434 HydrophobicContact CD2-CB 4.26Å; Y1411-V1434 HydrophobicContact CD2-CG1 3.86Å; Y1411-V1434 HydrophobicContact CE2-CG1 4.44Å; Y1411-V1434 WeakPolarHBondContact CE2-O 3.43Å; Y1411-V1436 HydrophobicContact CD1-CB 3.99Å; Y1411-V1436 HydrophobicContact CD1-CG2 3.62Å; Y1411-V1436 HydrophobicContact CD2-CG2 4.38Å; Y1411-V1436 HydrophobicContact CE1-CB 3.61Å; Y1411-V1436 HydrophobicContact CE1-CG2 3.72Å; Y1411-V1436 HydrophobicContact CE2-CG2 4.48Å; Y1411-V1436 HydrophobicContact CG-CG2 3.97Å; Y1411-V1436 PolarHBondContact OH-N 2.89Å; Y1411-K1440 PolarHBondContact OH-O 2.89Å; Y1411-Q1442 HydrophobicContact CD2-CB 3.93Å; Y1411-Q1442 HydrophobicContact CD2-CG 3.83Å; Y1411-Q1442 HydrophobicContact CE2-CB 3.88Å; Y1411-Q1442 VanDerWaalsContact CE2-CD 3.43Å; Y1411-Q1442 HydrophobicContact CE2-CG 3.53Å; Y1411-Q1442 VanDerWaalsContact CE2-NE2 3.33Å
1412	N	91.8	Very high	82.6	Confident	129 Å²	129	58.2 Å²	58.2	69%	0.69	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	0.4	-169.7	-62.5	-7	0	0	0	116.6	Q1442	N1412-Q1442 VanDerWaalsContact N-NE2 3.14Å; N1412-Q1442 PolarHBondContact OD1-OE1 2.81Å
1413	E	88.3	Confident	84.7	Confident	61 Å²	61	58.1 Å²	58.1	29%	0.285	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.6	-178.4	-64.3	165.1	-173.6	0	0	108.3	Y1411 N1439	Y1411-E1413 HydrophobicContact CD1-CB 4.06Å; Y1411-E1413 HydrophobicContact CE1-CB 3.95Å; Y1411-E1413 HydrophobicContact CE1-CG 4.45Å; Y1411-E1413 PolarHBondContact O-N 3.43Å; E1413-N1439 WeakPolarHBondContact OE2-CB 3.22Å; E1413-N1439 PolarHBondContact OE2-ND2 2.87Å
1414	P	90.6	Very high	86.9	Confident	70 Å²	70	53.8 Å²	53.8	46%	0.455	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	146.5	179.4	30.2	-34.5	0	0	0	111.1	N1388 Y1389	N1388-P1414 HydrophobicContact CB-CB 4.14Å; Y1389-P1414 HydrophobicContact CD1-CB 4.44Å; Y1389-P1414 HydrophobicContact CE1-CB 4.35Å
1415	V	91.2	Very high	88.9	Confident	5 Å²	5	48 Å²	48	3%	0.03	24%	0.241	C	C	.	.			trans	-71.9	140.8	175.9	-178.9	0	0	0	0	109.7	F1357 V1359 L1384 N1388 L1390 L1417 N1421 V1436	F1357-V1415 HydrophobicContact CE2-CG1 3.75Å; F1357-V1415 HydrophobicContact CZ-CG1 3.74Å; V1359-V1415 HydrophobicContact CG2-CG1 3.65Å; L1384-V1415 HydrophobicContact CD2-CB 4.02Å; L1384-V1415 HydrophobicContact CD2-CG1 4.37Å; L1384-V1415 HydrophobicContact CD2-CG2 3.6Å; N1388-V1415 WeakPolarHBondContact O-CB 3.22Å; N1388-V1415 PolarHBondContact O-N 3.19Å; L1390-V1415 HydrophobicContact CB-CG2 3.88Å; V1415-L1417 PolarHBondContact O-N 2.87Å; V1415-N1421 HydrophobicContact CG1-CB 4.03Å; V1415-N1421 WeakPolarHBondContact CG1-OD1 3.42Å; V1415-V1436 HydrophobicContact CG2-CG1 4.45Å
1416	Q	89.4	Confident	90.1	Very high	90 Å²	90	48.8 Å²	48.8	42%	0.421	25%	0.245	S	C	.	.			trans	-81.6	111.5	-172	-64.8	176.5	-86.6	0	0	110.5	Q1419 N1421 N1437	Q1416-Q1419 HydrophobicContact CB-CB 4.19Å; Q1416-N1421 PolarHBondContact N-OD1 2.9Å; Q1416-N1421 PolarHBondContact O-ND2 3.17Å; Q1416-N1437 PolarHBondContact OE1-ND2 2.92Å
1417	L	88.1	Confident	90.7	Very high	67 Å²	67	44.3 Å²	44.3	35%	0.351	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-60	144.8	173.4	-66.7	-178.9	0	0	0	111.2	V1359 N1388 V1415 Q1419	V1359-L1417 HydrophobicContact CB-CD2 3.9Å; V1359-L1417 HydrophobicContact CG1-CD2 3.45Å; V1359-L1417 VanDerWaalsContact CG1-CD2 3.45Å; N1388-L1417 WeakPolarHBondContact OD1-CD2 3.15Å; V1415-L1417 PolarHBondContact O-N 2.87Å; L1417-Q1419 PolarHBondContact O-N 3.26Å; L1417-Q1419 VanDerWaalsContact O-N 3.11Å
1418	N	86.3	Confident	90.7	Very high	114 Å²	114	45.8 Å²	45.8	61%	0.61	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	23.2	178	-59.5	-38.5	0	0	0	115	V1359	V1359-N1418 PolarHBondContact O-N 3.23Å
1419	Q	89.2	Confident	90.2	Very high	84 Å²	84	46.3 Å²	46.3	39%	0.393	23%	0.232	S	C	.	.	S	Bend	trans	-127.6	152.5	171.2	-63.9	-174.1	-13.6	0	0	110.6	L1358 Q1416 L1417 N1421	L1358-Q1419 VanDerWaalsContact CD1-N 3.3Å; L1358-Q1419 VanDerWaalsContact CD1-O 3.23Å; L1358-Q1419 WeakPolarHBondContact CD1-O 3.22Å; Q1416-Q1419 HydrophobicContact CB-CB 4.19Å; L1417-Q1419 PolarHBondContact O-N 3.26Å; L1417-Q1419 VanDerWaalsContact O-N 3.11Å; Q1419-N1421 PolarHBondContact O-N 3.24Å; Q1419-N1421 PolarHBondContact O-ND2 3.16Å
1420	W	91.5	Very high	89.6	Confident	14 Å²	14	50.8 Å²	50.8	5%	0.053	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	115.2	172.5	-74.7	105.1	0	0	0	110	I1326 I1356 F1357 L1358 A1497 Q1499 W1541 L1544 I1566 Q1567	I1326-W1420 HydrophobicContact CG2-CH2 3.92Å; I1326-W1420 HydrophobicContact CG2-CZ2 4.41Å; I1356-W1420 HydrophobicContact CG2-CE3 4.04Å; F1357-W1420 VanDerWaalsContact C-CE3 3.47Å; L1358-W1420 HydrophobicContact CB-CD2 3.84Å; L1358-W1420 HydrophobicContact CB-CE3 3.6Å; L1358-W1420 HydrophobicContact CB-CH2 3.73Å; L1358-W1420 HydrophobicContact CB-CZ2 3.96Å; L1358-W1420 HydrophobicContact CB-CZ3 3.54Å; L1358-W1420 HydrophobicContact CD2-CH2 4.4Å; L1358-W1420 HydrophobicContact CD2-CZ2 3.95Å; W1420-A1497 HydrophobicContact CH2-CB 3.79Å; W1420-A1497 HydrophobicContact CZ3-CB 4.49Å; W1420-Q1499 HydrophobicContact CE3-CB 3.97Å; W1420-Q1499 HydrophobicContact CH2-CB 3.73Å; W1420-Q1499 HydrophobicContact CZ3-CB 3.39Å; W1420-W1541 AromaticContact CZ2-CD1 3.99Å; W1420-W1541 AromaticContact CZ2-NE1 3.72Å; W1420-L1544 PolarHBondContact NE1-O 3.39Å; W1420-I1566 HydrophobicContact CB-CG2 3.81Å; W1420-Q1567 HydrophobicContact CB-CG 4.13Å
1421	N	93.8	Very high	89.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	147.8	179.3	-62	-93.3	0	0	0	110.1	I1356 F1357 V1415 Q1416 Q1419 N1437	I1356-N1421 WeakPolarHBondContact CA-O 3.42Å; F1357-N1421 HydrophobicContact CD1-CB 4.04Å; F1357-N1421 WeakPolarHBondContact CD1-O 3.23Å; F1357-N1421 HydrophobicContact CE1-CB 3.58Å; F1357-N1421 HydrophobicContact CE2-CB 4.23Å; F1357-N1421 HydrophobicContact CZ-CB 3.7Å; F1357-N1421 PolarHBondContact N-O 3.07Å; F1357-N1421 WeakPolarHBondContact O-CA 3.37Å; F1357-N1421 WeakPolarHBondContact O-CB 3.46Å; F1357-N1421 PolarHBondContact O-N 3.36Å; V1415-N1421 HydrophobicContact CG1-CB 4.03Å; V1415-N1421 WeakPolarHBondContact CG1-OD1 3.42Å; Q1416-N1421 PolarHBondContact N-OD1 2.9Å; Q1416-N1421 PolarHBondContact O-ND2 3.17Å; Q1419-N1421 PolarHBondContact O-N 3.24Å; Q1419-N1421 PolarHBondContact O-ND2 3.16Å; N1421-N1437 WeakPolarHBondContact CA-OD1 3.3Å; N1421-N1437 VanDerWaalsContact CB-OD1 3.23Å; N1421-N1437 WeakPolarHBondContact CB-OD1 3.46Å; N1421-N1437 PolarHBondContact OD1-ND2 2.78Å; N1421-N1437 PolarHBondContact OD1-OD1 2.77Å
1422	T	93.8	Very high	89.1	Confident	23 Å²	23	47.9 Å²	47.9	14%	0.141	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	114.2	175	-50.9	0	0	0	0	109.8	E1354 I1356 V1436 N1437	E1354-T1422 HydrophobicContact CG-CG2 4.32Å; I1356-T1422 HydrophobicContact CG1-CG2 4.41Å; T1422-V1436 CarbonylContact O-C 3.57Å; T1422-V1436 WeakPolarHBondContact O-CA 3.39Å; T1422-N1437 PolarHBondContact N-OD1 2.86Å; T1422-N1437 PolarHBondContact O-N 2.86Å
1423	L	95.3	Very high	89.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.8	176.5	163.5	54.2	0	0	0	109.9	E1354 L1355 F1357 L1366 A1382 L1390 I1425 V1434 K1435	E1354-L1423 CarbonylContact C-O 3.58Å; E1354-L1423 WeakPolarHBondContact CA-O 3.38Å; L1355-L1423 HydrophobicContact CB-CB 4.31Å; L1355-L1423 HydrophobicContact CD2-CD2 4.34Å; L1355-L1423 PolarHBondContact N-O 2.93Å; L1355-L1423 PolarHBondContact O-N 2.83Å; F1357-L1423 HydrophobicContact CD1-CB 4.35Å; F1357-L1423 HydrophobicContact CE1-CB 3.65Å; F1357-L1423 HydrophobicContact CZ-CB 4.47Å; L1366-L1423 HydrophobicContact CD1-CD2 4.28Å; A1382-L1423 HydrophobicContact CB-CD2 4.22Å; L1390-L1423 HydrophobicContact CD1-CD2 3.97Å; L1390-L1423 HydrophobicContact CD2-CD1 3.37Å; L1390-L1423 HydrophobicContact CD2-CD2 3.72Å; L1390-L1423 HydrophobicContact CD2-CG 4.09Å; L1390-L1423 HydrophobicContact CG-CD2 4.49Å; L1423-I1425 HydrophobicContact CD1-CD1 4.06Å; L1423-I1425 HydrophobicContact CD1-CG1 3.56Å; L1423-I1425 HydrophobicContact CD2-CD1 4.15Å; L1423-I1425 HydrophobicContact CG-CD1 4.16Å; L1423-I1425 HydrophobicContact CG-CG1 4.01Å; L1423-V1434 HydrophobicContact CD1-CG1 3.81Å; L1423-K1435 WeakPolarHBondContact CA-O 3.18Å
1424	L	94.3	Very high	89.4	Confident	31 Å²	31	43.6 Å²	43.6	16%	0.162	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.7	170.2	-61.4	169.6	0	0	0	110.5	I1353 E1354 V1434 K1435	I1353-L1424 CarbonylContact O-C 3.59Å; I1353-L1424 WeakPolarHBondContact O-CA 3.3Å; E1354-L1424 HydrophobicContact CB-CD2 3.62Å; E1354-L1424 HydrophobicContact CG-CD2 3.57Å; L1424-V1434 CarbonylContact O-C 3.59Å; L1424-V1434 WeakPolarHBondContact O-CA 3.47Å; L1424-K1435 HydrophobicContact CB-CB 4.1Å; L1424-K1435 HydrophobicContact CD1-CD 4.15Å; L1424-K1435 PolarHBondContact N-O 3.1Å; L1424-K1435 PolarHBondContact O-N 2.89Å
1425	I	94	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	113.7	177.2	-55.3	173.6	0	0	0	109.7	H1352 I1353 F1367 I1380 A1382 V1392 L1423 L1432 R1433 V1434	H1352-I1425 WeakPolarHBondContact CA-O 3.36Å; I1353-I1425 HydrophobicContact CB-CB 4.39Å; I1353-I1425 PolarHBondContact N-O 3.31Å; I1353-I1425 PolarHBondContact O-N 2.83Å; F1367-I1425 HydrophobicContact CE1-CD1 3.79Å; F1367-I1425 HydrophobicContact CZ-CD1 3.71Å; I1380-I1425 HydrophobicContact CD1-CG2 4.24Å; A1382-I1425 HydrophobicContact CB-CD1 4.42Å; V1392-I1425 HydrophobicContact CG1-CD1 3.97Å; V1392-I1425 HydrophobicContact CG1-CG2 4.39Å; V1392-I1425 HydrophobicContact CG2-CD1 3.9Å; V1392-I1425 HydrophobicContact CG2-CG1 4.36Å; L1423-I1425 HydrophobicContact CD1-CD1 4.06Å; L1423-I1425 HydrophobicContact CD1-CG1 3.56Å; L1423-I1425 HydrophobicContact CD2-CD1 4.15Å; L1423-I1425 HydrophobicContact CG-CD1 4.16Å; L1423-I1425 HydrophobicContact CG-CG1 4.01Å; I1425-L1432 HydrophobicContact CG2-CD1 3.6Å; I1425-R1433 WeakPolarHBondContact CA-O 3.29Å; I1425-V1434 HydrophobicContact CG1-CG2 4.47Å
1426	D	90.6	Very high	89.7	Confident	19 Å²	19	42.8 Å²	42.8	10%	0.102	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	102.4	171	-55	-48.1	0	0	0	109.7	H1352 L1428 L1432 R1433 R1441	H1352-D1426 IonicContact CE1-OD1 2.66Å; H1352-D1426 IonicContact CG-OD1 2.62Å; H1352-D1426 IonicContact ND1-OD1 3.98Å; H1352-D1426 PolarHBondContact ND1-OD1 2.92Å; D1426-L1428 HydrophobicContact CB-CG 4.46Å; D1426-L1428 PolarHBondContact O-N 3.28Å; D1426-L1432 CarbonylContact O-C 3.55Å; D1426-L1432 WeakPolarHBondContact O-CA 3.27Å; D1426-R1433 HydrophobicContact CB-CB 4.06Å; D1426-R1433 HydrophobicContact CB-CG 4.37Å; D1426-R1433 PolarHBondContact N-O 2.94Å; D1426-R1433 PolarHBondContact O-N 3Å; D1426-R1441 IonicContact OD2-CZ 2.65Å; D1426-R1441 IonicContact OD2-NE 3.53Å; D1426-R1441 IonicContact OD2-NH2 2.76Å; D1426-R1441 PolarHBondContact OD2-NH2 3.22Å
1427	K	88.6	Confident	89.3	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	102.4	166.3	-170.1	-80.2	174.8	-150.6	0	108.4	K1350 L1351 L1432 L1446 T1463 F1465	K1350-K1427 CarbonylContact C-O 3.55Å; K1350-K1427 WeakPolarHBondContact CA-O 3.47Å; L1351-K1427 HydrophobicContact CB-CB 4.18Å; L1351-K1427 PolarHBondContact N-O 2.84Å; L1351-K1427 PolarHBondContact O-N 2.86Å; K1427-L1432 HydrophobicContact CB-CD1 3.97Å; K1427-L1432 HydrophobicContact CG-CD1 4.35Å; K1427-L1446 HydrophobicContact CD-CD1 4.23Å; K1427-L1446 HydrophobicContact CG-CD1 4.28Å; K1427-T1463 PolarHBondContact NZ-O 2.85Å; K1427-T1463 VanDerWaalsContact NZ-O 3.1Å; K1427-F1465 HydrophobicContact CD-CB 4.34Å; K1427-F1465 HydrophobicContact CD-CD1 3.9Å; K1427-F1465 HydrophobicContact CD-CE1 4.31Å; K1427-F1465 HydrophobicContact CD-CG 4.06Å; K1427-F1465 HydrophobicContact CG-CE1 4.47Å
1428	L	83.9	Confident	88.8	Confident	44 Å²	44	39.6 Å²	39.6	23%	0.23	20%	0.204	C	C	.	.			trans	-90.7	-173.1	174.8	-56.3	177.4	0	0	0	110.6	K1350 D1426 V1431 L1446	K1350-L1428 HydrophobicContact CG-CD2 4.21Å; D1426-L1428 HydrophobicContact CB-CG 4.46Å; D1426-L1428 PolarHBondContact O-N 3.28Å; L1428-V1431 WeakPolarHBondContact CB-O 3.09Å; L1428-V1431 PolarHBondContact N-O 2.85Å; L1428-L1446 VanDerWaalsContact O-CD1 3.3Å; L1428-L1446 WeakPolarHBondContact O-CD1 2.96Å
1429	Q	75.7	Confident	88.8	Confident	105 Å²	105	37.7 Å²	37.7	49%	0.491	19%	0.193	S	C	.	.	S	Bend	trans	-59.8	-54.6	175.6	-73.7	-178.1	-36.8	0	0	112.2	L1446 T1463	Q1429-L1446 WeakPolarHBondContact O-CD1 3.27Å; Q1429-T1463 WeakPolarHBondContact O-CB 3Å; Q1429-T1463 WeakPolarHBondContact O-CG2 3.37Å
1430	K	79.1	Confident	88.6	Confident	106 Å²	106	41.7 Å²	41.7	46%	0.461	21%	0.21	S	C	.	.	S	Bend	trans	-107.9	-6.7	-172.2	-61.2	-167.3	178.1	-175.9	0	115.2	L1446 I1447	K1430-L1446 PolarHBondContact O-N 2.62Å; K1430-I1447 HydrophobicContact CB-CD1 3.89Å; K1430-I1447 HydrophobicContact CD-CD1 3.79Å; K1430-I1447 HydrophobicContact CG-CD1 3.66Å
1431	V	86.8	Confident	88.5	Confident	41 Å²	41	48 Å²	48	25%	0.248	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	135.8	-168.8	-179.7	0	0	0	0	110.1	L1428 R1433 R1443 V1444	L1428-V1431 WeakPolarHBondContact CB-O 3.09Å; L1428-V1431 PolarHBondContact N-O 2.85Å; V1431-R1433 HydrophobicContact CG1-CG 3.89Å; V1431-R1443 HydrophobicContact CG1-CB 3.94Å; V1431-V1444 WeakPolarHBondContact CA-O 3.41Å
1432	L	90.2	Very high	88.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.9	161.7	179.7	71.1	0	0	0	108	V1392 I1425 D1426 K1427 V1434 R1443 V1444 L1446	V1392-L1432 HydrophobicContact CG1-CD2 4.03Å; I1425-L1432 HydrophobicContact CG2-CD1 3.6Å; D1426-L1432 CarbonylContact O-C 3.55Å; D1426-L1432 WeakPolarHBondContact O-CA 3.27Å; K1427-L1432 HydrophobicContact CB-CD1 3.97Å; K1427-L1432 HydrophobicContact CG-CD1 4.35Å; L1432-V1434 HydrophobicContact CG-CG2 4.49Å; L1432-R1443 VanDerWaalsContact O-CA 3.3Å; L1432-R1443 WeakPolarHBondContact O-CA 3.5Å; L1432-V1444 HydrophobicContact CB-CG1 3.83Å; L1432-V1444 HydrophobicContact CD2-CG1 4.09Å; L1432-V1444 HydrophobicContact CG-CG1 4.42Å; L1432-V1444 PolarHBondContact N-O 2.82Å; L1432-V1444 PolarHBondContact O-N 2.86Å; L1432-L1446 HydrophobicContact CB-CD2 4.01Å; L1432-L1446 HydrophobicContact CB-CG 4.48Å
1433	R	92.3	Very high	88.3	Confident	100 Å²	100	58.1 Å²	58.1	38%	0.377	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.7	173	-47.7	174.5	175	168.4	-4.3	109.7	I1425 D1426 V1431 Q1442 R1443	I1425-R1433 WeakPolarHBondContact CA-O 3.29Å; D1426-R1433 HydrophobicContact CB-CB 4.06Å; D1426-R1433 HydrophobicContact CB-CG 4.37Å; D1426-R1433 PolarHBondContact N-O 2.94Å; D1426-R1433 PolarHBondContact O-N 3Å; V1431-R1433 HydrophobicContact CG1-CG 3.89Å; R1433-Q1442 CarbonylContact C-O 3.56Å; R1433-Q1442 VanDerWaalsContact CA-O 3.27Å; R1433-Q1442 WeakPolarHBondContact CA-O 3.37Å; R1433-R1443 HydrophobicContact CG-CB 4.36Å
1434	V	94	Very high	87.9	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.9	177.8	178.8	0	0	0	0	109.1	L1390 V1392 L1409 Y1411 L1423 L1424 I1425 L1432 R1441 Q1442	L1390-V1434 HydrophobicContact CD2-CG1 3.94Å; V1392-V1434 HydrophobicContact CB-CG2 4.08Å; V1392-V1434 HydrophobicContact CG1-CG2 4.43Å; V1392-V1434 HydrophobicContact CG2-CG1 4.16Å; V1392-V1434 HydrophobicContact CG2-CG2 3.79Å; L1409-V1434 HydrophobicContact CD1-CB 4.29Å; L1409-V1434 HydrophobicContact CD1-CG2 4Å; L1409-V1434 HydrophobicContact CD2-CB 3.87Å; L1409-V1434 HydrophobicContact CD2-CG1 4.36Å; L1409-V1434 HydrophobicContact CD2-CG2 3.91Å; L1409-V1434 HydrophobicContact CG-CG2 4.44Å; Y1411-V1434 HydrophobicContact CD2-CB 4.26Å; Y1411-V1434 HydrophobicContact CD2-CG1 3.86Å; Y1411-V1434 HydrophobicContact CE2-CG1 4.44Å; Y1411-V1434 WeakPolarHBondContact CE2-O 3.43Å; L1423-V1434 HydrophobicContact CD1-CG1 3.81Å; L1424-V1434 CarbonylContact O-C 3.59Å; L1424-V1434 WeakPolarHBondContact O-CA 3.47Å; I1425-V1434 HydrophobicContact CG1-CG2 4.47Å; L1432-V1434 HydrophobicContact CG-CG2 4.49Å; V1434-R1441 WeakPolarHBondContact O-CA 3.37Å; V1434-Q1442 PolarHBondContact N-O 2.92Å; V1434-Q1442 PolarHBondContact O-N 2.82Å
1435	K	93.8	Very high	87.4	Confident	54 Å²	54	61.6 Å²	61.6	24%	0.235	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.1	173.6	-154.9	-166.6	-175.5	-162.2	0	108.9	L1423 L1424 G1438 N1439 R1441	L1423-K1435 WeakPolarHBondContact CA-O 3.18Å; L1424-K1435 HydrophobicContact CB-CB 4.1Å; L1424-K1435 HydrophobicContact CD1-CD 4.15Å; L1424-K1435 PolarHBondContact N-O 3.1Å; L1424-K1435 PolarHBondContact O-N 2.89Å; K1435-G1438 WeakPolarHBondContact CE-O 3.39Å; K1435-G1438 PolarHBondContact NZ-O 3.32Å; K1435-N1439 WeakPolarHBondContact CE-O 3.48Å; K1435-N1439 VanDerWaalsContact CG-O 3.24Å; K1435-N1439 WeakPolarHBondContact CG-O 3.48Å; K1435-R1441 HydrophobicContact CB-CG 3.93Å; K1435-R1441 HydrophobicContact CD-CG 3.99Å; K1435-R1441 HydrophobicContact CG-CG 3.79Å
1436	V	92.6	Very high	86.6	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.2	170.6	-177.6	0	0	0	0	108.4	L1390 Y1411 V1415 T1422 G1438 N1439	L1390-V1436 HydrophobicContact CD2-CG2 3.75Å; Y1411-V1436 HydrophobicContact CD1-CB 3.99Å; Y1411-V1436 HydrophobicContact CD1-CG2 3.62Å; Y1411-V1436 HydrophobicContact CD2-CG2 4.38Å; Y1411-V1436 HydrophobicContact CE1-CB 3.61Å; Y1411-V1436 HydrophobicContact CE1-CG2 3.72Å; Y1411-V1436 HydrophobicContact CE2-CG2 4.48Å; Y1411-V1436 HydrophobicContact CG-CG2 3.97Å; Y1411-V1436 PolarHBondContact OH-N 2.89Å; V1415-V1436 HydrophobicContact CG2-CG1 4.45Å; T1422-V1436 CarbonylContact O-C 3.57Å; T1422-V1436 WeakPolarHBondContact O-CA 3.39Å; V1436-G1438 PolarHBondContact O-N 2.85Å; V1436-N1439 WeakPolarHBondContact O-CB 3.35Å; V1436-N1439 PolarHBondContact O-N 3.14Å
1437	N	82.7	Confident	85.9	Confident	38 Å²	38	61.2 Å²	61.2	20%	0.203	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	25.1	166	-60.7	9.4	0	0	0	117.8	Q1416 N1421 T1422	Q1416-N1437 PolarHBondContact OE1-ND2 2.92Å; N1421-N1437 WeakPolarHBondContact CA-OD1 3.3Å; N1421-N1437 VanDerWaalsContact CB-OD1 3.23Å; N1421-N1437 WeakPolarHBondContact CB-OD1 3.46Å; N1421-N1437 PolarHBondContact OD1-ND2 2.78Å; N1421-N1437 PolarHBondContact OD1-OD1 2.77Å; T1422-N1437 PolarHBondContact N-OD1 2.86Å; T1422-N1437 PolarHBondContact O-N 2.86Å
1438	G	76.7	Confident	84.9	Confident	52 Å²	52	63 Å²	63	54%	0.536	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-12	-176.7	0	0	0	0	0	115	K1435 V1436	K1435-G1438 WeakPolarHBondContact CE-O 3.39Å; K1435-G1438 PolarHBondContact NZ-O 3.32Å; V1436-G1438 PolarHBondContact O-N 2.85Å
1439	N	86.9	Confident	84.2	Confident	73 Å²	73	65.5 Å²	65.5	39%	0.39	33%	0.326	S	S	.	.			trans	-71	-177	-174.3	-60.2	-9.6	0	0	0	113.8	E1413 K1435 V1436 R1441	E1413-N1439 WeakPolarHBondContact OE2-CB 3.22Å; E1413-N1439 PolarHBondContact OE2-ND2 2.87Å; K1435-N1439 WeakPolarHBondContact CE-O 3.48Å; K1435-N1439 VanDerWaalsContact CG-O 3.24Å; K1435-N1439 WeakPolarHBondContact CG-O 3.48Å; V1436-N1439 WeakPolarHBondContact O-CB 3.35Å; V1436-N1439 PolarHBondContact O-N 3.14Å; N1439-R1441 PolarHBondContact O-N 3.11Å
1440	K	85.1	Confident	84	Confident	169 Å²	169	66.6 Å²	66.6	74%	0.735	33%	0.326	S	S	*	.			trans	-62.4	127.6	-170.9	-71.3	176.1	-179.2	170.1	0	111.4	Y1411 Q1442	Y1411-K1440 PolarHBondContact OH-O 2.89Å; K1440-Q1442 PolarHBondContact O-N 2.74Å
1441	R	88.6	Confident	83.4	Confident	146 Å²	146	62.6 Å²	62.6	55%	0.551	31%	0.309	S	S	*	.			trans	-63.1	115.4	174.1	-87.4	177.4	157	149.5	-7.3	109.8	D1426 V1434 K1435 N1439	D1426-R1441 IonicContact OD2-CZ 2.65Å; D1426-R1441 IonicContact OD2-NE 3.53Å; D1426-R1441 IonicContact OD2-NH2 2.76Å; D1426-R1441 PolarHBondContact OD2-NH2 3.22Å; V1434-R1441 WeakPolarHBondContact O-CA 3.37Å; K1435-R1441 HydrophobicContact CB-CG 3.93Å; K1435-R1441 HydrophobicContact CD-CG 3.99Å; K1435-R1441 HydrophobicContact CG-CG 3.79Å; N1439-R1441 PolarHBondContact O-N 3.11Å
1442	Q	91.4	Very high	82.2	Confident	29 Å²	29	66.2 Å²	66.2	14%	0.136	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	154.5	175	-62.2	178.4	29.2	0	0	109.4	Y1411 N1412 R1433 V1434 K1440	Y1411-Q1442 HydrophobicContact CD2-CB 3.93Å; Y1411-Q1442 HydrophobicContact CD2-CG 3.83Å; Y1411-Q1442 HydrophobicContact CE2-CB 3.88Å; Y1411-Q1442 VanDerWaalsContact CE2-CD 3.43Å; Y1411-Q1442 HydrophobicContact CE2-CG 3.53Å; Y1411-Q1442 VanDerWaalsContact CE2-NE2 3.33Å; N1412-Q1442 VanDerWaalsContact N-NE2 3.14Å; N1412-Q1442 PolarHBondContact OD1-OE1 2.81Å; R1433-Q1442 CarbonylContact C-O 3.56Å; R1433-Q1442 VanDerWaalsContact CA-O 3.27Å; R1433-Q1442 WeakPolarHBondContact CA-O 3.37Å; V1434-Q1442 PolarHBondContact N-O 2.92Å; V1434-Q1442 PolarHBondContact O-N 2.82Å; K1440-Q1442 PolarHBondContact O-N 2.74Å
1443	R	91.2	Very high	81	Confident	207 Å²	207	75 Å²	75	78%	0.781	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	144	-173.9	72.2	-178.1	-172.2	-179.5	2.4	112.2	V1431 L1432 R1433	V1431-R1443 HydrophobicContact CG1-CB 3.94Å; L1432-R1443 VanDerWaalsContact O-CA 3.3Å; L1432-R1443 WeakPolarHBondContact O-CA 3.5Å; R1433-R1443 HydrophobicContact CG-CB 4.36Å
1444	V	87.9	Confident	79.6	Confident	44 Å²	44	72.6 Å²	72.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.2	169.9	66.6	0	0	0	0	110	I1407 L1409 V1431 L1432	I1407-V1444 HydrophobicContact CG2-CB 4.43Å; I1407-V1444 HydrophobicContact CG2-CG1 3.46Å; I1407-V1444 VanDerWaalsContact CG2-CG1 3.46Å; I1407-V1444 HydrophobicContact CG2-CG2 4.07Å; L1409-V1444 HydrophobicContact CB-CG1 4.06Å; L1409-V1444 HydrophobicContact CD1-CB 4.12Å; L1409-V1444 HydrophobicContact CD1-CG1 3.89Å; L1409-V1444 HydrophobicContact CG-CG1 4.49Å; V1431-V1444 WeakPolarHBondContact CA-O 3.41Å; L1432-V1444 HydrophobicContact CB-CG1 3.83Å; L1432-V1444 HydrophobicContact CD2-CG1 4.09Å; L1432-V1444 HydrophobicContact CG-CG1 4.42Å; L1432-V1444 PolarHBondContact N-O 2.82Å; L1432-V1444 PolarHBondContact O-N 2.86Å
1445	S	83	Confident	78.2	Confident	60 Å²	60	79 Å²	79	42%	0.42	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	134.3	173.5	-173.8	0	0	0	0	110	I1447	S1445-I1447 WeakPolarHBondContact CB-O 3.29Å; S1445-I1447 PolarHBondContact O-N 2.9Å; S1445-I1447 PolarHBondContact OG-N 2.73Å; S1445-I1447 VanDerWaalsContact OG-N 3.08Å; S1445-I1447 PolarHBondContact OG-O 3.42Å
1446	L	78.4	Confident	76.8	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.005	41%	0.411	C	S	.	.	S	Bend	trans	-78.9	-4.4	167.9	-64.4	173.1	0	0	0	112.2	T1396 I1407 K1427 L1428 Q1429 K1430 L1432	T1396-L1446 HydrophobicContact CG2-CD2 4.09Å; I1407-L1446 HydrophobicContact CD1-CD2 3.95Å; I1407-L1446 HydrophobicContact CG1-CD2 4.31Å; I1407-L1446 HydrophobicContact CG2-CD2 4.4Å; K1427-L1446 HydrophobicContact CD-CD1 4.23Å; K1427-L1446 HydrophobicContact CG-CD1 4.28Å; L1428-L1446 VanDerWaalsContact O-CD1 3.3Å; L1428-L1446 WeakPolarHBondContact O-CD1 2.96Å; Q1429-L1446 WeakPolarHBondContact O-CD1 3.27Å; K1430-L1446 PolarHBondContact O-N 2.62Å; L1432-L1446 HydrophobicContact CB-CD2 4.01Å; L1432-L1446 HydrophobicContact CB-CG 4.48Å
1447	I	74.1	Confident	75.5	Confident	9 Å²	9	87.3 Å²	87.3	5%	0.046	43%	0.433	C	S	.	.	S	Bend	trans	-117.8	110.3	179.5	-62.7	151.2	0	0	0	107.4	K1430 S1445 F1451 L1459 T1463	K1430-I1447 HydrophobicContact CB-CD1 3.89Å; K1430-I1447 HydrophobicContact CD-CD1 3.79Å; K1430-I1447 HydrophobicContact CG-CD1 3.66Å; S1445-I1447 WeakPolarHBondContact CB-O 3.29Å; S1445-I1447 PolarHBondContact O-N 2.9Å; S1445-I1447 PolarHBondContact OG-N 2.73Å; S1445-I1447 VanDerWaalsContact OG-N 3.08Å; S1445-I1447 PolarHBondContact OG-O 3.42Å; I1447-F1451 HydrophobicContact CG2-CB 3.9Å; I1447-L1459 HydrophobicContact CD1-CD1 3.67Å; I1447-L1459 HydrophobicContact CD1-CG 4.29Å; I1447-L1459 HydrophobicContact CG1-CD1 4.05Å; I1447-L1459 HydrophobicContact CG2-CD1 4.32Å; I1447-T1463 HydrophobicContact CD1-CG2 4.03Å; I1447-T1463 HydrophobicContact CG1-CG2 3.98Å
1448	P	68.5	Low	74.5	Confident	40 Å²	40	87.7 Å²	87.7	26%	0.26	44%	0.435	S	S	.	.			trans	-52	142.3	169.8	-29.2	35.1	0	0	0	112.1	R1450 F1451	P1448-R1450 HydrophobicContact CB-CG 4.01Å; P1448-R1450 PolarHBondContact O-N 3.01Å; P1448-R1450 VanDerWaalsContact O-N 3.1Å; P1448-F1451 HydrophobicContact CB-CD2 4.08Å; P1448-F1451 HydrophobicContact CB-CE2 4.48Å; P1448-F1451 HydrophobicContact CG-CD2 4.07Å; P1448-F1451 HydrophobicContact CG-CE2 4.3Å; P1448-F1451 WeakPolarHBondContact O-CB 3.37Å; P1448-F1451 PolarHBondContact O-N 2.93Å
1449	S	70.2	Confident	74.1	Confident	97 Å²	97	86.1 Å²	86.1	68%	0.678	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-55.1	-36.6	-171.8	-48.3	0	0	0	0	113.8	F1451 L1452	S1449-F1451 PolarHBondContact O-N 3.4Å; S1449-L1452 WeakPolarHBondContact O-CB 3.39Å; S1449-L1452 WeakPolarHBondContact O-CD1 3.33Å; S1449-L1452 WeakPolarHBondContact O-CG 3.37Å; S1449-L1452 PolarHBondContact O-N 2.65Å; S1449-L1452 VanDerWaalsContact O-N 3.1Å
1450	R	69.8	Low	73.1	Confident	127 Å²	127	90.2 Å²	90.2	48%	0.479	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-56	-16.8	173.1	60.6	178	-175.3	169	8.5	115.1	E1404 P1448	E1404-R1450 VanDerWaalsContact CB-NH2 3.28Å; E1404-R1450 VanDerWaalsContact CD-NH1 3.32Å; E1404-R1450 IonicContact OE1-NH1 2.7Å; E1404-R1450 PolarHBondContact OE1-NH1 2.76Å; E1404-R1450 IonicContact OE2-CZ 3.32Å; E1404-R1450 IonicContact OE2-NH1 3.13Å; E1404-R1450 PolarHBondContact OE2-NH1 3.43Å; E1404-R1450 IonicContact OE2-NH2 2.69Å; E1404-R1450 PolarHBondContact OE2-NH2 3.44Å; P1448-R1450 HydrophobicContact CB-CG 4.01Å; P1448-R1450 PolarHBondContact O-N 3.01Å; P1448-R1450 VanDerWaalsContact O-N 3.1Å
1451	F	67.7	Low	72.2	Confident	23 Å²	23	87.6 Å²	87.6	10%	0.101	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-109.1	9.1	-178.5	-59.3	-29.4	0	0	0	113.4	I1447 P1448 S1449 H1453 I1454 L1462	I1447-F1451 HydrophobicContact CG2-CB 3.9Å; P1448-F1451 HydrophobicContact CB-CD2 4.08Å; P1448-F1451 HydrophobicContact CB-CE2 4.48Å; P1448-F1451 HydrophobicContact CG-CD2 4.07Å; P1448-F1451 HydrophobicContact CG-CE2 4.3Å; P1448-F1451 WeakPolarHBondContact O-CB 3.37Å; P1448-F1451 PolarHBondContact O-N 2.93Å; S1449-F1451 PolarHBondContact O-N 3.4Å; F1451-H1453 PolarHBondContact O-N 3.19Å; F1451-I1454 HydrophobicContact CB-CD1 3.84Å; F1451-I1454 HydrophobicContact CB-CG1 4.32Å; F1451-I1454 HydrophobicContact CD1-CD1 3.4Å; F1451-I1454 VanDerWaalsContact CD1-CD1 3.4Å; F1451-I1454 HydrophobicContact CD1-CG1 4.44Å; F1451-I1454 HydrophobicContact CE1-CD1 4.17Å; F1451-I1454 HydrophobicContact CG-CD1 3.81Å; F1451-I1454 WeakPolarHBondContact O-CB 3.3Å; F1451-I1454 PolarHBondContact O-N 2.61Å; F1451-L1462 HydrophobicContact CB-CD1 4.37Å; F1451-L1462 HydrophobicContact CD2-CD1 4.26Å; F1451-L1462 HydrophobicContact CG-CD1 4.46Å
1452	L	61	Low	71	Confident	117 Å²	117	81.1 Å²	81.1	61%	0.613	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.9	178.4	-76.2	167.2	0	0	0	114.1	S1449	S1449-L1452 WeakPolarHBondContact O-CB 3.39Å; S1449-L1452 WeakPolarHBondContact O-CD1 3.33Å; S1449-L1452 WeakPolarHBondContact O-CG 3.37Å; S1449-L1452 PolarHBondContact O-N 2.65Å; S1449-L1452 VanDerWaalsContact O-N 3.1Å
1453	H	64.9	Low	70.1	Confident	185 Å²	185	80.5 Å²	80.5	86%	0.856	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	10.7	-178.7	-58.5	-70.3	0	0	0	113.9	F1451	F1451-H1453 PolarHBondContact O-N 3.19Å
1454	I	63	Low	69.2	Low	48 Å²	48	71.7 Å²	71.7	25%	0.246	36%	0.362	C	S	.	.	S	Bend	trans	-79.9	146.1	-177.1	-75.5	-170.9	0	0	0	112.3	F1451 L1458 L1462	F1451-I1454 HydrophobicContact CB-CD1 3.84Å; F1451-I1454 HydrophobicContact CB-CG1 4.32Å; F1451-I1454 HydrophobicContact CD1-CD1 3.4Å; F1451-I1454 VanDerWaalsContact CD1-CD1 3.4Å; F1451-I1454 HydrophobicContact CD1-CG1 4.44Å; F1451-I1454 HydrophobicContact CE1-CD1 4.17Å; F1451-I1454 HydrophobicContact CG-CD1 3.81Å; F1451-I1454 WeakPolarHBondContact O-CB 3.3Å; F1451-I1454 PolarHBondContact O-N 2.61Å; I1454-L1458 HydrophobicContact CD1-CD2 4.19Å; I1454-L1458 HydrophobicContact CG2-CB 3.41Å; I1454-L1458 VanDerWaalsContact CG2-CB 3.41Å; I1454-L1458 HydrophobicContact CG2-CD2 3.69Å; I1454-L1458 HydrophobicContact CG2-CG 4.19Å; I1454-L1462 HydrophobicContact CG2-CD1 4.47Å
1455	Q	65.4	Low	68.8	Low	137 Å²	137	69.8 Å²	69.8	64%	0.64	35%	0.35	S	S	*	.			trans	-53.6	144.9	-179.9	-62.3	-173.2	5	0	0	113.4	H1457 L1458 L1459	Q1455-H1457 PolarHBondContact O-N 3.38Å; Q1455-H1457 PolarHBondContact OE1-CE1 3.33Å; Q1455-H1457 PolarHBondContact OE1-ND1 2.91Å; Q1455-L1458 PolarHBondContact O-N 3.19Å; Q1455-L1459 PolarHBondContact O-N 3.31Å
1456	N	64.2	Low	68.6	Low	125 Å²	125	70.1 Å²	70.1	67%	0.668	35%	0.347	S	S	*	.	H	α-helix	trans	-57.4	-18.3	-177.6	-86.7	-37.4	0	0	0	115.4	K1460	N1456-K1460 WeakPolarHBondContact O-CG 3.47Å
1457	H	64.6	Low	68.7	Low	106 Å²	106	70.1 Å²	70.1	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-77.4	-57.4	175.8	83.2	-93.1	0	0	0	110.9	Q1455 L1459 K1460 E1461	Q1455-H1457 PolarHBondContact O-N 3.38Å; Q1455-H1457 PolarHBondContact OE1-CE1 3.33Å; Q1455-H1457 PolarHBondContact OE1-ND1 2.91Å; H1457-L1459 PolarHBondContact O-N 3.44Å; H1457-L1459 VanDerWaalsContact O-N 3.14Å; H1457-K1460 WeakPolarHBondContact O-CB 3.38Å; H1457-K1460 PolarHBondContact O-N 2.83Å; H1457-E1461 PolarHBondContact O-N 3.24Å
1458	L	63	Low	68.7	Low	47 Å²	47	70.2 Å²	70.2	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-54.6	-34.4	173.1	-124.9	81.3	0	0	0	111.4	L1401 I1454 Q1455 K1460 E1461 L1462	L1401-L1458 HydrophobicContact CD1-CD2 4.19Å; I1454-L1458 HydrophobicContact CD1-CD2 4.19Å; I1454-L1458 HydrophobicContact CG2-CB 3.41Å; I1454-L1458 VanDerWaalsContact CG2-CB 3.41Å; I1454-L1458 HydrophobicContact CG2-CD2 3.69Å; I1454-L1458 HydrophobicContact CG2-CG 4.19Å; Q1455-L1458 PolarHBondContact O-N 3.19Å; L1458-K1460 VanDerWaalsContact C-N 3.28Å; L1458-K1460 PolarHBondContact O-N 2.96Å; L1458-E1461 CarbonylContact O-C 3.45Å; L1458-E1461 WeakPolarHBondContact O-CA 3.46Å; L1458-E1461 WeakPolarHBondContact O-CB 3.45Å; L1458-E1461 PolarHBondContact O-N 3.4Å; L1458-L1462 WeakPolarHBondContact O-CG 3.2Å; L1458-L1462 PolarHBondContact O-N 2.78Å
1459	L	66.5	Low	68.9	Low	18 Å²	18	71 Å²	71	9%	0.094	36%	0.355	C	S	.	.	H	α-helix	trans	-62.8	-31.9	177.4	-156.4	68.3	0	0	0	113	I1447 Q1455 H1457 T1463	I1447-L1459 HydrophobicContact CD1-CD1 3.67Å; I1447-L1459 HydrophobicContact CD1-CG 4.29Å; I1447-L1459 HydrophobicContact CG1-CD1 4.05Å; I1447-L1459 HydrophobicContact CG2-CD1 4.32Å; Q1455-L1459 PolarHBondContact O-N 3.31Å; H1457-L1459 PolarHBondContact O-N 3.44Å; H1457-L1459 VanDerWaalsContact O-N 3.14Å; L1459-T1463 WeakPolarHBondContact O-CB 3.08Å; L1459-T1463 WeakPolarHBondContact O-CG2 3.47Å; L1459-T1463 PolarHBondContact O-N 3.36Å; L1459-T1463 PolarHBondContact O-OG1 2.87Å
1460	K	67	Low	69.4	Low	159 Å²	159	66.4 Å²	66.4	69%	0.691	32%	0.323	S	S	*	.	H	α-helix	trans	-73	-28.8	171.6	-67.3	167.8	-176.5	174.1	0	111.9	N1456 H1457 L1458 N1464	N1456-K1460 WeakPolarHBondContact O-CG 3.47Å; H1457-K1460 WeakPolarHBondContact O-CB 3.38Å; H1457-K1460 PolarHBondContact O-N 2.83Å; L1458-K1460 VanDerWaalsContact C-N 3.28Å; L1458-K1460 PolarHBondContact O-N 2.96Å; K1460-N1464 WeakPolarHBondContact O-CB 3.49Å; K1460-N1464 PolarHBondContact O-N 2.88Å
1461	E	65.2	Low	70	Confident	114 Å²	114	61.6 Å²	61.6	53%	0.533	31%	0.308	S	S	.	.	H	α-helix	trans	-76.9	-49.5	176.8	-58	-160.5	125.9	0	0	111.8	G1397 H1457 L1458 T1463 N1464	G1397-E1461 WeakPolarHBondContact CA-O 3.36Å; H1457-E1461 PolarHBondContact O-N 3.24Å; L1458-E1461 CarbonylContact O-C 3.45Å; L1458-E1461 WeakPolarHBondContact O-CA 3.46Å; L1458-E1461 WeakPolarHBondContact O-CB 3.45Å; L1458-E1461 PolarHBondContact O-N 3.4Å; E1461-T1463 PolarHBondContact O-N 3.3Å; E1461-N1464 WeakPolarHBondContact O-CB 2.99Å; E1461-N1464 PolarHBondContact O-N 3.45Å
1462	L	64.9	Low	70.9	Confident	11 Å²	11	60.6 Å²	60.6	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-56.8	-33.6	176.1	-70.3	168.4	0	0	0	112.6	T1396 N1405 F1451 I1454 L1458	T1396-L1462 CarbonylContact C-O 3.38Å; T1396-L1462 WeakPolarHBondContact CB-O 3.14Å; T1396-L1462 PolarHBondContact OG1-O 3.33Å; N1405-L1462 WeakPolarHBondContact ND2-CD2 3.47Å; F1451-L1462 HydrophobicContact CB-CD1 4.37Å; F1451-L1462 HydrophobicContact CD2-CD1 4.26Å; F1451-L1462 HydrophobicContact CG-CD1 4.46Å; I1454-L1462 HydrophobicContact CG2-CD1 4.47Å; L1458-L1462 WeakPolarHBondContact O-CG 3.2Å; L1458-L1462 PolarHBondContact O-N 2.78Å
1463	T	70.7	Confident	72.3	Confident	16 Å²	16	55.3 Å²	55.3	10%	0.098	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.7	178.8	58.6	0	0	0	0	114.4	K1427 Q1429 I1447 L1459 E1461 F1465	K1427-T1463 PolarHBondContact NZ-O 2.85Å; K1427-T1463 VanDerWaalsContact NZ-O 3.1Å; Q1429-T1463 WeakPolarHBondContact O-CB 3Å; Q1429-T1463 WeakPolarHBondContact O-CG2 3.37Å; I1447-T1463 HydrophobicContact CD1-CG2 4.03Å; I1447-T1463 HydrophobicContact CG1-CG2 3.98Å; L1459-T1463 WeakPolarHBondContact O-CB 3.08Å; L1459-T1463 WeakPolarHBondContact O-CG2 3.47Å; L1459-T1463 PolarHBondContact O-N 3.36Å; L1459-T1463 PolarHBondContact O-OG1 2.87Å; E1461-T1463 PolarHBondContact O-N 3.3Å; T1463-F1465 PolarHBondContact O-N 3.48Å
1464	N	73	Confident	73.7	Confident	21 Å²	21	46.5 Å²	46.5	11%	0.112	24%	0.235	C	C	.	.			trans	-59.4	131.4	-179.8	-172.4	22.5	0	0	0	110.4	R1348 G1397 K1460 E1461	R1348-N1464 WeakPolarHBondContact CG-OD1 3.18Å; R1348-N1464 PolarHBondContact NE-OD1 2.81Å; G1397-N1464 PolarHBondContact N-O 3.29Å; K1460-N1464 WeakPolarHBondContact O-CB 3.49Å; K1460-N1464 PolarHBondContact O-N 2.88Å; E1461-N1464 WeakPolarHBondContact O-CB 2.99Å; E1461-N1464 PolarHBondContact O-N 3.45Å
1465	F	79.6	Confident	74.9	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.018	22%	0.224	C	C	.	.			trans	-153.4	111.3	-174	-172.1	-97.5	0	0	0	107.7	I1346 R1348 L1351 P1378 I1380 T1396 K1427 T1463 L1467	I1346-F1465 HydrophobicContact CG2-CD1 4.39Å; I1346-F1465 HydrophobicContact CG2-CE1 4.07Å; R1348-F1465 WeakPolarHBondContact CA-O 3.5Å; R1348-F1465 PolarHBondContact N-O 2.98Å; L1351-F1465 HydrophobicContact CD2-CE1 3.72Å; L1351-F1465 HydrophobicContact CD2-CZ 4.29Å; P1378-F1465 HydrophobicContact CB-CD2 3.95Å; P1378-F1465 HydrophobicContact CB-CE2 4.39Å; I1380-F1465 HydrophobicContact CB-CZ 4.03Å; I1380-F1465 HydrophobicContact CG2-CZ 4.05Å; T1396-F1465 HydrophobicContact CG2-CD2 3.94Å; K1427-F1465 HydrophobicContact CD-CB 4.34Å; K1427-F1465 HydrophobicContact CD-CD1 3.9Å; K1427-F1465 HydrophobicContact CD-CE1 4.31Å; K1427-F1465 HydrophobicContact CD-CG 4.06Å; K1427-F1465 HydrophobicContact CG-CE1 4.47Å; T1463-F1465 PolarHBondContact O-N 3.48Å; F1465-L1467 HydrophobicContact CE1-CD1 3.64Å; F1465-L1467 HydrophobicContact CE1-CG 4.09Å; F1465-L1467 HydrophobicContact CE2-CD1 4.17Å; F1465-L1467 HydrophobicContact CZ-CD1 3.4Å; F1465-L1467 HydrophobicContact CZ-CG 4.1Å
1466	D	78.6	Confident	76	Confident	67 Å²	67	38 Å²	38	36%	0.358	20%	0.196	S	C	.	.	B	Isolated β-bridge	trans	-140.1	114.3	-177.1	-174.9	4.8	0	0	0	108.4	I1346 S1468	I1346-D1466 WeakPolarHBondContact O-CA 3.26Å; D1466-S1468 WeakPolarHBondContact OD1-CB 2.99Å; D1466-S1468 PolarHBondContact OD1-N 3Å; D1466-S1468 PolarHBondContact OD1-OG 3.01Å
1467	L	80.9	Confident	76.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.171	C	C	.	.			trans	-119.2	21.9	178	-57.7	176.1	0	0	0	110.7	I1346 I1369 P1378 I1380 F1465 S1469 S1470	I1346-L1467 HydrophobicContact CB-CB 4.03Å; I1346-L1467 HydrophobicContact CD1-CB 4.19Å; I1346-L1467 HydrophobicContact CG2-CB 3.97Å; I1346-L1467 HydrophobicContact CG2-CD1 4.47Å; I1346-L1467 HydrophobicContact CG2-CG 4.43Å; I1346-L1467 PolarHBondContact O-N 2.89Å; I1369-L1467 HydrophobicContact CB-CD1 4.07Å; I1369-L1467 HydrophobicContact CG2-CB 3.99Å; I1369-L1467 HydrophobicContact CG2-CD1 3.8Å; I1369-L1467 HydrophobicContact CG2-CD2 4.5Å; I1369-L1467 HydrophobicContact CG2-CG 4.32Å; P1378-L1467 HydrophobicContact CB-CD2 4.46Å; P1378-L1467 HydrophobicContact CG-CD2 4.24Å; P1378-L1467 VanDerWaalsContact O-CD2 3.29Å; P1378-L1467 WeakPolarHBondContact O-CD2 3.31Å; I1380-L1467 HydrophobicContact CG2-CD1 3.7Å; F1465-L1467 HydrophobicContact CE1-CD1 3.64Å; F1465-L1467 HydrophobicContact CE1-CG 4.09Å; F1465-L1467 HydrophobicContact CE2-CD1 4.17Å; F1465-L1467 HydrophobicContact CZ-CD1 3.4Å; F1465-L1467 HydrophobicContact CZ-CG 4.1Å; L1467-S1469 PolarHBondContact O-N 3.44Å; L1467-S1470 WeakPolarHBondContact O-CB 3.43Å; L1467-S1470 PolarHBondContact O-N 2.89Å
1468	S	74.7	Confident	76.8	Confident	11 Å²	11	29.1 Å²	29.1	8%	0.077	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	123.2	178.2	-53.9	0	0	0	0	111.4	K1347 K1372 D1466 S1470	K1347-S1468 WeakPolarHBondContact CE-OG 3.02Å; K1347-S1468 WeakPolarHBondContact CG-OG 3.27Å; K1372-S1468 WeakPolarHBondContact CD-O 3.19Å; K1372-S1468 PolarHBondContact NZ-O 2.98Å; D1466-S1468 WeakPolarHBondContact OD1-CB 2.99Å; D1466-S1468 PolarHBondContact OD1-N 3Å; D1466-S1468 PolarHBondContact OD1-OG 3.01Å; S1468-S1470 PolarHBondContact O-N 2.84Å
1469	S	72.1	Confident	76.5	Confident	57 Å²	57	33 Å²	33	40%	0.399	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	11.5	-172.4	-30.4	0	0	0	0	115.8	P1340 K1372 L1467	P1340-S1469 PolarHBondContact O-N 3.31Å; K1372-S1469 PolarHBondContact NZ-OG 2.8Å; L1467-S1469 PolarHBondContact O-N 3.44Å
1470	S	80.5	Confident	75.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.202	C	C	.	.			trans	-72.8	129.9	165.6	-73	0	0	0	0	109.1	G1339 P1370 K1372 L1467 S1468	G1339-S1470 WeakPolarHBondContact CA-O 3.48Å; P1370-S1470 VanDerWaalsContact O-CB 3.28Å; P1370-S1470 WeakPolarHBondContact O-CB 3.48Å; P1370-S1470 PolarHBondContact O-OG 2.91Å; K1372-S1470 PolarHBondContact N-OG 2.81Å; L1467-S1470 WeakPolarHBondContact O-CB 3.43Å; L1467-S1470 PolarHBondContact O-N 2.89Å; S1468-S1470 PolarHBondContact O-N 2.84Å
1471	P	81.7	Confident	75.1	Confident	26 Å²	26	37.5 Å²	37.5	17%	0.169	18%	0.183	C	C	.	.			trans	-58.7	152.7	176.6	26.8	-35.5	0	0	0	111.2	R1336 L1337 P1370 Y1473	R1336-P1471 HydrophobicContact CG-CB 4.3Å; L1337-P1471 WeakPolarHBondContact O-CA 3.15Å; P1370-P1471 WeakPolarHBondContact CD-O 3.32Å; P1370-P1471 HydrophobicContact CG-CG 4.01Å; P1471-Y1473 HydrophobicContact CB-CE2 3.99Å; P1471-Y1473 HydrophobicContact CG-CE2 3.77Å
1472	I	87.9	Confident	74.2	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.015	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122	176.4	-61.2	155.9	0	0	0	107.6	R1336 L1337 I1369 L1474 I1503	R1336-I1472 WeakPolarHBondContact CA-O 3.06Å; L1337-I1472 HydrophobicContact CB-CB 4.29Å; L1337-I1472 PolarHBondContact N-O 2.86Å; L1337-I1472 PolarHBondContact O-N 3.07Å; I1369-I1472 HydrophobicContact CD1-CG1 4.09Å; I1369-I1472 HydrophobicContact CG1-CG1 4.09Å; I1369-I1472 HydrophobicContact CG1-CG2 4.38Å; I1472-L1474 HydrophobicContact CG2-CD2 3.96Å; I1472-L1474 HydrophobicContact CG2-CG 4.45Å; I1472-I1503 HydrophobicContact CD1-CD1 3.45Å; I1472-I1503 VanDerWaalsContact CD1-CD1 3.45Å; I1472-I1503 HydrophobicContact CG1-CD1 4.39Å
1473	Y	90.9	Very high	73.5	Confident	6 Å²	6	40.1 Å²	40.1	2%	0.024	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.9	174.4	-70.2	-96.7	0	0	0	109.4	F1334 I1335 R1336 F1367 F1368 P1370 P1471 G1476 D1481 I1484	F1334-Y1473 HydrophobicContact CD2-CD1 4.46Å; I1335-Y1473 CarbonylContact O-C 3.46Å; I1335-Y1473 VanDerWaalsContact O-CA 3.31Å; I1335-Y1473 WeakPolarHBondContact O-CA 3.41Å; R1336-Y1473 HydrophobicContact CB-CD1 4.08Å; R1336-Y1473 HydrophobicContact CB-CE1 3.89Å; R1336-Y1473 WeakPolarHBondContact CD-OH 3.45Å; R1336-Y1473 HydrophobicContact CG-CD1 4.25Å; R1336-Y1473 HydrophobicContact CG-CE1 3.74Å; R1336-Y1473 HydrophobicContact CG-CE2 4.29Å; R1336-Y1473 PolarHBondContact NE-OH 3.02Å; F1367-Y1473 CarbonylContact C-O 3.57Å; F1367-Y1473 WeakPolarHBondContact CA-O 3.18Å; F1367-Y1473 WeakPolarHBondContact CB-O 3.29Å; F1368-Y1473 PolarHBondContact N-O 3.49Å; F1368-Y1473 PolarHBondContact O-N 2.9Å; P1370-Y1473 HydrophobicContact CG-CD2 4.13Å; P1370-Y1473 HydrophobicContact CG-CE2 3.89Å; P1471-Y1473 HydrophobicContact CB-CE2 3.99Å; P1471-Y1473 HydrophobicContact CG-CE2 3.77Å; Y1473-G1476 WeakPolarHBondContact CB-O 3.31Å; Y1473-D1481 WeakPolarHBondContact CE1-OD2 3.23Å; Y1473-D1481 PolarHBondContact OH-OD2 2.75Å; Y1473-I1484 HydrophobicContact CE2-CD1 4.1Å
1474	L	92.9	Very high	72.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.5	175	-55.7	-179.3	0	0	0	109.9	F1329 F1334 I1335 L1337 F1367 I1472 G1476 I1498 I1501 L1510	F1329-L1474 WeakPolarHBondContact CE1-O 3.45Å; F1329-L1474 HydrophobicContact CZ-CB 4.18Å; F1334-L1474 WeakPolarHBondContact CA-O 3.46Å; I1335-L1474 HydrophobicContact CB-CB 4.3Å; I1335-L1474 PolarHBondContact N-O 2.72Å; I1335-L1474 PolarHBondContact O-N 2.74Å; L1337-L1474 HydrophobicContact CD1-CD1 3.82Å; L1337-L1474 HydrophobicContact CD1-CG 4.36Å; F1367-L1474 HydrophobicContact CB-CD2 3.77Å; I1472-L1474 HydrophobicContact CG2-CD2 3.96Å; I1472-L1474 HydrophobicContact CG2-CG 4.45Å; L1474-G1476 PolarHBondContact O-N 3.16Å; L1474-I1498 HydrophobicContact CB-CD1 4.18Å; L1474-I1501 HydrophobicContact CD1-CG2 4.14Å; L1474-I1501 HydrophobicContact CD2-CD1 3.8Å; L1474-L1510 HydrophobicContact CD1-CD2 3.71Å
1475	G	88.9	Confident	71.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	69.2	-16.5	174.2	0	0	0	0	0	117	G1333 L1365 L1366 G1493 F1494	G1333-G1475 CarbonylContact O-C 3.59Å; G1333-G1475 VanDerWaalsContact O-C 3.29Å; L1365-G1475 CarbonylContact O-C 3.57Å; L1365-G1475 WeakPolarHBondContact O-CA 3.35Å; L1366-G1475 PolarHBondContact O-N 3.44Å; G1475-G1493 CarbonylContact O-C 3.56Å; G1475-G1493 WeakPolarHBondContact O-CA 3.01Å; G1475-F1494 PolarHBondContact O-N 3.28Å
1476	G	87.2	Confident	71.1	Confident	5 Å²	5	47.1 Å²	47.1	5%	0.052	24%	0.24	C	C	.	.			trans	177.3	-166	-178.2	0	0	0	0	0	111.2	G1333 Y1473 L1474	G1333-G1476 PolarHBondContact O-N 2.98Å; Y1473-G1476 WeakPolarHBondContact CB-O 3.31Å; L1474-G1476 PolarHBondContact O-N 3.16Å
1477	Y	80.9	Confident	70.6	Confident	40 Å²	40	45 Å²	45	16%	0.157	23%	0.227	C	C	.	.			trans	-147.2	159.2	170.6	60.1	-89.2	0	0	0	110.9	L1365 I1484 L1485	L1365-Y1477 HydrophobicContact CD2-CD1 3.79Å; L1365-Y1477 HydrophobicContact CD2-CE1 4.35Å; Y1477-I1484 HydrophobicContact CD1-CG2 4.17Å; Y1477-I1484 HydrophobicContact CD2-CB 4.35Å; Y1477-I1484 HydrophobicContact CD2-CD1 4.47Å; Y1477-I1484 HydrophobicContact CD2-CG2 4Å; Y1477-I1484 HydrophobicContact CE1-CG2 4.35Å; Y1477-I1484 HydrophobicContact CE2-CG2 4.19Å; Y1477-I1484 HydrophobicContact CG-CD1 4.45Å; Y1477-I1484 HydrophobicContact CG-CG2 4.01Å; Y1477-L1485 HydrophobicContact CE2-CD2 4.31Å; Y1477-L1485 VanDerWaalsContact OH-CD2 3.25Å; Y1477-L1485 WeakPolarHBondContact OH-CD2 3.23Å
1478	G	66.7	Low	70.3	Confident	6 Å²	6	45.5 Å²	45.5	6%	0.062	23%	0.229	C	C	.	.			trans	-77.2	139.5	-175.9	0	0	0	0	0	113.3	F1334 Y1480 D1481	F1334-G1478 VanDerWaalsContact CE1-CA 3.47Å; G1478-Y1480 PolarHBondContact O-N 2.97Å; G1478-Y1480 VanDerWaalsContact O-N 3.14Å; G1478-D1481 PolarHBondContact O-N 3.09Å
1479	F	56.4	Low	70.1	Confident	129 Å²	129	48.6 Å²	48.6	57%	0.566	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.2	-178.4	-175.7	-99	0	0	0	114	Q1482	F1479-Q1482 WeakPolarHBondContact O-CG 3.09Å
1480	Y	47.9	Very low	70.2	Confident	216 Å²	216	46.4 Å²	46.4	85%	0.847	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-17.6	177.7	-63.4	-78.1	0	0	0	114.1	G1478 Q1482	G1478-Y1480 PolarHBondContact O-N 2.97Å; G1478-Y1480 VanDerWaalsContact O-N 3.14Å; Y1480-Q1482 PolarHBondContact O-N 2.71Å
1481	D	54.8	Low	69.6	Low	54 Å²	54	49.2 Å²	49.2	29%	0.289	24%	0.243	S	C	.	.			trans	-79.3	36.9	177.2	-69.1	-47.6	0	0	0	111.8	Y1473 G1478 S1483 I1484	Y1473-D1481 WeakPolarHBondContact CE1-OD2 3.23Å; Y1473-D1481 PolarHBondContact OH-OD2 2.75Å; G1478-D1481 PolarHBondContact O-N 3.09Å; D1481-S1483 PolarHBondContact O-N 2.92Å; D1481-I1484 HydrophobicContact CB-CD1 3.65Å; D1481-I1484 HydrophobicContact CB-CG1 4.23Å; D1481-I1484 WeakPolarHBondContact O-CB 3.43Å; D1481-I1484 VanDerWaalsContact O-CG1 3.27Å; D1481-I1484 WeakPolarHBondContact O-CG1 3.05Å; D1481-I1484 PolarHBondContact O-N 2.66Å
1482	Q	46.2	Very low	69	Low	108 Å²	108	48.7 Å²	48.7	51%	0.505	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-53.3	-22.8	-167.2	-64.4	-170.3	-14.7	0	0	115.4	F1479 Y1480 I1484 L1485	F1479-Q1482 WeakPolarHBondContact O-CG 3.09Å; Y1480-Q1482 PolarHBondContact O-N 2.71Å; Q1482-I1484 PolarHBondContact O-N 3.17Å; Q1482-L1485 HydrophobicContact CB-CD1 4.14Å; Q1482-L1485 HydrophobicContact CG-CD1 4.39Å; Q1482-L1485 WeakPolarHBondContact O-CB 3.42Å; Q1482-L1485 PolarHBondContact O-N 2.9Å; Q1482-L1485 VanDerWaalsContact O-N 3.11Å
1483	S	51	Low	68.7	Low	72 Å²	72	48.8 Å²	48.8	50%	0.503	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-54.4	-16.5	170	68.5	0	0	0	0	114.8	D1481 Y1487	D1481-S1483 PolarHBondContact O-N 2.92Å; S1483-Y1487 WeakPolarHBondContact O-CE2 3.11Å
1484	I	57.9	Low	68.7	Low	7 Å²	7	48.5 Å²	48.5	4%	0.036	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-75.6	-27.9	178.2	-68.1	-179.4	0	0	0	113.2	F1368 Y1473 Y1477 D1481 Q1482 N1486 Y1487	F1368-I1484 HydrophobicContact CD1-CD1 4.28Å; F1368-I1484 HydrophobicContact CD1-CG2 3.97Å; F1368-I1484 HydrophobicContact CE1-CB 4.13Å; F1368-I1484 HydrophobicContact CE1-CD1 3.88Å; F1368-I1484 HydrophobicContact CE1-CG1 3.81Å; F1368-I1484 HydrophobicContact CE1-CG2 3.42Å; F1368-I1484 VanDerWaalsContact CE1-CG2 3.42Å; F1368-I1484 HydrophobicContact CZ-CG2 4.19Å; Y1473-I1484 HydrophobicContact CE2-CD1 4.1Å; Y1477-I1484 HydrophobicContact CD1-CG2 4.17Å; Y1477-I1484 HydrophobicContact CD2-CB 4.35Å; Y1477-I1484 HydrophobicContact CD2-CD1 4.47Å; Y1477-I1484 HydrophobicContact CD2-CG2 4Å; Y1477-I1484 HydrophobicContact CE1-CG2 4.35Å; Y1477-I1484 HydrophobicContact CE2-CG2 4.19Å; Y1477-I1484 HydrophobicContact CG-CD1 4.45Å; Y1477-I1484 HydrophobicContact CG-CG2 4.01Å; D1481-I1484 HydrophobicContact CB-CD1 3.65Å; D1481-I1484 HydrophobicContact CB-CG1 4.23Å; D1481-I1484 WeakPolarHBondContact O-CB 3.43Å; D1481-I1484 VanDerWaalsContact O-CG1 3.27Å; D1481-I1484 WeakPolarHBondContact O-CG1 3.05Å; D1481-I1484 PolarHBondContact O-N 2.66Å; Q1482-I1484 PolarHBondContact O-N 3.17Å; I1484-N1486 PolarHBondContact O-N 3.12Å; I1484-Y1487 PolarHBondContact O-N 2.89Å; I1484-Y1487 VanDerWaalsContact O-N 3.15Å
1485	L	52.9	Low	68.4	Low	45 Å²	45	49.2 Å²	49.2	24%	0.236	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.3	-165.3	-77.1	161.3	0	0	0	116	Y1477 Q1482	Y1477-L1485 HydrophobicContact CE2-CD2 4.31Å; Y1477-L1485 VanDerWaalsContact OH-CD2 3.25Å; Y1477-L1485 WeakPolarHBondContact OH-CD2 3.23Å; Q1482-L1485 HydrophobicContact CB-CD1 4.14Å; Q1482-L1485 HydrophobicContact CG-CD1 4.39Å; Q1482-L1485 WeakPolarHBondContact O-CB 3.42Å; Q1482-L1485 PolarHBondContact O-N 2.9Å; Q1482-L1485 VanDerWaalsContact O-N 3.11Å
1486	N	63	Low	68.5	Low	137 Å²	137	49.2 Å²	49.2	73%	0.733	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.9	10.2	-175.9	-64.6	-11.3	0	0	0	114	I1484	I1484-N1486 PolarHBondContact O-N 3.12Å
1487	Y	68.1	Low	68.7	Low	22 Å²	22	49 Å²	49	9%	0.086	24%	0.239	C	C	.	.	S	Bend	trans	-110.2	-22.2	-174.4	-71.1	-83.8	0	0	0	115.5	P1371 P1374 N1376 F1379 S1483 I1484	P1371-Y1487 HydrophobicContact CG-CE1 3.88Å; P1371-Y1487 HydrophobicContact CG-CE2 4.27Å; P1374-Y1487 PolarHBondContact O-OH 2.9Å; N1376-Y1487 PolarHBondContact N-OH 2.76Å; F1379-Y1487 AromaticContact CD1-CD1 3.68Å; F1379-Y1487 HydrophobicContact CD1-CD1 3.68Å; F1379-Y1487 HydrophobicContact CD1-CE1 4.39Å; F1379-Y1487 AromaticContact CE1-CD1 3.83Å; F1379-Y1487 HydrophobicContact CE1-CD1 3.83Å; F1379-Y1487 HydrophobicContact CG-CD1 4.36Å; F1379-Y1487 WeakPolarHBondContact CZ-O 3.03Å; S1483-Y1487 WeakPolarHBondContact O-CE2 3.11Å; I1484-Y1487 PolarHBondContact O-N 2.89Å; I1484-Y1487 VanDerWaalsContact O-N 3.15Å
1488	I	74.4	Confident	69.4	Low	12 Å²	12	47.1 Å²	47.1	6%	0.062	23%	0.232	C	C	.	.			trans	-139.4	139.9	-173.4	-32.6	170.9	0	0	0	108.3	L1365 F1368 A1381 Y1383 I1490	L1365-I1488 HydrophobicContact CD1-CD1 3.9Å; L1365-I1488 HydrophobicContact CD2-CD1 4.27Å; F1368-I1488 HydrophobicContact CB-CD1 3.96Å; F1368-I1488 HydrophobicContact CD1-CD1 4.04Å; F1368-I1488 HydrophobicContact CD2-CD1 3.53Å; F1368-I1488 HydrophobicContact CD2-CG1 4.19Å; F1368-I1488 HydrophobicContact CE1-CD1 4.37Å; F1368-I1488 HydrophobicContact CE2-CD1 3.88Å; F1368-I1488 HydrophobicContact CE2-CG1 4.11Å; F1368-I1488 HydrophobicContact CG-CD1 3.59Å; F1368-I1488 HydrophobicContact CZ-CD1 4.28Å; A1381-I1488 HydrophobicContact CB-CD1 3.91Å; A1381-I1488 HydrophobicContact CB-CG1 4.19Å; A1381-I1488 HydrophobicContact CB-CG2 4.2Å; Y1383-I1488 HydrophobicContact CD1-CG2 3.81Å; Y1383-I1488 HydrophobicContact CE1-CG2 3.93Å; I1488-I1490 VanDerWaalsContact C-N 3.32Å; I1488-I1490 HydrophobicContact CG2-CG2 3.94Å; I1488-I1490 PolarHBondContact O-N 2.03Å
1489	P	70.4	Confident	70.5	Confident	75 Å²	75	47.4 Å²	47.4	49%	0.487	23%	0.232	S	C	.	.	S	Bend	trans	-70.1	-26.1	176.8	26.7	-35.8	0	0	0	113.5	Y1383	Y1383-P1489 HydrophobicContact CE1-CG 4.11Å; Y1383-P1489 HydrophobicContact CE2-CG 4.32Å; Y1383-P1489 VanDerWaalsContact OH-CG 3.26Å; Y1383-P1489 WeakPolarHBondContact OH-CG 3.12Å
1490	I	74	Confident	72.1	Confident	12 Å²	12	45.3 Å²	45.3	6%	0.062	22%	0.22	C	C	.	.			trans	-83.5	137	-179.9	-157.8	157.1	0	0	0	111.9	S1363 G1364 L1365 Y1383 L1384 I1488	S1363-I1490 WeakPolarHBondContact OG-CD1 3.44Å; G1364-I1490 VanDerWaalsContact CA-CD1 3.44Å; G1364-I1490 VanDerWaalsContact N-CD1 3.26Å; L1365-I1490 HydrophobicContact CB-CG2 3.97Å; L1365-I1490 HydrophobicContact CD1-CG2 4.01Å; Y1383-I1490 HydrophobicContact CD1-CG2 4.22Å; Y1383-I1490 HydrophobicContact CD2-CB 4.09Å; Y1383-I1490 HydrophobicContact CD2-CD1 4.04Å; Y1383-I1490 HydrophobicContact CD2-CG2 4.14Å; Y1383-I1490 HydrophobicContact CG-CB 4.23Å; Y1383-I1490 HydrophobicContact CG-CD1 4.49Å; Y1383-I1490 HydrophobicContact CG-CG2 3.76Å; L1384-I1490 WeakPolarHBondContact O-CD1 3.3Å; I1488-I1490 VanDerWaalsContact C-N 3.32Å; I1488-I1490 HydrophobicContact CG2-CG2 3.94Å; I1488-I1490 PolarHBondContact O-N 2.03Å
1491	R	67.4	Low	74.1	Confident	59 Å²	59	35 Å²	35	22%	0.223	18%	0.18	C	C	.	.			trans	-123.9	-11.1	-174.2	-63.7	173.4	175.2	-125	-12.7	114.4	N1790	R1491-N1790 HydrophobicContact CB-CB 3.9Å; R1491-N1790 WeakPolarHBondContact CD-O 3.49Å; R1491-N1790 PolarHBondContact NE-O 3.1Å; R1491-N1790 PolarHBondContact NH1-O 2.04Å
1492	H	70.1	Confident	75.6	Confident	15 Å²	15	33 Å²	33	7%	0.069	17%	0.169	C	C	.	.	S	Bend	trans	-101.3	153.9	172.2	71.5	83.8	0	0	0	110.5	S1363 L1365 M1788 R1793	S1363-H1492 VanDerWaalsContact C-CE1 3.47Å; S1363-H1492 PolarHBondContact OG-NE2 3.42Å; L1365-H1492 PolarHBondContact N-O 2.96Å; H1492-M1788 HydrophobicContact CB-CE 4.27Å; H1492-R1793 PolarHBondContact NE2-NH1 3.45Å; H1492-R1793 PolarHBondContact NE2-NH2 2.87Å
1493	G	80.2	Confident	77.4	Confident	4 Å²	4	28 Å²	28	4%	0.041	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-73.8	-177.5	177	0	0	0	0	0	113.8	G1331 G1364 G1475	G1331-G1493 WeakPolarHBondContact O-CA 3.37Å; G1331-G1493 PolarHBondContact O-N 2.68Å; G1364-G1493 VanDerWaalsContact CA-O 3.31Å; G1364-G1493 WeakPolarHBondContact CA-O 3.46Å; G1475-G1493 CarbonylContact O-C 3.56Å; G1475-G1493 WeakPolarHBondContact O-CA 3.01Å
1494	F	90.9	Very high	78.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.			trans	-81.9	141.9	-179.9	178.3	-133.7	0	0	0	111.9	F1329 G1331 F1357 L1358 V1359 L1366 L1384 G1475 I1498	F1329-F1494 CarbonylContact C-O 3.31Å; F1329-F1494 HydrophobicContact CB-CB 4.4Å; F1329-F1494 HydrophobicContact CB-CD1 4.23Å; F1329-F1494 WeakPolarHBondContact CB-O 3.36Å; F1329-F1494 HydrophobicContact CD2-CD1 4.01Å; F1329-F1494 HydrophobicContact CG-CD1 4.33Å; G1331-F1494 WeakPolarHBondContact CA-O 3.32Å; G1331-F1494 PolarHBondContact N-O 2.64Å; F1357-F1494 HydrophobicContact CB-CZ 4.37Å; F1357-F1494 HydrophobicContact CD2-CE2 4.35Å; F1357-F1494 AromaticContact CD2-CZ 3.94Å; F1357-F1494 HydrophobicContact CD2-CZ 3.94Å; L1358-F1494 VanDerWaalsContact O-CZ 3.25Å; L1358-F1494 WeakPolarHBondContact O-CZ 3.01Å; V1359-F1494 HydrophobicContact CB-CE2 4.34Å; V1359-F1494 HydrophobicContact CG1-CE2 4.22Å; V1359-F1494 HydrophobicContact CG2-CE2 4.09Å; V1359-F1494 HydrophobicContact CG2-CZ 4.41Å; L1366-F1494 HydrophobicContact CD2-CD1 4.21Å; L1366-F1494 HydrophobicContact CD2-CD2 3.57Å; L1366-F1494 HydrophobicContact CD2-CE1 4.05Å; L1366-F1494 HydrophobicContact CD2-CE2 3.41Å; L1366-F1494 VanDerWaalsContact CD2-CE2 3.41Å; L1366-F1494 HydrophobicContact CD2-CG 3.98Å; L1366-F1494 HydrophobicContact CD2-CZ 3.66Å; L1384-F1494 HydrophobicContact CD1-CE2 4.19Å; G1475-F1494 PolarHBondContact O-N 3.28Å; F1494-I1498 HydrophobicContact CD1-CD1 4.47Å; F1494-I1498 HydrophobicContact CD1-CG1 4.27Å; F1494-I1498 HydrophobicContact CE1-CG1 3.96Å
1495	Y	87.8	Confident	79.4	Confident	16 Å²	16	34.8 Å²	34.8	6%	0.063	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	105.2	168.7	-70.3	-83.7	0	0	0	109.1	S1330 T1360 Q1361 F1797 M1802	S1330-Y1495 VanDerWaalsContact O-CE1 3.31Å; S1330-Y1495 WeakPolarHBondContact O-CE1 3.38Å; T1360-Y1495 PolarHBondContact N-O 2.7Å; T1360-Y1495 PolarHBondContact OG1-O 3.01Å; T1360-Y1495 VanDerWaalsContact OG1-O 3.09Å; Q1361-Y1495 HydrophobicContact CB-CD2 4.29Å; Q1361-Y1495 HydrophobicContact CB-CG 3.92Å; Q1361-Y1495 HydrophobicContact CG-CD1 4.33Å; Q1361-Y1495 HydrophobicContact CG-CG 4.13Å; Q1361-Y1495 PolarHBondContact N-O 3.39Å; Y1495-F1797 HydrophobicContact CE1-CE1 4.01Å; Y1495-F1797 HydrophobicContact CE1-CZ 4.26Å; Y1495-F1797 HydrophobicContact CE2-CE1 4.47Å; Y1495-F1797 HydrophobicContact CE2-CZ 4.2Å; Y1495-F1797 AromaticContact CZ-CE1 3.74Å; Y1495-F1797 AromaticContact CZ-CZ 3.56Å; Y1495-F1797 WeakPolarHBondContact OH-CZ 3.13Å; Y1495-M1802 HydrophobicContact CE2-SD 4.41Å
1496	G	90.6	Very high	80.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158	-161.7	-170.9	0	0	0	0	0	114.2	Q1328 F1329 L1358 T1360	Q1328-G1496 CarbonylContact C-O 3.42Å; Q1328-G1496 WeakPolarHBondContact CA-O 2.99Å; F1329-G1496 PolarHBondContact N-O 3.15Å; F1329-G1496 PolarHBondContact O-N 2.87Å; F1329-G1496 VanDerWaalsContact O-N 3.1Å; L1358-G1496 CarbonylContact O-C 3.53Å; L1358-G1496 WeakPolarHBondContact O-CA 3.41Å; T1360-G1496 PolarHBondContact OG1-N 3Å
1497	A	91.8	Very high	80.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.5	173.9	0	0	0	0	0	111.4	I1326 P1327 F1357 L1358 W1420 W1541	I1326-A1497 HydrophobicContact CG2-CB 4.24Å; P1327-A1497 CarbonylContact O-C 3.24Å; P1327-A1497 WeakPolarHBondContact O-CA 3.14Å; F1357-A1497 CarbonylContact C-O 3.46Å; F1357-A1497 VanDerWaalsContact CA-O 3.3Å; F1357-A1497 WeakPolarHBondContact CA-O 3.44Å; L1358-A1497 HydrophobicContact CB-CB 4.44Å; L1358-A1497 PolarHBondContact N-O 2.84Å; L1358-A1497 PolarHBondContact O-N 3.25Å; W1420-A1497 HydrophobicContact CH2-CB 3.79Å; W1420-A1497 HydrophobicContact CZ3-CB 4.49Å; A1497-W1541 HydrophobicContact CB-CB 4Å; A1497-W1541 HydrophobicContact CB-CD2 3.89Å; A1497-W1541 HydrophobicContact CB-CE3 3.95Å; A1497-W1541 HydrophobicContact CB-CG 3.91Å
1498	I	93.8	Very high	81	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.7	171	-64.5	174.5	0	0	0	107.3	P1327 F1329 L1355 F1357 L1474 F1494 L1510	P1327-I1498 VanDerWaalsContact CD-O 3.23Å; P1327-I1498 WeakPolarHBondContact CD-O 3.12Å; P1327-I1498 PolarHBondContact O-N 2.78Å; F1329-I1498 HydrophobicContact CD2-CD1 4.41Å; F1329-I1498 HydrophobicContact CD2-CG1 4.36Å; F1329-I1498 HydrophobicContact CE2-CB 4.03Å; F1329-I1498 HydrophobicContact CE2-CD1 3.71Å; F1329-I1498 HydrophobicContact CE2-CG1 3.84Å; F1329-I1498 HydrophobicContact CZ-CD1 4.13Å; L1355-I1498 HydrophobicContact CD1-CD1 4.43Å; L1355-I1498 HydrophobicContact CD1-CG2 3.71Å; F1357-I1498 HydrophobicContact CB-CG1 4.31Å; L1474-I1498 HydrophobicContact CB-CD1 4.18Å; F1494-I1498 HydrophobicContact CD1-CD1 4.47Å; F1494-I1498 HydrophobicContact CD1-CG1 4.27Å; F1494-I1498 HydrophobicContact CE1-CG1 3.96Å; I1498-L1510 HydrophobicContact CG2-CD1 4.45Å
1499	Q	90	Very high	80.9	Confident	13 Å²	13	33.8 Å²	33.8	6%	0.061	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-36.6	-178.1	167.4	-179.7	-0.4	0	0	112.3	I1356 W1420 P1564 I1566	I1356-Q1499 HydrophobicContact CB-CB 4.22Å; I1356-Q1499 HydrophobicContact CB-CG 4.49Å; I1356-Q1499 HydrophobicContact CG2-CB 4.13Å; I1356-Q1499 HydrophobicContact CG2-CG 4.32Å; I1356-Q1499 PolarHBondContact O-N 2.84Å; W1420-Q1499 HydrophobicContact CE3-CB 3.97Å; W1420-Q1499 HydrophobicContact CH2-CB 3.73Å; W1420-Q1499 HydrophobicContact CZ3-CB 3.39Å; Q1499-P1564 HydrophobicContact CG-CB 4.06Å; Q1499-P1564 HydrophobicContact CG-CG 3.88Å; Q1499-P1564 PolarHBondContact NE2-O 3.46Å; Q1499-I1566 PolarHBondContact OE1-O 2.99Å
1500	R	89.9	Confident	81.4	Confident	84 Å²	84	31 Å²	31	32%	0.317	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	143.4	-171.3	-167	174.9	-167.5	-137.8	1	110.7	E1354 L1355 I1356 N1502 E1507	E1354-R1500 IonicContact OE2-NH1 2.77Å; L1355-R1500 WeakPolarHBondContact CA-O 3.37Å; I1356-R1500 HydrophobicContact CB-CB 4.14Å; I1356-R1500 HydrophobicContact CD1-CB 3.91Å; I1356-R1500 HydrophobicContact CD1-CG 4.44Å; I1356-R1500 HydrophobicContact CG1-CB 4.14Å; I1356-R1500 PolarHBondContact N-O 2.8Å; I1356-R1500 PolarHBondContact O-N 2.86Å; R1500-N1502 PolarHBondContact NE-OD1 2.92Å; R1500-N1502 PolarHBondContact NH1-ND2 2.03Å; R1500-E1507 HydrophobicContact CG-CG 4.38Å; R1500-E1507 WeakPolarHBondContact CG-OE1 3.05Å; R1500-E1507 IonicContact CZ-OE2 2.77Å; R1500-E1507 VanDerWaalsContact CZ-OE2 3.23Å; R1500-E1507 IonicContact NE-OE1 3.44Å; R1500-E1507 PolarHBondContact NE-OE1 3.35Å; R1500-E1507 IonicContact NE-OE2 2.77Å; R1500-E1507 PolarHBondContact NE-OE2 3.44Å; R1500-E1507 IonicContact NH2-OE2 2.87Å; R1500-E1507 PolarHBondContact NH2-OE2 3.15Å
1501	I	90.3	Very high	80.9	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	122.2	167.1	168.8	165.6	0	0	0	109.5	E1354 L1355 L1474 I1503 V1508 L1510	E1354-I1501 CarbonylContact O-C 3.6Å; E1354-I1501 WeakPolarHBondContact O-CA 3.21Å; L1355-I1501 HydrophobicContact CD1-CB 3.98Å; L1474-I1501 HydrophobicContact CD1-CG2 4.14Å; L1474-I1501 HydrophobicContact CD2-CD1 3.8Å; I1501-I1503 HydrophobicContact CD1-CD1 4.09Å; I1501-I1503 HydrophobicContact CD1-CG1 4.22Å; I1501-I1503 HydrophobicContact CG1-CD1 4.4Å; I1501-I1503 HydrophobicContact CG1-CG1 4.05Å; I1501-V1508 HydrophobicContact CG2-CB 4.1Å; I1501-V1508 PolarHBondContact O-N 3.08Å; I1501-L1510 HydrophobicContact CG2-CD2 4.13Å
1502	N	87.1	Confident	80.8	Confident	10 Å²	10	29.8 Å²	29.8	5%	0.053	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.8	170.7	-54	-32.2	0	0	0	109.5	I1353 E1354 R1500 A1506 E1507	I1353-N1502 WeakPolarHBondContact CA-O 3.47Å; E1354-N1502 HydrophobicContact CB-CB 4.13Å; E1354-N1502 PolarHBondContact N-O 2.84Å; E1354-N1502 PolarHBondContact O-N 3.07Å; E1354-N1502 PolarHBondContact OE2-ND2 3.43Å; R1500-N1502 PolarHBondContact NE-OD1 2.92Å; R1500-N1502 PolarHBondContact NH1-ND2 2.03Å; N1502-A1506 CarbonylContact C-O 3.57Å; N1502-A1506 VanDerWaalsContact CA-O 3.31Å; N1502-A1506 WeakPolarHBondContact CA-O 3.04Å; N1502-E1507 VanDerWaalsContact OD1-CA 3.31Å; N1502-E1507 WeakPolarHBondContact OD1-CA 3.14Å; N1502-E1507 VanDerWaalsContact OD1-CB 3.3Å; N1502-E1507 WeakPolarHBondContact OD1-CB 3.37Å; N1502-E1507 WeakPolarHBondContact OD1-CG 3.39Å
1503	I	84.6	Confident	80.1	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.026	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.8	175.1	-57.7	-178.8	0	0	0	108.1	I1346 L1351 H1352 I1472 I1501 E1505 A1506 V1508	I1346-I1503 HydrophobicContact CD1-CG2 4.26Å; I1346-I1503 HydrophobicContact CG1-CG2 4.26Å; L1351-I1503 HydrophobicContact CD1-CG2 3.86Å; H1352-I1503 WeakPolarHBondContact O-CA 3.42Å; I1472-I1503 HydrophobicContact CD1-CD1 3.45Å; I1472-I1503 VanDerWaalsContact CD1-CD1 3.45Å; I1472-I1503 HydrophobicContact CG1-CD1 4.39Å; I1501-I1503 HydrophobicContact CD1-CD1 4.09Å; I1501-I1503 HydrophobicContact CD1-CG1 4.22Å; I1501-I1503 HydrophobicContact CG1-CD1 4.4Å; I1501-I1503 HydrophobicContact CG1-CG1 4.05Å; I1503-E1505 PolarHBondContact O-N 3.4Å; I1503-A1506 PolarHBondContact N-O 2.67Å; I1503-A1506 PolarHBondContact O-N 3.06Å; I1503-V1508 HydrophobicContact CB-CG2 4.44Å; I1503-V1508 HydrophobicContact CD1-CG2 4.11Å; I1503-V1508 HydrophobicContact CG1-CG2 4.1Å
1504	N	79.7	Confident	78.5	Confident	41 Å²	41	33.1 Å²	33.1	22%	0.219	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	51.8	-177.6	-57.1	-38	0	0	0	112.8	Y1344 L1351 H1352 A1506	Y1344-N1504 PolarHBondContact O-ND2 3.02Å; L1351-N1504 WeakPolarHBondContact CA-OD1 3.31Å; H1352-N1504 PolarHBondContact N-OD1 3.43Å; H1352-N1504 PolarHBondContact O-N 3.34Å; N1504-A1506 PolarHBondContact O-N 3.08Å
1505	E	70.3	Confident	76.1	Confident	179 Å²	179	38 Å²	38	84%	0.836	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	-3.9	-179.8	-61	158.4	-155.4	0	0	115.1	I1503	I1503-E1505 PolarHBondContact O-N 3.4Å
1506	A	66.8	Low	73.6	Confident	25 Å²	25	40 Å²	40	21%	0.207	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	126.5	169.8	0	0	0	0	0	111.3	Y1344 N1502 I1503 N1504	Y1344-A1506 HydrophobicContact CD1-CB 3.69Å; Y1344-A1506 HydrophobicContact CE1-CB 3.82Å; Y1344-A1506 HydrophobicContact CG-CB 4.24Å; N1502-A1506 CarbonylContact C-O 3.57Å; N1502-A1506 VanDerWaalsContact CA-O 3.31Å; N1502-A1506 WeakPolarHBondContact CA-O 3.04Å; I1503-A1506 PolarHBondContact N-O 2.67Å; I1503-A1506 PolarHBondContact O-N 3.06Å; N1504-A1506 PolarHBondContact O-N 3.08Å
1507	E	72.9	Confident	71.1	Confident	88 Å²	88	42.6 Å²	42.6	41%	0.411	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.5	173	-177.5	158.3	-174.6	0	0	110.9	R1500 N1502 V1509	R1500-E1507 HydrophobicContact CG-CG 4.38Å; R1500-E1507 WeakPolarHBondContact CG-OE1 3.05Å; R1500-E1507 IonicContact CZ-OE2 2.77Å; R1500-E1507 VanDerWaalsContact CZ-OE2 3.23Å; R1500-E1507 IonicContact NE-OE1 3.44Å; R1500-E1507 PolarHBondContact NE-OE1 3.35Å; R1500-E1507 IonicContact NE-OE2 2.77Å; R1500-E1507 PolarHBondContact NE-OE2 3.44Å; R1500-E1507 IonicContact NH2-OE2 2.87Å; R1500-E1507 PolarHBondContact NH2-OE2 3.15Å; N1502-E1507 VanDerWaalsContact OD1-CA 3.31Å; N1502-E1507 WeakPolarHBondContact OD1-CA 3.14Å; N1502-E1507 VanDerWaalsContact OD1-CB 3.3Å; N1502-E1507 WeakPolarHBondContact OD1-CB 3.37Å; N1502-E1507 WeakPolarHBondContact OD1-CG 3.39Å; E1507-V1509 PolarHBondContact O-N 3.25Å
1508	V	78.8	Confident	68.4	Low	41 Å²	41	45.8 Å²	45.8	25%	0.248	26%	0.255	C	S	.	.			trans	-90.7	91.5	177.9	-175	0	0	0	0	107.8	L1337 I1501 I1503 L1510	L1337-V1508 HydrophobicContact CD1-CG1 3.68Å; I1501-V1508 HydrophobicContact CG2-CB 4.1Å; I1501-V1508 PolarHBondContact O-N 3.08Å; I1503-V1508 HydrophobicContact CB-CG2 4.44Å; I1503-V1508 HydrophobicContact CD1-CG2 4.11Å; I1503-V1508 HydrophobicContact CG1-CG2 4.1Å; V1508-L1510 PolarHBondContact O-N 3Å; V1508-L1510 VanDerWaalsContact O-N 3.15Å
1509	V	72	Confident	65.4	Low	42 Å²	42	50.9 Å²	50.9	26%	0.255	28%	0.281	S	S	.	.			trans	-60.2	114.1	-179.6	-179.1	0	0	0	0	109.9	E1507 A1511 L1577 M1580	E1507-V1509 PolarHBondContact O-N 3.25Å; V1509-A1511 PolarHBondContact O-N 3.15Å; V1509-A1511 VanDerWaalsContact O-N 3.13Å; V1509-L1577 HydrophobicContact CG1-CB 4.26Å; V1509-L1577 HydrophobicContact CG1-CD1 4.13Å; V1509-M1580 HydrophobicContact CG2-SD 4.14Å
1510	L	80.8	Confident	62.6	Low	15 Å²	15	54.9 Å²	54.9	8%	0.079	30%	0.302	C	S	.	.			trans	-77.6	96.6	177.8	-56.3	177.3	0	0	0	108.3	I1325 P1327 L1337 L1474 I1498 I1501 V1508 W1535	I1325-L1510 WeakPolarHBondContact CB-O 3.31Å; I1325-L1510 WeakPolarHBondContact CD1-O 3.38Å; I1325-L1510 HydrophobicContact CG2-CB 4.34Å; I1325-L1510 WeakPolarHBondContact CG2-O 2.91Å; P1327-L1510 HydrophobicContact CG-CB 4.36Å; P1327-L1510 HydrophobicContact CG-CD1 3.86Å; L1337-L1510 HydrophobicContact CD1-CD2 3.85Å; L1474-L1510 HydrophobicContact CD1-CD2 3.71Å; I1498-L1510 HydrophobicContact CG2-CD1 4.45Å; I1501-L1510 HydrophobicContact CG2-CD2 4.13Å; V1508-L1510 PolarHBondContact O-N 3Å; V1508-L1510 VanDerWaalsContact O-N 3.15Å; L1510-W1535 HydrophobicContact CB-CH2 4.09Å; L1510-W1535 HydrophobicContact CB-CZ2 4.17Å
1511	A	63.7	Low	60	Low	37 Å²	37	56.2 Å²	56.2	31%	0.306	32%	0.32	S	S	.	.			trans	-83.5	-13.5	-165.8	0	0	0	0	0	115	I1325 V1509 L1577	I1325-A1511 VanDerWaalsContact CD1-C 3.41Å; I1325-A1511 VanDerWaalsContact CD1-O 3.28Å; I1325-A1511 WeakPolarHBondContact CD1-O 3.3Å; V1509-A1511 PolarHBondContact O-N 3.15Å; V1509-A1511 VanDerWaalsContact O-N 3.13Å; A1511-L1577 HydrophobicContact CB-CD1 3.91Å; A1511-L1577 HydrophobicContact CB-CD2 4.26Å
1512	G	64.4	Low	57.1	Low	9 Å²	9	61.3 Å²	61.3	9%	0.093	35%	0.353	C	S	.	.			trans	90.6	170.4	-172.8	0	0	0	0	0	112.3	W1535	G1512-W1535 VanDerWaalsContact CA-CZ2 3.42Å; G1512-W1535 PolarHBondContact O-NE1 2.78Å
1513	P	55	Low	54.5	Low	35 Å²	35	66.2 Å²	66.2	23%	0.227	38%	0.376	C	S	.	.			trans	-61.3	144.1	169.3	27.7	-34	0	0	0	110.1	M1518 W1535	P1513-M1518 HydrophobicContact CB-CG 4.14Å; P1513-M1518 HydrophobicContact CG-CG 4.19Å; P1513-M1518 HydrophobicContact CG-SD 4.03Å; P1513-W1535 HydrophobicContact CB-CB 4.29Å; P1513-W1535 HydrophobicContact CB-CG 4.39Å
1514	S	48	Very low	52	Low	54 Å²	54	74 Å²	74	38%	0.378	41%	0.412	S	S	.	.			trans	-72.4	151.3	173.4	88.3	0	0	0	0	110.4	A1516 D1517 M1518	S1514-A1516 PolarHBondContact O-N 3.09Å; S1514-A1516 VanDerWaalsContact O-N 3.07Å; S1514-A1516 PolarHBondContact OG-N 3.06Å; S1514-D1517 VanDerWaalsContact CB-OD2 3.24Å; S1514-D1517 WeakPolarHBondContact CB-OD2 3.22Å; S1514-D1517 PolarHBondContact N-OD2 2.85Å; S1514-D1517 PolarHBondContact O-N 2.92Å; S1514-D1517 PolarHBondContact OG-N 2.04Å; S1514-D1517 PolarHBondContact OG-OD2 3.46Å; S1514-M1518 PolarHBondContact O-N 3.34Å; S1514-M1518 VanDerWaalsContact O-N 3.15Å
1515	L	40.6	Very low	49.9	Very low	102 Å²	102	76.8 Å²	76.8	53%	0.534	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-22.1	177.4	-156.6	75.6	0	0	0	112.5	Y1295 M1518 M1519	Y1295-L1515 HydrophobicContact CE2-CD1 3.78Å; L1515-M1518 HydrophobicContact CD1-SD 4.4Å; L1515-M1519 HydrophobicContact CD2-CE 4.3Å; L1515-M1519 HydrophobicContact CG-CE 4.27Å; L1515-M1519 WeakPolarHBondContact O-CG 3.34Å; L1515-M1519 PolarHBondContact O-N 3.42Å
1516	A	33.7	Very low	48	Very low	58 Å²	58	71.7 Å²	71.7	48%	0.479	42%	0.419	S	S	.	.	H	α-helix	trans	-76.1	-35.4	173.3	0	0	0	0	0	112.6	S1514 M1518 M1519 N1520	S1514-A1516 PolarHBondContact O-N 3.09Å; S1514-A1516 VanDerWaalsContact O-N 3.07Å; S1514-A1516 PolarHBondContact OG-N 3.06Å; A1516-M1518 PolarHBondContact O-N 2.74Å; A1516-M1519 PolarHBondContact O-N 2.79Å; A1516-N1520 VanDerWaalsContact O-CG 3.32Å; A1516-N1520 PolarHBondContact O-N 2.86Å; A1516-N1520 PolarHBondContact O-ND2 3.01Å; A1516-N1520 VanDerWaalsContact O-ND2 3.1Å
1517	D	38.4	Very low	46.3	Very low	56 Å²	56	79.9 Å²	79.9	30%	0.299	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-24.9	173	-60.5	-68	0	0	0	112	S1514	S1514-D1517 VanDerWaalsContact CB-OD2 3.24Å; S1514-D1517 WeakPolarHBondContact CB-OD2 3.22Å; S1514-D1517 PolarHBondContact N-OD2 2.85Å; S1514-D1517 PolarHBondContact O-N 2.92Å; S1514-D1517 PolarHBondContact OG-N 2.04Å; S1514-D1517 PolarHBondContact OG-OD2 3.46Å
1518	M	35.3	Very low	44.3	Very low	66 Å²	66	82.2 Å²	82.2	33%	0.325	47%	0.465	S	S	.	.	H	α-helix	trans	-81.4	-19.2	177.3	-64.7	178	69.1	0	0	114.2	Y1295 Q1311 P1513 S1514 L1515 A1516	Y1295-M1518 HydrophobicContact CD1-CE 4.17Å; Y1295-M1518 HydrophobicContact CD2-CE 3.8Å; Y1295-M1518 HydrophobicContact CG-CE 3.59Å; Q1311-M1518 HydrophobicContact CG-CE 4.25Å; P1513-M1518 HydrophobicContact CB-CG 4.14Å; P1513-M1518 HydrophobicContact CG-CG 4.19Å; P1513-M1518 HydrophobicContact CG-SD 4.03Å; S1514-M1518 PolarHBondContact O-N 3.34Å; S1514-M1518 VanDerWaalsContact O-N 3.15Å; L1515-M1518 HydrophobicContact CD1-SD 4.4Å; A1516-M1518 PolarHBondContact O-N 2.74Å
1519	M	30.9	Very low	41.9	Very low	108 Å²	108	84.8 Å²	84.8	53%	0.532	48%	0.482	S	S	.	.	H	α-helix	trans	-102.4	-15.8	-177.9	-71.2	-176.2	174	0	0	113.9	Y1295 L1515 A1516	Y1295-M1519 WeakPolarHBondContact OH-CE 3.37Å; L1515-M1519 HydrophobicContact CD2-CE 4.3Å; L1515-M1519 HydrophobicContact CG-CE 4.27Å; L1515-M1519 WeakPolarHBondContact O-CG 3.34Å; L1515-M1519 PolarHBondContact O-N 3.42Å; A1516-M1519 PolarHBondContact O-N 2.79Å
1520	N	31.8	Very low	40.1	Very low	96 Å²	96	90.3 Å²	90.3	51%	0.513	51%	0.505	S	S	.	.	S	Bend	trans	-95.2	122	-178	-68.7	-25.4	0	0	0	111.7	A1516	A1516-N1520 VanDerWaalsContact O-CG 3.32Å; A1516-N1520 PolarHBondContact O-N 2.86Å; A1516-N1520 PolarHBondContact O-ND2 3.01Å; A1516-N1520 VanDerWaalsContact O-ND2 3.1Å
1521	T	33.9	Very low	38.3	Very low	112 Å²	112	96 Å²	96	69%	0.687	54%	0.535	S	S	*	.			trans	-64.8	151.7	171	41.7	0	0	0	0	111.6	E1523	T1521-E1523 PolarHBondContact O-N 2.75Å
1522	P	29.6	Very low	37.8	Very low	109 Å²	109	100.9 Å²	100.9	71%	0.708	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	1.3	-156.1	-26	37	0	0	0	119.2
1523	E	32.9	Very low	37.9	Very low	113 Å²	113	103.2 Å²	103.2	53%	0.528	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.8	-17.1	-161.8	-68.3	178.2	124.7	0	0	115.5	R1028 T1521 Q1525	R1028-E1523 IonicContact CZ-OE1 2.76Å; R1028-E1523 VanDerWaalsContact CZ-OE1 3.26Å; R1028-E1523 IonicContact CZ-OE2 2.88Å; R1028-E1523 IonicContact NH1-OE1 3.14Å; R1028-E1523 PolarHBondContact NH1-OE1 3.09Å; R1028-E1523 IonicContact NH1-OE2 3.75Å; R1028-E1523 PolarHBondContact NH1-OE2 3.47Å; R1028-E1523 IonicContact NH2-OE1 3.67Å; R1028-E1523 PolarHBondContact NH2-OE1 3Å; T1521-E1523 PolarHBondContact O-N 2.75Å; E1523-Q1525 PolarHBondContact O-N 2.87Å
1524	E	32.5	Very low	38.5	Very low	167 Å²	167	105.5 Å²	105.5	78%	0.78	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-72.9	-10.2	175.2	-69.2	-158	133.9	0	0	113.8	G1526	E1524-G1526 PolarHBondContact O-N 2.81Å
1525	Q	35.4	Very low	40	Very low	101 Å²	101	104.4 Å²	104.4	47%	0.472	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-69.7	-1.3	-178.5	-61.8	-166	-20.8	0	0	114	E1523 K1527	E1523-Q1525 PolarHBondContact O-N 2.87Å; Q1525-K1527 VanDerWaalsContact C-N 3.33Å; Q1525-K1527 PolarHBondContact O-N 2.72Å
1526	G	30.1	Very low	41.3	Very low	72 Å²	72	100.9 Å²	100.9	74%	0.742	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-69.5	-8.1	-172.6	0	0	0	0	0	117.9	E1524	E1524-G1526 PolarHBondContact O-N 2.81Å
1527	K	31.9	Very low	43	Very low	196 Å²	196	101.7 Å²	101.7	85%	0.852	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-125.6	2.4	-176.6	-80.8	-179.7	178.1	170.3	0	117	Q1525	Q1525-K1527 VanDerWaalsContact C-N 3.33Å; Q1525-K1527 PolarHBondContact O-N 2.72Å
1528	L	30.6	Very low	44.5	Very low	138 Å²	138	99.8 Å²	99.8	72%	0.723	52%	0.524	S	S	*	.			trans	-137.2	87.2	170	-91.7	100.7	0	0	0	112.8
1529	P	27.8	Very low	46.3	Very low	95 Å²	95	97.6 Å²	97.6	62%	0.617	52%	0.515	S	S	*	.			trans	-74.5	158.1	169.4	30.7	-34	0	0	0	113
1530	H	34	Very low	48.7	Very low	158 Å²	158	92.7 Å²	92.7	73%	0.731	49%	0.491	S	S	*	.	S	Bend	trans	100.9	-30.3	161.3	-53.6	-63.5	0	0	0	120.8	R1336	R1336-H1530 PolarHBondContact NH2-O 2.76Å
1531	L	43.6	Very low	51.3	Low	134 Å²	134	90 Å²	90	70%	0.702	47%	0.473	S	S	*	.			trans	-97.4	-17.1	-158.7	-91.5	161.3	0	0	0	119.6
1532	F	53.9	Low	53.4	Low	139 Å²	139	87.8 Å²	87.8	61%	0.61	46%	0.455	S	S	*	.			trans	-109.9	158.4	-168.6	-60.4	-74.8	0	0	0	115.2	R1336	R1336-F1532 PolarHBondContact NH1-O 2.67Å
1533	E	65.8	Low	55.9	Low	58 Å²	58	83 Å²	83	27%	0.271	43%	0.426	S	S	.	.			trans	-75.7	140.3	170.6	175.6	163.8	169.9	0	0	109.9	R1336 L1337 W1535	R1336-E1533 WeakPolarHBondContact O-CA 3.19Å; L1337-E1533 VanDerWaalsContact CD2-CD 3.42Å; L1337-E1533 HydrophobicContact CD2-CG 3.86Å; L1337-E1533 VanDerWaalsContact CD2-OE1 3.27Å; L1337-E1533 WeakPolarHBondContact CD2-OE1 3.33Å; E1533-W1535 PolarHBondContact OE1-NE1 2.87Å
1534	K	68	Low	58.2	Low	84 Å²	84	82.3 Å²	82.3	37%	0.365	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	126.6	-177.8	-172.3	164.7	-172.6	163	0	111.7	I1335 R1336	I1335-K1534 CarbonylContact C-O 3.46Å; I1335-K1534 WeakPolarHBondContact CA-O 3.46Å; R1336-K1534 HydrophobicContact CB-CB 4.39Å; R1336-K1534 PolarHBondContact N-O 3.39Å; R1336-K1534 PolarHBondContact O-N 2.83Å
1535	W	79.2	Confident	60.7	Low	31 Å²	31	74.5 Å²	74.5	12%	0.117	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.7	175.9	-65.1	58.7	0	0	0	108.5	P1312 I1325 P1327 I1335 L1510 G1512 P1513 E1533 V1538	P1312-W1535 HydrophobicContact CB-CE3 4.16Å; P1312-W1535 HydrophobicContact CB-CH2 4.23Å; P1312-W1535 HydrophobicContact CB-CZ3 3.57Å; P1312-W1535 HydrophobicContact CG-CE3 3.74Å; P1312-W1535 HydrophobicContact CG-CZ3 3.55Å; I1325-W1535 HydrophobicContact CG2-CH2 3.77Å; I1325-W1535 HydrophobicContact CG2-CZ3 4.34Å; P1327-W1535 HydrophobicContact CB-CH2 4.3Å; P1327-W1535 HydrophobicContact CB-CZ3 3.91Å; P1327-W1535 HydrophobicContact CG-CH2 3.42Å; P1327-W1535 VanDerWaalsContact CG-CH2 3.42Å; P1327-W1535 HydrophobicContact CG-CZ3 3.49Å; P1327-W1535 VanDerWaalsContact CG-CZ3 3.49Å; I1335-W1535 HydrophobicContact CD1-CD2 4Å; I1335-W1535 HydrophobicContact CD1-CE3 3.74Å; I1335-W1535 HydrophobicContact CD1-CH2 3.57Å; I1335-W1535 HydrophobicContact CD1-CZ2 3.79Å; I1335-W1535 HydrophobicContact CD1-CZ3 3.54Å; I1335-W1535 HydrophobicContact CG1-CD2 3.82Å; I1335-W1535 HydrophobicContact CG1-CE3 3.82Å; I1335-W1535 HydrophobicContact CG1-CG 4.33Å; I1335-W1535 HydrophobicContact CG1-CH2 4.47Å; I1335-W1535 HydrophobicContact CG1-CZ2 4.44Å; I1335-W1535 HydrophobicContact CG1-CZ3 4.16Å; I1335-W1535 HydrophobicContact CG2-CD2 4Å; I1335-W1535 HydrophobicContact CG2-CG 4.1Å; I1335-W1535 HydrophobicContact CG2-CZ2 4.18Å; L1510-W1535 HydrophobicContact CB-CH2 4.09Å; L1510-W1535 HydrophobicContact CB-CZ2 4.17Å; G1512-W1535 VanDerWaalsContact CA-CZ2 3.42Å; G1512-W1535 PolarHBondContact O-NE1 2.78Å; P1513-W1535 HydrophobicContact CB-CB 4.29Å; P1513-W1535 HydrophobicContact CB-CG 4.39Å; E1533-W1535 PolarHBondContact OE1-NE1 2.87Å; W1535-V1538 HydrophobicContact CE3-CB 4.12Å; W1535-V1538 HydrophobicContact CE3-CG1 3.67Å; W1535-V1538 HydrophobicContact CZ3-CG1 3.77Å
1536	A	68.4	Low	63	Low	27 Å²	27	69.8 Å²	69.8	22%	0.223	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	134.7	174.8	0	0	0	0	0	110.2	G1333 F1334 V1538	G1333-A1536 CarbonylContact C-O 3.28Å; G1333-A1536 VanDerWaalsContact CA-O 3.3Å; G1333-A1536 WeakPolarHBondContact CA-O 3.33Å; F1334-A1536 HydrophobicContact CD1-CB 4.07Å; F1334-A1536 HydrophobicContact CE1-CB 3.6Å; F1334-A1536 HydrophobicContact CZ-CB 3.84Å; F1334-A1536 PolarHBondContact N-O 2.95Å; F1334-A1536 PolarHBondContact O-N 3.39Å; A1536-V1538 VanDerWaalsContact C-N 3.31Å; A1536-V1538 WeakPolarHBondContact O-CG2 3.38Å; A1536-V1538 PolarHBondContact O-N 3.42Å
1537	N	69.4	Low	65.4	Low	75 Å²	75	66.4 Å²	66.4	40%	0.401	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.8	40.6	179	-56.1	-25.2	0	0	0	114.1	N1332 G1333 E1852	N1332-N1537 PolarHBondContact ND2-ND2 2.83Å; N1332-N1537 VanDerWaalsContact ND2-ND2 3.12Å; G1333-N1537 WeakPolarHBondContact CA-O 3.41Å; N1537-E1852 PolarHBondContact ND2-OE1 2.87Å; N1537-E1852 PolarHBondContact ND2-OE2 3.01Å
1538	V	70.1	Confident	67.3	Low	17 Å²	17	60 Å²	60	10%	0.103	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.9	179.8	173.9	0	0	0	0	110	P1312 P1327 F1329 I1335 W1535 A1536	P1312-V1538 HydrophobicContact CG-CG1 4.08Å; P1327-V1538 HydrophobicContact CB-CG1 3.7Å; F1329-V1538 HydrophobicContact CD1-CG2 3.79Å; F1329-V1538 HydrophobicContact CE1-CG2 3.67Å; F1329-V1538 HydrophobicContact CZ-CG2 4.45Å; I1335-V1538 HydrophobicContact CG1-CG2 4.1Å; W1535-V1538 HydrophobicContact CE3-CB 4.12Å; W1535-V1538 HydrophobicContact CE3-CG1 3.67Å; W1535-V1538 HydrophobicContact CZ3-CG1 3.77Å; A1536-V1538 VanDerWaalsContact C-N 3.31Å; A1536-V1538 WeakPolarHBondContact O-CG2 3.38Å; A1536-V1538 PolarHBondContact O-N 3.42Å
1539	S	72.9	Confident	69.4	Low	19 Å²	19	61.4 Å²	61.4	13%	0.133	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	171	-176.9	52.7	0	0	0	0	112.2	Q1328	Q1328-S1539 PolarHBondContact N-O 2.96Å; Q1328-S1539 PolarHBondContact O-N 2.73Å; Q1328-S1539 PolarHBondContact O-OG 2.02Å
1540	Q	80.7	Confident	72	Confident	5 Å²	5	61.8 Å²	61.8	2%	0.023	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	126.8	170.9	178.7	69.2	14.4	0	0	111.4	C1310 W1314 V1323 T1324 Q1542	C1310-Q1540 PolarHBondContact O-N 3.17Å; C1310-Q1540 VanDerWaalsContact O-N 3.16Å; W1314-Q1540 WeakPolarHBondContact O-CB 3.48Å; W1314-Q1540 VanDerWaalsContact O-CG 3.31Å; W1314-Q1540 WeakPolarHBondContact O-CG 3.43Å; V1323-Q1540 HydrophobicContact CG2-CG 4.48Å; T1324-Q1540 PolarHBondContact O-NE2 2.8Å; Q1540-Q1542 PolarHBondContact O-N 2.79Å; Q1540-Q1542 PolarHBondContact O-NE2 3.31Å
1541	W	86	Confident	74.1	Confident	39 Å²	39	55.5 Å²	55.5	15%	0.148	28%	0.278	C	S	.	.			trans	-62.8	124.4	171.8	174.6	-108.8	0	0	0	112.5	I1326 Q1328 L1358 T1360 W1420 A1497 G1543 L1544	I1326-W1541 HydrophobicContact CB-CB 3.93Å; I1326-W1541 HydrophobicContact CG2-CB 3.59Å; I1326-W1541 HydrophobicContact CG2-CG 3.98Å; I1326-W1541 VanDerWaalsContact O-CB 3.27Å; I1326-W1541 WeakPolarHBondContact O-CB 3.45Å; I1326-W1541 PolarHBondContact O-N 2.8Å; Q1328-W1541 HydrophobicContact CB-CB 4.19Å; Q1328-W1541 HydrophobicContact CB-CE3 4.47Å; Q1328-W1541 HydrophobicContact CG-CE3 4.29Å; L1358-W1541 HydrophobicContact CD2-CD2 4.24Å; L1358-W1541 HydrophobicContact CD2-CE3 4.41Å; L1358-W1541 HydrophobicContact CD2-CH2 3.38Å; L1358-W1541 HydrophobicContact CD2-CZ2 3.08Å; L1358-W1541 HydrophobicContact CD2-CZ3 4.03Å; T1360-W1541 HydrophobicContact CG2-CH2 4.43Å; T1360-W1541 HydrophobicContact CG2-CZ3 4.25Å; W1420-W1541 AromaticContact CZ2-CD1 3.99Å; W1420-W1541 AromaticContact CZ2-NE1 3.72Å; A1497-W1541 HydrophobicContact CB-CB 4Å; A1497-W1541 HydrophobicContact CB-CD2 3.89Å; A1497-W1541 HydrophobicContact CB-CE3 3.95Å; A1497-W1541 HydrophobicContact CB-CG 3.91Å; W1541-G1543 VanDerWaalsContact CE2-CA 3.45Å; W1541-G1543 VanDerWaalsContact NE1-C 3.25Å; W1541-G1543 PolarHBondContact NE1-O 2.97Å; W1541-L1544 PolarHBondContact NE1-O 3.19Å
1542	Q	77.9	Confident	76.1	Confident	66 Å²	66	52.9 Å²	52.9	31%	0.308	27%	0.269	S	S	.	.			trans	-100.5	10.3	-176.3	-55.4	-60	-47.9	0	0	114.3	Q1540 G1547 P1548	Q1540-Q1542 PolarHBondContact O-N 2.79Å; Q1540-Q1542 PolarHBondContact O-NE2 3.31Å; Q1542-G1547 WeakPolarHBondContact O-CA 3.42Å; Q1542-P1548 VanDerWaalsContact OE1-CG 3.28Å
1543	G	81.9	Confident	77.6	Confident	10 Å²	10	46.8 Å²	46.8	10%	0.103	24%	0.243	C	C	.	.	S	Bend	trans	-105.3	-167.2	-176.3	0	0	0	0	0	115.2	W1541 C1546 G1547	W1541-G1543 VanDerWaalsContact CE2-CA 3.45Å; W1541-G1543 VanDerWaalsContact NE1-C 3.25Å; W1541-G1543 PolarHBondContact NE1-O 2.97Å; G1543-C1546 PolarHBondContact O-N 3.12Å; G1543-G1547 PolarHBondContact O-N 3.25Å
1544	L	81.9	Confident	78.3	Confident	98 Å²	98	49.7 Å²	49.7	51%	0.513	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	139.5	173.2	-76.2	157	0	0	0	111.4	W1420 W1541 Y1550	W1420-L1544 PolarHBondContact NE1-O 3.39Å; W1541-L1544 PolarHBondContact NE1-O 3.19Å; L1544-Y1550 HydrophobicContact CD1-CD1 4.4Å; L1544-Y1550 HydrophobicContact CD1-CE1 4.4Å; L1544-Y1550 HydrophobicContact CD2-CD1 3.57Å; L1544-Y1550 HydrophobicContact CD2-CE1 4.34Å; L1544-Y1550 HydrophobicContact CD2-CG 4.06Å; L1544-Y1550 HydrophobicContact CG-CD1 3.51Å; L1544-Y1550 HydrophobicContact CG-CE1 3.92Å; L1544-Y1550 HydrophobicContact CG-CG 3.92Å
1545	P	84.7	Confident	78.5	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.019	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	cis	-101.5	6.1	4.3	41.5	-38	0	0	0	114.3	P1564 H1568 A1569	P1545-P1564 HydrophobicContact CG-CB 3.47Å; P1545-P1564 VanDerWaalsContact CG-CB 3.47Å; P1545-H1568 WeakPolarHBondContact CB-O 3.43Å; P1545-H1568 WeakPolarHBondContact CG-O 3.29Å; P1545-A1569 HydrophobicContact CB-CB 4.05Å; P1545-A1569 HydrophobicContact CG-CB 4.37Å; P1545-A1569 WeakPolarHBondContact O-CB 3.14Å
1546	C	84.5	Confident	78.1	Confident	2 Å²	2	53 Å²	53	1%	0.014	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-1.1	-169.2	-80.8	0	0	0	0	117.3	Q1315 I1326 G1543 C1562	Q1315-C1546 PolarHBondContact OE1-O 3.17Å; Q1315-C1546 VanDerWaalsContact OE1-O 3.12Å; I1326-C1546 HydrophobicContact CD1-CB 3.93Å; G1543-C1546 PolarHBondContact O-N 3.12Å; C1546-C1562 WeakPolarHBondContact CA-SG 3.47Å; C1546-C1562 HydrophobicContact CB-CB 3.67Å; C1546-C1562 WeakPolarHBondContact CB-SG 3.24Å; C1546-C1562 VanDerWaalsContact SG-C 3.51Å; C1546-C1562 WeakPolarHBondContact SG-CB 3.44Å; C1546-C1562 CovalentContact SG-SG 2.04Å; C1546-C1562 PolarHBondContact SG-SG 2.03Å
1547	G	79.7	Confident	78.6	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	-64.1	174.1	174.4	0	0	0	0	0	114.1	Q1542 G1543 Q1549 Y1550 S1551	Q1542-G1547 WeakPolarHBondContact O-CA 3.42Å; G1543-G1547 PolarHBondContact O-N 3.25Å; G1547-Q1549 VanDerWaalsContact C-N 3.27Å; G1547-Q1549 PolarHBondContact O-N 3.46Å; G1547-Q1549 VanDerWaalsContact O-N 3.07Å; G1547-Y1550 PolarHBondContact O-N 3.34Å; G1547-S1551 PolarHBondContact O-N 2.69Å
1548	P	72.6	Confident	79.2	Confident	61 Å²	61	53.5 Å²	53.5	40%	0.396	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-32.6	-168.6	-28.5	35.4	0	0	0	115.7	Q1315 Q1542	Q1315-P1548 HydrophobicContact CB-CG 4.06Å; Q1315-P1548 HydrophobicContact CG-CG 4.13Å; Q1542-P1548 VanDerWaalsContact OE1-CG 3.28Å
1549	Q	74.5	Confident	80	Confident	168 Å²	168	57.4 Å²	57.4	79%	0.785	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-1.7	-179.9	-61.9	-179.8	0.2	0	0	113.5	G1547	G1547-Q1549 VanDerWaalsContact C-N 3.27Å; G1547-Q1549 PolarHBondContact O-N 3.46Å; G1547-Q1549 VanDerWaalsContact O-N 3.07Å
1550	Y	82.7	Confident	80.5	Confident	103 Å²	103	57.1 Å²	57.1	40%	0.404	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-19.3	-166	-58.5	-68.7	0	0	0	114	L1544 G1547	L1544-Y1550 HydrophobicContact CD1-CD1 4.4Å; L1544-Y1550 HydrophobicContact CD1-CE1 4.4Å; L1544-Y1550 HydrophobicContact CD2-CD1 3.57Å; L1544-Y1550 HydrophobicContact CD2-CE1 4.34Å; L1544-Y1550 HydrophobicContact CD2-CG 4.06Å; L1544-Y1550 HydrophobicContact CG-CD1 3.51Å; L1544-Y1550 HydrophobicContact CG-CE1 3.92Å; L1544-Y1550 HydrophobicContact CG-CG 3.92Å; G1547-Y1550 PolarHBondContact O-N 3.34Å
1551	S	78.9	Confident	80.7	Confident	27 Å²	27	57.5 Å²	57.5	19%	0.189	29%	0.291	C	S	.	.			trans	-59.6	127.1	173.6	-180	0	0	0	0	111.3	G1547 C1553 C1562	G1547-S1551 PolarHBondContact O-N 2.69Å; S1551-C1553 PolarHBondContact O-N 3.31Å; S1551-C1553 WeakPolarHBondContact OG-CB 3.01Å; S1551-C1553 PolarHBondContact OG-N 3.18Å; S1551-C1553 VanDerWaalsContact OG-N 3.16Å; S1551-C1562 WeakPolarHBondContact OG-CB 3.36Å
1552	P	84.1	Confident	80.7	Confident	79 Å²	79	55.7 Å²	55.7	51%	0.513	28%	0.284	S	S	.	.			trans	-75.5	3.5	171	30.3	-32.4	0	0	0	113.1	A1569	P1552-A1569 HydrophobicContact CG-CB 3.89Å
1553	C	85.9	Confident	81.1	Confident	10 Å²	10	54.8 Å²	54.8	7%	0.068	28%	0.278	C	S	.	.			trans	-107.2	127.1	-165.4	-47.1	0	0	0	0	111.5	S1551 C1571	S1551-C1553 PolarHBondContact O-N 3.31Å; S1551-C1553 WeakPolarHBondContact OG-CB 3.01Å; S1551-C1553 PolarHBondContact OG-N 3.18Å; S1551-C1553 VanDerWaalsContact OG-N 3.16Å; C1553-C1571 WeakPolarHBondContact CA-SG 3.21Å; C1553-C1571 HydrophobicContact CB-CB 3.86Å; C1553-C1571 WeakPolarHBondContact CB-SG 3.49Å; C1553-C1571 WeakPolarHBondContact SG-CA 2.94Å; C1553-C1571 WeakPolarHBondContact SG-CB 3.23Å; C1553-C1571 CovalentContact SG-SG 2.04Å; C1553-C1571 PolarHBondContact SG-SG 2.82Å
1554	Q	79.8	Confident	81.3	Confident	120 Å²	120	55.4 Å²	55.4	56%	0.561	28%	0.28	S	S	*	.			trans	-88.2	128.6	-177	-63.7	-178.3	-1.9	0	0	110.8	N1556 Q1557	Q1554-N1556 PolarHBondContact O-N 3.41Å; Q1554-N1556 VanDerWaalsContact O-N 3.12Å; Q1554-Q1557 HydrophobicContact CB-CB 4.46Å; Q1554-Q1557 HydrophobicContact CB-CG 4.03Å; Q1554-Q1557 PolarHBondContact O-N 3.5Å; Q1554-Q1557 VanDerWaalsContact O-N 3.09Å
1555	L	73	Confident	81.5	Confident	87 Å²	87	55 Å²	55	46%	0.455	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-31.4	-178.6	-76.5	96.1	0	0	0	113.8	Q1321 Q1557	Q1321-L1555 HydrophobicContact CG-CD2 4.01Å; L1555-Q1557 VanDerWaalsContact C-N 3.31Å; L1555-Q1557 PolarHBondContact O-N 2.96Å
1556	N	71.6	Confident	81.5	Confident	98 Å²	98	57.7 Å²	57.7	52%	0.524	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	9.3	-176.3	-62.3	-3.2	0	0	0	113.6	Q1554	Q1554-N1556 PolarHBondContact O-N 3.41Å; Q1554-N1556 VanDerWaalsContact O-N 3.12Å
1557	Q	79	Confident	81.5	Confident	89 Å²	89	63 Å²	63	42%	0.416	32%	0.317	S	S	.	.	S	Bend	trans	-107.4	159.5	173.7	-68.9	-164.1	26.1	0	0	111.4	Q1554 L1555 Y1559 S1560	Q1554-Q1557 HydrophobicContact CB-CB 4.46Å; Q1554-Q1557 HydrophobicContact CB-CG 4.03Å; Q1554-Q1557 PolarHBondContact O-N 3.5Å; Q1554-Q1557 VanDerWaalsContact O-N 3.09Å; L1555-Q1557 VanDerWaalsContact C-N 3.31Å; L1555-Q1557 PolarHBondContact O-N 2.96Å; Q1557-Y1559 PolarHBondContact O-N 2.58Å; Q1557-S1560 WeakPolarHBondContact O-CB 3.34Å; Q1557-S1560 PolarHBondContact O-N 3.49Å
1558	P	81	Confident	81.9	Confident	23 Å²	23	69.7 Å²	69.7	15%	0.149	35%	0.348	C	S	.	.	S	Bend	trans	-57.5	-39.5	175.3	-24.7	35	0	0	0	112.3	S1560 C1573 C1599 R1602 K1603 L1606	P1558-S1560 PolarHBondContact O-N 3.14Å; P1558-C1573 WeakPolarHBondContact O-CA 3.34Å; P1558-C1573 PolarHBondContact O-SG 2.97Å; P1558-C1599 HydrophobicContact CB-CB 4.38Å; P1558-R1602 HydrophobicContact CB-CB 4.28Å; P1558-K1603 HydrophobicContact CB-CB 4.32Å; P1558-K1603 HydrophobicContact CG-CB 3.68Å; P1558-K1603 HydrophobicContact CG-CG 4.05Å; P1558-L1606 HydrophobicContact CG-CD1 4.14Å
1559	Y	86.8	Confident	82.5	Confident	99 Å²	99	68 Å²	68	39%	0.388	34%	0.338	S	S	.	.			trans	-81.2	53.4	176.9	-58.6	-92.7	0	0	0	111.3	Q1557 C1571 A1572 C1573 C1599	Q1557-Y1559 PolarHBondContact O-N 2.58Å; Y1559-C1571 WeakPolarHBondContact CD1-O 3.39Å; Y1559-C1571 WeakPolarHBondContact O-CB 3.12Å; Y1559-A1572 CarbonylContact C-O 3.5Å; Y1559-A1572 VanDerWaalsContact CA-O 3.27Å; Y1559-A1572 WeakPolarHBondContact CA-O 3.47Å; Y1559-C1573 VanDerWaalsContact CD1-SG 3.51Å; Y1559-C1599 HydrophobicContact CE1-CB 4.4Å; Y1559-C1599 WeakPolarHBondContact CE1-SG 3.31Å; Y1559-C1599 HydrophobicContact CE2-CB 4.4Å
1560	S	82.5	Confident	83.2	Confident	12 Å²	12	63.7 Å²	63.7	8%	0.084	32%	0.324	C	S	.	.			trans	-80.3	-10.4	-174.1	57.6	0	0	0	0	114.8	Q1557 P1558 A1572	Q1557-S1560 WeakPolarHBondContact O-CB 3.34Å; Q1557-S1560 PolarHBondContact O-N 3.49Å; P1558-S1560 PolarHBondContact O-N 3.14Å; S1560-A1572 PolarHBondContact N-O 2.83Å
1561	I	85.1	Confident	83.5	Confident	14 Å²	14	61 Å²	61	7%	0.072	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.3	-171.5	-63.4	176.5	0	0	0	110.7	A1572 T1575	I1561-A1572 WeakPolarHBondContact CB-O 2.99Å; I1561-A1572 PolarHBondContact N-O 3.14Å; I1561-A1572 PolarHBondContact O-N 2.97Å; I1561-T1575 HydrophobicContact CD1-CG2 4.14Å; I1561-T1575 HydrophobicContact CG2-CG2 3.9Å
1562	C	86.3	Confident	83.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.4	177.4	-165.2	0	0	0	0	111.9	T1324 C1546 S1551 A1569	T1324-C1562 VanDerWaalsContact CB-O 3.24Å; T1324-C1562 WeakPolarHBondContact CB-O 3.49Å; T1324-C1562 PolarHBondContact OG1-O 3.14Å; C1546-C1562 WeakPolarHBondContact CA-SG 3.47Å; C1546-C1562 HydrophobicContact CB-CB 3.67Å; C1546-C1562 WeakPolarHBondContact CB-SG 3.24Å; C1546-C1562 VanDerWaalsContact SG-C 3.51Å; C1546-C1562 WeakPolarHBondContact SG-CB 3.44Å; C1546-C1562 CovalentContact SG-SG 2.04Å; C1546-C1562 PolarHBondContact SG-SG 2.03Å; S1551-C1562 WeakPolarHBondContact OG-CB 3.36Å; C1562-A1569 WeakPolarHBondContact SG-CB 3.21Å
1563	R	85.7	Confident	83.9	Confident	47 Å²	47	56.6 Å²	56.6	18%	0.177	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.2	169.6	-73	-172.9	179.3	160.8	1.1	110.3	A1569 T1570 A1572 T1574 E1595	R1563-A1569 CarbonylContact O-C 3.58Å; R1563-A1569 VanDerWaalsContact O-CA 3.25Å; R1563-A1569 WeakPolarHBondContact O-CA 3.3Å; R1563-A1569 WeakPolarHBondContact O-CB 3.35Å; R1563-T1570 PolarHBondContact N-O 2.81Å; R1563-T1570 PolarHBondContact O-N 3.47Å; R1563-A1572 HydrophobicContact CG-CB 3.88Å; R1563-A1572 VanDerWaalsContact CZ-CB 3.42Å; R1563-A1572 VanDerWaalsContact NE-CB 3.32Å; R1563-T1574 VanDerWaalsContact CZ-O 3.32Å; R1563-T1574 PolarHBondContact NE-O 2.94Å; R1563-T1574 VanDerWaalsContact NE-O 3.12Å; R1563-T1574 PolarHBondContact NH2-O 2.94Å; R1563-T1574 PolarHBondContact NH2-OG1 2.95Å; R1563-E1595 IonicContact CZ-OE2 3.97Å; R1563-E1595 IonicContact NH1-OE2 3.18Å; R1563-E1595 PolarHBondContact NH1-OE2 3.05Å; R1563-E1595 IonicContact NH2-OE1 2.8Å; R1563-E1595 IonicContact NH2-OE2 2.92Å; R1563-E1595 PolarHBondContact NH2-OE2 2.94Å
1564	P	87.6	Confident	83.7	Confident	23 Å²	23	56.5 Å²	56.5	15%	0.149	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	132.9	-174.6	35.6	-38.6	0	0	0	110.9	T1324 I1326 Q1499 P1545	T1324-P1564 HydrophobicContact CG2-CG 4.17Å; I1326-P1564 HydrophobicContact CD1-CB 3.85Å; I1326-P1564 HydrophobicContact CD1-CG 3.74Å; I1326-P1564 HydrophobicContact CG1-CG 4.03Å; Q1499-P1564 HydrophobicContact CG-CB 4.06Å; Q1499-P1564 HydrophobicContact CG-CG 3.88Å; Q1499-P1564 PolarHBondContact NE2-O 3.46Å; P1545-P1564 HydrophobicContact CG-CB 3.47Å; P1545-P1564 VanDerWaalsContact CG-CB 3.47Å
1565	N	85.7	Confident	83.6	Confident	91 Å²	91	51.6 Å²	51.6	49%	0.487	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	89.8	176.8	-175.1	6	0	0	0	111	Q1567 H1568	N1565-Q1567 PolarHBondContact O-N 3.49Å; N1565-Q1567 VanDerWaalsContact O-N 3.13Å; N1565-H1568 CarbonylContact C-O 3.53Å; N1565-H1568 WeakPolarHBondContact CA-O 3.46Å; N1565-H1568 PolarHBondContact N-O 2.85Å; N1565-H1568 PolarHBondContact O-N 3.48Å
1566	I	85.6	Confident	83.6	Confident	59 Å²	59	49.2 Å²	49.2	30%	0.303	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	-112	-167	-42.2	174.7	0	0	0	110.3	I1356 W1420 Q1499	I1356-I1566 HydrophobicContact CD1-CG1 4.07Å; I1356-I1566 HydrophobicContact CG2-CG1 4.5Å; I1356-I1566 HydrophobicContact CG2-CG2 4.42Å; W1420-I1566 HydrophobicContact CB-CG2 3.81Å; Q1499-I1566 PolarHBondContact OE1-O 2.99Å
1567	Q	83.9	Confident	83.5	Confident	113 Å²	113	46.8 Å²	46.8	53%	0.528	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.6	-179.6	-63.7	178.2	4.8	0	0	114	W1420 N1565	W1420-Q1567 HydrophobicContact CB-CG 4.13Å; N1565-Q1567 PolarHBondContact O-N 3.49Å; N1565-Q1567 VanDerWaalsContact O-N 3.13Å
1568	H	87.7	Confident	83.2	Confident	141 Å²	141	46.6 Å²	46.6	65%	0.653	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	174.6	179.7	-55.2	117.3	0	0	0	110.9	P1545 N1565	P1545-H1568 WeakPolarHBondContact CB-O 3.43Å; P1545-H1568 WeakPolarHBondContact CG-O 3.29Å; N1565-H1568 CarbonylContact C-O 3.53Å; N1565-H1568 WeakPolarHBondContact CA-O 3.46Å; N1565-H1568 PolarHBondContact N-O 2.85Å; N1565-H1568 PolarHBondContact O-N 3.48Å
1569	A	86.2	Confident	82.9	Confident	24 Å²	24	46.3 Å²	46.3	20%	0.198	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	155.9	165.5	0	0	0	0	0	111	P1545 P1552 C1562 R1563	P1545-A1569 HydrophobicContact CB-CB 4.05Å; P1545-A1569 HydrophobicContact CG-CB 4.37Å; P1545-A1569 WeakPolarHBondContact O-CB 3.14Å; P1552-A1569 HydrophobicContact CG-CB 3.89Å; C1562-A1569 WeakPolarHBondContact SG-CB 3.21Å; R1563-A1569 CarbonylContact O-C 3.58Å; R1563-A1569 VanDerWaalsContact O-CA 3.25Å; R1563-A1569 WeakPolarHBondContact O-CA 3.3Å; R1563-A1569 WeakPolarHBondContact O-CB 3.35Å
1570	T	88.5	Confident	81.8	Confident	79 Å²	79	43.1 Å²	43.1	49%	0.485	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	155.9	169.2	54	0	0	0	0	109	R1563	R1563-T1570 PolarHBondContact N-O 2.81Å; R1563-T1570 PolarHBondContact O-N 3.47Å
1571	C	89	Confident	80.9	Confident	46 Å²	46	44.6 Å²	44.6	31%	0.311	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.9	178.6	-60	0	0	0	0	110.3	C1553 Y1559	C1553-C1571 WeakPolarHBondContact CA-SG 3.21Å; C1553-C1571 HydrophobicContact CB-CB 3.86Å; C1553-C1571 WeakPolarHBondContact CB-SG 3.49Å; C1553-C1571 WeakPolarHBondContact SG-CA 2.94Å; C1553-C1571 WeakPolarHBondContact SG-CB 3.23Å; C1553-C1571 CovalentContact SG-SG 2.04Å; C1553-C1571 PolarHBondContact SG-SG 2.82Å; Y1559-C1571 WeakPolarHBondContact CD1-O 3.39Å; Y1559-C1571 WeakPolarHBondContact O-CB 3.12Å
1572	A	86.2	Confident	80.1	Confident	3 Å²	3	47 Å²	47	3%	0.025	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	166.7	-176	0	0	0	0	0	110	Y1559 S1560 I1561 R1563	Y1559-A1572 CarbonylContact C-O 3.5Å; Y1559-A1572 VanDerWaalsContact CA-O 3.27Å; Y1559-A1572 WeakPolarHBondContact CA-O 3.47Å; S1560-A1572 PolarHBondContact N-O 2.83Å; I1561-A1572 WeakPolarHBondContact CB-O 2.99Å; I1561-A1572 PolarHBondContact N-O 3.14Å; I1561-A1572 PolarHBondContact O-N 2.97Å; R1563-A1572 HydrophobicContact CG-CB 3.88Å; R1563-A1572 VanDerWaalsContact CZ-CB 3.42Å; R1563-A1572 VanDerWaalsContact NE-CB 3.32Å
1573	C	85.3	Confident	79	Confident	10 Å²	10	49.8 Å²	49.8	7%	0.068	26%	0.262	C	S	.	.	S	Bend	trans	-97.5	-8.7	178.4	-54.8	0	0	0	0	111.2	P1558 Y1559 E1595 A1598 C1599	P1558-C1573 WeakPolarHBondContact O-CA 3.34Å; P1558-C1573 PolarHBondContact O-SG 2.97Å; Y1559-C1573 VanDerWaalsContact CD1-SG 3.51Å; C1573-E1595 WeakPolarHBondContact CA-OE1 2.97Å; C1573-E1595 PolarHBondContact N-OE1 2.8Å; C1573-A1598 HydrophobicContact CB-CB 4.32Å; C1573-C1599 HydrophobicContact CB-CB 3.93Å; C1573-C1599 WeakPolarHBondContact CB-SG 3.17Å; C1573-C1599 WeakPolarHBondContact SG-CA 3.31Å; C1573-C1599 WeakPolarHBondContact SG-CB 3.45Å; C1573-C1599 CovalentContact SG-SG 2.02Å; C1573-C1599 PolarHBondContact SG-SG 2.82Å
1574	T	80.7	Confident	77.3	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.055	26%	0.256	C	S	.	.	S	Bend	trans	-136.8	150.2	176.9	54.5	0	0	0	0	112.9	R1563 Q1578 L1582 E1595 A1598	R1563-T1574 VanDerWaalsContact CZ-O 3.32Å; R1563-T1574 PolarHBondContact NE-O 2.94Å; R1563-T1574 VanDerWaalsContact NE-O 3.12Å; R1563-T1574 PolarHBondContact NH2-O 2.94Å; R1563-T1574 PolarHBondContact NH2-OG1 2.95Å; T1574-Q1578 HydrophobicContact CG2-CB 4.03Å; T1574-L1582 HydrophobicContact CG2-CD1 3.75Å; T1574-E1595 PolarHBondContact N-OE1 3.47Å; T1574-E1595 PolarHBondContact OG1-OE1 2.91Å; T1574-E1595 PolarHBondContact OG1-OE2 3.17Å; T1574-E1595 VanDerWaalsContact OG1-OE2 3.1Å; T1574-A1598 HydrophobicContact CG2-CB 3.77Å
1575	T	78.6	Confident	75.4	Confident	16 Å²	16	48.4 Å²	48.4	10%	0.098	26%	0.262	C	S	.	.			trans	-66.9	161.7	163.9	68.6	0	0	0	0	110.4	I1561 L1577 Q1578 L1579	I1561-T1575 HydrophobicContact CD1-CG2 4.14Å; I1561-T1575 HydrophobicContact CG2-CG2 3.9Å; T1575-L1577 PolarHBondContact O-N 2.85Å; T1575-Q1578 PolarHBondContact O-N 2.85Å; T1575-Q1578 WeakPolarHBondContact OG1-CG 3.33Å; T1575-Q1578 PolarHBondContact OG1-N 3.03Å; T1575-Q1578 VanDerWaalsContact OG1-N 3.12Å; T1575-L1579 PolarHBondContact O-N 2.87Å
1576	P	72.3	Confident	74.3	Confident	38 Å²	38	47.7 Å²	47.7	25%	0.247	25%	0.253	C	S	.	.	H	α-helix	trans	-56	-33.6	173.7	-27.4	36	0	0	0	113.5	T1324 M1580	T1324-P1576 HydrophobicContact CG2-CG 3.79Å; T1324-P1576 WeakPolarHBondContact OG1-CD 3.28Å; P1576-M1580 WeakPolarHBondContact O-CB 3.48Å; P1576-M1580 PolarHBondContact O-N 3.01Å
1577	L	69.9	Low	72.4	Confident	46 Å²	46	49 Å²	49	24%	0.241	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-45.8	174	-173.9	64.6	0	0	0	111.4	V1509 A1511 T1575 M1580 H1581	V1509-L1577 HydrophobicContact CG1-CB 4.26Å; V1509-L1577 HydrophobicContact CG1-CD1 4.13Å; A1511-L1577 HydrophobicContact CB-CD1 3.91Å; A1511-L1577 HydrophobicContact CB-CD2 4.26Å; T1575-L1577 PolarHBondContact O-N 2.85Å; L1577-M1580 HydrophobicContact CD1-CE 3.92Å; L1577-M1580 PolarHBondContact O-N 2.82Å; L1577-H1581 PolarHBondContact O-N 3.11Å; L1577-H1581 PolarHBondContact O-ND1 3.47Å
1578	Q	73.6	Confident	70.5	Confident	85 Å²	85	48.5 Å²	48.5	40%	0.397	26%	0.261	S	S	.	.	H	α-helix	trans	-65.8	-40.3	176.4	-75	168.6	-20.1	0	0	112.5	T1574 T1575 H1581 L1582	T1574-Q1578 HydrophobicContact CG2-CB 4.03Å; T1575-Q1578 PolarHBondContact O-N 2.85Å; T1575-Q1578 WeakPolarHBondContact OG1-CG 3.33Å; T1575-Q1578 PolarHBondContact OG1-N 3.03Å; T1575-Q1578 VanDerWaalsContact OG1-N 3.12Å; Q1578-H1581 WeakPolarHBondContact O-CA 3.48Å; Q1578-H1581 WeakPolarHBondContact O-CB 3.36Å; Q1578-H1581 PolarHBondContact O-N 2.83Å; Q1578-H1581 VanDerWaalsContact O-N 3.12Å; Q1578-L1582 PolarHBondContact O-N 2.91Å
1579	L	73.4	Confident	69	Low	17 Å²	17	45.1 Å²	45.1	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-42.5	173.9	-179.5	61.8	0	0	0	111.1	T1575 H1581 L1582 M1583 V1594	T1575-L1579 PolarHBondContact O-N 2.87Å; L1579-H1581 PolarHBondContact O-N 2.89Å; L1579-L1582 PolarHBondContact O-N 2.8Å; L1579-M1583 HydrophobicContact CD1-CG 3.91Å; L1579-M1583 HydrophobicContact CD1-SD 4.42Å; L1579-M1583 HydrophobicContact CG-CE 4.23Å; L1579-M1583 HydrophobicContact CG-CG 4.17Å; L1579-M1583 HydrophobicContact CG-SD 4.37Å; L1579-M1583 WeakPolarHBondContact O-CB 3.39Å; L1579-M1583 WeakPolarHBondContact O-CG 3.11Å; L1579-M1583 PolarHBondContact O-N 3.44Å; L1579-V1594 HydrophobicContact CD1-CB 4.19Å; L1579-V1594 HydrophobicContact CD1-CG1 3.92Å
1580	M	64.6	Low	67.9	Low	32 Å²	32	50.7 Å²	50.7	16%	0.158	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-37.4	172.4	-173.7	-174.7	77.2	0	0	111.3	N917 V1509 P1576 L1577 K1584	N917-M1580 HydrophobicContact CB-CE 3.94Å; N917-M1580 HydrophobicContact CB-SD 4.11Å; N917-M1580 PolarHBondContact ND2-SD 2.83Å; N917-M1580 VanDerWaalsContact ND2-SD 3.37Å; V1509-M1580 HydrophobicContact CG2-SD 4.14Å; P1576-M1580 WeakPolarHBondContact O-CB 3.48Å; P1576-M1580 PolarHBondContact O-N 3.01Å; L1577-M1580 HydrophobicContact CD1-CE 3.92Å; L1577-M1580 PolarHBondContact O-N 2.82Å; M1580-K1584 WeakPolarHBondContact O-CB 3.46Å; M1580-K1584 PolarHBondContact O-N 3.36Å
1581	H	62.2	Low	66.9	Low	43 Å²	43	50.2 Å²	50.2	20%	0.199	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-43.9	174.5	-75.6	58.3	0	0	0	112.9	Q915 N916 L1577 Q1578 L1579	Q915-H1581 VanDerWaalsContact O-CA 3.32Å; Q915-H1581 WeakPolarHBondContact O-CA 3.35Å; N916-H1581 VanDerWaalsContact CG-CD2 3.48Å; N916-H1581 PolarHBondContact ND2-NE2 3.35Å; N916-H1581 PolarHBondContact OD1-CD2 3.26Å; N916-H1581 VanDerWaalsContact OD1-CD2 3.25Å; N916-H1581 PolarHBondContact OD1-NE2 3.33Å; L1577-H1581 PolarHBondContact O-N 3.11Å; L1577-H1581 PolarHBondContact O-ND1 3.47Å; Q1578-H1581 WeakPolarHBondContact O-CA 3.48Å; Q1578-H1581 WeakPolarHBondContact O-CB 3.36Å; Q1578-H1581 PolarHBondContact O-N 2.83Å; Q1578-H1581 VanDerWaalsContact O-N 3.12Å; L1579-H1581 PolarHBondContact O-N 2.89Å
1582	L	68.4	Low	66.2	Low	65 Å²	65	52.9 Å²	52.9	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-67.8	-41.7	177.8	-66.8	179.2	0	0	0	112.4	T1574 Q1578 L1579 K1584 R1586 V1594 A1598	T1574-L1582 HydrophobicContact CG2-CD1 3.75Å; Q1578-L1582 PolarHBondContact O-N 2.91Å; L1579-L1582 PolarHBondContact O-N 2.8Å; L1582-K1584 VanDerWaalsContact C-N 3.35Å; L1582-R1586 WeakPolarHBondContact O-CD 3.42Å; L1582-V1594 HydrophobicContact CB-CG1 3.42Å; L1582-V1594 VanDerWaalsContact CB-CG1 3.42Å; L1582-V1594 HydrophobicContact CD1-CG1 4.19Å; L1582-V1594 HydrophobicContact CG-CG1 4.46Å; L1582-A1598 HydrophobicContact CD1-CB 3.72Å
1583	M	64.8	Low	65.9	Low	59 Å²	59	57.2 Å²	57.2	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-27.2	179.2	-71.2	-157.3	-58	0	0	113.2	L1579 G1585 R1586 T1591 V1594	L1579-M1583 HydrophobicContact CD1-CG 3.91Å; L1579-M1583 HydrophobicContact CD1-SD 4.42Å; L1579-M1583 HydrophobicContact CG-CE 4.23Å; L1579-M1583 HydrophobicContact CG-CG 4.17Å; L1579-M1583 HydrophobicContact CG-SD 4.37Å; L1579-M1583 WeakPolarHBondContact O-CB 3.39Å; L1579-M1583 WeakPolarHBondContact O-CG 3.11Å; L1579-M1583 PolarHBondContact O-N 3.44Å; M1583-G1585 VanDerWaalsContact C-N 3.32Å; M1583-G1585 PolarHBondContact O-N 2.79Å; M1583-R1586 CarbonylContact O-C 3.56Å; M1583-R1586 PolarHBondContact O-N 3.2Å; M1583-T1591 HydrophobicContact CE-CG2 4.08Å; M1583-T1591 HydrophobicContact SD-CG2 3.48Å; M1583-T1591 WeakPolarHBondContact SD-CG2 3.41Å; M1583-V1594 HydrophobicContact CG-CB 4.24Å; M1583-V1594 HydrophobicContact CG-CG1 4.07Å; M1583-V1594 HydrophobicContact CG-CG2 4.14Å
1584	K	49.6	Very low	65.6	Low	15 Å²	15	56.8 Å²	56.8	7%	0.065	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	86.2	-176.5	-160	-178.3	175.7	-125.6	0	110.4	G913 I914 Q915 N917 H918 M1580 L1582	G913-K1584 PolarHBondContact O-NZ 3.08Å; I914-K1584 WeakPolarHBondContact O-CD 3.41Å; I914-K1584 WeakPolarHBondContact O-CE 3.34Å; I914-K1584 WeakPolarHBondContact O-CG 3.47Å; I914-K1584 PolarHBondContact O-NZ 3.35Å; Q915-K1584 WeakPolarHBondContact O-CB 3.35Å; N917-K1584 VanDerWaalsContact CA-CE 3.46Å; N917-K1584 VanDerWaalsContact CA-NZ 3.26Å; N917-K1584 HydrophobicContact CB-CD 4.48Å; N917-K1584 WeakPolarHBondContact OD1-CD 3.5Å; N917-K1584 VanDerWaalsContact OD1-CE 3.31Å; N917-K1584 WeakPolarHBondContact OD1-CE 3.34Å; H918-K1584 PolarHBondContact O-NZ 2.64Å; M1580-K1584 WeakPolarHBondContact O-CB 3.46Å; M1580-K1584 PolarHBondContact O-N 3.36Å; L1582-K1584 VanDerWaalsContact C-N 3.35Å
1585	G	48	Very low	65.7	Low	26 Å²	26	57.1 Å²	57.1	27%	0.268	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	144.6	-15.6	-167.2	0	0	0	0	0	111.9	M1583	M1583-G1585 VanDerWaalsContact C-N 3.32Å; M1583-G1585 PolarHBondContact O-N 2.79Å
1586	R	61.2	Low	66	Low	76 Å²	76	62 Å²	62	29%	0.287	32%	0.315	S	S	.	.			trans	-126.4	54.3	-175.5	-59.2	175.2	169.7	-144.9	1.2	111.3	L1582 M1583 D1588 E1589 V1594 Q1597	L1582-R1586 WeakPolarHBondContact O-CD 3.42Å; M1583-R1586 CarbonylContact O-C 3.56Å; M1583-R1586 PolarHBondContact O-N 3.2Å; R1586-D1588 PolarHBondContact O-N 3.12Å; R1586-E1589 HydrophobicContact CB-CB 4.18Å; R1586-E1589 HydrophobicContact CB-CG 4.2Å; R1586-E1589 WeakPolarHBondContact CD-OE2 3.48Å; R1586-E1589 IonicContact CZ-OE1 2.68Å; R1586-E1589 IonicContact CZ-OE2 2.66Å; R1586-E1589 IonicContact NE-OE1 2.66Å; R1586-E1589 IonicContact NE-OE2 3.09Å; R1586-E1589 IonicContact NH1-OE1 2.68Å; R1586-E1589 IonicContact NH1-OE2 2.67Å; R1586-E1589 PolarHBondContact NH1-OE2 2.96Å; R1586-E1589 PolarHBondContact O-N 3.04Å; R1586-V1594 HydrophobicContact CB-CG2 4.49Å; R1586-Q1597 VanDerWaalsContact CZ-OE1 3.29Å; R1586-Q1597 VanDerWaalsContact NH1-NE2 3.17Å
1587	L	45.7	Very low	66.5	Low	87 Å²	87	64.3 Å²	64.3	46%	0.455	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-6.3	-172.5	-79.1	157.8	0	0	0	115.4	N878	N878-L1587 HydrophobicContact CB-CD1 3.77Å
1588	D	44.7	Very low	67.2	Low	102 Å²	102	62.9 Å²	62.9	55%	0.545	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-1.1	-180	-72.5	-70.1	0	0	0	113.4	T876 R1586	T876-D1588 WeakPolarHBondContact CB-OD2 3.29Å; T876-D1588 WeakPolarHBondContact CG2-OD1 3.39Å; T876-D1588 VanDerWaalsContact CG2-OD2 3.29Å; T876-D1588 WeakPolarHBondContact CG2-OD2 3.34Å; T876-D1588 PolarHBondContact OG1-OD2 2.99Å; R1586-D1588 PolarHBondContact O-N 3.12Å
1589	E	55.5	Low	67.8	Low	69 Å²	69	59.1 Å²	59.1	32%	0.322	30%	0.3	S	S	.	.	S	Bend	trans	-88.9	145.9	171.1	-68	-175.3	-157.5	0	0	110.3	R1586 V1594 Q1597	R1586-E1589 HydrophobicContact CB-CB 4.18Å; R1586-E1589 HydrophobicContact CB-CG 4.2Å; R1586-E1589 WeakPolarHBondContact CD-OE2 3.48Å; R1586-E1589 IonicContact CZ-OE1 2.68Å; R1586-E1589 IonicContact CZ-OE2 2.66Å; R1586-E1589 IonicContact NE-OE1 2.66Å; R1586-E1589 IonicContact NE-OE2 3.09Å; R1586-E1589 IonicContact NH1-OE1 2.68Å; R1586-E1589 IonicContact NH1-OE2 2.67Å; R1586-E1589 PolarHBondContact NH1-OE2 2.96Å; R1586-E1589 PolarHBondContact O-N 3.04Å; E1589-V1594 HydrophobicContact CB-CG2 3.87Å; E1589-V1594 WeakPolarHBondContact OE2-CG2 3.14Å; E1589-Q1597 PolarHBondContact OE2-NE2 2.94Å
1590	E	63.4	Low	68.4	Low	142 Å²	142	63.4 Å²	63.4	66%	0.664	32%	0.323	S	S	*	.			trans	-73.8	148.9	175.7	-65.8	-169	160	0	0	111.3	D1592 E1593 V1594	E1590-D1592 PolarHBondContact O-N 3.03Å; E1590-E1593 HydrophobicContact CB-CG 4.31Å; E1590-E1593 PolarHBondContact N-OE2 2.74Å; E1590-E1593 PolarHBondContact O-N 3.42Å; E1590-V1594 PolarHBondContact O-N 3.13Å
1591	T	67.5	Low	69.3	Low	68 Å²	68	67.4 Å²	67.4	42%	0.417	34%	0.341	S	S	.	.	H	α-helix	trans	-47.7	-38.6	179.2	41.6	0	0	0	0	112.6	M1583 E1595	M1583-T1591 HydrophobicContact CE-CG2 4.08Å; M1583-T1591 HydrophobicContact SD-CG2 3.48Å; M1583-T1591 WeakPolarHBondContact SD-CG2 3.41Å; T1591-E1595 WeakPolarHBondContact O-CB 3.5Å; T1591-E1595 PolarHBondContact O-N 2.8Å
1592	D	75.4	Confident	70.2	Confident	103 Å²	103	68.2 Å²	68.2	55%	0.551	34%	0.342	S	S	*	.	H	α-helix	trans	-80.2	-25.2	-172.8	-63.6	6.9	0	0	0	111.7	E1590 Q1596	E1590-D1592 PolarHBondContact O-N 3.03Å; D1592-Q1596 VanDerWaalsContact O-CB 3.28Å; D1592-Q1596 WeakPolarHBondContact O-CB 3.09Å; D1592-Q1596 WeakPolarHBondContact O-CG 3Å; D1592-Q1596 PolarHBondContact O-N 2.9Å; D1592-Q1596 PolarHBondContact O-NE2 3.08Å
1593	E	79.3	Confident	71	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-72.4	-43.4	172.3	-64.9	-174.7	124.7	0	0	110.9	E1590 E1595 Q1596 Q1597	E1590-E1593 HydrophobicContact CB-CG 4.31Å; E1590-E1593 PolarHBondContact N-OE2 2.74Å; E1590-E1593 PolarHBondContact O-N 3.42Å; E1593-E1595 VanDerWaalsContact C-N 3.34Å; E1593-Q1596 PolarHBondContact O-N 2.86Å; E1593-Q1597 WeakPolarHBondContact O-CG 3.35Å; E1593-Q1597 PolarHBondContact O-N 2.99Å
1594	V	79.5	Confident	71.7	Confident	1 Å²	1	73.4 Å²	73.4	1%	0.006	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-42.9	176.1	-176.7	0	0	0	0	110.5	L1579 L1582 M1583 R1586 E1589 E1590 Q1597 A1598	L1579-V1594 HydrophobicContact CD1-CB 4.19Å; L1579-V1594 HydrophobicContact CD1-CG1 3.92Å; L1582-V1594 HydrophobicContact CB-CG1 3.42Å; L1582-V1594 VanDerWaalsContact CB-CG1 3.42Å; L1582-V1594 HydrophobicContact CD1-CG1 4.19Å; L1582-V1594 HydrophobicContact CG-CG1 4.46Å; M1583-V1594 HydrophobicContact CG-CB 4.24Å; M1583-V1594 HydrophobicContact CG-CG1 4.07Å; M1583-V1594 HydrophobicContact CG-CG2 4.14Å; R1586-V1594 HydrophobicContact CB-CG2 4.49Å; E1589-V1594 HydrophobicContact CB-CG2 3.87Å; E1589-V1594 WeakPolarHBondContact OE2-CG2 3.14Å; E1590-V1594 PolarHBondContact O-N 3.13Å; V1594-Q1597 PolarHBondContact O-N 3.05Å; V1594-A1598 PolarHBondContact O-N 3.09Å; V1594-A1598 VanDerWaalsContact O-N 3.14Å
1595	E	82.5	Confident	73	Confident	16 Å²	16	75.6 Å²	75.6	8%	0.075	37%	0.373	C	S	.	.	H	α-helix	trans	-62.5	-47.4	173.3	-162.9	72.4	-135	0	0	111.7	R1563 C1573 T1574 T1591 E1593 Q1597 A1598 C1599	R1563-E1595 IonicContact CZ-OE2 3.97Å; R1563-E1595 IonicContact NH1-OE2 3.18Å; R1563-E1595 PolarHBondContact NH1-OE2 3.05Å; R1563-E1595 IonicContact NH2-OE1 2.8Å; R1563-E1595 IonicContact NH2-OE2 2.92Å; R1563-E1595 PolarHBondContact NH2-OE2 2.94Å; C1573-E1595 WeakPolarHBondContact CA-OE1 2.97Å; C1573-E1595 PolarHBondContact N-OE1 2.8Å; T1574-E1595 PolarHBondContact N-OE1 3.47Å; T1574-E1595 PolarHBondContact OG1-OE1 2.91Å; T1574-E1595 PolarHBondContact OG1-OE2 3.17Å; T1574-E1595 VanDerWaalsContact OG1-OE2 3.1Å; T1591-E1595 WeakPolarHBondContact O-CB 3.5Å; T1591-E1595 PolarHBondContact O-N 2.8Å; E1593-E1595 VanDerWaalsContact C-N 3.34Å; E1595-Q1597 VanDerWaalsContact C-N 3.31Å; E1595-Q1597 PolarHBondContact O-N 2.93Å; E1595-A1598 WeakPolarHBondContact O-CB 3.05Å; E1595-A1598 PolarHBondContact O-N 3.49Å; E1595-A1598 VanDerWaalsContact O-N 3.12Å; E1595-C1599 PolarHBondContact O-N 2.72Å; E1595-C1599 PolarHBondContact O-SG 3.28Å
1596	Q	84.9	Confident	74.2	Confident	118 Å²	118	74.8 Å²	74.8	55%	0.551	36%	0.363	S	S	*	.	H	α-helix	trans	-58.7	-39.6	178.6	-81.4	169.7	72.4	0	0	112.6	D1592 E1593 C1599 L1600	D1592-Q1596 VanDerWaalsContact O-CB 3.28Å; D1592-Q1596 WeakPolarHBondContact O-CB 3.09Å; D1592-Q1596 WeakPolarHBondContact O-CG 3Å; D1592-Q1596 PolarHBondContact O-N 2.9Å; D1592-Q1596 PolarHBondContact O-NE2 3.08Å; E1593-Q1596 PolarHBondContact O-N 2.86Å; Q1596-C1599 WeakPolarHBondContact O-CB 3.11Å; Q1596-C1599 PolarHBondContact O-N 3.31Å; Q1596-L1600 PolarHBondContact O-N 2.81Å
1597	Q	83.3	Confident	74.8	Confident	87 Å²	87	74.4 Å²	74.4	41%	0.407	37%	0.372	S	S	.	.	H	α-helix	trans	-64.9	-43.1	174.5	-71.8	179.6	40.3	0	0	112	R1586 E1589 E1593 V1594 E1595 C1599 L1600 Q1601	R1586-Q1597 VanDerWaalsContact CZ-OE1 3.29Å; R1586-Q1597 VanDerWaalsContact NH1-NE2 3.17Å; E1589-Q1597 PolarHBondContact OE2-NE2 2.94Å; E1593-Q1597 WeakPolarHBondContact O-CG 3.35Å; E1593-Q1597 PolarHBondContact O-N 2.99Å; V1594-Q1597 PolarHBondContact O-N 3.05Å; E1595-Q1597 VanDerWaalsContact C-N 3.31Å; E1595-Q1597 PolarHBondContact O-N 2.93Å; Q1597-C1599 VanDerWaalsContact C-N 3.32Å; Q1597-C1599 PolarHBondContact O-N 2.78Å; Q1597-L1600 WeakPolarHBondContact O-CB 3.34Å; Q1597-L1600 PolarHBondContact O-N 3.07Å; Q1597-Q1601 PolarHBondContact O-N 2.86Å
1598	A	83	Confident	76.1	Confident	16 Å²	16	79.2 Å²	79.2	13%	0.132	38%	0.384	C	S	.	.	H	α-helix	trans	-61.8	-40.3	174.3	0	0	0	0	0	112	C1573 T1574 L1582 V1594 E1595 L1600 Q1601 R1602	C1573-A1598 HydrophobicContact CB-CB 4.32Å; T1574-A1598 HydrophobicContact CG2-CB 3.77Å; L1582-A1598 HydrophobicContact CD1-CB 3.72Å; V1594-A1598 PolarHBondContact O-N 3.09Å; V1594-A1598 VanDerWaalsContact O-N 3.14Å; E1595-A1598 WeakPolarHBondContact O-CB 3.05Å; E1595-A1598 PolarHBondContact O-N 3.49Å; E1595-A1598 VanDerWaalsContact O-N 3.12Å; A1598-L1600 VanDerWaalsContact C-N 3.35Å; A1598-L1600 PolarHBondContact O-N 3.21Å; A1598-Q1601 PolarHBondContact O-N 3.13Å; A1598-R1602 WeakPolarHBondContact O-CB 3.24Å; A1598-R1602 PolarHBondContact O-N 2.77Å
1599	C	87	Confident	76.8	Confident	6 Å²	6	75.2 Å²	75.2	4%	0.041	36%	0.362	C	S	.	.	H	α-helix	trans	-62.6	-39.3	172.9	-61.4	0	0	0	0	112.7	P1558 Y1559 C1573 E1595 Q1596 Q1597 R1602 K1603	P1558-C1599 HydrophobicContact CB-CB 4.38Å; Y1559-C1599 HydrophobicContact CE1-CB 4.4Å; Y1559-C1599 WeakPolarHBondContact CE1-SG 3.31Å; Y1559-C1599 HydrophobicContact CE2-CB 4.4Å; C1573-C1599 HydrophobicContact CB-CB 3.93Å; C1573-C1599 WeakPolarHBondContact CB-SG 3.17Å; C1573-C1599 WeakPolarHBondContact SG-CA 3.31Å; C1573-C1599 WeakPolarHBondContact SG-CB 3.45Å; C1573-C1599 CovalentContact SG-SG 2.02Å; C1573-C1599 PolarHBondContact SG-SG 2.82Å; E1595-C1599 PolarHBondContact O-N 2.72Å; E1595-C1599 PolarHBondContact O-SG 3.28Å; Q1596-C1599 WeakPolarHBondContact O-CB 3.11Å; Q1596-C1599 PolarHBondContact O-N 3.31Å; Q1597-C1599 VanDerWaalsContact C-N 3.32Å; Q1597-C1599 PolarHBondContact O-N 2.78Å; C1599-R1602 PolarHBondContact O-N 3.12Å; C1599-K1603 VanDerWaalsContact O-CB 3.25Å; C1599-K1603 WeakPolarHBondContact O-CB 3.33Å; C1599-K1603 PolarHBondContact O-N 3.46Å
1600	L	86.8	Confident	77.2	Confident	107 Å²	107	76 Å²	76	56%	0.56	37%	0.369	S	S	*	.	H	α-helix	trans	-64.7	-42.7	176.3	-160	77.4	0	0	0	111	Q1596 Q1597 A1598 K1603 M1604	Q1596-L1600 PolarHBondContact O-N 2.81Å; Q1597-L1600 WeakPolarHBondContact O-CB 3.34Å; Q1597-L1600 PolarHBondContact O-N 3.07Å; A1598-L1600 VanDerWaalsContact C-N 3.35Å; A1598-L1600 PolarHBondContact O-N 3.21Å; L1600-K1603 PolarHBondContact O-N 3.48Å; L1600-M1604 WeakPolarHBondContact O-CG 3.4Å; L1600-M1604 PolarHBondContact O-N 2.88Å; L1600-M1604 VanDerWaalsContact O-N 3.1Å
1601	Q	82.2	Confident	76.9	Confident	115 Å²	115	72.5 Å²	72.5	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-50.5	173.4	-173.3	-174.6	-46	0	0	111.4	Q1597 A1598 K1603 M1604 E1605	Q1597-Q1601 PolarHBondContact O-N 2.86Å; A1598-Q1601 PolarHBondContact O-N 3.13Å; Q1601-K1603 PolarHBondContact O-N 3.21Å; Q1601-M1604 WeakPolarHBondContact O-CA 3.21Å; Q1601-M1604 WeakPolarHBondContact O-CB 3.41Å; Q1601-M1604 PolarHBondContact O-N 3.36Å; Q1601-E1605 PolarHBondContact NE2-OE1 3Å; Q1601-E1605 PolarHBondContact O-N 2.65Å
1602	R	81	Confident	75.9	Confident	60 Å²	60	72 Å²	72	23%	0.226	36%	0.363	C	S	.	.	H	α-helix	trans	-61.3	-33.9	-179.5	-166.7	60.7	175.6	161.8	1.3	112.2	P1558 A1598 C1599 E1605 L1606 Y1623	P1558-R1602 HydrophobicContact CB-CB 4.28Å; A1598-R1602 WeakPolarHBondContact O-CB 3.24Å; A1598-R1602 PolarHBondContact O-N 2.77Å; C1599-R1602 PolarHBondContact O-N 3.12Å; R1602-E1605 WeakPolarHBondContact CD-OE2 3.39Å; R1602-E1605 IonicContact CZ-OE2 3.89Å; R1602-E1605 IonicContact NE-OE2 2.68Å; R1602-E1605 IonicContact NH1-OE2 2.77Å; R1602-E1605 PolarHBondContact NH1-OE2 2.74Å; R1602-E1605 PolarHBondContact O-N 2.84Å; R1602-L1606 HydrophobicContact CG-CD1 4.35Å; R1602-L1606 WeakPolarHBondContact O-CB 3.39Å; R1602-L1606 WeakPolarHBondContact O-CD1 3.47Å; R1602-L1606 WeakPolarHBondContact O-CG 3.24Å; R1602-L1606 PolarHBondContact O-N 2.83Å; R1602-Y1623 PolarHBondContact NH2-OH 2.73Å
1603	K	85.6	Confident	74.4	Confident	133 Å²	133	69.8 Å²	69.8	58%	0.578	35%	0.351	S	S	*	.	H	α-helix	trans	-64.9	-38.7	171.6	-169.8	177.1	-179.2	179.8	0	112.5	P1558 C1599 L1600 Q1601 S1607	P1558-K1603 HydrophobicContact CB-CB 4.32Å; P1558-K1603 HydrophobicContact CG-CB 3.68Å; P1558-K1603 HydrophobicContact CG-CG 4.05Å; C1599-K1603 VanDerWaalsContact O-CB 3.25Å; C1599-K1603 WeakPolarHBondContact O-CB 3.33Å; C1599-K1603 PolarHBondContact O-N 3.46Å; L1600-K1603 PolarHBondContact O-N 3.48Å; Q1601-K1603 PolarHBondContact O-N 3.21Å; K1603-S1607 WeakPolarHBondContact O-CB 3.33Å; K1603-S1607 PolarHBondContact O-N 2.86Å
1604	M	80.8	Confident	72.7	Confident	101 Å²	101	70 Å²	70	50%	0.498	36%	0.363	S	S	.	.	H	α-helix	trans	-68.3	-42.2	174.7	-70.4	-174.5	-71.7	0	0	111.8	L1600 Q1601 S1607 R1608	L1600-M1604 WeakPolarHBondContact O-CG 3.4Å; L1600-M1604 PolarHBondContact O-N 2.88Å; L1600-M1604 VanDerWaalsContact O-N 3.1Å; Q1601-M1604 WeakPolarHBondContact O-CA 3.21Å; Q1601-M1604 WeakPolarHBondContact O-CB 3.41Å; Q1601-M1604 PolarHBondContact O-N 3.36Å; M1604-S1607 PolarHBondContact O-N 3.39Å; M1604-S1607 PolarHBondContact O-OG 2.84Å; M1604-R1608 PolarHBondContact O-N 2.98Å; M1604-R1608 VanDerWaalsContact O-N 3.11Å
1605	E	75.1	Confident	70.8	Confident	60 Å²	60	74.6 Å²	74.6	28%	0.28	40%	0.395	S	S	.	.	H	α-helix	trans	-57.3	-53	172.7	-68.3	167.2	-164.6	0	0	111.5	Q1601 R1602 S1607 R1608 L1609	Q1601-E1605 PolarHBondContact NE2-OE1 3Å; Q1601-E1605 PolarHBondContact O-N 2.65Å; R1602-E1605 WeakPolarHBondContact CD-OE2 3.39Å; R1602-E1605 IonicContact CZ-OE2 3.89Å; R1602-E1605 IonicContact NE-OE2 2.68Å; R1602-E1605 IonicContact NH1-OE2 2.77Å; R1602-E1605 PolarHBondContact NH1-OE2 2.74Å; R1602-E1605 PolarHBondContact O-N 2.84Å; E1605-S1607 PolarHBondContact O-N 2.85Å; E1605-R1608 WeakPolarHBondContact O-CB 3.4Å; E1605-R1608 PolarHBondContact O-N 2.79Å; E1605-L1609 PolarHBondContact O-N 2.79Å
1606	L	73.1	Confident	68.3	Low	10 Å²	10	83.8 Å²	83.8	5%	0.052	43%	0.429	C	S	.	.	H	α-helix	trans	-56.5	-36.6	175.6	-78.3	162.3	0	0	0	112.7	P1558 R1602 N1610 Y1623	P1558-L1606 HydrophobicContact CG-CD1 4.14Å; R1602-L1606 HydrophobicContact CG-CD1 4.35Å; R1602-L1606 WeakPolarHBondContact O-CB 3.39Å; R1602-L1606 WeakPolarHBondContact O-CD1 3.47Å; R1602-L1606 WeakPolarHBondContact O-CG 3.24Å; R1602-L1606 PolarHBondContact O-N 2.83Å; L1606-N1610 VanDerWaalsContact O-CB 3.31Å; L1606-N1610 WeakPolarHBondContact O-CB 3.41Å; L1606-N1610 VanDerWaalsContact O-CG 3.24Å; L1606-N1610 PolarHBondContact O-N 2.75Å; L1606-N1610 PolarHBondContact O-ND2 2.78Å; L1606-Y1623 VanDerWaalsContact CD2-OH 3.24Å; L1606-Y1623 WeakPolarHBondContact CD2-OH 3.24Å
1607	S	75.1	Confident	65.7	Low	67 Å²	67	85.3 Å²	85.3	47%	0.469	44%	0.441	S	S	.	.	H	α-helix	trans	-69.9	-30.8	177.3	75.7	0	0	0	0	113.6	K1603 M1604 E1605 S1611	K1603-S1607 WeakPolarHBondContact O-CB 3.33Å; K1603-S1607 PolarHBondContact O-N 2.86Å; M1604-S1607 PolarHBondContact O-N 3.39Å; M1604-S1607 PolarHBondContact O-OG 2.84Å; E1605-S1607 PolarHBondContact O-N 2.85Å; S1607-S1611 WeakPolarHBondContact O-CB 3.25Å; S1607-S1611 PolarHBondContact O-N 2.97Å; S1607-S1611 VanDerWaalsContact O-N 3.09Å; S1607-S1611 PolarHBondContact O-OG 3.39Å
1608	R	72.5	Confident	63.2	Low	188 Å²	188	89.2 Å²	89.2	71%	0.709	46%	0.464	S	S	*	.	H	α-helix	trans	-71.9	-43.4	174	-73.5	178	173.5	160.7	-0.9	111.3	M1604 E1605 S1611 A1612	M1604-R1608 PolarHBondContact O-N 2.98Å; M1604-R1608 VanDerWaalsContact O-N 3.11Å; E1605-R1608 WeakPolarHBondContact O-CB 3.4Å; E1605-R1608 PolarHBondContact O-N 2.79Å; R1608-S1611 WeakPolarHBondContact CA-OG 3.38Å; R1608-S1611 PolarHBondContact O-N 3.41Å; R1608-S1611 PolarHBondContact O-OG 3.2Å; R1608-S1611 VanDerWaalsContact O-OG 3.05Å; R1608-A1612 PolarHBondContact O-N 2.71Å
1609	L	60	Low	60.6	Low	18 Å²	18	92.2 Å²	92.2	9%	0.094	50%	0.496	C	S	.	.	H	α-helix	trans	-62.2	-51.3	174.1	-78.8	151.4	0	0	0	111.3	E1605 S1611 A1612 L1613 Y1623 D1624	E1605-L1609 PolarHBondContact O-N 2.79Å; L1609-S1611 VanDerWaalsContact C-N 3.28Å; L1609-S1611 PolarHBondContact O-N 3.03Å; L1609-A1612 WeakPolarHBondContact O-CB 3.22Å; L1609-A1612 PolarHBondContact O-N 2.78Å; L1609-A1612 VanDerWaalsContact O-N 3.14Å; L1609-L1613 HydrophobicContact CB-CD1 4.45Å; L1609-L1613 WeakPolarHBondContact O-CB 3.48Å; L1609-L1613 VanDerWaalsContact O-CD1 3.31Å; L1609-L1613 WeakPolarHBondContact O-CD1 3.39Å; L1609-L1613 WeakPolarHBondContact O-CG 3.35Å; L1609-L1613 PolarHBondContact O-N 2.84Å; L1609-Y1623 HydrophobicContact CD1-CD1 3.29Å; L1609-Y1623 HydrophobicContact CD1-CE1 3.27Å; L1609-Y1623 HydrophobicContact CD1-CG 4.09Å; L1609-D1624 WeakPolarHBondContact CD2-OD2 3.2Å
1610	N	64	Low	57.9	Low	85 Å²	85	99.7 Å²	99.7	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-62.4	-32.5	-180	-71.9	-17.1	0	0	0	113.2	L1606 S1614	L1606-N1610 VanDerWaalsContact O-CB 3.31Å; L1606-N1610 WeakPolarHBondContact O-CB 3.41Å; L1606-N1610 VanDerWaalsContact O-CG 3.24Å; L1606-N1610 PolarHBondContact O-N 2.75Å; L1606-N1610 PolarHBondContact O-ND2 2.78Å; N1610-S1614 WeakPolarHBondContact O-CB 3.32Å; N1610-S1614 PolarHBondContact O-N 2.77Å
1611	S	57	Low	54.9	Low	70 Å²	70	99 Å²	99	49%	0.49	53%	0.527	S	S	.	.	H	α-helix	trans	-72.9	-39.7	173.3	46.5	0	0	0	0	112.4	S1607 R1608 L1609 L1613 S1614	S1607-S1611 WeakPolarHBondContact O-CB 3.25Å; S1607-S1611 PolarHBondContact O-N 2.97Å; S1607-S1611 VanDerWaalsContact O-N 3.09Å; S1607-S1611 PolarHBondContact O-OG 3.39Å; R1608-S1611 WeakPolarHBondContact CA-OG 3.38Å; R1608-S1611 PolarHBondContact O-N 3.41Å; R1608-S1611 PolarHBondContact O-OG 3.2Å; R1608-S1611 VanDerWaalsContact O-OG 3.05Å; L1609-S1611 VanDerWaalsContact C-N 3.28Å; L1609-S1611 PolarHBondContact O-N 3.03Å; S1611-L1613 VanDerWaalsContact C-N 3.35Å; S1611-L1613 PolarHBondContact O-N 2.87Å; S1611-S1614 PolarHBondContact O-N 2.72Å; S1611-S1614 PolarHBondContact O-OG 2.66Å
1612	A	46.2	Very low	52.3	Low	56 Å²	56	99.6 Å²	99.6	46%	0.463	53%	0.53	S	S	.	.	H	α-helix	trans	-59.6	-44.4	170.4	0	0	0	0	0	112	R1608 L1609 S1614 S1615	R1608-A1612 PolarHBondContact O-N 2.71Å; L1609-A1612 WeakPolarHBondContact O-CB 3.22Å; L1609-A1612 PolarHBondContact O-N 2.78Å; L1609-A1612 VanDerWaalsContact O-N 3.14Å; A1612-S1614 PolarHBondContact O-N 2.76Å; A1612-S1615 WeakPolarHBondContact O-CB 3.24Å; A1612-S1615 PolarHBondContact O-N 3.49Å; A1612-S1615 PolarHBondContact O-OG 3.45Å
1613	L	44.6	Very low	49.8	Very low	57 Å²	57	100.9 Å²	100.9	30%	0.298	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-32.9	180	-68.5	159	0	0	0	112.9	L1609 S1611 S1615 R1616 L1621	L1609-L1613 HydrophobicContact CB-CD1 4.45Å; L1609-L1613 WeakPolarHBondContact O-CB 3.48Å; L1609-L1613 VanDerWaalsContact O-CD1 3.31Å; L1609-L1613 WeakPolarHBondContact O-CD1 3.39Å; L1609-L1613 WeakPolarHBondContact O-CG 3.35Å; L1609-L1613 PolarHBondContact O-N 2.84Å; S1611-L1613 VanDerWaalsContact C-N 3.35Å; S1611-L1613 PolarHBondContact O-N 2.87Å; L1613-S1615 PolarHBondContact O-N 2.92Å; L1613-R1616 CarbonylContact O-C 3.36Å; L1613-R1616 PolarHBondContact O-N 3.13Å; L1613-R1616 VanDerWaalsContact O-O 3.08Å; L1613-L1621 HydrophobicContact CD1-CD1 3.96Å; L1613-L1621 HydrophobicContact CD1-CD2 3.48Å; L1613-L1621 VanDerWaalsContact CD1-CD2 3.48Å; L1613-L1621 HydrophobicContact CD1-CG 3.48Å; L1613-L1621 VanDerWaalsContact CD1-CG 3.48Å; L1613-L1621 HydrophobicContact CD2-CD1 3.89Å; L1613-L1621 HydrophobicContact CD2-CG 3.83Å; L1613-L1621 HydrophobicContact CG-CG 4.31Å
1614	S	42.4	Very low	46.9	Very low	100 Å²	100	101 Å²	101	70%	0.699	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.3	174.5	73.5	0	0	0	0	114.4	N1610 S1611 A1612	N1610-S1614 WeakPolarHBondContact O-CB 3.32Å; N1610-S1614 PolarHBondContact O-N 2.77Å; S1611-S1614 PolarHBondContact O-N 2.72Å; S1611-S1614 PolarHBondContact O-OG 2.66Å; A1612-S1614 PolarHBondContact O-N 2.76Å
1615	S	39	Very low	44.5	Very low	96 Å²	96	99.2 Å²	99.2	67%	0.671	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-5	173.5	76.4	0	0	0	0	114.8	A1612 L1613	A1612-S1615 WeakPolarHBondContact O-CB 3.24Å; A1612-S1615 PolarHBondContact O-N 3.49Å; A1612-S1615 PolarHBondContact O-OG 3.45Å; L1613-S1615 PolarHBondContact O-N 2.92Å
1616	R	31	Very low	42.6	Very low	210 Å²	210	102.1 Å²	102.1	79%	0.792	57%	0.574	S	S	*	*			trans	-140.1	106.9	179.9	-75.7	-174.3	171.1	177.9	-3.5	111.7	L1613	L1613-R1616 CarbonylContact O-C 3.36Å; L1613-R1616 PolarHBondContact O-N 3.13Å; L1613-R1616 VanDerWaalsContact O-O 3.08Å
1617	N	30.1	Very low	40.6	Very low	150 Å²	150	109 Å²	109	80%	0.802	61%	0.611	S	S	*	*			trans	-65.7	161.2	162.2	-71.6	-20.8	0	0	0	110.8
1618	D	31.7	Very low	38.4	Very low	169 Å²	169	118 Å²	118	90%	0.904	64%	0.635	S	S	*	*	S	Bend	trans	64.7	115.5	174.8	-58.5	-22.9	0	0	0	117.9
1619	G	28.5	Very low	36.3	Very low	78 Å²	78	113.6 Å²	113.6	80%	0.804	64%	0.638	S	S	*	*	S	Bend	trans	145.9	-95.9	141.6	0	0	0	0	0	114.2
1620	Q	28.5	Very low	35.1	Very low	164 Å²	164	118.6 Å²	118.6	77%	0.766	67%	0.672	S	S	*	*			trans	-154.9	140.1	-174.3	-104.3	172.1	10.2	0	0	111
1621	L	25.2	Very low	33.5	Very low	93 Å²	93	120.6 Å²	120.6	49%	0.487	69%	0.692	S	S	.	*			trans	-85	126.7	165.8	-81.4	68.5	0	0	0	109.1	L1613	L1613-L1621 HydrophobicContact CD1-CD1 3.96Å; L1613-L1621 HydrophobicContact CD1-CD2 3.48Å; L1613-L1621 VanDerWaalsContact CD1-CD2 3.48Å; L1613-L1621 HydrophobicContact CD1-CG 3.48Å; L1613-L1621 VanDerWaalsContact CD1-CG 3.48Å; L1613-L1621 HydrophobicContact CD2-CD1 3.89Å; L1613-L1621 HydrophobicContact CD2-CG 3.83Å; L1613-L1621 HydrophobicContact CG-CG 4.31Å
1622	Q	26.7	Very low	32.1	Very low	126 Å²	126	127.1 Å²	127.1	59%	0.589	71%	0.706	S	S	*	*			trans	-131.7	144.2	150	-164.9	159	-0	0	0	107.6
1623	Y	27.9	Very low	31.2	Very low	88 Å²	88	131.5 Å²	131.5	35%	0.345	72%	0.717	S	S	.	*			trans	-67.7	159.3	-170.5	-82.1	-115.4	0	0	0	112.5	R1602 L1606 L1609 G1625	R1602-Y1623 PolarHBondContact NH2-OH 2.73Å; L1606-Y1623 VanDerWaalsContact CD2-OH 3.24Å; L1606-Y1623 WeakPolarHBondContact CD2-OH 3.24Å; L1609-Y1623 HydrophobicContact CD1-CD1 3.29Å; L1609-Y1623 HydrophobicContact CD1-CE1 3.27Å; L1609-Y1623 HydrophobicContact CD1-CG 4.09Å; Y1623-G1625 PolarHBondContact O-N 3.4Å
1624	D	26.5	Very low	30.4	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	74%	0.737	S	S	*	*			trans	-50.6	128	-164.4	-67	-68.2	0	0	0	116.6	L1609	L1609-D1624 WeakPolarHBondContact CD2-OD2 3.2Å
1625	G	30	Very low	29.6	Very low	64 Å²	64	139.8 Å²	139.8	66%	0.66	74%	0.739	S	S	*	*			trans	-153.4	141	163.8	0	0	0	0	0	110.5	Y1623	Y1623-G1625 PolarHBondContact O-N 3.4Å
1626	P	35.4	Very low	29.1	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	75%	0.747	S	S	*	*			trans	-104.4	102.2	-167	36.6	-32.4	0	0	0	116.6
1627	N	30.3	Very low	29.1	Very low	154 Å²	154	141.5 Å²	141.5	82%	0.824	75%	0.751	S	S	*	*			trans	59.6	112.4	132.4	-58.1	-46.7	0	0	0	122.7
1628	R	28.4	Very low	29.1	Very low	257 Å²	257	139.4 Å²	139.4	97%	0.97	75%	0.745	S	S	*	*				-152.7	131.5	113.7	-119.9	-176.1	-173.6	-167.2	2	112.4
1629	A	28.1	Very low	28.7	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	74%	0.741	S	S	*	*			trans	-173.7	175	-178.3	0	0	0	0	0	108.4
1630	P	35.9	Very low	28.7	Very low	124 Å²	124	144.3 Å²	144.3	81%	0.805	75%	0.747	S	S	*	*			cis	-133.4	169.2	-45.1	37	-23.1	0	0	0	112.8
1631	S	30.1	Very low	28.8	Very low	126 Å²	126	145 Å²	145	88%	0.881	75%	0.75	S	S	*	*			trans	-157.4	156.9	156.8	52.7	0	0	0	0	112.6
1632	R	27.6	Very low	28.9	Very low	207 Å²	207	148.7 Å²	148.7	78%	0.781	77%	0.77	S	S	*	*			trans	-79.5	-176.1	-165.3	-59.1	173.2	175.7	144.4	-1.4	115.7
1633	E	27.4	Very low	28.9	Very low	148 Å²	148	148.4 Å²	148.4	69%	0.692	78%	0.779	S	S	*	*			trans	101.8	125.9	157.2	-46.6	-39.7	-18.2	0	0	115.1
1634	I	27	Very low	28.9	Very low	139 Å²	139	149.2 Å²	149.2	71%	0.713	79%	0.794	S	S	*	*			cis	-155.2	-172	-5.3	-151.5	-135	0	0	0	112.3
1635	Y	25.9	Very low	28.8	Very low	193 Å²	193	147.7 Å²	147.7	76%	0.757	79%	0.79	S	S	*	*			trans	-72.8	149.1	-178.7	-62	-97.1	0	0	0	116
1636	N	29.5	Very low	28.7	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	78%	0.778	S	S	*	*				174.7	133.8	98.9	-86.7	-54.4	0	0	0	113.7
1637	E	31.4	Very low	28.4	Very low	185 Å²	185	145.8 Å²	145.8	86%	0.864	76%	0.758	S	S	*	*			trans	-80.5	161.6	161	-93.7	172.3	171.8	0	0	109.8
1638	P	28.9	Very low	28.3	Very low	106 Å²	106	141.5 Å²	141.5	69%	0.688	74%	0.744	S	S	*	*				-150.7	178	54.8	43.9	-23.7	0	0	0	118.7
1639	D	24.2	Very low	28.8	Very low	154 Å²	154	133 Å²	133	82%	0.824	71%	0.711	S	S	*	*			trans	45.3	82.7	147.7	-58.6	-22.3	0	0	0	120.2
1640	E	27.6	Very low	29.7	Very low	196 Å²	196	131.5 Å²	131.5	92%	0.916	69%	0.688	S	S	*	*			trans	-157.8	163.1	137.2	-119	168.1	-170.4	0	0	113.3
1641	E	30.2	Very low	30.5	Very low	178 Å²	178	128.2 Å²	128.2	83%	0.832	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-47.3	133.9	-160.2	-55.6	-177.2	125.3	0	0	117.7	P1643	E1641-P1643 WeakPolarHBondContact O-CD 3.32Å
1642	L	27	Very low	32.1	Very low	172 Å²	172	124 Å²	124	90%	0.901	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-62.2	116.6	175.8	-78.2	79.3	0	0	0	112.9
1643	P	27.3	Very low	34.5	Very low	120 Å²	120	114.2 Å²	114.2	78%	0.779	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-80.1	156	166.9	-9	29.7	0	0	0	110.9	E1641	E1641-P1643 WeakPolarHBondContact O-CD 3.32Å
1644	P	27.8	Very low	37.3	Very low	104 Å²	104	109 Å²	109	68%	0.675	57%	0.571	S	S	*	*			trans	-107.5	136.8	-136.3	36.8	-33.7	0	0	0	115.5
1645	V	25.6	Very low	40.2	Very low	102 Å²	102	102.4 Å²	102.4	62%	0.618	54%	0.537	S	S	*	.				15.8	115.7	114.7	-178.5	0	0	0	0	112.5	R1649	V1645-R1649 PolarHBondContact O-NH2 3.45Å
1646	D	26.2	Very low	42.9	Very low	76 Å²	76	94.9 Å²	94.9	41%	0.406	52%	0.518	S	S	.	.				-172.9	-169.4	61.4	-147.3	-25.4	0	0	0	111.3	R1649	D1646-R1649 HydrophobicContact CB-CG 3.48Å; D1646-R1649 VanDerWaalsContact CB-CG 3.48Å; D1646-R1649 IonicContact OD2-NE 2.72Å
1647	L	29.9	Very low	45.3	Very low	71 Å²	71	88.3 Å²	88.3	37%	0.372	49%	0.487	S	S	.	.	S	Bend	trans	-29.4	165.1	144.3	-87.6	51.1	0	0	0	114.6	N1215 I1300 R1649	N1215-L1647 PolarHBondContact ND2-O 3.44Å; N1215-L1647 PolarHBondContact OD1-O 2.9Å; I1300-L1647 HydrophobicContact CD1-CD1 3.83Å; I1300-L1647 HydrophobicContact CD1-CD2 4.1Å; L1647-R1649 PolarHBondContact O-N 3.03Å
1648	A	29.5	Very low	47.8	Very low	64 Å²	64	85.6 Å²	85.6	53%	0.529	48%	0.478	S	S	.	.	S	Bend	trans	-54.4	85.9	147	0	0	0	0	0	108.8	N1215 Q1650	N1215-A1648 HydrophobicContact CB-CB 4.38Å; N1215-A1648 WeakPolarHBondContact O-CB 3.4Å; N1215-A1648 WeakPolarHBondContact OD1-CA 3.27Å; N1215-A1648 PolarHBondContact OD1-N 3.08Å; A1648-Q1650 PolarHBondContact O-N 2.93Å
1649	R	37.3	Very low	50.3	Low	77 Å²	77	80.6 Å²	80.6	29%	0.291	45%	0.445	S	S	.	.			trans	-54.3	116.4	-160	-77.2	-169.7	-173	-146.2	5.4	108.2	V1645 D1646 L1647 I1651	V1645-R1649 PolarHBondContact O-NH2 3.45Å; D1646-R1649 HydrophobicContact CB-CG 3.48Å; D1646-R1649 VanDerWaalsContact CB-CG 3.48Å; D1646-R1649 IonicContact OD2-NE 2.72Å; L1647-R1649 PolarHBondContact O-N 3.03Å; R1649-I1651 HydrophobicContact CB-CG1 4.46Å; R1649-I1651 WeakPolarHBondContact O-CA 3.36Å; R1649-I1651 WeakPolarHBondContact O-CG1 3.43Å; R1649-I1651 PolarHBondContact O-N 2.66Å
1650	Q	46.8	Very low	53.3	Low	64 Å²	64	73.4 Å²	73.4	30%	0.299	41%	0.407	S	S	.	.			trans	-71.6	77.3	171.8	-63.5	162.6	-57.8	0	0	105.8	A1648 L1652 A1846 D1847	A1648-Q1650 PolarHBondContact O-N 2.93Å; Q1650-L1652 PolarHBondContact O-N 3.25Å; Q1650-A1846 HydrophobicContact CB-CB 4.34Å; Q1650-A1846 WeakPolarHBondContact O-CB 3.33Å; Q1650-D1847 VanDerWaalsContact CD-CG 3.41Å; Q1650-D1847 VanDerWaalsContact CD-OD1 3.28Å; Q1650-D1847 PolarHBondContact NE2-OD1 3.04Å; Q1650-D1847 PolarHBondContact NE2-OD2 3.4Å; Q1650-D1847 PolarHBondContact OE1-OD1 2.95Å; Q1650-D1847 PolarHBondContact OE1-OD2 2.72Å
1651	I	52.4	Low	56.2	Low	55 Å²	55	64 Å²	64	28%	0.282	36%	0.363	S	S	.	.			trans	-52.2	112.8	-144.1	-50.9	-179.8	0	0	0	109.2	R1649 I1653 L1858	R1649-I1651 HydrophobicContact CB-CG1 4.46Å; R1649-I1651 WeakPolarHBondContact O-CA 3.36Å; R1649-I1651 WeakPolarHBondContact O-CG1 3.43Å; R1649-I1651 PolarHBondContact O-N 2.66Å; I1651-I1653 VanDerWaalsContact C-N 3.26Å; I1651-I1653 HydrophobicContact CB-CD1 4.25Å; I1651-I1653 HydrophobicContact CG2-CD1 3.6Å; I1651-I1653 HydrophobicContact CG2-CG1 4.41Å; I1651-I1653 WeakPolarHBondContact O-CG1 3.39Å; I1651-I1653 PolarHBondContact O-N 2.79Å; I1651-L1858 HydrophobicContact CD1-CB 4.31Å; I1651-L1858 HydrophobicContact CD1-CD1 3.63Å; I1651-L1858 HydrophobicContact CD1-CG 3.92Å; I1651-L1858 HydrophobicContact CG2-CD1 4.39Å
1652	L	64.5	Low	58.8	Low	38 Å²	38	55.6 Å²	55.6	20%	0.199	32%	0.324	C	S	.	.			trans	-70.5	88.2	-174.9	-63.5	70.3	0	0	0	107.4	Q1650 W1782 C1871	Q1650-L1652 PolarHBondContact O-N 3.25Å; L1652-W1782 HydrophobicContact CD2-CH2 4.15Å; L1652-W1782 HydrophobicContact CD2-CZ2 3.66Å; L1652-W1782 HydrophobicContact CG-CH2 4.17Å; L1652-W1782 HydrophobicContact CG-CZ2 4.18Å; L1652-C1871 HydrophobicContact CB-CB 3.84Å; L1652-C1871 HydrophobicContact CD2-CB 4.5Å; L1652-C1871 PolarHBondContact O-N 3Å
1653	I	79	Confident	61.5	Low	1 Å²	1	47.4 Å²	47.4	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.7	179.8	-62.4	-51.4	0	0	0	108.1	I1651 F1655 Y1661 C1844 I1845 I1857 L1858 I1868 E1869	I1651-I1653 VanDerWaalsContact C-N 3.26Å; I1651-I1653 HydrophobicContact CB-CD1 4.25Å; I1651-I1653 HydrophobicContact CG2-CD1 3.6Å; I1651-I1653 HydrophobicContact CG2-CG1 4.41Å; I1651-I1653 WeakPolarHBondContact O-CG1 3.39Å; I1651-I1653 PolarHBondContact O-N 2.79Å; I1653-F1655 HydrophobicContact CB-CD2 4.31Å; I1653-F1655 HydrophobicContact CB-CE2 3.71Å; I1653-F1655 HydrophobicContact CB-CZ 4.31Å; I1653-F1655 HydrophobicContact CG2-CD2 3.93Å; I1653-F1655 HydrophobicContact CG2-CE2 3.59Å; I1653-F1655 HydrophobicContact CG2-CZ 3.98Å; I1653-F1655 VanDerWaalsContact O-CD2 3.31Å; I1653-F1655 WeakPolarHBondContact O-CD2 3.48Å; I1653-F1655 PolarHBondContact O-N 3.24Å; I1653-Y1661 HydrophobicContact CG2-CE2 3.88Å; I1653-C1844 WeakPolarHBondContact O-CA 3.38Å; I1653-I1845 PolarHBondContact N-O 2.81Å; I1653-I1845 PolarHBondContact O-N 3.22Å; I1653-I1857 HydrophobicContact CB-CG2 4.4Å; I1653-I1857 HydrophobicContact CG1-CG2 3.81Å; I1653-L1858 HydrophobicContact CD1-CD1 4.29Å; I1653-L1858 HydrophobicContact CD1-CD2 3.56Å; I1653-L1858 HydrophobicContact CD1-CG 3.97Å; I1653-L1858 HydrophobicContact CG1-CD2 3.98Å; I1653-L1858 HydrophobicContact CG1-CG 4.49Å; I1653-I1868 HydrophobicContact CD1-CG2 4.22Å; I1653-E1869 WeakPolarHBondContact CA-O 3.11Å
1654	N	86.1	Confident	63.8	Low	39 Å²	39	45.3 Å²	45.3	21%	0.209	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	110	167.2	-174.7	51.1	0	0	0	108	E1869 C1871	N1654-E1869 HydrophobicContact CB-CB 3.82Å; N1654-E1869 PolarHBondContact N-O 3.49Å; N1654-E1869 PolarHBondContact ND2-OE2 3.15Å; N1654-C1871 VanDerWaalsContact CA-SG 3.57Å
1655	F	87.8	Confident	65.7	Low	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.3	171	-68.4	-101.3	0	0	0	107.4	I1653 G1657 Y1661 L1823 F1841 T1842 G1843 I1845 I1857	I1653-F1655 HydrophobicContact CB-CD2 4.31Å; I1653-F1655 HydrophobicContact CB-CE2 3.71Å; I1653-F1655 HydrophobicContact CB-CZ 4.31Å; I1653-F1655 HydrophobicContact CG2-CD2 3.93Å; I1653-F1655 HydrophobicContact CG2-CE2 3.59Å; I1653-F1655 HydrophobicContact CG2-CZ 3.98Å; I1653-F1655 VanDerWaalsContact O-CD2 3.31Å; I1653-F1655 WeakPolarHBondContact O-CD2 3.48Å; I1653-F1655 PolarHBondContact O-N 3.24Å; F1655-G1657 VanDerWaalsContact C-N 3.33Å; F1655-G1657 PolarHBondContact O-N 2.84Å; F1655-Y1661 HydrophobicContact CD1-CD2 4.48Å; F1655-Y1661 AromaticContact CE1-CD2 3.54Å; F1655-Y1661 HydrophobicContact CE1-CD2 3.54Å; F1655-Y1661 AromaticContact CE1-CE2 3.86Å; F1655-Y1661 HydrophobicContact CE1-CE2 3.86Å; F1655-Y1661 AromaticContact CZ-CD2 3.91Å; F1655-Y1661 HydrophobicContact CZ-CD2 3.91Å; F1655-Y1661 HydrophobicContact CZ-CE2 4.02Å; F1655-L1823 HydrophobicContact CE1-CD2 4.43Å; F1655-L1823 HydrophobicContact CE1-CG 4.21Å; F1655-L1823 HydrophobicContact CZ-CD2 3.81Å; F1655-L1823 HydrophobicContact CZ-CG 3.98Å; F1655-F1841 HydrophobicContact CB-CD1 3.89Å; F1655-F1841 HydrophobicContact CD2-CD1 4.39Å; F1655-F1841 HydrophobicContact CG-CD1 4.19Å; F1655-T1842 VanDerWaalsContact O-CA 3.24Å; F1655-T1842 WeakPolarHBondContact O-CA 3.34Å; F1655-T1842 WeakPolarHBondContact O-CG2 3.49Å; F1655-G1843 PolarHBondContact N-O 3.06Å; F1655-G1843 PolarHBondContact O-N 3.34Å; F1655-G1843 VanDerWaalsContact O-N 3.12Å; F1655-I1845 HydrophobicContact CD2-CB 4.26Å; F1655-I1845 HydrophobicContact CD2-CD1 4.01Å; F1655-I1845 HydrophobicContact CD2-CG1 3.83Å; F1655-I1845 HydrophobicContact CE2-CB 3.68Å; F1655-I1845 HydrophobicContact CE2-CD1 3.75Å; F1655-I1845 HydrophobicContact CE2-CG1 3.67Å; F1655-I1845 HydrophobicContact CZ-CB 4.45Å; F1655-I1845 HydrophobicContact CZ-CD1 4.03Å; F1655-I1845 HydrophobicContact CZ-CG1 4.42Å; F1655-I1857 HydrophobicContact CZ-CG2 4.42Å
1656	G	81.1	Confident	67.8	Low	34 Å²	34	39.1 Å²	39.1	35%	0.351	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	12	-174.9	0	0	0	0	0	114.9	L1658 T1659	G1656-L1658 PolarHBondContact O-N 2.81Å; G1656-L1658 VanDerWaalsContact O-N 3.12Å; G1656-T1659 PolarHBondContact N-OG1 2.82Å; G1656-T1659 VanDerWaalsContact N-OG1 3.13Å
1657	G	81.5	Confident	69.8	Low	19 Å²	19	35.6 Å²	35.6	20%	0.196	21%	0.206	C	C	.	.	S	Bend	trans	71.3	-10.5	-165.1	0	0	0	0	0	114.5	F1655 N1840 F1841	F1655-G1657 VanDerWaalsContact C-N 3.33Å; F1655-G1657 PolarHBondContact O-N 2.84Å; G1657-N1840 WeakPolarHBondContact O-CB 3.36Å; G1657-N1840 PolarHBondContact O-ND2 2.8Å; G1657-F1841 WeakPolarHBondContact CA-O 3.33Å; G1657-F1841 PolarHBondContact N-O 3.21Å
1658	L	82.4	Confident	71.3	Confident	128 Å²	128	41 Å²	41	67%	0.67	22%	0.222	S	C	*	.	S	Bend	trans	-103.6	-13.6	167.8	-63.4	178.6	0	0	0	112.6	G1656 G1866	G1656-L1658 PolarHBondContact O-N 2.81Å; G1656-L1658 VanDerWaalsContact O-N 3.12Å; L1658-G1866 WeakPolarHBondContact O-CA 3.32Å
1659	T	83.1	Confident	72.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.			trans	-89.3	125.2	-172.9	-34.1	0	0	0	0	111.4	G1656 Y1661 H1865 P1867	G1656-T1659 PolarHBondContact N-OG1 2.82Å; G1656-T1659 VanDerWaalsContact N-OG1 3.13Å; T1659-Y1661 HydrophobicContact CG2-CD2 4.16Å; T1659-Y1661 HydrophobicContact CG2-CE2 3.54Å; T1659-H1865 CarbonylContact C-O 3.57Å; T1659-H1865 VanDerWaalsContact CA-O 3.24Å; T1659-H1865 WeakPolarHBondContact CA-O 3.37Å; T1659-P1867 WeakPolarHBondContact CG2-O 3.35Å; T1659-P1867 PolarHBondContact OG1-O 2.72Å
1660	V	86.1	Confident	74.3	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	125.3	176.8	-171	0	0	0	0	109.8	Y1822 L1823 H1865	V1660-Y1822 HydrophobicContact CG1-CD1 4.5Å; V1660-L1823 WeakPolarHBondContact CA-O 3.25Å; V1660-H1865 HydrophobicContact CB-CB 4.34Å; V1660-H1865 PolarHBondContact N-O 2.95Å; V1660-H1865 PolarHBondContact O-N 3.24Å
1661	Y	88.3	Confident	75.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	138.8	176.9	-70.7	-113.5	0	0	0	109.4	I1653 F1655 T1659 Y1822 L1823 I1857 L1858 A1861 I1864 I1868	I1653-Y1661 HydrophobicContact CG2-CE2 3.88Å; F1655-Y1661 HydrophobicContact CD1-CD2 4.48Å; F1655-Y1661 AromaticContact CE1-CD2 3.54Å; F1655-Y1661 HydrophobicContact CE1-CD2 3.54Å; F1655-Y1661 AromaticContact CE1-CE2 3.86Å; F1655-Y1661 HydrophobicContact CE1-CE2 3.86Å; F1655-Y1661 AromaticContact CZ-CD2 3.91Å; F1655-Y1661 HydrophobicContact CZ-CD2 3.91Å; F1655-Y1661 HydrophobicContact CZ-CE2 4.02Å; T1659-Y1661 HydrophobicContact CG2-CD2 4.16Å; T1659-Y1661 HydrophobicContact CG2-CE2 3.54Å; Y1661-Y1822 CarbonylContact O-C 3.55Å; Y1661-Y1822 VanDerWaalsContact O-CA 3.29Å; Y1661-Y1822 WeakPolarHBondContact O-CA 3.27Å; Y1661-L1823 PolarHBondContact N-O 3.01Å; Y1661-L1823 PolarHBondContact O-N 2.97Å; Y1661-I1857 WeakPolarHBondContact CD1-O 3.44Å; Y1661-I1857 HydrophobicContact CE1-CG2 4.49Å; Y1661-L1858 HydrophobicContact CE1-CD2 3.51Å; Y1661-L1858 WeakPolarHBondContact OH-CD2 3.42Å; Y1661-A1861 HydrophobicContact CD1-CB 3.74Å; Y1661-I1864 HydrophobicContact CD1-CB 4.43Å; Y1661-I1864 HydrophobicContact CD1-CD1 3.91Å; Y1661-I1864 HydrophobicContact CD1-CG1 3.66Å; Y1661-I1864 HydrophobicContact CD1-CG2 4.08Å; Y1661-I1864 HydrophobicContact CD2-CG2 4.27Å; Y1661-I1864 HydrophobicContact CE1-CB 4.43Å; Y1661-I1864 HydrophobicContact CE1-CD1 3.53Å; Y1661-I1864 HydrophobicContact CE1-CG1 3.75Å; Y1661-I1864 HydrophobicContact CE1-CG2 3.81Å; Y1661-I1864 HydrophobicContact CE2-CG2 4.06Å; Y1661-I1864 HydrophobicContact CG-CG1 4.4Å; Y1661-I1864 HydrophobicContact CG-CG2 4.29Å; Y1661-I1868 WeakPolarHBondContact OH-CG2 3.39Å
1662	T	84.4	Confident	76	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	149.9	173.9	84.7	0	0	0	0	110.6	V1821 Y1822 A1861 T1862 E1863	T1662-V1821 CarbonylContact C-O 3.5Å; T1662-V1821 VanDerWaalsContact CA-O 3.27Å; T1662-V1821 WeakPolarHBondContact CA-O 3.37Å; T1662-Y1822 HydrophobicContact CG2-CD1 3.62Å; T1662-Y1822 HydrophobicContact CG2-CE1 3.57Å; T1662-A1861 CarbonylContact O-C 3.58Å; T1662-A1861 VanDerWaalsContact O-CA 3.24Å; T1662-A1861 WeakPolarHBondContact O-CA 3.34Å; T1662-T1862 PolarHBondContact O-N 2.91Å; T1662-T1862 PolarHBondContact O-OG1 3.33Å; T1662-T1862 VanDerWaalsContact O-OG1 3.13Å; T1662-T1862 PolarHBondContact OG1-OG1 2.76Å; T1662-E1863 HydrophobicContact CG2-CB 3.96Å; T1662-E1863 PolarHBondContact N-O 3.29Å; T1662-E1863 VanDerWaalsContact OG1-CB 3.27Å; T1662-E1863 WeakPolarHBondContact OG1-CB 3.34Å; T1662-E1863 PolarHBondContact OG1-N 2.77Å; T1662-E1863 VanDerWaalsContact OG1-N 3.09Å
1663	Y	84.6	Confident	76.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	132.1	173.9	-48	-103.2	0	0	0	108.3	L1666 V1821 L1823 M1848 I1855 I1857 E1860 A1861 T1862	Y1663-L1666 VanDerWaalsContact CB-CD1 3.46Å; Y1663-L1666 HydrophobicContact CD1-CD1 3.98Å; Y1663-L1666 HydrophobicContact CG-CD1 3.82Å; Y1663-V1821 HydrophobicContact CD2-CB 4.48Å; Y1663-V1821 PolarHBondContact N-O 3.22Å; Y1663-V1821 PolarHBondContact O-N 2.85Å; Y1663-L1823 HydrophobicContact CE2-CB 3.83Å; Y1663-L1823 HydrophobicContact CE2-CD2 4.16Å; Y1663-M1848 HydrophobicContact CE1-CE 3.98Å; Y1663-M1848 HydrophobicContact CE2-CE 3.93Å; Y1663-I1855 HydrophobicContact CD1-CG2 4.09Å; Y1663-I1855 HydrophobicContact CE1-CG2 3.98Å; Y1663-I1857 PolarHBondContact OH-O 3.41Å; Y1663-E1860 HydrophobicContact CD1-CB 4.38Å; Y1663-E1860 VanDerWaalsContact CD1-O 3.25Å; Y1663-E1860 WeakPolarHBondContact CD1-O 3.24Å; Y1663-E1860 HydrophobicContact CE1-CB 4.49Å; Y1663-A1861 HydrophobicContact CD1-CB 4.23Å; Y1663-A1861 HydrophobicContact CE1-CB 3.73Å; Y1663-T1862 WeakPolarHBondContact CA-OG1 3.46Å; Y1663-T1862 PolarHBondContact N-OG1 2.93Å
1664	R	76	Confident	76.9	Confident	76 Å²	76	34.6 Å²	34.6	29%	0.287	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.8	176.9	-56.7	-150.6	167.6	92	7.5	111.5	T1203 L1666 D1820 T1862 E1863	T1203-R1664 HydrophobicContact CG2-CB 4.02Å; T1203-R1664 HydrophobicContact CG2-CG 3.95Å; R1664-L1666 PolarHBondContact O-N 2.83Å; R1664-D1820 WeakPolarHBondContact CD-OD1 3.29Å; R1664-D1820 WeakPolarHBondContact CG-OD1 3.24Å; R1664-D1820 IonicContact CZ-OD2 3.83Å; R1664-D1820 IonicContact NE-OD1 2.75Å; R1664-D1820 PolarHBondContact NE-OD1 3.03Å; R1664-D1820 IonicContact NE-OD2 3.06Å; R1664-D1820 PolarHBondContact NE-OD2 3.15Å; R1664-D1820 IonicContact NH2-OD2 3.32Å; R1664-D1820 PolarHBondContact NH2-OD2 2.7Å; R1664-T1862 HydrophobicContact CB-CG2 4.18Å; R1664-T1862 HydrophobicContact CG-CG2 4.18Å; R1664-T1862 PolarHBondContact N-OG1 2.86Å; R1664-E1863 IonicContact CZ-OE1 3.66Å; R1664-E1863 VanDerWaalsContact CZ-OE1 3.32Å; R1664-E1863 IonicContact NH1-OE1 3.85Å; R1664-E1863 PolarHBondContact NH1-OE1 3.08Å; R1664-E1863 IonicContact NH2-OE1 2.79Å; R1664-E1863 PolarHBondContact NH2-OE1 3.48Å
1665	G	66.4	Low	77	Confident	43 Å²	43	32.9 Å²	32.9	44%	0.443	18%	0.176	S	C	.	.	S	Bend	trans	81.4	1.7	169.3	0	0	0	0	0	117.1	I1667 R1819	G1665-I1667 VanDerWaalsContact C-N 3.27Å; G1665-I1667 PolarHBondContact O-N 3.15Å; G1665-R1819 PolarHBondContact N-O 2.88Å
1666	L	70.3	Confident	77	Confident	33 Å²	33	38.2 Å²	38.2	17%	0.173	20%	0.196	C	C	.	.	S	Bend	trans	-66.5	-23.8	-179.2	-61.2	-172.1	0	0	0	114.3	Y1663 R1664 I1850 I1855	Y1663-L1666 VanDerWaalsContact CB-CD1 3.46Å; Y1663-L1666 HydrophobicContact CD1-CD1 3.98Å; Y1663-L1666 HydrophobicContact CG-CD1 3.82Å; R1664-L1666 PolarHBondContact O-N 2.83Å; L1666-I1850 HydrophobicContact CB-CG2 4.17Å; L1666-I1850 HydrophobicContact CD1-CD1 3.8Å; L1666-I1855 HydrophobicContact CD1-CD1 4.31Å; L1666-I1855 HydrophobicContact CD1-CG1 4.3Å; L1666-I1855 HydrophobicContact CD1-CG2 4.06Å; L1666-I1855 HydrophobicContact CD2-CD1 4.26Å
1667	I	67.8	Low	77.5	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	18%	0.18	C	C	.	.			trans	-136.2	134.2	-179.1	-72.8	165.5	0	0	0	109.5	G1665 F1669 F1673 I1675 M1691 I1850 Q1851	G1665-I1667 VanDerWaalsContact C-N 3.27Å; G1665-I1667 PolarHBondContact O-N 3.15Å; I1667-F1669 WeakPolarHBondContact CG2-O 3.4Å; I1667-F1673 HydrophobicContact CD1-CB 3.9Å; I1667-F1673 HydrophobicContact CG2-CB 4.43Å; I1667-I1675 HydrophobicContact CD1-CD1 4.06Å; I1667-I1675 HydrophobicContact CD1-CG1 4.19Å; I1667-M1691 HydrophobicContact CD1-CE 4.34Å; I1667-M1691 HydrophobicContact CD1-SD 3.3Å; I1667-M1691 WeakPolarHBondContact CD1-SD 3.17Å; I1667-I1850 HydrophobicContact CD1-CG2 3.63Å; I1667-I1850 HydrophobicContact CG1-CG2 3.61Å; I1667-Q1851 HydrophobicContact CG1-CG 4.24Å
1668	R	61.9	Low	77.9	Confident	184 Å²	184	38.8 Å²	38.8	69%	0.694	18%	0.182	S	C	*	.	S	Bend	trans	-83.8	-23.5	-178.6	-65.2	-173	179.8	-162	-1	114.7
1669	F	64	Low	78.4	Confident	69 Å²	69	32.7 Å²	32.7	30%	0.303	15%	0.15	S	C	.	.	B	Isolated β-bridge	trans	-150	130.5	-179.5	-48.7	-84.6	0	0	0	109.5	I1667 S1671 D1672 P1816	I1667-F1669 WeakPolarHBondContact CG2-O 3.4Å; F1669-S1671 PolarHBondContact O-N 2.8Å; F1669-D1672 PolarHBondContact O-N 2.82Å; F1669-D1672 VanDerWaalsContact O-N 3.12Å; F1669-P1816 HydrophobicContact CD1-CB 4.34Å; F1669-P1816 HydrophobicContact CE1-CB 3.71Å; F1669-P1816 HydrophobicContact CZ-CB 3.94Å
1670	T	65.8	Low	78.8	Confident	0 Å²	0	35 Å²	35	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	2	171.9	66.8	0	0	0	0	113.4	F1673 M1691 V1727 R1819	T1670-F1673 VanDerWaalsContact O-CD1 3.29Å; T1670-F1673 WeakPolarHBondContact O-CD1 3.45Å; T1670-F1673 VanDerWaalsContact O-CE1 3.24Å; T1670-F1673 WeakPolarHBondContact O-CE1 3.23Å; T1670-M1691 HydrophobicContact CG2-CB 3.65Å; T1670-M1691 HydrophobicContact CG2-CE 4.32Å; T1670-M1691 HydrophobicContact CG2-SD 4.44Å; T1670-V1727 HydrophobicContact CG2-CG2 4.42Å; T1670-R1819 VanDerWaalsContact N-NH1 3.11Å; T1670-R1819 PolarHBondContact OG1-NH1 2.84Å
1671	S	64.3	Low	79.1	Confident	17 Å²	17	35 Å²	35	12%	0.119	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-21.4	166.3	55.2	0	0	0	0	112.6	F1669 G1789 N1790 K1791	F1669-S1671 PolarHBondContact O-N 2.8Å; S1671-G1789 CarbonylContact O-C 3.53Å; S1671-N1790 PolarHBondContact O-N 3.13Å; S1671-K1791 WeakPolarHBondContact O-CA 3.24Å; S1671-K1791 PolarHBondContact O-N 2.85Å
1672	D	70	Confident	79.3	Confident	46 Å²	46	40.8 Å²	40.8	25%	0.246	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	97.6	-173.1	-151.9	-29.4	0	0	0	111	F1669 G1789	F1669-D1672 PolarHBondContact O-N 2.82Å; F1669-D1672 VanDerWaalsContact O-N 3.12Å; D1672-G1789 CarbonylContact C-O 3.41Å; D1672-G1789 WeakPolarHBondContact CA-O 3.1Å
1673	F	78.9	Confident	79.6	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	153.4	-171.2	64.4	-90.7	0	0	0	113	I1667 T1670 I1675 M1691 V1727 L1740 A1787 M1788 G1789	I1667-F1673 HydrophobicContact CD1-CB 3.9Å; I1667-F1673 HydrophobicContact CG2-CB 4.43Å; T1670-F1673 VanDerWaalsContact O-CD1 3.29Å; T1670-F1673 WeakPolarHBondContact O-CD1 3.45Å; T1670-F1673 VanDerWaalsContact O-CE1 3.24Å; T1670-F1673 WeakPolarHBondContact O-CE1 3.23Å; F1673-I1675 HydrophobicContact CD2-CD1 3.99Å; F1673-I1675 HydrophobicContact CD2-CG1 4.14Å; F1673-M1691 HydrophobicContact CB-CE 4.25Å; F1673-M1691 HydrophobicContact CD1-CE 3.92Å; F1673-M1691 HydrophobicContact CD2-CE 4Å; F1673-M1691 HydrophobicContact CE1-CE 4.22Å; F1673-M1691 HydrophobicContact CE2-CE 4.29Å; F1673-M1691 HydrophobicContact CG-CE 3.81Å; F1673-M1691 HydrophobicContact CZ-CE 4.4Å; F1673-V1727 HydrophobicContact CE1-CG1 4.32Å; F1673-V1727 HydrophobicContact CE1-CG2 4.14Å; F1673-V1727 HydrophobicContact CE2-CG1 4.47Å; F1673-V1727 HydrophobicContact CZ-CG1 3.92Å; F1673-L1740 HydrophobicContact CE1-CD2 4.09Å; F1673-L1740 HydrophobicContact CZ-CD2 4.18Å; F1673-A1787 HydrophobicContact CE2-CB 4.13Å; F1673-M1788 CarbonylContact O-C 3.57Å; F1673-M1788 VanDerWaalsContact O-CA 3.27Å; F1673-M1788 WeakPolarHBondContact O-CA 3.47Å; F1673-G1789 PolarHBondContact N-O 3.19Å; F1673-G1789 PolarHBondContact O-N 2.75Å; F1673-G1789 VanDerWaalsContact O-O 3.12Å
1674	N	84.5	Confident	79.8	Confident	28 Å²	28	50.1 Å²	50.1	15%	0.15	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	116.4	168.8	-180	12.5	0	0	0	107.1	Q1786 I1850 Q1851	N1674-Q1786 PolarHBondContact OD1-NE2 2.93Å; N1674-I1850 CarbonylContact O-C 3.56Å; N1674-I1850 WeakPolarHBondContact O-CA 3.49Å; N1674-Q1851 PolarHBondContact O-N 2.72Å
1675	I	87.5	Confident	80.5	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.5	-173.7	-59.7	173.7	0	0	0	107.6	I1667 F1673 L1689 M1691 I1729 Q1786 A1787 L1849 I1850	I1667-I1675 HydrophobicContact CD1-CD1 4.06Å; I1667-I1675 HydrophobicContact CD1-CG1 4.19Å; F1673-I1675 HydrophobicContact CD2-CD1 3.99Å; F1673-I1675 HydrophobicContact CD2-CG1 4.14Å; I1675-L1689 HydrophobicContact CD1-CD2 3.96Å; I1675-L1689 HydrophobicContact CG2-CD1 4.1Å; I1675-M1691 HydrophobicContact CD1-CE 3.71Å; I1675-M1691 HydrophobicContact CD1-SD 3.68Å; I1675-I1729 HydrophobicContact CG2-CD1 4.46Å; I1675-Q1786 CarbonylContact O-C 3.48Å; I1675-Q1786 WeakPolarHBondContact O-CA 3.49Å; I1675-Q1786 WeakPolarHBondContact O-CG 3.04Å; I1675-A1787 PolarHBondContact N-O 2.71Å; I1675-A1787 PolarHBondContact O-N 3.48Å; I1675-L1849 CarbonylContact C-O 3.55Å; I1675-L1849 WeakPolarHBondContact CA-O 3.1Å; I1675-I1850 HydrophobicContact CG1-CG1 4.34Å; I1675-I1850 HydrophobicContact CG2-CG1 4.34Å
1676	R	88.2	Confident	81.6	Confident	111 Å²	111	45.7 Å²	45.7	42%	0.419	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146	173.9	-177.3	171.2	174.9	-152.3	-4.2	110	M1784 I1785 Q1786 M1848 L1849	R1676-M1784 HydrophobicContact CG-SD 3.87Å; R1676-M1784 PolarHBondContact NE-SD 3.09Å; R1676-I1785 CarbonylContact C-O 3.52Å; R1676-I1785 VanDerWaalsContact CA-O 3.29Å; R1676-I1785 WeakPolarHBondContact CA-O 3.31Å; R1676-Q1786 HydrophobicContact CB-CB 4.17Å; R1676-Q1786 HydrophobicContact CB-CG 4.05Å; R1676-Q1786 HydrophobicContact CG-CB 4.14Å; R1676-Q1786 HydrophobicContact CG-CG 4.44Å; R1676-M1848 CarbonylContact O-C 3.44Å; R1676-M1848 VanDerWaalsContact O-CA 3.3Å; R1676-M1848 WeakPolarHBondContact O-CA 3.34Å; R1676-L1849 HydrophobicContact CB-CB 4.39Å; R1676-L1849 HydrophobicContact CB-CD1 3.98Å; R1676-L1849 HydrophobicContact CG-CD1 4.11Å; R1676-L1849 PolarHBondContact N-O 3.19Å; R1676-L1849 PolarHBondContact O-N 2.87Å
1677	L	92	Very high	82.7	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	164.6	172.4	56.1	82.1	0	0	0	110.8	L1679 I1688 I1785 L1823 I1845	L1677-L1679 HydrophobicContact CD1-CB 4.18Å; L1677-L1679 HydrophobicContact CD1-CD2 4.25Å; L1677-L1679 HydrophobicContact CD1-CG 4.32Å; L1677-I1688 HydrophobicContact CD1-CG2 4.31Å; L1677-I1688 HydrophobicContact CD2-CG2 3.9Å; L1677-I1785 HydrophobicContact CD1-CB 3.94Å; L1677-I1785 HydrophobicContact CD1-CD1 4.16Å; L1677-I1785 HydrophobicContact CD1-CG1 4.33Å; L1677-I1785 HydrophobicContact CG-CB 4.46Å; L1677-I1785 PolarHBondContact N-O 2.7Å; L1677-I1785 PolarHBondContact O-N 2.93Å; L1677-L1823 HydrophobicContact CD2-CD1 4.37Å; L1677-I1845 HydrophobicContact CB-CG2 4.16Å; L1677-I1845 HydrophobicContact CD1-CG2 4.31Å; L1677-I1845 HydrophobicContact CD2-CG2 4.21Å; L1677-I1845 HydrophobicContact CG-CG2 4.47Å
1678	R	90.2	Very high	83.9	Confident	65 Å²	65	44 Å²	44	25%	0.245	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	142.9	161.5	-75	-164	-63.7	-171.1	-9.8	109.1	W1782 H1783 I1845 A1846 D1847	R1678-W1782 HydrophobicContact CB-CE3 3.86Å; R1678-W1782 HydrophobicContact CB-CZ3 4.01Å; R1678-H1783 CarbonylContact C-O 3.56Å; R1678-H1783 VanDerWaalsContact CA-O 3.3Å; R1678-H1783 WeakPolarHBondContact CA-O 3.35Å; R1678-I1845 CarbonylContact O-C 3.43Å; R1678-I1845 WeakPolarHBondContact O-CA 3.49Å; R1678-A1846 HydrophobicContact CB-CB 4.4Å; R1678-A1846 PolarHBondContact N-O 3.44Å; R1678-A1846 PolarHBondContact O-N 3.29Å; R1678-D1847 HydrophobicContact CB-CB 4.15Å; R1678-D1847 HydrophobicContact CG-CB 4Å; R1678-D1847 IonicContact CZ-OD1 3.93Å; R1678-D1847 IonicContact CZ-OD2 3.98Å; R1678-D1847 IonicContact NE-OD1 2.65Å; R1678-D1847 PolarHBondContact NE-OD1 3.1Å; R1678-D1847 IonicContact NE-OD2 3.68Å; R1678-D1847 PolarHBondContact NE-OD2 3.38Å; R1678-D1847 VanDerWaalsContact NE-OD2 3.09Å; R1678-D1847 IonicContact NH2-OD1 2.65Å; R1678-D1847 PolarHBondContact NH2-OD1 2.85Å; R1678-D1847 IonicContact NH2-OD2 2.77Å; R1678-D1847 PolarHBondContact NH2-OD2 3.17Å
1679	L	92.9	Very high	85.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	161.3	168.6	69.9	68.2	0	0	0	113	L1677 T1681 I1688 V1777 W1782 H1783 I1785 F1841 C1844 I1845	L1677-L1679 HydrophobicContact CD1-CB 4.18Å; L1677-L1679 HydrophobicContact CD1-CD2 4.25Å; L1677-L1679 HydrophobicContact CD1-CG 4.32Å; L1679-T1681 HydrophobicContact CD1-CG2 4.06Å; L1679-I1688 HydrophobicContact CD2-CD1 3.6Å; L1679-I1688 HydrophobicContact CD2-CG1 3.81Å; L1679-I1688 HydrophobicContact CD2-CG2 4.04Å; L1679-V1777 HydrophobicContact CD1-CB 4.36Å; L1679-V1777 HydrophobicContact CD1-CG2 4.17Å; L1679-W1782 VanDerWaalsContact C-CE3 3.46Å; L1679-W1782 WeakPolarHBondContact O-CA 3.49Å; L1679-H1783 PolarHBondContact N-O 2.97Å; L1679-H1783 PolarHBondContact O-N 2.87Å; L1679-I1785 HydrophobicContact CD1-CD1 4.42Å; L1679-I1785 HydrophobicContact CD2-CD1 3.4Å; L1679-I1785 VanDerWaalsContact CD2-CD1 3.4Å; L1679-I1785 HydrophobicContact CG-CD1 3.7Å; L1679-F1841 HydrophobicContact CB-CZ 4.15Å; L1679-F1841 HydrophobicContact CD1-CZ 4.47Å; L1679-F1841 HydrophobicContact CD2-CE2 3.89Å; L1679-F1841 HydrophobicContact CD2-CZ 3.98Å; L1679-F1841 HydrophobicContact CG-CZ 4.46Å; L1679-C1844 CarbonylContact C-O 3.58Å; L1679-C1844 WeakPolarHBondContact CA-O 3.09Å; L1679-C1844 WeakPolarHBondContact CB-O 3.39Å; L1679-I1845 HydrophobicContact CB-CG1 4.34Å
1680	R	91.2	Very high	86.6	Confident	47 Å²	47	32 Å²	32	18%	0.177	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	121.4	173.5	-176.5	-177.4	78.7	159	-4	109.5	G1780 E1781 W1782 G1843 C1844 K1872	R1680-G1780 WeakPolarHBondContact CD-O 3.37Å; R1680-G1780 WeakPolarHBondContact CG-O 3.13Å; R1680-E1781 WeakPolarHBondContact CA-O 3.14Å; R1680-E1781 WeakPolarHBondContact CG-O 3.37Å; R1680-W1782 HydrophobicContact CB-CD2 3.84Å; R1680-W1782 HydrophobicContact CB-CE3 3.88Å; R1680-W1782 HydrophobicContact CB-CG 4.39Å; R1680-W1782 HydrophobicContact CB-CH2 4.3Å; R1680-W1782 HydrophobicContact CB-CZ2 4.21Å; R1680-W1782 HydrophobicContact CB-CZ3 4.13Å; R1680-G1843 CarbonylContact O-C 3.56Å; R1680-G1843 WeakPolarHBondContact O-CA 3.27Å; R1680-C1844 HydrophobicContact CB-CB 4.05Å; R1680-C1844 PolarHBondContact N-O 2.88Å; R1680-C1844 PolarHBondContact O-N 3.04Å; R1680-K1872 PolarHBondContact NH2-O 3.43Å
1681	T	92.9	Very high	87.6	Confident	4 Å²	4	32 Å²	32	3%	0.025	15%	0.149	C	C	.	.			trans	-149.4	157.4	-178	-174.4	0	0	0	0	113	L1679 K1683 L1731 V1777 N1778 G1780 F1841 T1842	L1679-T1681 HydrophobicContact CD1-CG2 4.06Å; T1681-K1683 PolarHBondContact OG1-N 2.93Å; T1681-L1731 HydrophobicContact CG2-CD2 3.73Å; T1681-V1777 VanDerWaalsContact CG2-O 3.27Å; T1681-V1777 WeakPolarHBondContact CG2-O 3.44Å; T1681-N1778 CarbonylContact O-C 3.6Å; T1681-N1778 VanDerWaalsContact O-C 3.24Å; T1681-N1778 WeakPolarHBondContact O-CA 3.41Å; T1681-G1780 WeakPolarHBondContact O-CA 3.36Å; T1681-G1780 PolarHBondContact O-N 3.02Å; T1681-F1841 HydrophobicContact CG2-CE2 3.86Å; T1681-F1841 HydrophobicContact CG2-CZ 4.3Å; T1681-T1842 WeakPolarHBondContact CB-O 3.24Å; T1681-T1842 PolarHBondContact OG1-O 3.44Å
1682	N	91.4	Very high	88.2	Confident	121 Å²	121	31.7 Å²	31.7	65%	0.647	15%	0.146	S	C	*	.			trans	-116.5	7.1	169.7	62.7	6.4	0	0	0	112.7
1683	K	91.2	Very high	88	Confident	93 Å²	93	30.2 Å²	30.2	40%	0.404	14%	0.138	S	C	.	.			trans	-82.4	152.7	174	-63.3	-59.5	-172.4	172.7	0	110.8	T1681 L1731 N1778 T1842	T1681-K1683 PolarHBondContact OG1-N 2.93Å; K1683-L1731 HydrophobicContact CB-CD2 4.49Å; K1683-L1731 WeakPolarHBondContact O-CD2 3.25Å; K1683-N1778 VanDerWaalsContact O-CB 3.22Å; K1683-N1778 WeakPolarHBondContact O-CB 3.07Å; K1683-T1842 WeakPolarHBondContact CE-OG1 3.37Å
1684	M	89.5	Confident	86.9	Confident	104 Å²	104	33.9 Å²	33.9	51%	0.512	16%	0.155	S	C	.	.	S	Bend	trans	-86.5	-21.4	170.9	-65.8	-169.8	-63.8	0	0	112.7	R1732 N1733 G1734	M1684-R1732 CarbonylContact O-C 3.58Å; M1684-R1732 VanDerWaalsContact O-C 3.28Å; M1684-R1732 WeakPolarHBondContact O-CA 3.25Å; M1684-N1733 CarbonylContact O-C 3.51Å; M1684-N1733 PolarHBondContact O-N 2.86Å; M1684-G1734 PolarHBondContact O-N 2.78Å
1685	D	89.9	Confident	84.9	Confident	26 Å²	26	35.4 Å²	35.4	14%	0.139	17%	0.165	C	C	.	.			trans	-140.7	152.6	-172.8	-53	-80.6	0	0	0	111.4	L1731 R1732 N1733	D1685-L1731 CarbonylContact C-O 3.59Å; D1685-L1731 VanDerWaalsContact CA-O 3.22Å; D1685-L1731 WeakPolarHBondContact CA-O 3.08Å; D1685-R1732 WeakPolarHBondContact OD1-CA 3.21Å; D1685-R1732 IonicContact OD1-CZ 2.79Å; D1685-R1732 IonicContact OD1-NE 3.88Å; D1685-R1732 IonicContact OD1-NH1 3.3Å; D1685-R1732 PolarHBondContact OD1-NH1 2.78Å; D1685-N1733 PolarHBondContact OD1-N 2.81Å; D1685-N1733 VanDerWaalsContact OD1-N 3.09Å
1686	G	90.4	Very high	82.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.5	138.6	174.6	0	0	0	0	0	115.6	I1688 L1731 Q1839	G1686-I1688 PolarHBondContact O-N 2.82Å; G1686-L1731 PolarHBondContact N-O 2.9Å; G1686-L1731 VanDerWaalsContact N-O 3.07Å; G1686-L1731 WeakPolarHBondContact O-CB 3.34Å; G1686-L1731 PolarHBondContact O-N 3.08Å; G1686-Q1839 CarbonylContact C-O 3.51Å; G1686-Q1839 WeakPolarHBondContact CA-O 3.38Å
1687	I	91.9	Very high	79.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	113.2	177.1	-64.1	167.5	0	0	0	110.5	L1690 L1728 V1730 G1824 G1825 T1826 Y1837 Q1839 F1841	I1687-L1690 HydrophobicContact CG2-CB 4.31Å; I1687-L1728 HydrophobicContact CB-CD1 4.38Å; I1687-L1728 HydrophobicContact CG1-CD1 4.09Å; I1687-L1728 HydrophobicContact CG2-CD1 3.67Å; I1687-V1730 HydrophobicContact CG1-CG2 4.35Å; I1687-G1824 CarbonylContact O-C 3.51Å; I1687-G1824 WeakPolarHBondContact O-CA 3.47Å; I1687-G1825 PolarHBondContact O-N 3.09Å; I1687-T1826 HydrophobicContact CD1-CG2 3.63Å; I1687-Y1837 WeakPolarHBondContact CD1-O 3.36Å; I1687-Y1837 VanDerWaalsContact CG1-O 3.31Å; I1687-Y1837 WeakPolarHBondContact CG1-O 3.48Å; I1687-Q1839 WeakPolarHBondContact CG1-O 3.49Å; I1687-Q1839 PolarHBondContact N-O 3.28Å; I1687-F1841 WeakPolarHBondContact O-CB 3.39Å
1688	I	93.8	Very high	76.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-50.9	177.6	-61.6	158.8	0	0	0	109.6	L1677 L1679 G1686 I1729 L1731 V1736 I1785 L1823 G1824 F1841 I1845	L1677-I1688 HydrophobicContact CD1-CG2 4.31Å; L1677-I1688 HydrophobicContact CD2-CG2 3.9Å; L1679-I1688 HydrophobicContact CD2-CD1 3.6Å; L1679-I1688 HydrophobicContact CD2-CG1 3.81Å; L1679-I1688 HydrophobicContact CD2-CG2 4.04Å; G1686-I1688 PolarHBondContact O-N 2.82Å; I1688-I1729 WeakPolarHBondContact CA-O 3.48Å; I1688-I1729 HydrophobicContact CB-CB 4.4Å; I1688-I1729 HydrophobicContact CB-CG2 4.11Å; I1688-I1729 WeakPolarHBondContact CB-O 3.46Å; I1688-I1729 HydrophobicContact CD1-CG2 4.1Å; I1688-I1729 HydrophobicContact CG2-CG2 4.36Å; I1688-I1729 PolarHBondContact N-O 3.07Å; I1688-L1731 HydrophobicContact CD1-CB 4.29Å; I1688-V1736 HydrophobicContact CD1-CG1 4.29Å; I1688-I1785 HydrophobicContact CD1-CD1 4.02Å; I1688-L1823 WeakPolarHBondContact O-CD1 3.46Å; I1688-G1824 PolarHBondContact O-N 2.77Å; I1688-F1841 HydrophobicContact CG1-CD2 3.96Å; I1688-F1841 HydrophobicContact CG1-CE2 4.29Å; I1688-I1845 HydrophobicContact CG2-CD1 4.3Å
1689	L	92.8	Very high	73.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	139.8	-179.5	-178.5	149.6	0	0	0	111.2	I1675 M1691 L1728 I1729 V1821 Y1822 L1823 M1848	I1675-L1689 HydrophobicContact CD1-CD2 3.96Å; I1675-L1689 HydrophobicContact CG2-CD1 4.1Å; L1689-M1691 HydrophobicContact CD2-CG 3.7Å; L1689-L1728 CarbonylContact O-C 3.54Å; L1689-I1729 HydrophobicContact CB-CB 4.28Å; L1689-I1729 HydrophobicContact CB-CD1 4.31Å; L1689-I1729 HydrophobicContact CB-CG1 4.46Å; L1689-I1729 HydrophobicContact CD2-CD1 4.24Å; L1689-I1729 HydrophobicContact CD2-CG1 4.46Å; L1689-I1729 PolarHBondContact N-O 3.03Å; L1689-I1729 PolarHBondContact O-N 3.33Å; L1689-V1821 HydrophobicContact CD1-CG1 3.84Å; L1689-V1821 HydrophobicContact CD2-CG1 4.01Å; L1689-V1821 HydrophobicContact CG-CG1 3.83Å; L1689-Y1822 CarbonylContact C-O 3.45Å; L1689-Y1822 VanDerWaalsContact CA-O 3.24Å; L1689-Y1822 WeakPolarHBondContact CA-O 3.14Å; L1689-L1823 HydrophobicContact CB-CD1 4.36Å; L1689-L1823 HydrophobicContact CD1-CD1 4.16Å; L1689-M1848 HydrophobicContact CD1-SD 4.38Å
1690	L	89.3	Confident	69.9	Low	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	125.6	179.9	166.1	66.4	0	0	0	109.9	I1687 V1692 I1720 F1726 V1727 L1728 V1821 Y1822 I1830	I1687-L1690 HydrophobicContact CG2-CB 4.31Å; L1690-V1692 HydrophobicContact CD1-CG2 3.88Å; L1690-V1692 HydrophobicContact CD2-CG2 4.11Å; L1690-V1692 HydrophobicContact CG-CG2 3.75Å; L1690-I1720 HydrophobicContact CD2-CD1 3.93Å; L1690-F1726 HydrophobicContact CD1-CB 4.3Å; L1690-F1726 HydrophobicContact CD1-CD2 4.45Å; L1690-V1727 CarbonylContact C-O 3.54Å; L1690-V1727 WeakPolarHBondContact CA-O 3.48Å; L1690-L1728 HydrophobicContact CB-CD1 3.92Å; L1690-L1728 HydrophobicContact CD1-CB 4.24Å; L1690-L1728 HydrophobicContact CD1-CD1 4.13Å; L1690-V1821 CarbonylContact O-C 3.54Å; L1690-V1821 WeakPolarHBondContact O-CA 3.39Å; L1690-Y1822 HydrophobicContact CD2-CD2 4.39Å; L1690-Y1822 HydrophobicContact CG-CD2 4.36Å; L1690-Y1822 PolarHBondContact N-O 2.9Å; L1690-Y1822 PolarHBondContact O-N 3.26Å; L1690-I1830 HydrophobicContact CD1-CD1 4.19Å; L1690-I1830 HydrophobicContact CD2-CD1 4Å
1691	M	86.7	Confident	66.9	Low	1 Å²	1	65.5 Å²	65.5	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.4	172.9	-55	-167.2	-78	0	0	110.2	I1667 T1670 F1673 I1675 L1689 F1726 V1727 D1820 V1821	I1667-M1691 HydrophobicContact CD1-CE 4.34Å; I1667-M1691 HydrophobicContact CD1-SD 3.3Å; I1667-M1691 WeakPolarHBondContact CD1-SD 3.17Å; T1670-M1691 HydrophobicContact CG2-CB 3.65Å; T1670-M1691 HydrophobicContact CG2-CE 4.32Å; T1670-M1691 HydrophobicContact CG2-SD 4.44Å; F1673-M1691 HydrophobicContact CB-CE 4.25Å; F1673-M1691 HydrophobicContact CD1-CE 3.92Å; F1673-M1691 HydrophobicContact CD2-CE 4Å; F1673-M1691 HydrophobicContact CE1-CE 4.22Å; F1673-M1691 HydrophobicContact CE2-CE 4.29Å; F1673-M1691 HydrophobicContact CG-CE 3.81Å; F1673-M1691 HydrophobicContact CZ-CE 4.4Å; I1675-M1691 HydrophobicContact CD1-CE 3.71Å; I1675-M1691 HydrophobicContact CD1-SD 3.68Å; L1689-M1691 HydrophobicContact CD2-CG 3.7Å; M1691-F1726 CarbonylContact O-C 3.57Å; M1691-F1726 WeakPolarHBondContact O-CA 3.2Å; M1691-F1726 VanDerWaalsContact O-CB 3.23Å; M1691-F1726 WeakPolarHBondContact O-CB 3.09Å; M1691-V1727 HydrophobicContact CB-CB 4.41Å; M1691-V1727 HydrophobicContact CE-CB 3.61Å; M1691-V1727 HydrophobicContact CE-CG1 3.68Å; M1691-V1727 HydrophobicContact CE-CG2 4.16Å; M1691-V1727 PolarHBondContact N-O 3.04Å; M1691-V1727 PolarHBondContact O-N 2.87Å; M1691-D1820 CarbonylContact C-O 3.58Å; M1691-D1820 WeakPolarHBondContact CA-O 3.47Å; M1691-V1821 HydrophobicContact CG-CG1 4.27Å; M1691-V1821 HydrophobicContact CG-CG2 4.11Å; M1691-V1821 HydrophobicContact SD-CG2 4.45Å
1692	V	76.7	Confident	63.6	Low	9 Å²	9	73 Å²	73	6%	0.055	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	131.9	-175.2	-169.2	0	0	0	0	111.8	L1690 Q1694 I1720 F1726 R1819 D1820 Y1822	L1690-V1692 HydrophobicContact CD1-CG2 3.88Å; L1690-V1692 HydrophobicContact CD2-CG2 4.11Å; L1690-V1692 HydrophobicContact CG-CG2 3.75Å; V1692-Q1694 PolarHBondContact O-N 3.3Å; V1692-I1720 HydrophobicContact CG1-CD1 4.35Å; V1692-I1720 HydrophobicContact CG1-CG1 4.24Å; V1692-I1720 HydrophobicContact CG1-CG2 4.35Å; V1692-I1720 HydrophobicContact CG2-CD1 3.74Å; V1692-I1720 HydrophobicContact CG2-CG1 4.5Å; V1692-F1726 HydrophobicContact CG2-CB 4.49Å; V1692-R1819 WeakPolarHBondContact O-CA 3.28Å; V1692-R1819 WeakPolarHBondContact O-CB 3.48Å; V1692-D1820 PolarHBondContact N-O 2.9Å; V1692-D1820 PolarHBondContact O-N 2.76Å; V1692-D1820 VanDerWaalsContact O-N 3.08Å; V1692-Y1822 HydrophobicContact CG2-CD2 4.34Å; V1692-Y1822 HydrophobicContact CG2-CE2 4.2Å
1693	E	67.4	Low	60.7	Low	15 Å²	15	75.5 Å²	75.5	7%	0.07	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	110.6	159.6	178.3	176.5	118.8	0	0	109.5	T1695 E1725 R1746 P1817 R1819	E1693-T1695 PolarHBondContact O-N 2.98Å; E1693-E1725 HydrophobicContact CB-CB 4.09Å; E1693-E1725 PolarHBondContact N-O 3.01Å; E1693-R1746 IonicContact OE1-CZ 3.37Å; E1693-R1746 IonicContact OE1-NH1 3.23Å; E1693-R1746 IonicContact OE1-NH2 3.85Å; E1693-R1746 PolarHBondContact OE1-NH2 3Å; E1693-P1817 HydrophobicContact CG-CB 4.26Å; E1693-P1817 HydrophobicContact CG-CG 3.82Å; E1693-P1817 WeakPolarHBondContact OE2-CG 3.43Å; E1693-R1819 HydrophobicContact CB-CG 4.42Å; E1693-R1819 IonicContact OE2-CZ 3.92Å; E1693-R1819 IonicContact OE2-NE 3.89Å; E1693-R1819 IonicContact OE2-NH2 2.78Å; E1693-R1819 PolarHBondContact OE2-NH2 2.94Å
1694	Q	54.7	Low	57.6	Low	83 Å²	83	75.9 Å²	75.9	39%	0.388	41%	0.409	S	S	.	.			trans	-67	103.5	169	-77.4	-149.4	21.1	0	0	110	V1692 S1696 D1820	V1692-Q1694 PolarHBondContact O-N 3.3Å; Q1694-S1696 PolarHBondContact O-N 3.13Å; Q1694-D1820 PolarHBondContact NE2-OD2 3.32Å
1695	T	42	Very low	54.6	Low	60 Å²	60	76.1 Å²	76.1	37%	0.368	42%	0.421	S	S	.	.			trans	-77.9	65.3	165.4	56.2	0	0	0	0	109.9	E1693 L1697	E1693-T1695 PolarHBondContact O-N 2.98Å; T1695-L1697 PolarHBondContact O-N 2.62Å
1696	S	32.3	Very low	51.7	Low	89 Å²	89	79.7 Å²	79.7	62%	0.622	45%	0.448	S	S	*	.			trans	-73.8	105.7	179.4	61.1	0	0	0	0	110.9	Q1694 N1698	Q1694-S1696 PolarHBondContact O-N 3.13Å; S1696-N1698 PolarHBondContact O-N 2.96Å
1697	L	26.9	Very low	48.7	Very low	145 Å²	145	84.9 Å²	84.9	76%	0.759	48%	0.484	S	S	*	.			trans	-67.1	128.3	170.1	-63.5	84.8	0	0	0	109.4	T1695	T1695-L1697 PolarHBondContact O-N 2.62Å
1698	N	25.9	Very low	45.6	Very low	151 Å²	151	89.8 Å²	89.8	81%	0.807	52%	0.518	S	S	*	.			trans	-174.7	83.8	147.2	-96.4	-27.8	0	0	0	112.5	S1696	S1696-N1698 PolarHBondContact O-N 2.96Å
1699	H	25.2	Very low	42.3	Very low	197 Å²	197	95 Å²	95	91%	0.912	56%	0.555	S	S	*	*			trans	-125	107.6	155.1	-97.2	-51.1	0	0	0	108.6
1700	P	25.7	Very low	39.1	Very low	99 Å²	99	99.8 Å²	99.8	64%	0.643	59%	0.588	S	S	*	*			trans	-137.1	56	163.3	38.9	-22.3	0	0	0	112.1
1701	H	27.6	Very low	36	Very low	179 Å²	179	107.7 Å²	107.7	83%	0.829	63%	0.63	S	S	*	*			trans	-132.2	56.7	172.2	-86.2	-62.4	0	0	0	112.2
1702	D	25.5	Very low	33.2	Very low	162 Å²	162	116 Å²	116	87%	0.866	67%	0.672	S	S	*	*	S	Bend	trans	-168.4	87.1	146.6	-107.2	-20.3	0	0	0	109.4
1703	L	29.5	Very low	30.7	Very low	173 Å²	173	122.5 Å²	122.5	91%	0.906	71%	0.706	S	S	*	*			trans	-170.8	120.8	156	-109.6	160.2	0	0	0	110.6
1704	S	25.7	Very low	28.6	Very low	101 Å²	101	129.3 Å²	129.3	71%	0.706	74%	0.743	S	S	*	*			trans	-86.3	169.4	170.1	55.5	0	0	0	0	111.3
1705	S	27.8	Very low	27.3	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	76%	0.76	S	S	*	*			trans	87.1	127.5	166.1	77.2	0	0	0	0	120.4
1706	S	28.2	Very low	26.6	Very low	102 Å²	102	135 Å²	135	71%	0.713	77%	0.774	S	S	*	*			trans	61.1	84.9	147.4	48.8	0	0	0	0	122.1
1707	S	27.1	Very low	26.9	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	77%	0.771	S	S	*	*				87.2	148.9	112.2	81.8	0	0	0	0	122
1708	S	26.3	Very low	27.7	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	76%	0.759	S	S	*	*			trans	80.1	85.9	148.7	-49.5	0	0	0	0	119.8
1709	S	25.1	Very low	29	Very low	111 Å²	111	129.8 Å²	129.8	78%	0.776	74%	0.743	S	S	*	*				96.8	129.8	124.8	-56.7	0	0	0	0	121.7
1710	S	25.1	Very low	30.5	Very low	100 Å²	100	120.9 Å²	120.9	70%	0.699	70%	0.702	S	S	*	*			trans	63.5	100.1	146.4	52.9	0	0	0	0	120.9
1711	L	24.3	Very low	32.1	Very low	165 Å²	165	118.7 Å²	118.7	86%	0.864	69%	0.687	S	S	*	*				56.6	97	119.1	-63.7	163.5	0	0	0	118.5
1712	I	27.7	Very low	33.5	Very low	175 Å²	175	113 Å²	113	90%	0.897	67%	0.665	S	S	*	*				-147.1	151.4	128.1	-99.2	144.4	0	0	0	107.9
1713	L	24	Very low	34.9	Very low	146 Å²	146	110 Å²	110	76%	0.764	65%	0.649	S	S	*	*			trans	-76	149.8	-169.6	-167.2	69.8	0	0	0	112.6	Q1715	L1713-Q1715 PolarHBondContact O-N 3.36Å
1714	N	24.1	Very low	36.5	Very low	159 Å²	159	102 Å²	102	85%	0.85	61%	0.608	S	S	*	*			trans	-52.1	123.6	166.2	-66.1	-20.3	0	0	0	110.5
1715	Q	26.6	Very low	38.7	Very low	158 Å²	158	98.4 Å²	98.4	74%	0.738	58%	0.58	S	S	*	*			trans	-129	138.1	169.4	-70.8	-171.1	-25.4	0	0	109.8	L1713	L1713-Q1715 PolarHBondContact O-N 3.36Å
1716	P	28.5	Very low	41.2	Very low	103 Å²	103	93.4 Å²	93.4	67%	0.669	54%	0.544	S	S	*	.			trans	-66.3	157.1	167.9	30.7	-34.4	0	0	0	110.1	T1718	P1716-T1718 PolarHBondContact O-N 3.19Å; P1716-T1718 VanDerWaalsContact O-N 3.08Å
1717	V	38.1	Very low	43.9	Very low	93 Å²	93	88.6 Å²	88.6	56%	0.564	51%	0.51	S	S	*	.			trans	-64.1	111.9	174.8	179.6	0	0	0	0	108.6	F1828	V1717-F1828 WeakPolarHBondContact O-CD1 3.34Å; V1717-F1828 WeakPolarHBondContact O-CE1 3.27Å
1718	T	44.1	Very low	46.8	Very low	81 Å²	81	83.4 Å²	83.4	50%	0.497	47%	0.474	S	S	.	.			trans	-101.7	-0	-175.2	40.5	0	0	0	0	113.7	P1716 N1829	P1716-T1718 PolarHBondContact O-N 3.19Å; P1716-T1718 VanDerWaalsContact O-N 3.08Å; T1718-N1829 PolarHBondContact O-N 3.44Å
1719	Q	53	Low	50	Low	103 Å²	103	78.6 Å²	78.6	48%	0.481	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.8	-170.1	-64	-176.2	3.5	0	0	111.5	N1829 V1831	Q1719-N1829 WeakPolarHBondContact CA-O 3.46Å; Q1719-V1831 HydrophobicContact CB-CG2 3.96Å; Q1719-V1831 HydrophobicContact CG-CG2 4.24Å
1720	I	57.1	Low	53.2	Low	9 Å²	9	73.3 Å²	73.3	5%	0.046	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.7	167.1	-62.6	161.2	0	0	0	106.7	L1690 V1692 F1726 F1828 N1829 I1830 V1831	L1690-I1720 HydrophobicContact CD2-CD1 3.93Å; V1692-I1720 HydrophobicContact CG1-CD1 4.35Å; V1692-I1720 HydrophobicContact CG1-CG1 4.24Å; V1692-I1720 HydrophobicContact CG1-CG2 4.35Å; V1692-I1720 HydrophobicContact CG2-CD1 3.74Å; V1692-I1720 HydrophobicContact CG2-CG1 4.5Å; I1720-F1726 HydrophobicContact CG2-CD1 4.12Å; I1720-F1828 HydrophobicContact CD1-CB 3.84Å; I1720-F1828 HydrophobicContact CD1-CD2 4.3Å; I1720-F1828 HydrophobicContact CD1-CG 4.44Å; I1720-F1828 HydrophobicContact CG1-CB 3.86Å; I1720-F1828 HydrophobicContact CG1-CG 4.41Å; I1720-N1829 PolarHBondContact N-O 3.14Å; I1720-I1830 HydrophobicContact CB-CG1 4.37Å; I1720-I1830 HydrophobicContact CD1-CG1 4.07Å; I1720-I1830 HydrophobicContact CG2-CG2 4.36Å; I1720-V1831 WeakPolarHBondContact O-CB 3.35Å; I1720-V1831 PolarHBondContact O-N 2.93Å
1721	T	59.3	Low	56.5	Low	54 Å²	54	68.6 Å²	68.6	33%	0.331	37%	0.37	S	S	.	.			trans	-104.9	163.3	-175.6	72.8	0	0	0	0	111.9	N1723 S1724	T1721-N1723 PolarHBondContact O-N 2.81Å; T1721-N1723 PolarHBondContact OG1-N 3.22Å; T1721-S1724 PolarHBondContact N-OG 2.88Å; T1721-S1724 WeakPolarHBondContact O-CB 3.43Å; T1721-S1724 PolarHBondContact O-N 2.84Å; T1721-S1724 PolarHBondContact O-OG 2.9Å; T1721-S1724 PolarHBondContact OG1-OG 2.92Å
1722	T	55.6	Low	59.6	Low	58 Å²	58	62 Å²	62	36%	0.356	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.7	169.3	55.7	0	0	0	0	113.8	N1741 N1766 V1831	T1722-N1741 PolarHBondContact O-ND2 3Å; T1722-N1766 VanDerWaalsContact O-CG 3.31Å; T1722-N1766 PolarHBondContact O-ND2 3Å; T1722-V1831 WeakPolarHBondContact CG2-O 3.27Å
1723	N	56.7	Low	62.5	Low	100 Å²	100	58 Å²	58	54%	0.535	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	3.1	178.8	-60.5	-17.4	0	0	0	113.1	T1721 V1743 N1766	T1721-N1723 PolarHBondContact O-N 2.81Å; T1721-N1723 PolarHBondContact OG1-N 3.22Å; N1723-V1743 WeakPolarHBondContact O-CG2 3.48Å; N1723-N1766 PolarHBondContact OD1-ND2 2.83Å
1724	S	62.1	Low	65.6	Low	6 Å²	6	51.1 Å²	51.1	4%	0.042	28%	0.278	C	S	.	.	S	Bend	trans	-92.4	135.8	173.9	-55.2	0	0	0	0	109.5	T1721 F1726 N1741	T1721-S1724 PolarHBondContact N-OG 2.88Å; T1721-S1724 WeakPolarHBondContact O-CB 3.43Å; T1721-S1724 PolarHBondContact O-N 2.84Å; T1721-S1724 PolarHBondContact O-OG 2.9Å; T1721-S1724 PolarHBondContact OG1-OG 2.92Å; S1724-F1726 WeakPolarHBondContact O-CD1 3.21Å; S1724-F1726 PolarHBondContact O-N 3.21Å; S1724-N1741 PolarHBondContact O-ND2 2.72Å
1725	E	71.3	Confident	68.8	Low	25 Å²	25	47.9 Å²	47.9	12%	0.117	25%	0.254	C	S	.	.			trans	-71.3	125.7	170.8	-66.2	-150.3	143.1	0	0	109.9	E1693 N1741 V1743 R1819	E1693-E1725 HydrophobicContact CB-CB 4.09Å; E1693-E1725 PolarHBondContact N-O 3.01Å; E1725-N1741 WeakPolarHBondContact CA-O 3.48Å; E1725-V1743 HydrophobicContact CG-CB 4.02Å; E1725-V1743 HydrophobicContact CG-CG2 3.82Å; E1725-V1743 PolarHBondContact OE1-N 3.26Å; E1725-R1819 IonicContact OE2-CZ 3.82Å; E1725-R1819 IonicContact OE2-NH1 3.6Å; E1725-R1819 PolarHBondContact OE2-NH1 3.04Å; E1725-R1819 IonicContact OE2-NH2 3.55Å; E1725-R1819 PolarHBondContact OE2-NH2 2.79Å
1726	F	80	Confident	71.9	Confident	3 Å²	3	40.3 Å²	40.3	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	158.2	177.1	69.2	-101.6	0	0	0	112.9	L1690 M1691 V1692 I1720 S1724 L1728 N1741 L1768 I1830	L1690-F1726 HydrophobicContact CD1-CB 4.3Å; L1690-F1726 HydrophobicContact CD1-CD2 4.45Å; M1691-F1726 CarbonylContact O-C 3.57Å; M1691-F1726 WeakPolarHBondContact O-CA 3.2Å; M1691-F1726 VanDerWaalsContact O-CB 3.23Å; M1691-F1726 WeakPolarHBondContact O-CB 3.09Å; V1692-F1726 HydrophobicContact CG2-CB 4.49Å; I1720-F1726 HydrophobicContact CG2-CD1 4.12Å; S1724-F1726 WeakPolarHBondContact O-CD1 3.21Å; S1724-F1726 PolarHBondContact O-N 3.21Å; F1726-L1728 HydrophobicContact CD2-CB 4.4Å; F1726-N1741 HydrophobicContact CD1-CB 3.75Å; F1726-N1741 HydrophobicContact CD2-CB 4.15Å; F1726-N1741 HydrophobicContact CE1-CB 3.53Å; F1726-N1741 HydrophobicContact CE2-CB 3.95Å; F1726-N1741 HydrophobicContact CG-CB 4.05Å; F1726-N1741 HydrophobicContact CZ-CB 3.64Å; F1726-N1741 PolarHBondContact N-O 2.8Å; F1726-N1741 PolarHBondContact O-N 2.67Å; F1726-L1768 HydrophobicContact CE2-CD2 4.08Å; F1726-L1768 HydrophobicContact CZ-CD1 4.41Å; F1726-L1768 HydrophobicContact CZ-CD2 4.01Å; F1726-L1768 HydrophobicContact CZ-CG 4.37Å; F1726-I1830 HydrophobicContact CE1-CG2 4.29Å; F1726-I1830 HydrophobicContact CZ-CG2 4.22Å
1727	V	85.7	Confident	74.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.1	170.4	172	0	0	0	0	108.2	T1670 F1673 L1690 M1691 L1738 L1739 L1740	T1670-V1727 HydrophobicContact CG2-CG2 4.42Å; F1673-V1727 HydrophobicContact CE1-CG1 4.32Å; F1673-V1727 HydrophobicContact CE1-CG2 4.14Å; F1673-V1727 HydrophobicContact CE2-CG1 4.47Å; F1673-V1727 HydrophobicContact CZ-CG1 3.92Å; L1690-V1727 CarbonylContact C-O 3.54Å; L1690-V1727 WeakPolarHBondContact CA-O 3.48Å; M1691-V1727 HydrophobicContact CB-CB 4.41Å; M1691-V1727 HydrophobicContact CE-CB 3.61Å; M1691-V1727 HydrophobicContact CE-CG1 3.68Å; M1691-V1727 HydrophobicContact CE-CG2 4.16Å; M1691-V1727 PolarHBondContact N-O 3.04Å; M1691-V1727 PolarHBondContact O-N 2.87Å; V1727-L1738 HydrophobicContact CG1-CD1 3.56Å; V1727-L1739 CarbonylContact C-O 3.56Å; V1727-L1739 WeakPolarHBondContact CA-O 3.34Å; V1727-L1740 HydrophobicContact CG1-CG 4.39Å; V1727-L1740 HydrophobicContact CG2-CB 4.31Å; V1727-L1740 HydrophobicContact CG2-CD2 3.98Å; V1727-L1740 HydrophobicContact CG2-CG 4Å
1728	L	89	Confident	77.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120	-173.6	174.6	67.6	0	0	0	110	I1687 L1689 L1690 F1726 V1730 L1738 L1739 I1830 L1833	I1687-L1728 HydrophobicContact CB-CD1 4.38Å; I1687-L1728 HydrophobicContact CG1-CD1 4.09Å; I1687-L1728 HydrophobicContact CG2-CD1 3.67Å; L1689-L1728 CarbonylContact O-C 3.54Å; L1690-L1728 HydrophobicContact CB-CD1 3.92Å; L1690-L1728 HydrophobicContact CD1-CB 4.24Å; L1690-L1728 HydrophobicContact CD1-CD1 4.13Å; F1726-L1728 HydrophobicContact CD2-CB 4.4Å; L1728-V1730 HydrophobicContact CD1-CB 4.38Å; L1728-V1730 HydrophobicContact CD2-CB 4.21Å; L1728-V1730 HydrophobicContact CD2-CG1 4.22Å; L1728-V1730 HydrophobicContact CG-CB 4.02Å; L1728-V1730 HydrophobicContact CG-CG1 4.23Å; L1728-L1738 CarbonylContact O-C 3.45Å; L1728-L1738 WeakPolarHBondContact O-CA 3.41Å; L1728-L1739 HydrophobicContact CB-CB 4.31Å; L1728-L1739 HydrophobicContact CD2-CD1 4.14Å; L1728-L1739 PolarHBondContact N-O 3.47Å; L1728-L1739 PolarHBondContact O-N 3.26Å; L1728-I1830 HydrophobicContact CD2-CD1 4.43Å; L1728-L1833 HydrophobicContact CD2-CD1 3.71Å
1729	I	92.8	Very high	79.4	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.8	165.2	-49.8	-179.9	0	0	0	107	I1675 I1688 L1689 V1736 E1737 L1738 A1787	I1675-I1729 HydrophobicContact CG2-CD1 4.46Å; I1688-I1729 WeakPolarHBondContact CA-O 3.48Å; I1688-I1729 HydrophobicContact CB-CB 4.4Å; I1688-I1729 HydrophobicContact CB-CG2 4.11Å; I1688-I1729 WeakPolarHBondContact CB-O 3.46Å; I1688-I1729 HydrophobicContact CD1-CG2 4.1Å; I1688-I1729 HydrophobicContact CG2-CG2 4.36Å; I1688-I1729 PolarHBondContact N-O 3.07Å; L1689-I1729 HydrophobicContact CB-CB 4.28Å; L1689-I1729 HydrophobicContact CB-CD1 4.31Å; L1689-I1729 HydrophobicContact CB-CG1 4.46Å; L1689-I1729 HydrophobicContact CD2-CD1 4.24Å; L1689-I1729 HydrophobicContact CD2-CG1 4.46Å; L1689-I1729 PolarHBondContact N-O 3.03Å; L1689-I1729 PolarHBondContact O-N 3.33Å; I1729-V1736 HydrophobicContact CG2-CG1 3.83Å; I1729-E1737 WeakPolarHBondContact CA-O 3.33Å; I1729-L1738 HydrophobicContact CG1-CD1 3.98Å; I1729-A1787 HydrophobicContact CD1-CB 3.74Å; I1729-A1787 HydrophobicContact CG1-CB 4.46Å
1730	V	93.1	Very high	80.8	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.9	-172.3	63	0	0	0	0	110.3	I1687 L1728 R1732 E1737 Y1837	I1687-V1730 HydrophobicContact CG1-CG2 4.35Å; L1728-V1730 HydrophobicContact CD1-CB 4.38Å; L1728-V1730 HydrophobicContact CD2-CB 4.21Å; L1728-V1730 HydrophobicContact CD2-CG1 4.22Å; L1728-V1730 HydrophobicContact CG-CB 4.02Å; L1728-V1730 HydrophobicContact CG-CG1 4.23Å; V1730-R1732 HydrophobicContact CG1-CG 4.29Å; V1730-R1732 HydrophobicContact CG2-CG 4.38Å; V1730-E1737 HydrophobicContact CG1-CB 3.85Å; V1730-E1737 PolarHBondContact N-O 2.78Å; V1730-E1737 PolarHBondContact O-N 2.99Å; V1730-Y1837 HydrophobicContact CG1-CD1 3.92Å; V1730-Y1837 HydrophobicContact CG1-CE1 3.95Å; V1730-Y1837 HydrophobicContact CG2-CD1 4.19Å
1731	L	92.9	Very high	81.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	132.5	169.5	-168.1	71	0	0	0	108.8	T1681 K1683 D1685 G1686 I1688 R1735 V1777	T1681-L1731 HydrophobicContact CG2-CD2 3.73Å; K1683-L1731 HydrophobicContact CB-CD2 4.49Å; K1683-L1731 WeakPolarHBondContact O-CD2 3.25Å; D1685-L1731 CarbonylContact C-O 3.59Å; D1685-L1731 VanDerWaalsContact CA-O 3.22Å; D1685-L1731 WeakPolarHBondContact CA-O 3.08Å; G1686-L1731 PolarHBondContact N-O 2.9Å; G1686-L1731 VanDerWaalsContact N-O 3.07Å; G1686-L1731 WeakPolarHBondContact O-CB 3.34Å; G1686-L1731 PolarHBondContact O-N 3.08Å; I1688-L1731 HydrophobicContact CD1-CB 4.29Å; L1731-R1735 CarbonylContact C-O 3.53Å; L1731-R1735 WeakPolarHBondContact CA-O 3.41Å; L1731-V1777 HydrophobicContact CD1-CG2 3.29Å
1732	R	90.4	Very high	82	Confident	27 Å²	27	21.3 Å²	21.3	10%	0.102	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	126.1	177.2	-74.4	-67.9	-74	141	-18.4	111.7	M1684 D1685 V1730 G1734 R1735 E1737 D1836 Y1837	M1684-R1732 CarbonylContact O-C 3.58Å; M1684-R1732 VanDerWaalsContact O-C 3.28Å; M1684-R1732 WeakPolarHBondContact O-CA 3.25Å; D1685-R1732 WeakPolarHBondContact OD1-CA 3.21Å; D1685-R1732 IonicContact OD1-CZ 2.79Å; D1685-R1732 IonicContact OD1-NE 3.88Å; D1685-R1732 IonicContact OD1-NH1 3.3Å; D1685-R1732 PolarHBondContact OD1-NH1 2.78Å; V1730-R1732 HydrophobicContact CG1-CG 4.29Å; V1730-R1732 HydrophobicContact CG2-CG 4.38Å; R1732-G1734 PolarHBondContact O-N 2.97Å; R1732-R1735 PolarHBondContact N-O 3.4Å; R1732-R1735 PolarHBondContact O-N 2.82Å; R1732-E1737 HydrophobicContact CB-CG 4.3Å; R1732-E1737 WeakPolarHBondContact CB-OE1 3.34Å; R1732-D1836 VanDerWaalsContact CZ-CB 3.44Å; R1732-D1836 IonicContact CZ-OD2 2.81Å; R1732-D1836 IonicContact NH1-OD2 3.44Å; R1732-D1836 PolarHBondContact NH1-OD2 3.48Å; R1732-D1836 IonicContact NH2-OD2 2.77Å; R1732-D1836 PolarHBondContact NH2-OD2 3.41Å; R1732-Y1837 HydrophobicContact CG-CD1 4.11Å; R1732-Y1837 HydrophobicContact CG-CE1 3.55Å
1733	N	89	Confident	82.1	Confident	92 Å²	92	20 Å²	20	49%	0.492	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	25.4	-174.1	-62.9	-75.1	0	0	0	114	M1684 D1685 K1776	M1684-N1733 CarbonylContact O-C 3.51Å; M1684-N1733 PolarHBondContact O-N 2.86Å; D1685-N1733 PolarHBondContact OD1-N 2.81Å; D1685-N1733 VanDerWaalsContact OD1-N 3.09Å; N1733-K1776 PolarHBondContact O-NZ 2.83Å
1734	G	87.6	Confident	81.7	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	2.4	-176	0	0	0	0	0	116	M1684 R1732 K1776 V1777 N1778	M1684-G1734 PolarHBondContact O-N 2.78Å; R1732-G1734 PolarHBondContact O-N 2.97Å; G1734-K1776 CarbonylContact O-C 3.05Å; G1734-K1776 WeakPolarHBondContact O-CA 3.3Å; G1734-V1777 PolarHBondContact O-N 2.83Å; G1734-N1778 VanDerWaalsContact CA-OD1 3.3Å; G1734-N1778 WeakPolarHBondContact CA-OD1 3.42Å
1735	R	91.4	Very high	80.7	Confident	91 Å²	91	22.3 Å²	22.3	34%	0.343	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	150.4	176.1	-69.4	176.5	167.5	158.7	7.5	111	L1731 R1732 Q1772 A1773 R1774 K1776	L1731-R1735 CarbonylContact C-O 3.53Å; L1731-R1735 WeakPolarHBondContact CA-O 3.41Å; R1732-R1735 PolarHBondContact N-O 3.4Å; R1732-R1735 PolarHBondContact O-N 2.82Å; R1735-Q1772 HydrophobicContact CB-CG 4.09Å; R1735-Q1772 VanDerWaalsContact CD-OE1 3.3Å; R1735-A1773 VanDerWaalsContact CD-O 3.24Å; R1735-A1773 WeakPolarHBondContact CD-O 3.35Å; R1735-A1773 WeakPolarHBondContact CG-O 3.37Å; R1735-R1774 PolarHBondContact NE-O 2.93Å; R1735-R1774 VanDerWaalsContact NE-O 3.07Å; R1735-K1776 HydrophobicContact CG-CG 4.12Å
1736	V	93.2	Very high	79.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	128.3	172.5	-168.9	0	0	0	0	109.5	I1688 I1729 A1773 V1777 I1785 L1796 V1798	I1688-V1736 HydrophobicContact CD1-CG1 4.29Å; I1729-V1736 HydrophobicContact CG2-CG1 3.83Å; V1736-A1773 HydrophobicContact CB-CB 4.27Å; V1736-A1773 PolarHBondContact O-N 2.86Å; V1736-V1777 HydrophobicContact CG2-CG1 4.02Å; V1736-V1777 HydrophobicContact CG2-CG2 3.7Å; V1736-I1785 HydrophobicContact CB-CD1 4.49Å; V1736-I1785 HydrophobicContact CG1-CD1 4.1Å; V1736-I1785 HydrophobicContact CG1-CG2 4.2Å; V1736-I1785 HydrophobicContact CG2-CD1 3.54Å; V1736-I1785 HydrophobicContact CG2-CG1 4.14Å; V1736-L1796 HydrophobicContact CB-CD2 4.19Å; V1736-L1796 HydrophobicContact CG1-CD1 4.07Å; V1736-L1796 HydrophobicContact CG1-CD2 3.97Å; V1736-V1798 HydrophobicContact CB-CG2 3.84Å; V1736-V1798 HydrophobicContact CG2-CG2 3.71Å
1737	E	91	Very high	76.8	Confident	13 Å²	13	36.9 Å²	36.9	6%	0.061	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.6	170.8	-74.1	178	-164.2	0	0	109.6	I1729 V1730 R1732 L1739 I1771 Q1772 Y1837	I1729-E1737 WeakPolarHBondContact CA-O 3.33Å; V1730-E1737 HydrophobicContact CG1-CB 3.85Å; V1730-E1737 PolarHBondContact N-O 2.78Å; V1730-E1737 PolarHBondContact O-N 2.99Å; R1732-E1737 HydrophobicContact CB-CG 4.3Å; R1732-E1737 WeakPolarHBondContact CB-OE1 3.34Å; E1737-L1739 HydrophobicContact CB-CD2 4.46Å; E1737-I1771 WeakPolarHBondContact CA-O 3.48Å; E1737-Q1772 HydrophobicContact CG-CB 3.88Å; E1737-Q1772 HydrophobicContact CG-CG 3.74Å; E1737-Q1772 PolarHBondContact OE1-NE2 2.85Å; E1737-Y1837 WeakPolarHBondContact OE2-CE1 3.35Å; E1737-Y1837 PolarHBondContact OE2-OH 3.47Å
1738	L	90.9	Very high	74.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111	169.4	169.4	67.7	0	0	0	107.6	V1727 L1728 I1729 L1740 I1771 A1787 A1794 L1796	V1727-L1738 HydrophobicContact CG1-CD1 3.56Å; L1728-L1738 CarbonylContact O-C 3.45Å; L1728-L1738 WeakPolarHBondContact O-CA 3.41Å; I1729-L1738 HydrophobicContact CG1-CD1 3.98Å; L1738-L1740 HydrophobicContact CD2-CD1 4.23Å; L1738-L1740 HydrophobicContact CG-CD1 3.92Å; L1738-I1771 HydrophobicContact CB-CB 4.27Å; L1738-I1771 HydrophobicContact CD2-CD1 4.33Å; L1738-I1771 PolarHBondContact N-O 2.87Å; L1738-I1771 PolarHBondContact O-N 3.31Å; L1738-A1787 HydrophobicContact CD1-CB 4.37Å; L1738-A1787 HydrophobicContact CD2-CB 4.23Å; L1738-A1794 HydrophobicContact CD2-CB 4.37Å; L1738-L1796 HydrophobicContact CB-CB 4.43Å; L1738-L1796 HydrophobicContact CB-CD1 4.44Å; L1738-L1796 HydrophobicContact CB-CD2 4.11Å; L1738-L1796 HydrophobicContact CD2-CB 4.28Å
1739	L	86	Confident	71.4	Confident	8 Å²	8	55 Å²	55	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.9	173.5	-47.8	-170.8	0	0	0	109.7	V1727 L1728 E1737 L1768 M1769 P1770 L1833 Y1837	V1727-L1739 CarbonylContact C-O 3.56Å; V1727-L1739 WeakPolarHBondContact CA-O 3.34Å; L1728-L1739 HydrophobicContact CB-CB 4.31Å; L1728-L1739 HydrophobicContact CD2-CD1 4.14Å; L1728-L1739 PolarHBondContact N-O 3.47Å; L1728-L1739 PolarHBondContact O-N 3.26Å; E1737-L1739 HydrophobicContact CB-CD2 4.46Å; L1739-L1768 HydrophobicContact CB-CD2 3.93Å; L1739-L1768 HydrophobicContact CD1-CD2 4.22Å; L1739-M1769 WeakPolarHBondContact CA-O 3.41Å; L1739-P1770 HydrophobicContact CD2-CB 3.64Å; L1739-L1833 HydrophobicContact CD1-CD1 4.33Å; L1739-L1833 HydrophobicContact CD1-CD2 3.98Å; L1739-Y1837 HydrophobicContact CD1-CD1 4.13Å; L1739-Y1837 HydrophobicContact CD1-CE1 3.93Å
1740	L	80.9	Confident	68.3	Low	4 Å²	4	62.2 Å²	62.2	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.1	169.6	-57	93.3	0	0	0	110.3	F1673 V1727 L1738 L1768 M1769 I1771 A1794	F1673-L1740 HydrophobicContact CE1-CD2 4.09Å; F1673-L1740 HydrophobicContact CZ-CD2 4.18Å; V1727-L1740 HydrophobicContact CG1-CG 4.39Å; V1727-L1740 HydrophobicContact CG2-CB 4.31Å; V1727-L1740 HydrophobicContact CG2-CD2 3.98Å; V1727-L1740 HydrophobicContact CG2-CG 4Å; L1738-L1740 HydrophobicContact CD2-CD1 4.23Å; L1738-L1740 HydrophobicContact CG-CD1 3.92Å; L1740-L1768 WeakPolarHBondContact O-CA 3.43Å; L1740-M1769 HydrophobicContact CB-CB 4.43Å; L1740-M1769 HydrophobicContact CD1-SD 4.35Å; L1740-M1769 PolarHBondContact N-O 2.87Å; L1740-M1769 PolarHBondContact O-N 2.97Å; L1740-I1771 HydrophobicContact CD1-CD1 4.38Å; L1740-A1794 HydrophobicContact CD1-CB 3.73Å; L1740-A1794 HydrophobicContact CD2-CB 3.86Å; L1740-A1794 HydrophobicContact CG-CB 4.49Å
1741	N	75	Confident	65.4	Low	2 Å²	2	71.6 Å²	71.6	1%	0.011	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	111.9	169	-171	56.2	0	0	0	108.9	T1722 S1724 E1725 F1726 L1768	T1722-N1741 PolarHBondContact O-ND2 3Å; S1724-N1741 PolarHBondContact O-ND2 2.72Å; E1725-N1741 WeakPolarHBondContact CA-O 3.48Å; F1726-N1741 HydrophobicContact CD1-CB 3.75Å; F1726-N1741 HydrophobicContact CD2-CB 4.15Å; F1726-N1741 HydrophobicContact CE1-CB 3.53Å; F1726-N1741 HydrophobicContact CE2-CB 3.95Å; F1726-N1741 HydrophobicContact CG-CB 4.05Å; F1726-N1741 HydrophobicContact CZ-CB 3.64Å; F1726-N1741 PolarHBondContact N-O 2.8Å; F1726-N1741 PolarHBondContact O-N 2.67Å; N1741-L1768 HydrophobicContact CB-CD2 4.38Å; N1741-L1768 HydrophobicContact CB-CG 4.32Å
1742	L	66.9	Low	62.2	Low	16 Å²	16	76.6 Å²	76.6	8%	0.084	37%	0.374	C	S	.	.			trans	-123	136.6	-175.6	-58.8	176.1	0	0	0	109.4	T1744 F1807 V1810	L1742-T1744 PolarHBondContact O-N 3.42Å; L1742-F1807 HydrophobicContact CD1-CD1 4Å; L1742-F1807 HydrophobicContact CD1-CE1 3.41Å; L1742-F1807 VanDerWaalsContact CD1-CE1 3.41Å; L1742-F1807 HydrophobicContact CD1-CE2 4.26Å; L1742-F1807 HydrophobicContact CD1-CZ 3.55Å; L1742-V1810 HydrophobicContact CB-CG2 4.3Å; L1742-V1810 HydrophobicContact CD1-CG2 4.15Å
1743	V	58.1	Low	59.2	Low	31 Å²	31	87 Å²	87	19%	0.188	41%	0.414	C	S	.	.			trans	-98.8	92.6	-166.4	176.4	0	0	0	0	110.6	N1723 E1725 S1745	N1723-V1743 WeakPolarHBondContact O-CG2 3.48Å; E1725-V1743 HydrophobicContact CG-CB 4.02Å; E1725-V1743 HydrophobicContact CG-CG2 3.82Å; E1725-V1743 PolarHBondContact OE1-N 3.26Å; V1743-S1745 PolarHBondContact O-N 2.99Å
1744	T	48.5	Very low	56.3	Low	76 Å²	76	89.8 Å²	89.8	47%	0.466	43%	0.428	S	S	.	.			trans	-71.4	110.2	174.4	52.7	0	0	0	0	111	L1742 V1810	L1742-T1744 PolarHBondContact O-N 3.42Å; T1744-V1810 HydrophobicContact CG2-CG2 4.48Å
1745	S	41.5	Very low	53.5	Low	78 Å²	78	96.4 Å²	96.4	55%	0.545	47%	0.469	S	S	.	.			trans	83.5	103.8	176	175	0	0	0	0	117.9	V1743	V1743-S1745 PolarHBondContact O-N 2.99Å
1746	R	40	Very low	50.4	Low	142 Å²	142	98.9 Å²	98.9	54%	0.536	49%	0.489	S	S	.	.			trans	-104	105.6	144.2	-64.8	-172.6	-168	156.3	14.4	108.6	E1693 K1748	E1693-R1746 IonicContact OE1-CZ 3.37Å; E1693-R1746 IonicContact OE1-NH1 3.23Å; E1693-R1746 IonicContact OE1-NH2 3.85Å; E1693-R1746 PolarHBondContact OE1-NH2 3Å; R1746-K1748 PolarHBondContact O-N 3.5Å
1747	K	30.1	Very low	47.4	Very low	192 Å²	192	106.6 Å²	106.6	84%	0.835	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-63.2	123	172.5	-73.5	-174	177.1	-178.5	0	109.2	K1749	K1747-K1749 PolarHBondContact O-N 2.8Å
1748	K	31.1	Very low	44.4	Very low	194 Å²	194	113.1 Å²	113.1	84%	0.843	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-61	132.6	167.8	-83.3	-170.9	173.8	-177	0	109.1	R1746	R1746-K1748 PolarHBondContact O-N 3.5Å
1749	K	28.8	Very low	41.6	Very low	186 Å²	186	121 Å²	121	81%	0.809	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-67.2	163.7	153.4	-72.5	-177.1	174.8	-178.9	0	108.6	K1747	K1747-K1749 PolarHBondContact O-N 2.8Å
1750	D	29	Very low	38.9	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	65%	0.648	S	S	*	*			trans	79	58.1	172.8	-47.5	-18.7	0	0	0	116.4
1751	Q	31.8	Very low	36.3	Very low	197 Å²	197	131.7 Å²	131.7	92%	0.921	68%	0.681	S	S	*	*				-162.3	135.5	113.4	-102.4	165.2	22.5	0	0	109.9
1752	S	25.4	Very low	34.1	Very low	104 Å²	104	138 Å²	138	73%	0.727	71%	0.714	S	S	*	*			trans	-89.3	153.9	172.1	55.3	0	0	0	0	110.9
1753	W	27.4	Very low	32.1	Very low	247 Å²	247	142 Å²	142	94%	0.936	74%	0.742	S	S	*	*			trans	-166	142.7	131.1	-96.6	15.6	0	0	0	107.9
1754	D	26.8	Very low	30.9	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	76%	0.76	S	S	*	*			trans	-78.2	136.3	-172.4	-53.8	-88.5	0	0	0	113
1755	V	29.4	Very low	30.5	Very low	139 Å²	139	150.8 Å²	150.8	84%	0.842	77%	0.77	S	S	*	*			trans	-143.9	127.5	130.1	175.4	0	0	0	0	107.9
1756	N	26.4	Very low	30.5	Very low	143 Å²	143	149.5 Å²	149.5	77%	0.765	76%	0.756	S	S	*	*			trans	-67.9	133.8	171.1	-65.7	-66.5	0	0	0	110.9
1757	N	30.4	Very low	31.2	Very low	161 Å²	161	151.3 Å²	151.3	86%	0.861	76%	0.763	S	S	*	*			trans	-157.9	139.8	135.1	-101.9	-29.7	0	0	0	110.9
1758	N	28.4	Very low	32.8	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	74%	0.739	S	S	*	*			trans	-82.5	128.8	173.7	-58.1	-60.2	0	0	0	108.8
1759	D	32.6	Very low	34.6	Very low	166 Å²	166	137.6 Å²	137.6	89%	0.888	71%	0.707	S	S	*	*			trans	-143.2	127	153.2	-118.9	-34	0	0	0	109.5	G1761	D1759-G1761 PolarHBondContact O-N 2.98Å
1760	N	28.4	Very low	36.9	Very low	167 Å²	167	133 Å²	133	89%	0.893	70%	0.697	S	S	*	*			trans	-92.7	96	-170.3	-70.2	-59	0	0	0	110.3
1761	G	27.2	Very low	39.4	Very low	70 Å²	70	126 Å²	126	72%	0.722	66%	0.659	S	S	*	*			trans	-125.9	134.2	174.6	0	0	0	0	0	112	D1759	D1759-G1761 PolarHBondContact O-N 2.98Å
1762	N	27.4	Very low	42	Very low	133 Å²	133	120.1 Å²	120.1	71%	0.711	63%	0.631	S	S	*	*			trans	-53.8	141	-172.3	-96.4	-15.2	0	0	0	114.2	E1764	N1762-E1764 VanDerWaalsContact C-N 3.32Å; N1762-E1764 PolarHBondContact O-N 3.39Å
1763	P	26.4	Very low	44.8	Very low	101 Å²	101	115.2 Å²	115.2	66%	0.656	60%	0.597	S	S	*	*			trans	-77.2	81.8	169.4	33.3	-33.5	0	0	0	109.6	Y1765	P1763-Y1765 VanDerWaalsContact C-N 3.29Å; P1763-Y1765 PolarHBondContact O-N 3.12Å
1764	E	33	Very low	47.3	Very low	123 Å²	123	113.5 Å²	113.5	58%	0.575	59%	0.59	S	S	*	*			trans	-78.8	72.2	-166.2	-155	-177.8	-103.3	0	0	115	N1762 R1767	N1762-E1764 VanDerWaalsContact C-N 3.32Å; N1762-E1764 PolarHBondContact O-N 3.39Å; E1764-R1767 IonicContact OE2-CZ 2.65Å; E1764-R1767 IonicContact OE2-NE 3.56Å; E1764-R1767 IonicContact OE2-NH2 3.88Å; E1764-R1767 PolarHBondContact OE2-NH2 3.1Å
1765	Y	38.7	Very low	49.9	Very low	169 Å²	169	109.6 Å²	109.6	66%	0.663	57%	0.567	S	S	*	*			trans	44.6	135.2	143.3	-56.8	-74.3	0	0	0	121	P1763 R1767	P1763-Y1765 VanDerWaalsContact C-N 3.29Å; P1763-Y1765 PolarHBondContact O-N 3.12Å; Y1765-R1767 WeakPolarHBondContact O-CG 3.14Å; Y1765-R1767 PolarHBondContact O-N 3.13Å
1766	N	42.7	Very low	52.6	Low	50 Å²	50	107.6 Å²	107.6	27%	0.267	55%	0.547	S	S	.	.			trans	-44.2	108.8	167.6	-52.4	-41.9	0	0	0	111.2	T1722 N1723 L1768	T1722-N1766 VanDerWaalsContact O-CG 3.31Å; T1722-N1766 PolarHBondContact O-ND2 3Å; N1723-N1766 PolarHBondContact OD1-ND2 2.83Å; N1766-L1768 PolarHBondContact O-N 3.42Å; N1766-L1768 VanDerWaalsContact O-N 3.13Å
1767	R	53.9	Low	55.6	Low	181 Å²	181	100.8 Å²	100.8	68%	0.683	51%	0.511	S	S	*	.			trans	-86.1	88	-175.5	-69.4	-168.2	175	-166.5	-0.7	110.9	E1764 Y1765 M1769	E1764-R1767 IonicContact OE2-CZ 2.65Å; E1764-R1767 IonicContact OE2-NE 3.56Å; E1764-R1767 IonicContact OE2-NH2 3.88Å; E1764-R1767 PolarHBondContact OE2-NH2 3.1Å; Y1765-R1767 WeakPolarHBondContact O-CG 3.14Å; Y1765-R1767 PolarHBondContact O-N 3.13Å; R1767-M1769 PolarHBondContact O-N 2.9Å
1768	L	63.4	Low	58.4	Low	64 Å²	64	94.9 Å²	94.9	34%	0.335	48%	0.479	S	S	.	.			trans	-57	115.8	164.7	-112.4	167.2	0	0	0	109.5	F1726 L1739 L1740 N1741 N1766 P1770 L1833	F1726-L1768 HydrophobicContact CE2-CD2 4.08Å; F1726-L1768 HydrophobicContact CZ-CD1 4.41Å; F1726-L1768 HydrophobicContact CZ-CD2 4.01Å; F1726-L1768 HydrophobicContact CZ-CG 4.37Å; L1739-L1768 HydrophobicContact CB-CD2 3.93Å; L1739-L1768 HydrophobicContact CD1-CD2 4.22Å; L1740-L1768 WeakPolarHBondContact O-CA 3.43Å; N1741-L1768 HydrophobicContact CB-CD2 4.38Å; N1741-L1768 HydrophobicContact CB-CG 4.32Å; N1766-L1768 PolarHBondContact O-N 3.42Å; N1766-L1768 VanDerWaalsContact O-N 3.13Å; L1768-P1770 WeakPolarHBondContact O-CD 3.48Å; L1768-L1833 HydrophobicContact CD1-CD2 3.92Å
1769	M	69.1	Low	61.3	Low	33 Å²	33	92.6 Å²	92.6	16%	0.163	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.7	-170.9	-179.1	-171.6	176.8	0	0	110.9	L1739 L1740 R1767 I1771 G1805 E1806 F1807	L1739-M1769 WeakPolarHBondContact CA-O 3.41Å; L1740-M1769 HydrophobicContact CB-CB 4.43Å; L1740-M1769 HydrophobicContact CD1-SD 4.35Å; L1740-M1769 PolarHBondContact N-O 2.87Å; L1740-M1769 PolarHBondContact O-N 2.97Å; R1767-M1769 PolarHBondContact O-N 2.9Å; M1769-I1771 HydrophobicContact CE-CD1 4.03Å; M1769-I1771 HydrophobicContact CE-CG1 4.27Å; M1769-G1805 WeakPolarHBondContact CE-O 3.22Å; M1769-E1806 WeakPolarHBondContact CE-O 3.38Å; M1769-F1807 HydrophobicContact SD-CB 4.16Å; M1769-F1807 HydrophobicContact SD-CD1 4.29Å
1770	P	77.6	Confident	63.8	Low	91 Å²	91	85.9 Å²	85.9	59%	0.591	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.5	177.7	32.8	-33	0	0	0	113	L1739 L1768	L1739-P1770 HydrophobicContact CD2-CB 3.64Å; L1768-P1770 WeakPolarHBondContact O-CD 3.48Å
1771	I	82	Confident	66.6	Low	8 Å²	8	83.3 Å²	83.3	4%	0.041	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	104.7	168.1	-62.2	176.8	0	0	0	107.8	E1737 L1738 L1740 M1769 A1794 L1796 V1803	E1737-I1771 WeakPolarHBondContact CA-O 3.48Å; L1738-I1771 HydrophobicContact CB-CB 4.27Å; L1738-I1771 HydrophobicContact CD2-CD1 4.33Å; L1738-I1771 PolarHBondContact N-O 2.87Å; L1738-I1771 PolarHBondContact O-N 3.31Å; L1740-I1771 HydrophobicContact CD1-CD1 4.38Å; M1769-I1771 HydrophobicContact CE-CD1 4.03Å; M1769-I1771 HydrophobicContact CE-CG1 4.27Å; I1771-A1794 HydrophobicContact CD1-CB 3.67Å; I1771-L1796 HydrophobicContact CG2-CB 3.9Å; I1771-V1803 HydrophobicContact CG2-CB 3.93Å; I1771-V1803 HydrophobicContact CG2-CG1 3.77Å; I1771-V1803 WeakPolarHBondContact CG2-O 3.09Å
1772	Q	86.4	Confident	69.5	Low	72 Å²	72	82.9 Å²	82.9	34%	0.336	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.7	-179.7	-172.7	-175.4	87.3	0	0	111.6	R1735 E1737	R1735-Q1772 HydrophobicContact CB-CG 4.09Å; R1735-Q1772 VanDerWaalsContact CD-OE1 3.3Å; E1737-Q1772 HydrophobicContact CG-CB 3.88Å; E1737-Q1772 HydrophobicContact CG-CG 3.74Å; E1737-Q1772 PolarHBondContact OE1-NE2 2.85Å
1773	A	83.7	Confident	72.5	Confident	1 Å²	1	77 Å²	77	1%	0.008	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	137.9	168.8	0	0	0	0	0	111.4	R1735 V1736 L1796 V1798	R1735-A1773 VanDerWaalsContact CD-O 3.24Å; R1735-A1773 WeakPolarHBondContact CD-O 3.35Å; R1735-A1773 WeakPolarHBondContact CG-O 3.37Å; V1736-A1773 HydrophobicContact CB-CB 4.27Å; V1736-A1773 PolarHBondContact O-N 2.86Å; A1773-L1796 HydrophobicContact CB-CD2 4.12Å; A1773-V1798 HydrophobicContact CB-CB 4.08Å; A1773-V1798 HydrophobicContact CB-CG2 3.44Å; A1773-V1798 VanDerWaalsContact CB-CG2 3.44Å
1774	R	80	Confident	75.5	Confident	211 Å²	211	73.9 Å²	73.9	80%	0.796	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	-34.3	179.2	-66	-176.5	-179.5	-178.4	1.1	112.9	R1735	R1735-R1774 PolarHBondContact NE-O 2.93Å; R1735-R1774 VanDerWaalsContact NE-O 3.07Å
1775	H	80.7	Confident	78.3	Confident	68 Å²	68	68.1 Å²	68.1	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	146.3	-179.2	-161.6	59	0	0	0	110.9	H1783 V1798 D1799 H1801	H1775-H1783 AromaticContact CD2-CE1 3.93Å; H1775-H1783 AromaticContact CD2-ND1 3.89Å; H1775-H1783 AromaticContact NE2-CE1 3.6Å; H1775-H1783 AromaticContact NE2-ND1 3.9Å; H1775-V1798 HydrophobicContact CB-CG1 4.36Å; H1775-D1799 IonicContact CD2-OD2 3.16Å; H1775-D1799 IonicContact NE2-OD2 3.1Å; H1775-H1801 AromaticContact CG-CE1 3.89Å; H1775-H1801 AromaticContact CG-ND1 3.87Å; H1775-H1801 AromaticContact ND1-CE1 3.8Å
1776	K	86.3	Confident	80.8	Confident	98 Å²	98	61.4 Å²	61.4	43%	0.426	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	145.9	172	-82.8	175.1	165.7	-99.7	0	108.7	N1733 G1734 R1735 N1778	N1733-K1776 PolarHBondContact O-NZ 2.83Å; G1734-K1776 CarbonylContact O-C 3.05Å; G1734-K1776 WeakPolarHBondContact O-CA 3.3Å; R1735-K1776 HydrophobicContact CG-CG 4.12Å; K1776-N1778 WeakPolarHBondContact CD-OD1 3.49Å; K1776-N1778 PolarHBondContact NZ-OD1 2.95Å
1777	V	89.6	Confident	83	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.277	C	S	.	.			trans	-123.6	24.9	-179.6	-55.2	0	0	0	0	112.3	L1679 T1681 L1731 G1734 V1736 H1783 V1798	L1679-V1777 HydrophobicContact CD1-CB 4.36Å; L1679-V1777 HydrophobicContact CD1-CG2 4.17Å; T1681-V1777 VanDerWaalsContact CG2-O 3.27Å; T1681-V1777 WeakPolarHBondContact CG2-O 3.44Å; L1731-V1777 HydrophobicContact CD1-CG2 3.29Å; G1734-V1777 PolarHBondContact O-N 2.83Å; V1736-V1777 HydrophobicContact CG2-CG1 4.02Å; V1736-V1777 HydrophobicContact CG2-CG2 3.7Å; V1777-H1783 VanDerWaalsContact CA-CD2 3.49Å; V1777-H1783 WeakPolarHBondContact CA-CD2 3.43Å; V1777-H1783 WeakPolarHBondContact CA-NE2 3.49Å; V1777-H1783 HydrophobicContact CB-CB 3.97Å; V1777-H1783 VanDerWaalsContact CB-CD2 3.49Å; V1777-H1783 WeakPolarHBondContact CB-CD2 3.38Å; V1777-H1783 HydrophobicContact CG1-CB 3.73Å; V1777-H1783 VanDerWaalsContact CG1-CG 3.49Å; V1777-V1798 HydrophobicContact CG1-CG1 3.38Å
1778	N	90.2	Very high	84.4	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.193	25%	0.251	C	S	.	.			trans	-113.1	9.8	-169.2	81.5	-99.9	0	0	0	114.1	T1681 K1683 G1734 K1776 G1780	T1681-N1778 CarbonylContact O-C 3.6Å; T1681-N1778 VanDerWaalsContact O-C 3.24Å; T1681-N1778 WeakPolarHBondContact O-CA 3.41Å; K1683-N1778 VanDerWaalsContact O-CB 3.22Å; K1683-N1778 WeakPolarHBondContact O-CB 3.07Å; G1734-N1778 VanDerWaalsContact CA-OD1 3.3Å; G1734-N1778 WeakPolarHBondContact CA-OD1 3.42Å; K1776-N1778 WeakPolarHBondContact CD-OD1 3.49Å; K1776-N1778 PolarHBondContact NZ-OD1 2.95Å; N1778-G1780 VanDerWaalsContact C-N 3.32Å
1779	D	89	Confident	84.9	Confident	103 Å²	103	48.9 Å²	48.9	55%	0.551	24%	0.237	S	C	*	.	S	Bend	trans	-75.2	-21.8	-178.9	49.6	18.2	0	0	0	113.1	E1781 H1783	D1779-E1781 WeakPolarHBondContact OD1-CB 3.44Å; D1779-E1781 PolarHBondContact OD1-N 3.08Å; D1779-H1783 IonicContact OD1-NE2 3.43Å; D1779-H1783 PolarHBondContact OD1-NE2 3.33Å; D1779-H1783 VanDerWaalsContact OD1-NE2 3.16Å; D1779-H1783 IonicContact OD2-CE1 2.75Å; D1779-H1783 IonicContact OD2-NE2 2.75Å
1780	G	83.9	Confident	84.8	Confident	24 Å²	24	48.7 Å²	48.7	25%	0.247	24%	0.236	C	C	.	.	S	Bend	trans	108.5	5.2	-175.7	0	0	0	0	0	113.9	R1680 T1681 N1778	R1680-G1780 WeakPolarHBondContact CD-O 3.37Å; R1680-G1780 WeakPolarHBondContact CG-O 3.13Å; T1681-G1780 WeakPolarHBondContact O-CA 3.36Å; T1681-G1780 PolarHBondContact O-N 3.02Å; N1778-G1780 VanDerWaalsContact C-N 3.32Å
1781	E	88.5	Confident	84.2	Confident	114 Å²	114	47.1 Å²	47.1	53%	0.533	22%	0.22	S	C	.	.	S	Bend	trans	-98.8	172	179	-67	-57	151.4	0	0	113.6	R1680 D1779 H1783	R1680-E1781 WeakPolarHBondContact CA-O 3.14Å; R1680-E1781 WeakPolarHBondContact CG-O 3.37Å; D1779-E1781 WeakPolarHBondContact OD1-CB 3.44Å; D1779-E1781 PolarHBondContact OD1-N 3.08Å; E1781-H1783 PolarHBondContact O-CD2 3.3Å; E1781-H1783 VanDerWaalsContact O-CD2 3.31Å
1782	W	87.6	Confident	83.3	Confident	60 Å²	60	52 Å²	52	23%	0.227	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	116.4	179.9	-78.6	105.6	0	0	0	112.7	L1652 R1678 L1679 R1680 C1844 A1846	L1652-W1782 HydrophobicContact CD2-CH2 4.15Å; L1652-W1782 HydrophobicContact CD2-CZ2 3.66Å; L1652-W1782 HydrophobicContact CG-CH2 4.17Å; L1652-W1782 HydrophobicContact CG-CZ2 4.18Å; R1678-W1782 HydrophobicContact CB-CE3 3.86Å; R1678-W1782 HydrophobicContact CB-CZ3 4.01Å; L1679-W1782 VanDerWaalsContact C-CE3 3.46Å; L1679-W1782 WeakPolarHBondContact O-CA 3.49Å; R1680-W1782 HydrophobicContact CB-CD2 3.84Å; R1680-W1782 HydrophobicContact CB-CE3 3.88Å; R1680-W1782 HydrophobicContact CB-CG 4.39Å; R1680-W1782 HydrophobicContact CB-CH2 4.3Å; R1680-W1782 HydrophobicContact CB-CZ2 4.21Å; R1680-W1782 HydrophobicContact CB-CZ3 4.13Å; W1782-C1844 HydrophobicContact CH2-CB 3.5Å; W1782-C1844 HydrophobicContact CZ2-CB 4.07Å; W1782-C1844 HydrophobicContact CZ3-CB 4.13Å; W1782-A1846 HydrophobicContact CH2-CB 4.04Å; W1782-A1846 HydrophobicContact CZ3-CB 4.01Å
1783	H	90.5	Very high	82.3	Confident	9 Å²	9	49.2 Å²	49.2	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	140.3	174.8	-62.3	-85.1	0	0	0	111.8	R1678 L1679 H1775 V1777 D1779 E1781 D1799	R1678-H1783 CarbonylContact C-O 3.56Å; R1678-H1783 VanDerWaalsContact CA-O 3.3Å; R1678-H1783 WeakPolarHBondContact CA-O 3.35Å; L1679-H1783 PolarHBondContact N-O 2.97Å; L1679-H1783 PolarHBondContact O-N 2.87Å; H1775-H1783 AromaticContact CD2-CE1 3.93Å; H1775-H1783 AromaticContact CD2-ND1 3.89Å; H1775-H1783 AromaticContact NE2-CE1 3.6Å; H1775-H1783 AromaticContact NE2-ND1 3.9Å; V1777-H1783 VanDerWaalsContact CA-CD2 3.49Å; V1777-H1783 WeakPolarHBondContact CA-CD2 3.43Å; V1777-H1783 WeakPolarHBondContact CA-NE2 3.49Å; V1777-H1783 HydrophobicContact CB-CB 3.97Å; V1777-H1783 VanDerWaalsContact CB-CD2 3.49Å; V1777-H1783 WeakPolarHBondContact CB-CD2 3.38Å; V1777-H1783 HydrophobicContact CG1-CB 3.73Å; V1777-H1783 VanDerWaalsContact CG1-CG 3.49Å; D1779-H1783 IonicContact OD1-NE2 3.43Å; D1779-H1783 PolarHBondContact OD1-NE2 3.33Å; D1779-H1783 VanDerWaalsContact OD1-NE2 3.16Å; D1779-H1783 IonicContact OD2-CE1 2.75Å; D1779-H1783 IonicContact OD2-NE2 2.75Å; E1781-H1783 PolarHBondContact O-CD2 3.3Å; E1781-H1783 VanDerWaalsContact O-CD2 3.31Å; H1783-D1799 VanDerWaalsContact CA-OD1 3.26Å; H1783-D1799 WeakPolarHBondContact CA-OD1 3.44Å; H1783-D1799 IonicContact CE1-OD2 2.76Å; H1783-D1799 IonicContact CG-OD2 2.74Å; H1783-D1799 IonicContact ND1-OD1 2.69Å; H1783-D1799 IonicContact ND1-OD2 3.64Å; H1783-D1799 PolarHBondContact ND1-OD2 3.16Å
1784	M	89.7	Confident	81.8	Confident	36 Å²	36	49.2 Å²	49.2	18%	0.177	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122	174.4	-171.1	-76.4	-58.8	0	0	109.4	R1676 Q1786 V1798 D1799	R1676-M1784 HydrophobicContact CG-SD 3.87Å; R1676-M1784 PolarHBondContact NE-SD 3.09Å; M1784-Q1786 HydrophobicContact SD-CB 4.11Å; M1784-V1798 CarbonylContact O-C 3.55Å; M1784-V1798 WeakPolarHBondContact O-CA 3.22Å; M1784-D1799 WeakPolarHBondContact CE-O 3.41Å; M1784-D1799 PolarHBondContact N-OD1 2.85Å; M1784-D1799 PolarHBondContact O-N 3.32Å
1785	I	91.8	Very high	81.9	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.3	177.8	-58	175.9	0	0	0	108.4	R1676 L1677 L1679 I1688 V1736 L1796 F1797	R1676-I1785 CarbonylContact C-O 3.52Å; R1676-I1785 VanDerWaalsContact CA-O 3.29Å; R1676-I1785 WeakPolarHBondContact CA-O 3.31Å; L1677-I1785 HydrophobicContact CD1-CB 3.94Å; L1677-I1785 HydrophobicContact CD1-CD1 4.16Å; L1677-I1785 HydrophobicContact CD1-CG1 4.33Å; L1677-I1785 HydrophobicContact CG-CB 4.46Å; L1677-I1785 PolarHBondContact N-O 2.7Å; L1677-I1785 PolarHBondContact O-N 2.93Å; L1679-I1785 HydrophobicContact CD1-CD1 4.42Å; L1679-I1785 HydrophobicContact CD2-CD1 3.4Å; L1679-I1785 VanDerWaalsContact CD2-CD1 3.4Å; L1679-I1785 HydrophobicContact CG-CD1 3.7Å; I1688-I1785 HydrophobicContact CD1-CD1 4.02Å; V1736-I1785 HydrophobicContact CB-CD1 4.49Å; V1736-I1785 HydrophobicContact CG1-CD1 4.1Å; V1736-I1785 HydrophobicContact CG1-CG2 4.2Å; V1736-I1785 HydrophobicContact CG2-CD1 3.54Å; V1736-I1785 HydrophobicContact CG2-CG1 4.14Å; I1785-L1796 HydrophobicContact CG2-CD1 3.89Å; I1785-F1797 WeakPolarHBondContact CA-O 3.21Å
1786	Q	90.9	Very high	82.2	Confident	29 Å²	29	36.1 Å²	36.1	14%	0.136	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	129.1	170	-177.5	173.5	-2.1	0	0	110.5	N1674 I1675 R1676 M1784 M1788 L1796 F1797	N1674-Q1786 PolarHBondContact OD1-NE2 2.93Å; I1675-Q1786 CarbonylContact O-C 3.48Å; I1675-Q1786 WeakPolarHBondContact O-CA 3.49Å; I1675-Q1786 WeakPolarHBondContact O-CG 3.04Å; R1676-Q1786 HydrophobicContact CB-CB 4.17Å; R1676-Q1786 HydrophobicContact CB-CG 4.05Å; R1676-Q1786 HydrophobicContact CG-CB 4.14Å; R1676-Q1786 HydrophobicContact CG-CG 4.44Å; M1784-Q1786 HydrophobicContact SD-CB 4.11Å; Q1786-M1788 HydrophobicContact CG-CG 4.31Å; Q1786-L1796 CarbonylContact O-C 3.59Å; Q1786-L1796 WeakPolarHBondContact O-CA 3.18Å; Q1786-F1797 HydrophobicContact CB-CB 4.15Å; Q1786-F1797 HydrophobicContact CB-CD2 4.12Å; Q1786-F1797 HydrophobicContact CG-CD2 4.3Å; Q1786-F1797 PolarHBondContact N-O 2.82Å; Q1786-F1797 PolarHBondContact O-N 2.74Å
1787	A	88	Confident	82.2	Confident	1 Å²	1	32 Å²	32	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.6	178.3	0	0	0	0	0	109.9	F1673 I1675 I1729 L1738 T1795 L1796	F1673-A1787 HydrophobicContact CE2-CB 4.13Å; I1675-A1787 PolarHBondContact N-O 2.71Å; I1675-A1787 PolarHBondContact O-N 3.48Å; I1729-A1787 HydrophobicContact CD1-CB 3.74Å; I1729-A1787 HydrophobicContact CG1-CB 4.46Å; L1738-A1787 HydrophobicContact CD1-CB 4.37Å; L1738-A1787 HydrophobicContact CD2-CB 4.23Å; A1787-T1795 CarbonylContact C-O 3.58Å; A1787-T1795 WeakPolarHBondContact CA-O 3.33Å; A1787-L1796 HydrophobicContact CB-CD1 4.27Å
1788	M	84.8	Confident	82.1	Confident	27 Å²	27	32 Å²	32	13%	0.133	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.8	179	-49	-164.6	-49.3	0	0	110.8	H1492 F1673 Q1786 A1794 T1795 F1797	H1492-M1788 HydrophobicContact CB-CE 4.27Å; F1673-M1788 CarbonylContact O-C 3.57Å; F1673-M1788 VanDerWaalsContact O-CA 3.27Å; F1673-M1788 WeakPolarHBondContact O-CA 3.47Å; Q1786-M1788 HydrophobicContact CG-CG 4.31Å; M1788-A1794 CarbonylContact O-C 3.46Å; M1788-A1794 VanDerWaalsContact O-CA 3.23Å; M1788-A1794 WeakPolarHBondContact O-CA 3.41Å; M1788-T1795 PolarHBondContact N-O 2.81Å; M1788-T1795 PolarHBondContact O-N 2.86Å; M1788-F1797 HydrophobicContact CE-CE2 4.05Å; M1788-F1797 HydrophobicContact CE-CZ 4.49Å
1789	G	72.9	Confident	81.9	Confident	4 Å²	4	32 Å²	32	4%	0.041	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	142.1	168.6	0	0	0	0	0	109.4	S1671 D1672 F1673 R1793	S1671-G1789 CarbonylContact O-C 3.53Å; D1672-G1789 CarbonylContact C-O 3.41Å; D1672-G1789 WeakPolarHBondContact CA-O 3.1Å; F1673-G1789 PolarHBondContact N-O 3.19Å; F1673-G1789 PolarHBondContact O-N 2.75Å; F1673-G1789 VanDerWaalsContact O-O 3.12Å; G1789-R1793 WeakPolarHBondContact CA-O 3.39Å
1790	N	67.6	Low	81	Confident	28 Å²	28	34.2 Å²	34.2	15%	0.15	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	32.3	-167.1	65.3	27.3	0	0	0	114.2	R1491 S1671 R1793	R1491-N1790 HydrophobicContact CB-CB 3.9Å; R1491-N1790 WeakPolarHBondContact CD-O 3.49Å; R1491-N1790 PolarHBondContact NE-O 3.1Å; R1491-N1790 PolarHBondContact NH1-O 2.04Å; S1671-N1790 PolarHBondContact O-N 3.13Å; N1790-R1793 PolarHBondContact N-O 3.01Å; N1790-R1793 VanDerWaalsContact N-O 3.14Å; N1790-R1793 PolarHBondContact OD1-N 3.29Å; N1790-R1793 PolarHBondContact OD1-O 2.77Å
1791	K	64.1	Low	80.2	Confident	58 Å²	58	37.3 Å²	37.3	25%	0.252	18%	0.179	S	C	.	.	S	Bend	trans	64.5	-115.1	-142.8	-52.1	-175	-177.9	-177.5	0	108.7	S1671 R1793 F1807 D1812	S1671-K1791 WeakPolarHBondContact O-CA 3.24Å; S1671-K1791 PolarHBondContact O-N 2.85Å; K1791-R1793 PolarHBondContact O-N 3.1Å; K1791-F1807 WeakPolarHBondContact O-CE1 3.38Å; K1791-F1807 WeakPolarHBondContact O-CZ 3.48Å; K1791-D1812 IonicContact NZ-OD1 3.86Å; K1791-D1812 PolarHBondContact NZ-OD1 2.98Å; K1791-D1812 IonicContact NZ-OD2 3.42Å
1792	Q	62.6	Low	79.6	Confident	111 Å²	111	33.9 Å²	33.9	52%	0.519	16%	0.164	S	C	.	.	S	Bend	trans	-53.9	-18.2	-158.2	-70.7	170.4	-19.4	0	0	118.9	F1807	Q1792-F1807 PolarHBondContact O-N 2.92Å
1793	R	65.6	Low	79	Confident	14 Å²	14	33 Å²	33	5%	0.053	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.2	-177.2	-180	172.1	172.4	-150.9	-17.7	111.3	S1363 E1386 H1492 G1789 N1790 K1791 S1804 G1805 E1806	S1363-R1793 PolarHBondContact OG-NH1 2.78Å; E1386-R1793 IonicContact OE1-CZ 2.64Å; E1386-R1793 IonicContact OE1-NE 3.98Å; E1386-R1793 PolarHBondContact OE1-NE 3.38Å; E1386-R1793 IonicContact OE1-NH1 2.99Å; E1386-R1793 IonicContact OE1-NH2 3.72Å; E1386-R1793 PolarHBondContact OE1-NH2 2.02Å; H1492-R1793 PolarHBondContact NE2-NH1 3.45Å; H1492-R1793 PolarHBondContact NE2-NH2 2.87Å; G1789-R1793 WeakPolarHBondContact CA-O 3.39Å; N1790-R1793 PolarHBondContact N-O 3.01Å; N1790-R1793 VanDerWaalsContact N-O 3.14Å; N1790-R1793 PolarHBondContact OD1-N 3.29Å; N1790-R1793 PolarHBondContact OD1-O 2.77Å; K1791-R1793 PolarHBondContact O-N 3.1Å; R1793-S1804 PolarHBondContact NH2-OG 2.83Å; R1793-G1805 WeakPolarHBondContact CG-O 3.42Å; R1793-E1806 HydrophobicContact CB-CG 4.16Å; R1793-E1806 HydrophobicContact CG-CG 3.93Å
1794	A	74.6	Confident	78.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152.1	171.5	0	0	0	0	0	110.4	L1738 L1740 I1771 M1788 S1804 G1805	L1738-A1794 HydrophobicContact CD2-CB 4.37Å; L1740-A1794 HydrophobicContact CD1-CB 3.73Å; L1740-A1794 HydrophobicContact CD2-CB 3.86Å; L1740-A1794 HydrophobicContact CG-CB 4.49Å; I1771-A1794 HydrophobicContact CD1-CB 3.67Å; M1788-A1794 CarbonylContact O-C 3.46Å; M1788-A1794 VanDerWaalsContact O-CA 3.23Å; M1788-A1794 WeakPolarHBondContact O-CA 3.41Å; A1794-S1804 WeakPolarHBondContact O-CA 3.1Å; A1794-G1805 PolarHBondContact N-O 2.85Å; A1794-G1805 PolarHBondContact O-N 3.41Å; A1794-G1805 VanDerWaalsContact O-O 3.09Å
1795	T	80.5	Confident	77.2	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	133.1	-178.8	-62.5	0	0	0	0	110.9	A1787 M1788 F1797 M1802 V1803 S1804	A1787-T1795 CarbonylContact C-O 3.58Å; A1787-T1795 WeakPolarHBondContact CA-O 3.33Å; M1788-T1795 PolarHBondContact N-O 2.81Å; M1788-T1795 PolarHBondContact O-N 2.86Å; T1795-F1797 HydrophobicContact CG2-CD2 4.25Å; T1795-F1797 HydrophobicContact CG2-CE1 4.44Å; T1795-F1797 HydrophobicContact CG2-CE2 3.49Å; T1795-F1797 VanDerWaalsContact CG2-CE2 3.49Å; T1795-F1797 HydrophobicContact CG2-CZ 3.58Å; T1795-M1802 HydrophobicContact CG2-CG 3.45Å; T1795-M1802 VanDerWaalsContact CG2-CG 3.45Å; T1795-M1802 HydrophobicContact CG2-SD 3.73Å; T1795-V1803 WeakPolarHBondContact CA-O 3.42Å; T1795-S1804 WeakPolarHBondContact CG2-OG 3.5Å; T1795-S1804 WeakPolarHBondContact OG1-CB 3.34Å; T1795-S1804 PolarHBondContact OG1-OG 2.98Å
1796	L	87	Confident	75.8	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	125.2	179.6	179	65.5	0	0	0	109.4	V1736 L1738 I1771 A1773 I1785 Q1786 A1787 V1798 M1802 V1803	V1736-L1796 HydrophobicContact CB-CD2 4.19Å; V1736-L1796 HydrophobicContact CG1-CD1 4.07Å; V1736-L1796 HydrophobicContact CG1-CD2 3.97Å; L1738-L1796 HydrophobicContact CB-CB 4.43Å; L1738-L1796 HydrophobicContact CB-CD1 4.44Å; L1738-L1796 HydrophobicContact CB-CD2 4.11Å; L1738-L1796 HydrophobicContact CD2-CB 4.28Å; I1771-L1796 HydrophobicContact CG2-CB 3.9Å; A1773-L1796 HydrophobicContact CB-CD2 4.12Å; I1785-L1796 HydrophobicContact CG2-CD1 3.89Å; Q1786-L1796 CarbonylContact O-C 3.59Å; Q1786-L1796 WeakPolarHBondContact O-CA 3.18Å; A1787-L1796 HydrophobicContact CB-CD1 4.27Å; L1796-V1798 HydrophobicContact CG-CG2 4.39Å; L1796-M1802 CarbonylContact O-C 3.39Å; L1796-V1803 PolarHBondContact N-O 2.68Å; L1796-V1803 PolarHBondContact O-N 3.19Å
1797	F	86.7	Confident	74.4	Confident	10 Å²	10	39.5 Å²	39.5	4%	0.044	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136	168.8	-56.6	-94.8	0	0	0	108.9	Y1495 I1785 Q1786 M1788 T1795 H1801 M1802	Y1495-F1797 HydrophobicContact CE1-CE1 4.01Å; Y1495-F1797 HydrophobicContact CE1-CZ 4.26Å; Y1495-F1797 HydrophobicContact CE2-CE1 4.47Å; Y1495-F1797 HydrophobicContact CE2-CZ 4.2Å; Y1495-F1797 AromaticContact CZ-CE1 3.74Å; Y1495-F1797 AromaticContact CZ-CZ 3.56Å; Y1495-F1797 WeakPolarHBondContact OH-CZ 3.13Å; I1785-F1797 WeakPolarHBondContact CA-O 3.21Å; Q1786-F1797 HydrophobicContact CB-CB 4.15Å; Q1786-F1797 HydrophobicContact CB-CD2 4.12Å; Q1786-F1797 HydrophobicContact CG-CD2 4.3Å; Q1786-F1797 PolarHBondContact N-O 2.82Å; Q1786-F1797 PolarHBondContact O-N 2.74Å; M1788-F1797 HydrophobicContact CE-CE2 4.05Å; M1788-F1797 HydrophobicContact CE-CZ 4.49Å; T1795-F1797 HydrophobicContact CG2-CD2 4.25Å; T1795-F1797 HydrophobicContact CG2-CE1 4.44Å; T1795-F1797 HydrophobicContact CG2-CE2 3.49Å; T1795-F1797 VanDerWaalsContact CG2-CE2 3.49Å; T1795-F1797 HydrophobicContact CG2-CZ 3.58Å; F1797-H1801 CarbonylContact C-O 3.56Å; F1797-H1801 WeakPolarHBondContact CA-O 3.34Å; F1797-M1802 HydrophobicContact CD1-CB 3.73Å; F1797-M1802 HydrophobicContact CD1-CG 3.96Å; F1797-M1802 HydrophobicContact CE1-CB 3.55Å; F1797-M1802 HydrophobicContact CE1-CG 3.41Å; F1797-M1802 VanDerWaalsContact CE1-CG 3.41Å; F1797-M1802 HydrophobicContact CE1-SD 3.49Å; F1797-M1802 WeakPolarHBondContact CE1-SD 3.27Å; F1797-M1802 HydrophobicContact CZ-CB 4.36Å; F1797-M1802 HydrophobicContact CZ-CG 3.72Å; F1797-M1802 HydrophobicContact CZ-SD 3.53Å; F1797-M1802 VanDerWaalsContact CZ-SD 3.53Å
1798	V	87	Confident	72.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	107.6	166.3	177.9	0	0	0	0	107	V1736 A1773 H1775 V1777 M1784 L1796 N1800 H1801	V1736-V1798 HydrophobicContact CB-CG2 3.84Å; V1736-V1798 HydrophobicContact CG2-CG2 3.71Å; A1773-V1798 HydrophobicContact CB-CB 4.08Å; A1773-V1798 HydrophobicContact CB-CG2 3.44Å; A1773-V1798 VanDerWaalsContact CB-CG2 3.44Å; H1775-V1798 HydrophobicContact CB-CG1 4.36Å; V1777-V1798 HydrophobicContact CG1-CG1 3.38Å; M1784-V1798 CarbonylContact O-C 3.55Å; M1784-V1798 WeakPolarHBondContact O-CA 3.22Å; L1796-V1798 HydrophobicContact CG-CG2 4.39Å; V1798-N1800 PolarHBondContact O-N 2.89Å; V1798-N1800 VanDerWaalsContact O-N 3.16Å; V1798-H1801 PolarHBondContact N-O 3.47Å; V1798-H1801 WeakPolarHBondContact O-CB 3.31Å; V1798-H1801 PolarHBondContact O-N 3.21Å; V1798-H1801 PolarHBondContact O-ND1 2.94Å
1799	D	85.8	Confident	70.8	Confident	37 Å²	37	45.7 Å²	45.7	20%	0.198	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	-113.1	-168.8	-48.9	-57.3	0	0	0	110.6	H1775 H1783 M1784	H1775-D1799 IonicContact CD2-OD2 3.16Å; H1775-D1799 IonicContact NE2-OD2 3.1Å; H1783-D1799 VanDerWaalsContact CA-OD1 3.26Å; H1783-D1799 WeakPolarHBondContact CA-OD1 3.44Å; H1783-D1799 IonicContact CE1-OD2 2.76Å; H1783-D1799 IonicContact CG-OD2 2.74Å; H1783-D1799 IonicContact ND1-OD1 2.69Å; H1783-D1799 IonicContact ND1-OD2 3.64Å; H1783-D1799 PolarHBondContact ND1-OD2 3.16Å; M1784-D1799 WeakPolarHBondContact CE-O 3.41Å; M1784-D1799 PolarHBondContact N-OD1 2.85Å; M1784-D1799 PolarHBondContact O-N 3.32Å
1800	N	70.8	Confident	69.5	Low	150 Å²	150	48 Å²	48	80%	0.802	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	3.8	177.6	-62.7	-34.3	0	0	0	113.3	V1798	V1798-N1800 PolarHBondContact O-N 2.89Å; V1798-N1800 VanDerWaalsContact O-N 3.16Å
1801	H	66.8	Low	68.3	Low	89 Å²	89	49.5 Å²	49.5	41%	0.412	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	110.7	-177	-58.4	95.8	0	0	0	112	H1775 F1797 V1798	H1775-H1801 AromaticContact CG-CE1 3.89Å; H1775-H1801 AromaticContact CG-ND1 3.87Å; H1775-H1801 AromaticContact ND1-CE1 3.8Å; F1797-H1801 CarbonylContact C-O 3.56Å; F1797-H1801 WeakPolarHBondContact CA-O 3.34Å; V1798-H1801 PolarHBondContact N-O 3.47Å; V1798-H1801 WeakPolarHBondContact O-CB 3.31Å; V1798-H1801 PolarHBondContact O-N 3.21Å; V1798-H1801 PolarHBondContact O-ND1 2.94Å
1802	M	75.6	Confident	67.2	Low	42 Å²	42	52.2 Å²	52.2	21%	0.207	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	140	171.5	-176.4	176.6	60.3	0	0	112.1	Q1361 P1362 Y1495 T1795 L1796 F1797	Q1361-M1802 HydrophobicContact CB-CE 3.97Å; P1362-M1802 HydrophobicContact CG-CE 3.98Å; Y1495-M1802 HydrophobicContact CE2-SD 4.41Å; T1795-M1802 HydrophobicContact CG2-CG 3.45Å; T1795-M1802 VanDerWaalsContact CG2-CG 3.45Å; T1795-M1802 HydrophobicContact CG2-SD 3.73Å; L1796-M1802 CarbonylContact O-C 3.39Å; F1797-M1802 HydrophobicContact CD1-CB 3.73Å; F1797-M1802 HydrophobicContact CD1-CG 3.96Å; F1797-M1802 HydrophobicContact CE1-CB 3.55Å; F1797-M1802 HydrophobicContact CE1-CG 3.41Å; F1797-M1802 VanDerWaalsContact CE1-CG 3.41Å; F1797-M1802 HydrophobicContact CE1-SD 3.49Å; F1797-M1802 WeakPolarHBondContact CE1-SD 3.27Å; F1797-M1802 HydrophobicContact CZ-CB 4.36Å; F1797-M1802 HydrophobicContact CZ-CG 3.72Å; F1797-M1802 HydrophobicContact CZ-SD 3.53Å; F1797-M1802 VanDerWaalsContact CZ-SD 3.53Å
1803	V	76	Confident	66.1	Low	42 Å²	42	52.9 Å²	52.9	26%	0.255	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	118	164.4	-169.4	0	0	0	0	109.2	I1771 T1795 L1796	I1771-V1803 HydrophobicContact CG2-CB 3.93Å; I1771-V1803 HydrophobicContact CG2-CG1 3.77Å; I1771-V1803 WeakPolarHBondContact CG2-O 3.09Å; T1795-V1803 WeakPolarHBondContact CA-O 3.42Å; L1796-V1803 PolarHBondContact N-O 2.68Å; L1796-V1803 PolarHBondContact O-N 3.19Å
1804	S	77.6	Confident	64.7	Low	33 Å²	33	60.1 Å²	60.1	23%	0.231	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	162.1	173.4	-63.8	0	0	0	0	112	E1386 R1793 A1794 T1795	E1386-S1804 VanDerWaalsContact OE1-CB 3.28Å; E1386-S1804 WeakPolarHBondContact OE1-CB 3.29Å; R1793-S1804 PolarHBondContact NH2-OG 2.83Å; A1794-S1804 WeakPolarHBondContact O-CA 3.1Å; T1795-S1804 WeakPolarHBondContact CG2-OG 3.5Å; T1795-S1804 WeakPolarHBondContact OG1-CB 3.34Å; T1795-S1804 PolarHBondContact OG1-OG 2.98Å
1805	G	65.2	Low	62.8	Low	15 Å²	15	65 Å²	65	16%	0.155	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	150.4	159.7	0	0	0	0	0	111	M1769 R1793 A1794	M1769-G1805 WeakPolarHBondContact CE-O 3.22Å; R1793-G1805 WeakPolarHBondContact CG-O 3.42Å; A1794-G1805 PolarHBondContact N-O 2.85Å; A1794-G1805 PolarHBondContact O-N 3.41Å; A1794-G1805 VanDerWaalsContact O-O 3.09Å
1806	E	62.8	Low	60.9	Low	124 Å²	124	68.4 Å²	68.4	58%	0.579	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	152.7	179	-57.5	-167.7	143.4	0	0	111.7	M1769 R1793	M1769-E1806 WeakPolarHBondContact CE-O 3.38Å; R1793-E1806 HydrophobicContact CB-CG 4.16Å; R1793-E1806 HydrophobicContact CG-CG 3.93Å
1807	F	61.4	Low	58.9	Low	39 Å²	39	70.5 Å²	70.5	17%	0.171	41%	0.414	C	S	.	.			trans	-124.6	150.7	169.1	65.5	-111.1	0	0	0	111.8	L1742 M1769 K1791 Q1792 V1810	L1742-F1807 HydrophobicContact CD1-CD1 4Å; L1742-F1807 HydrophobicContact CD1-CE1 3.41Å; L1742-F1807 VanDerWaalsContact CD1-CE1 3.41Å; L1742-F1807 HydrophobicContact CD1-CE2 4.26Å; L1742-F1807 HydrophobicContact CD1-CZ 3.55Å; M1769-F1807 HydrophobicContact SD-CB 4.16Å; M1769-F1807 HydrophobicContact SD-CD1 4.29Å; K1791-F1807 WeakPolarHBondContact O-CE1 3.38Å; K1791-F1807 WeakPolarHBondContact O-CZ 3.48Å; Q1792-F1807 PolarHBondContact O-N 2.92Å; F1807-V1810 HydrophobicContact CD2-CG2 3.85Å; F1807-V1810 HydrophobicContact CE2-CB 3.71Å; F1807-V1810 HydrophobicContact CE2-CG2 3.27Å; F1807-V1810 HydrophobicContact CZ-CB 4.41Å; F1807-V1810 HydrophobicContact CZ-CG2 3.89Å
1808	A	46.9	Very low	57.1	Low	98 Å²	98	74.5 Å²	74.5	81%	0.81	44%	0.439	S	S	*	.			trans	-105.2	135.5	175.2	0	0	0	0	0	110.9
1809	G	49.1	Very low	55.9	Low	61 Å²	61	75.1 Å²	75.1	63%	0.629	44%	0.442	S	S	*	.			trans	101.6	11.7	156.6	0	0	0	0	0	119.5	A1811	G1809-A1811 PolarHBondContact O-N 2.76Å
1810	V	46.7	Very low	55.4	Low	52 Å²	52	73.5 Å²	73.5	32%	0.315	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-73.4	122	168.8	177.5	0	0	0	0	109.9	L1742 T1744 F1807	L1742-V1810 HydrophobicContact CB-CG2 4.3Å; L1742-V1810 HydrophobicContact CD1-CG2 4.15Å; T1744-V1810 HydrophobicContact CG2-CG2 4.48Å; F1807-V1810 HydrophobicContact CD2-CG2 3.85Å; F1807-V1810 HydrophobicContact CE2-CB 3.71Å; F1807-V1810 HydrophobicContact CE2-CG2 3.27Å; F1807-V1810 HydrophobicContact CZ-CB 4.41Å; F1807-V1810 HydrophobicContact CZ-CG2 3.89Å
1811	A	41.2	Very low	56.1	Low	59 Å²	59	66.4 Å²	66.4	49%	0.488	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-86	150	176.5	0	0	0	0	0	111.6	G1809 Y1813	G1809-A1811 PolarHBondContact O-N 2.76Å; A1811-Y1813 HydrophobicContact CB-CD2 4.5Å; A1811-Y1813 HydrophobicContact CB-CE2 4.07Å
1812	D	40.5	Very low	57.2	Low	116 Å²	116	62.3 Å²	62.3	62%	0.62	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-72.4	131	175.7	-101.5	-21.9	0	0	0	111.6	K1791	K1791-D1812 IonicContact NZ-OD1 3.86Å; K1791-D1812 PolarHBondContact NZ-OD1 2.98Å; K1791-D1812 IonicContact NZ-OD2 3.42Å
1813	Y	39.4	Very low	58	Low	125 Å²	125	60.3 Å²	60.3	49%	0.49	37%	0.366	S	S	.	.			trans	-137.3	117.3	174.9	-75.8	-78.6	0	0	0	110.1	A1811 T1815	A1811-Y1813 HydrophobicContact CB-CD2 4.5Å; A1811-Y1813 HydrophobicContact CB-CE2 4.07Å; Y1813-T1815 PolarHBondContact O-N 2.77Å
1814	D	36.6	Very low	58.6	Low	166 Å²	166	58.3 Å²	58.3	89%	0.888	35%	0.354	S	S	*	.	S	Bend	trans	-77.4	53.3	-177.5	-67.4	-55.4	0	0	0	113.8
1815	T	35	Very low	59.1	Low	103 Å²	103	56.8 Å²	56.8	63%	0.632	34%	0.343	S	S	*	.			trans	-143.2	110.4	173.9	52.7	0	0	0	0	111.3	Y1813 P1817	Y1813-T1815 PolarHBondContact O-N 2.77Å; T1815-P1817 WeakPolarHBondContact O-CD 3.45Å
1816	P	40.3	Very low	59.8	Low	75 Å²	75	56.9 Å²	56.9	49%	0.487	34%	0.341	S	S	.	.			trans	-95.5	98.8	176.1	33.1	-29.4	0	0	0	112.3	F1669	F1669-P1816 HydrophobicContact CD1-CB 4.34Å; F1669-P1816 HydrophobicContact CE1-CB 3.71Å; F1669-P1816 HydrophobicContact CZ-CB 3.94Å
1817	P	45.9	Very low	60.4	Low	45 Å²	45	54.3 Å²	54.3	29%	0.292	33%	0.33	S	S	.	.			trans	-69.9	135	163.1	29.5	-32.7	0	0	0	109.8	E1693 T1815 R1819	E1693-P1817 HydrophobicContact CG-CB 4.26Å; E1693-P1817 HydrophobicContact CG-CG 3.82Å; E1693-P1817 WeakPolarHBondContact OE2-CG 3.43Å; T1815-P1817 WeakPolarHBondContact O-CD 3.45Å; P1817-R1819 VanDerWaalsContact O-CG 3.25Å; P1817-R1819 WeakPolarHBondContact O-CG 3.34Å
1818	V	47.8	Very low	60.9	Low	93 Å²	93	54.6 Å²	54.6	56%	0.564	33%	0.332	S	S	*	.			trans	-60.8	135.8	175.5	171.2	0	0	0	0	109.9
1819	R	63.4	Low	61.9	Low	13 Å²	13	54.6 Å²	54.6	5%	0.049	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.9	-175.9	-51.9	-160.3	177.7	-173.5	-6.6	110.1	G1665 T1670 V1692 E1693 E1725 P1817	G1665-R1819 PolarHBondContact N-O 2.88Å; T1670-R1819 VanDerWaalsContact N-NH1 3.11Å; T1670-R1819 PolarHBondContact OG1-NH1 2.84Å; V1692-R1819 WeakPolarHBondContact O-CA 3.28Å; V1692-R1819 WeakPolarHBondContact O-CB 3.48Å; E1693-R1819 HydrophobicContact CB-CG 4.42Å; E1693-R1819 IonicContact OE2-CZ 3.92Å; E1693-R1819 IonicContact OE2-NE 3.89Å; E1693-R1819 IonicContact OE2-NH2 2.78Å; E1693-R1819 PolarHBondContact OE2-NH2 2.94Å; E1725-R1819 IonicContact OE2-CZ 3.82Å; E1725-R1819 IonicContact OE2-NH1 3.6Å; E1725-R1819 PolarHBondContact OE2-NH1 3.04Å; E1725-R1819 IonicContact OE2-NH2 3.55Å; E1725-R1819 PolarHBondContact OE2-NH2 2.79Å; P1817-R1819 VanDerWaalsContact O-CG 3.25Å; P1817-R1819 WeakPolarHBondContact O-CG 3.34Å
1820	D	75.2	Confident	62.9	Low	4 Å²	4	51.7 Å²	51.7	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	142.2	178.4	-75.8	6.7	0	0	0	109.4	R1664 M1691 V1692 Q1694 Y1822	R1664-D1820 WeakPolarHBondContact CD-OD1 3.29Å; R1664-D1820 WeakPolarHBondContact CG-OD1 3.24Å; R1664-D1820 IonicContact CZ-OD2 3.83Å; R1664-D1820 IonicContact NE-OD1 2.75Å; R1664-D1820 PolarHBondContact NE-OD1 3.03Å; R1664-D1820 IonicContact NE-OD2 3.06Å; R1664-D1820 PolarHBondContact NE-OD2 3.15Å; R1664-D1820 IonicContact NH2-OD2 3.32Å; R1664-D1820 PolarHBondContact NH2-OD2 2.7Å; M1691-D1820 CarbonylContact C-O 3.58Å; M1691-D1820 WeakPolarHBondContact CA-O 3.47Å; V1692-D1820 PolarHBondContact N-O 2.9Å; V1692-D1820 PolarHBondContact O-N 2.76Å; V1692-D1820 VanDerWaalsContact O-N 3.08Å; Q1694-D1820 PolarHBondContact NE2-OD2 3.32Å; D1820-Y1822 HydrophobicContact CB-CD2 4.5Å; D1820-Y1822 HydrophobicContact CB-CE2 3.51Å; D1820-Y1822 WeakPolarHBondContact CB-OH 3.41Å; D1820-Y1822 PolarHBondContact OD2-OH 2.98Å
1821	V	85.4	Confident	63.8	Low	1 Å²	1	52.4 Å²	52.4	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.7	175.8	-173.9	0	0	0	0	108.5	T1662 Y1663 L1689 L1690 M1691	T1662-V1821 CarbonylContact C-O 3.5Å; T1662-V1821 VanDerWaalsContact CA-O 3.27Å; T1662-V1821 WeakPolarHBondContact CA-O 3.37Å; Y1663-V1821 HydrophobicContact CD2-CB 4.48Å; Y1663-V1821 PolarHBondContact N-O 3.22Å; Y1663-V1821 PolarHBondContact O-N 2.85Å; L1689-V1821 HydrophobicContact CD1-CG1 3.84Å; L1689-V1821 HydrophobicContact CD2-CG1 4.01Å; L1689-V1821 HydrophobicContact CG-CG1 3.83Å; L1690-V1821 CarbonylContact O-C 3.54Å; L1690-V1821 WeakPolarHBondContact O-CA 3.39Å; M1691-V1821 HydrophobicContact CG-CG1 4.27Å; M1691-V1821 HydrophobicContact CG-CG2 4.11Å; M1691-V1821 HydrophobicContact SD-CG2 4.45Å
1822	Y	89.3	Confident	64.8	Low	3 Å²	3	52.5 Å²	52.5	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.7	176.1	-56	-96.7	0	0	0	108.1	V1660 Y1661 T1662 L1689 L1690 V1692 D1820 G1825 I1827 F1828	V1660-Y1822 HydrophobicContact CG1-CD1 4.5Å; Y1661-Y1822 CarbonylContact O-C 3.55Å; Y1661-Y1822 VanDerWaalsContact O-CA 3.29Å; Y1661-Y1822 WeakPolarHBondContact O-CA 3.27Å; T1662-Y1822 HydrophobicContact CG2-CD1 3.62Å; T1662-Y1822 HydrophobicContact CG2-CE1 3.57Å; L1689-Y1822 CarbonylContact C-O 3.45Å; L1689-Y1822 VanDerWaalsContact CA-O 3.24Å; L1689-Y1822 WeakPolarHBondContact CA-O 3.14Å; L1690-Y1822 HydrophobicContact CD2-CD2 4.39Å; L1690-Y1822 HydrophobicContact CG-CD2 4.36Å; L1690-Y1822 PolarHBondContact N-O 2.9Å; L1690-Y1822 PolarHBondContact O-N 3.26Å; V1692-Y1822 HydrophobicContact CG2-CD2 4.34Å; V1692-Y1822 HydrophobicContact CG2-CE2 4.2Å; D1820-Y1822 HydrophobicContact CB-CD2 4.5Å; D1820-Y1822 HydrophobicContact CB-CE2 3.51Å; D1820-Y1822 WeakPolarHBondContact CB-OH 3.41Å; D1820-Y1822 PolarHBondContact OD2-OH 2.98Å; Y1822-G1825 WeakPolarHBondContact CB-O 3.21Å; Y1822-I1827 HydrophobicContact CE1-CD1 4.2Å; Y1822-I1827 HydrophobicContact CE1-CG1 4.11Å; Y1822-F1828 HydrophobicContact CE1-CD2 4.38Å; Y1822-F1828 AromaticContact CE1-CE2 3.82Å; Y1822-F1828 HydrophobicContact CE1-CE2 3.82Å; Y1822-F1828 AromaticContact CZ-CE2 3.68Å; Y1822-F1828 WeakPolarHBondContact OH-CE2 3.31Å
1823	L	92.6	Very high	66.1	Low	0 Å²	0	48 Å²	48	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.6	-178.6	-179.9	77.5	0	0	0	109.2	F1655 V1660 Y1661 Y1663 L1677 I1688 L1689 G1825 I1845 M1848 I1857	F1655-L1823 HydrophobicContact CE1-CD2 4.43Å; F1655-L1823 HydrophobicContact CE1-CG 4.21Å; F1655-L1823 HydrophobicContact CZ-CD2 3.81Å; F1655-L1823 HydrophobicContact CZ-CG 3.98Å; V1660-L1823 WeakPolarHBondContact CA-O 3.25Å; Y1661-L1823 PolarHBondContact N-O 3.01Å; Y1661-L1823 PolarHBondContact O-N 2.97Å; Y1663-L1823 HydrophobicContact CE2-CB 3.83Å; Y1663-L1823 HydrophobicContact CE2-CD2 4.16Å; L1677-L1823 HydrophobicContact CD2-CD1 4.37Å; I1688-L1823 WeakPolarHBondContact O-CD1 3.46Å; L1689-L1823 HydrophobicContact CB-CD1 4.36Å; L1689-L1823 HydrophobicContact CD1-CD1 4.16Å; L1823-G1825 VanDerWaalsContact C-N 3.28Å; L1823-G1825 PolarHBondContact O-N 2.96Å; L1823-I1845 HydrophobicContact CD1-CD1 3.9Å; L1823-I1845 HydrophobicContact CG-CD1 4.17Å; L1823-M1848 HydrophobicContact CD1-SD 3.85Å; L1823-M1848 HydrophobicContact CD2-CE 4.24Å; L1823-M1848 HydrophobicContact CD2-SD 3.97Å; L1823-M1848 HydrophobicContact CG-SD 4.49Å; L1823-I1857 HydrophobicContact CD2-CG1 4.49Å; L1823-I1857 HydrophobicContact CD2-CG2 3.91Å
1824	G	88.1	Confident	67.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	80.6	-5.6	-179.4	0	0	0	0	0	116	I1687 I1688 N1840 F1841	I1687-G1824 CarbonylContact O-C 3.51Å; I1687-G1824 WeakPolarHBondContact O-CA 3.47Å; I1688-G1824 PolarHBondContact O-N 2.77Å; G1824-N1840 CarbonylContact O-C 3.49Å; G1824-N1840 WeakPolarHBondContact O-CB 3.5Å; G1824-F1841 PolarHBondContact O-N 3.04Å
1825	G	87.7	Confident	69.1	Low	0 Å²	0	40.4 Å²	40.4	0%	0	26%	0.258	C	S	.	.			trans	172.6	-162.9	-178.4	0	0	0	0	0	114.6	I1687 Y1822 L1823 N1840	I1687-G1825 PolarHBondContact O-N 3.09Å; Y1822-G1825 WeakPolarHBondContact CB-O 3.21Å; L1823-G1825 VanDerWaalsContact C-N 3.28Å; L1823-G1825 PolarHBondContact O-N 2.96Å; G1825-N1840 WeakPolarHBondContact CA-OD1 3.25Å
1826	T	80.8	Confident	70.7	Confident	17 Å²	17	38.7 Å²	38.7	10%	0.104	25%	0.245	C	C	.	.			trans	-139.8	150.7	172	-178.4	0	0	0	0	110.5	I1687 F1828 N1840	I1687-T1826 HydrophobicContact CD1-CG2 3.63Å; T1826-F1828 VanDerWaalsContact CG2-O 3.25Å; T1826-F1828 WeakPolarHBondContact CG2-O 3.44Å; T1826-F1828 PolarHBondContact OG1-N 3.19Å; T1826-F1828 PolarHBondContact OG1-O 2.85Å; T1826-N1840 PolarHBondContact N-OD1 3.22Å; T1826-N1840 VanDerWaalsContact N-OD1 3.1Å
1827	I	74.8	Confident	72.4	Confident	70 Å²	70	37.2 Å²	37.2	36%	0.359	23%	0.23	S	C	.	.	S	Bend	trans	-101	0	168.9	65.7	179	0	0	0	112.5	Y1822 H1865	Y1822-I1827 HydrophobicContact CE1-CD1 4.2Å; Y1822-I1827 HydrophobicContact CE1-CG1 4.11Å; I1827-H1865 HydrophobicContact CG2-CB 4.44Å
1828	F	72.5	Confident	73.8	Confident	45 Å²	45	37.8 Å²	37.8	20%	0.197	23%	0.228	C	C	.	.	S	Bend	trans	-122.8	138.2	179.3	-50.7	-79.4	0	0	0	110.9	V1717 I1720 Y1822 T1826 I1830	V1717-F1828 WeakPolarHBondContact O-CD1 3.34Å; V1717-F1828 WeakPolarHBondContact O-CE1 3.27Å; I1720-F1828 HydrophobicContact CD1-CB 3.84Å; I1720-F1828 HydrophobicContact CD1-CD2 4.3Å; I1720-F1828 HydrophobicContact CD1-CG 4.44Å; I1720-F1828 HydrophobicContact CG1-CB 3.86Å; I1720-F1828 HydrophobicContact CG1-CG 4.41Å; Y1822-F1828 HydrophobicContact CE1-CD2 4.38Å; Y1822-F1828 AromaticContact CE1-CE2 3.82Å; Y1822-F1828 HydrophobicContact CE1-CE2 3.82Å; Y1822-F1828 AromaticContact CZ-CE2 3.68Å; Y1822-F1828 WeakPolarHBondContact OH-CE2 3.31Å; T1826-F1828 VanDerWaalsContact CG2-O 3.25Å; T1826-F1828 WeakPolarHBondContact CG2-O 3.44Å; T1826-F1828 PolarHBondContact OG1-N 3.19Å; T1826-F1828 PolarHBondContact OG1-O 2.85Å; F1828-I1830 PolarHBondContact O-N 2.81Å
1829	N	68.6	Low	75.6	Confident	98 Å²	98	37.9 Å²	37.9	52%	0.524	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130	172.5	-74.6	-0.6	0	0	0	110.2	T1718 Q1719 I1720 V1831	T1718-N1829 PolarHBondContact O-N 3.44Å; Q1719-N1829 WeakPolarHBondContact CA-O 3.46Å; I1720-N1829 PolarHBondContact N-O 3.14Å; N1829-V1831 PolarHBondContact O-N 3.42Å
1830	I	70	Confident	76.8	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	98.9	176.4	-50.9	172.5	0	0	0	109	L1690 I1720 F1726 L1728 F1828 G1832 L1833 Q1838	L1690-I1830 HydrophobicContact CD1-CD1 4.19Å; L1690-I1830 HydrophobicContact CD2-CD1 4Å; I1720-I1830 HydrophobicContact CB-CG1 4.37Å; I1720-I1830 HydrophobicContact CD1-CG1 4.07Å; I1720-I1830 HydrophobicContact CG2-CG2 4.36Å; F1726-I1830 HydrophobicContact CE1-CG2 4.29Å; F1726-I1830 HydrophobicContact CZ-CG2 4.22Å; L1728-I1830 HydrophobicContact CD2-CD1 4.43Å; F1828-I1830 PolarHBondContact O-N 2.81Å; I1830-G1832 PolarHBondContact O-N 2.96Å; I1830-L1833 HydrophobicContact CB-CD1 4.16Å; I1830-L1833 HydrophobicContact CB-CG 4.49Å; I1830-L1833 HydrophobicContact CD1-CD1 4.06Å; I1830-L1833 HydrophobicContact CG2-CD1 3.74Å; I1830-L1833 HydrophobicContact CG2-CG 3.95Å; I1830-L1833 PolarHBondContact O-N 3.31Å; I1830-Q1838 PolarHBondContact O-NE2 2.99Å
1831	V	64.1	Low	77.6	Confident	66 Å²	66	39 Å²	39	40%	0.4	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	113.5	-180	-178.4	0	0	0	0	109.3	Q1719 I1720 T1722 N1829	Q1719-V1831 HydrophobicContact CB-CG2 3.96Å; Q1719-V1831 HydrophobicContact CG-CG2 4.24Å; I1720-V1831 WeakPolarHBondContact O-CB 3.35Å; I1720-V1831 PolarHBondContact O-N 2.93Å; T1722-V1831 WeakPolarHBondContact CG2-O 3.27Å; N1829-V1831 PolarHBondContact O-N 3.42Å
1832	G	62.6	Low	77.9	Confident	61 Å²	61	40.8 Å²	40.8	63%	0.629	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	120.6	-14.1	-179.5	0	0	0	0	0	114.6	I1830	I1830-G1832 PolarHBondContact O-N 2.96Å
1833	L	67.7	Low	77.9	Confident	23 Å²	23	41 Å²	41	12%	0.12	24%	0.244	C	C	.	.	S	Bend	trans	-100.9	145.9	172.1	-61.4	-179	0	0	0	110.7	L1728 L1739 L1768 I1830 Y1837 Q1838	L1728-L1833 HydrophobicContact CD2-CD1 3.71Å; L1739-L1833 HydrophobicContact CD1-CD1 4.33Å; L1739-L1833 HydrophobicContact CD1-CD2 3.98Å; L1768-L1833 HydrophobicContact CD1-CD2 3.92Å; I1830-L1833 HydrophobicContact CB-CD1 4.16Å; I1830-L1833 HydrophobicContact CB-CG 4.49Å; I1830-L1833 HydrophobicContact CD1-CD1 4.06Å; I1830-L1833 HydrophobicContact CG2-CD1 3.74Å; I1830-L1833 HydrophobicContact CG2-CG 3.95Å; I1830-L1833 PolarHBondContact O-N 3.31Å; L1833-Y1837 HydrophobicContact CB-CG 4.36Å; L1833-Q1838 PolarHBondContact O-NE2 3.04Å
1834	S	69.9	Low	77.8	Confident	56 Å²	56	41.2 Å²	41.2	39%	0.392	25%	0.245	S	C	.	.			trans	-67.6	163.6	177.6	72	0	0	0	0	112	D1836 Y1837	S1834-D1836 PolarHBondContact O-N 3.42Å; S1834-D1836 VanDerWaalsContact O-N 3.14Å; S1834-Y1837 WeakPolarHBondContact O-CB 3.48Å; S1834-Y1837 PolarHBondContact O-N 2.82Å; S1834-Y1837 WeakPolarHBondContact OG-CD2 3.05Å
1835	A	69.2	Low	78	Confident	75 Å²	75	41.2 Å²	41.2	62%	0.62	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-55.2	-32.7	179.7	0	0	0	0	0	112.8	Y1837 Q1838	A1835-Y1837 PolarHBondContact O-N 2.9Å; A1835-Q1838 PolarHBondContact O-N 3.18Å
1836	D	69.7	Low	77.8	Confident	67 Å²	67	41.2 Å²	41.2	36%	0.358	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-54.9	-37.6	175.4	-41.4	10.2	0	0	0	113	R1732 S1834 Q1838	R1732-D1836 VanDerWaalsContact CZ-CB 3.44Å; R1732-D1836 IonicContact CZ-OD2 2.81Å; R1732-D1836 IonicContact NH1-OD2 3.44Å; R1732-D1836 PolarHBondContact NH1-OD2 3.48Å; R1732-D1836 IonicContact NH2-OD2 2.77Å; R1732-D1836 PolarHBondContact NH2-OD2 3.41Å; S1834-D1836 PolarHBondContact O-N 3.42Å; S1834-D1836 VanDerWaalsContact O-N 3.14Å; D1836-Q1838 VanDerWaalsContact C-N 3.28Å; D1836-Q1838 PolarHBondContact O-N 2.83Å
1837	Y	75.5	Confident	77.8	Confident	43 Å²	43	41.9 Å²	41.9	17%	0.169	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-80.5	-6.5	178.8	-75.5	-82.1	0	0	0	113.3	I1687 V1730 R1732 E1737 L1739 L1833 S1834 A1835	I1687-Y1837 WeakPolarHBondContact CD1-O 3.36Å; I1687-Y1837 VanDerWaalsContact CG1-O 3.31Å; I1687-Y1837 WeakPolarHBondContact CG1-O 3.48Å; V1730-Y1837 HydrophobicContact CG1-CD1 3.92Å; V1730-Y1837 HydrophobicContact CG1-CE1 3.95Å; V1730-Y1837 HydrophobicContact CG2-CD1 4.19Å; R1732-Y1837 HydrophobicContact CG-CD1 4.11Å; R1732-Y1837 HydrophobicContact CG-CE1 3.55Å; E1737-Y1837 WeakPolarHBondContact OE2-CE1 3.35Å; E1737-Y1837 PolarHBondContact OE2-OH 3.47Å; L1739-Y1837 HydrophobicContact CD1-CD1 4.13Å; L1739-Y1837 HydrophobicContact CD1-CE1 3.93Å; L1833-Y1837 HydrophobicContact CB-CG 4.36Å; S1834-Y1837 WeakPolarHBondContact O-CB 3.48Å; S1834-Y1837 PolarHBondContact O-N 2.82Å; S1834-Y1837 WeakPolarHBondContact OG-CD2 3.05Å; A1835-Y1837 PolarHBondContact O-N 2.9Å
1838	Q	74.5	Confident	78.2	Confident	57 Å²	57	38.7 Å²	38.7	27%	0.266	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-105.2	9.1	-177.3	-57.6	-175.7	42.9	0	0	112.2	I1830 L1833 A1835 D1836	I1830-Q1838 PolarHBondContact O-NE2 2.99Å; L1833-Q1838 PolarHBondContact O-NE2 3.04Å; A1835-Q1838 PolarHBondContact O-N 3.18Å; D1836-Q1838 VanDerWaalsContact C-N 3.28Å; D1836-Q1838 PolarHBondContact O-N 2.83Å
1839	Q	85.7	Confident	78.6	Confident	96 Å²	96	38.4 Å²	38.4	45%	0.449	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-75.7	130.6	169.5	-63.8	-175.9	60.9	0	0	110	G1686 I1687	G1686-Q1839 CarbonylContact C-O 3.51Å; G1686-Q1839 WeakPolarHBondContact CA-O 3.38Å; I1687-Q1839 WeakPolarHBondContact CG1-O 3.49Å; I1687-Q1839 PolarHBondContact N-O 3.28Å
1840	N	88.6	Confident	79.1	Confident	41 Å²	41	33.9 Å²	33.9	22%	0.219	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-69.2	150	168.9	-67.4	-24.6	0	0	0	110.5	G1657 G1824 G1825 T1826	G1657-N1840 WeakPolarHBondContact O-CB 3.36Å; G1657-N1840 PolarHBondContact O-ND2 2.8Å; G1824-N1840 CarbonylContact O-C 3.49Å; G1824-N1840 WeakPolarHBondContact O-CB 3.5Å; G1825-N1840 WeakPolarHBondContact CA-OD1 3.25Å; T1826-N1840 PolarHBondContact N-OD1 3.22Å; T1826-N1840 VanDerWaalsContact N-OD1 3.1Å
1841	F	92.8	Very high	79.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-66.4	143.9	178.9	174.9	-100.5	0	0	0	112	F1655 G1657 L1679 T1681 I1687 I1688 G1824 G1843 I1845	F1655-F1841 HydrophobicContact CB-CD1 3.89Å; F1655-F1841 HydrophobicContact CD2-CD1 4.39Å; F1655-F1841 HydrophobicContact CG-CD1 4.19Å; G1657-F1841 WeakPolarHBondContact CA-O 3.33Å; G1657-F1841 PolarHBondContact N-O 3.21Å; L1679-F1841 HydrophobicContact CB-CZ 4.15Å; L1679-F1841 HydrophobicContact CD1-CZ 4.47Å; L1679-F1841 HydrophobicContact CD2-CE2 3.89Å; L1679-F1841 HydrophobicContact CD2-CZ 3.98Å; L1679-F1841 HydrophobicContact CG-CZ 4.46Å; T1681-F1841 HydrophobicContact CG2-CE2 3.86Å; T1681-F1841 HydrophobicContact CG2-CZ 4.3Å; I1687-F1841 WeakPolarHBondContact O-CB 3.39Å; I1688-F1841 HydrophobicContact CG1-CD2 3.96Å; I1688-F1841 HydrophobicContact CG1-CE2 4.29Å; G1824-F1841 PolarHBondContact O-N 3.04Å; F1841-G1843 VanDerWaalsContact CE1-C 3.49Å; F1841-I1845 HydrophobicContact CD1-CD1 3.99Å; F1841-I1845 HydrophobicContact CD1-CG1 4.12Å; F1841-I1845 HydrophobicContact CE1-CD1 3.99Å; F1841-I1845 HydrophobicContact CE1-CG1 3.61Å; F1841-I1845 HydrophobicContact CZ-CG1 4.33Å
1842	T	90.7	Very high	79.3	Confident	38 Å²	38	38.9 Å²	38.9	23%	0.233	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.1	166.8	-34.4	0	0	0	0	109.7	F1655 T1681 K1683	F1655-T1842 VanDerWaalsContact O-CA 3.24Å; F1655-T1842 WeakPolarHBondContact O-CA 3.34Å; F1655-T1842 WeakPolarHBondContact O-CG2 3.49Å; T1681-T1842 WeakPolarHBondContact CB-O 3.24Å; T1681-T1842 PolarHBondContact OG1-O 3.44Å; K1683-T1842 WeakPolarHBondContact CE-OG1 3.37Å
1843	G	91	Very high	79.4	Confident	8 Å²	8	40.5 Å²	40.5	8%	0.082	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	137.8	-169.6	-177.9	0	0	0	0	0	112.7	F1655 R1680 F1841	F1655-G1843 PolarHBondContact N-O 3.06Å; F1655-G1843 PolarHBondContact O-N 3.34Å; F1655-G1843 VanDerWaalsContact O-N 3.12Å; R1680-G1843 CarbonylContact O-C 3.56Å; R1680-G1843 WeakPolarHBondContact O-CA 3.27Å; F1841-G1843 VanDerWaalsContact CE1-C 3.49Å
1844	C	90.5	Very high	79.4	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.02	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	141.8	-179.3	-52.1	0	0	0	0	111.9	I1653 L1679 R1680 W1782 C1871	I1653-C1844 WeakPolarHBondContact O-CA 3.38Å; L1679-C1844 CarbonylContact C-O 3.58Å; L1679-C1844 WeakPolarHBondContact CA-O 3.09Å; L1679-C1844 WeakPolarHBondContact CB-O 3.39Å; R1680-C1844 HydrophobicContact CB-CB 4.05Å; R1680-C1844 PolarHBondContact N-O 2.88Å; R1680-C1844 PolarHBondContact O-N 3.04Å; W1782-C1844 HydrophobicContact CH2-CB 3.5Å; W1782-C1844 HydrophobicContact CZ2-CB 4.07Å; W1782-C1844 HydrophobicContact CZ3-CB 4.13Å; C1844-C1871 WeakPolarHBondContact CA-SG 3.24Å; C1844-C1871 HydrophobicContact CB-CB 4.11Å; C1844-C1871 WeakPolarHBondContact CB-SG 3.06Å; C1844-C1871 WeakPolarHBondContact SG-CB 3.14Å; C1844-C1871 CovalentContact SG-SG 2.02Å; C1844-C1871 PolarHBondContact SG-SG 3.33Å
1845	I	91	Very high	79.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.5	160.4	-50.4	-179.5	0	0	0	109	I1653 F1655 L1677 R1678 L1679 I1688 L1823 F1841 I1857	I1653-I1845 PolarHBondContact N-O 2.81Å; I1653-I1845 PolarHBondContact O-N 3.22Å; F1655-I1845 HydrophobicContact CD2-CB 4.26Å; F1655-I1845 HydrophobicContact CD2-CD1 4.01Å; F1655-I1845 HydrophobicContact CD2-CG1 3.83Å; F1655-I1845 HydrophobicContact CE2-CB 3.68Å; F1655-I1845 HydrophobicContact CE2-CD1 3.75Å; F1655-I1845 HydrophobicContact CE2-CG1 3.67Å; F1655-I1845 HydrophobicContact CZ-CB 4.45Å; F1655-I1845 HydrophobicContact CZ-CD1 4.03Å; F1655-I1845 HydrophobicContact CZ-CG1 4.42Å; L1677-I1845 HydrophobicContact CB-CG2 4.16Å; L1677-I1845 HydrophobicContact CD1-CG2 4.31Å; L1677-I1845 HydrophobicContact CD2-CG2 4.21Å; L1677-I1845 HydrophobicContact CG-CG2 4.47Å; R1678-I1845 CarbonylContact O-C 3.43Å; R1678-I1845 WeakPolarHBondContact O-CA 3.49Å; L1679-I1845 HydrophobicContact CB-CG1 4.34Å; I1688-I1845 HydrophobicContact CG2-CD1 4.3Å; L1823-I1845 HydrophobicContact CD1-CD1 3.9Å; L1823-I1845 HydrophobicContact CG-CD1 4.17Å; F1841-I1845 HydrophobicContact CD1-CD1 3.99Å; F1841-I1845 HydrophobicContact CD1-CG1 4.12Å; F1841-I1845 HydrophobicContact CE1-CD1 3.99Å; F1841-I1845 HydrophobicContact CE1-CG1 3.61Å; F1841-I1845 HydrophobicContact CZ-CG1 4.33Å; I1845-I1857 HydrophobicContact CB-CD1 4.44Å; I1845-I1857 HydrophobicContact CG2-CD1 4.13Å
1846	A	84	Confident	79.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	179.2	176.4	0	0	0	0	0	110.2	Q1650 R1678 W1782 M1848	Q1650-A1846 HydrophobicContact CB-CB 4.34Å; Q1650-A1846 WeakPolarHBondContact O-CB 3.33Å; R1678-A1846 HydrophobicContact CB-CB 4.4Å; R1678-A1846 PolarHBondContact N-O 3.44Å; R1678-A1846 PolarHBondContact O-N 3.29Å; W1782-A1846 HydrophobicContact CH2-CB 4.04Å; W1782-A1846 HydrophobicContact CZ3-CB 4.01Å; A1846-M1848 VanDerWaalsContact C-N 3.29Å; A1846-M1848 PolarHBondContact O-N 2.72Å; A1846-M1848 VanDerWaalsContact O-N 3.1Å
1847	D	79.9	Confident	80.2	Confident	30 Å²	30	38.3 Å²	38.3	16%	0.16	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.6	31	168.4	-60.1	53.7	0	0	0	116.2	Q1650 R1678 L1849	Q1650-D1847 VanDerWaalsContact CD-CG 3.41Å; Q1650-D1847 VanDerWaalsContact CD-OD1 3.28Å; Q1650-D1847 PolarHBondContact NE2-OD1 3.04Å; Q1650-D1847 PolarHBondContact NE2-OD2 3.4Å; Q1650-D1847 PolarHBondContact OE1-OD1 2.95Å; Q1650-D1847 PolarHBondContact OE1-OD2 2.72Å; R1678-D1847 HydrophobicContact CB-CB 4.15Å; R1678-D1847 HydrophobicContact CG-CB 4Å; R1678-D1847 IonicContact CZ-OD1 3.93Å; R1678-D1847 IonicContact CZ-OD2 3.98Å; R1678-D1847 IonicContact NE-OD1 2.65Å; R1678-D1847 PolarHBondContact NE-OD1 3.1Å; R1678-D1847 IonicContact NE-OD2 3.68Å; R1678-D1847 PolarHBondContact NE-OD2 3.38Å; R1678-D1847 VanDerWaalsContact NE-OD2 3.09Å; R1678-D1847 IonicContact NH2-OD1 2.65Å; R1678-D1847 PolarHBondContact NH2-OD1 2.85Å; R1678-D1847 IonicContact NH2-OD2 2.77Å; R1678-D1847 PolarHBondContact NH2-OD2 3.17Å; D1847-L1849 VanDerWaalsContact O-CD1 3.31Å; D1847-L1849 WeakPolarHBondContact O-CD1 3.5Å; D1847-L1849 PolarHBondContact O-N 2.86Å
1848	M	83.6	Confident	80.1	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.015	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	123	-177.6	-166.6	165.6	74.2	0	0	111.4	Y1663 R1676 L1689 L1823 A1846 I1850 I1855 I1857	Y1663-M1848 HydrophobicContact CE1-CE 3.98Å; Y1663-M1848 HydrophobicContact CE2-CE 3.93Å; R1676-M1848 CarbonylContact O-C 3.44Å; R1676-M1848 VanDerWaalsContact O-CA 3.3Å; R1676-M1848 WeakPolarHBondContact O-CA 3.34Å; L1689-M1848 HydrophobicContact CD1-SD 4.38Å; L1823-M1848 HydrophobicContact CD1-SD 3.85Å; L1823-M1848 HydrophobicContact CD2-CE 4.24Å; L1823-M1848 HydrophobicContact CD2-SD 3.97Å; L1823-M1848 HydrophobicContact CG-SD 4.49Å; A1846-M1848 VanDerWaalsContact C-N 3.29Å; A1846-M1848 PolarHBondContact O-N 2.72Å; A1846-M1848 VanDerWaalsContact O-N 3.1Å; M1848-I1850 HydrophobicContact CE-CD1 4.22Å; M1848-I1850 HydrophobicContact CG-CD1 4.46Å; M1848-I1850 HydrophobicContact CG-CG1 4.32Å; M1848-I1850 HydrophobicContact SD-CD1 4.18Å; M1848-I1855 HydrophobicContact CE-CB 3.73Å; M1848-I1855 HydrophobicContact CE-CG1 4.46Å; M1848-I1855 HydrophobicContact CE-CG2 3.52Å; M1848-I1855 HydrophobicContact CG-CB 4.46Å; M1848-I1855 PolarHBondContact O-N 2.79Å; M1848-I1857 HydrophobicContact CB-CD1 4.46Å; M1848-I1857 HydrophobicContact CB-CG1 4.07Å
1849	L	80.5	Confident	79.8	Confident	39 Å²	39	40.1 Å²	40.1	20%	0.204	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.3	165.6	-54.7	103	0	0	0	109.8	I1675 R1676 D1847 K1853 I1854	I1675-L1849 CarbonylContact C-O 3.55Å; I1675-L1849 WeakPolarHBondContact CA-O 3.1Å; R1676-L1849 HydrophobicContact CB-CB 4.39Å; R1676-L1849 HydrophobicContact CB-CD1 3.98Å; R1676-L1849 HydrophobicContact CG-CD1 4.11Å; R1676-L1849 PolarHBondContact N-O 3.19Å; R1676-L1849 PolarHBondContact O-N 2.87Å; D1847-L1849 VanDerWaalsContact O-CD1 3.31Å; D1847-L1849 WeakPolarHBondContact O-CD1 3.5Å; D1847-L1849 PolarHBondContact O-N 2.86Å; L1849-K1853 CarbonylContact C-O 3.42Å; L1849-K1853 WeakPolarHBondContact CA-O 3.14Å; L1849-I1854 HydrophobicContact CD2-CG1 3.56Å; L1849-I1854 HydrophobicContact CG-CG1 3.98Å
1850	I	80.2	Confident	79	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.1	173.8	-64.1	-178.7	0	0	0	108.2	L1666 I1667 N1674 I1675 M1848 E1852 K1853 I1855	L1666-I1850 HydrophobicContact CB-CG2 4.17Å; L1666-I1850 HydrophobicContact CD1-CD1 3.8Å; I1667-I1850 HydrophobicContact CD1-CG2 3.63Å; I1667-I1850 HydrophobicContact CG1-CG2 3.61Å; N1674-I1850 CarbonylContact O-C 3.56Å; N1674-I1850 WeakPolarHBondContact O-CA 3.49Å; I1675-I1850 HydrophobicContact CG1-CG1 4.34Å; I1675-I1850 HydrophobicContact CG2-CG1 4.34Å; M1848-I1850 HydrophobicContact CE-CD1 4.22Å; M1848-I1850 HydrophobicContact CG-CD1 4.46Å; M1848-I1850 HydrophobicContact CG-CG1 4.32Å; M1848-I1850 HydrophobicContact SD-CD1 4.18Å; I1850-E1852 PolarHBondContact O-N 3.28Å; I1850-K1853 PolarHBondContact N-O 2.87Å; I1850-K1853 WeakPolarHBondContact O-CB 3.4Å; I1850-K1853 PolarHBondContact O-N 2.88Å; I1850-K1853 VanDerWaalsContact O-N 3.07Å; I1850-I1855 HydrophobicContact CB-CD1 4.21Å; I1850-I1855 HydrophobicContact CB-CG1 3.74Å; I1850-I1855 HydrophobicContact CD1-CG1 4.24Å; I1850-I1855 HydrophobicContact CG1-CG1 3.93Å
1851	Q	72.7	Confident	78.4	Confident	81 Å²	81	36.8 Å²	36.8	38%	0.379	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	42.4	-171.6	-58.1	-165.3	-24.4	0	0	112.9	I1667 N1674 K1853	I1667-Q1851 HydrophobicContact CG1-CG 4.24Å; N1674-Q1851 PolarHBondContact O-N 2.72Å; Q1851-K1853 PolarHBondContact O-N 2.87Å
1852	E	65.6	Low	77.8	Confident	91 Å²	91	38.5 Å²	38.5	43%	0.425	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	-6.5	-174.3	-49.8	-157.4	153.8	0	0	116.4	N1332 N1537 I1850	N1332-E1852 WeakPolarHBondContact CB-OE1 3.31Å; N1332-E1852 PolarHBondContact ND2-OE1 3.17Å; N1537-E1852 PolarHBondContact ND2-OE1 2.87Å; N1537-E1852 PolarHBondContact ND2-OE2 3.01Å; I1850-E1852 PolarHBondContact O-N 3.28Å
1853	K	63.3	Low	77.2	Confident	96 Å²	96	39.6 Å²	39.6	42%	0.417	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.1	167.3	-171.6	-165.1	169.4	-159.1	0	109.4	L1849 I1850 Q1851 I1855 E1860	L1849-K1853 CarbonylContact C-O 3.42Å; L1849-K1853 WeakPolarHBondContact CA-O 3.14Å; I1850-K1853 PolarHBondContact N-O 2.87Å; I1850-K1853 WeakPolarHBondContact O-CB 3.4Å; I1850-K1853 PolarHBondContact O-N 2.88Å; I1850-K1853 VanDerWaalsContact O-N 3.07Å; Q1851-K1853 PolarHBondContact O-N 2.87Å; K1853-I1855 HydrophobicContact CB-CD1 4.24Å; K1853-I1855 HydrophobicContact CD-CD1 3.77Å; K1853-I1855 HydrophobicContact CG-CD1 4.12Å; K1853-I1855 PolarHBondContact O-N 2.98Å; K1853-E1860 WeakPolarHBondContact CE-OE1 3.36Å; K1853-E1860 IonicContact NZ-OE1 2.71Å; K1853-E1860 PolarHBondContact NZ-OE1 2.92Å; K1853-E1860 IonicContact NZ-OE2 3.66Å; K1853-E1860 PolarHBondContact NZ-OE2 3.48Å
1854	I	67.9	Low	76.7	Confident	112 Å²	112	42.6 Å²	42.6	57%	0.574	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	128	166.9	-61.1	171.4	0	0	0	108.1	L1849 P1856	L1849-I1854 HydrophobicContact CD2-CG1 3.56Å; L1849-I1854 HydrophobicContact CG-CG1 3.98Å; I1854-P1856 WeakPolarHBondContact O-CD 3.39Å
1855	I	75.1	Confident	76.1	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	24%	0.24	C	C	.	.			trans	-108	106.6	177.5	-49.7	-58.3	0	0	0	108.4	Y1663 L1666 M1848 I1850 K1853 I1857 E1860	Y1663-I1855 HydrophobicContact CD1-CG2 4.09Å; Y1663-I1855 HydrophobicContact CE1-CG2 3.98Å; L1666-I1855 HydrophobicContact CD1-CD1 4.31Å; L1666-I1855 HydrophobicContact CD1-CG1 4.3Å; L1666-I1855 HydrophobicContact CD1-CG2 4.06Å; L1666-I1855 HydrophobicContact CD2-CD1 4.26Å; M1848-I1855 HydrophobicContact CE-CB 3.73Å; M1848-I1855 HydrophobicContact CE-CG1 4.46Å; M1848-I1855 HydrophobicContact CE-CG2 3.52Å; M1848-I1855 HydrophobicContact CG-CB 4.46Å; M1848-I1855 PolarHBondContact O-N 2.79Å; I1850-I1855 HydrophobicContact CB-CD1 4.21Å; I1850-I1855 HydrophobicContact CB-CG1 3.74Å; I1850-I1855 HydrophobicContact CD1-CG1 4.24Å; I1850-I1855 HydrophobicContact CG1-CG1 3.93Å; K1853-I1855 HydrophobicContact CB-CD1 4.24Å; K1853-I1855 HydrophobicContact CD-CD1 3.77Å; K1853-I1855 HydrophobicContact CG-CD1 4.12Å; K1853-I1855 PolarHBondContact O-N 2.98Å; I1855-I1857 PolarHBondContact O-N 3.07Å; I1855-I1857 VanDerWaalsContact O-N 3.11Å; I1855-E1860 HydrophobicContact CG2-CB 3.95Å
1856	P	69.8	Low	75.4	Confident	52 Å²	52	47.9 Å²	47.9	34%	0.338	26%	0.263	S	S	.	.			trans	-56.4	115.7	171	-26.4	35.5	0	0	0	111.3	I1854 L1858 S1859 E1860	I1854-P1856 WeakPolarHBondContact O-CD 3.39Å; P1856-L1858 VanDerWaalsContact C-N 3.26Å; P1856-L1858 PolarHBondContact O-N 3.39Å; P1856-S1859 WeakPolarHBondContact CB-OG 3.34Å; P1856-S1859 PolarHBondContact O-N 2.94Å; P1856-E1860 HydrophobicContact CG-CG 4.45Å; P1856-E1860 PolarHBondContact O-N 2.71Å
1857	I	80.8	Confident	75.1	Confident	7 Å²	7	50.5 Å²	50.5	4%	0.036	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-40.6	-173.1	-64.6	174.8	0	0	0	111.5	I1653 F1655 Y1661 Y1663 L1823 I1845 M1848 I1855	I1653-I1857 HydrophobicContact CB-CG2 4.4Å; I1653-I1857 HydrophobicContact CG1-CG2 3.81Å; F1655-I1857 HydrophobicContact CZ-CG2 4.42Å; Y1661-I1857 WeakPolarHBondContact CD1-O 3.44Å; Y1661-I1857 HydrophobicContact CE1-CG2 4.49Å; Y1663-I1857 PolarHBondContact OH-O 3.41Å; L1823-I1857 HydrophobicContact CD2-CG1 4.49Å; L1823-I1857 HydrophobicContact CD2-CG2 3.91Å; I1845-I1857 HydrophobicContact CB-CD1 4.44Å; I1845-I1857 HydrophobicContact CG2-CD1 4.13Å; M1848-I1857 HydrophobicContact CB-CD1 4.46Å; M1848-I1857 HydrophobicContact CB-CG1 4.07Å; I1855-I1857 PolarHBondContact O-N 3.07Å; I1855-I1857 VanDerWaalsContact O-N 3.11Å
1858	L	73.7	Confident	74.8	Confident	52 Å²	52	53.5 Å²	53.5	27%	0.272	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-55.1	174.6	-65.3	-168.5	0	0	0	113.5	I1651 I1653 Y1661 P1856 E1860 A1861 I1868	I1651-L1858 HydrophobicContact CD1-CB 4.31Å; I1651-L1858 HydrophobicContact CD1-CD1 3.63Å; I1651-L1858 HydrophobicContact CD1-CG 3.92Å; I1651-L1858 HydrophobicContact CG2-CD1 4.39Å; I1653-L1858 HydrophobicContact CD1-CD1 4.29Å; I1653-L1858 HydrophobicContact CD1-CD2 3.56Å; I1653-L1858 HydrophobicContact CD1-CG 3.97Å; I1653-L1858 HydrophobicContact CG1-CD2 3.98Å; I1653-L1858 HydrophobicContact CG1-CG 4.49Å; Y1661-L1858 HydrophobicContact CE1-CD2 3.51Å; Y1661-L1858 WeakPolarHBondContact OH-CD2 3.42Å; P1856-L1858 VanDerWaalsContact C-N 3.26Å; P1856-L1858 PolarHBondContact O-N 3.39Å; L1858-E1860 PolarHBondContact O-N 3.24Å; L1858-A1861 PolarHBondContact O-N 3.44Å; L1858-I1868 HydrophobicContact CD2-CD1 4.47Å; L1858-I1868 HydrophobicContact CD2-CG2 3.98Å
1859	S	68.7	Low	74.4	Confident	86 Å²	86	57.8 Å²	57.8	60%	0.601	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.7	-159.3	71.7	0	0	0	0	116.1	P1856	P1856-S1859 WeakPolarHBondContact CB-OG 3.34Å; P1856-S1859 PolarHBondContact O-N 2.94Å
1860	E	69.3	Low	74	Confident	42 Å²	42	64.1 Å²	64.1	20%	0.196	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	3.1	169	-68.9	-165.2	-180	0	0	113.5	Y1663 K1853 I1855 P1856 L1858	Y1663-E1860 HydrophobicContact CD1-CB 4.38Å; Y1663-E1860 VanDerWaalsContact CD1-O 3.25Å; Y1663-E1860 WeakPolarHBondContact CD1-O 3.24Å; Y1663-E1860 HydrophobicContact CE1-CB 4.49Å; K1853-E1860 WeakPolarHBondContact CE-OE1 3.36Å; K1853-E1860 IonicContact NZ-OE1 2.71Å; K1853-E1860 PolarHBondContact NZ-OE1 2.92Å; K1853-E1860 IonicContact NZ-OE2 3.66Å; K1853-E1860 PolarHBondContact NZ-OE2 3.48Å; I1855-E1860 HydrophobicContact CG2-CB 3.95Å; P1856-E1860 HydrophobicContact CG-CG 4.45Å; P1856-E1860 PolarHBondContact O-N 2.71Å; L1858-E1860 PolarHBondContact O-N 3.24Å
1861	A	75.8	Confident	73.7	Confident	24 Å²	24	64.6 Å²	64.6	20%	0.198	34%	0.339	C	S	.	.			trans	-75	131.4	178.2	0	0	0	0	0	111.9	Y1661 T1662 Y1663 L1858 I1864	Y1661-A1861 HydrophobicContact CD1-CB 3.74Å; T1662-A1861 CarbonylContact O-C 3.58Å; T1662-A1861 VanDerWaalsContact O-CA 3.24Å; T1662-A1861 WeakPolarHBondContact O-CA 3.34Å; Y1663-A1861 HydrophobicContact CD1-CB 4.23Å; Y1663-A1861 HydrophobicContact CE1-CB 3.73Å; L1858-A1861 PolarHBondContact O-N 3.44Å; A1861-I1864 HydrophobicContact CB-CD1 4.42Å; A1861-I1864 HydrophobicContact CB-CG1 4.06Å
1862	T	79.2	Confident	73.4	Confident	36 Å²	36	69.5 Å²	69.5	22%	0.221	36%	0.359	C	S	.	.	S	Bend	trans	-82.7	-27.3	179.8	47	0	0	0	0	113.7	T1203 T1662 Y1663 R1664	T1203-T1862 HydrophobicContact CG2-CG2 3.99Å; T1662-T1862 PolarHBondContact O-N 2.91Å; T1662-T1862 PolarHBondContact O-OG1 3.33Å; T1662-T1862 VanDerWaalsContact O-OG1 3.13Å; T1662-T1862 PolarHBondContact OG1-OG1 2.76Å; Y1663-T1862 WeakPolarHBondContact CA-OG1 3.46Å; Y1663-T1862 PolarHBondContact N-OG1 2.93Å; R1664-T1862 HydrophobicContact CB-CG2 4.18Å; R1664-T1862 HydrophobicContact CG-CG2 4.18Å; R1664-T1862 PolarHBondContact N-OG1 2.86Å
1863	E	78.6	Confident	72.7	Confident	61 Å²	61	69.8 Å²	69.8	29%	0.285	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	146.9	171.2	-53.2	168.4	-163.8	0	0	108.7	T1662 R1664 H1865	T1662-E1863 HydrophobicContact CG2-CB 3.96Å; T1662-E1863 PolarHBondContact N-O 3.29Å; T1662-E1863 VanDerWaalsContact OG1-CB 3.27Å; T1662-E1863 WeakPolarHBondContact OG1-CB 3.34Å; T1662-E1863 PolarHBondContact OG1-N 2.77Å; T1662-E1863 VanDerWaalsContact OG1-N 3.09Å; R1664-E1863 IonicContact CZ-OE1 3.66Å; R1664-E1863 VanDerWaalsContact CZ-OE1 3.32Å; R1664-E1863 IonicContact NH1-OE1 3.85Å; R1664-E1863 PolarHBondContact NH1-OE1 3.08Å; R1664-E1863 IonicContact NH2-OE1 2.79Å; R1664-E1863 PolarHBondContact NH2-OE1 3.48Å; E1863-H1865 IonicContact OE2-CE1 3.18Å; E1863-H1865 IonicContact OE2-NE2 2.78Å; E1863-H1865 PolarHBondContact OE2-NE2 3.17Å
1864	I	80.1	Confident	71.5	Confident	71 Å²	71	72.2 Å²	72.2	36%	0.364	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.5	174.3	-51.2	173.1	0	0	0	107.9	Y1661 A1861 I1868	Y1661-I1864 HydrophobicContact CD1-CB 4.43Å; Y1661-I1864 HydrophobicContact CD1-CD1 3.91Å; Y1661-I1864 HydrophobicContact CD1-CG1 3.66Å; Y1661-I1864 HydrophobicContact CD1-CG2 4.08Å; Y1661-I1864 HydrophobicContact CD2-CG2 4.27Å; Y1661-I1864 HydrophobicContact CE1-CB 4.43Å; Y1661-I1864 HydrophobicContact CE1-CD1 3.53Å; Y1661-I1864 HydrophobicContact CE1-CG1 3.75Å; Y1661-I1864 HydrophobicContact CE1-CG2 3.81Å; Y1661-I1864 HydrophobicContact CE2-CG2 4.06Å; Y1661-I1864 HydrophobicContact CG-CG1 4.4Å; Y1661-I1864 HydrophobicContact CG-CG2 4.29Å; A1861-I1864 HydrophobicContact CB-CD1 4.42Å; A1861-I1864 HydrophobicContact CB-CG1 4.06Å; I1864-I1868 HydrophobicContact CD1-CD1 3.85Å; I1864-I1868 HydrophobicContact CG2-CD1 4.07Å; I1864-I1868 HydrophobicContact CG2-CG1 3.99Å
1865	H	78	Confident	71.7	Confident	69 Å²	69	70.2 Å²	70.2	32%	0.319	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	140.9	176.4	-60.1	-98.5	0	0	0	108.4	T1659 V1660 I1827 E1863	T1659-H1865 CarbonylContact C-O 3.57Å; T1659-H1865 VanDerWaalsContact CA-O 3.24Å; T1659-H1865 WeakPolarHBondContact CA-O 3.37Å; V1660-H1865 HydrophobicContact CB-CB 4.34Å; V1660-H1865 PolarHBondContact N-O 2.95Å; V1660-H1865 PolarHBondContact O-N 3.24Å; I1827-H1865 HydrophobicContact CG2-CB 4.44Å; E1863-H1865 IonicContact OE2-CE1 3.18Å; E1863-H1865 IonicContact OE2-NE2 2.78Å; E1863-H1865 PolarHBondContact OE2-NE2 3.17Å
1866	G	77.5	Confident	71.5	Confident	46 Å²	46	73.7 Å²	73.7	47%	0.474	40%	0.403	S	S	.	.	S	Bend	trans	79	-176.3	179.5	0	0	0	0	0	115.9	L1658	L1658-G1866 WeakPolarHBondContact O-CA 3.32Å
1867	P	76	Confident	71.6	Confident	55 Å²	55	74.9 Å²	74.9	36%	0.357	41%	0.407	S	S	.	.			trans	-78.9	134.3	-173.3	31.2	-34	0	0	0	112.5	T1659 E1869	T1659-P1867 WeakPolarHBondContact CG2-O 3.35Å; T1659-P1867 PolarHBondContact OG1-O 2.72Å; P1867-E1869 PolarHBondContact O-N 2.62Å
1868	I	73.7	Confident	71.1	Confident	93 Å²	93	78.9 Å²	78.9	48%	0.477	43%	0.429	S	S	.	.			trans	-86.5	98.6	171.5	-55.9	-178.3	0	0	0	108.6	I1653 Y1661 L1858 I1864	I1653-I1868 HydrophobicContact CD1-CG2 4.22Å; Y1661-I1868 WeakPolarHBondContact OH-CG2 3.39Å; L1858-I1868 HydrophobicContact CD2-CD1 4.47Å; L1858-I1868 HydrophobicContact CD2-CG2 3.98Å; I1864-I1868 HydrophobicContact CD1-CD1 3.85Å; I1864-I1868 HydrophobicContact CG2-CD1 4.07Å; I1864-I1868 HydrophobicContact CG2-CG1 3.99Å
1869	E	75.5	Confident	70.9	Confident	94 Å²	94	80.6 Å²	80.6	44%	0.439	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	147.1	173.6	-72	-177.2	-169.8	0	0	111.1	I1653 N1654 P1867	I1653-E1869 WeakPolarHBondContact CA-O 3.11Å; N1654-E1869 HydrophobicContact CB-CB 3.82Å; N1654-E1869 PolarHBondContact N-O 3.49Å; N1654-E1869 PolarHBondContact ND2-OE2 3.15Å; P1867-E1869 PolarHBondContact O-N 2.62Å
1870	R	73.7	Confident	71.1	Confident	171 Å²	171	80.2 Å²	80.2	65%	0.645	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	140.4	165.2	-69.7	-176	179.9	-175.8	0.6	109.3	K1872	R1870-K1872 PolarHBondContact O-N 2.94Å
1871	C	73.4	Confident	71.2	Confident	13 Å²	13	82.9 Å²	82.9	9%	0.088	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-62.2	133.6	167.8	-83.5	0	0	0	0	111.3	L1652 N1654 C1844 T1873	L1652-C1871 HydrophobicContact CB-CB 3.84Å; L1652-C1871 HydrophobicContact CD2-CB 4.5Å; L1652-C1871 PolarHBondContact O-N 3Å; N1654-C1871 VanDerWaalsContact CA-SG 3.57Å; C1844-C1871 WeakPolarHBondContact CA-SG 3.24Å; C1844-C1871 HydrophobicContact CB-CB 4.11Å; C1844-C1871 WeakPolarHBondContact CB-SG 3.06Å; C1844-C1871 WeakPolarHBondContact SG-CB 3.14Å; C1844-C1871 CovalentContact SG-SG 2.02Å; C1844-C1871 PolarHBondContact SG-SG 3.33Å; C1871-T1873 PolarHBondContact O-N 3.25Å
1872	K	66.2	Low	70.8	Confident	184 Å²	184	87.5 Å²	87.5	80%	0.8	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-60.9	121.3	162.8	-59.6	-179.8	-177.2	-178.9	0	107.2	R1680 R1870	R1680-K1872 PolarHBondContact NH2-O 3.43Å; R1870-K1872 PolarHBondContact O-N 2.94Å
1873	T	49.8	Very low	70.1	Confident	97 Å²	97	91.8 Å²	91.8	60%	0.595	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-55.4	142.7	174.2	45.3	0	0	0	0	109.6	C1871	C1871-T1873 PolarHBondContact O-N 3.25Å
1874	P	39.1	Very low	69.4	Low	147 Å²	147	94.5 Å²	94.5	96%	0.955	50%	0.501	S	S	*	.			trans	-61.1	0	153.6	31.9	-30.4	0	0	0	109.7

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