A0A5K4F8I1_SCHMA Loading...

Tr-type G domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F8I1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,280 aa.

						>A0A5K4F8I1_SCHMA|A0A5K4F8I1
MIQLLPTHNSSKELFTDIDPYQDNNFSSILFIRPNGNKHYLPVKYPNTILKWYENILIHLEKNKLLQWTLITISDYEECIGLKLIQWNNELMTLLKHIAPMLQQIDLSYLRLNEIPTNLLLRFSTHLFSLNLSYNQIEMNIFHELKSVYLWYKKQKHTENTIKQDVCCWIQTIHEIYLDHNKLEDQFPYEISNYMIGLRRLYIHNNGITSLKGLNGLTQLQVLRADFNKITSLHDYFFTLKKIEYLYLSHNCITQPISGIRLKYLNHLKVIDLSYNGLSFLPTVIFSLPCLQTLKLDHNNISNLPTLRSNSRISKEPIQLIDLSYNQINAISDGLLRITKQLDLSKNKLRTFPASLLKIIANIAQLKKIKPSEIIKLDLNDNPMIWPPYNIIECGIDSMIHYFQESRTELQSYYGIKITLLGDINCGKSSLAMSIVDKQNRMTENLEETTYSIESYTIQYDAIELIPKLYTDSEGNNNNNETILKKQTTRPTTITLWDCSGHINYIPLISFFTSLSTIFIIVVDITKLEPTLLIDNNNNSNNNNNIKNSKNYFYQTIGIWLDLILYRLNYLKIIVIVTKCDLIQSKIELNERINQLYKQIINYIKIKKFWFKNQIEHIESSINITQSITYYYEQLNNIYNTLYTFIYPYINRISLNNNNNNNNNENIINFNQLYYSIFDLAMKTPTYIPFCLKPLPNIWLDIELYLNDIKYSYNTHFNNNNNEMNINTTILLKSSFCHIIQNKFNLNLHNLKQLLTYLNNTGKILILDSYITLNNNNNNNEDNSLNDPITSSSSLIRPNPKFYIIIDPNLFIESFKYLLNPNLYYIIDYIKNKKINFSEKFYLSKIFLKNFIKNFKKIKKSDSINSLINYCNELKYGTGILSAYLWITLVEYNNLYIIKNNIEIGKSYVEILWRWLELAYPVPEPDLFKNFDTQINVSLDELNSSIWKFKYFPSPREIALSCGIISSTESLSQSPDNQSDTEDSTNSDTRQSPTNDQIQSLLCPERLPALCFPCLIPTSFCSPTDEMSNDLWKTACETGPRPIIFVYRFSYGLPQELFDKATVRLNWPELFKFRYTAHWKTGVQMFNSINRIVLRFLLIKSDNEDSLIKFEFRALPVTTTNSDDNEIRIENNDTAANIDEENHERSTLDENTTFNAGKSLKESNDKRQKHKQKPKWHKWPVPEENLWNLMLPILKEFDSILLAYKGLCCKRVMECPKCNELTLAGEWLTPSEVQTVKYRKCPACAHRIPSCLIAPPETGFQYKRKIKSEKKSRKCNKSRK
					

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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	21.5	Very low	27.8	Very low	248 Å²	248	145.9 Å²	145.9	100%	1.222	79%	0.794	S	S	*	*				0	101	0	-78.4	-154.1	-102.3	0	0	108.5
2	I	25.8	Very low	27.8	Very low	132 Å²	132	146.4 Å²	146.4	68%	0.677	78%	0.783	S	S	*	*			trans	-97	111	172.8	-65.1	171.9	0	0	0	105.7	F31	I2-F31 HydrophobicContact CG2-CD2 4.42Å
3	Q	22.9	Very low	28	Very low	184 Å²	184	149.5 Å²	149.5	86%	0.86	79%	0.79	S	S	*	*			trans	-85.7	110.7	171.9	-150	173.8	6.2	0	0	106.7	L5	Q3-L5 PolarHBondContact O-N 3.38Å; Q3-L5 VanDerWaalsContact O-N 3.14Å
4	L	28.6	Very low	28.4	Very low	137 Å²	137	149.5 Å²	149.5	72%	0.717	79%	0.789	S	S	*	*			trans	-64.2	105.9	177.3	-71	158.3	0	0	0	108.6	F31	L4-F31 HydrophobicContact CD2-CE2 4.26Å
5	L	24.6	Very low	28.5	Very low	152 Å²	152	151.6 Å²	151.6	80%	0.796	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.6	135.3	170.9	-85.6	162.8	0	0	0	109.4	Q3 T7	Q3-L5 PolarHBondContact O-N 3.38Å; Q3-L5 VanDerWaalsContact O-N 3.14Å; L5-T7 PolarHBondContact O-N 3Å
6	P	28.2	Very low	28.5	Very low	116 Å²	116	148.8 Å²	148.8	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-71	126.9	-176	-8.1	23.9	0	0	0	110.7	H8	P6-H8 PolarHBondContact O-N 3.03Å
7	T	32.6	Very low	28.7	Very low	116 Å²	116	149.1 Å²	149.1	71%	0.712	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.5	122.4	175.6	48.3	0	0	0	0	110.6	L5	L5-T7 PolarHBondContact O-N 3Å
8	H	27.2	Very low	28.7	Very low	179 Å²	179	147.9 Å²	147.9	83%	0.829	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-59	133.7	170.8	-89.8	-85.1	0	0	0	111.2	P6 S10	P6-H8 PolarHBondContact O-N 3.03Å; H8-S10 VanDerWaalsContact C-N 3.3Å; H8-S10 PolarHBondContact O-N 3.31Å
9	N	32.9	Very low	29	Very low	133 Å²	133	145.9 Å²	145.9	71%	0.711	77%	0.766	S	S	*	*	S	Bend	trans	-58.6	48.5	-167.3	-78.3	-36.5	0	0	0	118.4
10	S	30.9	Very low	29.5	Very low	119 Å²	119	142.6 Å²	142.6	83%	0.832	75%	0.754	S	S	*	*	S	Bend	trans	-123.2	8	173	56.9	0	0	0	0	116.1	H8	H8-S10 VanDerWaalsContact C-N 3.3Å; H8-S10 PolarHBondContact O-N 3.31Å
11	S	30.1	Very low	30	Very low	89 Å²	89	145.9 Å²	145.9	62%	0.622	76%	0.757	S	S	*	*			trans	-126.1	36.9	174.4	64.6	0	0	0	0	113.1
12	K	28.9	Very low	30.8	Very low	152 Å²	152	142.1 Å²	142.1	66%	0.661	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-0.6	180	-98.8	-173.8	176.7	179.7	0	115.3	T16	K12-T16 VanDerWaalsContact O-CG2 3.26Å; K12-T16 WeakPolarHBondContact O-CG2 3.46Å
13	E	30.2	Very low	31.2	Very low	187 Å²	187	141 Å²	141	87%	0.874	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	2.5	-177.8	-75.4	-172.4	167.9	0	0	115.7
14	L	34	Very low	31.6	Very low	149 Å²	149	140.3 Å²	140.3	78%	0.78	73%	0.734	S	S	*	*	S	Bend	trans	-114.3	0.9	-178.6	-106.1	134.6	0	0	0	115.9
15	F	28.7	Very low	31.7	Very low	181 Å²	181	140.3 Å²	140.3	79%	0.794	74%	0.735	S	S	*	*	S	Bend	trans	-144.9	44.6	-178.8	-65	-75	0	0	0	113.3
16	T	29.3	Very low	31.8	Very low	106 Å²	106	139.8 Å²	139.8	65%	0.65	73%	0.727	S	S	*	*			trans	-89.6	-7.1	-177	42.4	0	0	0	0	116.8	K12	K12-T16 VanDerWaalsContact O-CG2 3.26Å; K12-T16 WeakPolarHBondContact O-CG2 3.46Å
17	D	31	Very low	31.8	Very low	154 Å²	154	138.4 Å²	138.4	82%	0.824	72%	0.72	S	S	*	*	S	Bend	trans	-111	28.6	-172.2	-70.5	-7.4	0	0	0	114.9
18	I	29.3	Very low	31.7	Very low	128 Å²	128	136.9 Å²	136.9	66%	0.656	71%	0.714	S	S	*	*			trans	-126	99.7	173.6	-50.9	177.9	0	0	0	109.1	P20	I18-P20 WeakPolarHBondContact O-CD 3.46Å
19	D	34.3	Very low	31.8	Very low	110 Å²	110	134 Å²	134	59%	0.588	70%	0.703	S	S	*	*			trans	-62.7	112.6	173.9	-166.2	-5.4	0	0	0	109.3	Y21 Q22	D19-Y21 PolarHBondContact O-N 3.36Å; D19-Q22 PolarHBondContact O-N 3.09Å
20	P	38.7	Very low	31.7	Very low	79 Å²	79	132.6 Å²	132.6	51%	0.513	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71	2.5	-166.9	26.3	-33.9	0	0	0	114.9	I18 F26	I18-P20 WeakPolarHBondContact O-CD 3.46Å; P20-F26 HydrophobicContact CB-CZ 4.46Å
21	Y	40.4	Very low	31.8	Very low	212 Å²	212	133.3 Å²	133.3	83%	0.831	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-7.7	-178.5	-70	-76.1	0	0	0	115.4	D19	D19-Y21 PolarHBondContact O-N 3.36Å
22	Q	37.7	Very low	31.8	Very low	169 Å²	169	133 Å²	133	79%	0.79	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-17.5	-176.9	-73.4	-155	-14	0	0	116.7	D19	D19-Q22 PolarHBondContact O-N 3.09Å
23	D	34.3	Very low	31.9	Very low	110 Å²	110	137.2 Å²	137.2	59%	0.588	69%	0.686	S	S	*	*			trans	-118.5	100.7	179.2	-84.3	-37.9	0	0	0	112.7	N25	D23-N25 PolarHBondContact O-N 3.08Å
24	N	32.3	Very low	31.9	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	68%	0.678	S	S	*	*			trans	-67.1	20.9	170.6	-88.4	-29.6	0	0	0	114.1
25	N	30.1	Very low	31.9	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	68%	0.679	S	S	*	*			trans	-103.2	43.4	178.5	-80.9	-18.6	0	0	0	112.4	D23 S27	D23-N25 PolarHBondContact O-N 3.08Å; N25-S27 PolarHBondContact O-N 2.71Å
26	F	26.7	Very low	32	Very low	140 Å²	140	128.7 Å²	128.7	61%	0.614	68%	0.681	S	S	*	*			trans	-71.4	73.3	166.7	-77.1	-76.1	0	0	0	110.7	P20 I29	P20-F26 HydrophobicContact CB-CZ 4.46Å; F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.29Å
27	S	29	Very low	32.1	Very low	88 Å²	88	130.6 Å²	130.6	62%	0.615	69%	0.687	S	S	*	*			trans	-121.5	54.3	176.5	72.7	0	0	0	0	112.9	N25	N25-S27 PolarHBondContact O-N 2.71Å
28	S	30.2	Very low	32.1	Very low	83 Å²	83	133 Å²	133	58%	0.58	69%	0.69	S	S	*	*			trans	170.8	75.1	147	53.3	0	0	0	0	110.9	L30	S28-L30 PolarHBondContact O-N 3.37Å
29	I	29.8	Very low	32	Very low	119 Å²	119	134.1 Å²	134.1	61%	0.61	69%	0.692	S	S	*	*			trans	-86.9	103	164.3	-65.2	175.2	0	0	0	108.5	F26 F31	F26-I29 HydrophobicContact CD1-CD1 3.87Å; F26-I29 HydrophobicContact CE1-CD1 4.29Å; I29-F31 HydrophobicContact CG2-CD2 4.18Å; I29-F31 HydrophobicContact CG2-CE2 4Å
30	L	30.6	Very low	31.8	Very low	103 Å²	103	139 Å²	139	54%	0.539	70%	0.704	S	S	.	*			trans	-12.9	123.5	147.8	-164.9	120.1	0	0	0	115	S28	S28-L30 PolarHBondContact O-N 3.37Å
31	F	31.8	Very low	31.5	Very low	134 Å²	134	142.7 Å²	142.7	59%	0.588	72%	0.719	S	S	*	*			trans	-157.9	120.7	150.8	-92.7	-69	0	0	0	112.5	I2 L4 I29	I2-F31 HydrophobicContact CG2-CD2 4.42Å; L4-F31 HydrophobicContact CD2-CE2 4.26Å; I29-F31 HydrophobicContact CG2-CD2 4.18Å; I29-F31 HydrophobicContact CG2-CE2 4Å
32	I	30.4	Very low	31	Very low	84 Å²	84	137.8 Å²	137.8	43%	0.431	71%	0.712	S	S	.	*			trans	-76.7	130.6	170	-59.5	149.3	0	0	0	109	I73	I32-I73 WeakPolarHBondContact CD1-O 3.08Å; I32-I73 WeakPolarHBondContact CG1-O 3.47Å
33	R	31.5	Very low	31.2	Very low	239 Å²	239	133.6 Å²	133.6	90%	0.902	70%	0.698	S	S	*	*			trans	177.8	115.1	137.8	-106.5	175.7	175	174.1	1.1	110.8
34	P	31.1	Very low	31.5	Very low	110 Å²	110	136.7 Å²	136.7	71%	0.714	71%	0.707	S	S	*	*			trans	-126.2	132.5	144.3	23.5	-5.2	0	0	0	112.1
35	N	32	Very low	31.9	Very low	147 Å²	147	137.3 Å²	137.3	79%	0.786	70%	0.698	S	S	*	*			trans	77.3	78.6	151.4	-57.9	-12.6	0	0	0	118.9	N37	N35-N37 PolarHBondContact O-N 3.08Å
36	G	31.3	Very low	32.6	Very low	81 Å²	81	134.7 Å²	134.7	84%	0.835	69%	0.688	S	S	*	*				68.4	9	107.9	0	0	0	0	0	121.3
37	N	31	Very low	33.6	Very low	147 Å²	147	134 Å²	134	79%	0.786	69%	0.691	S	S	*	*			trans	-109.3	112.9	177.1	-78	-31.8	0	0	0	112.5	N35 H39	N35-N37 PolarHBondContact O-N 3.08Å; N37-H39 VanDerWaalsContact C-N 3.32Å; N37-H39 PolarHBondContact O-N 3.08Å; N37-H39 VanDerWaalsContact O-N 3.14Å
38	K	31.8	Very low	34.8	Very low	203 Å²	203	134.7 Å²	134.7	88%	0.883	69%	0.691	S	S	*	*			trans	-77.8	24.7	-170.4	-80.3	-172.8	174.1	-178.8	0	116.7
39	H	28.2	Very low	36.1	Very low	153 Å²	153	131.6 Å²	131.6	71%	0.708	67%	0.668	S	S	*	*			trans	-137.1	59.8	-168.2	-67.9	-52.9	0	0	0	116.6	N37	N37-H39 VanDerWaalsContact C-N 3.32Å; N37-H39 PolarHBondContact O-N 3.08Å; N37-H39 VanDerWaalsContact O-N 3.14Å
40	Y	30.1	Very low	37.5	Very low	212 Å²	212	130.1 Å²	130.1	83%	0.831	66%	0.661	S	S	*	*			trans	-148.8	143.6	162.6	-66.7	-71	0	0	0	112.8
41	L	30.7	Very low	38.9	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-94.4	154.3	-176.8	-78.2	157.5	0	0	0	111.7
42	P	31.6	Very low	40.3	Very low	108 Å²	108	130.5 Å²	130.5	70%	0.701	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-75.2	150.5	-173.7	28	-33.5	0	0	0	115.5
43	V	41.5	Very low	41.9	Very low	82 Å²	82	129 Å²	129	50%	0.497	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-102.4	159.7	-167.3	-178.1	0	0	0	0	113.3	E78	V43-E78 HydrophobicContact CG1-CG 4.42Å; V43-E78 VanDerWaalsContact CG1-OE1 3.3Å; V43-E78 WeakPolarHBondContact CG1-OE1 3.34Å
44	K	40.8	Very low	43.5	Very low	175 Å²	175	122.5 Å²	122.5	76%	0.761	63%	0.625	S	S	*	*	S	Bend	trans	-102.3	-11	-164	-89.5	-176.4	174.9	-179.1	0	118.9
45	Y	40.1	Very low	45.2	Very low	181 Å²	181	121.3 Å²	121.3	71%	0.71	61%	0.612	S	S	*	*			trans	-141.4	91.1	-170.4	-63.5	-74.5	0	0	0	115.6
46	P	45	Very low	46.9	Very low	82 Å²	82	114.3 Å²	114.3	53%	0.532	58%	0.575	S	S	.	*			trans	-84.2	-11	-171.8	29.2	-33.6	0	0	0	117.9	T48	P46-T48 PolarHBondContact O-N 2.97Å
47	N	47.3	Very low	48.6	Very low	127 Å²	127	112.2 Å²	112.2	68%	0.679	54%	0.544	S	S	*	.	H	α-helix	trans	-73.3	-25.3	-159.8	-71.1	-5.4	0	0	0	116.9
48	T	55.2	Low	50.5	Low	101 Å²	101	109.7 Å²	109.7	62%	0.62	53%	0.53	S	S	*	.	H	α-helix	trans	-78	-35.6	-178.6	26.3	0	0	0	0	113.2	P46	P46-T48 PolarHBondContact O-N 2.97Å
49	I	56.6	Low	52.2	Low	18 Å²	18	103.5 Å²	103.5	9%	0.092	50%	0.504	C	S	.	.	H	α-helix	trans	-69.6	-37.4	-178.3	-63.3	162.5	0	0	0	110.6	K51 W52 Y53 I73 E78 I80	I49-K51 PolarHBondContact O-N 3.36Å; I49-W52 PolarHBondContact O-N 3.37Å; I49-Y53 PolarHBondContact O-N 3.49Å; I49-I73 HydrophobicContact CG2-CG2 3.79Å; I49-E78 VanDerWaalsContact CD1-CA 3.5Å; I49-E78 HydrophobicContact CD1-CB 3.7Å; I49-E78 HydrophobicContact CD1-CG 3.88Å; I49-I80 HydrophobicContact CG2-CD1 4.25Å; I49-I80 HydrophobicContact CG2-CG1 4.13Å
50	L	58.4	Low	54.1	Low	88 Å²	88	96.2 Å²	96.2	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-56.6	-46	177.3	-81.4	159.5	0	0	0	112.2	W52 Y53 E54	L50-W52 VanDerWaalsContact C-N 3.34Å; L50-W52 PolarHBondContact O-N 3.07Å; L50-Y53 WeakPolarHBondContact O-CB 3.44Å; L50-Y53 PolarHBondContact O-N 3.2Å; L50-E54 WeakPolarHBondContact O-CG 3.48Å; L50-E54 PolarHBondContact O-N 3.21Å
51	K	61.8	Low	56.1	Low	146 Å²	146	91.9 Å²	91.9	64%	0.635	46%	0.457	S	S	*	.	H	α-helix	trans	-62.4	-38.8	177.1	-83.6	-173.1	174.9	-178.6	0	113.4	I49 N55	I49-K51 PolarHBondContact O-N 3.36Å; K51-N55 PolarHBondContact O-N 2.83Å; K51-N55 PolarHBondContact O-ND2 3.41Å
52	W	60.7	Low	58.1	Low	100 Å²	100	92.4 Å²	92.4	38%	0.379	45%	0.453	S	S	.	.	H	α-helix	trans	-68.8	-40.2	177.7	-73.7	-4.2	0	0	0	111.3	I49 L50 N55 I56 I80 M101	I49-W52 PolarHBondContact O-N 3.37Å; L50-W52 VanDerWaalsContact C-N 3.34Å; L50-W52 PolarHBondContact O-N 3.07Å; W52-N55 PolarHBondContact O-N 3.41Å; W52-I56 VanDerWaalsContact O-CG1 3.29Å; W52-I56 WeakPolarHBondContact O-CG1 3.42Å; W52-I56 PolarHBondContact O-N 2.95Å; W52-I56 VanDerWaalsContact O-N 3.1Å; W52-I80 HydrophobicContact CB-CD1 3.29Å; W52-I80 HydrophobicContact CD2-CD1 4.29Å; W52-I80 HydrophobicContact CE3-CD1 3.75Å; W52-I80 HydrophobicContact CE3-CG1 4.49Å; W52-I80 HydrophobicContact CG-CD1 4.21Å; W52-M101 VanDerWaalsContact CA-CE 3.48Å; W52-M101 HydrophobicContact CB-CE 3.59Å; W52-M101 HydrophobicContact CG-CE 3.74Å; W52-M101 WeakPolarHBondContact O-CE 3.03Å
53	Y	62.9	Low	59.9	Low	52 Å²	52	91.2 Å²	91.2	20%	0.204	44%	0.441	C	S	.	.	H	α-helix	trans	-62.1	-47.6	174.6	175	-114.4	0	0	0	112.6	I49 L50 N55 I56 L57 I71 I73	I49-Y53 PolarHBondContact O-N 3.49Å; L50-Y53 WeakPolarHBondContact O-CB 3.44Å; L50-Y53 PolarHBondContact O-N 3.2Å; Y53-N55 VanDerWaalsContact C-N 3.3Å; Y53-N55 PolarHBondContact O-N 2.72Å; Y53-I56 PolarHBondContact O-N 3.41Å; Y53-I56 VanDerWaalsContact O-N 3.11Å; Y53-L57 HydrophobicContact CD1-CD1 3.84Å; Y53-L57 HydrophobicContact CD1-CG 4.41Å; Y53-L57 HydrophobicContact CD2-CD1 4.49Å; Y53-L57 HydrophobicContact CD2-CG 4.24Å; Y53-L57 HydrophobicContact CE1-CD1 3.22Å; Y53-L57 HydrophobicContact CE1-CG 3.98Å; Y53-L57 HydrophobicContact CE2-CD1 3.97Å; Y53-L57 HydrophobicContact CE2-CD2 4.07Å; Y53-L57 HydrophobicContact CE2-CG 3.78Å; Y53-L57 HydrophobicContact CG-CD1 4.46Å; Y53-L57 PolarHBondContact O-N 3.5Å; Y53-I71 HydrophobicContact CD2-CG2 4.27Å; Y53-I71 HydrophobicContact CE2-CD1 4.26Å; Y53-I71 HydrophobicContact CE2-CG2 4.22Å; Y53-I73 HydrophobicContact CD1-CD1 3.89Å; Y53-I73 HydrophobicContact CD2-CD1 3.18Å; Y53-I73 HydrophobicContact CD2-CG1 3.81Å; Y53-I73 HydrophobicContact CE1-CD1 4.16Å; Y53-I73 HydrophobicContact CE2-CD1 3.52Å; Y53-I73 HydrophobicContact CE2-CG1 4.16Å; Y53-I73 HydrophobicContact CG-CD1 3.36Å; Y53-I73 HydrophobicContact CG-CG1 4.36Å
54	E	65.5	Low	61.3	Low	103 Å²	103	96 Å²	96	48%	0.481	46%	0.455	S	S	.	.	H	α-helix	trans	-54.2	-47.1	175.7	-75.7	171.7	176.3	0	0	111.4	L50 I56 L57 I58	L50-E54 WeakPolarHBondContact O-CG 3.48Å; L50-E54 PolarHBondContact O-N 3.21Å; E54-I56 PolarHBondContact O-N 3.18Å; E54-L57 PolarHBondContact O-N 2.73Å; E54-I58 WeakPolarHBondContact O-CD1 3.42Å; E54-I58 WeakPolarHBondContact O-CG1 3.48Å; E54-I58 PolarHBondContact O-N 3.43Å
55	N	67.2	Low	62.5	Low	84 Å²	84	87.9 Å²	87.9	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-62.1	-39.4	177.9	-76.1	-19	0	0	0	113	K51 W52 Y53 H59 M101	K51-N55 PolarHBondContact O-N 2.83Å; K51-N55 PolarHBondContact O-ND2 3.41Å; W52-N55 PolarHBondContact O-N 3.41Å; Y53-N55 VanDerWaalsContact C-N 3.3Å; Y53-N55 PolarHBondContact O-N 2.72Å; N55-H59 PolarHBondContact O-N 3.06Å; N55-H59 VanDerWaalsContact O-N 3.15Å; N55-M101 HydrophobicContact CB-CE 3.96Å
56	I	66.6	Low	63.7	Low	0 Å²	0	81.4 Å²	81.4	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-68.4	-44.3	177.7	-64.6	166.5	0	0	0	110.1	W52 Y53 E54 I58 H59 L60 I71 I80 I98 M101 L102	W52-I56 VanDerWaalsContact O-CG1 3.29Å; W52-I56 WeakPolarHBondContact O-CG1 3.42Å; W52-I56 PolarHBondContact O-N 2.95Å; W52-I56 VanDerWaalsContact O-N 3.1Å; Y53-I56 PolarHBondContact O-N 3.41Å; Y53-I56 VanDerWaalsContact O-N 3.11Å; E54-I56 PolarHBondContact O-N 3.18Å; I56-I58 PolarHBondContact O-N 2.92Å; I56-H59 PolarHBondContact O-N 3.14Å; I56-L60 HydrophobicContact CG2-CD1 4.22Å; I56-L60 HydrophobicContact CG2-CG 4.44Å; I56-L60 WeakPolarHBondContact O-CG 3.42Å; I56-L60 PolarHBondContact O-N 2.74Å; I56-I71 HydrophobicContact CG2-CD1 3.67Å; I56-I71 HydrophobicContact CG2-CG1 4.32Å; I56-I80 HydrophobicContact CD1-CD1 4.45Å; I56-I80 HydrophobicContact CD1-CG2 3.61Å; I56-I98 HydrophobicContact CG1-CG2 4.47Å; I56-I98 HydrophobicContact CG2-CG2 4.46Å; I56-M101 HydrophobicContact CD1-CB 4.45Å; I56-M101 HydrophobicContact CG1-CE 4.19Å; I56-M101 HydrophobicContact CG1-SD 4.28Å; I56-L102 HydrophobicContact CD1-CD2 4.21Å
57	L	68.3	Low	64.7	Low	37 Å²	37	83.7 Å²	83.7	19%	0.194	40%	0.401	C	S	.	.	H	α-helix	trans	-57.5	-48.4	175.7	-80.4	179.6	0	0	0	111.4	Y53 E54 H59 L60 E61 I71	Y53-L57 HydrophobicContact CD1-CD1 3.84Å; Y53-L57 HydrophobicContact CD1-CG 4.41Å; Y53-L57 HydrophobicContact CD2-CD1 4.49Å; Y53-L57 HydrophobicContact CD2-CG 4.24Å; Y53-L57 HydrophobicContact CE1-CD1 3.22Å; Y53-L57 HydrophobicContact CE1-CG 3.98Å; Y53-L57 HydrophobicContact CE2-CD1 3.97Å; Y53-L57 HydrophobicContact CE2-CD2 4.07Å; Y53-L57 HydrophobicContact CE2-CG 3.78Å; Y53-L57 HydrophobicContact CG-CD1 4.46Å; Y53-L57 PolarHBondContact O-N 3.5Å; E54-L57 PolarHBondContact O-N 2.73Å; L57-H59 PolarHBondContact O-N 3.41Å; L57-L60 PolarHBondContact O-N 3.26Å; L57-E61 WeakPolarHBondContact O-CG 3.29Å; L57-E61 PolarHBondContact O-N 3.15Å; L57-I71 HydrophobicContact CD2-CD1 4.31Å
58	I	70.8	Confident	65.4	Low	95 Å²	95	80.6 Å²	80.6	49%	0.487	38%	0.38	S	S	.	.	H	α-helix	trans	-56.1	-42	177.4	-69.1	163.5	0	0	0	110.7	E54 I56 K62	E54-I58 WeakPolarHBondContact O-CD1 3.42Å; E54-I58 WeakPolarHBondContact O-CG1 3.48Å; E54-I58 PolarHBondContact O-N 3.43Å; I56-I58 PolarHBondContact O-N 2.92Å; I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 PolarHBondContact O-N 3.32Å
59	H	67.5	Low	65.7	Low	72 Å²	72	76.4 Å²	76.4	33%	0.333	35%	0.354	S	S	.	.	H	α-helix	trans	-68.9	-34.6	176.5	-85.9	-2.6	0	0	0	113.8	N55 I56 L57 N63 L94 I98	N55-H59 PolarHBondContact O-N 3.06Å; N55-H59 VanDerWaalsContact O-N 3.15Å; I56-H59 PolarHBondContact O-N 3.14Å; L57-H59 PolarHBondContact O-N 3.41Å; H59-N63 PolarHBondContact O-N 3.02Å; H59-N63 PolarHBondContact O-ND2 2.86Å; H59-L94 HydrophobicContact CB-CD1 4.34Å; H59-I98 HydrophobicContact CB-CG2 4.32Å
60	L	68	Low	65.8	Low	0 Å²	0	79.5 Å²	79.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-72.5	-44.1	176.8	-71.3	176.4	0	0	0	112.7	I56 L57 N63 K64 L65 L66 T69 I71 L94	I56-L60 HydrophobicContact CG2-CD1 4.22Å; I56-L60 HydrophobicContact CG2-CG 4.44Å; I56-L60 WeakPolarHBondContact O-CG 3.42Å; I56-L60 PolarHBondContact O-N 2.74Å; L57-L60 PolarHBondContact O-N 3.26Å; L60-N63 PolarHBondContact O-N 3.07Å; L60-K64 PolarHBondContact O-N 3.41Å; L60-K64 VanDerWaalsContact O-N 3.1Å; L60-L65 HydrophobicContact CD2-CB 4.3Å; L60-L65 PolarHBondContact O-N 3.19Å; L60-L66 HydrophobicContact CB-CD1 4.31Å; L60-L66 HydrophobicContact CB-CG 4.02Å; L60-T69 WeakPolarHBondContact CD1-OG1 3.43Å; L60-T69 HydrophobicContact CD2-CG2 3.71Å; L60-T69 WeakPolarHBondContact CD2-OG1 3.43Å; L60-I71 HydrophobicContact CD1-CD1 3.29Å; L60-I71 HydrophobicContact CD1-CG1 3.97Å; L60-L94 HydrophobicContact CD2-CD1 4.04Å; L60-L94 HydrophobicContact CD2-CD2 3.32Å; L60-L94 HydrophobicContact CD2-CG 4.22Å
61	E	71.6	Confident	66.2	Low	121 Å²	121	76.9 Å²	76.9	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-63.1	-49.3	177.5	-74.1	-178.6	175.5	0	0	111	L57 N63 K64 L66	L57-E61 WeakPolarHBondContact O-CG 3.29Å; L57-E61 PolarHBondContact O-N 3.15Å; E61-N63 PolarHBondContact O-N 3.26Å; E61-N63 VanDerWaalsContact O-N 3.09Å; E61-K64 PolarHBondContact O-N 3.11Å; E61-L66 HydrophobicContact CB-CD1 4.25Å; E61-L66 HydrophobicContact CG-CD1 3.27Å
62	K	72.4	Confident	66.2	Low	168 Å²	168	72 Å²	72	73%	0.73	34%	0.339	S	S	*	.	H	α-helix	trans	-56	-31.6	179.3	-174.8	175.7	-179.5	179.1	0	112.7	I58	I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 PolarHBondContact O-N 3.32Å
63	N	69.6	Low	65.9	Low	84 Å²	84	68.5 Å²	68.5	45%	0.449	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	0.4	-179.8	-66.2	-54.4	0	0	0	114	H59 L60 E61 L65	H59-N63 PolarHBondContact O-N 3.02Å; H59-N63 PolarHBondContact O-ND2 2.86Å; L60-N63 PolarHBondContact O-N 3.07Å; E61-N63 PolarHBondContact O-N 3.26Å; E61-N63 VanDerWaalsContact O-N 3.09Å; N63-L65 VanDerWaalsContact C-N 3.27Å; N63-L65 HydrophobicContact CB-CD1 3.58Å; N63-L65 HydrophobicContact CB-CG 3.78Å; N63-L65 WeakPolarHBondContact O-CG 3.33Å; N63-L65 PolarHBondContact O-N 3.09Å
64	K	72	Confident	65.6	Low	183 Å²	183	67.2 Å²	67.2	80%	0.796	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	33.1	-175.1	-55.7	-178.6	178.2	-178.5	0	114.2	L60 E61	L60-K64 PolarHBondContact O-N 3.41Å; L60-K64 VanDerWaalsContact O-N 3.1Å; E61-K64 PolarHBondContact O-N 3.11Å
65	L	66	Low	64.8	Low	4 Å²	4	67.9 Å²	67.9	2%	0.021	33%	0.333	C	S	.	.			trans	-103.1	-2.3	-172.2	-63.2	173.4	0	0	0	114.6	L60 N63 Q67 W68 T69 E90 L91 L94	L60-L65 HydrophobicContact CD2-CB 4.3Å; L60-L65 PolarHBondContact O-N 3.19Å; N63-L65 VanDerWaalsContact C-N 3.27Å; N63-L65 HydrophobicContact CB-CD1 3.58Å; N63-L65 HydrophobicContact CB-CG 3.78Å; N63-L65 WeakPolarHBondContact O-CG 3.33Å; N63-L65 PolarHBondContact O-N 3.09Å; L65-Q67 PolarHBondContact O-N 3.1Å; L65-Q67 VanDerWaalsContact O-N 3.13Å; L65-W68 HydrophobicContact CD2-CE3 3.39Å; L65-W68 HydrophobicContact CD2-CZ3 3.36Å; L65-W68 PolarHBondContact O-N 3.31Å; L65-T69 PolarHBondContact O-OG1 2.95Å; L65-E90 HydrophobicContact CD2-CB 4.38Å; L65-L91 HydrophobicContact CB-CD2 4.09Å; L65-L91 HydrophobicContact CD1-CD2 4.15Å; L65-L91 HydrophobicContact CD2-CD2 4.09Å; L65-L91 HydrophobicContact CD2-CG 4.41Å; L65-L91 HydrophobicContact CG-CD2 4.32Å; L65-L94 HydrophobicContact CB-CD2 4.28Å; L65-L94 HydrophobicContact CD1-CB 3.78Å; L65-L94 HydrophobicContact CD1-CD1 4.18Å; L65-L94 HydrophobicContact CD1-CD2 3.73Å; L65-L94 HydrophobicContact CD1-CG 4.08Å
66	L	64.4	Low	63.7	Low	44 Å²	44	71.6 Å²	71.6	23%	0.23	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-50.3	-40.7	-177.4	-104.8	139.1	0	0	0	113.6	L60 E61 W68 T69	L60-L66 HydrophobicContact CB-CD1 4.31Å; L60-L66 HydrophobicContact CB-CG 4.02Å; E61-L66 HydrophobicContact CB-CD1 4.25Å; E61-L66 HydrophobicContact CG-CD1 3.27Å; L66-W68 PolarHBondContact O-N 2.93Å; L66-W68 VanDerWaalsContact O-N 3.12Å; L66-T69 PolarHBondContact O-N 3.49Å; L66-T69 VanDerWaalsContact O-O 3.06Å; L66-T69 PolarHBondContact O-OG1 3.25Å
67	Q	65.6	Low	63	Low	130 Å²	130	77.3 Å²	77.3	61%	0.607	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-63.2	-16.7	179.7	58.2	171.5	0	0	0	114.8	L65	L65-Q67 PolarHBondContact O-N 3.1Å; L65-Q67 VanDerWaalsContact O-N 3.13Å
68	W	62.8	Low	62.7	Low	63 Å²	63	79.7 Å²	79.7	24%	0.239	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-109.4	1	-177.6	-58	-26.5	0	0	0	113.5	L65 L66 I85 N88 L91	L65-W68 HydrophobicContact CD2-CE3 3.39Å; L65-W68 HydrophobicContact CD2-CZ3 3.36Å; L65-W68 PolarHBondContact O-N 3.31Å; L66-W68 PolarHBondContact O-N 2.93Å; L66-W68 VanDerWaalsContact O-N 3.12Å; W68-I85 PolarHBondContact O-N 3.45Å; W68-N88 VanDerWaalsContact CZ3-ND2 3.29Å; W68-N88 WeakPolarHBondContact CZ3-ND2 3.12Å; W68-L91 HydrophobicContact CB-CD1 3.79Å; W68-L91 HydrophobicContact CB-CD2 4.05Å; W68-L91 HydrophobicContact CB-CG 4.5Å; W68-L91 HydrophobicContact CD2-CD1 4.32Å; W68-L91 HydrophobicContact CE3-CD1 3.84Å; W68-L91 HydrophobicContact CE3-CD2 4.2Å; W68-L91 HydrophobicContact CE3-CG 3.99Å; W68-L91 HydrophobicContact CG-CD1 4.35Å
69	T	61.5	Low	62.6	Low	12 Å²	12	75.2 Å²	75.2	7%	0.074	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.5	-174.8	58.6	0	0	0	0	111	L60 L65 L66 L84 L91 L94	L60-T69 WeakPolarHBondContact CD1-OG1 3.43Å; L60-T69 HydrophobicContact CD2-CG2 3.71Å; L60-T69 WeakPolarHBondContact CD2-OG1 3.43Å; L65-T69 PolarHBondContact O-OG1 2.95Å; L66-T69 PolarHBondContact O-N 3.49Å; L66-T69 VanDerWaalsContact O-O 3.06Å; L66-T69 PolarHBondContact O-OG1 3.25Å; T69-L84 HydrophobicContact CG2-CD2 3.67Å; T69-L91 HydrophobicContact CG2-CD2 3.77Å; T69-L94 HydrophobicContact CG2-CD2 4.12Å
70	L	59.2	Low	63	Low	83 Å²	83	71.8 Å²	71.8	44%	0.435	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	110.1	169.8	-170.5	103.4	0	0	0	108.4	T72 K83 I85	L70-T72 HydrophobicContact CD2-CG2 3.95Å; L70-K83 HydrophobicContact CB-CB 4.21Å; L70-K83 HydrophobicContact CD2-CB 4.37Å; L70-K83 HydrophobicContact CD2-CD 4.39Å; L70-K83 PolarHBondContact N-O 3.08Å; L70-K83 PolarHBondContact O-N 3.46Å; L70-I85 HydrophobicContact CB-CD1 4.45Å
71	I	65	Low	63.6	Low	33 Å²	33	71.8 Å²	71.8	17%	0.169	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.3	172.3	-61.2	163	0	0	0	108.5	Y53 I56 L57 L60 I73	Y53-I71 HydrophobicContact CD2-CG2 4.27Å; Y53-I71 HydrophobicContact CE2-CD1 4.26Å; Y53-I71 HydrophobicContact CE2-CG2 4.22Å; I56-I71 HydrophobicContact CG2-CD1 3.67Å; I56-I71 HydrophobicContact CG2-CG1 4.32Å; L57-I71 HydrophobicContact CD2-CD1 4.31Å; L60-I71 HydrophobicContact CD1-CD1 3.29Å; L60-I71 HydrophobicContact CD1-CG1 3.97Å; I71-I73 HydrophobicContact CG2-CG1 4.14Å
72	T	62	Low	64.2	Low	44 Å²	44	66.1 Å²	66.1	27%	0.27	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	109.5	170.6	55.2	0	0	0	0	108.2	L70 G81	L70-T72 HydrophobicContact CD2-CG2 3.95Å; T72-G81 PolarHBondContact N-O 3.29Å; T72-G81 WeakPolarHBondContact O-CA 3.41Å; T72-G81 PolarHBondContact O-N 3.35Å; T72-G81 WeakPolarHBondContact OG1-CA 3.42Å; T72-G81 PolarHBondContact OG1-O 3.23Å
73	I	55.8	Low	64.6	Low	27 Å²	27	61.4 Å²	61.4	14%	0.138	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.9	164.5	-49.4	172.9	0	0	0	106	I32 I49 Y53 I71	I32-I73 WeakPolarHBondContact CD1-O 3.08Å; I32-I73 WeakPolarHBondContact CG1-O 3.47Å; I49-I73 HydrophobicContact CG2-CG2 3.79Å; Y53-I73 HydrophobicContact CD1-CD1 3.89Å; Y53-I73 HydrophobicContact CD2-CD1 3.18Å; Y53-I73 HydrophobicContact CD2-CG1 3.81Å; Y53-I73 HydrophobicContact CE1-CD1 4.16Å; Y53-I73 HydrophobicContact CE2-CD1 3.52Å; Y53-I73 HydrophobicContact CE2-CG1 4.16Å; Y53-I73 HydrophobicContact CG-CD1 3.36Å; Y53-I73 HydrophobicContact CG-CG1 4.36Å; I71-I73 HydrophobicContact CG2-CG1 4.14Å
74	S	55.6	Low	65.3	Low	24 Å²	24	57.5 Å²	57.5	17%	0.168	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	109.3	167.3	69	0	0	0	0	108.5	Y76 E77 E78 C79	S74-Y76 PolarHBondContact O-N 3.43Å; S74-E77 PolarHBondContact O-N 3.19Å; S74-E77 WeakPolarHBondContact OG-CB 3.32Å; S74-E78 PolarHBondContact O-N 3.18Å; S74-C79 PolarHBondContact N-O 2.9Å; S74-C79 VanDerWaalsContact N-O 3.12Å; S74-C79 PolarHBondContact O-N 3.36Å; S74-C79 PolarHBondContact OG-SG 3.41Å
75	D	48.8	Very low	65.5	Low	118 Å²	118	53.7 Å²	53.7	63%	0.631	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.5	172.5	-67.4	-14.9	0	0	0	111.8
76	Y	44.2	Very low	66.2	Low	162 Å²	162	58 Å²	58	64%	0.635	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-34.3	-177.7	-70.9	-84.3	0	0	0	114.6	S74	S74-Y76 PolarHBondContact O-N 3.43Å
77	E	51.9	Low	67	Low	119 Å²	119	59 Å²	59	56%	0.556	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	4.9	-178.4	-55.7	-169.2	152.4	0	0	113	S74 C79 Q104	S74-E77 PolarHBondContact O-N 3.19Å; S74-E77 WeakPolarHBondContact OG-CB 3.32Å; E77-C79 HydrophobicContact CB-CB 4.16Å; E77-C79 PolarHBondContact O-N 3.4Å; E77-C79 VanDerWaalsContact O-N 3.13Å; E77-Q104 PolarHBondContact OE2-NE2 3.11Å
78	E	62.5	Low	67.8	Low	88 Å²	88	54.7 Å²	54.7	41%	0.411	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	31.7	-171.5	-66.3	-172.4	175.1	0	0	113.1	V43 I49 S74 Q103	V43-E78 HydrophobicContact CG1-CG 4.42Å; V43-E78 VanDerWaalsContact CG1-OE1 3.3Å; V43-E78 WeakPolarHBondContact CG1-OE1 3.34Å; I49-E78 VanDerWaalsContact CD1-CA 3.5Å; I49-E78 HydrophobicContact CD1-CB 3.7Å; I49-E78 HydrophobicContact CD1-CG 3.88Å; S74-E78 PolarHBondContact O-N 3.18Å; E78-Q103 PolarHBondContact O-OE1 3.08Å
79	C	68.9	Low	68.7	Low	1 Å²	1	57.6 Å²	57.6	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.1	-170.2	96.2	0	0	0	0	113.8	S74 E77 Q103 Q104 F128	S74-C79 PolarHBondContact N-O 2.9Å; S74-C79 VanDerWaalsContact N-O 3.12Å; S74-C79 PolarHBondContact O-N 3.36Å; S74-C79 PolarHBondContact OG-SG 3.41Å; E77-C79 HydrophobicContact CB-CB 4.16Å; E77-C79 PolarHBondContact O-N 3.4Å; E77-C79 VanDerWaalsContact O-N 3.13Å; C79-Q103 HydrophobicContact CB-CB 4.25Å; C79-Q104 VanDerWaalsContact SG-CD 3.59Å; C79-F128 HydrophobicContact CB-CE1 3.87Å; C79-F128 HydrophobicContact CB-CZ 4.19Å
80	I	76.3	Confident	69.5	Low	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112.8	173.1	-55.8	-176.5	0	0	0	107.7	I49 W52 I56 L102 Q103 Q104	I49-I80 HydrophobicContact CG2-CD1 4.25Å; I49-I80 HydrophobicContact CG2-CG1 4.13Å; W52-I80 HydrophobicContact CB-CD1 3.29Å; W52-I80 HydrophobicContact CD2-CD1 4.29Å; W52-I80 HydrophobicContact CE3-CD1 3.75Å; W52-I80 HydrophobicContact CE3-CG1 4.49Å; W52-I80 HydrophobicContact CG-CD1 4.21Å; I56-I80 HydrophobicContact CD1-CD1 4.45Å; I56-I80 HydrophobicContact CD1-CG2 3.61Å; I80-L102 HydrophobicContact CG2-CD2 3.85Å; I80-Q103 PolarHBondContact O-N 3.33Å; I80-Q104 PolarHBondContact O-N 3.44Å
81	G	79.8	Confident	70.5	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	151.6	175.3	0	0	0	0	0	111.9	T72 Q104	T72-G81 PolarHBondContact N-O 3.29Å; T72-G81 WeakPolarHBondContact O-CA 3.41Å; T72-G81 PolarHBondContact O-N 3.35Å; T72-G81 WeakPolarHBondContact OG1-CA 3.42Å; T72-G81 PolarHBondContact OG1-O 3.23Å; G81-Q104 VanDerWaalsContact CA-O 3.28Å; G81-Q104 WeakPolarHBondContact CA-O 3.41Å
82	L	83.8	Confident	71.4	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.7	172.3	175.5	140.5	0	0	0	110.4	L84 L95 I98 L102 Q104 D106	L82-L84 HydrophobicContact CD2-CD2 3.67Å; L82-L84 HydrophobicContact CD2-CG 3.66Å; L82-L95 HydrophobicContact CD2-CD1 3.79Å; L82-I98 HydrophobicContact CD1-CD1 3.35Å; L82-L102 HydrophobicContact CB-CD1 3.72Å; L82-L102 HydrophobicContact CB-CD2 3.8Å; L82-L102 HydrophobicContact CB-CG 4.42Å; L82-L102 HydrophobicContact CD1-CD1 4.34Å; L82-L102 HydrophobicContact CD2-CD1 4.38Å; L82-L102 HydrophobicContact CG-CD1 4.39Å; L82-Q104 PolarHBondContact N-O 2.8Å; L82-Q104 VanDerWaalsContact N-O 3.08Å; L82-D106 PolarHBondContact O-N 2.86Å
83	K	82	Confident	72.3	Confident	68 Å²	68	59.7 Å²	59.7	30%	0.296	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.4	168.7	177.2	173.4	-168.7	133.9	0	110	L70 D106	L70-K83 HydrophobicContact CB-CB 4.21Å; L70-K83 HydrophobicContact CD2-CB 4.37Å; L70-K83 HydrophobicContact CD2-CD 4.39Å; L70-K83 PolarHBondContact N-O 3.08Å; L70-K83 PolarHBondContact O-N 3.46Å; K83-D106 WeakPolarHBondContact CA-O 3.45Å; K83-D106 HydrophobicContact CB-CB 3.92Å; K83-D106 VanDerWaalsContact CD-OD2 3.27Å; K83-D106 WeakPolarHBondContact CD-OD2 3.49Å; K83-D106 WeakPolarHBondContact CE-OD2 3.42Å; K83-D106 HydrophobicContact CG-CB 4.06Å; K83-D106 IonicContact NZ-OD2 3.95Å; K83-D106 PolarHBondContact NZ-OD2 2.77Å
84	L	82.9	Confident	73.4	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	170.2	-70.3	-172.2	0	0	0	110.1	T69 L82 W87 L91 L95 D106 L107 L110	T69-L84 HydrophobicContact CG2-CD2 3.67Å; L82-L84 HydrophobicContact CD2-CD2 3.67Å; L82-L84 HydrophobicContact CD2-CG 3.66Å; L84-W87 HydrophobicContact CD1-CE3 3.82Å; L84-W87 HydrophobicContact CD1-CZ3 3.9Å; L84-L91 HydrophobicContact CD2-CD2 4.31Å; L84-L95 HydrophobicContact CD1-CD2 4.11Å; L84-D106 PolarHBondContact N-O 3.45Å; L84-L107 HydrophobicContact CB-CD2 4.06Å; L84-L107 HydrophobicContact CD1-CD2 3.6Å; L84-L107 HydrophobicContact CG-CD2 3.87Å; L84-L110 HydrophobicContact CB-CD1 3.82Å
85	I	77.3	Confident	74.8	Confident	104 Å²	104	57.4 Å²	57.4	53%	0.533	28%	0.276	S	S	.	.	S	Bend	trans	-89.9	-31.3	177	-58.6	171.3	0	0	0	110.2	W68 L70 L110	W68-I85 PolarHBondContact O-N 3.45Å; L70-I85 HydrophobicContact CB-CD1 4.45Å; I85-L110 WeakPolarHBondContact O-CD2 3.35Å
86	Q	79.4	Confident	76.5	Confident	93 Å²	93	54 Å²	54	44%	0.435	26%	0.255	S	S	.	.	S	Bend	trans	-134.3	157.6	179.3	-169.6	170.5	-6.8	0	0	110	L91	Q86-L91 HydrophobicContact CB-CD1 4.25Å; Q86-L91 WeakPolarHBondContact O-CD1 3.49Å
87	W	82.2	Confident	78.3	Confident	66 Å²	66	52.3 Å²	52.3	25%	0.25	25%	0.253	C	S	.	.			trans	-120.3	122.2	175.1	-174.9	-98.9	0	0	0	110.5	L84 M92 L95 L107 L110 L112 L119	L84-W87 HydrophobicContact CD1-CE3 3.82Å; L84-W87 HydrophobicContact CD1-CZ3 3.9Å; W87-M92 HydrophobicContact CH2-CB 4.24Å; W87-M92 HydrophobicContact CH2-CG 4.05Å; W87-M92 HydrophobicContact CZ2-CB 4.06Å; W87-M92 HydrophobicContact CZ2-CG 3.86Å; W87-L95 HydrophobicContact CZ3-CD2 4.11Å; W87-L107 HydrophobicContact CZ3-CD1 4.38Å; W87-L107 HydrophobicContact CZ3-CD2 4.13Å; W87-L110 HydrophobicContact CB-CB 4.13Å; W87-L110 HydrophobicContact CB-CD1 4.25Å; W87-L110 HydrophobicContact CB-CD2 4.34Å; W87-L110 HydrophobicContact CB-CG 4.47Å; W87-L110 HydrophobicContact CE3-CD1 4.06Å; W87-L112 HydrophobicContact CB-CD2 4.12Å; W87-L112 HydrophobicContact CD2-CD2 3.51Å; W87-L112 HydrophobicContact CE3-CD2 4.12Å; W87-L112 HydrophobicContact CG-CD2 3.49Å; W87-L112 VanDerWaalsContact CG-CD2 3.49Å; W87-L112 HydrophobicContact CZ2-CD2 4.28Å; W87-L119 HydrophobicContact CH2-CD2 3.62Å; W87-L119 HydrophobicContact CZ3-CD2 4.43Å
88	N	82.5	Confident	79.7	Confident	39 Å²	39	46.6 Å²	46.6	21%	0.209	23%	0.226	C	C	.	.			trans	-149	174.9	171.2	67.3	16.2	0	0	0	109.8	W68 E90 L91 M92	W68-N88 VanDerWaalsContact CZ3-ND2 3.29Å; W68-N88 WeakPolarHBondContact CZ3-ND2 3.12Å; N88-E90 VanDerWaalsContact C-N 3.32Å; N88-E90 PolarHBondContact O-N 2.91Å; N88-E90 PolarHBondContact OD1-N 3.46Å; N88-L91 PolarHBondContact O-N 3.41Å; N88-L91 VanDerWaalsContact OD1-CB 3.25Å; N88-L91 WeakPolarHBondContact OD1-CB 3.35Å; N88-L91 WeakPolarHBondContact OD1-CG 3.13Å; N88-L91 PolarHBondContact OD1-N 2.97Å; N88-M92 WeakPolarHBondContact O-CB 3.36Å; N88-M92 PolarHBondContact O-N 3.03Å
89	N	81.5	Confident	80.8	Confident	125 Å²	125	42.4 Å²	42.4	67%	0.668	21%	0.207	S	C	*	.	H	α-helix	trans	-63.1	-37.4	-177.8	-72.8	-19.7	0	0	0	112.5	M92 T93	N89-M92 PolarHBondContact O-N 3.36Å; N89-T93 WeakPolarHBondContact O-CG2 3.45Å; N89-T93 PolarHBondContact O-N 3.26Å
90	E	78.4	Confident	81.6	Confident	113 Å²	113	45.5 Å²	45.5	53%	0.528	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-49.3	178.4	-68.1	177.5	173	0	0	111.4	L65 N88 M92 T93 L94	L65-E90 HydrophobicContact CD2-CB 4.38Å; N88-E90 VanDerWaalsContact C-N 3.32Å; N88-E90 PolarHBondContact O-N 2.91Å; N88-E90 PolarHBondContact OD1-N 3.46Å; E90-M92 VanDerWaalsContact C-N 3.28Å; E90-M92 PolarHBondContact O-N 2.97Å; E90-T93 PolarHBondContact O-N 2.61Å; E90-T93 VanDerWaalsContact O-N 3.1Å; E90-T93 PolarHBondContact O-OG1 3.33Å; E90-L94 PolarHBondContact O-N 2.85Å
91	L	79.4	Confident	81.8	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-34.4	175.7	-70	167.7	0	0	0	112	L65 W68 T69 L84 Q86 N88 L94 L95	L65-L91 HydrophobicContact CB-CD2 4.09Å; L65-L91 HydrophobicContact CD1-CD2 4.15Å; L65-L91 HydrophobicContact CD2-CD2 4.09Å; L65-L91 HydrophobicContact CD2-CG 4.41Å; L65-L91 HydrophobicContact CG-CD2 4.32Å; W68-L91 HydrophobicContact CB-CD1 3.79Å; W68-L91 HydrophobicContact CB-CD2 4.05Å; W68-L91 HydrophobicContact CB-CG 4.5Å; W68-L91 HydrophobicContact CD2-CD1 4.32Å; W68-L91 HydrophobicContact CE3-CD1 3.84Å; W68-L91 HydrophobicContact CE3-CD2 4.2Å; W68-L91 HydrophobicContact CE3-CG 3.99Å; W68-L91 HydrophobicContact CG-CD1 4.35Å; T69-L91 HydrophobicContact CG2-CD2 3.77Å; L84-L91 HydrophobicContact CD2-CD2 4.31Å; Q86-L91 HydrophobicContact CB-CD1 4.25Å; Q86-L91 WeakPolarHBondContact O-CD1 3.49Å; N88-L91 PolarHBondContact O-N 3.41Å; N88-L91 VanDerWaalsContact OD1-CB 3.25Å; N88-L91 WeakPolarHBondContact OD1-CB 3.35Å; N88-L91 WeakPolarHBondContact OD1-CG 3.13Å; N88-L91 PolarHBondContact OD1-N 2.97Å; L91-L94 HydrophobicContact CD2-CD2 4.09Å; L91-L94 PolarHBondContact O-N 3.09Å; L91-L95 VanDerWaalsContact O-CB 3.25Å; L91-L95 WeakPolarHBondContact O-CB 3.36Å; L91-L95 PolarHBondContact O-N 3.27Å
92	M	84.3	Confident	82	Confident	30 Å²	30	47.6 Å²	47.6	15%	0.148	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-41.1	173.2	-176	-86.8	-70.2	0	0	111.5	W87 N88 N89 E90 L95 K96	W87-M92 HydrophobicContact CH2-CB 4.24Å; W87-M92 HydrophobicContact CH2-CG 4.05Å; W87-M92 HydrophobicContact CZ2-CB 4.06Å; W87-M92 HydrophobicContact CZ2-CG 3.86Å; N88-M92 WeakPolarHBondContact O-CB 3.36Å; N88-M92 PolarHBondContact O-N 3.03Å; N89-M92 PolarHBondContact O-N 3.36Å; E90-M92 VanDerWaalsContact C-N 3.28Å; E90-M92 PolarHBondContact O-N 2.97Å; M92-L95 PolarHBondContact O-N 3.12Å; M92-K96 WeakPolarHBondContact O-CG 3.42Å; M92-K96 PolarHBondContact O-N 3.13Å; M92-K96 VanDerWaalsContact O-N 3.08Å; M92-K96 HydrophobicContact SD-CD 3.74Å; M92-K96 WeakPolarHBondContact SD-CE 3.49Å; M92-K96 HydrophobicContact SD-CG 4.37Å; M92-K96 PolarHBondContact SD-NZ 2.67Å
93	T	81.3	Confident	82.2	Confident	72 Å²	72	49 Å²	49	44%	0.442	24%	0.244	S	C	.	.	H	α-helix	trans	-65.2	-42.4	173.8	63.8	0	0	0	0	112.1	N89 E90 K96 H97	N89-T93 WeakPolarHBondContact O-CG2 3.45Å; N89-T93 PolarHBondContact O-N 3.26Å; E90-T93 PolarHBondContact O-N 2.61Å; E90-T93 VanDerWaalsContact O-N 3.1Å; E90-T93 PolarHBondContact O-OG1 3.33Å; T93-K96 WeakPolarHBondContact O-CB 3.3Å; T93-K96 PolarHBondContact O-N 2.92Å; T93-H97 PolarHBondContact O-N 2.95Å; T93-H97 PolarHBondContact O-ND1 3.19Å
94	L	78.6	Confident	82.5	Confident	3 Å²	3	48 Å²	48	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-58.9	-51	173.5	172.2	82.6	0	0	0	110.7	H59 L60 L65 T69 E90 L91 K96 H97 I98	H59-L94 HydrophobicContact CB-CD1 4.34Å; L60-L94 HydrophobicContact CD2-CD1 4.04Å; L60-L94 HydrophobicContact CD2-CD2 3.32Å; L60-L94 HydrophobicContact CD2-CG 4.22Å; L65-L94 HydrophobicContact CB-CD2 4.28Å; L65-L94 HydrophobicContact CD1-CB 3.78Å; L65-L94 HydrophobicContact CD1-CD1 4.18Å; L65-L94 HydrophobicContact CD1-CD2 3.73Å; L65-L94 HydrophobicContact CD1-CG 4.08Å; T69-L94 HydrophobicContact CG2-CD2 4.12Å; E90-L94 PolarHBondContact O-N 2.85Å; L91-L94 HydrophobicContact CD2-CD2 4.09Å; L91-L94 PolarHBondContact O-N 3.09Å; L94-K96 PolarHBondContact O-N 3.1Å; L94-H97 WeakPolarHBondContact O-CA 3.3Å; L94-H97 WeakPolarHBondContact O-CB 3.11Å; L94-H97 PolarHBondContact O-N 3.38Å; L94-I98 HydrophobicContact CD2-CD1 4.27Å; L94-I98 HydrophobicContact CG-CD1 4.09Å; L94-I98 WeakPolarHBondContact O-CG1 3.21Å; L94-I98 PolarHBondContact O-N 2.97Å; L94-I98 VanDerWaalsContact O-N 3.11Å
95	L	84.5	Confident	82.9	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-37.6	-178.8	-172.8	62.6	0	0	0	110.9	L82 L84 W87 L91 M92 H97 I98 A99 L102 L107 L119	L82-L95 HydrophobicContact CD2-CD1 3.79Å; L84-L95 HydrophobicContact CD1-CD2 4.11Å; W87-L95 HydrophobicContact CZ3-CD2 4.11Å; L91-L95 VanDerWaalsContact O-CB 3.25Å; L91-L95 WeakPolarHBondContact O-CB 3.36Å; L91-L95 PolarHBondContact O-N 3.27Å; M92-L95 PolarHBondContact O-N 3.12Å; L95-H97 VanDerWaalsContact C-N 3.27Å; L95-H97 PolarHBondContact O-N 2.88Å; L95-I98 HydrophobicContact CD1-CD1 4.44Å; L95-I98 HydrophobicContact CD1-CG1 4.26Å; L95-I98 PolarHBondContact O-N 2.83Å; L95-A99 WeakPolarHBondContact O-CA 3.28Å; L95-A99 WeakPolarHBondContact O-CB 3.34Å; L95-A99 PolarHBondContact O-N 3.42Å; L95-L102 HydrophobicContact CD1-CD1 3.88Å; L95-L107 HydrophobicContact CD2-CD1 4.41Å; L95-L107 HydrophobicContact CD2-CD2 4.03Å; L95-L119 HydrophobicContact CB-CD1 4.21Å; L95-L119 HydrophobicContact CD2-CD1 3.97Å; L95-L119 HydrophobicContact CD2-CD2 3.83Å; L95-L119 HydrophobicContact CD2-CG 4.45Å; L95-L119 HydrophobicContact CG-CD1 3.88Å
96	K	84.9	Confident	83.5	Confident	45 Å²	45	44.5 Å²	44.5	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-32.8	173.5	-75.9	173.8	170.9	168.1	0	114.1	M92 T93 L94 N118 L119 R122	M92-K96 WeakPolarHBondContact O-CG 3.42Å; M92-K96 PolarHBondContact O-N 3.13Å; M92-K96 VanDerWaalsContact O-N 3.08Å; M92-K96 HydrophobicContact SD-CD 3.74Å; M92-K96 WeakPolarHBondContact SD-CE 3.49Å; M92-K96 HydrophobicContact SD-CG 4.37Å; M92-K96 PolarHBondContact SD-NZ 2.67Å; T93-K96 WeakPolarHBondContact O-CB 3.3Å; T93-K96 PolarHBondContact O-N 2.92Å; L94-K96 PolarHBondContact O-N 3.1Å; K96-N118 VanDerWaalsContact CE-OD1 3.3Å; K96-N118 WeakPolarHBondContact CE-OD1 3.49Å; K96-N118 VanDerWaalsContact NZ-CG 3.26Å; K96-N118 PolarHBondContact NZ-ND2 2.97Å; K96-N118 PolarHBondContact NZ-OD1 3.38Å; K96-N118 VanDerWaalsContact NZ-OD1 3.12Å; K96-L119 HydrophobicContact CB-CD1 4.49Å; K96-L119 HydrophobicContact CG-CB 4.42Å; K96-L119 HydrophobicContact CG-CD1 3.64Å; K96-R122 HydrophobicContact CB-CG 4.37Å; K96-R122 HydrophobicContact CG-CG 4.37Å
97	H	81.7	Confident	84.2	Confident	127 Å²	127	40.1 Å²	40.1	59%	0.588	20%	0.202	S	C	*	.	H	α-helix	trans	-79.1	-38	179.5	-69.8	84.6	0	0	0	112	T93 L94 L95 P100	T93-H97 PolarHBondContact O-N 2.95Å; T93-H97 PolarHBondContact O-ND1 3.19Å; L94-H97 WeakPolarHBondContact O-CA 3.3Å; L94-H97 WeakPolarHBondContact O-CB 3.11Å; L94-H97 PolarHBondContact O-N 3.38Å; L95-H97 VanDerWaalsContact C-N 3.27Å; L95-H97 PolarHBondContact O-N 2.88Å; H97-P100 WeakPolarHBondContact O-CD 3.49Å
98	I	81.6	Confident	84.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-92.9	-22.2	-176.2	64.9	-175.2	0	0	0	113.8	I56 H59 L82 L94 L95 P100 M101 L102	I56-I98 HydrophobicContact CG1-CG2 4.47Å; I56-I98 HydrophobicContact CG2-CG2 4.46Å; H59-I98 HydrophobicContact CB-CG2 4.32Å; L82-I98 HydrophobicContact CD1-CD1 3.35Å; L94-I98 HydrophobicContact CD2-CD1 4.27Å; L94-I98 HydrophobicContact CG-CD1 4.09Å; L94-I98 WeakPolarHBondContact O-CG1 3.21Å; L94-I98 PolarHBondContact O-N 2.97Å; L94-I98 VanDerWaalsContact O-N 3.11Å; L95-I98 HydrophobicContact CD1-CD1 4.44Å; L95-I98 HydrophobicContact CD1-CG1 4.26Å; L95-I98 PolarHBondContact O-N 2.83Å; I98-P100 VanDerWaalsContact C-N 3.28Å; I98-P100 VanDerWaalsContact O-N 3.12Å; I98-M101 WeakPolarHBondContact O-CB 3.5Å; I98-M101 PolarHBondContact O-N 2.87Å; I98-L102 HydrophobicContact CG1-CD1 4.15Å
99	A	85.7	Confident	84.9	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-50.3	-34.2	-179.3	0	0	0	0	0	115.8	L95 M101 L102 R122 F123 S124	L95-A99 WeakPolarHBondContact O-CA 3.28Å; L95-A99 WeakPolarHBondContact O-CB 3.34Å; L95-A99 PolarHBondContact O-N 3.42Å; A99-M101 PolarHBondContact O-N 3.33Å; A99-L102 PolarHBondContact O-N 3.21Å; A99-R122 CarbonylContact C-O 3.37Å; A99-R122 HydrophobicContact CB-CB 4.25Å; A99-R122 WeakPolarHBondContact CB-O 3.42Å; A99-F123 HydrophobicContact CB-CD1 3.86Å; A99-F123 HydrophobicContact CB-CE1 4.4Å; A99-S124 PolarHBondContact O-N 3.08Å; A99-S124 VanDerWaalsContact O-N 3.08Å
100	P	85.4	Confident	85.4	Confident	65 Å²	65	37 Å²	37	42%	0.422	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-62.3	-21.1	175	-25.1	35.5	0	0	0	114.4	H97 I98 R122 S124	H97-P100 WeakPolarHBondContact O-CD 3.49Å; I98-P100 VanDerWaalsContact C-N 3.28Å; I98-P100 VanDerWaalsContact O-N 3.12Å; P100-R122 WeakPolarHBondContact CD-O 3.49Å; P100-R122 WeakPolarHBondContact CG-O 3.48Å; P100-S124 WeakPolarHBondContact O-CB 3.45Å; P100-S124 PolarHBondContact O-OG 3.28Å
101	M	80.9	Confident	85.9	Confident	43 Å²	43	41.8 Å²	41.8	21%	0.212	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-96.9	-11.9	-177.9	-54.3	176.6	64	0	0	113	W52 N55 I56 I98 A99	W52-M101 VanDerWaalsContact CA-CE 3.48Å; W52-M101 HydrophobicContact CB-CE 3.59Å; W52-M101 HydrophobicContact CG-CE 3.74Å; W52-M101 WeakPolarHBondContact O-CE 3.03Å; N55-M101 HydrophobicContact CB-CE 3.96Å; I56-M101 HydrophobicContact CD1-CB 4.45Å; I56-M101 HydrophobicContact CG1-CE 4.19Å; I56-M101 HydrophobicContact CG1-SD 4.28Å; I98-M101 WeakPolarHBondContact O-CB 3.5Å; I98-M101 PolarHBondContact O-N 2.87Å; A99-M101 PolarHBondContact O-N 3.33Å
102	L	84.5	Confident	86.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	20%	0.196	C	C	.	.			trans	-89.6	135.9	-173.5	-62.8	176.8	0	0	0	111.5	I56 I80 L82 L95 I98 A99 I105 S124	I56-L102 HydrophobicContact CD1-CD2 4.21Å; I80-L102 HydrophobicContact CG2-CD2 3.85Å; L82-L102 HydrophobicContact CB-CD1 3.72Å; L82-L102 HydrophobicContact CB-CD2 3.8Å; L82-L102 HydrophobicContact CB-CG 4.42Å; L82-L102 HydrophobicContact CD1-CD1 4.34Å; L82-L102 HydrophobicContact CD2-CD1 4.38Å; L82-L102 HydrophobicContact CG-CD1 4.39Å; L95-L102 HydrophobicContact CD1-CD1 3.88Å; I98-L102 HydrophobicContact CG1-CD1 4.15Å; A99-L102 PolarHBondContact O-N 3.21Å; L102-I105 HydrophobicContact CB-CD1 4.31Å; L102-I105 HydrophobicContact CB-CG1 3.97Å; L102-I105 HydrophobicContact CD1-CD1 4.31Å; L102-I105 HydrophobicContact CD1-CG1 3.94Å; L102-S124 WeakPolarHBondContact O-CB 3.3Å
103	Q	87.2	Confident	86.8	Confident	33 Å²	33	46 Å²	46	15%	0.154	22%	0.217	C	C	.	.	S	Bend	trans	-104.9	-21.2	175.9	-65.6	-179.7	-4.4	0	0	112.5	E78 C79 I80 H126 L127 F128 S129	E78-Q103 PolarHBondContact O-OE1 3.08Å; C79-Q103 HydrophobicContact CB-CB 4.25Å; I80-Q103 PolarHBondContact O-N 3.33Å; Q103-H126 HydrophobicContact CG-CB 4.22Å; Q103-L127 WeakPolarHBondContact O-CD1 3.19Å; Q103-F128 HydrophobicContact CB-CD1 3.95Å; Q103-F128 HydrophobicContact CB-CE1 3.86Å; Q103-F128 WeakPolarHBondContact O-CD1 3.42Å; Q103-F128 PolarHBondContact O-N 3.28Å; Q103-S129 PolarHBondContact O-N 2.88Å
104	Q	88.6	Confident	87.2	Confident	46 Å²	46	48.2 Å²	48.2	22%	0.215	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.5	170.2	-57.6	-175.5	-17.1	0	0	110.4	E77 C79 I80 G81 L82 F128 S129	E77-Q104 PolarHBondContact OE2-NE2 3.11Å; C79-Q104 VanDerWaalsContact SG-CD 3.59Å; I80-Q104 PolarHBondContact O-N 3.44Å; G81-Q104 VanDerWaalsContact CA-O 3.28Å; G81-Q104 WeakPolarHBondContact CA-O 3.41Å; L82-Q104 PolarHBondContact N-O 2.8Å; L82-Q104 VanDerWaalsContact N-O 3.08Å; Q104-F128 HydrophobicContact CG-CD1 4.46Å; Q104-F128 HydrophobicContact CG-CE1 3.77Å; Q104-F128 HydrophobicContact CG-CE2 3.98Å; Q104-F128 HydrophobicContact CG-CZ 3.54Å; Q104-S129 WeakPolarHBondContact CA-O 3.34Å
105	I	91.7	Very high	87.7	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	119.8	177.9	-66.4	174.2	0	0	0	108.8	L102 L107 F123 L127 S129 L130 N131	L102-I105 HydrophobicContact CB-CD1 4.31Å; L102-I105 HydrophobicContact CB-CG1 3.97Å; L102-I105 HydrophobicContact CD1-CD1 4.31Å; L102-I105 HydrophobicContact CD1-CG1 3.94Å; I105-L107 HydrophobicContact CG2-CD1 4Å; I105-L107 HydrophobicContact CG2-CD2 4.1Å; I105-L107 HydrophobicContact CG2-CG 3.7Å; I105-F123 HydrophobicContact CD1-CD1 3.74Å; I105-F123 HydrophobicContact CD1-CD2 4.27Å; I105-F123 HydrophobicContact CD1-CE1 3.67Å; I105-F123 HydrophobicContact CD1-CE2 4.22Å; I105-F123 HydrophobicContact CD1-CG 4.03Å; I105-F123 HydrophobicContact CD1-CZ 3.92Å; I105-L127 HydrophobicContact CB-CD1 4.24Å; I105-L127 HydrophobicContact CD1-CD1 3.69Å; I105-L127 HydrophobicContact CD1-CD2 4.44Å; I105-L127 HydrophobicContact CG1-CD1 3.67Å; I105-S129 PolarHBondContact N-O 2.89Å; I105-L130 HydrophobicContact CB-CD1 3.91Å; I105-L130 HydrophobicContact CG2-CD1 3.87Å; I105-L130 WeakPolarHBondContact O-CA 3.44Å; I105-N131 PolarHBondContact O-N 3.13Å
106	D	89.7	Confident	87.9	Confident	30 Å²	30	49.9 Å²	49.9	16%	0.16	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	109.4	174.1	-177	6	0	0	0	110.6	L82 K83 L84 S108 N131	L82-D106 PolarHBondContact O-N 2.86Å; K83-D106 WeakPolarHBondContact CA-O 3.45Å; K83-D106 HydrophobicContact CB-CB 3.92Å; K83-D106 VanDerWaalsContact CD-OD2 3.27Å; K83-D106 WeakPolarHBondContact CD-OD2 3.49Å; K83-D106 WeakPolarHBondContact CE-OD2 3.42Å; K83-D106 HydrophobicContact CG-CB 4.06Å; K83-D106 IonicContact NZ-OD2 3.95Å; K83-D106 PolarHBondContact NZ-OD2 2.77Å; L84-D106 PolarHBondContact N-O 3.45Å; D106-S108 WeakPolarHBondContact OD1-CB 3.39Å; D106-S108 PolarHBondContact OD1-N 3.38Å; D106-S108 PolarHBondContact OD1-OG 2.93Å; D106-S108 PolarHBondContact OD2-OG 2.94Å; D106-N131 HydrophobicContact CB-CB 4.25Å; D106-N131 PolarHBondContact OD1-ND2 3.27Å
107	L	92.9	Very high	88	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.24	C	C	.	.			trans	-115.9	26.8	176.2	-55.4	177.7	0	0	0	111.1	L84 W87 L95 I105 L110 L112 N131 L132 N135	L84-L107 HydrophobicContact CB-CD2 4.06Å; L84-L107 HydrophobicContact CD1-CD2 3.6Å; L84-L107 HydrophobicContact CG-CD2 3.87Å; W87-L107 HydrophobicContact CZ3-CD1 4.38Å; W87-L107 HydrophobicContact CZ3-CD2 4.13Å; L95-L107 HydrophobicContact CD2-CD1 4.41Å; L95-L107 HydrophobicContact CD2-CD2 4.03Å; I105-L107 HydrophobicContact CG2-CD1 4Å; I105-L107 HydrophobicContact CG2-CD2 4.1Å; I105-L107 HydrophobicContact CG2-CG 3.7Å; L107-L110 HydrophobicContact CB-CD1 3.91Å; L107-L110 HydrophobicContact CD2-CD1 4.03Å; L107-L112 HydrophobicContact CB-CD1 3.94Å; L107-L112 HydrophobicContact CD1-CD1 4.48Å; L107-N131 CarbonylContact C-O 3.13Å; L107-N131 PolarHBondContact N-O 3.47Å; L107-L132 HydrophobicContact CB-CD2 3.85Å; L107-L132 HydrophobicContact CD1-CD2 3.95Å; L107-L132 HydrophobicContact CG-CD2 4.29Å; L107-N135 PolarHBondContact O-ND2 2.71Å
108	S	90.6	Very high	88.3	Confident	4 Å²	4	48 Å²	48	3%	0.028	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	151.9	179.3	59.6	0	0	0	0	112.9	D106 L110 S133	D106-S108 WeakPolarHBondContact OD1-CB 3.39Å; D106-S108 PolarHBondContact OD1-N 3.38Å; D106-S108 PolarHBondContact OD1-OG 2.93Å; D106-S108 PolarHBondContact OD2-OG 2.94Å; S108-L110 VanDerWaalsContact C-N 3.26Å; S108-L110 PolarHBondContact O-N 3.22Å; S108-S133 WeakPolarHBondContact CA-O 3.31Å; S108-S133 VanDerWaalsContact CB-O 3.29Å; S108-S133 WeakPolarHBondContact CB-O 3.35Å; S108-S133 WeakPolarHBondContact CB-OG 3.47Å
109	Y	90.8	Very high	88.7	Confident	141 Å²	141	48 Å²	48	55%	0.553	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	21	176.5	-61.2	-89.7	0	0	0	116.3	S133 Y134	Y109-S133 PolarHBondContact N-O 3.37Å; Y109-S133 VanDerWaalsContact N-O 3.09Å; Y109-Y134 WeakPolarHBondContact CA-O 3.43Å; Y109-Y134 HydrophobicContact CD1-CD1 4.3Å; Y109-Y134 AromaticContact CD1-CG 3.9Å; Y109-Y134 HydrophobicContact CD1-CG 3.9Å; Y109-Y134 HydrophobicContact CD2-CD2 4.3Å; Y109-Y134 HydrophobicContact CD2-CG 4.37Å; Y109-Y134 AromaticContact CE1-CD1 3.49Å; Y109-Y134 HydrophobicContact CE1-CD1 3.49Å; Y109-Y134 VanDerWaalsContact CE1-CD1 3.49Å; Y109-Y134 AromaticContact CE1-CD2 3.82Å; Y109-Y134 HydrophobicContact CE1-CD2 3.82Å; Y109-Y134 HydrophobicContact CE1-CE1 4.11Å; Y109-Y134 HydrophobicContact CE1-CE2 4.41Å; Y109-Y134 AromaticContact CE1-CG 3.31Å; Y109-Y134 HydrophobicContact CE1-CG 3.31Å; Y109-Y134 AromaticContact CE2-CD2 3.52Å; Y109-Y134 HydrophobicContact CE2-CD2 3.52Å; Y109-Y134 HydrophobicContact CE2-CE2 4.12Å; Y109-Y134 AromaticContact CE2-CG 3.86Å; Y109-Y134 HydrophobicContact CE2-CG 3.86Å; Y109-Y134 HydrophobicContact CG-CG 4.39Å; Y109-Y134 AromaticContact CZ-CD1 3.74Å; Y109-Y134 AromaticContact CZ-CD2 3.25Å; Y109-Y134 AromaticContact CZ-CE2 3.65Å; Y109-Y134 AromaticContact CZ-CG 3.3Å; Y109-Y134 VanDerWaalsContact OH-CD2 3.26Å; Y109-Y134 WeakPolarHBondContact OH-CD2 3.21Å; Y109-Y134 WeakPolarHBondContact OH-CE2 3.25Å; Y109-Y134 VanDerWaalsContact OH-CZ 3.24Å
110	L	90.3	Very high	89	Confident	19 Å²	19	48 Å²	48	10%	0.099	23%	0.232	C	C	.	.	S	Bend	trans	-95.1	4	-177	-66.3	-178.3	0	0	0	114	L84 I85 W87 L107 S108 L112 N135	L84-L110 HydrophobicContact CB-CD1 3.82Å; I85-L110 WeakPolarHBondContact O-CD2 3.35Å; W87-L110 HydrophobicContact CB-CB 4.13Å; W87-L110 HydrophobicContact CB-CD1 4.25Å; W87-L110 HydrophobicContact CB-CD2 4.34Å; W87-L110 HydrophobicContact CB-CG 4.47Å; W87-L110 HydrophobicContact CE3-CD1 4.06Å; L107-L110 HydrophobicContact CB-CD1 3.91Å; L107-L110 HydrophobicContact CD2-CD1 4.03Å; S108-L110 VanDerWaalsContact C-N 3.26Å; S108-L110 PolarHBondContact O-N 3.22Å; L110-L112 HydrophobicContact CB-CD1 4.06Å; L110-L112 HydrophobicContact CB-CD2 4.06Å; L110-L112 HydrophobicContact CB-CG 3.7Å; L110-L112 HydrophobicContact CD1-CD1 4.33Å; L110-L112 PolarHBondContact O-N 3.03Å; L110-N135 WeakPolarHBondContact CA-OD1 3.27Å; L110-N135 PolarHBondContact N-OD1 3.42Å
111	R	89.3	Confident	89.2	Confident	214 Å²	214	47.1 Å²	47.1	81%	0.808	22%	0.223	S	C	*	.			trans	55.3	33	-176.3	-53.6	178.6	-179	175.1	0.5	112.8	N135	R111-N135 PolarHBondContact N-OD1 2.95Å
112	L	91.7	Very high	89.6	Confident	8 Å²	8	52.1 Å²	52.1	4%	0.042	24%	0.24	C	C	.	.			trans	-69.8	132.8	-178.9	-58.6	173.6	0	0	0	110.8	W87 L107 L110 N135 Q136 I137	W87-L112 HydrophobicContact CB-CD2 4.12Å; W87-L112 HydrophobicContact CD2-CD2 3.51Å; W87-L112 HydrophobicContact CE3-CD2 4.12Å; W87-L112 HydrophobicContact CG-CD2 3.49Å; W87-L112 VanDerWaalsContact CG-CD2 3.49Å; W87-L112 HydrophobicContact CZ2-CD2 4.28Å; L107-L112 HydrophobicContact CB-CD1 3.94Å; L107-L112 HydrophobicContact CD1-CD1 4.48Å; L110-L112 HydrophobicContact CB-CD1 4.06Å; L110-L112 HydrophobicContact CB-CD2 4.06Å; L110-L112 HydrophobicContact CB-CG 3.7Å; L110-L112 HydrophobicContact CD1-CD1 4.33Å; L110-L112 PolarHBondContact O-N 3.03Å; L112-N135 HydrophobicContact CB-CB 4.15Å; L112-N135 PolarHBondContact N-OD1 3.08Å; L112-Q136 CarbonylContact O-C 3.55Å; L112-Q136 WeakPolarHBondContact O-CA 3.48Å; L112-Q136 WeakPolarHBondContact O-CB 3.14Å; L112-Q136 PolarHBondContact O-N 3.27Å; L112-I137 PolarHBondContact O-N 3.25Å
113	N	90.9	Very high	89.9	Confident	112 Å²	112	52.2 Å²	52.2	60%	0.599	24%	0.24	S	C	*	.	S	Bend	trans	-88.8	-34.3	170.8	-62.9	-22.3	0	0	0	111.5	Q136	N113-Q136 VanDerWaalsContact OD1-CB 3.26Å; N113-Q136 WeakPolarHBondContact OD1-CB 3.3Å
114	E	89.8	Confident	89.9	Confident	118 Å²	118	51.1 Å²	51.1	55%	0.551	24%	0.236	S	C	*	.			trans	-152.2	164.5	-175.7	62.6	-175.6	-168.1	0	0	110.2
115	I	90	Very high	89.7	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	24%	0.241	C	C	.	.			trans	-119	113.6	173.5	-54.9	178.2	0	0	0	107.7	T117 L119 L120 L132 I141 E144	I115-T117 PolarHBondContact O-N 2.78Å; I115-L119 HydrophobicContact CG2-CD2 3.95Å; I115-L119 HydrophobicContact CG2-CG 4.5Å; I115-L120 HydrophobicContact CB-CD1 4.46Å; I115-L120 HydrophobicContact CB-CD2 4.12Å; I115-L120 HydrophobicContact CB-CG 4.31Å; I115-L120 HydrophobicContact CG2-CD1 4.49Å; I115-L120 HydrophobicContact CG2-CD2 3.57Å; I115-L120 HydrophobicContact CG2-CG 3.81Å; I115-L132 HydrophobicContact CD1-CD1 3.41Å; I115-L132 VanDerWaalsContact CD1-CD1 3.41Å; I115-L132 HydrophobicContact CD1-CD2 3.3Å; I115-L132 HydrophobicContact CD1-CG 3.96Å; I115-I141 HydrophobicContact CB-CD1 4.06Å; I115-I141 HydrophobicContact CD1-CD1 4.27Å; I115-I141 HydrophobicContact CG1-CD1 4.21Å; I115-E144 VanDerWaalsContact O-OE2 3.09Å
116	P	87.3	Confident	89.4	Confident	38 Å²	38	57 Å²	57	25%	0.247	27%	0.267	C	S	.	.			trans	-50.7	128.3	-177.5	-29.2	35.3	0	0	0	112.1	N118 L119 L120	P116-N118 WeakPolarHBondContact CB-OD1 3.44Å; P116-N118 PolarHBondContact O-N 3.1Å; P116-N118 VanDerWaalsContact O-N 3.09Å; P116-L119 HydrophobicContact CB-CB 4.48Å; P116-L119 WeakPolarHBondContact O-CA 2.98Å; P116-L119 WeakPolarHBondContact O-CB 3.41Å; P116-L119 PolarHBondContact O-N 3.46Å; P116-L120 PolarHBondContact O-N 3.21Å; P116-L120 VanDerWaalsContact O-N 3.16Å
117	T	88.3	Confident	89.4	Confident	55 Å²	55	55.6 Å²	55.6	34%	0.337	26%	0.259	S	S	.	.	H	α-helix	trans	-53.6	-33.8	178.4	49.6	0	0	0	0	112.7	I115 L119 L120 L121 E144	I115-T117 PolarHBondContact O-N 2.78Å; T117-L119 VanDerWaalsContact C-N 3.25Å; T117-L119 PolarHBondContact O-N 3.09Å; T117-L120 PolarHBondContact O-N 2.9Å; T117-L121 VanDerWaalsContact O-CG 3.29Å; T117-L121 WeakPolarHBondContact O-CG 3.08Å; T117-L121 PolarHBondContact O-N 3.39Å; T117-E144 HydrophobicContact CG2-CB 3.74Å; T117-E144 HydrophobicContact CG2-CG 3.89Å
118	N	87.2	Confident	89.3	Confident	77 Å²	77	57.6 Å²	57.6	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-23	176.1	66.4	7.3	0	0	0	114.2	K96 P116 R122	K96-N118 VanDerWaalsContact CE-OD1 3.3Å; K96-N118 WeakPolarHBondContact CE-OD1 3.49Å; K96-N118 VanDerWaalsContact NZ-CG 3.26Å; K96-N118 PolarHBondContact NZ-ND2 2.97Å; K96-N118 PolarHBondContact NZ-OD1 3.38Å; K96-N118 VanDerWaalsContact NZ-OD1 3.12Å; P116-N118 WeakPolarHBondContact CB-OD1 3.44Å; P116-N118 PolarHBondContact O-N 3.1Å; P116-N118 VanDerWaalsContact O-N 3.09Å; N118-R122 WeakPolarHBondContact O-CG 3.41Å
119	L	89.9	Confident	89.4	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-83.5	-44.6	171.4	172.3	65.1	0	0	0	110.4	W87 L95 K96 I115 P116 T117 L121 R122 F123	W87-L119 HydrophobicContact CH2-CD2 3.62Å; W87-L119 HydrophobicContact CZ3-CD2 4.43Å; L95-L119 HydrophobicContact CB-CD1 4.21Å; L95-L119 HydrophobicContact CD2-CD1 3.97Å; L95-L119 HydrophobicContact CD2-CD2 3.83Å; L95-L119 HydrophobicContact CD2-CG 4.45Å; L95-L119 HydrophobicContact CG-CD1 3.88Å; K96-L119 HydrophobicContact CB-CD1 4.49Å; K96-L119 HydrophobicContact CG-CB 4.42Å; K96-L119 HydrophobicContact CG-CD1 3.64Å; I115-L119 HydrophobicContact CG2-CD2 3.95Å; I115-L119 HydrophobicContact CG2-CG 4.5Å; P116-L119 HydrophobicContact CB-CB 4.48Å; P116-L119 WeakPolarHBondContact O-CA 2.98Å; P116-L119 WeakPolarHBondContact O-CB 3.41Å; P116-L119 PolarHBondContact O-N 3.46Å; T117-L119 VanDerWaalsContact C-N 3.25Å; T117-L119 PolarHBondContact O-N 3.09Å; L119-L121 PolarHBondContact O-N 3.01Å; L119-R122 WeakPolarHBondContact O-CB 3.29Å; L119-R122 PolarHBondContact O-N 3.02Å; L119-F123 HydrophobicContact CD1-CE1 3.99Å; L119-F123 HydrophobicContact CD2-CE1 4.45Å; L119-F123 HydrophobicContact CG-CE1 3.81Å; L119-F123 HydrophobicContact CG-CZ 4.36Å; L119-F123 WeakPolarHBondContact O-CD1 3.25Å
120	L	91.8	Very high	89.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.7	-31.1	176.3	-63	174.3	0	0	0	112.2	I115 P116 T117 R122 F123 I141 E144 L145 V148 W169	I115-L120 HydrophobicContact CB-CD1 4.46Å; I115-L120 HydrophobicContact CB-CD2 4.12Å; I115-L120 HydrophobicContact CB-CG 4.31Å; I115-L120 HydrophobicContact CG2-CD1 4.49Å; I115-L120 HydrophobicContact CG2-CD2 3.57Å; I115-L120 HydrophobicContact CG2-CG 3.81Å; P116-L120 PolarHBondContact O-N 3.21Å; P116-L120 VanDerWaalsContact O-N 3.16Å; T117-L120 PolarHBondContact O-N 2.9Å; L120-R122 PolarHBondContact O-N 2.95Å; L120-F123 HydrophobicContact CD2-CD2 4.26Å; L120-F123 HydrophobicContact CD2-CE2 3.62Å; L120-F123 HydrophobicContact CD2-CZ 4.02Å; L120-I141 HydrophobicContact CD1-CD1 4.31Å; L120-E144 HydrophobicContact CD1-CB 4.03Å; L120-L145 HydrophobicContact CD1-CD2 4.15Å; L120-L145 HydrophobicContact CD2-CD2 4.41Å; L120-V148 HydrophobicContact CB-CG2 3.67Å; L120-V148 HydrophobicContact CD1-CG2 4.26Å; L120-W169 HydrophobicContact CB-CZ2 4.34Å; L120-W169 HydrophobicContact CD2-CH2 4.43Å; L120-W169 HydrophobicContact CD2-CZ2 4.01Å; L120-W169 PolarHBondContact O-NE1 2.86Å
121	L	90.1	Very high	89.8	Confident	46 Å²	46	52 Å²	52	24%	0.241	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.7	173.8	-76	169.1	0	0	0	114.5	T117 L119 V148 W151 Y152	T117-L121 VanDerWaalsContact O-CG 3.29Å; T117-L121 WeakPolarHBondContact O-CG 3.08Å; T117-L121 PolarHBondContact O-N 3.39Å; L119-L121 PolarHBondContact O-N 3.01Å; L121-V148 HydrophobicContact CD2-CG1 4.1Å; L121-V148 HydrophobicContact CD2-CG2 4.44Å; L121-V148 HydrophobicContact CG-CG2 4.32Å; L121-W151 HydrophobicContact CD2-CB 4.16Å; L121-W151 HydrophobicContact CD2-CD2 3.57Å; L121-W151 HydrophobicContact CD2-CE3 3.36Å; L121-W151 HydrophobicContact CD2-CG 3.93Å; L121-W151 HydrophobicContact CD2-CZ3 3.96Å; L121-Y152 HydrophobicContact CD2-CD2 4.49Å; L121-Y152 HydrophobicContact CD2-CE2 4.17Å; L121-Y152 PolarHBondContact O-OH 2.87Å; L121-Y152 VanDerWaalsContact O-OH 3.14Å
122	R	89.7	Confident	90.1	Very high	149 Å²	149	42 Å²	42	56%	0.562	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-6.6	-179.5	-64.1	-65.1	-176.9	176.2	1	113.4	K96 A99 P100 N118 L119 L120	K96-R122 HydrophobicContact CB-CG 4.37Å; K96-R122 HydrophobicContact CG-CG 4.37Å; A99-R122 CarbonylContact C-O 3.37Å; A99-R122 HydrophobicContact CB-CB 4.25Å; A99-R122 WeakPolarHBondContact CB-O 3.42Å; P100-R122 WeakPolarHBondContact CD-O 3.49Å; P100-R122 WeakPolarHBondContact CG-O 3.48Å; N118-R122 WeakPolarHBondContact O-CG 3.41Å; L119-R122 WeakPolarHBondContact O-CB 3.29Å; L119-R122 PolarHBondContact O-N 3.02Å; L120-R122 PolarHBondContact O-N 2.95Å
123	F	91.2	Very high	90.3	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.013	21%	0.211	C	C	.	.	S	Bend	trans	-64.9	140.3	-179.8	-71.9	2.3	0	0	0	111.2	A99 I105 L119 L120 L127 L130 W169	A99-F123 HydrophobicContact CB-CD1 3.86Å; A99-F123 HydrophobicContact CB-CE1 4.4Å; I105-F123 HydrophobicContact CD1-CD1 3.74Å; I105-F123 HydrophobicContact CD1-CD2 4.27Å; I105-F123 HydrophobicContact CD1-CE1 3.67Å; I105-F123 HydrophobicContact CD1-CE2 4.22Å; I105-F123 HydrophobicContact CD1-CG 4.03Å; I105-F123 HydrophobicContact CD1-CZ 3.92Å; L119-F123 HydrophobicContact CD1-CE1 3.99Å; L119-F123 HydrophobicContact CD2-CE1 4.45Å; L119-F123 HydrophobicContact CG-CE1 3.81Å; L119-F123 HydrophobicContact CG-CZ 4.36Å; L119-F123 WeakPolarHBondContact O-CD1 3.25Å; L120-F123 HydrophobicContact CD2-CD2 4.26Å; L120-F123 HydrophobicContact CD2-CE2 3.62Å; L120-F123 HydrophobicContact CD2-CZ 4.02Å; F123-L127 HydrophobicContact CB-CD2 4.2Å; F123-L127 HydrophobicContact CD2-CD2 3.63Å; F123-L127 HydrophobicContact CE2-CD2 4.32Å; F123-L127 HydrophobicContact CG-CD2 4.19Å; F123-L130 HydrophobicContact CE2-CD1 3.93Å; F123-L130 HydrophobicContact CE2-CD2 4.12Å; F123-L130 HydrophobicContact CZ-CD1 4.38Å; F123-W169 HydrophobicContact CB-CD2 4.26Å; F123-W169 HydrophobicContact CB-CG 3.95Å; F123-W169 HydrophobicContact CD2-CD2 4.18Å; F123-W169 AromaticContact CD2-CE2 3.73Å; F123-W169 HydrophobicContact CD2-CH2 4.12Å; F123-W169 AromaticContact CD2-CZ2 3.72Å; F123-W169 HydrophobicContact CD2-CZ2 3.72Å; F123-W169 HydrophobicContact CE2-CH2 4.43Å; F123-W169 HydrophobicContact CE2-CZ2 4.26Å
124	S	85.6	Confident	90.5	Very high	10 Å²	10	40.5 Å²	40.5	7%	0.07	20%	0.198	C	C	.	.			trans	-56.4	140.7	178.7	-168	0	0	0	0	111.9	A99 P100 L102 H126 L127 W169	A99-S124 PolarHBondContact O-N 3.08Å; A99-S124 VanDerWaalsContact O-N 3.08Å; P100-S124 WeakPolarHBondContact O-CB 3.45Å; P100-S124 PolarHBondContact O-OG 3.28Å; L102-S124 WeakPolarHBondContact O-CB 3.3Å; S124-H126 PolarHBondContact O-N 3.11Å; S124-H126 VanDerWaalsContact O-N 3.09Å; S124-H126 PolarHBondContact OG-N 3.35Å; S124-L127 VanDerWaalsContact O-CB 3.25Å; S124-L127 WeakPolarHBondContact O-CB 3.42Å; S124-L127 PolarHBondContact O-N 2.74Å; S124-W169 WeakPolarHBondContact O-CB 3.15Å
125	T	84.9	Confident	90.7	Very high	52 Å²	52	34.9 Å²	34.9	32%	0.319	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.7	169.2	54.9	0	0	0	0	112.9	C167 T172	T125-C167 WeakPolarHBondContact CB-O 3.44Å; T125-C167 WeakPolarHBondContact CG2-O 3.33Å; T125-T172 WeakPolarHBondContact O-CG2 3.26Å; T125-T172 PolarHBondContact O-OG1 3.06Å; T125-T172 VanDerWaalsContact O-OG1 3.07Å
126	H	84.6	Confident	91	Very high	121 Å²	121	38.4 Å²	38.4	56%	0.56	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	5.5	175	-59.3	-69.9	0	0	0	113.3	Q103 S124 F128	Q103-H126 HydrophobicContact CG-CB 4.22Å; S124-H126 PolarHBondContact O-N 3.11Å; S124-H126 VanDerWaalsContact O-N 3.09Å; S124-H126 PolarHBondContact OG-N 3.35Å; H126-F128 PolarHBondContact O-N 2.83Å
127	L	90.1	Very high	91.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.			trans	-61.8	123	176.3	-170.4	80	0	0	0	109.6	Q103 I105 F123 S124 L130 W169 T172 I173	Q103-L127 WeakPolarHBondContact O-CD1 3.19Å; I105-L127 HydrophobicContact CB-CD1 4.24Å; I105-L127 HydrophobicContact CD1-CD1 3.69Å; I105-L127 HydrophobicContact CD1-CD2 4.44Å; I105-L127 HydrophobicContact CG1-CD1 3.67Å; F123-L127 HydrophobicContact CB-CD2 4.2Å; F123-L127 HydrophobicContact CD2-CD2 3.63Å; F123-L127 HydrophobicContact CE2-CD2 4.32Å; F123-L127 HydrophobicContact CG-CD2 4.19Å; S124-L127 VanDerWaalsContact O-CB 3.25Å; S124-L127 WeakPolarHBondContact O-CB 3.42Å; S124-L127 PolarHBondContact O-N 2.74Å; L127-L130 HydrophobicContact CD2-CB 4.41Å; L127-W169 HydrophobicContact CB-CB 4.06Å; L127-W169 HydrophobicContact CD2-CD2 4.13Å; L127-W169 HydrophobicContact CD2-CE3 3.74Å; L127-W169 HydrophobicContact CD2-CZ3 4.15Å; L127-T172 PolarHBondContact O-OG1 3.41Å; L127-T172 VanDerWaalsContact O-OG1 3.11Å; L127-I173 HydrophobicContact CD2-CD1 3.99Å; L127-I173 HydrophobicContact CG-CD1 4.14Å
128	F	90.6	Very high	91.7	Very high	42 Å²	42	39.5 Å²	39.5	18%	0.184	19%	0.186	C	C	.	.			trans	-116.7	-20.9	177.5	72.7	-95.2	0	0	0	113.3	C79 Q103 Q104 H126 H174 E175	C79-F128 HydrophobicContact CB-CE1 3.87Å; C79-F128 HydrophobicContact CB-CZ 4.19Å; Q103-F128 HydrophobicContact CB-CD1 3.95Å; Q103-F128 HydrophobicContact CB-CE1 3.86Å; Q103-F128 WeakPolarHBondContact O-CD1 3.42Å; Q103-F128 PolarHBondContact O-N 3.28Å; Q104-F128 HydrophobicContact CG-CD1 4.46Å; Q104-F128 HydrophobicContact CG-CE1 3.77Å; Q104-F128 HydrophobicContact CG-CE2 3.98Å; Q104-F128 HydrophobicContact CG-CZ 3.54Å; H126-F128 PolarHBondContact O-N 2.83Å; F128-H174 HydrophobicContact CB-CB 4.23Å; F128-H174 CarbonylContact O-C 3.51Å; F128-H174 WeakPolarHBondContact O-CA 3.32Å; F128-H174 WeakPolarHBondContact O-CB 3.24Å; F128-H174 PolarHBondContact O-N 3.45Å; F128-E175 PolarHBondContact O-N 2.98Å
129	S	93.1	Very high	91.9	Very high	11 Å²	11	37.5 Å²	37.5	8%	0.077	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131	177.9	-168.9	0	0	0	0	111.9	Q103 Q104 I105 E175	Q103-S129 PolarHBondContact O-N 2.88Å; Q104-S129 WeakPolarHBondContact CA-O 3.34Å; I105-S129 PolarHBondContact N-O 2.89Å; S129-E175 WeakPolarHBondContact CA-O 3.35Å
130	L	94.8	Very high	91.9	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	113.3	175.4	180	62.3	0	0	0	109.6	I105 F123 L127 L132 W169 I173 E175 I176 Y177	I105-L130 HydrophobicContact CB-CD1 3.91Å; I105-L130 HydrophobicContact CG2-CD1 3.87Å; I105-L130 WeakPolarHBondContact O-CA 3.44Å; F123-L130 HydrophobicContact CE2-CD1 3.93Å; F123-L130 HydrophobicContact CE2-CD2 4.12Å; F123-L130 HydrophobicContact CZ-CD1 4.38Å; L127-L130 HydrophobicContact CD2-CB 4.41Å; L130-L132 HydrophobicContact CD1-CD2 3.94Å; L130-L132 HydrophobicContact CD1-CG 4.31Å; L130-L132 HydrophobicContact CD2-CD1 3.99Å; L130-L132 HydrophobicContact CD2-CG 4.34Å; L130-L132 HydrophobicContact CG-CD1 4.16Å; L130-L132 HydrophobicContact CG-CD2 4.14Å; L130-L132 HydrophobicContact CG-CG 3.95Å; L130-W169 HydrophobicContact CD2-CH2 3.84Å; L130-W169 HydrophobicContact CD2-CZ3 4Å; L130-I173 HydrophobicContact CB-CD1 3.89Å; L130-E175 PolarHBondContact N-O 3.15Å; L130-I176 WeakPolarHBondContact O-CA 3.32Å; L130-Y177 PolarHBondContact O-N 3.4Å
131	N	94.4	Very high	91.9	Very high	30 Å²	30	42 Å²	42	16%	0.16	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	115.9	178.7	-177.7	1.9	0	0	0	111.4	I105 D106 L107 S133 Y177	I105-N131 PolarHBondContact O-N 3.13Å; D106-N131 HydrophobicContact CB-CB 4.25Å; D106-N131 PolarHBondContact OD1-ND2 3.27Å; L107-N131 CarbonylContact C-O 3.13Å; L107-N131 PolarHBondContact N-O 3.47Å; N131-S133 VanDerWaalsContact OD1-CB 3.29Å; N131-S133 WeakPolarHBondContact OD1-CB 3.25Å; N131-S133 PolarHBondContact OD1-N 2.75Å; N131-S133 PolarHBondContact OD1-OG 3.3Å; N131-Y177 HydrophobicContact CB-CD2 3.97Å; N131-Y177 HydrophobicContact CB-CG 4.26Å; N131-Y177 WeakPolarHBondContact OD1-CB 3.26Å
132	L	95.9	Very high	92	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	19%	0.188	C	C	.	.			trans	-123.9	19.4	-179.6	-55	176.5	0	0	0	111.7	L107 I115 L130 N135 I137 Y177 L178 N181	L107-L132 HydrophobicContact CB-CD2 3.85Å; L107-L132 HydrophobicContact CD1-CD2 3.95Å; L107-L132 HydrophobicContact CG-CD2 4.29Å; I115-L132 HydrophobicContact CD1-CD1 3.41Å; I115-L132 VanDerWaalsContact CD1-CD1 3.41Å; I115-L132 HydrophobicContact CD1-CD2 3.3Å; I115-L132 HydrophobicContact CD1-CG 3.96Å; L130-L132 HydrophobicContact CD1-CD2 3.94Å; L130-L132 HydrophobicContact CD1-CG 4.31Å; L130-L132 HydrophobicContact CD2-CD1 3.99Å; L130-L132 HydrophobicContact CD2-CG 4.34Å; L130-L132 HydrophobicContact CG-CD1 4.16Å; L130-L132 HydrophobicContact CG-CD2 4.14Å; L130-L132 HydrophobicContact CG-CG 3.95Å; L132-N135 PolarHBondContact O-ND2 3.12Å; L132-I137 HydrophobicContact CB-CD1 3.6Å; L132-I137 HydrophobicContact CD1-CD1 4.05Å; L132-I137 HydrophobicContact CG-CD1 4.29Å; L132-Y177 CarbonylContact C-O 3.17Å; L132-Y177 WeakPolarHBondContact CA-O 3.34Å; L132-Y177 WeakPolarHBondContact CB-O 3.24Å; L132-Y177 PolarHBondContact N-O 2.8Å; L132-L178 HydrophobicContact CB-CD2 3.99Å; L132-L178 HydrophobicContact CD1-CD2 3.92Å; L132-N181 PolarHBondContact O-ND2 2.96Å
133	S	95.3	Very high	92	Very high	7 Å²	7	38.5 Å²	38.5	5%	0.049	19%	0.187	C	C	.	.			trans	-62.9	155.2	-176.8	58.9	0	0	0	0	112.8	S108 Y109 N131 N135 Y177 D179	S108-S133 WeakPolarHBondContact CA-O 3.31Å; S108-S133 VanDerWaalsContact CB-O 3.29Å; S108-S133 WeakPolarHBondContact CB-O 3.35Å; S108-S133 WeakPolarHBondContact CB-OG 3.47Å; Y109-S133 PolarHBondContact N-O 3.37Å; Y109-S133 VanDerWaalsContact N-O 3.09Å; N131-S133 VanDerWaalsContact OD1-CB 3.29Å; N131-S133 WeakPolarHBondContact OD1-CB 3.25Å; N131-S133 PolarHBondContact OD1-N 2.75Å; N131-S133 PolarHBondContact OD1-OG 3.3Å; S133-N135 VanDerWaalsContact C-N 3.32Å; S133-N135 PolarHBondContact O-N 3.36Å; S133-N135 PolarHBondContact O-ND2 3.3Å; S133-Y177 PolarHBondContact N-O 3.43Å; S133-D179 CarbonylContact C-O 3.48Å; S133-D179 VanDerWaalsContact CA-O 3.23Å; S133-D179 WeakPolarHBondContact CA-O 3.43Å; S133-D179 VanDerWaalsContact CB-CG 3.5Å; S133-D179 VanDerWaalsContact CB-OD1 3.27Å; S133-D179 WeakPolarHBondContact CB-OD1 3.36Å; S133-D179 WeakPolarHBondContact CB-OD2 3.38Å
134	Y	95.5	Very high	91.9	Very high	82 Å²	82	39.3 Å²	39.3	32%	0.322	19%	0.191	S	C	.	.	S	Bend	trans	57.2	41	176.1	-61.7	-92	0	0	0	114.4	Y109 D179 H180	Y109-Y134 WeakPolarHBondContact CA-O 3.43Å; Y109-Y134 HydrophobicContact CD1-CD1 4.3Å; Y109-Y134 AromaticContact CD1-CG 3.9Å; Y109-Y134 HydrophobicContact CD1-CG 3.9Å; Y109-Y134 HydrophobicContact CD2-CD2 4.3Å; Y109-Y134 HydrophobicContact CD2-CG 4.37Å; Y109-Y134 AromaticContact CE1-CD1 3.49Å; Y109-Y134 HydrophobicContact CE1-CD1 3.49Å; Y109-Y134 VanDerWaalsContact CE1-CD1 3.49Å; Y109-Y134 AromaticContact CE1-CD2 3.82Å; Y109-Y134 HydrophobicContact CE1-CD2 3.82Å; Y109-Y134 HydrophobicContact CE1-CE1 4.11Å; Y109-Y134 HydrophobicContact CE1-CE2 4.41Å; Y109-Y134 AromaticContact CE1-CG 3.31Å; Y109-Y134 HydrophobicContact CE1-CG 3.31Å; Y109-Y134 AromaticContact CE2-CD2 3.52Å; Y109-Y134 HydrophobicContact CE2-CD2 3.52Å; Y109-Y134 HydrophobicContact CE2-CE2 4.12Å; Y109-Y134 AromaticContact CE2-CG 3.86Å; Y109-Y134 HydrophobicContact CE2-CG 3.86Å; Y109-Y134 HydrophobicContact CG-CG 4.39Å; Y109-Y134 AromaticContact CZ-CD1 3.74Å; Y109-Y134 AromaticContact CZ-CD2 3.25Å; Y109-Y134 AromaticContact CZ-CE2 3.65Å; Y109-Y134 AromaticContact CZ-CG 3.3Å; Y109-Y134 VanDerWaalsContact OH-CD2 3.26Å; Y109-Y134 WeakPolarHBondContact OH-CD2 3.21Å; Y109-Y134 WeakPolarHBondContact OH-CE2 3.25Å; Y109-Y134 VanDerWaalsContact OH-CZ 3.24Å; Y134-D179 PolarHBondContact N-O 3.33Å; Y134-H180 VanDerWaalsContact CA-O 3.32Å; Y134-H180 WeakPolarHBondContact CA-O 2.87Å; Y134-H180 HydrophobicContact CD1-CB 3.53Å; Y134-H180 AromaticContact CD1-CG 3.64Å; Y134-H180 HydrophobicContact CD2-CB 4.24Å; Y134-H180 HydrophobicContact CE1-CB 3.77Å; Y134-H180 AromaticContact CE1-CD2 3.39Å; Y134-H180 WeakPolarHBondContact CE1-CD2 3.23Å; Y134-H180 AromaticContact CE1-CE1 3.7Å; Y134-H180 AromaticContact CE1-CG 3.3Å; Y134-H180 AromaticContact CE1-ND1 3.52Å; Y134-H180 AromaticContact CE1-NE2 3.67Å; Y134-H180 HydrophobicContact CE2-CB 4.43Å; Y134-H180 AromaticContact CE2-CD2 3.71Å; Y134-H180 HydrophobicContact CG-CB 3.8Å; Y134-H180 AromaticContact CZ-CD2 3.17Å; Y134-H180 AromaticContact CZ-CE1 4Å; Y134-H180 AromaticContact CZ-CG 3.62Å; Y134-H180 AromaticContact CZ-NE2 3.48Å; Y134-H180 PolarHBondContact N-O 3.11Å; Y134-H180 PolarHBondContact OH-CD2 3.29Å; Y134-H180 VanDerWaalsContact OH-CD2 3.26Å; Y134-H180 PolarHBondContact OH-NE2 3.31Å; Y134-H180 VanDerWaalsContact OH-NE2 3.08Å
135	N	95.4	Very high	92.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-113.3	-158.4	173.8	-77.3	-59.2	0	0	0	109.9	L107 L110 R111 L112 L132 S133 I137 H180 N181	L107-N135 PolarHBondContact O-ND2 2.71Å; L110-N135 WeakPolarHBondContact CA-OD1 3.27Å; L110-N135 PolarHBondContact N-OD1 3.42Å; R111-N135 PolarHBondContact N-OD1 2.95Å; L112-N135 HydrophobicContact CB-CB 4.15Å; L112-N135 PolarHBondContact N-OD1 3.08Å; L132-N135 PolarHBondContact O-ND2 3.12Å; S133-N135 VanDerWaalsContact C-N 3.32Å; S133-N135 PolarHBondContact O-N 3.36Å; S133-N135 PolarHBondContact O-ND2 3.3Å; N135-I137 HydrophobicContact CB-CD1 3.98Å; N135-I137 HydrophobicContact CB-CG1 3.89Å; N135-H180 PolarHBondContact N-O 3.47Å; N135-N181 VanDerWaalsContact CA-OD1 3.32Å; N135-N181 WeakPolarHBondContact CA-OD1 3.32Å; N135-N181 WeakPolarHBondContact CB-OD1 3.47Å; N135-N181 PolarHBondContact N-OD1 3.41Å; N135-N181 PolarHBondContact O-OD1 3.04Å
136	Q	95.1	Very high	92.5	Very high	76 Å²	76	39.8 Å²	39.8	36%	0.355	19%	0.188	S	C	.	.			trans	-121.4	27.8	177.2	-58.7	-65.3	-69.2	0	0	110.5	L112 N113 E138 N181	L112-Q136 CarbonylContact O-C 3.55Å; L112-Q136 WeakPolarHBondContact O-CA 3.48Å; L112-Q136 WeakPolarHBondContact O-CB 3.14Å; L112-Q136 PolarHBondContact O-N 3.27Å; N113-Q136 VanDerWaalsContact OD1-CB 3.26Å; N113-Q136 WeakPolarHBondContact OD1-CB 3.3Å; Q136-E138 PolarHBondContact O-N 2.96Å; Q136-N181 PolarHBondContact N-OD1 3.49Å
137	I	95.4	Very high	92.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.176	C	C	.	.			trans	-70.2	130	-171.4	-62.3	169.3	0	0	0	110	L112 L132 N135 I141 L178 N181 K182	L112-I137 PolarHBondContact O-N 3.25Å; L132-I137 HydrophobicContact CB-CD1 3.6Å; L132-I137 HydrophobicContact CD1-CD1 4.05Å; L132-I137 HydrophobicContact CG-CD1 4.29Å; N135-I137 HydrophobicContact CB-CD1 3.98Å; N135-I137 HydrophobicContact CB-CG1 3.89Å; I137-I141 HydrophobicContact CG2-CB 3.71Å; I137-I141 HydrophobicContact CG2-CG1 4.23Å; I137-I141 HydrophobicContact CG2-CG2 3.7Å; I137-L178 HydrophobicContact CD1-CD2 4.37Å; I137-L178 HydrophobicContact CG2-CD2 4.33Å; I137-N181 HydrophobicContact CB-CB 4.34Å; I137-N181 VanDerWaalsContact CB-OD1 3.31Å; I137-N181 WeakPolarHBondContact CB-OD1 3.44Å; I137-N181 PolarHBondContact N-OD1 3.02Å; I137-K182 CarbonylContact O-C 3.59Å; I137-K182 WeakPolarHBondContact O-CA 3.25Å; I137-K182 PolarHBondContact O-N 3.5Å
138	E	94.5	Very high	92.9	Very high	114 Å²	114	36.1 Å²	36.1	53%	0.533	18%	0.176	S	C	.	.	B	Isolated β-bridge	trans	-96.5	170.2	176.5	-62.1	-176.5	-179.7	0	0	111.4	Q136 N140 I141 K182	Q136-E138 PolarHBondContact O-N 2.96Å; E138-N140 PolarHBondContact O-N 2.95Å; E138-I141 WeakPolarHBondContact O-CG2 3.25Å; E138-I141 PolarHBondContact O-N 3.37Å; E138-K182 HydrophobicContact CG-CB 4.13Å
139	M	92	Very high	92.8	Very high	36 Å²	36	35.7 Å²	35.7	18%	0.177	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.3	-178.3	-165.8	62.7	82.6	0	0	113.7	I141 F142 L183 E184	M139-I141 PolarHBondContact O-N 3.32Å; M139-F142 HydrophobicContact CG-CD2 4.36Å; M139-F142 PolarHBondContact O-N 2.87Å; M139-F142 HydrophobicContact SD-CD2 3.42Å; M139-F142 WeakPolarHBondContact SD-CD2 3.46Å; M139-F142 HydrophobicContact SD-CE2 3.54Å; M139-F142 VanDerWaalsContact SD-CE2 3.54Å; M139-L183 HydrophobicContact CE-CB 4.15Å; M139-E184 WeakPolarHBondContact CE-O 3.47Å
140	N	89.9	Confident	92.7	Very high	86 Å²	86	38.8 Å²	38.8	46%	0.46	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.2	177.7	-166.4	38	0	0	0	113.9	E138 F142 H143 E144	E138-N140 PolarHBondContact O-N 2.95Å; N140-F142 PolarHBondContact O-N 3.4Å; N140-F142 VanDerWaalsContact O-N 3.11Å; N140-H143 WeakPolarHBondContact O-CA 3.29Å; N140-H143 VanDerWaalsContact O-CB 3.26Å; N140-H143 WeakPolarHBondContact O-CB 3.44Å; N140-H143 PolarHBondContact O-N 2.87Å; N140-H143 WeakPolarHBondContact OD1-CB 2.98Å; N140-E144 PolarHBondContact O-N 3.17Å; N140-E144 VanDerWaalsContact O-N 3.17Å
141	I	91.8	Very high	92.3	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-53.5	-35.2	175.6	-172	58	0	0	0	112.1	I115 L120 I137 E138 M139 H143 E144 L145	I115-I141 HydrophobicContact CB-CD1 4.06Å; I115-I141 HydrophobicContact CD1-CD1 4.27Å; I115-I141 HydrophobicContact CG1-CD1 4.21Å; L120-I141 HydrophobicContact CD1-CD1 4.31Å; I137-I141 HydrophobicContact CG2-CB 3.71Å; I137-I141 HydrophobicContact CG2-CG1 4.23Å; I137-I141 HydrophobicContact CG2-CG2 3.7Å; E138-I141 WeakPolarHBondContact O-CG2 3.25Å; E138-I141 PolarHBondContact O-N 3.37Å; M139-I141 PolarHBondContact O-N 3.32Å; I141-H143 VanDerWaalsContact C-N 3.3Å; I141-H143 PolarHBondContact O-N 3.17Å; I141-E144 VanDerWaalsContact CD1-OE2 3.25Å; I141-E144 WeakPolarHBondContact CD1-OE2 3.5Å; I141-E144 WeakPolarHBondContact O-CB 3.42Å; I141-E144 PolarHBondContact O-N 3.2Å; I141-E144 VanDerWaalsContact O-N 3.17Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.45Å; I141-L145 PolarHBondContact O-N 3.16Å
142	F	91.7	Very high	91.9	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-70.8	-26.1	178	-66.2	-68.1	0	0	0	113.3	M139 N140 L145 K146 L178 L183 F187 P188 I191	M139-F142 HydrophobicContact CG-CD2 4.36Å; M139-F142 PolarHBondContact O-N 2.87Å; M139-F142 HydrophobicContact SD-CD2 3.42Å; M139-F142 WeakPolarHBondContact SD-CD2 3.46Å; M139-F142 HydrophobicContact SD-CE2 3.54Å; M139-F142 VanDerWaalsContact SD-CE2 3.54Å; N140-F142 PolarHBondContact O-N 3.4Å; N140-F142 VanDerWaalsContact O-N 3.11Å; F142-L145 HydrophobicContact CD1-CD1 4.02Å; F142-L145 HydrophobicContact CE1-CD1 4.41Å; F142-K146 VanDerWaalsContact O-CB 3.32Å; F142-K146 WeakPolarHBondContact O-CB 3.46Å; F142-K146 PolarHBondContact O-N 2.97Å; F142-L178 HydrophobicContact CE1-CD1 4.17Å; F142-L178 HydrophobicContact CE2-CD1 4.36Å; F142-L178 HydrophobicContact CZ-CD1 3.55Å; F142-L183 HydrophobicContact CE2-CD1 4.48Å; F142-L183 HydrophobicContact CE2-CD2 4.32Å; F142-F187 HydrophobicContact CD1-CE2 4.25Å; F142-F187 HydrophobicContact CD1-CZ 4.04Å; F142-F187 HydrophobicContact CE1-CD2 4.48Å; F142-F187 AromaticContact CE1-CE2 3.47Å; F142-F187 HydrophobicContact CE1-CE2 3.47Å; F142-F187 VanDerWaalsContact CE1-CE2 3.47Å; F142-F187 AromaticContact CE1-CZ 3.53Å; F142-F187 HydrophobicContact CE1-CZ 3.53Å; F142-F187 HydrophobicContact CE2-CD2 4.29Å; F142-F187 AromaticContact CE2-CE2 3.97Å; F142-F187 HydrophobicContact CE2-CE2 3.97Å; F142-F187 HydrophobicContact CZ-CD2 4.05Å; F142-F187 AromaticContact CZ-CE2 3.3Å; F142-F187 HydrophobicContact CZ-CE2 3.3Å; F142-F187 AromaticContact CZ-CZ 3.89Å; F142-F187 HydrophobicContact CZ-CZ 3.89Å; F142-P188 HydrophobicContact CB-CG 3.84Å; F142-P188 HydrophobicContact CD2-CG 4.41Å; F142-P188 HydrophobicContact CG-CG 4.3Å; F142-I191 HydrophobicContact CB-CG2 4.13Å; F142-I191 HydrophobicContact CD1-CG1 4.37Å; F142-I191 HydrophobicContact CD1-CG2 3.98Å; F142-I191 HydrophobicContact CG-CG2 4.3Å
143	H	89.2	Confident	91.3	Very high	120 Å²	120	49 Å²	49	56%	0.556	23%	0.227	S	C	*	.	H	α-helix	trans	-70.3	-39.6	170.2	-175.4	-85.8	0	0	0	110.7	N140 I141 K146 S147	N140-H143 WeakPolarHBondContact O-CA 3.29Å; N140-H143 VanDerWaalsContact O-CB 3.26Å; N140-H143 WeakPolarHBondContact O-CB 3.44Å; N140-H143 PolarHBondContact O-N 2.87Å; N140-H143 WeakPolarHBondContact OD1-CB 2.98Å; I141-H143 VanDerWaalsContact C-N 3.3Å; I141-H143 PolarHBondContact O-N 3.17Å; H143-K146 WeakPolarHBondContact O-CB 3.34Å; H143-K146 PolarHBondContact O-N 3.44Å; H143-S147 PolarHBondContact O-N 3.44Å
144	E	90.6	Very high	90.8	Very high	20 Å²	20	55.8 Å²	55.8	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-47.3	173.3	-62.2	-177.2	142.6	0	0	111.2	I115 T117 L120 N140 I141 K146 S147 V148	I115-E144 VanDerWaalsContact O-OE2 3.09Å; T117-E144 HydrophobicContact CG2-CB 3.74Å; T117-E144 HydrophobicContact CG2-CG 3.89Å; L120-E144 HydrophobicContact CD1-CB 4.03Å; N140-E144 PolarHBondContact O-N 3.17Å; N140-E144 VanDerWaalsContact O-N 3.17Å; I141-E144 VanDerWaalsContact CD1-OE2 3.25Å; I141-E144 WeakPolarHBondContact CD1-OE2 3.5Å; I141-E144 WeakPolarHBondContact O-CB 3.42Å; I141-E144 PolarHBondContact O-N 3.2Å; I141-E144 VanDerWaalsContact O-N 3.17Å; E144-K146 VanDerWaalsContact C-N 3.31Å; E144-K146 PolarHBondContact O-N 3.4Å; E144-S147 WeakPolarHBondContact O-CA 3.28Å; E144-S147 WeakPolarHBondContact O-CB 3.36Å; E144-S147 PolarHBondContact O-N 2.91Å; E144-S147 PolarHBondContact O-OG 3.21Å; E144-V148 WeakPolarHBondContact O-CG2 3.43Å; E144-V148 PolarHBondContact O-N 3.41Å
145	L	92.3	Very high	89.9	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.052	25%	0.254	C	S	.	.	H	α-helix	trans	-58.9	-42.2	174.2	-65.3	176.7	0	0	0	111.9	L120 I141 F142 S147 V148 Y149 W169 I170 I191	L120-L145 HydrophobicContact CD1-CD2 4.15Å; L120-L145 HydrophobicContact CD2-CD2 4.41Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.45Å; I141-L145 PolarHBondContact O-N 3.16Å; F142-L145 HydrophobicContact CD1-CD1 4.02Å; F142-L145 HydrophobicContact CE1-CD1 4.41Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 3.49Å; L145-V148 PolarHBondContact O-N 2.99Å; L145-Y149 PolarHBondContact O-N 3.34Å; L145-W169 HydrophobicContact CD2-CH2 3.29Å; L145-W169 HydrophobicContact CD2-CZ2 3.51Å; L145-W169 HydrophobicContact CD2-CZ3 4.39Å; L145-I170 HydrophobicContact CB-CD1 4.15Å; L145-I170 HydrophobicContact CD2-CD1 4.33Å; L145-I170 WeakPolarHBondContact O-CD1 3.46Å; L145-I191 HydrophobicContact CB-CD1 4Å; L145-I191 HydrophobicContact CB-CG1 4.35Å
146	K	90.9	Very high	88.4	Confident	62 Å²	62	60 Å²	60	27%	0.27	28%	0.277	S	S	.	.	H	α-helix	trans	-58.8	-44	173.1	177.6	-179.6	177.7	-177.9	0	111.4	F142 H143 E144 V148 Y149 L150 I191 Y194	F142-K146 VanDerWaalsContact O-CB 3.32Å; F142-K146 WeakPolarHBondContact O-CB 3.46Å; F142-K146 PolarHBondContact O-N 2.97Å; H143-K146 WeakPolarHBondContact O-CB 3.34Å; H143-K146 PolarHBondContact O-N 3.44Å; E144-K146 VanDerWaalsContact C-N 3.31Å; E144-K146 PolarHBondContact O-N 3.4Å; K146-V148 VanDerWaalsContact C-N 3.32Å; K146-V148 PolarHBondContact O-N 3.29Å; K146-Y149 PolarHBondContact O-N 3.32Å; K146-L150 HydrophobicContact CG-CD1 4.03Å; K146-L150 HydrophobicContact CG-CG 4.43Å; K146-L150 WeakPolarHBondContact O-CB 3.49Å; K146-L150 VanDerWaalsContact O-CG 3.3Å; K146-L150 WeakPolarHBondContact O-CG 3.44Å; K146-L150 PolarHBondContact O-N 2.78Å; K146-I191 HydrophobicContact CB-CD1 4.18Å; K146-Y194 HydrophobicContact CG-CE2 4.36Å
147	S	90.7	Very high	86.7	Confident	43 Å²	43	63.6 Å²	63.6	30%	0.301	29%	0.293	S	S	.	.	H	α-helix	trans	-61.9	-40.2	178.6	78.4	0	0	0	0	112.1	H143 E144 L145 L150 W151	H143-S147 PolarHBondContact O-N 3.44Å; E144-S147 WeakPolarHBondContact O-CA 3.28Å; E144-S147 WeakPolarHBondContact O-CB 3.36Å; E144-S147 PolarHBondContact O-N 2.91Å; E144-S147 PolarHBondContact O-OG 3.21Å; L145-S147 VanDerWaalsContact C-N 3.31Å; L145-S147 PolarHBondContact O-N 3.49Å; S147-L150 PolarHBondContact O-N 3.36Å; S147-W151 WeakPolarHBondContact O-CB 3.39Å; S147-W151 PolarHBondContact O-N 2.95Å
148	V	90.7	Very high	84.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-49.6	175.9	171.7	0	0	0	0	110.5	L120 L121 E144 L145 K146 L150 W151 Y152 I170	L120-V148 HydrophobicContact CB-CG2 3.67Å; L120-V148 HydrophobicContact CD1-CG2 4.26Å; L121-V148 HydrophobicContact CD2-CG1 4.1Å; L121-V148 HydrophobicContact CD2-CG2 4.44Å; L121-V148 HydrophobicContact CG-CG2 4.32Å; E144-V148 WeakPolarHBondContact O-CG2 3.43Å; E144-V148 PolarHBondContact O-N 3.41Å; L145-V148 PolarHBondContact O-N 2.99Å; K146-V148 VanDerWaalsContact C-N 3.32Å; K146-V148 PolarHBondContact O-N 3.29Å; V148-L150 PolarHBondContact O-N 3.3Å; V148-W151 WeakPolarHBondContact O-CB 2.92Å; V148-W151 PolarHBondContact O-N 3.13Å; V148-Y152 HydrophobicContact CG1-CD2 3.95Å; V148-Y152 HydrophobicContact CG1-CE2 3.82Å; V148-Y152 WeakPolarHBondContact O-CD2 3.32Å; V148-Y152 PolarHBondContact O-N 3.17Å; V148-I170 HydrophobicContact CB-CD1 3.94Å; V148-I170 HydrophobicContact CG1-CD1 3.83Å
149	Y	90.5	Very high	82.9	Confident	32 Å²	32	68 Å²	68	13%	0.125	32%	0.32	C	S	.	.	H	α-helix	trans	-58.1	-46.5	177.5	177.5	-98	0	0	0	112.2	L145 K146 W151 Y152 K153 Q171 Y194	L145-Y149 PolarHBondContact O-N 3.34Å; K146-Y149 PolarHBondContact O-N 3.32Å; Y149-W151 VanDerWaalsContact C-N 3.29Å; Y149-W151 PolarHBondContact O-N 2.81Å; Y149-Y152 PolarHBondContact O-N 2.8Å; Y149-K153 HydrophobicContact CE1-CD 4.21Å; Y149-K153 WeakPolarHBondContact O-CB 3.21Å; Y149-K153 PolarHBondContact O-N 3.06Å; Y149-Q171 HydrophobicContact CD2-CG 4.38Å; Y149-Q171 HydrophobicContact CE2-CG 3.89Å; Y149-Y194 AromaticContact CD1-CD1 3.94Å; Y149-Y194 HydrophobicContact CD1-CD1 3.94Å; Y149-Y194 AromaticContact CD1-CD2 3.51Å; Y149-Y194 HydrophobicContact CD1-CD2 3.51Å; Y149-Y194 HydrophobicContact CD1-CE1 4.15Å; Y149-Y194 AromaticContact CD1-CE2 3.75Å; Y149-Y194 HydrophobicContact CD1-CE2 3.75Å; Y149-Y194 AromaticContact CD1-CG 3.63Å; Y149-Y194 HydrophobicContact CD1-CG 3.63Å; Y149-Y194 HydrophobicContact CD2-CG 4.32Å; Y149-Y194 AromaticContact CE1-CD1 3.47Å; Y149-Y194 HydrophobicContact CE1-CD1 3.47Å; Y149-Y194 VanDerWaalsContact CE1-CD1 3.47Å; Y149-Y194 AromaticContact CE1-CD2 3.95Å; Y149-Y194 HydrophobicContact CE1-CD2 3.95Å; Y149-Y194 AromaticContact CE1-CE1 3.64Å; Y149-Y194 HydrophobicContact CE1-CE1 3.64Å; Y149-Y194 HydrophobicContact CE1-CE2 4.11Å; Y149-Y194 AromaticContact CE1-CG 3.65Å; Y149-Y194 HydrophobicContact CE1-CG 3.65Å; Y149-Y194 AromaticContact CE1-CZ 3.97Å; Y149-Y194 HydrophobicContact CE2-CG 4.36Å; Y149-Y194 AromaticContact CG-CD2 3.93Å; Y149-Y194 HydrophobicContact CG-CD2 3.93Å; Y149-Y194 AromaticContact CG-CG 3.98Å; Y149-Y194 HydrophobicContact CG-CG 3.98Å; Y149-Y194 AromaticContact CZ-CD1 3.81Å
150	L	89.4	Confident	80.8	Confident	76 Å²	76	74.5 Å²	74.5	40%	0.398	36%	0.355	S	S	.	.	H	α-helix	trans	-64.9	-34.1	179.1	-69.9	176.4	0	0	0	112.2	K146 S147 V148 K153 K154	K146-L150 HydrophobicContact CG-CD1 4.03Å; K146-L150 HydrophobicContact CG-CG 4.43Å; K146-L150 WeakPolarHBondContact O-CB 3.49Å; K146-L150 VanDerWaalsContact O-CG 3.3Å; K146-L150 WeakPolarHBondContact O-CG 3.44Å; K146-L150 PolarHBondContact O-N 2.78Å; S147-L150 PolarHBondContact O-N 3.36Å; V148-L150 PolarHBondContact O-N 3.3Å; L150-K153 PolarHBondContact O-N 3.44Å; L150-K154 WeakPolarHBondContact O-CB 3.47Å; L150-K154 PolarHBondContact O-N 2.98Å
151	W	87.8	Confident	78.6	Confident	119 Å²	119	75.1 Å²	75.1	45%	0.451	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-51.4	173.5	-176.1	93.5	0	0	0	111.3	L121 S147 V148 Y149 K153 K154 Q155	L121-W151 HydrophobicContact CD2-CB 4.16Å; L121-W151 HydrophobicContact CD2-CD2 3.57Å; L121-W151 HydrophobicContact CD2-CE3 3.36Å; L121-W151 HydrophobicContact CD2-CG 3.93Å; L121-W151 HydrophobicContact CD2-CZ3 3.96Å; S147-W151 WeakPolarHBondContact O-CB 3.39Å; S147-W151 PolarHBondContact O-N 2.95Å; V148-W151 WeakPolarHBondContact O-CB 2.92Å; V148-W151 PolarHBondContact O-N 3.13Å; Y149-W151 VanDerWaalsContact C-N 3.29Å; Y149-W151 PolarHBondContact O-N 2.81Å; W151-K153 VanDerWaalsContact C-N 3.31Å; W151-K153 PolarHBondContact O-N 3.29Å; W151-K154 WeakPolarHBondContact O-CB 3.29Å; W151-K154 PolarHBondContact O-N 3.21Å; W151-K154 VanDerWaalsContact O-N 3.08Å; W151-Q155 HydrophobicContact CD2-CG 4.16Å; W151-Q155 HydrophobicContact CE3-CG 4.04Å; W151-Q155 HydrophobicContact CH2-CG 3.87Å; W151-Q155 HydrophobicContact CZ2-CG 3.98Å; W151-Q155 HydrophobicContact CZ3-CG 3.9Å; W151-Q155 WeakPolarHBondContact O-CG 3.42Å; W151-Q155 PolarHBondContact O-N 3.25Å; W151-Q155 VanDerWaalsContact O-N 3.07Å
152	Y	84.9	Confident	76.3	Confident	29 Å²	29	82 Å²	82	11%	0.114	40%	0.398	C	S	.	.	H	α-helix	trans	-59	-42.5	176.2	-83.6	-78.9	0	0	0	112.1	L121 V148 Y149 K154 Q155 K156 V166 C168	L121-Y152 HydrophobicContact CD2-CD2 4.49Å; L121-Y152 HydrophobicContact CD2-CE2 4.17Å; L121-Y152 PolarHBondContact O-OH 2.87Å; L121-Y152 VanDerWaalsContact O-OH 3.14Å; V148-Y152 HydrophobicContact CG1-CD2 3.95Å; V148-Y152 HydrophobicContact CG1-CE2 3.82Å; V148-Y152 WeakPolarHBondContact O-CD2 3.32Å; V148-Y152 PolarHBondContact O-N 3.17Å; Y149-Y152 PolarHBondContact O-N 2.8Å; Y152-K154 VanDerWaalsContact C-N 3.28Å; Y152-K154 PolarHBondContact O-N 3.08Å; Y152-Q155 PolarHBondContact O-N 3.29Å; Y152-K156 PolarHBondContact O-N 3.3Å; Y152-V166 HydrophobicContact CD1-CG1 3.93Å; Y152-V166 HydrophobicContact CE1-CG1 4.36Å; Y152-C168 HydrophobicContact CD1-CB 3.89Å; Y152-C168 HydrophobicContact CD2-CB 3.32Å; Y152-C168 HydrophobicContact CE1-CB 4.28Å; Y152-C168 HydrophobicContact CE2-CB 3.77Å; Y152-C168 HydrophobicContact CG-CB 3.39Å
153	K	84.3	Confident	73.9	Confident	106 Å²	106	92.3 Å²	92.3	46%	0.461	44%	0.443	S	S	.	.	H	α-helix	trans	-61.4	-36.3	176.6	-173.5	177.7	178.4	-179.7	0	112.2	Y149 L150 W151 K156 H157	Y149-K153 HydrophobicContact CE1-CD 4.21Å; Y149-K153 WeakPolarHBondContact O-CB 3.21Å; Y149-K153 PolarHBondContact O-N 3.06Å; L150-K153 PolarHBondContact O-N 3.44Å; W151-K153 VanDerWaalsContact C-N 3.31Å; W151-K153 PolarHBondContact O-N 3.29Å; K153-K156 WeakPolarHBondContact O-CB 3.31Å; K153-K156 PolarHBondContact O-N 3.42Å; K153-H157 PolarHBondContact O-CD2 3.11Å
154	K	84.8	Confident	71.8	Confident	149 Å²	149	94.3 Å²	94.3	65%	0.648	45%	0.452	S	S	*	.	H	α-helix	trans	-69.2	-38.9	176.6	-169.9	178.6	178.4	-176.4	0	111.7	L150 W151 Y152 K156 H157	L150-K154 WeakPolarHBondContact O-CB 3.47Å; L150-K154 PolarHBondContact O-N 2.98Å; W151-K154 WeakPolarHBondContact O-CB 3.29Å; W151-K154 PolarHBondContact O-N 3.21Å; W151-K154 VanDerWaalsContact O-N 3.08Å; Y152-K154 VanDerWaalsContact C-N 3.28Å; Y152-K154 PolarHBondContact O-N 3.08Å; K154-K156 VanDerWaalsContact C-N 3.26Å; K154-K156 PolarHBondContact O-N 3.3Å; K154-H157 PolarHBondContact O-N 3.28Å; K154-H157 VanDerWaalsContact O-N 3.08Å
155	Q	76.2	Confident	69.9	Low	59 Å²	59	99.2 Å²	99.2	28%	0.276	48%	0.479	S	S	.	.	H	α-helix	trans	-62.3	-33.8	176.6	-62	-56.5	-20.6	0	0	112.4	W151 Y152 H157 T158 E159	W151-Q155 HydrophobicContact CD2-CG 4.16Å; W151-Q155 HydrophobicContact CE3-CG 4.04Å; W151-Q155 HydrophobicContact CH2-CG 3.87Å; W151-Q155 HydrophobicContact CZ2-CG 3.98Å; W151-Q155 HydrophobicContact CZ3-CG 3.9Å; W151-Q155 WeakPolarHBondContact O-CG 3.42Å; W151-Q155 PolarHBondContact O-N 3.25Å; W151-Q155 VanDerWaalsContact O-N 3.07Å; Y152-Q155 PolarHBondContact O-N 3.29Å; Q155-H157 PolarHBondContact O-N 2.84Å; Q155-H157 VanDerWaalsContact O-N 3.08Å; Q155-T158 WeakPolarHBondContact CA-OG1 3.1Å; Q155-T158 PolarHBondContact O-N 2.96Å; Q155-T158 VanDerWaalsContact O-N 3.09Å; Q155-T158 PolarHBondContact O-OG1 3.42Å; Q155-T158 PolarHBondContact OE1-OG1 2.78Å; Q155-E159 PolarHBondContact O-N 3.27Å
156	K	64.4	Low	68	Low	112 Å²	112	101.7 Å²	101.7	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-56.8	-24.2	173.6	-165.1	172.7	-173.5	165.5	0	113.7	Y152 K153 K154 D165	Y152-K156 PolarHBondContact O-N 3.3Å; K153-K156 WeakPolarHBondContact O-CB 3.31Å; K153-K156 PolarHBondContact O-N 3.42Å; K154-K156 VanDerWaalsContact C-N 3.26Å; K154-K156 PolarHBondContact O-N 3.3Å; K156-D165 IonicContact NZ-OD1 2.73Å; K156-D165 PolarHBondContact NZ-OD1 3.26Å
157	H	58.2	Low	66.8	Low	150 Å²	150	101 Å²	101	69%	0.694	50%	0.497	S	S	*	.	H	α-helix	trans	-93.6	-16.5	179.6	-73	-69.5	0	0	0	114.1	K153 K154 Q155	K153-H157 PolarHBondContact O-CD2 3.11Å; K154-H157 PolarHBondContact O-N 3.28Å; K154-H157 VanDerWaalsContact O-N 3.08Å; Q155-H157 PolarHBondContact O-N 2.84Å; Q155-H157 VanDerWaalsContact O-N 3.08Å
158	T	57.8	Low	66.5	Low	90 Å²	90	99 Å²	99	55%	0.552	48%	0.483	S	S	*	.	H	α-helix	trans	-93.5	-28	-177.2	45.5	0	0	0	0	113	Q155 N160	Q155-T158 WeakPolarHBondContact CA-OG1 3.1Å; Q155-T158 PolarHBondContact O-N 2.96Å; Q155-T158 VanDerWaalsContact O-N 3.09Å; Q155-T158 PolarHBondContact O-OG1 3.42Å; Q155-T158 PolarHBondContact OE1-OG1 2.78Å; T158-N160 PolarHBondContact O-N 3.35Å
159	E	51.7	Low	66.5	Low	118 Å²	118	99.1 Å²	99.1	55%	0.551	48%	0.483	S	S	*	.			trans	-90.3	96.4	178.4	-71.5	179	171.9	0	0	110.7	Q155 T161	Q155-E159 PolarHBondContact O-N 3.27Å; E159-T161 PolarHBondContact O-N 3.12Å
160	N	48.3	Very low	66.6	Low	172 Å²	172	97.6 Å²	97.6	92%	0.92	48%	0.478	S	S	*	.			trans	-69.5	13.3	170.7	-101.1	-11.2	0	0	0	113.5	T158	T158-N160 PolarHBondContact O-N 3.35Å
161	T	44.6	Very low	66.6	Low	99 Å²	99	96.4 Å²	96.4	61%	0.607	47%	0.47	S	S	*	.	S	Bend	trans	-112.9	105.3	-174.4	41.8	0	0	0	0	111.1	E159	E159-T161 PolarHBondContact O-N 3.12Å
162	I	43.2	Very low	66.5	Low	153 Å²	153	92.3 Å²	92.3	79%	0.785	46%	0.458	S	S	*	.			trans	66.7	120.5	157.4	-52	173.1	0	0	0	115.2	Q164	I162-Q164 PolarHBondContact O-N 3.18Å
163	K	42.2	Very low	66.9	Low	218 Å²	218	91 Å²	91	95%	0.948	45%	0.453	S	S	*	.			trans	-59.8	52.9	179	-64.7	174.2	172.1	173.6	0	115
164	Q	43.8	Very low	67.4	Low	162 Å²	162	88.7 Å²	88.7	76%	0.757	44%	0.444	S	S	*	.			trans	-87.4	110.8	158	-76.7	-179.6	-14	0	0	106.5	I162 V166	I162-Q164 PolarHBondContact O-N 3.18Å; Q164-V166 PolarHBondContact O-N 3.48Å
165	D	51	Low	67.9	Low	124 Å²	124	82.7 Å²	82.7	66%	0.663	42%	0.418	S	S	*	.			trans	-55.5	101.6	171.1	-85.7	-43.8	0	0	0	108.1	K156 C167	K156-D165 IonicContact NZ-OD1 2.73Å; K156-D165 PolarHBondContact NZ-OD1 3.26Å; D165-C167 PolarHBondContact O-N 3.48Å
166	V	53.2	Low	68.9	Low	61 Å²	61	80.1 Å²	80.1	37%	0.37	41%	0.406	S	S	.	.			trans	-66.9	83.8	171.6	-174.1	0	0	0	0	107	Y152 Q164 C168	Y152-V166 HydrophobicContact CD1-CG1 3.93Å; Y152-V166 HydrophobicContact CE1-CG1 4.36Å; Q164-V166 PolarHBondContact O-N 3.48Å; V166-C168 PolarHBondContact O-N 2.96Å
167	C	65.8	Low	70.4	Confident	48 Å²	48	77.3 Å²	77.3	32%	0.324	39%	0.393	S	S	.	.			trans	-79.3	112.6	178.4	-159.8	0	0	0	0	107.1	T125 D165	T125-C167 WeakPolarHBondContact CB-O 3.44Å; T125-C167 WeakPolarHBondContact CG2-O 3.33Å; D165-C167 PolarHBondContact O-N 3.48Å
168	C	84.8	Confident	72.2	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.014	36%	0.36	C	S	.	.			trans	-75.9	154.6	175.4	79.2	0	0	0	0	110.2	Y152 V166 I170 Q171	Y152-C168 HydrophobicContact CD1-CB 3.89Å; Y152-C168 HydrophobicContact CD2-CB 3.32Å; Y152-C168 HydrophobicContact CE1-CB 4.28Å; Y152-C168 HydrophobicContact CE2-CB 3.77Å; Y152-C168 HydrophobicContact CG-CB 3.39Å; V166-C168 PolarHBondContact O-N 2.96Å; C168-I170 PolarHBondContact O-N 3.45Å; C168-Q171 PolarHBondContact O-N 3.42Å
169	W	90.1	Very high	74.1	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-25.6	-177.6	70.7	-98.7	0	0	0	114.6	L120 F123 S124 L127 L130 L145 Q171 T172 I173	L120-W169 HydrophobicContact CB-CZ2 4.34Å; L120-W169 HydrophobicContact CD2-CH2 4.43Å; L120-W169 HydrophobicContact CD2-CZ2 4.01Å; L120-W169 PolarHBondContact O-NE1 2.86Å; F123-W169 HydrophobicContact CB-CD2 4.26Å; F123-W169 HydrophobicContact CB-CG 3.95Å; F123-W169 HydrophobicContact CD2-CD2 4.18Å; F123-W169 AromaticContact CD2-CE2 3.73Å; F123-W169 HydrophobicContact CD2-CH2 4.12Å; F123-W169 AromaticContact CD2-CZ2 3.72Å; F123-W169 HydrophobicContact CD2-CZ2 3.72Å; F123-W169 HydrophobicContact CE2-CH2 4.43Å; F123-W169 HydrophobicContact CE2-CZ2 4.26Å; S124-W169 WeakPolarHBondContact O-CB 3.15Å; L127-W169 HydrophobicContact CB-CB 4.06Å; L127-W169 HydrophobicContact CD2-CD2 4.13Å; L127-W169 HydrophobicContact CD2-CE3 3.74Å; L127-W169 HydrophobicContact CD2-CZ3 4.15Å; L130-W169 HydrophobicContact CD2-CH2 3.84Å; L130-W169 HydrophobicContact CD2-CZ3 4Å; L145-W169 HydrophobicContact CD2-CH2 3.29Å; L145-W169 HydrophobicContact CD2-CZ2 3.51Å; L145-W169 HydrophobicContact CD2-CZ3 4.39Å; W169-Q171 PolarHBondContact O-N 3.47Å; W169-T172 VanDerWaalsContact CA-OG1 3.3Å; W169-T172 WeakPolarHBondContact CA-OG1 3.47Å; W169-T172 CarbonylContact O-C 3.52Å; W169-T172 PolarHBondContact O-N 3.37Å; W169-T172 VanDerWaalsContact O-N 3.08Å; W169-T172 PolarHBondContact O-OG1 3.12Å; W169-T172 VanDerWaalsContact O-OG1 3.06Å; W169-I173 HydrophobicContact CE3-CB 4.3Å; W169-I173 HydrophobicContact CE3-CD1 4.08Å; W169-I173 HydrophobicContact CZ3-CD1 4.06Å; W169-I173 HydrophobicContact CZ3-CG1 4.39Å; W169-I173 WeakPolarHBondContact O-CB 3.46Å; W169-I173 PolarHBondContact O-N 3.36Å
170	I	91.8	Very high	76.2	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-27.5	176.7	-63.3	171.6	0	0	0	111.7	L145 V148 C168 I173 I191 M195	L145-I170 HydrophobicContact CB-CD1 4.15Å; L145-I170 HydrophobicContact CD2-CD1 4.33Å; L145-I170 WeakPolarHBondContact O-CD1 3.46Å; V148-I170 HydrophobicContact CB-CD1 3.94Å; V148-I170 HydrophobicContact CG1-CD1 3.83Å; C168-I170 PolarHBondContact O-N 3.45Å; I170-I173 WeakPolarHBondContact O-CG2 3.42Å; I170-I191 HydrophobicContact CG2-CD1 4.48Å; I170-M195 HydrophobicContact CG2-CG 3.67Å; I170-M195 WeakPolarHBondContact O-CA 3.36Å
171	Q	89.2	Confident	78.5	Confident	50 Å²	50	56 Å²	56	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-85.1	-25.2	176.5	-62.2	-172.5	-63.9	0	0	112.4	Y149 C168 W169 I196 G197	Y149-Q171 HydrophobicContact CD2-CG 4.38Å; Y149-Q171 HydrophobicContact CE2-CG 3.89Å; C168-Q171 PolarHBondContact O-N 3.42Å; W169-Q171 PolarHBondContact O-N 3.47Å; Q171-I196 HydrophobicContact CB-CG1 4.27Å; Q171-G197 WeakPolarHBondContact O-CA 3.09Å; Q171-G197 PolarHBondContact O-N 3.05Å
172	T	86.9	Confident	80.9	Confident	34 Å²	34	55.7 Å²	55.7	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-96.6	-12	-178.4	63	0	0	0	0	113.7	T125 L127 W169 H174	T125-T172 WeakPolarHBondContact O-CG2 3.26Å; T125-T172 PolarHBondContact O-OG1 3.06Å; T125-T172 VanDerWaalsContact O-OG1 3.07Å; L127-T172 PolarHBondContact O-OG1 3.41Å; L127-T172 VanDerWaalsContact O-OG1 3.11Å; W169-T172 VanDerWaalsContact CA-OG1 3.3Å; W169-T172 WeakPolarHBondContact CA-OG1 3.47Å; W169-T172 CarbonylContact O-C 3.52Å; W169-T172 PolarHBondContact O-N 3.37Å; W169-T172 VanDerWaalsContact O-N 3.08Å; W169-T172 PolarHBondContact O-OG1 3.12Å; W169-T172 VanDerWaalsContact O-OG1 3.06Å; T172-H174 PolarHBondContact O-CE1 2.79Å; T172-H174 VanDerWaalsContact O-CE1 3.28Å; T172-H174 PolarHBondContact O-N 3.01Å; T172-H174 PolarHBondContact O-ND1 2.84Å
173	I	93.3	Very high	83.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.236	C	C	.	.			trans	-60	128.8	178.8	-162.5	77.9	0	0	0	109.9	L127 L130 W169 I170 I176 M195 G197 L198	L127-I173 HydrophobicContact CD2-CD1 3.99Å; L127-I173 HydrophobicContact CG-CD1 4.14Å; L130-I173 HydrophobicContact CB-CD1 3.89Å; W169-I173 HydrophobicContact CE3-CB 4.3Å; W169-I173 HydrophobicContact CE3-CD1 4.08Å; W169-I173 HydrophobicContact CZ3-CD1 4.06Å; W169-I173 HydrophobicContact CZ3-CG1 4.39Å; W169-I173 WeakPolarHBondContact O-CB 3.46Å; W169-I173 PolarHBondContact O-N 3.36Å; I170-I173 WeakPolarHBondContact O-CG2 3.42Å; I173-I176 HydrophobicContact CD1-CG1 4.45Å; I173-I176 HydrophobicContact CG1-CD1 4.04Å; I173-I176 HydrophobicContact CG1-CG1 3.64Å; I173-I176 HydrophobicContact CG2-CD1 4.14Å; I173-M195 HydrophobicContact CG2-CG 4.47Å; I173-G197 CarbonylContact O-C 3.58Å; I173-L198 HydrophobicContact CG2-CD1 4.11Å; I173-L198 VanDerWaalsContact O-CA 3.29Å; I173-L198 WeakPolarHBondContact O-CA 3.38Å; I173-L198 PolarHBondContact O-N 2.85Å
174	H	94.3	Very high	85.7	Confident	57 Å²	57	43.4 Å²	43.4	26%	0.264	22%	0.216	S	C	.	.			trans	-104.6	-35.4	179.7	-74.1	76.8	0	0	0	111.4	F128 T172 R199 R200	F128-H174 HydrophobicContact CB-CB 4.23Å; F128-H174 CarbonylContact O-C 3.51Å; F128-H174 WeakPolarHBondContact O-CA 3.32Å; F128-H174 WeakPolarHBondContact O-CB 3.24Å; F128-H174 PolarHBondContact O-N 3.45Å; T172-H174 PolarHBondContact O-CE1 2.79Å; T172-H174 VanDerWaalsContact O-CE1 3.28Å; T172-H174 PolarHBondContact O-N 3.01Å; T172-H174 PolarHBondContact O-ND1 2.84Å; H174-R199 PolarHBondContact CD2-NE 3.13Å; H174-R199 VanDerWaalsContact CD2-NE 3.28Å; H174-R199 PolarHBondContact NE2-NH2 2.98Å; H174-R199 PolarHBondContact O-N 2.84Å; H174-R200 PolarHBondContact O-N 3.29Å
175	E	95.9	Very high	87.8	Confident	23 Å²	23	40.8 Å²	40.8	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.6	-175.2	-49	-171.2	167.9	0	0	111.3	F128 S129 L130 Y177 R200	F128-E175 PolarHBondContact O-N 2.98Å; S129-E175 WeakPolarHBondContact CA-O 3.35Å; L130-E175 PolarHBondContact N-O 3.15Å; E175-Y177 HydrophobicContact CB-CE2 3.83Å; E175-Y177 WeakPolarHBondContact OE2-CE2 3.23Å; E175-Y177 PolarHBondContact OE2-OH 3.23Å; E175-R200 WeakPolarHBondContact CA-O 3.32Å; E175-R200 HydrophobicContact CB-CB 4.37Å; E175-R200 HydrophobicContact CG-CB 4.09Å; E175-R200 HydrophobicContact CG-CG 4.28Å; E175-R200 WeakPolarHBondContact OE1-CD 3.46Å; E175-R200 IonicContact OE1-CZ 2.83Å; E175-R200 IonicContact OE1-NE 2.66Å; E175-R200 IonicContact OE1-NH1 2.67Å; E175-R200 PolarHBondContact OE1-NH1 3.36Å
176	I	95.8	Very high	89.5	Confident	5 Å²	5	40 Å²	40	3%	0.026	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.8	171.6	-65.6	176.1	0	0	0	108.4	L130 I173 L178 M195 L198 R200 L201 Y202	L130-I176 WeakPolarHBondContact O-CA 3.32Å; I173-I176 HydrophobicContact CD1-CG1 4.45Å; I173-I176 HydrophobicContact CG1-CD1 4.04Å; I173-I176 HydrophobicContact CG1-CG1 3.64Å; I173-I176 HydrophobicContact CG2-CD1 4.14Å; I176-L178 HydrophobicContact CG2-CD1 3.57Å; I176-L178 HydrophobicContact CG2-CG 3.71Å; I176-M195 HydrophobicContact CD1-SD 3.86Å; I176-L198 HydrophobicContact CB-CD1 4.16Å; I176-L198 HydrophobicContact CD1-CD1 3.79Å; I176-L198 HydrophobicContact CD1-CD2 4.46Å; I176-L198 HydrophobicContact CG1-CD1 3.68Å; I176-R200 PolarHBondContact N-O 2.78Å; I176-L201 HydrophobicContact CB-CD1 4.19Å; I176-L201 HydrophobicContact CG2-CD1 4.27Å; I176-Y202 PolarHBondContact O-N 2.94Å
177	Y	97	Very high	91.1	Very high	54 Å²	54	37.5 Å²	37.5	21%	0.212	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.2	172.5	-52.6	-106.9	0	0	0	109.3	L130 N131 L132 S133 E175 Y202	L130-Y177 PolarHBondContact O-N 3.4Å; N131-Y177 HydrophobicContact CB-CD2 3.97Å; N131-Y177 HydrophobicContact CB-CG 4.26Å; N131-Y177 WeakPolarHBondContact OD1-CB 3.26Å; L132-Y177 CarbonylContact C-O 3.17Å; L132-Y177 WeakPolarHBondContact CA-O 3.34Å; L132-Y177 WeakPolarHBondContact CB-O 3.24Å; L132-Y177 PolarHBondContact N-O 2.8Å; S133-Y177 PolarHBondContact N-O 3.43Å; E175-Y177 HydrophobicContact CB-CE2 3.83Å; E175-Y177 WeakPolarHBondContact OE2-CE2 3.23Å; E175-Y177 PolarHBondContact OE2-OH 3.23Å; Y177-Y202 HydrophobicContact CD1-CD1 4.47Å; Y177-Y202 AromaticContact CD1-CD2 3.36Å; Y177-Y202 HydrophobicContact CD1-CD2 3.36Å; Y177-Y202 AromaticContact CD1-CE2 3.89Å; Y177-Y202 HydrophobicContact CD1-CE2 3.89Å; Y177-Y202 AromaticContact CD1-CG 3.71Å; Y177-Y202 HydrophobicContact CD1-CG 3.71Å; Y177-Y202 HydrophobicContact CD2-CD2 4.46Å; Y177-Y202 HydrophobicContact CE1-CD1 4.44Å; Y177-Y202 AromaticContact CE1-CD2 3.32Å; Y177-Y202 HydrophobicContact CE1-CD2 3.32Å; Y177-Y202 HydrophobicContact CE1-CE1 4.44Å; Y177-Y202 AromaticContact CE1-CE2 3.31Å; Y177-Y202 HydrophobicContact CE1-CE2 3.31Å; Y177-Y202 AromaticContact CE1-CG 3.93Å; Y177-Y202 HydrophobicContact CE1-CG 3.93Å; Y177-Y202 AromaticContact CE1-CZ 3.92Å; Y177-Y202 HydrophobicContact CE2-CD2 4.42Å; Y177-Y202 HydrophobicContact CE2-CE2 4.41Å; Y177-Y202 AromaticContact CG-CD2 3.95Å; Y177-Y202 HydrophobicContact CG-CD2 3.95Å; Y177-Y202 HydrophobicContact CG-CG 4.48Å; Y177-Y202 AromaticContact CZ-CD2 3.88Å; Y177-Y202 AromaticContact CZ-CE2 3.6Å
178	L	96.2	Very high	92	Very high	2 Å²	2	37 Å²	37	1%	0.01	18%	0.179	C	C	.	.			trans	-133	17.1	-179.8	-79.2	166.4	0	0	0	110.7	L132 I137 F142 I176 N181 L183 Y202 I203 N206	L132-L178 HydrophobicContact CB-CD2 3.99Å; L132-L178 HydrophobicContact CD1-CD2 3.92Å; I137-L178 HydrophobicContact CD1-CD2 4.37Å; I137-L178 HydrophobicContact CG2-CD2 4.33Å; F142-L178 HydrophobicContact CE1-CD1 4.17Å; F142-L178 HydrophobicContact CE2-CD1 4.36Å; F142-L178 HydrophobicContact CZ-CD1 3.55Å; I176-L178 HydrophobicContact CG2-CD1 3.57Å; I176-L178 HydrophobicContact CG2-CG 3.71Å; L178-N181 PolarHBondContact O-ND2 3.24Å; L178-N181 VanDerWaalsContact O-ND2 3.12Å; L178-L183 HydrophobicContact CB-CD1 3.9Å; L178-L183 HydrophobicContact CD1-CD1 4.25Å; L178-Y202 CarbonylContact C-O 3.24Å; L178-Y202 WeakPolarHBondContact CA-O 3.48Å; L178-Y202 PolarHBondContact N-O 2.82Å; L178-I203 HydrophobicContact CB-CG2 4.15Å; L178-N206 PolarHBondContact O-ND2 3.37Å
179	D	96.3	Very high	92	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.053	20%	0.201	C	C	.	.			trans	-64.7	154	175.6	55.1	-72	0	0	0	112.2	S133 Y134 N181 Y202 H204	S133-D179 CarbonylContact C-O 3.48Å; S133-D179 VanDerWaalsContact CA-O 3.23Å; S133-D179 WeakPolarHBondContact CA-O 3.43Å; S133-D179 VanDerWaalsContact CB-CG 3.5Å; S133-D179 VanDerWaalsContact CB-OD1 3.27Å; S133-D179 WeakPolarHBondContact CB-OD1 3.36Å; S133-D179 WeakPolarHBondContact CB-OD2 3.38Å; Y134-D179 PolarHBondContact N-O 3.33Å; D179-N181 PolarHBondContact O-N 3.11Å; D179-N181 PolarHBondContact O-ND2 3.25Å; D179-N181 VanDerWaalsContact O-ND2 3.15Å; D179-Y202 PolarHBondContact N-O 2.73Å; D179-H204 CarbonylContact C-O 3.43Å; D179-H204 WeakPolarHBondContact CA-O 3.42Å; D179-H204 VanDerWaalsContact CB-CD2 3.46Å; D179-H204 WeakPolarHBondContact CB-CD2 3.48Å; D179-H204 WeakPolarHBondContact CB-NE2 3.4Å; D179-H204 WeakPolarHBondContact CB-O 3.41Å; D179-H204 IonicContact OD2-CE1 2.77Å; D179-H204 IonicContact OD2-NE2 3.05Å
180	H	96.5	Very high	91.7	Very high	57 Å²	57	47 Å²	47	26%	0.264	22%	0.221	S	C	.	.	S	Bend	trans	54.9	51.4	-177.9	-67.3	-92.5	0	0	0	113.5	Y134 N135 H204 N205	Y134-H180 VanDerWaalsContact CA-O 3.32Å; Y134-H180 WeakPolarHBondContact CA-O 2.87Å; Y134-H180 HydrophobicContact CD1-CB 3.53Å; Y134-H180 AromaticContact CD1-CG 3.64Å; Y134-H180 HydrophobicContact CD2-CB 4.24Å; Y134-H180 HydrophobicContact CE1-CB 3.77Å; Y134-H180 AromaticContact CE1-CD2 3.39Å; Y134-H180 WeakPolarHBondContact CE1-CD2 3.23Å; Y134-H180 AromaticContact CE1-CE1 3.7Å; Y134-H180 AromaticContact CE1-CG 3.3Å; Y134-H180 AromaticContact CE1-ND1 3.52Å; Y134-H180 AromaticContact CE1-NE2 3.67Å; Y134-H180 HydrophobicContact CE2-CB 4.43Å; Y134-H180 AromaticContact CE2-CD2 3.71Å; Y134-H180 HydrophobicContact CG-CB 3.8Å; Y134-H180 AromaticContact CZ-CD2 3.17Å; Y134-H180 AromaticContact CZ-CE1 4Å; Y134-H180 AromaticContact CZ-CG 3.62Å; Y134-H180 AromaticContact CZ-NE2 3.48Å; Y134-H180 PolarHBondContact N-O 3.11Å; Y134-H180 PolarHBondContact OH-CD2 3.29Å; Y134-H180 VanDerWaalsContact OH-CD2 3.26Å; Y134-H180 PolarHBondContact OH-NE2 3.31Å; Y134-H180 VanDerWaalsContact OH-NE2 3.08Å; N135-H180 PolarHBondContact N-O 3.47Å; H180-H204 AromaticContact CD2-CE1 3.67Å; H180-H204 AromaticContact CD2-ND1 3.98Å; H180-H204 PolarHBondContact N-O 2.96Å; H180-H204 AromaticContact NE2-CE1 3.62Å; H180-H204 AromaticContact NE2-ND1 3.83Å; H180-N205 WeakPolarHBondContact CA-O 3.48Å; H180-N205 VanDerWaalsContact CE1-CG 3.43Å; H180-N205 PolarHBondContact CE1-ND2 2.87Å; H180-N205 PolarHBondContact N-O 2.91Å; H180-N205 PolarHBondContact NE2-ND2 3.12Å
181	N	96.7	Very high	91.6	Very high	14 Å²	14	47 Å²	47	8%	0.075	22%	0.222	C	C	.	.	S	Bend	trans	-125.3	-162.8	176.2	-84.9	-69.5	0	0	0	110.2	L132 N135 Q136 I137 L178 D179 L183 N206	L132-N181 PolarHBondContact O-ND2 2.96Å; N135-N181 VanDerWaalsContact CA-OD1 3.32Å; N135-N181 WeakPolarHBondContact CA-OD1 3.32Å; N135-N181 WeakPolarHBondContact CB-OD1 3.47Å; N135-N181 PolarHBondContact N-OD1 3.41Å; N135-N181 PolarHBondContact O-OD1 3.04Å; Q136-N181 PolarHBondContact N-OD1 3.49Å; I137-N181 HydrophobicContact CB-CB 4.34Å; I137-N181 VanDerWaalsContact CB-OD1 3.31Å; I137-N181 WeakPolarHBondContact CB-OD1 3.44Å; I137-N181 PolarHBondContact N-OD1 3.02Å; L178-N181 PolarHBondContact O-ND2 3.24Å; L178-N181 VanDerWaalsContact O-ND2 3.12Å; D179-N181 PolarHBondContact O-N 3.11Å; D179-N181 PolarHBondContact O-ND2 3.25Å; D179-N181 VanDerWaalsContact O-ND2 3.15Å; N181-L183 HydrophobicContact CB-CG 4.37Å; N181-N206 VanDerWaalsContact CA-OD1 3.3Å; N181-N206 WeakPolarHBondContact CA-OD1 3.36Å; N181-N206 WeakPolarHBondContact CB-OD1 3.27Å; N181-N206 PolarHBondContact N-OD1 3.43Å; N181-N206 PolarHBondContact O-OD1 3.19Å; N181-N206 VanDerWaalsContact O-OD1 3.05Å
182	K	94.4	Very high	91.5	Very high	92 Å²	92	44.7 Å²	44.7	40%	0.4	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-113.1	39.3	177.4	-66.7	179.6	178.6	159.7	0	111.6	I137 E138 E184 N206	I137-K182 CarbonylContact O-C 3.59Å; I137-K182 WeakPolarHBondContact O-CA 3.25Å; I137-K182 PolarHBondContact O-N 3.5Å; E138-K182 HydrophobicContact CG-CB 4.13Å; K182-E184 PolarHBondContact O-N 2.79Å; K182-N206 PolarHBondContact N-OD1 3.29Å
183	L	94.5	Very high	91.6	Very high	1 Å²	1	46 Å²	46	1%	0.005	22%	0.217	C	C	.	.			trans	-72.2	110.9	176.4	-56.3	-178	0	0	0	109.6	M139 F142 L178 N181 I203 N206 G207 I208	M139-L183 HydrophobicContact CE-CB 4.15Å; F142-L183 HydrophobicContact CE2-CD1 4.48Å; F142-L183 HydrophobicContact CE2-CD2 4.32Å; L178-L183 HydrophobicContact CB-CD1 3.9Å; L178-L183 HydrophobicContact CD1-CD1 4.25Å; N181-L183 HydrophobicContact CB-CG 4.37Å; L183-I203 HydrophobicContact CD1-CG2 4.15Å; L183-N206 HydrophobicContact CB-CB 4Å; L183-N206 WeakPolarHBondContact CB-OD1 3.47Å; L183-N206 WeakPolarHBondContact CG-OD1 3.13Å; L183-N206 PolarHBondContact N-OD1 2.95Å; L183-G207 CarbonylContact O-C 3.34Å; L183-G207 VanDerWaalsContact O-C 3.24Å; L183-G207 VanDerWaalsContact O-CA 3.22Å; L183-G207 WeakPolarHBondContact O-CA 3.38Å; L183-G207 PolarHBondContact O-N 2.65Å; L183-I208 HydrophobicContact CB-CD1 4.28Å; L183-I208 HydrophobicContact CB-CG1 4.12Å; L183-I208 PolarHBondContact O-N 3.5Å
184	E	91.6	Very high	91.4	Very high	112 Å²	112	48.5 Å²	48.5	52%	0.523	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	163.9	177.2	-60.3	-165.1	157.1	0	0	111.6	M139 K182	M139-E184 WeakPolarHBondContact CE-O 3.47Å; K182-E184 PolarHBondContact O-N 2.79Å
185	D	88.6	Confident	91.3	Very high	106 Å²	106	45.9 Å²	45.9	57%	0.567	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	67.4	-135.3	178.7	-63	-37.5	0	0	0	114.8	I208 T209	D185-I208 CarbonylContact O-C 3.39Å; D185-I208 WeakPolarHBondContact O-CA 3.28Å; D185-I208 WeakPolarHBondContact O-CG2 3.22Å; D185-T209 PolarHBondContact O-N 2.82Å; D185-T209 PolarHBondContact O-OG1 3.48Å
186	Q	86.3	Confident	91	Very high	109 Å²	109	48.8 Å²	48.8	51%	0.509	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	151.3	-171	66.4	-179	1.6	0	0	110.6
187	F	86.2	Confident	90.7	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.035	24%	0.235	C	C	.	.			trans	-65.4	133.1	176.3	-160.1	-89.9	0	0	0	110.7	F142 Y189 I191 M195 L201 K212 L214	F142-F187 HydrophobicContact CD1-CE2 4.25Å; F142-F187 HydrophobicContact CD1-CZ 4.04Å; F142-F187 HydrophobicContact CE1-CD2 4.48Å; F142-F187 AromaticContact CE1-CE2 3.47Å; F142-F187 HydrophobicContact CE1-CE2 3.47Å; F142-F187 VanDerWaalsContact CE1-CE2 3.47Å; F142-F187 AromaticContact CE1-CZ 3.53Å; F142-F187 HydrophobicContact CE1-CZ 3.53Å; F142-F187 HydrophobicContact CE2-CD2 4.29Å; F142-F187 AromaticContact CE2-CE2 3.97Å; F142-F187 HydrophobicContact CE2-CE2 3.97Å; F142-F187 HydrophobicContact CZ-CD2 4.05Å; F142-F187 AromaticContact CZ-CE2 3.3Å; F142-F187 HydrophobicContact CZ-CE2 3.3Å; F142-F187 AromaticContact CZ-CZ 3.89Å; F142-F187 HydrophobicContact CZ-CZ 3.89Å; F187-Y189 PolarHBondContact O-N 2.98Å; F187-I191 HydrophobicContact CD1-CG2 4.34Å; F187-I191 HydrophobicContact CE1-CG2 3.67Å; F187-I191 HydrophobicContact CZ-CG2 4.25Å; F187-M195 HydrophobicContact CE1-CE 3.77Å; F187-M195 HydrophobicContact CZ-CE 3.51Å; F187-L201 HydrophobicContact CE2-CD2 4.19Å; F187-K212 PolarHBondContact N-O 3.12Å; F187-L214 HydrophobicContact CB-CD2 3.75Å; F187-L214 HydrophobicContact CB-CG 4.26Å; F187-L214 HydrophobicContact CD1-CD2 3.67Å; F187-L214 HydrophobicContact CD2-CD2 3.66Å; F187-L214 HydrophobicContact CE1-CD2 4.1Å; F187-L214 HydrophobicContact CE2-CD2 4.08Å; F187-L214 HydrophobicContact CG-CD2 3.41Å; F187-L214 VanDerWaalsContact CG-CD2 3.41Å; F187-L214 HydrophobicContact CG-CG 4.4Å; F187-L214 HydrophobicContact CZ-CD2 4.28Å
188	P	85.8	Confident	90.6	Very high	36 Å²	36	46.7 Å²	46.7	23%	0.234	23%	0.226	C	C	.	.			trans	-64.8	131.6	-179.6	-20.2	32.1	0	0	0	111.8	F142 E190 I191	F142-P188 HydrophobicContact CB-CG 3.84Å; F142-P188 HydrophobicContact CD2-CG 4.41Å; F142-P188 HydrophobicContact CG-CG 4.3Å; P188-E190 VanDerWaalsContact C-N 3.34Å; P188-E190 PolarHBondContact O-N 3.04Å; P188-I191 HydrophobicContact CB-CG2 4.04Å; P188-I191 HydrophobicContact CG-CG2 4.42Å; P188-I191 WeakPolarHBondContact O-CG2 3.42Å
189	Y	84.9	Confident	90.6	Very high	124 Å²	124	51.7 Å²	51.7	49%	0.486	24%	0.244	S	C	.	.	H	α-helix	trans	-67.3	-34.6	-176.3	174.7	-87.9	0	0	0	112.6	F187 S192 N193 N215	F187-Y189 PolarHBondContact O-N 2.98Å; Y189-S192 PolarHBondContact O-OG 3.02Å; Y189-N193 VanDerWaalsContact CE1-ND2 3.27Å; Y189-N193 WeakPolarHBondContact CE1-ND2 3.27Å; Y189-N215 WeakPolarHBondContact CD2-OD1 3.45Å; Y189-N215 WeakPolarHBondContact CE2-ND2 3.26Å; Y189-N215 WeakPolarHBondContact CE2-OD1 2.92Å
190	E	83.8	Confident	90.7	Very high	91 Å²	91	55.9 Å²	55.9	43%	0.425	26%	0.259	S	S	.	.	H	α-helix	trans	-71.2	-40.6	-171.6	-58.9	84.4	168.9	0	0	112	P188 N193 Y194	P188-E190 VanDerWaalsContact C-N 3.34Å; P188-E190 PolarHBondContact O-N 3.04Å; E190-N193 PolarHBondContact O-N 3.25Å; E190-Y194 WeakPolarHBondContact O-CD2 3.44Å; E190-Y194 WeakPolarHBondContact O-CE2 3.49Å
191	I	88.9	Confident	90.7	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-72.2	-31.1	-176.8	-164.9	55.2	0	0	0	111.8	F142 L145 K146 I170 F187 P188 N193 Y194 M195	F142-I191 HydrophobicContact CB-CG2 4.13Å; F142-I191 HydrophobicContact CD1-CG1 4.37Å; F142-I191 HydrophobicContact CD1-CG2 3.98Å; F142-I191 HydrophobicContact CG-CG2 4.3Å; L145-I191 HydrophobicContact CB-CD1 4Å; L145-I191 HydrophobicContact CB-CG1 4.35Å; K146-I191 HydrophobicContact CB-CD1 4.18Å; I170-I191 HydrophobicContact CG2-CD1 4.48Å; F187-I191 HydrophobicContact CD1-CG2 4.34Å; F187-I191 HydrophobicContact CE1-CG2 3.67Å; F187-I191 HydrophobicContact CZ-CG2 4.25Å; P188-I191 HydrophobicContact CB-CG2 4.04Å; P188-I191 HydrophobicContact CG-CG2 4.42Å; P188-I191 WeakPolarHBondContact O-CG2 3.42Å; I191-N193 PolarHBondContact O-N 3.12Å; I191-Y194 HydrophobicContact CD1-CD2 3.88Å; I191-Y194 PolarHBondContact O-N 2.86Å; I191-M195 HydrophobicContact CB-CE 4.33Å; I191-M195 HydrophobicContact CG1-CE 3.81Å; I191-M195 HydrophobicContact CG1-SD 4.41Å; I191-M195 HydrophobicContact CG2-CE 3.89Å; I191-M195 PolarHBondContact O-N 3.25Å
192	S	88.5	Confident	90.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.3	-29.9	179.4	69.3	0	0	0	0	112.6	Y189 Y194 G213 G216	Y189-S192 PolarHBondContact O-OG 3.02Å; S192-Y194 PolarHBondContact O-N 3.01Å; S192-G213 WeakPolarHBondContact CB-O 3.13Å; S192-G213 PolarHBondContact OG-O 3.28Å; S192-G216 CarbonylContact O-C 3.55Å; S192-G216 VanDerWaalsContact O-C 3.24Å
193	N	88.1	Confident	90.8	Very high	63 Å²	63	50.3 Å²	50.3	34%	0.337	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.6	175	-66.3	-28.8	0	0	0	113.1	Y189 E190 I191 I196 G216	Y189-N193 VanDerWaalsContact CE1-ND2 3.27Å; Y189-N193 WeakPolarHBondContact CE1-ND2 3.27Å; E190-N193 PolarHBondContact O-N 3.25Å; I191-N193 PolarHBondContact O-N 3.12Å; N193-I196 WeakPolarHBondContact O-CG2 3.42Å; N193-G216 VanDerWaalsContact OD1-CA 3.25Å; N193-G216 WeakPolarHBondContact OD1-CA 3.43Å
194	Y	89.7	Confident	90.9	Very high	53 Å²	53	51 Å²	51	21%	0.208	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-31.2	178	-53.5	-31.8	0	0	0	112.1	K146 Y149 E190 I191 S192 I196	K146-Y194 HydrophobicContact CG-CE2 4.36Å; Y149-Y194 AromaticContact CD1-CD1 3.94Å; Y149-Y194 HydrophobicContact CD1-CD1 3.94Å; Y149-Y194 AromaticContact CD1-CD2 3.51Å; Y149-Y194 HydrophobicContact CD1-CD2 3.51Å; Y149-Y194 HydrophobicContact CD1-CE1 4.15Å; Y149-Y194 AromaticContact CD1-CE2 3.75Å; Y149-Y194 HydrophobicContact CD1-CE2 3.75Å; Y149-Y194 AromaticContact CD1-CG 3.63Å; Y149-Y194 HydrophobicContact CD1-CG 3.63Å; Y149-Y194 HydrophobicContact CD2-CG 4.32Å; Y149-Y194 AromaticContact CE1-CD1 3.47Å; Y149-Y194 HydrophobicContact CE1-CD1 3.47Å; Y149-Y194 VanDerWaalsContact CE1-CD1 3.47Å; Y149-Y194 AromaticContact CE1-CD2 3.95Å; Y149-Y194 HydrophobicContact CE1-CD2 3.95Å; Y149-Y194 AromaticContact CE1-CE1 3.64Å; Y149-Y194 HydrophobicContact CE1-CE1 3.64Å; Y149-Y194 HydrophobicContact CE1-CE2 4.11Å; Y149-Y194 AromaticContact CE1-CG 3.65Å; Y149-Y194 HydrophobicContact CE1-CG 3.65Å; Y149-Y194 AromaticContact CE1-CZ 3.97Å; Y149-Y194 HydrophobicContact CE2-CG 4.36Å; Y149-Y194 AromaticContact CG-CD2 3.93Å; Y149-Y194 HydrophobicContact CG-CD2 3.93Å; Y149-Y194 AromaticContact CG-CG 3.98Å; Y149-Y194 HydrophobicContact CG-CG 3.98Å; Y149-Y194 AromaticContact CZ-CD1 3.81Å; E190-Y194 WeakPolarHBondContact O-CD2 3.44Å; E190-Y194 WeakPolarHBondContact O-CE2 3.49Å; I191-Y194 HydrophobicContact CD1-CD2 3.88Å; I191-Y194 PolarHBondContact O-N 2.86Å; S192-Y194 PolarHBondContact O-N 3.01Å; Y194-I196 PolarHBondContact O-N 3.07Å
195	M	91.6	Very high	91.1	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	22%	0.224	C	C	.	.			trans	-80.6	55.1	178.1	-68.4	-179.9	-66.1	0	0	112.5	I170 I173 I176 F187 I191 G197 L198 L217	I170-M195 HydrophobicContact CG2-CG 3.67Å; I170-M195 WeakPolarHBondContact O-CA 3.36Å; I173-M195 HydrophobicContact CG2-CG 4.47Å; I176-M195 HydrophobicContact CD1-SD 3.86Å; F187-M195 HydrophobicContact CE1-CE 3.77Å; F187-M195 HydrophobicContact CZ-CE 3.51Å; I191-M195 HydrophobicContact CB-CE 4.33Å; I191-M195 HydrophobicContact CG1-CE 3.81Å; I191-M195 HydrophobicContact CG1-SD 4.41Å; I191-M195 HydrophobicContact CG2-CE 3.89Å; I191-M195 PolarHBondContact O-N 3.25Å; M195-G197 VanDerWaalsContact C-N 3.26Å; M195-G197 PolarHBondContact O-N 3.04Å; M195-L198 HydrophobicContact CB-CB 4.18Å; M195-L198 WeakPolarHBondContact O-CB 3.33Å; M195-L198 PolarHBondContact O-N 3.06Å; M195-L217 HydrophobicContact CB-CD2 3.87Å; M195-L217 HydrophobicContact CE-CD2 4.15Å
196	I	88.8	Confident	91.5	Very high	83 Å²	83	43.9 Å²	43.9	43%	0.426	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.3	-173.2	58.8	171.3	0	0	0	113.7	Q171 N193 Y194 Q219	Q171-I196 HydrophobicContact CB-CG1 4.27Å; N193-I196 WeakPolarHBondContact O-CG2 3.42Å; Y194-I196 PolarHBondContact O-N 3.07Å; I196-Q219 WeakPolarHBondContact O-CG 3.33Å
197	G	90.2	Very high	91.9	Very high	15 Å²	15	39.1 Å²	39.1	16%	0.155	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.7	178.3	0	0	0	0	0	114.8	Q171 I173 M195 R199	Q171-G197 WeakPolarHBondContact O-CA 3.09Å; Q171-G197 PolarHBondContact O-N 3.05Å; I173-G197 CarbonylContact O-C 3.58Å; M195-G197 VanDerWaalsContact C-N 3.26Å; M195-G197 PolarHBondContact O-N 3.04Å; G197-R199 WeakPolarHBondContact O-CG 3.31Å; G197-R199 PolarHBondContact O-N 2.81Å
198	L	95.1	Very high	92.3	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	18%	0.181	C	C	.	.			trans	-67.1	122.7	-168.5	-169.2	72.9	0	0	0	111.7	I173 I176 M195 L201 L217 Q219 L220	I173-L198 HydrophobicContact CG2-CD1 4.11Å; I173-L198 VanDerWaalsContact O-CA 3.29Å; I173-L198 WeakPolarHBondContact O-CA 3.38Å; I173-L198 PolarHBondContact O-N 2.85Å; I176-L198 HydrophobicContact CB-CD1 4.16Å; I176-L198 HydrophobicContact CD1-CD1 3.79Å; I176-L198 HydrophobicContact CD1-CD2 4.46Å; I176-L198 HydrophobicContact CG1-CD1 3.68Å; M195-L198 HydrophobicContact CB-CB 4.18Å; M195-L198 WeakPolarHBondContact O-CB 3.33Å; M195-L198 PolarHBondContact O-N 3.06Å; L198-L201 HydrophobicContact CD2-CB 4.25Å; L198-L201 HydrophobicContact CD2-CD1 4.39Å; L198-L217 HydrophobicContact CB-CD2 4.37Å; L198-L217 HydrophobicContact CD2-CD1 4.07Å; L198-L217 HydrophobicContact CD2-CD2 3.9Å; L198-Q219 CarbonylContact O-C 3.6Å; L198-Q219 VanDerWaalsContact O-C 3.24Å; L198-L220 HydrophobicContact CD2-CD1 4.41Å; L198-L220 HydrophobicContact CG-CD1 4.37Å; L198-L220 WeakPolarHBondContact O-CA 3.4Å; L198-L220 PolarHBondContact O-N 2.83Å
199	R	96.6	Very high	92.6	Very high	106 Å²	106	39.7 Å²	39.7	40%	0.4	19%	0.185	S	C	.	.			trans	-110.7	-33.1	-178.8	-56.3	-166.2	-169.1	174.1	9.1	113	H174 G197 Q221 V222	H174-R199 PolarHBondContact CD2-NE 3.13Å; H174-R199 VanDerWaalsContact CD2-NE 3.28Å; H174-R199 PolarHBondContact NE2-NH2 2.98Å; H174-R199 PolarHBondContact O-N 2.84Å; G197-R199 WeakPolarHBondContact O-CG 3.31Å; G197-R199 PolarHBondContact O-N 2.81Å; R199-Q221 PolarHBondContact O-N 2.9Å; R199-V222 PolarHBondContact O-N 2.89Å
200	R	97.6	Very high	92.9	Very high	98 Å²	98	34.5 Å²	34.5	37%	0.37	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.3	-177.3	-52.8	-172.7	171.5	116.9	-1.6	110.4	H174 E175 I176 Y202 V222	H174-R200 PolarHBondContact O-N 3.29Å; E175-R200 WeakPolarHBondContact CA-O 3.32Å; E175-R200 HydrophobicContact CB-CB 4.37Å; E175-R200 HydrophobicContact CG-CB 4.09Å; E175-R200 HydrophobicContact CG-CG 4.28Å; E175-R200 WeakPolarHBondContact OE1-CD 3.46Å; E175-R200 IonicContact OE1-CZ 2.83Å; E175-R200 IonicContact OE1-NE 2.66Å; E175-R200 IonicContact OE1-NH1 2.67Å; E175-R200 PolarHBondContact OE1-NH1 3.36Å; I176-R200 PolarHBondContact N-O 2.78Å; R200-Y202 HydrophobicContact CB-CE2 3.75Å; R200-V222 WeakPolarHBondContact CA-O 3.21Å; R200-V222 HydrophobicContact CB-CB 4.18Å; R200-V222 HydrophobicContact CG-CB 4Å; R200-V222 HydrophobicContact CG-CG2 4Å
201	L	96.7	Very high	93.3	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	117.5	178.3	-179.7	60.4	0	0	0	109.8	I176 F187 L198 I203 L214 L217 L220 V222 L223 R224	I176-L201 HydrophobicContact CB-CD1 4.19Å; I176-L201 HydrophobicContact CG2-CD1 4.27Å; F187-L201 HydrophobicContact CE2-CD2 4.19Å; L198-L201 HydrophobicContact CD2-CB 4.25Å; L198-L201 HydrophobicContact CD2-CD1 4.39Å; L201-I203 HydrophobicContact CD1-CG2 3.76Å; L201-I203 HydrophobicContact CD2-CD1 4.3Å; L201-I203 HydrophobicContact CD2-CG2 4.42Å; L201-I203 HydrophobicContact CG-CG2 3.9Å; L201-L214 HydrophobicContact CD2-CD2 4.02Å; L201-L217 HydrophobicContact CD2-CD1 3.99Å; L201-L220 HydrophobicContact CB-CD1 3.82Å; L201-V222 PolarHBondContact N-O 3.14Å; L201-L223 HydrophobicContact CB-CD1 4.16Å; L201-L223 HydrophobicContact CD2-CD1 4.02Å; L201-L223 HydrophobicContact CG-CD1 4.16Å; L201-R224 PolarHBondContact O-N 2.89Å
202	Y	97.2	Very high	93.2	Very high	43 Å²	43	34.1 Å²	34.1	17%	0.169	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114.7	177.2	-57.2	-94.2	0	0	0	109.3	I176 Y177 L178 D179 R200 V222 R224	I176-Y202 PolarHBondContact O-N 2.94Å; Y177-Y202 HydrophobicContact CD1-CD1 4.47Å; Y177-Y202 AromaticContact CD1-CD2 3.36Å; Y177-Y202 HydrophobicContact CD1-CD2 3.36Å; Y177-Y202 AromaticContact CD1-CE2 3.89Å; Y177-Y202 HydrophobicContact CD1-CE2 3.89Å; Y177-Y202 AromaticContact CD1-CG 3.71Å; Y177-Y202 HydrophobicContact CD1-CG 3.71Å; Y177-Y202 HydrophobicContact CD2-CD2 4.46Å; Y177-Y202 HydrophobicContact CE1-CD1 4.44Å; Y177-Y202 AromaticContact CE1-CD2 3.32Å; Y177-Y202 HydrophobicContact CE1-CD2 3.32Å; Y177-Y202 HydrophobicContact CE1-CE1 4.44Å; Y177-Y202 AromaticContact CE1-CE2 3.31Å; Y177-Y202 HydrophobicContact CE1-CE2 3.31Å; Y177-Y202 AromaticContact CE1-CG 3.93Å; Y177-Y202 HydrophobicContact CE1-CG 3.93Å; Y177-Y202 AromaticContact CE1-CZ 3.92Å; Y177-Y202 HydrophobicContact CE2-CD2 4.42Å; Y177-Y202 HydrophobicContact CE2-CE2 4.41Å; Y177-Y202 AromaticContact CG-CD2 3.95Å; Y177-Y202 HydrophobicContact CG-CD2 3.95Å; Y177-Y202 HydrophobicContact CG-CG 4.48Å; Y177-Y202 AromaticContact CZ-CD2 3.88Å; Y177-Y202 AromaticContact CZ-CE2 3.6Å; L178-Y202 CarbonylContact C-O 3.24Å; L178-Y202 WeakPolarHBondContact CA-O 3.48Å; L178-Y202 PolarHBondContact N-O 2.82Å; D179-Y202 PolarHBondContact N-O 2.73Å; R200-Y202 HydrophobicContact CB-CE2 3.75Å; Y202-V222 HydrophobicContact CE1-CG1 4.33Å; Y202-R224 HydrophobicContact CD1-CB 3.71Å; Y202-R224 HydrophobicContact CD1-CG 4.42Å; Y202-R224 HydrophobicContact CE1-CB 4.28Å
203	I	96.1	Very high	93.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	17%	0.169	C	C	.	.			trans	-138.4	20.8	-175.6	57.2	-178.6	0	0	0	111.3	L178 L183 L201 N206 I208 L223 R224 A225 N228	L178-I203 HydrophobicContact CB-CG2 4.15Å; L183-I203 HydrophobicContact CD1-CG2 4.15Å; L201-I203 HydrophobicContact CD1-CG2 3.76Å; L201-I203 HydrophobicContact CD2-CD1 4.3Å; L201-I203 HydrophobicContact CD2-CG2 4.42Å; L201-I203 HydrophobicContact CG-CG2 3.9Å; I203-N206 PolarHBondContact O-ND2 3.25Å; I203-I208 HydrophobicContact CB-CD1 3.89Å; I203-I208 HydrophobicContact CD1-CD1 3.65Å; I203-I208 HydrophobicContact CG1-CD1 4.03Å; I203-L223 HydrophobicContact CD1-CD1 3.94Å; I203-L223 HydrophobicContact CG1-CD1 4.32Å; I203-R224 CarbonylContact C-O 3.58Å; I203-R224 WeakPolarHBondContact CG1-O 3.48Å; I203-R224 PolarHBondContact N-O 2.63Å; I203-A225 HydrophobicContact CD1-CB 3.99Å; I203-A225 HydrophobicContact CG1-CB 3.74Å; I203-N228 PolarHBondContact O-ND2 3.38Å
204	H	96.2	Very high	93.2	Very high	16 Å²	16	31.6 Å²	31.6	7%	0.074	15%	0.153	C	C	.	.			trans	-70	159.9	179	68.1	86.2	0	0	0	112.2	D179 H180 N206 R224 D226	D179-H204 CarbonylContact C-O 3.43Å; D179-H204 WeakPolarHBondContact CA-O 3.42Å; D179-H204 VanDerWaalsContact CB-CD2 3.46Å; D179-H204 WeakPolarHBondContact CB-CD2 3.48Å; D179-H204 WeakPolarHBondContact CB-NE2 3.4Å; D179-H204 WeakPolarHBondContact CB-O 3.41Å; D179-H204 IonicContact OD2-CE1 2.77Å; D179-H204 IonicContact OD2-NE2 3.05Å; H180-H204 AromaticContact CD2-CE1 3.67Å; H180-H204 AromaticContact CD2-ND1 3.98Å; H180-H204 PolarHBondContact N-O 2.96Å; H180-H204 AromaticContact NE2-CE1 3.62Å; H180-H204 AromaticContact NE2-ND1 3.83Å; H204-N206 PolarHBondContact O-ND2 3.05Å; H204-R224 HydrophobicContact CB-CG 4.23Å; H204-R224 VanDerWaalsContact CD2-CD 3.5Å; H204-R224 WeakPolarHBondContact CD2-CD 3.44Å; H204-R224 PolarHBondContact N-O 3.28Å; H204-D226 CarbonylContact C-O 3.24Å; H204-D226 WeakPolarHBondContact CA-O 3.5Å; H204-D226 HydrophobicContact CB-CB 3.98Å; H204-D226 WeakPolarHBondContact CB-O 3.5Å
205	N	96.9	Very high	93.1	Very high	51 Å²	51	30.4 Å²	30.4	27%	0.273	15%	0.15	S	C	.	.	S	Bend	trans	55.1	55.7	-174.9	-73.7	-54.7	0	0	0	112.5	H180 D226 F227	H180-N205 WeakPolarHBondContact CA-O 3.48Å; H180-N205 VanDerWaalsContact CE1-CG 3.43Å; H180-N205 PolarHBondContact CE1-ND2 2.87Å; H180-N205 PolarHBondContact N-O 2.91Å; H180-N205 PolarHBondContact NE2-ND2 3.12Å; N205-D226 PolarHBondContact N-O 3.37Å; N205-F227 WeakPolarHBondContact CA-O 3.02Å; N205-F227 HydrophobicContact CB-CB 4.48Å; N205-F227 PolarHBondContact N-O 3.15Å; N205-F227 WeakPolarHBondContact OD1-CB 3.36Å; N205-F227 WeakPolarHBondContact OD1-CG 3.21Å
206	N	96.3	Very high	92.8	Very high	17 Å²	17	30.6 Å²	30.6	9%	0.091	15%	0.152	C	C	.	.	S	Bend	trans	-132.5	-170.6	175	-83.7	-73.9	0	0	0	109.4	L178 N181 K182 L183 I203 H204 I208 F227 N228	L178-N206 PolarHBondContact O-ND2 3.37Å; N181-N206 VanDerWaalsContact CA-OD1 3.3Å; N181-N206 WeakPolarHBondContact CA-OD1 3.36Å; N181-N206 WeakPolarHBondContact CB-OD1 3.27Å; N181-N206 PolarHBondContact N-OD1 3.43Å; N181-N206 PolarHBondContact O-OD1 3.19Å; N181-N206 VanDerWaalsContact O-OD1 3.05Å; K182-N206 PolarHBondContact N-OD1 3.29Å; L183-N206 HydrophobicContact CB-CB 4Å; L183-N206 WeakPolarHBondContact CB-OD1 3.47Å; L183-N206 WeakPolarHBondContact CG-OD1 3.13Å; L183-N206 PolarHBondContact N-OD1 2.95Å; I203-N206 PolarHBondContact O-ND2 3.25Å; H204-N206 PolarHBondContact O-ND2 3.05Å; N206-I208 HydrophobicContact CB-CD1 4.42Å; N206-I208 HydrophobicContact CB-CG1 4.18Å; N206-F227 PolarHBondContact N-O 3.07Å; N206-N228 WeakPolarHBondContact CA-OD1 3.34Å; N206-N228 WeakPolarHBondContact CB-OD1 3.29Å; N206-N228 PolarHBondContact N-OD1 2.84Å; N206-N228 PolarHBondContact O-OD1 3.24Å; N206-N228 VanDerWaalsContact O-OD1 3.08Å
207	G	94.3	Very high	93	Very high	9 Å²	9	26.6 Å²	26.6	9%	0.093	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	21.3	177.1	0	0	0	0	0	114.6	L183 T209 N228	L183-G207 CarbonylContact O-C 3.34Å; L183-G207 VanDerWaalsContact O-C 3.24Å; L183-G207 VanDerWaalsContact O-CA 3.22Å; L183-G207 WeakPolarHBondContact O-CA 3.38Å; L183-G207 PolarHBondContact O-N 2.65Å; G207-T209 PolarHBondContact O-N 2.91Å; G207-N228 PolarHBondContact N-OD1 2.88Å
208	I	95.2	Very high	93	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	128.3	-171.7	-61.1	176.6	0	0	0	110.2	L183 D185 I203 N206 N228 K229 I230	L183-I208 HydrophobicContact CB-CD1 4.28Å; L183-I208 HydrophobicContact CB-CG1 4.12Å; L183-I208 PolarHBondContact O-N 3.5Å; D185-I208 CarbonylContact O-C 3.39Å; D185-I208 WeakPolarHBondContact O-CA 3.28Å; D185-I208 WeakPolarHBondContact O-CG2 3.22Å; I203-I208 HydrophobicContact CB-CD1 3.89Å; I203-I208 HydrophobicContact CD1-CD1 3.65Å; I203-I208 HydrophobicContact CG1-CD1 4.03Å; N206-I208 HydrophobicContact CB-CD1 4.42Å; N206-I208 HydrophobicContact CB-CG1 4.18Å; I208-N228 HydrophobicContact CB-CB 4.34Å; I208-N228 WeakPolarHBondContact CB-OD1 3.23Å; I208-N228 PolarHBondContact N-OD1 3.27Å; I208-K229 CarbonylContact O-C 3.52Å; I208-K229 VanDerWaalsContact O-C 3.25Å; I208-K229 WeakPolarHBondContact O-CA 3.42Å; I208-K229 PolarHBondContact O-N 3.48Å; I208-I230 HydrophobicContact CG2-CG1 4.41Å; I208-I230 PolarHBondContact O-N 3.36Å
209	T	93	Very high	92.9	Very high	52 Å²	52	32.2 Å²	32.2	32%	0.319	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-17.9	-176.7	62.1	0	0	0	0	113.3	D185 G207 K229 I230	D185-T209 PolarHBondContact O-N 2.82Å; D185-T209 PolarHBondContact O-OG1 3.48Å; G207-T209 PolarHBondContact O-N 2.91Å; T209-K229 WeakPolarHBondContact CA-O 3.47Å; T209-K229 HydrophobicContact CG2-CB 4.17Å; T209-I230 WeakPolarHBondContact O-CA 3.38Å
210	S	91.1	Very high	92.9	Very high	16 Å²	16	27.1 Å²	27.1	11%	0.112	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	139.4	-179.2	-164.3	0	0	0	0	112.8	K212	S210-K212 PolarHBondContact O-N 3.41Å; S210-K212 WeakPolarHBondContact OG-CG 3.29Å; S210-K212 PolarHBondContact OG-N 3.49Å
211	L	90.7	Very high	92.9	Very high	6 Å²	6	24.7 Å²	24.7	3%	0.031	13%	0.133	C	C	.	.			trans	-83.1	11.4	170.6	-61.1	-179.6	0	0	0	113.4	L214 L223 A225 I230 L233 F237 L248	L211-L214 HydrophobicContact CB-CD1 4.08Å; L211-L214 HydrophobicContact CD2-CD1 3.87Å; L211-L214 HydrophobicContact CG-CD1 4.48Å; L211-L223 HydrophobicContact CD1-CD2 4.28Å; L211-L223 HydrophobicContact CD2-CD2 4.4Å; L211-A225 HydrophobicContact CD2-CB 4.28Å; L211-I230 HydrophobicContact CD1-CD1 4.21Å; L211-I230 HydrophobicContact CD2-CD1 3.6Å; L211-I230 HydrophobicContact CD2-CG1 4.37Å; L211-I230 HydrophobicContact CG-CD1 3.79Å; L211-I230 HydrophobicContact CG-CG1 4.33Å; L211-I230 HydrophobicContact CG-CG2 4.23Å; L211-L233 HydrophobicContact CD1-CD2 3.86Å; L211-F237 HydrophobicContact CB-CD2 4.32Å; L211-F237 HydrophobicContact CD1-CD2 3.94Å; L211-F237 HydrophobicContact CD1-CE2 3.89Å; L211-L248 HydrophobicContact CD1-CD1 4.44Å; L211-L248 HydrophobicContact CD1-CD2 3.77Å
212	K	87.5	Confident	92.9	Very high	78 Å²	78	25.3 Å²	25.3	34%	0.339	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	144.3	169.7	-77.1	179.5	176.9	-172.8	0	109.7	F187 S210 H234	F187-K212 PolarHBondContact N-O 3.12Å; S210-K212 PolarHBondContact O-N 3.41Å; S210-K212 WeakPolarHBondContact OG-CG 3.29Å; S210-K212 PolarHBondContact OG-N 3.49Å; K212-H234 WeakPolarHBondContact CE-CD2 3.47Å; K212-H234 WeakPolarHBondContact CE-NE2 3.45Å; K212-H234 HydrophobicContact CG-CB 4.05Å; K212-H234 PolarHBondContact NZ-CD2 3.46Å; K212-H234 PolarHBondContact NZ-NE2 2.8Å
213	G	86	Confident	92.9	Very high	9 Å²	9	23.2 Å²	23.2	9%	0.093	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-14.7	179.7	0	0	0	0	0	114.9	S192 N215	S192-G213 WeakPolarHBondContact CB-O 3.13Å; S192-G213 PolarHBondContact OG-O 3.28Å; G213-N215 PolarHBondContact O-N 2.89Å
214	L	90.3	Very high	93	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-74.5	-8.1	178.1	-62.1	-179.5	0	0	0	114.2	F187 L201 L211 G216 L217 L223 L240	F187-L214 HydrophobicContact CB-CD2 3.75Å; F187-L214 HydrophobicContact CB-CG 4.26Å; F187-L214 HydrophobicContact CD1-CD2 3.67Å; F187-L214 HydrophobicContact CD2-CD2 3.66Å; F187-L214 HydrophobicContact CE1-CD2 4.1Å; F187-L214 HydrophobicContact CE2-CD2 4.08Å; F187-L214 HydrophobicContact CG-CD2 3.41Å; F187-L214 VanDerWaalsContact CG-CD2 3.41Å; F187-L214 HydrophobicContact CG-CG 4.4Å; F187-L214 HydrophobicContact CZ-CD2 4.28Å; L201-L214 HydrophobicContact CD2-CD2 4.02Å; L211-L214 HydrophobicContact CB-CD1 4.08Å; L211-L214 HydrophobicContact CD2-CD1 3.87Å; L211-L214 HydrophobicContact CG-CD1 4.48Å; L214-G216 PolarHBondContact O-N 3.05Å; L214-L217 HydrophobicContact CB-CD1 4.28Å; L214-L217 HydrophobicContact CD2-CD1 3.63Å; L214-L217 WeakPolarHBondContact O-CB 3.16Å; L214-L217 WeakPolarHBondContact O-CG 3.49Å; L214-L217 PolarHBondContact O-N 3.42Å; L214-L223 HydrophobicContact CD1-CD1 4.33Å; L214-L223 HydrophobicContact CD1-CD2 3.85Å; L214-L240 HydrophobicContact CB-CD1 4.38Å; L214-L240 WeakPolarHBondContact O-CD2 3.41Å
215	N	87	Confident	93	Very high	28 Å²	28	27.2 Å²	27.2	15%	0.15	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-59.5	-22.2	-172.3	59.4	-78.6	0	0	0	114.8	Y189 G213 L217 T239	Y189-N215 WeakPolarHBondContact CD2-OD1 3.45Å; Y189-N215 WeakPolarHBondContact CE2-ND2 3.26Å; Y189-N215 WeakPolarHBondContact CE2-OD1 2.92Å; G213-N215 PolarHBondContact O-N 2.89Å; N215-L217 VanDerWaalsContact C-N 3.34Å; N215-T239 WeakPolarHBondContact CB-OG1 3.46Å
216	G	86.5	Confident	93	Very high	6 Å²	6	25 Å²	25	6%	0.062	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-74.5	-19	175.2	0	0	0	0	0	114.4	S192 N193 L214 T218	S192-G216 CarbonylContact O-C 3.55Å; S192-G216 VanDerWaalsContact O-C 3.24Å; N193-G216 VanDerWaalsContact OD1-CA 3.25Å; N193-G216 WeakPolarHBondContact OD1-CA 3.43Å; L214-G216 PolarHBondContact O-N 3.05Å; G216-T218 PolarHBondContact O-N 3.26Å
217	L	92.8	Very high	93	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.			trans	-77.5	60.2	-178.8	-53.4	178	0	0	0	111.4	M195 L198 L201 L214 N215 Q219 L220 L240	M195-L217 HydrophobicContact CB-CD2 3.87Å; M195-L217 HydrophobicContact CE-CD2 4.15Å; L198-L217 HydrophobicContact CB-CD2 4.37Å; L198-L217 HydrophobicContact CD2-CD1 4.07Å; L198-L217 HydrophobicContact CD2-CD2 3.9Å; L201-L217 HydrophobicContact CD2-CD1 3.99Å; L214-L217 HydrophobicContact CB-CD1 4.28Å; L214-L217 HydrophobicContact CD2-CD1 3.63Å; L214-L217 WeakPolarHBondContact O-CB 3.16Å; L214-L217 WeakPolarHBondContact O-CG 3.49Å; L214-L217 PolarHBondContact O-N 3.42Å; N215-L217 VanDerWaalsContact C-N 3.34Å; L217-Q219 PolarHBondContact O-N 3.28Å; L217-L220 HydrophobicContact CB-CB 4.02Å; L217-L220 HydrophobicContact CB-CD2 4.46Å; L217-L220 HydrophobicContact CD1-CD1 4.46Å; L217-L220 HydrophobicContact CD1-CD2 4.21Å; L217-L220 VanDerWaalsContact O-CB 3.23Å; L217-L220 WeakPolarHBondContact O-CB 3.35Å; L217-L220 PolarHBondContact O-N 3.45Å; L217-L240 HydrophobicContact CB-CD2 4.24Å; L217-L240 VanDerWaalsContact O-CD2 3.24Å; L217-L240 WeakPolarHBondContact O-CD2 3.31Å
218	T	89.1	Confident	93.2	Very high	72 Å²	72	28.4 Å²	28.4	44%	0.442	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.2	-170.2	59.6	0	0	0	0	114.6	G216	G216-T218 PolarHBondContact O-N 3.26Å
219	Q	94	Very high	93.2	Very high	61 Å²	61	33.8 Å²	33.8	29%	0.285	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	2.5	177.4	-57.3	-57.4	-42.5	0	0	113.8	I196 L198 L217 Q221	I196-Q219 WeakPolarHBondContact O-CG 3.33Å; L198-Q219 CarbonylContact O-C 3.6Å; L198-Q219 VanDerWaalsContact O-C 3.24Å; L217-Q219 PolarHBondContact O-N 3.28Å; Q219-Q221 PolarHBondContact O-N 3.41Å
220	L	96.1	Very high	93.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.			trans	-64.8	124.5	-175.2	-161.8	72	0	0	0	111.3	L198 L201 L217 L223 L240 K242 I243	L198-L220 HydrophobicContact CD2-CD1 4.41Å; L198-L220 HydrophobicContact CG-CD1 4.37Å; L198-L220 WeakPolarHBondContact O-CA 3.4Å; L198-L220 PolarHBondContact O-N 2.83Å; L201-L220 HydrophobicContact CB-CD1 3.82Å; L217-L220 HydrophobicContact CB-CB 4.02Å; L217-L220 HydrophobicContact CB-CD2 4.46Å; L217-L220 HydrophobicContact CD1-CD1 4.46Å; L217-L220 HydrophobicContact CD1-CD2 4.21Å; L217-L220 VanDerWaalsContact O-CB 3.23Å; L217-L220 WeakPolarHBondContact O-CB 3.35Å; L217-L220 PolarHBondContact O-N 3.45Å; L220-L223 HydrophobicContact CD2-CB 4.03Å; L220-L223 HydrophobicContact CD2-CD1 4.36Å; L220-L240 HydrophobicContact CB-CD2 4.37Å; L220-L240 HydrophobicContact CD2-CD1 4.16Å; L220-K242 CarbonylContact O-C 3.5Å; L220-I243 VanDerWaalsContact O-CA 3.32Å; L220-I243 WeakPolarHBondContact O-CA 3.27Å; L220-I243 PolarHBondContact O-N 3.47Å; L220-I243 VanDerWaalsContact O-N 3.14Å
221	Q	97.3	Very high	93.3	Very high	47 Å²	47	33.7 Å²	33.7	22%	0.22	17%	0.165	C	C	.	.			trans	-110.6	-37.7	179.2	-69.9	175.5	-23.2	0	0	111.6	R199 Q219 E244 Y245	R199-Q221 PolarHBondContact O-N 2.9Å; Q219-Q221 PolarHBondContact O-N 3.41Å; Q221-E244 PolarHBondContact O-N 2.91Å; Q221-Y245 PolarHBondContact O-N 2.78Å
222	V	97.7	Very high	93.3	Very high	13 Å²	13	34.2 Å²	34.2	8%	0.079	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.7	-179.6	-176.8	0	0	0	0	109.2	R199 R200 L201 Y202 Y245	R199-V222 PolarHBondContact O-N 2.89Å; R200-V222 WeakPolarHBondContact CA-O 3.21Å; R200-V222 HydrophobicContact CB-CB 4.18Å; R200-V222 HydrophobicContact CG-CB 4Å; R200-V222 HydrophobicContact CG-CG2 4Å; L201-V222 PolarHBondContact N-O 3.14Å; Y202-V222 HydrophobicContact CE1-CG1 4.33Å; V222-Y245 WeakPolarHBondContact CA-O 3.24Å; V222-Y245 HydrophobicContact CG2-CD2 3.86Å; V222-Y245 HydrophobicContact CG2-CG 4.41Å
223	L	97.1	Very high	93.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	117.6	168.6	179.5	62	0	0	0	109.2	L201 I203 L211 L214 L220 A225 F237 I243 Y245 L246 Y247	L201-L223 HydrophobicContact CB-CD1 4.16Å; L201-L223 HydrophobicContact CD2-CD1 4.02Å; L201-L223 HydrophobicContact CG-CD1 4.16Å; I203-L223 HydrophobicContact CD1-CD1 3.94Å; I203-L223 HydrophobicContact CG1-CD1 4.32Å; L211-L223 HydrophobicContact CD1-CD2 4.28Å; L211-L223 HydrophobicContact CD2-CD2 4.4Å; L214-L223 HydrophobicContact CD1-CD1 4.33Å; L214-L223 HydrophobicContact CD1-CD2 3.85Å; L220-L223 HydrophobicContact CD2-CB 4.03Å; L220-L223 HydrophobicContact CD2-CD1 4.36Å; L223-A225 HydrophobicContact CG-CB 4.48Å; L223-F237 HydrophobicContact CD2-CE2 3.89Å; L223-I243 HydrophobicContact CB-CD1 3.93Å; L223-Y245 PolarHBondContact N-O 2.92Å; L223-L246 HydrophobicContact CB-CD1 4.1Å; L223-L246 HydrophobicContact CD2-CD1 3.86Å; L223-L246 HydrophobicContact CG-CD1 4.22Å; L223-Y247 PolarHBondContact O-N 3.26Å
224	R	97.3	Very high	93.1	Very high	101 Å²	101	33.7 Å²	33.7	38%	0.381	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.3	173.1	-167.3	173.6	-175	-176.5	0.9	110	L201 Y202 I203 H204 D226 Y247	L201-R224 PolarHBondContact O-N 2.89Å; Y202-R224 HydrophobicContact CD1-CB 3.71Å; Y202-R224 HydrophobicContact CD1-CG 4.42Å; Y202-R224 HydrophobicContact CE1-CB 4.28Å; I203-R224 CarbonylContact C-O 3.58Å; I203-R224 WeakPolarHBondContact CG1-O 3.48Å; I203-R224 PolarHBondContact N-O 2.63Å; H204-R224 HydrophobicContact CB-CG 4.23Å; H204-R224 VanDerWaalsContact CD2-CD 3.5Å; H204-R224 WeakPolarHBondContact CD2-CD 3.44Å; H204-R224 PolarHBondContact N-O 3.28Å; R224-D226 WeakPolarHBondContact CG-OD2 3.14Å; R224-D226 IonicContact NE-OD2 3.42Å; R224-D226 PolarHBondContact NE-OD2 3.42Å; R224-D226 VanDerWaalsContact NE-OD2 3.13Å; R224-Y247 HydrophobicContact CB-CD2 4.19Å; R224-Y247 HydrophobicContact CG-CD2 4.13Å; R224-Y247 HydrophobicContact CG-CG 4.34Å
225	A	96.7	Very high	92.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.18	C	C	.	.			trans	-132.7	31.7	-176.2	0	0	0	0	0	112.4	I203 L211 L223 N228 I230 Y247 L248 N251	I203-A225 HydrophobicContact CD1-CB 3.99Å; I203-A225 HydrophobicContact CG1-CB 3.74Å; L211-A225 HydrophobicContact CD2-CB 4.28Å; L223-A225 HydrophobicContact CG-CB 4.48Å; A225-N228 PolarHBondContact O-ND2 3.04Å; A225-I230 HydrophobicContact CB-CD1 4.02Å; A225-Y247 CarbonylContact C-O 3.59Å; A225-Y247 PolarHBondContact N-O 3.47Å; A225-L248 HydrophobicContact CB-CD2 3.93Å; A225-N251 PolarHBondContact O-ND2 2.78Å
226	D	96.6	Very high	92.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	20%	0.199	C	C	.	.			trans	-59.7	159.2	173.1	-50.4	-62.7	0	0	0	112.5	H204 N205 R224 N228 Y247 L248 S249	H204-D226 CarbonylContact C-O 3.24Å; H204-D226 WeakPolarHBondContact CA-O 3.5Å; H204-D226 HydrophobicContact CB-CB 3.98Å; H204-D226 WeakPolarHBondContact CB-O 3.5Å; N205-D226 PolarHBondContact N-O 3.37Å; R224-D226 WeakPolarHBondContact CG-OD2 3.14Å; R224-D226 IonicContact NE-OD2 3.42Å; R224-D226 PolarHBondContact NE-OD2 3.42Å; R224-D226 VanDerWaalsContact NE-OD2 3.13Å; D226-N228 VanDerWaalsContact C-N 3.34Å; D226-N228 PolarHBondContact O-N 3.12Å; D226-N228 PolarHBondContact O-ND2 3.3Å; D226-Y247 PolarHBondContact N-O 3.37Å; D226-Y247 VanDerWaalsContact OD1-CB 3.27Å; D226-Y247 WeakPolarHBondContact OD1-CB 3.38Å; D226-Y247 VanDerWaalsContact OD2-CB 3.26Å; D226-Y247 WeakPolarHBondContact OD2-CB 3.09Å; D226-L248 PolarHBondContact OD1-N 3Å; D226-L248 VanDerWaalsContact OD1-N 3.15Å; D226-S249 CarbonylContact C-O 3.24Å; D226-S249 WeakPolarHBondContact CA-O 3.24Å; D226-S249 WeakPolarHBondContact CB-OG 3.42Å; D226-S249 WeakPolarHBondContact OD1-CB 3.03Å; D226-S249 PolarHBondContact OD1-N 3.13Å; D226-S249 PolarHBondContact OD1-OG 3.38Å
227	F	97.2	Very high	92.5	Very high	90 Å²	90	41.7 Å²	41.7	40%	0.395	20%	0.197	S	C	.	.	S	Bend	trans	52.4	51.7	175.6	-61.4	-87.9	0	0	0	112.5	N205 N206 S249 H250	N205-F227 WeakPolarHBondContact CA-O 3.02Å; N205-F227 HydrophobicContact CB-CB 4.48Å; N205-F227 PolarHBondContact N-O 3.15Å; N205-F227 WeakPolarHBondContact OD1-CB 3.36Å; N205-F227 WeakPolarHBondContact OD1-CG 3.21Å; N206-F227 PolarHBondContact N-O 3.07Å; F227-S249 PolarHBondContact N-O 3.38Å; F227-H250 VanDerWaalsContact CA-O 3.3Å; F227-H250 WeakPolarHBondContact CA-O 3.03Å; F227-H250 HydrophobicContact CD1-CB 3.55Å; F227-H250 AromaticContact CD1-CG 3.79Å; F227-H250 HydrophobicContact CD2-CB 4.38Å; F227-H250 HydrophobicContact CE1-CB 3.72Å; F227-H250 AromaticContact CE1-CD2 3.42Å; F227-H250 VanDerWaalsContact CE1-CD2 3.42Å; F227-H250 WeakPolarHBondContact CE1-CD2 3.29Å; F227-H250 AromaticContact CE1-CG 3.38Å; F227-H250 AromaticContact CE1-ND1 3.8Å; F227-H250 AromaticContact CE1-NE2 3.84Å; F227-H250 AromaticContact CE2-CD2 3.71Å; F227-H250 HydrophobicContact CG-CB 3.91Å; F227-H250 HydrophobicContact CZ-CB 4.21Å; F227-H250 AromaticContact CZ-CD2 3.16Å; F227-H250 WeakPolarHBondContact CZ-CD2 3.2Å; F227-H250 AromaticContact CZ-CG 3.66Å; F227-H250 AromaticContact CZ-NE2 3.56Å; F227-H250 PolarHBondContact N-O 2.95Å
228	N	97	Very high	92.3	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.048	20%	0.198	C	C	.	.	S	Bend	trans	-124.2	-167.2	174.9	-85.8	-69.4	0	0	0	109	I203 N206 G207 I208 A225 D226 I230 H250 N251	I203-N228 PolarHBondContact O-ND2 3.38Å; N206-N228 WeakPolarHBondContact CA-OD1 3.34Å; N206-N228 WeakPolarHBondContact CB-OD1 3.29Å; N206-N228 PolarHBondContact N-OD1 2.84Å; N206-N228 PolarHBondContact O-OD1 3.24Å; N206-N228 VanDerWaalsContact O-OD1 3.08Å; G207-N228 PolarHBondContact N-OD1 2.88Å; I208-N228 HydrophobicContact CB-CB 4.34Å; I208-N228 WeakPolarHBondContact CB-OD1 3.23Å; I208-N228 PolarHBondContact N-OD1 3.27Å; A225-N228 PolarHBondContact O-ND2 3.04Å; D226-N228 VanDerWaalsContact C-N 3.34Å; D226-N228 PolarHBondContact O-N 3.12Å; D226-N228 PolarHBondContact O-ND2 3.3Å; N228-I230 HydrophobicContact CB-CD1 4.15Å; N228-I230 HydrophobicContact CB-CG1 4.13Å; N228-H250 PolarHBondContact N-O 2.95Å; N228-N251 WeakPolarHBondContact CA-OD1 3.45Å; N228-N251 WeakPolarHBondContact CB-OD1 3.39Å; N228-N251 PolarHBondContact N-OD1 2.85Å; N228-N251 PolarHBondContact O-OD1 2.93Å
229	K	95.4	Very high	92.3	Very high	116 Å²	116	41.4 Å²	41.4	50%	0.504	20%	0.195	S	C	.	.			trans	-115.4	29.6	179.6	-62.2	173.7	-174.1	163.8	0	111.5	I208 T209 T231 N251	I208-K229 CarbonylContact O-C 3.52Å; I208-K229 VanDerWaalsContact O-C 3.25Å; I208-K229 WeakPolarHBondContact O-CA 3.42Å; I208-K229 PolarHBondContact O-N 3.48Å; T209-K229 WeakPolarHBondContact CA-O 3.47Å; T209-K229 HydrophobicContact CG2-CB 4.17Å; K229-T231 PolarHBondContact O-N 3.23Å; K229-N251 PolarHBondContact N-OD1 3.27Å
230	I	95.7	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.182	C	C	.	.			trans	-67.2	126.1	-175.4	-59.5	161	0	0	0	109.2	I208 T209 L211 A225 N228 L248 N251 C252 I253	I208-I230 HydrophobicContact CG2-CG1 4.41Å; I208-I230 PolarHBondContact O-N 3.36Å; T209-I230 WeakPolarHBondContact O-CA 3.38Å; L211-I230 HydrophobicContact CD1-CD1 4.21Å; L211-I230 HydrophobicContact CD2-CD1 3.6Å; L211-I230 HydrophobicContact CD2-CG1 4.37Å; L211-I230 HydrophobicContact CG-CD1 3.79Å; L211-I230 HydrophobicContact CG-CG1 4.33Å; L211-I230 HydrophobicContact CG-CG2 4.23Å; A225-I230 HydrophobicContact CB-CD1 4.02Å; N228-I230 HydrophobicContact CB-CD1 4.15Å; N228-I230 HydrophobicContact CB-CG1 4.13Å; I230-L248 HydrophobicContact CD1-CD2 3.89Å; I230-N251 HydrophobicContact CB-CB 4.24Å; I230-N251 VanDerWaalsContact CB-OD1 3.25Å; I230-N251 WeakPolarHBondContact CB-OD1 3.19Å; I230-N251 WeakPolarHBondContact CD1-OD1 3.36Å; I230-N251 WeakPolarHBondContact CG1-OD1 3.22Å; I230-N251 PolarHBondContact N-OD1 2.87Å; I230-C252 CarbonylContact O-C 3.57Å; I230-C252 VanDerWaalsContact O-CA 3.3Å; I230-C252 WeakPolarHBondContact O-CA 3.34Å; I230-C252 PolarHBondContact O-N 3.01Å; I230-I253 HydrophobicContact CG2-CD1 4.45Å; I230-I253 HydrophobicContact CG2-CG1 4.24Å; I230-I253 WeakPolarHBondContact O-CG1 3.36Å; I230-I253 PolarHBondContact O-N 2.79Å
231	T	91.6	Very high	91.9	Very high	67 Å²	67	44.8 Å²	44.8	41%	0.411	21%	0.209	S	C	.	.			trans	-101.8	-19.4	-175	52.4	0	0	0	0	114.6	K229 C252	K229-T231 PolarHBondContact O-N 3.23Å; T231-C252 WeakPolarHBondContact CA-O 3.41Å; T231-C252 HydrophobicContact CG2-CB 4.14Å
232	S	90	Very high	91.8	Very high	16 Å²	16	46.8 Å²	46.8	11%	0.112	22%	0.217	C	C	.	.			trans	-161	150.8	-176.9	56.1	0	0	0	0	112.4	Q255	S232-Q255 VanDerWaalsContact CB-OE1 3.22Å
233	L	88.7	Confident	91.7	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.099	21%	0.213	C	C	.	.			trans	-90.6	97	167	-68.3	-180	0	0	0	109.4	L211 F237 F238 L248 I257	L211-L233 HydrophobicContact CD1-CD2 3.86Å; L233-F237 HydrophobicContact CD2-CD1 4.16Å; L233-F237 HydrophobicContact CD2-CE1 4.34Å; L233-F237 HydrophobicContact CD2-CG 4.28Å; L233-F238 HydrophobicContact CB-CZ 4.28Å; L233-L248 HydrophobicContact CD1-CD1 4.35Å; L233-L248 HydrophobicContact CD2-CD1 3.68Å; L233-L248 HydrophobicContact CG-CD1 4.46Å; L233-I257 HydrophobicContact CD1-CD1 4.35Å; L233-I257 HydrophobicContact CD1-CG1 4.43Å; L233-I257 HydrophobicContact CD1-CG2 4.4Å
234	H	81.4	Confident	91.7	Very high	57 Å²	57	48 Å²	48	26%	0.264	22%	0.222	S	C	.	.			trans	-69.2	156.8	-178.3	-157.8	-91.1	0	0	0	112.2	K212 Y236 F237	K212-H234 WeakPolarHBondContact CE-CD2 3.47Å; K212-H234 WeakPolarHBondContact CE-NE2 3.45Å; K212-H234 HydrophobicContact CG-CB 4.05Å; K212-H234 PolarHBondContact NZ-CD2 3.46Å; K212-H234 PolarHBondContact NZ-NE2 2.8Å; H234-Y236 AromaticContact CE1-CD2 3.7Å; H234-Y236 AromaticContact CE1-CE2 3.76Å; H234-Y236 AromaticContact ND1-CD2 3.33Å; H234-Y236 VanDerWaalsContact ND1-CD2 3.33Å; H234-Y236 WeakPolarHBondContact ND1-CD2 3.48Å; H234-Y236 AromaticContact ND1-CE2 3.88Å; H234-Y236 PolarHBondContact O-N 2.65Å; H234-F237 WeakPolarHBondContact O-CB 3.11Å; H234-F237 PolarHBondContact O-N 2.58Å
235	D	82.2	Confident	91.7	Very high	59 Å²	59	46.6 Å²	46.6	32%	0.316	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.8	-177	-76.2	-33.1	0	0	0	115.8	F237 F238 R261	D235-F237 VanDerWaalsContact C-N 3.28Å; D235-F237 PolarHBondContact O-N 2.91Å; D235-F238 WeakPolarHBondContact O-CD2 3.43Å; D235-F238 PolarHBondContact O-N 3.14Å; D235-R261 VanDerWaalsContact CG-CZ 3.47Å; D235-R261 IonicContact OD1-CZ 2.77Å; D235-R261 IonicContact OD1-NE 3.2Å; D235-R261 IonicContact OD1-NH1 3.92Å; D235-R261 PolarHBondContact OD1-NH1 3.12Å; D235-R261 IonicContact OD2-CZ 2.76Å; D235-R261 IonicContact OD2-NH1 2.63Å; D235-R261 PolarHBondContact OD2-NH1 3.2Å; D235-R261 IonicContact OD2-NH2 3.91Å
236	Y	82.4	Confident	91.7	Very high	140 Å²	140	46.6 Å²	46.6	55%	0.549	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-20	179	-64.4	-66.8	0	0	0	112.8	H234 F238 T239	H234-Y236 AromaticContact CE1-CD2 3.7Å; H234-Y236 AromaticContact CE1-CE2 3.76Å; H234-Y236 AromaticContact ND1-CD2 3.33Å; H234-Y236 VanDerWaalsContact ND1-CD2 3.33Å; H234-Y236 WeakPolarHBondContact ND1-CD2 3.48Å; H234-Y236 AromaticContact ND1-CE2 3.88Å; H234-Y236 PolarHBondContact O-N 2.65Å; Y236-F238 PolarHBondContact O-N 3Å; Y236-T239 WeakPolarHBondContact O-CG2 3.46Å; Y236-T239 PolarHBondContact O-N 3.09Å; Y236-T239 PolarHBondContact O-OG1 3.43Å
237	F	87.1	Confident	91.8	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.018	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-60.5	-37.3	174.3	178.1	-99.8	0	0	0	111.4	L211 L223 L233 H234 D235 T239 L240 I243 L246 L265	L211-F237 HydrophobicContact CB-CD2 4.32Å; L211-F237 HydrophobicContact CD1-CD2 3.94Å; L211-F237 HydrophobicContact CD1-CE2 3.89Å; L223-F237 HydrophobicContact CD2-CE2 3.89Å; L233-F237 HydrophobicContact CD2-CD1 4.16Å; L233-F237 HydrophobicContact CD2-CE1 4.34Å; L233-F237 HydrophobicContact CD2-CG 4.28Å; H234-F237 WeakPolarHBondContact O-CB 3.11Å; H234-F237 PolarHBondContact O-N 2.58Å; D235-F237 VanDerWaalsContact C-N 3.28Å; D235-F237 PolarHBondContact O-N 2.91Å; F237-T239 PolarHBondContact O-N 3.01Å; F237-L240 HydrophobicContact CD2-CD1 3.94Å; F237-L240 HydrophobicContact CE2-CD1 3.82Å; F237-L240 WeakPolarHBondContact O-CB 3.17Å; F237-L240 WeakPolarHBondContact O-CG 3.44Å; F237-L240 PolarHBondContact O-N 3.17Å; F237-L240 VanDerWaalsContact O-N 3.17Å; F237-I243 HydrophobicContact CE2-CD1 4.43Å; F237-I243 HydrophobicContact CZ-CD1 4.07Å; F237-L246 HydrophobicContact CE1-CD2 3.67Å; F237-L246 HydrophobicContact CE2-CD1 4.11Å; F237-L246 HydrophobicContact CZ-CD1 3.6Å; F237-L246 HydrophobicContact CZ-CD2 3.41Å; F237-L246 VanDerWaalsContact CZ-CD2 3.41Å; F237-L246 HydrophobicContact CZ-CG 4.13Å; F237-L265 HydrophobicContact CE1-CD1 4.09Å
238	F	88.8	Confident	91.8	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.022	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-71.7	3.8	-177.9	-53.3	-75.4	0	0	0	114.2	L233 D235 Y236 L240 I257 R261 L262 L265	L233-F238 HydrophobicContact CB-CZ 4.28Å; D235-F238 WeakPolarHBondContact O-CD2 3.43Å; D235-F238 PolarHBondContact O-N 3.14Å; Y236-F238 PolarHBondContact O-N 3Å; F238-L240 VanDerWaalsContact C-N 3.33Å; F238-I257 HydrophobicContact CE1-CG2 4.38Å; F238-I257 HydrophobicContact CZ-CG2 4.02Å; F238-R261 HydrophobicContact CB-CB 3.8Å; F238-R261 HydrophobicContact CD1-CB 4.32Å; F238-R261 HydrophobicContact CD2-CB 3.57Å; F238-R261 HydrophobicContact CD2-CG 4.46Å; F238-R261 HydrophobicContact CE2-CB 4.23Å; F238-R261 HydrophobicContact CG-CB 3.63Å; F238-L262 HydrophobicContact CD1-CB 4.44Å; F238-L262 HydrophobicContact CE1-CB 4.06Å; F238-L262 HydrophobicContact CE1-CD1 4.22Å; F238-L262 HydrophobicContact CE1-CG 4.31Å; F238-L265 HydrophobicContact CD1-CD1 4.01Å; F238-L265 HydrophobicContact CD1-CG 4.25Å; F238-L265 HydrophobicContact CE1-CD1 4.45Å
239	T	87.5	Confident	91.8	Very high	61 Å²	61	45.4 Å²	45.4	37%	0.374	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-81.5	-13.9	170.3	67.7	0	0	0	0	112.9	N215 Y236 F237 K241	N215-T239 WeakPolarHBondContact CB-OG1 3.46Å; Y236-T239 WeakPolarHBondContact O-CG2 3.46Å; Y236-T239 PolarHBondContact O-N 3.09Å; Y236-T239 PolarHBondContact O-OG1 3.43Å; F237-T239 PolarHBondContact O-N 3.01Å; T239-K241 PolarHBondContact O-N 3.44Å
240	L	91.7	Very high	91.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.202	C	C	.	.			trans	-74.6	64.4	178.2	-61.5	176.4	0	0	0	111.6	L214 L217 L220 F237 F238 K242 I243	L214-L240 HydrophobicContact CB-CD1 4.38Å; L214-L240 WeakPolarHBondContact O-CD2 3.41Å; L217-L240 HydrophobicContact CB-CD2 4.24Å; L217-L240 VanDerWaalsContact O-CD2 3.24Å; L217-L240 WeakPolarHBondContact O-CD2 3.31Å; L220-L240 HydrophobicContact CB-CD2 4.37Å; L220-L240 HydrophobicContact CD2-CD1 4.16Å; F237-L240 HydrophobicContact CD2-CD1 3.94Å; F237-L240 HydrophobicContact CE2-CD1 3.82Å; F237-L240 WeakPolarHBondContact O-CB 3.17Å; F237-L240 WeakPolarHBondContact O-CG 3.44Å; F237-L240 PolarHBondContact O-N 3.17Å; F237-L240 VanDerWaalsContact O-N 3.17Å; F238-L240 VanDerWaalsContact C-N 3.33Å; L240-K242 PolarHBondContact O-N 2.99Å; L240-K242 VanDerWaalsContact O-N 3.13Å; L240-I243 HydrophobicContact CB-CB 4.36Å; L240-I243 HydrophobicContact CD1-CD1 4.3Å; L240-I243 WeakPolarHBondContact O-CB 3.27Å; L240-I243 VanDerWaalsContact O-CG2 3.24Å; L240-I243 WeakPolarHBondContact O-CG2 3.31Å; L240-I243 PolarHBondContact O-N 2.95Å; L240-I243 VanDerWaalsContact O-N 3.14Å
241	K	90.8	Very high	91.9	Very high	132 Å²	132	43.6 Å²	43.6	57%	0.574	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.9	-170.2	-66.1	178.3	-176.6	177.2	0	114.1	T239 I243 H267	T239-K241 PolarHBondContact O-N 3.44Å; K241-I243 VanDerWaalsContact C-N 3.35Å; K241-H267 PolarHBondContact O-CD2 2.98Å; K241-H267 VanDerWaalsContact O-CD2 3.28Å
242	K	94.2	Very high	92.1	Very high	88 Å²	88	43.6 Å²	43.6	38%	0.383	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	1.5	-178.3	-65.5	-163.1	178.1	-168	0	114.1	L220 L240 E244	L220-K242 CarbonylContact O-C 3.5Å; L240-K242 PolarHBondContact O-N 2.99Å; L240-K242 VanDerWaalsContact O-N 3.13Å; K242-E244 PolarHBondContact O-N 3Å
243	I	96	Very high	92.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.			trans	-66.7	131.2	-177.6	-156.2	159.5	0	0	0	110.6	L220 L223 F237 L240 K241 L246 L265 H267 L268	L220-I243 VanDerWaalsContact O-CA 3.32Å; L220-I243 WeakPolarHBondContact O-CA 3.27Å; L220-I243 PolarHBondContact O-N 3.47Å; L220-I243 VanDerWaalsContact O-N 3.14Å; L223-I243 HydrophobicContact CB-CD1 3.93Å; F237-I243 HydrophobicContact CE2-CD1 4.43Å; F237-I243 HydrophobicContact CZ-CD1 4.07Å; L240-I243 HydrophobicContact CB-CB 4.36Å; L240-I243 HydrophobicContact CD1-CD1 4.3Å; L240-I243 WeakPolarHBondContact O-CB 3.27Å; L240-I243 VanDerWaalsContact O-CG2 3.24Å; L240-I243 WeakPolarHBondContact O-CG2 3.31Å; L240-I243 PolarHBondContact O-N 2.95Å; L240-I243 VanDerWaalsContact O-N 3.14Å; K241-I243 VanDerWaalsContact C-N 3.35Å; I243-L246 HydrophobicContact CD1-CD1 4.12Å; I243-L265 HydrophobicContact CG2-CB 4.45Å; I243-L265 HydrophobicContact CG2-CD1 4.39Å; I243-L265 HydrophobicContact CG2-CD2 3.88Å; I243-L265 HydrophobicContact CG2-CG 4.47Å; I243-H267 CarbonylContact O-C 3.42Å; I243-H267 VanDerWaalsContact O-C 3.24Å; I243-L268 HydrophobicContact CG2-CD1 4.01Å; I243-L268 WeakPolarHBondContact O-CA 3.27Å; I243-L268 PolarHBondContact O-N 3.39Å; I243-L268 VanDerWaalsContact O-N 3.16Å
244	E	97.3	Very high	92.2	Very high	39 Å²	39	45.8 Å²	45.8	18%	0.182	22%	0.22	C	C	.	.			trans	-115	-39.7	-178.7	-61.2	-168.6	-173.7	0	0	111.4	Q221 K242 H267 K269 V270	Q221-E244 PolarHBondContact O-N 2.91Å; K242-E244 PolarHBondContact O-N 3Å; E244-H267 WeakPolarHBondContact CA-O 3.29Å; E244-H267 HydrophobicContact CG-CB 4.25Å; E244-K269 HydrophobicContact CB-CD 4.4Å; E244-K269 WeakPolarHBondContact O-CA 3.44Å; E244-K269 PolarHBondContact O-N 3.14Å; E244-K269 IonicContact OE1-NZ 3.9Å; E244-K269 WeakPolarHBondContact OE2-CE 3.49Å; E244-K269 IonicContact OE2-NZ 3.37Å; E244-K269 PolarHBondContact OE2-NZ 3.28Å; E244-V270 PolarHBondContact O-N 3.37Å
245	Y	97.8	Very high	92.2	Very high	71 Å²	71	48.5 Å²	48.5	28%	0.278	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	117.9	-177.1	-56.9	-93.7	0	0	0	109.9	Q221 V222 L223 K269 V270	Q221-Y245 PolarHBondContact O-N 2.78Å; V222-Y245 WeakPolarHBondContact CA-O 3.24Å; V222-Y245 HydrophobicContact CG2-CD2 3.86Å; V222-Y245 HydrophobicContact CG2-CG 4.41Å; L223-Y245 PolarHBondContact N-O 2.92Å; Y245-K269 HydrophobicContact CE2-CD 4.43Å; Y245-V270 HydrophobicContact CD1-CB 3.8Å; Y245-V270 HydrophobicContact CD1-CG2 3.64Å; Y245-V270 HydrophobicContact CE1-CB 4.4Å; Y245-V270 HydrophobicContact CE1-CG2 3.74Å
246	L	96.9	Very high	92	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	112.3	-178.5	179.3	60.4	0	0	0	110.2	L223 F237 I243 L248 L268 V270 I271 D272	L223-L246 HydrophobicContact CB-CD1 4.1Å; L223-L246 HydrophobicContact CD2-CD1 3.86Å; L223-L246 HydrophobicContact CG-CD1 4.22Å; F237-L246 HydrophobicContact CE1-CD2 3.67Å; F237-L246 HydrophobicContact CE2-CD1 4.11Å; F237-L246 HydrophobicContact CZ-CD1 3.6Å; F237-L246 HydrophobicContact CZ-CD2 3.41Å; F237-L246 VanDerWaalsContact CZ-CD2 3.41Å; F237-L246 HydrophobicContact CZ-CG 4.13Å; I243-L246 HydrophobicContact CD1-CD1 4.12Å; L246-L248 HydrophobicContact CD1-CD1 3.84Å; L246-L248 HydrophobicContact CD1-CD2 4.21Å; L246-L248 HydrophobicContact CD1-CG 3.84Å; L246-L248 HydrophobicContact CD2-CD1 3.84Å; L246-L248 HydrophobicContact CG-CD1 3.78Å; L246-L248 HydrophobicContact CG-CG 3.98Å; L246-L268 HydrophobicContact CB-CD1 3.9Å; L246-V270 PolarHBondContact N-O 2.92Å; L246-I271 HydrophobicContact CB-CG1 4.39Å; L246-I271 HydrophobicContact CD2-CD1 3.94Å; L246-I271 HydrophobicContact CD2-CG1 4.05Å; L246-I271 HydrophobicContact CG-CG1 4.38Å; L246-I271 WeakPolarHBondContact O-CA 3.34Å; L246-D272 PolarHBondContact O-N 2.69Å
247	Y	97.9	Very high	92	Very high	67 Å²	67	43.9 Å²	43.9	26%	0.263	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.7	178.5	-53.7	-85.3	0	0	0	110.4	L223 R224 A225 D226 V270 D272	L223-Y247 PolarHBondContact O-N 3.26Å; R224-Y247 HydrophobicContact CB-CD2 4.19Å; R224-Y247 HydrophobicContact CG-CD2 4.13Å; R224-Y247 HydrophobicContact CG-CG 4.34Å; A225-Y247 CarbonylContact C-O 3.59Å; A225-Y247 PolarHBondContact N-O 3.47Å; D226-Y247 PolarHBondContact N-O 3.37Å; D226-Y247 VanDerWaalsContact OD1-CB 3.27Å; D226-Y247 WeakPolarHBondContact OD1-CB 3.38Å; D226-Y247 VanDerWaalsContact OD2-CB 3.26Å; D226-Y247 WeakPolarHBondContact OD2-CB 3.09Å; Y247-V270 HydrophobicContact CE1-CG1 3.95Å; Y247-D272 HydrophobicContact CD1-CB 3.87Å
248	L	97.2	Very high	91.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.			trans	-135.1	24.7	-175.1	-62.9	172.7	0	0	0	111.7	L211 A225 D226 I230 L233 L246 N251 I253 D272 L273 N276	L211-L248 HydrophobicContact CD1-CD1 4.44Å; L211-L248 HydrophobicContact CD1-CD2 3.77Å; A225-L248 HydrophobicContact CB-CD2 3.93Å; D226-L248 PolarHBondContact OD1-N 3Å; D226-L248 VanDerWaalsContact OD1-N 3.15Å; I230-L248 HydrophobicContact CD1-CD2 3.89Å; L233-L248 HydrophobicContact CD1-CD1 4.35Å; L233-L248 HydrophobicContact CD2-CD1 3.68Å; L233-L248 HydrophobicContact CG-CD1 4.46Å; L246-L248 HydrophobicContact CD1-CD1 3.84Å; L246-L248 HydrophobicContact CD1-CD2 4.21Å; L246-L248 HydrophobicContact CD1-CG 3.84Å; L246-L248 HydrophobicContact CD2-CD1 3.84Å; L246-L248 HydrophobicContact CG-CD1 3.78Å; L246-L248 HydrophobicContact CG-CG 3.98Å; L248-N251 PolarHBondContact O-ND2 2.92Å; L248-N251 VanDerWaalsContact O-ND2 3.09Å; L248-I253 HydrophobicContact CB-CD1 4.17Å; L248-I253 HydrophobicContact CD1-CD1 4.2Å; L248-D272 CarbonylContact C-O 3.56Å; L248-D272 WeakPolarHBondContact CA-O 3.38Å; L248-D272 WeakPolarHBondContact CB-O 3.27Å; L248-D272 PolarHBondContact N-O 3.09Å; L248-L273 HydrophobicContact CB-CD2 4.05Å; L248-L273 HydrophobicContact CD1-CD2 3.95Å; L248-N276 PolarHBondContact O-ND2 2.99Å
249	S	97.1	Very high	90.6	Very high	11 Å²	11	46.2 Å²	46.2	8%	0.077	24%	0.243	C	C	.	.			trans	-62.6	154.8	177.6	64.4	0	0	0	0	111.4	D226 F227 N251 S274	D226-S249 CarbonylContact C-O 3.24Å; D226-S249 WeakPolarHBondContact CA-O 3.24Å; D226-S249 WeakPolarHBondContact CB-OG 3.42Å; D226-S249 WeakPolarHBondContact OD1-CB 3.03Å; D226-S249 PolarHBondContact OD1-N 3.13Å; D226-S249 PolarHBondContact OD1-OG 3.38Å; F227-S249 PolarHBondContact N-O 3.38Å; S249-N251 PolarHBondContact O-N 3.14Å; S249-N251 PolarHBondContact O-ND2 2.88Å; S249-N251 VanDerWaalsContact O-ND2 3.12Å; S249-S274 CarbonylContact C-O 3.25Å; S249-S274 WeakPolarHBondContact CA-O 3.22Å; S249-S274 WeakPolarHBondContact CB-OG 3.44Å
250	H	97.8	Very high	89.8	Confident	67 Å²	67	49.4 Å²	49.4	31%	0.31	26%	0.257	S	S	.	.	S	Bend	trans	53.2	52.3	178.3	-63.6	-84.9	0	0	0	112.9	F227 N228 S274 Y275	F227-H250 VanDerWaalsContact CA-O 3.3Å; F227-H250 WeakPolarHBondContact CA-O 3.03Å; F227-H250 HydrophobicContact CD1-CB 3.55Å; F227-H250 AromaticContact CD1-CG 3.79Å; F227-H250 HydrophobicContact CD2-CB 4.38Å; F227-H250 HydrophobicContact CE1-CB 3.72Å; F227-H250 AromaticContact CE1-CD2 3.42Å; F227-H250 VanDerWaalsContact CE1-CD2 3.42Å; F227-H250 WeakPolarHBondContact CE1-CD2 3.29Å; F227-H250 AromaticContact CE1-CG 3.38Å; F227-H250 AromaticContact CE1-ND1 3.8Å; F227-H250 AromaticContact CE1-NE2 3.84Å; F227-H250 AromaticContact CE2-CD2 3.71Å; F227-H250 HydrophobicContact CG-CB 3.91Å; F227-H250 HydrophobicContact CZ-CB 4.21Å; F227-H250 AromaticContact CZ-CD2 3.16Å; F227-H250 WeakPolarHBondContact CZ-CD2 3.2Å; F227-H250 AromaticContact CZ-CG 3.66Å; F227-H250 AromaticContact CZ-NE2 3.56Å; F227-H250 PolarHBondContact N-O 2.95Å; N228-H250 PolarHBondContact N-O 2.95Å; H250-S274 PolarHBondContact N-O 3.44Å; H250-S274 VanDerWaalsContact N-O 3.09Å; H250-Y275 WeakPolarHBondContact CA-O 3.41Å; H250-Y275 AromaticContact CE1-CD1 3.52Å; H250-Y275 AromaticContact CE1-CD2 3.51Å; H250-Y275 AromaticContact CE1-CE1 3.95Å; H250-Y275 AromaticContact CE1-CE2 3.94Å; H250-Y275 AromaticContact CE1-CG 3.27Å; H250-Y275 PolarHBondContact N-O 3.49Å; H250-Y275 WeakPolarHBondContact ND1-CB 2.96Å; H250-Y275 AromaticContact ND1-CD1 3.97Å; H250-Y275 AromaticContact ND1-CG 3.63Å; H250-Y275 AromaticContact NE2-CD2 3.41Å; H250-Y275 WeakPolarHBondContact NE2-CD2 3.2Å; H250-Y275 AromaticContact NE2-CE2 3.8Å; H250-Y275 AromaticContact NE2-CG 3.66Å
251	N	96.7	Very high	89.2	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.059	28%	0.275	C	S	.	.	S	Bend	trans	-120.5	-168	173.5	-86.4	-80.6	0	0	0	110	A225 N228 K229 I230 L248 S249 I253 Y275 N276	A225-N251 PolarHBondContact O-ND2 2.78Å; N228-N251 WeakPolarHBondContact CA-OD1 3.45Å; N228-N251 WeakPolarHBondContact CB-OD1 3.39Å; N228-N251 PolarHBondContact N-OD1 2.85Å; N228-N251 PolarHBondContact O-OD1 2.93Å; K229-N251 PolarHBondContact N-OD1 3.27Å; I230-N251 HydrophobicContact CB-CB 4.24Å; I230-N251 VanDerWaalsContact CB-OD1 3.25Å; I230-N251 WeakPolarHBondContact CB-OD1 3.19Å; I230-N251 WeakPolarHBondContact CD1-OD1 3.36Å; I230-N251 WeakPolarHBondContact CG1-OD1 3.22Å; I230-N251 PolarHBondContact N-OD1 2.87Å; L248-N251 PolarHBondContact O-ND2 2.92Å; L248-N251 VanDerWaalsContact O-ND2 3.09Å; S249-N251 PolarHBondContact O-N 3.14Å; S249-N251 PolarHBondContact O-ND2 2.88Å; S249-N251 VanDerWaalsContact O-ND2 3.12Å; N251-I253 HydrophobicContact CB-CD1 4.46Å; N251-I253 HydrophobicContact CB-CG1 4.21Å; N251-Y275 PolarHBondContact N-O 2.99Å; N251-N276 WeakPolarHBondContact CA-OD1 3.49Å; N251-N276 WeakPolarHBondContact CB-OD1 3.23Å; N251-N276 PolarHBondContact O-OD1 3.06Å
252	C	94.1	Very high	88.9	Confident	66 Å²	66	48 Å²	48	45%	0.446	25%	0.248	S	C	.	.			trans	-116	31.8	-179.3	-66.7	0	0	0	0	112	I230 T231 T254 N276	I230-C252 CarbonylContact O-C 3.57Å; I230-C252 VanDerWaalsContact O-CA 3.3Å; I230-C252 WeakPolarHBondContact O-CA 3.34Å; I230-C252 PolarHBondContact O-N 3.01Å; T231-C252 WeakPolarHBondContact CA-O 3.41Å; T231-C252 HydrophobicContact CG2-CB 4.14Å; C252-T254 PolarHBondContact O-N 3.12Å; C252-N276 PolarHBondContact N-OD1 2.87Å
253	I	94	Very high	88.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	S	.	.			trans	-72.4	105.1	-175.5	-54.7	171.4	0	0	0	108.8	I230 L248 N251 L273 N276 G277 L278	I230-I253 HydrophobicContact CG2-CD1 4.45Å; I230-I253 HydrophobicContact CG2-CG1 4.24Å; I230-I253 WeakPolarHBondContact O-CG1 3.36Å; I230-I253 PolarHBondContact O-N 2.79Å; L248-I253 HydrophobicContact CB-CD1 4.17Å; L248-I253 HydrophobicContact CD1-CD1 4.2Å; N251-I253 HydrophobicContact CB-CD1 4.46Å; N251-I253 HydrophobicContact CB-CG1 4.21Å; I253-L273 HydrophobicContact CD1-CD2 3.82Å; I253-N276 HydrophobicContact CB-CB 4.25Å; I253-N276 VanDerWaalsContact CB-OD1 3.29Å; I253-N276 WeakPolarHBondContact CB-OD1 3.3Å; I253-N276 VanDerWaalsContact CG1-OD1 3.3Å; I253-N276 WeakPolarHBondContact CG1-OD1 3.44Å; I253-N276 PolarHBondContact N-OD1 2.88Å; I253-G277 CarbonylContact O-C 3.17Å; I253-G277 VanDerWaalsContact O-C 3.32Å; I253-G277 WeakPolarHBondContact O-CA 3.32Å; I253-G277 PolarHBondContact O-N 3.45Å; I253-L278 HydrophobicContact CG2-CD2 3.81Å; I253-L278 HydrophobicContact CG2-CG 4.45Å; I253-L278 PolarHBondContact O-N 2.9Å
254	T	88	Confident	87.9	Confident	81 Å²	81	53.5 Å²	53.5	50%	0.497	27%	0.27	S	S	.	.			trans	-117.2	-19.9	-178.9	46.2	0	0	0	0	112.2	C252	C252-T254 PolarHBondContact O-N 3.12Å
255	Q	81.4	Confident	87.6	Confident	115 Å²	115	51.7 Å²	51.7	54%	0.537	26%	0.261	S	S	.	.	S	Bend	trans	-74.7	144.6	179.6	-67.4	-167.8	-13.4	0	0	111.5	S232 I257	S232-Q255 VanDerWaalsContact CB-OE1 3.22Å; Q255-I257 PolarHBondContact O-N 3.26Å
256	P	78.5	Confident	87.1	Confident	94 Å²	94	52 Å²	52	61%	0.61	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-57.5	135.2	174	-22.1	31.9	0	0	0	111.8	F280	P256-F280 HydrophobicContact CB-CD1 4.41Å
257	I	82.3	Confident	87	Confident	7 Å²	7	56.6 Å²	56.6	4%	0.036	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-76.7	128.5	176.5	-55.4	172.7	0	0	0	109.2	L233 F238 Q255 G259 L262 L273 L278 P282	L233-I257 HydrophobicContact CD1-CD1 4.35Å; L233-I257 HydrophobicContact CD1-CG1 4.43Å; L233-I257 HydrophobicContact CD1-CG2 4.4Å; F238-I257 HydrophobicContact CE1-CG2 4.38Å; F238-I257 HydrophobicContact CZ-CG2 4.02Å; Q255-I257 PolarHBondContact O-N 3.26Å; I257-G259 PolarHBondContact O-N 3.01Å; I257-L262 HydrophobicContact CG2-CD1 3.41Å; I257-L262 VanDerWaalsContact CG2-CD1 3.41Å; I257-L273 HydrophobicContact CD1-CD1 3.68Å; I257-L278 HydrophobicContact CD1-CD1 4.21Å; I257-L278 HydrophobicContact CD1-CD2 4.16Å; I257-L278 HydrophobicContact CG1-CD2 4.12Å; I257-P282 HydrophobicContact CB-CG 4.22Å; I257-P282 HydrophobicContact CG2-CG 4.5Å
258	S	75.3	Confident	86.8	Confident	40 Å²	40	53.4 Å²	53.4	28%	0.28	28%	0.277	S	S	.	.			trans	-64.9	102.6	-178.7	-176.8	0	0	0	0	112.3	I260 R261 L262	S258-I260 VanDerWaalsContact C-N 3.31Å; S258-I260 PolarHBondContact O-N 2.88Å; S258-R261 PolarHBondContact O-N 3.5Å; S258-L262 PolarHBondContact O-N 2.83Å
259	G	70.3	Confident	86.7	Confident	19 Å²	19	56 Å²	56	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-35.2	-177.5	0	0	0	0	0	114.2	I257 R261 V284	I257-G259 PolarHBondContact O-N 3.01Å; G259-R261 VanDerWaalsContact C-N 3.33Å; G259-R261 PolarHBondContact O-N 3.16Å; G259-V284 WeakPolarHBondContact O-CB 3.14Å; G259-V284 WeakPolarHBondContact O-CG1 3.42Å; G259-V284 WeakPolarHBondContact O-CG2 3.36Å
260	I	69.7	Low	86.7	Confident	127 Å²	127	56.4 Å²	56.4	65%	0.651	29%	0.29	S	S	*	.	H	α-helix	trans	-67.1	-34.1	-175.6	-62.9	169.3	0	0	0	112.1	S258 K263	S258-I260 VanDerWaalsContact C-N 3.31Å; S258-I260 PolarHBondContact O-N 2.88Å; I260-K263 VanDerWaalsContact O-CD 3.3Å; I260-K263 WeakPolarHBondContact O-CD 3.1Å; I260-K263 VanDerWaalsContact O-CE 3.24Å; I260-K263 WeakPolarHBondContact O-CE 3.46Å; I260-K263 VanDerWaalsContact O-CG 3.29Å; I260-K263 WeakPolarHBondContact O-CG 3.18Å
261	R	80.5	Confident	86.6	Confident	101 Å²	101	53.4 Å²	53.4	38%	0.381	28%	0.276	S	S	.	.	H	α-helix	trans	-92	-26.2	-177.6	-71.7	-165.9	166.5	102.7	-10.7	113.1	D235 F238 S258 G259 K263 Y264	D235-R261 VanDerWaalsContact CG-CZ 3.47Å; D235-R261 IonicContact OD1-CZ 2.77Å; D235-R261 IonicContact OD1-NE 3.2Å; D235-R261 IonicContact OD1-NH1 3.92Å; D235-R261 PolarHBondContact OD1-NH1 3.12Å; D235-R261 IonicContact OD2-CZ 2.76Å; D235-R261 IonicContact OD2-NH1 2.63Å; D235-R261 PolarHBondContact OD2-NH1 3.2Å; D235-R261 IonicContact OD2-NH2 3.91Å; F238-R261 HydrophobicContact CB-CB 3.8Å; F238-R261 HydrophobicContact CD1-CB 4.32Å; F238-R261 HydrophobicContact CD2-CB 3.57Å; F238-R261 HydrophobicContact CD2-CG 4.46Å; F238-R261 HydrophobicContact CE2-CB 4.23Å; F238-R261 HydrophobicContact CG-CB 3.63Å; S258-R261 PolarHBondContact O-N 3.5Å; G259-R261 VanDerWaalsContact C-N 3.33Å; G259-R261 PolarHBondContact O-N 3.16Å; R261-K263 PolarHBondContact O-N 3.18Å; R261-K263 VanDerWaalsContact O-N 3.14Å; R261-Y264 HydrophobicContact CB-CD2 4.23Å; R261-Y264 HydrophobicContact CB-CE2 4.39Å; R261-Y264 HydrophobicContact CG-CE2 4.24Å; R261-Y264 WeakPolarHBondContact O-CB 3.1Å; R261-Y264 WeakPolarHBondContact O-CD2 3.26Å; R261-Y264 PolarHBondContact O-N 3.41Å
262	L	84.8	Confident	86.7	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-30.4	178.9	-164.9	136.3	0	0	0	112.7	F238 I257 S258 Y264 L265 V284 I285 L288	F238-L262 HydrophobicContact CD1-CB 4.44Å; F238-L262 HydrophobicContact CE1-CB 4.06Å; F238-L262 HydrophobicContact CE1-CD1 4.22Å; F238-L262 HydrophobicContact CE1-CG 4.31Å; I257-L262 HydrophobicContact CG2-CD1 3.41Å; I257-L262 VanDerWaalsContact CG2-CD1 3.41Å; S258-L262 PolarHBondContact O-N 2.83Å; L262-Y264 PolarHBondContact O-N 2.94Å; L262-L265 PolarHBondContact O-N 3.11Å; L262-L265 VanDerWaalsContact O-N 3.13Å; L262-V284 HydrophobicContact CB-CG1 4.48Å; L262-V284 HydrophobicContact CD2-CG1 4.24Å; L262-I285 HydrophobicContact CD2-CB 3.96Å; L262-I285 HydrophobicContact CD2-CG1 4.07Å; L262-L288 HydrophobicContact CD2-CD1 3.74Å; L262-L288 HydrophobicContact CD2-CD2 4.18Å; L262-L288 HydrophobicContact CD2-CG 4Å; L262-L288 WeakPolarHBondContact O-CD2 3.36Å
263	K	82.9	Confident	86.8	Confident	98 Å²	98	50.4 Å²	50.4	43%	0.426	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-12.1	173.8	78.9	-173.4	-179.6	175.8	0	115.4	I260 R261 N266 V284	I260-K263 VanDerWaalsContact O-CD 3.3Å; I260-K263 WeakPolarHBondContact O-CD 3.1Å; I260-K263 VanDerWaalsContact O-CE 3.24Å; I260-K263 WeakPolarHBondContact O-CE 3.46Å; I260-K263 VanDerWaalsContact O-CG 3.29Å; I260-K263 WeakPolarHBondContact O-CG 3.18Å; R261-K263 PolarHBondContact O-N 3.18Å; R261-K263 VanDerWaalsContact O-N 3.14Å; K263-N266 PolarHBondContact O-OD1 2.72Å; K263-V284 HydrophobicContact CB-CG1 3.74Å
264	Y	85.3	Confident	86.9	Confident	105 Å²	105	50.8 Å²	50.8	41%	0.412	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-12.8	179.4	-61.5	-52.6	0	0	0	113.1	R261 L262 N266	R261-Y264 HydrophobicContact CB-CD2 4.23Å; R261-Y264 HydrophobicContact CB-CE2 4.39Å; R261-Y264 HydrophobicContact CG-CE2 4.24Å; R261-Y264 WeakPolarHBondContact O-CB 3.1Å; R261-Y264 WeakPolarHBondContact O-CD2 3.26Å; R261-Y264 PolarHBondContact O-N 3.41Å; L262-Y264 PolarHBondContact O-N 2.94Å; Y264-N266 PolarHBondContact O-N 3.19Å
265	L	90.8	Very high	87.4	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	25%	0.251	C	S	.	.			trans	-83.9	55.3	178.2	-54.1	-175	0	0	0	110.9	F237 F238 I243 L262 H267 L268	F237-L265 HydrophobicContact CE1-CD1 4.09Å; F238-L265 HydrophobicContact CD1-CD1 4.01Å; F238-L265 HydrophobicContact CD1-CG 4.25Å; F238-L265 HydrophobicContact CE1-CD1 4.45Å; I243-L265 HydrophobicContact CG2-CB 4.45Å; I243-L265 HydrophobicContact CG2-CD1 4.39Å; I243-L265 HydrophobicContact CG2-CD2 3.88Å; I243-L265 HydrophobicContact CG2-CG 4.47Å; L262-L265 PolarHBondContact O-N 3.11Å; L262-L265 VanDerWaalsContact O-N 3.13Å; L265-H267 PolarHBondContact O-N 2.87Å; L265-L268 HydrophobicContact CB-CB 4.12Å; L265-L268 HydrophobicContact CB-CD2 4.44Å; L265-L268 HydrophobicContact CD1-CD2 4.33Å; L265-L268 VanDerWaalsContact O-CB 3.27Å; L265-L268 WeakPolarHBondContact O-CB 3.19Å; L265-L268 PolarHBondContact O-N 2.76Å; L265-L268 VanDerWaalsContact O-N 3.12Å
266	N	88.4	Confident	88.1	Confident	77 Å²	77	46.5 Å²	46.5	41%	0.412	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.5	-170.9	-71.7	-22.6	0	0	0	114.1	K263 Y264 P289 C290	K263-N266 PolarHBondContact O-OD1 2.72Å; Y264-N266 PolarHBondContact O-N 3.19Å; N266-P289 HydrophobicContact CB-CG 4.24Å; N266-P289 WeakPolarHBondContact O-CG 3.5Å; N266-C290 WeakPolarHBondContact O-CB 3.3Å; N266-C290 PolarHBondContact O-SG 3.42Å; N266-C290 VanDerWaalsContact O-SG 3.32Å
267	H	93.3	Very high	88.7	Confident	97 Å²	97	42.7 Å²	42.7	45%	0.449	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-1.7	-179.6	-65.4	-75.5	0	0	0	113.3	K241 I243 E244 L265 K269	K241-H267 PolarHBondContact O-CD2 2.98Å; K241-H267 VanDerWaalsContact O-CD2 3.28Å; I243-H267 CarbonylContact O-C 3.42Å; I243-H267 VanDerWaalsContact O-C 3.24Å; E244-H267 WeakPolarHBondContact CA-O 3.29Å; E244-H267 HydrophobicContact CG-CB 4.25Å; L265-H267 PolarHBondContact O-N 2.87Å; H267-K269 PolarHBondContact O-N 3.14Å
268	L	94.7	Very high	89.2	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	21%	0.206	C	C	.	.			trans	-65.8	118.6	-175.8	-168.8	71.2	0	0	0	110.7	I243 L246 L265 I271 L288 C290 L291	I243-L268 HydrophobicContact CG2-CD1 4.01Å; I243-L268 WeakPolarHBondContact O-CA 3.27Å; I243-L268 PolarHBondContact O-N 3.39Å; I243-L268 VanDerWaalsContact O-N 3.16Å; L246-L268 HydrophobicContact CB-CD1 3.9Å; L265-L268 HydrophobicContact CB-CB 4.12Å; L265-L268 HydrophobicContact CB-CD2 4.44Å; L265-L268 HydrophobicContact CD1-CD2 4.33Å; L265-L268 VanDerWaalsContact O-CB 3.27Å; L265-L268 WeakPolarHBondContact O-CB 3.19Å; L265-L268 PolarHBondContact O-N 2.76Å; L265-L268 VanDerWaalsContact O-N 3.12Å; L268-I271 HydrophobicContact CD2-CB 4.02Å; L268-I271 HydrophobicContact CD2-CD1 4.16Å; L268-I271 HydrophobicContact CD2-CG2 4.48Å; L268-L288 HydrophobicContact CB-CD1 4.39Å; L268-L288 HydrophobicContact CD2-CD1 3.78Å; L268-C290 CarbonylContact O-C 3.24Å; L268-L291 HydrophobicContact CG-CD1 4.48Å; L268-L291 VanDerWaalsContact O-CA 3.26Å; L268-L291 WeakPolarHBondContact O-CA 3.41Å; L268-L291 PolarHBondContact O-N 3.32Å; L268-L291 VanDerWaalsContact O-N 3.15Å
269	K	95.5	Very high	89.8	Confident	55 Å²	55	43.6 Å²	43.6	24%	0.239	21%	0.214	C	C	.	.			trans	-101	-44	178.6	-66.6	173.4	-177	162.1	0	111.7	E244 Y245 H267 C290 Q292 T293	E244-K269 HydrophobicContact CB-CD 4.4Å; E244-K269 WeakPolarHBondContact O-CA 3.44Å; E244-K269 PolarHBondContact O-N 3.14Å; E244-K269 IonicContact OE1-NZ 3.9Å; E244-K269 WeakPolarHBondContact OE2-CE 3.49Å; E244-K269 IonicContact OE2-NZ 3.37Å; E244-K269 PolarHBondContact OE2-NZ 3.28Å; Y245-K269 HydrophobicContact CE2-CD 4.43Å; H267-K269 PolarHBondContact O-N 3.14Å; K269-C290 WeakPolarHBondContact CA-O 3.5Å; K269-C290 HydrophobicContact CG-CB 4.38Å; K269-Q292 WeakPolarHBondContact O-CA 3.49Å; K269-Q292 PolarHBondContact O-N 2.69Å; K269-T293 PolarHBondContact O-N 3.4Å
270	V	96.9	Very high	90.4	Very high	18 Å²	18	47.5 Å²	47.5	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128	-177.2	-179.2	0	0	0	0	109.3	E244 Y245 L246 Y247 T293	E244-V270 PolarHBondContact O-N 3.37Å; Y245-V270 HydrophobicContact CD1-CB 3.8Å; Y245-V270 HydrophobicContact CD1-CG2 3.64Å; Y245-V270 HydrophobicContact CE1-CB 4.4Å; Y245-V270 HydrophobicContact CE1-CG2 3.74Å; L246-V270 PolarHBondContact N-O 2.92Å; Y247-V270 HydrophobicContact CE1-CG1 3.95Å; V270-T293 WeakPolarHBondContact CA-O 3.47Å; V270-T293 HydrophobicContact CG1-CG2 4.39Å
271	I	96.1	Very high	91.2	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.5	168.1	-170.8	172.5	0	0	0	110.1	L246 L268 L273 I285 L291 T293 L294 K295	L246-I271 HydrophobicContact CB-CG1 4.39Å; L246-I271 HydrophobicContact CD2-CD1 3.94Å; L246-I271 HydrophobicContact CD2-CG1 4.05Å; L246-I271 HydrophobicContact CG-CG1 4.38Å; L246-I271 WeakPolarHBondContact O-CA 3.34Å; L268-I271 HydrophobicContact CD2-CB 4.02Å; L268-I271 HydrophobicContact CD2-CD1 4.16Å; L268-I271 HydrophobicContact CD2-CG2 4.48Å; I271-L273 HydrophobicContact CD1-CD1 3.67Å; I271-L273 HydrophobicContact CD1-CG 4.1Å; I271-L273 HydrophobicContact CG1-CD1 4.06Å; I271-L273 HydrophobicContact CG1-CG 4.02Å; I271-I285 HydrophobicContact CG2-CD1 4.44Å; I271-L291 HydrophobicContact CG2-CD1 3.95Å; I271-T293 PolarHBondContact N-O 3.24Å; I271-L294 HydrophobicContact CG2-CB 4.47Å; I271-L294 HydrophobicContact CG2-CD1 3.37Å; I271-K295 PolarHBondContact O-N 3.09Å
272	D	97.7	Very high	91.4	Very high	15 Å²	15	36.9 Å²	36.9	8%	0.08	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.2	175.6	-163.1	-24.8	0	0	0	109.6	L246 Y247 L248 S274 K295	L246-D272 PolarHBondContact O-N 2.69Å; Y247-D272 HydrophobicContact CD1-CB 3.87Å; L248-D272 CarbonylContact C-O 3.56Å; L248-D272 WeakPolarHBondContact CA-O 3.38Å; L248-D272 WeakPolarHBondContact CB-O 3.27Å; L248-D272 PolarHBondContact N-O 3.09Å; D272-S274 VanDerWaalsContact OD1-CB 3.23Å; D272-S274 WeakPolarHBondContact OD1-CB 3.26Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 3.21Å; D272-K295 HydrophobicContact CB-CB 4.4Å; D272-K295 HydrophobicContact CB-CD 4.5Å; D272-K295 VanDerWaalsContact OD2-CD 3.31Å; D272-K295 WeakPolarHBondContact OD2-CD 3.46Å
273	L	96.7	Very high	91.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.			trans	-120	20	177.7	-73.1	165.9	0	0	0	110.6	L248 I253 I257 I271 N276 L278 K295 L296 N299	L248-L273 HydrophobicContact CB-CD2 4.05Å; L248-L273 HydrophobicContact CD1-CD2 3.95Å; I253-L273 HydrophobicContact CD1-CD2 3.82Å; I257-L273 HydrophobicContact CD1-CD1 3.68Å; I271-L273 HydrophobicContact CD1-CD1 3.67Å; I271-L273 HydrophobicContact CD1-CG 4.1Å; I271-L273 HydrophobicContact CG1-CD1 4.06Å; I271-L273 HydrophobicContact CG1-CG 4.02Å; L273-N276 PolarHBondContact O-ND2 2.99Å; L273-L278 HydrophobicContact CB-CD1 4.01Å; L273-L278 HydrophobicContact CD1-CD1 4.1Å; L273-L278 HydrophobicContact CG-CD1 4.45Å; L273-K295 PolarHBondContact N-O 3.05Å; L273-L296 HydrophobicContact CB-CD2 3.77Å; L273-L296 HydrophobicContact CD1-CD2 3.99Å; L273-N299 PolarHBondContact O-ND2 2.95Å
274	S	97.1	Very high	91.5	Very high	7 Å²	7	37 Å²	37	5%	0.049	19%	0.187	C	C	.	.			trans	-60.9	156.6	179.5	60.4	0	0	0	0	112.5	S249 H250 D272 N276 D297	S249-S274 CarbonylContact C-O 3.25Å; S249-S274 WeakPolarHBondContact CA-O 3.22Å; S249-S274 WeakPolarHBondContact CB-OG 3.44Å; H250-S274 PolarHBondContact N-O 3.44Å; H250-S274 VanDerWaalsContact N-O 3.09Å; D272-S274 VanDerWaalsContact OD1-CB 3.23Å; D272-S274 WeakPolarHBondContact OD1-CB 3.26Å; D272-S274 PolarHBondContact OD1-N 3.11Å; D272-S274 PolarHBondContact OD1-OG 3.21Å; S274-N276 VanDerWaalsContact C-N 3.31Å; S274-N276 PolarHBondContact O-N 3.42Å; S274-N276 PolarHBondContact O-ND2 2.88Å; S274-D297 CarbonylContact C-O 3.42Å; S274-D297 WeakPolarHBondContact CA-O 3.27Å; S274-D297 VanDerWaalsContact CB-CG 3.41Å; S274-D297 WeakPolarHBondContact CB-OD1 3.47Å; S274-D297 WeakPolarHBondContact CB-OD2 3.39Å
275	Y	97.7	Very high	91.6	Very high	91 Å²	91	32 Å²	32	36%	0.357	17%	0.168	S	C	.	.	S	Bend	trans	51.4	48.8	178.3	-63.1	-89.9	0	0	0	113.2	H250 N251 D297 H298	H250-Y275 WeakPolarHBondContact CA-O 3.41Å; H250-Y275 AromaticContact CE1-CD1 3.52Å; H250-Y275 AromaticContact CE1-CD2 3.51Å; H250-Y275 AromaticContact CE1-CE1 3.95Å; H250-Y275 AromaticContact CE1-CE2 3.94Å; H250-Y275 AromaticContact CE1-CG 3.27Å; H250-Y275 PolarHBondContact N-O 3.49Å; H250-Y275 WeakPolarHBondContact ND1-CB 2.96Å; H250-Y275 AromaticContact ND1-CD1 3.97Å; H250-Y275 AromaticContact ND1-CG 3.63Å; H250-Y275 AromaticContact NE2-CD2 3.41Å; H250-Y275 WeakPolarHBondContact NE2-CD2 3.2Å; H250-Y275 AromaticContact NE2-CE2 3.8Å; H250-Y275 AromaticContact NE2-CG 3.66Å; N251-Y275 PolarHBondContact N-O 2.99Å; Y275-D297 WeakPolarHBondContact CE2-OD2 3.02Å; Y275-D297 PolarHBondContact N-O 2.94Å; Y275-H298 WeakPolarHBondContact CA-O 3.34Å; Y275-H298 HydrophobicContact CD1-CB 3.53Å; Y275-H298 AromaticContact CD1-CG 3.71Å; Y275-H298 HydrophobicContact CD2-CB 4.23Å; Y275-H298 HydrophobicContact CE1-CB 3.71Å; Y275-H298 AromaticContact CE1-CD2 3.37Å; Y275-H298 WeakPolarHBondContact CE1-CD2 3.31Å; Y275-H298 AromaticContact CE1-CE1 3.82Å; Y275-H298 AromaticContact CE1-CG 3.31Å; Y275-H298 AromaticContact CE1-ND1 3.62Å; Y275-H298 AromaticContact CE1-NE2 3.66Å; Y275-H298 HydrophobicContact CE2-CB 4.39Å; Y275-H298 AromaticContact CE2-CD2 3.62Å; Y275-H298 HydrophobicContact CG-CB 3.82Å; Y275-H298 AromaticContact CZ-CD2 3.09Å; Y275-H298 AromaticContact CZ-CG 3.58Å; Y275-H298 AromaticContact CZ-NE2 3.39Å; Y275-H298 PolarHBondContact N-O 3.47Å; Y275-H298 PolarHBondContact OH-CD2 2.9Å; Y275-H298 PolarHBondContact OH-NE2 3.49Å
276	N	95.7	Very high	91.4	Very high	16 Å²	16	32 Å²	32	9%	0.086	17%	0.168	C	C	.	.	S	Bend	trans	-118.7	-165	172.4	-83	-82.5	0	0	0	109.1	L248 N251 C252 I253 L273 S274 L278 H298 N299	L248-N276 PolarHBondContact O-ND2 2.99Å; N251-N276 WeakPolarHBondContact CA-OD1 3.49Å; N251-N276 WeakPolarHBondContact CB-OD1 3.23Å; N251-N276 PolarHBondContact O-OD1 3.06Å; C252-N276 PolarHBondContact N-OD1 2.87Å; I253-N276 HydrophobicContact CB-CB 4.25Å; I253-N276 VanDerWaalsContact CB-OD1 3.29Å; I253-N276 WeakPolarHBondContact CB-OD1 3.3Å; I253-N276 VanDerWaalsContact CG1-OD1 3.3Å; I253-N276 WeakPolarHBondContact CG1-OD1 3.44Å; I253-N276 PolarHBondContact N-OD1 2.88Å; L273-N276 PolarHBondContact O-ND2 2.99Å; S274-N276 VanDerWaalsContact C-N 3.31Å; S274-N276 PolarHBondContact O-N 3.42Å; S274-N276 PolarHBondContact O-ND2 2.88Å; N276-L278 HydrophobicContact CB-CG 4.48Å; N276-H298 PolarHBondContact N-O 3.39Å; N276-N299 WeakPolarHBondContact CA-OD1 3.47Å; N276-N299 WeakPolarHBondContact CB-OD1 3.33Å; N276-N299 PolarHBondContact N-OD1 2.84Å; N276-N299 PolarHBondContact O-OD1 3.21Å
277	G	90.9	Very high	91.1	Very high	14 Å²	14	29.5 Å²	29.5	14%	0.144	16%	0.156	C	C	.	.			trans	-118.4	29	177.7	0	0	0	0	0	112.8	I253 S279 N299	I253-G277 CarbonylContact O-C 3.17Å; I253-G277 VanDerWaalsContact O-C 3.32Å; I253-G277 WeakPolarHBondContact O-CA 3.32Å; I253-G277 PolarHBondContact O-N 3.45Å; G277-S279 PolarHBondContact O-N 3.11Å; G277-N299 PolarHBondContact N-OD1 3.15Å
278	L	93	Very high	90.9	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.135	C	C	.	.			trans	-65.8	127.1	-176.8	-69.4	169.5	0	0	0	110.2	I253 I257 L273 N276 L296 N299 N300 I301	I253-L278 HydrophobicContact CG2-CD2 3.81Å; I253-L278 HydrophobicContact CG2-CG 4.45Å; I253-L278 PolarHBondContact O-N 2.9Å; I257-L278 HydrophobicContact CD1-CD1 4.21Å; I257-L278 HydrophobicContact CD1-CD2 4.16Å; I257-L278 HydrophobicContact CG1-CD2 4.12Å; L273-L278 HydrophobicContact CB-CD1 4.01Å; L273-L278 HydrophobicContact CD1-CD1 4.1Å; L273-L278 HydrophobicContact CG-CD1 4.45Å; N276-L278 HydrophobicContact CB-CG 4.48Å; L278-L296 HydrophobicContact CD1-CD2 3.92Å; L278-N299 HydrophobicContact CB-CB 4.29Å; L278-N299 WeakPolarHBondContact CB-OD1 3.3Å; L278-N299 PolarHBondContact N-OD1 2.97Å; L278-N300 CarbonylContact O-C 3.46Å; L278-N300 VanDerWaalsContact O-CA 3.32Å; L278-N300 WeakPolarHBondContact O-CA 2.91Å; L278-N300 PolarHBondContact O-N 2.87Å; L278-I301 HydrophobicContact CB-CG1 4.46Å; L278-I301 WeakPolarHBondContact O-CG1 3.4Å; L278-I301 PolarHBondContact O-N 3.35Å
279	S	88.2	Confident	90.5	Very high	64 Å²	64	26.6 Å²	26.6	45%	0.448	15%	0.146	S	C	.	.			trans	-105.1	-14	174.1	55.8	0	0	0	0	113.6	G277 N300	G277-S279 PolarHBondContact O-N 3.11Å; S279-N300 WeakPolarHBondContact CA-O 3.43Å
280	F	83.5	Confident	90.3	Very high	101 Å²	101	26.4 Å²	26.4	44%	0.443	15%	0.151	S	C	.	.	B	Isolated β-bridge	trans	-140.3	140.8	-175.3	179.3	-94.6	0	0	0	111.4	P256 P282	P256-F280 HydrophobicContact CB-CD1 4.41Å; F280-P282 HydrophobicContact CE1-CB 4.42Å
281	L	85.4	Confident	90.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.			trans	-123.3	124.9	178.6	-166.5	73.7	0	0	0	111.2	I285 F286 L296	L281-I285 HydrophobicContact CD1-CD1 4.05Å; L281-I285 HydrophobicContact CD1-CG2 4.19Å; L281-I285 HydrophobicContact CD2-CG2 3.94Å; L281-I285 HydrophobicContact CG-CG2 3.88Å; L281-F286 HydrophobicContact CD2-CE1 4.31Å; L281-F286 HydrophobicContact CD2-CE2 3.52Å; L281-F286 HydrophobicContact CD2-CZ 3.31Å; L281-F286 HydrophobicContact CG-CE2 4.35Å; L281-L296 HydrophobicContact CD1-CD1 3.57Å; L281-L296 HydrophobicContact CD1-CD2 3.91Å; L281-L296 HydrophobicContact CD1-CG 4.42Å; L281-L296 HydrophobicContact CD2-CD1 3.5Å; L281-L296 HydrophobicContact CG-CD1 4.18Å
282	P	85.3	Confident	90.1	Very high	6 Å²	6	28.9 Å²	28.9	4%	0.039	16%	0.162	C	C	.	.			trans	-73	138.2	-179.9	29	-33.8	0	0	0	112	I257 F280 V284 I285	I257-P282 HydrophobicContact CB-CG 4.22Å; I257-P282 HydrophobicContact CG2-CG 4.5Å; F280-P282 HydrophobicContact CE1-CB 4.42Å; P282-V284 PolarHBondContact O-N 2.83Å; P282-I285 VanDerWaalsContact O-CG2 3.27Å; P282-I285 WeakPolarHBondContact O-CG2 3.42Å; P282-I285 PolarHBondContact O-N 2.9Å; P282-I285 VanDerWaalsContact O-N 3.13Å
283	T	84	Confident	90	Very high	72 Å²	72	29.6 Å²	29.6	44%	0.442	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-46.3	-37.4	174.4	43.7	0	0	0	0	113.6	I285 F286 P305	T283-I285 PolarHBondContact O-N 3.49Å; T283-F286 PolarHBondContact O-N 3.31Å; T283-P305 HydrophobicContact CG2-CB 3.34Å; T283-P305 HydrophobicContact CG2-CG 4.14Å
284	V	84.9	Confident	90	Very high	31 Å²	31	29.6 Å²	29.6	19%	0.188	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-62.1	-27.1	-173.9	177.7	0	0	0	0	112.9	G259 L262 K263 P282 F286 S287	G259-V284 WeakPolarHBondContact O-CB 3.14Å; G259-V284 WeakPolarHBondContact O-CG1 3.42Å; G259-V284 WeakPolarHBondContact O-CG2 3.36Å; L262-V284 HydrophobicContact CB-CG1 4.48Å; L262-V284 HydrophobicContact CD2-CG1 4.24Å; K263-V284 HydrophobicContact CB-CG1 3.74Å; P282-V284 PolarHBondContact O-N 2.83Å; V284-F286 PolarHBondContact O-N 2.83Å; V284-S287 WeakPolarHBondContact CA-OG 3.44Å; V284-S287 WeakPolarHBondContact O-CB 3.38Å; V284-S287 PolarHBondContact O-N 2.97Å; V284-S287 PolarHBondContact O-OG 2.86Å
285	I	88.3	Confident	90.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-59.9	-35.1	179.9	-159.6	167.7	0	0	0	111.9	L262 I271 L281 P282 T283 S287 L288 L291 L294	L262-I285 HydrophobicContact CD2-CB 3.96Å; L262-I285 HydrophobicContact CD2-CG1 4.07Å; I271-I285 HydrophobicContact CG2-CD1 4.44Å; L281-I285 HydrophobicContact CD1-CD1 4.05Å; L281-I285 HydrophobicContact CD1-CG2 4.19Å; L281-I285 HydrophobicContact CD2-CG2 3.94Å; L281-I285 HydrophobicContact CG-CG2 3.88Å; P282-I285 VanDerWaalsContact O-CG2 3.27Å; P282-I285 WeakPolarHBondContact O-CG2 3.42Å; P282-I285 PolarHBondContact O-N 2.9Å; P282-I285 VanDerWaalsContact O-N 3.13Å; T283-I285 PolarHBondContact O-N 3.49Å; I285-S287 VanDerWaalsContact C-N 3.25Å; I285-S287 PolarHBondContact O-N 3.04Å; I285-L288 HydrophobicContact CG1-CD1 4.49Å; I285-L291 HydrophobicContact CG1-CD2 4.47Å; I285-L291 VanDerWaalsContact O-CD2 3.27Å; I285-L291 WeakPolarHBondContact O-CD2 3.45Å; I285-L294 HydrophobicContact CD1-CD1 3.56Å; I285-L294 HydrophobicContact CD1-CD2 4.29Å; I285-L294 HydrophobicContact CG1-CD1 4.29Å; I285-L294 HydrophobicContact CG1-CD2 4.42Å; I285-L294 HydrophobicContact CG2-CD2 4.26Å
286	F	85.9	Confident	90	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-76.3	-12.6	178.2	-59.5	-70.8	0	0	0	113.6	L281 T283 V284 L294 P305 L307 I321 L335 I338	L281-F286 HydrophobicContact CD2-CE1 4.31Å; L281-F286 HydrophobicContact CD2-CE2 3.52Å; L281-F286 HydrophobicContact CD2-CZ 3.31Å; L281-F286 HydrophobicContact CG-CE2 4.35Å; T283-F286 PolarHBondContact O-N 3.31Å; V284-F286 PolarHBondContact O-N 2.83Å; F286-L294 HydrophobicContact CD1-CD2 4.28Å; F286-L294 HydrophobicContact CE1-CD2 3.79Å; F286-L294 HydrophobicContact CZ-CD2 4.41Å; F286-P305 HydrophobicContact CD2-CG 4.13Å; F286-P305 HydrophobicContact CE2-CG 3.65Å; F286-L307 HydrophobicContact CB-CD1 4.18Å; F286-L307 HydrophobicContact CB-CD2 3.94Å; F286-L307 HydrophobicContact CD1-CD1 4.27Å; F286-L307 HydrophobicContact CD2-CD1 3.97Å; F286-L307 HydrophobicContact CD2-CD2 3.78Å; F286-L307 HydrophobicContact CD2-CG 4.36Å; F286-L307 HydrophobicContact CE2-CD1 4.38Å; F286-L307 HydrophobicContact CG-CD1 3.87Å; F286-L307 HydrophobicContact CG-CD2 4.09Å; F286-I321 HydrophobicContact CD1-CD1 4.22Å; F286-I321 HydrophobicContact CE1-CD1 4.06Å; F286-L335 HydrophobicContact CD1-CD1 4.03Å; F286-L335 HydrophobicContact CE1-CD1 3.51Å; F286-L335 HydrophobicContact CZ-CD1 3.95Å; F286-I338 HydrophobicContact CB-CD1 3.65Å; F286-I338 HydrophobicContact CD1-CD1 3.57Å; F286-I338 HydrophobicContact CG-CD1 3.9Å
287	S	82.9	Confident	90.1	Very high	25 Å²	25	28.5 Å²	28.5	18%	0.175	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-94.7	-5.5	-179.8	72.1	0	0	0	0	114.1	V284 I285 S311	V284-S287 WeakPolarHBondContact CA-OG 3.44Å; V284-S287 WeakPolarHBondContact O-CB 3.38Å; V284-S287 PolarHBondContact O-N 2.97Å; V284-S287 PolarHBondContact O-OG 2.86Å; I285-S287 VanDerWaalsContact C-N 3.25Å; I285-S287 PolarHBondContact O-N 3.04Å; S287-S311 WeakPolarHBondContact CA-O 3.21Å; S287-S311 WeakPolarHBondContact CB-O 3.34Å
288	L	88.7	Confident	90.4	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	17%	0.167	C	C	.	.			trans	-61.6	126.3	179.8	-72.5	178.8	0	0	0	110.8	L262 L268 I285 C290 L291	L262-L288 HydrophobicContact CD2-CD1 3.74Å; L262-L288 HydrophobicContact CD2-CD2 4.18Å; L262-L288 HydrophobicContact CD2-CG 4Å; L262-L288 WeakPolarHBondContact O-CD2 3.36Å; L268-L288 HydrophobicContact CB-CD1 4.39Å; L268-L288 HydrophobicContact CD2-CD1 3.78Å; I285-L288 HydrophobicContact CG1-CD1 4.49Å; L288-C290 PolarHBondContact O-N 3.43Å; L288-L291 HydrophobicContact CB-CB 3.83Å; L288-L291 HydrophobicContact CB-CD2 4.49Å; L288-L291 HydrophobicContact CD1-CD2 4.48Å; L288-L291 PolarHBondContact O-N 2.84Å
289	P	86.3	Confident	90.6	Very high	35 Å²	35	30.5 Å²	30.5	23%	0.227	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-32.7	-166	26.7	-33.8	0	0	0	113.3	N266 S314	N266-P289 HydrophobicContact CB-CG 4.24Å; N266-P289 WeakPolarHBondContact O-CG 3.5Å; P289-S314 WeakPolarHBondContact O-CB 3.41Å; P289-S314 PolarHBondContact O-OG 3.17Å
290	C	91.3	Very high	90.8	Very high	51 Å²	51	31.9 Å²	31.9	35%	0.345	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	2.1	-178.4	-65.9	0	0	0	0	114	N266 L268 K269 L288 Q292	N266-C290 WeakPolarHBondContact O-CB 3.3Å; N266-C290 PolarHBondContact O-SG 3.42Å; N266-C290 VanDerWaalsContact O-SG 3.32Å; L268-C290 CarbonylContact O-C 3.24Å; K269-C290 WeakPolarHBondContact CA-O 3.5Å; K269-C290 HydrophobicContact CG-CB 4.38Å; L288-C290 PolarHBondContact O-N 3.43Å; C290-Q292 PolarHBondContact O-N 2.94Å
291	L	93.7	Very high	91.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.149	C	C	.	.			trans	-68.5	122.1	-172.2	-170.8	69.5	0	0	0	111.2	L268 I271 I285 L288 L294 R312 I318	L268-L291 HydrophobicContact CG-CD1 4.48Å; L268-L291 VanDerWaalsContact O-CA 3.26Å; L268-L291 WeakPolarHBondContact O-CA 3.41Å; L268-L291 PolarHBondContact O-N 3.32Å; L268-L291 VanDerWaalsContact O-N 3.15Å; I271-L291 HydrophobicContact CG2-CD1 3.95Å; I285-L291 HydrophobicContact CG1-CD2 4.47Å; I285-L291 VanDerWaalsContact O-CD2 3.27Å; I285-L291 WeakPolarHBondContact O-CD2 3.45Å; L288-L291 HydrophobicContact CB-CB 3.83Å; L288-L291 HydrophobicContact CB-CD2 4.49Å; L288-L291 HydrophobicContact CD1-CD2 4.48Å; L288-L291 PolarHBondContact O-N 2.84Å; L291-L294 HydrophobicContact CD2-CB 4.32Å; L291-R312 PolarHBondContact O-NH2 3.36Å; L291-I318 HydrophobicContact CB-CG1 4.33Å; L291-I318 HydrophobicContact CD2-CD1 4.01Å; L291-I318 HydrophobicContact CD2-CG1 4.19Å; L291-I318 HydrophobicContact CG-CD1 4.49Å; L291-I318 HydrophobicContact CG-CG1 4.12Å; L291-I318 VanDerWaalsContact O-CG1 3.31Å; L291-I318 WeakPolarHBondContact O-CG1 3.38Å
292	Q	94.9	Very high	91.4	Very high	75 Å²	75	29.2 Å²	29.2	35%	0.35	16%	0.164	S	C	.	.			trans	-112.4	-32.4	-178.9	-68.5	175.5	-10.4	0	0	112.2	K269 C290 I318 Q319 L320	K269-Q292 WeakPolarHBondContact O-CA 3.49Å; K269-Q292 PolarHBondContact O-N 2.69Å; C290-Q292 PolarHBondContact O-N 2.94Å; Q292-I318 WeakPolarHBondContact O-CG2 3.3Å; Q292-Q319 HydrophobicContact CB-CG 4.35Å; Q292-Q319 WeakPolarHBondContact O-CA 3.06Å; Q292-Q319 WeakPolarHBondContact O-CB 3.49Å; Q292-Q319 PolarHBondContact O-N 3.21Å; Q292-L320 PolarHBondContact O-N 3.41Å; Q292-L320 VanDerWaalsContact O-N 3.14Å
293	T	96.7	Very high	91.3	Very high	30 Å²	30	34.4 Å²	34.4	18%	0.184	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	126.8	-178.5	-56.4	0	0	0	0	110.8	K269 V270 I271 K295 L320	K269-T293 PolarHBondContact O-N 3.4Å; V270-T293 WeakPolarHBondContact CA-O 3.47Å; V270-T293 HydrophobicContact CG1-CG2 4.39Å; I271-T293 PolarHBondContact N-O 3.24Å; T293-K295 HydrophobicContact CG2-CG 4.13Å; T293-L320 WeakPolarHBondContact CA-O 3.37Å; T293-L320 HydrophobicContact CG2-CB 4.26Å; T293-L320 HydrophobicContact CG2-CD2 4.05Å; T293-L320 HydrophobicContact CG2-CG 4.42Å
294	L	96.6	Very high	91.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110.6	175.7	173.4	58.2	0	0	0	108.7	I271 I285 F286 L291 L296 L320 I321 D322	I271-L294 HydrophobicContact CG2-CB 4.47Å; I271-L294 HydrophobicContact CG2-CD1 3.37Å; I285-L294 HydrophobicContact CD1-CD1 3.56Å; I285-L294 HydrophobicContact CD1-CD2 4.29Å; I285-L294 HydrophobicContact CG1-CD1 4.29Å; I285-L294 HydrophobicContact CG1-CD2 4.42Å; I285-L294 HydrophobicContact CG2-CD2 4.26Å; F286-L294 HydrophobicContact CD1-CD2 4.28Å; F286-L294 HydrophobicContact CE1-CD2 3.79Å; F286-L294 HydrophobicContact CZ-CD2 4.41Å; L291-L294 HydrophobicContact CD2-CB 4.32Å; L294-L296 HydrophobicContact CD1-CD1 3.78Å; L294-L296 HydrophobicContact CD1-CD2 4.45Å; L294-L296 HydrophobicContact CD1-CG 3.84Å; L294-L296 HydrophobicContact CD2-CD1 3.87Å; L294-L296 HydrophobicContact CG-CD1 3.78Å; L294-L296 HydrophobicContact CG-CG 4.13Å; L294-L320 PolarHBondContact N-O 2.98Å; L294-I321 HydrophobicContact CB-CG1 4.5Å; L294-I321 HydrophobicContact CD2-CG2 4.45Å; L294-I321 WeakPolarHBondContact O-CA 3.39Å; L294-D322 PolarHBondContact O-N 2.76Å
295	K	97.6	Very high	90.9	Very high	74 Å²	74	31.5 Å²	31.5	32%	0.322	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.9	174.7	-65.6	-179.8	169.4	-164.5	0	110.8	I271 D272 L273 T293 D322	I271-K295 PolarHBondContact O-N 3.09Å; D272-K295 HydrophobicContact CB-CB 4.4Å; D272-K295 HydrophobicContact CB-CD 4.5Å; D272-K295 VanDerWaalsContact OD2-CD 3.31Å; D272-K295 WeakPolarHBondContact OD2-CD 3.46Å; L273-K295 PolarHBondContact N-O 3.05Å; T293-K295 HydrophobicContact CG2-CG 4.13Å; K295-D322 HydrophobicContact CG-CB 4.33Å
296	L	96.7	Very high	90.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.209	C	C	.	.			trans	-137.3	17	-176.8	-72.2	165.1	0	0	0	111.1	L273 L278 L281 L294 N299 I301 D322 L323 N326	L273-L296 HydrophobicContact CB-CD2 3.77Å; L273-L296 HydrophobicContact CD1-CD2 3.99Å; L278-L296 HydrophobicContact CD1-CD2 3.92Å; L281-L296 HydrophobicContact CD1-CD1 3.57Å; L281-L296 HydrophobicContact CD1-CD2 3.91Å; L281-L296 HydrophobicContact CD1-CG 4.42Å; L281-L296 HydrophobicContact CD2-CD1 3.5Å; L281-L296 HydrophobicContact CG-CD1 4.18Å; L294-L296 HydrophobicContact CD1-CD1 3.78Å; L294-L296 HydrophobicContact CD1-CD2 4.45Å; L294-L296 HydrophobicContact CD1-CG 3.84Å; L294-L296 HydrophobicContact CD2-CD1 3.87Å; L294-L296 HydrophobicContact CG-CD1 3.78Å; L294-L296 HydrophobicContact CG-CG 4.13Å; L296-N299 PolarHBondContact O-ND2 2.78Å; L296-I301 HydrophobicContact CB-CD1 4.13Å; L296-I301 HydrophobicContact CD1-CD1 4.24Å; L296-I301 HydrophobicContact CD2-CD1 4.3Å; L296-I301 HydrophobicContact CG-CD1 4.48Å; L296-D322 CarbonylContact C-O 3.57Å; L296-D322 WeakPolarHBondContact CA-O 3.16Å; L296-D322 WeakPolarHBondContact CB-O 3.42Å; L296-D322 PolarHBondContact N-O 3.29Å; L296-L323 HydrophobicContact CB-CD2 3.9Å; L296-L323 HydrophobicContact CD1-CD2 3.75Å; L296-N326 PolarHBondContact O-ND2 3.3Å
297	D	97.2	Very high	89.3	Confident	17 Å²	17	37.9 Å²	37.9	9%	0.091	21%	0.212	C	C	.	.			trans	-61.8	153.9	179.4	56.4	-68.8	0	0	0	112.3	S274 Y275 N299 S324	S274-D297 CarbonylContact C-O 3.42Å; S274-D297 WeakPolarHBondContact CA-O 3.27Å; S274-D297 VanDerWaalsContact CB-CG 3.41Å; S274-D297 WeakPolarHBondContact CB-OD1 3.47Å; S274-D297 WeakPolarHBondContact CB-OD2 3.39Å; Y275-D297 WeakPolarHBondContact CE2-OD2 3.02Å; Y275-D297 PolarHBondContact N-O 2.94Å; D297-N299 PolarHBondContact O-N 3.47Å; D297-N299 PolarHBondContact O-ND2 2.98Å; D297-S324 WeakPolarHBondContact CA-O 3.49Å; D297-S324 VanDerWaalsContact CB-OG 3.26Å; D297-S324 WeakPolarHBondContact CB-OG 3.5Å
298	H	97.7	Very high	88.3	Confident	52 Å²	52	46.9 Å²	46.9	24%	0.241	24%	0.242	C	C	.	.	S	Bend	trans	54.4	52.5	-178.6	-67.9	-88.9	0	0	0	113.4	Y275 N276 S324 Y325	Y275-H298 WeakPolarHBondContact CA-O 3.34Å; Y275-H298 HydrophobicContact CD1-CB 3.53Å; Y275-H298 AromaticContact CD1-CG 3.71Å; Y275-H298 HydrophobicContact CD2-CB 4.23Å; Y275-H298 HydrophobicContact CE1-CB 3.71Å; Y275-H298 AromaticContact CE1-CD2 3.37Å; Y275-H298 WeakPolarHBondContact CE1-CD2 3.31Å; Y275-H298 AromaticContact CE1-CE1 3.82Å; Y275-H298 AromaticContact CE1-CG 3.31Å; Y275-H298 AromaticContact CE1-ND1 3.62Å; Y275-H298 AromaticContact CE1-NE2 3.66Å; Y275-H298 HydrophobicContact CE2-CB 4.39Å; Y275-H298 AromaticContact CE2-CD2 3.62Å; Y275-H298 HydrophobicContact CG-CB 3.82Å; Y275-H298 AromaticContact CZ-CD2 3.09Å; Y275-H298 AromaticContact CZ-CG 3.58Å; Y275-H298 AromaticContact CZ-NE2 3.39Å; Y275-H298 PolarHBondContact N-O 3.47Å; Y275-H298 PolarHBondContact OH-CD2 2.9Å; Y275-H298 PolarHBondContact OH-NE2 3.49Å; N276-H298 PolarHBondContact N-O 3.39Å; H298-S324 PolarHBondContact N-O 3Å; H298-S324 VanDerWaalsContact N-O 3.13Å; H298-Y325 WeakPolarHBondContact CA-O 3.46Å; H298-Y325 AromaticContact CD2-CD2 3.8Å; H298-Y325 AromaticContact CD2-CG 3.95Å; H298-Y325 AromaticContact CE1-CD1 3.32Å; H298-Y325 WeakPolarHBondContact CE1-CD1 3.32Å; H298-Y325 AromaticContact CE1-CD2 3.7Å; H298-Y325 AromaticContact CE1-CE1 3.52Å; H298-Y325 AromaticContact CE1-CE2 3.92Å; H298-Y325 AromaticContact CE1-CG 3.38Å; H298-Y325 AromaticContact CE1-CZ 3.8Å; H298-Y325 PolarHBondContact N-O 3.12Å; H298-Y325 AromaticContact ND1-CD1 3.82Å; H298-Y325 AromaticContact ND1-CG 3.71Å; H298-Y325 AromaticContact NE2-CD1 3.89Å; H298-Y325 AromaticContact NE2-CD2 3.38Å; H298-Y325 WeakPolarHBondContact NE2-CD2 3.35Å; H298-Y325 AromaticContact NE2-CE1 3.96Å; H298-Y325 AromaticContact NE2-CE2 3.5Å; H298-Y325 WeakPolarHBondContact NE2-CE2 3.46Å; H298-Y325 AromaticContact NE2-CG 3.56Å; H298-Y325 AromaticContact NE2-CZ 3.76Å
299	N	96.5	Very high	86.8	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	26%	0.258	C	S	.	.	S	Bend	trans	-123	-172.1	172.1	-82.9	-78.2	0	0	0	110.3	L273 N276 G277 L278 L296 D297 I301 Y325 N326	L273-N299 PolarHBondContact O-ND2 2.95Å; N276-N299 WeakPolarHBondContact CA-OD1 3.47Å; N276-N299 WeakPolarHBondContact CB-OD1 3.33Å; N276-N299 PolarHBondContact N-OD1 2.84Å; N276-N299 PolarHBondContact O-OD1 3.21Å; G277-N299 PolarHBondContact N-OD1 3.15Å; L278-N299 HydrophobicContact CB-CB 4.29Å; L278-N299 WeakPolarHBondContact CB-OD1 3.3Å; L278-N299 PolarHBondContact N-OD1 2.97Å; L296-N299 PolarHBondContact O-ND2 2.78Å; D297-N299 PolarHBondContact O-N 3.47Å; D297-N299 PolarHBondContact O-ND2 2.98Å; N299-I301 HydrophobicContact CB-CD1 4.36Å; N299-I301 HydrophobicContact CB-CG1 4.17Å; N299-Y325 PolarHBondContact N-O 3.32Å; N299-N326 WeakPolarHBondContact CA-OD1 3.34Å; N299-N326 WeakPolarHBondContact CB-OD1 3.46Å; N299-N326 PolarHBondContact O-OD1 2.69Å
300	N	93.3	Very high	85.4	Confident	93 Å²	93	52.5 Å²	52.5	50%	0.497	27%	0.274	S	S	.	.			trans	-111.4	28.5	179.8	-67.1	-37.5	0	0	0	112.3	L278 S279 S302	L278-N300 CarbonylContact O-C 3.46Å; L278-N300 VanDerWaalsContact O-CA 3.32Å; L278-N300 WeakPolarHBondContact O-CA 2.91Å; L278-N300 PolarHBondContact O-N 2.87Å; S279-N300 WeakPolarHBondContact CA-O 3.43Å; N300-S302 PolarHBondContact O-N 3.21Å
301	I	93.8	Very high	83.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.267	C	S	.	.			trans	-71.2	121.4	-175.1	-57.9	170.6	0	0	0	108.9	L278 L296 N299 L304 L323 N326 Q327 I328	L278-I301 HydrophobicContact CB-CG1 4.46Å; L278-I301 WeakPolarHBondContact O-CG1 3.4Å; L278-I301 PolarHBondContact O-N 3.35Å; L296-I301 HydrophobicContact CB-CD1 4.13Å; L296-I301 HydrophobicContact CD1-CD1 4.24Å; L296-I301 HydrophobicContact CD2-CD1 4.3Å; L296-I301 HydrophobicContact CG-CD1 4.48Å; N299-I301 HydrophobicContact CB-CD1 4.36Å; N299-I301 HydrophobicContact CB-CG1 4.17Å; I301-L304 HydrophobicContact CG2-CD2 4.23Å; I301-L323 HydrophobicContact CD1-CD2 4.2Å; I301-N326 HydrophobicContact CB-CB 4.36Å; I301-N326 VanDerWaalsContact CB-OD1 3.3Å; I301-N326 WeakPolarHBondContact CB-OD1 3.48Å; I301-N326 WeakPolarHBondContact CG1-OD1 3.25Å; I301-N326 PolarHBondContact N-OD1 2.97Å; I301-Q327 CarbonylContact O-C 3.51Å; I301-Q327 VanDerWaalsContact O-C 3.24Å; I301-Q327 WeakPolarHBondContact O-CA 3.32Å; I301-Q327 PolarHBondContact O-N 2.86Å; I301-I328 HydrophobicContact CG2-CG1 4.35Å; I301-I328 WeakPolarHBondContact O-CG1 3.35Å; I301-I328 PolarHBondContact O-N 2.97Å
302	S	88.1	Confident	82.3	Confident	45 Å²	45	52.9 Å²	52.9	32%	0.315	27%	0.273	S	S	.	.			trans	-107.6	-34.1	177.8	58.6	0	0	0	0	114.1	N300 Q327	N300-S302 PolarHBondContact O-N 3.21Å; S302-Q327 VanDerWaalsContact CA-O 3.28Å; S302-Q327 WeakPolarHBondContact CA-O 3.14Å
303	N	81.7	Confident	80.6	Confident	115 Å²	115	55.8 Å²	55.8	62%	0.615	29%	0.289	S	S	*	.	B	Isolated β-bridge	trans	-120	122	-178.5	-69.7	-29.7	0	0	0	110.2
304	L	84.4	Confident	79	Confident	24 Å²	24	56 Å²	56	13%	0.126	29%	0.292	C	S	.	.			trans	-86.9	144	169.3	-67.5	170.6	0	0	0	110	I301 L323 I328 I331 L335	I301-L304 HydrophobicContact CG2-CD2 4.23Å; L304-L323 HydrophobicContact CD1-CD1 4.17Å; L304-L323 HydrophobicContact CD2-CD1 3.91Å; L304-L323 HydrophobicContact CD2-CD2 4.15Å; L304-I328 HydrophobicContact CD1-CD1 4.01Å; L304-I328 HydrophobicContact CD1-CG2 3.84Å; L304-I328 HydrophobicContact CD2-CD1 4.14Å; L304-I328 HydrophobicContact CG-CD1 4.08Å; L304-I328 HydrophobicContact CG-CG1 4.35Å; L304-I328 HydrophobicContact CG-CG2 4.15Å; L304-I331 HydrophobicContact CD1-CG1 4.4Å; L304-L335 HydrophobicContact CD1-CD2 3.82Å
305	P	77.2	Confident	77.6	Confident	18 Å²	18	65 Å²	65	12%	0.117	33%	0.331	C	S	.	.			trans	-65.7	144.8	175.9	25.3	-32.1	0	0	0	112.1	T283 F286 L307 S332	T283-P305 HydrophobicContact CG2-CB 3.34Å; T283-P305 HydrophobicContact CG2-CG 4.14Å; F286-P305 HydrophobicContact CD2-CG 4.13Å; F286-P305 HydrophobicContact CE2-CG 3.65Å; P305-L307 PolarHBondContact O-N 3.09Å; P305-L307 VanDerWaalsContact O-N 3.16Å; P305-S332 PolarHBondContact O-OG 3Å
306	T	71.2	Confident	76.7	Confident	121 Å²	121	67.5 Å²	67.5	74%	0.742	34%	0.344	S	S	*	.			trans	-71	108.8	173.7	-40	0	0	0	0	110.1
307	L	69	Low	76.1	Confident	14 Å²	14	69.5 Å²	69.5	7%	0.073	36%	0.357	C	S	.	.			trans	-89.8	123.9	-179.4	-66.4	172.9	0	0	0	110.3	F286 P305 S332 G334 L335 I338	F286-L307 HydrophobicContact CB-CD1 4.18Å; F286-L307 HydrophobicContact CB-CD2 3.94Å; F286-L307 HydrophobicContact CD1-CD1 4.27Å; F286-L307 HydrophobicContact CD2-CD1 3.97Å; F286-L307 HydrophobicContact CD2-CD2 3.78Å; F286-L307 HydrophobicContact CD2-CG 4.36Å; F286-L307 HydrophobicContact CE2-CD1 4.38Å; F286-L307 HydrophobicContact CG-CD1 3.87Å; F286-L307 HydrophobicContact CG-CD2 4.09Å; P305-L307 PolarHBondContact O-N 3.09Å; P305-L307 VanDerWaalsContact O-N 3.16Å; L307-S332 PolarHBondContact N-OG 3.28Å; L307-G334 WeakPolarHBondContact O-CA 3.36Å; L307-L335 HydrophobicContact CD1-CB 4.21Å; L307-L335 HydrophobicContact CD1-CD1 3.86Å; L307-I338 HydrophobicContact CD1-CD1 3.74Å
308	R	62.8	Low	75.8	Confident	215 Å²	215	68.7 Å²	68.7	81%	0.811	35%	0.352	S	S	*	.			trans	-72.8	150.9	166.5	-65	-174.3	-179.6	177.4	-0.8	109.2	N310 S311	R308-N310 PolarHBondContact O-N 3.45Å; R308-S311 VanDerWaalsContact O-CB 3.23Å; R308-S311 WeakPolarHBondContact O-CB 3.3Å; R308-S311 PolarHBondContact O-N 3.07Å; R308-S311 PolarHBondContact O-OG 3.23Å
309	S	56.5	Low	75.6	Confident	48 Å²	48	69.4 Å²	69.4	34%	0.336	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.2	-177.5	-168.2	0	0	0	0	114.1	R337	S309-R337 PolarHBondContact OG-NH1 3.39Å
310	N	56.2	Low	75.5	Confident	107 Å²	107	70.9 Å²	70.9	57%	0.572	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	20.9	-177.3	-55.4	12.4	0	0	0	112.2	R308 R312	R308-N310 PolarHBondContact O-N 3.45Å; N310-R312 PolarHBondContact O-N 3.42Å
311	S	56.1	Low	75.6	Confident	29 Å²	29	66.5 Å²	66.5	20%	0.203	34%	0.34	C	S	.	.			trans	-66.9	-22.4	-177.4	51.9	0	0	0	0	113.3	S287 R308	S287-S311 WeakPolarHBondContact CA-O 3.21Å; S287-S311 WeakPolarHBondContact CB-O 3.34Å; R308-S311 VanDerWaalsContact O-CB 3.23Å; R308-S311 WeakPolarHBondContact O-CB 3.3Å; R308-S311 PolarHBondContact O-N 3.07Å; R308-S311 PolarHBondContact O-OG 3.23Å
312	R	63.3	Low	75.8	Confident	30 Å²	30	67.6 Å²	67.6	11%	0.113	35%	0.346	C	S	.	.			trans	-95.8	131.3	177.7	-164.4	-169.2	-178.6	97.5	-2	111.3	L291 N310 S314 E316 I338	L291-R312 PolarHBondContact O-NH2 3.36Å; N310-R312 PolarHBondContact O-N 3.42Å; R312-S314 VanDerWaalsContact CD-O 3.27Å; R312-S314 WeakPolarHBondContact CD-O 3Å; R312-E316 PolarHBondContact NE-O 3.02Å; R312-E316 PolarHBondContact NH2-O 3.38Å; R312-I338 HydrophobicContact CB-CG2 4.15Å
313	I	59.7	Low	76.2	Confident	135 Å²	135	65.5 Å²	65.5	69%	0.692	33%	0.331	S	S	*	.	S	Bend	trans	-77	-35.4	177.9	-58.4	166.2	0	0	0	111
314	S	64.3	Low	76.9	Confident	35 Å²	35	60.3 Å²	60.3	25%	0.245	30%	0.304	C	S	.	.	S	Bend	trans	-82.1	141.9	-179.4	177.8	0	0	0	0	112.3	P289 R312 E316	P289-S314 WeakPolarHBondContact O-CB 3.41Å; P289-S314 PolarHBondContact O-OG 3.17Å; R312-S314 VanDerWaalsContact CD-O 3.27Å; R312-S314 WeakPolarHBondContact CD-O 3Å; S314-E316 VanDerWaalsContact C-N 3.34Å; S314-E316 PolarHBondContact OG-N 3.14Å
315	K	67.2	Low	77.5	Confident	190 Å²	190	63.8 Å²	63.8	83%	0.826	32%	0.316	S	S	*	.	S	Bend	trans	-73.9	-24.5	176.1	-68	-174.4	177.5	-176.5	0	112.8
316	E	77.2	Confident	78.4	Confident	125 Å²	125	63.1 Å²	63.1	58%	0.584	31%	0.312	S	S	*	.	S	Bend	trans	-83	128	179.1	-65.7	-172	172.5	0	0	110.2	R312 S314	R312-E316 PolarHBondContact NE-O 3.02Å; R312-E316 PolarHBondContact NH2-O 3.38Å; S314-E316 VanDerWaalsContact C-N 3.34Å; S314-E316 PolarHBondContact OG-N 3.14Å
317	P	84.4	Confident	79.5	Confident	42 Å²	42	61.3 Å²	61.3	27%	0.273	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-65.1	153.1	175.5	27.6	-34.5	0	0	0	111.6	Q319 I338 K340	P317-Q319 PolarHBondContact O-N 2.92Å; P317-Q319 PolarHBondContact O-NE2 3.25Å; P317-I338 CarbonylContact C-O 3.58Å; P317-I338 WeakPolarHBondContact CA-O 3.39Å; P317-K340 HydrophobicContact CB-CG 4.13Å; P317-K340 HydrophobicContact CG-CD 4.28Å; P317-K340 HydrophobicContact CG-CG 3.58Å
318	I	90.7	Very high	80.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-53.6	136.2	163.6	-84.4	138.4	0	0	0	106.8	L291 Q292 L320 I321 I338 T339 K340	L291-I318 HydrophobicContact CB-CG1 4.33Å; L291-I318 HydrophobicContact CD2-CD1 4.01Å; L291-I318 HydrophobicContact CD2-CG1 4.19Å; L291-I318 HydrophobicContact CG-CD1 4.49Å; L291-I318 HydrophobicContact CG-CG1 4.12Å; L291-I318 VanDerWaalsContact O-CG1 3.31Å; L291-I318 WeakPolarHBondContact O-CG1 3.38Å; Q292-I318 WeakPolarHBondContact O-CG2 3.3Å; I318-L320 WeakPolarHBondContact CG2-O 3.26Å; I318-I321 HydrophobicContact CB-CD1 4.47Å; I318-I321 HydrophobicContact CB-CG1 4.21Å; I318-I321 HydrophobicContact CD1-CD1 3.98Å; I318-I321 HydrophobicContact CD1-CG1 4.27Å; I318-I321 HydrophobicContact CG2-CD1 4.23Å; I318-I321 HydrophobicContact CG2-CG1 3.46Å; I318-I321 VanDerWaalsContact CG2-CG1 3.46Å; I318-I338 WeakPolarHBondContact CB-O 3.45Å; I318-I338 HydrophobicContact CD1-CD1 4.35Å; I318-I338 PolarHBondContact N-O 2.88Å; I318-T339 CarbonylContact O-C 3.56Å; I318-T339 WeakPolarHBondContact O-CA 3.47Å; I318-T339 PolarHBondContact O-OG1 3.33Å; I318-K340 PolarHBondContact O-N 3.19Å
319	Q	93.5	Very high	81.9	Confident	68 Å²	68	55 Å²	55	32%	0.318	28%	0.278	S	S	.	.	S	Bend	trans	-73.3	-41.7	178.2	-56	-59.8	-44.8	0	0	110.6	Q292 P317 K340 Q341	Q292-Q319 HydrophobicContact CB-CG 4.35Å; Q292-Q319 WeakPolarHBondContact O-CA 3.06Å; Q292-Q319 WeakPolarHBondContact O-CB 3.49Å; Q292-Q319 PolarHBondContact O-N 3.21Å; P317-Q319 PolarHBondContact O-N 2.92Å; P317-Q319 PolarHBondContact O-NE2 3.25Å; Q319-K340 VanDerWaalsContact OE1-CD 3.28Å; Q319-K340 VanDerWaalsContact OE1-CE 3.31Å; Q319-Q341 VanDerWaalsContact O-CB 3.26Å; Q319-Q341 WeakPolarHBondContact O-CB 3.43Å; Q319-Q341 PolarHBondContact O-N 3.05Å
320	L	95.2	Very high	83.3	Confident	35 Å²	35	55.8 Å²	55.8	18%	0.183	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	126.7	-177.4	175.6	66.5	0	0	0	112.1	Q292 T293 L294 I318 Q341	Q292-L320 PolarHBondContact O-N 3.41Å; Q292-L320 VanDerWaalsContact O-N 3.14Å; T293-L320 WeakPolarHBondContact CA-O 3.37Å; T293-L320 HydrophobicContact CG2-CB 4.26Å; T293-L320 HydrophobicContact CG2-CD2 4.05Å; T293-L320 HydrophobicContact CG2-CG 4.42Å; L294-L320 PolarHBondContact N-O 2.98Å; I318-L320 WeakPolarHBondContact CG2-O 3.26Å; L320-Q341 HydrophobicContact CD1-CB 3.91Å; L320-Q341 VanDerWaalsContact CD1-CD 3.49Å; L320-Q341 HydrophobicContact CD1-CG 3.57Å
321	I	95.9	Very high	84.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117	162.7	-59.8	178	0	0	0	107.2	F286 L294 I318 L323 L335 I338 T339 Q341 L342 D343	F286-I321 HydrophobicContact CD1-CD1 4.22Å; F286-I321 HydrophobicContact CE1-CD1 4.06Å; L294-I321 HydrophobicContact CB-CG1 4.5Å; L294-I321 HydrophobicContact CD2-CG2 4.45Å; L294-I321 WeakPolarHBondContact O-CA 3.39Å; I318-I321 HydrophobicContact CB-CD1 4.47Å; I318-I321 HydrophobicContact CB-CG1 4.21Å; I318-I321 HydrophobicContact CD1-CD1 3.98Å; I318-I321 HydrophobicContact CD1-CG1 4.27Å; I318-I321 HydrophobicContact CG2-CD1 4.23Å; I318-I321 HydrophobicContact CG2-CG1 3.46Å; I318-I321 VanDerWaalsContact CG2-CG1 3.46Å; I321-L323 HydrophobicContact CG2-CD1 3.82Å; I321-L323 HydrophobicContact CG2-CG 3.9Å; I321-L335 HydrophobicContact CD1-CD1 3.84Å; I321-I338 HydrophobicContact CD1-CD1 4.37Å; I321-I338 HydrophobicContact CD1-CG1 4.45Å; I321-T339 HydrophobicContact CD1-CG2 4Å; I321-T339 HydrophobicContact CG1-CG2 4.37Å; I321-Q341 PolarHBondContact N-O 3.06Å; I321-L342 HydrophobicContact CB-CD1 3.78Å; I321-L342 HydrophobicContact CG2-CD1 3.75Å; I321-L342 WeakPolarHBondContact O-CA 3.13Å; I321-D343 PolarHBondContact O-N 3.36Å
322	D	97.2	Very high	85.4	Confident	24 Å²	24	51.2 Å²	51.2	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	113.2	174.9	-168.4	-15.2	0	0	0	109.7	L294 K295 L296 S324	L294-D322 PolarHBondContact O-N 2.76Å; K295-D322 HydrophobicContact CG-CB 4.33Å; L296-D322 CarbonylContact C-O 3.57Å; L296-D322 WeakPolarHBondContact CA-O 3.16Å; L296-D322 WeakPolarHBondContact CB-O 3.42Å; L296-D322 PolarHBondContact N-O 3.29Å; D322-S324 WeakPolarHBondContact OD1-CB 3.27Å; D322-S324 PolarHBondContact OD1-N 2.96Å; D322-S324 PolarHBondContact OD1-OG 3.03Å
323	L	96.4	Very high	85.6	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.			trans	-120.3	18	177.8	-73.2	164	0	0	0	111	L296 I301 L304 I321 N326 I328 L335 L342 D343 L344 N347	L296-L323 HydrophobicContact CB-CD2 3.9Å; L296-L323 HydrophobicContact CD1-CD2 3.75Å; I301-L323 HydrophobicContact CD1-CD2 4.2Å; L304-L323 HydrophobicContact CD1-CD1 4.17Å; L304-L323 HydrophobicContact CD2-CD1 3.91Å; L304-L323 HydrophobicContact CD2-CD2 4.15Å; I321-L323 HydrophobicContact CG2-CD1 3.82Å; I321-L323 HydrophobicContact CG2-CG 3.9Å; L323-N326 PolarHBondContact O-ND2 3.28Å; L323-N326 VanDerWaalsContact O-ND2 3.08Å; L323-I328 HydrophobicContact CB-CD1 3.87Å; L323-I328 HydrophobicContact CD1-CD1 4.22Å; L323-I328 HydrophobicContact CD2-CD1 4.21Å; L323-I328 HydrophobicContact CG-CD1 4.34Å; L323-L335 HydrophobicContact CD1-CD2 4Å; L323-L342 HydrophobicContact CD1-CD1 4.25Å; L323-D343 CarbonylContact C-O 3.32Å; L323-D343 WeakPolarHBondContact CA-O 3.35Å; L323-D343 WeakPolarHBondContact CB-O 3.21Å; L323-D343 PolarHBondContact N-O 3.15Å; L323-L344 HydrophobicContact CB-CD2 4.1Å; L323-L344 HydrophobicContact CD1-CD2 4.09Å; L323-N347 PolarHBondContact O-ND2 2.99Å
324	S	96.6	Very high	86.3	Confident	7 Å²	7	46.7 Å²	46.7	5%	0.049	24%	0.242	C	C	.	.			trans	-62.3	158	-178.3	63	0	0	0	0	112.3	D297 H298 D322 N326 S345	D297-S324 WeakPolarHBondContact CA-O 3.49Å; D297-S324 VanDerWaalsContact CB-OG 3.26Å; D297-S324 WeakPolarHBondContact CB-OG 3.5Å; H298-S324 PolarHBondContact N-O 3Å; H298-S324 VanDerWaalsContact N-O 3.13Å; D322-S324 WeakPolarHBondContact OD1-CB 3.27Å; D322-S324 PolarHBondContact OD1-N 2.96Å; D322-S324 PolarHBondContact OD1-OG 3.03Å; S324-N326 PolarHBondContact O-N 3.45Å; S324-N326 PolarHBondContact O-ND2 3.4Å; S324-S345 CarbonylContact C-O 3.46Å; S324-S345 WeakPolarHBondContact CA-O 3.46Å; S324-S345 VanDerWaalsContact CB-OG 3.3Å; S324-S345 WeakPolarHBondContact CB-OG 3.43Å
325	Y	97.4	Very high	86.9	Confident	97 Å²	97	45.1 Å²	45.1	38%	0.38	23%	0.23	S	C	.	.	S	Bend	trans	52.5	48.6	179.7	-60.4	-98.8	0	0	0	114.2	H298 N299 S345 K346	H298-Y325 WeakPolarHBondContact CA-O 3.46Å; H298-Y325 AromaticContact CD2-CD2 3.8Å; H298-Y325 AromaticContact CD2-CG 3.95Å; H298-Y325 AromaticContact CE1-CD1 3.32Å; H298-Y325 WeakPolarHBondContact CE1-CD1 3.32Å; H298-Y325 AromaticContact CE1-CD2 3.7Å; H298-Y325 AromaticContact CE1-CE1 3.52Å; H298-Y325 AromaticContact CE1-CE2 3.92Å; H298-Y325 AromaticContact CE1-CG 3.38Å; H298-Y325 AromaticContact CE1-CZ 3.8Å; H298-Y325 PolarHBondContact N-O 3.12Å; H298-Y325 AromaticContact ND1-CD1 3.82Å; H298-Y325 AromaticContact ND1-CG 3.71Å; H298-Y325 AromaticContact NE2-CD1 3.89Å; H298-Y325 AromaticContact NE2-CD2 3.38Å; H298-Y325 WeakPolarHBondContact NE2-CD2 3.35Å; H298-Y325 AromaticContact NE2-CE1 3.96Å; H298-Y325 AromaticContact NE2-CE2 3.5Å; H298-Y325 WeakPolarHBondContact NE2-CE2 3.46Å; H298-Y325 AromaticContact NE2-CG 3.56Å; H298-Y325 AromaticContact NE2-CZ 3.76Å; N299-Y325 PolarHBondContact N-O 3.32Å; Y325-S345 PolarHBondContact N-O 2.77Å; Y325-S345 VanDerWaalsContact N-O 3.11Å; Y325-K346 VanDerWaalsContact CA-O 3.32Å; Y325-K346 WeakPolarHBondContact CA-O 3.48Å; Y325-K346 HydrophobicContact CD1-CB 4.09Å; Y325-K346 HydrophobicContact CD1-CD 3.64Å; Y325-K346 HydrophobicContact CD1-CG 4.49Å; Y325-K346 HydrophobicContact CD2-CB 4.4Å; Y325-K346 HydrophobicContact CD2-CD 4.08Å; Y325-K346 HydrophobicContact CE1-CB 4.46Å; Y325-K346 HydrophobicContact CE1-CD 3.14Å; Y325-K346 HydrophobicContact CE1-CG 4.37Å; Y325-K346 HydrophobicContact CE2-CD 3.62Å; Y325-K346 HydrophobicContact CG-CB 4.09Å; Y325-K346 HydrophobicContact CG-CD 4.1Å; Y325-K346 PolarHBondContact N-O 3.21Å; Y325-K346 PolarHBondContact OH-NZ 3.46Å
326	N	96.3	Very high	87.3	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.016	19%	0.194	C	C	.	.	S	Bend	trans	-119.5	-164.6	173.5	-84.9	-83.3	0	0	0	110.2	L296 N299 I301 L323 S324 I328 N347	L296-N326 PolarHBondContact O-ND2 3.3Å; N299-N326 WeakPolarHBondContact CA-OD1 3.34Å; N299-N326 WeakPolarHBondContact CB-OD1 3.46Å; N299-N326 PolarHBondContact O-OD1 2.69Å; I301-N326 HydrophobicContact CB-CB 4.36Å; I301-N326 VanDerWaalsContact CB-OD1 3.3Å; I301-N326 WeakPolarHBondContact CB-OD1 3.48Å; I301-N326 WeakPolarHBondContact CG1-OD1 3.25Å; I301-N326 PolarHBondContact N-OD1 2.97Å; L323-N326 PolarHBondContact O-ND2 3.28Å; L323-N326 VanDerWaalsContact O-ND2 3.08Å; S324-N326 PolarHBondContact O-N 3.45Å; S324-N326 PolarHBondContact O-ND2 3.4Å; N326-I328 HydrophobicContact CB-CD1 4.16Å; N326-I328 HydrophobicContact CB-CG1 4.1Å; N326-N347 VanDerWaalsContact CA-OD1 3.32Å; N326-N347 WeakPolarHBondContact CA-OD1 3.47Å; N326-N347 WeakPolarHBondContact CB-OD1 3.45Å; N326-N347 PolarHBondContact N-OD1 2.82Å; N326-N347 PolarHBondContact O-OD1 3.32Å
327	Q	93.1	Very high	87.2	Confident	84 Å²	84	35.8 Å²	35.8	39%	0.393	19%	0.185	S	C	.	.			trans	-117.8	30.7	179.9	-58.5	-63.4	-25.4	0	0	111.6	I301 S302 N329 N347	I301-Q327 CarbonylContact O-C 3.51Å; I301-Q327 VanDerWaalsContact O-C 3.24Å; I301-Q327 WeakPolarHBondContact O-CA 3.32Å; I301-Q327 PolarHBondContact O-N 2.86Å; S302-Q327 VanDerWaalsContact CA-O 3.28Å; S302-Q327 WeakPolarHBondContact CA-O 3.14Å; Q327-N329 PolarHBondContact O-N 2.99Å; Q327-N329 PolarHBondContact O-OD1 3.46Å; Q327-N347 PolarHBondContact N-OD1 3.41Å
328	I	93.9	Very high	87.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.			trans	-73.3	124	-171.8	-58.8	165.6	0	0	0	109.9	I301 L304 L323 N326 A330 I331 L344 N347 K348 L349	I301-I328 HydrophobicContact CG2-CG1 4.35Å; I301-I328 WeakPolarHBondContact O-CG1 3.35Å; I301-I328 PolarHBondContact O-N 2.97Å; L304-I328 HydrophobicContact CD1-CD1 4.01Å; L304-I328 HydrophobicContact CD1-CG2 3.84Å; L304-I328 HydrophobicContact CD2-CD1 4.14Å; L304-I328 HydrophobicContact CG-CD1 4.08Å; L304-I328 HydrophobicContact CG-CG1 4.35Å; L304-I328 HydrophobicContact CG-CG2 4.15Å; L323-I328 HydrophobicContact CB-CD1 3.87Å; L323-I328 HydrophobicContact CD1-CD1 4.22Å; L323-I328 HydrophobicContact CD2-CD1 4.21Å; L323-I328 HydrophobicContact CG-CD1 4.34Å; N326-I328 HydrophobicContact CB-CD1 4.16Å; N326-I328 HydrophobicContact CB-CG1 4.1Å; I328-A330 WeakPolarHBondContact CG2-O 3.49Å; I328-I331 HydrophobicContact CG2-CG1 4.48Å; I328-L344 HydrophobicContact CD1-CD2 4.1Å; I328-N347 HydrophobicContact CB-CB 4.28Å; I328-N347 VanDerWaalsContact CB-OD1 3.31Å; I328-N347 WeakPolarHBondContact CB-OD1 3.43Å; I328-N347 WeakPolarHBondContact CG1-OD1 3.46Å; I328-N347 PolarHBondContact N-OD1 3.16Å; I328-K348 CarbonylContact O-C 3.42Å; I328-K348 VanDerWaalsContact O-C 3.24Å; I328-K348 WeakPolarHBondContact O-CA 3.43Å; I328-K348 PolarHBondContact O-N 3.45Å; I328-L349 HydrophobicContact CG2-CD2 4.1Å; I328-L349 PolarHBondContact O-N 3.3Å
329	N	89.3	Confident	87	Confident	97 Å²	97	34.4 Å²	34.4	52%	0.519	18%	0.176	S	C	.	.			trans	-101.7	-22	-178.7	-63.8	-1.1	0	0	0	113.4	Q327 K348	Q327-N329 PolarHBondContact O-N 2.99Å; Q327-N329 PolarHBondContact O-OD1 3.46Å; N329-K348 WeakPolarHBondContact OD1-CB 3.37Å
330	A	84.8	Confident	86.8	Confident	64 Å²	64	35.8 Å²	35.8	53%	0.529	18%	0.181	S	C	.	.			trans	-150	151.4	-177.9	0	0	0	0	0	111.5	I328	I328-A330 WeakPolarHBondContact CG2-O 3.49Å
331	I	83.4	Confident	86.8	Confident	20 Å²	20	37.9 Å²	37.9	10%	0.103	19%	0.19	C	C	.	.			trans	-122	146	179.5	-60.8	150.2	0	0	0	109.2	L304 I328 L335 L344 L349 F352	L304-I331 HydrophobicContact CD1-CG1 4.4Å; I328-I331 HydrophobicContact CG2-CG1 4.48Å; I331-L335 HydrophobicContact CG2-CB 4.34Å; I331-L335 HydrophobicContact CG2-CD2 4.25Å; I331-L344 HydrophobicContact CD1-CD1 3.33Å; I331-L344 HydrophobicContact CD1-CD2 4.21Å; I331-L344 HydrophobicContact CD1-CG 4.33Å; I331-L344 HydrophobicContact CG1-CD1 4.11Å; I331-L344 HydrophobicContact CG1-CD2 4.29Å; I331-L349 HydrophobicContact CD1-CD1 3.52Å; I331-L349 HydrophobicContact CD1-CD2 3.64Å; I331-L349 HydrophobicContact CD1-CG 4.24Å; I331-L349 HydrophobicContact CG1-CD1 4.39Å; I331-L349 HydrophobicContact CG1-CD2 3.79Å; I331-F352 HydrophobicContact CD1-CD2 4.41Å; I331-F352 HydrophobicContact CD1-CE2 4.49Å
332	S	73.4	Confident	86.7	Confident	20 Å²	20	37.9 Å²	37.9	14%	0.14	19%	0.19	C	C	.	.			trans	-96.6	151.4	173.7	72.2	0	0	0	0	112.3	P305 L307 G334 L335	P305-S332 PolarHBondContact O-OG 3Å; L307-S332 PolarHBondContact N-OG 3.28Å; S332-G334 PolarHBondContact O-N 3.43Å; S332-L335 PolarHBondContact O-N 3.15Å
333	D	68.7	Low	86.6	Confident	67 Å²	67	38.1 Å²	38.1	36%	0.358	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-26.3	-175.6	-67.8	2.1	0	0	0	114.4	L335 S355 L356	D333-L335 PolarHBondContact O-N 3.49Å; D333-S355 PolarHBondContact OD1-OG 3.28Å; D333-S355 PolarHBondContact OD2-OG 3.14Å; D333-L356 HydrophobicContact CB-CD2 3.7Å; D333-L356 HydrophobicContact CB-CG 4.2Å; D333-L356 WeakPolarHBondContact O-CD2 3.27Å; D333-L356 WeakPolarHBondContact OD1-CG 2.98Å
334	G	73.1	Confident	86.5	Confident	3 Å²	3	38.1 Å²	38.1	3%	0.031	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.6	-176.9	0	0	0	0	0	115	L307 S332 R337	L307-G334 WeakPolarHBondContact O-CA 3.36Å; S332-G334 PolarHBondContact O-N 3.43Å; G334-R337 PolarHBondContact O-N 3.36Å
335	L	76.8	Confident	86.4	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-39.3	-173.5	-172	65.8	0	0	0	112.7	F286 L304 L307 I321 L323 I331 S332 D333 R337 I338 L342	F286-L335 HydrophobicContact CD1-CD1 4.03Å; F286-L335 HydrophobicContact CE1-CD1 3.51Å; F286-L335 HydrophobicContact CZ-CD1 3.95Å; L304-L335 HydrophobicContact CD1-CD2 3.82Å; L307-L335 HydrophobicContact CD1-CB 4.21Å; L307-L335 HydrophobicContact CD1-CD1 3.86Å; I321-L335 HydrophobicContact CD1-CD1 3.84Å; L323-L335 HydrophobicContact CD1-CD2 4Å; I331-L335 HydrophobicContact CG2-CB 4.34Å; I331-L335 HydrophobicContact CG2-CD2 4.25Å; S332-L335 PolarHBondContact O-N 3.15Å; D333-L335 PolarHBondContact O-N 3.49Å; L335-R337 VanDerWaalsContact C-N 3.26Å; L335-R337 PolarHBondContact O-N 3.5Å; L335-I338 HydrophobicContact CD1-CD1 4.21Å; L335-I338 HydrophobicContact CD1-CG1 4.49Å; L335-I338 WeakPolarHBondContact O-CG1 3.47Å; L335-I338 PolarHBondContact O-N 3.17Å; L335-L342 HydrophobicContact CD2-CD1 3.99Å; L335-L342 HydrophobicContact CD2-CD2 4Å; L335-L342 HydrophobicContact CG-CD1 4.29Å; L335-L342 HydrophobicContact CG-CD2 4.15Å
336	L	75.2	Confident	86.4	Confident	13 Å²	13	37.4 Å²	37.4	7%	0.068	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.6	180	-67	163.4	0	0	0	112.8	L342 F352 L356 I360 I375 L377	L336-L342 HydrophobicContact CD2-CD2 3.47Å; L336-L342 VanDerWaalsContact CD2-CD2 3.47Å; L336-L342 HydrophobicContact CG-CD2 4.19Å; L336-F352 HydrophobicContact CD1-CE1 4.31Å; L336-F352 HydrophobicContact CD1-CE2 4Å; L336-F352 HydrophobicContact CD1-CZ 3.41Å; L336-F352 VanDerWaalsContact CD1-CZ 3.41Å; L336-F352 HydrophobicContact CD2-CZ 4.27Å; L336-F352 HydrophobicContact CG-CZ 4.5Å; L336-L356 HydrophobicContact CB-CD2 4.38Å; L336-L356 HydrophobicContact CD1-CB 3.71Å; L336-L356 HydrophobicContact CD1-CD1 3.35Å; L336-L356 HydrophobicContact CD1-CD2 3.63Å; L336-L356 HydrophobicContact CD1-CG 3.71Å; L336-L356 HydrophobicContact CG-CD1 4.46Å; L336-I360 HydrophobicContact CD1-CD1 4.5Å; L336-I375 HydrophobicContact CB-CD1 4.04Å; L336-I375 HydrophobicContact CD2-CD1 3.44Å; L336-I375 VanDerWaalsContact CD2-CD1 3.44Å; L336-I375 HydrophobicContact CG-CD1 4.33Å; L336-L377 HydrophobicContact CD2-CD1 3.93Å
337	R	75.7	Confident	86.3	Confident	105 Å²	105	37.3 Å²	37.3	40%	0.396	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-19.6	179	-68.9	-174.2	174.7	-159	-6.5	113.3	S309 G334 L335	S309-R337 PolarHBondContact OG-NH1 3.39Å; G334-R337 PolarHBondContact O-N 3.36Å; L335-R337 VanDerWaalsContact C-N 3.26Å; L335-R337 PolarHBondContact O-N 3.5Å
338	I	82.9	Confident	86.3	Confident	7 Å²	7	38.2 Å²	38.2	4%	0.036	19%	0.193	C	C	.	.	S	Bend	trans	-104.8	1	-171.5	63.3	162.1	0	0	0	113.6	F286 L307 R312 P317 I318 I321 L335	F286-I338 HydrophobicContact CB-CD1 3.65Å; F286-I338 HydrophobicContact CD1-CD1 3.57Å; F286-I338 HydrophobicContact CG-CD1 3.9Å; L307-I338 HydrophobicContact CD1-CD1 3.74Å; R312-I338 HydrophobicContact CB-CG2 4.15Å; P317-I338 CarbonylContact C-O 3.58Å; P317-I338 WeakPolarHBondContact CA-O 3.39Å; I318-I338 WeakPolarHBondContact CB-O 3.45Å; I318-I338 HydrophobicContact CD1-CD1 4.35Å; I318-I338 PolarHBondContact N-O 2.88Å; I321-I338 HydrophobicContact CD1-CD1 4.37Å; I321-I338 HydrophobicContact CD1-CG1 4.45Å; L335-I338 HydrophobicContact CD1-CD1 4.21Å; L335-I338 HydrophobicContact CD1-CG1 4.49Å; L335-I338 WeakPolarHBondContact O-CG1 3.47Å; L335-I338 PolarHBondContact O-N 3.17Å
339	T	88.1	Confident	86.2	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.037	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-136	150.6	-178.5	-168.4	0	0	0	0	112.9	I318 I321 Q341 L342 I375	I318-T339 CarbonylContact O-C 3.56Å; I318-T339 WeakPolarHBondContact O-CA 3.47Å; I318-T339 PolarHBondContact O-OG1 3.33Å; I321-T339 HydrophobicContact CD1-CG2 4Å; I321-T339 HydrophobicContact CG1-CG2 4.37Å; T339-Q341 PolarHBondContact OG1-N 3.05Å; T339-Q341 PolarHBondContact OG1-O 3.39Å; T339-L342 HydrophobicContact CG2-CB 3.77Å; T339-L342 HydrophobicContact CG2-CD1 4.42Å; T339-L342 HydrophobicContact CG2-CG 4.48Å; T339-I375 HydrophobicContact CG2-CD1 4.12Å
340	K	90.3	Very high	86.1	Confident	98 Å²	98	41.4 Å²	41.4	43%	0.426	20%	0.198	S	C	.	.	S	Bend	trans	-89.1	-29.2	170.6	-61.1	-164.2	-170.4	164.5	0	112.9	P317 I318 Q319 I375 K376	P317-K340 HydrophobicContact CB-CG 4.13Å; P317-K340 HydrophobicContact CG-CD 4.28Å; P317-K340 HydrophobicContact CG-CG 3.58Å; I318-K340 PolarHBondContact O-N 3.19Å; Q319-K340 VanDerWaalsContact OE1-CD 3.28Å; Q319-K340 VanDerWaalsContact OE1-CE 3.31Å; K340-I375 CarbonylContact O-C 3.09Å; K340-I375 WeakPolarHBondContact O-CA 3.22Å; K340-K376 PolarHBondContact O-N 2.83Å
341	Q	93.8	Very high	86.1	Confident	79 Å²	79	42.2 Å²	42.2	37%	0.369	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.5	176.2	-174.5	173.5	-15.3	0	0	109.2	Q319 L320 I321 T339 K376	Q319-Q341 VanDerWaalsContact O-CB 3.26Å; Q319-Q341 WeakPolarHBondContact O-CB 3.43Å; Q319-Q341 PolarHBondContact O-N 3.05Å; L320-Q341 HydrophobicContact CD1-CB 3.91Å; L320-Q341 VanDerWaalsContact CD1-CD 3.49Å; L320-Q341 HydrophobicContact CD1-CG 3.57Å; I321-Q341 PolarHBondContact N-O 3.06Å; T339-Q341 PolarHBondContact OG1-N 3.05Å; T339-Q341 PolarHBondContact OG1-O 3.39Å; Q341-K376 CarbonylContact C-O 3.58Å; Q341-K376 VanDerWaalsContact CA-O 3.29Å; Q341-K376 WeakPolarHBondContact CA-O 3.4Å; Q341-K376 HydrophobicContact CB-CB 4.17Å; Q341-K376 HydrophobicContact CG-CB 3.93Å
342	L	94	Very high	86.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	112.1	178.6	-176.5	59.7	0	0	0	108.9	I321 L323 L335 L336 T339 L344 I375 K376 L377 D378	I321-L342 HydrophobicContact CB-CD1 3.78Å; I321-L342 HydrophobicContact CG2-CD1 3.75Å; I321-L342 WeakPolarHBondContact O-CA 3.13Å; L323-L342 HydrophobicContact CD1-CD1 4.25Å; L335-L342 HydrophobicContact CD2-CD1 3.99Å; L335-L342 HydrophobicContact CD2-CD2 4Å; L335-L342 HydrophobicContact CG-CD1 4.29Å; L335-L342 HydrophobicContact CG-CD2 4.15Å; L336-L342 HydrophobicContact CD2-CD2 3.47Å; L336-L342 VanDerWaalsContact CD2-CD2 3.47Å; L336-L342 HydrophobicContact CG-CD2 4.19Å; T339-L342 HydrophobicContact CG2-CB 3.77Å; T339-L342 HydrophobicContact CG2-CD1 4.42Å; T339-L342 HydrophobicContact CG2-CG 4.48Å; L342-L344 HydrophobicContact CD1-CD1 4.41Å; L342-L344 HydrophobicContact CD1-CG 4.22Å; L342-L344 HydrophobicContact CD2-CD1 3.45Å; L342-L344 VanDerWaalsContact CD2-CD1 3.45Å; L342-L344 HydrophobicContact CD2-CG 4.15Å; L342-L344 HydrophobicContact CG-CD1 3.71Å; L342-L344 HydrophobicContact CG-CG 3.9Å; L342-I375 HydrophobicContact CB-CD1 4.35Å; L342-K376 PolarHBondContact N-O 3.16Å; L342-L377 HydrophobicContact CB-CD1 4.09Å; L342-L377 HydrophobicContact CD2-CD1 4.07Å; L342-L377 HydrophobicContact CG-CD1 4.19Å; L342-L377 WeakPolarHBondContact O-CA 3.08Å; L342-D378 PolarHBondContact O-N 3.4Å
343	D	95.4	Very high	86.6	Confident	29 Å²	29	41.9 Å²	41.9	16%	0.155	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.5	171.4	-165.2	-24	0	0	0	109.2	I321 L323 S345	I321-D343 PolarHBondContact O-N 3.36Å; L323-D343 CarbonylContact C-O 3.32Å; L323-D343 WeakPolarHBondContact CA-O 3.35Å; L323-D343 WeakPolarHBondContact CB-O 3.21Å; L323-D343 PolarHBondContact N-O 3.15Å; D343-S345 VanDerWaalsContact OD1-CB 3.23Å; D343-S345 WeakPolarHBondContact OD1-CB 3.48Å; D343-S345 PolarHBondContact OD1-N 2.79Å; D343-S345 PolarHBondContact OD1-OG 3.36Å
344	L	94.9	Very high	87.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.194	C	C	.	.			trans	-122.4	15.3	176.2	-75.5	158.1	0	0	0	110.8	L323 I328 I331 L342 N347 L349 L377 D378 L379 N382	L323-L344 HydrophobicContact CB-CD2 4.1Å; L323-L344 HydrophobicContact CD1-CD2 4.09Å; I328-L344 HydrophobicContact CD1-CD2 4.1Å; I331-L344 HydrophobicContact CD1-CD1 3.33Å; I331-L344 HydrophobicContact CD1-CD2 4.21Å; I331-L344 HydrophobicContact CD1-CG 4.33Å; I331-L344 HydrophobicContact CG1-CD1 4.11Å; I331-L344 HydrophobicContact CG1-CD2 4.29Å; L342-L344 HydrophobicContact CD1-CD1 4.41Å; L342-L344 HydrophobicContact CD1-CG 4.22Å; L342-L344 HydrophobicContact CD2-CD1 3.45Å; L342-L344 VanDerWaalsContact CD2-CD1 3.45Å; L342-L344 HydrophobicContact CD2-CG 4.15Å; L342-L344 HydrophobicContact CG-CD1 3.71Å; L342-L344 HydrophobicContact CG-CG 3.9Å; L344-N347 WeakPolarHBondContact O-CB 3.45Å; L344-N347 PolarHBondContact O-ND2 3.49Å; L344-L349 HydrophobicContact CB-CD1 4.07Å; L344-L349 HydrophobicContact CD1-CD1 4.49Å; L344-L377 HydrophobicContact CD1-CD1 4.09Å; L344-D378 CarbonylContact C-O 3.13Å; L344-D378 WeakPolarHBondContact CA-O 3.31Å; L344-D378 WeakPolarHBondContact CB-O 3.4Å; L344-D378 PolarHBondContact N-O 3.32Å; L344-L379 HydrophobicContact CB-CD2 3.99Å; L344-L379 HydrophobicContact CD1-CD2 4.05Å; L344-N382 PolarHBondContact O-ND2 3.45Å
345	S	94.8	Very high	87.1	Confident	12 Å²	12	43.1 Å²	43.1	8%	0.084	21%	0.21	C	C	.	.			trans	-59.9	154.2	-179.2	64	0	0	0	0	111.8	S324 Y325 D343 N347 D378 N380	S324-S345 CarbonylContact C-O 3.46Å; S324-S345 WeakPolarHBondContact CA-O 3.46Å; S324-S345 VanDerWaalsContact CB-OG 3.3Å; S324-S345 WeakPolarHBondContact CB-OG 3.43Å; Y325-S345 PolarHBondContact N-O 2.77Å; Y325-S345 VanDerWaalsContact N-O 3.11Å; D343-S345 VanDerWaalsContact OD1-CB 3.23Å; D343-S345 WeakPolarHBondContact OD1-CB 3.48Å; D343-S345 PolarHBondContact OD1-N 2.79Å; D343-S345 PolarHBondContact OD1-OG 3.36Å; S345-N347 VanDerWaalsContact C-N 3.33Å; S345-N347 PolarHBondContact O-N 3.08Å; S345-N347 PolarHBondContact O-ND2 3.07Å; S345-N347 VanDerWaalsContact O-ND2 3.12Å; S345-D378 PolarHBondContact N-O 2.86Å; S345-N380 CarbonylContact C-O 3.52Å; S345-N380 WeakPolarHBondContact CA-O 3.42Å; S345-N380 WeakPolarHBondContact CB-O 3.17Å
346	K	95.9	Very high	87.1	Confident	76 Å²	76	43 Å²	43	33%	0.33	21%	0.21	S	C	.	.	S	Bend	trans	55.1	45.6	176.4	-62.9	178.9	179.5	-170.3	0	113.6	Y325 N380 D381	Y325-K346 VanDerWaalsContact CA-O 3.32Å; Y325-K346 WeakPolarHBondContact CA-O 3.48Å; Y325-K346 HydrophobicContact CD1-CB 4.09Å; Y325-K346 HydrophobicContact CD1-CD 3.64Å; Y325-K346 HydrophobicContact CD1-CG 4.49Å; Y325-K346 HydrophobicContact CD2-CB 4.4Å; Y325-K346 HydrophobicContact CD2-CD 4.08Å; Y325-K346 HydrophobicContact CE1-CB 4.46Å; Y325-K346 HydrophobicContact CE1-CD 3.14Å; Y325-K346 HydrophobicContact CE1-CG 4.37Å; Y325-K346 HydrophobicContact CE2-CD 3.62Å; Y325-K346 HydrophobicContact CG-CB 4.09Å; Y325-K346 HydrophobicContact CG-CD 4.1Å; Y325-K346 PolarHBondContact N-O 3.21Å; Y325-K346 PolarHBondContact OH-NZ 3.46Å; K346-N380 PolarHBondContact N-O 3.41Å; K346-D381 WeakPolarHBondContact CA-O 3.39Å; K346-D381 HydrophobicContact CB-CB 4.32Å; K346-D381 HydrophobicContact CD-CB 4.48Å; K346-D381 WeakPolarHBondContact CE-OD2 3.04Å; K346-D381 HydrophobicContact CG-CB 3.4Å; K346-D381 WeakPolarHBondContact CG-OD2 3.42Å; K346-D381 IonicContact NZ-OD2 3.94Å
347	N	95.6	Very high	87.5	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.011	21%	0.207	C	C	.	.	S	Bend	trans	-112.2	-155.8	173	-86.4	-79.4	0	0	0	110.2	L323 N326 Q327 I328 L344 S345 L349 N382	L323-N347 PolarHBondContact O-ND2 2.99Å; N326-N347 VanDerWaalsContact CA-OD1 3.32Å; N326-N347 WeakPolarHBondContact CA-OD1 3.47Å; N326-N347 WeakPolarHBondContact CB-OD1 3.45Å; N326-N347 PolarHBondContact N-OD1 2.82Å; N326-N347 PolarHBondContact O-OD1 3.32Å; Q327-N347 PolarHBondContact N-OD1 3.41Å; I328-N347 HydrophobicContact CB-CB 4.28Å; I328-N347 VanDerWaalsContact CB-OD1 3.31Å; I328-N347 WeakPolarHBondContact CB-OD1 3.43Å; I328-N347 WeakPolarHBondContact CG1-OD1 3.46Å; I328-N347 PolarHBondContact N-OD1 3.16Å; L344-N347 WeakPolarHBondContact O-CB 3.45Å; L344-N347 PolarHBondContact O-ND2 3.49Å; S345-N347 VanDerWaalsContact C-N 3.33Å; S345-N347 PolarHBondContact O-N 3.08Å; S345-N347 PolarHBondContact O-ND2 3.07Å; S345-N347 VanDerWaalsContact O-ND2 3.12Å; N347-L349 HydrophobicContact CB-CG 4.4Å; N347-N382 WeakPolarHBondContact CA-OD1 3.27Å; N347-N382 WeakPolarHBondContact CB-OD1 3.17Å; N347-N382 PolarHBondContact N-OD1 3.09Å; N347-N382 PolarHBondContact O-OD1 3.18Å
348	K	92.3	Very high	87.7	Confident	102 Å²	102	39.1 Å²	39.1	44%	0.443	20%	0.195	S	C	.	.			trans	-122.9	25.5	-178.3	-62.7	-60.2	176.2	-163	0	111.8	I328 N329 R350 N382	I328-K348 CarbonylContact O-C 3.42Å; I328-K348 VanDerWaalsContact O-C 3.24Å; I328-K348 WeakPolarHBondContact O-CA 3.43Å; I328-K348 PolarHBondContact O-N 3.45Å; N329-K348 WeakPolarHBondContact OD1-CB 3.37Å; K348-R350 PolarHBondContact O-N 3.44Å; K348-N382 PolarHBondContact N-OD1 3.03Å
349	L	91.1	Very high	87.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.201	C	C	.	.			trans	-68.2	126.8	179.3	-60.1	166.2	0	0	0	109.8	I328 I331 L344 N347 L379 N382 P383 M384	I328-L349 HydrophobicContact CG2-CD2 4.1Å; I328-L349 PolarHBondContact O-N 3.3Å; I331-L349 HydrophobicContact CD1-CD1 3.52Å; I331-L349 HydrophobicContact CD1-CD2 3.64Å; I331-L349 HydrophobicContact CD1-CG 4.24Å; I331-L349 HydrophobicContact CG1-CD1 4.39Å; I331-L349 HydrophobicContact CG1-CD2 3.79Å; L344-L349 HydrophobicContact CB-CD1 4.07Å; L344-L349 HydrophobicContact CD1-CD1 4.49Å; N347-L349 HydrophobicContact CB-CG 4.4Å; L349-L379 HydrophobicContact CD1-CD2 3.92Å; L349-N382 HydrophobicContact CB-CB 4.11Å; L349-N382 WeakPolarHBondContact CB-OD1 3.22Å; L349-N382 WeakPolarHBondContact CG-OD1 3.38Å; L349-N382 PolarHBondContact N-OD1 3.48Å; L349-P383 CarbonylContact O-C 3.53Å; L349-P383 VanDerWaalsContact O-CD 3.24Å; L349-P383 WeakPolarHBondContact O-CD 3.45Å; L349-P383 WeakPolarHBondContact O-CG 3.36Å; L349-M384 HydrophobicContact CB-SD 3.88Å; L349-M384 VanDerWaalsContact O-SD 3.41Å
350	R	87.2	Confident	87.2	Confident	164 Å²	164	40.3 Å²	40.3	62%	0.619	20%	0.201	S	C	*	.			trans	-100	-26.4	172.2	-65.4	-174.6	179.4	-171.2	-1.4	112.9	K348 P383 I385 W386	K348-R350 PolarHBondContact O-N 3.44Å; R350-P383 WeakPolarHBondContact CA-O 3.47Å; R350-P383 HydrophobicContact CG-CG 4.19Å; R350-I385 HydrophobicContact CB-CD1 4.11Å; R350-I385 HydrophobicContact CB-CG1 4.31Å; R350-I385 WeakPolarHBondContact O-CA 3.43Å; R350-I385 WeakPolarHBondContact O-CB 3.22Å; R350-I385 PolarHBondContact O-N 2.98Å; R350-W386 PolarHBondContact O-N 3.32Å
351	T	84.9	Confident	86.9	Confident	80 Å²	80	36 Å²	36	49%	0.491	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-142.2	141.3	-179.1	57.1	0	0	0	0	110.3	W386	T351-W386 CarbonylContact C-O 3.47Å; T351-W386 WeakPolarHBondContact CA-O 3.16Å; T351-W386 HydrophobicContact CG2-CB 4.3Å
352	F	86.3	Confident	86.2	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.009	18%	0.179	C	C	.	.			trans	-99.5	133.8	168.8	-169.6	-100.5	0	0	0	109.1	I331 L336 A354 L356 L357 L377 L379 M384 W386 M399	I331-F352 HydrophobicContact CD1-CD2 4.41Å; I331-F352 HydrophobicContact CD1-CE2 4.49Å; L336-F352 HydrophobicContact CD1-CE1 4.31Å; L336-F352 HydrophobicContact CD1-CE2 4Å; L336-F352 HydrophobicContact CD1-CZ 3.41Å; L336-F352 VanDerWaalsContact CD1-CZ 3.41Å; L336-F352 HydrophobicContact CD2-CZ 4.27Å; L336-F352 HydrophobicContact CG-CZ 4.5Å; F352-A354 PolarHBondContact O-N 3.19Å; F352-L356 HydrophobicContact CE1-CB 4.06Å; F352-L356 HydrophobicContact CZ-CB 4.36Å; F352-L357 HydrophobicContact CD1-CD1 4.31Å; F352-L357 HydrophobicContact CD1-CD2 3.88Å; F352-L357 HydrophobicContact CD1-CG 3.85Å; F352-L357 HydrophobicContact CE1-CD2 3.62Å; F352-L357 HydrophobicContact CE1-CG 3.89Å; F352-L377 HydrophobicContact CE1-CD2 4.3Å; F352-L377 HydrophobicContact CE2-CD1 4.5Å; F352-L377 HydrophobicContact CE2-CD2 3.66Å; F352-L377 HydrophobicContact CZ-CD2 3.5Å; F352-L379 HydrophobicContact CB-CD1 4.39Å; F352-L379 HydrophobicContact CD2-CD1 3.77Å; F352-L379 HydrophobicContact CD2-CD2 4.08Å; F352-L379 HydrophobicContact CE2-CD1 4.19Å; F352-L379 HydrophobicContact CE2-CD2 4.32Å; F352-L379 HydrophobicContact CG-CD1 4.13Å; F352-M384 HydrophobicContact CB-CE 3.73Å; F352-W386 PolarHBondContact N-O 3.09Å; F352-W386 WeakPolarHBondContact O-CZ3 3.27Å; F352-M399 HydrophobicContact CB-CE 4.35Å; F352-M399 HydrophobicContact CD1-CE 3.85Å; F352-M399 HydrophobicContact CE1-CE 4.3Å; F352-M399 HydrophobicContact CG-CE 4.13Å
353	P	81.2	Confident	85.5	Confident	32 Å²	32	37 Å²	37	21%	0.208	19%	0.191	C	C	.	.			trans	-67.6	130.4	-171.1	-23.8	36.5	0	0	0	113.9	S355 L356 L357	P353-S355 VanDerWaalsContact C-N 3.26Å; P353-S355 PolarHBondContact O-N 3.46Å; P353-L356 HydrophobicContact CB-CB 4.35Å; P353-L356 HydrophobicContact CB-CD1 3.95Å; P353-L356 HydrophobicContact CB-CG 4.21Å; P353-L356 HydrophobicContact CG-CD1 3.75Å; P353-L356 WeakPolarHBondContact O-CB 3.1Å; P353-L356 PolarHBondContact O-N 3.01Å; P353-L357 PolarHBondContact O-N 3Å
354	A	79.8	Confident	85	Confident	43 Å²	43	36 Å²	36	36%	0.355	19%	0.188	S	C	.	.	H	α-helix	trans	-60.4	-33.3	174.3	0	0	0	0	0	113.3	F352 L356 L357 K358 W386 F403	F352-A354 PolarHBondContact O-N 3.19Å; A354-L356 PolarHBondContact O-N 3.03Å; A354-L357 PolarHBondContact O-N 3.31Å; A354-K358 PolarHBondContact O-N 3.48Å; A354-W386 HydrophobicContact CB-CH2 3.6Å; A354-W386 HydrophobicContact CB-CZ3 3.84Å; A354-F403 HydrophobicContact CB-CE2 3.81Å; A354-F403 WeakPolarHBondContact O-CZ 3.25Å
355	S	72.1	Confident	84.4	Confident	52 Å²	52	43.2 Å²	43.2	36%	0.364	22%	0.221	S	C	.	.	H	α-helix	trans	-56.9	-37.2	173.4	51.1	0	0	0	0	111.8	D333 P353 K358 I359	D333-S355 PolarHBondContact OD1-OG 3.28Å; D333-S355 PolarHBondContact OD2-OG 3.14Å; P353-S355 VanDerWaalsContact C-N 3.26Å; P353-S355 PolarHBondContact O-N 3.46Å; S355-K358 WeakPolarHBondContact O-CB 3.39Å; S355-K358 PolarHBondContact O-N 3.47Å; S355-I359 WeakPolarHBondContact O-CD1 3.47Å; S355-I359 VanDerWaalsContact O-CG1 3.3Å; S355-I359 WeakPolarHBondContact O-CG1 3.15Å; S355-I359 PolarHBondContact O-N 3.19Å; S355-I359 VanDerWaalsContact O-N 3.11Å
356	L	77	Confident	83.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-75.4	-42.6	-178.5	-77.8	169.4	0	0	0	112.7	D333 L336 F352 P353 A354 K358 I359 I360	D333-L356 HydrophobicContact CB-CD2 3.7Å; D333-L356 HydrophobicContact CB-CG 4.2Å; D333-L356 WeakPolarHBondContact O-CD2 3.27Å; D333-L356 WeakPolarHBondContact OD1-CG 2.98Å; L336-L356 HydrophobicContact CB-CD2 4.38Å; L336-L356 HydrophobicContact CD1-CB 3.71Å; L336-L356 HydrophobicContact CD1-CD1 3.35Å; L336-L356 HydrophobicContact CD1-CD2 3.63Å; L336-L356 HydrophobicContact CD1-CG 3.71Å; L336-L356 HydrophobicContact CG-CD1 4.46Å; F352-L356 HydrophobicContact CE1-CB 4.06Å; F352-L356 HydrophobicContact CZ-CB 4.36Å; P353-L356 HydrophobicContact CB-CB 4.35Å; P353-L356 HydrophobicContact CB-CD1 3.95Å; P353-L356 HydrophobicContact CB-CG 4.21Å; P353-L356 HydrophobicContact CG-CD1 3.75Å; P353-L356 WeakPolarHBondContact O-CB 3.1Å; P353-L356 PolarHBondContact O-N 3.01Å; A354-L356 PolarHBondContact O-N 3.03Å; L356-K358 PolarHBondContact O-N 3Å; L356-I359 HydrophobicContact CD2-CD1 4.13Å; L356-I359 PolarHBondContact O-N 3.18Å; L356-I359 VanDerWaalsContact O-N 3.12Å; L356-I360 WeakPolarHBondContact O-CG1 3.34Å; L356-I360 PolarHBondContact O-N 3.45Å
357	L	84.8	Confident	83.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-41.6	171.8	-65.6	176.7	0	0	0	110.8	F352 P353 A354 I359 I360 A361 W386 P387 I396 M399 I400 F403	F352-L357 HydrophobicContact CD1-CD1 4.31Å; F352-L357 HydrophobicContact CD1-CD2 3.88Å; F352-L357 HydrophobicContact CD1-CG 3.85Å; F352-L357 HydrophobicContact CE1-CD2 3.62Å; F352-L357 HydrophobicContact CE1-CG 3.89Å; P353-L357 PolarHBondContact O-N 3Å; A354-L357 PolarHBondContact O-N 3.31Å; L357-I359 PolarHBondContact O-N 3.04Å; L357-I360 PolarHBondContact O-N 3.36Å; L357-A361 WeakPolarHBondContact O-CB 3.41Å; L357-A361 PolarHBondContact O-N 2.73Å; L357-W386 HydrophobicContact CD1-CH2 3.82Å; L357-W386 HydrophobicContact CD1-CZ3 3.99Å; L357-P387 HydrophobicContact CD1-CG 4.13Å; L357-I396 HydrophobicContact CD2-CD1 3.86Å; L357-M399 HydrophobicContact CD2-CB 4.07Å; L357-M399 HydrophobicContact CD2-CE 3.99Å; L357-I400 HydrophobicContact CB-CD1 3.86Å; L357-I400 HydrophobicContact CD2-CD1 3.81Å; L357-I400 HydrophobicContact CG-CD1 4.43Å; L357-I400 WeakPolarHBondContact O-CD1 3.03Å; L357-F403 HydrophobicContact CB-CB 4.26Å; L357-F403 HydrophobicContact CB-CD1 3.92Å; L357-F403 HydrophobicContact CB-CD2 4.3Å; L357-F403 HydrophobicContact CB-CE1 4.27Å; L357-F403 HydrophobicContact CB-CG 3.89Å; L357-F403 HydrophobicContact CD1-CB 3.97Å; L357-F403 HydrophobicContact CD1-CD2 4.33Å; L357-F403 HydrophobicContact CD1-CG 4.21Å
358	K	79.3	Confident	82.7	Confident	36 Å²	36	61.6 Å²	61.6	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-57.4	-47.1	173.4	-170.4	-172.7	-165.7	162.8	0	112.5	A354 S355 L356 I360 A361 N362 F403 L704	A354-K358 PolarHBondContact O-N 3.48Å; S355-K358 WeakPolarHBondContact O-CB 3.39Å; S355-K358 PolarHBondContact O-N 3.47Å; L356-K358 PolarHBondContact O-N 3Å; K358-I360 VanDerWaalsContact C-N 3.34Å; K358-I360 PolarHBondContact O-N 3.11Å; K358-A361 PolarHBondContact O-N 3.07Å; K358-N362 WeakPolarHBondContact O-CB 3.19Å; K358-N362 VanDerWaalsContact O-CG 3.24Å; K358-N362 PolarHBondContact O-N 3.26Å; K358-N362 PolarHBondContact O-OD1 3.25Å; K358-F403 HydrophobicContact CB-CE1 3.87Å; K358-F403 HydrophobicContact CB-CZ 3.91Å; K358-L704 VanDerWaalsContact NZ-CD1 3.34Å
359	I	76.2	Confident	82.6	Confident	30 Å²	30	59.4 Å²	59.4	15%	0.154	30%	0.298	C	S	.	.	H	α-helix	trans	-62.2	-45.3	-179.3	-70.2	161	0	0	0	110.3	S355 L356 L357 N362 I363	S355-I359 WeakPolarHBondContact O-CD1 3.47Å; S355-I359 VanDerWaalsContact O-CG1 3.3Å; S355-I359 WeakPolarHBondContact O-CG1 3.15Å; S355-I359 PolarHBondContact O-N 3.19Å; S355-I359 VanDerWaalsContact O-N 3.11Å; L356-I359 HydrophobicContact CD2-CD1 4.13Å; L356-I359 PolarHBondContact O-N 3.18Å; L356-I359 VanDerWaalsContact O-N 3.12Å; L357-I359 PolarHBondContact O-N 3.04Å; I359-N362 PolarHBondContact O-N 3.17Å; I359-I363 HydrophobicContact CG2-CD1 3.8Å; I359-I363 VanDerWaalsContact O-CG1 3.28Å; I359-I363 WeakPolarHBondContact O-CG1 3.02Å; I359-I363 PolarHBondContact O-N 2.96Å
360	I	84.4	Confident	82.5	Confident	7 Å²	7	65.4 Å²	65.4	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-45.1	178.9	-64.2	166.2	0	0	0	110.3	L336 L356 L357 K358 N362 I363 A364 P371 I375 I396 I400	L336-I360 HydrophobicContact CD1-CD1 4.5Å; L356-I360 WeakPolarHBondContact O-CG1 3.34Å; L356-I360 PolarHBondContact O-N 3.45Å; L357-I360 PolarHBondContact O-N 3.36Å; K358-I360 VanDerWaalsContact C-N 3.34Å; K358-I360 PolarHBondContact O-N 3.11Å; I360-N362 VanDerWaalsContact C-N 3.35Å; I360-N362 PolarHBondContact O-N 3.32Å; I360-I363 PolarHBondContact O-N 2.83Å; I360-A364 WeakPolarHBondContact O-CB 3.43Å; I360-A364 PolarHBondContact O-N 2.87Å; I360-P371 HydrophobicContact CG2-CB 3.85Å; I360-I375 HydrophobicContact CD1-CG2 3.93Å; I360-I375 HydrophobicContact CG1-CG2 4.4Å; I360-I396 HydrophobicContact CD1-CD1 4.12Å; I360-I396 HydrophobicContact CG2-CG1 4.5Å; I360-I400 HydrophobicContact CB-CD1 4.19Å; I360-I400 HydrophobicContact CG2-CD1 4.24Å; I360-I400 HydrophobicContact CG2-CG1 4.47Å
361	A	83.9	Confident	82.5	Confident	9 Å²	9	58.5 Å²	58.5	7%	0.074	30%	0.3	C	S	.	.	H	α-helix	trans	-57.7	-45.7	175.9	0	0	0	0	0	112.1	L357 K358 I363 A364 Q365 I400	L357-A361 WeakPolarHBondContact O-CB 3.41Å; L357-A361 PolarHBondContact O-N 2.73Å; K358-A361 PolarHBondContact O-N 3.07Å; A361-I363 PolarHBondContact O-N 3.09Å; A361-A364 WeakPolarHBondContact O-CB 3.27Å; A361-A364 PolarHBondContact O-N 3.5Å; A361-Q365 WeakPolarHBondContact O-CB 3.34Å; A361-Q365 PolarHBondContact O-N 3.39Å; A361-I400 HydrophobicContact CB-CD1 4.22Å; A361-I400 HydrophobicContact CB-CG2 3.9Å
362	N	79.8	Confident	82.8	Confident	48 Å²	48	56.7 Å²	56.7	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-43.2	178.2	-72.5	7	0	0	0	111.4	K358 I359 I360 Q365 L366	K358-N362 WeakPolarHBondContact O-CB 3.19Å; K358-N362 VanDerWaalsContact O-CG 3.24Å; K358-N362 PolarHBondContact O-N 3.26Å; K358-N362 PolarHBondContact O-OD1 3.25Å; I359-N362 PolarHBondContact O-N 3.17Å; I360-N362 VanDerWaalsContact C-N 3.35Å; I360-N362 PolarHBondContact O-N 3.32Å; N362-Q365 PolarHBondContact O-N 3.11Å; N362-L366 WeakPolarHBondContact O-CB 3.49Å; N362-L366 VanDerWaalsContact O-CG 3.22Å; N362-L366 WeakPolarHBondContact O-CG 3.5Å; N362-L366 PolarHBondContact O-N 3.43Å
363	I	79.2	Confident	82.8	Confident	50 Å²	50	62.8 Å²	62.8	26%	0.256	32%	0.32	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177.5	-64.2	166.1	0	0	0	110.6	I359 I360 A361 L366 K367 I374	I359-I363 HydrophobicContact CG2-CD1 3.8Å; I359-I363 VanDerWaalsContact O-CG1 3.28Å; I359-I363 WeakPolarHBondContact O-CG1 3.02Å; I359-I363 PolarHBondContact O-N 2.96Å; I360-I363 PolarHBondContact O-N 2.83Å; A361-I363 PolarHBondContact O-N 3.09Å; I363-L366 PolarHBondContact O-N 2.79Å; I363-K367 HydrophobicContact CG2-CD 3.94Å; I363-K367 HydrophobicContact CG2-CG 4.42Å; I363-K367 WeakPolarHBondContact O-CB 3.38Å; I363-K367 PolarHBondContact O-N 3.39Å; I363-I374 HydrophobicContact CB-CD1 3.95Å; I363-I374 HydrophobicContact CG2-CD1 3.63Å; I363-I374 HydrophobicContact CG2-CG1 4.18Å; I363-I374 HydrophobicContact CG2-CG2 4.31Å
364	A	85	Confident	83	Confident	10 Å²	10	63 Å²	63	8%	0.083	32%	0.318	C	S	.	.	H	α-helix	trans	-58.9	-48.2	176.8	0	0	0	0	0	111.2	I360 A361 K368 I369 P371 I374	I360-A364 WeakPolarHBondContact O-CB 3.43Å; I360-A364 PolarHBondContact O-N 2.87Å; A361-A364 WeakPolarHBondContact O-CB 3.27Å; A361-A364 PolarHBondContact O-N 3.5Å; A364-K368 WeakPolarHBondContact O-CA 3.25Å; A364-K368 PolarHBondContact O-N 2.93Å; A364-I369 WeakPolarHBondContact CA-O 3.34Å; A364-I369 WeakPolarHBondContact CB-O 3.31Å; A364-I369 PolarHBondContact O-N 3.09Å; A364-I369 VanDerWaalsContact O-N 3.12Å; A364-P371 HydrophobicContact CB-CG 3.95Å; A364-I374 VanDerWaalsContact CA-CD1 3.41Å; A364-I374 HydrophobicContact CB-CD1 3.67Å; A364-I374 VanDerWaalsContact N-CD1 3.25Å
365	Q	82	Confident	83.4	Confident	151 Å²	151	61.1 Å²	61.1	71%	0.706	30%	0.302	S	S	*	.	H	α-helix	trans	-64.3	-46.4	177.7	-170.7	179.3	8.2	0	0	112.1	A361 N362 K367 K368	A361-Q365 WeakPolarHBondContact O-CB 3.34Å; A361-Q365 PolarHBondContact O-N 3.39Å; N362-Q365 PolarHBondContact O-N 3.11Å; Q365-K367 PolarHBondContact O-N 3.22Å; Q365-K368 PolarHBondContact O-N 2.87Å
366	L	80.2	Confident	84.4	Confident	139 Å²	139	65.2 Å²	65.2	73%	0.728	31%	0.314	S	S	*	.	H	α-helix	trans	-64.3	-41	-179.5	-75.7	173.4	0	0	0	112.5	N362 I363	N362-L366 WeakPolarHBondContact O-CB 3.49Å; N362-L366 VanDerWaalsContact O-CG 3.22Å; N362-L366 WeakPolarHBondContact O-CG 3.5Å; N362-L366 PolarHBondContact O-N 3.43Å; I363-L366 PolarHBondContact O-N 2.79Å
367	K	84.4	Confident	85.1	Confident	139 Å²	139	66.5 Å²	66.5	60%	0.604	32%	0.32	S	S	*	.	H	α-helix	trans	-88	-5.8	-179.7	-70.1	-175.2	178.1	-176.7	0	113.6	I363 Q365 I369	I363-K367 HydrophobicContact CG2-CD 3.94Å; I363-K367 HydrophobicContact CG2-CG 4.42Å; I363-K367 WeakPolarHBondContact O-CB 3.38Å; I363-K367 PolarHBondContact O-N 3.39Å; Q365-K367 PolarHBondContact O-N 3.22Å; K367-I369 HydrophobicContact CB-CD1 3.76Å; K367-I369 HydrophobicContact CB-CG1 3.7Å; K367-I369 HydrophobicContact CD-CD1 3.83Å; K367-I369 HydrophobicContact CG-CD1 4.47Å; K367-I369 PolarHBondContact O-N 2.92Å
368	K	86.5	Confident	85.5	Confident	197 Å²	197	69 Å²	69	86%	0.857	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	41.7	-173.4	-58.6	-177.3	178.7	-178.4	0	113	A364 Q365	A364-K368 WeakPolarHBondContact O-CA 3.25Å; A364-K368 PolarHBondContact O-N 2.93Å; Q365-K368 PolarHBondContact O-N 2.87Å
369	I	89.1	Confident	86.2	Confident	56 Å²	56	67.4 Å²	67.4	29%	0.287	33%	0.327	S	S	.	.			trans	-123.9	158.6	178.2	58.6	-178	0	0	0	110	A364 K367 E373 I374	A364-I369 WeakPolarHBondContact CA-O 3.34Å; A364-I369 WeakPolarHBondContact CB-O 3.31Å; A364-I369 PolarHBondContact O-N 3.09Å; A364-I369 VanDerWaalsContact O-N 3.12Å; K367-I369 HydrophobicContact CB-CD1 3.76Å; K367-I369 HydrophobicContact CB-CG1 3.7Å; K367-I369 HydrophobicContact CD-CD1 3.83Å; K367-I369 HydrophobicContact CG-CD1 4.47Å; K367-I369 PolarHBondContact O-N 2.92Å; I369-E373 HydrophobicContact CB-CB 4.49Å; I369-I374 HydrophobicContact CD1-CD1 4.17Å; I369-I374 HydrophobicContact CD1-CG1 3.5Å; I369-I374 VanDerWaalsContact CD1-CG1 3.5Å; I369-I374 HydrophobicContact CG1-CD1 4.08Å; I369-I374 HydrophobicContact CG1-CG1 3.85Å
370	K	88.6	Confident	86.9	Confident	128 Å²	128	68.4 Å²	68.4	56%	0.557	33%	0.332	S	S	*	.			trans	-68.4	144.4	176.8	-66.9	-176.1	178.2	-177	0	111	S372 E373 I374	K370-S372 PolarHBondContact O-N 3.33Å; K370-E373 HydrophobicContact CB-CG 4.28Å; K370-E373 WeakPolarHBondContact O-CB 3.29Å; K370-E373 PolarHBondContact O-N 3.38Å; K370-I374 PolarHBondContact O-N 3.36Å
371	P	88.2	Confident	87.3	Confident	18 Å²	18	72.5 Å²	72.5	12%	0.117	35%	0.354	C	S	.	.	H	α-helix	trans	-48.8	-38.7	170.9	-27.4	31.6	0	0	0	114	I360 A364 E373 I374 I375 I396 D397 I400	I360-P371 HydrophobicContact CG2-CB 3.85Å; A364-P371 HydrophobicContact CB-CG 3.95Å; P371-E373 VanDerWaalsContact C-N 3.27Å; P371-E373 PolarHBondContact O-N 3.06Å; P371-I374 WeakPolarHBondContact O-CB 3.17Å; P371-I374 PolarHBondContact O-N 3.29Å; P371-I374 VanDerWaalsContact O-N 3.09Å; P371-I375 PolarHBondContact O-N 2.91Å; P371-I396 HydrophobicContact CB-CG1 4.24Å; P371-I396 HydrophobicContact CB-CG2 4.16Å; P371-D397 WeakPolarHBondContact CB-OD1 3.41Å; P371-D397 WeakPolarHBondContact CD-OD1 3.18Å; P371-D397 WeakPolarHBondContact CG-OD1 3.3Å; P371-I400 HydrophobicContact CB-CG1 3.89Å; P371-I400 HydrophobicContact CG-CB 4.19Å; P371-I400 HydrophobicContact CG-CG1 3.81Å; P371-I400 HydrophobicContact CG-CG2 4.33Å
372	S	90	Very high	87.6	Confident	43 Å²	43	72.6 Å²	72.6	30%	0.301	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-23.2	175.9	51.8	0	0	0	0	115.2	K370 D397	K370-S372 PolarHBondContact O-N 3.33Å; S372-D397 VanDerWaalsContact CB-OD2 3.28Å; S372-D397 WeakPolarHBondContact CB-OD2 3.5Å; S372-D397 PolarHBondContact N-OD1 3.4Å; S372-D397 PolarHBondContact OG-OD1 3.37Å; S372-D397 PolarHBondContact OG-OD2 3.4Å
373	E	86.9	Confident	88.1	Confident	130 Å²	130	73.4 Å²	73.4	61%	0.607	36%	0.362	S	S	*	.	H	α-helix	trans	-83.2	-20.2	173.8	-66.7	173.1	-162.5	0	0	112.4	I369 K370 P371	I369-E373 HydrophobicContact CB-CB 4.49Å; K370-E373 HydrophobicContact CB-CG 4.28Å; K370-E373 WeakPolarHBondContact O-CB 3.29Å; K370-E373 PolarHBondContact O-N 3.38Å; P371-E373 VanDerWaalsContact C-N 3.27Å; P371-E373 PolarHBondContact O-N 3.06Å
374	I	85.9	Confident	88.4	Confident	36 Å²	36	72.1 Å²	72.1	19%	0.185	36%	0.355	C	S	.	.	H	α-helix	trans	-78.8	-49.2	176	-65.5	166.9	0	0	0	110.3	I363 A364 I369 K370 P371	I363-I374 HydrophobicContact CB-CD1 3.95Å; I363-I374 HydrophobicContact CG2-CD1 3.63Å; I363-I374 HydrophobicContact CG2-CG1 4.18Å; I363-I374 HydrophobicContact CG2-CG2 4.31Å; A364-I374 VanDerWaalsContact CA-CD1 3.41Å; A364-I374 HydrophobicContact CB-CD1 3.67Å; A364-I374 VanDerWaalsContact N-CD1 3.25Å; I369-I374 HydrophobicContact CD1-CD1 4.17Å; I369-I374 HydrophobicContact CD1-CG1 3.5Å; I369-I374 VanDerWaalsContact CD1-CG1 3.5Å; I369-I374 HydrophobicContact CG1-CD1 4.08Å; I369-I374 HydrophobicContact CG1-CG1 3.85Å; K370-I374 PolarHBondContact O-N 3.36Å; P371-I374 WeakPolarHBondContact O-CB 3.17Å; P371-I374 PolarHBondContact O-N 3.29Å; P371-I374 VanDerWaalsContact O-N 3.09Å
375	I	88.9	Confident	88.4	Confident	3 Å²	3	77 Å²	77	2%	0.015	38%	0.379	C	S	.	.			trans	-146.6	128	-177.9	-170.6	156.2	0	0	0	111.3	L336 T339 K340 L342 I360 P371	L336-I375 HydrophobicContact CB-CD1 4.04Å; L336-I375 HydrophobicContact CD2-CD1 3.44Å; L336-I375 VanDerWaalsContact CD2-CD1 3.44Å; L336-I375 HydrophobicContact CG-CD1 4.33Å; T339-I375 HydrophobicContact CG2-CD1 4.12Å; K340-I375 CarbonylContact O-C 3.09Å; K340-I375 WeakPolarHBondContact O-CA 3.22Å; L342-I375 HydrophobicContact CB-CD1 4.35Å; I360-I375 HydrophobicContact CD1-CG2 3.93Å; I360-I375 HydrophobicContact CG1-CG2 4.4Å; P371-I375 PolarHBondContact O-N 2.91Å
376	K	92.1	Very high	88.3	Confident	139 Å²	139	73 Å²	73	60%	0.604	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	107.1	165.2	-67.4	-174.4	179	-174.2	0	108	K340 Q341 L342	K340-K376 PolarHBondContact O-N 2.83Å; Q341-K376 CarbonylContact C-O 3.58Å; Q341-K376 VanDerWaalsContact CA-O 3.29Å; Q341-K376 WeakPolarHBondContact CA-O 3.4Å; Q341-K376 HydrophobicContact CB-CB 4.17Å; Q341-K376 HydrophobicContact CG-CB 3.93Å; L342-K376 PolarHBondContact N-O 3.16Å
377	L	92.7	Very high	88.6	Confident	28 Å²	28	66.4 Å²	66.4	15%	0.147	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.2	-176.8	179	66.1	0	0	0	109.8	L336 L342 L344 F352 L379 I396	L336-L377 HydrophobicContact CD2-CD1 3.93Å; L342-L377 HydrophobicContact CB-CD1 4.09Å; L342-L377 HydrophobicContact CD2-CD1 4.07Å; L342-L377 HydrophobicContact CG-CD1 4.19Å; L342-L377 WeakPolarHBondContact O-CA 3.08Å; L344-L377 HydrophobicContact CD1-CD1 4.09Å; F352-L377 HydrophobicContact CE1-CD2 4.3Å; F352-L377 HydrophobicContact CE2-CD1 4.5Å; F352-L377 HydrophobicContact CE2-CD2 3.66Å; F352-L377 HydrophobicContact CZ-CD2 3.5Å; L377-L379 HydrophobicContact CD1-CD2 4.24Å; L377-L379 HydrophobicContact CD1-CG 4.29Å; L377-L379 HydrophobicContact CD2-CD1 3.81Å; L377-L379 HydrophobicContact CD2-CG 4.04Å; L377-L379 HydrophobicContact CG-CD1 4.28Å; L377-L379 HydrophobicContact CG-CD2 4.43Å; L377-L379 HydrophobicContact CG-CG 3.95Å; L377-I396 HydrophobicContact CD2-CD1 4Å
378	D	93.1	Very high	88.6	Confident	52 Å²	52	61.6 Å²	61.6	28%	0.278	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.1	170.4	-164.1	-27	0	0	0	109.8	L342 L344 S345 N380	L342-D378 PolarHBondContact O-N 3.4Å; L344-D378 CarbonylContact C-O 3.13Å; L344-D378 WeakPolarHBondContact CA-O 3.31Å; L344-D378 WeakPolarHBondContact CB-O 3.4Å; L344-D378 PolarHBondContact N-O 3.32Å; S345-D378 PolarHBondContact N-O 2.86Å; D378-N380 VanDerWaalsContact OD1-CB 3.25Å; D378-N380 WeakPolarHBondContact OD1-CB 3.35Å; D378-N380 PolarHBondContact OD1-N 3.08Å; D378-N380 PolarHBondContact OD1-ND2 3.49Å
379	L	93.2	Very high	88.6	Confident	3 Å²	3	57 Å²	57	2%	0.016	28%	0.283	C	S	.	.			trans	-123.3	9.6	178.7	-67	172.6	0	0	0	112.1	L344 L349 F352 L377 N382 M384 I392 M399	L344-L379 HydrophobicContact CB-CD2 3.99Å; L344-L379 HydrophobicContact CD1-CD2 4.05Å; L349-L379 HydrophobicContact CD1-CD2 3.92Å; F352-L379 HydrophobicContact CB-CD1 4.39Å; F352-L379 HydrophobicContact CD2-CD1 3.77Å; F352-L379 HydrophobicContact CD2-CD2 4.08Å; F352-L379 HydrophobicContact CE2-CD1 4.19Å; F352-L379 HydrophobicContact CE2-CD2 4.32Å; F352-L379 HydrophobicContact CG-CD1 4.13Å; L377-L379 HydrophobicContact CD1-CD2 4.24Å; L377-L379 HydrophobicContact CD1-CG 4.29Å; L377-L379 HydrophobicContact CD2-CD1 3.81Å; L377-L379 HydrophobicContact CD2-CG 4.04Å; L377-L379 HydrophobicContact CG-CD1 4.28Å; L377-L379 HydrophobicContact CG-CD2 4.43Å; L377-L379 HydrophobicContact CG-CG 3.95Å; L379-N382 WeakPolarHBondContact O-CB 3.2Å; L379-N382 PolarHBondContact O-ND2 3.2Å; L379-M384 HydrophobicContact CD1-CE 4.43Å; L379-I392 HydrophobicContact CB-CG2 3.68Å; L379-I392 HydrophobicContact CD1-CG2 4.38Å; L379-M399 HydrophobicContact CD1-CE 3.71Å; L379-M399 HydrophobicContact CD1-SD 4.18Å
380	N	91.8	Very high	88.4	Confident	50 Å²	50	59.2 Å²	59.2	27%	0.267	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	154.3	-173.4	-66.6	-36.1	0	0	0	112	S345 K346 D378 N382	S345-N380 CarbonylContact C-O 3.52Å; S345-N380 WeakPolarHBondContact CA-O 3.42Å; S345-N380 WeakPolarHBondContact CB-O 3.17Å; K346-N380 PolarHBondContact N-O 3.41Å; D378-N380 VanDerWaalsContact OD1-CB 3.25Å; D378-N380 WeakPolarHBondContact OD1-CB 3.35Å; D378-N380 PolarHBondContact OD1-N 3.08Å; D378-N380 PolarHBondContact OD1-ND2 3.49Å; N380-N382 VanDerWaalsContact C-N 3.25Å; N380-N382 PolarHBondContact O-N 3.37Å; N380-N382 PolarHBondContact O-ND2 2.86Å
381	D	91.5	Very high	88.5	Confident	93 Å²	93	54.4 Å²	54.4	50%	0.497	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	32.6	179.8	-59.2	-43.9	0	0	0	115.2	K346	K346-D381 WeakPolarHBondContact CA-O 3.39Å; K346-D381 HydrophobicContact CB-CB 4.32Å; K346-D381 HydrophobicContact CD-CB 4.48Å; K346-D381 WeakPolarHBondContact CE-OD2 3.04Å; K346-D381 HydrophobicContact CG-CB 3.4Å; K346-D381 WeakPolarHBondContact CG-OD2 3.42Å; K346-D381 IonicContact NZ-OD2 3.94Å
382	N	91.3	Very high	88.5	Confident	11 Å²	11	54 Å²	54	6%	0.059	27%	0.273	C	S	.	.	S	Bend	trans	-103.5	149.2	167	-80.8	-84	0	0	0	110.5	L344 N347 K348 L349 L379 N380 M384	L344-N382 PolarHBondContact O-ND2 3.45Å; N347-N382 WeakPolarHBondContact CA-OD1 3.27Å; N347-N382 WeakPolarHBondContact CB-OD1 3.17Å; N347-N382 PolarHBondContact N-OD1 3.09Å; N347-N382 PolarHBondContact O-OD1 3.18Å; K348-N382 PolarHBondContact N-OD1 3.03Å; L349-N382 HydrophobicContact CB-CB 4.11Å; L349-N382 WeakPolarHBondContact CB-OD1 3.22Å; L349-N382 WeakPolarHBondContact CG-OD1 3.38Å; L349-N382 PolarHBondContact N-OD1 3.48Å; L379-N382 WeakPolarHBondContact O-CB 3.2Å; L379-N382 PolarHBondContact O-ND2 3.2Å; N380-N382 VanDerWaalsContact C-N 3.25Å; N380-N382 PolarHBondContact O-N 3.37Å; N380-N382 PolarHBondContact O-ND2 2.86Å; N382-M384 HydrophobicContact CB-CG 3.69Å; N382-M384 HydrophobicContact CB-SD 4.18Å; N382-M384 PolarHBondContact O-N 3.49Å
383	P	89	Confident	88.4	Confident	65 Å²	65	58.1 Å²	58.1	42%	0.422	29%	0.287	S	S	.	.			trans	-74	56.3	176	33.4	-37.1	0	0	0	112.1	L349 R350	L349-P383 CarbonylContact O-C 3.53Å; L349-P383 VanDerWaalsContact O-CD 3.24Å; L349-P383 WeakPolarHBondContact O-CD 3.45Å; L349-P383 WeakPolarHBondContact O-CG 3.36Å; R350-P383 WeakPolarHBondContact CA-O 3.47Å; R350-P383 HydrophobicContact CG-CG 4.19Å
384	M	86.6	Confident	88.5	Confident	23 Å²	23	56.2 Å²	56.2	11%	0.113	29%	0.287	C	S	.	.			trans	-70.9	127.3	-171.7	-68.8	-67.2	-74.4	0	0	112	L349 F352 L379 N382 W386 I392	L349-M384 HydrophobicContact CB-SD 3.88Å; L349-M384 VanDerWaalsContact O-SD 3.41Å; F352-M384 HydrophobicContact CB-CE 3.73Å; L379-M384 HydrophobicContact CD1-CE 4.43Å; N382-M384 HydrophobicContact CB-CG 3.69Å; N382-M384 HydrophobicContact CB-SD 4.18Å; N382-M384 PolarHBondContact O-N 3.49Å; M384-W386 WeakPolarHBondContact CE-O 3.04Å; M384-I392 HydrophobicContact CB-CD1 3.7Å; M384-I392 HydrophobicContact CE-CD1 3.36Å; M384-I392 HydrophobicContact CG-CD1 3.57Å; M384-I392 HydrophobicContact SD-CD1 4.32Å
385	I	84.2	Confident	88.7	Confident	114 Å²	114	55.7 Å²	55.7	59%	0.585	29%	0.291	S	S	*	.			trans	-98	-40.6	170.3	-57	175.1	0	0	0	109.2	R350	R350-I385 HydrophobicContact CB-CD1 4.11Å; R350-I385 HydrophobicContact CB-CG1 4.31Å; R350-I385 WeakPolarHBondContact O-CA 3.43Å; R350-I385 WeakPolarHBondContact O-CB 3.22Å; R350-I385 PolarHBondContact O-N 2.98Å
386	W	81.1	Confident	88.9	Confident	66 Å²	66	56 Å²	56	25%	0.25	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-145.9	129.4	-179.7	-167	88.7	0	0	0	113.2	R350 T351 F352 A354 L357 M384 Y402 F403	R350-W386 PolarHBondContact O-N 3.32Å; T351-W386 CarbonylContact C-O 3.47Å; T351-W386 WeakPolarHBondContact CA-O 3.16Å; T351-W386 HydrophobicContact CG2-CB 4.3Å; F352-W386 PolarHBondContact N-O 3.09Å; F352-W386 WeakPolarHBondContact O-CZ3 3.27Å; A354-W386 HydrophobicContact CB-CH2 3.6Å; A354-W386 HydrophobicContact CB-CZ3 3.84Å; L357-W386 HydrophobicContact CD1-CH2 3.82Å; L357-W386 HydrophobicContact CD1-CZ3 3.99Å; M384-W386 WeakPolarHBondContact CE-O 3.04Å; W386-Y402 AromaticContact NE1-CE1 3.81Å; W386-F403 AromaticContact CH2-CD2 3.9Å; W386-F403 HydrophobicContact CH2-CD2 3.9Å; W386-F403 HydrophobicContact CH2-CE2 4.38Å; W386-F403 HydrophobicContact CZ2-CD2 4.23Å
387	P	85.4	Confident	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	S	Bend	cis	-58.6	158.2	-12.2	-23.4	34.9	0	0	0	112.2	L357 I391 I392 M399 Y402	L357-P387 HydrophobicContact CD1-CG 4.13Å; P387-I391 HydrophobicContact CB-CG2 4.3Å; P387-I392 HydrophobicContact CB-CG1 4.25Å; P387-I392 VanDerWaalsContact O-CD1 3.3Å; P387-I392 WeakPolarHBondContact O-CD1 3.39Å; P387-M399 HydrophobicContact CG-CE 3.74Å; P387-Y402 HydrophobicContact CB-CD1 4.16Å; P387-Y402 HydrophobicContact CB-CE1 4.27Å
388	P	83.9	Confident	88.8	Confident	39 Å²	39	53 Å²	53	25%	0.253	29%	0.287	S	S	.	.			trans	-57	148.2	173.7	-25.2	34.1	0	0	0	112.6	N390 I391 I392 Y402	P388-N390 VanDerWaalsContact C-N 3.34Å; P388-N390 WeakPolarHBondContact CB-OD1 3.23Å; P388-N390 PolarHBondContact O-N 3.12Å; P388-I391 HydrophobicContact CB-CD1 4.09Å; P388-I391 HydrophobicContact CG-CD1 3.92Å; P388-I391 WeakPolarHBondContact O-CB 3.02Å; P388-I391 PolarHBondContact O-N 3.03Å; P388-I392 PolarHBondContact O-N 3.41Å; P388-Y402 HydrophobicContact CG-CE1 4.47Å
389	Y	86.7	Confident	88.7	Confident	99 Å²	99	50.7 Å²	50.7	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-57.1	-41.5	-172.6	-179.4	-92	0	0	0	113.9	I391 I392 E393	Y389-I391 PolarHBondContact O-N 3.2Å; Y389-I392 WeakPolarHBondContact O-CB 3.37Å; Y389-I392 PolarHBondContact O-N 3.44Å; Y389-E393 HydrophobicContact CE1-CB 4.47Å; Y389-E393 PolarHBondContact O-N 2.94Å
390	N	86.4	Confident	88.5	Confident	104 Å²	104	50.9 Å²	50.9	56%	0.556	28%	0.275	S	S	*	.	H	α-helix	trans	-60.2	-26.4	177.7	60.3	-29.2	0	0	0	113.7	P388 C394	P388-N390 VanDerWaalsContact C-N 3.34Å; P388-N390 WeakPolarHBondContact CB-OD1 3.23Å; P388-N390 PolarHBondContact O-N 3.12Å; N390-C394 PolarHBondContact O-SG 3.01Å
391	I	89.2	Confident	88.2	Confident	26 Å²	26	53.5 Å²	53.5	13%	0.133	29%	0.286	C	S	.	.	H	α-helix	trans	-81.6	-37.2	174.9	-70	151.2	0	0	0	110.8	P387 P388 Y389 C394 M399 Y402	P387-I391 HydrophobicContact CB-CG2 4.3Å; P388-I391 HydrophobicContact CB-CD1 4.09Å; P388-I391 HydrophobicContact CG-CD1 3.92Å; P388-I391 WeakPolarHBondContact O-CB 3.02Å; P388-I391 PolarHBondContact O-N 3.03Å; Y389-I391 PolarHBondContact O-N 3.2Å; I391-C394 PolarHBondContact O-N 3.35Å; I391-M399 HydrophobicContact CG2-CB 4.44Å; I391-M399 HydrophobicContact CG2-CG 4.08Å; I391-Y402 HydrophobicContact CD1-CD1 3.82Å; I391-Y402 HydrophobicContact CD1-CD2 3.21Å; I391-Y402 HydrophobicContact CD1-CE1 3.95Å; I391-Y402 HydrophobicContact CD1-CE2 3.37Å; I391-Y402 HydrophobicContact CD1-CG 3.43Å; I391-Y402 VanDerWaalsContact CD1-CG 3.43Å; I391-Y402 HydrophobicContact CG1-CD2 4.23Å; I391-Y402 HydrophobicContact CG1-CG 4.25Å; I391-Y402 HydrophobicContact CG2-CD1 4.41Å; I391-Y402 HydrophobicContact CG2-CG 4.15Å
392	I	89.3	Confident	87.9	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.046	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-42.8	178	-65.6	173.2	0	0	0	110.8	L379 M384 P387 P388 Y389 C394 G395 M399	L379-I392 HydrophobicContact CB-CG2 3.68Å; L379-I392 HydrophobicContact CD1-CG2 4.38Å; M384-I392 HydrophobicContact CB-CD1 3.7Å; M384-I392 HydrophobicContact CE-CD1 3.36Å; M384-I392 HydrophobicContact CG-CD1 3.57Å; M384-I392 HydrophobicContact SD-CD1 4.32Å; P387-I392 HydrophobicContact CB-CG1 4.25Å; P387-I392 VanDerWaalsContact O-CD1 3.3Å; P387-I392 WeakPolarHBondContact O-CD1 3.39Å; P388-I392 PolarHBondContact O-N 3.41Å; Y389-I392 WeakPolarHBondContact O-CB 3.37Å; Y389-I392 PolarHBondContact O-N 3.44Å; I392-C394 PolarHBondContact O-N 3.43Å; I392-G395 WeakPolarHBondContact O-CA 3.31Å; I392-G395 PolarHBondContact O-N 2.92Å; I392-M399 HydrophobicContact CG1-CE 4.36Å; I392-M399 HydrophobicContact CG1-CG 4.49Å; I392-M399 HydrophobicContact CG1-SD 4.34Å
393	E	87.7	Confident	87.6	Confident	130 Å²	130	52.3 Å²	52.3	61%	0.607	27%	0.274	S	S	*	.	H	α-helix	trans	-60	-32.5	178.2	-170.1	175.5	-175.1	0	0	112.1	Y389 G395	Y389-E393 HydrophobicContact CE1-CB 4.47Å; Y389-E393 PolarHBondContact O-N 2.94Å; E393-G395 PolarHBondContact O-N 2.97Å
394	C	88.3	Confident	87.2	Confident	90 Å²	90	53.8 Å²	53.8	61%	0.608	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-7.1	174.1	-62.5	0	0	0	0	113.9	N390 I391 I392 S398	N390-C394 PolarHBondContact O-SG 3.01Å; I391-C394 PolarHBondContact O-N 3.35Å; I392-C394 PolarHBondContact O-N 3.43Å; C394-S398 WeakPolarHBondContact CB-OG 3.11Å; C394-S398 PolarHBondContact O-OG 2.95Å
395	G	90.6	Very high	86.5	Confident	26 Å²	26	57.3 Å²	57.3	27%	0.268	29%	0.292	S	S	.	.			trans	91.1	176.8	175.6	0	0	0	0	0	115.7	I392 E393 D397 S398 M399	I392-G395 WeakPolarHBondContact O-CA 3.31Å; I392-G395 PolarHBondContact O-N 2.92Å; E393-G395 PolarHBondContact O-N 2.97Å; G395-D397 VanDerWaalsContact C-N 3.3Å; G395-D397 PolarHBondContact O-N 3Å; G395-S398 PolarHBondContact O-N 3.29Å; G395-M399 PolarHBondContact O-N 3.08Å; G395-M399 VanDerWaalsContact O-N 3.08Å
396	I	91.8	Very high	85.8	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-61.7	-33.2	-171.6	-169.4	65.6	0	0	0	113.4	L357 I360 P371 L377 S398 M399 I400	L357-I396 HydrophobicContact CD2-CD1 3.86Å; I360-I396 HydrophobicContact CD1-CD1 4.12Å; I360-I396 HydrophobicContact CG2-CG1 4.5Å; P371-I396 HydrophobicContact CB-CG1 4.24Å; P371-I396 HydrophobicContact CB-CG2 4.16Å; L377-I396 HydrophobicContact CD2-CD1 4Å; I396-S398 VanDerWaalsContact C-N 3.34Å; I396-S398 PolarHBondContact O-N 3.26Å; I396-M399 HydrophobicContact CD1-CB 4.38Å; I396-M399 HydrophobicContact CD1-SD 3.98Å; I396-M399 WeakPolarHBondContact O-CB 3.49Å; I396-M399 PolarHBondContact O-N 3.28Å; I396-I400 HydrophobicContact CG1-CG1 4.5Å; I396-I400 WeakPolarHBondContact O-CG1 3.23Å; I396-I400 PolarHBondContact O-N 2.94Å
397	D	92.9	Very high	84.9	Confident	57 Å²	57	55.1 Å²	55.1	31%	0.305	28%	0.28	S	S	.	.	H	α-helix	trans	-62.7	-43.4	179	-64.5	-31.4	0	0	0	110.6	P371 S372 G395 I400 H401	P371-D397 WeakPolarHBondContact CB-OD1 3.41Å; P371-D397 WeakPolarHBondContact CD-OD1 3.18Å; P371-D397 WeakPolarHBondContact CG-OD1 3.3Å; S372-D397 VanDerWaalsContact CB-OD2 3.28Å; S372-D397 WeakPolarHBondContact CB-OD2 3.5Å; S372-D397 PolarHBondContact N-OD1 3.4Å; S372-D397 PolarHBondContact OG-OD1 3.37Å; S372-D397 PolarHBondContact OG-OD2 3.4Å; G395-D397 VanDerWaalsContact C-N 3.3Å; G395-D397 PolarHBondContact O-N 3Å; D397-I400 PolarHBondContact O-N 3.15Å; D397-H401 PolarHBondContact O-N 3.22Å
398	S	91.7	Very high	83.2	Confident	47 Å²	47	60.7 Å²	60.7	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-36.6	174.7	-59.2	0	0	0	0	112.5	C394 G395 I396 I400 H401 Y402	C394-S398 WeakPolarHBondContact CB-OG 3.11Å; C394-S398 PolarHBondContact O-OG 2.95Å; G395-S398 PolarHBondContact O-N 3.29Å; I396-S398 VanDerWaalsContact C-N 3.34Å; I396-S398 PolarHBondContact O-N 3.26Å; S398-I400 VanDerWaalsContact C-N 3.31Å; S398-I400 PolarHBondContact O-N 3.42Å; S398-H401 PolarHBondContact O-N 2.83Å; S398-Y402 WeakPolarHBondContact O-CB 3.3Å; S398-Y402 PolarHBondContact O-N 2.8Å
399	M	90.7	Very high	81.4	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.02	34%	0.34	C	S	.	.	H	α-helix	trans	-61.3	-39.6	172.2	-66.2	174.6	72.6	0	0	112.1	F352 L357 L379 P387 I391 I392 G395 I396 F403	F352-M399 HydrophobicContact CB-CE 4.35Å; F352-M399 HydrophobicContact CD1-CE 3.85Å; F352-M399 HydrophobicContact CE1-CE 4.3Å; F352-M399 HydrophobicContact CG-CE 4.13Å; L357-M399 HydrophobicContact CD2-CB 4.07Å; L357-M399 HydrophobicContact CD2-CE 3.99Å; L379-M399 HydrophobicContact CD1-CE 3.71Å; L379-M399 HydrophobicContact CD1-SD 4.18Å; P387-M399 HydrophobicContact CG-CE 3.74Å; I391-M399 HydrophobicContact CG2-CB 4.44Å; I391-M399 HydrophobicContact CG2-CG 4.08Å; I392-M399 HydrophobicContact CG1-CE 4.36Å; I392-M399 HydrophobicContact CG1-CG 4.49Å; I392-M399 HydrophobicContact CG1-SD 4.34Å; G395-M399 PolarHBondContact O-N 3.08Å; G395-M399 VanDerWaalsContact O-N 3.08Å; I396-M399 HydrophobicContact CD1-CB 4.38Å; I396-M399 HydrophobicContact CD1-SD 3.98Å; I396-M399 WeakPolarHBondContact O-CB 3.49Å; I396-M399 PolarHBondContact O-N 3.28Å; M399-F403 WeakPolarHBondContact O-CB 3.43Å; M399-F403 PolarHBondContact O-N 3.46Å
400	I	88.9	Confident	78.9	Confident	7 Å²	7	68.6 Å²	68.6	4%	0.036	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-42	175.8	-65.2	-57.4	0	0	0	110.8	L357 I360 A361 P371 I396 D397 S398 F403 Q404	L357-I400 HydrophobicContact CB-CD1 3.86Å; L357-I400 HydrophobicContact CD2-CD1 3.81Å; L357-I400 HydrophobicContact CG-CD1 4.43Å; L357-I400 WeakPolarHBondContact O-CD1 3.03Å; I360-I400 HydrophobicContact CB-CD1 4.19Å; I360-I400 HydrophobicContact CG2-CD1 4.24Å; I360-I400 HydrophobicContact CG2-CG1 4.47Å; A361-I400 HydrophobicContact CB-CD1 4.22Å; A361-I400 HydrophobicContact CB-CG2 3.9Å; P371-I400 HydrophobicContact CB-CG1 3.89Å; P371-I400 HydrophobicContact CG-CB 4.19Å; P371-I400 HydrophobicContact CG-CG1 3.81Å; P371-I400 HydrophobicContact CG-CG2 4.33Å; I396-I400 HydrophobicContact CG1-CG1 4.5Å; I396-I400 WeakPolarHBondContact O-CG1 3.23Å; I396-I400 PolarHBondContact O-N 2.94Å; D397-I400 PolarHBondContact O-N 3.15Å; S398-I400 VanDerWaalsContact C-N 3.31Å; S398-I400 PolarHBondContact O-N 3.42Å; I400-F403 WeakPolarHBondContact O-CB 3.47Å; I400-F403 PolarHBondContact O-N 3.38Å; I400-Q404 HydrophobicContact CG2-CG 4.42Å; I400-Q404 WeakPolarHBondContact O-CB 3.16Å; I400-Q404 VanDerWaalsContact O-CG 3.32Å; I400-Q404 WeakPolarHBondContact O-CG 3.5Å; I400-Q404 PolarHBondContact O-N 3.49Å
401	H	85.6	Confident	76.6	Confident	106 Å²	106	68.4 Å²	68.4	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-52.3	175.5	-169.3	-86.6	0	0	0	111.4	D397 S398 F403 Q404 E405	D397-H401 PolarHBondContact O-N 3.22Å; S398-H401 PolarHBondContact O-N 2.83Å; H401-F403 VanDerWaalsContact C-N 3.27Å; H401-F403 PolarHBondContact O-N 3.2Å; H401-Q404 WeakPolarHBondContact O-CA 3.36Å; H401-Q404 WeakPolarHBondContact O-CB 3.26Å; H401-Q404 PolarHBondContact O-N 2.96Å; H401-E405 IonicContact CE1-OE1 3.92Å; H401-E405 PolarHBondContact CE1-OE1 3.41Å; H401-E405 IonicContact CE1-OE2 3.59Å; H401-E405 PolarHBondContact CE1-OE2 3.1Å; H401-E405 VanDerWaalsContact ND1-CD 3.27Å; H401-E405 IonicContact ND1-OE1 3.19Å; H401-E405 IonicContact ND1-OE2 2.73Å; H401-E405 PolarHBondContact ND1-OE2 2.65Å; H401-E405 PolarHBondContact O-N 3.13Å
402	Y	84.2	Confident	74.5	Confident	70 Å²	70	71 Å²	71	28%	0.275	37%	0.372	S	S	.	.	H	α-helix	trans	-57.4	-41.2	176.2	178.3	-106.3	0	0	0	112.1	W386 P387 P388 I391 S398 Q404 E405 S406	W386-Y402 AromaticContact NE1-CE1 3.81Å; P387-Y402 HydrophobicContact CB-CD1 4.16Å; P387-Y402 HydrophobicContact CB-CE1 4.27Å; P388-Y402 HydrophobicContact CG-CE1 4.47Å; I391-Y402 HydrophobicContact CD1-CD1 3.82Å; I391-Y402 HydrophobicContact CD1-CD2 3.21Å; I391-Y402 HydrophobicContact CD1-CE1 3.95Å; I391-Y402 HydrophobicContact CD1-CE2 3.37Å; I391-Y402 HydrophobicContact CD1-CG 3.43Å; I391-Y402 VanDerWaalsContact CD1-CG 3.43Å; I391-Y402 HydrophobicContact CG1-CD2 4.23Å; I391-Y402 HydrophobicContact CG1-CG 4.25Å; I391-Y402 HydrophobicContact CG2-CD1 4.41Å; I391-Y402 HydrophobicContact CG2-CG 4.15Å; S398-Y402 WeakPolarHBondContact O-CB 3.3Å; S398-Y402 PolarHBondContact O-N 2.8Å; Y402-Q404 PolarHBondContact O-N 2.88Å; Y402-E405 PolarHBondContact O-N 2.9Å; Y402-S406 VanDerWaalsContact O-CB 3.31Å; Y402-S406 WeakPolarHBondContact O-CB 3.44Å; Y402-S406 PolarHBondContact O-N 2.66Å; Y402-S406 PolarHBondContact O-OG 2.95Å
403	F	85.1	Confident	72.3	Confident	8 Å²	8	75.1 Å²	75.1	4%	0.035	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-40.3	175	174.5	-113	0	0	0	112.7	A354 L357 K358 W386 M399 I400 H401 S406 R407	A354-F403 HydrophobicContact CB-CE2 3.81Å; A354-F403 WeakPolarHBondContact O-CZ 3.25Å; L357-F403 HydrophobicContact CB-CB 4.26Å; L357-F403 HydrophobicContact CB-CD1 3.92Å; L357-F403 HydrophobicContact CB-CD2 4.3Å; L357-F403 HydrophobicContact CB-CE1 4.27Å; L357-F403 HydrophobicContact CB-CG 3.89Å; L357-F403 HydrophobicContact CD1-CB 3.97Å; L357-F403 HydrophobicContact CD1-CD2 4.33Å; L357-F403 HydrophobicContact CD1-CG 4.21Å; K358-F403 HydrophobicContact CB-CE1 3.87Å; K358-F403 HydrophobicContact CB-CZ 3.91Å; W386-F403 AromaticContact CH2-CD2 3.9Å; W386-F403 HydrophobicContact CH2-CD2 3.9Å; W386-F403 HydrophobicContact CH2-CE2 4.38Å; W386-F403 HydrophobicContact CZ2-CD2 4.23Å; M399-F403 WeakPolarHBondContact O-CB 3.43Å; M399-F403 PolarHBondContact O-N 3.46Å; I400-F403 WeakPolarHBondContact O-CB 3.47Å; I400-F403 PolarHBondContact O-N 3.38Å; H401-F403 VanDerWaalsContact C-N 3.27Å; H401-F403 PolarHBondContact O-N 3.2Å; F403-S406 WeakPolarHBondContact CA-OG 3.43Å; F403-S406 PolarHBondContact O-OG 3.23Å; F403-R407 VanDerWaalsContact CZ-NE 3.32Å; F403-R407 PolarHBondContact O-N 2.9Å
404	Q	80.5	Confident	70.8	Confident	97 Å²	97	74.9 Å²	74.9	45%	0.453	38%	0.382	S	S	.	.	H	α-helix	trans	-68.5	-42.2	176.3	-73.3	174.4	-14	0	0	111.8	I400 H401 Y402 R407 T408	I400-Q404 HydrophobicContact CG2-CG 4.42Å; I400-Q404 WeakPolarHBondContact O-CB 3.16Å; I400-Q404 VanDerWaalsContact O-CG 3.32Å; I400-Q404 WeakPolarHBondContact O-CG 3.5Å; I400-Q404 PolarHBondContact O-N 3.49Å; H401-Q404 WeakPolarHBondContact O-CA 3.36Å; H401-Q404 WeakPolarHBondContact O-CB 3.26Å; H401-Q404 PolarHBondContact O-N 2.96Å; Y402-Q404 PolarHBondContact O-N 2.88Å; Q404-R407 WeakPolarHBondContact O-CB 3.23Å; Q404-R407 PolarHBondContact O-N 2.97Å; Q404-R407 VanDerWaalsContact O-N 3.1Å; Q404-T408 PolarHBondContact O-N 3.21Å
405	E	73.1	Confident	69.6	Low	97 Å²	97	71.6 Å²	71.6	45%	0.453	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-44.2	175	-74.4	-178.2	136.9	0	0	111.7	H401 Y402 R407 T408 E409	H401-E405 IonicContact CE1-OE1 3.92Å; H401-E405 PolarHBondContact CE1-OE1 3.41Å; H401-E405 IonicContact CE1-OE2 3.59Å; H401-E405 PolarHBondContact CE1-OE2 3.1Å; H401-E405 VanDerWaalsContact ND1-CD 3.27Å; H401-E405 IonicContact ND1-OE1 3.19Å; H401-E405 IonicContact ND1-OE2 2.73Å; H401-E405 PolarHBondContact ND1-OE2 2.65Å; H401-E405 PolarHBondContact O-N 3.13Å; Y402-E405 PolarHBondContact O-N 2.9Å; E405-R407 PolarHBondContact O-N 3.25Å; E405-T408 WeakPolarHBondContact CA-OG1 3.36Å; E405-T408 PolarHBondContact O-N 2.86Å; E405-T408 PolarHBondContact O-OG1 3.4Å; E405-E409 PolarHBondContact O-N 3.23Å
406	S	67.9	Low	68.8	Low	28 Å²	28	70.4 Å²	70.4	20%	0.196	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-23.9	175.2	74.2	0	0	0	0	112.7	Y402 F403 L410	Y402-S406 VanDerWaalsContact O-CB 3.31Å; Y402-S406 WeakPolarHBondContact O-CB 3.44Å; Y402-S406 PolarHBondContact O-N 2.66Å; Y402-S406 PolarHBondContact O-OG 2.95Å; F403-S406 WeakPolarHBondContact CA-OG 3.43Å; F403-S406 PolarHBondContact O-OG 3.23Å; S406-L410 WeakPolarHBondContact O-CD1 3.27Å
407	R	62.5	Low	68.2	Low	105 Å²	105	71.6 Å²	71.6	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-85	-34.1	173	-77.8	-177	166.7	178.8	1.3	113.8	F403 Q404 E405 E409 L410	F403-R407 VanDerWaalsContact CZ-NE 3.32Å; F403-R407 PolarHBondContact O-N 2.9Å; Q404-R407 WeakPolarHBondContact O-CB 3.23Å; Q404-R407 PolarHBondContact O-N 2.97Å; Q404-R407 VanDerWaalsContact O-N 3.1Å; E405-R407 PolarHBondContact O-N 3.25Å; R407-E409 PolarHBondContact O-N 3.23Å; R407-L410 PolarHBondContact O-N 3.38Å
408	T	50.8	Low	67.8	Low	117 Å²	117	69 Å²	69	72%	0.718	34%	0.342	S	S	*	.	H	α-helix	trans	-62.7	-23.9	176.9	47.8	0	0	0	0	112	Q404 E405	Q404-T408 PolarHBondContact O-N 3.21Å; E405-T408 WeakPolarHBondContact CA-OG1 3.36Å; E405-T408 PolarHBondContact O-N 2.86Å; E405-T408 PolarHBondContact O-OG1 3.4Å
409	E	44.5	Very low	67.6	Low	170 Å²	170	67 Å²	67	79%	0.794	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-14.4	172.6	-64.5	-175.8	167.5	0	0	114	E405 R407	E405-E409 PolarHBondContact O-N 3.23Å; R407-E409 PolarHBondContact O-N 3.23Å
410	L	35.8	Very low	67.6	Low	134 Å²	134	66.8 Å²	66.8	70%	0.702	33%	0.326	S	S	*	.			trans	-111.3	82.9	-174.8	-75.2	167.5	0	0	0	111.8	S406 R407 S412	S406-L410 WeakPolarHBondContact O-CD1 3.27Å; R407-L410 PolarHBondContact O-N 3.38Å; L410-S412 PolarHBondContact O-N 3.01Å
411	Q	37.9	Very low	67.6	Low	101 Å²	101	66.4 Å²	66.4	47%	0.472	32%	0.324	S	S	.	.			trans	-75	116	154.7	-75	-179.6	-9	0	0	107.9	Y413	Q411-Y413 HydrophobicContact CB-CD2 4.1Å; Q411-Y413 HydrophobicContact CB-CE2 3.44Å; Q411-Y413 VanDerWaalsContact CB-CE2 3.44Å; Q411-Y413 WeakPolarHBondContact O-CD2 3.42Å; Q411-Y413 PolarHBondContact O-N 2.98Å; Q411-Y413 VanDerWaalsContact O-N 3.14Å; Q411-Y413 PolarHBondContact OE1-OH 2.77Å
412	S	45	Very low	67.6	Low	81 Å²	81	61.4 Å²	61.4	57%	0.566	30%	0.301	S	S	*	.			trans	-76.6	100.3	-178.3	52.5	0	0	0	0	110.5	L410	L410-S412 PolarHBondContact O-N 3.01Å
413	Y	42.7	Very low	67.6	Low	95 Å²	95	60.1 Å²	60.1	37%	0.373	30%	0.299	S	S	.	.			trans	-95	132	168.6	-65.7	-87.7	0	0	0	109.1	Q411 R490 P694	Q411-Y413 HydrophobicContact CB-CD2 4.1Å; Q411-Y413 HydrophobicContact CB-CE2 3.44Å; Q411-Y413 VanDerWaalsContact CB-CE2 3.44Å; Q411-Y413 WeakPolarHBondContact O-CD2 3.42Å; Q411-Y413 PolarHBondContact O-N 2.98Å; Q411-Y413 VanDerWaalsContact O-N 3.14Å; Q411-Y413 PolarHBondContact OE1-OH 2.77Å; Y413-R490 WeakPolarHBondContact OH-CD 3.31Å; Y413-P694 HydrophobicContact CE1-CB 4.3Å
414	Y	55.6	Low	67.5	Low	125 Å²	125	63.2 Å²	63.2	49%	0.49	32%	0.315	S	S	.	.			trans	-89.8	110.2	173.2	-76.3	-85.3	0	0	0	109.3	F690 L695	Y414-F690 HydrophobicContact CD1-CD1 4.12Å; Y414-F690 AromaticContact CD2-CD1 3.6Å; Y414-F690 HydrophobicContact CD2-CD1 3.6Å; Y414-F690 HydrophobicContact CD2-CE1 4.36Å; Y414-F690 HydrophobicContact CD2-CG 4.49Å; Y414-F690 HydrophobicContact CE1-CD1 4.35Å; Y414-F690 AromaticContact CE2-CD1 3.85Å; Y414-F690 HydrophobicContact CE2-CD1 3.85Å; Y414-F690 HydrophobicContact CE2-CE1 4.16Å; Y414-F690 HydrophobicContact CG-CB 4.13Å; Y414-F690 AromaticContact CG-CD1 3.73Å; Y414-F690 HydrophobicContact CG-CD1 3.73Å; Y414-F690 HydrophobicContact CG-CG 4.29Å; Y414-L695 HydrophobicContact CD2-CD1 4.05Å; Y414-L695 HydrophobicContact CE2-CD1 3.75Å
415	G	63.2	Low	67.4	Low	21 Å²	21	62 Å²	62	22%	0.216	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-76	167.8	172.8	0	0	0	0	0	113.5	T493	G415-T493 CarbonylContact C-O 3.56Å; G415-T493 VanDerWaalsContact C-O 3.3Å; G415-T493 WeakPolarHBondContact CA-O 3.5Å; G415-T493 VanDerWaalsContact CA-OG1 3.27Å; G415-T493 WeakPolarHBondContact CA-OG1 3.49Å
416	I	73.6	Confident	67.8	Low	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	129	168.6	-63.2	175.8	0	0	0	108.2	I418 T493 I494 T495 I518 I677 F678 A681 Y687 C691	I416-I418 HydrophobicContact CG2-CG1 3.98Å; I416-T493 PolarHBondContact N-O 3.05Å; I416-I494 HydrophobicContact CB-CG1 4.38Å; I416-I494 CarbonylContact O-C 3.55Å; I416-I494 WeakPolarHBondContact O-CA 3.25Å; I416-T495 PolarHBondContact O-N 3.11Å; I416-T495 PolarHBondContact O-OG1 3.14Å; I416-I518 HydrophobicContact CG2-CD1 3.83Å; I416-I518 HydrophobicContact CG2-CG1 4.49Å; I416-I677 HydrophobicContact CD1-CG2 4.12Å; I416-I677 HydrophobicContact CG2-CG2 3.86Å; I416-F678 HydrophobicContact CD1-CD1 3.6Å; I416-F678 HydrophobicContact CD1-CD2 4.45Å; I416-F678 HydrophobicContact CD1-CE1 3.45Å; I416-F678 VanDerWaalsContact CD1-CE1 3.45Å; I416-F678 HydrophobicContact CD1-CE2 4.33Å; I416-F678 HydrophobicContact CD1-CG 4.12Å; I416-F678 HydrophobicContact CD1-CZ 3.84Å; I416-A681 HydrophobicContact CD1-CB 3.95Å; I416-A681 HydrophobicContact CG1-CB 4.48Å; I416-Y687 HydrophobicContact CG1-CE1 4.31Å; I416-Y687 HydrophobicContact CG2-CE1 4.45Å; I416-C691 WeakPolarHBondContact CG1-SG 3.49Å
417	K	80.1	Confident	68.4	Low	33 Å²	33	56.5 Å²	56.5	14%	0.143	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.5	172	-175	179.4	174.2	174.4	0	109.7	T495 F512 T517 I518 Y687	K417-T495 WeakPolarHBondContact CA-OG1 3.41Å; K417-F512 PolarHBondContact NZ-O 2.61Å; K417-T517 HydrophobicContact CD-CG2 4.33Å; K417-T517 HydrophobicContact CG-CG2 4.19Å; K417-I518 PolarHBondContact O-N 3.12Å; K417-Y687 PolarHBondContact N-OH 3.07Å; K417-Y687 PolarHBondContact O-OH 3.23Å
418	I	85.1	Confident	69.6	Low	3 Å²	3	52.1 Å²	52.1	2%	0.015	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	139.2	176.5	-55.2	-179.1	0	0	0	108.7	I416 I494 T495 L496 W497 I518 I520 I677	I416-I418 HydrophobicContact CG2-CG1 3.98Å; I418-I494 HydrophobicContact CD1-CG2 3.29Å; I418-I494 HydrophobicContact CG1-CG2 3.83Å; I418-T495 PolarHBondContact N-O 2.79Å; I418-L496 HydrophobicContact CB-CD1 3.9Å; I418-L496 HydrophobicContact CG2-CD1 3.65Å; I418-W497 WeakPolarHBondContact O-CB 3.13Å; I418-W497 PolarHBondContact O-N 3.02Å; I418-I518 CarbonylContact C-O 3.56Å; I418-I518 VanDerWaalsContact CA-O 3.31Å; I418-I518 WeakPolarHBondContact CA-O 3.49Å; I418-I520 HydrophobicContact CG2-CD1 3.41Å; I418-I520 VanDerWaalsContact CG2-CD1 3.41Å; I418-I520 HydrophobicContact CG2-CG1 3.67Å; I418-I677 HydrophobicContact CD1-CD1 3.42Å; I418-I677 VanDerWaalsContact CD1-CD1 3.42Å; I418-I677 HydrophobicContact CD1-CG1 3.93Å; I418-I677 HydrophobicContact CD1-CG2 3.79Å; I418-I677 HydrophobicContact CG1-CG2 4.35Å
419	T	87.7	Confident	71.2	Confident	4 Å²	4	47 Å²	47	3%	0.025	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.1	174.2	-59.6	0	0	0	0	109.9	L421 W497 C499 T517 I518 F519 I520	T419-L421 HydrophobicContact CG2-CD2 3.93Å; T419-L421 HydrophobicContact CG2-CG 4.26Å; T419-W497 WeakPolarHBondContact CA-O 3.38Å; T419-W497 HydrophobicContact CG2-CB 4.35Å; T419-C499 VanDerWaalsContact CG2-SG 3.51Å; T419-T517 WeakPolarHBondContact OG1-CG2 3.43Å; T419-I518 PolarHBondContact N-O 3.14Å; T419-F519 HydrophobicContact CG2-CD1 4.28Å; T419-F519 HydrophobicContact CG2-CE1 4.2Å; T419-I520 PolarHBondContact O-N 3.35Å
420	L	89.3	Confident	73	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	125.1	175.1	-57.9	-177.4	0	0	0	109.2	L431 A432 L496 W497 D498 C499 I520	L420-L431 HydrophobicContact CD2-CD2 4.33Å; L420-A432 HydrophobicContact CD1-CB 3.67Å; L420-L496 HydrophobicContact CD1-CD1 4.07Å; L420-L496 HydrophobicContact CD1-CD2 4.16Å; L420-L496 HydrophobicContact CD1-CG 4.23Å; L420-L496 HydrophobicContact CD2-CD1 3.83Å; L420-L496 HydrophobicContact CG-CD1 3.74Å; L420-L496 HydrophobicContact CG-CG 4.29Å; L420-W497 PolarHBondContact N-O 3.36Å; L420-D498 HydrophobicContact CD1-CB 4.45Å; L420-C499 WeakPolarHBondContact O-CB 3.33Å; L420-C499 PolarHBondContact O-N 2.79Å; L420-I520 CarbonylContact C-O 3.54Å; L420-I520 WeakPolarHBondContact CA-O 3.1Å; L420-I520 HydrophobicContact CD2-CB 3.7Å; L420-I520 HydrophobicContact CD2-CD1 4.08Å; L420-I520 HydrophobicContact CD2-CG1 4.33Å; L420-I520 HydrophobicContact CD2-CG2 3.86Å
421	L	88.9	Confident	75.2	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.7	177.8	-59.6	178.9	0	0	0	109.1	T419 K428 C499 I509 F519 I520 I521 V522 W560 I564	T419-L421 HydrophobicContact CG2-CD2 3.93Å; T419-L421 HydrophobicContact CG2-CG 4.26Å; L421-K428 VanDerWaalsContact C-CD 3.47Å; L421-C499 HydrophobicContact CD2-CB 4.11Å; L421-I509 HydrophobicContact CD2-CD1 4.36Å; L421-I509 HydrophobicContact CD2-CG2 3.86Å; L421-F519 HydrophobicContact CD1-CD1 3.49Å; L421-F519 VanDerWaalsContact CD1-CD1 3.49Å; L421-F519 HydrophobicContact CD1-CE1 4.1Å; L421-F519 HydrophobicContact CD1-CG 4.32Å; L421-F519 HydrophobicContact CG-CD1 4.17Å; L421-I520 PolarHBondContact N-O 3.29Å; L421-I521 HydrophobicContact CB-CG1 4.32Å; L421-I521 CarbonylContact O-C 3.59Å; L421-I521 VanDerWaalsContact O-CA 3.31Å; L421-I521 WeakPolarHBondContact O-CA 3.27Å; L421-V522 PolarHBondContact O-N 3.11Å; L421-W560 HydrophobicContact CB-CB 4.47Å; L421-W560 HydrophobicContact CB-CD2 3.96Å; L421-W560 HydrophobicContact CB-CE3 4.2Å; L421-W560 HydrophobicContact CB-CG 4.07Å; L421-W560 HydrophobicContact CD1-CB 4.26Å; L421-W560 HydrophobicContact CD1-CD2 4.37Å; L421-W560 HydrophobicContact CD1-CE3 4Å; L421-W560 HydrophobicContact CD1-CG 4.5Å; L421-W560 HydrophobicContact CD2-CD2 4.47Å; L421-W560 HydrophobicContact CD2-CE3 3.87Å; L421-W560 HydrophobicContact CD2-CH2 4.48Å; L421-W560 HydrophobicContact CD2-CZ3 3.87Å; L421-W560 HydrophobicContact CG-CE3 4.25Å; L421-I564 HydrophobicContact CD1-CD1 4.06Å; L421-I564 HydrophobicContact CD1-CG1 4.47Å
422	G	87	Confident	77.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.			trans	144.1	166.1	-177.6	0	0	0	0	0	111.8	K428 G501	G422-K428 WeakPolarHBondContact O-CE 3.37Å; G422-K428 PolarHBondContact O-NZ 2.95Å; G422-G501 WeakPolarHBondContact O-CA 3.41Å
423	D	84.3	Confident	79.1	Confident	43 Å²	43	25.9 Å²	25.9	23%	0.23	13%	0.128	C	C	.	.			trans	-64.9	164.8	-174.6	-165.7	16.4	0	0	0	113.4	N425 C426 K428 T556	D423-N425 PolarHBondContact O-N 2.93Å; D423-C426 PolarHBondContact O-SG 3.16Å; D423-K428 PolarHBondContact O-NZ 2.71Å; D423-T556 HydrophobicContact CB-CG2 3.64Å; D423-T556 WeakPolarHBondContact OD2-CG2 3.43Å
424	I	81.6	Confident	80.8	Confident	74 Å²	74	21.3 Å²	21.3	38%	0.379	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	137.3	172.6	-56.3	167.8	0	0	0	108.4	C426 H502	I424-C426 VanDerWaalsContact C-N 3.34Å; I424-C426 PolarHBondContact O-N 2.99Å; I424-H502 HydrophobicContact CD1-CB 4.17Å; I424-H502 HydrophobicContact CG1-CB 4.5Å
425	N	79.3	Confident	82	Confident	72 Å²	72	15.6 Å²	15.6	39%	0.385	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	35.8	173.9	-68.9	19.3	0	0	0	115.1	D423 E447 T449 K579	D423-N425 PolarHBondContact O-N 2.93Å; N425-E447 WeakPolarHBondContact CA-OE2 3.25Å; N425-E447 WeakPolarHBondContact CB-OE2 3.15Å; N425-T449 WeakPolarHBondContact OD1-CG2 3.17Å; N425-K579 PolarHBondContact O-NZ 2.99Å
426	C	82.2	Confident	82.7	Confident	1 Å²	1	17 Å²	17	1%	0.007	9%	0.092	C	C	.	.	S	Bend	trans	-99.8	6.6	171.8	72.8	0	0	0	0	113.5	D423 I424 K428 V522 D524 T578	D423-C426 PolarHBondContact O-SG 3.16Å; I424-C426 VanDerWaalsContact C-N 3.34Å; I424-C426 PolarHBondContact O-N 2.99Å; C426-K428 VanDerWaalsContact SG-CG 3.59Å; C426-V522 WeakPolarHBondContact O-CG1 3.38Å; C426-V522 PolarHBondContact SG-O 2.97Å; C426-D524 HydrophobicContact CB-CB 4.09Å; C426-T578 PolarHBondContact O-OG1 3.31Å
427	G	80.1	Confident	82.8	Confident	7 Å²	7	20.1 Å²	20.1	7%	0.072	11%	0.109	C	C	.	.	S	Bend	trans	84.1	25.5	179	0	0	0	0	0	115.7	L431	G427-L431 VanDerWaalsContact O-CB 3.24Å; G427-L431 WeakPolarHBondContact O-CB 3.44Å; G427-L431 PolarHBondContact O-N 3.33Å
428	K	86.1	Confident	82.4	Confident	13 Å²	13	26.5 Å²	26.5	6%	0.057	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-52	176.4	-68.9	-176.6	-56.2	-68.1	0	112.5	L421 G422 D423 C426 L431 A432 D498 C499 V522	L421-K428 VanDerWaalsContact C-CD 3.47Å; G422-K428 WeakPolarHBondContact O-CE 3.37Å; G422-K428 PolarHBondContact O-NZ 2.95Å; D423-K428 PolarHBondContact O-NZ 2.71Å; C426-K428 VanDerWaalsContact SG-CG 3.59Å; K428-L431 CarbonylContact O-C 3.59Å; K428-L431 WeakPolarHBondContact O-CB 3.41Å; K428-L431 PolarHBondContact O-N 2.99Å; K428-A432 WeakPolarHBondContact O-CB 3.36Å; K428-A432 PolarHBondContact O-N 3.24Å; K428-D498 WeakPolarHBondContact CB-OD1 3.5Å; K428-C499 WeakPolarHBondContact CE-O 3.37Å; K428-V522 HydrophobicContact CG-CB 3.78Å; K428-V522 HydrophobicContact CG-CG1 4.37Å; K428-V522 HydrophobicContact CG-CG2 3.88Å
429	S	85.3	Confident	81.5	Confident	10 Å²	10	32.1 Å²	32.1	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-69	-39.5	-178	-48.2	0	0	0	0	111.3	L431 A432 M433 E448 T450 D498	S429-L431 VanDerWaalsContact C-N 3.32Å; S429-L431 PolarHBondContact O-N 2.76Å; S429-A432 PolarHBondContact O-N 3.42Å; S429-A432 VanDerWaalsContact O-N 3.13Å; S429-M433 WeakPolarHBondContact O-CB 3.3Å; S429-M433 PolarHBondContact O-N 3.39Å; S429-E448 VanDerWaalsContact CB-O 3.25Å; S429-E448 WeakPolarHBondContact CB-O 3.36Å; S429-E448 PolarHBondContact OG-O 3.05Å; S429-T450 PolarHBondContact OG-N 3.06Å; S429-T450 PolarHBondContact OG-OG1 3.44Å; S429-T450 VanDerWaalsContact OG-OG1 3.09Å; S429-D498 WeakPolarHBondContact CA-OD2 3.34Å; S429-D498 WeakPolarHBondContact CB-OD2 3.5Å; S429-D498 PolarHBondContact N-OD2 3.05Å; S429-D498 PolarHBondContact OG-OD2 3.22Å
430	S	81.6	Confident	80.4	Confident	9 Å²	9	34.5 Å²	34.5	6%	0.063	18%	0.176	C	C	.	.	H	α-helix	trans	-57.3	-44.1	169.8	-47.8	0	0	0	0	111.7	S434	S430-S434 WeakPolarHBondContact O-CB 3.33Å; S430-S434 PolarHBondContact O-N 2.91Å; S430-S434 PolarHBondContact O-OG 2.95Å
431	L	81.9	Confident	79.3	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-63.9	-45.2	174.2	177.3	68.8	0	0	0	111.3	L420 G427 K428 S429 S434 I435 M442 V522 I576 I653	L420-L431 HydrophobicContact CD2-CD2 4.33Å; G427-L431 VanDerWaalsContact O-CB 3.24Å; G427-L431 WeakPolarHBondContact O-CB 3.44Å; G427-L431 PolarHBondContact O-N 3.33Å; K428-L431 CarbonylContact O-C 3.59Å; K428-L431 WeakPolarHBondContact O-CB 3.41Å; K428-L431 PolarHBondContact O-N 2.99Å; S429-L431 VanDerWaalsContact C-N 3.32Å; S429-L431 PolarHBondContact O-N 2.76Å; L431-S434 PolarHBondContact O-N 2.81Å; L431-I435 HydrophobicContact CD1-CD1 4.06Å; L431-I435 HydrophobicContact CD1-CG1 4.31Å; L431-I435 HydrophobicContact CG-CD1 3.88Å; L431-I435 HydrophobicContact CG-CG1 4.49Å; L431-I435 WeakPolarHBondContact O-CG1 3.49Å; L431-I435 PolarHBondContact O-N 3.42Å; L431-M442 HydrophobicContact CB-SD 4.29Å; L431-V522 HydrophobicContact CD2-CG2 3.79Å; L431-I576 HydrophobicContact CD2-CD1 3.7Å; L431-I576 HydrophobicContact CD2-CG2 4.41Å; L431-I653 HydrophobicContact CD1-CD1 3.62Å
432	A	84.7	Confident	78.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-52.7	-179.4	0	0	0	0	0	111.5	L420 K428 S429 S434 I435 V436 Y456 L496 D498	L420-A432 HydrophobicContact CD1-CB 3.67Å; K428-A432 WeakPolarHBondContact O-CB 3.36Å; K428-A432 PolarHBondContact O-N 3.24Å; S429-A432 PolarHBondContact O-N 3.42Å; S429-A432 VanDerWaalsContact O-N 3.13Å; A432-S434 VanDerWaalsContact C-N 3.31Å; A432-S434 PolarHBondContact O-N 3.48Å; A432-I435 WeakPolarHBondContact O-CB 3.38Å; A432-I435 PolarHBondContact O-N 2.74Å; A432-V436 VanDerWaalsContact O-CG2 3.25Å; A432-V436 WeakPolarHBondContact O-CG2 3.45Å; A432-V436 PolarHBondContact O-N 3.24Å; A432-Y456 HydrophobicContact CB-CD2 4.32Å; A432-Y456 HydrophobicContact CB-CE2 3.98Å; A432-L496 HydrophobicContact CB-CD2 3.7Å; A432-D498 HydrophobicContact CB-CB 4.16Å
433	M	80.7	Confident	76.5	Confident	31 Å²	31	41.9 Å²	41.9	15%	0.153	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-36.6	177.7	-70.8	-53.8	-60.8	0	0	112.1	S429 I435 V436 D437 E448 Y456	S429-M433 WeakPolarHBondContact O-CB 3.3Å; S429-M433 PolarHBondContact O-N 3.39Å; M433-I435 VanDerWaalsContact C-N 3.3Å; M433-I435 PolarHBondContact O-N 3.34Å; M433-V436 PolarHBondContact O-N 3.13Å; M433-D437 WeakPolarHBondContact CE-OD2 3.49Å; M433-D437 PolarHBondContact O-N 2.81Å; M433-E448 WeakPolarHBondContact CG-OE2 3.44Å; M433-Y456 HydrophobicContact SD-CD1 4.5Å; M433-Y456 HydrophobicContact SD-CE1 3.79Å
434	S	79	Confident	75.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.2	-35.2	175.6	-57.6	0	0	0	0	112.4	S430 L431 A432 K438 Q439 R441 F670	S430-S434 WeakPolarHBondContact O-CB 3.33Å; S430-S434 PolarHBondContact O-N 2.91Å; S430-S434 PolarHBondContact O-OG 2.95Å; L431-S434 PolarHBondContact O-N 2.81Å; A432-S434 VanDerWaalsContact C-N 3.31Å; A432-S434 PolarHBondContact O-N 3.48Å; S434-K438 WeakPolarHBondContact O-CA 3.32Å; S434-K438 PolarHBondContact O-N 3.49Å; S434-Q439 WeakPolarHBondContact CA-O 3.13Å; S434-Q439 WeakPolarHBondContact CB-O 3.43Å; S434-Q439 PolarHBondContact OG-O 2.98Å; S434-R441 PolarHBondContact OG-N 3.26Å; S434-F670 WeakPolarHBondContact O-CZ 3.31Å
435	I	79.9	Confident	73.9	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-42.3	173.9	-67.2	165.8	0	0	0	110.6	L431 A432 M433 I458 L496 F670 L673 Y674	L431-I435 HydrophobicContact CD1-CD1 4.06Å; L431-I435 HydrophobicContact CD1-CG1 4.31Å; L431-I435 HydrophobicContact CG-CD1 3.88Å; L431-I435 HydrophobicContact CG-CG1 4.49Å; L431-I435 WeakPolarHBondContact O-CG1 3.49Å; L431-I435 PolarHBondContact O-N 3.42Å; A432-I435 WeakPolarHBondContact O-CB 3.38Å; A432-I435 PolarHBondContact O-N 2.74Å; M433-I435 VanDerWaalsContact C-N 3.3Å; M433-I435 PolarHBondContact O-N 3.34Å; I435-I458 HydrophobicContact CG2-CD1 3.39Å; I435-I458 HydrophobicContact CG2-CG1 4.35Å; I435-L496 HydrophobicContact CD1-CD2 4.37Å; I435-F670 HydrophobicContact CG1-CD1 3.8Å; I435-F670 HydrophobicContact CG1-CE1 3.68Å; I435-L673 HydrophobicContact CD1-CD2 3.69Å; I435-L673 HydrophobicContact CG1-CD2 4.21Å; I435-Y674 HydrophobicContact CG2-CE1 4.46Å; I435-Y674 WeakPolarHBondContact CG2-OH 3.35Å
436	V	78.9	Confident	72.8	Confident	50 Å²	50	53.1 Å²	53.1	30%	0.303	27%	0.271	S	S	.	.	H	α-helix	trans	-68.6	-50.8	-176.3	173.9	0	0	0	0	111.5	A432 M433 Y456 I458	A432-V436 VanDerWaalsContact O-CG2 3.25Å; A432-V436 WeakPolarHBondContact O-CG2 3.45Å; A432-V436 PolarHBondContact O-N 3.24Å; M433-V436 PolarHBondContact O-N 3.13Å; V436-Y456 VanDerWaalsContact CG2-CB 3.43Å; V436-Y456 HydrophobicContact CG2-CD1 4.12Å; V436-Y456 HydrophobicContact CG2-CD2 4.24Å; V436-Y456 HydrophobicContact CG2-CG 3.68Å; V436-I458 HydrophobicContact CG2-CD1 4.4Å; V436-I458 HydrophobicContact CG2-CG1 4.18Å
437	D	74.7	Confident	71.8	Confident	67 Å²	67	55.8 Å²	55.8	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-91.1	-8	-174	-64.3	-15.8	0	0	0	112.9	M433 Q439 R441	M433-D437 WeakPolarHBondContact CE-OD2 3.49Å; M433-D437 PolarHBondContact O-N 2.81Å; D437-Q439 HydrophobicContact CB-CB 4.39Å; D437-Q439 HydrophobicContact CB-CG 4.32Å; D437-Q439 PolarHBondContact O-N 3.19Å; D437-R441 IonicContact OD2-CZ 3.56Å; D437-R441 IonicContact OD2-NE 3.75Å; D437-R441 IonicContact OD2-NH2 2.68Å; D437-R441 PolarHBondContact OD2-NH2 3.33Å
438	K	71.1	Confident	70.8	Confident	166 Å²	166	59.5 Å²	59.5	72%	0.722	30%	0.299	S	S	*	.			trans	56.3	22.7	-171.1	-55.8	-178.6	180	-179.3	0	113.6	S434	S434-K438 WeakPolarHBondContact O-CA 3.32Å; S434-K438 PolarHBondContact O-N 3.49Å
439	Q	67	Low	70	Confident	122 Å²	122	62.3 Å²	62.3	57%	0.57	32%	0.317	S	S	*	.			trans	-104.5	144.6	176.1	-66.8	-173.6	-5.3	0	0	110	S434 D437 R441	S434-Q439 WeakPolarHBondContact CA-O 3.13Å; S434-Q439 WeakPolarHBondContact CB-O 3.43Å; S434-Q439 PolarHBondContact OG-O 2.98Å; D437-Q439 HydrophobicContact CB-CB 4.39Å; D437-Q439 HydrophobicContact CB-CG 4.32Å; D437-Q439 PolarHBondContact O-N 3.19Å; Q439-R441 PolarHBondContact O-N 2.86Å
440	N	64.1	Low	69.3	Low	54 Å²	54	62.3 Å²	62.3	29%	0.289	32%	0.317	S	S	.	.			trans	-82.8	101.8	178.9	-174.8	0.3	0	0	0	110.5	M442 L655 I668	N440-M442 WeakPolarHBondContact OD1-CB 3.23Å; N440-M442 PolarHBondContact OD1-N 3.17Å; N440-L655 WeakPolarHBondContact ND2-CD2 3.4Å; N440-I668 HydrophobicContact CB-CD1 4.16Å; N440-I668 VanDerWaalsContact CG-CD1 3.46Å; N440-I668 VanDerWaalsContact OD1-CD1 3.32Å; N440-I668 WeakPolarHBondContact OD1-CD1 3.3Å
441	R	66.9	Low	68.6	Low	44 Å²	44	70.6 Å²	70.6	17%	0.166	35%	0.348	C	S	.	.			trans	-98.3	6.5	173.5	-59.4	-169.7	-172.9	-167.3	-2.6	113.6	S434 D437 Q439 T443 E444 E448	S434-R441 PolarHBondContact OG-N 3.26Å; D437-R441 IonicContact OD2-CZ 3.56Å; D437-R441 IonicContact OD2-NE 3.75Å; D437-R441 IonicContact OD2-NH2 2.68Å; D437-R441 PolarHBondContact OD2-NH2 3.33Å; Q439-R441 PolarHBondContact O-N 2.86Å; R441-T443 PolarHBondContact O-N 3.37Å; R441-E444 PolarHBondContact O-N 3.45Å; R441-E448 IonicContact NH1-OE1 2.67Å; R441-E448 PolarHBondContact NH1-OE1 3.42Å; R441-E448 IonicContact NH1-OE2 2.74Å; R441-E448 PolarHBondContact NH1-OE2 3.34Å
442	M	63.6	Low	68.3	Low	33 Å²	33	72.9 Å²	72.9	16%	0.163	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.6	-176.1	-60.6	-62	-64.2	0	0	113.2	L431 N440 T578 I653 I668	L431-M442 HydrophobicContact CB-SD 4.29Å; N440-M442 WeakPolarHBondContact OD1-CB 3.23Å; N440-M442 PolarHBondContact OD1-N 3.17Å; M442-T578 HydrophobicContact CE-CG2 3.47Å; M442-T578 VanDerWaalsContact CE-CG2 3.47Å; M442-I653 HydrophobicContact CG-CG2 4.33Å; M442-I668 HydrophobicContact CG-CD1 4.14Å
443	T	54.5	Low	68.1	Low	78 Å²	78	74.5 Å²	74.5	48%	0.479	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-10.2	-179.7	46.7	0	0	0	0	114.8	R441 N445 L655	R441-T443 PolarHBondContact O-N 3.37Å; T443-N445 PolarHBondContact O-N 2.69Å; T443-L655 HydrophobicContact CG2-CD1 3.35Å; T443-L655 HydrophobicContact CG2-CD2 3.32Å; T443-L655 HydrophobicContact CG2-CG 3.95Å
444	E	54.6	Low	68.2	Low	104 Å²	104	77 Å²	77	49%	0.486	38%	0.384	S	S	.	.			trans	-76.4	127.3	-174.2	-67.5	-176.3	-178.5	0	0	110.6	R441 L446	R441-E444 PolarHBondContact O-N 3.45Å; E444-L446 PolarHBondContact O-N 2.97Å
445	N	55.3	Low	68.4	Low	170 Å²	170	80.7 Å²	80.7	91%	0.909	41%	0.409	S	S	*	.	S	Bend	trans	-62.3	-21.9	177.3	-72.9	-20.7	0	0	0	112.6	T443 E447	T443-N445 PolarHBondContact O-N 2.69Å; N445-E447 PolarHBondContact O-N 3.49Å
446	L	56.9	Low	68.4	Low	150 Å²	150	82.6 Å²	82.6	79%	0.785	42%	0.416	S	S	*	.	S	Bend	trans	-86.8	96.2	174.7	-74.5	160.6	0	0	0	108.7	E444 E448	E444-L446 PolarHBondContact O-N 2.97Å; L446-E448 PolarHBondContact O-N 3.36Å
447	E	60.3	Low	68.4	Low	57 Å²	57	84.5 Å²	84.5	27%	0.266	43%	0.428	S	S	.	.			trans	-72.7	113.4	173.1	-68.1	-175.1	176.8	0	0	110	N425 N445 K579	N425-E447 WeakPolarHBondContact CA-OE2 3.25Å; N425-E447 WeakPolarHBondContact CB-OE2 3.15Å; N445-E447 PolarHBondContact O-N 3.49Å; E447-K579 WeakPolarHBondContact OE1-CE 3.39Å; E447-K579 IonicContact OE1-NZ 3.24Å; E447-K579 PolarHBondContact OE1-NZ 2.9Å
448	E	60.6	Low	68.4	Low	86 Å²	86	82 Å²	82	40%	0.402	42%	0.415	S	S	.	.			trans	-61.8	133.7	168.6	-66.5	177.8	151.7	0	0	109.1	S429 M433 R441 L446	S429-E448 VanDerWaalsContact CB-O 3.25Å; S429-E448 WeakPolarHBondContact CB-O 3.36Å; S429-E448 PolarHBondContact OG-O 3.05Å; M433-E448 WeakPolarHBondContact CG-OE2 3.44Å; R441-E448 IonicContact NH1-OE1 2.67Å; R441-E448 PolarHBondContact NH1-OE1 3.42Å; R441-E448 IonicContact NH1-OE2 2.74Å; R441-E448 PolarHBondContact NH1-OE2 3.34Å; L446-E448 PolarHBondContact O-N 3.36Å
449	T	68.1	Low	68.4	Low	71 Å²	71	79.8 Å²	79.8	44%	0.436	41%	0.407	S	S	.	.			trans	-123.9	120.3	-178	51.4	0	0	0	0	111.3	N425 Y451	N425-T449 WeakPolarHBondContact OD1-CG2 3.17Å; T449-Y451 PolarHBondContact O-N 3.05Å
450	T	70	Confident	68.5	Low	11 Å²	11	75 Å²	75	7%	0.067	38%	0.384	C	S	.	.			trans	-77.1	119.9	172.8	-56.7	0	0	0	0	111	S429 S452 E454 D498	S429-T450 PolarHBondContact OG-N 3.06Å; S429-T450 PolarHBondContact OG-OG1 3.44Å; S429-T450 VanDerWaalsContact OG-OG1 3.09Å; T450-S452 PolarHBondContact O-N 2.7Å; T450-E454 HydrophobicContact CG2-CB 3.93Å; T450-E454 HydrophobicContact CG2-CG 3.73Å; T450-D498 PolarHBondContact OG1-OD2 3.21Å
451	Y	68.6	Low	68.5	Low	182 Å²	182	75.1 Å²	75.1	71%	0.714	39%	0.385	S	S	*	.	S	Bend	trans	-68.8	-33.1	-177.4	-71.8	-78.4	0	0	0	113.6	T449 Y505	T449-Y451 PolarHBondContact O-N 3.05Å; Y451-Y505 WeakPolarHBondContact O-CE2 3.47Å; Y451-Y505 PolarHBondContact O-OH 3.36Å
452	S	75.7	Confident	68.2	Low	50 Å²	50	73.3 Å²	73.3	35%	0.35	38%	0.379	S	S	.	.	S	Bend	trans	-136.7	-95.7	-179.2	61.6	0	0	0	0	111.9	T450 S500	T450-S452 PolarHBondContact O-N 2.7Å; S452-S500 WeakPolarHBondContact O-CB 3.45Å; S452-S500 PolarHBondContact O-N 3.28Å
453	I	79.7	Confident	68	Low	34 Å²	34	74.8 Å²	74.8	17%	0.174	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	124.4	175.9	-59.5	177.6	0	0	0	107.6	W497 D498 L508 I509 F512	I453-W497 HydrophobicContact CG2-CD2 4.3Å; I453-W497 HydrophobicContact CG2-CE3 3.46Å; I453-W497 VanDerWaalsContact CG2-CE3 3.46Å; I453-W497 HydrophobicContact CG2-CZ3 3.92Å; I453-D498 CarbonylContact C-O 3.55Å; I453-D498 VanDerWaalsContact CA-O 3.32Å; I453-D498 WeakPolarHBondContact CA-O 3.42Å; I453-L508 HydrophobicContact CD1-CD2 3.87Å; I453-L508 HydrophobicContact CD1-CG 4Å; I453-L508 HydrophobicContact CG1-CD2 4.22Å; I453-I509 HydrophobicContact CD1-CG1 4.15Å; I453-F512 HydrophobicContact CD1-CD2 3.66Å; I453-F512 HydrophobicContact CD1-CE2 3.98Å
454	E	82.1	Confident	68.2	Low	85 Å²	85	77.4 Å²	77.4	40%	0.397	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	145.6	171.3	-77.2	175.4	-145	0	0	109.7	T450 Y456 W497 D498	T450-E454 HydrophobicContact CG2-CB 3.93Å; T450-E454 HydrophobicContact CG2-CG 3.73Å; E454-Y456 HydrophobicContact CB-CE2 4.17Å; E454-Y456 PolarHBondContact OE2-OH 3.41Å; E454-W497 CarbonylContact O-C 3.52Å; E454-W497 WeakPolarHBondContact O-CA 3.39Å; E454-D498 PolarHBondContact N-O 3.49Å; E454-D498 PolarHBondContact O-N 2.93Å
455	S	83.6	Confident	68.3	Low	77 Å²	77	72.8 Å²	72.8	54%	0.538	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	-177.7	68.9	0	0	0	0	111.2	L496	S455-L496 CarbonylContact C-O 3.59Å; S455-L496 VanDerWaalsContact CA-O 3.3Å; S455-L496 WeakPolarHBondContact CA-O 3.37Å
456	Y	80.9	Confident	68.4	Low	43 Å²	43	66.6 Å²	66.6	17%	0.169	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	140.4	178.1	-47.1	-82.2	0	0	0	109.8	A432 M433 V436 E454 T495 L496 D498	A432-Y456 HydrophobicContact CB-CD2 4.32Å; A432-Y456 HydrophobicContact CB-CE2 3.98Å; M433-Y456 HydrophobicContact SD-CD1 4.5Å; M433-Y456 HydrophobicContact SD-CE1 3.79Å; V436-Y456 VanDerWaalsContact CG2-CB 3.43Å; V436-Y456 HydrophobicContact CG2-CD1 4.12Å; V436-Y456 HydrophobicContact CG2-CD2 4.24Å; V436-Y456 HydrophobicContact CG2-CG 3.68Å; E454-Y456 HydrophobicContact CB-CE2 4.17Å; E454-Y456 PolarHBondContact OE2-OH 3.41Å; Y456-T495 CarbonylContact O-C 3.54Å; Y456-T495 WeakPolarHBondContact O-CA 3.32Å; Y456-L496 HydrophobicContact CD2-CD2 4.37Å; Y456-L496 PolarHBondContact N-O 3.29Å; Y456-L496 PolarHBondContact O-N 3.39Å; Y456-D498 HydrophobicContact CE2-CB 4.05Å
457	T	78.6	Confident	68.2	Low	90 Å²	90	63.4 Å²	63.4	55%	0.552	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	113.7	177.5	-56	0	0	0	0	109.4	T493 T495	T457-T493 HydrophobicContact CG2-CG2 4.21Å; T457-T495 HydrophobicContact CG2-CG2 4.29Å
458	I	74.5	Confident	68	Low	15 Å²	15	66.8 Å²	66.8	8%	0.077	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.4	-179.2	-58.3	144.7	0	0	0	108	I435 V436 T493 I494 L496	I435-I458 HydrophobicContact CG2-CD1 3.39Å; I435-I458 HydrophobicContact CG2-CG1 4.35Å; V436-I458 HydrophobicContact CG2-CD1 4.4Å; V436-I458 HydrophobicContact CG2-CG1 4.18Å; I458-T493 CarbonylContact O-C 3.52Å; I458-T493 WeakPolarHBondContact O-CA 3.43Å; I458-I494 HydrophobicContact CB-CB 4.32Å; I458-I494 HydrophobicContact CD1-CG2 4.44Å; I458-I494 PolarHBondContact N-O 3.01Å; I458-I494 PolarHBondContact O-N 3.36Å; I458-L496 HydrophobicContact CD1-CB 4.05Å; I458-L496 HydrophobicContact CD1-CD2 4.33Å
459	Q	70.4	Confident	67.6	Low	120 Å²	120	64.4 Å²	64.4	56%	0.561	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.4	171.1	-63.2	-71.7	-17.1	0	0	108.2	P491 T493	Q459-P491 HydrophobicContact CB-CB 4.41Å; Q459-P491 HydrophobicContact CB-CG 4.49Å; Q459-T493 VanDerWaalsContact NE2-CG2 3.35Å
460	Y	69.3	Low	66.9	Low	20 Å²	20	67.4 Å²	67.4	8%	0.078	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	123.5	-178	-171.5	-89.1	0	0	0	111.3	A462 L465 T492 I494 Y674 F678	Y460-A462 PolarHBondContact O-N 3.27Å; Y460-L465 HydrophobicContact CE1-CD1 3.56Å; Y460-L465 HydrophobicContact CE1-CG 4.09Å; Y460-T492 CarbonylContact C-O 3.17Å; Y460-T492 PolarHBondContact N-O 3.36Å; Y460-T492 CarbonylContact O-C 3.58Å; Y460-T492 WeakPolarHBondContact O-CA 3.34Å; Y460-T492 WeakPolarHBondContact O-CB 3.49Å; Y460-T492 PolarHBondContact O-N 2.78Å; Y460-I494 HydrophobicContact CG-CD1 4.2Å; Y460-Y674 AromaticContact CD2-CD1 3.79Å; Y460-Y674 HydrophobicContact CD2-CD1 3.79Å; Y460-Y674 AromaticContact CD2-CD2 3.78Å; Y460-Y674 HydrophobicContact CD2-CD2 3.78Å; Y460-Y674 AromaticContact CD2-CE1 3.81Å; Y460-Y674 HydrophobicContact CD2-CE1 3.81Å; Y460-Y674 AromaticContact CD2-CE2 3.8Å; Y460-Y674 HydrophobicContact CD2-CE2 3.8Å; Y460-Y674 AromaticContact CD2-CG 3.79Å; Y460-Y674 HydrophobicContact CD2-CG 3.79Å; Y460-Y674 AromaticContact CD2-CZ 3.81Å; Y460-Y674 HydrophobicContact CE1-CG 4.31Å; Y460-Y674 AromaticContact CE2-CD1 3.91Å; Y460-Y674 HydrophobicContact CE2-CD1 3.91Å; Y460-Y674 AromaticContact CE2-CD2 3.2Å; Y460-Y674 HydrophobicContact CE2-CD2 3.2Å; Y460-Y674 HydrophobicContact CE2-CE1 4.24Å; Y460-Y674 AromaticContact CE2-CE2 3.61Å; Y460-Y674 HydrophobicContact CE2-CE2 3.61Å; Y460-Y674 AromaticContact CE2-CG 3.39Å; Y460-Y674 HydrophobicContact CE2-CG 3.39Å; Y460-Y674 HydrophobicContact CG-CD1 4.16Å; Y460-Y674 HydrophobicContact CG-CE1 4.32Å; Y460-Y674 HydrophobicContact CG-CG 4.41Å; Y460-Y674 AromaticContact CZ-CD2 3.83Å; Y460-Y674 AromaticContact CZ-CG 3.67Å; Y460-F678 HydrophobicContact CD1-CD2 4.36Å; Y460-F678 AromaticContact CD1-CE2 3.33Å; Y460-F678 HydrophobicContact CD1-CE2 3.33Å; Y460-F678 AromaticContact CD1-CZ 3.75Å; Y460-F678 HydrophobicContact CD1-CZ 3.75Å; Y460-F678 HydrophobicContact CE1-CD2 4.23Å; Y460-F678 AromaticContact CE1-CE2 3.61Å; Y460-F678 HydrophobicContact CE1-CE2 3.61Å; Y460-F678 HydrophobicContact CE1-CZ 4.32Å; Y460-F678 HydrophobicContact CG-CE2 4.27Å
461	D	63.7	Low	65.8	Low	58 Å²	58	71.5 Å²	71.5	31%	0.31	36%	0.36	S	S	.	.			trans	-83	103.2	179.1	-161.8	-13.6	0	0	0	111.1	I463 E464 P491	D461-I463 PolarHBondContact O-N 3.33Å; D461-I463 VanDerWaalsContact O-N 3.1Å; D461-I463 WeakPolarHBondContact OD1-CB 3.21Å; D461-I463 VanDerWaalsContact OD1-CD1 3.22Å; D461-I463 WeakPolarHBondContact OD1-CD1 3.29Å; D461-I463 WeakPolarHBondContact OD1-CG1 3.5Å; D461-I463 PolarHBondContact OD1-N 3.45Å; D461-I463 VanDerWaalsContact OD1-N 3.17Å; D461-E464 PolarHBondContact O-N 3.28Å; D461-P491 HydrophobicContact CB-CB 4.41Å
462	A	62.1	Low	64.7	Low	5 Å²	5	69.1 Å²	69.1	4%	0.041	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-63	-15.1	-180	0	0	0	0	0	113.5	Y460 E464 L465 I466 T492 F678 L692	Y460-A462 PolarHBondContact O-N 3.27Å; A462-E464 PolarHBondContact O-N 3.35Å; A462-L465 PolarHBondContact O-N 3.49Å; A462-I466 PolarHBondContact O-N 2.98Å; A462-T492 WeakPolarHBondContact CB-OG1 3.44Å; A462-F678 HydrophobicContact CB-CD1 4.15Å; A462-F678 HydrophobicContact CB-CE1 3.54Å; A462-F678 HydrophobicContact CB-CZ 3.81Å; A462-L692 HydrophobicContact CB-CD2 3.83Å
463	I	59.2	Low	62.9	Low	65 Å²	65	70.6 Å²	70.6	33%	0.333	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-55.6	-36.6	179.8	-64	166.8	0	0	0	111.5	D461 L465 I466 P467 T488	D461-I463 PolarHBondContact O-N 3.33Å; D461-I463 VanDerWaalsContact O-N 3.1Å; D461-I463 WeakPolarHBondContact OD1-CB 3.21Å; D461-I463 VanDerWaalsContact OD1-CD1 3.22Å; D461-I463 WeakPolarHBondContact OD1-CD1 3.29Å; D461-I463 WeakPolarHBondContact OD1-CG1 3.5Å; D461-I463 PolarHBondContact OD1-N 3.45Å; D461-I463 VanDerWaalsContact OD1-N 3.17Å; I463-L465 PolarHBondContact O-N 2.96Å; I463-I466 PolarHBondContact O-N 2.82Å; I463-P467 WeakPolarHBondContact O-CD 3.42Å; I463-T488 WeakPolarHBondContact CD1-O 3.11Å
464	E	58.3	Low	60.7	Low	132 Å²	132	78.6 Å²	78.6	62%	0.617	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-63.1	-25.8	179	-68.8	-170.9	171.4	0	0	113.3	D461 A462	D461-E464 PolarHBondContact O-N 3.28Å; A462-E464 PolarHBondContact O-N 3.35Å
465	L	57.6	Low	58.6	Low	8 Å²	8	77.6 Å²	77.6	4%	0.042	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-21.5	-177.1	-62	174.5	0	0	0	113.1	Y460 A462 I463 P467 K468 L469 Y675 F678	Y460-L465 HydrophobicContact CE1-CD1 3.56Å; Y460-L465 HydrophobicContact CE1-CG 4.09Å; A462-L465 PolarHBondContact O-N 3.49Å; I463-L465 PolarHBondContact O-N 2.96Å; L465-P467 VanDerWaalsContact C-CD 3.45Å; L465-P467 VanDerWaalsContact C-N 3.34Å; L465-K468 PolarHBondContact O-N 3.47Å; L465-L469 HydrophobicContact CB-CD1 4.08Å; L465-L469 HydrophobicContact CB-CG 4.49Å; L465-L469 WeakPolarHBondContact O-CG 3.39Å; L465-L469 PolarHBondContact O-N 3.27Å; L465-Y675 HydrophobicContact CD2-CD2 4.06Å; L465-F678 HydrophobicContact CD1-CB 4.08Å; L465-F678 HydrophobicContact CD1-CD2 3.35Å; L465-F678 HydrophobicContact CD1-CE2 4.01Å; L465-F678 HydrophobicContact CD1-CG 3.9Å
466	I	56.8	Low	56.2	Low	39 Å²	39	81.3 Å²	81.3	20%	0.2	43%	0.433	C	S	.	.	H	α-helix	trans	-49.4	-48.4	-178	-69	176.6	0	0	0	111.9	A462 I463 K468 L469 Y470	A462-I466 PolarHBondContact O-N 2.98Å; I463-I466 PolarHBondContact O-N 2.82Å; I466-K468 VanDerWaalsContact C-N 3.34Å; I466-K468 PolarHBondContact O-N 2.94Å; I466-L469 PolarHBondContact O-N 3.46Å; I466-Y470 HydrophobicContact CG2-CD2 4.01Å; I466-Y470 HydrophobicContact CG2-CE2 3.97Å; I466-Y470 VanDerWaalsContact O-CD2 3.24Å; I466-Y470 WeakPolarHBondContact O-CD2 3.41Å
467	P	53.3	Low	54.3	Low	83 Å²	83	85.7 Å²	85.7	54%	0.539	46%	0.459	S	S	.	.	H	α-helix	trans	-59.3	-43.5	-179.4	-21.8	32.5	0	0	0	112.6	I463 L465 L469 Y470 T471	I463-P467 WeakPolarHBondContact O-CD 3.42Å; L465-P467 VanDerWaalsContact C-CD 3.45Å; L465-P467 VanDerWaalsContact C-N 3.34Å; P467-L469 VanDerWaalsContact C-N 3.35Å; P467-L469 PolarHBondContact O-N 2.65Å; P467-Y470 PolarHBondContact O-N 2.83Å; P467-T471 WeakPolarHBondContact O-CG2 3.37Å; P467-T471 PolarHBondContact O-N 2.74Å
468	K	54.7	Low	52.5	Low	129 Å²	129	88.8 Å²	88.8	56%	0.561	47%	0.473	S	S	*	.	H	α-helix	trans	-74.4	-22.5	-177.4	-68.3	-176.9	176.4	177.4	0	113.8	L465 I466 T471 Y675	L465-K468 PolarHBondContact O-N 3.47Å; I466-K468 VanDerWaalsContact C-N 3.34Å; I466-K468 PolarHBondContact O-N 2.94Å; K468-T471 PolarHBondContact O-OG1 3.01Å; K468-Y675 HydrophobicContact CB-CD2 4.12Å; K468-Y675 HydrophobicContact CB-CE2 3.59Å; K468-Y675 PolarHBondContact O-OH 2.89Å
469	L	52.7	Low	51.1	Low	35 Å²	35	94.5 Å²	94.5	18%	0.183	50%	0.503	C	S	.	.	H	α-helix	trans	-77.6	-24	179.2	-72.9	166.7	0	0	0	112.1	L465 I466 P467 Y675 F678 D679	L465-L469 HydrophobicContact CB-CD1 4.08Å; L465-L469 HydrophobicContact CB-CG 4.49Å; L465-L469 WeakPolarHBondContact O-CG 3.39Å; L465-L469 PolarHBondContact O-N 3.27Å; I466-L469 PolarHBondContact O-N 3.46Å; P467-L469 VanDerWaalsContact C-N 3.35Å; P467-L469 PolarHBondContact O-N 2.65Å; L469-Y675 HydrophobicContact CD2-CD2 4.08Å; L469-Y675 HydrophobicContact CD2-CE2 3.6Å; L469-Y675 HydrophobicContact CG-CD2 4.32Å; L469-Y675 HydrophobicContact CG-CE2 3.86Å; L469-F678 HydrophobicContact CD1-CB 4.31Å; L469-D679 HydrophobicContact CD2-CB 3.72Å
470	Y	52.7	Low	49.5	Very low	135 Å²	135	93.7 Å²	93.7	53%	0.529	50%	0.503	S	S	.	.	H	α-helix	trans	-103.7	-13.6	-179.1	-68.2	-73.5	0	0	0	114.4	I466 P467 D472 S473	I466-Y470 HydrophobicContact CG2-CD2 4.01Å; I466-Y470 HydrophobicContact CG2-CE2 3.97Å; I466-Y470 VanDerWaalsContact O-CD2 3.24Å; I466-Y470 WeakPolarHBondContact O-CD2 3.41Å; P467-Y470 PolarHBondContact O-N 2.83Å; Y470-D472 VanDerWaalsContact C-N 3.26Å; Y470-D472 PolarHBondContact O-N 3.02Å; Y470-S473 PolarHBondContact O-N 3.09Å; Y470-S473 PolarHBondContact O-OG 3.35Å
471	T	48.2	Very low	47.9	Very low	96 Å²	96	100.1 Å²	100.1	59%	0.589	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-23.8	177.4	44.2	0	0	0	0	113.9	P467 K468 S473	P467-T471 WeakPolarHBondContact O-CG2 3.37Å; P467-T471 PolarHBondContact O-N 2.74Å; K468-T471 PolarHBondContact O-OG1 3.01Å; T471-S473 PolarHBondContact O-N 3.02Å
472	D	43.9	Very low	46.8	Very low	133 Å²	133	102.9 Å²	102.9	71%	0.711	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-4.3	179	-72	-1.7	0	0	0	113.2	Y470 E474	Y470-D472 VanDerWaalsContact C-N 3.26Å; Y470-D472 PolarHBondContact O-N 3.02Å; D472-E474 PolarHBondContact O-N 3.11Å
473	S	39.8	Very low	45.7	Very low	81 Å²	81	107.8 Å²	107.8	57%	0.566	58%	0.577	S	S	*	*	S	Bend	trans	-94.5	83.7	166	50.3	0	0	0	0	110	Y470 T471 G475	Y470-S473 PolarHBondContact O-N 3.09Å; Y470-S473 PolarHBondContact O-OG 3.35Å; T471-S473 PolarHBondContact O-N 3.02Å; S473-G475 PolarHBondContact O-N 3.22Å
474	E	32.1	Very low	44.7	Very low	201 Å²	201	108.6 Å²	108.6	94%	0.939	58%	0.582	S	S	*	*			trans	-57	102.6	164.8	-74.1	-172.4	157.7	0	0	109.3	D472	D472-E474 PolarHBondContact O-N 3.11Å
475	G	38	Very low	43.8	Very low	64 Å²	64	111.3 Å²	111.3	66%	0.66	59%	0.591	S	S	*	*			trans	-172.8	88.1	179.7	0	0	0	0	0	110.8	S473 N477	S473-G475 PolarHBondContact O-N 3.22Å; G475-N477 PolarHBondContact O-N 2.87Å; G475-N477 VanDerWaalsContact O-N 3.13Å
476	N	34.5	Very low	43	Very low	156 Å²	156	120.1 Å²	120.1	83%	0.834	63%	0.629	S	S	*	*			trans	-26.9	108.9	170.6	-82.3	-27.7	0	0	0	113.5
477	N	40.1	Very low	42.3	Very low	135 Å²	135	123.4 Å²	123.4	72%	0.722	64%	0.644	S	S	*	*			trans	-164.2	88.8	156.1	-93	-29.7	0	0	0	110.2	G475 N479	G475-N477 PolarHBondContact O-N 2.87Å; G475-N477 VanDerWaalsContact O-N 3.13Å; N477-N479 PolarHBondContact O-N 3Å
478	N	41.6	Very low	41.9	Very low	155 Å²	155	121.8 Å²	121.8	83%	0.829	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	17.4	-176.3	-78.2	-8.9	0	0	0	115.9
479	N	43.5	Very low	41.2	Very low	135 Å²	135	122 Å²	122	72%	0.722	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	0.6	-178.6	-74.3	-9.9	0	0	0	114.9	N477	N477-N479 PolarHBondContact O-N 3Å
480	N	37.7	Very low	40.8	Very low	103 Å²	103	127.4 Å²	127.4	55%	0.551	66%	0.663	S	S	*	*	S	Bend	trans	-96	-12.1	-176.8	-73.5	-18	0	0	0	115.2	T482	N480-T482 PolarHBondContact O-N 3.26Å
481	E	36.4	Very low	40.9	Very low	154 Å²	154	123.5 Å²	123.5	72%	0.72	65%	0.654	S	S	*	*	H	α-helix	trans	-68.3	-29.7	-177	-75.2	-164.7	152.2	0	0	114
482	T	39.3	Very low	41.6	Very low	116 Å²	116	119.8 Å²	119.8	71%	0.712	63%	0.631	S	S	*	*	H	α-helix	trans	-80.8	-21.2	-177	42.7	0	0	0	0	113.8	N480	N480-T482 PolarHBondContact O-N 3.26Å
483	I	39.9	Very low	42.8	Very low	109 Å²	109	114.7 Å²	114.7	56%	0.559	61%	0.605	S	S	*	*	H	α-helix	trans	-82.6	-30.7	-178	-62.4	175	0	0	0	111.6
484	L	38.3	Very low	44.7	Very low	82 Å²	82	110.9 Å²	110.9	43%	0.429	58%	0.578	S	S	.	*	H	α-helix	trans	-82.8	-29.2	-174.6	-78.8	159.5	0	0	0	114.2	K486 Q487	L484-K486 PolarHBondContact O-N 3.44Å; L484-Q487 PolarHBondContact O-N 2.94Å
485	K	39.5	Very low	47	Very low	189 Å²	189	103.1 Å²	103.1	82%	0.822	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-10.6	-179.8	-79.3	-176.4	177.6	173.7	0	115.2
486	K	40	Very low	49.3	Very low	192 Å²	192	100.1 Å²	100.1	84%	0.835	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-3.1	-179.2	-83.4	-174.4	176.3	179.1	0	115.4	L484	L484-K486 PolarHBondContact O-N 3.44Å
487	Q	41.6	Very low	51.8	Low	108 Å²	108	95.3 Å²	95.3	51%	0.505	48%	0.483	S	S	.	.	S	Bend	trans	-109	112.5	-175.9	-70.8	-171.9	-4.5	0	0	111.9	L484	L484-Q487 PolarHBondContact O-N 2.94Å
488	T	44.6	Very low	54.1	Low	50 Å²	50	88.9 Å²	88.9	31%	0.307	45%	0.449	S	S	.	.			trans	85.1	118.6	172.7	74.3	0	0	0	0	114.9	I463	I463-T488 WeakPolarHBondContact CD1-O 3.11Å
489	T	41.4	Very low	56.2	Low	134 Å²	134	81.6 Å²	81.6	82%	0.822	41%	0.41	S	S	*	.			trans	-119	19.1	175.3	51.1	0	0	0	0	111.2
490	R	43.8	Very low	58.1	Low	148 Å²	148	75.8 Å²	75.8	56%	0.558	38%	0.38	S	S	*	.	S	Bend	trans	-122.2	133.1	-179.1	-79.1	-170	174.5	-168.6	-0.8	111.7	Y413	Y413-R490 WeakPolarHBondContact OH-CD 3.31Å
491	P	54.3	Low	60.1	Low	52 Å²	52	71.3 Å²	71.3	34%	0.338	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-61.9	139	-176.2	25.4	-33.8	0	0	0	111	Q459 D461	Q459-P491 HydrophobicContact CB-CB 4.41Å; Q459-P491 HydrophobicContact CB-CG 4.49Å; D461-P491 HydrophobicContact CB-CB 4.41Å
492	T	62.7	Low	62.2	Low	19 Å²	19	67.6 Å²	67.6	12%	0.117	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.7	171.6	-30.9	0	0	0	0	108.9	Y460 A462 F678 C691	Y460-T492 CarbonylContact C-O 3.17Å; Y460-T492 PolarHBondContact N-O 3.36Å; Y460-T492 CarbonylContact O-C 3.58Å; Y460-T492 WeakPolarHBondContact O-CA 3.34Å; Y460-T492 WeakPolarHBondContact O-CB 3.49Å; Y460-T492 PolarHBondContact O-N 2.78Å; A462-T492 WeakPolarHBondContact CB-OG1 3.44Å; T492-F678 HydrophobicContact CG2-CE1 4.39Å; T492-C691 VanDerWaalsContact CG2-O 3.29Å; T492-C691 WeakPolarHBondContact CG2-O 3.21Å
493	T	70	Confident	63.9	Low	26 Å²	26	66.8 Å²	66.8	16%	0.16	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.5	176	50.1	0	0	0	0	110.8	G415 I416 T457 I458 Q459	G415-T493 CarbonylContact C-O 3.56Å; G415-T493 VanDerWaalsContact C-O 3.3Å; G415-T493 WeakPolarHBondContact CA-O 3.5Å; G415-T493 VanDerWaalsContact CA-OG1 3.27Å; G415-T493 WeakPolarHBondContact CA-OG1 3.49Å; I416-T493 PolarHBondContact N-O 3.05Å; T457-T493 HydrophobicContact CG2-CG2 4.21Å; I458-T493 CarbonylContact O-C 3.52Å; I458-T493 WeakPolarHBondContact O-CA 3.43Å; Q459-T493 VanDerWaalsContact NE2-CG2 3.35Å
494	I	78.7	Confident	65.7	Low	1 Å²	1	64 Å²	64	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	118.8	168.2	-63.4	174	0	0	0	106.7	I416 I418 I458 Y460 Y674 F678	I416-I494 HydrophobicContact CB-CG1 4.38Å; I416-I494 CarbonylContact O-C 3.55Å; I416-I494 WeakPolarHBondContact O-CA 3.25Å; I418-I494 HydrophobicContact CD1-CG2 3.29Å; I418-I494 HydrophobicContact CG1-CG2 3.83Å; I458-I494 HydrophobicContact CB-CB 4.32Å; I458-I494 HydrophobicContact CD1-CG2 4.44Å; I458-I494 PolarHBondContact N-O 3.01Å; I458-I494 PolarHBondContact O-N 3.36Å; Y460-I494 HydrophobicContact CG-CD1 4.2Å; I494-Y674 HydrophobicContact CD1-CD1 3.57Å; I494-Y674 HydrophobicContact CD1-CE1 3.65Å; I494-F678 HydrophobicContact CD1-CE2 3.95Å; I494-F678 HydrophobicContact CD1-CZ 4.33Å
495	T	81	Confident	67.6	Low	38 Å²	38	63.9 Å²	63.9	23%	0.233	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	105.6	174.3	48.3	0	0	0	0	108.9	I416 K417 I418 Y456 T457	I416-T495 PolarHBondContact O-N 3.11Å; I416-T495 PolarHBondContact O-OG1 3.14Å; K417-T495 WeakPolarHBondContact CA-OG1 3.41Å; I418-T495 PolarHBondContact N-O 2.79Å; Y456-T495 CarbonylContact O-C 3.54Å; Y456-T495 WeakPolarHBondContact O-CA 3.32Å; T457-T495 HydrophobicContact CG2-CG2 4.29Å
496	L	86.2	Confident	69.3	Low	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.5	-179.9	-174.3	72.7	0	0	0	109.5	I418 L420 A432 I435 S455 Y456 I458	I418-L496 HydrophobicContact CB-CD1 3.9Å; I418-L496 HydrophobicContact CG2-CD1 3.65Å; L420-L496 HydrophobicContact CD1-CD1 4.07Å; L420-L496 HydrophobicContact CD1-CD2 4.16Å; L420-L496 HydrophobicContact CD1-CG 4.23Å; L420-L496 HydrophobicContact CD2-CD1 3.83Å; L420-L496 HydrophobicContact CG-CD1 3.74Å; L420-L496 HydrophobicContact CG-CG 4.29Å; A432-L496 HydrophobicContact CB-CD2 3.7Å; I435-L496 HydrophobicContact CD1-CD2 4.37Å; S455-L496 CarbonylContact C-O 3.59Å; S455-L496 VanDerWaalsContact CA-O 3.3Å; S455-L496 WeakPolarHBondContact CA-O 3.37Å; Y456-L496 HydrophobicContact CD2-CD2 4.37Å; Y456-L496 PolarHBondContact N-O 3.29Å; Y456-L496 PolarHBondContact O-N 3.39Å; I458-L496 HydrophobicContact CD1-CB 4.05Å; I458-L496 HydrophobicContact CD1-CD2 4.33Å
497	W	86.8	Confident	71	Confident	54 Å²	54	51.3 Å²	51.3	21%	0.205	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.6	176.2	-73	49	0	0	0	108.7	I418 T419 L420 I453 E454 F512	I418-W497 WeakPolarHBondContact O-CB 3.13Å; I418-W497 PolarHBondContact O-N 3.02Å; T419-W497 WeakPolarHBondContact CA-O 3.38Å; T419-W497 HydrophobicContact CG2-CB 4.35Å; L420-W497 PolarHBondContact N-O 3.36Å; I453-W497 HydrophobicContact CG2-CD2 4.3Å; I453-W497 HydrophobicContact CG2-CE3 3.46Å; I453-W497 VanDerWaalsContact CG2-CE3 3.46Å; I453-W497 HydrophobicContact CG2-CZ3 3.92Å; E454-W497 CarbonylContact O-C 3.52Å; E454-W497 WeakPolarHBondContact O-CA 3.39Å; W497-F512 HydrophobicContact CE3-CB 4.18Å; W497-F512 HydrophobicContact CE3-CG 4.39Å; W497-F512 HydrophobicContact CH2-CB 4.28Å; W497-F512 AromaticContact CH2-CD1 3.61Å; W497-F512 HydrophobicContact CH2-CD1 3.61Å; W497-F512 HydrophobicContact CH2-CE1 4.09Å; W497-F512 AromaticContact CH2-CG 3.99Å; W497-F512 HydrophobicContact CH2-CG 3.99Å; W497-F512 HydrophobicContact CZ3-CB 3.63Å; W497-F512 AromaticContact CZ3-CD1 3.58Å; W497-F512 HydrophobicContact CZ3-CD1 3.58Å; W497-F512 AromaticContact CZ3-CD2 3.95Å; W497-F512 HydrophobicContact CZ3-CD2 3.95Å; W497-F512 HydrophobicContact CZ3-CE1 4.18Å; W497-F512 HydrophobicContact CZ3-CE2 4.5Å; W497-F512 AromaticContact CZ3-CG 3.44Å; W497-F512 HydrophobicContact CZ3-CG 3.44Å; W497-F512 VanDerWaalsContact CZ3-CG 3.44Å
498	D	88	Confident	72.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	115.5	171.6	-171.1	14.5	0	0	0	109.6	L420 K428 S429 A432 T450 I453 E454 Y456	L420-D498 HydrophobicContact CD1-CB 4.45Å; K428-D498 WeakPolarHBondContact CB-OD1 3.5Å; S429-D498 WeakPolarHBondContact CA-OD2 3.34Å; S429-D498 WeakPolarHBondContact CB-OD2 3.5Å; S429-D498 PolarHBondContact N-OD2 3.05Å; S429-D498 PolarHBondContact OG-OD2 3.22Å; A432-D498 HydrophobicContact CB-CB 4.16Å; T450-D498 PolarHBondContact OG1-OD2 3.21Å; I453-D498 CarbonylContact C-O 3.55Å; I453-D498 VanDerWaalsContact CA-O 3.32Å; I453-D498 WeakPolarHBondContact CA-O 3.42Å; E454-D498 PolarHBondContact N-O 3.49Å; E454-D498 PolarHBondContact O-N 2.93Å; Y456-D498 HydrophobicContact CE2-CB 4.05Å
499	C	87.3	Confident	73.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	142.7	-176.9	-62.9	0	0	0	0	110.9	T419 L420 L421 K428 G501 I509	T419-C499 VanDerWaalsContact CG2-SG 3.51Å; L420-C499 WeakPolarHBondContact O-CB 3.33Å; L420-C499 PolarHBondContact O-N 2.79Å; L421-C499 HydrophobicContact CD2-CB 4.11Å; K428-C499 WeakPolarHBondContact CE-O 3.37Å; C499-G501 PolarHBondContact O-N 3.48Å; C499-I509 HydrophobicContact CB-CD1 3.71Å; C499-I509 HydrophobicContact CB-CG1 3.97Å
500	S	82.7	Confident	75.3	Confident	13 Å²	13	41.7 Å²	41.7	9%	0.091	21%	0.213	C	C	.	.			trans	-55.4	135.7	172.3	-176.1	0	0	0	0	111.1	S452 H502 Y505	S452-S500 WeakPolarHBondContact O-CB 3.45Å; S452-S500 PolarHBondContact O-N 3.28Å; S500-H502 PolarHBondContact O-N 3.05Å; S500-H502 PolarHBondContact OG-N 3.25Å; S500-Y505 VanDerWaalsContact CB-CD2 3.49Å; S500-Y505 WeakPolarHBondContact OG-CD2 3.3Å
501	G	79.6	Confident	76.4	Confident	10 Å²	10	42.5 Å²	42.5	10%	0.103	22%	0.221	C	C	.	.			trans	-74.8	-5.8	174.5	0	0	0	0	0	114	G422 C499	G422-G501 WeakPolarHBondContact O-CA 3.41Å; C499-G501 PolarHBondContact O-N 3.48Å
502	H	80.5	Confident	76.9	Confident	76 Å²	76	43.7 Å²	43.7	35%	0.352	22%	0.221	S	C	.	.	S	Bend	trans	-78.1	131.1	-175.4	-166.9	-70	0	0	0	111.4	I424 S500 N504 Y505	I424-H502 HydrophobicContact CD1-CB 4.17Å; I424-H502 HydrophobicContact CG1-CB 4.5Å; S500-H502 PolarHBondContact O-N 3.05Å; S500-H502 PolarHBondContact OG-N 3.25Å; H502-N504 PolarHBondContact CE1-ND2 3.46Å; H502-N504 WeakPolarHBondContact ND1-CB 3.39Å; H502-N504 PolarHBondContact ND1-N 2.94Å; H502-N504 PolarHBondContact O-N 3.25Å; H502-Y505 HydrophobicContact CB-CD2 4.07Å; H502-Y505 HydrophobicContact CB-CE2 4.46Å; H502-Y505 PolarHBondContact O-N 3.43Å
503	I	75	Confident	77.1	Confident	98 Å²	98	43.8 Å²	43.8	50%	0.503	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-55.2	-30.7	-173.5	-153	169.7	0	0	0	113.6	Y505 I506 I559	I503-Y505 PolarHBondContact O-N 2.99Å; I503-I506 HydrophobicContact CB-CD1 4.42Å; I503-I506 HydrophobicContact CG1-CD1 3.52Å; I503-I506 WeakPolarHBondContact O-CB 3.39Å; I503-I506 WeakPolarHBondContact O-CG1 3.26Å; I503-I506 PolarHBondContact O-N 3.41Å; I503-I506 VanDerWaalsContact O-N 3.13Å; I503-I559 HydrophobicContact CD1-CD1 3.84Å
504	N	78	Confident	76.9	Confident	52 Å²	52	44.6 Å²	44.6	28%	0.278	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-60.6	-21.5	177	-66.9	-3.2	0	0	0	114.4	H502 P507 S1019	H502-N504 PolarHBondContact CE1-ND2 3.46Å; H502-N504 WeakPolarHBondContact ND1-CB 3.39Å; H502-N504 PolarHBondContact ND1-N 2.94Å; H502-N504 PolarHBondContact O-N 3.25Å; N504-P507 WeakPolarHBondContact O-CD 3.45Å; N504-S1019 PolarHBondContact ND2-OG 2.9Å
505	Y	77.5	Confident	76	Confident	78 Å²	78	49.1 Å²	49.1	31%	0.306	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-90.1	-5.6	178.3	-70	-75.5	0	0	0	113.7	Y451 S500 H502 I503 L508 I509	Y451-Y505 WeakPolarHBondContact O-CE2 3.47Å; Y451-Y505 PolarHBondContact O-OH 3.36Å; S500-Y505 VanDerWaalsContact CB-CD2 3.49Å; S500-Y505 WeakPolarHBondContact OG-CD2 3.3Å; H502-Y505 HydrophobicContact CB-CD2 4.07Å; H502-Y505 HydrophobicContact CB-CE2 4.46Å; H502-Y505 PolarHBondContact O-N 3.43Å; I503-Y505 PolarHBondContact O-N 2.99Å; Y505-L508 HydrophobicContact CD1-CD2 3.87Å; Y505-L508 HydrophobicContact CE1-CD2 4.45Å; Y505-L508 WeakPolarHBondContact O-CA 3.26Å; Y505-L508 WeakPolarHBondContact O-CB 3.16Å; Y505-L508 PolarHBondContact O-N 3.26Å; Y505-I509 WeakPolarHBondContact O-CG1 3.38Å; Y505-I509 PolarHBondContact O-N 3.09Å
506	I	76.7	Confident	75.3	Confident	38 Å²	38	49.5 Å²	49.5	20%	0.195	26%	0.256	C	S	.	.	H	α-helix	trans	-51.6	-46.2	176.9	-75.2	172.8	0	0	0	113.2	I503 L508 I509 S510 I559 W560 L563	I503-I506 HydrophobicContact CB-CD1 4.42Å; I503-I506 HydrophobicContact CG1-CD1 3.52Å; I503-I506 WeakPolarHBondContact O-CB 3.39Å; I503-I506 WeakPolarHBondContact O-CG1 3.26Å; I503-I506 PolarHBondContact O-N 3.41Å; I503-I506 VanDerWaalsContact O-N 3.13Å; I506-L508 VanDerWaalsContact C-N 3.29Å; I506-L508 PolarHBondContact O-N 3.38Å; I506-I509 PolarHBondContact O-N 2.97Å; I506-S510 VanDerWaalsContact O-CB 3.3Å; I506-S510 WeakPolarHBondContact O-CB 3.44Å; I506-S510 PolarHBondContact O-N 3.05Å; I506-I559 HydrophobicContact CD1-CG2 3.22Å; I506-I559 HydrophobicContact CG1-CG2 4.48Å; I506-W560 HydrophobicContact CD1-CZ3 4.49Å; I506-W560 HydrophobicContact CG1-CE3 4.48Å; I506-W560 HydrophobicContact CG1-CH2 3.99Å; I506-W560 HydrophobicContact CG1-CZ3 3.74Å; I506-L563 HydrophobicContact CB-CD1 4.19Å; I506-L563 HydrophobicContact CG1-CD1 4.13Å; I506-L563 HydrophobicContact CG2-CD1 3.68Å; I506-L563 HydrophobicContact CG2-CG 4.44Å
507	P	74.3	Confident	74.7	Confident	79 Å²	79	49.7 Å²	49.7	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-40.8	176.8	-24	34.9	0	0	0	112.4	N504 S510 F511	N504-P507 WeakPolarHBondContact O-CD 3.45Å; P507-S510 PolarHBondContact O-N 3.03Å; P507-S510 PolarHBondContact O-OG 3.16Å; P507-F511 PolarHBondContact O-N 3.02Å
508	L	73.5	Confident	74.4	Confident	72 Å²	72	47.2 Å²	47.2	38%	0.377	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-49.9	177.9	-174.7	72.3	0	0	0	111.1	I453 Y505 I506 S510 F511 F512	I453-L508 HydrophobicContact CD1-CD2 3.87Å; I453-L508 HydrophobicContact CD1-CG 4Å; I453-L508 HydrophobicContact CG1-CD2 4.22Å; Y505-L508 HydrophobicContact CD1-CD2 3.87Å; Y505-L508 HydrophobicContact CE1-CD2 4.45Å; Y505-L508 WeakPolarHBondContact O-CA 3.26Å; Y505-L508 WeakPolarHBondContact O-CB 3.16Å; Y505-L508 PolarHBondContact O-N 3.26Å; I506-L508 VanDerWaalsContact C-N 3.29Å; I506-L508 PolarHBondContact O-N 3.38Å; L508-S510 VanDerWaalsContact C-N 3.26Å; L508-S510 PolarHBondContact O-N 2.93Å; L508-F511 VanDerWaalsContact O-CB 3.27Å; L508-F511 WeakPolarHBondContact O-CB 3.46Å; L508-F511 PolarHBondContact O-N 3.13Å; L508-F512 HydrophobicContact CD1-CE2 3.81Å; L508-F512 HydrophobicContact CG-CD2 4.39Å; L508-F512 HydrophobicContact CG-CE2 3.93Å; L508-F512 VanDerWaalsContact O-CD2 3.23Å; L508-F512 WeakPolarHBondContact O-CD2 3.33Å
509	I	73.2	Confident	74.3	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-57.1	-43.6	177.9	-65.4	164.8	0	0	0	109.9	L421 I453 C499 Y505 I506 F511 F512 T513 W560 L563	L421-I509 HydrophobicContact CD2-CD1 4.36Å; L421-I509 HydrophobicContact CD2-CG2 3.86Å; I453-I509 HydrophobicContact CD1-CG1 4.15Å; C499-I509 HydrophobicContact CB-CD1 3.71Å; C499-I509 HydrophobicContact CB-CG1 3.97Å; Y505-I509 WeakPolarHBondContact O-CG1 3.38Å; Y505-I509 PolarHBondContact O-N 3.09Å; I506-I509 PolarHBondContact O-N 2.97Å; I509-F511 PolarHBondContact O-N 2.85Å; I509-F511 VanDerWaalsContact O-N 3.15Å; I509-F512 PolarHBondContact O-N 2.88Å; I509-T513 HydrophobicContact CG2-CG2 4.37Å; I509-T513 WeakPolarHBondContact O-CG2 3.43Å; I509-T513 PolarHBondContact O-N 2.89Å; I509-T513 VanDerWaalsContact O-N 3.14Å; I509-W560 HydrophobicContact CD1-CH2 3.68Å; I509-W560 HydrophobicContact CD1-CZ3 3.62Å; I509-L563 HydrophobicContact CG2-CD1 4.26Å
510	S	70.5	Confident	74.3	Confident	17 Å²	17	47.1 Å²	47.1	12%	0.119	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-23.1	178.2	87	0	0	0	0	113.9	I506 P507 L508 T513 R567	I506-S510 VanDerWaalsContact O-CB 3.3Å; I506-S510 WeakPolarHBondContact O-CB 3.44Å; I506-S510 PolarHBondContact O-N 3.05Å; P507-S510 PolarHBondContact O-N 3.03Å; P507-S510 PolarHBondContact O-OG 3.16Å; L508-S510 VanDerWaalsContact C-N 3.26Å; L508-S510 PolarHBondContact O-N 2.93Å; S510-T513 PolarHBondContact O-OG1 2.91Å; S510-R567 PolarHBondContact O-NE 2.98Å; S510-R567 PolarHBondContact O-NH2 3.13Å; S510-R567 VanDerWaalsContact O-NH2 3.1Å; S510-R567 PolarHBondContact OG-NH2 3.46Å
511	F	68.5	Low	74.6	Confident	165 Å²	165	46.6 Å²	46.6	72%	0.724	24%	0.243	S	C	*	.	H	α-helix	trans	-75.4	-29.6	175.1	-168.9	-97.1	0	0	0	111.8	P507 L508 I509	P507-F511 PolarHBondContact O-N 3.02Å; L508-F511 VanDerWaalsContact O-CB 3.27Å; L508-F511 WeakPolarHBondContact O-CB 3.46Å; L508-F511 PolarHBondContact O-N 3.13Å; I509-F511 PolarHBondContact O-N 2.85Å; I509-F511 VanDerWaalsContact O-N 3.15Å
512	F	64	Low	74.9	Confident	77 Å²	77	46.1 Å²	46.1	34%	0.338	24%	0.239	S	C	.	.	H	α-helix	trans	-95.7	-7.7	-178.2	-64.1	-69.6	0	0	0	114.1	K417 I453 W497 L508 I509 S514	K417-F512 PolarHBondContact NZ-O 2.61Å; I453-F512 HydrophobicContact CD1-CD2 3.66Å; I453-F512 HydrophobicContact CD1-CE2 3.98Å; W497-F512 HydrophobicContact CE3-CB 4.18Å; W497-F512 HydrophobicContact CE3-CG 4.39Å; W497-F512 HydrophobicContact CH2-CB 4.28Å; W497-F512 AromaticContact CH2-CD1 3.61Å; W497-F512 HydrophobicContact CH2-CD1 3.61Å; W497-F512 HydrophobicContact CH2-CE1 4.09Å; W497-F512 AromaticContact CH2-CG 3.99Å; W497-F512 HydrophobicContact CH2-CG 3.99Å; W497-F512 HydrophobicContact CZ3-CB 3.63Å; W497-F512 AromaticContact CZ3-CD1 3.58Å; W497-F512 HydrophobicContact CZ3-CD1 3.58Å; W497-F512 AromaticContact CZ3-CD2 3.95Å; W497-F512 HydrophobicContact CZ3-CD2 3.95Å; W497-F512 HydrophobicContact CZ3-CE1 4.18Å; W497-F512 HydrophobicContact CZ3-CE2 4.5Å; W497-F512 AromaticContact CZ3-CG 3.44Å; W497-F512 HydrophobicContact CZ3-CG 3.44Å; W497-F512 VanDerWaalsContact CZ3-CG 3.44Å; L508-F512 HydrophobicContact CD1-CE2 3.81Å; L508-F512 HydrophobicContact CG-CD2 4.39Å; L508-F512 HydrophobicContact CG-CE2 3.93Å; L508-F512 VanDerWaalsContact O-CD2 3.23Å; L508-F512 WeakPolarHBondContact O-CD2 3.33Å; I509-F512 PolarHBondContact O-N 2.88Å; F512-S514 PolarHBondContact O-N 2.86Å
513	T	66.6	Low	75.2	Confident	21 Å²	21	42.6 Å²	42.6	13%	0.129	22%	0.222	C	C	.	.			trans	-69.4	115.5	174.3	54.5	0	0	0	0	110.9	I509 S510 F519 L563	I509-T513 HydrophobicContact CG2-CG2 4.37Å; I509-T513 WeakPolarHBondContact O-CG2 3.43Å; I509-T513 PolarHBondContact O-N 2.89Å; I509-T513 VanDerWaalsContact O-N 3.14Å; S510-T513 PolarHBondContact O-OG1 2.91Å; T513-F519 HydrophobicContact CG2-CE1 3.66Å; T513-F519 HydrophobicContact CG2-CZ 3.48Å; T513-F519 VanDerWaalsContact CG2-CZ 3.48Å; T513-L563 HydrophobicContact CG2-CD2 3.91Å
514	S	66	Low	75.6	Confident	42 Å²	42	38 Å²	38	29%	0.294	20%	0.199	S	C	.	.			trans	-105.6	160.2	171.1	71.7	0	0	0	0	110.9	F512 S516 T517	F512-S514 PolarHBondContact O-N 2.86Å; S514-S516 PolarHBondContact O-N 2.73Å; S514-S516 PolarHBondContact OG-OG 3.05Å; S514-T517 PolarHBondContact N-OG1 3.2Å; S514-T517 WeakPolarHBondContact O-CB 3.32Å; S514-T517 PolarHBondContact O-N 3.37Å; S514-T517 PolarHBondContact O-OG1 2.88Å; S514-T517 PolarHBondContact OG-OG1 3.15Å
515	L	60.7	Low	75.8	Confident	97 Å²	97	35.5 Å²	35.5	51%	0.508	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.8	174.1	-73.5	159.5	0	0	0	111.1	T517 L568 Y570	L515-T517 PolarHBondContact O-N 3.19Å; L515-T517 VanDerWaalsContact O-N 3.15Å; L515-L568 HydrophobicContact CD2-CD2 3.85Å; L515-L568 HydrophobicContact CG-CD2 4.22Å; L515-Y570 VanDerWaalsContact C-OH 3.32Å; L515-Y570 HydrophobicContact CD2-CE1 3.97Å; L515-Y570 PolarHBondContact O-OH 3.4Å
516	S	64.8	Low	75.9	Confident	45 Å²	45	34.1 Å²	34.1	32%	0.315	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	30.1	178.1	66.9	0	0	0	0	113.6	S514 Y687	S514-S516 PolarHBondContact O-N 2.73Å; S514-S516 PolarHBondContact OG-OG 3.05Å; S516-Y687 WeakPolarHBondContact O-CE2 3.47Å; S516-Y687 PolarHBondContact O-OH 2.95Å
517	T	75.6	Confident	76.1	Confident	5 Å²	5	36 Å²	36	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.4	177	-57.6	0	0	0	0	110.2	K417 T419 S514 L515 F519	K417-T517 HydrophobicContact CD-CG2 4.33Å; K417-T517 HydrophobicContact CG-CG2 4.19Å; T419-T517 WeakPolarHBondContact OG1-CG2 3.43Å; S514-T517 PolarHBondContact N-OG1 3.2Å; S514-T517 WeakPolarHBondContact O-CB 3.32Å; S514-T517 PolarHBondContact O-N 3.37Å; S514-T517 PolarHBondContact O-OG1 2.88Å; S514-T517 PolarHBondContact OG-OG1 3.15Å; L515-T517 PolarHBondContact O-N 3.19Å; L515-T517 VanDerWaalsContact O-N 3.15Å; T517-F519 HydrophobicContact CG2-CD1 4.46Å; T517-F519 HydrophobicContact CG2-CE1 4.03Å; T517-F519 HydrophobicContact CG2-CE2 4.17Å; T517-F519 HydrophobicContact CG2-CZ 3.87Å
518	I	80.3	Confident	76.2	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.3	170.1	-63.4	178.7	0	0	0	108.2	I416 K417 I418 T419 I574 I677 L680 A681 Y687	I416-I518 HydrophobicContact CG2-CD1 3.83Å; I416-I518 HydrophobicContact CG2-CG1 4.49Å; K417-I518 PolarHBondContact O-N 3.12Å; I418-I518 CarbonylContact C-O 3.56Å; I418-I518 VanDerWaalsContact CA-O 3.31Å; I418-I518 WeakPolarHBondContact CA-O 3.49Å; T419-I518 PolarHBondContact N-O 3.14Å; I518-I574 HydrophobicContact CG2-CD1 4.23Å; I518-I677 HydrophobicContact CD1-CG2 4.01Å; I518-I677 WeakPolarHBondContact CD1-O 3.35Å; I518-L680 HydrophobicContact CB-CD2 4.31Å; I518-L680 HydrophobicContact CD1-CD2 3.7Å; I518-L680 HydrophobicContact CG1-CD2 3.64Å; I518-L680 HydrophobicContact CG2-CD2 3.86Å; I518-A681 HydrophobicContact CD1-CB 3.95Å; I518-Y687 HydrophobicContact CD1-CE2 4.4Å; I518-Y687 HydrophobicContact CG1-CE2 4.03Å
519	F	85.9	Confident	76	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.7	178.3	-66	-80.7	0	0	0	110.9	T419 L421 T513 T517 I564 L568 I573 I574	T419-F519 HydrophobicContact CG2-CD1 4.28Å; T419-F519 HydrophobicContact CG2-CE1 4.2Å; L421-F519 HydrophobicContact CD1-CD1 3.49Å; L421-F519 VanDerWaalsContact CD1-CD1 3.49Å; L421-F519 HydrophobicContact CD1-CE1 4.1Å; L421-F519 HydrophobicContact CD1-CG 4.32Å; L421-F519 HydrophobicContact CG-CD1 4.17Å; T513-F519 HydrophobicContact CG2-CE1 3.66Å; T513-F519 HydrophobicContact CG2-CZ 3.48Å; T513-F519 VanDerWaalsContact CG2-CZ 3.48Å; T517-F519 HydrophobicContact CG2-CD1 4.46Å; T517-F519 HydrophobicContact CG2-CE1 4.03Å; T517-F519 HydrophobicContact CG2-CE2 4.17Å; T517-F519 HydrophobicContact CG2-CZ 3.87Å; F519-I564 HydrophobicContact CB-CD1 3.67Å; F519-I564 HydrophobicContact CD1-CD1 4.01Å; F519-I564 HydrophobicContact CD1-CG1 4.19Å; F519-I564 HydrophobicContact CD2-CD1 3.89Å; F519-I564 HydrophobicContact CD2-CG1 3.98Å; F519-I564 HydrophobicContact CD2-CG2 4.16Å; F519-I564 HydrophobicContact CE1-CG1 4.37Å; F519-I564 HydrophobicContact CE2-CG1 4.2Å; F519-I564 HydrophobicContact CE2-CG2 4.31Å; F519-I564 HydrophobicContact CG-CD1 3.55Å; F519-I564 HydrophobicContact CG-CG1 3.98Å; F519-I564 HydrophobicContact CZ-CG1 4.38Å; F519-L568 HydrophobicContact CD2-CD1 4.45Å; F519-L568 HydrophobicContact CE2-CD1 3.63Å; F519-L568 HydrophobicContact CZ-CD1 4.49Å; F519-I573 HydrophobicContact CB-CG1 4.23Å; F519-I573 WeakPolarHBondContact O-CA 3.35Å; F519-I574 PolarHBondContact O-N 3.19Å
520	I	87.6	Confident	75.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.3	172.3	-59.3	-172.7	0	0	0	107.3	I418 T419 L420 L421 V522 I574 I576 L673 I677	I418-I520 HydrophobicContact CG2-CD1 3.41Å; I418-I520 VanDerWaalsContact CG2-CD1 3.41Å; I418-I520 HydrophobicContact CG2-CG1 3.67Å; T419-I520 PolarHBondContact O-N 3.35Å; L420-I520 CarbonylContact C-O 3.54Å; L420-I520 WeakPolarHBondContact CA-O 3.1Å; L420-I520 HydrophobicContact CD2-CB 3.7Å; L420-I520 HydrophobicContact CD2-CD1 4.08Å; L420-I520 HydrophobicContact CD2-CG1 4.33Å; L420-I520 HydrophobicContact CD2-CG2 3.86Å; L421-I520 PolarHBondContact N-O 3.29Å; I520-V522 HydrophobicContact CG2-CG2 4.29Å; I520-I574 CarbonylContact C-O 3.57Å; I520-I574 VanDerWaalsContact CA-O 3.25Å; I520-I574 WeakPolarHBondContact CA-O 3.29Å; I520-I574 HydrophobicContact CG1-CB 4.22Å; I520-I576 HydrophobicContact CD1-CD1 4.48Å; I520-I576 HydrophobicContact CG2-CB 4.43Å; I520-I576 HydrophobicContact CG2-CD1 3.3Å; I520-I576 HydrophobicContact CG2-CG1 3.76Å; I520-L673 HydrophobicContact CD1-CD1 4.5Å; I520-I677 HydrophobicContact CD1-CD1 4.43Å
521	I	88.3	Confident	74.6	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.3	173.8	-60.2	179	0	0	0	108.3	L421 V523 I557 W560 L561 I573 I574 V575 I576	L421-I521 HydrophobicContact CB-CG1 4.32Å; L421-I521 CarbonylContact O-C 3.59Å; L421-I521 VanDerWaalsContact O-CA 3.31Å; L421-I521 WeakPolarHBondContact O-CA 3.27Å; I521-V523 HydrophobicContact CG2-CG2 3.98Å; I521-I557 HydrophobicContact CD1-CG2 4.41Å; I521-I557 HydrophobicContact CG2-CG1 4.29Å; I521-W560 HydrophobicContact CD1-CB 3.89Å; I521-W560 HydrophobicContact CG1-CB 4.43Å; I521-L561 HydrophobicContact CD1-CD2 4.12Å; I521-L561 HydrophobicContact CD1-CG 4.48Å; I521-I573 HydrophobicContact CB-CG2 4.24Å; I521-I573 HydrophobicContact CD1-CD1 4.03Å; I521-I573 HydrophobicContact CD1-CG2 3.82Å; I521-I573 HydrophobicContact CG1-CG2 3.73Å; I521-I574 PolarHBondContact N-O 3.16Å; I521-V575 WeakPolarHBondContact O-CA 3.43Å; I521-I576 PolarHBondContact O-N 2.84Å
522	V	86.4	Confident	73.3	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.2	177	-173.1	0	0	0	0	109.1	L421 C426 K428 L431 I520 I576 T578	L421-V522 PolarHBondContact O-N 3.11Å; C426-V522 WeakPolarHBondContact O-CG1 3.38Å; C426-V522 PolarHBondContact SG-O 2.97Å; K428-V522 HydrophobicContact CG-CB 3.78Å; K428-V522 HydrophobicContact CG-CG1 4.37Å; K428-V522 HydrophobicContact CG-CG2 3.88Å; L431-V522 HydrophobicContact CD2-CG2 3.79Å; I520-V522 HydrophobicContact CG2-CG2 4.29Å; V522-I576 CarbonylContact C-O 3.54Å; V522-I576 WeakPolarHBondContact CA-O 3.35Å; V522-T578 HydrophobicContact CG1-CG2 3.44Å; V522-T578 VanDerWaalsContact CG1-CG2 3.44Å
523	V	85.7	Confident	72	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.1	-173.7	-175.6	0	0	0	0	110	I521 I525 I557 V575 I576 V577 T578 L596	I521-V523 HydrophobicContact CG2-CG2 3.98Å; V523-I525 PolarHBondContact O-N 2.81Å; V523-I557 HydrophobicContact CG1-CD1 4.12Å; V523-I557 HydrophobicContact CG2-CD1 3.61Å; V523-I557 HydrophobicContact CG2-CG1 3.8Å; V523-V575 HydrophobicContact CG2-CG1 3.96Å; V523-I576 PolarHBondContact N-O 3.39Å; V523-V577 HydrophobicContact CB-CG2 4.49Å; V523-V577 WeakPolarHBondContact O-CA 3.34Å; V523-T578 PolarHBondContact O-N 3.01Å; V523-T578 PolarHBondContact O-OG1 2.95Å; V523-L596 HydrophobicContact CB-CD2 4.48Å; V523-L596 HydrophobicContact CG1-CD2 4.21Å
524	D	83.7	Confident	70.6	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.011	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.4	169.6	-175.6	-16.1	0	0	0	109.4	C426 T526 K527 Y552 K579	C426-D524 HydrophobicContact CB-CB 4.09Å; D524-T526 VanDerWaalsContact C-N 3.29Å; D524-T526 PolarHBondContact O-N 3.28Å; D524-T526 WeakPolarHBondContact OD1-CB 3.31Å; D524-T526 PolarHBondContact OD1-N 3.28Å; D524-T526 PolarHBondContact OD1-OG1 2.86Å; D524-K527 HydrophobicContact CB-CD 4.12Å; D524-K527 HydrophobicContact CB-CG 4.38Å; D524-K527 VanDerWaalsContact OD2-CE 3.3Å; D524-K527 WeakPolarHBondContact OD2-CE 3.43Å; D524-K527 IonicContact OD2-NZ 3.67Å; D524-Y552 PolarHBondContact O-OH 3.31Å; D524-K579 WeakPolarHBondContact OD2-CD 3.36Å; D524-K579 IonicContact OD2-NZ 3.38Å; D524-K579 PolarHBondContact OD2-NZ 2.67Å; D524-K579 VanDerWaalsContact OD2-NZ 3.1Å
525	I	82.1	Confident	69.2	Low	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-74.8	-20.9	-176.4	-160.3	64	0	0	0	113.7	V523 K527 L528 V577 T578 I583 L589 R592 I593	V523-I525 PolarHBondContact O-N 2.81Å; I525-K527 PolarHBondContact O-N 2.87Å; I525-L528 HydrophobicContact CD1-CB 4.34Å; I525-L528 WeakPolarHBondContact O-CB 2.97Å; I525-L528 PolarHBondContact O-N 2.92Å; I525-L528 VanDerWaalsContact O-N 3.16Å; I525-V577 HydrophobicContact CB-CG1 3.41Å; I525-V577 VanDerWaalsContact CB-CG1 3.41Å; I525-V577 HydrophobicContact CD1-CG1 4.07Å; I525-V577 HydrophobicContact CG1-CG1 3.93Å; I525-V577 HydrophobicContact CG2-CG1 3.8Å; I525-T578 WeakPolarHBondContact CG2-O 3.41Å; I525-T578 PolarHBondContact N-O 2.97Å; I525-I583 HydrophobicContact CB-CD1 4.25Å; I525-I583 HydrophobicContact CG1-CD1 3.97Å; I525-I583 HydrophobicContact CG2-CD1 3.54Å; I525-I583 HydrophobicContact CG2-CG1 4.37Å; I525-L589 HydrophobicContact CG1-CD1 4.25Å; I525-L589 HydrophobicContact CG2-CD1 4.14Å; I525-R592 HydrophobicContact CD1-CB 3.81Å; I525-R592 HydrophobicContact CG1-CB 3.92Å; I525-R592 PolarHBondContact O-NH1 2.81Å; I525-I593 HydrophobicContact CD1-CG1 4.34Å
526	T	78.9	Confident	68.2	Low	48 Å²	48	60.8 Å²	60.8	29%	0.294	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-32.8	-178.3	65.6	0	0	0	0	111.1	D524 L528 K579 L582 I583 R592	D524-T526 VanDerWaalsContact C-N 3.29Å; D524-T526 PolarHBondContact O-N 3.28Å; D524-T526 WeakPolarHBondContact OD1-CB 3.31Å; D524-T526 PolarHBondContact OD1-N 3.28Å; D524-T526 PolarHBondContact OD1-OG1 2.86Å; T526-L528 VanDerWaalsContact C-N 3.3Å; T526-L528 PolarHBondContact O-N 3.13Å; T526-K579 HydrophobicContact CG2-CB 3.88Å; T526-K579 WeakPolarHBondContact CG2-O 3.41Å; T526-L582 HydrophobicContact CG2-CB 3.66Å; T526-L582 HydrophobicContact CG2-CD1 4.01Å; T526-L582 HydrophobicContact CG2-CG 4.4Å; T526-I583 HydrophobicContact CG2-CG1 4.45Å; T526-R592 PolarHBondContact O-NH1 2.94Å
527	K	81	Confident	66.8	Low	79 Å²	79	65.5 Å²	65.5	34%	0.343	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-9.6	178.1	-63.5	178.9	-177.7	172.2	0	113.7	D524 I525 E529 Y552	D524-K527 HydrophobicContact CB-CD 4.12Å; D524-K527 HydrophobicContact CB-CG 4.38Å; D524-K527 VanDerWaalsContact OD2-CE 3.3Å; D524-K527 WeakPolarHBondContact OD2-CE 3.43Å; D524-K527 IonicContact OD2-NZ 3.67Å; I525-K527 PolarHBondContact O-N 2.87Å; K527-E529 PolarHBondContact O-N 3.44Å; K527-Y552 HydrophobicContact CB-CD2 4.23Å; K527-Y552 HydrophobicContact CB-CE1 3.82Å; K527-Y552 HydrophobicContact CB-CE2 3.5Å; K527-Y552 WeakPolarHBondContact CB-OH 3.28Å; K527-Y552 HydrophobicContact CD-CE2 3.8Å; K527-Y552 WeakPolarHBondContact CD-OH 3.44Å; K527-Y552 HydrophobicContact CG-CE2 4.27Å
528	L	77.2	Confident	64.9	Low	4 Å²	4	72.6 Å²	72.6	2%	0.021	39%	0.385	C	S	.	.	S	Bend	trans	-83.3	100.2	176.8	-158.1	130.3	0	0	0	109.1	I525 T526 R592 Q595 L596	I525-L528 HydrophobicContact CD1-CB 4.34Å; I525-L528 WeakPolarHBondContact O-CB 2.97Å; I525-L528 PolarHBondContact O-N 2.92Å; I525-L528 VanDerWaalsContact O-N 3.16Å; T526-L528 VanDerWaalsContact C-N 3.3Å; T526-L528 PolarHBondContact O-N 3.13Å; L528-R592 HydrophobicContact CD2-CB 4.2Å; L528-R592 WeakPolarHBondContact O-CD 3.38Å; L528-R592 PolarHBondContact O-NH1 3.46Å; L528-R592 VanDerWaalsContact O-NH1 3.13Å; L528-Q595 HydrophobicContact CD2-CB 4.38Å; L528-Q595 HydrophobicContact CD2-CG 4.17Å; L528-L596 HydrophobicContact CD1-CB 4.02Å; L528-L596 HydrophobicContact CD1-CD1 3.58Å; L528-L596 HydrophobicContact CD1-CG 4.28Å
529	E	68.3	Low	62.8	Low	158 Å²	158	80.4 Å²	80.4	74%	0.738	43%	0.427	S	S	*	.			trans	-62.6	132.3	178.6	-71.5	-176	170.7	0	0	111.1	K527 T531 Q595	K527-E529 PolarHBondContact O-N 3.44Å; E529-T531 PolarHBondContact O-N 2.84Å; E529-Q595 PolarHBondContact O-NE2 3.39Å; E529-Q595 VanDerWaalsContact O-NE2 3.07Å
530	P	58.5	Low	60.3	Low	65 Å²	65	84.9 Å²	84.9	42%	0.422	46%	0.458	S	S	.	.			trans	-64.1	122.6	170	24.6	-28.9	0	0	0	108.2	L532	P530-L532 PolarHBondContact O-N 3.22Å
531	T	55.7	Low	57.8	Low	98 Å²	98	92.5 Å²	92.5	60%	0.601	50%	0.499	S	S	*	.			trans	-61.8	108.5	172.9	42.7	0	0	0	0	108.2	E529 L533	E529-T531 PolarHBondContact O-N 2.84Å; T531-L533 PolarHBondContact O-N 3.06Å
532	L	42.4	Very low	55.2	Low	162 Å²	162	98.8 Å²	98.8	85%	0.848	53%	0.533	S	S	*	.			trans	-50.7	117.2	164.2	-76.5	167.1	0	0	0	106.8	P530 I534	P530-L532 PolarHBondContact O-N 3.22Å; L532-I534 PolarHBondContact O-N 2.92Å
533	L	35.8	Very low	52.8	Low	160 Å²	160	105.1 Å²	105.1	84%	0.838	57%	0.567	S	S	*	*			trans	-52.4	111.6	169.3	-75.8	162.4	0	0	0	106	T531 D535	T531-L533 PolarHBondContact O-N 3.06Å; L533-D535 VanDerWaalsContact C-N 3.32Å; L533-D535 PolarHBondContact O-N 3.38Å
534	I	38.2	Very low	50.4	Low	147 Å²	147	112 Å²	112	75%	0.754	60%	0.604	S	S	*	*			trans	-64.5	102.7	172.2	-62.7	171.1	0	0	0	104.6	L532 N536	L532-I534 PolarHBondContact O-N 2.92Å; I534-N536 PolarHBondContact O-N 2.84Å
535	D	35.5	Very low	48	Very low	141 Å²	141	118.3 Å²	118.3	75%	0.754	64%	0.637	S	S	*	*			trans	-55.1	113.2	168.6	-83.6	-28.6	0	0	0	107.1	L533 N537	L533-D535 VanDerWaalsContact C-N 3.32Å; L533-D535 PolarHBondContact O-N 3.38Å; D535-N537 PolarHBondContact O-N 2.87Å
536	N	40.1	Very low	45.7	Very low	156 Å²	156	124.1 Å²	124.1	83%	0.834	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	17.7	-172.3	-86	-25.9	0	0	0	114.9	I534	I534-N536 PolarHBondContact O-N 2.84Å
537	N	36.5	Very low	43.8	Very low	145 Å²	145	131 Å²	131	78%	0.775	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	0.3	-171.5	-83.9	-4.4	0	0	0	117.1	D535	D535-N537 PolarHBondContact O-N 2.87Å
538	N	34.5	Very low	41.7	Very low	154 Å²	154	134 Å²	134	82%	0.824	71%	0.713	S	S	*	*			trans	-109.2	81	176.9	-72.3	-17.6	0	0	0	112.6	S540	N538-S540 PolarHBondContact O-N 2.97Å; N538-S540 VanDerWaalsContact O-N 3.07Å
539	N	35.6	Very low	39.8	Very low	165 Å²	165	138.1 Å²	138.1	88%	0.882	74%	0.741	S	S	*	*			trans	-63	94.2	156.8	-78.7	-29.7	0	0	0	109.4
540	S	34.1	Very low	38.9	Very low	95 Å²	95	138.3 Å²	138.3	66%	0.664	74%	0.74	S	S	*	*	S	Bend	trans	179.4	113.8	144.8	37.6	0	0	0	0	112.9	N538 N542	N538-S540 PolarHBondContact O-N 2.97Å; N538-S540 VanDerWaalsContact O-N 3.07Å; S540-N542 PolarHBondContact O-N 3.48Å
541	N	35.8	Very low	39.3	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	74%	0.742	S	S	*	*			trans	54.7	49.3	138	-65.2	-8.9	0	0	0	120.8
542	N	33.6	Very low	40	Very low	134 Å²	134	136.8 Å²	136.8	72%	0.717	72%	0.721	S	S	*	*			trans	-126.3	59.7	161.7	-88.9	-23.2	0	0	0	112.8	S540 N544	S540-N542 PolarHBondContact O-N 3.48Å; N542-N544 VanDerWaalsContact C-N 3.31Å; N542-N544 PolarHBondContact O-N 2.94Å
543	N	35.8	Very low	41.9	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-0.3	177.4	-91.4	-12.1	0	0	0	115.1
544	N	35.4	Very low	43.9	Very low	146 Å²	146	126.5 Å²	126.5	78%	0.781	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-14.3	-178.2	-77.3	-10.3	0	0	0	114.8	N542	N542-N544 VanDerWaalsContact C-N 3.31Å; N542-N544 PolarHBondContact O-N 2.94Å
545	N	32.7	Very low	45.6	Very low	134 Å²	134	124.1 Å²	124.1	72%	0.717	65%	0.647	S	S	*	*	S	Bend	trans	-90.2	-10.9	179.9	-75.2	-6.7	0	0	0	114.5	K547	N545-K547 VanDerWaalsContact C-N 3.35Å; N545-K547 PolarHBondContact O-N 3.44Å
546	I	34.7	Very low	47.4	Very low	122 Å²	122	117.6 Å²	117.6	63%	0.626	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-17.3	-177.7	-63.2	170.2	0	0	0	112.5	N548	I546-N548 VanDerWaalsContact C-N 3.33Å; I546-N548 PolarHBondContact O-N 2.8Å
547	K	38	Very low	49.4	Very low	193 Å²	193	110.2 Å²	110.2	84%	0.839	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-12.3	-179	-83.8	-176.1	176.8	176.3	0	115.2	N545	N545-K547 VanDerWaalsContact C-N 3.35Å; N545-K547 PolarHBondContact O-N 3.44Å
548	N	36.6	Very low	51.6	Low	142 Å²	142	103.3 Å²	103.3	76%	0.759	54%	0.536	S	S	*	.	S	Bend	trans	-112.3	-6.9	-171.7	-81.5	-6.8	0	0	0	116.2	I546 K550	I546-N548 VanDerWaalsContact C-N 3.33Å; I546-N548 PolarHBondContact O-N 2.8Å; N548-K550 PolarHBondContact O-N 3.16Å
549	S	37.2	Very low	54	Low	89 Å²	89	98.5 Å²	98.5	62%	0.622	51%	0.51	S	S	*	.			trans	-75	82.8	168.7	63	0	0	0	0	108.6	N551	S549-N551 PolarHBondContact O-N 2.84Å
550	K	50.3	Low	56.3	Low	163 Å²	163	90.9 Å²	90.9	71%	0.709	47%	0.469	S	S	*	.			trans	-46.3	107.8	166.3	-75.2	173.4	175.9	175.4	0	107	N548 Y552	N548-K550 PolarHBondContact O-N 3.16Å; K550-Y552 PolarHBondContact O-N 3.49Å
551	N	66.7	Low	58.7	Low	86 Å²	86	86.5 Å²	86.5	46%	0.46	44%	0.438	S	S	.	.			trans	-66	99.1	-170.4	-165.4	-15.6	0	0	0	108.5	S549 F553 Y554	S549-N551 PolarHBondContact O-N 2.84Å; N551-F553 PolarHBondContact O-N 2.88Å; N551-Y554 HydrophobicContact CB-CD2 3.78Å; N551-Y554 HydrophobicContact CB-CE2 4.45Å; N551-Y554 WeakPolarHBondContact ND2-CE2 3.33Å; N551-Y554 PolarHBondContact O-N 2.95Å
552	Y	71.2	Confident	60.9	Low	45 Å²	45	80.5 Å²	80.5	18%	0.176	41%	0.405	C	S	.	.	H	α-helix	trans	-46.9	-40.2	-173	173.2	-103.9	0	0	0	111.8	D524 K527 K550 Y554 Q555 T556	D524-Y552 PolarHBondContact O-OH 3.31Å; K527-Y552 HydrophobicContact CB-CD2 4.23Å; K527-Y552 HydrophobicContact CB-CE1 3.82Å; K527-Y552 HydrophobicContact CB-CE2 3.5Å; K527-Y552 WeakPolarHBondContact CB-OH 3.28Å; K527-Y552 HydrophobicContact CD-CE2 3.8Å; K527-Y552 WeakPolarHBondContact CD-OH 3.44Å; K527-Y552 HydrophobicContact CG-CE2 4.27Å; K550-Y552 PolarHBondContact O-N 3.49Å; Y552-Y554 VanDerWaalsContact C-N 3.33Å; Y552-Y554 PolarHBondContact O-N 2.93Å; Y552-Q555 PolarHBondContact O-N 2.91Å; Y552-T556 HydrophobicContact CD1-CG2 4.46Å; Y552-T556 HydrophobicContact CD2-CG2 3.77Å; Y552-T556 HydrophobicContact CE1-CG2 4.02Å; Y552-T556 HydrophobicContact CE2-CG2 3.22Å; Y552-T556 HydrophobicContact CG-CG2 4.34Å; Y552-T556 PolarHBondContact O-N 3.46Å; Y552-T556 PolarHBondContact O-OG1 2.92Å
553	F	81.5	Confident	63.1	Low	6 Å²	6	74.8 Å²	74.8	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-50.7	-46.2	175.4	178.9	-91.1	0	0	0	114	N551 I557 G558 L561 L596 Q599 I600 Y603	N551-F553 PolarHBondContact O-N 2.88Å; F553-I557 HydrophobicContact CD2-CB 4.39Å; F553-I557 HydrophobicContact CD2-CD1 3.98Å; F553-I557 HydrophobicContact CE2-CB 4.04Å; F553-I557 HydrophobicContact CE2-CD1 3.87Å; F553-I557 HydrophobicContact CE2-CG2 4.01Å; F553-I557 HydrophobicContact CZ-CB 4.23Å; F553-I557 HydrophobicContact CZ-CG2 4Å; F553-I557 WeakPolarHBondContact O-CB 3.16Å; F553-I557 PolarHBondContact O-N 3.44Å; F553-G558 PolarHBondContact O-N 3.19Å; F553-L561 HydrophobicContact CZ-CD1 4.39Å; F553-L596 HydrophobicContact CD2-CD1 4.08Å; F553-L596 HydrophobicContact CE2-CD1 4.16Å; F553-Q599 HydrophobicContact CD2-CB 3.61Å; F553-Q599 HydrophobicContact CD2-CG 4.45Å; F553-Q599 VanDerWaalsContact CD2-OE1 3.25Å; F553-Q599 HydrophobicContact CE2-CB 3.66Å; F553-Q599 HydrophobicContact CG-CB 4.14Å; F553-Q599 HydrophobicContact CZ-CB 4.24Å; F553-I600 HydrophobicContact CE2-CB 4.48Å; F553-I600 HydrophobicContact CE2-CG1 3.6Å; F553-I600 HydrophobicContact CZ-CB 4.45Å; F553-I600 HydrophobicContact CZ-CG1 3.92Å; F553-Y603 HydrophobicContact CD1-CD2 4.46Å; F553-Y603 AromaticContact CE1-CD2 3.71Å; F553-Y603 HydrophobicContact CE1-CD2 3.71Å; F553-Y603 HydrophobicContact CE1-CE2 4.49Å; F553-Y603 AromaticContact CE1-CG 3.76Å; F553-Y603 HydrophobicContact CE1-CG 3.76Å; F553-Y603 HydrophobicContact CZ-CG 4.33Å
554	Y	76.8	Confident	65.1	Low	99 Å²	99	68.4 Å²	68.4	39%	0.388	34%	0.341	S	S	.	.	I	π-helix	trans	-67.1	-40.9	-177.6	-82.1	-100.9	0	0	0	111.1	N551 Y552 T556 G558 I559 Y603	N551-Y554 HydrophobicContact CB-CD2 3.78Å; N551-Y554 HydrophobicContact CB-CE2 4.45Å; N551-Y554 WeakPolarHBondContact ND2-CE2 3.33Å; N551-Y554 PolarHBondContact O-N 2.95Å; Y552-Y554 VanDerWaalsContact C-N 3.33Å; Y552-Y554 PolarHBondContact O-N 2.93Å; Y554-T556 VanDerWaalsContact C-N 3.35Å; Y554-G558 WeakPolarHBondContact O-CA 3.47Å; Y554-G558 PolarHBondContact O-N 3.31Å; Y554-I559 WeakPolarHBondContact O-CG1 3.22Å; Y554-I559 PolarHBondContact O-N 2.81Å; Y554-I559 VanDerWaalsContact O-N 3.08Å; Y554-Y603 HydrophobicContact CD1-CD2 4.38Å; Y554-Y603 AromaticContact CD1-CE2 3.68Å; Y554-Y603 HydrophobicContact CD1-CE2 3.68Å; Y554-Y603 AromaticContact CE1-CD2 3.85Å; Y554-Y603 HydrophobicContact CE1-CD2 3.85Å; Y554-Y603 AromaticContact CE1-CE2 3.34Å; Y554-Y603 HydrophobicContact CE1-CE2 3.34Å; Y554-Y603 AromaticContact CZ-CD2 3.93Å; Y554-Y603 AromaticContact CZ-CE2 3.91Å
555	Q	73.9	Confident	67	Low	98 Å²	98	61.6 Å²	61.6	46%	0.458	30%	0.304	S	S	.	.	I	π-helix	trans	-70.8	-31.7	-177.7	-66.4	-174.7	-25.3	0	0	112.4	Y552	Y552-Q555 PolarHBondContact O-N 2.91Å
556	T	75.3	Confident	68.8	Low	3 Å²	3	60.6 Å²	60.6	2%	0.018	29%	0.291	C	S	.	.	I	π-helix	trans	-100.4	-28.8	-173.9	56.8	0	0	0	0	114.4	D423 Y552 Y554	D423-T556 HydrophobicContact CB-CG2 3.64Å; D423-T556 WeakPolarHBondContact OD2-CG2 3.43Å; Y552-T556 HydrophobicContact CD1-CG2 4.46Å; Y552-T556 HydrophobicContact CD2-CG2 3.77Å; Y552-T556 HydrophobicContact CE1-CG2 4.02Å; Y552-T556 HydrophobicContact CE2-CG2 3.22Å; Y552-T556 HydrophobicContact CG-CG2 4.34Å; Y552-T556 PolarHBondContact O-N 3.46Å; Y552-T556 PolarHBondContact O-OG1 2.92Å; Y554-T556 VanDerWaalsContact C-N 3.35Å
557	I	81.2	Confident	70.4	Confident	1 Å²	1	61 Å²	61	1%	0.005	29%	0.285	C	S	.	.	I	π-helix	trans	-125	-46.1	-174.5	-59.4	171	0	0	0	111	I521 V523 F553 I559 W560 L561 L596 I600	I521-I557 HydrophobicContact CD1-CG2 4.41Å; I521-I557 HydrophobicContact CG2-CG1 4.29Å; V523-I557 HydrophobicContact CG1-CD1 4.12Å; V523-I557 HydrophobicContact CG2-CD1 3.61Å; V523-I557 HydrophobicContact CG2-CG1 3.8Å; F553-I557 HydrophobicContact CD2-CB 4.39Å; F553-I557 HydrophobicContact CD2-CD1 3.98Å; F553-I557 HydrophobicContact CE2-CB 4.04Å; F553-I557 HydrophobicContact CE2-CD1 3.87Å; F553-I557 HydrophobicContact CE2-CG2 4.01Å; F553-I557 HydrophobicContact CZ-CB 4.23Å; F553-I557 HydrophobicContact CZ-CG2 4Å; F553-I557 WeakPolarHBondContact O-CB 3.16Å; F553-I557 PolarHBondContact O-N 3.44Å; I557-I559 VanDerWaalsContact C-N 3.32Å; I557-I559 PolarHBondContact O-N 2.79Å; I557-W560 PolarHBondContact O-N 3.05Å; I557-W560 VanDerWaalsContact O-N 3.1Å; I557-L561 HydrophobicContact CG2-CD1 3.77Å; I557-L561 HydrophobicContact CG2-CG 3.95Å; I557-L561 WeakPolarHBondContact O-CG 3.34Å; I557-L561 PolarHBondContact O-N 3.03Å; I557-L596 HydrophobicContact CD1-CD1 3.2Å; I557-L596 HydrophobicContact CD1-CG 4.34Å; I557-I600 HydrophobicContact CG2-CG1 4.37Å
558	G	82.9	Confident	71.5	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.01	25%	0.247	C	C	.	.	I	π-helix	trans	-55.9	-42.8	-175.7	0	0	0	0	0	113.8	F553 Y554 W560 L561 D562 Y603	F553-G558 PolarHBondContact O-N 3.19Å; Y554-G558 WeakPolarHBondContact O-CA 3.47Å; Y554-G558 PolarHBondContact O-N 3.31Å; G558-W560 VanDerWaalsContact C-N 3.34Å; G558-W560 PolarHBondContact O-N 3.04Å; G558-L561 PolarHBondContact O-N 3.48Å; G558-D562 PolarHBondContact O-N 3.26Å; G558-Y603 PolarHBondContact O-OH 2.98Å
559	I	83.7	Confident	72.5	Confident	53 Å²	53	47.6 Å²	47.6	27%	0.272	22%	0.222	S	C	.	.	H	α-helix	trans	-59.7	-42.2	177.7	-69.4	169.2	0	0	0	112	I503 I506 Y554 I557 D562 L563	I503-I559 HydrophobicContact CD1-CD1 3.84Å; I506-I559 HydrophobicContact CD1-CG2 3.22Å; I506-I559 HydrophobicContact CG1-CG2 4.48Å; Y554-I559 WeakPolarHBondContact O-CG1 3.22Å; Y554-I559 PolarHBondContact O-N 2.81Å; Y554-I559 VanDerWaalsContact O-N 3.08Å; I557-I559 VanDerWaalsContact C-N 3.32Å; I557-I559 PolarHBondContact O-N 2.79Å; I559-D562 PolarHBondContact O-N 3.13Å; I559-L563 PolarHBondContact O-N 3.45Å; I559-L563 VanDerWaalsContact O-N 3.07Å
560	W	85.2	Confident	73.6	Confident	5 Å²	5	44.9 Å²	44.9	2%	0.019	20%	0.199	C	C	.	.	H	α-helix	trans	-73.6	-37.4	179.2	-59.1	117.8	0	0	0	112.1	L421 I506 I509 I521 I557 G558 D562 L563 I564	L421-W560 HydrophobicContact CB-CB 4.47Å; L421-W560 HydrophobicContact CB-CD2 3.96Å; L421-W560 HydrophobicContact CB-CE3 4.2Å; L421-W560 HydrophobicContact CB-CG 4.07Å; L421-W560 HydrophobicContact CD1-CB 4.26Å; L421-W560 HydrophobicContact CD1-CD2 4.37Å; L421-W560 HydrophobicContact CD1-CE3 4Å; L421-W560 HydrophobicContact CD1-CG 4.5Å; L421-W560 HydrophobicContact CD2-CD2 4.47Å; L421-W560 HydrophobicContact CD2-CE3 3.87Å; L421-W560 HydrophobicContact CD2-CH2 4.48Å; L421-W560 HydrophobicContact CD2-CZ3 3.87Å; L421-W560 HydrophobicContact CG-CE3 4.25Å; I506-W560 HydrophobicContact CD1-CZ3 4.49Å; I506-W560 HydrophobicContact CG1-CE3 4.48Å; I506-W560 HydrophobicContact CG1-CH2 3.99Å; I506-W560 HydrophobicContact CG1-CZ3 3.74Å; I509-W560 HydrophobicContact CD1-CH2 3.68Å; I509-W560 HydrophobicContact CD1-CZ3 3.62Å; I521-W560 HydrophobicContact CD1-CB 3.89Å; I521-W560 HydrophobicContact CG1-CB 4.43Å; I557-W560 PolarHBondContact O-N 3.05Å; I557-W560 VanDerWaalsContact O-N 3.1Å; G558-W560 VanDerWaalsContact C-N 3.34Å; G558-W560 PolarHBondContact O-N 3.04Å; W560-D562 VanDerWaalsContact C-N 3.3Å; W560-D562 PolarHBondContact O-N 2.91Å; W560-L563 HydrophobicContact CE3-CD1 3.97Å; W560-L563 HydrophobicContact CZ3-CD1 3.98Å; W560-L563 PolarHBondContact O-N 2.79Å; W560-I564 VanDerWaalsContact O-CG1 3.28Å; W560-I564 WeakPolarHBondContact O-CG1 3.42Å; W560-I564 PolarHBondContact O-N 3.19Å
561	L	84.3	Confident	74.2	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-58.9	-43.6	172.1	-68.3	179.7	0	0	0	111.2	I521 F553 I557 G558 I564 L565 L571 I573 I600 Y603	I521-L561 HydrophobicContact CD1-CD2 4.12Å; I521-L561 HydrophobicContact CD1-CG 4.48Å; F553-L561 HydrophobicContact CZ-CD1 4.39Å; I557-L561 HydrophobicContact CG2-CD1 3.77Å; I557-L561 HydrophobicContact CG2-CG 3.95Å; I557-L561 WeakPolarHBondContact O-CG 3.34Å; I557-L561 PolarHBondContact O-N 3.03Å; G558-L561 PolarHBondContact O-N 3.48Å; L561-I564 PolarHBondContact O-N 3.15Å; L561-L565 WeakPolarHBondContact O-CB 3.25Å; L561-L565 VanDerWaalsContact O-CG 3.27Å; L561-L565 WeakPolarHBondContact O-CG 3.07Å; L561-L565 PolarHBondContact O-N 3.3Å; L561-L571 HydrophobicContact CD2-CD1 4.03Å; L561-L571 HydrophobicContact CD2-CD2 4.12Å; L561-I573 HydrophobicContact CD2-CD1 3.25Å; L561-I600 HydrophobicContact CD1-CG2 4.45Å; L561-Y603 HydrophobicContact CB-CD1 4.25Å; L561-Y603 HydrophobicContact CB-CE1 3.83Å; L561-Y603 HydrophobicContact CD1-CD1 3.53Å; L561-Y603 HydrophobicContact CD1-CE1 3.96Å; L561-Y603 HydrophobicContact CD1-CG 4.33Å
562	D	81.6	Confident	74.3	Confident	33 Å²	33	33.9 Å²	33.9	18%	0.176	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-47	176.6	-80.9	-0.2	0	0	0	111.8	G558 I559 W560 I564 L565 Y566 Y603 K607	G558-D562 PolarHBondContact O-N 3.26Å; I559-D562 PolarHBondContact O-N 3.13Å; W560-D562 VanDerWaalsContact C-N 3.3Å; W560-D562 PolarHBondContact O-N 2.91Å; D562-I564 VanDerWaalsContact C-N 3.27Å; D562-I564 PolarHBondContact O-N 3.37Å; D562-L565 PolarHBondContact O-N 2.88Å; D562-Y566 HydrophobicContact CB-CD2 4.18Å; D562-Y566 HydrophobicContact CB-CE2 3.91Å; D562-Y566 WeakPolarHBondContact O-CD2 3.16Å; D562-Y566 PolarHBondContact O-N 3.24Å; D562-Y603 PolarHBondContact OD1-OH 3.42Å; D562-Y603 PolarHBondContact OD2-OH 2.92Å; D562-Y603 VanDerWaalsContact OD2-OH 3.07Å; D562-K607 WeakPolarHBondContact OD1-CE 3.32Å; D562-K607 IonicContact OD1-NZ 3.49Å; D562-K607 PolarHBondContact OD1-NZ 2.87Å; D562-K607 IonicContact OD2-NZ 3.13Å; D562-K607 PolarHBondContact OD2-NZ 2.72Å
563	L	80.5	Confident	74.6	Confident	14 Å²	14	32 Å²	32	7%	0.073	14%	0.14	C	C	.	.	H	α-helix	trans	-53.5	-46.9	176.4	-173.8	163.1	0	0	0	111.3	I506 I509 T513 I559 W560 R567	I506-L563 HydrophobicContact CB-CD1 4.19Å; I506-L563 HydrophobicContact CG1-CD1 4.13Å; I506-L563 HydrophobicContact CG2-CD1 3.68Å; I506-L563 HydrophobicContact CG2-CG 4.44Å; I509-L563 HydrophobicContact CG2-CD1 4.26Å; T513-L563 HydrophobicContact CG2-CD2 3.91Å; I559-L563 PolarHBondContact O-N 3.45Å; I559-L563 VanDerWaalsContact O-N 3.07Å; W560-L563 HydrophobicContact CE3-CD1 3.97Å; W560-L563 HydrophobicContact CZ3-CD1 3.98Å; W560-L563 PolarHBondContact O-N 2.79Å; L563-R567 WeakPolarHBondContact O-CB 3.33Å; L563-R567 WeakPolarHBondContact O-CG 3.36Å; L563-R567 PolarHBondContact O-N 2.99Å
564	I	77	Confident	74.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-68.4	-46	-178.7	-63.5	164.7	0	0	0	110.7	L421 F519 W560 L561 D562 Y566 R567 L568 L571 I573	L421-I564 HydrophobicContact CD1-CD1 4.06Å; L421-I564 HydrophobicContact CD1-CG1 4.47Å; F519-I564 HydrophobicContact CB-CD1 3.67Å; F519-I564 HydrophobicContact CD1-CD1 4.01Å; F519-I564 HydrophobicContact CD1-CG1 4.19Å; F519-I564 HydrophobicContact CD2-CD1 3.89Å; F519-I564 HydrophobicContact CD2-CG1 3.98Å; F519-I564 HydrophobicContact CD2-CG2 4.16Å; F519-I564 HydrophobicContact CE1-CG1 4.37Å; F519-I564 HydrophobicContact CE2-CG1 4.2Å; F519-I564 HydrophobicContact CE2-CG2 4.31Å; F519-I564 HydrophobicContact CG-CD1 3.55Å; F519-I564 HydrophobicContact CG-CG1 3.98Å; F519-I564 HydrophobicContact CZ-CG1 4.38Å; W560-I564 VanDerWaalsContact O-CG1 3.28Å; W560-I564 WeakPolarHBondContact O-CG1 3.42Å; W560-I564 PolarHBondContact O-N 3.19Å; L561-I564 PolarHBondContact O-N 3.15Å; D562-I564 VanDerWaalsContact C-N 3.27Å; D562-I564 PolarHBondContact O-N 3.37Å; I564-Y566 VanDerWaalsContact C-N 3.34Å; I564-Y566 PolarHBondContact O-N 2.66Å; I564-R567 PolarHBondContact O-N 2.99Å; I564-L568 HydrophobicContact CG2-CD1 4.26Å; I564-L568 WeakPolarHBondContact O-CA 3.26Å; I564-L568 WeakPolarHBondContact O-CB 3.21Å; I564-L568 PolarHBondContact O-N 3.07Å; I564-L571 HydrophobicContact CB-CD1 4.19Å; I564-L571 HydrophobicContact CG2-CD1 3.85Å; I564-I573 HydrophobicContact CD1-CD1 3.47Å; I564-I573 VanDerWaalsContact CD1-CD1 3.47Å; I564-I573 HydrophobicContact CD1-CG1 3.87Å
565	L	75.9	Confident	74.9	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-35	179.6	-73.5	172.3	0	0	0	113.5	L561 D562 L568 L571 K607 F611 L642	L561-L565 WeakPolarHBondContact O-CB 3.25Å; L561-L565 VanDerWaalsContact O-CG 3.27Å; L561-L565 WeakPolarHBondContact O-CG 3.07Å; L561-L565 PolarHBondContact O-N 3.3Å; D562-L565 PolarHBondContact O-N 2.88Å; L565-L568 VanDerWaalsContact O-O 3.06Å; L565-L571 HydrophobicContact CD2-CB 4.13Å; L565-L571 HydrophobicContact CD2-CD1 3.89Å; L565-L571 HydrophobicContact CG-CD1 3.92Å; L565-K607 HydrophobicContact CD1-CB 4.23Å; L565-K607 HydrophobicContact CD1-CG 4.42Å; L565-F611 HydrophobicContact CB-CZ 4.36Å; L565-F611 HydrophobicContact CD1-CE2 4.38Å; L565-L642 HydrophobicContact CD2-CD1 3.96Å; L565-L642 HydrophobicContact CD2-CD2 4.35Å; L565-L642 HydrophobicContact CD2-CG 4.21Å
566	Y	70.9	Confident	75.3	Confident	113 Å²	113	22.9 Å²	22.9	44%	0.443	10%	0.102	S	C	.	.	H	α-helix	trans	-77.3	-26.3	178.7	-71.7	-55.6	0	0	0	113.2	D562 I564 F611	D562-Y566 HydrophobicContact CB-CD2 4.18Å; D562-Y566 HydrophobicContact CB-CE2 3.91Å; D562-Y566 WeakPolarHBondContact O-CD2 3.16Å; D562-Y566 PolarHBondContact O-N 3.24Å; I564-Y566 VanDerWaalsContact C-N 3.34Å; I564-Y566 PolarHBondContact O-N 2.66Å; Y566-F611 HydrophobicContact CE1-CE1 4.16Å; Y566-F611 HydrophobicContact CE1-CZ 4.49Å
567	R	67	Low	75.5	Confident	132 Å²	132	22.8 Å²	22.8	50%	0.498	10%	0.101	S	C	.	.	H	α-helix	trans	-92.3	-36.3	-179.9	-76	-63.5	-165.7	155.1	5.5	112.8	S510 L563 I564	S510-R567 PolarHBondContact O-NE 2.98Å; S510-R567 PolarHBondContact O-NH2 3.13Å; S510-R567 VanDerWaalsContact O-NH2 3.1Å; S510-R567 PolarHBondContact OG-NH2 3.46Å; L563-R567 WeakPolarHBondContact O-CB 3.33Å; L563-R567 WeakPolarHBondContact O-CG 3.36Å; L563-R567 PolarHBondContact O-N 2.99Å; I564-R567 PolarHBondContact O-N 2.99Å
568	L	62.6	Low	75.5	Confident	6 Å²	6	22.8 Å²	22.8	3%	0.031	10%	0.101	C	C	.	.			trans	-117.1	135.2	-174.9	-56	-169.9	0	0	0	110.1	L515 F519 I564 L565 Y570	L515-L568 HydrophobicContact CD2-CD2 3.85Å; L515-L568 HydrophobicContact CG-CD2 4.22Å; F519-L568 HydrophobicContact CD2-CD1 4.45Å; F519-L568 HydrophobicContact CE2-CD1 3.63Å; F519-L568 HydrophobicContact CZ-CD1 4.49Å; I564-L568 HydrophobicContact CG2-CD1 4.26Å; I564-L568 WeakPolarHBondContact O-CA 3.26Å; I564-L568 WeakPolarHBondContact O-CB 3.21Å; I564-L568 PolarHBondContact O-N 3.07Å; L565-L568 VanDerWaalsContact O-O 3.06Å; L568-Y570 HydrophobicContact CD1-CE2 4.45Å; L568-Y570 PolarHBondContact O-N 2.98Å
569	N	56.8	Low	75.1	Confident	47 Å²	47	24.8 Å²	24.8	25%	0.251	11%	0.109	S	C	.	.	S	Bend	trans	-67.9	0.6	175.9	-80.8	8.3	0	0	0	113.4	T641 L642	N569-T641 VanDerWaalsContact CB-OG1 3.22Å; N569-T641 WeakPolarHBondContact CB-OG1 3.26Å; N569-T641 CarbonylContact O-C 3.23Å; N569-T641 WeakPolarHBondContact O-CB 3.2Å; N569-T641 PolarHBondContact O-OG1 3.43Å; N569-L642 PolarHBondContact O-N 3.47Å
570	Y	59.4	Low	74.6	Confident	32 Å²	32	22.4 Å²	22.4	13%	0.125	10%	0.097	C	C	.	.	S	Bend	trans	-149.1	158.7	178.5	55.5	-95.8	0	0	0	111.5	L515 L568 K572	L515-Y570 VanDerWaalsContact C-OH 3.32Å; L515-Y570 HydrophobicContact CD2-CE1 3.97Å; L515-Y570 PolarHBondContact O-OH 3.4Å; L568-Y570 HydrophobicContact CD1-CE2 4.45Å; L568-Y570 PolarHBondContact O-N 2.98Å; Y570-K572 HydrophobicContact CD2-CB 4.35Å; Y570-K572 HydrophobicContact CD2-CD 3.81Å; Y570-K572 HydrophobicContact CD2-CG 3.81Å; Y570-K572 HydrophobicContact CE2-CD 3.82Å; Y570-K572 HydrophobicContact CE2-CG 4.2Å
571	L	64.6	Low	73.8	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	113.4	-179.4	-166.6	83.5	0	0	0	110.6	L561 I564 L565 I573 I604 Y643 T644 F645	L561-L571 HydrophobicContact CD2-CD1 4.03Å; L561-L571 HydrophobicContact CD2-CD2 4.12Å; I564-L571 HydrophobicContact CB-CD1 4.19Å; I564-L571 HydrophobicContact CG2-CD1 3.85Å; L565-L571 HydrophobicContact CD2-CB 4.13Å; L565-L571 HydrophobicContact CD2-CD1 3.89Å; L565-L571 HydrophobicContact CG-CD1 3.92Å; L571-I573 HydrophobicContact CD1-CD1 3.43Å; L571-I573 VanDerWaalsContact CD1-CD1 3.43Å; L571-I573 HydrophobicContact CD1-CG1 4.24Å; L571-I573 HydrophobicContact CD2-CD1 4.21Å; L571-I573 HydrophobicContact CG-CD1 3.69Å; L571-I573 HydrophobicContact CG-CG1 4.15Å; L571-I604 HydrophobicContact CD2-CD1 3.41Å; L571-I604 VanDerWaalsContact CD2-CD1 3.41Å; L571-I604 HydrophobicContact CD2-CG1 3.85Å; L571-Y643 PolarHBondContact N-O 3.17Å; L571-T644 HydrophobicContact CB-CG2 4.05Å; L571-T644 HydrophobicContact CD2-CG2 4.03Å; L571-F645 PolarHBondContact O-N 3.07Å
572	K	68	Low	73.3	Confident	15 Å²	15	30.2 Å²	30.2	7%	0.065	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	99.9	179.2	-75.8	-174.6	176.5	-174.3	0	110.6	Y570 F645 L680 K683 T684	Y570-K572 HydrophobicContact CD2-CB 4.35Å; Y570-K572 HydrophobicContact CD2-CD 3.81Å; Y570-K572 HydrophobicContact CD2-CG 3.81Å; Y570-K572 HydrophobicContact CE2-CD 3.82Å; Y570-K572 HydrophobicContact CE2-CG 4.2Å; K572-F645 HydrophobicContact CG-CB 4.26Å; K572-L680 HydrophobicContact CB-CD2 4.2Å; K572-K683 PolarHBondContact NZ-O 2.97Å; K572-T684 HydrophobicContact CD-CG2 4.25Å; K572-T684 WeakPolarHBondContact CD-OG1 3.41Å; K572-T684 VanDerWaalsContact NZ-CA 3.26Å; K572-T684 VanDerWaalsContact NZ-CB 3.33Å; K572-T684 PolarHBondContact NZ-OG1 3.46Å
573	I	77.9	Confident	72.9	Confident	7 Å²	7	29.4 Å²	29.4	4%	0.036	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	136	-168.4	-58.4	174.2	0	0	0	109.7	F519 I521 L561 I564 L571 V575	F519-I573 HydrophobicContact CB-CG1 4.23Å; F519-I573 WeakPolarHBondContact O-CA 3.35Å; I521-I573 HydrophobicContact CB-CG2 4.24Å; I521-I573 HydrophobicContact CD1-CD1 4.03Å; I521-I573 HydrophobicContact CD1-CG2 3.82Å; I521-I573 HydrophobicContact CG1-CG2 3.73Å; L561-I573 HydrophobicContact CD2-CD1 3.25Å; I564-I573 HydrophobicContact CD1-CD1 3.47Å; I564-I573 VanDerWaalsContact CD1-CD1 3.47Å; I564-I573 HydrophobicContact CD1-CG1 3.87Å; L571-I573 HydrophobicContact CD1-CD1 3.43Å; L571-I573 VanDerWaalsContact CD1-CD1 3.43Å; L571-I573 HydrophobicContact CD1-CG1 4.24Å; L571-I573 HydrophobicContact CD2-CD1 4.21Å; L571-I573 HydrophobicContact CG-CD1 3.69Å; L571-I573 HydrophobicContact CG-CG1 4.15Å; I573-V575 HydrophobicContact CG2-CG2 4.04Å
574	I	80.7	Confident	72.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.6	164.4	-58.2	174.2	0	0	0	106.9	I518 F519 I520 I521 I576 I677 L680	I518-I574 HydrophobicContact CG2-CD1 4.23Å; F519-I574 PolarHBondContact O-N 3.19Å; I520-I574 CarbonylContact C-O 3.57Å; I520-I574 VanDerWaalsContact CA-O 3.25Å; I520-I574 WeakPolarHBondContact CA-O 3.29Å; I520-I574 HydrophobicContact CG1-CB 4.22Å; I521-I574 PolarHBondContact N-O 3.16Å; I574-I576 HydrophobicContact CG2-CG1 4.17Å; I574-I677 HydrophobicContact CD1-CG1 3.88Å; I574-L680 HydrophobicContact CG1-CD1 4.26Å
575	V	82.7	Confident	72.7	Confident	11 Å²	11	40.5 Å²	40.5	7%	0.067	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.7	175.4	-178	0	0	0	0	108.3	I521 V523 I573 L596 I600	I521-V575 WeakPolarHBondContact O-CA 3.43Å; V523-V575 HydrophobicContact CG2-CG1 3.96Å; I573-V575 HydrophobicContact CG2-CG2 4.04Å; V575-L596 HydrophobicContact CG1-CD2 4.29Å; V575-I600 HydrophobicContact CG1-CD1 4.39Å; V575-I600 HydrophobicContact CG2-CD1 3.94Å
576	I	82.4	Confident	72.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.7	178.2	-62.4	176.3	0	0	0	108.1	L431 I520 I521 V522 V523 I574 T578 I653 L673	L431-I576 HydrophobicContact CD2-CD1 3.7Å; L431-I576 HydrophobicContact CD2-CG2 4.41Å; I520-I576 HydrophobicContact CD1-CD1 4.48Å; I520-I576 HydrophobicContact CG2-CB 4.43Å; I520-I576 HydrophobicContact CG2-CD1 3.3Å; I520-I576 HydrophobicContact CG2-CG1 3.76Å; I521-I576 PolarHBondContact O-N 2.84Å; V522-I576 CarbonylContact C-O 3.54Å; V522-I576 WeakPolarHBondContact CA-O 3.35Å; V523-I576 PolarHBondContact N-O 3.39Å; I574-I576 HydrophobicContact CG2-CG1 4.17Å; I576-T578 HydrophobicContact CG2-CG2 4.41Å; I576-I653 HydrophobicContact CG2-CD1 3.7Å; I576-I653 HydrophobicContact CG2-CG1 4.26Å; I576-L673 HydrophobicContact CD1-CD1 3.3Å; I576-L673 HydrophobicContact CG1-CD1 4.25Å
577	V	81.1	Confident	73.1	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.4	177.9	171.7	0	0	0	0	110	V523 I525 L596 I650 N651 I653	V523-V577 HydrophobicContact CB-CG2 4.49Å; V523-V577 WeakPolarHBondContact O-CA 3.34Å; I525-V577 HydrophobicContact CB-CG1 3.41Å; I525-V577 VanDerWaalsContact CB-CG1 3.41Å; I525-V577 HydrophobicContact CD1-CG1 4.07Å; I525-V577 HydrophobicContact CG1-CG1 3.93Å; I525-V577 HydrophobicContact CG2-CG1 3.8Å; V577-L596 HydrophobicContact CG2-CD2 3.84Å; V577-I650 HydrophobicContact CB-CG2 3.91Å; V577-I650 HydrophobicContact CG2-CG2 3.34Å; V577-N651 PolarHBondContact N-O 2.82Å; V577-I653 PolarHBondContact O-N 2.82Å
578	T	79.9	Confident	73.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	165.7	-178.4	59.7	0	0	0	0	111	C426 M442 V522 V523 I525 I576 C580	C426-T578 PolarHBondContact O-OG1 3.31Å; M442-T578 HydrophobicContact CE-CG2 3.47Å; M442-T578 VanDerWaalsContact CE-CG2 3.47Å; V522-T578 HydrophobicContact CG1-CG2 3.44Å; V522-T578 VanDerWaalsContact CG1-CG2 3.44Å; V523-T578 PolarHBondContact O-N 3.01Å; V523-T578 PolarHBondContact O-OG1 2.95Å; I525-T578 WeakPolarHBondContact CG2-O 3.41Å; I525-T578 PolarHBondContact N-O 2.97Å; I576-T578 HydrophobicContact CG2-CG2 4.41Å; T578-C580 VanDerWaalsContact C-N 3.3Å; T578-C580 PolarHBondContact O-N 2.77Å
579	K	75.1	Confident	74.5	Confident	43 Å²	43	45 Å²	45	19%	0.187	22%	0.222	C	C	.	.			trans	59.6	34.5	-179.8	-53.9	-173	-171.2	169.6	0	114.3	N425 E447 D524 T526 D581 L582	N425-K579 PolarHBondContact O-NZ 2.99Å; E447-K579 WeakPolarHBondContact OE1-CE 3.39Å; E447-K579 IonicContact OE1-NZ 3.24Å; E447-K579 PolarHBondContact OE1-NZ 2.9Å; D524-K579 WeakPolarHBondContact OD2-CD 3.36Å; D524-K579 IonicContact OD2-NZ 3.38Å; D524-K579 PolarHBondContact OD2-NZ 2.67Å; D524-K579 VanDerWaalsContact OD2-NZ 3.1Å; T526-K579 HydrophobicContact CG2-CB 3.88Å; T526-K579 WeakPolarHBondContact CG2-O 3.41Å; K579-D581 VanDerWaalsContact C-OD1 3.29Å; K579-D581 WeakPolarHBondContact CA-OD1 3.21Å; K579-D581 PolarHBondContact O-N 3.29Å; K579-L582 HydrophobicContact CB-CD1 4.06Å; K579-L582 HydrophobicContact CB-CG 4.4Å; K579-L582 HydrophobicContact CD-CD1 4.1Å; K579-L582 HydrophobicContact CG-CD1 4.44Å; K579-L582 PolarHBondContact O-N 3.22Å
580	C	73.8	Confident	75.6	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.02	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-65.5	-28.9	179.5	-64.9	0	0	0	0	112.7	T578 L582 I583 L589	T578-C580 VanDerWaalsContact C-N 3.3Å; T578-C580 PolarHBondContact O-N 2.77Å; C580-L582 VanDerWaalsContact C-N 3.3Å; C580-I583 PolarHBondContact O-N 2.97Å; C580-L589 HydrophobicContact CB-CD1 4.04Å; C580-L589 HydrophobicContact CB-CD2 4.02Å
581	D	68.6	Low	76.7	Confident	58 Å²	58	49.3 Å²	49.3	31%	0.31	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-67.4	-25.8	179.6	56	-53.4	0	0	0	113.6	K579 I583 L655	K579-D581 VanDerWaalsContact C-OD1 3.29Å; K579-D581 WeakPolarHBondContact CA-OD1 3.21Å; K579-D581 PolarHBondContact O-N 3.29Å; D581-I583 PolarHBondContact O-N 3.35Å; D581-L655 HydrophobicContact CB-CB 4.13Å; D581-L655 HydrophobicContact CB-CD1 4.28Å; D581-L655 WeakPolarHBondContact OD2-CD1 3.09Å
582	L	73.1	Confident	77.5	Confident	114 Å²	114	50.5 Å²	50.5	60%	0.597	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-74	-10.7	174.9	-62.6	-176.4	0	0	0	113.1	T526 K579 C580	T526-L582 HydrophobicContact CG2-CB 3.66Å; T526-L582 HydrophobicContact CG2-CD1 4.01Å; T526-L582 HydrophobicContact CG2-CG 4.4Å; K579-L582 HydrophobicContact CB-CD1 4.06Å; K579-L582 HydrophobicContact CB-CG 4.4Å; K579-L582 HydrophobicContact CD-CD1 4.1Å; K579-L582 HydrophobicContact CG-CD1 4.44Å; K579-L582 PolarHBondContact O-N 3.22Å; C580-L582 VanDerWaalsContact C-N 3.3Å
583	I	73.3	Confident	78.1	Confident	16 Å²	16	50.1 Å²	50.1	8%	0.082	25%	0.246	C	C	.	.			trans	-97	108.8	175.2	-59.4	-178.5	0	0	0	109	I525 T526 C580 D581 S585 E588 L589	I525-I583 HydrophobicContact CB-CD1 4.25Å; I525-I583 HydrophobicContact CG1-CD1 3.97Å; I525-I583 HydrophobicContact CG2-CD1 3.54Å; I525-I583 HydrophobicContact CG2-CG1 4.37Å; T526-I583 HydrophobicContact CG2-CG1 4.45Å; C580-I583 PolarHBondContact O-N 2.97Å; D581-I583 PolarHBondContact O-N 3.35Å; I583-S585 PolarHBondContact O-N 2.88Å; I583-E588 HydrophobicContact CG2-CB 4.09Å; I583-E588 HydrophobicContact CG2-CG 4.1Å; I583-L589 HydrophobicContact CB-CB 4.45Å; I583-L589 HydrophobicContact CD1-CD1 3.88Å; I583-L589 HydrophobicContact CG2-CB 4.04Å
584	Q	74.6	Confident	78.3	Confident	201 Å²	201	54.1 Å²	54.1	94%	0.939	27%	0.268	S	S	*	.			trans	-65.3	-36.1	-174.3	-66.1	-177.9	-9.3	0	0	113.4
585	S	78.6	Confident	78.3	Confident	47 Å²	47	55.5 Å²	55.5	33%	0.329	27%	0.274	S	S	.	.			trans	-92.1	120.3	-178.5	172.2	0	0	0	0	111.7	I583 I587 E588 L589	I583-S585 PolarHBondContact O-N 2.88Å; S585-I587 PolarHBondContact O-N 3.3Å; S585-I587 PolarHBondContact OG-N 3.47Å; S585-E588 PolarHBondContact O-N 3.12Å; S585-E588 PolarHBondContact OG-N 3.32Å; S585-E588 VanDerWaalsContact OG-N 3.14Å; S585-L589 PolarHBondContact O-N 3.3Å
586	K	76.3	Confident	78.4	Confident	158 Å²	158	55 Å²	55	69%	0.687	27%	0.271	S	S	*	.	H	α-helix	trans	-62.5	-30.3	173.1	-170.3	174.1	-177.3	177	0	112.2	N590	K586-N590 WeakPolarHBondContact O-CB 3.19Å; K586-N590 PolarHBondContact O-N 2.9Å; K586-N590 VanDerWaalsContact O-N 3.12Å; K586-N590 PolarHBondContact O-ND2 3.34Å
587	I	77.7	Confident	78.3	Confident	116 Å²	116	58.7 Å²	58.7	60%	0.595	29%	0.286	S	S	*	.	H	α-helix	trans	-67.9	-48.7	176	-61.4	171.9	0	0	0	109	S585 L589 N590 E591	S585-I587 PolarHBondContact O-N 3.3Å; S585-I587 PolarHBondContact OG-N 3.47Å; I587-L589 PolarHBondContact O-N 3.47Å; I587-N590 WeakPolarHBondContact O-CB 2.96Å; I587-N590 PolarHBondContact O-N 2.88Å; I587-N590 VanDerWaalsContact O-N 3.16Å; I587-E591 WeakPolarHBondContact O-CG 3.3Å; I587-E591 PolarHBondContact O-N 3.36Å
588	E	80.3	Confident	78.4	Confident	59 Å²	59	65.3 Å²	65.3	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-44.2	177.9	-174.1	-174.2	172.5	0	0	111.7	I583 S585 N590 E591 R592	I583-E588 HydrophobicContact CG2-CB 4.09Å; I583-E588 HydrophobicContact CG2-CG 4.1Å; S585-E588 PolarHBondContact O-N 3.12Å; S585-E588 PolarHBondContact OG-N 3.32Å; S585-E588 VanDerWaalsContact OG-N 3.14Å; E588-N590 VanDerWaalsContact C-N 3.33Å; E588-N590 PolarHBondContact O-N 2.94Å; E588-E591 PolarHBondContact O-N 3.46Å; E588-R592 WeakPolarHBondContact O-CG 3.27Å; E588-R592 PolarHBondContact O-N 3.39Å; E588-R592 IonicContact OE1-CZ 2.66Å; E588-R592 IonicContact OE1-NE 2.97Å; E588-R592 PolarHBondContact OE1-NE 3.34Å; E588-R592 IonicContact OE1-NH2 2.77Å; E588-R592 PolarHBondContact OE1-NH2 3.35Å
589	L	79.1	Confident	78.5	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.073	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-45.9	175.3	177.8	66.2	0	0	0	111.5	I525 C580 I583 S585 I587 E591 R592 I593	I525-L589 HydrophobicContact CG1-CD1 4.25Å; I525-L589 HydrophobicContact CG2-CD1 4.14Å; C580-L589 HydrophobicContact CB-CD1 4.04Å; C580-L589 HydrophobicContact CB-CD2 4.02Å; I583-L589 HydrophobicContact CB-CB 4.45Å; I583-L589 HydrophobicContact CD1-CD1 3.88Å; I583-L589 HydrophobicContact CG2-CB 4.04Å; S585-L589 PolarHBondContact O-N 3.3Å; I587-L589 PolarHBondContact O-N 3.47Å; L589-E591 VanDerWaalsContact C-N 3.34Å; L589-R592 PolarHBondContact O-N 3.09Å; L589-I593 HydrophobicContact CD1-CD1 4.04Å; L589-I593 HydrophobicContact CD1-CG1 4.44Å; L589-I593 HydrophobicContact CG-CD1 3.97Å; L589-I593 WeakPolarHBondContact O-CB 3.42Å; L589-I593 VanDerWaalsContact O-CG1 3.25Å; L589-I593 WeakPolarHBondContact O-CG1 3.36Å; L589-I593 PolarHBondContact O-N 3.05Å
590	N	80.5	Confident	78.9	Confident	51 Å²	51	65.6 Å²	65.6	27%	0.273	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-41.7	177	-74.1	-22.8	0	0	0	111.9	K586 I587 E588 I593 N594 R652	K586-N590 WeakPolarHBondContact O-CB 3.19Å; K586-N590 PolarHBondContact O-N 2.9Å; K586-N590 VanDerWaalsContact O-N 3.12Å; K586-N590 PolarHBondContact O-ND2 3.34Å; I587-N590 WeakPolarHBondContact O-CB 2.96Å; I587-N590 PolarHBondContact O-N 2.88Å; I587-N590 VanDerWaalsContact O-N 3.16Å; E588-N590 VanDerWaalsContact C-N 3.33Å; E588-N590 PolarHBondContact O-N 2.94Å; N590-I593 PolarHBondContact O-N 3.45Å; N590-N594 WeakPolarHBondContact O-CB 3Å; N590-N594 PolarHBondContact O-N 3.38Å; N590-N594 PolarHBondContact O-ND2 3.09Å; N590-R652 PolarHBondContact OD1-NH1 3.12Å; N590-R652 PolarHBondContact OD1-NH2 3.44Å
591	E	81.8	Confident	79.2	Confident	119 Å²	119	67.7 Å²	67.7	56%	0.556	33%	0.327	S	S	*	.	H	α-helix	trans	-62.3	-46.7	177.4	-74.8	177.2	170.4	0	0	111.5	I587 E588 L589 I593 N594 Q595	I587-E591 WeakPolarHBondContact O-CG 3.3Å; I587-E591 PolarHBondContact O-N 3.36Å; E588-E591 PolarHBondContact O-N 3.46Å; L589-E591 VanDerWaalsContact C-N 3.34Å; E591-I593 PolarHBondContact O-N 3.22Å; E591-N594 PolarHBondContact O-N 2.83Å; E591-Q595 VanDerWaalsContact O-CB 3.3Å; E591-Q595 WeakPolarHBondContact O-CB 3.34Å; E591-Q595 PolarHBondContact O-N 3.07Å
592	R	82.2	Confident	79.8	Confident	27 Å²	27	69.1 Å²	69.1	10%	0.102	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-40.6	177	-67.4	-171.8	-168.1	-155.4	0.2	112.4	I525 T526 L528 E588 L589 Q595 L596	I525-R592 HydrophobicContact CD1-CB 3.81Å; I525-R592 HydrophobicContact CG1-CB 3.92Å; I525-R592 PolarHBondContact O-NH1 2.81Å; T526-R592 PolarHBondContact O-NH1 2.94Å; L528-R592 HydrophobicContact CD2-CB 4.2Å; L528-R592 WeakPolarHBondContact O-CD 3.38Å; L528-R592 PolarHBondContact O-NH1 3.46Å; L528-R592 VanDerWaalsContact O-NH1 3.13Å; E588-R592 WeakPolarHBondContact O-CG 3.27Å; E588-R592 PolarHBondContact O-N 3.39Å; E588-R592 IonicContact OE1-CZ 2.66Å; E588-R592 IonicContact OE1-NE 2.97Å; E588-R592 PolarHBondContact OE1-NE 3.34Å; E588-R592 IonicContact OE1-NH2 2.77Å; E588-R592 PolarHBondContact OE1-NH2 3.35Å; L589-R592 PolarHBondContact O-N 3.09Å; R592-Q595 PolarHBondContact O-N 2.83Å; R592-L596 WeakPolarHBondContact O-CB 3.47Å; R592-L596 PolarHBondContact O-N 3.13Å
593	I	80.6	Confident	80.3	Confident	7 Å²	7	64.1 Å²	64.1	4%	0.036	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-44.9	175.6	-71.7	171.7	0	0	0	110.8	I525 L589 N590 E591 Q595 L596 Y597 I650 R652	I525-I593 HydrophobicContact CD1-CG1 4.34Å; L589-I593 HydrophobicContact CD1-CD1 4.04Å; L589-I593 HydrophobicContact CD1-CG1 4.44Å; L589-I593 HydrophobicContact CG-CD1 3.97Å; L589-I593 WeakPolarHBondContact O-CB 3.42Å; L589-I593 VanDerWaalsContact O-CG1 3.25Å; L589-I593 WeakPolarHBondContact O-CG1 3.36Å; L589-I593 PolarHBondContact O-N 3.05Å; N590-I593 PolarHBondContact O-N 3.45Å; E591-I593 PolarHBondContact O-N 3.22Å; I593-Q595 VanDerWaalsContact C-N 3.34Å; I593-L596 PolarHBondContact O-N 2.99Å; I593-Y597 PolarHBondContact O-N 2.92Å; I593-I650 HydrophobicContact CG2-CB 3.98Å; I593-I650 HydrophobicContact CG2-CD1 3.62Å; I593-I650 HydrophobicContact CG2-CG1 4.34Å; I593-I650 HydrophobicContact CG2-CG2 4.11Å; I593-R652 HydrophobicContact CD1-CG 3.84Å; I593-R652 VanDerWaalsContact CD1-NE 3.35Å
594	N	81.3	Confident	80.5	Confident	92 Å²	92	64 Å²	64	49%	0.492	31%	0.307	S	S	.	.	H	α-helix	trans	-66.1	-38.3	177.5	-74.1	-24	0	0	0	111.9	N590 E591 Y597 K598	N590-N594 WeakPolarHBondContact O-CB 3Å; N590-N594 PolarHBondContact O-N 3.38Å; N590-N594 PolarHBondContact O-ND2 3.09Å; E591-N594 PolarHBondContact O-N 2.83Å; N594-Y597 PolarHBondContact O-N 2.68Å; N594-K598 WeakPolarHBondContact O-CB 3.28Å; N594-K598 WeakPolarHBondContact O-CG 3.26Å; N594-K598 PolarHBondContact O-N 3.39Å
595	Q	82.3	Confident	80.7	Confident	29 Å²	29	60.8 Å²	60.8	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-47.6	173.6	-179.5	-175.2	-18.3	0	0	110.5	L528 E529 E591 R592 I593 Y597 K598 Q599	L528-Q595 HydrophobicContact CD2-CB 4.38Å; L528-Q595 HydrophobicContact CD2-CG 4.17Å; E529-Q595 PolarHBondContact O-NE2 3.39Å; E529-Q595 VanDerWaalsContact O-NE2 3.07Å; E591-Q595 VanDerWaalsContact O-CB 3.3Å; E591-Q595 WeakPolarHBondContact O-CB 3.34Å; E591-Q595 PolarHBondContact O-N 3.07Å; R592-Q595 PolarHBondContact O-N 2.83Å; I593-Q595 VanDerWaalsContact C-N 3.34Å; Q595-Y597 PolarHBondContact O-N 3.05Å; Q595-K598 PolarHBondContact O-N 3.38Å; Q595-Q599 WeakPolarHBondContact O-CG 3.34Å; Q595-Q599 PolarHBondContact O-N 3.17Å
596	L	83.1	Confident	80.9	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-48.6	177	179.4	64.7	0	0	0	111.4	V523 L528 F553 I557 V575 V577 R592 I593 K598 Q599 I600 I650	V523-L596 HydrophobicContact CB-CD2 4.48Å; V523-L596 HydrophobicContact CG1-CD2 4.21Å; L528-L596 HydrophobicContact CD1-CB 4.02Å; L528-L596 HydrophobicContact CD1-CD1 3.58Å; L528-L596 HydrophobicContact CD1-CG 4.28Å; F553-L596 HydrophobicContact CD2-CD1 4.08Å; F553-L596 HydrophobicContact CE2-CD1 4.16Å; I557-L596 HydrophobicContact CD1-CD1 3.2Å; I557-L596 HydrophobicContact CD1-CG 4.34Å; V575-L596 HydrophobicContact CG1-CD2 4.29Å; V577-L596 HydrophobicContact CG2-CD2 3.84Å; R592-L596 WeakPolarHBondContact O-CB 3.47Å; R592-L596 PolarHBondContact O-N 3.13Å; I593-L596 PolarHBondContact O-N 2.99Å; L596-K598 VanDerWaalsContact C-N 3.34Å; L596-K598 PolarHBondContact O-N 3.29Å; L596-Q599 PolarHBondContact O-N 2.85Å; L596-Q599 VanDerWaalsContact O-N 3.15Å; L596-I600 HydrophobicContact CD1-CD1 4.4Å; L596-I600 HydrophobicContact CG-CD1 4.2Å; L596-I600 WeakPolarHBondContact O-CG1 3.39Å; L596-I600 PolarHBondContact O-N 2.94Å; L596-I650 HydrophobicContact CD2-CD1 4.45Å
597	Y	81.7	Confident	81.1	Confident	77 Å²	77	57 Å²	57	30%	0.302	27%	0.271	S	S	.	.	H	α-helix	trans	-57.5	-45.6	177.2	-174.6	-103.4	0	0	0	112.2	I593 N594 Q595 Q599 I600 I601 I646 I650	I593-Y597 PolarHBondContact O-N 2.92Å; N594-Y597 PolarHBondContact O-N 2.68Å; Q595-Y597 PolarHBondContact O-N 3.05Å; Y597-Q599 PolarHBondContact O-N 2.95Å; Y597-I600 PolarHBondContact O-N 3.24Å; Y597-I601 HydrophobicContact CD1-CD1 3.8Å; Y597-I601 HydrophobicContact CE1-CD1 3.22Å; Y597-I601 HydrophobicContact CE1-CG1 4.33Å; Y597-I601 HydrophobicContact CE2-CD1 4.3Å; Y597-I601 PolarHBondContact O-N 3.41Å; Y597-I601 VanDerWaalsContact O-N 3.1Å; Y597-I646 HydrophobicContact CE2-CG2 4.03Å; Y597-I650 HydrophobicContact CD2-CD1 4.36Å
598	K	81.8	Confident	81.2	Confident	139 Å²	139	55.7 Å²	55.7	60%	0.604	26%	0.261	S	S	*	.	H	α-helix	trans	-61.4	-41.6	175.4	-75.7	176.7	-179.1	178.7	0	112.1	N594 Q595 L596 I601 N602	N594-K598 WeakPolarHBondContact O-CB 3.28Å; N594-K598 WeakPolarHBondContact O-CG 3.26Å; N594-K598 PolarHBondContact O-N 3.39Å; Q595-K598 PolarHBondContact O-N 3.38Å; L596-K598 VanDerWaalsContact C-N 3.34Å; L596-K598 PolarHBondContact O-N 3.29Å; K598-I601 PolarHBondContact O-N 3.47Å; K598-N602 WeakPolarHBondContact O-CB 3.26Å; K598-N602 VanDerWaalsContact O-CG 3.28Å; K598-N602 PolarHBondContact O-N 3.45Å
599	Q	83	Confident	81.1	Confident	46 Å²	46	58.9 Å²	58.9	22%	0.215	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-41.9	177.8	-74.1	178.3	-10	0	0	111.9	F553 Q595 L596 Y597 N602 Y603	F553-Q599 HydrophobicContact CD2-CB 3.61Å; F553-Q599 HydrophobicContact CD2-CG 4.45Å; F553-Q599 VanDerWaalsContact CD2-OE1 3.25Å; F553-Q599 HydrophobicContact CE2-CB 3.66Å; F553-Q599 HydrophobicContact CG-CB 4.14Å; F553-Q599 HydrophobicContact CZ-CB 4.24Å; Q595-Q599 WeakPolarHBondContact O-CG 3.34Å; Q595-Q599 PolarHBondContact O-N 3.17Å; L596-Q599 PolarHBondContact O-N 2.85Å; L596-Q599 VanDerWaalsContact O-N 3.15Å; Y597-Q599 PolarHBondContact O-N 2.95Å; Q599-N602 PolarHBondContact O-N 3.48Å; Q599-Y603 VanDerWaalsContact O-CB 3.31Å; Q599-Y603 WeakPolarHBondContact O-CB 3.38Å; Q599-Y603 PolarHBondContact O-N 3.1Å
600	I	82.9	Confident	81.2	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-49.2	176.3	-63.7	171.7	0	0	0	111.1	F553 I557 L561 V575 L596 Y597 N602 Y603 I604 I646	F553-I600 HydrophobicContact CE2-CB 4.48Å; F553-I600 HydrophobicContact CE2-CG1 3.6Å; F553-I600 HydrophobicContact CZ-CB 4.45Å; F553-I600 HydrophobicContact CZ-CG1 3.92Å; I557-I600 HydrophobicContact CG2-CG1 4.37Å; L561-I600 HydrophobicContact CD1-CG2 4.45Å; V575-I600 HydrophobicContact CG1-CD1 4.39Å; V575-I600 HydrophobicContact CG2-CD1 3.94Å; L596-I600 HydrophobicContact CD1-CD1 4.4Å; L596-I600 HydrophobicContact CG-CD1 4.2Å; L596-I600 WeakPolarHBondContact O-CG1 3.39Å; L596-I600 PolarHBondContact O-N 2.94Å; Y597-I600 PolarHBondContact O-N 3.24Å; I600-N602 VanDerWaalsContact C-N 3.34Å; I600-N602 PolarHBondContact O-N 3.43Å; I600-Y603 PolarHBondContact O-N 2.89Å; I600-I604 HydrophobicContact CG2-CD1 3.72Å; I600-I604 WeakPolarHBondContact O-CD1 3.24Å; I600-I604 WeakPolarHBondContact O-CG1 3.34Å; I600-I604 PolarHBondContact O-N 3.13Å; I600-I646 HydrophobicContact CG2-CD1 3.82Å
601	I	80.1	Confident	81.2	Confident	46 Å²	46	60 Å²	60	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-45.3	178.7	-70.6	177.9	0	0	0	110.8	Y597 K598 Y603 I604 K605 I646	Y597-I601 HydrophobicContact CD1-CD1 3.8Å; Y597-I601 HydrophobicContact CE1-CD1 3.22Å; Y597-I601 HydrophobicContact CE1-CG1 4.33Å; Y597-I601 HydrophobicContact CE2-CD1 4.3Å; Y597-I601 PolarHBondContact O-N 3.41Å; Y597-I601 VanDerWaalsContact O-N 3.1Å; K598-I601 PolarHBondContact O-N 3.47Å; I601-Y603 VanDerWaalsContact C-N 3.34Å; I601-Y603 PolarHBondContact O-N 3.25Å; I601-I604 PolarHBondContact O-N 3.16Å; I601-K605 HydrophobicContact CG2-CD 4.11Å; I601-K605 HydrophobicContact CG2-CG 4.46Å; I601-K605 WeakPolarHBondContact O-CG 3.25Å; I601-K605 PolarHBondContact O-N 3.49Å; I601-I646 HydrophobicContact CG1-CD1 3.92Å
602	N	81.9	Confident	81.1	Confident	89 Å²	89	58.4 Å²	58.4	48%	0.476	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-41.8	179.1	-76.4	-10.2	0	0	0	111.4	K598 Q599 I600 I604 K605 I606	K598-N602 WeakPolarHBondContact O-CB 3.26Å; K598-N602 VanDerWaalsContact O-CG 3.28Å; K598-N602 PolarHBondContact O-N 3.45Å; Q599-N602 PolarHBondContact O-N 3.48Å; I600-N602 VanDerWaalsContact C-N 3.34Å; I600-N602 PolarHBondContact O-N 3.43Å; N602-I604 PolarHBondContact O-N 3.5Å; N602-K605 PolarHBondContact O-N 2.89Å; N602-I606 WeakPolarHBondContact O-CD1 3.19Å; N602-I606 VanDerWaalsContact O-CG1 3.24Å; N602-I606 WeakPolarHBondContact O-CG1 3.42Å; N602-I606 PolarHBondContact O-N 2.85Å
603	Y	82.5	Confident	81.2	Confident	8 Å²	8	60 Å²	60	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-46.7	176.6	-174.2	-94	0	0	0	112.1	F553 Y554 G558 L561 D562 Q599 I600 I601 K605 I606 K607	F553-Y603 HydrophobicContact CD1-CD2 4.46Å; F553-Y603 AromaticContact CE1-CD2 3.71Å; F553-Y603 HydrophobicContact CE1-CD2 3.71Å; F553-Y603 HydrophobicContact CE1-CE2 4.49Å; F553-Y603 AromaticContact CE1-CG 3.76Å; F553-Y603 HydrophobicContact CE1-CG 3.76Å; F553-Y603 HydrophobicContact CZ-CG 4.33Å; Y554-Y603 HydrophobicContact CD1-CD2 4.38Å; Y554-Y603 AromaticContact CD1-CE2 3.68Å; Y554-Y603 HydrophobicContact CD1-CE2 3.68Å; Y554-Y603 AromaticContact CE1-CD2 3.85Å; Y554-Y603 HydrophobicContact CE1-CD2 3.85Å; Y554-Y603 AromaticContact CE1-CE2 3.34Å; Y554-Y603 HydrophobicContact CE1-CE2 3.34Å; Y554-Y603 AromaticContact CZ-CD2 3.93Å; Y554-Y603 AromaticContact CZ-CE2 3.91Å; G558-Y603 PolarHBondContact O-OH 2.98Å; L561-Y603 HydrophobicContact CB-CD1 4.25Å; L561-Y603 HydrophobicContact CB-CE1 3.83Å; L561-Y603 HydrophobicContact CD1-CD1 3.53Å; L561-Y603 HydrophobicContact CD1-CE1 3.96Å; L561-Y603 HydrophobicContact CD1-CG 4.33Å; D562-Y603 PolarHBondContact OD1-OH 3.42Å; D562-Y603 PolarHBondContact OD2-OH 2.92Å; D562-Y603 VanDerWaalsContact OD2-OH 3.07Å; Q599-Y603 VanDerWaalsContact O-CB 3.31Å; Q599-Y603 WeakPolarHBondContact O-CB 3.38Å; Q599-Y603 PolarHBondContact O-N 3.1Å; I600-Y603 PolarHBondContact O-N 2.89Å; I601-Y603 VanDerWaalsContact C-N 3.34Å; I601-Y603 PolarHBondContact O-N 3.25Å; Y603-K605 PolarHBondContact O-N 3.43Å; Y603-I606 PolarHBondContact O-N 3.15Å; Y603-K607 HydrophobicContact CD1-CG 4.13Å; Y603-K607 HydrophobicContact CE1-CD 4.43Å; Y603-K607 HydrophobicContact CE1-CG 3.75Å; Y603-K607 WeakPolarHBondContact O-CG 3.37Å; Y603-K607 PolarHBondContact O-N 2.85Å; Y603-K607 VanDerWaalsContact OH-CE 3.22Å; Y603-K607 WeakPolarHBondContact OH-CE 3.34Å; Y603-K607 PolarHBondContact OH-NZ 3.01Å
604	I	79	Confident	81.3	Confident	13 Å²	13	62.3 Å²	62.3	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-42.7	177.8	-70.3	162.8	0	0	0	111	L571 I600 I601 N602 I606 K607 K608 T644 I646	L571-I604 HydrophobicContact CD2-CD1 3.41Å; L571-I604 VanDerWaalsContact CD2-CD1 3.41Å; L571-I604 HydrophobicContact CD2-CG1 3.85Å; I600-I604 HydrophobicContact CG2-CD1 3.72Å; I600-I604 WeakPolarHBondContact O-CD1 3.24Å; I600-I604 WeakPolarHBondContact O-CG1 3.34Å; I600-I604 PolarHBondContact O-N 3.13Å; I601-I604 PolarHBondContact O-N 3.16Å; N602-I604 PolarHBondContact O-N 3.5Å; I604-I606 VanDerWaalsContact C-N 3.35Å; I604-I606 PolarHBondContact O-N 3.03Å; I604-K607 PolarHBondContact O-N 3.38Å; I604-K608 WeakPolarHBondContact O-CB 3.46Å; I604-K608 PolarHBondContact O-N 3.31Å; I604-T644 HydrophobicContact CD1-CG2 4.31Å; I604-T644 HydrophobicContact CG2-CG2 3.4Å; I604-T644 VanDerWaalsContact CG2-CG2 3.4Å; I604-I646 HydrophobicContact CD1-CD1 3.62Å; I604-I646 HydrophobicContact CD1-CG1 4.11Å
605	K	78.7	Confident	81.3	Confident	134 Å²	134	58.4 Å²	58.4	58%	0.583	27%	0.266	S	S	*	.	H	α-helix	trans	-59.4	-45.5	175.1	-76.2	177.4	179.1	179.4	0	111.5	I601 N602 Y603 K607 K608 F609	I601-K605 HydrophobicContact CG2-CD 4.11Å; I601-K605 HydrophobicContact CG2-CG 4.46Å; I601-K605 WeakPolarHBondContact O-CG 3.25Å; I601-K605 PolarHBondContact O-N 3.49Å; N602-K605 PolarHBondContact O-N 2.89Å; Y603-K605 PolarHBondContact O-N 3.43Å; K605-K607 PolarHBondContact O-N 3.16Å; K605-K608 PolarHBondContact O-N 3.23Å; K605-F609 PolarHBondContact O-N 3.49Å
606	I	81.4	Confident	81.3	Confident	95 Å²	95	60.9 Å²	60.9	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-44.1	177	-68.9	163.7	0	0	0	110.5	N602 Y603 I604 F609 W610	N602-I606 WeakPolarHBondContact O-CD1 3.19Å; N602-I606 VanDerWaalsContact O-CG1 3.24Å; N602-I606 WeakPolarHBondContact O-CG1 3.42Å; N602-I606 PolarHBondContact O-N 2.85Å; Y603-I606 PolarHBondContact O-N 3.15Å; I604-I606 VanDerWaalsContact C-N 3.35Å; I604-I606 PolarHBondContact O-N 3.03Å; I606-F609 PolarHBondContact O-N 2.94Å; I606-W610 WeakPolarHBondContact O-CB 3.39Å; I606-W610 PolarHBondContact O-N 2.77Å
607	K	81.9	Confident	81.1	Confident	31 Å²	31	66.9 Å²	66.9	14%	0.135	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-39.6	178.1	-74.4	-76.8	168.4	152.9	0	112.6	D562 L565 Y603 I604 K605 F609 W610 F611	D562-K607 WeakPolarHBondContact OD1-CE 3.32Å; D562-K607 IonicContact OD1-NZ 3.49Å; D562-K607 PolarHBondContact OD1-NZ 2.87Å; D562-K607 IonicContact OD2-NZ 3.13Å; D562-K607 PolarHBondContact OD2-NZ 2.72Å; L565-K607 HydrophobicContact CD1-CB 4.23Å; L565-K607 HydrophobicContact CD1-CG 4.42Å; Y603-K607 HydrophobicContact CD1-CG 4.13Å; Y603-K607 HydrophobicContact CE1-CD 4.43Å; Y603-K607 HydrophobicContact CE1-CG 3.75Å; Y603-K607 WeakPolarHBondContact O-CG 3.37Å; Y603-K607 PolarHBondContact O-N 2.85Å; Y603-K607 VanDerWaalsContact OH-CE 3.22Å; Y603-K607 WeakPolarHBondContact OH-CE 3.34Å; Y603-K607 PolarHBondContact OH-NZ 3.01Å; I604-K607 PolarHBondContact O-N 3.38Å; K605-K607 PolarHBondContact O-N 3.16Å; K607-F609 VanDerWaalsContact C-N 3.34Å; K607-F609 PolarHBondContact O-N 2.84Å; K607-W610 WeakPolarHBondContact O-CB 3.34Å; K607-W610 PolarHBondContact O-N 3.37Å; K607-F611 HydrophobicContact CB-CE2 4.43Å; K607-F611 WeakPolarHBondContact O-CD2 3.37Å; K607-F611 WeakPolarHBondContact O-CG 3.28Å; K607-F611 PolarHBondContact O-N 2.95Å
608	K	78	Confident	81	Confident	89 Å²	89	63.7 Å²	63.7	39%	0.387	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-42	174.2	-170.5	172.2	-176.6	171.6	0	111.7	I604 K605 F611 K612 Y639	I604-K608 WeakPolarHBondContact O-CB 3.46Å; I604-K608 PolarHBondContact O-N 3.31Å; K605-K608 PolarHBondContact O-N 3.23Å; K608-F611 PolarHBondContact O-N 2.78Å; K608-K612 PolarHBondContact O-N 3.18Å; K608-K612 VanDerWaalsContact O-N 3.07Å; K608-Y639 HydrophobicContact CG-CD2 4.16Å; K608-Y639 HydrophobicContact CG-CE2 3.94Å
609	F	79.4	Confident	80.8	Confident	126 Å²	126	62.1 Å²	62.1	55%	0.553	29%	0.288	S	S	*	.	H	α-helix	trans	-63.4	-42.2	172.9	-177.6	-102.3	0	0	0	111.7	K605 I606 K607 F611 K612 N613	K605-F609 PolarHBondContact O-N 3.49Å; I606-F609 PolarHBondContact O-N 2.94Å; K607-F609 VanDerWaalsContact C-N 3.34Å; K607-F609 PolarHBondContact O-N 2.84Å; F609-F611 PolarHBondContact O-N 2.66Å; F609-K612 WeakPolarHBondContact O-CB 3.1Å; F609-K612 PolarHBondContact O-N 3.09Å; F609-N613 WeakPolarHBondContact CE1-ND2 3.32Å; F609-N613 VanDerWaalsContact CZ-ND2 3.33Å; F609-N613 WeakPolarHBondContact CZ-ND2 3.38Å; F609-N613 PolarHBondContact O-N 3.44Å; F609-N613 PolarHBondContact O-OD1 3Å
610	W	81	Confident	80.5	Confident	88 Å²	88	64.1 Å²	64.1	33%	0.333	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-46.3	176	-174.8	88.1	0	0	0	112.2	I606 K607 K612 N613 Q614 L635	I606-W610 WeakPolarHBondContact O-CB 3.39Å; I606-W610 PolarHBondContact O-N 2.77Å; K607-W610 WeakPolarHBondContact O-CB 3.34Å; K607-W610 PolarHBondContact O-N 3.37Å; W610-K612 VanDerWaalsContact C-N 3.34Å; W610-K612 PolarHBondContact O-N 3.4Å; W610-N613 PolarHBondContact O-N 2.84Å; W610-Q614 HydrophobicContact CD2-CG 3.98Å; W610-Q614 HydrophobicContact CE3-CG 4.06Å; W610-Q614 HydrophobicContact CH2-CG 3.82Å; W610-Q614 HydrophobicContact CZ2-CG 3.73Å; W610-Q614 HydrophobicContact CZ3-CG 3.98Å; W610-Q614 WeakPolarHBondContact O-CG 3.31Å; W610-Q614 PolarHBondContact O-N 3.45Å; W610-L635 HydrophobicContact CZ3-CD2 4.44Å
611	F	80.3	Confident	79.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-44.6	175.4	-68.7	-49.4	0	0	0	111.7	L565 Y566 K607 K608 F609 N613 Q614 I615 L635 I638 Y639 L642	L565-F611 HydrophobicContact CB-CZ 4.36Å; L565-F611 HydrophobicContact CD1-CE2 4.38Å; Y566-F611 HydrophobicContact CE1-CE1 4.16Å; Y566-F611 HydrophobicContact CE1-CZ 4.49Å; K607-F611 HydrophobicContact CB-CE2 4.43Å; K607-F611 WeakPolarHBondContact O-CD2 3.37Å; K607-F611 WeakPolarHBondContact O-CG 3.28Å; K607-F611 PolarHBondContact O-N 2.95Å; K608-F611 PolarHBondContact O-N 2.78Å; F609-F611 PolarHBondContact O-N 2.66Å; F611-N613 PolarHBondContact O-N 2.85Å; F611-Q614 PolarHBondContact O-N 3.15Å; F611-I615 VanDerWaalsContact O-CG1 3.24Å; F611-I615 WeakPolarHBondContact O-CG1 3.38Å; F611-I615 PolarHBondContact O-N 2.84Å; F611-L635 HydrophobicContact CD1-CD2 3.54Å; F611-L635 HydrophobicContact CE1-CD2 4Å; F611-I638 HydrophobicContact CD2-CG2 3.97Å; F611-I638 HydrophobicContact CE1-CG2 4.25Å; F611-I638 HydrophobicContact CE2-CG2 3.64Å; F611-I638 HydrophobicContact CG-CG2 4.43Å; F611-I638 HydrophobicContact CZ-CG2 3.8Å; F611-Y639 HydrophobicContact CB-CD2 4.38Å; F611-L642 HydrophobicContact CD2-CD1 4Å; F611-L642 HydrophobicContact CE2-CD1 3.96Å
612	K	80.6	Confident	78.9	Confident	85 Å²	85	71.3 Å²	71.3	37%	0.37	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-48	176.4	-163	-169.7	-177.5	-136.4	0	111.8	K608 F609 W610 Q614 I615 E616 Y639	K608-K612 PolarHBondContact O-N 3.18Å; K608-K612 VanDerWaalsContact O-N 3.07Å; F609-K612 WeakPolarHBondContact O-CB 3.1Å; F609-K612 PolarHBondContact O-N 3.09Å; W610-K612 VanDerWaalsContact C-N 3.34Å; W610-K612 PolarHBondContact O-N 3.4Å; K612-Q614 VanDerWaalsContact C-N 3.31Å; K612-Q614 PolarHBondContact O-N 3.1Å; K612-I615 WeakPolarHBondContact O-CB 3.5Å; K612-I615 PolarHBondContact O-N 2.95Å; K612-E616 WeakPolarHBondContact CE-OE1 3.23Å; K612-E616 IonicContact NZ-OE1 2.92Å; K612-E616 PolarHBondContact NZ-OE1 2.79Å; K612-E616 WeakPolarHBondContact O-CG 3.33Å; K612-E616 PolarHBondContact O-N 3Å; K612-Y639 HydrophobicContact CB-CD2 4.29Å; K612-Y639 HydrophobicContact CB-CE2 3.72Å; K612-Y639 HydrophobicContact CG-CE2 4.02Å
613	N	82.7	Confident	77.7	Confident	60 Å²	60	73.5 Å²	73.5	32%	0.321	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-36.1	178.8	-74.7	9.1	0	0	0	112.3	F609 W610 F611 H617	F609-N613 WeakPolarHBondContact CE1-ND2 3.32Å; F609-N613 VanDerWaalsContact CZ-ND2 3.33Å; F609-N613 WeakPolarHBondContact CZ-ND2 3.38Å; F609-N613 PolarHBondContact O-N 3.44Å; F609-N613 PolarHBondContact O-OD1 3Å; W610-N613 PolarHBondContact O-N 2.84Å; F611-N613 PolarHBondContact O-N 2.85Å; N613-H617 VanDerWaalsContact O-CB 3.22Å; N613-H617 WeakPolarHBondContact O-CB 3.26Å; N613-H617 PolarHBondContact O-N 3.4Å
614	Q	82.8	Confident	76.3	Confident	57 Å²	57	77.4 Å²	77.4	27%	0.266	38%	0.379	S	S	.	.	H	α-helix	trans	-67.3	-40.2	174.8	-69.7	-58.3	-45.1	0	0	111.6	W610 F611 K612 H617 I618 L635	W610-Q614 HydrophobicContact CD2-CG 3.98Å; W610-Q614 HydrophobicContact CE3-CG 4.06Å; W610-Q614 HydrophobicContact CH2-CG 3.82Å; W610-Q614 HydrophobicContact CZ2-CG 3.73Å; W610-Q614 HydrophobicContact CZ3-CG 3.98Å; W610-Q614 WeakPolarHBondContact O-CG 3.31Å; W610-Q614 PolarHBondContact O-N 3.45Å; F611-Q614 PolarHBondContact O-N 3.15Å; K612-Q614 VanDerWaalsContact C-N 3.31Å; K612-Q614 PolarHBondContact O-N 3.1Å; Q614-H617 PolarHBondContact O-N 2.88Å; Q614-I618 WeakPolarHBondContact O-CD1 3.32Å; Q614-I618 VanDerWaalsContact O-CG1 3.23Å; Q614-I618 WeakPolarHBondContact O-CG1 3.35Å; Q614-I618 PolarHBondContact O-N 2.92Å; Q614-L635 HydrophobicContact CB-CD1 3.91Å
615	I	81.5	Confident	75.7	Confident	10 Å²	10	80.1 Å²	80.1	5%	0.051	40%	0.396	C	S	.	.	H	α-helix	trans	-60.8	-51.8	173.5	-69	166.1	0	0	0	109.7	F611 K612 H617 I618 E619 Y632 L635 N636 Y639	F611-I615 VanDerWaalsContact O-CG1 3.24Å; F611-I615 WeakPolarHBondContact O-CG1 3.38Å; F611-I615 PolarHBondContact O-N 2.84Å; K612-I615 WeakPolarHBondContact O-CB 3.5Å; K612-I615 PolarHBondContact O-N 2.95Å; I615-H617 VanDerWaalsContact C-N 3.3Å; I615-H617 PolarHBondContact O-N 3.45Å; I615-I618 PolarHBondContact O-N 3.41Å; I615-I618 VanDerWaalsContact O-N 3.07Å; I615-E619 HydrophobicContact CG2-CG 4.36Å; I615-E619 WeakPolarHBondContact CG2-OE1 3.46Å; I615-E619 WeakPolarHBondContact O-CB 3.35Å; I615-E619 WeakPolarHBondContact O-CG 3.48Å; I615-E619 PolarHBondContact O-N 3.36Å; I615-Y632 HydrophobicContact CG2-CD2 4.46Å; I615-Y632 HydrophobicContact CG2-CE2 3.78Å; I615-L635 HydrophobicContact CD1-CB 4.34Å; I615-L635 HydrophobicContact CG1-CB 3.91Å; I615-N636 HydrophobicContact CD1-CB 4.37Å; I615-Y639 HydrophobicContact CD1-CD1 4.32Å; I615-Y639 HydrophobicContact CD1-CG 3.91Å
616	E	82.9	Confident	74.8	Confident	81 Å²	81	82.2 Å²	82.2	38%	0.379	41%	0.408	S	S	.	.	H	α-helix	trans	-60.3	-37.2	177.8	-71.5	174.8	-174.6	0	0	112	K612 E619 S620	K612-E616 WeakPolarHBondContact CE-OE1 3.23Å; K612-E616 IonicContact NZ-OE1 2.92Å; K612-E616 PolarHBondContact NZ-OE1 2.79Å; K612-E616 WeakPolarHBondContact O-CG 3.33Å; K612-E616 PolarHBondContact O-N 3Å; E616-E619 PolarHBondContact O-N 3.1Å; E616-S620 WeakPolarHBondContact O-CB 3.23Å; E616-S620 PolarHBondContact O-N 3.1Å; E616-S620 PolarHBondContact O-OG 2.89Å
617	H	79.3	Confident	73.9	Confident	125 Å²	125	81.7 Å²	81.7	58%	0.579	41%	0.413	S	S	*	.	H	α-helix	trans	-67.5	-37.3	174.7	-174.3	-67.6	0	0	0	112.2	N613 Q614 I615 S620 S621	N613-H617 VanDerWaalsContact O-CB 3.22Å; N613-H617 WeakPolarHBondContact O-CB 3.26Å; N613-H617 PolarHBondContact O-N 3.4Å; Q614-H617 PolarHBondContact O-N 2.88Å; I615-H617 VanDerWaalsContact C-N 3.3Å; I615-H617 PolarHBondContact O-N 3.45Å; H617-S620 WeakPolarHBondContact CA-OG 3.17Å; H617-S620 PolarHBondContact O-OG 3.49Å; H617-S621 WeakPolarHBondContact O-CB 3.46Å; H617-S621 PolarHBondContact O-N 2.92Å
618	I	78.8	Confident	73.4	Confident	10 Å²	10	82.7 Å²	82.7	5%	0.051	42%	0.419	C	S	.	.	H	α-helix	trans	-72.9	-40.3	175.6	-66.7	163	0	0	0	110.5	Q614 I615 S620 S621 I628 Y631 Y632 L635	Q614-I618 WeakPolarHBondContact O-CD1 3.32Å; Q614-I618 VanDerWaalsContact O-CG1 3.23Å; Q614-I618 WeakPolarHBondContact O-CG1 3.35Å; Q614-I618 PolarHBondContact O-N 2.92Å; I615-I618 PolarHBondContact O-N 3.41Å; I615-I618 VanDerWaalsContact O-N 3.07Å; I618-S620 VanDerWaalsContact C-N 3.32Å; I618-S620 PolarHBondContact O-N 3.36Å; I618-S621 WeakPolarHBondContact O-CB 3.3Å; I618-S621 PolarHBondContact O-N 3.48Å; I618-S621 PolarHBondContact O-OG 2.93Å; I618-I628 HydrophobicContact CB-CG2 4.44Å; I618-I628 HydrophobicContact CG1-CG2 4.2Å; I618-I628 HydrophobicContact CG2-CG2 3.44Å; I618-I628 VanDerWaalsContact CG2-CG2 3.44Å; I618-Y631 HydrophobicContact CD1-CD1 3.71Å; I618-Y631 HydrophobicContact CD1-CE1 4.04Å; I618-Y632 HydrophobicContact CB-CD2 4.27Å; I618-Y632 HydrophobicContact CG2-CD2 3.89Å; I618-Y632 HydrophobicContact CG2-CG 4.32Å; I618-L635 HydrophobicContact CD1-CD1 3.64Å
619	E	78.9	Confident	73	Confident	106 Å²	106	81 Å²	81	50%	0.495	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-34.7	177.5	-72.7	175.2	169.8	0	0	112.4	I615 E616 S621 Y632	I615-E619 HydrophobicContact CG2-CG 4.36Å; I615-E619 WeakPolarHBondContact CG2-OE1 3.46Å; I615-E619 WeakPolarHBondContact O-CB 3.35Å; I615-E619 WeakPolarHBondContact O-CG 3.48Å; I615-E619 PolarHBondContact O-N 3.36Å; E616-E619 PolarHBondContact O-N 3.1Å; E619-S621 VanDerWaalsContact C-N 3.29Å; E619-Y632 HydrophobicContact CG-CD2 4.44Å; E619-Y632 HydrophobicContact CG-CE2 3.57Å; E619-Y632 VanDerWaalsContact OE1-CE2 3.3Å; E619-Y632 WeakPolarHBondContact OE1-CE2 3.3Å; E619-Y632 PolarHBondContact OE1-OH 3.12Å
620	S	75.9	Confident	72.4	Confident	88 Å²	88	82 Å²	82	62%	0.615	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.4	172.3	55.9	0	0	0	0	113.6	E616 H617 I618 I622	E616-S620 WeakPolarHBondContact O-CB 3.23Å; E616-S620 PolarHBondContact O-N 3.1Å; E616-S620 PolarHBondContact O-OG 2.89Å; H617-S620 WeakPolarHBondContact CA-OG 3.17Å; H617-S620 PolarHBondContact O-OG 3.49Å; I618-S620 VanDerWaalsContact C-N 3.32Å; I618-S620 PolarHBondContact O-N 3.36Å; S620-I622 PolarHBondContact O-N 2.83Å
621	S	70.6	Confident	72	Confident	36 Å²	36	82.5 Å²	82.5	25%	0.252	42%	0.42	S	S	.	.			trans	-75.7	123.6	179.2	77.9	0	0	0	0	111	H617 I618 E619 N623	H617-S621 WeakPolarHBondContact O-CB 3.46Å; H617-S621 PolarHBondContact O-N 2.92Å; I618-S621 WeakPolarHBondContact O-CB 3.3Å; I618-S621 PolarHBondContact O-N 3.48Å; I618-S621 PolarHBondContact O-OG 2.93Å; E619-S621 VanDerWaalsContact C-N 3.29Å; S621-N623 PolarHBondContact O-N 3.09Å
622	I	58.6	Low	71.7	Confident	166 Å²	166	85.3 Å²	85.3	85%	0.851	43%	0.431	S	S	*	.	S	Bend	trans	-66.6	-25.6	-173.8	-61.6	165.1	0	0	0	111.9	S620	S620-I622 PolarHBondContact O-N 2.83Å
623	N	57.7	Low	71.2	Confident	136 Å²	136	86.2 Å²	86.2	73%	0.727	44%	0.437	S	S	*	.			trans	-126.4	101.3	-175.8	-74.9	-35.6	0	0	0	111.8	S621	S621-N623 PolarHBondContact O-N 3.09Å
624	I	53	Low	70.5	Confident	90 Å²	90	86.6 Å²	86.6	46%	0.462	44%	0.436	S	S	.	.			trans	-95.9	109.4	178.2	-56	175.2	0	0	0	109.3	I628 T629	I624-I628 HydrophobicContact CG2-CB 4.08Å; I624-I628 HydrophobicContact CG2-CG2 3.9Å; I624-T629 WeakPolarHBondContact CG2-OG1 3.33Å
625	T	66.3	Low	70	Confident	70 Å²	70	84 Å²	84	43%	0.429	43%	0.425	S	S	.	.			trans	-77.2	159.4	171.2	61.1	0	0	0	0	111	S627 I628 T629	T625-S627 PolarHBondContact O-N 3.4Å; T625-S627 VanDerWaalsContact O-N 3.15Å; T625-S627 PolarHBondContact OG1-OG 2.93Å; T625-I628 CarbonylContact O-C 3.55Å; T625-I628 WeakPolarHBondContact O-CA 3.47Å; T625-I628 WeakPolarHBondContact O-CB 3.44Å; T625-I628 PolarHBondContact O-N 3.12Å; T625-I628 WeakPolarHBondContact OG1-CD1 3.18Å; T625-I628 VanDerWaalsContact OG1-CG1 3.26Å; T625-I628 WeakPolarHBondContact OG1-CG1 3.42Å; T625-I628 PolarHBondContact OG1-N 3.4Å; T625-T629 PolarHBondContact O-N 3.02Å; T625-T629 PolarHBondContact O-OG1 3.01Å
626	Q	59.7	Low	69.5	Low	177 Å²	177	85.3 Å²	85.3	83%	0.827	43%	0.432	S	S	*	.	H	α-helix	trans	-57.8	-31.8	179.4	-166.3	171	8.2	0	0	113.4	T629 Y630	Q626-T629 PolarHBondContact O-N 3.28Å; Q626-Y630 PolarHBondContact O-N 2.81Å
627	S	63.2	Low	68.6	Low	85 Å²	85	85 Å²	85	59%	0.594	43%	0.433	S	S	*	.	H	α-helix	trans	-66.6	-39.5	171	37.8	0	0	0	0	112.6	T625 Y630 Y631	T625-S627 PolarHBondContact O-N 3.4Å; T625-S627 VanDerWaalsContact O-N 3.15Å; T625-S627 PolarHBondContact OG1-OG 2.93Å; S627-Y630 PolarHBondContact O-N 3.49Å; S627-Y631 WeakPolarHBondContact O-CB 3.27Å; S627-Y631 PolarHBondContact O-N 3.49Å
628	I	71.3	Confident	67.8	Low	51 Å²	51	79.4 Å²	79.4	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-70.1	-37.6	175.2	-64.6	168.4	0	0	0	110.1	I618 I624 T625 Y631 Y632	I618-I628 HydrophobicContact CB-CG2 4.44Å; I618-I628 HydrophobicContact CG1-CG2 4.2Å; I618-I628 HydrophobicContact CG2-CG2 3.44Å; I618-I628 VanDerWaalsContact CG2-CG2 3.44Å; I624-I628 HydrophobicContact CG2-CB 4.08Å; I624-I628 HydrophobicContact CG2-CG2 3.9Å; T625-I628 CarbonylContact O-C 3.55Å; T625-I628 WeakPolarHBondContact O-CA 3.47Å; T625-I628 WeakPolarHBondContact O-CB 3.44Å; T625-I628 PolarHBondContact O-N 3.12Å; T625-I628 WeakPolarHBondContact OG1-CD1 3.18Å; T625-I628 VanDerWaalsContact OG1-CG1 3.26Å; T625-I628 WeakPolarHBondContact OG1-CG1 3.42Å; T625-I628 PolarHBondContact OG1-N 3.4Å; I628-Y631 CarbonylContact O-C 3.53Å; I628-Y631 PolarHBondContact O-N 2.89Å; I628-Y632 VanDerWaalsContact O-CB 3.26Å; I628-Y632 WeakPolarHBondContact O-CB 3.44Å; I628-Y632 PolarHBondContact O-N 3.48Å
629	T	67.9	Low	67.5	Low	53 Å²	53	82 Å²	82	33%	0.325	42%	0.416	S	S	.	.	H	α-helix	trans	-60	-47.3	173.5	-45.9	0	0	0	0	111.2	I624 T625 Q626 Y631 Y632 E633	I624-T629 WeakPolarHBondContact CG2-OG1 3.33Å; T625-T629 PolarHBondContact O-N 3.02Å; T625-T629 PolarHBondContact O-OG1 3.01Å; Q626-T629 PolarHBondContact O-N 3.28Å; T629-Y631 VanDerWaalsContact C-N 3.31Å; T629-Y631 PolarHBondContact O-N 2.91Å; T629-Y632 WeakPolarHBondContact O-CB 3.42Å; T629-Y632 PolarHBondContact O-N 3.38Å; T629-E633 WeakPolarHBondContact O-CG 3.3Å; T629-E633 PolarHBondContact O-N 2.84Å
630	Y	66.7	Low	66.6	Low	147 Å²	147	81.9 Å²	81.9	58%	0.576	42%	0.419	S	S	*	.	H	α-helix	trans	-61.8	-41	175.8	-178.3	-98.7	0	0	0	111.7	Q626 S627 E633 Q634	Q626-Y630 PolarHBondContact O-N 2.81Å; S627-Y630 PolarHBondContact O-N 3.49Å; Y630-E633 PolarHBondContact O-N 2.94Å; Y630-Q634 HydrophobicContact CD1-CG 4.32Å; Y630-Q634 HydrophobicContact CE1-CG 3.95Å; Y630-Q634 VanDerWaalsContact O-CG 3.27Å; Y630-Q634 WeakPolarHBondContact O-CG 3.34Å; Y630-Q634 PolarHBondContact O-N 3.5Å; Y630-Q634 PolarHBondContact OH-NE2 3.01Å; Y630-Q634 VanDerWaalsContact OH-NE2 3.09Å
631	Y	72.8	Confident	65.6	Low	99 Å²	99	80.1 Å²	80.1	39%	0.388	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-41.2	176.2	-173.8	-118.1	0	0	0	112.3	I618 S627 I628 T629 Q634 L635	I618-Y631 HydrophobicContact CD1-CD1 3.71Å; I618-Y631 HydrophobicContact CD1-CE1 4.04Å; S627-Y631 WeakPolarHBondContact O-CB 3.27Å; S627-Y631 PolarHBondContact O-N 3.49Å; I628-Y631 CarbonylContact O-C 3.53Å; I628-Y631 PolarHBondContact O-N 2.89Å; T629-Y631 VanDerWaalsContact C-N 3.31Å; T629-Y631 PolarHBondContact O-N 2.91Å; Y631-Q634 PolarHBondContact O-N 3.49Å; Y631-L635 HydrophobicContact CD1-CD1 3.72Å; Y631-L635 HydrophobicContact CD1-CG 4.42Å; Y631-L635 HydrophobicContact CE1-CD1 3.34Å; Y631-L635 HydrophobicContact CE1-CG 4.11Å; Y631-L635 HydrophobicContact CE2-CD1 4.37Å; Y631-L635 HydrophobicContact CE2-CG 4.27Å; Y631-L635 HydrophobicContact CG-CD1 4.39Å; Y631-L635 WeakPolarHBondContact O-CB 3.22Å; Y631-L635 WeakPolarHBondContact O-CG 3.37Å; Y631-L635 PolarHBondContact O-N 3.27Å
632	Y	74.8	Confident	64.8	Low	59 Å²	59	79.1 Å²	79.1	23%	0.231	40%	0.397	C	S	.	.	H	α-helix	trans	-60.7	-48.7	173.5	173.3	-95.3	0	0	0	111.4	I615 I618 E619 I628 T629 Q634 L635 N636	I615-Y632 HydrophobicContact CG2-CD2 4.46Å; I615-Y632 HydrophobicContact CG2-CE2 3.78Å; I618-Y632 HydrophobicContact CB-CD2 4.27Å; I618-Y632 HydrophobicContact CG2-CD2 3.89Å; I618-Y632 HydrophobicContact CG2-CG 4.32Å; E619-Y632 HydrophobicContact CG-CD2 4.44Å; E619-Y632 HydrophobicContact CG-CE2 3.57Å; E619-Y632 VanDerWaalsContact OE1-CE2 3.3Å; E619-Y632 WeakPolarHBondContact OE1-CE2 3.3Å; E619-Y632 PolarHBondContact OE1-OH 3.12Å; I628-Y632 VanDerWaalsContact O-CB 3.26Å; I628-Y632 WeakPolarHBondContact O-CB 3.44Å; I628-Y632 PolarHBondContact O-N 3.48Å; T629-Y632 WeakPolarHBondContact O-CB 3.42Å; T629-Y632 PolarHBondContact O-N 3.38Å; Y632-Q634 VanDerWaalsContact C-N 3.3Å; Y632-Q634 PolarHBondContact O-N 2.96Å; Y632-L635 PolarHBondContact O-N 3.49Å; Y632-N636 HydrophobicContact CE1-CB 4.39Å; Y632-N636 WeakPolarHBondContact O-CB 3.47Å; Y632-N636 PolarHBondContact O-N 3.09Å; Y632-N636 PolarHBondContact OH-ND2 2.81Å
633	E	70.1	Confident	64.4	Low	105 Å²	105	78.9 Å²	78.9	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-42.9	176.7	-75.9	177.5	-179.2	0	0	111.4	T629 Y630 N637	T629-E633 WeakPolarHBondContact O-CG 3.3Å; T629-E633 PolarHBondContact O-N 2.84Å; Y630-E633 PolarHBondContact O-N 2.94Å; E633-N637 WeakPolarHBondContact O-CB 3.35Å; E633-N637 PolarHBondContact O-N 2.85Å; E633-N637 PolarHBondContact O-ND2 3.43Å; E633-N637 VanDerWaalsContact O-ND2 3.13Å
634	Q	67.6	Low	64	Low	67 Å²	67	75.4 Å²	75.4	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-63.8	-48.1	175.8	-70.2	-69.3	-8.3	0	0	111.7	Y630 Y631 Y632 N637 I638	Y630-Q634 HydrophobicContact CD1-CG 4.32Å; Y630-Q634 HydrophobicContact CE1-CG 3.95Å; Y630-Q634 VanDerWaalsContact O-CG 3.27Å; Y630-Q634 WeakPolarHBondContact O-CG 3.34Å; Y630-Q634 PolarHBondContact O-N 3.5Å; Y630-Q634 PolarHBondContact OH-NE2 3.01Å; Y630-Q634 VanDerWaalsContact OH-NE2 3.09Å; Y631-Q634 PolarHBondContact O-N 3.49Å; Y632-Q634 VanDerWaalsContact C-N 3.3Å; Y632-Q634 PolarHBondContact O-N 2.96Å; Q634-N637 PolarHBondContact O-N 2.89Å; Q634-I638 WeakPolarHBondContact O-CB 3.4Å; Q634-I638 WeakPolarHBondContact O-CD1 3.28Å; Q634-I638 VanDerWaalsContact O-CG1 3.22Å; Q634-I638 WeakPolarHBondContact O-CG1 3.41Å; Q634-I638 PolarHBondContact O-N 2.81Å
635	L	72.1	Confident	63.7	Low	4 Å²	4	75.4 Å²	75.4	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-62	-44.9	177.9	-77.3	175.8	0	0	0	112.4	W610 F611 Q614 I615 I618 Y631 Y632 I638 Y639	W610-L635 HydrophobicContact CZ3-CD2 4.44Å; F611-L635 HydrophobicContact CD1-CD2 3.54Å; F611-L635 HydrophobicContact CE1-CD2 4Å; Q614-L635 HydrophobicContact CB-CD1 3.91Å; I615-L635 HydrophobicContact CD1-CB 4.34Å; I615-L635 HydrophobicContact CG1-CB 3.91Å; I618-L635 HydrophobicContact CD1-CD1 3.64Å; Y631-L635 HydrophobicContact CD1-CD1 3.72Å; Y631-L635 HydrophobicContact CD1-CG 4.42Å; Y631-L635 HydrophobicContact CE1-CD1 3.34Å; Y631-L635 HydrophobicContact CE1-CG 4.11Å; Y631-L635 HydrophobicContact CE2-CD1 4.37Å; Y631-L635 HydrophobicContact CE2-CG 4.27Å; Y631-L635 HydrophobicContact CG-CD1 4.39Å; Y631-L635 WeakPolarHBondContact O-CB 3.22Å; Y631-L635 WeakPolarHBondContact O-CG 3.37Å; Y631-L635 PolarHBondContact O-N 3.27Å; Y632-L635 PolarHBondContact O-N 3.49Å; L635-I638 PolarHBondContact O-N 3.41Å; L635-Y639 WeakPolarHBondContact O-CB 3.33Å; L635-Y639 PolarHBondContact O-N 2.67Å
636	N	71.3	Confident	62.9	Low	37 Å²	37	73.8 Å²	73.8	20%	0.198	36%	0.355	C	S	.	.	H	α-helix	trans	-69.4	-38	-178.1	-156.9	7.3	0	0	0	110.6	I615 Y632 Y639 N640	I615-N636 HydrophobicContact CD1-CB 4.37Å; Y632-N636 HydrophobicContact CE1-CB 4.39Å; Y632-N636 WeakPolarHBondContact O-CB 3.47Å; Y632-N636 PolarHBondContact O-N 3.09Å; Y632-N636 PolarHBondContact OH-ND2 2.81Å; N636-Y639 PolarHBondContact O-N 3.43Å; N636-N640 VanDerWaalsContact O-CB 3.26Å; N636-N640 WeakPolarHBondContact O-CB 3.46Å; N636-N640 PolarHBondContact O-N 3.17Å; N636-N640 PolarHBondContact O-ND2 2.92Å; N636-N640 PolarHBondContact OD1-ND2 2.98Å
637	N	63.2	Low	62.2	Low	74 Å²	74	67.2 Å²	67.2	40%	0.396	32%	0.323	S	S	.	.	H	α-helix	trans	-57.7	-56.5	168.1	-78.2	-27.2	0	0	0	110.5	E633 Q634 Y639 N640 T641	E633-N637 WeakPolarHBondContact O-CB 3.35Å; E633-N637 PolarHBondContact O-N 2.85Å; E633-N637 PolarHBondContact O-ND2 3.43Å; E633-N637 VanDerWaalsContact O-ND2 3.13Å; Q634-N637 PolarHBondContact O-N 2.89Å; N637-Y639 VanDerWaalsContact C-N 3.27Å; N637-Y639 PolarHBondContact O-N 2.8Å; N637-N640 PolarHBondContact O-N 3.41Å; N637-T641 PolarHBondContact O-N 3.13Å; N637-T641 PolarHBondContact O-OG1 3.47Å
638	I	63.7	Low	61.3	Low	7 Å²	7	67.2 Å²	67.2	4%	0.036	32%	0.321	C	S	.	.	H	α-helix	trans	-52.4	-46.1	178.7	-68.8	163.3	0	0	0	110.9	F611 Q634 L635 L642	F611-I638 HydrophobicContact CD2-CG2 3.97Å; F611-I638 HydrophobicContact CE1-CG2 4.25Å; F611-I638 HydrophobicContact CE2-CG2 3.64Å; F611-I638 HydrophobicContact CG-CG2 4.43Å; F611-I638 HydrophobicContact CZ-CG2 3.8Å; Q634-I638 WeakPolarHBondContact O-CB 3.4Å; Q634-I638 WeakPolarHBondContact O-CD1 3.28Å; Q634-I638 VanDerWaalsContact O-CG1 3.22Å; Q634-I638 WeakPolarHBondContact O-CG1 3.41Å; Q634-I638 PolarHBondContact O-N 2.81Å; L635-I638 PolarHBondContact O-N 3.41Å; I638-L642 HydrophobicContact CG2-CD1 3.87Å; I638-L642 WeakPolarHBondContact O-CB 3.4Å; I638-L642 PolarHBondContact O-N 2.97Å; I638-L642 VanDerWaalsContact O-N 3.16Å
639	Y	71.3	Confident	60.3	Low	64 Å²	64	72.1 Å²	72.1	25%	0.251	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-46	-179.6	-179.9	-101	0	0	0	113.2	K608 F611 K612 I615 L635 N636 N637	K608-Y639 HydrophobicContact CG-CD2 4.16Å; K608-Y639 HydrophobicContact CG-CE2 3.94Å; F611-Y639 HydrophobicContact CB-CD2 4.38Å; K612-Y639 HydrophobicContact CB-CD2 4.29Å; K612-Y639 HydrophobicContact CB-CE2 3.72Å; K612-Y639 HydrophobicContact CG-CE2 4.02Å; I615-Y639 HydrophobicContact CD1-CD1 4.32Å; I615-Y639 HydrophobicContact CD1-CG 3.91Å; L635-Y639 WeakPolarHBondContact O-CB 3.33Å; L635-Y639 PolarHBondContact O-N 2.67Å; N636-Y639 PolarHBondContact O-N 3.43Å; N637-Y639 VanDerWaalsContact C-N 3.27Å; N637-Y639 PolarHBondContact O-N 2.8Å
640	N	61.4	Low	59.5	Low	104 Å²	104	70.6 Å²	70.6	56%	0.556	33%	0.327	S	S	*	.	H	α-helix	trans	-73.5	-34.9	-176.5	-70.7	-32.3	0	0	0	112.7	N636 N637	N636-N640 VanDerWaalsContact O-CB 3.26Å; N636-N640 WeakPolarHBondContact O-CB 3.46Å; N636-N640 PolarHBondContact O-N 3.17Å; N636-N640 PolarHBondContact O-ND2 2.92Å; N636-N640 PolarHBondContact OD1-ND2 2.98Å; N637-N640 PolarHBondContact O-N 3.41Å
641	T	54.6	Low	58.9	Low	51 Å²	51	64.2 Å²	64.2	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-96.6	2.8	-176.9	58.7	0	0	0	0	113.8	N569 N637 Y643	N569-T641 VanDerWaalsContact CB-OG1 3.22Å; N569-T641 WeakPolarHBondContact CB-OG1 3.26Å; N569-T641 CarbonylContact O-C 3.23Å; N569-T641 WeakPolarHBondContact O-CB 3.2Å; N569-T641 PolarHBondContact O-OG1 3.43Å; N637-T641 PolarHBondContact O-N 3.13Å; N637-T641 PolarHBondContact O-OG1 3.47Å; T641-Y643 WeakPolarHBondContact O-CD2 3.33Å; T641-Y643 PolarHBondContact O-N 3.3Å
642	L	52.8	Low	57.8	Low	16 Å²	16	64.6 Å²	64.6	8%	0.084	30%	0.304	C	S	.	.			trans	-65.8	73.2	-179	-137.4	144.7	0	0	0	111.7	L565 N569 F611 I638 T644	L565-L642 HydrophobicContact CD2-CD1 3.96Å; L565-L642 HydrophobicContact CD2-CD2 4.35Å; L565-L642 HydrophobicContact CD2-CG 4.21Å; N569-L642 PolarHBondContact O-N 3.47Å; F611-L642 HydrophobicContact CD2-CD1 4Å; F611-L642 HydrophobicContact CE2-CD1 3.96Å; I638-L642 HydrophobicContact CG2-CD1 3.87Å; I638-L642 WeakPolarHBondContact O-CB 3.4Å; I638-L642 PolarHBondContact O-N 2.97Å; I638-L642 VanDerWaalsContact O-N 3.16Å; L642-T644 HydrophobicContact CD2-CG2 3.43Å; L642-T644 VanDerWaalsContact CD2-CG2 3.43Å; L642-T644 PolarHBondContact O-N 2.92Å
643	Y	50.2	Low	56.7	Low	160 Å²	160	62.8 Å²	62.8	63%	0.627	30%	0.298	S	S	*	.			trans	-79.8	110.6	162.1	-73	-80.8	0	0	0	107.5	L571 T641 F645	L571-Y643 PolarHBondContact N-O 3.17Å; T641-Y643 WeakPolarHBondContact O-CD2 3.33Å; T641-Y643 PolarHBondContact O-N 3.3Å; Y643-F645 HydrophobicContact CD1-CE2 4.46Å; Y643-F645 HydrophobicContact CG-CE2 4.44Å
644	T	49.4	Very low	55.7	Low	64 Å²	64	61.5 Å²	61.5	39%	0.393	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	104.9	171.5	43.5	0	0	0	0	109.7	L571 I604 L642	L571-T644 HydrophobicContact CB-CG2 4.05Å; L571-T644 HydrophobicContact CD2-CG2 4.03Å; I604-T644 HydrophobicContact CD1-CG2 4.31Å; I604-T644 HydrophobicContact CG2-CG2 3.4Å; I604-T644 VanDerWaalsContact CG2-CG2 3.4Å; L642-T644 HydrophobicContact CD2-CG2 3.43Å; L642-T644 VanDerWaalsContact CD2-CG2 3.43Å; L642-T644 PolarHBondContact O-N 2.92Å
645	F	46.5	Very low	54.7	Low	90 Å²	90	60.7 Å²	60.7	40%	0.395	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	91.3	165.4	-72.8	-88.5	0	0	0	107.8	L571 K572 Y643	L571-F645 PolarHBondContact O-N 3.07Å; K572-F645 HydrophobicContact CG-CB 4.26Å; Y643-F645 HydrophobicContact CD1-CE2 4.46Å; Y643-F645 HydrophobicContact CG-CE2 4.44Å
646	I	50.9	Low	53.4	Low	35 Å²	35	66.6 Å²	66.6	18%	0.179	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	114.3	163.2	-53.1	168.2	0	0	0	104.8	Y597 I600 I601 I604	Y597-I646 HydrophobicContact CE2-CG2 4.03Å; I600-I646 HydrophobicContact CG2-CD1 3.82Å; I601-I646 HydrophobicContact CG1-CD1 3.92Å; I604-I646 HydrophobicContact CD1-CD1 3.62Å; I604-I646 HydrophobicContact CD1-CG1 4.11Å
647	Y	44.7	Very low	51.9	Low	39 Å²	39	69.9 Å²	69.9	15%	0.153	35%	0.347	C	S	.	.			trans	-59.7	125.5	176.6	-155.6	-100.6	0	0	0	108.6	Y649 S676 D679	Y647-Y649 HydrophobicContact CE1-CD2 4.15Å; Y647-Y649 PolarHBondContact O-N 2.92Å; Y647-Y649 VanDerWaalsContact O-N 3.12Å; Y647-S676 WeakPolarHBondContact CE1-OG 3.18Å; Y647-D679 HydrophobicContact CE2-CB 4.47Å; Y647-D679 WeakPolarHBondContact CE2-OD2 3.46Å
648	P	45.1	Very low	50.4	Low	86 Å²	86	73.1 Å²	73.1	56%	0.558	36%	0.364	S	S	*	.	S	Bend	trans	-68	-17.5	-164.2	24.1	-33.2	0	0	0	113.6
649	Y	49.5	Very low	49.1	Very low	154 Å²	154	80.2 Å²	80.2	60%	0.604	40%	0.402	S	S	*	.			trans	-95.8	104.4	176	-64.4	-77.8	0	0	0	109.9	Y647 N651	Y647-Y649 HydrophobicContact CE1-CD2 4.15Å; Y647-Y649 PolarHBondContact O-N 2.92Å; Y647-Y649 VanDerWaalsContact O-N 3.12Å; Y649-N651 PolarHBondContact O-N 3.46Å
650	I	50.7	Low	47.4	Very low	20 Å²	20	84.6 Å²	84.6	10%	0.103	43%	0.43	C	S	.	.			trans	-61.9	105.5	158.5	-68.2	171.7	0	0	0	106	V577 I593 L596 Y597 R652	V577-I650 HydrophobicContact CB-CG2 3.91Å; V577-I650 HydrophobicContact CG2-CG2 3.34Å; I593-I650 HydrophobicContact CG2-CB 3.98Å; I593-I650 HydrophobicContact CG2-CD1 3.62Å; I593-I650 HydrophobicContact CG2-CG1 4.34Å; I593-I650 HydrophobicContact CG2-CG2 4.11Å; L596-I650 HydrophobicContact CD2-CD1 4.45Å; Y597-I650 HydrophobicContact CD2-CD1 4.36Å; I650-R652 PolarHBondContact O-N 3.47Å
651	N	53.6	Low	46.3	Very low	13 Å²	13	86.5 Å²	86.5	7%	0.07	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	120.3	-179.7	-81.3	-34.5	0	0	0	108.4	V577 Y649 Q672	V577-N651 PolarHBondContact N-O 2.82Å; Y649-N651 PolarHBondContact O-N 3.46Å; N651-Q672 PolarHBondContact OD1-NE2 3.4Å
652	R	50.9	Low	45.4	Very low	107 Å²	107	90.9 Å²	90.9	40%	0.404	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.1	178.6	-58	177.1	-169.3	-166.3	-5.6	108.5	N590 I593 I650	N590-R652 PolarHBondContact OD1-NH1 3.12Å; N590-R652 PolarHBondContact OD1-NH2 3.44Å; I593-R652 HydrophobicContact CD1-CG 3.84Å; I593-R652 VanDerWaalsContact CD1-NE 3.35Å; I650-R652 PolarHBondContact O-N 3.47Å
653	I	51.8	Low	44.5	Very low	21 Å²	21	97.4 Å²	97.4	11%	0.108	50%	0.497	C	S	.	.			trans	-106.9	101.6	166.7	-56.3	174.2	0	0	0	105.6	L431 M442 I576 V577 I668	L431-I653 HydrophobicContact CD1-CD1 3.62Å; M442-I653 HydrophobicContact CG-CG2 4.33Å; I576-I653 HydrophobicContact CG2-CD1 3.7Å; I576-I653 HydrophobicContact CG2-CG1 4.26Å; V577-I653 PolarHBondContact O-N 2.82Å; I653-I668 HydrophobicContact CG2-CD1 3.75Å; I653-I668 HydrophobicContact CG2-CG1 4.11Å; I653-I668 HydrophobicContact CG2-CG2 4.28Å
654	S	49.4	Very low	43.8	Very low	78 Å²	78	96.9 Å²	96.9	55%	0.545	51%	0.505	S	S	.	.			trans	-122.4	143.9	177.7	64.5	0	0	0	0	111
655	L	46.6	Very low	43	Very low	50 Å²	50	102.5 Å²	102.5	26%	0.262	53%	0.527	S	S	.	.			trans	-94	-9.5	-171.4	-87	144.8	0	0	0	116.6	N440 T443 D581 N657	N440-L655 WeakPolarHBondContact ND2-CD2 3.4Å; T443-L655 HydrophobicContact CG2-CD1 3.35Å; T443-L655 HydrophobicContact CG2-CD2 3.32Å; T443-L655 HydrophobicContact CG2-CG 3.95Å; D581-L655 HydrophobicContact CB-CB 4.13Å; D581-L655 HydrophobicContact CB-CD1 4.28Å; D581-L655 WeakPolarHBondContact OD2-CD1 3.09Å; L655-N657 PolarHBondContact O-N 3.39Å; L655-N657 VanDerWaalsContact O-N 3.08Å
656	N	43.8	Very low	42.6	Very low	128 Å²	128	104 Å²	104	68%	0.684	54%	0.539	S	S	*	.			trans	-72.7	110.4	-160.7	-83	-4.9	0	0	0	115.6	N658	N656-N658 PolarHBondContact O-N 3.02Å; N656-N658 VanDerWaalsContact O-N 3.16Å
657	N	39.5	Very low	42.2	Very low	107 Å²	107	108.9 Å²	108.9	57%	0.572	56%	0.564	S	S	*	*			trans	-70.7	17.5	175.5	-94	-15.1	0	0	0	116.6	L655 N659 N666	L655-N657 PolarHBondContact O-N 3.39Å; L655-N657 VanDerWaalsContact O-N 3.08Å; N657-N659 PolarHBondContact O-N 3.26Å; N657-N666 PolarHBondContact ND2-OD1 2.89Å; N657-N666 VanDerWaalsContact ND2-OD1 3.12Å; N657-N666 PolarHBondContact OD1-OD1 3.16Å
658	N	33	Very low	42.5	Very low	141 Å²	141	108.5 Å²	108.5	75%	0.754	56%	0.564	S	S	*	*			trans	-89.8	75.7	-175.3	-76	-5.5	0	0	0	111.7	N656	N656-N658 PolarHBondContact O-N 3.02Å; N656-N658 VanDerWaalsContact O-N 3.16Å
659	N	36.2	Very low	43.1	Very low	156 Å²	156	108.9 Å²	108.9	83%	0.834	56%	0.561	S	S	*	*			trans	-148.6	100.7	143.3	-89.3	-25.5	0	0	0	107.3	N657 N661	N657-N659 PolarHBondContact O-N 3.26Å; N659-N661 VanDerWaalsContact C-N 3.33Å; N659-N661 PolarHBondContact O-N 3.33Å
660	N	35.6	Very low	44	Very low	157 Å²	157	102.8 Å²	102.8	84%	0.84	54%	0.538	S	S	*	.			trans	-53.3	100.8	162.6	-73.4	-26	0	0	0	107.8
661	N	37.1	Very low	44.8	Very low	143 Å²	143	105.7 Å²	105.7	77%	0.765	55%	0.554	S	S	*	*	S	Bend	trans	176.8	113.3	144.2	-83.7	-22.9	0	0	0	109.1	N659	N659-N661 VanDerWaalsContact C-N 3.33Å; N659-N661 PolarHBondContact O-N 3.33Å
662	N	35.9	Very low	45.5	Very low	144 Å²	144	109.6 Å²	109.6	77%	0.77	57%	0.572	S	S	*	*			trans	67.4	93.1	157.7	-57.9	-19.1	0	0	0	118.6
663	N	35	Very low	46.7	Very low	153 Å²	153	105.1 Å²	105.1	82%	0.818	56%	0.556	S	S	*	*	S	Bend	trans	31	95.8	137.7	-59.7	-11.7	0	0	0	118.4
664	N	34.3	Very low	47.8	Very low	149 Å²	149	104.5 Å²	104.5	80%	0.797	55%	0.552	S	S	*	*			trans	143.6	25.7	142.2	-74.2	-13.4	0	0	0	116.4
665	E	33.6	Very low	49	Very low	182 Å²	182	102.7 Å²	102.7	85%	0.85	53%	0.534	S	S	*	.			trans	-110.7	37.7	-172.6	-65.4	-164.7	157.3	0	0	116.8	I667	E665-I667 PolarHBondContact O-N 3.12Å
666	N	37.3	Very low	50.2	Low	122 Å²	122	100.4 Å²	100.4	65%	0.652	52%	0.522	S	S	*	.			trans	-80.8	8.1	169.8	-85.3	-11.2	0	0	0	114.1	N657	N657-N666 PolarHBondContact ND2-OD1 2.89Å; N657-N666 VanDerWaalsContact ND2-OD1 3.12Å; N657-N666 PolarHBondContact OD1-OD1 3.16Å
667	I	42.2	Very low	51.8	Low	137 Å²	137	94.4 Å²	94.4	70%	0.703	49%	0.49	S	S	*	.			trans	-97.1	108.2	-166.2	-56.2	173	0	0	0	109.8	E665 N669	E665-I667 PolarHBondContact O-N 3.12Å; I667-N669 PolarHBondContact O-N 3.01Å; I667-N669 VanDerWaalsContact O-N 3.07Å
668	I	51.1	Low	53.5	Low	31 Å²	31	89.4 Å²	89.4	16%	0.159	46%	0.463	C	S	.	.			trans	-48.4	119.1	159.8	-66.3	171	0	0	0	106.9	N440 M442 I653 F670	N440-I668 HydrophobicContact CB-CD1 4.16Å; N440-I668 VanDerWaalsContact CG-CD1 3.46Å; N440-I668 VanDerWaalsContact OD1-CD1 3.32Å; N440-I668 WeakPolarHBondContact OD1-CD1 3.3Å; M442-I668 HydrophobicContact CG-CD1 4.14Å; I653-I668 HydrophobicContact CG2-CD1 3.75Å; I653-I668 HydrophobicContact CG2-CG1 4.11Å; I653-I668 HydrophobicContact CG2-CG2 4.28Å; I668-F670 HydrophobicContact CB-CD2 4.36Å; I668-F670 HydrophobicContact CB-CE2 3.9Å; I668-F670 HydrophobicContact CB-CZ 4.01Å; I668-F670 HydrophobicContact CD1-CZ 4.36Å; I668-F670 HydrophobicContact CG2-CD1 4.21Å; I668-F670 HydrophobicContact CG2-CD2 4.34Å; I668-F670 HydrophobicContact CG2-CE1 3.93Å; I668-F670 HydrophobicContact CG2-CE2 4.08Å; I668-F670 HydrophobicContact CG2-CG 4.39Å; I668-F670 HydrophobicContact CG2-CZ 3.85Å; I668-F670 WeakPolarHBondContact O-CD2 3.07Å; I668-F670 PolarHBondContact O-N 2.87Å
669	N	58.6	Low	55.4	Low	93 Å²	93	83.5 Å²	83.5	50%	0.497	43%	0.431	S	S	.	.			trans	-74.6	72.7	-175.1	-166.8	-4.7	0	0	0	111.1	I667 N671 Q672	I667-N669 PolarHBondContact O-N 3.01Å; I667-N669 VanDerWaalsContact O-N 3.07Å; N669-N671 PolarHBondContact O-N 3.5Å; N669-N671 VanDerWaalsContact OD1-CB 3.29Å; N669-N671 WeakPolarHBondContact OD1-CB 3.33Å; N669-N671 PolarHBondContact OD1-N 3.45Å; N669-Q672 PolarHBondContact O-N 3.15Å
670	F	67.3	Low	57.1	Low	26 Å²	26	76.4 Å²	76.4	11%	0.114	39%	0.393	C	S	.	.	H	α-helix	trans	-55.4	-22.1	175.6	-66.5	-72.4	0	0	0	112	S434 I435 I668 Q672 L673 Y674	S434-F670 WeakPolarHBondContact O-CZ 3.31Å; I435-F670 HydrophobicContact CG1-CD1 3.8Å; I435-F670 HydrophobicContact CG1-CE1 3.68Å; I668-F670 HydrophobicContact CB-CD2 4.36Å; I668-F670 HydrophobicContact CB-CE2 3.9Å; I668-F670 HydrophobicContact CB-CZ 4.01Å; I668-F670 HydrophobicContact CD1-CZ 4.36Å; I668-F670 HydrophobicContact CG2-CD1 4.21Å; I668-F670 HydrophobicContact CG2-CD2 4.34Å; I668-F670 HydrophobicContact CG2-CE1 3.93Å; I668-F670 HydrophobicContact CG2-CE2 4.08Å; I668-F670 HydrophobicContact CG2-CG 4.39Å; I668-F670 HydrophobicContact CG2-CZ 3.85Å; I668-F670 WeakPolarHBondContact O-CD2 3.07Å; I668-F670 PolarHBondContact O-N 2.87Å; F670-Q672 PolarHBondContact O-N 3.48Å; F670-L673 WeakPolarHBondContact O-CA 3.47Å; F670-L673 VanDerWaalsContact O-CB 3.31Å; F670-L673 WeakPolarHBondContact O-CB 3.41Å; F670-L673 PolarHBondContact O-N 3.18Å; F670-L673 VanDerWaalsContact O-N 3.07Å; F670-Y674 HydrophobicContact CB-CD2 4.13Å; F670-Y674 HydrophobicContact CB-CE2 3.75Å; F670-Y674 WeakPolarHBondContact O-CD2 3.45Å; F670-Y674 PolarHBondContact O-N 2.83Å
671	N	67.5	Low	58.8	Low	81 Å²	81	69 Å²	69	43%	0.433	35%	0.353	S	S	.	.	H	α-helix	trans	-61.8	-31.4	176	-60	-28.7	0	0	0	112.6	N669 Y675	N669-N671 PolarHBondContact O-N 3.5Å; N669-N671 VanDerWaalsContact OD1-CB 3.29Å; N669-N671 WeakPolarHBondContact OD1-CB 3.33Å; N669-N671 PolarHBondContact OD1-N 3.45Å; N671-Y675 WeakPolarHBondContact O-CB 3.33Å; N671-Y675 PolarHBondContact O-N 3.23Å
672	Q	69.4	Low	60.2	Low	95 Å²	95	64.2 Å²	64.2	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-68.8	-38	174.1	-173.8	175.8	-1.7	0	0	111.7	N651 N669 F670 S676	N651-Q672 PolarHBondContact OD1-NE2 3.4Å; N669-Q672 PolarHBondContact O-N 3.15Å; F670-Q672 PolarHBondContact O-N 3.48Å; Q672-S676 PolarHBondContact O-N 2.92Å; Q672-S676 PolarHBondContact O-OG 3.23Å
673	L	74.7	Confident	61.4	Low	13 Å²	13	63 Å²	63	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-62.8	-51.2	173.1	-177.3	96.3	0	0	0	110.2	I435 I520 I576 F670 Y675 S676 I677	I435-L673 HydrophobicContact CD1-CD2 3.69Å; I435-L673 HydrophobicContact CG1-CD2 4.21Å; I520-L673 HydrophobicContact CD1-CD1 4.5Å; I576-L673 HydrophobicContact CD1-CD1 3.3Å; I576-L673 HydrophobicContact CG1-CD1 4.25Å; F670-L673 WeakPolarHBondContact O-CA 3.47Å; F670-L673 VanDerWaalsContact O-CB 3.31Å; F670-L673 WeakPolarHBondContact O-CB 3.41Å; F670-L673 PolarHBondContact O-N 3.18Å; F670-L673 VanDerWaalsContact O-N 3.07Å; L673-Y675 PolarHBondContact O-N 3.4Å; L673-S676 WeakPolarHBondContact O-CB 3.42Å; L673-S676 PolarHBondContact O-N 3.07Å; L673-S676 VanDerWaalsContact O-N 3.15Å; L673-I677 HydrophobicContact CD2-CD1 3.81Å; L673-I677 HydrophobicContact CG-CD1 3.75Å; L673-I677 WeakPolarHBondContact O-CD1 3.44Å; L673-I677 VanDerWaalsContact O-CG1 3.3Å; L673-I677 WeakPolarHBondContact O-CG1 3.49Å; L673-I677 PolarHBondContact O-N 3.47Å
674	Y	76.4	Confident	62.5	Low	8 Å²	8	55.9 Å²	55.9	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-47.1	177.6	-67.8	-59.8	0	0	0	111.3	I435 Y460 I494 F670 S676 I677 F678	I435-Y674 HydrophobicContact CG2-CE1 4.46Å; I435-Y674 WeakPolarHBondContact CG2-OH 3.35Å; Y460-Y674 AromaticContact CD2-CD1 3.79Å; Y460-Y674 HydrophobicContact CD2-CD1 3.79Å; Y460-Y674 AromaticContact CD2-CD2 3.78Å; Y460-Y674 HydrophobicContact CD2-CD2 3.78Å; Y460-Y674 AromaticContact CD2-CE1 3.81Å; Y460-Y674 HydrophobicContact CD2-CE1 3.81Å; Y460-Y674 AromaticContact CD2-CE2 3.8Å; Y460-Y674 HydrophobicContact CD2-CE2 3.8Å; Y460-Y674 AromaticContact CD2-CG 3.79Å; Y460-Y674 HydrophobicContact CD2-CG 3.79Å; Y460-Y674 AromaticContact CD2-CZ 3.81Å; Y460-Y674 HydrophobicContact CE1-CG 4.31Å; Y460-Y674 AromaticContact CE2-CD1 3.91Å; Y460-Y674 HydrophobicContact CE2-CD1 3.91Å; Y460-Y674 AromaticContact CE2-CD2 3.2Å; Y460-Y674 HydrophobicContact CE2-CD2 3.2Å; Y460-Y674 HydrophobicContact CE2-CE1 4.24Å; Y460-Y674 AromaticContact CE2-CE2 3.61Å; Y460-Y674 HydrophobicContact CE2-CE2 3.61Å; Y460-Y674 AromaticContact CE2-CG 3.39Å; Y460-Y674 HydrophobicContact CE2-CG 3.39Å; Y460-Y674 HydrophobicContact CG-CD1 4.16Å; Y460-Y674 HydrophobicContact CG-CE1 4.32Å; Y460-Y674 HydrophobicContact CG-CG 4.41Å; Y460-Y674 AromaticContact CZ-CD2 3.83Å; Y460-Y674 AromaticContact CZ-CG 3.67Å; I494-Y674 HydrophobicContact CD1-CD1 3.57Å; I494-Y674 HydrophobicContact CD1-CE1 3.65Å; F670-Y674 HydrophobicContact CB-CD2 4.13Å; F670-Y674 HydrophobicContact CB-CE2 3.75Å; F670-Y674 WeakPolarHBondContact O-CD2 3.45Å; F670-Y674 PolarHBondContact O-N 2.83Å; Y674-S676 VanDerWaalsContact C-N 3.32Å; Y674-S676 PolarHBondContact O-N 2.97Å; Y674-I677 HydrophobicContact CD1-CD1 4.47Å; Y674-I677 WeakPolarHBondContact O-CB 3.43Å; Y674-I677 PolarHBondContact O-N 3.28Å; Y674-I677 VanDerWaalsContact O-N 3.14Å; Y674-F678 VanDerWaalsContact O-CD2 3.25Å; Y674-F678 WeakPolarHBondContact O-CD2 3.01Å; Y674-F678 PolarHBondContact O-N 3.47Å
675	Y	72.9	Confident	63.3	Low	41 Å²	41	53.6 Å²	53.6	16%	0.161	27%	0.27	C	S	.	.	H	α-helix	trans	-53.8	-47.7	174.4	-177	-93.9	0	0	0	112.3	L465 K468 L469 N671 L673 I677 F678 D679	L465-Y675 HydrophobicContact CD2-CD2 4.06Å; K468-Y675 HydrophobicContact CB-CD2 4.12Å; K468-Y675 HydrophobicContact CB-CE2 3.59Å; K468-Y675 PolarHBondContact O-OH 2.89Å; L469-Y675 HydrophobicContact CD2-CD2 4.08Å; L469-Y675 HydrophobicContact CD2-CE2 3.6Å; L469-Y675 HydrophobicContact CG-CD2 4.32Å; L469-Y675 HydrophobicContact CG-CE2 3.86Å; N671-Y675 WeakPolarHBondContact O-CB 3.33Å; N671-Y675 PolarHBondContact O-N 3.23Å; L673-Y675 PolarHBondContact O-N 3.4Å; Y675-I677 VanDerWaalsContact C-N 3.33Å; Y675-I677 PolarHBondContact O-N 2.87Å; Y675-F678 PolarHBondContact O-N 3.39Å; Y675-D679 WeakPolarHBondContact O-CB 3.11Å; Y675-D679 PolarHBondContact O-N 2.99Å
676	S	73.3	Confident	64.2	Low	2 Å²	2	47.4 Å²	47.4	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-38.8	179.5	-52.3	0	0	0	0	112.2	Y647 Q672 L673 Y674 L680	Y647-S676 WeakPolarHBondContact CE1-OG 3.18Å; Q672-S676 PolarHBondContact O-N 2.92Å; Q672-S676 PolarHBondContact O-OG 3.23Å; L673-S676 WeakPolarHBondContact O-CB 3.42Å; L673-S676 PolarHBondContact O-N 3.07Å; L673-S676 VanDerWaalsContact O-N 3.15Å; Y674-S676 VanDerWaalsContact C-N 3.32Å; Y674-S676 PolarHBondContact O-N 2.97Å; S676-L680 WeakPolarHBondContact O-CB 3.35Å; S676-L680 PolarHBondContact O-N 3.32Å; S676-L680 VanDerWaalsContact O-N 3.09Å
677	I	77.5	Confident	65.1	Low	1 Å²	1	42 Å²	42	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-48.5	176	-69.4	157.5	0	0	0	110.4	I416 I418 I518 I520 I574 L673 Y674 Y675 L680 A681	I416-I677 HydrophobicContact CD1-CG2 4.12Å; I416-I677 HydrophobicContact CG2-CG2 3.86Å; I418-I677 HydrophobicContact CD1-CD1 3.42Å; I418-I677 VanDerWaalsContact CD1-CD1 3.42Å; I418-I677 HydrophobicContact CD1-CG1 3.93Å; I418-I677 HydrophobicContact CD1-CG2 3.79Å; I418-I677 HydrophobicContact CG1-CG2 4.35Å; I518-I677 HydrophobicContact CD1-CG2 4.01Å; I518-I677 WeakPolarHBondContact CD1-O 3.35Å; I520-I677 HydrophobicContact CD1-CD1 4.43Å; I574-I677 HydrophobicContact CD1-CG1 3.88Å; L673-I677 HydrophobicContact CD2-CD1 3.81Å; L673-I677 HydrophobicContact CG-CD1 3.75Å; L673-I677 WeakPolarHBondContact O-CD1 3.44Å; L673-I677 VanDerWaalsContact O-CG1 3.3Å; L673-I677 WeakPolarHBondContact O-CG1 3.49Å; L673-I677 PolarHBondContact O-N 3.47Å; Y674-I677 HydrophobicContact CD1-CD1 4.47Å; Y674-I677 WeakPolarHBondContact O-CB 3.43Å; Y674-I677 PolarHBondContact O-N 3.28Å; Y674-I677 VanDerWaalsContact O-N 3.14Å; Y675-I677 VanDerWaalsContact C-N 3.33Å; Y675-I677 PolarHBondContact O-N 2.87Å; I677-L680 PolarHBondContact O-N 3.42Å; I677-A681 WeakPolarHBondContact O-CB 3.43Å; I677-A681 PolarHBondContact O-N 2.89Å
678	F	75	Confident	65.3	Low	2 Å²	2	40.6 Å²	40.6	1%	0.009	21%	0.209	C	C	.	.	H	α-helix	trans	-70	-40.5	-177.8	-83.7	-82	0	0	0	112.5	I416 Y460 A462 L465 L469 T492 I494 Y674 Y675 L680 A681 M682	I416-F678 HydrophobicContact CD1-CD1 3.6Å; I416-F678 HydrophobicContact CD1-CD2 4.45Å; I416-F678 HydrophobicContact CD1-CE1 3.45Å; I416-F678 VanDerWaalsContact CD1-CE1 3.45Å; I416-F678 HydrophobicContact CD1-CE2 4.33Å; I416-F678 HydrophobicContact CD1-CG 4.12Å; I416-F678 HydrophobicContact CD1-CZ 3.84Å; Y460-F678 HydrophobicContact CD1-CD2 4.36Å; Y460-F678 AromaticContact CD1-CE2 3.33Å; Y460-F678 HydrophobicContact CD1-CE2 3.33Å; Y460-F678 AromaticContact CD1-CZ 3.75Å; Y460-F678 HydrophobicContact CD1-CZ 3.75Å; Y460-F678 HydrophobicContact CE1-CD2 4.23Å; Y460-F678 AromaticContact CE1-CE2 3.61Å; Y460-F678 HydrophobicContact CE1-CE2 3.61Å; Y460-F678 HydrophobicContact CE1-CZ 4.32Å; Y460-F678 HydrophobicContact CG-CE2 4.27Å; A462-F678 HydrophobicContact CB-CD1 4.15Å; A462-F678 HydrophobicContact CB-CE1 3.54Å; A462-F678 HydrophobicContact CB-CZ 3.81Å; L465-F678 HydrophobicContact CD1-CB 4.08Å; L465-F678 HydrophobicContact CD1-CD2 3.35Å; L465-F678 HydrophobicContact CD1-CE2 4.01Å; L465-F678 HydrophobicContact CD1-CG 3.9Å; L469-F678 HydrophobicContact CD1-CB 4.31Å; T492-F678 HydrophobicContact CG2-CE1 4.39Å; I494-F678 HydrophobicContact CD1-CE2 3.95Å; I494-F678 HydrophobicContact CD1-CZ 4.33Å; Y674-F678 VanDerWaalsContact O-CD2 3.25Å; Y674-F678 WeakPolarHBondContact O-CD2 3.01Å; Y674-F678 PolarHBondContact O-N 3.47Å; Y675-F678 PolarHBondContact O-N 3.39Å; F678-L680 VanDerWaalsContact C-N 3.35Å; F678-L680 PolarHBondContact O-N 3.05Å; F678-A681 PolarHBondContact O-N 3.44Å; F678-M682 WeakPolarHBondContact O-CB 3.33Å; F678-M682 WeakPolarHBondContact O-CG 3.48Å; F678-M682 PolarHBondContact O-N 2.74Å
679	D	71.5	Confident	65.2	Low	17 Å²	17	41.1 Å²	41.1	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-45	174.9	-178.2	45.5	0	0	0	111	L469 Y647 Y675 A681 M682 K683	L469-D679 HydrophobicContact CD2-CB 3.72Å; Y647-D679 HydrophobicContact CE2-CB 4.47Å; Y647-D679 WeakPolarHBondContact CE2-OD2 3.46Å; Y675-D679 WeakPolarHBondContact O-CB 3.11Å; Y675-D679 PolarHBondContact O-N 2.99Å; D679-A681 PolarHBondContact O-N 3.11Å; D679-M682 PolarHBondContact O-N 3.08Å; D679-K683 VanDerWaalsContact CG-NZ 3.27Å; D679-K683 WeakPolarHBondContact O-CB 3.04Å; D679-K683 WeakPolarHBondContact O-CG 3.39Å; D679-K683 PolarHBondContact O-N 3.16Å; D679-K683 WeakPolarHBondContact OD1-CE 3.39Å; D679-K683 IonicContact OD1-NZ 2.88Å; D679-K683 PolarHBondContact OD1-NZ 2.9Å; D679-K683 WeakPolarHBondContact OD2-CE 3.3Å; D679-K683 IonicContact OD2-NZ 3.7Å; D679-K683 PolarHBondContact OD2-NZ 3.48Å
680	L	72.8	Confident	64.8	Low	8 Å²	8	39.6 Å²	39.6	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-37.1	176.4	-170.6	141.2	0	0	0	112	I518 K572 I574 S676 I677 F678 T684	I518-L680 HydrophobicContact CB-CD2 4.31Å; I518-L680 HydrophobicContact CD1-CD2 3.7Å; I518-L680 HydrophobicContact CG1-CD2 3.64Å; I518-L680 HydrophobicContact CG2-CD2 3.86Å; K572-L680 HydrophobicContact CB-CD2 4.2Å; I574-L680 HydrophobicContact CG1-CD1 4.26Å; S676-L680 WeakPolarHBondContact O-CB 3.35Å; S676-L680 PolarHBondContact O-N 3.32Å; S676-L680 VanDerWaalsContact O-N 3.09Å; I677-L680 PolarHBondContact O-N 3.42Å; F678-L680 VanDerWaalsContact C-N 3.35Å; F678-L680 PolarHBondContact O-N 3.05Å; L680-T684 PolarHBondContact O-N 3.31Å; L680-T684 PolarHBondContact O-OG1 3.19Å
681	A	71.6	Confident	63.9	Low	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-45.9	172.6	0	0	0	0	0	111.7	I416 I518 I677 F678 D679 T684 Y687	I416-A681 HydrophobicContact CD1-CB 3.95Å; I416-A681 HydrophobicContact CG1-CB 4.48Å; I518-A681 HydrophobicContact CD1-CB 3.95Å; I677-A681 WeakPolarHBondContact O-CB 3.43Å; I677-A681 PolarHBondContact O-N 2.89Å; F678-A681 PolarHBondContact O-N 3.44Å; D679-A681 PolarHBondContact O-N 3.11Å; A681-T684 WeakPolarHBondContact O-CA 3.18Å; A681-T684 VanDerWaalsContact O-CB 3.29Å; A681-T684 WeakPolarHBondContact O-CB 3.32Å; A681-T684 PolarHBondContact O-N 2.63Å; A681-Y687 HydrophobicContact CB-CG 4.37Å; A681-Y687 WeakPolarHBondContact O-CB 3.22Å
682	M	65.5	Low	62.9	Low	44 Å²	44	37.3 Å²	37.3	22%	0.217	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-39.2	179.4	-74	-63	124.1	0	0	112.7	F678 D679 T684 I688 C691 L692	F678-M682 WeakPolarHBondContact O-CB 3.33Å; F678-M682 WeakPolarHBondContact O-CG 3.48Å; F678-M682 PolarHBondContact O-N 2.74Å; D679-M682 PolarHBondContact O-N 3.08Å; M682-T684 PolarHBondContact O-N 3.06Å; M682-T684 VanDerWaalsContact O-N 3.14Å; M682-I688 WeakPolarHBondContact O-CG1 3.44Å; M682-C691 HydrophobicContact CE-CB 3.86Å; M682-L692 HydrophobicContact CE-CD1 3.21Å; M682-L692 HydrophobicContact CE-CD2 4.48Å; M682-L692 HydrophobicContact CE-CG 3.53Å; M682-L692 HydrophobicContact SD-CD1 3.67Å
683	K	62.3	Low	61.9	Low	117 Å²	117	38.1 Å²	38.1	51%	0.509	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	1.5	172.8	-70.5	170.8	178.7	161.5	0	113	K572 D679	K572-K683 PolarHBondContact NZ-O 2.97Å; D679-K683 VanDerWaalsContact CG-NZ 3.27Å; D679-K683 WeakPolarHBondContact O-CB 3.04Å; D679-K683 WeakPolarHBondContact O-CG 3.39Å; D679-K683 PolarHBondContact O-N 3.16Å; D679-K683 WeakPolarHBondContact OD1-CE 3.39Å; D679-K683 IonicContact OD1-NZ 2.88Å; D679-K683 PolarHBondContact OD1-NZ 2.9Å; D679-K683 WeakPolarHBondContact OD2-CE 3.3Å; D679-K683 IonicContact OD2-NZ 3.7Å; D679-K683 PolarHBondContact OD2-NZ 3.48Å
684	T	57.6	Low	60.6	Low	4 Å²	4	40.8 Å²	40.8	3%	0.025	21%	0.213	C	C	.	.			trans	-101	114.2	179.6	-57.8	0	0	0	0	111.8	K572 L680 A681 M682 T686 Y687	K572-T684 HydrophobicContact CD-CG2 4.25Å; K572-T684 WeakPolarHBondContact CD-OG1 3.41Å; K572-T684 VanDerWaalsContact NZ-CA 3.26Å; K572-T684 VanDerWaalsContact NZ-CB 3.33Å; K572-T684 PolarHBondContact NZ-OG1 3.46Å; L680-T684 PolarHBondContact O-N 3.31Å; L680-T684 PolarHBondContact O-OG1 3.19Å; A681-T684 WeakPolarHBondContact O-CA 3.18Å; A681-T684 VanDerWaalsContact O-CB 3.29Å; A681-T684 WeakPolarHBondContact O-CB 3.32Å; A681-T684 PolarHBondContact O-N 2.63Å; M682-T684 PolarHBondContact O-N 3.06Å; M682-T684 VanDerWaalsContact O-N 3.14Å; T684-T686 WeakPolarHBondContact CG2-OG1 3.45Å; T684-T686 PolarHBondContact O-N 3.47Å; T684-Y687 HydrophobicContact CG2-CD2 3.87Å; T684-Y687 PolarHBondContact O-N 2.81Å
685	P	51.8	Low	59.5	Low	101 Å²	101	42.1 Å²	42.1	66%	0.656	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-34.4	-174.9	-25.5	32	0	0	0	113.5	Y687	P685-Y687 VanDerWaalsContact C-N 3.32Å; P685-Y687 PolarHBondContact O-N 2.94Å
686	T	52.9	Low	58.9	Low	53 Å²	53	42.7 Å²	42.7	33%	0.325	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-19.4	-179.3	59.1	0	0	0	0	113.6	T684 F690	T684-T686 WeakPolarHBondContact CG2-OG1 3.45Å; T684-T686 PolarHBondContact O-N 3.47Å; T686-F690 WeakPolarHBondContact O-CD2 3.03Å; T686-F690 WeakPolarHBondContact O-CE2 3.4Å
687	Y	54.8	Low	58.3	Low	7 Å²	7	48.5 Å²	48.5	3%	0.027	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-26	-172.8	-100.5	-67.7	0	0	0	113.6	I416 K417 S516 I518 A681 T684 P685 P689 F690 C691	I416-Y687 HydrophobicContact CG1-CE1 4.31Å; I416-Y687 HydrophobicContact CG2-CE1 4.45Å; K417-Y687 PolarHBondContact N-OH 3.07Å; K417-Y687 PolarHBondContact O-OH 3.23Å; S516-Y687 WeakPolarHBondContact O-CE2 3.47Å; S516-Y687 PolarHBondContact O-OH 2.95Å; I518-Y687 HydrophobicContact CD1-CE2 4.4Å; I518-Y687 HydrophobicContact CG1-CE2 4.03Å; A681-Y687 HydrophobicContact CB-CG 4.37Å; A681-Y687 WeakPolarHBondContact O-CB 3.22Å; T684-Y687 HydrophobicContact CG2-CD2 3.87Å; T684-Y687 PolarHBondContact O-N 2.81Å; P685-Y687 VanDerWaalsContact C-N 3.32Å; P685-Y687 PolarHBondContact O-N 2.94Å; Y687-P689 VanDerWaalsContact C-N 3.28Å; Y687-P689 VanDerWaalsContact O-N 3.13Å; Y687-F690 PolarHBondContact O-N 3.43Å; Y687-C691 WeakPolarHBondContact CD1-SG 3.41Å; Y687-C691 PolarHBondContact O-N 2.73Å
688	I	47.4	Very low	57.9	Low	108 Å²	108	51.1 Å²	51.1	55%	0.554	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-37.2	-176.1	-65.3	172.7	0	0	0	113.6	M682 F690	M682-I688 WeakPolarHBondContact O-CG1 3.44Å; I688-F690 VanDerWaalsContact C-N 3.34Å; I688-F690 PolarHBondContact O-N 3.5Å
689	P	49.3	Very low	57.7	Low	43 Å²	43	52.2 Å²	52.2	28%	0.279	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.6	177.1	-16.8	31.2	0	0	0	114.8	Y687	Y687-P689 VanDerWaalsContact C-N 3.28Å; Y687-P689 VanDerWaalsContact O-N 3.13Å
690	F	48.8	Very low	57.3	Low	61 Å²	61	55.9 Å²	55.9	27%	0.268	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-34.5	-160.5	-62.6	-67.9	0	0	0	114.1	Y414 T686 Y687 I688	Y414-F690 HydrophobicContact CD1-CD1 4.12Å; Y414-F690 AromaticContact CD2-CD1 3.6Å; Y414-F690 HydrophobicContact CD2-CD1 3.6Å; Y414-F690 HydrophobicContact CD2-CE1 4.36Å; Y414-F690 HydrophobicContact CD2-CG 4.49Å; Y414-F690 HydrophobicContact CE1-CD1 4.35Å; Y414-F690 AromaticContact CE2-CD1 3.85Å; Y414-F690 HydrophobicContact CE2-CD1 3.85Å; Y414-F690 HydrophobicContact CE2-CE1 4.16Å; Y414-F690 HydrophobicContact CG-CB 4.13Å; Y414-F690 AromaticContact CG-CD1 3.73Å; Y414-F690 HydrophobicContact CG-CD1 3.73Å; Y414-F690 HydrophobicContact CG-CG 4.29Å; T686-F690 WeakPolarHBondContact O-CD2 3.03Å; T686-F690 WeakPolarHBondContact O-CE2 3.4Å; Y687-F690 PolarHBondContact O-N 3.43Å; I688-F690 VanDerWaalsContact C-N 3.34Å; I688-F690 PolarHBondContact O-N 3.5Å
691	C	49.7	Very low	57.2	Low	8 Å²	8	59.5 Å²	59.5	5%	0.054	32%	0.316	C	S	.	.	S	Bend	trans	-80.4	-25.8	-167	-74.6	0	0	0	0	116.3	I416 T492 M682 Y687	I416-C691 WeakPolarHBondContact CG1-SG 3.49Å; T492-C691 VanDerWaalsContact CG2-O 3.29Å; T492-C691 WeakPolarHBondContact CG2-O 3.21Å; M682-C691 HydrophobicContact CE-CB 3.86Å; Y687-C691 WeakPolarHBondContact CD1-SG 3.41Å; Y687-C691 PolarHBondContact O-N 2.73Å
692	L	46.2	Very low	57.4	Low	50 Å²	50	59.5 Å²	59.5	26%	0.262	32%	0.316	S	S	.	.	S	Bend	trans	-132.2	3	-163.1	-67	-179	0	0	0	116.2	A462 M682	A462-L692 HydrophobicContact CB-CD2 3.83Å; M682-L692 HydrophobicContact CE-CD1 3.21Å; M682-L692 HydrophobicContact CE-CD2 4.48Å; M682-L692 HydrophobicContact CE-CG 3.53Å; M682-L692 HydrophobicContact SD-CD1 3.67Å
693	K	47.5	Very low	57.7	Low	112 Å²	112	58.5 Å²	58.5	49%	0.487	31%	0.311	S	S	.	.	S	Bend	trans	-133.1	128.8	175.1	-71.7	-172.6	178.8	-179.5	0	111.4	L695	K693-L695 PolarHBondContact O-N 2.99Å; K693-L695 VanDerWaalsContact O-N 3.09Å
694	P	48.5	Very low	57.9	Low	70 Å²	70	54.8 Å²	54.8	46%	0.455	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-57.1	120.5	165.4	24.2	-30.9	0	0	0	107.6	Y413 P696	Y413-P694 HydrophobicContact CE1-CB 4.3Å; P694-P696 VanDerWaalsContact O-CD 3.27Å; P694-P696 WeakPolarHBondContact O-CD 3.47Å
695	L	53	Low	58.7	Low	35 Å²	35	57.1 Å²	57.1	18%	0.183	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-59.9	119.5	172	-89.8	151.8	0	0	0	107.3	Y414 K693 N697 W699 Y757	Y414-L695 HydrophobicContact CD2-CD1 4.05Å; Y414-L695 HydrophobicContact CE2-CD1 3.75Å; K693-L695 PolarHBondContact O-N 2.99Å; K693-L695 VanDerWaalsContact O-N 3.09Å; L695-N697 PolarHBondContact O-N 3.12Å; L695-W699 HydrophobicContact CD2-CD2 4.23Å; L695-W699 HydrophobicContact CD2-CE3 3.31Å; L695-W699 HydrophobicContact CD2-CZ3 3.73Å; L695-Y757 HydrophobicContact CD2-CD2 4.1Å; L695-Y757 HydrophobicContact CD2-CE2 3.75Å
696	P	59.6	Low	59.7	Low	54 Å²	54	52.5 Å²	52.5	35%	0.351	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-57.1	127.3	176.1	-24.7	35.3	0	0	0	108.9	P694 I698 W699	P694-P696 VanDerWaalsContact O-CD 3.27Å; P694-P696 WeakPolarHBondContact O-CD 3.47Å; P696-I698 HydrophobicContact CB-CG2 4.04Å; P696-I698 PolarHBondContact O-N 2.66Å; P696-W699 HydrophobicContact CB-CG 4.41Å; P696-W699 HydrophobicContact CG-CD2 4.37Å; P696-W699 HydrophobicContact CG-CZ2 4.21Å; P696-W699 WeakPolarHBondContact O-CB 3.46Å; P696-W699 PolarHBondContact O-N 2.89Å
697	N	61.5	Low	60.2	Low	123 Å²	123	52.6 Å²	52.6	66%	0.658	27%	0.273	S	S	*	.	H	α-helix	trans	-48.7	-33.1	-178.3	-73.7	-12.7	0	0	0	112.5	L695 W699 L700 D701	L695-N697 PolarHBondContact O-N 3.12Å; N697-W699 PolarHBondContact O-N 3.46Å; N697-L700 WeakPolarHBondContact O-CB 2.83Å; N697-L700 PolarHBondContact O-N 2.65Å; N697-L700 VanDerWaalsContact O-N 3.14Å; N697-D701 PolarHBondContact O-N 2.86Å
698	I	69.4	Low	60.6	Low	57 Å²	57	56 Å²	56	29%	0.292	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-25.9	178	-152.4	164.6	0	0	0	113.7	P696 D701 I702 F744 L746	P696-I698 HydrophobicContact CB-CG2 4.04Å; P696-I698 PolarHBondContact O-N 2.66Å; I698-D701 PolarHBondContact O-N 3.24Å; I698-I702 WeakPolarHBondContact O-CD1 3.47Å; I698-I702 WeakPolarHBondContact O-CG1 3.22Å; I698-I702 PolarHBondContact O-N 3.38Å; I698-F744 HydrophobicContact CD1-CB 3.9Å; I698-F744 HydrophobicContact CD1-CD1 4.08Å; I698-F744 HydrophobicContact CD1-CG 4.48Å; I698-F744 WeakPolarHBondContact CD1-O 3.33Å; I698-F744 HydrophobicContact CG1-CB 4.23Å; I698-F744 HydrophobicContact CG1-CD1 3.73Å; I698-F744 HydrophobicContact CG1-CG 4.36Å; I698-L746 HydrophobicContact CG2-CD2 4.31Å
699	W	68.9	Low	61.1	Low	25 Å²	25	52.1 Å²	52.1	10%	0.095	27%	0.272	C	S	.	.	H	α-helix	trans	-70.1	-35.3	178.2	-68.4	14.3	0	0	0	111.7	L695 P696 N697 I702 E703 Q753 L754 Y757	L695-W699 HydrophobicContact CD2-CD2 4.23Å; L695-W699 HydrophobicContact CD2-CE3 3.31Å; L695-W699 HydrophobicContact CD2-CZ3 3.73Å; P696-W699 HydrophobicContact CB-CG 4.41Å; P696-W699 HydrophobicContact CG-CD2 4.37Å; P696-W699 HydrophobicContact CG-CZ2 4.21Å; P696-W699 WeakPolarHBondContact O-CB 3.46Å; P696-W699 PolarHBondContact O-N 2.89Å; N697-W699 PolarHBondContact O-N 3.46Å; W699-I702 PolarHBondContact O-N 2.89Å; W699-E703 PolarHBondContact O-N 3.28Å; W699-Q753 HydrophobicContact CH2-CB 3.87Å; W699-Q753 HydrophobicContact CZ2-CB 3.96Å; W699-L754 HydrophobicContact CB-CD1 4.19Å; W699-L754 HydrophobicContact CD2-CD1 3.99Å; W699-L754 HydrophobicContact CG-CD1 3.76Å; W699-Y757 AromaticContact CE3-CD1 3.82Å; W699-Y757 HydrophobicContact CE3-CD1 3.82Å; W699-Y757 HydrophobicContact CE3-CD2 4.01Å; W699-Y757 HydrophobicContact CE3-CE1 4.36Å; W699-Y757 AromaticContact CE3-CG 3.64Å; W699-Y757 HydrophobicContact CE3-CG 3.64Å; W699-Y757 HydrophobicContact CZ3-CD1 4.44Å; W699-Y757 HydrophobicContact CZ3-CD2 4.07Å; W699-Y757 AromaticContact CZ3-CG 3.82Å; W699-Y757 HydrophobicContact CZ3-CG 3.82Å
700	L	63.5	Low	61.3	Low	93 Å²	93	55 Å²	55	49%	0.487	28%	0.28	S	S	.	.	H	α-helix	trans	-68.2	-38.5	173.6	-164.7	76.2	0	0	0	110.9	N697 I702 E703 L704	N697-L700 WeakPolarHBondContact O-CB 2.83Å; N697-L700 PolarHBondContact O-N 2.65Å; N697-L700 VanDerWaalsContact O-N 3.14Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 3.46Å; L700-E703 PolarHBondContact O-N 3.04Å; L700-L704 WeakPolarHBondContact O-CG 3.48Å; L700-L704 PolarHBondContact O-N 3.05Å; L700-L704 VanDerWaalsContact O-N 3.09Å
701	D	71.1	Confident	61	Low	84 Å²	84	57.5 Å²	57.5	45%	0.449	29%	0.289	S	S	.	.	H	α-helix	trans	-64.5	-36.1	174.6	-64.2	-30.7	0	0	0	111.7	N697 I698 L704 Y705 F744	N697-D701 PolarHBondContact O-N 2.86Å; I698-D701 PolarHBondContact O-N 3.24Å; D701-L704 PolarHBondContact O-N 3Å; D701-Y705 WeakPolarHBondContact O-CB 3.35Å; D701-Y705 PolarHBondContact O-N 3.39Å; D701-F744 HydrophobicContact CB-CE1 4.29Å
702	I	75.9	Confident	60.5	Low	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-44	173.9	-69.3	163	0	0	0	111.2	I698 W699 L700 L704 Y705 L706 I740 F744 L746 L754 L758	I698-I702 WeakPolarHBondContact O-CD1 3.47Å; I698-I702 WeakPolarHBondContact O-CG1 3.22Å; I698-I702 PolarHBondContact O-N 3.38Å; W699-I702 PolarHBondContact O-N 2.89Å; L700-I702 VanDerWaalsContact C-N 3.3Å; L700-I702 PolarHBondContact O-N 3.46Å; I702-L704 VanDerWaalsContact C-N 3.3Å; I702-L704 PolarHBondContact O-N 3.18Å; I702-Y705 WeakPolarHBondContact O-CB 3.1Å; I702-Y705 PolarHBondContact O-N 2.77Å; I702-L706 HydrophobicContact CG2-CD1 4.19Å; I702-L706 HydrophobicContact CG2-CG 4.38Å; I702-L706 WeakPolarHBondContact O-CG 3.5Å; I702-L706 PolarHBondContact O-N 3.31Å; I702-I740 HydrophobicContact CD1-CG2 4.32Å; I702-I740 HydrophobicContact CG2-CD1 4.2Å; I702-F744 HydrophobicContact CB-CE2 4.38Å; I702-F744 HydrophobicContact CB-CZ 4.38Å; I702-F744 HydrophobicContact CD1-CB 4.19Å; I702-F744 HydrophobicContact CD1-CD1 4.35Å; I702-F744 HydrophobicContact CD1-CD2 4.05Å; I702-F744 HydrophobicContact CD1-CG 3.94Å; I702-F744 HydrophobicContact CG1-CB 4.41Å; I702-F744 HydrophobicContact CG1-CD1 3.77Å; I702-F744 HydrophobicContact CG1-CD2 3.51Å; I702-F744 HydrophobicContact CG1-CE1 3.77Å; I702-F744 HydrophobicContact CG1-CE2 3.53Å; I702-F744 HydrophobicContact CG1-CG 3.63Å; I702-F744 HydrophobicContact CG1-CZ 3.64Å; I702-L746 HydrophobicContact CD1-CD1 3.93Å; I702-L754 HydrophobicContact CD1-CD1 4.06Å; I702-L754 HydrophobicContact CD1-CD2 3.56Å; I702-L754 HydrophobicContact CD1-CG 4.47Å; I702-L754 HydrophobicContact CG2-CD1 4.35Å; I702-L754 HydrophobicContact CG2-CD2 4.3Å; I702-L758 HydrophobicContact CG2-CD1 4.25Å
703	E	72	Confident	60.2	Low	23 Å²	23	62.7 Å²	62.7	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-59.6	-41.3	175.1	-74.5	-166.2	-175	0	0	112.4	W699 L700 Y705 L706 N707 Y757 L758 K763	W699-E703 PolarHBondContact O-N 3.28Å; L700-E703 PolarHBondContact O-N 3.04Å; E703-Y705 VanDerWaalsContact C-N 3.35Å; E703-L706 PolarHBondContact O-N 3.11Å; E703-N707 PolarHBondContact O-N 3.12Å; E703-N707 PolarHBondContact O-ND2 3.32Å; E703-Y757 HydrophobicContact CG-CE1 4.3Å; E703-Y757 WeakPolarHBondContact OE1-CE1 3.43Å; E703-Y757 PolarHBondContact OE1-OH 3.02Å; E703-L758 HydrophobicContact CG-CD2 3.93Å; E703-K763 HydrophobicContact CG-CG 4.24Å; E703-K763 WeakPolarHBondContact OE2-CE 3.32Å; E703-K763 IonicContact OE2-NZ 3.63Å
704	L	65.6	Low	59.7	Low	40 Å²	40	62.5 Å²	62.5	21%	0.209	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-43.7	175.2	-67.3	168	0	0	0	111.1	K358 L700 D701 I702 L706 N707 D708	K358-L704 VanDerWaalsContact NZ-CD1 3.34Å; L700-L704 WeakPolarHBondContact O-CG 3.48Å; L700-L704 PolarHBondContact O-N 3.05Å; L700-L704 VanDerWaalsContact O-N 3.09Å; D701-L704 PolarHBondContact O-N 3Å; I702-L704 VanDerWaalsContact C-N 3.3Å; I702-L704 PolarHBondContact O-N 3.18Å; L704-L706 VanDerWaalsContact C-N 3.34Å; L704-L706 PolarHBondContact O-N 3.43Å; L704-N707 CarbonylContact O-C 3.57Å; L704-N707 WeakPolarHBondContact O-CB 3.37Å; L704-N707 PolarHBondContact O-N 3.49Å; L704-N707 VanDerWaalsContact O-N 3.15Å; L704-D708 PolarHBondContact O-N 3.49Å
705	Y	75.4	Confident	59	Low	52 Å²	52	63 Å²	63	20%	0.204	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-42.7	176.3	173.8	-119.3	0	0	0	112.4	D701 I702 E703 N707 D708 I709 I739 I740 K743 F744	D701-Y705 WeakPolarHBondContact O-CB 3.35Å; D701-Y705 PolarHBondContact O-N 3.39Å; I702-Y705 WeakPolarHBondContact O-CB 3.1Å; I702-Y705 PolarHBondContact O-N 2.77Å; E703-Y705 VanDerWaalsContact C-N 3.35Å; Y705-N707 VanDerWaalsContact C-N 3.3Å; Y705-N707 PolarHBondContact O-N 2.99Å; Y705-D708 PolarHBondContact O-N 3.37Å; Y705-D708 VanDerWaalsContact O-N 3.1Å; Y705-I709 HydrophobicContact CD1-CD1 4.12Å; Y705-I709 HydrophobicContact CD2-CG1 4.29Å; Y705-I709 HydrophobicContact CE1-CD1 3.59Å; Y705-I709 HydrophobicContact CE1-CG1 4.28Å; Y705-I709 HydrophobicContact CE2-CD1 4.01Å; Y705-I709 HydrophobicContact CE2-CG1 3.77Å; Y705-I709 WeakPolarHBondContact O-CG1 3.1Å; Y705-I709 PolarHBondContact O-N 2.89Å; Y705-I739 HydrophobicContact CE1-CG2 4.37Å; Y705-I740 HydrophobicContact CD1-CD1 4.04Å; Y705-I740 HydrophobicContact CE1-CD1 4.04Å; Y705-K743 HydrophobicContact CD1-CD 4.05Å; Y705-K743 HydrophobicContact CD2-CD 4.2Å; Y705-K743 HydrophobicContact CE1-CD 3.59Å; Y705-K743 HydrophobicContact CE2-CD 3.84Å; Y705-K743 HydrophobicContact CG-CD 4.28Å; Y705-K743 VanDerWaalsContact CZ-CD 3.45Å; Y705-F744 AromaticContact CD1-CE2 3.61Å; Y705-F744 HydrophobicContact CD1-CE2 3.61Å; Y705-F744 AromaticContact CD1-CZ 3.94Å; Y705-F744 HydrophobicContact CD1-CZ 3.94Å; Y705-F744 HydrophobicContact CE1-CE2 4.21Å; Y705-F744 HydrophobicContact CG-CE2 4.13Å; Y705-F744 AromaticContact CG-CZ 3.97Å; Y705-F744 HydrophobicContact CG-CZ 3.97Å
706	L	71.9	Confident	57.9	Low	5 Å²	5	68.2 Å²	68.2	3%	0.026	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-38.6	174.9	-67	174.1	0	0	0	111.6	I702 E703 L704 D708 I709 F736 I740 L758 I764 I806	I702-L706 HydrophobicContact CG2-CD1 4.19Å; I702-L706 HydrophobicContact CG2-CG 4.38Å; I702-L706 WeakPolarHBondContact O-CG 3.5Å; I702-L706 PolarHBondContact O-N 3.31Å; E703-L706 PolarHBondContact O-N 3.11Å; L704-L706 VanDerWaalsContact C-N 3.34Å; L704-L706 PolarHBondContact O-N 3.43Å; L706-D708 VanDerWaalsContact C-N 3.34Å; L706-I709 HydrophobicContact CD2-CD1 4.39Å; L706-F736 HydrophobicContact CD1-CZ 4.48Å; L706-F736 HydrophobicContact CD2-CE2 3.67Å; L706-F736 HydrophobicContact CD2-CZ 4.04Å; L706-I740 HydrophobicContact CD2-CD1 4.31Å; L706-L758 HydrophobicContact CD1-CD1 3.81Å; L706-L758 HydrophobicContact CD1-CD2 3.9Å; L706-L758 HydrophobicContact CD1-CG 4.48Å; L706-I764 HydrophobicContact CD1-CG2 4.24Å; L706-I806 HydrophobicContact CB-CG2 4.19Å; L706-I806 HydrophobicContact CD2-CD1 3.92Å; L706-I806 HydrophobicContact CD2-CG1 4.39Å; L706-I806 HydrophobicContact CD2-CG2 4.13Å
707	N	64.4	Low	56.4	Low	54 Å²	54	71.6 Å²	71.6	29%	0.289	35%	0.352	S	S	.	.	H	α-helix	trans	-66.6	-34.5	172.6	-64.9	-40.5	0	0	0	112	E703 L704 Y705 K710 Y711	E703-N707 PolarHBondContact O-N 3.12Å; E703-N707 PolarHBondContact O-ND2 3.32Å; L704-N707 CarbonylContact O-C 3.57Å; L704-N707 WeakPolarHBondContact O-CB 3.37Å; L704-N707 PolarHBondContact O-N 3.49Å; L704-N707 VanDerWaalsContact O-N 3.15Å; Y705-N707 VanDerWaalsContact C-N 3.3Å; Y705-N707 PolarHBondContact O-N 2.99Å; N707-K710 VanDerWaalsContact O-CB 3.23Å; N707-K710 WeakPolarHBondContact O-CB 2.98Å; N707-K710 PolarHBondContact O-N 3.33Å; N707-Y711 WeakPolarHBondContact O-CD2 3.45Å; N707-Y711 WeakPolarHBondContact O-CE2 3.35Å
708	D	63.1	Low	55	Low	78 Å²	78	72.2 Å²	72.2	42%	0.417	36%	0.356	S	S	.	.	H	α-helix	trans	-74.1	-35.7	179.2	-74.6	-19.4	0	0	0	112.7	L704 Y705 L706 K710 Y711 S712	L704-D708 PolarHBondContact O-N 3.49Å; Y705-D708 PolarHBondContact O-N 3.37Å; Y705-D708 VanDerWaalsContact O-N 3.1Å; L706-D708 VanDerWaalsContact C-N 3.34Å; D708-K710 PolarHBondContact O-N 3.31Å; D708-Y711 PolarHBondContact O-N 2.91Å; D708-S712 PolarHBondContact O-N 3.07Å
709	I	57.9	Low	53.2	Low	27 Å²	27	77 Å²	77	14%	0.138	38%	0.382	C	S	.	.	H	α-helix	trans	-54.4	-37.2	171.2	-68.8	172.6	0	0	0	110.4	Y705 L706 Y711 S712	Y705-I709 HydrophobicContact CD1-CD1 4.12Å; Y705-I709 HydrophobicContact CD2-CG1 4.29Å; Y705-I709 HydrophobicContact CE1-CD1 3.59Å; Y705-I709 HydrophobicContact CE1-CG1 4.28Å; Y705-I709 HydrophobicContact CE2-CD1 4.01Å; Y705-I709 HydrophobicContact CE2-CG1 3.77Å; Y705-I709 WeakPolarHBondContact O-CG1 3.1Å; Y705-I709 PolarHBondContact O-N 2.89Å; L706-I709 HydrophobicContact CD2-CD1 4.39Å; I709-Y711 VanDerWaalsContact C-N 3.28Å; I709-Y711 PolarHBondContact O-N 3.4Å; I709-S712 PolarHBondContact O-OG 3.19Å
710	K	52.5	Low	51.5	Low	104 Å²	104	83 Å²	83	45%	0.452	42%	0.416	S	S	.	.	H	α-helix	trans	-61.7	-33.9	175.6	-174	-177.8	176.9	171.4	0	112.8	N707 D708 D807	N707-K710 VanDerWaalsContact O-CB 3.23Å; N707-K710 WeakPolarHBondContact O-CB 2.98Å; N707-K710 PolarHBondContact O-N 3.33Å; D708-K710 PolarHBondContact O-N 3.31Å; K710-D807 WeakPolarHBondContact CE-OD2 3.42Å; K710-D807 IonicContact NZ-OD2 2.71Å; K710-D807 PolarHBondContact NZ-OD2 3.2Å
711	Y	43.5	Very low	50	Low	113 Å²	113	86 Å²	86	44%	0.443	43%	0.432	S	S	.	.	H	α-helix	trans	-91.8	-30.9	-173.3	-67.5	-64.6	0	0	0	114	N707 D708 I709 Y713	N707-Y711 WeakPolarHBondContact O-CD2 3.45Å; N707-Y711 WeakPolarHBondContact O-CE2 3.35Å; D708-Y711 PolarHBondContact O-N 2.91Å; I709-Y711 VanDerWaalsContact C-N 3.28Å; I709-Y711 PolarHBondContact O-N 3.4Å; Y711-Y713 PolarHBondContact O-N 3.01Å
712	S	38.5	Very low	48.2	Very low	61 Å²	61	90.3 Å²	90.3	43%	0.427	46%	0.456	S	S	.	.	H	α-helix	trans	-66.3	-35.4	-176.2	66.7	0	0	0	0	113.4	D708 I709 T715	D708-S712 PolarHBondContact O-N 3.07Å; I709-S712 PolarHBondContact O-OG 3.19Å; S712-T715 PolarHBondContact O-N 3.24Å; S712-T715 PolarHBondContact O-OG1 3.41Å
713	Y	40	Very low	45.9	Very low	107 Å²	107	98.5 Å²	98.5	42%	0.42	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-79.7	-21.7	-169.7	-103.9	-87.5	0	0	0	116.3	Y711 T715 H716 T728	Y711-Y713 PolarHBondContact O-N 3.01Å; Y713-T715 PolarHBondContact O-N 3.23Å; Y713-H716 PolarHBondContact O-N 3Å; Y713-T728 HydrophobicContact CE2-CG2 4.46Å
714	N	37.9	Very low	43.9	Very low	107 Å²	107	105.7 Å²	105.7	57%	0.572	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-70.1	-3.2	174	-81.2	-34.1	0	0	0	113.1
715	T	34.3	Very low	42.2	Very low	81 Å²	81	107.3 Å²	107.3	50%	0.497	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-93	-12.3	-179.7	66.3	0	0	0	0	115.5	S712 Y713	S712-T715 PolarHBondContact O-N 3.24Å; S712-T715 PolarHBondContact O-OG1 3.41Å; Y713-T715 PolarHBondContact O-N 3.23Å
716	H	29.3	Very low	40.3	Very low	145 Å²	145	109 Å²	109	67%	0.671	55%	0.55	S	S	*	.			trans	-100.2	11.6	-171.2	-82.5	-69	0	0	0	116.2	Y713 N718	Y713-H716 PolarHBondContact O-N 3Å; H716-N718 PolarHBondContact O-N 3.47Å
717	F	27.7	Very low	38.9	Very low	124 Å²	124	111.2 Å²	111.2	54%	0.544	56%	0.562	S	S	.	*	S	Bend	trans	-75.6	76.2	161.4	-86.3	-79.1	0	0	0	110.3	Y896	F717-Y896 AromaticContact CE2-CD2 3.64Å; F717-Y896 HydrophobicContact CE2-CD2 3.64Å; F717-Y896 AromaticContact CE2-CE2 3.59Å; F717-Y896 HydrophobicContact CE2-CE2 3.59Å; F717-Y896 HydrophobicContact CE2-CG 4.34Å; F717-Y896 HydrophobicContact CZ-CD1 4.08Å; F717-Y896 AromaticContact CZ-CD2 3.51Å; F717-Y896 HydrophobicContact CZ-CD2 3.51Å; F717-Y896 HydrophobicContact CZ-CE1 4.19Å; F717-Y896 AromaticContact CZ-CE2 3.66Å; F717-Y896 HydrophobicContact CZ-CE2 3.66Å; F717-Y896 AromaticContact CZ-CG 3.74Å; F717-Y896 HydrophobicContact CZ-CG 3.74Å
718	N	31.3	Very low	38.3	Very low	136 Å²	136	110.2 Å²	110.2	73%	0.727	56%	0.558	S	S	*	*	S	Bend	trans	157.4	87.4	150.9	-81.9	-14.5	0	0	0	106.8	H716	H716-N718 PolarHBondContact O-N 3.47Å
719	N	31.6	Very low	38.3	Very low	157 Å²	157	109.4 Å²	109.4	84%	0.84	56%	0.556	S	S	*	*			trans	176.4	131.8	131.1	-84.8	-15	0	0	0	109.2	N721	N719-N721 PolarHBondContact O-N 3.43Å
720	N	34	Very low	38.4	Very low	153 Å²	153	109 Å²	109	82%	0.818	55%	0.554	S	S	*	*			trans	-54.4	123.1	172.2	-61.2	-28.6	0	0	0	109.2
721	N	32.5	Very low	39.1	Very low	154 Å²	154	104.7 Å²	104.7	82%	0.824	54%	0.535	S	S	*	.			trans	-175.3	141.2	142.6	-86.9	-17	0	0	0	110.4	N719 E723	N719-N721 PolarHBondContact O-N 3.43Å; N721-E723 PolarHBondContact O-N 3.35Å
722	N	32.2	Very low	40.5	Very low	176 Å²	176	102 Å²	102	94%	0.941	53%	0.528	S	S	*	.			trans	-78.9	69.4	-164.2	-72.5	-28.1	0	0	0	114.4
723	E	28.9	Very low	42.3	Very low	172 Å²	172	101.9 Å²	101.9	80%	0.804	52%	0.52	S	S	*	.			trans	-111.7	139.4	163.7	-73.8	-173.8	168	0	0	111.5	N721 N725	N721-E723 PolarHBondContact O-N 3.35Å; E723-N725 PolarHBondContact O-N 2.92Å
724	M	28.6	Very low	44.1	Very low	173 Å²	173	100.8 Å²	100.8	85%	0.852	53%	0.528	S	S	*	.			trans	-49	97.5	-167.1	-72.9	-85	-154.8	0	0	114.2	I726	M724-I726 PolarHBondContact O-N 3.38Å; M724-I726 VanDerWaalsContact O-N 3.11Å
725	N	31.7	Very low	46	Very low	75 Å²	75	98.1 Å²	98.1	40%	0.401	52%	0.518	S	S	.	.			trans	-74.5	83.5	179.5	-77.6	-42.2	0	0	0	113.7	E723 N901	E723-N725 PolarHBondContact O-N 2.92Å; N725-N901 PolarHBondContact O-ND2 2.76Å; N725-N901 PolarHBondContact O-OD1 2.76Å
726	I	34.1	Very low	48.3	Very low	87 Å²	87	94.3 Å²	94.3	45%	0.446	49%	0.494	S	S	.	.			trans	-89.3	122.9	171.7	-58.9	171.9	0	0	0	109.2	M724 T728 L731 I904	M724-I726 PolarHBondContact O-N 3.38Å; M724-I726 VanDerWaalsContact O-N 3.11Å; I726-T728 WeakPolarHBondContact O-CG2 3.43Å; I726-T728 PolarHBondContact O-N 2.85Å; I726-L731 HydrophobicContact CG2-CD2 4.1Å; I726-I904 HydrophobicContact CG2-CD1 4.47Å
727	N	43.8	Very low	50.9	Low	51 Å²	51	88.5 Å²	88.5	27%	0.273	47%	0.47	S	S	.	.			trans	-64.3	102.8	171.4	-91.7	-13.5	0	0	0	108.8	T729 Y896 N901	N727-T729 PolarHBondContact O-N 3.29Å; N727-Y896 PolarHBondContact ND2-O 3.05Å; N727-Y896 VanDerWaalsContact ND2-O 3.08Å; N727-N901 HydrophobicContact CB-CB 4.37Å; N727-N901 WeakPolarHBondContact CB-ND2 3.5Å; N727-N901 PolarHBondContact N-ND2 3.47Å; N727-N901 PolarHBondContact N-OD1 2.7Å; N727-N901 PolarHBondContact ND2-ND2 3.43Å; N727-N901 PolarHBondContact OD1-ND2 2.74Å
728	T	50.8	Low	53.5	Low	33 Å²	33	87.9 Å²	87.9	20%	0.202	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-2.1	-166.2	50.6	0	0	0	0	116.2	Y713 I726 I730	Y713-T728 HydrophobicContact CE2-CG2 4.46Å; I726-T728 WeakPolarHBondContact O-CG2 3.43Å; I726-T728 PolarHBondContact O-N 2.85Å; T728-I730 VanDerWaalsContact C-N 3.28Å; T728-I730 PolarHBondContact O-N 3.32Å
729	T	62.6	Low	55.9	Low	61 Å²	61	84.4 Å²	84.4	37%	0.374	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-24.5	175.2	49	0	0	0	0	112.5	N727 I805 I806	N727-T729 PolarHBondContact O-N 3.29Å; T729-I805 CarbonylContact O-C 3.13Å; T729-I805 VanDerWaalsContact O-CA 3.27Å; T729-I805 WeakPolarHBondContact O-CA 3.33Å; T729-I806 PolarHBondContact O-N 2.7Å
730	I	60	Low	58.5	Low	19 Å²	19	77 Å²	77	10%	0.097	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	107.6	179.6	-53.1	166.7	0	0	0	107.7	T728 Y803 I804 I805 I904 Y908	T728-I730 VanDerWaalsContact C-N 3.28Å; T728-I730 PolarHBondContact O-N 3.32Å; I730-Y803 HydrophobicContact CG2-CD1 4.08Å; I730-Y803 HydrophobicContact CG2-CG 4.27Å; I730-I804 WeakPolarHBondContact CA-O 3.24Å; I730-I805 HydrophobicContact CG1-CG1 4.19Å; I730-I904 HydrophobicContact CB-CG2 3.87Å; I730-I904 HydrophobicContact CD1-CG2 4.38Å; I730-I904 HydrophobicContact CG2-CG2 3.96Å; I730-Y908 HydrophobicContact CD1-CD2 3.24Å; I730-Y908 HydrophobicContact CD1-CE2 3.78Å; I730-Y908 HydrophobicContact CD1-CG 3.87Å; I730-Y908 HydrophobicContact CG1-CD2 4.4Å
731	L	68.6	Low	60.8	Low	13 Å²	13	72.7 Å²	72.7	7%	0.068	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	150.9	-178.3	-69.5	167.4	0	0	0	109.9	I726 K733 F736 I739 Y803 I804 I806	I726-L731 HydrophobicContact CG2-CD2 4.1Å; L731-K733 PolarHBondContact O-N 2.67Å; L731-F736 HydrophobicContact CB-CB 4.08Å; L731-F736 HydrophobicContact CD1-CB 4.31Å; L731-F736 HydrophobicContact CD1-CD2 4.01Å; L731-I739 HydrophobicContact CD1-CD1 4.09Å; L731-Y803 CarbonylContact O-C 3.57Å; L731-Y803 VanDerWaalsContact O-CA 3.31Å; L731-Y803 WeakPolarHBondContact O-CA 3.41Å; L731-I804 PolarHBondContact N-O 2.82Å; L731-I804 PolarHBondContact O-N 3.03Å; L731-I806 HydrophobicContact CD1-CD1 4.07Å
732	L	71.6	Confident	63	Low	56 Å²	56	70.2 Å²	70.2	29%	0.293	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	137.6	163.2	-71.6	167.7	0	0	0	108.5	S734 S735 F736 K801 F802 Y803	L732-S734 PolarHBondContact O-N 3.42Å; L732-S734 VanDerWaalsContact O-N 3.16Å; L732-S735 PolarHBondContact O-N 3.38Å; L732-F736 PolarHBondContact O-N 3.07Å; L732-K801 HydrophobicContact CD2-CB 3.58Å; L732-K801 HydrophobicContact CD2-CD 3.86Å; L732-K801 HydrophobicContact CD2-CG 4.18Å; L732-F802 WeakPolarHBondContact CA-O 3.38Å; L732-Y803 HydrophobicContact CD2-CD1 3.87Å; L732-Y803 HydrophobicContact CD2-CE1 3.44Å; L732-Y803 VanDerWaalsContact CD2-CE1 3.44Å; L732-Y803 HydrophobicContact CG-CD1 4.36Å; L732-Y803 HydrophobicContact CG-CE1 4.04Å
733	K	76.5	Confident	65.4	Low	60 Å²	60	67.2 Å²	67.2	26%	0.261	35%	0.35	S	S	.	.	H	α-helix	trans	-50.4	-42.4	178.3	-174.9	171.1	-169.9	172.4	0	110.9	L731 F736 C737 I766 D768 F802 I804	L731-K733 PolarHBondContact O-N 2.67Å; K733-F736 PolarHBondContact O-N 3.4Å; K733-C737 VanDerWaalsContact O-CB 3.25Å; K733-C737 WeakPolarHBondContact O-CB 3.48Å; K733-C737 PolarHBondContact O-N 3.35Å; K733-C737 PolarHBondContact O-SG 2.91Å; K733-I766 HydrophobicContact CD-CG2 4.35Å; K733-D768 IonicContact NZ-OD1 3.34Å; K733-D768 PolarHBondContact NZ-OD1 2.85Å; K733-D768 IonicContact NZ-OD2 3.01Å; K733-D768 PolarHBondContact NZ-OD2 3.19Å; K733-F802 HydrophobicContact CB-CB 3.85Å; K733-F802 HydrophobicContact CD-CB 3.94Å; K733-F802 HydrophobicContact CD-CG 4.46Å; K733-F802 PolarHBondContact N-O 3.42Å; K733-I804 HydrophobicContact CB-CD1 4.25Å; K733-I804 HydrophobicContact CB-CG1 4.18Å; K733-I804 HydrophobicContact CG-CD1 3.93Å; K733-I804 HydrophobicContact CG-CG1 4.26Å
734	S	78.5	Confident	67.9	Low	84 Å²	84	60.5 Å²	60.5	59%	0.587	32%	0.318	S	S	*	.	H	α-helix	trans	-61.4	-46.2	174.9	54.6	0	0	0	0	113.4	L732 C737 H738	L732-S734 PolarHBondContact O-N 3.42Å; L732-S734 VanDerWaalsContact O-N 3.16Å; S734-C737 WeakPolarHBondContact O-CB 3.22Å; S734-C737 PolarHBondContact O-N 2.99Å; S734-H738 WeakPolarHBondContact O-CB 3.5Å; S734-H738 PolarHBondContact O-N 3.3Å
735	S	77.2	Confident	70.5	Confident	50 Å²	50	59.5 Å²	59.5	35%	0.35	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-42.7	178.1	-56	0	0	0	0	112.2	L732 H738 I739	L732-S735 PolarHBondContact O-N 3.38Å; S735-H738 PolarHBondContact O-N 3.39Å; S735-I739 WeakPolarHBondContact O-CD1 3.26Å; S735-I739 VanDerWaalsContact O-CG1 3.25Å; S735-I739 WeakPolarHBondContact O-CG1 3.25Å; S735-I739 PolarHBondContact O-N 3.09Å
736	F	83.6	Confident	72.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-48.8	175.2	178.4	-91.7	0	0	0	111.2	L706 L731 L732 K733 H738 I739 I740 L755 L758 I764 I804 I806	L706-F736 HydrophobicContact CD1-CZ 4.48Å; L706-F736 HydrophobicContact CD2-CE2 3.67Å; L706-F736 HydrophobicContact CD2-CZ 4.04Å; L731-F736 HydrophobicContact CB-CB 4.08Å; L731-F736 HydrophobicContact CD1-CB 4.31Å; L731-F736 HydrophobicContact CD1-CD2 4.01Å; L732-F736 PolarHBondContact O-N 3.07Å; K733-F736 PolarHBondContact O-N 3.4Å; F736-H738 VanDerWaalsContact C-N 3.31Å; F736-H738 PolarHBondContact O-N 3.37Å; F736-I739 PolarHBondContact O-N 3.04Å; F736-I740 HydrophobicContact CD1-CG1 4.29Å; F736-I740 HydrophobicContact CD2-CG1 4.48Å; F736-I740 HydrophobicContact CE1-CG1 3.88Å; F736-I740 HydrophobicContact CE2-CG1 4.11Å; F736-I740 HydrophobicContact CZ-CD1 4.36Å; F736-I740 HydrophobicContact CZ-CG1 3.79Å; F736-I740 WeakPolarHBondContact O-CG1 3.37Å; F736-I740 PolarHBondContact O-N 3.31Å; F736-L755 HydrophobicContact CD1-CD2 3.83Å; F736-L755 HydrophobicContact CE1-CD2 3.57Å; F736-L758 HydrophobicContact CZ-CD1 4.26Å; F736-I764 HydrophobicContact CE1-CD1 4.32Å; F736-I764 HydrophobicContact CE2-CG2 4.43Å; F736-I764 HydrophobicContact CZ-CD1 4.44Å; F736-I764 HydrophobicContact CZ-CG2 4.14Å; F736-I804 HydrophobicContact CB-CB 4.46Å; F736-I804 HydrophobicContact CB-CD1 4.01Å; F736-I804 HydrophobicContact CD1-CD1 3.48Å; F736-I804 VanDerWaalsContact CD1-CD1 3.48Å; F736-I804 HydrophobicContact CD1-CG2 4.46Å; F736-I804 HydrophobicContact CD2-CG2 4.22Å; F736-I804 HydrophobicContact CE1-CD1 4.16Å; F736-I804 HydrophobicContact CE2-CG2 4.42Å; F736-I804 HydrophobicContact CG-CB 4.42Å; F736-I804 HydrophobicContact CG-CD1 3.85Å; F736-I804 HydrophobicContact CG-CG2 4.23Å; F736-I806 HydrophobicContact CD2-CD1 3.98Å; F736-I806 HydrophobicContact CD2-CG1 4.26Å; F736-I806 HydrophobicContact CE2-CD1 3.76Å; F736-I806 HydrophobicContact CE2-CG1 3.91Å
737	C	84.2	Confident	74.9	Confident	22 Å²	22	56.3 Å²	56.3	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-53.5	-49.3	174.2	-76.8	0	0	0	0	111.1	K733 S734 I739 I740 Q741 L751	K733-C737 VanDerWaalsContact O-CB 3.25Å; K733-C737 WeakPolarHBondContact O-CB 3.48Å; K733-C737 PolarHBondContact O-N 3.35Å; K733-C737 PolarHBondContact O-SG 2.91Å; S734-C737 WeakPolarHBondContact O-CB 3.22Å; S734-C737 PolarHBondContact O-N 2.99Å; C737-I739 PolarHBondContact O-N 3.17Å; C737-I740 PolarHBondContact O-N 2.9Å; C737-Q741 WeakPolarHBondContact O-CB 3.38Å; C737-Q741 PolarHBondContact O-N 3.47Å; C737-L751 HydrophobicContact CB-CD2 3.79Å
738	H	81.7	Confident	76.4	Confident	111 Å²	111	60.4 Å²	60.4	51%	0.514	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-41.3	-179.4	-165.3	61.4	0	0	0	112.9	S734 S735 F736 N742	S734-H738 WeakPolarHBondContact O-CB 3.5Å; S734-H738 PolarHBondContact O-N 3.3Å; S735-H738 PolarHBondContact O-N 3.39Å; F736-H738 VanDerWaalsContact C-N 3.31Å; F736-H738 PolarHBondContact O-N 3.37Å; H738-N742 PolarHBondContact CD2-ND2 2.92Å; H738-N742 VanDerWaalsContact CD2-ND2 3.31Å; H738-N742 PolarHBondContact CE1-ND2 2.94Å; H738-N742 PolarHBondContact CE1-OD1 2.91Å; H738-N742 PolarHBondContact NE2-ND2 3.01Å; H738-N742 VanDerWaalsContact O-CB 3.26Å; H738-N742 WeakPolarHBondContact O-CB 3.47Å; H738-N742 PolarHBondContact O-N 3.24Å; H738-N742 PolarHBondContact O-ND2 3.42Å; H738-N742 PolarHBondContact O-OD1 2.65Å
739	I	82.3	Confident	77.4	Confident	63 Å²	63	64.6 Å²	64.6	32%	0.323	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-49	176.9	-70.8	163.3	0	0	0	110.8	Y705 L731 S735 F736 C737 K743	Y705-I739 HydrophobicContact CE1-CG2 4.37Å; L731-I739 HydrophobicContact CD1-CD1 4.09Å; S735-I739 WeakPolarHBondContact O-CD1 3.26Å; S735-I739 VanDerWaalsContact O-CG1 3.25Å; S735-I739 WeakPolarHBondContact O-CG1 3.25Å; S735-I739 PolarHBondContact O-N 3.09Å; F736-I739 PolarHBondContact O-N 3.04Å; C737-I739 PolarHBondContact O-N 3.17Å; I739-K743 WeakPolarHBondContact O-CB 3.21Å; I739-K743 PolarHBondContact O-N 3.35Å
740	I	84.2	Confident	77.8	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-70.7	-40.7	-177.7	-65.2	-61.9	0	0	0	110.7	I702 Y705 L706 F736 C737 K743 F744 L746 L751 L754	I702-I740 HydrophobicContact CD1-CG2 4.32Å; I702-I740 HydrophobicContact CG2-CD1 4.2Å; Y705-I740 HydrophobicContact CD1-CD1 4.04Å; Y705-I740 HydrophobicContact CE1-CD1 4.04Å; L706-I740 HydrophobicContact CD2-CD1 4.31Å; F736-I740 HydrophobicContact CD1-CG1 4.29Å; F736-I740 HydrophobicContact CD2-CG1 4.48Å; F736-I740 HydrophobicContact CE1-CG1 3.88Å; F736-I740 HydrophobicContact CE2-CG1 4.11Å; F736-I740 HydrophobicContact CZ-CD1 4.36Å; F736-I740 HydrophobicContact CZ-CG1 3.79Å; F736-I740 WeakPolarHBondContact O-CG1 3.37Å; F736-I740 PolarHBondContact O-N 3.31Å; C737-I740 PolarHBondContact O-N 2.9Å; I740-K743 PolarHBondContact O-N 2.8Å; I740-F744 HydrophobicContact CD1-CD2 4.46Å; I740-F744 HydrophobicContact CD1-CE2 4.24Å; I740-F744 HydrophobicContact CG2-CD2 4.33Å; I740-F744 WeakPolarHBondContact O-CB 3.32Å; I740-F744 PolarHBondContact O-N 3.19Å; I740-L746 HydrophobicContact CG2-CD1 3.69Å; I740-L751 HydrophobicContact CG2-CD1 4.17Å; I740-L754 HydrophobicContact CG2-CD2 3.62Å
741	Q	83.3	Confident	78.6	Confident	63 Å²	63	63.9 Å²	63.9	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-46.1	178.2	-162.1	179	-10.5	0	0	111.9	C737 N745 L746	C737-Q741 WeakPolarHBondContact O-CB 3.38Å; C737-Q741 PolarHBondContact O-N 3.47Å; Q741-N745 WeakPolarHBondContact O-CA 3.15Å; Q741-N745 PolarHBondContact O-N 3.23Å; Q741-L746 HydrophobicContact CG-CB 4.46Å; Q741-L746 WeakPolarHBondContact CG-O 3.41Å; Q741-L746 PolarHBondContact NE2-O 2.86Å; Q741-L746 PolarHBondContact O-N 2.87Å
742	N	79	Confident	78.7	Confident	103 Å²	103	70.8 Å²	70.8	55%	0.551	36%	0.362	S	S	*	.	H	α-helix	trans	-68.9	-40.2	178.5	-69.5	-6.1	0	0	0	112	H738	H738-N742 PolarHBondContact CD2-ND2 2.92Å; H738-N742 VanDerWaalsContact CD2-ND2 3.31Å; H738-N742 PolarHBondContact CE1-ND2 2.94Å; H738-N742 PolarHBondContact CE1-OD1 2.91Å; H738-N742 PolarHBondContact NE2-ND2 3.01Å; H738-N742 VanDerWaalsContact O-CB 3.26Å; H738-N742 WeakPolarHBondContact O-CB 3.47Å; H738-N742 PolarHBondContact O-N 3.24Å; H738-N742 PolarHBondContact O-ND2 3.42Å; H738-N742 PolarHBondContact O-OD1 2.65Å
743	K	81.7	Confident	78.6	Confident	112 Å²	112	70.9 Å²	70.9	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-72	-37.4	-176	-174.5	166.8	-174.6	167.3	0	112.9	Y705 I739 I740	Y705-K743 HydrophobicContact CD1-CD 4.05Å; Y705-K743 HydrophobicContact CD2-CD 4.2Å; Y705-K743 HydrophobicContact CE1-CD 3.59Å; Y705-K743 HydrophobicContact CE2-CD 3.84Å; Y705-K743 HydrophobicContact CG-CD 4.28Å; Y705-K743 VanDerWaalsContact CZ-CD 3.45Å; I739-K743 WeakPolarHBondContact O-CB 3.21Å; I739-K743 PolarHBondContact O-N 3.35Å; I740-K743 PolarHBondContact O-N 2.8Å
744	F	82.6	Confident	78.6	Confident	32 Å²	32	68 Å²	68	14%	0.14	35%	0.348	C	S	.	.	H	α-helix	trans	-111.8	7.4	-174.8	-63.1	-81.8	0	0	0	113.4	I698 D701 I702 Y705 I740 L746	I698-F744 HydrophobicContact CD1-CB 3.9Å; I698-F744 HydrophobicContact CD1-CD1 4.08Å; I698-F744 HydrophobicContact CD1-CG 4.48Å; I698-F744 WeakPolarHBondContact CD1-O 3.33Å; I698-F744 HydrophobicContact CG1-CB 4.23Å; I698-F744 HydrophobicContact CG1-CD1 3.73Å; I698-F744 HydrophobicContact CG1-CG 4.36Å; D701-F744 HydrophobicContact CB-CE1 4.29Å; I702-F744 HydrophobicContact CB-CE2 4.38Å; I702-F744 HydrophobicContact CB-CZ 4.38Å; I702-F744 HydrophobicContact CD1-CB 4.19Å; I702-F744 HydrophobicContact CD1-CD1 4.35Å; I702-F744 HydrophobicContact CD1-CD2 4.05Å; I702-F744 HydrophobicContact CD1-CG 3.94Å; I702-F744 HydrophobicContact CG1-CB 4.41Å; I702-F744 HydrophobicContact CG1-CD1 3.77Å; I702-F744 HydrophobicContact CG1-CD2 3.51Å; I702-F744 HydrophobicContact CG1-CE1 3.77Å; I702-F744 HydrophobicContact CG1-CE2 3.53Å; I702-F744 HydrophobicContact CG1-CG 3.63Å; I702-F744 HydrophobicContact CG1-CZ 3.64Å; Y705-F744 AromaticContact CD1-CE2 3.61Å; Y705-F744 HydrophobicContact CD1-CE2 3.61Å; Y705-F744 AromaticContact CD1-CZ 3.94Å; Y705-F744 HydrophobicContact CD1-CZ 3.94Å; Y705-F744 HydrophobicContact CE1-CE2 4.21Å; Y705-F744 HydrophobicContact CG-CE2 4.13Å; Y705-F744 AromaticContact CG-CZ 3.97Å; Y705-F744 HydrophobicContact CG-CZ 3.97Å; I740-F744 HydrophobicContact CD1-CD2 4.46Å; I740-F744 HydrophobicContact CD1-CE2 4.24Å; I740-F744 HydrophobicContact CG2-CD2 4.33Å; I740-F744 WeakPolarHBondContact O-CB 3.32Å; I740-F744 PolarHBondContact O-N 3.19Å; F744-L746 HydrophobicContact CB-CD1 4.21Å; F744-L746 HydrophobicContact CB-CD2 4.44Å; F744-L746 HydrophobicContact CB-CG 3.98Å; F744-L746 PolarHBondContact O-N 3.48Å
745	N	81.3	Confident	78.5	Confident	151 Å²	151	64.9 Å²	64.9	81%	0.807	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	50.6	179.2	-159.2	21.5	0	0	0	113.4	Q741	Q741-N745 WeakPolarHBondContact O-CA 3.15Å; Q741-N745 PolarHBondContact O-N 3.23Å
746	L	79.4	Confident	77.9	Confident	12 Å²	12	66.1 Å²	66.1	6%	0.063	33%	0.33	C	S	.	.			trans	-86.9	145.1	-176.1	-61.4	170.4	0	0	0	111.3	I698 I702 I740 Q741 F744 N750 L751 L754	I698-L746 HydrophobicContact CG2-CD2 4.31Å; I702-L746 HydrophobicContact CD1-CD1 3.93Å; I740-L746 HydrophobicContact CG2-CD1 3.69Å; Q741-L746 HydrophobicContact CG-CB 4.46Å; Q741-L746 WeakPolarHBondContact CG-O 3.41Å; Q741-L746 PolarHBondContact NE2-O 2.86Å; Q741-L746 PolarHBondContact O-N 2.87Å; F744-L746 HydrophobicContact CB-CD1 4.21Å; F744-L746 HydrophobicContact CB-CD2 4.44Å; F744-L746 HydrophobicContact CB-CG 3.98Å; F744-L746 PolarHBondContact O-N 3.48Å; L746-N750 HydrophobicContact CD2-CB 4.46Å; L746-L751 HydrophobicContact CD1-CD1 4.38Å; L746-L754 HydrophobicContact CD1-CD2 3.6Å
747	N	79.5	Confident	77.2	Confident	84 Å²	84	67.3 Å²	67.3	45%	0.449	34%	0.335	S	S	.	.			trans	-82.6	165.6	167.5	67.6	21.9	0	0	0	110.8	H749 N750 L751	N747-H749 VanDerWaalsContact C-N 3.26Å; N747-H749 PolarHBondContact O-N 2.84Å; N747-H749 PolarHBondContact OD1-N 2.92Å; N747-N750 PolarHBondContact O-N 2.79Å; N747-N750 WeakPolarHBondContact OD1-CB 3.38Å; N747-N750 PolarHBondContact OD1-N 2.83Å; N747-N750 PolarHBondContact OD1-ND2 3.17Å; N747-N750 PolarHBondContact OD1-OD1 2.82Å; N747-L751 WeakPolarHBondContact O-CB 3.12Å; N747-L751 PolarHBondContact O-N 2.87Å
748	L	75.3	Confident	76.7	Confident	137 Å²	137	66.3 Å²	66.3	72%	0.717	33%	0.328	S	S	*	.	H	α-helix	trans	-58.9	-36.8	-176.6	-162.9	82.9	0	0	0	112.6	L751 K752	L748-L751 PolarHBondContact O-N 3.16Å; L748-K752 PolarHBondContact O-N 3Å; L748-K752 VanDerWaalsContact O-N 3.13Å
749	H	71.3	Confident	76.1	Confident	121 Å²	121	63.6 Å²	63.6	56%	0.56	32%	0.317	S	S	*	.	H	α-helix	trans	-65.8	-48.8	179.6	-173.6	77	0	0	0	112	N747 L751 K752 Q753	N747-H749 VanDerWaalsContact C-N 3.26Å; N747-H749 PolarHBondContact O-N 2.84Å; N747-H749 PolarHBondContact OD1-N 2.92Å; H749-L751 VanDerWaalsContact C-N 3.3Å; H749-L751 PolarHBondContact O-N 3.08Å; H749-K752 PolarHBondContact O-N 3.06Å; H749-Q753 PolarHBondContact NE2-NE2 3.05Å; H749-Q753 PolarHBondContact O-N 3Å
750	N	72	Confident	74.8	Confident	56 Å²	56	65.7 Å²	65.7	30%	0.299	33%	0.329	S	S	.	.	H	α-helix	trans	-66.3	-34.9	178	-69.2	-9.9	0	0	0	111.3	L746 N747 Q753 L754	L746-N750 HydrophobicContact CD2-CB 4.46Å; N747-N750 PolarHBondContact O-N 2.79Å; N747-N750 WeakPolarHBondContact OD1-CB 3.38Å; N747-N750 PolarHBondContact OD1-N 2.83Å; N747-N750 PolarHBondContact OD1-ND2 3.17Å; N747-N750 PolarHBondContact OD1-OD1 2.82Å; N750-Q753 PolarHBondContact O-N 3.17Å; N750-L754 VanDerWaalsContact O-CB 3.24Å; N750-L754 WeakPolarHBondContact O-CB 3.47Å; N750-L754 PolarHBondContact O-N 2.89Å
751	L	76.9	Confident	73.7	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-42.6	176.3	-173.6	69	0	0	0	111.9	C737 I740 L746 N747 L748 H749 L754 L755	C737-L751 HydrophobicContact CB-CD2 3.79Å; I740-L751 HydrophobicContact CG2-CD1 4.17Å; L746-L751 HydrophobicContact CD1-CD1 4.38Å; N747-L751 WeakPolarHBondContact O-CB 3.12Å; N747-L751 PolarHBondContact O-N 2.87Å; L748-L751 PolarHBondContact O-N 3.16Å; H749-L751 VanDerWaalsContact C-N 3.3Å; H749-L751 PolarHBondContact O-N 3.08Å; L751-L754 PolarHBondContact O-N 3.34Å; L751-L755 HydrophobicContact CG-CD1 4.43Å; L751-L755 WeakPolarHBondContact O-CG 3.44Å; L751-L755 PolarHBondContact O-N 3.31Å
752	K	71.3	Confident	72.8	Confident	159 Å²	159	66.8 Å²	66.8	69%	0.691	35%	0.347	S	S	*	.	H	α-helix	trans	-63.6	-42.9	177	-168.6	177.6	-179.2	-179.8	0	111.7	L748 H749 T756	L748-K752 PolarHBondContact O-N 3Å; L748-K752 VanDerWaalsContact O-N 3.13Å; H749-K752 PolarHBondContact O-N 3.06Å; K752-T756 PolarHBondContact O-N 3.48Å; K752-T756 PolarHBondContact O-OG1 2.76Å
753	Q	68.5	Low	72.2	Confident	57 Å²	57	65 Å²	65	27%	0.266	33%	0.334	S	S	.	.	H	α-helix	trans	-64.1	-44.7	175.6	-70.6	-179	-1.8	0	0	111.8	W699 H749 N750 T756 Y757	W699-Q753 HydrophobicContact CH2-CB 3.87Å; W699-Q753 HydrophobicContact CZ2-CB 3.96Å; H749-Q753 PolarHBondContact NE2-NE2 3.05Å; H749-Q753 PolarHBondContact O-N 3Å; N750-Q753 PolarHBondContact O-N 3.17Å; Q753-T756 PolarHBondContact O-N 2.88Å; Q753-Y757 WeakPolarHBondContact O-CB 3.5Å; Q753-Y757 PolarHBondContact O-N 3.19Å
754	L	77	Confident	71.9	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-45.1	177.2	175.5	71.3	0	0	0	112.2	W699 I702 I740 L746 N750 L751 T756 Y757 L758	W699-L754 HydrophobicContact CB-CD1 4.19Å; W699-L754 HydrophobicContact CD2-CD1 3.99Å; W699-L754 HydrophobicContact CG-CD1 3.76Å; I702-L754 HydrophobicContact CD1-CD1 4.06Å; I702-L754 HydrophobicContact CD1-CD2 3.56Å; I702-L754 HydrophobicContact CD1-CG 4.47Å; I702-L754 HydrophobicContact CG2-CD1 4.35Å; I702-L754 HydrophobicContact CG2-CD2 4.3Å; I740-L754 HydrophobicContact CG2-CD2 3.62Å; L746-L754 HydrophobicContact CD1-CD2 3.6Å; N750-L754 VanDerWaalsContact O-CB 3.24Å; N750-L754 WeakPolarHBondContact O-CB 3.47Å; N750-L754 PolarHBondContact O-N 2.89Å; L751-L754 PolarHBondContact O-N 3.34Å; L754-T756 VanDerWaalsContact C-N 3.28Å; L754-T756 PolarHBondContact O-N 3.3Å; L754-Y757 HydrophobicContact CD1-CD1 4.36Å; L754-Y757 WeakPolarHBondContact O-CB 3.24Å; L754-Y757 PolarHBondContact O-N 3.16Å; L754-L758 HydrophobicContact CD1-CD1 4.02Å; L754-L758 HydrophobicContact CD1-CG 4Å; L754-L758 HydrophobicContact CD2-CD1 4.4Å; L754-L758 HydrophobicContact CG-CD1 3.87Å; L754-L758 HydrophobicContact CG-CG 4.23Å; L754-L758 WeakPolarHBondContact O-CB 3.16Å; L754-L758 WeakPolarHBondContact O-CG 3.45Å; L754-L758 PolarHBondContact O-N 3.41Å
755	L	75.4	Confident	71.2	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-42.2	178	-76.9	171	0	0	0	111.7	F736 L751 L758 N759 I764 I766 I804	F736-L755 HydrophobicContact CD1-CD2 3.83Å; F736-L755 HydrophobicContact CE1-CD2 3.57Å; L751-L755 HydrophobicContact CG-CD1 4.43Å; L751-L755 WeakPolarHBondContact O-CG 3.44Å; L751-L755 PolarHBondContact O-N 3.31Å; L755-L758 PolarHBondContact O-N 3.24Å; L755-N759 VanDerWaalsContact O-CB 3.31Å; L755-N759 WeakPolarHBondContact O-CB 2.81Å; L755-N759 PolarHBondContact O-N 3.23Å; L755-I764 HydrophobicContact CD2-CD1 3.88Å; L755-I766 HydrophobicContact CB-CD1 4.23Å; L755-I766 HydrophobicContact CD2-CD1 4.47Å; L755-I804 HydrophobicContact CD2-CD1 3.76Å
756	T	65.8	Low	70.6	Confident	76 Å²	76	54.8 Å²	54.8	47%	0.466	29%	0.286	S	S	.	.	H	α-helix	trans	-64.4	-45	176.9	-47.3	0	0	0	0	110.5	K752 Q753 L754 N759 N760	K752-T756 PolarHBondContact O-N 3.48Å; K752-T756 PolarHBondContact O-OG1 2.76Å; Q753-T756 PolarHBondContact O-N 2.88Å; L754-T756 VanDerWaalsContact C-N 3.28Å; L754-T756 PolarHBondContact O-N 3.3Å; T756-N759 PolarHBondContact O-N 3.38Å; T756-N760 WeakPolarHBondContact O-CB 3.32Å; T756-N760 PolarHBondContact O-N 2.77Å; T756-N760 PolarHBondContact O-ND2 2.86Å
757	Y	68.2	Low	69.6	Low	28 Å²	28	55.7 Å²	55.7	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-57.6	-53.1	174.9	168.6	-97.6	0	0	0	112	L695 W699 E703 Q753 L754 N759 N760 T761	L695-Y757 HydrophobicContact CD2-CD2 4.1Å; L695-Y757 HydrophobicContact CD2-CE2 3.75Å; W699-Y757 AromaticContact CE3-CD1 3.82Å; W699-Y757 HydrophobicContact CE3-CD1 3.82Å; W699-Y757 HydrophobicContact CE3-CD2 4.01Å; W699-Y757 HydrophobicContact CE3-CE1 4.36Å; W699-Y757 AromaticContact CE3-CG 3.64Å; W699-Y757 HydrophobicContact CE3-CG 3.64Å; W699-Y757 HydrophobicContact CZ3-CD1 4.44Å; W699-Y757 HydrophobicContact CZ3-CD2 4.07Å; W699-Y757 AromaticContact CZ3-CG 3.82Å; W699-Y757 HydrophobicContact CZ3-CG 3.82Å; E703-Y757 HydrophobicContact CG-CE1 4.3Å; E703-Y757 WeakPolarHBondContact OE1-CE1 3.43Å; E703-Y757 PolarHBondContact OE1-OH 3.02Å; Q753-Y757 WeakPolarHBondContact O-CB 3.5Å; Q753-Y757 PolarHBondContact O-N 3.19Å; L754-Y757 HydrophobicContact CD1-CD1 4.36Å; L754-Y757 WeakPolarHBondContact O-CB 3.24Å; L754-Y757 PolarHBondContact O-N 3.16Å; Y757-N759 VanDerWaalsContact C-N 3.3Å; Y757-N759 PolarHBondContact O-N 3.3Å; Y757-N760 PolarHBondContact O-N 3.4Å; Y757-T761 HydrophobicContact CD2-CG2 4.09Å; Y757-T761 HydrophobicContact CE1-CG2 4.3Å; Y757-T761 HydrophobicContact CE2-CG2 3.67Å; Y757-T761 WeakPolarHBondContact O-CG2 3.46Å; Y757-T761 PolarHBondContact O-N 3.33Å; Y757-T761 PolarHBondContact O-OG1 2.87Å; Y757-T761 VanDerWaalsContact O-OG1 3.11Å
758	L	73.1	Confident	68.3	Low	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.9	-33.6	-178.4	-68.9	174.2	0	0	0	112.7	I702 E703 L706 F736 L754 L755 T761 G762 K763 I764	I702-L758 HydrophobicContact CG2-CD1 4.25Å; E703-L758 HydrophobicContact CG-CD2 3.93Å; L706-L758 HydrophobicContact CD1-CD1 3.81Å; L706-L758 HydrophobicContact CD1-CD2 3.9Å; L706-L758 HydrophobicContact CD1-CG 4.48Å; F736-L758 HydrophobicContact CZ-CD1 4.26Å; L754-L758 HydrophobicContact CD1-CD1 4.02Å; L754-L758 HydrophobicContact CD1-CG 4Å; L754-L758 HydrophobicContact CD2-CD1 4.4Å; L754-L758 HydrophobicContact CG-CD1 3.87Å; L754-L758 HydrophobicContact CG-CG 4.23Å; L754-L758 WeakPolarHBondContact O-CB 3.16Å; L754-L758 WeakPolarHBondContact O-CG 3.45Å; L754-L758 PolarHBondContact O-N 3.41Å; L755-L758 PolarHBondContact O-N 3.24Å; L758-T761 PolarHBondContact O-OG1 2.98Å; L758-G762 PolarHBondContact O-N 3.26Å; L758-K763 HydrophobicContact CB-CB 4.39Å; L758-K763 HydrophobicContact CD2-CB 3.96Å; L758-K763 HydrophobicContact CD2-CG 4.31Å; L758-K763 PolarHBondContact O-N 2.89Å; L758-I764 HydrophobicContact CB-CD1 3.69Å; L758-I764 HydrophobicContact CB-CG1 3.7Å; L758-I764 HydrophobicContact CB-CG2 4.32Å; L758-I764 HydrophobicContact CD1-CD1 4.32Å; L758-I764 PolarHBondContact O-N 3.35Å; L758-I764 VanDerWaalsContact O-N 3.07Å
759	N	69.3	Low	66.6	Low	55 Å²	55	52.1 Å²	52.1	29%	0.294	28%	0.278	S	S	.	.	H	α-helix	trans	-70	-44.5	175.6	-168.6	66.7	0	0	0	110.9	L755 T756 Y757 T761 G762 I764 I766	L755-N759 VanDerWaalsContact O-CB 3.31Å; L755-N759 WeakPolarHBondContact O-CB 2.81Å; L755-N759 PolarHBondContact O-N 3.23Å; T756-N759 PolarHBondContact O-N 3.38Å; Y757-N759 VanDerWaalsContact C-N 3.3Å; Y757-N759 PolarHBondContact O-N 3.3Å; N759-T761 PolarHBondContact O-N 2.96Å; N759-G762 PolarHBondContact O-N 3.39Å; N759-G762 VanDerWaalsContact O-N 3.07Å; N759-I764 WeakPolarHBondContact CA-O 3.43Å; N759-I764 HydrophobicContact CB-CG1 4.26Å; N759-I764 PolarHBondContact OD1-O 3.29Å; N759-I766 HydrophobicContact CB-CD1 4.3Å; N759-I766 HydrophobicContact CB-CG1 4.36Å; N759-I766 PolarHBondContact OD1-N 2.85Å; N759-I766 VanDerWaalsContact OD1-N 3.1Å
760	N	55.2	Low	64.9	Low	106 Å²	106	56 Å²	56	57%	0.567	29%	0.289	S	S	*	.	H	α-helix	trans	-68.8	-32.5	179.8	-70	-8.1	0	0	0	113.1	T756 Y757 G762	T756-N760 WeakPolarHBondContact O-CB 3.32Å; T756-N760 PolarHBondContact O-N 2.77Å; T756-N760 PolarHBondContact O-ND2 2.86Å; Y757-N760 PolarHBondContact O-N 3.4Å; N760-G762 PolarHBondContact O-N 2.97Å
761	T	61.2	Low	63	Low	53 Å²	53	58.9 Å²	58.9	33%	0.325	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.9	173.2	58.6	0	0	0	0	113	Y757 L758 N759 K763	Y757-T761 HydrophobicContact CD2-CG2 4.09Å; Y757-T761 HydrophobicContact CE1-CG2 4.3Å; Y757-T761 HydrophobicContact CE2-CG2 3.67Å; Y757-T761 WeakPolarHBondContact O-CG2 3.46Å; Y757-T761 PolarHBondContact O-N 3.33Å; Y757-T761 PolarHBondContact O-OG1 2.87Å; Y757-T761 VanDerWaalsContact O-OG1 3.11Å; L758-T761 PolarHBondContact O-OG1 2.98Å; N759-T761 PolarHBondContact O-N 2.96Å; T761-K763 PolarHBondContact O-N 2.93Å; T761-K763 WeakPolarHBondContact OG1-CG 3.37Å
762	G	63.8	Low	60.7	Low	35 Å²	35	64.9 Å²	64.9	36%	0.361	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	14.4	-178.2	0	0	0	0	0	113.8	L758 N759 N760 P808	L758-G762 PolarHBondContact O-N 3.26Å; N759-G762 PolarHBondContact O-N 3.39Å; N759-G762 VanDerWaalsContact O-N 3.07Å; N760-G762 PolarHBondContact O-N 2.97Å; G762-P808 VanDerWaalsContact O-CD 3.31Å; G762-P808 WeakPolarHBondContact O-CD 3.36Å
763	K	67.9	Low	58.6	Low	64 Å²	64	63.6 Å²	63.6	28%	0.278	34%	0.34	S	S	.	.	S	Bend	trans	-72	-32.7	175.7	-67.5	-63.5	-173.4	-172.2	0	111.8	E703 L758 T761 D807	E703-K763 HydrophobicContact CG-CG 4.24Å; E703-K763 WeakPolarHBondContact OE2-CE 3.32Å; E703-K763 IonicContact OE2-NZ 3.63Å; L758-K763 HydrophobicContact CB-CB 4.39Å; L758-K763 HydrophobicContact CD2-CB 3.96Å; L758-K763 HydrophobicContact CD2-CG 4.31Å; L758-K763 PolarHBondContact O-N 2.89Å; T761-K763 PolarHBondContact O-N 2.93Å; T761-K763 WeakPolarHBondContact OG1-CG 3.37Å; K763-D807 PolarHBondContact O-N 2.91Å
764	I	75.4	Confident	56.7	Low	2 Å²	2	67.9 Å²	67.9	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.1	170.7	70.1	-179.7	0	0	0	109.9	L706 F736 L755 L758 N759 I766 I804 I805 I806	L706-I764 HydrophobicContact CD1-CG2 4.24Å; F736-I764 HydrophobicContact CE1-CD1 4.32Å; F736-I764 HydrophobicContact CE2-CG2 4.43Å; F736-I764 HydrophobicContact CZ-CD1 4.44Å; F736-I764 HydrophobicContact CZ-CG2 4.14Å; L755-I764 HydrophobicContact CD2-CD1 3.88Å; L758-I764 HydrophobicContact CB-CD1 3.69Å; L758-I764 HydrophobicContact CB-CG1 3.7Å; L758-I764 HydrophobicContact CB-CG2 4.32Å; L758-I764 HydrophobicContact CD1-CD1 4.32Å; L758-I764 PolarHBondContact O-N 3.35Å; L758-I764 VanDerWaalsContact O-N 3.07Å; N759-I764 WeakPolarHBondContact CA-O 3.43Å; N759-I764 HydrophobicContact CB-CG1 4.26Å; N759-I764 PolarHBondContact OD1-O 3.29Å; I764-I766 HydrophobicContact CD1-CD1 4.35Å; I764-I766 HydrophobicContact CD1-CG1 4.09Å; I764-I766 HydrophobicContact CG1-CG1 4.4Å; I764-I804 HydrophobicContact CB-CG2 3.85Å; I764-I804 HydrophobicContact CD1-CG2 4.04Å; I764-I804 HydrophobicContact CG1-CG2 4.38Å; I764-I804 HydrophobicContact CG2-CG2 4.15Å; I764-I805 CarbonylContact C-O 3.53Å; I764-I805 WeakPolarHBondContact CA-O 3.03Å; I764-I806 HydrophobicContact CG2-CG1 4.33Å
765	L	66.9	Low	54.3	Low	49 Å²	49	74.6 Å²	74.6	26%	0.257	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.6	165.6	179.6	72.5	0	0	0	107.9	L767 I805 P808 F811	L765-L767 HydrophobicContact CD2-CD2 3.88Å; L765-L767 HydrophobicContact CD2-CG 4.38Å; L765-L767 HydrophobicContact CG-CD2 4.31Å; L765-I805 HydrophobicContact CB-CB 4.33Å; L765-I805 PolarHBondContact N-O 3.13Å; L765-I805 PolarHBondContact O-N 3.3Å; L765-P808 HydrophobicContact CB-CB 3.59Å; L765-P808 HydrophobicContact CB-CG 3.88Å; L765-P808 HydrophobicContact CD2-CB 4.15Å; L765-P808 HydrophobicContact CG-CB 4.46Å; L765-F811 HydrophobicContact CD2-CD1 3.87Å; L765-F811 HydrophobicContact CD2-CE1 3.94Å
766	I	69	Low	52.2	Low	30 Å²	30	80.6 Å²	80.6	15%	0.154	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	113.5	172.7	-52.3	179.8	0	0	0	107.4	K733 L755 N759 I764 D768 I804	K733-I766 HydrophobicContact CD-CG2 4.35Å; L755-I766 HydrophobicContact CB-CD1 4.23Å; L755-I766 HydrophobicContact CD2-CD1 4.47Å; N759-I766 HydrophobicContact CB-CD1 4.3Å; N759-I766 HydrophobicContact CB-CG1 4.36Å; N759-I766 PolarHBondContact OD1-N 2.85Å; N759-I766 VanDerWaalsContact OD1-N 3.1Å; I764-I766 HydrophobicContact CD1-CD1 4.35Å; I764-I766 HydrophobicContact CD1-CG1 4.09Å; I764-I766 HydrophobicContact CG1-CG1 4.4Å; I766-D768 VanDerWaalsContact C-N 3.26Å; I766-D768 VanDerWaalsContact CG2-OD1 3.26Å; I766-D768 WeakPolarHBondContact CG2-OD1 3.36Å; I766-D768 PolarHBondContact O-N 3.21Å; I766-D768 VanDerWaalsContact O-N 3.1Å; I766-I804 HydrophobicContact CG1-CD1 4.41Å; I766-I804 HydrophobicContact CG1-CG1 4.22Å; I766-I804 HydrophobicContact CG2-CG1 4.47Å
767	L	59.1	Low	50.5	Low	32 Å²	32	84.9 Å²	84.9	17%	0.168	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	76.6	173.4	-67.6	169.6	0	0	0	108	L765 Y803 I805 F811 I911	L765-L767 HydrophobicContact CD2-CD2 3.88Å; L765-L767 HydrophobicContact CD2-CG 4.38Å; L765-L767 HydrophobicContact CG-CD2 4.31Å; L767-Y803 PolarHBondContact N-O 2.76Å; L767-I805 HydrophobicContact CD1-CD1 3.6Å; L767-I805 HydrophobicContact CD1-CG1 3.9Å; L767-I805 HydrophobicContact CG-CD1 4.41Å; L767-F811 HydrophobicContact CD2-CZ 4.46Å; L767-I911 HydrophobicContact CD1-CD1 3.71Å; L767-I911 HydrophobicContact CD1-CG2 4.16Å; L767-I911 HydrophobicContact CD2-CG2 4.23Å
768	D	52	Low	48.6	Very low	79 Å²	79	90.6 Å²	90.6	42%	0.422	49%	0.485	S	S	.	.			trans	-75.4	126.7	167.6	-73.6	-23.1	0	0	0	107.6	K733 I766 Y770 F802	K733-D768 IonicContact NZ-OD1 3.34Å; K733-D768 PolarHBondContact NZ-OD1 2.85Å; K733-D768 IonicContact NZ-OD2 3.01Å; K733-D768 PolarHBondContact NZ-OD2 3.19Å; I766-D768 VanDerWaalsContact C-N 3.26Å; I766-D768 VanDerWaalsContact CG2-OD1 3.26Å; I766-D768 WeakPolarHBondContact CG2-OD1 3.36Å; I766-D768 PolarHBondContact O-N 3.21Å; I766-D768 VanDerWaalsContact O-N 3.1Å; D768-Y770 PolarHBondContact O-N 2.93Å; D768-F802 HydrophobicContact CB-CD1 4.41Å; D768-F802 HydrophobicContact CB-CE1 4.26Å; D768-F802 WeakPolarHBondContact OD1-CD1 3.38Å
769	S	38.7	Very low	46.6	Very low	67 Å²	67	97.1 Å²	97.1	47%	0.469	52%	0.521	S	S	.	.			trans	-57.8	108.3	179.2	53.1	0	0	0	0	109.1	I771	S769-I771 PolarHBondContact O-N 2.88Å
770	Y	36.5	Very low	44.7	Very low	203 Å²	203	102.2 Å²	102.2	80%	0.796	55%	0.548	S	S	*	.			trans	-49.7	137.7	164.1	-113	-100.2	0	0	0	109.3	D768	D768-Y770 PolarHBondContact O-N 2.93Å
771	I	31.9	Very low	43.4	Very low	115 Å²	115	106 Å²	106	59%	0.59	56%	0.562	S	S	*	*			trans	92.5	82.9	164	-48	160.4	0	0	0	115.9	S769 L773	S769-I771 PolarHBondContact O-N 2.88Å; I771-L773 HydrophobicContact CG1-CD1 4.4Å; I771-L773 HydrophobicContact CG2-CB 3.81Å; I771-L773 HydrophobicContact CG2-CD1 4.29Å; I771-L773 HydrophobicContact CG2-CG 4.34Å
772	T	27.8	Very low	41.8	Very low	135 Å²	135	110 Å²	110	83%	0.828	58%	0.581	S	S	*	*				-99.6	73.8	123.6	50.4	0	0	0	0	107.9	N774	T772-N774 PolarHBondContact O-N 2.91Å; T772-N774 VanDerWaalsContact O-N 3.09Å
773	L	28.5	Very low	40	Very low	132 Å²	132	115.1 Å²	115.1	69%	0.691	60%	0.6	S	S	*	*			trans	-77.4	44.5	158.8	-83.9	157.3	0	0	0	110.3	I771 N775	I771-L773 HydrophobicContact CG1-CD1 4.4Å; I771-L773 HydrophobicContact CG2-CB 3.81Å; I771-L773 HydrophobicContact CG2-CD1 4.29Å; I771-L773 HydrophobicContact CG2-CG 4.34Å; L773-N775 VanDerWaalsContact C-N 3.29Å
774	N	27.4	Very low	38.1	Very low	146 Å²	146	116.9 Å²	116.9	78%	0.781	62%	0.621	S	S	*	*			trans	-102.5	58.3	156.2	-79.7	2.1	0	0	0	107.3	T772 N776	T772-N774 PolarHBondContact O-N 2.91Å; T772-N774 VanDerWaalsContact O-N 3.09Å; N774-N776 PolarHBondContact O-N 3.44Å
775	N	28	Very low	35.7	Very low	142 Å²	142	125.1 Å²	125.1	76%	0.759	66%	0.664	S	S	*	*			trans	-69	79.2	152.5	-85.8	-8	0	0	0	106.4	L773	L773-N775 VanDerWaalsContact C-N 3.29Å
776	N	30.4	Very low	33.7	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	69%	0.688	S	S	*	*			trans	-178.1	81.9	158.4	-87.2	-17.6	0	0	0	105.7	N774	N774-N776 PolarHBondContact O-N 3.44Å
777	N	29.2	Very low	31.7	Very low	165 Å²	165	135 Å²	135	88%	0.882	72%	0.718	S	S	*	*			trans	-174.9	108.2	138.6	-86	-17.9	0	0	0	107.7
778	N	29.2	Very low	30.2	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	75%	0.751	S	S	*	*			trans	-57	148.8	174.5	-70.7	-32.7	0	0	0	111.5
779	N	30.6	Very low	29	Very low	138 Å²	138	143 Å²	143	74%	0.738	77%	0.766	S	S	*	*			trans	64.1	100.5	155	-52.8	-14.7	0	0	0	116.2
780	N	30.2	Very low	28.5	Very low	162 Å²	162	146 Å²	146	87%	0.866	78%	0.782	S	S	*	*				178.4	113.2	112.2	-80.6	-21.9	0	0	0	108.9
781	E	27.3	Very low	28.1	Very low	186 Å²	186	142.1 Å²	142.1	87%	0.869	78%	0.784	S	S	*	*			trans	-64.4	124.8	157.9	-65.7	179.6	146.4	0	0	108
782	D	27.3	Very low	28	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	79%	0.793	S	S	*	*				156.5	121.3	128.9	-86.9	-33.9	0	0	0	113.4
783	N	27.5	Very low	28.1	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	80%	0.795	S	S	*	*			trans	44.4	96.8	137.5	-57.2	-39.9	0	0	0	119.7
784	S	26.8	Very low	28.1	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	80%	0.796	S	S	*	*				167.9	131.8	115.7	48.2	0	0	0	0	110.9	N786	S784-N786 PolarHBondContact O-N 3.36Å
785	L	25.3	Very low	28.2	Very low	176 Å²	176	141 Å²	141	92%	0.921	80%	0.801	S	S	*	*			trans	-65.2	99	168.5	-77.2	93.5	0	0	0	108.7
786	N	25.5	Very low	28.3	Very low	142 Å²	142	142.1 Å²	142.1	76%	0.759	81%	0.805	S	S	*	*			trans	-133.3	123.3	162.6	-83	-35.4	0	0	0	109.5	S784	S784-N786 PolarHBondContact O-N 3.36Å
787	D	26	Very low	28.2	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	81%	0.806	S	S	*	*			trans	-57.9	130.8	-176.1	-72	-50.6	0	0	0	112.5	I789	D787-I789 PolarHBondContact O-N 3.09Å
788	P	28	Very low	28.2	Very low	133 Å²	133	142.3 Å²	142.3	86%	0.864	80%	0.795	S	S	*	*			trans	-84	83.8	173.1	33.4	-29.4	0	0	0	109.1
789	I	26.4	Very low	28.5	Very low	146 Å²	146	142.6 Å²	142.6	75%	0.749	80%	0.797	S	S	*	*			trans	-83.2	104.5	157.9	-58.8	171.3	0	0	0	105.8	D787	D787-I789 PolarHBondContact O-N 3.09Å
790	T	28.8	Very low	29	Very low	129 Å²	129	139.5 Å²	139.5	79%	0.791	78%	0.784	S	S	*	*			trans	156.4	93	147.4	41.3	0	0	0	0	110.9
791	S	28.4	Very low	30	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	77%	0.771	S	S	*	*			trans	-175.2	119.9	137.3	33.7	0	0	0	0	108.3
792	S	29.1	Very low	31.7	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	75%	0.75	S	S	*	*			trans	-64.6	148	-179.2	33.8	0	0	0	0	111.8
793	S	30.4	Very low	33.6	Very low	126 Å²	126	128.5 Å²	128.5	88%	0.881	72%	0.719	S	S	*	*	S	Bend	trans	81.1	36.8	159	74.5	0	0	0	0	120.2
794	S	28.7	Very low	35.8	Very low	99 Å²	99	121.7 Å²	121.7	69%	0.692	68%	0.683	S	S	*	*	S	Bend	trans	-135.9	121.4	151.1	62	0	0	0	0	109.9	I796	S794-I796 PolarHBondContact O-N 2.88Å; S794-I796 VanDerWaalsContact O-N 3.07Å
795	L	29.4	Very low	37.8	Very low	170 Å²	170	117.2 Å²	117.2	89%	0.89	65%	0.651	S	S	*	*			trans	-22.3	104.9	177.7	-69.5	152.8	0	0	0	113.1	R797	L795-R797 PolarHBondContact O-N 2.94Å
796	I	29.1	Very low	39.9	Very low	164 Å²	164	109.5 Å²	109.5	84%	0.841	61%	0.611	S	S	*	*			trans	-58.6	99	177.9	-61.5	167.4	0	0	0	108	S794 P798	S794-I796 PolarHBondContact O-N 2.88Å; S794-I796 VanDerWaalsContact O-N 3.07Å; I796-P798 WeakPolarHBondContact O-CD 3.4Å
797	R	29.6	Very low	41.8	Very low	211 Å²	211	104.8 Å²	104.8	80%	0.796	59%	0.585	S	S	*	*			trans	-77.7	114.7	168.8	-72.7	-178.6	176.5	179	-1.3	107.2	L795 N799	L795-R797 PolarHBondContact O-N 2.94Å; R797-N799 PolarHBondContact O-N 2.92Å
798	P	29.6	Very low	43.6	Very low	102 Å²	102	98.2 Å²	98.2	66%	0.662	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-63.5	133.6	-179.4	23.7	-31.2	0	0	0	110.8	I796	I796-P798 WeakPolarHBondContact O-CD 3.4Å
799	N	34.7	Very low	45.1	Very low	154 Å²	154	96.5 Å²	96.5	82%	0.824	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-53.8	119.6	175.1	-104.4	-19.9	0	0	0	110.1	R797 K801	R797-N799 PolarHBondContact O-N 2.92Å; N799-K801 PolarHBondContact O-N 2.91Å
800	P	41.2	Very low	46.4	Very low	73 Å²	73	93.1 Å²	93.1	47%	0.474	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-70.2	126.3	-175.9	26.6	-31.9	0	0	0	110.4
801	K	49.9	Very low	47.8	Very low	136 Å²	136	87.8 Å²	87.8	59%	0.591	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-67.2	136.6	174.1	-68.2	178.1	-178.8	173.5	0	109.8	L732 N799 Y803	L732-K801 HydrophobicContact CD2-CB 3.58Å; L732-K801 HydrophobicContact CD2-CD 3.86Å; L732-K801 HydrophobicContact CD2-CG 4.18Å; N799-K801 PolarHBondContact O-N 2.91Å; K801-Y803 HydrophobicContact CB-CE2 3.82Å; K801-Y803 WeakPolarHBondContact O-CD2 3.25Å; K801-Y803 WeakPolarHBondContact O-CE2 3.49Å
802	F	64	Low	49.1	Very low	95 Å²	95	85.4 Å²	85.4	42%	0.417	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-74.1	123.9	176.4	-68.3	-81.9	0	0	0	111.2	L732 K733 D768	L732-F802 WeakPolarHBondContact CA-O 3.38Å; K733-F802 HydrophobicContact CB-CB 3.85Å; K733-F802 HydrophobicContact CD-CB 3.94Å; K733-F802 HydrophobicContact CD-CG 4.46Å; K733-F802 PolarHBondContact N-O 3.42Å; D768-F802 HydrophobicContact CB-CD1 4.41Å; D768-F802 HydrophobicContact CB-CE1 4.26Å; D768-F802 WeakPolarHBondContact OD1-CD1 3.38Å
803	Y	68.1	Low	50.2	Low	21 Å²	21	83.9 Å²	83.9	8%	0.082	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	146.8	-179.7	-62.4	-80.8	0	0	0	112.1	I730 L731 L732 L767 K801 S907 I911	I730-Y803 HydrophobicContact CG2-CD1 4.08Å; I730-Y803 HydrophobicContact CG2-CG 4.27Å; L731-Y803 CarbonylContact O-C 3.57Å; L731-Y803 VanDerWaalsContact O-CA 3.31Å; L731-Y803 WeakPolarHBondContact O-CA 3.41Å; L732-Y803 HydrophobicContact CD2-CD1 3.87Å; L732-Y803 HydrophobicContact CD2-CE1 3.44Å; L732-Y803 VanDerWaalsContact CD2-CE1 3.44Å; L732-Y803 HydrophobicContact CG-CD1 4.36Å; L732-Y803 HydrophobicContact CG-CE1 4.04Å; L767-Y803 PolarHBondContact N-O 2.76Å; K801-Y803 HydrophobicContact CB-CE2 3.82Å; K801-Y803 WeakPolarHBondContact O-CD2 3.25Å; K801-Y803 WeakPolarHBondContact O-CE2 3.49Å; Y803-S907 PolarHBondContact OH-OG 3.5Å; Y803-I911 HydrophobicContact CD2-CD1 4.42Å
804	I	72.1	Confident	51.2	Low	0 Å²	0	78.5 Å²	78.5	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.6	171.5	-67.1	-176.9	0	0	0	108.2	I730 L731 K733 F736 L755 I764 I766	I730-I804 WeakPolarHBondContact CA-O 3.24Å; L731-I804 PolarHBondContact N-O 2.82Å; L731-I804 PolarHBondContact O-N 3.03Å; K733-I804 HydrophobicContact CB-CD1 4.25Å; K733-I804 HydrophobicContact CB-CG1 4.18Å; K733-I804 HydrophobicContact CG-CD1 3.93Å; K733-I804 HydrophobicContact CG-CG1 4.26Å; F736-I804 HydrophobicContact CB-CB 4.46Å; F736-I804 HydrophobicContact CB-CD1 4.01Å; F736-I804 HydrophobicContact CD1-CD1 3.48Å; F736-I804 VanDerWaalsContact CD1-CD1 3.48Å; F736-I804 HydrophobicContact CD1-CG2 4.46Å; F736-I804 HydrophobicContact CD2-CG2 4.22Å; F736-I804 HydrophobicContact CE1-CD1 4.16Å; F736-I804 HydrophobicContact CE2-CG2 4.42Å; F736-I804 HydrophobicContact CG-CB 4.42Å; F736-I804 HydrophobicContact CG-CD1 3.85Å; F736-I804 HydrophobicContact CG-CG2 4.23Å; L755-I804 HydrophobicContact CD2-CD1 3.76Å; I764-I804 HydrophobicContact CB-CG2 3.85Å; I764-I804 HydrophobicContact CD1-CG2 4.04Å; I764-I804 HydrophobicContact CG1-CG2 4.38Å; I764-I804 HydrophobicContact CG2-CG2 4.15Å; I766-I804 HydrophobicContact CG1-CD1 4.41Å; I766-I804 HydrophobicContact CG1-CG1 4.22Å; I766-I804 HydrophobicContact CG2-CG1 4.47Å
805	I	69.8	Low	52.3	Low	8 Å²	8	75.2 Å²	75.2	4%	0.041	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	121.9	170.4	-52.9	-171	0	0	0	108.8	T729 I730 I764 L765 L767 P808 F811 Y908	T729-I805 CarbonylContact O-C 3.13Å; T729-I805 VanDerWaalsContact O-CA 3.27Å; T729-I805 WeakPolarHBondContact O-CA 3.33Å; I730-I805 HydrophobicContact CG1-CG1 4.19Å; I764-I805 CarbonylContact C-O 3.53Å; I764-I805 WeakPolarHBondContact CA-O 3.03Å; L765-I805 HydrophobicContact CB-CB 4.33Å; L765-I805 PolarHBondContact N-O 3.13Å; L765-I805 PolarHBondContact O-N 3.3Å; L767-I805 HydrophobicContact CD1-CD1 3.6Å; L767-I805 HydrophobicContact CD1-CG1 3.9Å; L767-I805 HydrophobicContact CG-CD1 4.41Å; I805-P808 HydrophobicContact CG2-CB 4.47Å; I805-F811 HydrophobicContact CD1-CB 4.35Å; I805-F811 HydrophobicContact CD1-CD1 4.5Å; I805-F811 HydrophobicContact CD1-CD2 3.95Å; I805-F811 HydrophobicContact CD1-CE2 4.24Å; I805-F811 HydrophobicContact CD1-CG 4.04Å; I805-Y908 HydrophobicContact CD1-CD2 4.36Å; I805-Y908 HydrophobicContact CD1-CE2 4.14Å
806	I	69.6	Low	53.2	Low	14 Å²	14	73 Å²	73	7%	0.072	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	127.3	172.9	-55.2	172.4	0	0	0	108.4	L706 T729 L731 F736 I764	L706-I806 HydrophobicContact CB-CG2 4.19Å; L706-I806 HydrophobicContact CD2-CD1 3.92Å; L706-I806 HydrophobicContact CD2-CG1 4.39Å; L706-I806 HydrophobicContact CD2-CG2 4.13Å; T729-I806 PolarHBondContact O-N 2.7Å; L731-I806 HydrophobicContact CD1-CD1 4.07Å; F736-I806 HydrophobicContact CD2-CD1 3.98Å; F736-I806 HydrophobicContact CD2-CG1 4.26Å; F736-I806 HydrophobicContact CE2-CD1 3.76Å; F736-I806 HydrophobicContact CE2-CG1 3.91Å; I764-I806 HydrophobicContact CG2-CG1 4.33Å
807	D	65.6	Low	54.1	Low	43 Å²	43	71.4 Å²	71.4	23%	0.23	34%	0.344	C	S	.	.	S	Bend	trans	57	72.3	-174.7	-169.9	12.7	0	0	0	113.4	K710 K763 N809	K710-D807 WeakPolarHBondContact CE-OD2 3.42Å; K710-D807 IonicContact NZ-OD2 2.71Å; K710-D807 PolarHBondContact NZ-OD2 3.2Å; K763-D807 PolarHBondContact O-N 2.91Å; D807-N809 PolarHBondContact O-N 3.24Å; D807-N809 PolarHBondContact OD1-ND2 2.9Å
808	P	63.8	Low	54.7	Low	6 Å²	6	62.7 Å²	62.7	4%	0.039	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-1.5	-173.6	30.4	-37.7	0	0	0	114.4	G762 L765 I805 L810 F811 I812	G762-P808 VanDerWaalsContact O-CD 3.31Å; G762-P808 WeakPolarHBondContact O-CD 3.36Å; L765-P808 HydrophobicContact CB-CB 3.59Å; L765-P808 HydrophobicContact CB-CG 3.88Å; L765-P808 HydrophobicContact CD2-CB 4.15Å; L765-P808 HydrophobicContact CG-CB 4.46Å; I805-P808 HydrophobicContact CG2-CB 4.47Å; P808-L810 PolarHBondContact O-N 3.41Å; P808-L810 VanDerWaalsContact O-N 3.13Å; P808-F811 WeakPolarHBondContact O-CA 3.24Å; P808-F811 WeakPolarHBondContact O-CB 3.35Å; P808-F811 PolarHBondContact O-N 3.37Å; P808-I812 HydrophobicContact CB-CD1 4.25Å; P808-I812 HydrophobicContact CG-CD1 4.34Å; P808-I812 WeakPolarHBondContact O-CG1 3.48Å; P808-I812 PolarHBondContact O-N 3.05Å
809	N	58.5	Low	55.3	Low	97 Å²	97	61.4 Å²	61.4	52%	0.519	30%	0.3	S	S	.	.	H	α-helix	trans	-51.9	-39.3	-180	-74.8	-43.6	0	0	0	112.6	D807 I812 E813	D807-N809 PolarHBondContact O-N 3.24Å; D807-N809 PolarHBondContact OD1-ND2 2.9Å; N809-I812 PolarHBondContact O-N 3.32Å; N809-E813 WeakPolarHBondContact O-CB 3.49Å; N809-E813 VanDerWaalsContact O-CG 3.25Å; N809-E813 WeakPolarHBondContact O-CG 3.5Å; N809-E813 PolarHBondContact O-N 2.89Å
810	L	54.2	Low	55.8	Low	76 Å²	76	56.6 Å²	56.6	40%	0.398	28%	0.275	S	S	.	.	H	α-helix	trans	-67	-39	176.8	-171.2	73.8	0	0	0	112.5	P808 S814 N893 L895	P808-L810 PolarHBondContact O-N 3.41Å; P808-L810 VanDerWaalsContact O-N 3.13Å; L810-S814 WeakPolarHBondContact O-CB 3.15Å; L810-S814 PolarHBondContact O-N 3.33Å; L810-S814 PolarHBondContact O-OG 2.88Å; L810-N893 HydrophobicContact CD1-CB 4.39Å; L810-N893 HydrophobicContact CD2-CB 4.43Å; L810-L895 HydrophobicContact CD2-CD1 4.35Å; L810-L895 HydrophobicContact CD2-CD2 4.48Å; L810-L895 HydrophobicContact CD2-CG 4.42Å
811	F	57.5	Low	55.8	Low	16 Å²	16	57.3 Å²	57.3	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-45.4	175.1	-179.2	-103.6	0	0	0	110.9	L765 L767 I805 P808 S814 F815 Y908 I911 L912	L765-F811 HydrophobicContact CD2-CD1 3.87Å; L765-F811 HydrophobicContact CD2-CE1 3.94Å; L767-F811 HydrophobicContact CD2-CZ 4.46Å; I805-F811 HydrophobicContact CD1-CB 4.35Å; I805-F811 HydrophobicContact CD1-CD1 4.5Å; I805-F811 HydrophobicContact CD1-CD2 3.95Å; I805-F811 HydrophobicContact CD1-CE2 4.24Å; I805-F811 HydrophobicContact CD1-CG 4.04Å; P808-F811 WeakPolarHBondContact O-CA 3.24Å; P808-F811 WeakPolarHBondContact O-CB 3.35Å; P808-F811 PolarHBondContact O-N 3.37Å; F811-S814 PolarHBondContact O-N 3.05Å; F811-F815 HydrophobicContact CD1-CD2 4.1Å; F811-F815 HydrophobicContact CD1-CE2 4.3Å; F811-F815 AromaticContact CE1-CD2 3.79Å; F811-F815 HydrophobicContact CE1-CD2 3.79Å; F811-F815 AromaticContact CE1-CE2 3.53Å; F811-F815 HydrophobicContact CE1-CE2 3.53Å; F811-F815 HydrophobicContact CE2-CD2 4.44Å; F811-F815 HydrophobicContact CE2-CE2 4.08Å; F811-F815 HydrophobicContact CZ-CD2 4.02Å; F811-F815 AromaticContact CZ-CE2 3.45Å; F811-F815 HydrophobicContact CZ-CE2 3.45Å; F811-F815 VanDerWaalsContact CZ-CE2 3.45Å; F811-F815 PolarHBondContact O-N 3.45Å; F811-Y908 HydrophobicContact CD2-CD2 4.2Å; F811-Y908 AromaticContact CD2-CE2 3.31Å; F811-Y908 HydrophobicContact CD2-CE2 3.31Å; F811-Y908 AromaticContact CD2-CZ 3.56Å; F811-Y908 WeakPolarHBondContact CD2-OH 3.29Å; F811-Y908 HydrophobicContact CE2-CD2 4.26Å; F811-Y908 AromaticContact CE2-CE2 3.78Å; F811-Y908 HydrophobicContact CE2-CE2 3.78Å; F811-Y908 HydrophobicContact CG-CE2 4.37Å; F811-I911 HydrophobicContact CZ-CG2 4.25Å; F811-L912 HydrophobicContact CE2-CD1 4.32Å; F811-L912 HydrophobicContact CE2-CD2 4.01Å; F811-L912 HydrophobicContact CE2-CG 3.84Å; F811-L912 HydrophobicContact CZ-CD2 4.43Å; F811-L912 HydrophobicContact CZ-CG 4.5Å
812	I	56.6	Low	55.5	Low	72 Å²	72	54.2 Å²	54.2	37%	0.369	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-45.6	177.5	-65.1	166.5	0	0	0	110.7	P808 N809 F815 K816	P808-I812 HydrophobicContact CB-CD1 4.25Å; P808-I812 HydrophobicContact CG-CD1 4.34Å; P808-I812 WeakPolarHBondContact O-CG1 3.48Å; P808-I812 PolarHBondContact O-N 3.05Å; N809-I812 PolarHBondContact O-N 3.32Å; I812-F815 WeakPolarHBondContact O-CB 3.43Å; I812-F815 PolarHBondContact O-N 3.3Å; I812-K816 WeakPolarHBondContact O-CG 3.34Å; I812-K816 PolarHBondContact O-N 3.46Å
813	E	51.3	Low	54.4	Low	78 Å²	78	51.7 Å²	51.7	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-42.8	176.2	-73.7	-62.7	127.9	0	0	111.2	N809 F815 K816 Y817	N809-E813 WeakPolarHBondContact O-CB 3.49Å; N809-E813 VanDerWaalsContact O-CG 3.25Å; N809-E813 WeakPolarHBondContact O-CG 3.5Å; N809-E813 PolarHBondContact O-N 2.89Å; E813-F815 VanDerWaalsContact C-N 3.29Å; E813-F815 PolarHBondContact O-N 3.32Å; E813-K816 WeakPolarHBondContact O-CB 3.21Å; E813-K816 PolarHBondContact O-N 3.19Å; E813-K816 VanDerWaalsContact O-N 3.15Å; E813-K816 IonicContact OE1-NZ 3.52Å; E813-K816 PolarHBondContact OE1-NZ 3.26Å; E813-Y817 WeakPolarHBondContact O-CD2 3.42Å; E813-Y817 PolarHBondContact O-N 3.08Å; E813-Y817 VanDerWaalsContact O-N 3.12Å
814	S	51.1	Low	53.2	Low	14 Å²	14	58.1 Å²	58.1	10%	0.098	29%	0.285	C	S	.	.	H	α-helix	trans	-59.4	-39.5	176	-58.4	0	0	0	0	112.1	L810 F811 Y817 L818 N893	L810-S814 WeakPolarHBondContact O-CB 3.15Å; L810-S814 PolarHBondContact O-N 3.33Å; L810-S814 PolarHBondContact O-OG 2.88Å; F811-S814 PolarHBondContact O-N 3.05Å; S814-Y817 PolarHBondContact O-N 3.43Å; S814-L818 PolarHBondContact O-N 3.5Å; S814-N893 PolarHBondContact OG-ND2 2.92Å
815	F	52.2	Low	51.9	Low	30 Å²	30	65 Å²	65	13%	0.132	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-49.1	172.2	-109.1	-80.2	0	0	0	112.5	F811 I812 E813 Y817 L818 L819 L912 W915	F811-F815 HydrophobicContact CD1-CD2 4.1Å; F811-F815 HydrophobicContact CD1-CE2 4.3Å; F811-F815 AromaticContact CE1-CD2 3.79Å; F811-F815 HydrophobicContact CE1-CD2 3.79Å; F811-F815 AromaticContact CE1-CE2 3.53Å; F811-F815 HydrophobicContact CE1-CE2 3.53Å; F811-F815 HydrophobicContact CE2-CD2 4.44Å; F811-F815 HydrophobicContact CE2-CE2 4.08Å; F811-F815 HydrophobicContact CZ-CD2 4.02Å; F811-F815 AromaticContact CZ-CE2 3.45Å; F811-F815 HydrophobicContact CZ-CE2 3.45Å; F811-F815 VanDerWaalsContact CZ-CE2 3.45Å; F811-F815 PolarHBondContact O-N 3.45Å; I812-F815 WeakPolarHBondContact O-CB 3.43Å; I812-F815 PolarHBondContact O-N 3.3Å; E813-F815 VanDerWaalsContact C-N 3.29Å; E813-F815 PolarHBondContact O-N 3.32Å; F815-Y817 PolarHBondContact O-N 3.24Å; F815-L818 PolarHBondContact O-N 2.92Å; F815-L818 VanDerWaalsContact O-N 3.16Å; F815-L819 HydrophobicContact CD1-CD1 4.24Å; F815-L819 HydrophobicContact CD1-CG 4.5Å; F815-L819 WeakPolarHBondContact O-CB 3.48Å; F815-L819 VanDerWaalsContact O-CG 3.3Å; F815-L819 WeakPolarHBondContact O-CG 3.3Å; F815-L819 PolarHBondContact O-N 3.48Å; F815-L912 HydrophobicContact CD2-CD2 3.52Å; F815-L912 HydrophobicContact CE2-CD2 3.24Å; F815-L912 HydrophobicContact CE2-CG 4.31Å; F815-L912 HydrophobicContact CG-CD2 4.28Å; F815-L912 HydrophobicContact CZ-CD2 3.8Å; F815-W915 HydrophobicContact CE1-CB 3.96Å; F815-W915 HydrophobicContact CE1-CD2 4.36Å; F815-W915 HydrophobicContact CE1-CE3 4.08Å; F815-W915 HydrophobicContact CE1-CG 4.35Å; F815-W915 HydrophobicContact CZ-CB 3.51Å; F815-W915 HydrophobicContact CZ-CD2 4.01Å; F815-W915 HydrophobicContact CZ-CE3 4.2Å; F815-W915 AromaticContact CZ-CG 3.74Å; F815-W915 HydrophobicContact CZ-CG 3.74Å
816	K	47.9	Very low	50.6	Low	123 Å²	123	65.7 Å²	65.7	54%	0.535	32%	0.316	S	S	.	.	H	α-helix	trans	-56.2	-35.2	177.5	-68.9	176.2	-174.2	169.1	0	112.2	I812 E813	I812-K816 WeakPolarHBondContact O-CG 3.34Å; I812-K816 PolarHBondContact O-N 3.46Å; E813-K816 WeakPolarHBondContact O-CB 3.21Å; E813-K816 PolarHBondContact O-N 3.19Å; E813-K816 VanDerWaalsContact O-N 3.15Å; E813-K816 IonicContact OE1-NZ 3.52Å; E813-K816 PolarHBondContact OE1-NZ 3.26Å
817	Y	48.1	Very low	49.4	Very low	130 Å²	130	66 Å²	66	51%	0.51	32%	0.317	S	S	.	.	H	α-helix	trans	-76.6	-40	177.1	-74.5	-72	0	0	0	113.4	E813 S814 F815 L819 N820	E813-Y817 WeakPolarHBondContact O-CD2 3.42Å; E813-Y817 PolarHBondContact O-N 3.08Å; E813-Y817 VanDerWaalsContact O-N 3.12Å; S814-Y817 PolarHBondContact O-N 3.43Å; F815-Y817 PolarHBondContact O-N 3.24Å; Y817-L819 VanDerWaalsContact C-N 3.3Å; Y817-N820 WeakPolarHBondContact O-CB 3.17Å; Y817-N820 PolarHBondContact O-N 2.98Å; Y817-N820 VanDerWaalsContact O-N 3.11Å
818	L	43.6	Very low	48.2	Very low	28 Å²	28	67 Å²	67	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-67.9	-31.7	177.4	-76.5	168.6	0	0	0	112.2	S814 F815 N820 L823 W886 L889 L912 L916	S814-L818 PolarHBondContact O-N 3.5Å; F815-L818 PolarHBondContact O-N 2.92Å; F815-L818 VanDerWaalsContact O-N 3.16Å; L818-N820 PolarHBondContact O-N 3.47Å; L818-L823 HydrophobicContact CD2-CD2 4.46Å; L818-W886 HydrophobicContact CD1-CH2 4.14Å; L818-W886 HydrophobicContact CD1-CZ3 4.2Å; L818-W886 HydrophobicContact CD2-CH2 3.69Å; L818-W886 HydrophobicContact CD2-CZ3 3.97Å; L818-L889 HydrophobicContact CD2-CD1 3.98Å; L818-L912 HydrophobicContact CD1-CD2 4.04Å; L818-L916 HydrophobicContact CD1-CD1 4.41Å
819	L	42	Very low	47.5	Very low	76 Å²	76	71.6 Å²	71.6	40%	0.398	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-1	172.5	-67	171.2	0	0	0	113.2	F815 Y817 P821 Y920	F815-L819 HydrophobicContact CD1-CD1 4.24Å; F815-L819 HydrophobicContact CD1-CG 4.5Å; F815-L819 WeakPolarHBondContact O-CB 3.48Å; F815-L819 VanDerWaalsContact O-CG 3.3Å; F815-L819 WeakPolarHBondContact O-CG 3.3Å; F815-L819 PolarHBondContact O-N 3.48Å; Y817-L819 VanDerWaalsContact C-N 3.3Å; L819-P821 WeakPolarHBondContact O-CD 3.22Å; L819-Y920 HydrophobicContact CD2-CE2 4.42Å
820	N	44.2	Very low	46.9	Very low	53 Å²	53	69.9 Å²	69.9	28%	0.283	33%	0.33	S	S	.	.			trans	-72.8	113	178.1	-169.1	-31.9	0	0	0	110.2	Y817 L818 N822 L823	Y817-N820 WeakPolarHBondContact O-CB 3.17Å; Y817-N820 PolarHBondContact O-N 2.98Å; Y817-N820 VanDerWaalsContact O-N 3.11Å; L818-N820 PolarHBondContact O-N 3.47Å; N820-N822 PolarHBondContact O-N 3.22Å; N820-N822 WeakPolarHBondContact OD1-CB 3.05Å; N820-N822 PolarHBondContact OD1-N 2.98Å; N820-N822 VanDerWaalsContact OD1-N 3.11Å; N820-N822 PolarHBondContact OD1-ND2 3.5Å; N820-N822 VanDerWaalsContact OD1-ND2 3.1Å; N820-L823 VanDerWaalsContact O-CB 3.31Å; N820-L823 WeakPolarHBondContact O-CB 3.45Å; N820-L823 PolarHBondContact O-N 2.83Å
821	P	41.7	Very low	46.4	Very low	87 Å²	87	72.7 Å²	72.7	57%	0.565	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.6	-174.8	24.7	-34	0	0	0	112.9	L819 L823 Y824	L819-P821 WeakPolarHBondContact O-CD 3.22Å; P821-L823 PolarHBondContact O-N 3.11Å; P821-Y824 PolarHBondContact O-N 2.58Å
822	N	42.8	Very low	45.7	Very low	72 Å²	72	76.6 Å²	76.6	39%	0.385	36%	0.361	S	S	.	.	H	α-helix	trans	-69.3	-18.6	177.4	-62.7	-61.2	0	0	0	113.6	N820 Y824 Y825 I826 F841	N820-N822 PolarHBondContact O-N 3.22Å; N820-N822 WeakPolarHBondContact OD1-CB 3.05Å; N820-N822 PolarHBondContact OD1-N 2.98Å; N820-N822 VanDerWaalsContact OD1-N 3.11Å; N820-N822 PolarHBondContact OD1-ND2 3.5Å; N820-N822 VanDerWaalsContact OD1-ND2 3.1Å; N822-Y824 VanDerWaalsContact C-N 3.26Å; N822-Y824 PolarHBondContact O-N 3.14Å; N822-Y825 PolarHBondContact O-N 3.4Å; N822-I826 WeakPolarHBondContact O-CG1 3.38Å; N822-I826 PolarHBondContact O-N 3.48Å; N822-I826 VanDerWaalsContact O-N 3.12Å; N822-F841 HydrophobicContact CB-CD1 4.31Å; N822-F841 HydrophobicContact CB-CE1 4.27Å
823	L	42.2	Very low	45	Very low	41 Å²	41	82 Å²	82	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-60.7	-41	178.7	-147	92.1	0	0	0	110.3	L818 N820 P821 Y825 I826 I827 L885	L818-L823 HydrophobicContact CD2-CD2 4.46Å; N820-L823 VanDerWaalsContact O-CB 3.31Å; N820-L823 WeakPolarHBondContact O-CB 3.45Å; N820-L823 PolarHBondContact O-N 2.83Å; P821-L823 PolarHBondContact O-N 3.11Å; L823-Y825 PolarHBondContact O-N 3.34Å; L823-I826 PolarHBondContact O-N 2.91Å; L823-I827 HydrophobicContact CD2-CD1 4.03Å; L823-I827 HydrophobicContact CG-CD1 4.17Å; L823-I827 WeakPolarHBondContact O-CD1 3.45Å; L823-I827 WeakPolarHBondContact O-CG1 3.45Å; L823-I827 PolarHBondContact O-N 3.23Å; L823-L885 HydrophobicContact CD2-CD2 4.24Å
824	Y	42.5	Very low	44.2	Very low	157 Å²	157	86.7 Å²	86.7	62%	0.616	40%	0.401	S	S	*	.	H	α-helix	trans	-56.7	-48.2	176.3	179.4	-95.6	0	0	0	111.8	P821 N822 I826 I827 D828	P821-Y824 PolarHBondContact O-N 2.58Å; N822-Y824 VanDerWaalsContact C-N 3.26Å; N822-Y824 PolarHBondContact O-N 3.14Å; Y824-I826 VanDerWaalsContact C-N 3.33Å; Y824-I826 PolarHBondContact O-N 3.34Å; Y824-I827 WeakPolarHBondContact O-CB 3.48Å; Y824-I827 PolarHBondContact O-N 2.82Å; Y824-I827 VanDerWaalsContact O-N 3.14Å; Y824-D828 PolarHBondContact O-N 3.3Å
825	Y	44	Very low	43.3	Very low	143 Å²	143	93.3 Å²	93.3	56%	0.561	43%	0.433	S	S	*	.	H	α-helix	trans	-62.8	-37.4	178.2	-69.3	-79.3	0	0	0	112.8	N822 L823 I827 Y829	N822-Y825 PolarHBondContact O-N 3.4Å; L823-Y825 PolarHBondContact O-N 3.34Å; Y825-I827 VanDerWaalsContact C-N 3.33Å; Y825-Y829 WeakPolarHBondContact O-CB 3.2Å; Y825-Y829 PolarHBondContact O-N 3.22Å
826	I	44.3	Very low	42.6	Very low	24 Å²	24	99.3 Å²	99.3	12%	0.123	47%	0.467	C	S	.	.	H	α-helix	trans	-66.2	-38.9	175.8	-65.6	164.5	0	0	0	110.7	N822 L823 Y824 I830 L843	N822-I826 WeakPolarHBondContact O-CG1 3.38Å; N822-I826 PolarHBondContact O-N 3.48Å; N822-I826 VanDerWaalsContact O-N 3.12Å; L823-I826 PolarHBondContact O-N 2.91Å; Y824-I826 VanDerWaalsContact C-N 3.33Å; Y824-I826 PolarHBondContact O-N 3.34Å; I826-I830 HydrophobicContact CG2-CD1 4.05Å; I826-I830 WeakPolarHBondContact O-CD1 3.19Å; I826-I830 WeakPolarHBondContact O-CG1 3.35Å; I826-I830 PolarHBondContact O-N 3.41Å; I826-L843 HydrophobicContact CD1-CD1 3.37Å
827	I	42.6	Very low	41.9	Very low	21 Å²	21	100.2 Å²	100.2	11%	0.108	47%	0.471	C	S	.	.	H	α-helix	trans	-68.9	-45.5	178.8	-68.2	155.8	0	0	0	110.8	L823 Y824 Y825 Y829 I830 K831 L881 L885	L823-I827 HydrophobicContact CD2-CD1 4.03Å; L823-I827 HydrophobicContact CG-CD1 4.17Å; L823-I827 WeakPolarHBondContact O-CD1 3.45Å; L823-I827 WeakPolarHBondContact O-CG1 3.45Å; L823-I827 PolarHBondContact O-N 3.23Å; Y824-I827 WeakPolarHBondContact O-CB 3.48Å; Y824-I827 PolarHBondContact O-N 2.82Å; Y824-I827 VanDerWaalsContact O-N 3.14Å; Y825-I827 VanDerWaalsContact C-N 3.33Å; I827-Y829 VanDerWaalsContact C-N 3.35Å; I827-I830 PolarHBondContact O-N 2.87Å; I827-K831 PolarHBondContact O-N 2.83Å; I827-L881 HydrophobicContact CB-CD2 4.43Å; I827-L881 HydrophobicContact CD1-CD1 3.91Å; I827-L881 HydrophobicContact CD1-CD2 3.43Å; I827-L881 VanDerWaalsContact CD1-CD2 3.43Å; I827-L881 HydrophobicContact CD1-CG 4.13Å; I827-L881 HydrophobicContact CG1-CD2 3.83Å; I827-L881 HydrophobicContact CG2-CD1 4.38Å; I827-L881 HydrophobicContact CG2-CD2 3.76Å; I827-L881 HydrophobicContact CG2-CG 3.92Å; I827-L885 HydrophobicContact CD1-CD2 3.77Å; I827-L885 HydrophobicContact CG1-CD2 4.11Å
828	D	41.7	Very low	41.5	Very low	64 Å²	64	99.3 Å²	99.3	34%	0.342	48%	0.484	S	S	.	.	H	α-helix	trans	-65.1	-40.3	176.9	-167.6	59.3	0	0	0	111.4	Y824 I830 K831 N832	Y824-D828 PolarHBondContact O-N 3.3Å; D828-I830 VanDerWaalsContact C-N 3.34Å; D828-I830 PolarHBondContact O-N 3.38Å; D828-K831 PolarHBondContact O-N 3.18Å; D828-K831 VanDerWaalsContact O-N 3.12Å; D828-N832 WeakPolarHBondContact O-CB 3.37Å; D828-N832 PolarHBondContact O-N 3.23Å; D828-N832 PolarHBondContact OD1-ND2 3.33Å; D828-N832 PolarHBondContact OD2-ND2 3.13Å
829	Y	49.5	Very low	41.1	Very low	101 Å²	101	105.8 Å²	105.8	40%	0.396	51%	0.513	S	S	.	.	H	α-helix	trans	-56.5	-43.5	171.8	173.2	-92.6	0	0	0	112.6	Y825 I827 K831 K833 F837	Y825-Y829 WeakPolarHBondContact O-CB 3.2Å; Y825-Y829 PolarHBondContact O-N 3.22Å; I827-Y829 VanDerWaalsContact C-N 3.35Å; Y829-K831 VanDerWaalsContact C-N 3.34Å; Y829-K833 PolarHBondContact O-N 3.45Å; Y829-F837 HydrophobicContact CE1-CE1 4.5Å; Y829-F837 HydrophobicContact CE1-CE2 4.14Å; Y829-F837 AromaticContact CE1-CZ 3.62Å; Y829-F837 HydrophobicContact CE1-CZ 3.62Å; Y829-F837 HydrophobicContact CE2-CE1 4.35Å; Y829-F837 HydrophobicContact CE2-CE2 4.16Å; Y829-F837 AromaticContact CE2-CZ 3.91Å; Y829-F837 HydrophobicContact CE2-CZ 3.91Å; Y829-F837 AromaticContact CZ-CE2 3.47Å; Y829-F837 VanDerWaalsContact CZ-CE2 3.47Å; Y829-F837 AromaticContact CZ-CZ 3.29Å; Y829-F837 WeakPolarHBondContact OH-CE2 3.32Å; Y829-F837 VanDerWaalsContact OH-CZ 3.23Å; Y829-F837 WeakPolarHBondContact OH-CZ 3.35Å
830	I	44.3	Very low	41	Very low	61 Å²	61	110 Å²	110	31%	0.313	53%	0.528	S	S	.	.	H	α-helix	trans	-67	-35.7	177.5	-69.9	163.2	0	0	0	111.4	I826 I827 D828 F851	I826-I830 HydrophobicContact CG2-CD1 4.05Å; I826-I830 WeakPolarHBondContact O-CD1 3.19Å; I826-I830 WeakPolarHBondContact O-CG1 3.35Å; I826-I830 PolarHBondContact O-N 3.41Å; I827-I830 PolarHBondContact O-N 2.87Å; D828-I830 VanDerWaalsContact C-N 3.34Å; D828-I830 PolarHBondContact O-N 3.38Å; I830-F851 HydrophobicContact CD1-CE1 3.71Å; I830-F851 HydrophobicContact CD1-CZ 4.17Å
831	K	43.6	Very low	40.6	Very low	136 Å²	136	111.7 Å²	111.7	59%	0.591	53%	0.533	S	S	*	.	H	α-helix	trans	-68.7	-46.6	175.4	-86.3	-175.3	174.9	177.1	0	112	I827 D828 Y829 I880	I827-K831 PolarHBondContact O-N 2.83Å; D828-K831 PolarHBondContact O-N 3.18Å; D828-K831 VanDerWaalsContact O-N 3.12Å; Y829-K831 VanDerWaalsContact C-N 3.34Å; K831-I880 PolarHBondContact NZ-O 2.92Å
832	N	44	Very low	40.6	Very low	98 Å²	98	118.9 Å²	118.9	52%	0.524	55%	0.551	S	S	.	*	H	α-helix	trans	-91.6	-10.7	-163.8	-66	-25.5	0	0	0	115.2	D828 K834	D828-N832 WeakPolarHBondContact O-CB 3.37Å; D828-N832 PolarHBondContact O-N 3.23Å; D828-N832 PolarHBondContact OD1-ND2 3.33Å; D828-N832 PolarHBondContact OD2-ND2 3.13Å; N832-K834 PolarHBondContact O-N 3.42Å
833	K	41.1	Very low	40.3	Very low	184 Å²	184	117.8 Å²	117.8	80%	0.8	54%	0.544	S	S	*	.			trans	44	24.5	164.9	-91.5	-167.7	-175	173.9	0	117.6	Y829	Y829-K833 PolarHBondContact O-N 3.45Å
834	K	34.1	Very low	40.4	Very low	178 Å²	178	119 Å²	119	77%	0.774	56%	0.556	S	S	*	*			trans	-138.1	141.9	174.3	-73.9	-174.5	177.1	179	0	109.5	N832	N832-K834 PolarHBondContact O-N 3.42Å
835	I	33.2	Very low	40.5	Very low	153 Å²	153	120.4 Å²	120.4	79%	0.785	57%	0.566	S	S	*	*	S	Bend	trans	105.4	130.3	172.6	-53.1	161.3	0	0	0	114.8
836	N	37.5	Very low	40.6	Very low	156 Å²	156	119.4 Å²	119.4	83%	0.834	57%	0.569	S	S	*	*			trans	-74.2	133.8	-169.5	-81.9	-34.3	0	0	0	112.9	S838	N836-S838 PolarHBondContact O-N 2.97Å; N836-S838 VanDerWaalsContact O-N 3.14Å
837	F	33.7	Very low	40.4	Very low	142 Å²	142	120.5 Å²	120.5	62%	0.623	57%	0.573	S	S	*	*			trans	-64.7	103.6	176.9	-78.3	-81.1	0	0	0	112.9	Y829	Y829-F837 HydrophobicContact CE1-CE1 4.5Å; Y829-F837 HydrophobicContact CE1-CE2 4.14Å; Y829-F837 AromaticContact CE1-CZ 3.62Å; Y829-F837 HydrophobicContact CE1-CZ 3.62Å; Y829-F837 HydrophobicContact CE2-CE1 4.35Å; Y829-F837 HydrophobicContact CE2-CE2 4.16Å; Y829-F837 AromaticContact CE2-CZ 3.91Å; Y829-F837 HydrophobicContact CE2-CZ 3.91Å; Y829-F837 AromaticContact CZ-CE2 3.47Å; Y829-F837 VanDerWaalsContact CZ-CE2 3.47Å; Y829-F837 AromaticContact CZ-CZ 3.29Å; Y829-F837 WeakPolarHBondContact OH-CE2 3.32Å; Y829-F837 VanDerWaalsContact OH-CZ 3.23Å; Y829-F837 WeakPolarHBondContact OH-CZ 3.35Å
838	S	38.3	Very low	40.5	Very low	111 Å²	111	122.2 Å²	122.2	78%	0.776	58%	0.582	S	S	*	*			trans	-111.9	-11.6	156.7	52.3	0	0	0	0	114.1	N836	N836-S838 PolarHBondContact O-N 2.97Å; N836-S838 VanDerWaalsContact O-N 3.14Å
839	E	36.4	Very low	40.8	Very low	164 Å²	164	126.4 Å²	126.4	77%	0.766	60%	0.597	S	S	*	*	S	Bend	trans	-110.4	126.7	-177.7	-68.3	-175.6	167.1	0	0	112.8
840	K	39.4	Very low	40.6	Very low	165 Å²	165	124.8 Å²	124.8	72%	0.717	60%	0.595	S	S	*	*			trans	-91.1	107.9	-167.8	-72.7	-179.9	177	-176.3	0	110.9
841	F	35.9	Very low	40.4	Very low	87 Å²	87	122.7 Å²	122.7	38%	0.382	58%	0.584	S	S	.	*			trans	-69.2	134.6	166.1	-72.1	-83.8	0	0	0	111.7	N822 L843	N822-F841 HydrophobicContact CB-CD1 4.31Å; N822-F841 HydrophobicContact CB-CE1 4.27Å; F841-L843 PolarHBondContact O-N 3.48Å
842	Y	41.6	Very low	40.6	Very low	239 Å²	239	120.1 Å²	120.1	94%	0.937	58%	0.576	S	S	*	*			trans	-80.5	62.2	175.7	-80.4	-93.9	0	0	0	111.9
843	L	36.8	Very low	40.7	Very low	48 Å²	48	121 Å²	121	25%	0.251	58%	0.575	S	S	.	*	S	Bend	trans	-114.8	143.3	165.3	-72.4	170.4	0	0	0	109.1	I826 F841 K845 F847 L848	I826-L843 HydrophobicContact CD1-CD1 3.37Å; F841-L843 PolarHBondContact O-N 3.48Å; L843-K845 PolarHBondContact O-N 2.81Å; L843-F847 HydrophobicContact CB-CD1 4.41Å; L843-F847 HydrophobicContact CD1-CD1 4.29Å; L843-F847 HydrophobicContact CD1-CE1 4.23Å; L843-L848 HydrophobicContact CB-CD1 3.97Å; L843-L848 HydrophobicContact CB-CG 4.39Å
844	S	43.8	Very low	40.6	Very low	66 Å²	66	115 Å²	115	46%	0.462	55%	0.552	S	S	.	*			trans	-55.4	132	179.9	82.3	0	0	0	0	109.5	I846 F847 L848	S844-I846 PolarHBondContact O-N 3.3Å; S844-F847 WeakPolarHBondContact O-CB 3.5Å; S844-F847 PolarHBondContact O-N 3.26Å; S844-F847 VanDerWaalsContact OG-CB 3.27Å; S844-F847 WeakPolarHBondContact OG-CB 3.5Å; S844-F847 PolarHBondContact OG-N 3.38Å; S844-L848 PolarHBondContact O-N 3.21Å
845	K	44.9	Very low	40.6	Very low	188 Å²	188	110 Å²	110	82%	0.817	53%	0.53	S	S	*	.	H	α-helix	trans	-53.4	-29.2	176.5	-83.1	-177.3	177.2	177.5	0	111.9	L843 K849	L843-K845 PolarHBondContact O-N 2.81Å; K845-K849 WeakPolarHBondContact O-CB 3.27Å; K845-K849 PolarHBondContact O-N 3.46Å
846	I	45.4	Very low	41	Very low	121 Å²	121	110.3 Å²	110.3	62%	0.621	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-47.1	177.2	-63.3	168.3	0	0	0	110.2	S844 K849 N850	S844-I846 PolarHBondContact O-N 3.3Å; I846-K849 PolarHBondContact O-N 2.77Å; I846-N850 VanDerWaalsContact O-CB 3.29Å; I846-N850 WeakPolarHBondContact O-CB 3.48Å; I846-N850 VanDerWaalsContact O-CG 3.23Å; I846-N850 PolarHBondContact O-N 2.87Å; I846-N850 PolarHBondContact O-ND2 3.44Å
847	F	41.2	Very low	41	Very low	47 Å²	47	110.5 Å²	110.5	21%	0.206	52%	0.519	C	S	.	.	H	α-helix	trans	-60.7	-55.2	175.4	176.6	-96.4	0	0	0	110.9	L843 S844 K849 N850 F851 Y892	L843-F847 HydrophobicContact CB-CD1 4.41Å; L843-F847 HydrophobicContact CD1-CD1 4.29Å; L843-F847 HydrophobicContact CD1-CE1 4.23Å; S844-F847 WeakPolarHBondContact O-CB 3.5Å; S844-F847 PolarHBondContact O-N 3.26Å; S844-F847 VanDerWaalsContact OG-CB 3.27Å; S844-F847 WeakPolarHBondContact OG-CB 3.5Å; S844-F847 PolarHBondContact OG-N 3.38Å; F847-K849 VanDerWaalsContact C-N 3.28Å; F847-K849 PolarHBondContact O-N 2.76Å; F847-N850 PolarHBondContact O-N 2.83Å; F847-N850 VanDerWaalsContact O-N 3.12Å; F847-F851 HydrophobicContact CE1-CB 4.46Å; F847-F851 HydrophobicContact CE1-CD2 4.46Å; F847-F851 HydrophobicContact CZ-CD2 4.18Å; F847-F851 WeakPolarHBondContact O-CB 3.39Å; F847-F851 PolarHBondContact O-N 3.25Å; F847-Y892 HydrophobicContact CD2-CD2 4.24Å; F847-Y892 AromaticContact CD2-CE2 3.96Å; F847-Y892 HydrophobicContact CD2-CE2 3.96Å
848	L	43.6	Very low	41	Very low	57 Å²	57	107.1 Å²	107.1	30%	0.298	51%	0.507	S	S	.	.	H	α-helix	trans	-56.4	-42.1	178.4	-99.3	157.5	0	0	0	111.9	L843 S844 I852	L843-L848 HydrophobicContact CB-CD1 3.97Å; L843-L848 HydrophobicContact CB-CG 4.39Å; S844-L848 PolarHBondContact O-N 3.21Å; L848-I852 HydrophobicContact CD2-CD1 4.17Å; L848-I852 VanDerWaalsContact O-CB 3.28Å; L848-I852 WeakPolarHBondContact O-CB 3.3Å; L848-I852 WeakPolarHBondContact O-CD1 3.29Å; L848-I852 WeakPolarHBondContact O-CG1 3.24Å; L848-I852 PolarHBondContact O-N 2.77Å
849	K	48.9	Very low	40.7	Very low	152 Å²	152	110.9 Å²	110.9	66%	0.661	51%	0.509	S	S	*	.	H	α-helix	trans	-67.1	-42.4	177.7	-173	177.5	-176.9	178.2	0	112.1	K845 I846 F847 K853	K845-K849 WeakPolarHBondContact O-CB 3.27Å; K845-K849 PolarHBondContact O-N 3.46Å; I846-K849 PolarHBondContact O-N 2.77Å; F847-K849 VanDerWaalsContact C-N 3.28Å; F847-K849 PolarHBondContact O-N 2.76Å; K849-K853 WeakPolarHBondContact O-CB 3.45Å; K849-K853 PolarHBondContact O-N 2.7Å
850	N	43.8	Very low	40.8	Very low	68 Å²	68	111.7 Å²	111.7	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-68	-44.1	177.3	-74.8	-12.7	0	0	0	111.1	I846 F847 K853 N854	I846-N850 VanDerWaalsContact O-CB 3.29Å; I846-N850 WeakPolarHBondContact O-CB 3.48Å; I846-N850 VanDerWaalsContact O-CG 3.23Å; I846-N850 PolarHBondContact O-N 2.87Å; I846-N850 PolarHBondContact O-ND2 3.44Å; F847-N850 PolarHBondContact O-N 2.83Å; F847-N850 VanDerWaalsContact O-N 3.12Å; N850-K853 PolarHBondContact O-N 2.9Å; N850-N854 WeakPolarHBondContact O-CB 3.35Å; N850-N854 PolarHBondContact O-N 2.81Å
851	F	41	Very low	40.8	Very low	17 Å²	17	107.5 Å²	107.5	8%	0.075	50%	0.502	C	S	.	.	H	α-helix	trans	-56	-52.2	174.4	-174.4	-94.2	0	0	0	111.5	I830 F847 K853 F855 L885 T888	I830-F851 HydrophobicContact CD1-CE1 3.71Å; I830-F851 HydrophobicContact CD1-CZ 4.17Å; F847-F851 HydrophobicContact CE1-CB 4.46Å; F847-F851 HydrophobicContact CE1-CD2 4.46Å; F847-F851 HydrophobicContact CZ-CD2 4.18Å; F847-F851 WeakPolarHBondContact O-CB 3.39Å; F847-F851 PolarHBondContact O-N 3.25Å; F851-K853 PolarHBondContact O-N 2.83Å; F851-F855 HydrophobicContact CE1-CD2 4.49Å; F851-F855 HydrophobicContact CZ-CD2 4.46Å; F851-F855 HydrophobicContact CZ-CE2 4.36Å; F851-F855 PolarHBondContact O-N 2.82Å; F851-L885 HydrophobicContact CE2-CD1 3.49Å; F851-L885 VanDerWaalsContact CE2-CD1 3.49Å; F851-L885 HydrophobicContact CZ-CD1 3.39Å; F851-T888 HydrophobicContact CD2-CG2 3.91Å; F851-T888 HydrophobicContact CE2-CG2 4.31Å
852	I	48.1	Very low	40.9	Very low	81 Å²	81	109.9 Å²	109.9	42%	0.415	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-38.9	176.8	-67.4	165.6	0	0	0	112	L848 F855 K856	L848-I852 HydrophobicContact CD2-CD1 4.17Å; L848-I852 VanDerWaalsContact O-CB 3.28Å; L848-I852 WeakPolarHBondContact O-CB 3.3Å; L848-I852 WeakPolarHBondContact O-CD1 3.29Å; L848-I852 WeakPolarHBondContact O-CG1 3.24Å; L848-I852 PolarHBondContact O-N 2.77Å; I852-F855 PolarHBondContact O-N 3.41Å; I852-K856 HydrophobicContact CG2-CD 4.37Å; I852-K856 PolarHBondContact O-N 3.02Å
853	K	45.2	Very low	41	Very low	117 Å²	117	101.1 Å²	101.1	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-38.9	-178.8	-176	-176.3	-178.7	-171	0	111.8	K849 N850 F851 K856 K857	K849-K853 WeakPolarHBondContact O-CB 3.45Å; K849-K853 PolarHBondContact O-N 2.7Å; N850-K853 PolarHBondContact O-N 2.9Å; F851-K853 PolarHBondContact O-N 2.83Å; K853-K856 PolarHBondContact O-N 2.79Å; K853-K857 PolarHBondContact O-N 3.14Å
854	N	39.6	Very low	41	Very low	59 Å²	59	101.6 Å²	101.6	32%	0.316	49%	0.494	S	S	.	.	H	α-helix	trans	-69.2	-40.6	176.4	-74.5	0.2	0	0	0	110.7	N850 K856 K857 T888 E891	N850-N854 WeakPolarHBondContact O-CB 3.35Å; N850-N854 PolarHBondContact O-N 2.81Å; N854-K856 VanDerWaalsContact C-N 3.35Å; N854-K856 PolarHBondContact O-N 2.82Å; N854-K857 PolarHBondContact O-N 3.45Å; N854-T888 HydrophobicContact CB-CG2 4.31Å; N854-E891 PolarHBondContact ND2-OE2 2.85Å
855	F	34.3	Very low	40.6	Very low	72 Å²	72	103.8 Å²	103.8	32%	0.316	50%	0.501	S	S	.	.	H	α-helix	trans	-59.7	-39.3	173.6	-118.9	-87.6	0	0	0	113.5	F851 I852 K857 Y884	F851-F855 HydrophobicContact CE1-CD2 4.49Å; F851-F855 HydrophobicContact CZ-CD2 4.46Å; F851-F855 HydrophobicContact CZ-CE2 4.36Å; F851-F855 PolarHBondContact O-N 2.82Å; I852-F855 PolarHBondContact O-N 3.41Å; F855-K857 PolarHBondContact O-N 3.15Å; F855-Y884 HydrophobicContact CZ-CG 4.34Å
856	K	40.8	Very low	40.4	Very low	160 Å²	160	98.2 Å²	98.2	70%	0.696	49%	0.486	S	S	*	.	H	α-helix	trans	-73.5	-21.5	-178.2	-78.6	-174.1	178.6	-176	0	115	I852 K853 N854 I858	I852-K856 HydrophobicContact CG2-CD 4.37Å; I852-K856 PolarHBondContact O-N 3.02Å; K853-K856 PolarHBondContact O-N 2.79Å; N854-K856 VanDerWaalsContact C-N 3.35Å; N854-K856 PolarHBondContact O-N 2.82Å; K856-I858 VanDerWaalsContact C-N 3.27Å; K856-I858 PolarHBondContact O-N 2.91Å
857	K	38.1	Very low	39.8	Very low	159 Å²	159	95.8 Å²	95.8	69%	0.691	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.5	-178.1	-86.4	-175.7	170.8	-173	0	113.7	K853 N854 F855 K859	K853-K857 PolarHBondContact O-N 3.14Å; N854-K857 PolarHBondContact O-N 3.45Å; F855-K857 PolarHBondContact O-N 3.15Å; K857-K859 VanDerWaalsContact C-N 3.32Å; K857-K859 PolarHBondContact O-N 3.46Å; K857-K859 VanDerWaalsContact O-N 3.12Å
858	I	35	Very low	39.5	Very low	72 Å²	72	97.1 Å²	97.1	37%	0.369	48%	0.482	S	S	.	.			trans	-92.7	60.8	-172.1	-49	175.9	0	0	0	110	K856 Y884	K856-I858 VanDerWaalsContact C-N 3.27Å; K856-I858 PolarHBondContact O-N 2.91Å; I858-Y884 HydrophobicContact CD1-CD1 3.65Å; I858-Y884 HydrophobicContact CD1-CE1 3.65Å; I858-Y884 HydrophobicContact CG2-CE1 4.03Å
859	K	31.4	Very low	39.2	Very low	189 Å²	189	99.5 Å²	99.5	82%	0.822	50%	0.495	S	S	*	.			trans	-115.7	14.9	-178.5	-93.7	-163	176.7	-166.4	0	115	K857	K857-K859 VanDerWaalsContact C-N 3.32Å; K857-K859 PolarHBondContact O-N 3.46Å; K857-K859 VanDerWaalsContact O-N 3.12Å
860	K	37.9	Very low	38.6	Very low	181 Å²	181	100.3 Å²	100.3	79%	0.787	50%	0.495	S	S	*	.			trans	-83.4	116.4	170.3	-77.3	-171	173.4	-173	0	108.9	D862 S863	K860-D862 VanDerWaalsContact C-N 3.31Å; K860-D862 PolarHBondContact O-N 3.48Å; K860-S863 PolarHBondContact O-OG 3.31Å
861	S	40.6	Very low	37.9	Very low	77 Å²	77	99.9 Å²	99.9	54%	0.538	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.7	-165.3	46.3	0	0	0	0	115	S863 I864	S861-S863 PolarHBondContact O-N 3.03Å; S861-I864 PolarHBondContact O-N 3.3Å
862	D	36.2	Very low	37.5	Very low	138 Å²	138	102.2 Å²	102.2	74%	0.738	51%	0.51	S	S	*	.	H	α-helix	trans	-82	-22.3	-164	-56.2	-11.5	0	0	0	112.7	K860 I864	K860-D862 VanDerWaalsContact C-N 3.31Å; K860-D862 PolarHBondContact O-N 3.48Å; D862-I864 VanDerWaalsContact C-N 3.3Å
863	S	45.5	Very low	36.9	Very low	54 Å²	54	105.6 Å²	105.6	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-78	-15.8	172.2	59.4	0	0	0	0	113.1	K860 S861 S866 L867	K860-S863 PolarHBondContact O-OG 3.31Å; S861-S863 PolarHBondContact O-N 3.03Å; S863-S866 PolarHBondContact O-OG 3.4Å; S863-L867 WeakPolarHBondContact O-CB 3.31Å; S863-L867 WeakPolarHBondContact O-CD1 3.25Å; S863-L867 PolarHBondContact O-N 2.77Å
864	I	34.8	Very low	36.3	Very low	58 Å²	58	105.4 Å²	105.4	30%	0.297	53%	0.528	S	S	.	.	H	α-helix	trans	-74.9	-40.8	-176.3	-65.5	174.5	0	0	0	110.7	S861 D862 L867 I868	S861-I864 PolarHBondContact O-N 3.3Å; D862-I864 VanDerWaalsContact C-N 3.3Å; I864-L867 PolarHBondContact O-N 3.46Å; I864-I868 HydrophobicContact CG2-CD1 3.47Å; I864-I868 VanDerWaalsContact CG2-CD1 3.47Å; I864-I868 HydrophobicContact CG2-CG1 4.03Å; I864-I868 VanDerWaalsContact O-CB 3.32Å; I864-I868 WeakPolarHBondContact O-CB 3.29Å; I864-I868 WeakPolarHBondContact O-CG1 3.43Å; I864-I868 PolarHBondContact O-N 2.86Å
865	N	37.3	Very low	35.8	Very low	113 Å²	113	110.1 Å²	110.1	60%	0.604	55%	0.546	S	S	*	.	H	α-helix	trans	-71.3	-35.9	-178.1	-75.9	-13.7	0	0	0	113	I868 N869	N865-I868 PolarHBondContact O-N 3.48Å; N865-N869 PolarHBondContact O-N 3.07Å
866	S	40.7	Very low	35.6	Very low	71 Å²	71	117.5 Å²	117.5	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-69.3	-36.5	174.1	81	0	0	0	0	111.7	S863 N869 Y870	S863-S866 PolarHBondContact O-OG 3.4Å; S866-N869 PolarHBondContact O-N 3.5Å; S866-Y870 PolarHBondContact O-N 3.1Å
867	L	31.8	Very low	35	Very low	70 Å²	70	111.9 Å²	111.9	37%	0.366	56%	0.56	S	S	.	*	H	α-helix	trans	-71.6	-37.5	174.8	-101.2	133.7	0	0	0	112.3	S863 I864 N869 Y870 C871	S863-L867 WeakPolarHBondContact O-CB 3.31Å; S863-L867 WeakPolarHBondContact O-CD1 3.25Å; S863-L867 PolarHBondContact O-N 2.77Å; I864-L867 PolarHBondContact O-N 3.46Å; L867-N869 VanDerWaalsContact C-N 3.3Å; L867-Y870 PolarHBondContact O-N 3.47Å; L867-C871 VanDerWaalsContact O-CB 3.31Å; L867-C871 WeakPolarHBondContact O-CB 2.97Å; L867-C871 PolarHBondContact O-N 2.87Å; L867-C871 PolarHBondContact O-SG 2.71Å
868	I	35.9	Very low	34.8	Very low	75 Å²	75	109.1 Å²	109.1	39%	0.385	56%	0.557	S	S	.	*	H	α-helix	trans	-62.8	-40	172.1	-74.2	171.8	0	0	0	109.7	I864 N865 C871 N872	I864-I868 HydrophobicContact CG2-CD1 3.47Å; I864-I868 VanDerWaalsContact CG2-CD1 3.47Å; I864-I868 HydrophobicContact CG2-CG1 4.03Å; I864-I868 VanDerWaalsContact O-CB 3.32Å; I864-I868 WeakPolarHBondContact O-CB 3.29Å; I864-I868 WeakPolarHBondContact O-CG1 3.43Å; I864-I868 PolarHBondContact O-N 2.86Å; N865-I868 PolarHBondContact O-N 3.48Å; I868-C871 CarbonylContact O-C 3.58Å; I868-C871 PolarHBondContact O-N 2.91Å; I868-N872 WeakPolarHBondContact CG2-ND2 3.43Å; I868-N872 VanDerWaalsContact O-CB 3.24Å; I868-N872 WeakPolarHBondContact O-CB 3.3Å; I868-N872 PolarHBondContact O-N 3.26Å; I868-N872 PolarHBondContact O-ND2 3.28Å
869	N	37.2	Very low	34.5	Very low	106 Å²	106	109.5 Å²	109.5	57%	0.567	58%	0.579	S	S	*	*	H	α-helix	trans	-64.5	-43.8	175	-79.7	-4.2	0	0	0	112.1	N865 S866 L867 C871 N872 E873	N865-N869 PolarHBondContact O-N 3.07Å; S866-N869 PolarHBondContact O-N 3.5Å; L867-N869 VanDerWaalsContact C-N 3.3Å; N869-C871 VanDerWaalsContact C-N 3.32Å; N869-C871 PolarHBondContact O-N 2.8Å; N869-N872 PolarHBondContact O-N 3.16Å; N869-N872 VanDerWaalsContact O-N 3.15Å; N869-E873 PolarHBondContact O-N 3.48Å
870	Y	36.4	Very low	34.9	Very low	170 Å²	170	104.7 Å²	104.7	67%	0.667	56%	0.561	S	S	*	*	H	α-helix	trans	-62.7	-37.5	173.1	-103.7	-74.8	0	0	0	112.9	S866 L867 L874	S866-Y870 PolarHBondContact O-N 3.1Å; L867-Y870 PolarHBondContact O-N 3.47Å; Y870-L874 PolarHBondContact O-N 3.04Å
871	C	29.1	Very low	34.9	Very low	59 Å²	59	99.2 Å²	99.2	40%	0.399	54%	0.54	S	S	.	.	H	α-helix	trans	-73.4	-27.5	174.4	-70.2	0	0	0	0	112.7	L867 I868 N869 L874 K875	L867-C871 VanDerWaalsContact O-CB 3.31Å; L867-C871 WeakPolarHBondContact O-CB 2.97Å; L867-C871 PolarHBondContact O-N 2.87Å; L867-C871 PolarHBondContact O-SG 2.71Å; I868-C871 CarbonylContact O-C 3.58Å; I868-C871 PolarHBondContact O-N 2.91Å; N869-C871 VanDerWaalsContact C-N 3.32Å; N869-C871 PolarHBondContact O-N 2.8Å; C871-L874 CarbonylContact O-C 3.24Å; C871-L874 PolarHBondContact O-N 3.32Å; C871-K875 PolarHBondContact O-N 3.19Å
872	N	31.3	Very low	35	Very low	66 Å²	66	98.1 Å²	98.1	35%	0.353	53%	0.532	S	S	.	.	H	α-helix	trans	-74	-34.9	175	-80	-24.1	0	0	0	111.1	I868 N869 L874 K875	I868-N872 WeakPolarHBondContact CG2-ND2 3.43Å; I868-N872 VanDerWaalsContact O-CB 3.24Å; I868-N872 WeakPolarHBondContact O-CB 3.3Å; I868-N872 PolarHBondContact O-N 3.26Å; I868-N872 PolarHBondContact O-ND2 3.28Å; N869-N872 PolarHBondContact O-N 3.16Å; N869-N872 VanDerWaalsContact O-N 3.15Å; N872-L874 VanDerWaalsContact C-N 3.27Å; N872-L874 PolarHBondContact O-N 2.96Å; N872-K875 WeakPolarHBondContact O-CB 3.27Å; N872-K875 PolarHBondContact O-N 3.49Å; N872-K875 VanDerWaalsContact O-N 3.12Å
873	E	36.3	Very low	35.2	Very low	151 Å²	151	94 Å²	94	71%	0.706	52%	0.518	S	S	*	.	H	α-helix	trans	-62.5	-37	168.5	-74.4	-163.4	161.5	0	0	111.4	N869 K875	N869-E873 PolarHBondContact O-N 3.48Å; E873-K875 VanDerWaalsContact C-N 3.29Å; E873-K875 PolarHBondContact O-N 2.62Å
874	L	33.2	Very low	35.1	Very low	114 Å²	114	94.4 Å²	94.4	60%	0.597	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-77.6	-9.5	174	-74.6	164.9	0	0	0	114.1	Y870 C871 N872 Y876 G877 I880	Y870-L874 PolarHBondContact O-N 3.04Å; C871-L874 CarbonylContact O-C 3.24Å; C871-L874 PolarHBondContact O-N 3.32Å; N872-L874 VanDerWaalsContact C-N 3.27Å; N872-L874 PolarHBondContact O-N 2.96Å; L874-Y876 PolarHBondContact O-N 3.29Å; L874-G877 PolarHBondContact O-N 3.33Å; L874-I880 HydrophobicContact CB-CD1 4.2Å
875	K	27.3	Very low	35.6	Very low	158 Å²	158	92.3 Å²	92.3	69%	0.687	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-71	-14.9	-178.5	-160.3	179.2	-177.9	-174.1	0	112.9	C871 N872 E873 G877	C871-K875 PolarHBondContact O-N 3.19Å; N872-K875 WeakPolarHBondContact O-CB 3.27Å; N872-K875 PolarHBondContact O-N 3.49Å; N872-K875 VanDerWaalsContact O-N 3.12Å; E873-K875 VanDerWaalsContact C-N 3.29Å; E873-K875 PolarHBondContact O-N 2.62Å; K875-G877 VanDerWaalsContact C-N 3.27Å; K875-G877 PolarHBondContact O-N 2.69Å
876	Y	31.8	Very low	36.2	Very low	226 Å²	226	90 Å²	90	89%	0.886	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-82.5	5.6	178.6	-72.2	-70.5	0	0	0	114.8	L874	L874-Y876 PolarHBondContact O-N 3.29Å
877	G	27.9	Very low	36.3	Very low	42 Å²	42	90.5 Å²	90.5	43%	0.433	48%	0.48	S	S	.	.	S	Bend	trans	-155.7	121	171.4	0	0	0	0	0	112.7	L874 K875	L874-G877 PolarHBondContact O-N 3.33Å; K875-G877 VanDerWaalsContact C-N 3.27Å; K875-G877 PolarHBondContact O-N 2.69Å
878	T	32.4	Very low	37	Very low	102 Å²	102	87.9 Å²	87.9	63%	0.626	47%	0.467	S	S	*	.	S	Bend	trans	69.7	137.2	161.7	72.9	0	0	0	0	118.4	I880	T878-I880 VanDerWaalsContact O-CG1 3.27Å; T878-I880 WeakPolarHBondContact O-CG1 3.27Å; T878-I880 PolarHBondContact O-N 3.3Å
879	G	30.4	Very low	37.5	Very low	80 Å²	80	86.2 Å²	86.2	83%	0.825	46%	0.458	S	S	*	.			trans	-63	115.3	-166.9	0	0	0	0	0	114.9
880	I	38.6	Very low	37.8	Very low	87 Å²	87	82.9 Å²	82.9	45%	0.446	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-92.4	132.4	-168.9	-59.3	179.1	0	0	0	113.7	K831 L874 T878	K831-I880 PolarHBondContact NZ-O 2.92Å; L874-I880 HydrophobicContact CB-CD1 4.2Å; T878-I880 VanDerWaalsContact O-CG1 3.27Å; T878-I880 WeakPolarHBondContact O-CG1 3.27Å; T878-I880 PolarHBondContact O-N 3.3Å
881	L	39.2	Very low	38.1	Very low	67 Å²	67	79.6 Å²	79.6	35%	0.351	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-93.6	130.2	158.3	-129.5	144	0	0	0	108.5	I827 A883 L885	I827-L881 HydrophobicContact CB-CD2 4.43Å; I827-L881 HydrophobicContact CD1-CD1 3.91Å; I827-L881 HydrophobicContact CD1-CD2 3.43Å; I827-L881 VanDerWaalsContact CD1-CD2 3.43Å; I827-L881 HydrophobicContact CD1-CG 4.13Å; I827-L881 HydrophobicContact CG1-CD2 3.83Å; I827-L881 HydrophobicContact CG2-CD1 4.38Å; I827-L881 HydrophobicContact CG2-CD2 3.76Å; I827-L881 HydrophobicContact CG2-CG 3.92Å; L881-A883 PolarHBondContact O-N 2.93Å; L881-L885 HydrophobicContact CD2-CB 4.4Å; L881-L885 HydrophobicContact CD2-CD2 3.42Å; L881-L885 VanDerWaalsContact CD2-CD2 3.42Å; L881-L885 HydrophobicContact CD2-CG 4.48Å
882	S	42.5	Very low	38.9	Very low	53 Å²	53	83 Å²	83	37%	0.371	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-61.7	134.1	-162.8	74.7	0	0	0	0	113.2	Y884 L885	S882-Y884 PolarHBondContact O-N 3.3Å; S882-L885 PolarHBondContact O-N 3.49Å
883	A	40.1	Very low	39.4	Very low	52 Å²	52	81.9 Å²	81.9	43%	0.43	43%	0.432	S	S	.	.	H	α-helix	trans	-46.4	-26.9	174.1	0	0	0	0	0	114.2	L881 W886 I887	L881-A883 PolarHBondContact O-N 2.93Å; A883-W886 PolarHBondContact O-N 2.86Å; A883-I887 WeakPolarHBondContact O-CG1 3.48Å; A883-I887 PolarHBondContact O-N 3.29Å
884	Y	43.4	Very low	39.7	Very low	63 Å²	63	79.4 Å²	79.4	25%	0.247	42%	0.423	C	S	.	.	H	α-helix	trans	-62.8	-38	176.5	-66.6	-70.6	0	0	0	114.6	F855 I858 S882 W886 I887 T888	F855-Y884 HydrophobicContact CZ-CG 4.34Å; I858-Y884 HydrophobicContact CD1-CD1 3.65Å; I858-Y884 HydrophobicContact CD1-CE1 3.65Å; I858-Y884 HydrophobicContact CG2-CE1 4.03Å; S882-Y884 PolarHBondContact O-N 3.3Å; Y884-W886 PolarHBondContact O-N 3.06Å; Y884-I887 PolarHBondContact O-N 3.1Å; Y884-T888 PolarHBondContact O-N 3.01Å; Y884-T888 VanDerWaalsContact O-N 3.11Å; Y884-T888 PolarHBondContact O-OG1 3.2Å
885	L	45.8	Very low	39.9	Very low	14 Å²	14	75.8 Å²	75.8	7%	0.073	41%	0.405	C	S	.	.	H	α-helix	trans	-61.3	-40.3	176.2	-171.8	81.6	0	0	0	110.3	L823 I827 F851 L881 S882 T888 L889	L823-L885 HydrophobicContact CD2-CD2 4.24Å; I827-L885 HydrophobicContact CD1-CD2 3.77Å; I827-L885 HydrophobicContact CG1-CD2 4.11Å; F851-L885 HydrophobicContact CE2-CD1 3.49Å; F851-L885 VanDerWaalsContact CE2-CD1 3.49Å; F851-L885 HydrophobicContact CZ-CD1 3.39Å; L881-L885 HydrophobicContact CD2-CB 4.4Å; L881-L885 HydrophobicContact CD2-CD2 3.42Å; L881-L885 VanDerWaalsContact CD2-CD2 3.42Å; L881-L885 HydrophobicContact CD2-CG 4.48Å; S882-L885 PolarHBondContact O-N 3.49Å; L885-T888 WeakPolarHBondContact CA-OG1 3.48Å; L885-T888 WeakPolarHBondContact O-CB 3.47Å; L885-T888 PolarHBondContact O-N 3.02Å; L885-T888 PolarHBondContact O-OG1 2.95Å; L885-T888 VanDerWaalsContact O-OG1 3.09Å; L885-L889 PolarHBondContact O-N 2.88Å; L885-L889 VanDerWaalsContact O-N 3.09Å
886	W	48.5	Very low	40.6	Very low	63 Å²	63	73.6 Å²	73.6	24%	0.239	39%	0.393	C	S	.	.	H	α-helix	trans	-69.7	-43.9	-179.8	-69.6	113.1	0	0	0	112.6	L818 A883 Y884 T888 L889 V890	L818-W886 HydrophobicContact CD1-CH2 4.14Å; L818-W886 HydrophobicContact CD1-CZ3 4.2Å; L818-W886 HydrophobicContact CD2-CH2 3.69Å; L818-W886 HydrophobicContact CD2-CZ3 3.97Å; A883-W886 PolarHBondContact O-N 2.86Å; Y884-W886 PolarHBondContact O-N 3.06Å; W886-T888 PolarHBondContact O-N 3.05Å; W886-L889 HydrophobicContact CE3-CD1 3.88Å; W886-L889 HydrophobicContact CZ3-CD1 3.91Å; W886-L889 PolarHBondContact O-N 3.49Å; W886-L889 VanDerWaalsContact O-N 3.15Å; W886-V890 WeakPolarHBondContact O-CB 3.42Å; W886-V890 VanDerWaalsContact O-CG2 3.31Å; W886-V890 WeakPolarHBondContact O-CG2 3.38Å; W886-V890 PolarHBondContact O-N 3.27Å
887	I	43.4	Very low	40.8	Very low	83 Å²	83	66.8 Å²	66.8	43%	0.426	37%	0.371	S	S	.	.	H	α-helix	trans	-54.8	-38.4	171.1	-65.9	167.9	0	0	0	109.9	A883 Y884 E891	A883-I887 WeakPolarHBondContact O-CG1 3.48Å; A883-I887 PolarHBondContact O-N 3.29Å; Y884-I887 PolarHBondContact O-N 3.1Å; I887-E891 HydrophobicContact CG2-CG 4.14Å; I887-E891 VanDerWaalsContact O-CB 3.27Å; I887-E891 WeakPolarHBondContact O-CB 3.48Å; I887-E891 VanDerWaalsContact O-CG 3.27Å; I887-E891 WeakPolarHBondContact O-CG 3.22Å; I887-E891 PolarHBondContact O-N 3.36Å
888	T	45.5	Very low	41.3	Very low	15 Å²	15	68.1 Å²	68.1	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-69.1	-39.1	179.5	-3	0	0	0	0	113.4	F851 N854 Y884 L885 W886 Y892	F851-T888 HydrophobicContact CD2-CG2 3.91Å; F851-T888 HydrophobicContact CE2-CG2 4.31Å; N854-T888 HydrophobicContact CB-CG2 4.31Å; Y884-T888 PolarHBondContact O-N 3.01Å; Y884-T888 VanDerWaalsContact O-N 3.11Å; Y884-T888 PolarHBondContact O-OG1 3.2Å; L885-T888 WeakPolarHBondContact CA-OG1 3.48Å; L885-T888 WeakPolarHBondContact O-CB 3.47Å; L885-T888 PolarHBondContact O-N 3.02Å; L885-T888 PolarHBondContact O-OG1 2.95Å; L885-T888 VanDerWaalsContact O-OG1 3.09Å; W886-T888 PolarHBondContact O-N 3.05Å; T888-Y892 WeakPolarHBondContact O-CB 3.47Å; T888-Y892 PolarHBondContact O-N 2.85Å
889	L	46.5	Very low	41.7	Very low	40 Å²	40	71.9 Å²	71.9	21%	0.209	38%	0.375	C	S	.	.	H	α-helix	trans	-67.5	-41.8	176.4	-74.2	170.1	0	0	0	111.8	L818 L885 W886 Y892 N893	L818-L889 HydrophobicContact CD2-CD1 3.98Å; L885-L889 PolarHBondContact O-N 2.88Å; L885-L889 VanDerWaalsContact O-N 3.09Å; W886-L889 HydrophobicContact CE3-CD1 3.88Å; W886-L889 HydrophobicContact CZ3-CD1 3.91Å; W886-L889 PolarHBondContact O-N 3.49Å; W886-L889 VanDerWaalsContact O-N 3.15Å; L889-Y892 PolarHBondContact O-N 3.33Å; L889-N893 WeakPolarHBondContact O-CB 3.38Å; L889-N893 PolarHBondContact O-N 2.97Å
890	V	44.4	Very low	42.1	Very low	35 Å²	35	73.3 Å²	73.3	21%	0.212	36%	0.364	C	S	.	.	H	α-helix	trans	-65.6	-44.9	177.6	171.1	0	0	0	0	111.2	W886 N893 N894 L895 I897	W886-V890 WeakPolarHBondContact O-CB 3.42Å; W886-V890 VanDerWaalsContact O-CG2 3.31Å; W886-V890 WeakPolarHBondContact O-CG2 3.38Å; W886-V890 PolarHBondContact O-N 3.27Å; V890-N893 PolarHBondContact O-N 2.83Å; V890-N894 PolarHBondContact O-N 3.38Å; V890-L895 HydrophobicContact CG1-CB 4.18Å; V890-L895 WeakPolarHBondContact CG1-O 3.31Å; V890-L895 PolarHBondContact O-N 3.14Å; V890-I897 HydrophobicContact CG1-CD1 4Å; V890-I897 HydrophobicContact CG1-CG1 3.99Å; V890-I897 HydrophobicContact CG2-CD1 4.46Å
891	E	43.5	Very low	42.4	Very low	101 Å²	101	69.4 Å²	69.4	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-66.9	-41.1	175	-76.6	-177.4	170.4	0	0	112.6	N854 I887 N893 N894	N854-E891 PolarHBondContact ND2-OE2 2.85Å; I887-E891 HydrophobicContact CG2-CG 4.14Å; I887-E891 VanDerWaalsContact O-CB 3.27Å; I887-E891 WeakPolarHBondContact O-CB 3.48Å; I887-E891 VanDerWaalsContact O-CG 3.27Å; I887-E891 WeakPolarHBondContact O-CG 3.22Å; I887-E891 PolarHBondContact O-N 3.36Å; E891-N893 PolarHBondContact O-N 3.23Å; E891-N894 PolarHBondContact O-N 3.26Å; E891-N894 VanDerWaalsContact O-N 3.16Å
892	Y	44.1	Very low	42.7	Very low	131 Å²	131	69.5 Å²	69.5	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-34	179.5	-175.8	-99.9	0	0	0	112.1	F847 T888 L889 N894	F847-Y892 HydrophobicContact CD2-CD2 4.24Å; F847-Y892 AromaticContact CD2-CE2 3.96Å; F847-Y892 HydrophobicContact CD2-CE2 3.96Å; T888-Y892 WeakPolarHBondContact O-CB 3.47Å; T888-Y892 PolarHBondContact O-N 2.85Å; L889-Y892 PolarHBondContact O-N 3.33Å; Y892-N894 VanDerWaalsContact C-N 3.34Å
893	N	42	Very low	42.9	Very low	43 Å²	43	72.5 Å²	72.5	23%	0.23	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	8.6	179.2	-70.4	-20	0	0	0	113.8	L810 S814 L889 V890 E891 L895	L810-N893 HydrophobicContact CD1-CB 4.39Å; L810-N893 HydrophobicContact CD2-CB 4.43Å; S814-N893 PolarHBondContact OG-ND2 2.92Å; L889-N893 WeakPolarHBondContact O-CB 3.38Å; L889-N893 PolarHBondContact O-N 2.97Å; V890-N893 PolarHBondContact O-N 2.83Å; E891-N893 PolarHBondContact O-N 3.23Å; N893-L895 HydrophobicContact CB-CD1 4.42Å; N893-L895 HydrophobicContact CB-CG 4.49Å; N893-L895 PolarHBondContact O-N 2.93Å
894	N	42.8	Very low	43.2	Very low	98 Å²	98	71.6 Å²	71.6	52%	0.524	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	25.9	-177.4	-72.4	-30.8	0	0	0	114.7	V890 E891 Y892 Y896	V890-N894 PolarHBondContact O-N 3.38Å; E891-N894 PolarHBondContact O-N 3.26Å; E891-N894 VanDerWaalsContact O-N 3.16Å; Y892-N894 VanDerWaalsContact C-N 3.34Å; N894-Y896 HydrophobicContact CB-CE2 4.32Å; N894-Y896 WeakPolarHBondContact O-CD2 3.47Å; N894-Y896 PolarHBondContact O-N 3.03Å
895	L	37.5	Very low	43.5	Very low	39 Å²	39	69.2 Å²	69.2	20%	0.204	33%	0.334	C	S	.	.			trans	-85.3	84.8	174	-70.6	169.6	0	0	0	108.5	L810 V890 N893 I897	L810-L895 HydrophobicContact CD2-CD1 4.35Å; L810-L895 HydrophobicContact CD2-CD2 4.48Å; L810-L895 HydrophobicContact CD2-CG 4.42Å; V890-L895 HydrophobicContact CG1-CB 4.18Å; V890-L895 WeakPolarHBondContact CG1-O 3.31Å; V890-L895 PolarHBondContact O-N 3.14Å; N893-L895 HydrophobicContact CB-CD1 4.42Å; N893-L895 HydrophobicContact CB-CG 4.49Å; N893-L895 PolarHBondContact O-N 2.93Å; L895-I897 PolarHBondContact O-N 3.49Å
896	Y	41.5	Very low	43.6	Very low	112 Å²	112	74.1 Å²	74.1	44%	0.439	36%	0.355	S	S	.	.			trans	-68.9	108.3	176.9	-61.9	-87.1	0	0	0	109.8	F717 N727 N894 I898	F717-Y896 AromaticContact CE2-CD2 3.64Å; F717-Y896 HydrophobicContact CE2-CD2 3.64Å; F717-Y896 AromaticContact CE2-CE2 3.59Å; F717-Y896 HydrophobicContact CE2-CE2 3.59Å; F717-Y896 HydrophobicContact CE2-CG 4.34Å; F717-Y896 HydrophobicContact CZ-CD1 4.08Å; F717-Y896 AromaticContact CZ-CD2 3.51Å; F717-Y896 HydrophobicContact CZ-CD2 3.51Å; F717-Y896 HydrophobicContact CZ-CE1 4.19Å; F717-Y896 AromaticContact CZ-CE2 3.66Å; F717-Y896 HydrophobicContact CZ-CE2 3.66Å; F717-Y896 AromaticContact CZ-CG 3.74Å; F717-Y896 HydrophobicContact CZ-CG 3.74Å; N727-Y896 PolarHBondContact ND2-O 3.05Å; N727-Y896 VanDerWaalsContact ND2-O 3.08Å; N894-Y896 HydrophobicContact CB-CE2 4.32Å; N894-Y896 WeakPolarHBondContact O-CD2 3.47Å; N894-Y896 PolarHBondContact O-N 3.03Å; Y896-I898 VanDerWaalsContact C-N 3.34Å; Y896-I898 PolarHBondContact O-N 3.17Å; Y896-I898 VanDerWaalsContact O-N 3.09Å
897	I	37	Very low	43.7	Very low	83 Å²	83	72 Å²	72	43%	0.426	35%	0.35	S	S	.	.			trans	-78.2	89.4	167.3	-56.3	175.8	0	0	0	107.1	V890 L895 I902	V890-I897 HydrophobicContact CG1-CD1 4Å; V890-I897 HydrophobicContact CG1-CG1 3.99Å; V890-I897 HydrophobicContact CG2-CD1 4.46Å; L895-I897 PolarHBondContact O-N 3.49Å; I897-I902 HydrophobicContact CG2-CG1 4.01Å
898	I	38.8	Very low	44.2	Very low	70 Å²	70	69.6 Å²	69.6	36%	0.359	34%	0.336	S	S	.	.			trans	-80.3	155.1	173.7	-39.8	170	0	0	0	107.9	Y896 N900 N901 I902	Y896-I898 VanDerWaalsContact C-N 3.34Å; Y896-I898 PolarHBondContact O-N 3.17Å; Y896-I898 VanDerWaalsContact O-N 3.09Å; I898-N900 PolarHBondContact O-N 2.91Å; I898-N901 PolarHBondContact O-N 3.27Å; I898-I902 PolarHBondContact O-N 3.05Å
899	K	40	Very low	44.4	Very low	180 Å²	180	71.7 Å²	71.7	78%	0.783	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-46.3	-31.3	-178.7	-142.4	179.2	-175.1	-176.1	0	113.8	I902	K899-I902 HydrophobicContact CG-CD1 4.13Å
900	N	39.8	Very low	44.5	Very low	111 Å²	111	74 Å²	74	59%	0.594	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-79.4	-16.9	-179.4	-62.5	4	0	0	0	114.6	I898	I898-N900 PolarHBondContact O-N 2.91Å
901	N	43.3	Very low	44.9	Very low	5 Å²	5	74.3 Å²	74.3	3%	0.027	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-116.7	15.9	-177.4	-68.3	-39.3	0	0	0	113.1	N725 N727 I898 E903 I904 G905	N725-N901 PolarHBondContact O-ND2 2.76Å; N725-N901 PolarHBondContact O-OD1 2.76Å; N727-N901 HydrophobicContact CB-CB 4.37Å; N727-N901 WeakPolarHBondContact CB-ND2 3.5Å; N727-N901 PolarHBondContact N-ND2 3.47Å; N727-N901 PolarHBondContact N-OD1 2.7Å; N727-N901 PolarHBondContact ND2-ND2 3.43Å; N727-N901 PolarHBondContact OD1-ND2 2.74Å; I898-N901 PolarHBondContact O-N 3.27Å; N901-E903 VanDerWaalsContact C-N 3.28Å; N901-E903 PolarHBondContact O-N 2.83Å; N901-I904 PolarHBondContact O-N 2.82Å; N901-G905 PolarHBondContact O-N 3.48Å
902	I	46.6	Very low	45.3	Very low	68 Å²	68	69.9 Å²	69.9	35%	0.349	34%	0.338	S	S	.	.	H	α-helix	trans	-55.1	-43.4	-179.6	-77.4	170.9	0	0	0	111.4	I897 I898 K899 G905 K906	I897-I902 HydrophobicContact CG2-CG1 4.01Å; I898-I902 PolarHBondContact O-N 3.05Å; K899-I902 HydrophobicContact CG-CD1 4.13Å; I902-G905 PolarHBondContact O-N 3.34Å; I902-K906 HydrophobicContact CG2-CD 4.15Å; I902-K906 HydrophobicContact CG2-CG 4.39Å; I902-K906 VanDerWaalsContact O-CG 3.31Å; I902-K906 WeakPolarHBondContact O-CG 3.36Å; I902-K906 PolarHBondContact O-N 3Å
903	E	45.9	Very low	45.6	Very low	117 Å²	117	68.8 Å²	68.8	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-40.6	179.9	-69.1	-64.1	124	0	0	112.4	N901 K906 S907	N901-E903 VanDerWaalsContact C-N 3.28Å; N901-E903 PolarHBondContact O-N 2.83Å; E903-K906 PolarHBondContact O-N 3.2Å; E903-K906 IonicContact OE1-NZ 3.62Å; E903-K906 PolarHBondContact OE1-NZ 3.49Å; E903-S907 PolarHBondContact O-N 3.36Å; E903-S907 PolarHBondContact O-OG 2.9Å
904	I	48	Very low	45.9	Very low	33 Å²	33	72.6 Å²	72.6	17%	0.169	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-42.2	177.3	-58.7	172.8	0	0	0	110.4	I726 I730 N901 S907 Y908	I726-I904 HydrophobicContact CG2-CD1 4.47Å; I730-I904 HydrophobicContact CB-CG2 3.87Å; I730-I904 HydrophobicContact CD1-CG2 4.38Å; I730-I904 HydrophobicContact CG2-CG2 3.96Å; N901-I904 PolarHBondContact O-N 2.82Å; I904-S907 PolarHBondContact O-N 2.87Å; I904-Y908 WeakPolarHBondContact O-CB 3.19Å; I904-Y908 PolarHBondContact O-N 3.15Å
905	G	49.7	Very low	46.2	Very low	13 Å²	13	74.5 Å²	74.5	13%	0.134	34%	0.344	C	S	.	.	H	α-helix	trans	-60.8	-42.7	174	0	0	0	0	0	112.3	N901 I902 Y908 V909	N901-G905 PolarHBondContact O-N 3.48Å; I902-G905 PolarHBondContact O-N 3.34Å; G905-Y908 PolarHBondContact O-N 2.84Å; G905-V909 VanDerWaalsContact O-CG2 3.23Å; G905-V909 WeakPolarHBondContact O-CG2 3.35Å; G905-V909 PolarHBondContact O-N 3.28Å
906	K	47.9	Very low	46.6	Very low	116 Å²	116	74.2 Å²	74.2	50%	0.504	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-49.9	175.1	-75.4	174.8	-176.6	171.7	0	111.9	I902 E903 Y908 V909 E910	I902-K906 HydrophobicContact CG2-CD 4.15Å; I902-K906 HydrophobicContact CG2-CG 4.39Å; I902-K906 VanDerWaalsContact O-CG 3.31Å; I902-K906 WeakPolarHBondContact O-CG 3.36Å; I902-K906 PolarHBondContact O-N 3Å; E903-K906 PolarHBondContact O-N 3.2Å; E903-K906 IonicContact OE1-NZ 3.62Å; E903-K906 PolarHBondContact OE1-NZ 3.49Å; K906-Y908 VanDerWaalsContact C-N 3.33Å; K906-Y908 PolarHBondContact O-N 3.32Å; K906-V909 WeakPolarHBondContact O-CB 3.09Å; K906-V909 PolarHBondContact O-N 2.99Å; K906-V909 VanDerWaalsContact O-N 3.16Å; K906-E910 PolarHBondContact O-N 3.27Å
907	S	50	Low	46.6	Very low	20 Å²	20	73.6 Å²	73.6	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-40.3	179.3	-57.9	0	0	0	0	112.2	Y803 E903 I904 V909 E910 I911	Y803-S907 PolarHBondContact OH-OG 3.5Å; E903-S907 PolarHBondContact O-N 3.36Å; E903-S907 PolarHBondContact O-OG 2.9Å; I904-S907 PolarHBondContact O-N 2.87Å; S907-V909 VanDerWaalsContact C-N 3.33Å; S907-V909 PolarHBondContact O-N 3.29Å; S907-E910 PolarHBondContact O-N 2.91Å; S907-I911 WeakPolarHBondContact O-CD1 3.47Å; S907-I911 WeakPolarHBondContact O-CG1 3.36Å; S907-I911 PolarHBondContact O-N 3.29Å
908	Y	52.9	Low	46.7	Very low	32 Å²	32	75.8 Å²	75.8	13%	0.125	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-42.5	174.8	-178.1	-95.7	0	0	0	112.1	I730 I805 F811 I904 G905 K906 L912	I730-Y908 HydrophobicContact CD1-CD2 3.24Å; I730-Y908 HydrophobicContact CD1-CE2 3.78Å; I730-Y908 HydrophobicContact CD1-CG 3.87Å; I730-Y908 HydrophobicContact CG1-CD2 4.4Å; I805-Y908 HydrophobicContact CD1-CD2 4.36Å; I805-Y908 HydrophobicContact CD1-CE2 4.14Å; F811-Y908 HydrophobicContact CD2-CD2 4.2Å; F811-Y908 AromaticContact CD2-CE2 3.31Å; F811-Y908 HydrophobicContact CD2-CE2 3.31Å; F811-Y908 AromaticContact CD2-CZ 3.56Å; F811-Y908 WeakPolarHBondContact CD2-OH 3.29Å; F811-Y908 HydrophobicContact CE2-CD2 4.26Å; F811-Y908 AromaticContact CE2-CE2 3.78Å; F811-Y908 HydrophobicContact CE2-CE2 3.78Å; F811-Y908 HydrophobicContact CG-CE2 4.37Å; I904-Y908 WeakPolarHBondContact O-CB 3.19Å; I904-Y908 PolarHBondContact O-N 3.15Å; G905-Y908 PolarHBondContact O-N 2.84Å; K906-Y908 VanDerWaalsContact C-N 3.33Å; K906-Y908 PolarHBondContact O-N 3.32Å; Y908-L912 HydrophobicContact CD1-CD1 3.76Å; Y908-L912 HydrophobicContact CE1-CD1 3.34Å; Y908-L912 PolarHBondContact O-N 2.93Å; Y908-L912 VanDerWaalsContact O-N 3.17Å
909	V	50	Low	46.7	Very low	58 Å²	58	75 Å²	75	35%	0.352	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-43.2	175.3	170.9	0	0	0	0	111.2	G905 K906 S907 I911 L912 W913	G905-V909 VanDerWaalsContact O-CG2 3.23Å; G905-V909 WeakPolarHBondContact O-CG2 3.35Å; G905-V909 PolarHBondContact O-N 3.28Å; K906-V909 WeakPolarHBondContact O-CB 3.09Å; K906-V909 PolarHBondContact O-N 2.99Å; K906-V909 VanDerWaalsContact O-N 3.16Å; S907-V909 VanDerWaalsContact C-N 3.33Å; S907-V909 PolarHBondContact O-N 3.29Å; V909-I911 VanDerWaalsContact C-N 3.34Å; V909-I911 PolarHBondContact O-N 3.25Å; V909-L912 PolarHBondContact O-N 3.41Å; V909-W913 WeakPolarHBondContact O-CB 3.32Å; V909-W913 PolarHBondContact O-N 2.94Å
910	E	49.2	Very low	46.4	Very low	90 Å²	90	72.7 Å²	72.7	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-41.7	178	-170.3	-178.7	172.9	0	0	111.6	K906 S907 W913 R914	K906-E910 PolarHBondContact O-N 3.27Å; S907-E910 PolarHBondContact O-N 2.91Å; E910-W913 PolarHBondContact O-N 3.14Å; E910-R914 HydrophobicContact CG-CG 4.45Å; E910-R914 WeakPolarHBondContact O-CB 3.04Å; E910-R914 WeakPolarHBondContact O-CG 3.48Å; E910-R914 PolarHBondContact O-N 2.96Å; E910-R914 IonicContact OE1-CZ 3.63Å; E910-R914 VanDerWaalsContact OE1-CZ 3.3Å; E910-R914 IonicContact OE1-NE 2.76Å; E910-R914 PolarHBondContact OE1-NE 2.8Å; E910-R914 IonicContact OE1-NH2 2.74Å; E910-R914 PolarHBondContact OE1-NH2 3.31Å
911	I	52.5	Low	46	Very low	40 Å²	40	72.5 Å²	72.5	21%	0.205	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-44.9	178.1	-67.9	163.4	0	0	0	111.2	L767 Y803 F811 S907 V909 W915	L767-I911 HydrophobicContact CD1-CD1 3.71Å; L767-I911 HydrophobicContact CD1-CG2 4.16Å; L767-I911 HydrophobicContact CD2-CG2 4.23Å; Y803-I911 HydrophobicContact CD2-CD1 4.42Å; F811-I911 HydrophobicContact CZ-CG2 4.25Å; S907-I911 WeakPolarHBondContact O-CD1 3.47Å; S907-I911 WeakPolarHBondContact O-CG1 3.36Å; S907-I911 PolarHBondContact O-N 3.29Å; V909-I911 VanDerWaalsContact C-N 3.34Å; V909-I911 PolarHBondContact O-N 3.25Å; I911-W915 PolarHBondContact O-N 3.04Å
912	L	52.3	Low	45.5	Very low	9 Å²	9	78 Å²	78	5%	0.047	38%	0.384	C	S	.	.	H	α-helix	trans	-62.7	-42.1	174.8	-84.9	162.9	0	0	0	111.8	F811 F815 L818 Y908 V909 W915 L916	F811-L912 HydrophobicContact CE2-CD1 4.32Å; F811-L912 HydrophobicContact CE2-CD2 4.01Å; F811-L912 HydrophobicContact CE2-CG 3.84Å; F811-L912 HydrophobicContact CZ-CD2 4.43Å; F811-L912 HydrophobicContact CZ-CG 4.5Å; F815-L912 HydrophobicContact CD2-CD2 3.52Å; F815-L912 HydrophobicContact CE2-CD2 3.24Å; F815-L912 HydrophobicContact CE2-CG 4.31Å; F815-L912 HydrophobicContact CG-CD2 4.28Å; F815-L912 HydrophobicContact CZ-CD2 3.8Å; L818-L912 HydrophobicContact CD1-CD2 4.04Å; Y908-L912 HydrophobicContact CD1-CD1 3.76Å; Y908-L912 HydrophobicContact CE1-CD1 3.34Å; Y908-L912 PolarHBondContact O-N 2.93Å; Y908-L912 VanDerWaalsContact O-N 3.17Å; V909-L912 PolarHBondContact O-N 3.41Å; L912-W915 PolarHBondContact O-N 3.06Å; L912-L916 WeakPolarHBondContact O-CG 3.31Å; L912-L916 PolarHBondContact O-N 3.21Å
913	W	50.3	Low	44.7	Very low	107 Å²	107	80.1 Å²	80.1	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-50.5	178.4	-175.6	-73.2	0	0	0	111.8	V909 E910 W915 L916 E917	V909-W913 WeakPolarHBondContact O-CB 3.32Å; V909-W913 PolarHBondContact O-N 2.94Å; E910-W913 PolarHBondContact O-N 3.14Å; W913-W915 PolarHBondContact O-N 3.21Å; W913-L916 CarbonylContact O-C 3.57Å; W913-L916 WeakPolarHBondContact O-CA 3.21Å; W913-L916 WeakPolarHBondContact O-CB 3.33Å; W913-L916 PolarHBondContact O-N 2.88Å; W913-E917 VanDerWaalsContact CD1-CD 3.48Å; W913-E917 PolarHBondContact NE1-OE1 2.73Å; W913-E917 PolarHBondContact O-N 3.25Å
914	R	48	Very low	44.1	Very low	123 Å²	123	82.2 Å²	82.2	46%	0.464	41%	0.413	S	S	.	.	H	α-helix	trans	-60	-34.5	179.6	-74.2	-171.7	-177.6	-156.4	5.8	112.1	E910 L918	E910-R914 HydrophobicContact CG-CG 4.45Å; E910-R914 WeakPolarHBondContact O-CB 3.04Å; E910-R914 WeakPolarHBondContact O-CG 3.48Å; E910-R914 PolarHBondContact O-N 2.96Å; E910-R914 IonicContact OE1-CZ 3.63Å; E910-R914 VanDerWaalsContact OE1-CZ 3.3Å; E910-R914 IonicContact OE1-NE 2.76Å; E910-R914 PolarHBondContact OE1-NE 2.8Å; E910-R914 IonicContact OE1-NH2 2.74Å; E910-R914 PolarHBondContact OE1-NH2 3.31Å; R914-L918 WeakPolarHBondContact O-CG 3.39Å; R914-L918 PolarHBondContact O-N 3.04Å; R914-L918 VanDerWaalsContact O-N 3.13Å
915	W	50	Low	43.5	Very low	138 Å²	138	84.7 Å²	84.7	52%	0.523	43%	0.431	S	S	.	.	H	α-helix	trans	-68.9	-38.8	171.3	-99.4	83.8	0	0	0	113.2	F815 I911 L912 W913 L918 A919	F815-W915 HydrophobicContact CE1-CB 3.96Å; F815-W915 HydrophobicContact CE1-CD2 4.36Å; F815-W915 HydrophobicContact CE1-CE3 4.08Å; F815-W915 HydrophobicContact CE1-CG 4.35Å; F815-W915 HydrophobicContact CZ-CB 3.51Å; F815-W915 HydrophobicContact CZ-CD2 4.01Å; F815-W915 HydrophobicContact CZ-CE3 4.2Å; F815-W915 AromaticContact CZ-CG 3.74Å; F815-W915 HydrophobicContact CZ-CG 3.74Å; I911-W915 PolarHBondContact O-N 3.04Å; L912-W915 PolarHBondContact O-N 3.06Å; W913-W915 PolarHBondContact O-N 3.21Å; W915-L918 PolarHBondContact O-N 3.29Å; W915-A919 WeakPolarHBondContact O-CB 3.07Å; W915-A919 PolarHBondContact O-N 3.21Å
916	L	45.2	Very low	42.7	Very low	34 Å²	34	89.9 Å²	89.9	18%	0.178	46%	0.456	C	S	.	.	H	α-helix	trans	-67.4	-38.4	174.6	-79.2	169.4	0	0	0	112.3	L818 L912 W913 L918 A919 Y920	L818-L916 HydrophobicContact CD1-CD1 4.41Å; L912-L916 WeakPolarHBondContact O-CG 3.31Å; L912-L916 PolarHBondContact O-N 3.21Å; W913-L916 CarbonylContact O-C 3.57Å; W913-L916 WeakPolarHBondContact O-CA 3.21Å; W913-L916 WeakPolarHBondContact O-CB 3.33Å; W913-L916 PolarHBondContact O-N 2.88Å; L916-L918 VanDerWaalsContact C-N 3.3Å; L916-L918 PolarHBondContact O-N 3.16Å; L916-A919 PolarHBondContact O-N 3.3Å; L916-Y920 HydrophobicContact CD2-CD2 4.47Å; L916-Y920 PolarHBondContact O-N 3.46Å
917	E	41.7	Very low	42.1	Very low	99 Å²	99	91.2 Å²	91.2	46%	0.463	47%	0.467	S	S	.	.	H	α-helix	trans	-60.2	-39.6	171.1	-88.1	178.1	170.8	0	0	111.7	W913 Y920 P921	W913-E917 VanDerWaalsContact CD1-CD 3.48Å; W913-E917 PolarHBondContact NE1-OE1 2.73Å; W913-E917 PolarHBondContact O-N 3.25Å; E917-Y920 CarbonylContact O-C 3.55Å; E917-Y920 PolarHBondContact O-N 3.28Å; E917-P921 WeakPolarHBondContact O-CA 3.5Å
918	L	38.6	Very low	41.2	Very low	129 Å²	129	98.9 Å²	98.9	68%	0.675	50%	0.499	S	S	*	.	H	α-helix	trans	-67.5	-39	174.5	-75.8	166.9	0	0	0	112.3	R914 W915 L916 Y920	R914-L918 WeakPolarHBondContact O-CG 3.39Å; R914-L918 PolarHBondContact O-N 3.04Å; R914-L918 VanDerWaalsContact O-N 3.13Å; W915-L918 PolarHBondContact O-N 3.29Å; L916-L918 VanDerWaalsContact C-N 3.3Å; L916-L918 PolarHBondContact O-N 3.16Å; L918-Y920 VanDerWaalsContact C-N 3.32Å
919	A	39.4	Very low	40.1	Very low	53 Å²	53	105.7 Å²	105.7	44%	0.438	53%	0.529	S	S	.	.	H	α-helix	trans	-71.9	-27.9	176.8	0	0	0	0	0	112.6	W915 L916	W915-A919 WeakPolarHBondContact O-CB 3.07Å; W915-A919 PolarHBondContact O-N 3.21Å; L916-A919 PolarHBondContact O-N 3.3Å
920	Y	33.9	Very low	39.2	Very low	132 Å²	132	110.4 Å²	110.4	52%	0.518	55%	0.552	S	S	.	*	S	Bend	trans	-140.5	78.2	-177.8	-61.6	-82.9	0	0	0	110.4	L819 L916 E917 L918 V922	L819-Y920 HydrophobicContact CD2-CE2 4.42Å; L916-Y920 HydrophobicContact CD2-CD2 4.47Å; L916-Y920 PolarHBondContact O-N 3.46Å; E917-Y920 CarbonylContact O-C 3.55Å; E917-Y920 PolarHBondContact O-N 3.28Å; L918-Y920 VanDerWaalsContact C-N 3.32Å; Y920-V922 PolarHBondContact O-N 2.56Å
921	P	30.7	Very low	38.1	Very low	107 Å²	107	114.7 Å²	114.7	70%	0.695	57%	0.57	S	S	*	*			trans	-62.2	111	-179.8	23	-31.9	0	0	0	109.8	E917	E917-P921 WeakPolarHBondContact O-CA 3.5Å
922	V	33.4	Very low	37	Very low	119 Å²	119	119.9 Å²	119.9	72%	0.721	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-81.9	118.9	169.7	-177	0	0	0	0	106.5	Y920 E924	Y920-V922 PolarHBondContact O-N 2.56Å; V922-E924 PolarHBondContact O-N 3.15Å
923	P	30.2	Very low	36	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-61.1	130.1	-178.9	22.2	-30	0	0	0	110.5
924	E	31.9	Very low	35	Very low	160 Å²	160	129.1 Å²	129.1	75%	0.748	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-57.4	138.3	-174.3	-84.3	-178.3	154.9	0	0	112.3	V922 D926	V922-E924 PolarHBondContact O-N 3.15Å; E924-D926 VanDerWaalsContact C-N 3.33Å; E924-D926 PolarHBondContact O-N 3.33Å
925	P	35.8	Very low	34	Very low	85 Å²	85	129.9 Å²	129.9	55%	0.552	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-83.7	3.2	-174	-5.5	24.8	0	0	0	115	L927	P925-L927 PolarHBondContact O-N 2.74Å; P925-L927 VanDerWaalsContact O-N 3.11Å
926	D	33.2	Very low	33.1	Very low	122 Å²	122	131.8 Å²	131.8	65%	0.652	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-77.9	6.1	-169.7	-78.1	-19.4	0	0	0	115	E924 F928	E924-D926 VanDerWaalsContact C-N 3.33Å; E924-D926 PolarHBondContact O-N 3.33Å; D926-F928 PolarHBondContact O-N 2.8Å; D926-F928 VanDerWaalsContact O-N 3.15Å
927	L	34.3	Very low	32.3	Very low	144 Å²	144	133.2 Å²	133.2	75%	0.754	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-71.2	5.1	167.8	-98.5	154.2	0	0	0	114.5	P925	P925-L927 PolarHBondContact O-N 2.74Å; P925-L927 VanDerWaalsContact O-N 3.11Å
928	F	30.9	Very low	31.8	Very low	181 Å²	181	132.4 Å²	132.4	79%	0.794	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-119.4	10.4	-178.3	-76.1	-73.9	0	0	0	116.9	D926	D926-F928 PolarHBondContact O-N 2.8Å; D926-F928 VanDerWaalsContact O-N 3.15Å
929	K	31.2	Very low	31.5	Very low	176 Å²	176	133 Å²	133	77%	0.765	71%	0.705	S	S	*	*	S	Bend	trans	-101.9	-6.7	178.5	-85.8	-175	177.5	174.4	0	117.3
930	N	31	Very low	31.4	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	72%	0.719	S	S	*	*	S	Bend	trans	-111.6	20.3	-178.7	-74.4	-6.9	0	0	0	114.9
931	F	25.9	Very low	31.4	Very low	180 Å²	180	137.2 Å²	137.2	79%	0.789	73%	0.725	S	S	*	*			trans	-104	23.2	176.2	-90.2	-74.1	0	0	0	114.5
932	D	29.9	Very low	31.4	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	72%	0.721	S	S	*	*			trans	-104.6	100.4	162.8	-85.3	-30.2	0	0	0	109.1
933	T	30.4	Very low	31.5	Very low	128 Å²	128	137.9 Å²	137.9	79%	0.785	72%	0.718	S	S	*	*	S	Bend	trans	143.8	122.2	146.1	50.2	0	0	0	0	110.5
934	Q	28.5	Very low	31.7	Very low	182 Å²	182	137.4 Å²	137.4	85%	0.85	72%	0.717	S	S	*	*			trans	69.9	91.6	169.7	-51.7	-179	1.6	0	0	115.6
935	I	27.4	Very low	31.5	Very low	139 Å²	139	133.5 Å²	133.5	71%	0.713	71%	0.707	S	S	*	*				-160.7	103.3	127.3	-88.5	140	0	0	0	105.9	V937	I935-V937 VanDerWaalsContact C-N 3.32Å; I935-V937 HydrophobicContact CG2-CB 3.76Å; I935-V937 HydrophobicContact CG2-CG2 3.38Å; I935-V937 PolarHBondContact O-N 3.36Å; I935-V937 VanDerWaalsContact O-N 3.11Å
936	N	30.6	Very low	31.1	Very low	179 Å²	179	136.5 Å²	136.5	96%	0.957	72%	0.717	S	S	*	*			trans	-70.6	89.7	162.4	-83.2	-23.7	0	0	0	107.4
937	V	29.1	Very low	30.7	Very low	64 Å²	64	141.5 Å²	141.5	39%	0.388	73%	0.727	S	S	.	*			trans	-126.5	130.8	166.3	168.5	0	0	0	0	107.9	I935 E941	I935-V937 VanDerWaalsContact C-N 3.32Å; I935-V937 HydrophobicContact CG2-CB 3.76Å; I935-V937 HydrophobicContact CG2-CG2 3.38Å; I935-V937 PolarHBondContact O-N 3.36Å; I935-V937 VanDerWaalsContact O-N 3.11Å; V937-E941 HydrophobicContact CG1-CB 4.12Å
938	S	31.9	Very low	30.2	Very low	81 Å²	81	142.8 Å²	142.8	57%	0.566	73%	0.727	S	S	*	*			trans	-49.2	139.7	-176.8	41.1	0	0	0	0	112.5	D940 E941	S938-D940 PolarHBondContact O-N 2.92Å; S938-E941 PolarHBondContact O-N 3.47Å; S938-E941 VanDerWaalsContact O-N 3.12Å
939	L	33	Very low	30	Very low	141 Å²	141	143.6 Å²	143.6	74%	0.738	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-11.5	-172.6	-146.1	78.6	0	0	0	115.1	N943	L939-N943 PolarHBondContact O-ND2 3.07Å
940	D	37.1	Very low	29.8	Very low	140 Å²	140	143.4 Å²	143.4	75%	0.749	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-27.6	-179.6	-66.6	-25.8	0	0	0	113.4	S938	S938-D940 PolarHBondContact O-N 2.92Å
941	E	32	Very low	29.7	Very low	135 Å²	135	146.2 Å²	146.2	63%	0.631	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-20.5	179.9	-75.4	-172.7	157.3	0	0	113.8	V937 S938 N943	V937-E941 HydrophobicContact CG1-CB 4.12Å; S938-E941 PolarHBondContact O-N 3.47Å; S938-E941 VanDerWaalsContact O-N 3.12Å; E941-N943 VanDerWaalsContact C-N 3.32Å; E941-N943 PolarHBondContact O-N 2.96Å
942	L	31.2	Very low	29.9	Very low	119 Å²	119	144.7 Å²	144.7	62%	0.623	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-4.3	176.2	-93.1	159.1	0	0	0	114
943	N	35.4	Very low	30	Very low	120 Å²	120	142.3 Å²	142.3	64%	0.642	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-9.8	178.3	-83.2	-41.9	0	0	0	114.7	L939 E941	L939-N943 PolarHBondContact O-ND2 3.07Å; E941-N943 VanDerWaalsContact C-N 3.32Å; E941-N943 PolarHBondContact O-N 2.96Å
944	S	34.5	Very low	30.2	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	70%	0.697	S	S	*	*	S	Bend	trans	-107.3	-8.4	-174.7	55.5	0	0	0	0	116.3
945	S	28	Very low	30.6	Very low	78 Å²	78	135.3 Å²	135.3	55%	0.545	69%	0.69	S	S	.	*	S	Bend	trans	-151.4	100.1	178	54.8	0	0	0	0	111.9
946	I	26.7	Very low	31.1	Very low	148 Å²	148	137.4 Å²	137.4	76%	0.759	69%	0.688	S	S	*	*	S	Bend	trans	154.2	91.9	141.8	-74	154.7	0	0	0	109.2	K948	I946-K948 PolarHBondContact O-N 2.86Å
947	W	24.9	Very low	31.5	Very low	228 Å²	228	133.3 Å²	133.3	86%	0.864	66%	0.664	S	S	*	*			trans	62.2	52	132.2	-57.8	27.4	0	0	0	116.9	F949	W947-F949 PolarHBondContact O-N 3.33Å
948	K	25.7	Very low	31.9	Very low	170 Å²	170	134.3 Å²	134.3	74%	0.739	67%	0.666	S	S	*	*			trans	-74.9	110.8	151.1	-74.6	176	-179.8	167.8	0	107.5	I946 K950	I946-K948 PolarHBondContact O-N 2.86Å; K948-K950 PolarHBondContact O-N 2.75Å
949	F	25.2	Very low	32.2	Very low	199 Å²	199	131.2 Å²	131.2	87%	0.873	65%	0.645	S	S	*	*			trans	-54.7	82.8	161.2	-88.3	-90.2	0	0	0	108.4	W947 Y951	W947-F949 PolarHBondContact O-N 3.33Å; F949-Y951 PolarHBondContact O-N 3Å
950	K	27.2	Very low	32.6	Very low	172 Å²	172	127.9 Å²	127.9	75%	0.748	63%	0.628	S	S	*	*			trans	-75.3	104.4	169.8	-93.4	-177.4	173.3	178.7	0	105.8	K948 F952	K948-K950 PolarHBondContact O-N 2.75Å; K950-F952 PolarHBondContact O-N 3.43Å; K950-F952 VanDerWaalsContact O-N 3.11Å
951	Y	28.3	Very low	32.9	Very low	215 Å²	215	125 Å²	125	84%	0.843	62%	0.619	S	S	*	*			trans	-26	112.1	154	-77.6	-96	0	0	0	110.6	F949 P953	F949-Y951 PolarHBondContact O-N 3Å; Y951-P953 WeakPolarHBondContact O-CD 3.2Å
952	F	30.1	Very low	33.3	Very low	149 Å²	149	122.5 Å²	122.5	65%	0.654	62%	0.615	S	S	*	*			trans	-70.7	104	173.8	-67.6	-84.3	0	0	0	108.9	K950 S954	K950-F952 PolarHBondContact O-N 3.43Å; K950-F952 VanDerWaalsContact O-N 3.11Å; F952-S954 PolarHBondContact O-N 3.42Å
953	P	33.7	Very low	33.4	Very low	98 Å²	98	119.9 Å²	119.9	64%	0.636	62%	0.617	S	S	*	*			trans	-98.5	79.1	179.7	27.2	-5.4	0	0	0	108.3	Y951 E957	Y951-P953 WeakPolarHBondContact O-CD 3.2Å; P953-E957 WeakPolarHBondContact CD-OE2 3.46Å
954	S	33.5	Very low	33.5	Very low	55 Å²	55	120.3 Å²	120.3	39%	0.385	62%	0.618	S	S	.	*			trans	147.7	148.2	144.5	66.3	0	0	0	0	112.6	F952 R956 E957 I958	F952-S954 PolarHBondContact O-N 3.42Å; S954-R956 PolarHBondContact O-N 3.01Å; S954-R956 VanDerWaalsContact O-N 3.07Å; S954-E957 PolarHBondContact O-N 3.47Å; S954-E957 VanDerWaalsContact O-N 3.09Å; S954-I958 PolarHBondContact O-N 3.46Å
955	P	36.7	Very low	33.5	Very low	108 Å²	108	119.9 Å²	119.9	70%	0.701	61%	0.606	S	S	*	*	H	α-helix	trans	-56.7	-25.1	-178.6	-26.7	35	0	0	0	115.2	I958 A959	P955-I958 PolarHBondContact O-N 3.23Å; P955-A959 WeakPolarHBondContact O-CB 3.33Å; P955-A959 PolarHBondContact O-N 3.09Å
956	R	38.4	Very low	34	Very low	182 Å²	182	120.9 Å²	120.9	69%	0.687	61%	0.614	S	S	*	*	H	α-helix	trans	-66.6	-38.6	177.9	-172.7	178.4	-179.8	-175.5	-0.1	111.9	S954 A959 L960	S954-R956 PolarHBondContact O-N 3.01Å; S954-R956 VanDerWaalsContact O-N 3.07Å; R956-A959 PolarHBondContact O-N 3.14Å; R956-L960 HydrophobicContact CG-CD1 4.5Å; R956-L960 PolarHBondContact O-N 3.34Å
957	E	38.3	Very low	34.3	Very low	94 Å²	94	118.8 Å²	118.8	44%	0.439	61%	0.612	S	S	.	*	H	α-helix	trans	-74.1	-33.2	177.7	-67.7	-177.3	167.8	0	0	111.5	P953 S954 A959 L960 S961	P953-E957 WeakPolarHBondContact CD-OE2 3.46Å; S954-E957 PolarHBondContact O-N 3.47Å; S954-E957 VanDerWaalsContact O-N 3.09Å; E957-A959 VanDerWaalsContact C-N 3.34Å; E957-L960 PolarHBondContact O-N 3.42Å; E957-S961 WeakPolarHBondContact O-CB 3.44Å; E957-S961 PolarHBondContact O-N 2.88Å; E957-S961 PolarHBondContact O-OG 3.14Å
958	I	38	Very low	34.9	Very low	84 Å²	84	113.8 Å²	113.8	43%	0.431	61%	0.607	S	S	.	*	H	α-helix	trans	-61.8	-45.5	170.6	-60.6	175.8	0	0	0	109.6	S954 P955 L960 S961 C962	S954-I958 PolarHBondContact O-N 3.46Å; P955-I958 PolarHBondContact O-N 3.23Å; I958-L960 PolarHBondContact O-N 2.73Å; I958-S961 WeakPolarHBondContact CA-OG 3.14Å; I958-S961 PolarHBondContact O-N 3.36Å; I958-S961 PolarHBondContact O-OG 3.39Å; I958-C962 WeakPolarHBondContact O-CB 3.4Å; I958-C962 PolarHBondContact O-N 2.71Å; I958-C962 PolarHBondContact O-SG 3.11Å; I958-C962 VanDerWaalsContact O-SG 3.41Å
959	A	38.7	Very low	35.2	Very low	16 Å²	16	114.4 Å²	114.4	13%	0.132	61%	0.612	C	S	.	*	H	α-helix	trans	-65.3	-35.5	178.2	0	0	0	0	0	113.6	P955 R956 E957 G963 I964 I965	P955-A959 WeakPolarHBondContact O-CB 3.33Å; P955-A959 PolarHBondContact O-N 3.09Å; R956-A959 PolarHBondContact O-N 3.14Å; E957-A959 VanDerWaalsContact C-N 3.34Å; A959-G963 PolarHBondContact O-N 3.47Å; A959-I964 HydrophobicContact CB-CB 4.37Å; A959-I964 WeakPolarHBondContact O-CB 3.22Å; A959-I964 PolarHBondContact O-N 2.93Å; A959-I965 HydrophobicContact CB-CD1 3.67Å; A959-I965 HydrophobicContact CB-CG1 3.98Å; A959-I965 PolarHBondContact O-N 2.64Å
960	L	41.7	Very low	35.6	Very low	71 Å²	71	110.7 Å²	110.7	37%	0.372	61%	0.611	S	S	.	*	H	α-helix	trans	-67.9	-42.6	171.4	-78.2	160.7	0	0	0	111.6	R956 E957 I958 G963 I965	R956-L960 HydrophobicContact CG-CD1 4.5Å; R956-L960 PolarHBondContact O-N 3.34Å; E957-L960 PolarHBondContact O-N 3.42Å; I958-L960 PolarHBondContact O-N 2.73Å; L960-G963 PolarHBondContact O-N 3.33Å; L960-I965 WeakPolarHBondContact CD2-O 3.35Å
961	S	42.7	Very low	35.7	Very low	80 Å²	80	111 Å²	111	56%	0.559	62%	0.62	S	S	*	*	H	α-helix	trans	-70.3	-33.4	-178.3	71.2	0	0	0	0	113.7	E957 I958 G963	E957-S961 WeakPolarHBondContact O-CB 3.44Å; E957-S961 PolarHBondContact O-N 2.88Å; E957-S961 PolarHBondContact O-OG 3.14Å; I958-S961 WeakPolarHBondContact CA-OG 3.14Å; I958-S961 PolarHBondContact O-N 3.36Å; I958-S961 PolarHBondContact O-OG 3.39Å; S961-G963 PolarHBondContact O-N 3.18Å
962	C	40.1	Very low	36	Very low	82 Å²	82	106.6 Å²	106.6	55%	0.554	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	6	174.8	-64.4	0	0	0	0	113	I958 I964	I958-C962 WeakPolarHBondContact O-CB 3.4Å; I958-C962 PolarHBondContact O-N 2.71Å; I958-C962 PolarHBondContact O-SG 3.11Å; I958-C962 VanDerWaalsContact O-SG 3.41Å; C962-I964 HydrophobicContact CB-CD1 3.74Å; C962-I964 HydrophobicContact CB-CG1 3.82Å; C962-I964 PolarHBondContact O-N 3.48Å; C962-I964 VanDerWaalsContact O-N 3.16Å
963	G	33.1	Very low	35.8	Very low	65 Å²	65	108.1 Å²	108.1	67%	0.67	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.6	18.5	-179.1	0	0	0	0	0	114	A959 L960 S961 I965	A959-G963 PolarHBondContact O-N 3.47Å; L960-G963 PolarHBondContact O-N 3.33Å; S961-G963 PolarHBondContact O-N 3.18Å; G963-I965 VanDerWaalsContact C-N 3.3Å
964	I	39.2	Very low	35.5	Very low	128 Å²	128	108.8 Å²	108.8	66%	0.656	64%	0.637	S	S	*	*	S	Bend	trans	-76.4	-24.3	179.5	-59.8	172.8	0	0	0	110.1	A959 C962	A959-I964 HydrophobicContact CB-CB 4.37Å; A959-I964 WeakPolarHBondContact O-CB 3.22Å; A959-I964 PolarHBondContact O-N 2.93Å; C962-I964 HydrophobicContact CB-CD1 3.74Å; C962-I964 HydrophobicContact CB-CG1 3.82Å; C962-I964 PolarHBondContact O-N 3.48Å; C962-I964 VanDerWaalsContact O-N 3.16Å
965	I	33.2	Very low	36.2	Very low	95 Å²	95	111 Å²	111	49%	0.487	65%	0.65	S	S	.	*	S	Bend	trans	-137.1	134.6	175.7	-51.4	175	0	0	0	108.3	A959 L960 G963	A959-I965 HydrophobicContact CB-CD1 3.67Å; A959-I965 HydrophobicContact CB-CG1 3.98Å; A959-I965 PolarHBondContact O-N 2.64Å; L960-I965 WeakPolarHBondContact CD2-O 3.35Å; G963-I965 VanDerWaalsContact C-N 3.3Å
966	S	38.8	Very low	35.6	Very low	100 Å²	100	112.4 Å²	112.4	70%	0.699	65%	0.652	S	S	*	*			trans	-91.5	140.4	177.3	52	0	0	0	0	112.1	T968	S966-T968 PolarHBondContact O-N 2.97Å
967	S	34.1	Very low	35.1	Very low	103 Å²	103	109.9 Å²	109.9	72%	0.72	65%	0.652	S	S	*	*			trans	-81.9	96.2	176.8	56.3	0	0	0	0	111
968	T	36	Very low	34.6	Very low	123 Å²	123	113.6 Å²	113.6	76%	0.755	67%	0.669	S	S	*	*			trans	-130.2	92.3	166.4	53.4	0	0	0	0	109.9	S966	S966-T968 PolarHBondContact O-N 2.97Å
969	E	31.6	Very low	34	Very low	183 Å²	183	114 Å²	114	86%	0.855	68%	0.68	S	S	*	*			trans	-130.9	112.3	151.6	-84.5	-178.2	-175.3	0	0	106.5
970	S	34.3	Very low	33.4	Very low	122 Å²	122	120.2 Å²	120.2	85%	0.853	71%	0.71	S	S	*	*			trans	-151.6	120.5	147.7	55	0	0	0	0	109.8
971	L	30.4	Very low	33	Very low	177 Å²	177	123.8 Å²	123.8	93%	0.927	74%	0.735	S	S	*	*			trans	-59.8	139.7	178.3	-66.3	136.2	0	0	0	111.9
972	S	33.8	Very low	32.2	Very low	124 Å²	124	128.4 Å²	128.4	87%	0.867	75%	0.748	S	S	*	*			trans	-157.5	143.9	144.9	55.1	0	0	0	0	110.7
973	Q	25.8	Very low	31.6	Very low	180 Å²	180	131.2 Å²	131.2	84%	0.841	76%	0.758	S	S	*	*			trans	-99.7	155.4	-162.4	-64.1	165.8	-42.1	0	0	112.7
974	S	27.4	Very low	31.3	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	76%	0.759	S	S	*	*			trans	76.1	165.9	144.4	75.5	0	0	0	0	120.5
975	P	47.4	Very low	30.7	Very low	101 Å²	101	132.6 Å²	132.6	66%	0.656	76%	0.764	S	S	*	*				-131.4	179.3	-67.2	39.7	-23.6	0	0	0	113.5
976	D	25.6	Very low	30.4	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	78%	0.781	S	S	*	*			trans	78.5	137	151.2	-64.8	-23.6	0	0	0	123.2
977	N	27.7	Very low	29.9	Very low	130 Å²	130	135.9 Å²	135.9	70%	0.695	78%	0.783	S	S	*	*			trans	96.4	101.1	147.2	-64.8	-25.4	0	0	0	121.5
978	Q	26.4	Very low	29.6	Very low	171 Å²	171	139.2 Å²	139.2	80%	0.799	79%	0.792	S	S	*	*				76.7	127.5	115.5	-71.5	-176.4	-9.9	0	0	122.1
979	S	26.6	Very low	29.4	Very low	93 Å²	93	138.9 Å²	138.9	65%	0.65	79%	0.79	S	S	*	*			trans	70.6	114.3	138	62.9	0	0	0	0	120.4
980	D	26	Very low	29.3	Very low	146 Å²	146	142 Å²	142	78%	0.781	79%	0.794	S	S	*	*				50.3	114.4	125.9	-50.8	-25.2	0	0	0	118.8
981	T	32.3	Very low	29	Very low	146 Å²	146	144.9 Å²	144.9	90%	0.896	79%	0.794	S	S	*	*				179.8	150.6	110.9	28.7	0	0	0	0	111.9
982	E	25.9	Very low	29.1	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	78%	0.783	S	S	*	*			trans	-75.3	169	-169	-63.1	167.7	141.9	0	0	114.3
983	D	28	Very low	28.7	Very low	142 Å²	142	139.1 Å²	139.1	76%	0.759	77%	0.766	S	S	*	*			trans	83.4	100.6	153.7	-67.8	-17.3	0	0	0	121.4
984	S	26.6	Very low	29.1	Very low	98 Å²	98	134.9 Å²	134.9	69%	0.685	75%	0.753	S	S	*	*				97.2	121.1	121.5	80.7	0	0	0	0	119.4
985	T	26.2	Very low	29.5	Very low	124 Å²	124	135.7 Å²	135.7	76%	0.761	75%	0.749	S	S	*	*			trans	80.7	122.9	153.9	68	0	0	0	0	119.9
986	N	27.7	Very low	29.1	Very low	160 Å²	160	136.6 Å²	136.6	86%	0.856	75%	0.748	S	S	*	*			trans	76.2	85.6	154.8	-60.9	-17.8	0	0	0	118.8
987	S	29.1	Very low	29.5	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	74%	0.737	S	S	*	*			trans	-148.9	90.3	151.8	49.6	0	0	0	0	112.2	T989	S987-T989 PolarHBondContact O-N 2.66Å; S987-T989 VanDerWaalsContact O-N 3.12Å
988	D	27.7	Very low	29.8	Very low	173 Å²	173	133.3 Å²	133.3	93%	0.925	73%	0.726	S	S	*	*			trans	-78.3	72.3	160.7	-91.5	-29.4	0	0	0	109.2
989	T	31.5	Very low	30.2	Very low	116 Å²	116	131.9 Å²	131.9	71%	0.712	72%	0.719	S	S	*	*			trans	-89.9	102.5	163.2	45.9	0	0	0	0	108.5	S987 Q991	S987-T989 PolarHBondContact O-N 2.66Å; S987-T989 VanDerWaalsContact O-N 3.12Å; T989-Q991 PolarHBondContact O-N 2.76Å
990	R	28.7	Very low	30.6	Very low	248 Å²	248	131 Å²	131	94%	0.936	71%	0.713	S	S	*	*			trans	-46.3	104.6	177.7	-66	174.8	-175.5	173.3	1.1	111.4
991	Q	29.3	Very low	30.8	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-66.7	131.2	162.3	-74.7	180	-9	0	0	108.9	T989	T989-Q991 PolarHBondContact O-N 2.76Å
992	S	30.8	Very low	30.6	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.4	175	46.6	0	0	0	0	111.4	T994	S992-T994 PolarHBondContact O-N 3.02Å
993	P	27.1	Very low	30.6	Very low	80 Å²	80	126.8 Å²	126.8	52%	0.519	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-56.8	122.3	-173.2	-22.4	33.9	0	0	0	111.3	Q997	P993-Q997 VanDerWaalsContact CA-OE1 3.3Å; P993-Q997 HydrophobicContact CB-CB 3.76Å; P993-Q997 HydrophobicContact CB-CG 4.44Å
994	T	34	Very low	30.7	Very low	92 Å²	92	124.5 Å²	124.5	56%	0.564	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-64.6	157	168.1	51.2	0	0	0	0	109.7	S992 D996 Q997	S992-T994 PolarHBondContact O-N 3.02Å; T994-D996 PolarHBondContact O-N 2.96Å; T994-Q997 WeakPolarHBondContact O-CB 3.23Å; T994-Q997 PolarHBondContact O-N 2.98Å
995	N	35.2	Very low	30.8	Very low	129 Å²	129	127 Å²	127	69%	0.69	69%	0.689	S	S	*	*	H	α-helix	trans	-51.1	-22.7	-176.9	-89.5	-22.2	0	0	0	114.6	I998 Q999	N995-I998 PolarHBondContact O-N 3.26Å; N995-Q999 PolarHBondContact O-N 3.47Å; N995-Q999 VanDerWaalsContact O-N 3.09Å
996	D	38.2	Very low	30.9	Very low	120 Å²	120	132 Å²	132	64%	0.642	69%	0.694	S	S	*	*	H	α-helix	trans	-69.3	-31.3	175.4	-63.5	-21.9	0	0	0	112.7	T994 Q999 S1000	T994-D996 PolarHBondContact O-N 2.96Å; D996-Q999 PolarHBondContact O-N 3.13Å; D996-S1000 PolarHBondContact O-N 2.96Å
997	Q	35.4	Very low	30.7	Very low	107 Å²	107	132.1 Å²	132.1	50%	0.5	69%	0.693	S	S	.	*	H	α-helix	trans	-72.3	-31.8	174.7	-71.5	-172.4	-3.4	0	0	111.9	P993 T994 S1000 L1001	P993-Q997 VanDerWaalsContact CA-OE1 3.3Å; P993-Q997 HydrophobicContact CB-CB 3.76Å; P993-Q997 HydrophobicContact CB-CG 4.44Å; T994-Q997 WeakPolarHBondContact O-CB 3.23Å; T994-Q997 PolarHBondContact O-N 2.98Å; Q997-S1000 PolarHBondContact O-N 3.36Å; Q997-S1000 PolarHBondContact O-OG 3.21Å; Q997-L1001 PolarHBondContact O-N 3.11Å
998	I	34.1	Very low	30.7	Very low	91 Å²	91	132.7 Å²	132.7	47%	0.467	70%	0.695	S	S	.	*	H	α-helix	trans	-71	-34.9	173.2	-62.2	177.1	0	0	0	110.9	N995 S1000	N995-I998 PolarHBondContact O-N 3.26Å; I998-S1000 VanDerWaalsContact C-N 3.35Å
999	Q	35	Very low	30.5	Very low	141 Å²	141	128.5 Å²	128.5	66%	0.659	68%	0.684	S	S	*	*	H	α-helix	trans	-69.9	-29.5	172.5	-79.9	-174	-11.3	0	0	112.9	N995 D996 L1001 L1002	N995-Q999 PolarHBondContact O-N 3.47Å; N995-Q999 VanDerWaalsContact O-N 3.09Å; D996-Q999 PolarHBondContact O-N 3.13Å; Q999-L1001 VanDerWaalsContact C-N 3.35Å; Q999-L1001 PolarHBondContact O-N 3.02Å; Q999-L1002 PolarHBondContact O-N 3.13Å
1000	S	34.2	Very low	30.2	Very low	74 Å²	74	130 Å²	130	52%	0.517	69%	0.687	S	S	.	*	H	α-helix	trans	-68.7	-29.1	176.9	82.7	0	0	0	0	114.2	D996 Q997 I998 L1002	D996-S1000 PolarHBondContact O-N 2.96Å; Q997-S1000 PolarHBondContact O-N 3.36Å; Q997-S1000 PolarHBondContact O-OG 3.21Å; I998-S1000 VanDerWaalsContact C-N 3.35Å; S1000-L1002 VanDerWaalsContact C-N 3.3Å; S1000-L1002 PolarHBondContact O-N 3.18Å
1001	L	30.4	Very low	30	Very low	151 Å²	151	123.9 Å²	123.9	79%	0.791	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-13.7	179.2	-83.5	158.1	0	0	0	113.4	Q997 Q999	Q997-L1001 PolarHBondContact O-N 3.11Å; Q999-L1001 VanDerWaalsContact C-N 3.35Å; Q999-L1001 PolarHBondContact O-N 3.02Å
1002	L	27.5	Very low	29.7	Very low	144 Å²	144	122 Å²	122	75%	0.754	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	12.7	176.7	-66.4	170	0	0	0	112.6	Q999 S1000	Q999-L1002 PolarHBondContact O-N 3.13Å; S1000-L1002 VanDerWaalsContact C-N 3.3Å; S1000-L1002 PolarHBondContact O-N 3.18Å
1003	C	26.2	Very low	29.5	Very low	86 Å²	86	122.3 Å²	122.3	58%	0.581	67%	0.67	S	S	*	*			trans	-73.6	125.3	175.8	-88.3	0	0	0	0	112	E1005	C1003-E1005 VanDerWaalsContact C-N 3.26Å; C1003-E1005 PolarHBondContact O-N 2.67Å; C1003-E1005 VanDerWaalsContact O-N 3.15Å
1004	P	29.7	Very low	29.3	Very low	95 Å²	95	123.2 Å²	123.2	62%	0.617	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-76.3	1.1	-171.4	-10.7	27.3	0	0	0	115.6	R1006	P1004-R1006 VanDerWaalsContact C-N 3.27Å; P1004-R1006 PolarHBondContact O-N 3.07Å
1005	E	29.5	Very low	28.9	Very low	151 Å²	151	125.3 Å²	125.3	71%	0.706	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-83.4	11.2	-171.3	-66.7	-171.8	169.3	0	0	115	C1003 Q1055	C1003-E1005 VanDerWaalsContact C-N 3.26Å; C1003-E1005 PolarHBondContact O-N 2.67Å; C1003-E1005 VanDerWaalsContact O-N 3.15Å; E1005-Q1055 PolarHBondContact OE1-NE2 3.4Å
1006	R	26.7	Very low	28.4	Very low	228 Å²	228	123.5 Å²	123.5	86%	0.86	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-135.4	36.4	178.7	-72.2	-168.3	176.4	177.2	0.8	116	P1004 P1008	P1004-R1006 VanDerWaalsContact C-N 3.27Å; P1004-R1006 PolarHBondContact O-N 3.07Å; R1006-P1008 WeakPolarHBondContact O-CD 3.36Å
1007	L	25.2	Very low	27.9	Very low	162 Å²	162	120.9 Å²	120.9	85%	0.848	66%	0.663	S	S	*	*			trans	-111.3	93	163.4	-80.4	163.4	0	0	0	110.8	A1009	L1007-A1009 VanDerWaalsContact C-N 3.26Å; L1007-A1009 PolarHBondContact O-N 3.26Å; L1007-A1009 VanDerWaalsContact O-N 3.16Å
1008	P	29.4	Very low	27.7	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	67%	0.671	S	S	*	*			trans	-83.9	23.6	-168.7	-3.9	24.4	0	0	0	114.7	R1006	R1006-P1008 WeakPolarHBondContact O-CD 3.36Å
1009	A	22.8	Very low	27.6	Very low	86 Å²	86	120.1 Å²	120.1	71%	0.711	67%	0.673	S	S	*	*			trans	-107.5	85.5	-176.3	0	0	0	0	0	110.3	L1007	L1007-A1009 VanDerWaalsContact C-N 3.26Å; L1007-A1009 PolarHBondContact O-N 3.26Å; L1007-A1009 VanDerWaalsContact O-N 3.16Å
1010	L	25.4	Very low	27.2	Very low	147 Å²	147	122.2 Å²	122.2	77%	0.77	68%	0.681	S	S	*	*			trans	177.5	57.5	139.3	-90.1	163.8	0	0	0	109.2	F1012	L1010-F1012 HydrophobicContact CD2-CD2 3.88Å; L1010-F1012 HydrophobicContact CD2-CE2 4.41Å; L1010-F1012 PolarHBondContact O-N 2.94Å
1011	C	23.8	Very low	26.7	Very low	119 Å²	119	122.1 Å²	122.1	80%	0.804	68%	0.679	S	S	*	*			trans	-69.5	62.2	163.3	-67	0	0	0	0	111
1012	F	23.6	Very low	26.8	Very low	143 Å²	143	120 Å²	120	63%	0.627	68%	0.677	S	S	*	*			trans	-103	95.7	162.1	-87.1	-81.8	0	0	0	109	L1010	L1010-F1012 HydrophobicContact CD2-CD2 3.88Å; L1010-F1012 HydrophobicContact CD2-CE2 4.41Å; L1010-F1012 PolarHBondContact O-N 2.94Å
1013	P	25.3	Very low	27	Very low	107 Å²	107	116.3 Å²	116.3	70%	0.695	66%	0.662	S	S	*	*				-123.2	100.1	127.8	20.6	-3.9	0	0	0	108.2
1014	C	23.6	Very low	27.5	Very low	99 Å²	99	116.8 Å²	116.8	67%	0.669	66%	0.662	S	S	*	*			trans	-57.2	137.7	158.7	-118.7	0	0	0	0	108.8
1015	L	26	Very low	28.3	Very low	135 Å²	135	118.3 Å²	118.3	71%	0.707	67%	0.665	S	S	*	*			trans	78.2	79.8	151.2	-57.2	160.5	0	0	0	117.6
1016	I	25.6	Very low	29.2	Very low	92 Å²	92	117.2 Å²	117.2	47%	0.472	66%	0.66	S	S	.	*				-138.2	116.4	125	-50.4	-177.4	0	0	0	108.4	T1018 Y1075	I1016-T1018 PolarHBondContact O-N 3.07Å; I1016-Y1075 HydrophobicContact CD1-CD1 4.41Å; I1016-Y1075 HydrophobicContact CD1-CD2 3.39Å; I1016-Y1075 HydrophobicContact CD1-CE2 4.2Å; I1016-Y1075 HydrophobicContact CD1-CG 3.5Å; I1016-Y1075 VanDerWaalsContact CD1-CG 3.5Å; I1016-Y1075 HydrophobicContact CG1-CD2 4.48Å
1017	P	27	Very low	30.4	Very low	64 Å²	64	111.6 Å²	111.6	42%	0.416	65%	0.645	S	S	.	*			trans	-67.1	130.7	178.7	26.9	-30.9	0	0	0	110	S1019 F1020	P1017-S1019 PolarHBondContact O-N 3.31Å; P1017-F1020 PolarHBondContact O-N 3.41Å; P1017-F1020 VanDerWaalsContact O-N 3.13Å
1018	T	30	Very low	32.4	Very low	108 Å²	108	104.5 Å²	104.5	66%	0.663	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-58.7	-15.9	-179.9	44.4	0	0	0	0	113.7	I1016 F1020 C1021	I1016-T1018 PolarHBondContact O-N 3.07Å; T1018-F1020 PolarHBondContact O-N 3.47Å; T1018-C1021 CarbonylContact O-C 3.53Å; T1018-C1021 VanDerWaalsContact O-C 3.23Å; T1018-C1021 PolarHBondContact O-N 3.32Å
1019	S	32	Very low	34.4	Very low	75 Å²	75	102.8 Å²	102.8	52%	0.524	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-73.2	-4.4	175.7	59.8	0	0	0	0	114.7	N504 P1017	N504-S1019 PolarHBondContact ND2-OG 2.9Å; P1017-S1019 PolarHBondContact O-N 3.31Å
1020	F	26.9	Very low	36.8	Very low	184 Å²	184	102.6 Å²	102.6	81%	0.807	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-106.7	7.7	163.5	-93.5	-79	0	0	0	113.6	P1017 T1018	P1017-F1020 PolarHBondContact O-N 3.41Å; P1017-F1020 VanDerWaalsContact O-N 3.13Å; T1018-F1020 PolarHBondContact O-N 3.47Å
1021	C	25.3	Very low	39.1	Very low	73 Å²	73	97.7 Å²	97.7	49%	0.493	56%	0.555	S	S	.	*			trans	-126.7	62.3	166.4	-72.2	0	0	0	0	109.7	T1018	T1018-C1021 CarbonylContact O-C 3.53Å; T1018-C1021 VanDerWaalsContact O-C 3.23Å; T1018-C1021 PolarHBondContact O-N 3.32Å
1022	S	32.2	Very low	41.9	Very low	105 Å²	105	93.2 Å²	93.2	73%	0.734	52%	0.521	S	S	*	.			trans	-102.2	90.8	141.7	63	0	0	0	0	105.5
1023	P	31.8	Very low	44.6	Very low	67 Å²	67	92.1 Å²	92.1	44%	0.435	52%	0.516	S	S	.	.	S	Bend		-147.8	157.4	113.6	33.2	-15.5	0	0	0	112.1	M1027	P1023-M1027 HydrophobicContact CG-CB 3.87Å; P1023-M1027 HydrophobicContact CG-CE 4.11Å; P1023-M1027 HydrophobicContact CG-SD 4.34Å
1024	T	35.6	Very low	47.2	Very low	96 Å²	96	89.6 Å²	89.6	59%	0.589	50%	0.499	S	S	*	.			trans	-28	142.9	156.2	48.1	0	0	0	0	112.1	E1026 M1027	T1024-E1026 PolarHBondContact O-N 2.86Å; T1024-E1026 PolarHBondContact OG1-OE2 3Å; T1024-E1026 VanDerWaalsContact OG1-OE2 3.14Å; T1024-M1027 PolarHBondContact O-N 3.37Å
1025	D	46.3	Very low	49.9	Very low	127 Å²	127	84.9 Å²	84.9	68%	0.679	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.6	-15	179.3	-88.3	-44.4	0	0	0	115.2	S1028 N1029	D1025-S1028 PolarHBondContact O-OG 3.48Å; D1025-N1029 VanDerWaalsContact O-CB 3.31Å; D1025-N1029 WeakPolarHBondContact O-CB 3.49Å; D1025-N1029 VanDerWaalsContact O-CG 3.26Å; D1025-N1029 PolarHBondContact O-N 3.37Å; D1025-N1029 PolarHBondContact O-ND2 3.3Å
1026	E	49.2	Very low	52.5	Low	128 Å²	128	80.8 Å²	80.8	60%	0.598	45%	0.449	S	S	*	.	H	α-helix	trans	-50.7	-55.8	175.8	-66.9	175.5	154.4	0	0	113.8	T1024 S1028 N1029 D1030	T1024-E1026 PolarHBondContact O-N 2.86Å; T1024-E1026 PolarHBondContact OG1-OE2 3Å; T1024-E1026 VanDerWaalsContact OG1-OE2 3.14Å; E1026-S1028 PolarHBondContact O-N 2.92Å; E1026-N1029 CarbonylContact O-C 3.51Å; E1026-N1029 PolarHBondContact O-N 3.26Å; E1026-N1029 VanDerWaalsContact O-N 3.11Å; E1026-D1030 WeakPolarHBondContact O-CB 3.24Å; E1026-D1030 PolarHBondContact O-N 3.48Å
1027	M	52.3	Low	55	Low	110 Å²	110	82.9 Å²	82.9	54%	0.542	46%	0.457	S	S	.	.	H	α-helix	trans	-65.1	-36.8	-170.7	-166.2	178.9	76	0	0	113.7	P1023 T1024 D1030 L1031	P1023-M1027 HydrophobicContact CG-CB 3.87Å; P1023-M1027 HydrophobicContact CG-CE 4.11Å; P1023-M1027 HydrophobicContact CG-SD 4.34Å; T1024-M1027 PolarHBondContact O-N 3.37Å; M1027-D1030 PolarHBondContact O-N 3.01Å; M1027-L1031 WeakPolarHBondContact O-CG 3.46Å; M1027-L1031 PolarHBondContact O-N 3.38Å
1028	S	66.3	Low	57	Low	14 Å²	14	83.4 Å²	83.4	10%	0.098	46%	0.459	C	S	.	.	H	α-helix	trans	-71.2	-37.4	177.4	83.1	0	0	0	0	111.5	D1025 E1026 W1032 Q1084	D1025-S1028 PolarHBondContact O-OG 3.48Å; E1026-S1028 PolarHBondContact O-N 2.92Å; S1028-W1032 PolarHBondContact O-N 3.48Å; S1028-Q1084 PolarHBondContact O-NE2 2.82Å
1029	N	70.7	Confident	58.8	Low	80 Å²	80	79.2 Å²	79.2	43%	0.428	44%	0.437	S	S	.	.	H	α-helix	trans	-69.5	-36.4	174.5	-77	-34.7	0	0	0	111.1	D1025 E1026 W1032 K1033	D1025-N1029 VanDerWaalsContact O-CB 3.31Å; D1025-N1029 WeakPolarHBondContact O-CB 3.49Å; D1025-N1029 VanDerWaalsContact O-CG 3.26Å; D1025-N1029 PolarHBondContact O-N 3.37Å; D1025-N1029 PolarHBondContact O-ND2 3.3Å; E1026-N1029 CarbonylContact O-C 3.51Å; E1026-N1029 PolarHBondContact O-N 3.26Å; E1026-N1029 VanDerWaalsContact O-N 3.11Å; N1029-W1032 PolarHBondContact O-N 3.46Å; N1029-K1033 WeakPolarHBondContact O-CA 3.46Å; N1029-K1033 WeakPolarHBondContact O-CB 3.28Å; N1029-K1033 PolarHBondContact O-N 3.05Å
1030	D	73.8	Confident	60.8	Low	82 Å²	82	76.6 Å²	76.6	44%	0.439	42%	0.418	S	S	.	.	H	α-helix	trans	-68.9	-45.1	178.2	-71.7	-22.3	0	0	0	111.4	E1026 M1027 W1032 K1033 T1034	E1026-D1030 WeakPolarHBondContact O-CB 3.24Å; E1026-D1030 PolarHBondContact O-N 3.48Å; M1027-D1030 PolarHBondContact O-N 3.01Å; D1030-W1032 VanDerWaalsContact C-N 3.28Å; D1030-W1032 PolarHBondContact O-N 3.36Å; D1030-K1033 PolarHBondContact O-N 3.33Å; D1030-T1034 WeakPolarHBondContact O-CB 3.39Å; D1030-T1034 PolarHBondContact O-N 3.04Å; D1030-T1034 PolarHBondContact O-OG1 2.6Å
1031	L	75	Confident	63	Low	44 Å²	44	73.1 Å²	73.1	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-58.5	-43.9	173.5	-78	170.4	0	0	0	111.1	M1027 A1035 L1115	M1027-L1031 WeakPolarHBondContact O-CG 3.46Å; M1027-L1031 PolarHBondContact O-N 3.38Å; L1031-A1035 VanDerWaalsContact O-CB 3.29Å; L1031-A1035 WeakPolarHBondContact O-CB 3.47Å; L1031-A1035 PolarHBondContact O-N 3.28Å; L1031-L1115 HydrophobicContact CD2-CD1 4.1Å
1032	W	82.5	Confident	65.7	Low	25 Å²	25	70.6 Å²	70.6	10%	0.095	38%	0.382	C	S	.	.	H	α-helix	trans	-67.8	-44.2	178.1	-173	-103.1	0	0	0	112.4	S1028 N1029 D1030 A1035 C1036 V1093 R1095 E1111 R1113	S1028-W1032 PolarHBondContact O-N 3.48Å; N1029-W1032 PolarHBondContact O-N 3.46Å; D1030-W1032 VanDerWaalsContact C-N 3.28Å; D1030-W1032 PolarHBondContact O-N 3.36Å; W1032-A1035 CarbonylContact O-C 3.6Å; W1032-A1035 PolarHBondContact O-N 2.98Å; W1032-C1036 PolarHBondContact NE1-SG 3.27Å; W1032-C1036 VanDerWaalsContact NE1-SG 3.38Å; W1032-C1036 WeakPolarHBondContact O-CB 3.2Å; W1032-C1036 PolarHBondContact O-N 3.26Å; W1032-C1036 PolarHBondContact O-SG 2.87Å; W1032-V1093 HydrophobicContact CE3-CB 4.3Å; W1032-V1093 HydrophobicContact CE3-CG1 3.67Å; W1032-V1093 HydrophobicContact CZ3-CB 4.31Å; W1032-V1093 HydrophobicContact CZ3-CG1 3.89Å; W1032-R1095 HydrophobicContact CD2-CG 4.41Å; W1032-R1095 VanDerWaalsContact CD2-CZ 3.42Å; W1032-R1095 HydrophobicContact CE3-CG 3.91Å; W1032-R1095 HydrophobicContact CH2-CB 3.88Å; W1032-R1095 HydrophobicContact CH2-CG 3.65Å; W1032-R1095 HydrophobicContact CZ2-CG 4.2Å; W1032-R1095 HydrophobicContact CZ3-CB 4.09Å; W1032-R1095 HydrophobicContact CZ3-CG 3.51Å; W1032-E1111 HydrophobicContact CH2-CB 4.16Å; W1032-E1111 HydrophobicContact CH2-CG 3.68Å; W1032-E1111 VanDerWaalsContact CZ2-CD 3.41Å; W1032-E1111 HydrophobicContact CZ2-CG 4.14Å; W1032-E1111 VanDerWaalsContact CZ2-OE2 3.32Å; W1032-E1111 WeakPolarHBondContact CZ2-OE2 3.36Å; W1032-R1113 HydrophobicContact CH2-CG 4.14Å; W1032-R1113 HydrophobicContact CZ3-CG 4.39Å
1033	K	80.1	Confident	68.1	Low	120 Å²	120	66.1 Å²	66.1	52%	0.522	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-46.5	177.9	-176.3	178.3	177.3	-173.3	0	110.6	N1029 D1030 A1035 C1036 E1037	N1029-K1033 WeakPolarHBondContact O-CA 3.46Å; N1029-K1033 WeakPolarHBondContact O-CB 3.28Å; N1029-K1033 PolarHBondContact O-N 3.05Å; D1030-K1033 PolarHBondContact O-N 3.33Å; K1033-A1035 PolarHBondContact O-N 2.95Å; K1033-C1036 CarbonylContact O-C 3.59Å; K1033-C1036 WeakPolarHBondContact O-CA 3.16Å; K1033-C1036 WeakPolarHBondContact O-CB 3.45Å; K1033-C1036 PolarHBondContact O-N 2.61Å; K1033-E1037 WeakPolarHBondContact CE-OE1 3.43Å; K1033-E1037 HydrophobicContact CG-CG 4.49Å; K1033-E1037 WeakPolarHBondContact CG-OE1 3.34Å; K1033-E1037 WeakPolarHBondContact O-CG 3.42Å; K1033-E1037 PolarHBondContact O-N 3.48Å
1034	T	79.3	Confident	70.7	Confident	54 Å²	54	63.6 Å²	63.6	33%	0.331	33%	0.333	S	S	.	.	H	α-helix	trans	-58.3	-46.9	173.6	-54.5	0	0	0	0	110.9	D1030 C1036 E1037 T1038 L1115	D1030-T1034 WeakPolarHBondContact O-CB 3.39Å; D1030-T1034 PolarHBondContact O-N 3.04Å; D1030-T1034 PolarHBondContact O-OG1 2.6Å; T1034-C1036 PolarHBondContact O-N 3.34Å; T1034-E1037 PolarHBondContact O-N 2.83Å; T1034-T1038 WeakPolarHBondContact O-CB 3.36Å; T1034-T1038 PolarHBondContact O-N 2.93Å; T1034-T1038 PolarHBondContact O-OG1 2.89Å; T1034-L1115 HydrophobicContact CG2-CD2 3.85Å
1035	A	80.8	Confident	73.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-26.6	175.7	0	0	0	0	0	112.7	L1031 W1032 K1033 G1039 V1093 R1113 L1115	L1031-A1035 VanDerWaalsContact O-CB 3.29Å; L1031-A1035 WeakPolarHBondContact O-CB 3.47Å; L1031-A1035 PolarHBondContact O-N 3.28Å; W1032-A1035 CarbonylContact O-C 3.6Å; W1032-A1035 PolarHBondContact O-N 2.98Å; K1033-A1035 PolarHBondContact O-N 2.95Å; A1035-G1039 VanDerWaalsContact O-CA 3.3Å; A1035-G1039 WeakPolarHBondContact O-CA 3.34Å; A1035-G1039 PolarHBondContact O-N 3.06Å; A1035-V1093 HydrophobicContact CB-CG2 4.44Å; A1035-R1113 HydrophobicContact CB-CB 4.02Å; A1035-L1115 HydrophobicContact CB-CD2 4.13Å; A1035-L1115 HydrophobicContact CB-CG 4.2Å
1036	C	80	Confident	75	Confident	49 Å²	49	53.3 Å²	53.3	33%	0.331	27%	0.274	S	S	.	.	H	α-helix	trans	-76.4	-40.6	174.8	-70.5	0	0	0	0	113.6	W1032 K1033 T1034 R1113	W1032-C1036 PolarHBondContact NE1-SG 3.27Å; W1032-C1036 VanDerWaalsContact NE1-SG 3.38Å; W1032-C1036 WeakPolarHBondContact O-CB 3.2Å; W1032-C1036 PolarHBondContact O-N 3.26Å; W1032-C1036 PolarHBondContact O-SG 2.87Å; K1033-C1036 CarbonylContact O-C 3.59Å; K1033-C1036 WeakPolarHBondContact O-CA 3.16Å; K1033-C1036 WeakPolarHBondContact O-CB 3.45Å; K1033-C1036 PolarHBondContact O-N 2.61Å; T1034-C1036 PolarHBondContact O-N 3.34Å; C1036-R1113 PolarHBondContact SG-NH1 3.1Å
1037	E	77.4	Confident	76.9	Confident	136 Å²	136	47.3 Å²	47.3	64%	0.636	25%	0.246	S	C	*	.	H	α-helix	trans	-79.9	-40.1	-176.3	-70.5	171.8	-179.7	0	0	112.2	K1033 T1034	K1033-E1037 WeakPolarHBondContact CE-OE1 3.43Å; K1033-E1037 HydrophobicContact CG-CG 4.49Å; K1033-E1037 WeakPolarHBondContact CG-OE1 3.34Å; K1033-E1037 WeakPolarHBondContact O-CG 3.42Å; K1033-E1037 PolarHBondContact O-N 3.48Å; T1034-E1037 PolarHBondContact O-N 2.83Å
1038	T	69.6	Low	78.3	Confident	75 Å²	75	46.7 Å²	46.7	46%	0.46	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-21.9	-170.2	65.9	0	0	0	0	113.8	T1034 P1116	T1034-T1038 WeakPolarHBondContact O-CB 3.36Å; T1034-T1038 PolarHBondContact O-N 2.93Å; T1034-T1038 PolarHBondContact O-OG1 2.89Å; T1038-P1116 WeakPolarHBondContact OG1-CD 3.5Å; T1038-P1116 WeakPolarHBondContact OG1-CG 3.29Å
1039	G	67.8	Low	79.2	Confident	19 Å²	19	46 Å²	46	20%	0.196	23%	0.233	C	C	.	.	S	Bend	trans	-70.4	156.6	-174.7	0	0	0	0	0	112.9	A1035 A1114	A1035-G1039 VanDerWaalsContact O-CA 3.3Å; A1035-G1039 WeakPolarHBondContact O-CA 3.34Å; A1035-G1039 PolarHBondContact O-N 3.06Å; G1039-A1114 VanDerWaalsContact CA-O 3.24Å; G1039-A1114 WeakPolarHBondContact CA-O 2.85Å
1040	P	73.1	Confident	79.3	Confident	20 Å²	20	44.4 Å²	44.4	13%	0.13	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-66.2	169.6	169.4	32.6	-37.2	0	0	0	111.9	A1114 H1177 W1179	P1040-A1114 HydrophobicContact CG-CB 3.86Å; P1040-H1177 HydrophobicContact CB-CB 4.21Å; P1040-H1177 WeakPolarHBondContact CB-O 3.27Å; P1040-H1177 WeakPolarHBondContact CG-O 3.49Å; P1040-W1179 HydrophobicContact CB-CG 4.49Å; P1040-W1179 VanDerWaalsContact CG-CD1 3.47Å; P1040-W1179 HydrophobicContact CG-CD2 3.89Å; P1040-W1179 HydrophobicContact CG-CG 3.75Å; P1040-W1179 HydrophobicContact CG-CZ2 4.37Å
1041	R	73.6	Confident	79.1	Confident	111 Å²	111	49.9 Å²	49.9	42%	0.419	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-53.6	133.3	-179.5	-66.2	-178.9	-176.9	168.3	-1.9	111	P1216 H1246	R1041-P1216 HydrophobicContact CB-CB 4.16Å; R1041-H1246 PolarHBondContact NH1-CE1 3.04Å; R1041-H1246 PolarHBondContact NH1-NE2 3.27Å
1042	P	82.5	Confident	78.8	Confident	20 Å²	20	49.6 Å²	49.6	13%	0.13	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-66.9	155.4	-174.7	28.4	-35.8	0	0	0	111.6	I1044 E1111 F1112 R1113	P1042-I1044 HydrophobicContact CB-CD1 4.3Å; P1042-I1044 HydrophobicContact CB-CG1 4.12Å; P1042-I1044 HydrophobicContact CG-CD1 4.09Å; P1042-I1044 HydrophobicContact CG-CG1 4.39Å; P1042-E1111 HydrophobicContact CB-CG 4.26Å; P1042-F1112 WeakPolarHBondContact CA-O 3.08Å; P1042-R1113 HydrophobicContact CB-CG 3.94Å
1043	I	82.5	Confident	78.4	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.056	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118.6	168.3	-56.2	169.9	0	0	0	107.4	F1045 F1112 W1179 L1186 M1190 M1213 L1252	I1043-F1045 HydrophobicContact CG2-CD2 4.49Å; I1043-F1045 HydrophobicContact CG2-CE2 3.95Å; I1043-F1045 HydrophobicContact CG2-CZ 4.15Å; I1043-F1112 HydrophobicContact CB-CB 4.48Å; I1043-F1112 PolarHBondContact N-O 3.3Å; I1043-F1112 VanDerWaalsContact N-O 3.08Å; I1043-F1112 PolarHBondContact O-N 3Å; I1043-W1179 HydrophobicContact CD1-CH2 4.24Å; I1043-W1179 HydrophobicContact CD1-CZ2 3.85Å; I1043-W1179 HydrophobicContact CG1-CH2 4.43Å; I1043-W1179 HydrophobicContact CG1-CZ2 3.86Å; I1043-L1186 HydrophobicContact CD1-CD2 3.77Å; I1043-M1190 HydrophobicContact CB-CE 3.98Å; I1043-M1190 HydrophobicContact CD1-CE 4.26Å; I1043-M1190 HydrophobicContact CD1-SD 4.42Å; I1043-M1190 HydrophobicContact CG2-CE 3.62Å; I1043-M1213 HydrophobicContact CG2-CE 3.91Å; I1043-L1252 HydrophobicContact CD1-CD2 3.84Å; I1043-L1252 HydrophobicContact CG1-CD2 4.13Å
1044	I	86.6	Confident	78.1	Confident	15 Å²	15	45.9 Å²	45.9	8%	0.077	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.6	-172.6	-54.2	175.2	0	0	0	109.7	P1042 V1046 F1110 E1111 E1214	P1042-I1044 HydrophobicContact CB-CD1 4.3Å; P1042-I1044 HydrophobicContact CB-CG1 4.12Å; P1042-I1044 HydrophobicContact CG-CD1 4.09Å; P1042-I1044 HydrophobicContact CG-CG1 4.39Å; I1044-V1046 HydrophobicContact CG2-CG2 3.87Å; I1044-F1110 WeakPolarHBondContact CA-O 3.24Å; I1044-E1111 HydrophobicContact CD1-CG 4.28Å; I1044-E1111 HydrophobicContact CG1-CB 4.32Å; I1044-E1111 HydrophobicContact CG1-CG 3.95Å; I1044-E1214 HydrophobicContact CB-CB 4.17Å; I1044-E1214 WeakPolarHBondContact CD1-OE2 3.4Å; I1044-E1214 HydrophobicContact CG2-CB 4.32Å; I1044-E1214 HydrophobicContact CG2-CG 4.23Å; I1044-E1214 PolarHBondContact O-N 3.47Å
1045	F	87.6	Confident	77.4	Confident	7 Å²	7	48.1 Å²	48.1	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.5	170.2	-66.3	-68	0	0	0	109.9	I1043 K1109 F1110 F1112 W1187 M1190 L1194 M1213	I1043-F1045 HydrophobicContact CG2-CD2 4.49Å; I1043-F1045 HydrophobicContact CG2-CE2 3.95Å; I1043-F1045 HydrophobicContact CG2-CZ 4.15Å; F1045-K1109 CarbonylContact O-C 3.58Å; F1045-K1109 WeakPolarHBondContact O-CA 3.44Å; F1045-F1110 HydrophobicContact CB-CB 4.43Å; F1045-F1110 PolarHBondContact N-O 2.85Å; F1045-F1110 PolarHBondContact O-N 2.6Å; F1045-F1112 HydrophobicContact CD2-CE2 4.27Å; F1045-W1187 AromaticContact CZ-CH2 3.89Å; F1045-W1187 HydrophobicContact CZ-CH2 3.89Å; F1045-W1187 HydrophobicContact CZ-CZ3 4.33Å; F1045-M1190 HydrophobicContact CD2-CE 4.1Å; F1045-M1190 HydrophobicContact CE2-CE 3.44Å; F1045-M1190 VanDerWaalsContact CE2-CE 3.44Å; F1045-M1190 HydrophobicContact CZ-CE 4.42Å; F1045-L1194 HydrophobicContact CB-CD2 4.32Å; F1045-L1194 HydrophobicContact CD2-CD1 3.73Å; F1045-L1194 HydrophobicContact CD2-CD2 4.15Å; F1045-L1194 HydrophobicContact CE2-CD1 3.64Å; F1045-L1194 HydrophobicContact CG-CD1 4.39Å; F1045-L1194 HydrophobicContact CG-CD2 4.39Å; F1045-L1194 HydrophobicContact CZ-CD1 4.28Å; F1045-M1213 HydrophobicContact CD1-CE 4.27Å; F1045-M1213 HydrophobicContact CE1-CE 3.62Å; F1045-M1213 HydrophobicContact CZ-CE 3.96Å
1046	V	85	Confident	77	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.2	-176	-175.1	0	0	0	0	109.8	I1044 L1107 I1108 K1109 R1211 V1212 E1214 L1221	I1044-V1046 HydrophobicContact CG2-CG2 3.87Å; V1046-L1107 HydrophobicContact CG1-CB 4.06Å; V1046-L1107 HydrophobicContact CG1-CD1 4.43Å; V1046-L1107 HydrophobicContact CG1-CD2 3.87Å; V1046-L1107 HydrophobicContact CG1-CG 4.34Å; V1046-I1108 CarbonylContact C-O 3.56Å; V1046-I1108 WeakPolarHBondContact CA-O 3.41Å; V1046-K1109 HydrophobicContact CB-CG 4.47Å; V1046-K1109 HydrophobicContact CG1-CG 4.11Å; V1046-K1109 HydrophobicContact CG2-CB 4.44Å; V1046-K1109 HydrophobicContact CG2-CD 4.1Å; V1046-K1109 HydrophobicContact CG2-CG 3.82Å; V1046-R1211 CarbonylContact O-C 3.44Å; V1046-V1212 PolarHBondContact N-O 3.27Å; V1046-V1212 PolarHBondContact O-N 3.38Å; V1046-V1212 VanDerWaalsContact O-O 3.07Å; V1046-E1214 HydrophobicContact CG2-CG 3.94Å; V1046-L1221 HydrophobicContact CB-CD2 3.83Å; V1046-L1221 HydrophobicContact CG1-CD2 4.07Å; V1046-L1221 HydrophobicContact CG2-CD2 3.73Å
1047	Y	87.6	Confident	76.9	Confident	2 Å²	2	51 Å²	51	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.6	170.8	-69.4	-100.7	0	0	0	108	F1049 L1107 I1108 F1110 L1194 F1197 D1198 L1201 R1211	Y1047-F1049 WeakPolarHBondContact O-CD2 3.46Å; Y1047-F1049 VanDerWaalsContact O-CE2 3.3Å; Y1047-F1049 WeakPolarHBondContact O-CE2 3.29Å; Y1047-L1107 WeakPolarHBondContact O-CA 3.25Å; Y1047-I1108 PolarHBondContact N-O 2.83Å; Y1047-I1108 PolarHBondContact O-N 3.13Å; Y1047-F1110 HydrophobicContact CD2-CD2 4.13Å; Y1047-F1110 AromaticContact CD2-CE2 3.88Å; Y1047-F1110 HydrophobicContact CD2-CE2 3.88Å; Y1047-F1110 AromaticContact CE2-CD2 3.99Å; Y1047-F1110 HydrophobicContact CE2-CD2 3.99Å; Y1047-F1110 AromaticContact CE2-CE2 3.71Å; Y1047-F1110 HydrophobicContact CE2-CE2 3.71Å; Y1047-L1194 HydrophobicContact CE2-CD2 4.22Å; Y1047-F1197 HydrophobicContact CD1-CD1 4.23Å; Y1047-F1197 AromaticContact CD1-CE1 3.94Å; Y1047-F1197 HydrophobicContact CD1-CE1 3.94Å; Y1047-F1197 AromaticContact CD2-CD1 3.92Å; Y1047-F1197 HydrophobicContact CD2-CD1 3.92Å; Y1047-F1197 AromaticContact CD2-CE1 3.65Å; Y1047-F1197 HydrophobicContact CD2-CE1 3.65Å; Y1047-F1197 AromaticContact CE1-CD1 3.95Å; Y1047-F1197 HydrophobicContact CE1-CD1 3.95Å; Y1047-F1197 HydrophobicContact CE1-CE1 4.15Å; Y1047-F1197 AromaticContact CE2-CD1 3.65Å; Y1047-F1197 HydrophobicContact CE2-CD1 3.65Å; Y1047-F1197 AromaticContact CE2-CE1 3.91Å; Y1047-F1197 HydrophobicContact CE2-CE1 3.91Å; Y1047-F1197 HydrophobicContact CG-CD1 4.19Å; Y1047-F1197 AromaticContact CG-CE1 3.66Å; Y1047-F1197 HydrophobicContact CG-CE1 3.66Å; Y1047-F1197 AromaticContact CZ-CD1 3.65Å; Y1047-D1198 VanDerWaalsContact CE1-OD1 3.23Å; Y1047-D1198 WeakPolarHBondContact CE1-OD1 3.45Å; Y1047-D1198 PolarHBondContact OH-OD1 3.4Å; Y1047-L1201 HydrophobicContact CD1-CD1 3.43Å; Y1047-L1201 VanDerWaalsContact CD1-CD1 3.43Å; Y1047-L1201 HydrophobicContact CE1-CD1 3.59Å; Y1047-L1201 HydrophobicContact CG-CD1 4.33Å; Y1047-R1211 HydrophobicContact CD1-CB 4.38Å; Y1047-R1211 HydrophobicContact CD1-CG 4.4Å; Y1047-R1211 HydrophobicContact CE1-CB 4.29Å; Y1047-R1211 HydrophobicContact CE1-CG 4.05Å; Y1047-R1211 VanDerWaalsContact OH-CZ 3.25Å; Y1047-R1211 PolarHBondContact OH-NH1 3.29Å
1048	R	82.4	Confident	77	Confident	97 Å²	97	44.7 Å²	44.7	37%	0.366	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.4	-176.9	-178.8	171.7	172.5	157.3	9.9	110.2	D1105 L1107 C1209 K1210	R1048-D1105 HydrophobicContact CG-CB 3.59Å; R1048-D1105 WeakPolarHBondContact CG-OD2 3.35Å; R1048-D1105 IonicContact CZ-OD1 2.7Å; R1048-D1105 IonicContact CZ-OD2 2.92Å; R1048-D1105 IonicContact NE-OD1 3.88Å; R1048-D1105 IonicContact NE-OD2 3.97Å; R1048-D1105 PolarHBondContact NE-OD2 3.2Å; R1048-D1105 IonicContact NH2-OD1 3.04Å; R1048-D1105 PolarHBondContact NH2-OD1 3.33Å; R1048-D1105 IonicContact NH2-OD2 2.72Å; R1048-D1105 PolarHBondContact NH2-OD2 3Å; R1048-L1107 HydrophobicContact CB-CD2 3.68Å; R1048-L1107 HydrophobicContact CG-CD2 3.69Å; R1048-C1209 CarbonylContact O-C 3.57Å; R1048-C1209 VanDerWaalsContact O-CA 3.27Å; R1048-C1209 WeakPolarHBondContact O-CA 3.32Å; R1048-K1210 PolarHBondContact N-O 2.84Å; R1048-K1210 PolarHBondContact O-N 2.91Å
1049	F	85.1	Confident	77.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	93	-175.5	-60.6	-87.1	0	0	0	110.2	Y1047 Y1051 G1052 L1053 L1057 S1106 I1108 L1201 L1207 C1209	Y1047-F1049 WeakPolarHBondContact O-CD2 3.46Å; Y1047-F1049 VanDerWaalsContact O-CE2 3.3Å; Y1047-F1049 WeakPolarHBondContact O-CE2 3.29Å; F1049-Y1051 PolarHBondContact O-N 3.26Å; F1049-Y1051 VanDerWaalsContact O-N 3.16Å; F1049-G1052 PolarHBondContact O-N 2.68Å; F1049-L1053 HydrophobicContact CB-CD1 4.48Å; F1049-L1053 HydrophobicContact CD1-CD1 3.89Å; F1049-L1053 HydrophobicContact CD2-CD1 3.33Å; F1049-L1053 HydrophobicContact CE1-CD1 3.86Å; F1049-L1053 HydrophobicContact CE2-CD1 3.3Å; F1049-L1053 HydrophobicContact CG-CB 4.49Å; F1049-L1053 HydrophobicContact CG-CD1 3.63Å; F1049-L1053 HydrophobicContact CZ-CD1 3.57Å; F1049-L1057 HydrophobicContact CE1-CD2 3.96Å; F1049-L1057 HydrophobicContact CZ-CD2 4.15Å; F1049-S1106 WeakPolarHBondContact CD2-O 3.36Å; F1049-S1106 PolarHBondContact N-O 3.35Å; F1049-I1108 HydrophobicContact CE2-CB 4.1Å; F1049-I1108 HydrophobicContact CE2-CD1 3.84Å; F1049-I1108 HydrophobicContact CE2-CG1 3.89Å; F1049-I1108 HydrophobicContact CZ-CD1 4.15Å; F1049-L1201 HydrophobicContact CE1-CD2 3.8Å; F1049-L1201 HydrophobicContact CZ-CD2 3.79Å; F1049-L1207 HydrophobicContact CD1-CD1 3.81Å; F1049-L1207 HydrophobicContact CD1-CD2 4.39Å; F1049-L1207 HydrophobicContact CD1-CG 4.11Å; F1049-L1207 HydrophobicContact CE1-CD1 4.15Å; F1049-L1207 HydrophobicContact CE1-CD2 3.9Å; F1049-L1207 HydrophobicContact CE1-CG 4.1Å; F1049-C1209 HydrophobicContact CD1-CB 3.67Å; F1049-C1209 HydrophobicContact CE1-CB 3.44Å; F1049-C1209 VanDerWaalsContact CE1-CB 3.44Å; F1049-C1209 HydrophobicContact CZ-CB 4.21Å
1050	S	73.1	Confident	77.2	Confident	45 Å²	45	48 Å²	48	32%	0.315	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.7	-170.3	-55.4	0	0	0	0	116.1	D1105	S1050-D1105 VanDerWaalsContact CA-CG 3.5Å; S1050-D1105 WeakPolarHBondContact CA-OD2 3.46Å; S1050-D1105 WeakPolarHBondContact CB-OD2 3.45Å; S1050-D1105 PolarHBondContact OG-OD2 3.3Å
1051	Y	69.6	Low	77	Confident	197 Å²	197	47 Å²	47	77%	0.773	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.1	28.4	177.9	-58.2	-78.3	0	0	0	111.4	F1049 C1208	F1049-Y1051 PolarHBondContact O-N 3.26Å; F1049-Y1051 VanDerWaalsContact O-N 3.16Å; Y1051-C1208 HydrophobicContact CD2-CB 3.57Å; Y1051-C1208 HydrophobicContact CE2-CB 3.96Å
1052	G	68.5	Low	76.8	Confident	39 Å²	39	42.1 Å²	42.1	40%	0.402	21%	0.21	S	C	.	.			trans	87.4	152.9	-178	0	0	0	0	0	113.6	F1049	F1049-G1052 PolarHBondContact O-N 2.68Å
1053	L	74	Confident	75.9	Confident	22 Å²	22	45 Å²	45	12%	0.115	23%	0.227	C	C	.	.			trans	-91.3	129.4	172.6	-171.9	87.5	0	0	0	109.2	F1049 Q1055 L1057 F1058 L1098 I1108	F1049-L1053 HydrophobicContact CB-CD1 4.48Å; F1049-L1053 HydrophobicContact CD1-CD1 3.89Å; F1049-L1053 HydrophobicContact CD2-CD1 3.33Å; F1049-L1053 HydrophobicContact CE1-CD1 3.86Å; F1049-L1053 HydrophobicContact CE2-CD1 3.3Å; F1049-L1053 HydrophobicContact CG-CB 4.49Å; F1049-L1053 HydrophobicContact CG-CD1 3.63Å; F1049-L1053 HydrophobicContact CZ-CD1 3.57Å; L1053-Q1055 PolarHBondContact O-N 3.25Å; L1053-L1057 HydrophobicContact CD1-CB 4.43Å; L1053-L1057 HydrophobicContact CD1-CD2 3.54Å; L1053-L1057 HydrophobicContact CD1-CG 4.25Å; L1053-L1057 HydrophobicContact CG-CB 4.32Å; L1053-L1057 HydrophobicContact CG-CD2 4.24Å; L1053-F1058 HydrophobicContact CD2-CB 4.27Å; L1053-L1098 HydrophobicContact CD2-CD1 3.43Å; L1053-L1098 VanDerWaalsContact CD2-CD1 3.43Å; L1053-L1098 HydrophobicContact CD2-CD2 4.15Å; L1053-L1098 HydrophobicContact CD2-CG 4.45Å; L1053-I1108 HydrophobicContact CD1-CD1 3.54Å; L1053-I1108 HydrophobicContact CD1-CG1 4.14Å; L1053-I1108 HydrophobicContact CD2-CD1 4.02Å; L1053-I1108 HydrophobicContact CD2-CG1 4.38Å; L1053-I1108 HydrophobicContact CG-CD1 4.45Å
1054	P	73	Confident	74.9	Confident	44 Å²	44	52.3 Å²	52.3	29%	0.286	25%	0.254	S	S	.	.			trans	-54.8	130.7	170.7	-20.8	29.6	0	0	0	110.2	E1056 L1057 Y1204 L1207	P1054-E1056 PolarHBondContact O-N 3.42Å; P1054-L1057 HydrophobicContact CB-CB 4.04Å; P1054-L1057 HydrophobicContact CG-CB 4.23Å; P1054-L1057 HydrophobicContact CG-CD2 4.38Å; P1054-L1057 WeakPolarHBondContact O-CB 3.33Å; P1054-L1057 PolarHBondContact O-N 2.97Å; P1054-Y1204 HydrophobicContact CB-CE1 4.32Å; P1054-Y1204 HydrophobicContact CG-CD1 4.31Å; P1054-Y1204 HydrophobicContact CG-CE1 4.47Å; P1054-L1207 VanDerWaalsContact CD-CD1 3.43Å; P1054-L1207 HydrophobicContact CG-CD1 3.7Å
1055	Q	66.5	Low	73.7	Confident	101 Å²	101	51.9 Å²	51.9	47%	0.472	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-39.7	-173.8	-85.5	-175.8	-29.2	0	0	112.4	E1005 L1053	E1005-Q1055 PolarHBondContact OE1-NE2 3.4Å; L1053-Q1055 PolarHBondContact O-N 3.25Å
1056	E	71.6	Confident	72	Confident	110 Å²	110	56.8 Å²	56.8	51%	0.514	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.3	-177.9	-57.3	177.4	-179.1	0	0	114.9	P1054 F1058 D1059 K1060	P1054-E1056 PolarHBondContact O-N 3.42Å; E1056-F1058 PolarHBondContact O-N 3.02Å; E1056-D1059 PolarHBondContact O-N 2.96Å; E1056-K1060 WeakPolarHBondContact O-CB 3.43Å; E1056-K1060 WeakPolarHBondContact O-CG 3.21Å; E1056-K1060 PolarHBondContact O-N 2.9Å; E1056-K1060 WeakPolarHBondContact OE2-CE 3.4Å; E1056-K1060 IonicContact OE2-NZ 3.1Å; E1056-K1060 PolarHBondContact OE2-NZ 3.24Å
1057	L	78.1	Confident	71	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.3	-40.7	-173.1	174.4	61.8	0	0	0	111.5	F1049 L1053 P1054 A1061 I1200 L1201 Y1204 L1207	F1049-L1057 HydrophobicContact CE1-CD2 3.96Å; F1049-L1057 HydrophobicContact CZ-CD2 4.15Å; L1053-L1057 HydrophobicContact CD1-CB 4.43Å; L1053-L1057 HydrophobicContact CD1-CD2 3.54Å; L1053-L1057 HydrophobicContact CD1-CG 4.25Å; L1053-L1057 HydrophobicContact CG-CB 4.32Å; L1053-L1057 HydrophobicContact CG-CD2 4.24Å; P1054-L1057 HydrophobicContact CB-CB 4.04Å; P1054-L1057 HydrophobicContact CG-CB 4.23Å; P1054-L1057 HydrophobicContact CG-CD2 4.38Å; P1054-L1057 WeakPolarHBondContact O-CB 3.33Å; P1054-L1057 PolarHBondContact O-N 2.97Å; L1057-A1061 VanDerWaalsContact O-CB 3.26Å; L1057-A1061 WeakPolarHBondContact O-CB 3.42Å; L1057-A1061 PolarHBondContact O-N 3.23Å; L1057-I1200 HydrophobicContact CD1-CG2 3.88Å; L1057-L1201 HydrophobicContact CD1-CD2 4.12Å; L1057-L1201 HydrophobicContact CD2-CD2 3.68Å; L1057-L1201 HydrophobicContact CG-CD2 4.39Å; L1057-Y1204 HydrophobicContact CD1-CD2 3.67Å; L1057-Y1204 HydrophobicContact CD1-CE2 3.36Å; L1057-L1207 HydrophobicContact CD2-CD1 4.41Å; L1057-L1207 HydrophobicContact CD2-CD2 3.6Å
1058	F	78.6	Confident	69.1	Low	3 Å²	3	59.8 Å²	59.8	1%	0.013	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-46.9	177.6	-175.6	-101.3	0	0	0	111.1	L1053 E1056 K1060 A1061 T1062 F1096 L1098 I1108	L1053-F1058 HydrophobicContact CD2-CB 4.27Å; E1056-F1058 PolarHBondContact O-N 3.02Å; F1058-K1060 PolarHBondContact O-N 3.08Å; F1058-A1061 WeakPolarHBondContact O-CB 3.34Å; F1058-A1061 PolarHBondContact O-N 3.26Å; F1058-A1061 VanDerWaalsContact O-N 3.07Å; F1058-T1062 HydrophobicContact CD1-CG2 4.22Å; F1058-T1062 HydrophobicContact CE1-CG2 3.78Å; F1058-T1062 HydrophobicContact CE2-CG2 4.42Å; F1058-T1062 HydrophobicContact CZ-CG2 3.88Å; F1058-T1062 PolarHBondContact O-N 2.8Å; F1058-T1062 PolarHBondContact O-OG1 2.86Å; F1058-F1096 HydrophobicContact CD2-CD1 4.3Å; F1058-F1096 AromaticContact CD2-CE1 3.56Å; F1058-F1096 HydrophobicContact CD2-CE1 3.56Å; F1058-F1096 AromaticContact CD2-CZ 3.86Å; F1058-F1096 HydrophobicContact CD2-CZ 3.86Å; F1058-F1096 AromaticContact CE2-CD1 3.47Å; F1058-F1096 HydrophobicContact CE2-CD1 3.47Å; F1058-F1096 VanDerWaalsContact CE2-CD1 3.47Å; F1058-F1096 AromaticContact CE2-CE1 3.18Å; F1058-F1096 HydrophobicContact CE2-CE1 3.18Å; F1058-F1096 HydrophobicContact CE2-CE2 4.48Å; F1058-F1096 HydrophobicContact CE2-CG 4.25Å; F1058-F1096 AromaticContact CE2-CZ 3.76Å; F1058-F1096 HydrophobicContact CE2-CZ 3.76Å; F1058-F1096 HydrophobicContact CG-CE1 4.48Å; F1058-F1096 AromaticContact CZ-CD1 3.82Å; F1058-F1096 HydrophobicContact CZ-CD1 3.82Å; F1058-F1096 AromaticContact CZ-CE1 3.85Å; F1058-F1096 HydrophobicContact CZ-CE1 3.85Å; F1058-L1098 HydrophobicContact CB-CD2 3.89Å; F1058-L1098 HydrophobicContact CD1-CB 4.34Å; F1058-L1098 HydrophobicContact CD1-CD2 4.23Å; F1058-L1098 HydrophobicContact CD2-CB 3.64Å; F1058-L1098 HydrophobicContact CD2-CD2 4.33Å; F1058-L1098 HydrophobicContact CD2-CG 4.42Å; F1058-L1098 HydrophobicContact CE1-CB 4.38Å; F1058-L1098 HydrophobicContact CE2-CB 3.69Å; F1058-L1098 HydrophobicContact CG-CB 3.98Å; F1058-L1098 HydrophobicContact CG-CD2 3.89Å; F1058-L1098 HydrophobicContact CG-CG 4.46Å; F1058-L1098 HydrophobicContact CZ-CB 4.08Å; F1058-I1108 HydrophobicContact CD2-CD1 4.26Å; F1058-I1108 HydrophobicContact CD2-CG1 4.4Å
1059	D	72.7	Confident	67.5	Low	88 Å²	88	63.5 Å²	63.5	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-41	178.8	-59.9	-35	0	0	0	111.8	E1056 A1061 T1062 V1063	E1056-D1059 PolarHBondContact O-N 2.96Å; D1059-A1061 VanDerWaalsContact C-N 3.28Å; D1059-A1061 PolarHBondContact O-N 3.04Å; D1059-T1062 WeakPolarHBondContact CA-OG1 2.96Å; D1059-T1062 PolarHBondContact O-N 3.49Å; D1059-T1062 PolarHBondContact O-OG1 3.4Å; D1059-V1063 WeakPolarHBondContact O-CB 3.4Å; D1059-V1063 WeakPolarHBondContact O-CG2 3.43Å; D1059-V1063 PolarHBondContact O-N 2.8Å
1060	K	69.1	Low	66.1	Low	76 Å²	76	69.5 Å²	69.5	33%	0.33	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-32.8	173.4	-72.3	-169	-156.5	145.6	0	111.9	E1056 F1058 R1064 Y1204	E1056-K1060 WeakPolarHBondContact O-CB 3.43Å; E1056-K1060 WeakPolarHBondContact O-CG 3.21Å; E1056-K1060 PolarHBondContact O-N 2.9Å; E1056-K1060 WeakPolarHBondContact OE2-CE 3.4Å; E1056-K1060 IonicContact OE2-NZ 3.1Å; E1056-K1060 PolarHBondContact OE2-NZ 3.24Å; F1058-K1060 PolarHBondContact O-N 3.08Å; K1060-R1064 WeakPolarHBondContact O-CB 3.46Å; K1060-R1064 PolarHBondContact O-N 3.29Å; K1060-Y1204 VanDerWaalsContact CD-OH 3.29Å; K1060-Y1204 WeakPolarHBondContact CD-OH 3.43Å; K1060-Y1204 PolarHBondContact NZ-OH 3.46Å; K1060-Y1204 VanDerWaalsContact NZ-OH 3.09Å
1061	A	69.9	Low	65.5	Low	0 Å²	0	69 Å²	69	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-71.3	-44	177.4	0	0	0	0	0	112.1	L1057 F1058 D1059 V1063 L1065 F1096 F1197	L1057-A1061 VanDerWaalsContact O-CB 3.26Å; L1057-A1061 WeakPolarHBondContact O-CB 3.42Å; L1057-A1061 PolarHBondContact O-N 3.23Å; F1058-A1061 WeakPolarHBondContact O-CB 3.34Å; F1058-A1061 PolarHBondContact O-N 3.26Å; F1058-A1061 VanDerWaalsContact O-N 3.07Å; D1059-A1061 VanDerWaalsContact C-N 3.28Å; D1059-A1061 PolarHBondContact O-N 3.04Å; A1061-V1063 VanDerWaalsContact C-N 3.27Å; A1061-V1063 PolarHBondContact O-N 3.17Å; A1061-L1065 HydrophobicContact CB-CD1 4.34Å; A1061-L1065 VanDerWaalsContact O-CB 3.25Å; A1061-L1065 WeakPolarHBondContact O-CB 3.32Å; A1061-L1065 WeakPolarHBondContact O-CD1 3.31Å; A1061-L1065 VanDerWaalsContact O-CG 3.24Å; A1061-L1065 WeakPolarHBondContact O-CG 3.33Å; A1061-L1065 PolarHBondContact O-N 3.1Å; A1061-F1096 HydrophobicContact CB-CE1 4.16Å; A1061-F1096 HydrophobicContact CB-CZ 3.91Å; A1061-F1197 HydrophobicContact CB-CD2 3.87Å; A1061-F1197 HydrophobicContact CB-CE2 3.5Å
1062	T	68.7	Low	65.4	Low	8 Å²	8	65.8 Å²	65.8	5%	0.049	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-37.1	174.9	53.1	0	0	0	0	111.5	F1058 D1059 W1067 V1083 F1096	F1058-T1062 HydrophobicContact CD1-CG2 4.22Å; F1058-T1062 HydrophobicContact CE1-CG2 3.78Å; F1058-T1062 HydrophobicContact CE2-CG2 4.42Å; F1058-T1062 HydrophobicContact CZ-CG2 3.88Å; F1058-T1062 PolarHBondContact O-N 2.8Å; F1058-T1062 PolarHBondContact O-OG1 2.86Å; D1059-T1062 WeakPolarHBondContact CA-OG1 2.96Å; D1059-T1062 PolarHBondContact O-N 3.49Å; D1059-T1062 PolarHBondContact O-OG1 3.4Å; T1062-W1067 PolarHBondContact O-NE1 3.29Å; T1062-V1083 HydrophobicContact CG2-CG2 3.6Å; T1062-F1096 HydrophobicContact CG2-CD1 3.77Å; T1062-F1096 HydrophobicContact CG2-CE1 3.67Å
1063	V	64.4	Low	65.5	Low	80 Å²	80	64 Å²	64	49%	0.485	31%	0.314	S	S	.	.	H	α-helix	trans	-79.5	-45.1	179.5	175.6	0	0	0	0	113.7	D1059 A1061	D1059-V1063 WeakPolarHBondContact O-CB 3.4Å; D1059-V1063 WeakPolarHBondContact O-CG2 3.43Å; D1059-V1063 PolarHBondContact O-N 2.8Å; A1061-V1063 VanDerWaalsContact C-N 3.27Å; A1061-V1063 PolarHBondContact O-N 3.17Å
1064	R	61	Low	65.2	Low	164 Å²	164	71.3 Å²	71.3	62%	0.619	34%	0.34	S	S	*	.	H	α-helix	trans	-78.8	-33.3	-173.5	-90.2	-170.7	159.7	152.7	-1.1	114.6	K1060 N1066 I1200	K1060-R1064 WeakPolarHBondContact O-CB 3.46Å; K1060-R1064 PolarHBondContact O-N 3.29Å; R1064-N1066 VanDerWaalsContact C-N 3.31Å; R1064-N1066 PolarHBondContact O-N 3.38Å; R1064-I1200 HydrophobicContact CB-CD1 3.81Å; R1064-I1200 HydrophobicContact CB-CG1 4.48Å
1065	L	60.4	Low	65.1	Low	7 Å²	7	72 Å²	72	4%	0.037	34%	0.337	C	S	.	.	S	Bend	trans	-64.5	103.7	172.7	-68.1	167.2	0	0	0	104.7	A1061 W1067 E1196 F1197 I1200	A1061-L1065 HydrophobicContact CB-CD1 4.34Å; A1061-L1065 VanDerWaalsContact O-CB 3.25Å; A1061-L1065 WeakPolarHBondContact O-CB 3.32Å; A1061-L1065 WeakPolarHBondContact O-CD1 3.31Å; A1061-L1065 VanDerWaalsContact O-CG 3.24Å; A1061-L1065 WeakPolarHBondContact O-CG 3.33Å; A1061-L1065 PolarHBondContact O-N 3.1Å; L1065-W1067 HydrophobicContact CB-CD2 3.8Å; L1065-W1067 HydrophobicContact CB-CE3 4.46Å; L1065-W1067 HydrophobicContact CB-CG 4.25Å; L1065-W1067 HydrophobicContact CB-CH2 4.12Å; L1065-W1067 HydrophobicContact CB-CZ2 3.43Å; L1065-W1067 VanDerWaalsContact CB-CZ2 3.43Å; L1065-W1067 VanDerWaalsContact CB-NE1 3.27Å; L1065-W1067 HydrophobicContact CD1-CH2 3.7Å; L1065-W1067 HydrophobicContact CD1-CZ2 3.15Å; L1065-W1067 HydrophobicContact CG-CH2 4.36Å; L1065-W1067 HydrophobicContact CG-CZ2 3.82Å; L1065-W1067 PolarHBondContact O-N 2.93Å; L1065-W1067 PolarHBondContact O-NE1 2.8Å; L1065-E1196 HydrophobicContact CD2-CB 3.38Å; L1065-F1197 HydrophobicContact CD1-CB 4.25Å; L1065-F1197 HydrophobicContact CD1-CD2 3.96Å; L1065-F1197 HydrophobicContact CD2-CB 4.42Å; L1065-I1200 HydrophobicContact CD1-CD1 4.42Å; L1065-I1200 HydrophobicContact CD2-CD1 3.99Å; L1065-I1200 HydrophobicContact CG-CD1 3.77Å
1066	N	51.9	Low	65.3	Low	109 Å²	109	69 Å²	69	58%	0.583	33%	0.326	S	S	*	.			trans	-76.1	70.4	-171.8	-167.6	11.6	0	0	0	109.6	R1064	R1064-N1066 VanDerWaalsContact C-N 3.31Å; R1064-N1066 PolarHBondContact O-N 3.38Å
1067	W	64.5	Low	65.3	Low	3 Å²	3	64.7 Å²	64.7	1%	0.011	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.2	-163.6	-61.7	108.6	0	0	0	118.2	T1062 L1065 Y1075 M1085 L1094 F1110 I1193	T1062-W1067 PolarHBondContact O-NE1 3.29Å; L1065-W1067 HydrophobicContact CB-CD2 3.8Å; L1065-W1067 HydrophobicContact CB-CE3 4.46Å; L1065-W1067 HydrophobicContact CB-CG 4.25Å; L1065-W1067 HydrophobicContact CB-CH2 4.12Å; L1065-W1067 HydrophobicContact CB-CZ2 3.43Å; L1065-W1067 VanDerWaalsContact CB-CZ2 3.43Å; L1065-W1067 VanDerWaalsContact CB-NE1 3.27Å; L1065-W1067 HydrophobicContact CD1-CH2 3.7Å; L1065-W1067 HydrophobicContact CD1-CZ2 3.15Å; L1065-W1067 HydrophobicContact CG-CH2 4.36Å; L1065-W1067 HydrophobicContact CG-CZ2 3.82Å; L1065-W1067 PolarHBondContact O-N 2.93Å; L1065-W1067 PolarHBondContact O-NE1 2.8Å; W1067-Y1075 HydrophobicContact CB-CE2 3.97Å; W1067-Y1075 AromaticContact CD1-CZ 3.89Å; W1067-M1085 HydrophobicContact CB-CE 3.34Å; W1067-M1085 HydrophobicContact CB-SD 3.78Å; W1067-M1085 HydrophobicContact CD2-CE 4.49Å; W1067-M1085 HydrophobicContact CD2-SD 3.74Å; W1067-M1085 HydrophobicContact CE3-SD 3.88Å; W1067-M1085 HydrophobicContact CG-CE 4.01Å; W1067-M1085 HydrophobicContact CG-SD 3.74Å; W1067-L1094 HydrophobicContact CH2-CD2 4.5Å; W1067-L1094 HydrophobicContact CZ3-CD2 4.14Å; W1067-F1110 HydrophobicContact CH2-CE1 4.01Å; W1067-I1193 HydrophobicContact CH2-CG2 3.38Å; W1067-I1193 HydrophobicContact CZ3-CB 4.15Å; W1067-I1193 HydrophobicContact CZ3-CD1 3.91Å; W1067-I1193 HydrophobicContact CZ3-CG1 3.76Å; W1067-I1193 HydrophobicContact CZ3-CG2 3.39Å
1068	P	48.2	Very low	65	Low	63 Å²	63	70.5 Å²	70.5	41%	0.409	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-37.6	-164	-17.1	29.3	0	0	0	116.8	Y1075	P1068-Y1075 HydrophobicContact CG-CE2 4.18Å
1069	E	49.4	Very low	64.7	Low	174 Å²	174	74 Å²	74	81%	0.813	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-44	-168.6	-73.2	-169.1	157.9	0	0	114.2	F1071 K1072	E1069-F1071 PolarHBondContact O-N 2.94Å; E1069-K1072 PolarHBondContact O-N 3.45Å
1070	L	54.7	Low	64.5	Low	126 Å²	126	79.3 Å²	79.3	66%	0.66	37%	0.368	S	S	*	.	S	Bend	trans	-60.1	-33.8	-174.5	-92.3	151.5	0	0	0	112.9
1071	F	61.2	Low	64.9	Low	35 Å²	35	78.9 Å²	78.9	15%	0.154	37%	0.372	C	S	.	.	S	Bend	trans	-117.6	1.6	-174.4	-52	-56.9	0	0	0	114.3	E1069 F1073 N1087 P1192 I1193	E1069-F1071 PolarHBondContact O-N 2.94Å; F1071-F1073 VanDerWaalsContact C-N 3.26Å; F1071-F1073 HydrophobicContact CB-CD2 3.83Å; F1071-F1073 HydrophobicContact CB-CE2 4.39Å; F1071-F1073 WeakPolarHBondContact O-CD2 3.43Å; F1071-F1073 PolarHBondContact O-N 3.46Å; F1071-N1087 PolarHBondContact O-ND2 2.79Å; F1071-P1192 HydrophobicContact CD1-CB 4.26Å; F1071-P1192 HydrophobicContact CE1-CB 3.25Å; F1071-P1192 HydrophobicContact CE1-CG 3.91Å; F1071-P1192 HydrophobicContact CZ-CB 3.48Å; F1071-P1192 VanDerWaalsContact CZ-CB 3.48Å; F1071-I1193 HydrophobicContact CD2-CG1 3.95Å; F1071-I1193 HydrophobicContact CE2-CG1 4.08Å; F1071-I1193 HydrophobicContact CG-CG1 4.3Å
1072	K	66.8	Low	65.4	Low	129 Å²	129	78.9 Å²	78.9	56%	0.561	37%	0.372	S	S	*	.			trans	55.7	35.2	-179.4	-51.3	-175.5	180	-177.1	0	114.1	E1069 N1087 I1089	E1069-K1072 PolarHBondContact O-N 3.45Å; K1072-N1087 PolarHBondContact O-ND2 3.09Å; K1072-I1089 HydrophobicContact CB-CD1 4.32Å; K1072-I1089 HydrophobicContact CD-CD1 3.3Å; K1072-I1089 HydrophobicContact CG-CD1 4.44Å
1073	F	71.1	Confident	66	Low	1 Å²	1	78.6 Å²	78.6	0%	0.004	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-96.6	130.1	170.9	-84	-90.4	0	0	0	109.8	F1071 M1085 N1087 I1092 L1094 L1189 I1193	F1071-F1073 VanDerWaalsContact C-N 3.26Å; F1071-F1073 HydrophobicContact CB-CD2 3.83Å; F1071-F1073 HydrophobicContact CB-CE2 4.39Å; F1071-F1073 WeakPolarHBondContact O-CD2 3.43Å; F1071-F1073 PolarHBondContact O-N 3.46Å; F1073-M1085 HydrophobicContact CB-CB 4.19Å; F1073-M1085 HydrophobicContact CB-CE 3.68Å; F1073-M1085 HydrophobicContact CB-SD 4.45Å; F1073-M1085 HydrophobicContact CD1-CB 3.97Å; F1073-M1085 HydrophobicContact CG-CB 4.47Å; F1073-N1087 HydrophobicContact CD1-CB 3.64Å; F1073-N1087 HydrophobicContact CD2-CB 4.2Å; F1073-N1087 HydrophobicContact CE1-CB 3.55Å; F1073-N1087 HydrophobicContact CE2-CB 4.14Å; F1073-N1087 HydrophobicContact CG-CB 3.98Å; F1073-N1087 HydrophobicContact CZ-CB 3.83Å; F1073-I1092 HydrophobicContact CE1-CG2 4.29Å; F1073-I1092 HydrophobicContact CZ-CG2 4.26Å; F1073-L1094 HydrophobicContact CD1-CB 4.46Å; F1073-L1094 HydrophobicContact CE1-CB 3.89Å; F1073-L1094 HydrophobicContact CZ-CB 4.43Å; F1073-L1189 HydrophobicContact CE1-CD2 4.47Å; F1073-L1189 HydrophobicContact CE2-CD1 4.21Å; F1073-L1189 HydrophobicContact CE2-CD2 3.37Å; F1073-L1189 HydrophobicContact CE2-CG 3.63Å; F1073-L1189 HydrophobicContact CZ-CD2 3.27Å; F1073-L1189 HydrophobicContact CZ-CG 4.07Å; F1073-I1193 HydrophobicContact CE2-CD1 4.09Å
1074	R	67.2	Low	66.8	Low	177 Å²	177	74.9 Å²	74.9	67%	0.668	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.4	173.1	-62.9	-179.1	-179.8	173.8	-1.6	109.3	M1085 F1086	R1074-M1085 CarbonylContact O-C 3.52Å; R1074-M1085 VanDerWaalsContact O-CA 3.25Å; R1074-M1085 WeakPolarHBondContact O-CA 3.25Å; R1074-F1086 PolarHBondContact N-O 2.78Å; R1074-F1086 PolarHBondContact O-N 2.83Å
1075	Y	71.4	Confident	67.9	Low	59 Å²	59	67.2 Å²	67.2	23%	0.231	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	144.3	172.2	-69.8	-100.2	0	0	0	110.3	I1016 W1067 P1068 V1083 M1085	I1016-Y1075 HydrophobicContact CD1-CD1 4.41Å; I1016-Y1075 HydrophobicContact CD1-CD2 3.39Å; I1016-Y1075 HydrophobicContact CD1-CE2 4.2Å; I1016-Y1075 HydrophobicContact CD1-CG 3.5Å; I1016-Y1075 VanDerWaalsContact CD1-CG 3.5Å; I1016-Y1075 HydrophobicContact CG1-CD2 4.48Å; W1067-Y1075 HydrophobicContact CB-CE2 3.97Å; W1067-Y1075 AromaticContact CD1-CZ 3.89Å; P1068-Y1075 HydrophobicContact CG-CE2 4.18Å; Y1075-V1083 HydrophobicContact CD1-CG1 3.46Å; Y1075-V1083 VanDerWaalsContact CD1-CG1 3.46Å; Y1075-V1083 HydrophobicContact CE1-CG1 3.33Å; Y1075-M1085 HydrophobicContact CD1-CE 4.17Å; Y1075-M1085 HydrophobicContact CD1-CG 4.06Å; Y1075-M1085 HydrophobicContact CD1-SD 4.41Å; Y1075-M1085 HydrophobicContact CD2-CE 3.68Å; Y1075-M1085 HydrophobicContact CE1-CE 4.16Å; Y1075-M1085 HydrophobicContact CE1-CG 4.37Å; Y1075-M1085 HydrophobicContact CE1-SD 4.2Å; Y1075-M1085 HydrophobicContact CE2-CE 3.67Å; Y1075-M1085 HydrophobicContact CG-CE 3.97Å; Y1075-M1085 HydrophobicContact CG-CG 4.43Å
1076	T	70.9	Confident	68.9	Low	37 Å²	37	68.9 Å²	68.9	23%	0.227	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	-28.2	177.3	54.7	0	0	0	0	112.2	Q1084 F1086	T1076-Q1084 PolarHBondContact N-O 2.83Å; T1076-Q1084 VanDerWaalsContact OG1-CG 3.25Å; T1076-Q1084 WeakPolarHBondContact OG1-CG 3.36Å; T1076-Q1084 PolarHBondContact OG1-NE2 2.96Å; T1076-Q1084 PolarHBondContact OG1-O 2.81Å; T1076-Q1084 VanDerWaalsContact OG1-O 3.05Å; T1076-F1086 HydrophobicContact CG2-CB 3.7Å
1077	A	71.6	Confident	70.4	Confident	20 Å²	20	63.8 Å²	63.8	17%	0.165	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	152	173.3	0	0	0	0	0	110.7	W1079 Q1084	A1077-W1079 HydrophobicContact CB-CE3 4.13Å; A1077-W1079 HydrophobicContact CB-CZ3 3.77Å; A1077-Q1084 HydrophobicContact CB-CB 4.13Å; A1077-Q1084 PolarHBondContact N-O 2.91Å; A1077-Q1084 PolarHBondContact O-N 2.92Å
1078	H	72.5	Confident	70.9	Confident	121 Å²	121	66.1 Å²	66.1	56%	0.56	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	127.3	176.4	-173.8	-66.4	0	0	0	109.6	V1083	H1078-V1083 VanDerWaalsContact CD2-CG2 3.41Å; H1078-V1083 WeakPolarHBondContact CD2-CG2 3.4Å
1079	W	71.6	Confident	72.3	Confident	78 Å²	78	68 Å²	68	30%	0.295	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	170.2	178.4	57.7	97.6	0	0	0	110.7	A1077 T1081 G1082 Q1084 R1095 L1097	A1077-W1079 HydrophobicContact CB-CE3 4.13Å; A1077-W1079 HydrophobicContact CB-CZ3 3.77Å; W1079-T1081 VanDerWaalsContact CD1-OG1 3.3Å; W1079-T1081 PolarHBondContact O-N 3.1Å; W1079-G1082 PolarHBondContact N-O 2.97Å; W1079-G1082 VanDerWaalsContact NE1-N 3.12Å; W1079-G1082 PolarHBondContact O-N 3.35Å; W1079-G1082 VanDerWaalsContact O-N 3.15Å; W1079-Q1084 HydrophobicContact CH2-CB 3.99Å; W1079-Q1084 HydrophobicContact CZ3-CB 3.92Å; W1079-R1095 HydrophobicContact CH2-CG 4.29Å; W1079-L1097 HydrophobicContact CZ2-CD2 3.57Å
1080	K	68.5	Low	73.8	Confident	199 Å²	199	61.2 Å²	61.2	87%	0.865	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.7	-174.8	-75.5	-173.6	176.6	-178.1	0	114.6
1081	T	76.9	Confident	75.1	Confident	67 Å²	67	59.5 Å²	59.5	41%	0.411	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	15.7	-175.5	55.1	0	0	0	0	112.3	W1079 L1097 L1098	W1079-T1081 VanDerWaalsContact CD1-OG1 3.3Å; W1079-T1081 PolarHBondContact O-N 3.1Å; T1081-L1097 CarbonylContact O-C 3.59Å; T1081-L1097 WeakPolarHBondContact O-CA 3.37Å; T1081-L1098 PolarHBondContact O-N 3.47Å
1082	G	80	Confident	76.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.5	163.9	179.7	0	0	0	0	0	116.8	W1079 F1096	W1079-G1082 PolarHBondContact N-O 2.97Å; W1079-G1082 VanDerWaalsContact NE1-N 3.12Å; W1079-G1082 PolarHBondContact O-N 3.35Å; W1079-G1082 VanDerWaalsContact O-N 3.15Å; G1082-F1096 CarbonylContact C-O 3.47Å; G1082-F1096 WeakPolarHBondContact CA-O 3.31Å
1083	V	82.8	Confident	77.1	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	133.3	-176.1	-177.8	0	0	0	0	108.6	T1062 Y1075 H1078 M1085 R1095 F1096	T1062-V1083 HydrophobicContact CG2-CG2 3.6Å; Y1075-V1083 HydrophobicContact CD1-CG1 3.46Å; Y1075-V1083 VanDerWaalsContact CD1-CG1 3.46Å; Y1075-V1083 HydrophobicContact CE1-CG1 3.33Å; H1078-V1083 VanDerWaalsContact CD2-CG2 3.41Å; H1078-V1083 WeakPolarHBondContact CD2-CG2 3.4Å; V1083-M1085 HydrophobicContact CG1-CG 3.98Å; V1083-R1095 CarbonylContact O-C 3.46Å; V1083-R1095 WeakPolarHBondContact O-CA 3.35Å; V1083-F1096 HydrophobicContact CB-CB 4.43Å; V1083-F1096 PolarHBondContact N-O 2.77Å; V1083-F1096 PolarHBondContact O-N 2.83Å
1084	Q	80.6	Confident	77.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.9	173	-169.1	178.5	-75.4	0	0	111.3	S1028 T1076 A1077 W1079 V1093 L1094 R1095	S1028-Q1084 PolarHBondContact O-NE2 2.82Å; T1076-Q1084 PolarHBondContact N-O 2.83Å; T1076-Q1084 VanDerWaalsContact OG1-CG 3.25Å; T1076-Q1084 WeakPolarHBondContact OG1-CG 3.36Å; T1076-Q1084 PolarHBondContact OG1-NE2 2.96Å; T1076-Q1084 PolarHBondContact OG1-O 2.81Å; T1076-Q1084 VanDerWaalsContact OG1-O 3.05Å; A1077-Q1084 HydrophobicContact CB-CB 4.13Å; A1077-Q1084 PolarHBondContact N-O 2.91Å; A1077-Q1084 PolarHBondContact O-N 2.92Å; W1079-Q1084 HydrophobicContact CH2-CB 3.99Å; W1079-Q1084 HydrophobicContact CZ3-CB 3.92Å; Q1084-V1093 HydrophobicContact CG-CG1 3.81Å; Q1084-L1094 WeakPolarHBondContact CA-O 3.3Å; Q1084-R1095 HydrophobicContact CB-CG 4.13Å; Q1084-R1095 HydrophobicContact CG-CG 3.96Å; Q1084-R1095 VanDerWaalsContact OE1-CZ 3.29Å
1085	M	84.6	Confident	78.9	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.02	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.8	-178.6	-53.1	-169.2	73.7	0	0	111.5	W1067 F1073 R1074 Y1075 V1083 V1093 L1094	W1067-M1085 HydrophobicContact CB-CE 3.34Å; W1067-M1085 HydrophobicContact CB-SD 3.78Å; W1067-M1085 HydrophobicContact CD2-CE 4.49Å; W1067-M1085 HydrophobicContact CD2-SD 3.74Å; W1067-M1085 HydrophobicContact CE3-SD 3.88Å; W1067-M1085 HydrophobicContact CG-CE 4.01Å; W1067-M1085 HydrophobicContact CG-SD 3.74Å; F1073-M1085 HydrophobicContact CB-CB 4.19Å; F1073-M1085 HydrophobicContact CB-CE 3.68Å; F1073-M1085 HydrophobicContact CB-SD 4.45Å; F1073-M1085 HydrophobicContact CD1-CB 3.97Å; F1073-M1085 HydrophobicContact CG-CB 4.47Å; R1074-M1085 CarbonylContact O-C 3.52Å; R1074-M1085 VanDerWaalsContact O-CA 3.25Å; R1074-M1085 WeakPolarHBondContact O-CA 3.25Å; Y1075-M1085 HydrophobicContact CD1-CE 4.17Å; Y1075-M1085 HydrophobicContact CD1-CG 4.06Å; Y1075-M1085 HydrophobicContact CD1-SD 4.41Å; Y1075-M1085 HydrophobicContact CD2-CE 3.68Å; Y1075-M1085 HydrophobicContact CE1-CE 4.16Å; Y1075-M1085 HydrophobicContact CE1-CG 4.37Å; Y1075-M1085 HydrophobicContact CE1-SD 4.2Å; Y1075-M1085 HydrophobicContact CE2-CE 3.67Å; Y1075-M1085 HydrophobicContact CG-CE 3.97Å; Y1075-M1085 HydrophobicContact CG-CG 4.43Å; V1083-M1085 HydrophobicContact CG1-CG 3.98Å; M1085-V1093 CarbonylContact O-C 3.3Å; M1085-V1093 WeakPolarHBondContact O-CA 3.5Å; M1085-L1094 PolarHBondContact N-O 3.29Å; M1085-L1094 PolarHBondContact O-N 2.86Å
1086	F	80.7	Confident	79.6	Confident	41 Å²	41	42.7 Å²	42.7	18%	0.18	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.6	-178.3	175.9	-123.1	0	0	0	111.6	R1074 T1076 I1092 V1093 L1115	R1074-F1086 PolarHBondContact N-O 2.78Å; R1074-F1086 PolarHBondContact O-N 2.83Å; T1076-F1086 HydrophobicContact CG2-CB 3.7Å; F1086-I1092 WeakPolarHBondContact CD2-O 3.47Å; F1086-V1093 HydrophobicContact CD2-CG2 3.85Å; F1086-V1093 HydrophobicContact CE2-CG2 4.44Å; F1086-L1115 HydrophobicContact CD2-CD1 4.06Å; F1086-L1115 HydrophobicContact CE2-CD1 3.45Å; F1086-L1115 VanDerWaalsContact CE2-CD1 3.45Å; F1086-L1115 HydrophobicContact CZ-CD1 4.13Å
1087	N	83.5	Confident	80.4	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.011	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	106.2	169.2	-174.2	-53.3	0	0	0	108.9	F1071 K1072 F1073 I1089 N1090 R1091 I1092	F1071-N1087 PolarHBondContact O-ND2 2.79Å; K1072-N1087 PolarHBondContact O-ND2 3.09Å; F1073-N1087 HydrophobicContact CD1-CB 3.64Å; F1073-N1087 HydrophobicContact CD2-CB 4.2Å; F1073-N1087 HydrophobicContact CE1-CB 3.55Å; F1073-N1087 HydrophobicContact CE2-CB 4.14Å; F1073-N1087 HydrophobicContact CG-CB 3.98Å; F1073-N1087 HydrophobicContact CZ-CB 3.83Å; N1087-I1089 PolarHBondContact O-N 2.8Å; N1087-I1089 PolarHBondContact OD1-N 3.49Å; N1087-I1089 VanDerWaalsContact OD1-N 3.14Å; N1087-N1090 PolarHBondContact OD1-N 2.94Å; N1087-N1090 PolarHBondContact OD1-ND2 3.41Å; N1087-R1091 VanDerWaalsContact O-CA 3.29Å; N1087-R1091 WeakPolarHBondContact O-CA 3.44Å; N1087-R1091 PolarHBondContact O-N 2.79Å; N1087-I1092 PolarHBondContact N-O 3.5Å; N1087-I1092 PolarHBondContact O-N 3.04Å
1088	S	74.2	Confident	81.2	Confident	52 Å²	52	42.1 Å²	42.1	36%	0.364	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-38.5	-177.7	54.2	0	0	0	0	113.1	R1091	S1088-R1091 PolarHBondContact O-N 2.7Å
1089	I	78	Confident	81.7	Confident	103 Å²	103	39.4 Å²	39.4	53%	0.528	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-45.4	-176	-64.7	168.2	0	0	0	110.7	K1072 N1087	K1072-I1089 HydrophobicContact CB-CD1 4.32Å; K1072-I1089 HydrophobicContact CD-CD1 3.3Å; K1072-I1089 HydrophobicContact CG-CD1 4.44Å; N1087-I1089 PolarHBondContact O-N 2.8Å; N1087-I1089 PolarHBondContact OD1-N 3.49Å; N1087-I1089 VanDerWaalsContact OD1-N 3.14Å
1090	N	80.4	Confident	81.8	Confident	31 Å²	31	41.8 Å²	41.8	17%	0.166	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-1.5	-176.4	-61.4	-49.4	0	0	0	113	N1087 I1092 P1180 V1181 L1189	N1087-N1090 PolarHBondContact OD1-N 2.94Å; N1087-N1090 PolarHBondContact OD1-ND2 3.41Å; N1090-I1092 VanDerWaalsContact C-N 3.33Å; N1090-I1092 HydrophobicContact CB-CD1 3.81Å; N1090-I1092 HydrophobicContact CB-CG1 4.21Å; N1090-I1092 PolarHBondContact O-N 3.14Å; N1090-P1180 VanDerWaalsContact O-CG 3.31Å; N1090-P1180 WeakPolarHBondContact O-CG 3.35Å; N1090-V1181 HydrophobicContact CB-CG1 4.2Å; N1090-V1181 HydrophobicContact CB-CG2 4.06Å; N1090-V1181 WeakPolarHBondContact OD1-CG1 3.48Å; N1090-L1189 WeakPolarHBondContact ND2-CD1 3.07Å
1091	R	83	Confident	81.5	Confident	91 Å²	91	34.2 Å²	34.2	34%	0.343	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	47.3	-175.4	-62.8	-169.6	-179.9	-163.9	0.1	113	N1087 S1088 L1115 P1116 P1180	N1087-R1091 VanDerWaalsContact O-CA 3.29Å; N1087-R1091 WeakPolarHBondContact O-CA 3.44Å; N1087-R1091 PolarHBondContact O-N 2.79Å; S1088-R1091 PolarHBondContact O-N 2.7Å; R1091-L1115 HydrophobicContact CB-CB 4.22Å; R1091-L1115 PolarHBondContact O-N 3.4Å; R1091-P1116 PolarHBondContact NH1-O 2.84Å; R1091-P1180 HydrophobicContact CB-CG 4.34Å
1092	I	83.8	Confident	80.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.7	-179.2	-66.8	164.9	0	0	0	109.7	F1073 F1086 N1087 N1090 F1112 R1113 W1179 V1181 L1186 L1189	F1073-I1092 HydrophobicContact CE1-CG2 4.29Å; F1073-I1092 HydrophobicContact CZ-CG2 4.26Å; F1086-I1092 WeakPolarHBondContact CD2-O 3.47Å; N1087-I1092 PolarHBondContact N-O 3.5Å; N1087-I1092 PolarHBondContact O-N 3.04Å; N1090-I1092 VanDerWaalsContact C-N 3.33Å; N1090-I1092 HydrophobicContact CB-CD1 3.81Å; N1090-I1092 HydrophobicContact CB-CG1 4.21Å; N1090-I1092 PolarHBondContact O-N 3.14Å; I1092-F1112 HydrophobicContact CG2-CD1 4.26Å; I1092-R1113 CarbonylContact C-O 3.53Å; I1092-R1113 WeakPolarHBondContact CA-O 3.04Å; I1092-W1179 HydrophobicContact CD1-CZ3 4.44Å; I1092-W1179 HydrophobicContact CG1-CZ3 4.18Å; I1092-V1181 HydrophobicContact CD1-CG2 3.72Å; I1092-V1181 HydrophobicContact CG1-CG2 4.4Å; I1092-L1186 HydrophobicContact CD1-CD1 3.46Å; I1092-L1186 VanDerWaalsContact CD1-CD1 3.46Å; I1092-L1189 HydrophobicContact CD1-CD2 3.72Å
1093	V	86.7	Confident	79.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.1	170.1	-167.5	0	0	0	0	108.6	W1032 A1035 Q1084 M1085 F1086 R1113 L1115	W1032-V1093 HydrophobicContact CE3-CB 4.3Å; W1032-V1093 HydrophobicContact CE3-CG1 3.67Å; W1032-V1093 HydrophobicContact CZ3-CB 4.31Å; W1032-V1093 HydrophobicContact CZ3-CG1 3.89Å; A1035-V1093 HydrophobicContact CB-CG2 4.44Å; Q1084-V1093 HydrophobicContact CG-CG1 3.81Å; M1085-V1093 CarbonylContact O-C 3.3Å; M1085-V1093 WeakPolarHBondContact O-CA 3.5Å; F1086-V1093 HydrophobicContact CD2-CG2 3.85Å; F1086-V1093 HydrophobicContact CE2-CG2 4.44Å; V1093-R1113 PolarHBondContact N-O 3.49Å; V1093-R1113 PolarHBondContact O-N 3.14Å; V1093-L1115 HydrophobicContact CG2-CD1 3.6Å; V1093-L1115 HydrophobicContact CG2-CG 4.19Å
1094	L	87	Confident	78.6	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.6	177.5	170.8	59.6	0	0	0	109.2	W1067 F1073 Q1084 M1085 F1110 E1111 F1112 I1193	W1067-L1094 HydrophobicContact CH2-CD2 4.5Å; W1067-L1094 HydrophobicContact CZ3-CD2 4.14Å; F1073-L1094 HydrophobicContact CD1-CB 4.46Å; F1073-L1094 HydrophobicContact CE1-CB 3.89Å; F1073-L1094 HydrophobicContact CZ-CB 4.43Å; Q1084-L1094 WeakPolarHBondContact CA-O 3.3Å; M1085-L1094 PolarHBondContact N-O 3.29Å; M1085-L1094 PolarHBondContact O-N 2.86Å; L1094-F1110 HydrophobicContact CD1-CB 4.35Å; L1094-F1110 HydrophobicContact CD1-CD1 4.4Å; L1094-E1111 CarbonylContact C-O 3.5Å; L1094-E1111 WeakPolarHBondContact CA-O 3.03Å; L1094-F1112 HydrophobicContact CB-CD1 4.37Å; L1094-F1112 HydrophobicContact CB-CE1 4.41Å; L1094-F1112 HydrophobicContact CD1-CD1 3.81Å; L1094-F1112 HydrophobicContact CD1-CD2 3.95Å; L1094-F1112 HydrophobicContact CD1-CE1 3.58Å; L1094-F1112 HydrophobicContact CD1-CE2 3.74Å; L1094-F1112 HydrophobicContact CD1-CG 3.99Å; L1094-F1112 HydrophobicContact CD1-CZ 3.55Å; L1094-F1112 HydrophobicContact CD2-CE1 3.95Å; L1094-F1112 HydrophobicContact CD2-CZ 4.18Å; L1094-F1112 HydrophobicContact CG-CE1 4.18Å; L1094-F1112 HydrophobicContact CG-CZ 4.45Å; L1094-I1193 HydrophobicContact CD2-CD1 4.19Å
1095	R	87.9	Confident	78.3	Confident	40 Å²	40	54.6 Å²	54.6	15%	0.151	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.5	163.8	-80.8	-172.6	-179.3	-174	-5.3	111	W1032 W1079 V1083 Q1084 L1097 F1110 E1111	W1032-R1095 HydrophobicContact CD2-CG 4.41Å; W1032-R1095 VanDerWaalsContact CD2-CZ 3.42Å; W1032-R1095 HydrophobicContact CE3-CG 3.91Å; W1032-R1095 HydrophobicContact CH2-CB 3.88Å; W1032-R1095 HydrophobicContact CH2-CG 3.65Å; W1032-R1095 HydrophobicContact CZ2-CG 4.2Å; W1032-R1095 HydrophobicContact CZ3-CB 4.09Å; W1032-R1095 HydrophobicContact CZ3-CG 3.51Å; W1079-R1095 HydrophobicContact CH2-CG 4.29Å; V1083-R1095 CarbonylContact O-C 3.46Å; V1083-R1095 WeakPolarHBondContact O-CA 3.35Å; Q1084-R1095 HydrophobicContact CB-CG 4.13Å; Q1084-R1095 HydrophobicContact CG-CG 3.96Å; Q1084-R1095 VanDerWaalsContact OE1-CZ 3.29Å; R1095-L1097 HydrophobicContact CB-CD1 4.11Å; R1095-L1097 HydrophobicContact CB-CG 4.26Å; R1095-F1110 CarbonylContact O-C 3.55Å; R1095-F1110 WeakPolarHBondContact O-CA 3.41Å; R1095-E1111 HydrophobicContact CB-CB 4.42Å; R1095-E1111 PolarHBondContact N-O 2.91Å; R1095-E1111 PolarHBondContact O-N 2.95Å
1096	F	87.4	Confident	78.1	Confident	4 Å²	4	55.3 Å²	55.3	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	113.6	169.3	179	-120.7	0	0	0	108.1	F1058 A1061 T1062 G1082 V1083 I1108 K1109 F1110 F1197	F1058-F1096 HydrophobicContact CD2-CD1 4.3Å; F1058-F1096 AromaticContact CD2-CE1 3.56Å; F1058-F1096 HydrophobicContact CD2-CE1 3.56Å; F1058-F1096 AromaticContact CD2-CZ 3.86Å; F1058-F1096 HydrophobicContact CD2-CZ 3.86Å; F1058-F1096 AromaticContact CE2-CD1 3.47Å; F1058-F1096 HydrophobicContact CE2-CD1 3.47Å; F1058-F1096 VanDerWaalsContact CE2-CD1 3.47Å; F1058-F1096 AromaticContact CE2-CE1 3.18Å; F1058-F1096 HydrophobicContact CE2-CE1 3.18Å; F1058-F1096 HydrophobicContact CE2-CE2 4.48Å; F1058-F1096 HydrophobicContact CE2-CG 4.25Å; F1058-F1096 AromaticContact CE2-CZ 3.76Å; F1058-F1096 HydrophobicContact CE2-CZ 3.76Å; F1058-F1096 HydrophobicContact CG-CE1 4.48Å; F1058-F1096 AromaticContact CZ-CD1 3.82Å; F1058-F1096 HydrophobicContact CZ-CD1 3.82Å; F1058-F1096 AromaticContact CZ-CE1 3.85Å; F1058-F1096 HydrophobicContact CZ-CE1 3.85Å; A1061-F1096 HydrophobicContact CB-CE1 4.16Å; A1061-F1096 HydrophobicContact CB-CZ 3.91Å; T1062-F1096 HydrophobicContact CG2-CD1 3.77Å; T1062-F1096 HydrophobicContact CG2-CE1 3.67Å; G1082-F1096 CarbonylContact C-O 3.47Å; G1082-F1096 WeakPolarHBondContact CA-O 3.31Å; V1083-F1096 HydrophobicContact CB-CB 4.43Å; V1083-F1096 PolarHBondContact N-O 2.77Å; V1083-F1096 PolarHBondContact O-N 2.83Å; F1096-I1108 HydrophobicContact CD2-CG2 3.9Å; F1096-I1108 HydrophobicContact CE2-CG2 3.1Å; F1096-I1108 HydrophobicContact CZ-CG2 3.64Å; F1096-K1109 CarbonylContact C-O 3.56Å; F1096-K1109 WeakPolarHBondContact CA-O 3.39Å; F1096-F1110 AromaticContact CD2-CD1 3.66Å; F1096-F1110 HydrophobicContact CD2-CD1 3.66Å; F1096-F1110 HydrophobicContact CD2-CD2 4.12Å; F1096-F1110 AromaticContact CD2-CE1 3.28Å; F1096-F1110 HydrophobicContact CD2-CE1 3.28Å; F1096-F1110 AromaticContact CD2-CE2 3.79Å; F1096-F1110 HydrophobicContact CD2-CE2 3.79Å; F1096-F1110 HydrophobicContact CD2-CG 4.08Å; F1096-F1110 AromaticContact CD2-CZ 3.38Å; F1096-F1110 HydrophobicContact CD2-CZ 3.38Å; F1096-F1110 HydrophobicContact CE2-CD1 4.3Å; F1096-F1110 HydrophobicContact CE2-CD2 4.25Å; F1096-F1110 AromaticContact CE2-CE1 3.57Å; F1096-F1110 HydrophobicContact CE2-CE1 3.57Å; F1096-F1110 AromaticContact CE2-CE2 3.51Å; F1096-F1110 HydrophobicContact CE2-CE2 3.51Å; F1096-F1110 AromaticContact CE2-CZ 3.13Å; F1096-F1110 HydrophobicContact CE2-CZ 3.13Å; F1096-F1110 HydrophobicContact CG-CE1 4.2Å; F1096-F1110 HydrophobicContact CZ-CZ 4.21Å; F1096-F1197 HydrophobicContact CE2-CE2 4.31Å; F1096-F1197 HydrophobicContact CE2-CZ 4.45Å; F1096-F1197 HydrophobicContact CZ-CE2 4.01Å; F1096-F1197 HydrophobicContact CZ-CZ 4.42Å
1097	L	87.8	Confident	78.3	Confident	32 Å²	32	54 Å²	54	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.5	-166.6	-76.1	160	0	0	0	111.3	W1079 T1081 R1095 I1108 K1109	W1079-L1097 HydrophobicContact CZ2-CD2 3.57Å; T1081-L1097 CarbonylContact O-C 3.59Å; T1081-L1097 WeakPolarHBondContact O-CA 3.37Å; R1095-L1097 HydrophobicContact CB-CD1 4.11Å; R1095-L1097 HydrophobicContact CB-CG 4.26Å; L1097-I1108 CarbonylContact O-C 3.34Å; L1097-I1108 WeakPolarHBondContact O-CA 3.35Å; L1097-K1109 HydrophobicContact CB-CB 4.29Å; L1097-K1109 PolarHBondContact N-O 3.04Å; L1097-K1109 PolarHBondContact O-N 3.34Å
1098	L	86.8	Confident	78.6	Confident	14 Å²	14	54 Å²	54	7%	0.073	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116	166.9	176.6	57	0	0	0	109.5	L1053 F1058 T1081 K1100 I1108	L1053-L1098 HydrophobicContact CD2-CD1 3.43Å; L1053-L1098 VanDerWaalsContact CD2-CD1 3.43Å; L1053-L1098 HydrophobicContact CD2-CD2 4.15Å; L1053-L1098 HydrophobicContact CD2-CG 4.45Å; F1058-L1098 HydrophobicContact CB-CD2 3.89Å; F1058-L1098 HydrophobicContact CD1-CB 4.34Å; F1058-L1098 HydrophobicContact CD1-CD2 4.23Å; F1058-L1098 HydrophobicContact CD2-CB 3.64Å; F1058-L1098 HydrophobicContact CD2-CD2 4.33Å; F1058-L1098 HydrophobicContact CD2-CG 4.42Å; F1058-L1098 HydrophobicContact CE1-CB 4.38Å; F1058-L1098 HydrophobicContact CE2-CB 3.69Å; F1058-L1098 HydrophobicContact CG-CB 3.98Å; F1058-L1098 HydrophobicContact CG-CD2 3.89Å; F1058-L1098 HydrophobicContact CG-CG 4.46Å; F1058-L1098 HydrophobicContact CZ-CB 4.08Å; T1081-L1098 PolarHBondContact O-N 3.47Å; L1098-K1100 HydrophobicContact CD1-CG 4.29Å; L1098-K1100 HydrophobicContact CD2-CD 4.5Å; L1098-K1100 HydrophobicContact CD2-CG 4.36Å; L1098-K1100 HydrophobicContact CG-CG 4.11Å; L1098-I1108 HydrophobicContact CD1-CG1 3.99Å
1099	I	82.6	Confident	79.2	Confident	63 Å²	63	53.4 Å²	53.4	32%	0.323	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.1	173.7	-66.1	160.4	0	0	0	107.4	L1107 K1109	I1099-L1107 HydrophobicContact CB-CB 4.33Å; I1099-L1107 PolarHBondContact N-O 3.49Å; I1099-L1107 PolarHBondContact O-N 3.3Å; I1099-K1109 HydrophobicContact CD1-CD 3.41Å; I1099-K1109 VanDerWaalsContact CD1-CD 3.41Å; I1099-K1109 HydrophobicContact CD1-CG 3.89Å
1100	K	74.2	Confident	79.7	Confident	129 Å²	129	48.5 Å²	48.5	56%	0.561	24%	0.241	S	C	*	.			trans	-98.3	127	169	-63.7	-175.1	-178.7	-177.4	0	107.3	L1098	L1098-K1100 HydrophobicContact CD1-CG 4.29Å; L1098-K1100 HydrophobicContact CD2-CD 4.5Å; L1098-K1100 HydrophobicContact CD2-CG 4.36Å; L1098-K1100 HydrophobicContact CG-CG 4.11Å
1101	S	62.3	Low	80.1	Confident	39 Å²	39	48.4 Å²	48.4	27%	0.273	24%	0.239	S	C	.	.			trans	-115.5	142.8	167	51.7	0	0	0	0	108.2	N1103 E1104	S1101-N1103 PolarHBondContact O-N 3.31Å; S1101-E1104 WeakPolarHBondContact OG-CA 3.39Å; S1101-E1104 WeakPolarHBondContact OG-CB 3.45Å; S1101-E1104 PolarHBondContact OG-N 3Å; S1101-E1104 PolarHBondContact OG-O 3.27Å
1102	D	58.9	Low	80.3	Confident	168 Å²	168	44 Å²	44	90%	0.898	22%	0.223	S	C	*	.	S	Bend	trans	-67.5	-22.3	-176.8	-59.5	-35.6	0	0	0	112.2
1103	N	56.2	Low	80.5	Confident	162 Å²	162	46 Å²	46	87%	0.866	23%	0.23	S	C	*	.	S	Bend	trans	-120.3	1.7	-173	-66	-23.9	0	0	0	114.8	S1101	S1101-N1103 PolarHBondContact O-N 3.31Å
1104	E	64.3	Low	80.4	Confident	137 Å²	137	46 Å²	46	64%	0.64	23%	0.23	S	C	*	.	S	Bend	trans	-134.4	170.1	179.5	-36.8	-179.3	136.5	0	0	112.9	S1101 S1106	S1101-E1104 WeakPolarHBondContact OG-CA 3.39Å; S1101-E1104 WeakPolarHBondContact OG-CB 3.45Å; S1101-E1104 PolarHBondContact OG-N 3Å; S1101-E1104 PolarHBondContact OG-O 3.27Å; E1104-S1106 PolarHBondContact O-N 3.22Å
1105	D	74.5	Confident	80	Confident	31 Å²	31	46.7 Å²	46.7	17%	0.166	23%	0.233	C	C	.	.			trans	-54.1	132.2	174.7	-59.5	37	0	0	0	111.3	R1048 S1050 L1107	R1048-D1105 HydrophobicContact CG-CB 3.59Å; R1048-D1105 WeakPolarHBondContact CG-OD2 3.35Å; R1048-D1105 IonicContact CZ-OD1 2.7Å; R1048-D1105 IonicContact CZ-OD2 2.92Å; R1048-D1105 IonicContact NE-OD1 3.88Å; R1048-D1105 IonicContact NE-OD2 3.97Å; R1048-D1105 PolarHBondContact NE-OD2 3.2Å; R1048-D1105 IonicContact NH2-OD1 3.04Å; R1048-D1105 PolarHBondContact NH2-OD1 3.33Å; R1048-D1105 IonicContact NH2-OD2 2.72Å; R1048-D1105 PolarHBondContact NH2-OD2 3Å; S1050-D1105 VanDerWaalsContact CA-CG 3.5Å; S1050-D1105 WeakPolarHBondContact CA-OD2 3.46Å; S1050-D1105 WeakPolarHBondContact CB-OD2 3.45Å; S1050-D1105 PolarHBondContact OG-OD2 3.3Å; D1105-L1107 WeakPolarHBondContact O-CG 3.22Å; D1105-L1107 PolarHBondContact O-N 3.48Å
1106	S	79.9	Confident	79	Confident	20 Å²	20	47.4 Å²	47.4	14%	0.14	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	138.3	171.5	-62.3	0	0	0	0	110.9	F1049 E1104	F1049-S1106 WeakPolarHBondContact CD2-O 3.36Å; F1049-S1106 PolarHBondContact N-O 3.35Å; E1104-S1106 PolarHBondContact O-N 3.22Å
1107	L	85.7	Confident	77.7	Confident	14 Å²	14	51.5 Å²	51.5	7%	0.073	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.6	-176.4	-56.6	174.2	0	0	0	111.1	V1046 Y1047 R1048 I1099 D1105 L1221	V1046-L1107 HydrophobicContact CG1-CB 4.06Å; V1046-L1107 HydrophobicContact CG1-CD1 4.43Å; V1046-L1107 HydrophobicContact CG1-CD2 3.87Å; V1046-L1107 HydrophobicContact CG1-CG 4.34Å; Y1047-L1107 WeakPolarHBondContact O-CA 3.25Å; R1048-L1107 HydrophobicContact CB-CD2 3.68Å; R1048-L1107 HydrophobicContact CG-CD2 3.69Å; I1099-L1107 HydrophobicContact CB-CB 4.33Å; I1099-L1107 PolarHBondContact N-O 3.49Å; I1099-L1107 PolarHBondContact O-N 3.3Å; D1105-L1107 WeakPolarHBondContact O-CG 3.22Å; D1105-L1107 PolarHBondContact O-N 3.48Å; L1107-L1221 HydrophobicContact CD1-CD1 4.47Å
1108	I	88.4	Confident	75.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.9	165.4	-69.2	178.3	0	0	0	108.6	V1046 Y1047 F1049 L1053 F1058 F1096 L1097 L1098 F1110 F1197	V1046-I1108 CarbonylContact C-O 3.56Å; V1046-I1108 WeakPolarHBondContact CA-O 3.41Å; Y1047-I1108 PolarHBondContact N-O 2.83Å; Y1047-I1108 PolarHBondContact O-N 3.13Å; F1049-I1108 HydrophobicContact CE2-CB 4.1Å; F1049-I1108 HydrophobicContact CE2-CD1 3.84Å; F1049-I1108 HydrophobicContact CE2-CG1 3.89Å; F1049-I1108 HydrophobicContact CZ-CD1 4.15Å; L1053-I1108 HydrophobicContact CD1-CD1 3.54Å; L1053-I1108 HydrophobicContact CD1-CG1 4.14Å; L1053-I1108 HydrophobicContact CD2-CD1 4.02Å; L1053-I1108 HydrophobicContact CD2-CG1 4.38Å; L1053-I1108 HydrophobicContact CG-CD1 4.45Å; F1058-I1108 HydrophobicContact CD2-CD1 4.26Å; F1058-I1108 HydrophobicContact CD2-CG1 4.4Å; F1096-I1108 HydrophobicContact CD2-CG2 3.9Å; F1096-I1108 HydrophobicContact CE2-CG2 3.1Å; F1096-I1108 HydrophobicContact CZ-CG2 3.64Å; L1097-I1108 CarbonylContact O-C 3.34Å; L1097-I1108 WeakPolarHBondContact O-CA 3.35Å; L1098-I1108 HydrophobicContact CD1-CG1 3.99Å; I1108-F1110 HydrophobicContact CG2-CE2 4.06Å; I1108-F1197 HydrophobicContact CB-CZ 4.44Å; I1108-F1197 HydrophobicContact CD1-CE2 4.46Å; I1108-F1197 HydrophobicContact CD1-CZ 3.76Å; I1108-F1197 HydrophobicContact CG2-CE1 4.26Å; I1108-F1197 HydrophobicContact CG2-CZ 3.93Å
1109	K	87.5	Confident	73.4	Confident	41 Å²	41	59.5 Å²	59.5	18%	0.178	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.4	-177.4	-57.6	-164.1	-178.5	179.7	0	111.8	F1045 V1046 F1096 L1097 I1099 E1214	F1045-K1109 CarbonylContact O-C 3.58Å; F1045-K1109 WeakPolarHBondContact O-CA 3.44Å; V1046-K1109 HydrophobicContact CB-CG 4.47Å; V1046-K1109 HydrophobicContact CG1-CG 4.11Å; V1046-K1109 HydrophobicContact CG2-CB 4.44Å; V1046-K1109 HydrophobicContact CG2-CD 4.1Å; V1046-K1109 HydrophobicContact CG2-CG 3.82Å; F1096-K1109 CarbonylContact C-O 3.56Å; F1096-K1109 WeakPolarHBondContact CA-O 3.39Å; L1097-K1109 HydrophobicContact CB-CB 4.29Å; L1097-K1109 PolarHBondContact N-O 3.04Å; L1097-K1109 PolarHBondContact O-N 3.34Å; I1099-K1109 HydrophobicContact CD1-CD 3.41Å; I1099-K1109 VanDerWaalsContact CD1-CD 3.41Å; I1099-K1109 HydrophobicContact CD1-CG 3.89Å; K1109-E1214 WeakPolarHBondContact CE-OE1 3.48Å; K1109-E1214 IonicContact NZ-OE1 3.27Å; K1109-E1214 PolarHBondContact NZ-OE1 3.33Å
1110	F	88.6	Confident	71.1	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	110.6	166.9	-65.9	-99.1	0	0	0	108.6	I1044 F1045 Y1047 W1067 L1094 R1095 F1096 I1108 F1112 I1193 L1194 F1197	I1044-F1110 WeakPolarHBondContact CA-O 3.24Å; F1045-F1110 HydrophobicContact CB-CB 4.43Å; F1045-F1110 PolarHBondContact N-O 2.85Å; F1045-F1110 PolarHBondContact O-N 2.6Å; Y1047-F1110 HydrophobicContact CD2-CD2 4.13Å; Y1047-F1110 AromaticContact CD2-CE2 3.88Å; Y1047-F1110 HydrophobicContact CD2-CE2 3.88Å; Y1047-F1110 AromaticContact CE2-CD2 3.99Å; Y1047-F1110 HydrophobicContact CE2-CD2 3.99Å; Y1047-F1110 AromaticContact CE2-CE2 3.71Å; Y1047-F1110 HydrophobicContact CE2-CE2 3.71Å; W1067-F1110 HydrophobicContact CH2-CE1 4.01Å; L1094-F1110 HydrophobicContact CD1-CB 4.35Å; L1094-F1110 HydrophobicContact CD1-CD1 4.4Å; R1095-F1110 CarbonylContact O-C 3.55Å; R1095-F1110 WeakPolarHBondContact O-CA 3.41Å; F1096-F1110 AromaticContact CD2-CD1 3.66Å; F1096-F1110 HydrophobicContact CD2-CD1 3.66Å; F1096-F1110 HydrophobicContact CD2-CD2 4.12Å; F1096-F1110 AromaticContact CD2-CE1 3.28Å; F1096-F1110 HydrophobicContact CD2-CE1 3.28Å; F1096-F1110 AromaticContact CD2-CE2 3.79Å; F1096-F1110 HydrophobicContact CD2-CE2 3.79Å; F1096-F1110 HydrophobicContact CD2-CG 4.08Å; F1096-F1110 AromaticContact CD2-CZ 3.38Å; F1096-F1110 HydrophobicContact CD2-CZ 3.38Å; F1096-F1110 HydrophobicContact CE2-CD1 4.3Å; F1096-F1110 HydrophobicContact CE2-CD2 4.25Å; F1096-F1110 AromaticContact CE2-CE1 3.57Å; F1096-F1110 HydrophobicContact CE2-CE1 3.57Å; F1096-F1110 AromaticContact CE2-CE2 3.51Å; F1096-F1110 HydrophobicContact CE2-CE2 3.51Å; F1096-F1110 AromaticContact CE2-CZ 3.13Å; F1096-F1110 HydrophobicContact CE2-CZ 3.13Å; F1096-F1110 HydrophobicContact CG-CE1 4.2Å; F1096-F1110 HydrophobicContact CZ-CZ 4.21Å; I1108-F1110 HydrophobicContact CG2-CE2 4.06Å; F1110-F1112 HydrophobicContact CB-CE2 3.84Å; F1110-I1193 HydrophobicContact CD1-CG2 4.36Å; F1110-I1193 HydrophobicContact CE1-CG2 4.01Å; F1110-L1194 HydrophobicContact CD2-CD2 4.38Å; F1110-L1194 HydrophobicContact CG-CD2 4.48Å; F1110-F1197 AromaticContact CE2-CD1 3.72Å; F1110-F1197 HydrophobicContact CE2-CD1 3.72Å; F1110-F1197 AromaticContact CE2-CE1 3.93Å; F1110-F1197 HydrophobicContact CE2-CE1 3.93Å; F1110-F1197 HydrophobicContact CE2-CG 4.15Å; F1110-F1197 HydrophobicContact CZ-CB 4.08Å; F1110-F1197 AromaticContact CZ-CD1 3.84Å; F1110-F1197 HydrophobicContact CZ-CD1 3.84Å; F1110-F1197 HydrophobicContact CZ-CD2 4.2Å; F1110-F1197 HydrophobicContact CZ-CE1 4.3Å; F1110-F1197 AromaticContact CZ-CG 3.77Å; F1110-F1197 HydrophobicContact CZ-CG 3.77Å
1111	E	87.9	Confident	69	Low	28 Å²	28	63.4 Å²	63.4	13%	0.131	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	113.8	-179.6	-176.6	173.9	-175	0	0	110.6	W1032 P1042 I1044 L1094 R1095 R1113	W1032-E1111 HydrophobicContact CH2-CB 4.16Å; W1032-E1111 HydrophobicContact CH2-CG 3.68Å; W1032-E1111 VanDerWaalsContact CZ2-CD 3.41Å; W1032-E1111 HydrophobicContact CZ2-CG 4.14Å; W1032-E1111 VanDerWaalsContact CZ2-OE2 3.32Å; W1032-E1111 WeakPolarHBondContact CZ2-OE2 3.36Å; P1042-E1111 HydrophobicContact CB-CG 4.26Å; I1044-E1111 HydrophobicContact CD1-CG 4.28Å; I1044-E1111 HydrophobicContact CG1-CB 4.32Å; I1044-E1111 HydrophobicContact CG1-CG 3.95Å; L1094-E1111 CarbonylContact C-O 3.5Å; L1094-E1111 WeakPolarHBondContact CA-O 3.03Å; R1095-E1111 HydrophobicContact CB-CB 4.42Å; R1095-E1111 PolarHBondContact N-O 2.91Å; R1095-E1111 PolarHBondContact O-N 2.95Å; E1111-R1113 HydrophobicContact CG-CG 4.41Å; E1111-R1113 IonicContact OE1-CZ 3.62Å; E1111-R1113 IonicContact OE1-NE 3.3Å; E1111-R1113 PolarHBondContact OE1-NE 3.44Å; E1111-R1113 IonicContact OE1-NH2 3.67Å; E1111-R1113 PolarHBondContact OE1-NH2 3.47Å
1112	F	87.8	Confident	67.5	Low	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	126.4	177	-62.9	-98.7	0	0	0	109.9	P1042 I1043 F1045 I1092 L1094 F1110 W1179 M1190 I1193	P1042-F1112 WeakPolarHBondContact CA-O 3.08Å; I1043-F1112 HydrophobicContact CB-CB 4.48Å; I1043-F1112 PolarHBondContact N-O 3.3Å; I1043-F1112 VanDerWaalsContact N-O 3.08Å; I1043-F1112 PolarHBondContact O-N 3Å; F1045-F1112 HydrophobicContact CD2-CE2 4.27Å; I1092-F1112 HydrophobicContact CG2-CD1 4.26Å; L1094-F1112 HydrophobicContact CB-CD1 4.37Å; L1094-F1112 HydrophobicContact CB-CE1 4.41Å; L1094-F1112 HydrophobicContact CD1-CD1 3.81Å; L1094-F1112 HydrophobicContact CD1-CD2 3.95Å; L1094-F1112 HydrophobicContact CD1-CE1 3.58Å; L1094-F1112 HydrophobicContact CD1-CE2 3.74Å; L1094-F1112 HydrophobicContact CD1-CG 3.99Å; L1094-F1112 HydrophobicContact CD1-CZ 3.55Å; L1094-F1112 HydrophobicContact CD2-CE1 3.95Å; L1094-F1112 HydrophobicContact CD2-CZ 4.18Å; L1094-F1112 HydrophobicContact CG-CE1 4.18Å; L1094-F1112 HydrophobicContact CG-CZ 4.45Å; F1110-F1112 HydrophobicContact CB-CE2 3.84Å; F1112-W1179 HydrophobicContact CB-CH2 4.13Å; F1112-W1179 WeakPolarHBondContact O-CH2 3.49Å; F1112-M1190 HydrophobicContact CB-CE 4.13Å; F1112-M1190 HydrophobicContact CD1-CE 4.11Å; F1112-M1190 HydrophobicContact CD1-CG 3.92Å; F1112-M1190 HydrophobicContact CD2-CE 3.3Å; F1112-M1190 HydrophobicContact CE1-CB 4.4Å; F1112-M1190 HydrophobicContact CE1-CE 4.35Å; F1112-M1190 HydrophobicContact CE1-CG 3.66Å; F1112-M1190 HydrophobicContact CE2-CE 3.59Å; F1112-M1190 HydrophobicContact CE2-CG 4.32Å; F1112-M1190 HydrophobicContact CG-CE 3.59Å; F1112-M1190 HydrophobicContact CG-CG 4.37Å; F1112-M1190 HydrophobicContact CZ-CB 4.23Å; F1112-M1190 HydrophobicContact CZ-CE 4.12Å; F1112-M1190 HydrophobicContact CZ-CG 3.87Å; F1112-I1193 HydrophobicContact CE1-CD1 4.47Å
1113	R	87.7	Confident	66	Low	41 Å²	41	65.6 Å²	65.6	16%	0.155	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	152	174.4	-69.4	-170.9	178.6	-119.8	7.7	111.2	W1032 A1035 C1036 P1042 I1092 V1093 E1111	W1032-R1113 HydrophobicContact CH2-CG 4.14Å; W1032-R1113 HydrophobicContact CZ3-CG 4.39Å; A1035-R1113 HydrophobicContact CB-CB 4.02Å; C1036-R1113 PolarHBondContact SG-NH1 3.1Å; P1042-R1113 HydrophobicContact CB-CG 3.94Å; I1092-R1113 CarbonylContact C-O 3.53Å; I1092-R1113 WeakPolarHBondContact CA-O 3.04Å; V1093-R1113 PolarHBondContact N-O 3.49Å; V1093-R1113 PolarHBondContact O-N 3.14Å; E1111-R1113 HydrophobicContact CG-CG 4.41Å; E1111-R1113 IonicContact OE1-CZ 3.62Å; E1111-R1113 IonicContact OE1-NE 3.3Å; E1111-R1113 PolarHBondContact OE1-NE 3.44Å; E1111-R1113 IonicContact OE1-NH2 3.67Å; E1111-R1113 PolarHBondContact OE1-NH2 3.47Å
1114	A	84.3	Confident	64.6	Low	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145.8	177.1	0	0	0	0	0	111.5	G1039 P1040 W1179 P1180	G1039-A1114 VanDerWaalsContact CA-O 3.24Å; G1039-A1114 WeakPolarHBondContact CA-O 2.85Å; P1040-A1114 HydrophobicContact CG-CB 3.86Å; A1114-W1179 HydrophobicContact CB-CD2 3.99Å; A1114-W1179 HydrophobicContact CB-CE3 3.55Å; A1114-W1179 HydrophobicContact CB-CH2 4.36Å; A1114-W1179 HydrophobicContact CB-CZ3 3.77Å; A1114-P1180 HydrophobicContact CB-CG 3.86Å
1115	L	79.4	Confident	62.8	Low	17 Å²	17	65.7 Å²	65.7	9%	0.089	37%	0.374	C	S	.	.			trans	-94.4	149.8	172.1	-78.9	151.8	0	0	0	110.8	L1031 T1034 A1035 F1086 R1091 V1093	L1031-L1115 HydrophobicContact CD2-CD1 4.1Å; T1034-L1115 HydrophobicContact CG2-CD2 3.85Å; A1035-L1115 HydrophobicContact CB-CD2 4.13Å; A1035-L1115 HydrophobicContact CB-CG 4.2Å; F1086-L1115 HydrophobicContact CD2-CD1 4.06Å; F1086-L1115 HydrophobicContact CE2-CD1 3.45Å; F1086-L1115 VanDerWaalsContact CE2-CD1 3.45Å; F1086-L1115 HydrophobicContact CZ-CD1 4.13Å; R1091-L1115 HydrophobicContact CB-CB 4.22Å; R1091-L1115 PolarHBondContact O-N 3.4Å; V1093-L1115 HydrophobicContact CG2-CD1 3.6Å; V1093-L1115 HydrophobicContact CG2-CG 4.19Å
1116	P	66.3	Low	60.5	Low	56 Å²	56	72.7 Å²	72.7	36%	0.364	41%	0.406	S	S	.	.			trans	-67.3	151.9	-176.4	26.3	-33	0	0	0	112.4	T1038 R1091	T1038-P1116 WeakPolarHBondContact OG1-CD 3.5Å; T1038-P1116 WeakPolarHBondContact OG1-CG 3.29Å; R1091-P1116 PolarHBondContact NH1-O 2.84Å
1117	V	60.1	Low	57.9	Low	89 Å²	89	79.5 Å²	79.5	54%	0.539	44%	0.438	S	S	.	.			trans	-86.9	111.7	168.4	-176.4	0	0	0	0	106.8	T1119 P1180	V1117-T1119 PolarHBondContact O-N 2.89Å; V1117-P1180 HydrophobicContact CG2-CB 4.05Å
1118	T	49.3	Very low	55	Low	96 Å²	96	88.5 Å²	88.5	59%	0.589	47%	0.471	S	S	*	.			trans	-65.5	98.1	170.5	43.8	0	0	0	0	107.8	T1120	T1118-T1120 PolarHBondContact O-N 2.88Å
1119	T	36.5	Very low	51.8	Low	118 Å²	118	96.1 Å²	96.1	72%	0.724	51%	0.511	S	S	*	.			trans	-74.9	81.6	169.4	48.5	0	0	0	0	108	V1117 N1121	V1117-T1119 PolarHBondContact O-N 2.89Å; T1119-N1121 PolarHBondContact O-N 2.84Å
1120	T	33.3	Very low	48.8	Very low	122 Å²	122	102.1 Å²	102.1	75%	0.748	54%	0.539	S	S	*	.			trans	-75.4	98.8	161.9	46.1	0	0	0	0	106.7	T1118 S1122	T1118-T1120 PolarHBondContact O-N 2.88Å; T1120-S1122 PolarHBondContact O-N 3.04Å
1121	N	29.7	Very low	45.9	Very low	153 Å²	153	108.7 Å²	108.7	82%	0.818	57%	0.574	S	S	*	*			trans	-68.4	105.7	167.4	-75.1	-14.6	0	0	0	108.4	T1119	T1119-N1121 PolarHBondContact O-N 2.84Å
1122	S	30.4	Very low	42.9	Very low	106 Å²	106	114.5 Å²	114.5	74%	0.741	61%	0.606	S	S	*	*			trans	-172.5	121.8	147	52.2	0	0	0	0	107.8	T1120	T1120-S1122 PolarHBondContact O-N 3.04Å
1123	D	28.1	Very low	39.8	Very low	147 Å²	147	121.4 Å²	121.4	79%	0.786	64%	0.644	S	S	*	*			trans	-59.3	155.2	-176.5	-61.7	-55.6	0	0	0	113.7
1124	D	27.9	Very low	36.9	Very low	141 Å²	141	126 Å²	126	75%	0.754	68%	0.676	S	S	*	*			trans	52.4	97.6	151.9	-58.1	-23.4	0	0	0	118.7
1125	N	25.7	Very low	34	Very low	160 Å²	160	130.3 Å²	130.3	86%	0.856	71%	0.712	S	S	*	*				-171.3	133.4	120	-89.6	-31.4	0	0	0	111.6	I1127	N1125-I1127 PolarHBondContact O-N 3.34Å
1126	E	25.3	Very low	31.3	Very low	178 Å²	178	133.3 Å²	133.3	83%	0.832	74%	0.739	S	S	*	*			trans	-55.5	127.9	177	-62.4	178.5	144	0	0	111.8
1127	I	26.5	Very low	29.3	Very low	162 Å²	162	137 Å²	137	83%	0.831	76%	0.756	S	S	*	*			trans	-110.1	96.4	163.2	-60.9	177.3	0	0	0	107.4	N1125	N1125-I1127 PolarHBondContact O-N 3.34Å
1128	R	23.5	Very low	27.5	Very low	203 Å²	203	139.1 Å²	139.1	77%	0.766	76%	0.762	S	S	*	*			trans	-60.2	133.2	160.5	-81.6	177.1	173.9	168.4	0.2	108.6	E1130	R1128-E1130 PolarHBondContact O-N 3.31Å; R1128-E1130 VanDerWaalsContact O-N 3.1Å
1129	I	23.1	Very low	26.3	Very low	160 Å²	160	140.6 Å²	140.6	82%	0.821	77%	0.767	S	S	*	*			trans	-72.8	94.9	173.6	-60.2	163.2	0	0	0	106.4
1130	E	24.3	Very low	25.7	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	77%	0.771	S	S	*	*			trans	-102.4	111.3	164	-79.9	-174.6	177.7	0	0	108.8	R1128	R1128-E1130 PolarHBondContact O-N 3.31Å; R1128-E1130 VanDerWaalsContact O-N 3.1Å
1131	N	26.3	Very low	25.1	Very low	138 Å²	138	144.6 Å²	144.6	74%	0.738	77%	0.769	S	S	*	*			trans	-56.8	132.2	153.3	-57.8	-44.2	0	0	0	107.3
1132	N	24.8	Very low	24.8	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	76%	0.756	S	S	*	*			trans	-163.6	130.6	137.6	-91.7	-22.7	0	0	0	110
1133	D	24.4	Very low	24.5	Very low	146 Å²	146	144.6 Å²	144.6	78%	0.781	76%	0.755	S	S	*	*			trans	-48.5	140.8	161.9	-56.9	-63.7	0	0	0	111.1
1134	T	26.6	Very low	24.4	Very low	137 Å²	137	146 Å²	146	84%	0.84	76%	0.757	S	S	*	*				176.7	122.1	124.8	28.1	0	0	0	0	111.1
1135	A	22.6	Very low	24.2	Very low	91 Å²	91	150.4 Å²	150.4	75%	0.752	76%	0.763	S	S	*	*			trans	48.2	114.1	132.4	0	0	0	0	0	119.9
1136	A	23.7	Very low	24.1	Very low	79 Å²	79	147.7 Å²	147.7	65%	0.653	76%	0.757	S	S	*	*				81.2	115.4	120.1	0	0	0	0	0	118.7
1137	N	23.2	Very low	24.1	Very low	135 Å²	135	145.1 Å²	145.1	72%	0.722	75%	0.754	S	S	*	*				78.6	115.1	123.9	-71.1	-3.6	0	0	0	117.1
1138	I	23	Very low	23.9	Very low	132 Å²	132	144.4 Å²	144.4	68%	0.677	75%	0.751	S	S	*	*				79.3	129.5	102.8	-70.9	170	0	0	0	108.8
1139	D	23	Very low	23.9	Very low	128 Å²	128	141.7 Å²	141.7	68%	0.684	75%	0.751	S	S	*	*			cis	-165.3	-173.9	-2.7	-93.8	-27	0	0	0	103
1140	E	23.6	Very low	23.9	Very low	174 Å²	174	141.4 Å²	141.4	81%	0.813	75%	0.746	S	S	*	*			trans	76.3	135.5	154.2	-58.4	-176.4	179.1	0	0	116.6
1141	E	22.5	Very low	23.8	Very low	150 Å²	150	139.5 Å²	139.5	70%	0.701	74%	0.742	S	S	*	*			cis	-177.5	153.8	-18.1	-126	-176.4	-170.5	0	0	103.3
1142	N	22.9	Very low	23.8	Very low	101 Å²	101	140 Å²	140	54%	0.54	75%	0.75	S	S	.	*			trans	77	116	142.2	-65.7	-20.2	0	0	0	122.7
1143	H	24.2	Very low	23.6	Very low	157 Å²	157	138.8 Å²	138.8	73%	0.727	75%	0.748	S	S	*	*			trans	73	135.6	131.3	-57.8	-43.3	0	0	0	116.6
1144	E	26.4	Very low	23.5	Very low	178 Å²	178	140.7 Å²	140.7	83%	0.832	75%	0.75	S	S	*	*			cis	-157.4	127.4	46.4	-72.1	175.9	148.8	0	0	109
1145	R	22.1	Very low	23.4	Very low	232 Å²	232	142.5 Å²	142.5	88%	0.875	75%	0.754	S	S	*	*				43	118.1	105.4	-74.6	-178.7	176.3	172.9	0.5	115.9
1146	S	24.4	Very low	23.4	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	76%	0.756	S	S	*	*				170.7	128.4	103.2	45.7	0	0	0	0	113.8
1147	T	25.3	Very low	23.3	Very low	124 Å²	124	142.5 Å²	142.5	76%	0.761	76%	0.761	S	S	*	*			trans	58.1	100.4	139.8	59.4	0	0	0	0	118.8
1148	L	22	Very low	23.5	Very low	147 Å²	147	145.7 Å²	145.7	77%	0.77	77%	0.769	S	S	*	*				47.9	117.2	74.3	-84.7	153.7	0	0	0	114.9
1149	D	24.5	Very low	23.4	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	78%	0.777	S	S	*	*			trans	145.6	88.4	138.6	-74.3	-11	0	0	0	109.3
1150	E	22.1	Very low	23.7	Very low	153 Å²	153	147.4 Å²	147.4	72%	0.715	79%	0.788	S	S	*	*				56.4	117.5	85.6	-80.7	-156.7	-177.3	0	0	115.9
1151	N	22.5	Very low	23.7	Very low	128 Å²	128	148.7 Å²	148.7	68%	0.684	79%	0.791	S	S	*	*			trans	70.9	101	141.3	-57.1	-27	0	0	0	118.7
1152	T	25	Very low	23.8	Very low	148 Å²	148	150.3 Å²	150.3	91%	0.908	80%	0.798	S	S	*	*				-145.1	123.8	124.9	40.5	0	0	0	0	112.3
1153	T	21.7	Very low	23.9	Very low	125 Å²	125	151 Å²	151	77%	0.767	81%	0.812	S	S	*	*			trans	-64.9	146.4	178.6	33.7	0	0	0	0	114.7
1154	F	21.3	Very low	23.8	Very low	185 Å²	185	149.4 Å²	149.4	81%	0.811	81%	0.808	S	S	*	*			trans	40.5	116.6	139.9	-83.9	-96.5	0	0	0	118.9
1155	N	25	Very low	23.9	Very low	175 Å²	175	148.8 Å²	148.8	94%	0.936	81%	0.811	S	S	*	*			trans	-146.8	128	131.4	-102.9	-32.2	0	0	0	112.7
1156	A	22.5	Very low	24.2	Very low	96 Å²	96	146.4 Å²	146.4	79%	0.793	81%	0.806	S	S	*	*			trans	-83.2	154	-177.4	0	0	0	0	0	111.7
1157	G	22.5	Very low	24.2	Very low	74 Å²	74	152.7 Å²	152.7	76%	0.763	81%	0.814	S	S	*	*			trans	108.1	87.4	151.3	0	0	0	0	0	115.4
1158	K	26.3	Very low	24.2	Very low	203 Å²	203	154.5 Å²	154.5	88%	0.883	81%	0.814	S	S	*	*			trans	-140.3	105.8	143.8	-96.9	179.2	-174.2	173.9	0	109.9	L1160	K1158-L1160 PolarHBondContact O-N 3.29Å
1159	S	22.4	Very low	24.6	Very low	121 Å²	121	157.8 Å²	157.8	85%	0.846	82%	0.822	S	S	*	*			trans	-57.9	118.5	167.1	49.7	0	0	0	0	110.9
1160	L	28.3	Very low	24.8	Very low	174 Å²	174	157.9 Å²	157.9	91%	0.911	82%	0.818	S	S	*	*			trans	-110.5	123.9	167.3	-100.7	147.9	0	0	0	109.2	K1158	K1158-L1160 PolarHBondContact O-N 3.29Å
1161	K	24.9	Very low	25.1	Very low	201 Å²	201	160.3 Å²	160.3	87%	0.874	83%	0.826	S	S	*	*			trans	-66.1	152	-168.7	-73.9	175.8	173.8	177.3	0	112.9
1162	E	22.6	Very low	25.4	Very low	184 Å²	184	162.2 Å²	162.2	86%	0.86	83%	0.83	S	S	*	*			trans	-51.6	123.6	177.4	-58.7	169.9	140.2	0	0	113.3
1163	S	25.1	Very low	25.7	Very low	117 Å²	117	161.7 Å²	161.7	82%	0.818	82%	0.816	S	S	*	*			trans	-112.6	119.6	153.1	56.1	0	0	0	0	108.8	D1165	S1163-D1165 PolarHBondContact O-N 2.91Å
1164	N	24	Very low	26.3	Very low	123 Å²	123	160.3 Å²	160.3	66%	0.658	81%	0.809	S	S	*	*			trans	-72.8	100.5	-176.3	-82.9	-57.8	0	0	0	110.9
1165	D	27.8	Very low	27.3	Very low	165 Å²	165	160.3 Å²	160.3	88%	0.882	81%	0.809	S	S	*	*			trans	-120	73.9	156	-96.9	-35	0	0	0	110.5	S1163 R1167	S1163-D1165 PolarHBondContact O-N 2.91Å; D1165-R1167 PolarHBondContact O-N 2.89Å
1166	K	27.2	Very low	28.7	Very low	181 Å²	181	155.5 Å²	155.5	79%	0.787	78%	0.777	S	S	*	*			trans	-81.1	84.9	168.6	-72.6	178.3	-178.3	168	0	109.1
1167	R	25.1	Very low	30.4	Very low	237 Å²	237	155.3 Å²	155.3	89%	0.894	76%	0.76	S	S	*	*	S	Bend	trans	-157.4	120.3	152.1	-102	148.8	-161.5	-146.4	8.1	110.4	D1165	D1165-R1167 PolarHBondContact O-N 2.89Å
1168	Q	26.4	Very low	32.2	Very low	162 Å²	162	161.2 Å²	161.2	76%	0.757	76%	0.764	S	S	*	*			trans	76.3	54.7	167.6	-49.2	-171.6	15.2	0	0	118	H1170	Q1168-H1170 PolarHBondContact O-N 3.05Å
1169	K	29.5	Very low	34.5	Very low	215 Å²	215	152.8 Å²	152.8	94%	0.935	73%	0.727	S	S	*	*			trans	-65.6	80.5	149.1	-75.9	-176.7	179.5	177	0	109.1	K1171	K1169-K1171 PolarHBondContact O-N 2.64Å; K1169-K1171 VanDerWaalsContact O-N 3.09Å
1170	H	28.9	Very low	36.7	Very low	148 Å²	148	149 Å²	149	69%	0.685	70%	0.7	S	S	*	*			trans	-47.8	119.3	157.6	-94	-86.7	0	0	0	106.9	Q1168 Q1172	Q1168-H1170 PolarHBondContact O-N 3.05Å; H1170-Q1172 PolarHBondContact O-N 3.41Å
1171	K	28.7	Very low	38.8	Very low	205 Å²	205	141.8 Å²	141.8	89%	0.891	66%	0.663	S	S	*	*			trans	-53.7	84.7	175.3	-69.8	176.5	176	177.4	0	108.8	K1169 K1173	K1169-K1171 PolarHBondContact O-N 2.64Å; K1169-K1171 VanDerWaalsContact O-N 3.09Å; K1171-K1173 PolarHBondContact O-N 2.87Å
1172	Q	28.9	Very low	40.8	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	65%	0.646	S	S	*	*			trans	-59.9	110.7	168.6	-77	-174.1	6	0	0	104.9	H1170	H1170-Q1172 PolarHBondContact O-N 3.41Å
1173	K	31	Very low	42.9	Very low	137 Å²	137	128.8 Å²	128.8	60%	0.596	61%	0.612	S	S	*	*			trans	-55.5	140.3	171.1	-68.9	175	178.4	175.5	0	106.8	K1171 K1175	K1171-K1173 PolarHBondContact O-N 2.87Å; K1173-K1175 PolarHBondContact O-N 3.1Å
1174	P	34.7	Very low	44.8	Very low	96 Å²	96	127.3 Å²	127.3	62%	0.623	59%	0.593	S	S	*	*			trans	-56.9	110.8	179.7	23.3	-31	0	0	0	107.7	W1176	P1174-W1176 PolarHBondContact O-N 3.44Å
1175	K	41.8	Very low	46.9	Very low	186 Å²	186	125 Å²	125	81%	0.809	58%	0.58	S	S	*	*			trans	-57.3	119.5	170.6	-72.6	-179.8	175.7	-178.3	0	105.1	K1173 H1177	K1173-K1175 PolarHBondContact O-N 3.1Å; K1175-H1177 PolarHBondContact O-N 3.48Å
1176	W	54.6	Low	49.1	Very low	73 Å²	73	117.2 Å²	117.2	28%	0.277	54%	0.539	S	S	.	.			trans	-48.3	140.2	-176.3	-87.9	52.1	0	0	0	110.5	P1174 K1178 E1183 C1251 L1252	P1174-W1176 PolarHBondContact O-N 3.44Å; W1176-K1178 VanDerWaalsContact C-N 3.31Å; W1176-K1178 PolarHBondContact O-N 3.32Å; W1176-E1183 HydrophobicContact CD2-CB 4.28Å; W1176-E1183 HydrophobicContact CE3-CB 4.44Å; W1176-E1183 HydrophobicContact CH2-CB 4.25Å; W1176-E1183 HydrophobicContact CH2-CG 3.57Å; W1176-E1183 HydrophobicContact CZ2-CB 4.04Å; W1176-E1183 HydrophobicContact CZ2-CG 3.4Å; W1176-E1183 VanDerWaalsContact CZ2-CG 3.4Å; W1176-E1183 VanDerWaalsContact CZ2-OE1 3.27Å; W1176-E1183 WeakPolarHBondContact CZ2-OE1 3.41Å; W1176-E1183 VanDerWaalsContact CZ2-OE2 3.3Å; W1176-E1183 WeakPolarHBondContact CZ2-OE2 3Å; W1176-E1183 HydrophobicContact CZ3-CB 4.43Å; W1176-E1183 HydrophobicContact CZ3-CG 4.18Å; W1176-E1183 PolarHBondContact NE1-OE2 3.47Å; W1176-C1251 HydrophobicContact CH2-CB 4.18Å; W1176-C1251 HydrophobicContact CZ2-CB 3.68Å; W1176-C1251 WeakPolarHBondContact CZ2-SG 3.41Å; W1176-L1252 HydrophobicContact CH2-CD2 3.83Å; W1176-L1252 HydrophobicContact CZ3-CD2 3.64Å
1177	H	57.9	Low	51.3	Low	92 Å²	92	109 Å²	109	43%	0.426	50%	0.502	S	S	.	.	S	Bend	trans	-43	77	-170.2	-55.3	-51.3	0	0	0	114.7	P1040 K1175 W1179	P1040-H1177 HydrophobicContact CB-CB 4.21Å; P1040-H1177 WeakPolarHBondContact CB-O 3.27Å; P1040-H1177 WeakPolarHBondContact CG-O 3.49Å; K1175-H1177 PolarHBondContact O-N 3.48Å; H1177-W1179 PolarHBondContact O-N 2.81Å
1178	K	61	Low	53.5	Low	198 Å²	198	102.8 Å²	102.8	86%	0.861	49%	0.487	S	S	*	.	S	Bend	trans	46.3	22.5	172.4	-59.3	-175.5	176.2	-175.7	0	116.2	W1176	W1176-K1178 VanDerWaalsContact C-N 3.31Å; W1176-K1178 PolarHBondContact O-N 3.32Å
1179	W	73.6	Confident	55.8	Low	27 Å²	27	95.7 Å²	95.7	10%	0.102	45%	0.454	C	S	.	.			trans	-71.7	139.1	176	-82.6	80	0	0	0	108.8	P1040 I1043 I1092 F1112 A1114 H1177 V1181 L1186	P1040-W1179 HydrophobicContact CB-CG 4.49Å; P1040-W1179 VanDerWaalsContact CG-CD1 3.47Å; P1040-W1179 HydrophobicContact CG-CD2 3.89Å; P1040-W1179 HydrophobicContact CG-CG 3.75Å; P1040-W1179 HydrophobicContact CG-CZ2 4.37Å; I1043-W1179 HydrophobicContact CD1-CH2 4.24Å; I1043-W1179 HydrophobicContact CD1-CZ2 3.85Å; I1043-W1179 HydrophobicContact CG1-CH2 4.43Å; I1043-W1179 HydrophobicContact CG1-CZ2 3.86Å; I1092-W1179 HydrophobicContact CD1-CZ3 4.44Å; I1092-W1179 HydrophobicContact CG1-CZ3 4.18Å; F1112-W1179 HydrophobicContact CB-CH2 4.13Å; F1112-W1179 WeakPolarHBondContact O-CH2 3.49Å; A1114-W1179 HydrophobicContact CB-CD2 3.99Å; A1114-W1179 HydrophobicContact CB-CE3 3.55Å; A1114-W1179 HydrophobicContact CB-CH2 4.36Å; A1114-W1179 HydrophobicContact CB-CZ3 3.77Å; H1177-W1179 PolarHBondContact O-N 2.81Å; W1179-V1181 PolarHBondContact O-N 2.64Å; W1179-L1186 HydrophobicContact CD2-CD2 4.17Å; W1179-L1186 HydrophobicContact CE3-CD1 3.92Å; W1179-L1186 HydrophobicContact CE3-CD2 3.95Å; W1179-L1186 HydrophobicContact CZ3-CD1 3.75Å; W1179-L1186 HydrophobicContact CZ3-CD2 4.23Å
1180	P	69.3	Low	58.2	Low	42 Å²	42	85.6 Å²	85.6	27%	0.273	41%	0.41	S	S	.	.	S	Bend	trans	-70.4	-15.6	-174.4	26.5	-34.6	0	0	0	113.2	N1090 R1091 A1114 V1117	N1090-P1180 VanDerWaalsContact O-CG 3.31Å; N1090-P1180 WeakPolarHBondContact O-CG 3.35Å; R1091-P1180 HydrophobicContact CB-CG 4.34Å; A1114-P1180 HydrophobicContact CB-CG 3.86Å; V1117-P1180 HydrophobicContact CG2-CB 4.05Å
1181	V	71.3	Confident	60.4	Low	21 Å²	21	79.2 Å²	79.2	13%	0.127	38%	0.381	C	S	.	.	S	Bend	trans	-121.3	148.3	-177.4	-109.8	0	0	0	0	112.3	N1090 I1092 W1179 N1185	N1090-V1181 HydrophobicContact CB-CG1 4.2Å; N1090-V1181 HydrophobicContact CB-CG2 4.06Å; N1090-V1181 WeakPolarHBondContact OD1-CG1 3.48Å; I1092-V1181 HydrophobicContact CD1-CG2 3.72Å; I1092-V1181 HydrophobicContact CG1-CG2 4.4Å; W1179-V1181 PolarHBondContact O-N 2.64Å; V1181-N1185 HydrophobicContact CB-CB 4.38Å; V1181-N1185 HydrophobicContact CG1-CB 4.1Å
1182	P	68	Low	62.6	Low	82 Å²	82	71.4 Å²	71.4	53%	0.532	35%	0.352	S	S	.	.			trans	-57.9	149.3	170.9	-22.5	33.2	0	0	0	112.8	E1184 N1185 L1186	P1182-E1184 VanDerWaalsContact C-N 3.27Å; P1182-E1184 PolarHBondContact O-N 2.68Å; P1182-N1185 PolarHBondContact O-N 3.15Å; P1182-L1186 PolarHBondContact O-N 3.27Å
1183	E	65.9	Low	65	Low	30 Å²	30	63.5 Å²	63.5	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-47.2	-45.2	178.6	173.1	-179.3	177.2	0	0	113.2	W1176 N1185 L1186 W1187 C1251 F1260	W1176-E1183 HydrophobicContact CD2-CB 4.28Å; W1176-E1183 HydrophobicContact CE3-CB 4.44Å; W1176-E1183 HydrophobicContact CH2-CB 4.25Å; W1176-E1183 HydrophobicContact CH2-CG 3.57Å; W1176-E1183 HydrophobicContact CZ2-CB 4.04Å; W1176-E1183 HydrophobicContact CZ2-CG 3.4Å; W1176-E1183 VanDerWaalsContact CZ2-CG 3.4Å; W1176-E1183 VanDerWaalsContact CZ2-OE1 3.27Å; W1176-E1183 WeakPolarHBondContact CZ2-OE1 3.41Å; W1176-E1183 VanDerWaalsContact CZ2-OE2 3.3Å; W1176-E1183 WeakPolarHBondContact CZ2-OE2 3Å; W1176-E1183 HydrophobicContact CZ3-CB 4.43Å; W1176-E1183 HydrophobicContact CZ3-CG 4.18Å; W1176-E1183 PolarHBondContact NE1-OE2 3.47Å; E1183-N1185 PolarHBondContact O-N 3.46Å; E1183-L1186 PolarHBondContact O-N 2.9Å; E1183-W1187 VanDerWaalsContact O-CD1 3.28Å; E1183-W1187 PolarHBondContact O-N 3.47Å; E1183-W1187 VanDerWaalsContact O-N 3.13Å; E1183-C1251 WeakPolarHBondContact OE1-CB 3.48Å; E1183-F1260 HydrophobicContact CG-CE2 4.27Å; E1183-F1260 HydrophobicContact CG-CZ 4.39Å
1184	E	64.6	Low	67.3	Low	87 Å²	87	57 Å²	57	41%	0.407	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-41.6	-179.4	-63.4	177.5	-167.6	0	0	111.8	P1182 W1187 N1188 F1260	P1182-E1184 VanDerWaalsContact C-N 3.27Å; P1182-E1184 PolarHBondContact O-N 2.68Å; E1184-W1187 PolarHBondContact O-N 2.95Å; E1184-N1188 PolarHBondContact O-N 3.09Å; E1184-N1188 PolarHBondContact O-ND2 2.89Å; E1184-N1188 PolarHBondContact O-OD1 3.47Å; E1184-F1260 HydrophobicContact CG-CD1 4.47Å; E1184-F1260 HydrophobicContact CG-CD2 4.34Å; E1184-F1260 HydrophobicContact CG-CE1 4.07Å; E1184-F1260 HydrophobicContact CG-CE2 3.91Å; E1184-F1260 HydrophobicContact CG-CZ 3.76Å; E1184-F1260 WeakPolarHBondContact OE1-CD1 3.25Å; E1184-F1260 WeakPolarHBondContact OE1-CE1 3.38Å
1185	N	68.9	Low	69.3	Low	74 Å²	74	57.4 Å²	57.4	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-71.6	-38.1	-179.4	-70.1	0	0	0	0	111.9	V1181 P1182 E1183 W1187 N1188 L1189	V1181-N1185 HydrophobicContact CB-CB 4.38Å; V1181-N1185 HydrophobicContact CG1-CB 4.1Å; P1182-N1185 PolarHBondContact O-N 3.15Å; E1183-N1185 PolarHBondContact O-N 3.46Å; N1185-W1187 VanDerWaalsContact C-N 3.3Å; N1185-W1187 PolarHBondContact O-N 3.47Å; N1185-N1188 PolarHBondContact O-N 2.87Å; N1185-L1189 PolarHBondContact O-N 3.12Å
1186	L	73.6	Confident	70.9	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-43	175.2	-177	64.4	0	0	0	110.8	I1043 I1092 W1179 P1182 E1183 L1189 M1190	I1043-L1186 HydrophobicContact CD1-CD2 3.77Å; I1092-L1186 HydrophobicContact CD1-CD1 3.46Å; I1092-L1186 VanDerWaalsContact CD1-CD1 3.46Å; W1179-L1186 HydrophobicContact CD2-CD2 4.17Å; W1179-L1186 HydrophobicContact CE3-CD1 3.92Å; W1179-L1186 HydrophobicContact CE3-CD2 3.95Å; W1179-L1186 HydrophobicContact CZ3-CD1 3.75Å; W1179-L1186 HydrophobicContact CZ3-CD2 4.23Å; P1182-L1186 PolarHBondContact O-N 3.27Å; E1183-L1186 PolarHBondContact O-N 2.9Å; L1186-L1189 WeakPolarHBondContact O-CB 3.31Å; L1186-L1189 PolarHBondContact O-N 2.98Å; L1186-L1189 VanDerWaalsContact O-N 3.16Å; L1186-M1190 HydrophobicContact CD1-CG 4.44Å; L1186-M1190 HydrophobicContact CD1-SD 3.98Å; L1186-M1190 HydrophobicContact CD2-SD 4.25Å; L1186-M1190 HydrophobicContact CG-SD 3.69Å; L1186-M1190 VanDerWaalsContact O-CG 3.3Å; L1186-M1190 WeakPolarHBondContact O-CG 3.34Å; L1186-M1190 PolarHBondContact O-N 3.4Å
1187	W	73.3	Confident	72.2	Confident	8 Å²	8	49.8 Å²	49.8	3%	0.03	25%	0.249	C	C	.	.	H	α-helix	trans	-69.6	-36.9	176.3	-85.2	116	0	0	0	114	F1045 E1183 E1184 N1185 L1189 M1190 L1191 W1227 C1251 A1254 P1255 P1256	F1045-W1187 AromaticContact CZ-CH2 3.89Å; F1045-W1187 HydrophobicContact CZ-CH2 3.89Å; F1045-W1187 HydrophobicContact CZ-CZ3 4.33Å; E1183-W1187 VanDerWaalsContact O-CD1 3.28Å; E1183-W1187 PolarHBondContact O-N 3.47Å; E1183-W1187 VanDerWaalsContact O-N 3.13Å; E1184-W1187 PolarHBondContact O-N 2.95Å; N1185-W1187 VanDerWaalsContact C-N 3.3Å; N1185-W1187 PolarHBondContact O-N 3.47Å; W1187-L1189 PolarHBondContact O-N 2.91Å; W1187-L1189 VanDerWaalsContact O-N 3.16Å; W1187-M1190 HydrophobicContact CE3-CB 4.43Å; W1187-M1190 PolarHBondContact O-N 2.76Å; W1187-L1191 HydrophobicContact CE3-CB 4.35Å; W1187-L1191 WeakPolarHBondContact O-CB 3.48Å; W1187-L1191 PolarHBondContact O-N 2.9Å; W1187-W1227 AromaticContact CH2-CH2 3.74Å; W1187-W1227 HydrophobicContact CH2-CH2 3.74Å; W1187-W1227 AromaticContact CH2-CZ3 3.65Å; W1187-W1227 HydrophobicContact CH2-CZ3 3.65Å; W1187-W1227 AromaticContact CZ3-CH2 3.7Å; W1187-W1227 HydrophobicContact CZ3-CH2 3.7Å; W1187-W1227 HydrophobicContact CZ3-CZ3 4.04Å; W1187-C1251 VanDerWaalsContact CZ2-O 3.32Å; W1187-C1251 WeakPolarHBondContact CZ2-O 3.39Å; W1187-C1251 PolarHBondContact NE1-O 3.2Å; W1187-A1254 WeakPolarHBondContact CZ2-O 3.41Å; W1187-P1255 HydrophobicContact CE3-CB 4.41Å; W1187-P1255 HydrophobicContact CZ3-CB 4.48Å; W1187-P1256 VanDerWaalsContact CB-CD 3.48Å; W1187-P1256 HydrophobicContact CB-CG 3.47Å; W1187-P1256 VanDerWaalsContact CB-CG 3.47Å; W1187-P1256 VanDerWaalsContact CD1-CD 3.46Å; W1187-P1256 HydrophobicContact CG-CG 3.68Å
1188	N	71.4	Confident	73.2	Confident	106 Å²	106	47.5 Å²	47.5	57%	0.567	24%	0.24	S	C	*	.	H	α-helix	trans	-58.7	-24.8	171.6	-69.5	-19.9	0	0	0	111.9	E1184 N1185 P1192	E1184-N1188 PolarHBondContact O-N 3.09Å; E1184-N1188 PolarHBondContact O-ND2 2.89Å; E1184-N1188 PolarHBondContact O-OD1 3.47Å; N1185-N1188 PolarHBondContact O-N 2.87Å; N1188-P1192 VanDerWaalsContact O-CD 3.26Å; N1188-P1192 WeakPolarHBondContact O-CD 3.4Å; N1188-P1192 WeakPolarHBondContact O-CG 3.18Å
1189	L	74.9	Confident	73.8	Confident	14 Å²	14	40.7 Å²	40.7	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-82.5	-48.9	175	-146.9	85.8	0	0	0	112.7	F1073 N1090 I1092 N1185 L1186 W1187 I1193	F1073-L1189 HydrophobicContact CE1-CD2 4.47Å; F1073-L1189 HydrophobicContact CE2-CD1 4.21Å; F1073-L1189 HydrophobicContact CE2-CD2 3.37Å; F1073-L1189 HydrophobicContact CE2-CG 3.63Å; F1073-L1189 HydrophobicContact CZ-CD2 3.27Å; F1073-L1189 HydrophobicContact CZ-CG 4.07Å; N1090-L1189 WeakPolarHBondContact ND2-CD1 3.07Å; I1092-L1189 HydrophobicContact CD1-CD2 3.72Å; N1185-L1189 PolarHBondContact O-N 3.12Å; L1186-L1189 WeakPolarHBondContact O-CB 3.31Å; L1186-L1189 PolarHBondContact O-N 2.98Å; L1186-L1189 VanDerWaalsContact O-N 3.16Å; W1187-L1189 PolarHBondContact O-N 2.91Å; W1187-L1189 VanDerWaalsContact O-N 3.16Å; L1189-I1193 WeakPolarHBondContact O-CD1 3.41Å
1190	M	79.6	Confident	74	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-80.1	-37.7	-171.4	-61.4	168.7	87	0	0	113.2	I1043 F1045 F1112 L1186 W1187 I1193 L1194	I1043-M1190 HydrophobicContact CB-CE 3.98Å; I1043-M1190 HydrophobicContact CD1-CE 4.26Å; I1043-M1190 HydrophobicContact CD1-SD 4.42Å; I1043-M1190 HydrophobicContact CG2-CE 3.62Å; F1045-M1190 HydrophobicContact CD2-CE 4.1Å; F1045-M1190 HydrophobicContact CE2-CE 3.44Å; F1045-M1190 VanDerWaalsContact CE2-CE 3.44Å; F1045-M1190 HydrophobicContact CZ-CE 4.42Å; F1112-M1190 HydrophobicContact CB-CE 4.13Å; F1112-M1190 HydrophobicContact CD1-CE 4.11Å; F1112-M1190 HydrophobicContact CD1-CG 3.92Å; F1112-M1190 HydrophobicContact CD2-CE 3.3Å; F1112-M1190 HydrophobicContact CE1-CB 4.4Å; F1112-M1190 HydrophobicContact CE1-CE 4.35Å; F1112-M1190 HydrophobicContact CE1-CG 3.66Å; F1112-M1190 HydrophobicContact CE2-CE 3.59Å; F1112-M1190 HydrophobicContact CE2-CG 4.32Å; F1112-M1190 HydrophobicContact CG-CE 3.59Å; F1112-M1190 HydrophobicContact CG-CG 4.37Å; F1112-M1190 HydrophobicContact CZ-CB 4.23Å; F1112-M1190 HydrophobicContact CZ-CE 4.12Å; F1112-M1190 HydrophobicContact CZ-CG 3.87Å; L1186-M1190 HydrophobicContact CD1-CG 4.44Å; L1186-M1190 HydrophobicContact CD1-SD 3.98Å; L1186-M1190 HydrophobicContact CD2-SD 4.25Å; L1186-M1190 HydrophobicContact CG-SD 3.69Å; L1186-M1190 VanDerWaalsContact O-CG 3.3Å; L1186-M1190 WeakPolarHBondContact O-CG 3.34Å; L1186-M1190 PolarHBondContact O-N 3.4Å; W1187-M1190 HydrophobicContact CE3-CB 4.43Å; W1187-M1190 PolarHBondContact O-N 2.76Å; M1190-I1193 PolarHBondContact O-N 3.03Å; M1190-L1194 HydrophobicContact CB-CD1 4.41Å; M1190-L1194 WeakPolarHBondContact O-CD1 3.49Å; M1190-L1194 VanDerWaalsContact O-CG 3.28Å; M1190-L1194 WeakPolarHBondContact O-CG 3.47Å; M1190-L1194 PolarHBondContact O-N 3.26Å; M1190-L1194 VanDerWaalsContact O-N 3.12Å
1191	L	75.5	Confident	74.5	Confident	14 Å²	14	38.2 Å²	38.2	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-43.9	-171.4	-173.7	66.3	0	0	0	113.2	W1187 I1193 L1194 K1195 W1227 P1255 E1257	W1187-L1191 HydrophobicContact CE3-CB 4.35Å; W1187-L1191 WeakPolarHBondContact O-CB 3.48Å; W1187-L1191 PolarHBondContact O-N 2.9Å; L1191-I1193 VanDerWaalsContact C-N 3.33Å; L1191-I1193 PolarHBondContact O-N 3.15Å; L1191-L1194 PolarHBondContact O-N 3.43Å; L1191-K1195 HydrophobicContact CD1-CG 4.43Å; L1191-K1195 HydrophobicContact CG-CD 4.14Å; L1191-K1195 HydrophobicContact CG-CG 4.41Å; L1191-K1195 WeakPolarHBondContact O-CB 3.43Å; L1191-K1195 WeakPolarHBondContact O-CG 3.3Å; L1191-K1195 PolarHBondContact O-N 3.06Å; L1191-W1227 HydrophobicContact CD1-CH2 4.39Å; L1191-W1227 HydrophobicContact CD1-CZ2 4.36Å; L1191-P1255 HydrophobicContact CD1-CB 4.14Å; L1191-P1255 HydrophobicContact CD1-CG 4.31Å; L1191-P1255 HydrophobicContact CD2-CB 4.24Å; L1191-E1257 HydrophobicContact CD2-CG 4.49Å
1192	P	75.2	Confident	74.4	Confident	42 Å²	42	44.3 Å²	44.3	27%	0.273	23%	0.234	S	C	.	.	H	α-helix	trans	-61.7	-40.6	176.6	-25.8	37.7	0	0	0	112.9	F1071 N1188 L1194 K1195 E1196	F1071-P1192 HydrophobicContact CD1-CB 4.26Å; F1071-P1192 HydrophobicContact CE1-CB 3.25Å; F1071-P1192 HydrophobicContact CE1-CG 3.91Å; F1071-P1192 HydrophobicContact CZ-CB 3.48Å; F1071-P1192 VanDerWaalsContact CZ-CB 3.48Å; N1188-P1192 VanDerWaalsContact O-CD 3.26Å; N1188-P1192 WeakPolarHBondContact O-CD 3.4Å; N1188-P1192 WeakPolarHBondContact O-CG 3.18Å; P1192-L1194 VanDerWaalsContact C-N 3.34Å; P1192-L1194 PolarHBondContact O-N 2.96Å; P1192-K1195 PolarHBondContact O-N 3.36Å; P1192-E1196 PolarHBondContact O-N 3.23Å
1193	I	78	Confident	74.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-48.8	177.1	-66.9	169.5	0	0	0	110.3	W1067 F1071 F1073 L1094 F1110 F1112 L1189 M1190 L1191 E1196 F1197	W1067-I1193 HydrophobicContact CH2-CG2 3.38Å; W1067-I1193 HydrophobicContact CZ3-CB 4.15Å; W1067-I1193 HydrophobicContact CZ3-CD1 3.91Å; W1067-I1193 HydrophobicContact CZ3-CG1 3.76Å; W1067-I1193 HydrophobicContact CZ3-CG2 3.39Å; F1071-I1193 HydrophobicContact CD2-CG1 3.95Å; F1071-I1193 HydrophobicContact CE2-CG1 4.08Å; F1071-I1193 HydrophobicContact CG-CG1 4.3Å; F1073-I1193 HydrophobicContact CE2-CD1 4.09Å; L1094-I1193 HydrophobicContact CD2-CD1 4.19Å; F1110-I1193 HydrophobicContact CD1-CG2 4.36Å; F1110-I1193 HydrophobicContact CE1-CG2 4.01Å; F1112-I1193 HydrophobicContact CE1-CD1 4.47Å; L1189-I1193 WeakPolarHBondContact O-CD1 3.41Å; M1190-I1193 PolarHBondContact O-N 3.03Å; L1191-I1193 VanDerWaalsContact C-N 3.33Å; L1191-I1193 PolarHBondContact O-N 3.15Å; I1193-E1196 PolarHBondContact O-N 3.33Å; I1193-F1197 PolarHBondContact O-N 2.87Å
1194	L	79.7	Confident	74.7	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-68	-38.8	-179.5	-63.6	164	0	0	0	111.6	F1045 Y1047 F1110 M1190 L1191 P1192 F1197 D1198	F1045-L1194 HydrophobicContact CB-CD2 4.32Å; F1045-L1194 HydrophobicContact CD2-CD1 3.73Å; F1045-L1194 HydrophobicContact CD2-CD2 4.15Å; F1045-L1194 HydrophobicContact CE2-CD1 3.64Å; F1045-L1194 HydrophobicContact CG-CD1 4.39Å; F1045-L1194 HydrophobicContact CG-CD2 4.39Å; F1045-L1194 HydrophobicContact CZ-CD1 4.28Å; Y1047-L1194 HydrophobicContact CE2-CD2 4.22Å; F1110-L1194 HydrophobicContact CD2-CD2 4.38Å; F1110-L1194 HydrophobicContact CG-CD2 4.48Å; M1190-L1194 HydrophobicContact CB-CD1 4.41Å; M1190-L1194 WeakPolarHBondContact O-CD1 3.49Å; M1190-L1194 VanDerWaalsContact O-CG 3.28Å; M1190-L1194 WeakPolarHBondContact O-CG 3.47Å; M1190-L1194 PolarHBondContact O-N 3.26Å; M1190-L1194 VanDerWaalsContact O-N 3.12Å; L1191-L1194 PolarHBondContact O-N 3.43Å; P1192-L1194 VanDerWaalsContact C-N 3.34Å; P1192-L1194 PolarHBondContact O-N 2.96Å; L1194-F1197 PolarHBondContact O-N 3.28Å; L1194-D1198 WeakPolarHBondContact O-CB 3.33Å; L1194-D1198 PolarHBondContact O-N 3.07Å
1195	K	76.6	Confident	74.2	Confident	104 Å²	104	49.3 Å²	49.3	45%	0.452	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-39.7	176.5	-79.9	179.3	177.4	171.4	0	112	L1191 P1192 D1198 S1199 E1257	L1191-K1195 HydrophobicContact CD1-CG 4.43Å; L1191-K1195 HydrophobicContact CG-CD 4.14Å; L1191-K1195 HydrophobicContact CG-CG 4.41Å; L1191-K1195 WeakPolarHBondContact O-CB 3.43Å; L1191-K1195 WeakPolarHBondContact O-CG 3.3Å; L1191-K1195 PolarHBondContact O-N 3.06Å; P1192-K1195 PolarHBondContact O-N 3.36Å; K1195-D1198 PolarHBondContact O-N 3.36Å; K1195-S1199 PolarHBondContact O-N 3.26Å; K1195-E1257 IonicContact NZ-OE1 2.78Å; K1195-E1257 IonicContact NZ-OE2 3.11Å; K1195-E1257 PolarHBondContact NZ-OE2 3.45Å
1196	E	76.5	Confident	74.1	Confident	99 Å²	99	49.6 Å²	49.6	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-69.2	-39.1	175.2	-81.4	-67.1	176.9	0	0	111.9	L1065 P1192 I1193 D1198 S1199 I1200	L1065-E1196 HydrophobicContact CD2-CB 3.38Å; P1192-E1196 PolarHBondContact O-N 3.23Å; I1193-E1196 PolarHBondContact O-N 3.33Å; E1196-D1198 VanDerWaalsContact C-N 3.33Å; E1196-D1198 PolarHBondContact O-N 2.77Å; E1196-S1199 WeakPolarHBondContact O-CB 3.11Å; E1196-S1199 PolarHBondContact O-N 3.07Å; E1196-S1199 VanDerWaalsContact O-N 3.13Å; E1196-S1199 PolarHBondContact O-OG 3.28Å; E1196-S1199 PolarHBondContact OE2-OG 3.4Å; E1196-S1199 VanDerWaalsContact OE2-OG 3.05Å; E1196-I1200 WeakPolarHBondContact O-CG1 3.46Å; E1196-I1200 PolarHBondContact O-N 3.33Å; E1196-I1200 VanDerWaalsContact O-N 3.07Å
1197	F	82	Confident	73.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-40.5	174.5	-171.6	-116.1	0	0	0	111.4	Y1047 A1061 L1065 F1096 I1108 F1110 I1193 L1194 S1199 I1200 L1201	Y1047-F1197 HydrophobicContact CD1-CD1 4.23Å; Y1047-F1197 AromaticContact CD1-CE1 3.94Å; Y1047-F1197 HydrophobicContact CD1-CE1 3.94Å; Y1047-F1197 AromaticContact CD2-CD1 3.92Å; Y1047-F1197 HydrophobicContact CD2-CD1 3.92Å; Y1047-F1197 AromaticContact CD2-CE1 3.65Å; Y1047-F1197 HydrophobicContact CD2-CE1 3.65Å; Y1047-F1197 AromaticContact CE1-CD1 3.95Å; Y1047-F1197 HydrophobicContact CE1-CD1 3.95Å; Y1047-F1197 HydrophobicContact CE1-CE1 4.15Å; Y1047-F1197 AromaticContact CE2-CD1 3.65Å; Y1047-F1197 HydrophobicContact CE2-CD1 3.65Å; Y1047-F1197 AromaticContact CE2-CE1 3.91Å; Y1047-F1197 HydrophobicContact CE2-CE1 3.91Å; Y1047-F1197 HydrophobicContact CG-CD1 4.19Å; Y1047-F1197 AromaticContact CG-CE1 3.66Å; Y1047-F1197 HydrophobicContact CG-CE1 3.66Å; Y1047-F1197 AromaticContact CZ-CD1 3.65Å; A1061-F1197 HydrophobicContact CB-CD2 3.87Å; A1061-F1197 HydrophobicContact CB-CE2 3.5Å; L1065-F1197 HydrophobicContact CD1-CB 4.25Å; L1065-F1197 HydrophobicContact CD1-CD2 3.96Å; L1065-F1197 HydrophobicContact CD2-CB 4.42Å; F1096-F1197 HydrophobicContact CE2-CE2 4.31Å; F1096-F1197 HydrophobicContact CE2-CZ 4.45Å; F1096-F1197 HydrophobicContact CZ-CE2 4.01Å; F1096-F1197 HydrophobicContact CZ-CZ 4.42Å; I1108-F1197 HydrophobicContact CB-CZ 4.44Å; I1108-F1197 HydrophobicContact CD1-CE2 4.46Å; I1108-F1197 HydrophobicContact CD1-CZ 3.76Å; I1108-F1197 HydrophobicContact CG2-CE1 4.26Å; I1108-F1197 HydrophobicContact CG2-CZ 3.93Å; F1110-F1197 AromaticContact CE2-CD1 3.72Å; F1110-F1197 HydrophobicContact CE2-CD1 3.72Å; F1110-F1197 AromaticContact CE2-CE1 3.93Å; F1110-F1197 HydrophobicContact CE2-CE1 3.93Å; F1110-F1197 HydrophobicContact CE2-CG 4.15Å; F1110-F1197 HydrophobicContact CZ-CB 4.08Å; F1110-F1197 AromaticContact CZ-CD1 3.84Å; F1110-F1197 HydrophobicContact CZ-CD1 3.84Å; F1110-F1197 HydrophobicContact CZ-CD2 4.2Å; F1110-F1197 HydrophobicContact CZ-CE1 4.3Å; F1110-F1197 AromaticContact CZ-CG 3.77Å; F1110-F1197 HydrophobicContact CZ-CG 3.77Å; I1193-F1197 PolarHBondContact O-N 2.87Å; L1194-F1197 PolarHBondContact O-N 3.28Å; F1197-S1199 PolarHBondContact O-N 3.47Å; F1197-I1200 WeakPolarHBondContact O-CB 3.5Å; F1197-I1200 PolarHBondContact O-N 3.17Å; F1197-I1200 VanDerWaalsContact O-N 3.12Å; F1197-L1201 HydrophobicContact CD1-CD1 3.9Å; F1197-L1201 HydrophobicContact CD1-CG 4.23Å; F1197-L1201 HydrophobicContact CE1-CD1 3.66Å; F1197-L1201 HydrophobicContact CE1-CD2 4.1Å; F1197-L1201 HydrophobicContact CE1-CG 4Å; F1197-L1201 HydrophobicContact CE2-CD2 4.4Å; F1197-L1201 HydrophobicContact CZ-CD1 4.32Å; F1197-L1201 HydrophobicContact CZ-CD2 3.9Å; F1197-L1201 HydrophobicContact CZ-CG 4.22Å; F1197-L1201 WeakPolarHBondContact O-CG 3.38Å; F1197-L1201 PolarHBondContact O-N 3.1Å
1198	D	78.1	Confident	73.5	Confident	44 Å²	44	54.3 Å²	54.3	24%	0.235	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-37.1	172.7	-66.3	-19.4	0	0	0	111.3	Y1047 L1194 K1195 E1196 L1201 L1202 R1211	Y1047-D1198 VanDerWaalsContact CE1-OD1 3.23Å; Y1047-D1198 WeakPolarHBondContact CE1-OD1 3.45Å; Y1047-D1198 PolarHBondContact OH-OD1 3.4Å; L1194-D1198 WeakPolarHBondContact O-CB 3.33Å; L1194-D1198 PolarHBondContact O-N 3.07Å; K1195-D1198 PolarHBondContact O-N 3.36Å; E1196-D1198 VanDerWaalsContact C-N 3.33Å; E1196-D1198 PolarHBondContact O-N 2.77Å; D1198-L1201 PolarHBondContact O-N 3.02Å; D1198-L1202 WeakPolarHBondContact O-CB 3.36Å; D1198-L1202 VanDerWaalsContact O-CG 3.25Å; D1198-L1202 WeakPolarHBondContact O-CG 3.22Å; D1198-L1202 PolarHBondContact O-N 2.94Å; D1198-R1211 IonicContact OD1-NH1 2.69Å; D1198-R1211 IonicContact OD2-NH1 2.83Å; D1198-R1211 PolarHBondContact OD2-NH1 2.8Å
1199	S	73.9	Confident	73.7	Confident	56 Å²	56	51.6 Å²	51.6	39%	0.392	30%	0.298	S	S	.	.	H	α-helix	trans	-63.3	-40.4	175.9	97.1	0	0	0	0	111.9	K1195 E1196 F1197 A1203	K1195-S1199 PolarHBondContact O-N 3.26Å; E1196-S1199 WeakPolarHBondContact O-CB 3.11Å; E1196-S1199 PolarHBondContact O-N 3.07Å; E1196-S1199 VanDerWaalsContact O-N 3.13Å; E1196-S1199 PolarHBondContact O-OG 3.28Å; E1196-S1199 PolarHBondContact OE2-OG 3.4Å; E1196-S1199 VanDerWaalsContact OE2-OG 3.05Å; F1197-S1199 PolarHBondContact O-N 3.47Å; S1199-A1203 PolarHBondContact O-N 3.47Å
1200	I	77.7	Confident	73.5	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-45.8	175.8	-64.1	169.9	0	0	0	110.2	L1057 R1064 L1065 E1196 F1197 L1202 A1203 Y1204	L1057-I1200 HydrophobicContact CD1-CG2 3.88Å; R1064-I1200 HydrophobicContact CB-CD1 3.81Å; R1064-I1200 HydrophobicContact CB-CG1 4.48Å; L1065-I1200 HydrophobicContact CD1-CD1 4.42Å; L1065-I1200 HydrophobicContact CD2-CD1 3.99Å; L1065-I1200 HydrophobicContact CG-CD1 3.77Å; E1196-I1200 WeakPolarHBondContact O-CG1 3.46Å; E1196-I1200 PolarHBondContact O-N 3.33Å; E1196-I1200 VanDerWaalsContact O-N 3.07Å; F1197-I1200 WeakPolarHBondContact O-CB 3.5Å; F1197-I1200 PolarHBondContact O-N 3.17Å; F1197-I1200 VanDerWaalsContact O-N 3.12Å; I1200-L1202 PolarHBondContact O-N 3.49Å; I1200-A1203 WeakPolarHBondContact O-CB 3.32Å; I1200-A1203 PolarHBondContact O-N 3.45Å; I1200-Y1204 HydrophobicContact CG2-CE2 4.46Å; I1200-Y1204 WeakPolarHBondContact O-CD2 3.46Å
1201	L	78.8	Confident	73.3	Confident	10 Å²	10	59 Å²	59	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-43.5	177.9	-64.6	-179.6	0	0	0	111.9	Y1047 F1049 L1057 F1197 D1198 A1203 Y1204 L1207	Y1047-L1201 HydrophobicContact CD1-CD1 3.43Å; Y1047-L1201 VanDerWaalsContact CD1-CD1 3.43Å; Y1047-L1201 HydrophobicContact CE1-CD1 3.59Å; Y1047-L1201 HydrophobicContact CG-CD1 4.33Å; F1049-L1201 HydrophobicContact CE1-CD2 3.8Å; F1049-L1201 HydrophobicContact CZ-CD2 3.79Å; L1057-L1201 HydrophobicContact CD1-CD2 4.12Å; L1057-L1201 HydrophobicContact CD2-CD2 3.68Å; L1057-L1201 HydrophobicContact CG-CD2 4.39Å; F1197-L1201 HydrophobicContact CD1-CD1 3.9Å; F1197-L1201 HydrophobicContact CD1-CG 4.23Å; F1197-L1201 HydrophobicContact CE1-CD1 3.66Å; F1197-L1201 HydrophobicContact CE1-CD2 4.1Å; F1197-L1201 HydrophobicContact CE1-CG 4Å; F1197-L1201 HydrophobicContact CE2-CD2 4.4Å; F1197-L1201 HydrophobicContact CZ-CD1 4.32Å; F1197-L1201 HydrophobicContact CZ-CD2 3.9Å; F1197-L1201 HydrophobicContact CZ-CG 4.22Å; F1197-L1201 WeakPolarHBondContact O-CG 3.38Å; F1197-L1201 PolarHBondContact O-N 3.1Å; D1198-L1201 PolarHBondContact O-N 3.02Å; L1201-A1203 PolarHBondContact O-N 3.26Å; L1201-Y1204 PolarHBondContact O-N 2.92Å; L1201-L1207 HydrophobicContact CB-CD2 4.47Å; L1201-L1207 HydrophobicContact CD2-CD2 3.73Å
1202	L	71	Confident	73.6	Confident	149 Å²	149	59.1 Å²	59.1	78%	0.78	33%	0.33	S	S	*	.	H	α-helix	trans	-64.6	-21.5	178.4	-74.4	170	0	0	0	113.5	D1198 I1200 Y1204	D1198-L1202 WeakPolarHBondContact O-CB 3.36Å; D1198-L1202 VanDerWaalsContact O-CG 3.25Å; D1198-L1202 WeakPolarHBondContact O-CG 3.22Å; D1198-L1202 PolarHBondContact O-N 2.94Å; I1200-L1202 PolarHBondContact O-N 3.49Å; L1202-Y1204 VanDerWaalsContact C-N 3.3Å
1203	A	71.3	Confident	74	Confident	67 Å²	67	57.6 Å²	57.6	55%	0.554	32%	0.319	S	S	*	.	H	α-helix	trans	-73	-22.9	174.6	0	0	0	0	0	112.7	S1199 I1200 L1201 K1205	S1199-A1203 PolarHBondContact O-N 3.47Å; I1200-A1203 WeakPolarHBondContact O-CB 3.32Å; I1200-A1203 PolarHBondContact O-N 3.45Å; L1201-A1203 PolarHBondContact O-N 3.26Å; A1203-K1205 PolarHBondContact O-N 2.85Å
1204	Y	67.3	Low	74.3	Confident	53 Å²	53	58.4 Å²	58.4	21%	0.208	32%	0.323	C	S	.	.	S	Bend	trans	-87.4	100.1	178.1	-80.3	-92.2	0	0	0	111.2	P1054 L1057 K1060 I1200 L1201 L1202 G1206 L1207	P1054-Y1204 HydrophobicContact CB-CE1 4.32Å; P1054-Y1204 HydrophobicContact CG-CD1 4.31Å; P1054-Y1204 HydrophobicContact CG-CE1 4.47Å; L1057-Y1204 HydrophobicContact CD1-CD2 3.67Å; L1057-Y1204 HydrophobicContact CD1-CE2 3.36Å; K1060-Y1204 VanDerWaalsContact CD-OH 3.29Å; K1060-Y1204 WeakPolarHBondContact CD-OH 3.43Å; K1060-Y1204 PolarHBondContact NZ-OH 3.46Å; K1060-Y1204 VanDerWaalsContact NZ-OH 3.09Å; I1200-Y1204 HydrophobicContact CG2-CE2 4.46Å; I1200-Y1204 WeakPolarHBondContact O-CD2 3.46Å; L1201-Y1204 PolarHBondContact O-N 2.92Å; L1202-Y1204 VanDerWaalsContact C-N 3.3Å; Y1204-G1206 PolarHBondContact O-N 2.94Å; Y1204-L1207 HydrophobicContact CG-CD2 4.4Å; Y1204-L1207 WeakPolarHBondContact O-CB 2.88Å; Y1204-L1207 PolarHBondContact O-N 2.69Å
1205	K	55.4	Low	74.4	Confident	184 Å²	184	58.4 Å²	58.4	80%	0.8	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	129.6	175.5	-79.9	-178.5	166.7	-169.7	0	111.4	A1203 L1207	A1203-K1205 PolarHBondContact O-N 2.85Å; K1205-L1207 VanDerWaalsContact C-N 3.31Å
1206	G	66.1	Low	74.4	Confident	81 Å²	81	54.6 Å²	54.6	84%	0.835	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-4.8	178.2	0	0	0	0	0	114.5	Y1204 C1208	Y1204-G1206 PolarHBondContact O-N 2.94Å; G1206-C1208 PolarHBondContact O-N 3.13Å; G1206-C1208 VanDerWaalsContact O-N 3.14Å
1207	L	69.3	Low	74.6	Confident	35 Å²	35	55.8 Å²	55.8	18%	0.183	31%	0.312	C	S	.	.			trans	-70.1	108.8	177.7	-173	67.3	0	0	0	110.6	F1049 P1054 L1057 L1201 Y1204 K1205 C1209	F1049-L1207 HydrophobicContact CD1-CD1 3.81Å; F1049-L1207 HydrophobicContact CD1-CD2 4.39Å; F1049-L1207 HydrophobicContact CD1-CG 4.11Å; F1049-L1207 HydrophobicContact CE1-CD1 4.15Å; F1049-L1207 HydrophobicContact CE1-CD2 3.9Å; F1049-L1207 HydrophobicContact CE1-CG 4.1Å; P1054-L1207 VanDerWaalsContact CD-CD1 3.43Å; P1054-L1207 HydrophobicContact CG-CD1 3.7Å; L1057-L1207 HydrophobicContact CD2-CD1 4.41Å; L1057-L1207 HydrophobicContact CD2-CD2 3.6Å; L1201-L1207 HydrophobicContact CB-CD2 4.47Å; L1201-L1207 HydrophobicContact CD2-CD2 3.73Å; Y1204-L1207 HydrophobicContact CG-CD2 4.4Å; Y1204-L1207 WeakPolarHBondContact O-CB 2.88Å; Y1204-L1207 PolarHBondContact O-N 2.69Å; K1205-L1207 VanDerWaalsContact C-N 3.31Å; L1207-C1209 PolarHBondContact O-N 3.39Å
1208	C	65.3	Low	74.7	Confident	73 Å²	73	57.9 Å²	57.9	49%	0.493	33%	0.326	S	S	.	.			trans	-87.9	99	174.4	-91	0	0	0	0	110.1	Y1051 G1206	Y1051-C1208 HydrophobicContact CD2-CB 3.57Å; Y1051-C1208 HydrophobicContact CE2-CB 3.96Å; G1206-C1208 PolarHBondContact O-N 3.13Å; G1206-C1208 VanDerWaalsContact O-N 3.14Å
1209	C	75.1	Confident	74.8	Confident	50 Å²	50	60.5 Å²	60.5	34%	0.338	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140	175.2	65.2	0	0	0	0	111.8	R1048 F1049 L1207	R1048-C1209 CarbonylContact O-C 3.57Å; R1048-C1209 VanDerWaalsContact O-CA 3.27Å; R1048-C1209 WeakPolarHBondContact O-CA 3.32Å; F1049-C1209 HydrophobicContact CD1-CB 3.67Å; F1049-C1209 HydrophobicContact CE1-CB 3.44Å; F1049-C1209 VanDerWaalsContact CE1-CB 3.44Å; F1049-C1209 HydrophobicContact CZ-CB 4.21Å; L1207-C1209 PolarHBondContact O-N 3.39Å
1210	K	71.4	Confident	75.3	Confident	139 Å²	139	63 Å²	63	60%	0.604	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.1	169.1	-72.8	-178.2	-179.3	174.1	0	109.3	R1048	R1048-K1210 PolarHBondContact N-O 2.84Å; R1048-K1210 PolarHBondContact O-N 2.91Å
1211	R	75.2	Confident	75.4	Confident	31 Å²	31	65.5 Å²	65.5	12%	0.117	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.5	174.1	-170.6	174.7	179.7	161	2.1	109.7	V1046 Y1047 D1198 A1224 G1225 W1227	V1046-R1211 CarbonylContact O-C 3.44Å; Y1047-R1211 HydrophobicContact CD1-CB 4.38Å; Y1047-R1211 HydrophobicContact CD1-CG 4.4Å; Y1047-R1211 HydrophobicContact CE1-CB 4.29Å; Y1047-R1211 HydrophobicContact CE1-CG 4.05Å; Y1047-R1211 VanDerWaalsContact OH-CZ 3.25Å; Y1047-R1211 PolarHBondContact OH-NH1 3.29Å; D1198-R1211 IonicContact OD1-NH1 2.69Å; D1198-R1211 IonicContact OD2-NH1 2.83Å; D1198-R1211 PolarHBondContact OD2-NH1 2.8Å; R1211-A1224 CarbonylContact O-C 3.6Å; R1211-G1225 VanDerWaalsContact O-CA 3.31Å; R1211-G1225 WeakPolarHBondContact O-CA 2.98Å; R1211-G1225 PolarHBondContact O-N 3.43Å; R1211-W1227 VanDerWaalsContact CZ-CZ2 3.41Å
1212	V	80.7	Confident	75.1	Confident	18 Å²	18	66.1 Å²	66.1	11%	0.109	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156.1	-177	-161.1	0	0	0	0	109.6	V1046 L1221 L1223	V1046-V1212 PolarHBondContact N-O 3.27Å; V1046-V1212 PolarHBondContact O-N 3.38Å; V1046-V1212 VanDerWaalsContact O-O 3.07Å; V1212-L1221 HydrophobicContact CB-CD2 4.24Å; V1212-L1221 HydrophobicContact CG1-CB 4.01Å; V1212-L1221 HydrophobicContact CG1-CD2 4.09Å; V1212-L1223 CarbonylContact C-O 3.52Å; V1212-L1223 VanDerWaalsContact CA-O 3.3Å; V1212-L1223 WeakPolarHBondContact CA-O 3.3Å; V1212-L1223 WeakPolarHBondContact CG1-O 3.37Å
1213	M	83.8	Confident	75.1	Confident	9 Å²	9	59.4 Å²	59.4	4%	0.044	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.4	168.8	167.5	-176.2	-93.6	0	0	110.4	I1043 F1045 T1222 L1223 L1252 I1253	I1043-M1213 HydrophobicContact CG2-CE 3.91Å; F1045-M1213 HydrophobicContact CD1-CE 4.27Å; F1045-M1213 HydrophobicContact CE1-CE 3.62Å; F1045-M1213 HydrophobicContact CZ-CE 3.96Å; M1213-T1222 PolarHBondContact O-N 3.31Å; M1213-T1222 VanDerWaalsContact O-N 3.15Å; M1213-L1223 HydrophobicContact CB-CB 4.25Å; M1213-L1223 HydrophobicContact CG-CD1 4.49Å; M1213-L1223 PolarHBondContact N-O 3.23Å; M1213-L1223 HydrophobicContact SD-CD1 4.04Å; M1213-L1252 HydrophobicContact CE-CB 4.16Å; M1213-L1252 WeakPolarHBondContact CE-O 3.25Å; M1213-L1252 HydrophobicContact SD-CB 4.49Å; M1213-I1253 HydrophobicContact SD-CG1 4.45Å
1214	E	84.9	Confident	74.6	Confident	18 Å²	18	59.7 Å²	59.7	8%	0.084	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	138.3	170.4	-70.5	-179.7	-177	0	0	110.9	I1044 V1046 K1109 P1216 L1221	I1044-E1214 HydrophobicContact CB-CB 4.17Å; I1044-E1214 WeakPolarHBondContact CD1-OE2 3.4Å; I1044-E1214 HydrophobicContact CG2-CB 4.32Å; I1044-E1214 HydrophobicContact CG2-CG 4.23Å; I1044-E1214 PolarHBondContact O-N 3.47Å; V1046-E1214 HydrophobicContact CG2-CG 3.94Å; K1109-E1214 WeakPolarHBondContact CE-OE1 3.48Å; K1109-E1214 IonicContact NZ-OE1 3.27Å; K1109-E1214 PolarHBondContact NZ-OE1 3.33Å; E1214-P1216 WeakPolarHBondContact O-CD 3.24Å; E1214-L1221 HydrophobicContact CG-CD2 3.37Å; E1214-L1221 HydrophobicContact CG-CG 4.03Å
1215	C	82	Confident	74	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.344	C	S	.	.			trans	-66.8	123.6	175.2	176.2	0	0	0	0	109.8	K1217 C1218 N1219 E1220 C1241 I1248	C1215-K1217 PolarHBondContact O-N 2.87Å; C1215-K1217 PolarHBondContact SG-N 3Å; C1215-C1218 PolarHBondContact O-N 3.44Å; C1215-N1219 WeakPolarHBondContact O-CA 3.33Å; C1215-N1219 PolarHBondContact O-N 2.94Å; C1215-E1220 PolarHBondContact N-O 2.94Å; C1215-C1241 HydrophobicContact CB-CB 4.21Å; C1215-C1241 VanDerWaalsContact CB-SG 3.57Å; C1215-I1248 HydrophobicContact CB-CD1 4.03Å
1216	P	75.9	Confident	73.8	Confident	25 Å²	25	58.6 Å²	58.6	16%	0.162	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	1.3	-178.2	28	-36.2	0	0	0	114.6	R1041 E1214	R1041-P1216 HydrophobicContact CB-CB 4.16Å; E1214-P1216 WeakPolarHBondContact O-CD 3.24Å
1217	K	80.5	Confident	73.1	Confident	123 Å²	123	58.7 Å²	58.7	54%	0.535	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-47.3	175.8	-173.3	-172.1	176.3	-167.6	0	112.6	C1215 H1246	C1215-K1217 PolarHBondContact O-N 2.87Å; C1215-K1217 PolarHBondContact SG-N 3Å; K1217-H1246 HydrophobicContact CB-CB 4.03Å; K1217-H1246 HydrophobicContact CD-CB 3.68Å; K1217-H1246 HydrophobicContact CG-CB 4.46Å
1218	C	84.4	Confident	72.1	Confident	44 Å²	44	57.6 Å²	57.6	30%	0.297	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	3.2	-175.2	67.9	0	0	0	0	113.3	C1215 E1220 C1244	C1215-C1218 PolarHBondContact O-N 3.44Å; C1218-E1220 PolarHBondContact O-N 2.8Å; C1218-C1244 HydrophobicContact CB-CB 3.66Å; C1218-C1244 PolarHBondContact SG-SG 3.24Å
1219	N	81.5	Confident	71.2	Confident	100 Å²	100	57 Å²	57	54%	0.535	31%	0.307	S	S	.	.			trans	58.7	6	-179.3	-56	-16.6	0	0	0	115.7	C1215	C1215-N1219 WeakPolarHBondContact O-CA 3.33Å; C1215-N1219 PolarHBondContact O-N 2.94Å
1220	E	83.1	Confident	69.7	Low	109 Å²	109	58.2 Å²	58.2	51%	0.509	31%	0.314	S	S	.	.			trans	-71.2	137.2	176.7	-81.4	-74.2	-178.5	0	0	113	C1215 C1218 T1222 A1243	C1215-E1220 PolarHBondContact N-O 2.94Å; C1218-E1220 PolarHBondContact O-N 2.8Å; E1220-T1222 HydrophobicContact CB-CG2 3.54Å; E1220-T1222 VanDerWaalsContact O-CG2 3.25Å; E1220-T1222 WeakPolarHBondContact O-CG2 3.46Å; E1220-T1222 PolarHBondContact O-N 3.19Å; E1220-T1222 PolarHBondContact O-OG1 2.89Å; E1220-T1222 VanDerWaalsContact O-OG1 3.05Å; E1220-A1243 HydrophobicContact CB-CB 3.65Å; E1220-A1243 HydrophobicContact CG-CB 3.64Å
1221	L	79.6	Confident	68.4	Low	57 Å²	57	55 Å²	55	30%	0.298	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	91.2	178.5	-73.8	170.9	0	0	0	110.1	V1046 L1107 V1212 E1214	V1046-L1221 HydrophobicContact CB-CD2 3.83Å; V1046-L1221 HydrophobicContact CG1-CD2 4.07Å; V1046-L1221 HydrophobicContact CG2-CD2 3.73Å; L1107-L1221 HydrophobicContact CD1-CD1 4.47Å; V1212-L1221 HydrophobicContact CB-CD2 4.24Å; V1212-L1221 HydrophobicContact CG1-CB 4.01Å; V1212-L1221 HydrophobicContact CG1-CD2 4.09Å; E1214-L1221 HydrophobicContact CG-CD2 3.37Å; E1214-L1221 HydrophobicContact CG-CG 4.03Å
1222	T	74	Confident	67.1	Low	23 Å²	23	56.9 Å²	56.9	14%	0.141	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-14.2	-157.7	47	0	0	0	0	115.3	M1213 E1220 C1241 P1242 A1243	M1213-T1222 PolarHBondContact O-N 3.31Å; M1213-T1222 VanDerWaalsContact O-N 3.15Å; E1220-T1222 HydrophobicContact CB-CG2 3.54Å; E1220-T1222 VanDerWaalsContact O-CG2 3.25Å; E1220-T1222 WeakPolarHBondContact O-CG2 3.46Å; E1220-T1222 PolarHBondContact O-N 3.19Å; E1220-T1222 PolarHBondContact O-OG1 2.89Å; E1220-T1222 VanDerWaalsContact O-OG1 3.05Å; T1222-C1241 WeakPolarHBondContact CG2-SG 3.33Å; T1222-P1242 HydrophobicContact CG2-CG 3.92Å; T1222-A1243 HydrophobicContact CG2-CB 4Å
1223	L	70.1	Confident	65.6	Low	8 Å²	8	57.6 Å²	57.6	4%	0.042	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	97.4	-173.1	-65.6	167.2	0	0	0	110	V1212 M1213 R1239 I1248 I1253	V1212-L1223 CarbonylContact C-O 3.52Å; V1212-L1223 VanDerWaalsContact CA-O 3.3Å; V1212-L1223 WeakPolarHBondContact CA-O 3.3Å; V1212-L1223 WeakPolarHBondContact CG1-O 3.37Å; M1213-L1223 HydrophobicContact CB-CB 4.25Å; M1213-L1223 HydrophobicContact CG-CD1 4.49Å; M1213-L1223 PolarHBondContact N-O 3.23Å; M1213-L1223 HydrophobicContact SD-CD1 4.04Å; L1223-R1239 HydrophobicContact CD2-CB 4.19Å; L1223-I1248 HydrophobicContact CD1-CD1 3.67Å; L1223-I1248 HydrophobicContact CD1-CG2 4.27Å; L1223-I1248 HydrophobicContact CG-CD1 4.49Å; L1223-I1253 HydrophobicContact CD1-CD1 3.5Å; L1223-I1253 HydrophobicContact CD1-CG1 3.76Å; L1223-I1253 HydrophobicContact CD1-CG2 4.39Å; L1223-I1253 HydrophobicContact CD2-CD1 4.07Å; L1223-I1253 HydrophobicContact CG-CD1 4.41Å
1224	A	61.6	Low	63.9	Low	74 Å²	74	62.3 Å²	62.3	61%	0.612	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	148.5	179.9	0	0	0	0	0	113.2	R1211 E1226	R1211-A1224 CarbonylContact O-C 3.6Å; A1224-E1226 PolarHBondContact O-N 3.42Å
1225	G	53.9	Low	62.4	Low	47 Å²	47	66.8 Å²	66.8	49%	0.485	37%	0.374	S	S	.	.	S	Bend	trans	-91.5	82.1	-155.2	0	0	0	0	0	118	R1211	R1211-G1225 VanDerWaalsContact O-CA 3.31Å; R1211-G1225 WeakPolarHBondContact O-CA 2.98Å; R1211-G1225 PolarHBondContact O-N 3.43Å
1226	E	50.4	Low	61.3	Low	167 Å²	167	69.2 Å²	69.2	78%	0.78	39%	0.389	S	S	*	.	S	Bend	trans	-111.8	115.9	140.3	-68.3	-175.4	173.8	0	0	106.4	A1224 L1228	A1224-E1226 PolarHBondContact O-N 3.42Å; E1226-L1228 PolarHBondContact O-N 2.98Å
1227	W	53.3	Low	60.6	Low	83 Å²	83	76 Å²	76	31%	0.314	42%	0.416	S	S	.	.			trans	-53.8	117.1	175	-68.7	97.2	0	0	0	108.1	W1187 L1191 R1211 T1229 I1253 P1255	W1187-W1227 AromaticContact CH2-CH2 3.74Å; W1187-W1227 HydrophobicContact CH2-CH2 3.74Å; W1187-W1227 AromaticContact CH2-CZ3 3.65Å; W1187-W1227 HydrophobicContact CH2-CZ3 3.65Å; W1187-W1227 AromaticContact CZ3-CH2 3.7Å; W1187-W1227 HydrophobicContact CZ3-CH2 3.7Å; W1187-W1227 HydrophobicContact CZ3-CZ3 4.04Å; L1191-W1227 HydrophobicContact CD1-CH2 4.39Å; L1191-W1227 HydrophobicContact CD1-CZ2 4.36Å; R1211-W1227 VanDerWaalsContact CZ-CZ2 3.41Å; W1227-T1229 PolarHBondContact O-N 3.17Å; W1227-T1229 VanDerWaalsContact O-N 3.09Å; W1227-I1253 VanDerWaalsContact CE3-O 3.25Å; W1227-I1253 WeakPolarHBondContact CZ3-O 3.47Å; W1227-P1255 HydrophobicContact CD2-CG 4.08Å; W1227-P1255 HydrophobicContact CE3-CG 3.57Å; W1227-P1255 HydrophobicContact CH2-CG 3.96Å; W1227-P1255 HydrophobicContact CZ2-CG 4.47Å; W1227-P1255 HydrophobicContact CZ3-CB 4.3Å; W1227-P1255 VanDerWaalsContact CZ3-CD 3.46Å; W1227-P1255 HydrophobicContact CZ3-CG 3.5Å; W1227-P1255 VanDerWaalsContact CZ3-CG 3.5Å
1228	L	47.3	Very low	60.2	Low	11 Å²	11	74.8 Å²	74.8	6%	0.058	41%	0.409	C	S	.	.			trans	-40.1	121.5	-173.8	-69.4	168.7	0	0	0	109.6	E1226 E1232 V1233 A1254	E1226-L1228 PolarHBondContact O-N 2.98Å; L1228-E1232 WeakPolarHBondContact CA-OE2 3.47Å; L1228-E1232 HydrophobicContact CB-CB 3.95Å; L1228-E1232 HydrophobicContact CD2-CB 3.67Å; L1228-E1232 HydrophobicContact CD2-CG 4.44Å; L1228-E1232 HydrophobicContact CG-CB 4.36Å; L1228-V1233 HydrophobicContact CB-CG2 3.44Å; L1228-V1233 VanDerWaalsContact CB-CG2 3.44Å; L1228-V1233 HydrophobicContact CD1-CG2 4.25Å; L1228-A1254 HydrophobicContact CB-CB 4.34Å; L1228-A1254 HydrophobicContact CD1-CB 4.34Å
1229	T	45.6	Very low	59.7	Low	62 Å²	62	77.4 Å²	77.4	38%	0.38	41%	0.412	S	S	.	.			trans	-54.5	151.6	174.3	53.9	0	0	0	0	108.4	W1227 S1231 E1232 V1233	W1227-T1229 PolarHBondContact O-N 3.17Å; W1227-T1229 VanDerWaalsContact O-N 3.09Å; T1229-S1231 WeakPolarHBondContact CB-OG 3.48Å; T1229-S1231 PolarHBondContact O-N 3.01Å; T1229-S1231 PolarHBondContact OG1-OG 3.25Å; T1229-E1232 PolarHBondContact N-OE2 3.02Å; T1229-E1232 PolarHBondContact O-N 3.23Å; T1229-E1232 VanDerWaalsContact OG1-CG 3.3Å; T1229-E1232 WeakPolarHBondContact OG1-CG 3.39Å; T1229-E1232 PolarHBondContact OG1-OE2 3.04Å; T1229-V1233 PolarHBondContact O-N 3.41Å; T1229-V1233 VanDerWaalsContact O-N 3.09Å
1230	P	43.9	Very low	59.6	Low	74 Å²	74	79 Å²	79	48%	0.481	41%	0.414	S	S	.	.	H	α-helix	trans	-49	-31.1	178.2	-29.1	35.1	0	0	0	113.2	Q1234 T1258	P1230-Q1234 WeakPolarHBondContact O-CB 3.2Å; P1230-Q1234 WeakPolarHBondContact O-CG 3.25Å; P1230-Q1234 PolarHBondContact O-N 2.91Å; P1230-Q1234 PolarHBondContact O-NE2 3.26Å; P1230-T1258 HydrophobicContact CG-CG2 4.35Å
1231	S	45.3	Very low	59.5	Low	72 Å²	72	73.8 Å²	73.8	50%	0.503	39%	0.39	S	S	.	.	H	α-helix	trans	-64.6	-39.8	172	33.3	0	0	0	0	114.7	T1229	T1229-S1231 WeakPolarHBondContact CB-OG 3.48Å; T1229-S1231 PolarHBondContact O-N 3.01Å; T1229-S1231 PolarHBondContact OG1-OG 3.25Å
1232	E	47.6	Very low	59.4	Low	70 Å²	70	76 Å²	76	33%	0.327	41%	0.408	S	S	.	.	H	α-helix	trans	-76.9	-34.6	179.4	-67.5	170.2	123.2	0	0	112.3	L1228 T1229 Q1234 T1235 V1236	L1228-E1232 WeakPolarHBondContact CA-OE2 3.47Å; L1228-E1232 HydrophobicContact CB-CB 3.95Å; L1228-E1232 HydrophobicContact CD2-CB 3.67Å; L1228-E1232 HydrophobicContact CD2-CG 4.44Å; L1228-E1232 HydrophobicContact CG-CB 4.36Å; T1229-E1232 PolarHBondContact N-OE2 3.02Å; T1229-E1232 PolarHBondContact O-N 3.23Å; T1229-E1232 VanDerWaalsContact OG1-CG 3.3Å; T1229-E1232 WeakPolarHBondContact OG1-CG 3.39Å; T1229-E1232 PolarHBondContact OG1-OE2 3.04Å; E1232-Q1234 VanDerWaalsContact C-N 3.27Å; E1232-Q1234 PolarHBondContact O-N 3.07Å; E1232-T1235 PolarHBondContact O-N 3.29Å; E1232-T1235 PolarHBondContact O-OG1 2.95Å; E1232-V1236 PolarHBondContact O-N 3.16Å
1233	V	49.4	Very low	59.9	Low	34 Å²	34	77.8 Å²	77.8	21%	0.206	43%	0.425	C	S	.	.	H	α-helix	trans	-64.6	-33.9	172.6	-176.6	0	0	0	0	111.1	L1228 T1229 T1235 A1254	L1228-V1233 HydrophobicContact CB-CG2 3.44Å; L1228-V1233 VanDerWaalsContact CB-CG2 3.44Å; L1228-V1233 HydrophobicContact CD1-CG2 4.25Å; T1229-V1233 PolarHBondContact O-N 3.41Å; T1229-V1233 VanDerWaalsContact O-N 3.09Å; V1233-T1235 VanDerWaalsContact C-N 3.32Å; V1233-T1235 PolarHBondContact O-N 3.04Å; V1233-A1254 HydrophobicContact CG2-CB 3.92Å
1234	Q	47.3	Very low	60.6	Low	107 Å²	107	79.1 Å²	79.1	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-30.7	-178	-80.7	164.5	37.3	0	0	113.7	P1230 E1232 Y1262	P1230-Q1234 WeakPolarHBondContact O-CB 3.2Å; P1230-Q1234 WeakPolarHBondContact O-CG 3.25Å; P1230-Q1234 PolarHBondContact O-N 2.91Å; P1230-Q1234 PolarHBondContact O-NE2 3.26Å; E1232-Q1234 VanDerWaalsContact C-N 3.27Å; E1232-Q1234 PolarHBondContact O-N 3.07Å; Q1234-Y1262 HydrophobicContact CG-CD1 4.43Å; Q1234-Y1262 HydrophobicContact CG-CE1 4.45Å
1235	T	54.4	Low	61.7	Low	113 Å²	113	78.5 Å²	78.5	69%	0.693	43%	0.43	S	S	*	.	H	α-helix	trans	-101.2	-32.1	-170.8	53	0	0	0	0	113.5	E1232 V1233	E1232-T1235 PolarHBondContact O-N 3.29Å; E1232-T1235 PolarHBondContact O-OG1 2.95Å; V1233-T1235 VanDerWaalsContact C-N 3.32Å; V1233-T1235 PolarHBondContact O-N 3.04Å
1236	V	58.7	Low	63	Low	51 Å²	51	78.5 Å²	78.5	31%	0.309	42%	0.417	S	S	.	.			trans	-112.1	107.5	-168.7	-174.4	0	0	0	0	111.2	E1232 Y1238 R1239 S1250	E1232-V1236 PolarHBondContact O-N 3.16Å; V1236-Y1238 VanDerWaalsContact C-N 3.35Å; V1236-Y1238 WeakPolarHBondContact CG1-O 3.4Å; V1236-R1239 HydrophobicContact CG1-CG 4.13Å; V1236-S1250 WeakPolarHBondContact O-CB 3.48Å; V1236-S1250 PolarHBondContact O-OG 3.47Å
1237	K	61.3	Low	64.4	Low	168 Å²	168	78.1 Å²	78.1	73%	0.73	41%	0.408	S	S	*	.	S	Bend	trans	-71.4	-29.4	174.7	-72.4	-178.2	-178.1	170.7	0	113.6	S1250	K1237-S1250 PolarHBondContact O-N 3.36Å; K1237-S1250 PolarHBondContact O-OG 2.58Å
1238	Y	71.5	Confident	65.3	Low	97 Å²	97	74.2 Å²	74.2	38%	0.38	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	134.4	-178.5	-54.2	-90.8	0	0	0	108.5	V1236 R1247 I1248 P1249	V1236-Y1238 VanDerWaalsContact C-N 3.35Å; V1236-Y1238 WeakPolarHBondContact CG1-O 3.4Å; Y1238-R1247 HydrophobicContact CD1-CB 4.15Å; Y1238-R1247 HydrophobicContact CG-CB 4.12Å; Y1238-I1248 CarbonylContact C-O 3.49Å; Y1238-I1248 WeakPolarHBondContact CA-O 3.3Å; Y1238-P1249 HydrophobicContact CD1-CB 4.2Å; Y1238-P1249 HydrophobicContact CD1-CG 4.09Å; Y1238-P1249 HydrophobicContact CE1-CB 4.22Å; Y1238-P1249 HydrophobicContact CE1-CG 3.99Å
1239	R	73.9	Confident	66.4	Low	99 Å²	99	74.8 Å²	74.8	37%	0.374	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	137.9	161.6	-91.1	-165.4	173.7	-179.1	3	108.7	L1223 V1236 I1248 I1253	L1223-R1239 HydrophobicContact CD2-CB 4.19Å; V1236-R1239 HydrophobicContact CG1-CG 4.13Å; R1239-I1248 PolarHBondContact N-O 3.43Å; R1239-I1248 PolarHBondContact O-N 3.02Å; R1239-I1253 HydrophobicContact CB-CD1 3.93Å; R1239-I1253 HydrophobicContact CG-CD1 4.45Å
1240	K	79.2	Confident	67.5	Low	132 Å²	132	72.4 Å²	72.4	57%	0.574	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	130	168.9	-69.2	-178	-178.3	178	0	107.6	P1242 H1246 R1247	K1240-P1242 VanDerWaalsContact O-CD 3.27Å; K1240-P1242 WeakPolarHBondContact O-CD 3.36Å; K1240-H1246 CarbonylContact C-O 3.24Å; K1240-H1246 WeakPolarHBondContact CA-O 3.29Å; K1240-R1247 HydrophobicContact CG-CG 4.22Å
1241	C	80.8	Confident	68.3	Low	1 Å²	1	70.3 Å²	70.3	1%	0.007	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-56.2	120.4	165.6	173.5	0	0	0	0	108.4	C1215 T1222 A1243 C1244 A1245 H1246 I1248	C1215-C1241 HydrophobicContact CB-CB 4.21Å; C1215-C1241 VanDerWaalsContact CB-SG 3.57Å; T1222-C1241 WeakPolarHBondContact CG2-SG 3.33Å; C1241-A1243 PolarHBondContact O-N 3.1Å; C1241-A1243 PolarHBondContact SG-N 2.71Å; C1241-C1244 VanDerWaalsContact SG-SG 3.68Å; C1241-A1245 WeakPolarHBondContact O-CA 3.31Å; C1241-A1245 PolarHBondContact O-N 3.27Å; C1241-H1246 HydrophobicContact CB-CB 4.38Å; C1241-H1246 PolarHBondContact N-O 2.94Å; C1241-I1248 HydrophobicContact CB-CD1 4Å; C1241-I1248 HydrophobicContact CB-CG1 4.48Å
1242	P	79	Confident	69	Low	103 Å²	103	67.6 Å²	67.6	67%	0.669	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.1	176.6	13	-28.7	0	0	0	113.4	T1222 K1240	T1222-P1242 HydrophobicContact CG2-CG 3.92Å; K1240-P1242 VanDerWaalsContact O-CD 3.27Å; K1240-P1242 WeakPolarHBondContact O-CD 3.36Å
1243	A	82.8	Confident	69.8	Low	61 Å²	61	65.4 Å²	65.4	50%	0.504	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-45.7	-177.8	0	0	0	0	0	114	E1220 T1222 C1241	E1220-A1243 HydrophobicContact CB-CB 3.65Å; E1220-A1243 HydrophobicContact CG-CB 3.64Å; T1222-A1243 HydrophobicContact CG2-CB 4Å; C1241-A1243 PolarHBondContact O-N 3.1Å; C1241-A1243 PolarHBondContact SG-N 2.71Å
1244	C	85.7	Confident	70.3	Confident	36 Å²	36	64 Å²	64	24%	0.243	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	8.4	-173.5	74	0	0	0	0	115	C1218 C1241 H1246	C1218-C1244 HydrophobicContact CB-CB 3.66Å; C1218-C1244 PolarHBondContact SG-SG 3.24Å; C1241-C1244 VanDerWaalsContact SG-SG 3.68Å; C1244-H1246 PolarHBondContact O-N 3.22Å; C1244-H1246 WeakPolarHBondContact SG-CB 3.02Å
1245	A	84.5	Confident	70.8	Confident	61 Å²	61	59.9 Å²	59.9	50%	0.504	32%	0.315	S	S	.	.			trans	55.3	9.4	-174.4	0	0	0	0	0	115.5	C1241 R1247	C1241-A1245 WeakPolarHBondContact O-CA 3.31Å; C1241-A1245 PolarHBondContact O-N 3.27Å; A1245-R1247 PolarHBondContact O-N 3.41Å
1246	H	82	Confident	70.7	Confident	46 Å²	46	55.2 Å²	55.2	21%	0.213	29%	0.287	C	S	.	.			trans	-65.2	133.6	-179	-169.8	58.3	0	0	0	111.2	R1041 K1217 K1240 C1241 C1244 I1248	R1041-H1246 PolarHBondContact NH1-CE1 3.04Å; R1041-H1246 PolarHBondContact NH1-NE2 3.27Å; K1217-H1246 HydrophobicContact CB-CB 4.03Å; K1217-H1246 HydrophobicContact CD-CB 3.68Å; K1217-H1246 HydrophobicContact CG-CB 4.46Å; K1240-H1246 CarbonylContact C-O 3.24Å; K1240-H1246 WeakPolarHBondContact CA-O 3.29Å; C1241-H1246 HydrophobicContact CB-CB 4.38Å; C1241-H1246 PolarHBondContact N-O 2.94Å; C1244-H1246 PolarHBondContact O-N 3.22Å; C1244-H1246 WeakPolarHBondContact SG-CB 3.02Å; H1246-I1248 PolarHBondContact O-N 3.13Å; H1246-I1248 VanDerWaalsContact O-N 3.13Å
1247	R	78.2	Confident	70.4	Confident	160 Å²	160	58.3 Å²	58.3	60%	0.604	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	99.1	-179.9	-71.1	-176.7	-178.6	-178.9	0.4	109.9	Y1238 K1240 A1245	Y1238-R1247 HydrophobicContact CD1-CB 4.15Å; Y1238-R1247 HydrophobicContact CG-CB 4.12Å; K1240-R1247 HydrophobicContact CG-CG 4.22Å; A1245-R1247 PolarHBondContact O-N 3.41Å
1248	I	73.2	Confident	69.8	Low	0 Å²	0	53 Å²	53	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	121.6	174.6	-56.2	171.8	0	0	0	108.1	C1215 L1223 Y1238 R1239 C1241 H1246 S1250 L1252 I1253	C1215-I1248 HydrophobicContact CB-CD1 4.03Å; L1223-I1248 HydrophobicContact CD1-CD1 3.67Å; L1223-I1248 HydrophobicContact CD1-CG2 4.27Å; L1223-I1248 HydrophobicContact CG-CD1 4.49Å; Y1238-I1248 CarbonylContact C-O 3.49Å; Y1238-I1248 WeakPolarHBondContact CA-O 3.3Å; R1239-I1248 PolarHBondContact N-O 3.43Å; R1239-I1248 PolarHBondContact O-N 3.02Å; C1241-I1248 HydrophobicContact CB-CD1 4Å; C1241-I1248 HydrophobicContact CB-CG1 4.48Å; H1246-I1248 PolarHBondContact O-N 3.13Å; H1246-I1248 VanDerWaalsContact O-N 3.13Å; I1248-S1250 PolarHBondContact O-N 3.01Å; I1248-L1252 HydrophobicContact CG2-CB 4.36Å; I1248-L1252 HydrophobicContact CG2-CD1 4.28Å; I1248-I1253 HydrophobicContact CG2-CD1 4.2Å; I1248-I1253 HydrophobicContact CG2-CG1 4.17Å
1249	P	70.4	Confident	68.5	Low	23 Å²	23	49.3 Å²	49.3	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	130.6	174.8	-23.3	30.8	0	0	0	111.7	Y1238 C1251 L1252	Y1238-P1249 HydrophobicContact CD1-CB 4.2Å; Y1238-P1249 HydrophobicContact CD1-CG 4.09Å; Y1238-P1249 HydrophobicContact CE1-CB 4.22Å; Y1238-P1249 HydrophobicContact CE1-CG 3.99Å; P1249-C1251 WeakPolarHBondContact CB-SG 3.46Å; P1249-C1251 PolarHBondContact O-N 2.92Å; P1249-C1251 VanDerWaalsContact O-N 3.13Å; P1249-L1252 HydrophobicContact CB-CG 4.39Å; P1249-L1252 HydrophobicContact CG-CD1 4.24Å; P1249-L1252 WeakPolarHBondContact O-CB 3.15Å; P1249-L1252 PolarHBondContact O-N 3.44Å
1250	S	67.8	Low	67.1	Low	12 Å²	12	47.1 Å²	47.1	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-23.1	-178.6	49.3	0	0	0	0	113.7	V1236 K1237 I1248 L1252 I1253 A1254	V1236-S1250 WeakPolarHBondContact O-CB 3.48Å; V1236-S1250 PolarHBondContact O-OG 3.47Å; K1237-S1250 PolarHBondContact O-N 3.36Å; K1237-S1250 PolarHBondContact O-OG 2.58Å; I1248-S1250 PolarHBondContact O-N 3.01Å; S1250-L1252 VanDerWaalsContact C-N 3.3Å; S1250-L1252 PolarHBondContact O-N 2.9Å; S1250-I1253 CarbonylContact O-C 3.49Å; S1250-I1253 WeakPolarHBondContact O-CA 3.4Å; S1250-I1253 WeakPolarHBondContact O-CB 3.37Å; S1250-I1253 PolarHBondContact O-N 3.4Å; S1250-A1254 PolarHBondContact O-N 2.91Å
1251	C	61.4	Low	65.4	Low	31 Å²	31	48.3 Å²	48.3	21%	0.209	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-15	173.4	51.7	0	0	0	0	115	W1176 E1183 W1187 P1249 I1253	W1176-C1251 HydrophobicContact CH2-CB 4.18Å; W1176-C1251 HydrophobicContact CZ2-CB 3.68Å; W1176-C1251 WeakPolarHBondContact CZ2-SG 3.41Å; E1183-C1251 WeakPolarHBondContact OE1-CB 3.48Å; W1187-C1251 VanDerWaalsContact CZ2-O 3.32Å; W1187-C1251 WeakPolarHBondContact CZ2-O 3.39Å; W1187-C1251 PolarHBondContact NE1-O 3.2Å; P1249-C1251 WeakPolarHBondContact CB-SG 3.46Å; P1249-C1251 PolarHBondContact O-N 2.92Å; P1249-C1251 VanDerWaalsContact O-N 3.13Å; C1251-I1253 VanDerWaalsContact C-N 3.27Å
1252	L	60.8	Low	63.6	Low	15 Å²	15	52.2 Å²	52.2	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-77.9	-21.8	165.1	-67.1	178.3	0	0	0	110.8	I1043 W1176 M1213 I1248 P1249 S1250	I1043-L1252 HydrophobicContact CD1-CD2 3.84Å; I1043-L1252 HydrophobicContact CG1-CD2 4.13Å; W1176-L1252 HydrophobicContact CH2-CD2 3.83Å; W1176-L1252 HydrophobicContact CZ3-CD2 3.64Å; M1213-L1252 HydrophobicContact CE-CB 4.16Å; M1213-L1252 WeakPolarHBondContact CE-O 3.25Å; M1213-L1252 HydrophobicContact SD-CB 4.49Å; I1248-L1252 HydrophobicContact CG2-CB 4.36Å; I1248-L1252 HydrophobicContact CG2-CD1 4.28Å; P1249-L1252 HydrophobicContact CB-CG 4.39Å; P1249-L1252 HydrophobicContact CG-CD1 4.24Å; P1249-L1252 WeakPolarHBondContact O-CB 3.15Å; P1249-L1252 PolarHBondContact O-N 3.44Å; S1250-L1252 VanDerWaalsContact C-N 3.3Å; S1250-L1252 PolarHBondContact O-N 2.9Å
1253	I	62.9	Low	61.7	Low	24 Å²	24	52.1 Å²	52.1	12%	0.123	28%	0.276	C	S	.	.	H	α-helix	trans	-95	-22.1	-174.9	-41.3	175.8	0	0	0	111	M1213 L1223 W1227 R1239 I1248 S1250 C1251	M1213-I1253 HydrophobicContact SD-CG1 4.45Å; L1223-I1253 HydrophobicContact CD1-CD1 3.5Å; L1223-I1253 HydrophobicContact CD1-CG1 3.76Å; L1223-I1253 HydrophobicContact CD1-CG2 4.39Å; L1223-I1253 HydrophobicContact CD2-CD1 4.07Å; L1223-I1253 HydrophobicContact CG-CD1 4.41Å; W1227-I1253 VanDerWaalsContact CE3-O 3.25Å; W1227-I1253 WeakPolarHBondContact CZ3-O 3.47Å; R1239-I1253 HydrophobicContact CB-CD1 3.93Å; R1239-I1253 HydrophobicContact CG-CD1 4.45Å; I1248-I1253 HydrophobicContact CG2-CD1 4.2Å; I1248-I1253 HydrophobicContact CG2-CG1 4.17Å; S1250-I1253 CarbonylContact O-C 3.49Å; S1250-I1253 WeakPolarHBondContact O-CA 3.4Å; S1250-I1253 WeakPolarHBondContact O-CB 3.37Å; S1250-I1253 PolarHBondContact O-N 3.4Å; C1251-I1253 VanDerWaalsContact C-N 3.27Å
1254	A	61.2	Low	60.2	Low	5 Å²	5	58.4 Å²	58.4	4%	0.041	29%	0.287	C	S	.	.	S	Bend	trans	-133.9	144.8	-173.2	0	0	0	0	0	114	W1187 L1228 V1233 S1250	W1187-A1254 WeakPolarHBondContact CZ2-O 3.41Å; L1228-A1254 HydrophobicContact CB-CB 4.34Å; L1228-A1254 HydrophobicContact CD1-CB 4.34Å; V1233-A1254 HydrophobicContact CG2-CB 3.92Å; S1250-A1254 PolarHBondContact O-N 2.91Å
1255	P	57.5	Low	58.4	Low	20 Å²	20	62.3 Å²	62.3	13%	0.13	30%	0.3	C	S	.	.			trans	-77.2	156	-176.7	7.4	12	0	0	0	111.5	W1187 L1191 W1227 E1257 T1258	W1187-P1255 HydrophobicContact CE3-CB 4.41Å; W1187-P1255 HydrophobicContact CZ3-CB 4.48Å; L1191-P1255 HydrophobicContact CD1-CB 4.14Å; L1191-P1255 HydrophobicContact CD1-CG 4.31Å; L1191-P1255 HydrophobicContact CD2-CB 4.24Å; W1227-P1255 HydrophobicContact CD2-CG 4.08Å; W1227-P1255 HydrophobicContact CE3-CG 3.57Å; W1227-P1255 HydrophobicContact CH2-CG 3.96Å; W1227-P1255 HydrophobicContact CZ2-CG 4.47Å; W1227-P1255 HydrophobicContact CZ3-CB 4.3Å; W1227-P1255 VanDerWaalsContact CZ3-CD 3.46Å; W1227-P1255 HydrophobicContact CZ3-CG 3.5Å; W1227-P1255 VanDerWaalsContact CZ3-CG 3.5Å; P1255-E1257 VanDerWaalsContact C-N 3.32Å; P1255-E1257 PolarHBondContact O-N 3.37Å; P1255-T1258 PolarHBondContact O-OG1 3.04Å
1256	P	51.2	Low	56.6	Low	15 Å²	15	62.5 Å²	62.5	10%	0.097	29%	0.292	C	S	.	.	H	α-helix	trans	-72.1	-23.3	-172.8	26.5	-34	0	0	0	113.7	W1187 T1258 G1259 F1260	W1187-P1256 VanDerWaalsContact CB-CD 3.48Å; W1187-P1256 HydrophobicContact CB-CG 3.47Å; W1187-P1256 VanDerWaalsContact CB-CG 3.47Å; W1187-P1256 VanDerWaalsContact CD1-CD 3.46Å; W1187-P1256 HydrophobicContact CG-CG 3.68Å; P1256-T1258 PolarHBondContact O-N 2.61Å; P1256-G1259 PolarHBondContact O-N 3.18Å; P1256-F1260 HydrophobicContact CB-CD2 3.37Å; P1256-F1260 HydrophobicContact CB-CE2 3.67Å; P1256-F1260 PolarHBondContact O-N 2.74Å
1257	E	52.3	Low	54.9	Low	115 Å²	115	67.1 Å²	67.1	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-51.4	-31.3	-178.5	-69.6	177	171.9	0	0	111.8	L1191 K1195 P1255	L1191-E1257 HydrophobicContact CD2-CG 4.49Å; K1195-E1257 IonicContact NZ-OE1 2.78Å; K1195-E1257 IonicContact NZ-OE2 3.11Å; K1195-E1257 PolarHBondContact NZ-OE2 3.45Å; P1255-E1257 VanDerWaalsContact C-N 3.32Å; P1255-E1257 PolarHBondContact O-N 3.37Å
1258	T	48.8	Very low	53.8	Low	56 Å²	56	62.8 Å²	62.8	34%	0.344	31%	0.306	S	S	.	.	H	α-helix	trans	-94.7	-30.8	177.2	59.7	0	0	0	0	114	P1230 P1255 P1256	P1230-T1258 HydrophobicContact CG-CG2 4.35Å; P1255-T1258 PolarHBondContact O-OG1 3.04Å; P1256-T1258 PolarHBondContact O-N 2.61Å
1259	G	44.8	Very low	52.7	Low	21 Å²	21	66.7 Å²	66.7	22%	0.216	32%	0.324	C	S	.	.	H	α-helix	trans	-84.9	-36.8	-174	0	0	0	0	0	115.4	P1256 K1263	P1256-G1259 PolarHBondContact O-N 3.18Å; G1259-K1263 PolarHBondContact O-N 2.91Å; G1259-K1263 VanDerWaalsContact O-N 3.09Å
1260	F	43.7	Very low	51.8	Low	52 Å²	52	72.5 Å²	72.5	23%	0.228	35%	0.347	C	S	.	.	H	α-helix	trans	-79.5	-38.3	-173.2	-85.3	-89.7	0	0	0	113.4	E1183 E1184 P1256 Y1262 K1263 R1264	E1183-F1260 HydrophobicContact CG-CE2 4.27Å; E1183-F1260 HydrophobicContact CG-CZ 4.39Å; E1184-F1260 HydrophobicContact CG-CD1 4.47Å; E1184-F1260 HydrophobicContact CG-CD2 4.34Å; E1184-F1260 HydrophobicContact CG-CE1 4.07Å; E1184-F1260 HydrophobicContact CG-CE2 3.91Å; E1184-F1260 HydrophobicContact CG-CZ 3.76Å; E1184-F1260 WeakPolarHBondContact OE1-CD1 3.25Å; E1184-F1260 WeakPolarHBondContact OE1-CE1 3.38Å; P1256-F1260 HydrophobicContact CB-CD2 3.37Å; P1256-F1260 HydrophobicContact CB-CE2 3.67Å; P1256-F1260 PolarHBondContact O-N 2.74Å; F1260-Y1262 PolarHBondContact O-N 2.72Å; F1260-K1263 PolarHBondContact O-N 3.12Å; F1260-R1264 PolarHBondContact O-N 3.17Å; F1260-R1264 VanDerWaalsContact O-N 3.11Å
1261	Q	44.9	Very low	51	Low	158 Å²	158	79.8 Å²	79.8	74%	0.738	38%	0.377	S	S	*	.	H	α-helix	trans	-56.1	-38.2	173.6	-70.1	-172	-2.9	0	0	110.9
1262	Y	41.6	Very low	50.6	Low	83 Å²	83	81.2 Å²	81.2	33%	0.325	39%	0.388	S	S	.	.	H	α-helix	trans	-81.4	-33	178.7	-150.9	-91.4	0	0	0	113.7	Q1234 F1260 R1264 K1265 I1266	Q1234-Y1262 HydrophobicContact CG-CD1 4.43Å; Q1234-Y1262 HydrophobicContact CG-CE1 4.45Å; F1260-Y1262 PolarHBondContact O-N 2.72Å; Y1262-R1264 VanDerWaalsContact C-N 3.27Å; Y1262-R1264 PolarHBondContact O-N 3.05Å; Y1262-K1265 HydrophobicContact CD2-CD 4.22Å; Y1262-K1265 HydrophobicContact CE2-CD 4.08Å; Y1262-K1265 CarbonylContact O-C 3.57Å; Y1262-K1265 WeakPolarHBondContact O-CA 3.19Å; Y1262-K1265 WeakPolarHBondContact O-CB 3.1Å; Y1262-K1265 PolarHBondContact O-N 2.7Å; Y1262-I1266 HydrophobicContact CD1-CD1 3.73Å; Y1262-I1266 HydrophobicContact CD1-CG1 3.82Å; Y1262-I1266 HydrophobicContact CE1-CD1 3.86Å; Y1262-I1266 HydrophobicContact CE1-CG1 3.8Å; Y1262-I1266 PolarHBondContact O-N 3.29Å
1263	K	40.6	Very low	50.1	Low	100 Å²	100	89.2 Å²	89.2	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-61.6	-34.6	173.4	-113	176.6	-169.9	161.9	0	112.5	G1259 F1260 K1265 I1266 K1267	G1259-K1263 PolarHBondContact O-N 2.91Å; G1259-K1263 VanDerWaalsContact O-N 3.09Å; F1260-K1263 PolarHBondContact O-N 3.12Å; K1263-K1265 VanDerWaalsContact C-N 3.31Å; K1263-I1266 PolarHBondContact O-N 3.29Å; K1263-K1267 WeakPolarHBondContact O-CB 3.5Å; K1263-K1267 PolarHBondContact O-N 3.47Å
1264	R	50.3	Low	49.5	Very low	193 Å²	193	96 Å²	96	73%	0.728	45%	0.445	S	S	*	.	H	α-helix	trans	-61.3	-42.6	170.9	-74.7	-174.7	179.6	174.6	1.4	110.5	F1260 Y1262 K1267 S1268	F1260-R1264 PolarHBondContact O-N 3.17Å; F1260-R1264 VanDerWaalsContact O-N 3.11Å; Y1262-R1264 VanDerWaalsContact C-N 3.27Å; Y1262-R1264 PolarHBondContact O-N 3.05Å; R1264-K1267 PolarHBondContact O-N 3.46Å; R1264-S1268 PolarHBondContact O-N 2.75Å; R1264-S1268 PolarHBondContact O-OG 3.07Å
1265	K	49.4	Very low	48.8	Very low	118 Å²	118	99.7 Å²	99.7	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-44.6	173.6	-127.1	178.6	-177.4	-177.9	0	113.6	Y1262 K1263 K1267 S1268 E1269	Y1262-K1265 HydrophobicContact CD2-CD 4.22Å; Y1262-K1265 HydrophobicContact CE2-CD 4.08Å; Y1262-K1265 CarbonylContact O-C 3.57Å; Y1262-K1265 WeakPolarHBondContact O-CA 3.19Å; Y1262-K1265 WeakPolarHBondContact O-CB 3.1Å; Y1262-K1265 PolarHBondContact O-N 2.7Å; K1263-K1265 VanDerWaalsContact C-N 3.31Å; K1265-K1267 VanDerWaalsContact C-N 3.35Å; K1265-K1267 PolarHBondContact O-N 3.14Å; K1265-S1268 WeakPolarHBondContact CA-OG 3.47Å; K1265-S1268 PolarHBondContact O-N 3.19Å; K1265-S1268 PolarHBondContact O-OG 2.67Å; K1265-E1269 WeakPolarHBondContact O-CB 3.18Å; K1265-E1269 WeakPolarHBondContact O-CG 3.21Å; K1265-E1269 PolarHBondContact O-N 3.36Å
1266	I	45.4	Very low	48.3	Very low	65 Å²	65	104 Å²	104	33%	0.333	49%	0.491	S	S	.	.	H	α-helix	trans	-69.5	-33.3	176.8	-64.6	174.2	0	0	0	111.5	Y1262 K1263 E1269 K1270	Y1262-I1266 HydrophobicContact CD1-CD1 3.73Å; Y1262-I1266 HydrophobicContact CD1-CG1 3.82Å; Y1262-I1266 HydrophobicContact CE1-CD1 3.86Å; Y1262-I1266 HydrophobicContact CE1-CG1 3.8Å; Y1262-I1266 PolarHBondContact O-N 3.29Å; K1263-I1266 PolarHBondContact O-N 3.29Å; I1266-E1269 PolarHBondContact O-N 3.39Å; I1266-K1270 HydrophobicContact CG2-CD 4.13Å; I1266-K1270 HydrophobicContact CG2-CG 4.29Å; I1266-K1270 WeakPolarHBondContact O-CB 3.11Å; I1266-K1270 WeakPolarHBondContact O-CG 3.47Å; I1266-K1270 PolarHBondContact O-N 3.37Å
1267	K	47	Very low	48.3	Very low	144 Å²	144	111.7 Å²	111.7	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-67.8	-39.6	175.4	-88.1	-173.5	175.7	-177.7	0	111.5	K1263 R1264 K1265 K1271	K1263-K1267 WeakPolarHBondContact O-CB 3.5Å; K1263-K1267 PolarHBondContact O-N 3.47Å; R1264-K1267 PolarHBondContact O-N 3.46Å; K1265-K1267 VanDerWaalsContact C-N 3.35Å; K1265-K1267 PolarHBondContact O-N 3.14Å; K1267-K1271 PolarHBondContact O-N 3.16Å
1268	S	55	Low	48.1	Very low	69 Å²	69	110.9 Å²	110.9	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-65.5	-42.8	172.7	54.4	0	0	0	0	111.1	R1264 K1265 K1270 K1271 S1272	R1264-S1268 PolarHBondContact O-N 2.75Å; R1264-S1268 PolarHBondContact O-OG 3.07Å; K1265-S1268 WeakPolarHBondContact CA-OG 3.47Å; K1265-S1268 PolarHBondContact O-N 3.19Å; K1265-S1268 PolarHBondContact O-OG 2.67Å; S1268-K1270 PolarHBondContact O-N 3.23Å; S1268-K1271 PolarHBondContact O-N 3.43Å; S1268-S1272 PolarHBondContact O-N 2.94Å
1269	E	50.5	Low	47.9	Very low	82 Å²	82	119 Å²	119	38%	0.383	56%	0.555	S	S	.	*	H	α-helix	trans	-68	-32.1	177.2	-74.6	175.7	-173	0	0	114.2	K1265 I1266 S1272 R1273	K1265-E1269 WeakPolarHBondContact O-CB 3.18Å; K1265-E1269 WeakPolarHBondContact O-CG 3.21Å; K1265-E1269 PolarHBondContact O-N 3.36Å; I1266-E1269 PolarHBondContact O-N 3.39Å; E1269-S1272 WeakPolarHBondContact CA-OG 3.44Å; E1269-S1272 PolarHBondContact O-OG 3.31Å; E1269-R1273 WeakPolarHBondContact O-CB 3.43Å; E1269-R1273 WeakPolarHBondContact O-CG 3.32Å; E1269-R1273 PolarHBondContact O-N 3.42Å
1270	K	51.2	Low	47.4	Very low	144 Å²	144	129.5 Å²	129.5	63%	0.626	59%	0.594	S	S	*	*	H	α-helix	trans	-77.3	-30	173.7	-79.5	-174.9	177.4	178.3	0	112.5	I1266 S1268 K1274	I1266-K1270 HydrophobicContact CG2-CD 4.13Å; I1266-K1270 HydrophobicContact CG2-CG 4.29Å; I1266-K1270 WeakPolarHBondContact O-CB 3.11Å; I1266-K1270 WeakPolarHBondContact O-CG 3.47Å; I1266-K1270 PolarHBondContact O-N 3.37Å; S1268-K1270 PolarHBondContact O-N 3.23Å; K1270-K1274 WeakPolarHBondContact O-CB 3.4Å; K1270-K1274 PolarHBondContact O-N 3.21Å
1271	K	49.9	Very low	47.6	Very low	165 Å²	165	133.4 Å²	133.4	72%	0.717	61%	0.613	S	S	*	*	H	α-helix	trans	-64.7	-44.1	168.3	-85	-171.7	172.5	-172	0	110.1	K1267 S1268 K1274 C1275	K1267-K1271 PolarHBondContact O-N 3.16Å; S1268-K1271 PolarHBondContact O-N 3.43Å; K1271-K1274 PolarHBondContact O-N 3.06Å; K1271-C1275 PolarHBondContact O-N 3.35Å
1272	S	52.7	Low	47.7	Very low	62 Å²	62	132.1 Å²	132.1	43%	0.434	61%	0.606	S	S	.	*	H	α-helix	trans	-65.1	-41.1	176.4	68.6	0	0	0	0	112.7	S1268 E1269 K1274 C1275 N1276	S1268-S1272 PolarHBondContact O-N 2.94Å; E1269-S1272 WeakPolarHBondContact CA-OG 3.44Å; E1269-S1272 PolarHBondContact O-OG 3.31Å; S1272-K1274 PolarHBondContact O-N 3.24Å; S1272-C1275 PolarHBondContact O-N 3.08Å; S1272-N1276 PolarHBondContact O-N 3.16Å; S1272-N1276 VanDerWaalsContact O-N 3.11Å
1273	R	51.1	Low	48.1	Very low	183 Å²	183	134.8 Å²	134.8	69%	0.691	62%	0.622	S	S	*	*	H	α-helix	trans	-71.4	-27.2	176.3	-75	-176.2	177.8	170.2	2.2	114.6	E1269 K1277	E1269-R1273 WeakPolarHBondContact O-CB 3.43Å; E1269-R1273 WeakPolarHBondContact O-CG 3.32Å; E1269-R1273 PolarHBondContact O-N 3.42Å; R1273-K1277 PolarHBondContact O-N 3.03Å
1274	K	50.1	Low	48.5	Very low	166 Å²	166	136.8 Å²	136.8	72%	0.722	63%	0.633	S	S	*	*	H	α-helix	trans	-74.3	-38.9	171.8	-89.7	-168.7	170.5	-166.4	0	111.9	K1270 K1271 S1272 N1276 K1277 S1278	K1270-K1274 WeakPolarHBondContact O-CB 3.4Å; K1270-K1274 PolarHBondContact O-N 3.21Å; K1271-K1274 PolarHBondContact O-N 3.06Å; S1272-K1274 PolarHBondContact O-N 3.24Å; K1274-N1276 PolarHBondContact O-N 3.26Å; K1274-K1277 PolarHBondContact O-N 2.87Å; K1274-K1277 VanDerWaalsContact O-N 3.17Å; K1274-S1278 PolarHBondContact O-N 3.36Å
1275	C	47.4	Very low	48.4	Very low	82 Å²	82	133.3 Å²	133.3	55%	0.554	63%	0.627	S	S	*	*	H	α-helix	trans	-60	-32.6	170.5	-77.8	0	0	0	0	112.3	K1271 S1272 S1278	K1271-C1275 PolarHBondContact O-N 3.35Å; S1272-C1275 PolarHBondContact O-N 3.08Å; C1275-S1278 PolarHBondContact O-OG 3.12Å
1276	N	47.1	Very low	48.3	Very low	110 Å²	110	134.3 Å²	134.3	59%	0.588	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-11.8	177.1	-76.2	-2.8	0	0	0	115.2	S1272 K1274	S1272-N1276 PolarHBondContact O-N 3.16Å; S1272-N1276 VanDerWaalsContact O-N 3.11Å; K1274-N1276 PolarHBondContact O-N 3.26Å
1277	K	51	Low	48.6	Very low	178 Å²	178	139.3 Å²	139.3	77%	0.774	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-8.1	173.6	-86.5	-164.8	175.7	-167.1	0	114.3	R1273 K1274 R1279	R1273-K1277 PolarHBondContact O-N 3.03Å; K1274-K1277 PolarHBondContact O-N 2.87Å; K1274-K1277 VanDerWaalsContact O-N 3.17Å; K1277-R1279 VanDerWaalsContact C-N 3.33Å
1278	S	48.6	Very low	48.7	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	66%	0.658	S	S	*	*	S	Bend	trans	-90.3	-1.2	164.4	57.6	0	0	0	0	112.7	K1274 C1275	K1274-S1278 PolarHBondContact O-N 3.36Å; C1275-S1278 PolarHBondContact O-OG 3.12Å
1279	R	43.8	Very low	48.1	Very low	227 Å²	227	144.8 Å²	144.8	86%	0.857	67%	0.673	S	S	*	*			trans	-111.6	4.1	174.6	-86	-173.1	172.9	175.8	-2.2	113.8	K1277	K1277-R1279 VanDerWaalsContact C-N 3.33Å
1280	K	34.4	Very low	47.9	Very low	240 Å²	240	150.5 Å²	150.5	100%	1.043	70%	0.699	S	S	*	*			trans	-116.5	0	160.9	-76	-168.5	175.9	-167.7	0	106.7

Retrieved 1,280 of 1,280 residues in 599.8 ms (Link to these results)

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