A0A5K4FBN1_SCHMA Loading...

PLAT domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBN1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,531 aa.

						>A0A5K4FBN1_SCHMA|A0A5K4FBN1
MNLEDSTNDDYLKNSKSRFSFHRKEEKEHKGIICCGHNTCHLDRYNLISSVKPFTARPYTLYKVVLTTADVPGAGTSAQIYITLKGEWGSSTRQKLRKEKVPTRNLRFYFYPGSTNTFSVVSPDLGGLHSVFIEHDSLRKSDSWLLESVQVFHPLTKKRYMFMCNHWFSLYKEDGLIARELFGIRSAKTKYSIVTVTGDQEGSGTNSKVYITIYGRTGITPRIELSQENKSTGKDILCAPFGRGTSTKFIVKAPNVGAITNIRIKQDESGNEPHWFLERVVVTDMSYPQWTYYFHLSCWLSSKYGDGKSCRLVRGYREPTGTGVETEYKLTFYTSDQKDAGTTGEVYVKLYGEKDSSREIWVNSINQKNRRQPTSYHFTRGSTVEVYLPPCPQLGEITKLKVGHNRAGSSPSWFLNKVIVDDLRMNRVFEFPCYAWITKPSETIIVCQKSIKKEEKEIIWQKIPLEIRLYTGDVPNAGTTAKVYLRLSGPEQIAISKPPYPNYQITNTTVQKGFDKTLDHVDQKTTSENKEDVYTTPYIWLEDGNYDRNGVTLFSIDLPVPKFISPLSQLVIGHDNTGHSPSWFFDKVQIYCPLNGVEQTFLYRKWLTSSKPGMKVEQILCEEKSLRKCTDKKIPWEISVKTSPIANSYVTAAVSIIIFGSKDKTMKIQLDRSNLEVSSEWTKVSGNEVVEMFRPNVESKFRIYIKDIGIPCKLRIQHDNKGSNPNWHLQEIVLTNLRTHEQYEFYCNRWLSTREDDGSILREIPAKGPGITNPLPLYHYIIQIFTGNKPNSGTNANIFINIFGEKGDCGERWLGRSVNRNSELFQQNQMDEFVIEAVQLGSINKICIGHEERSPGYGWYLAKIVLTIKENPKYKLTFECYRWFDVGEDDGQIVRELFAHSSLSAIAYNVTVLTGTCRNAGTVANVFVHLYGLQGESKDMQLKHKETEITKFEAGKSEEFILACGKLGEIKKIKIWHDSIAPHSGWFLDEVVVIDYFLGRRYVFHVNRWLAKNEADGLISLDLQPTSIINIERMIPYEIIIFTGDRSGSQTKSIVTVQLYGTPLKRKTEIIRLSRTQHHFKFGQPETFRIFAPDIGPLQKLIVERDGTGLSDGWFLEKVLIRKPSNFFQKMNRSPTVSPVRSITRQISKDHMISQKDSNQLNVTQPDKNLDGSPSIISVPEELKDAEGAENYWFFFNAWLSKQHDNKQMNCETFSSTENGKPLQSLMESSYEVIVKTGGRKYAGTDSHVYITMFGINSESKEYHLANSKTHNNKFEQNHEDLFNLNAVGLGSLKKIRVRHTNTGIAPGWFLDYILIRESIEQKKMEYFFPCYQWLSATRLDGLVIRELSVASENIFERWKSGHDISDDSRLILEDQSTIYHVRIHTGSQSNISSDANVQIQLYGDKDFTGNIRLYKAYYGKEDILVNKFQAGQIANFIVKAINIGNIKKIRIEHDTAVGSARWFVERVEVEARKLGLLWKFECNRFITPQQPELILYPEPKDISFVKPMTNYQIKTFTSDISGAETTSSVYIQLYGNDSLPSSIRRLHQNNDSEQRFQRNKIDTFYVELEELQEPFSKLRIWHNDKGSSTDWHLNKVEIRKIKTNQYVFVTYIFPCNKWLSRNMDQAALERELIPSHMLQDQNGVLQFERQLSPKWLMNTYEVRITTGDKAYAGTDASVYITLFGENGDSGERKLTKSLTHRNKFERGQTDVFQLEIVDLGKINKVRIRHDNSGVNPSWYLSTIEVFNISKSQSVHGLKDQPNETHHLVKYIFNCEAWLSTEHDEKVLDRFFSAEIIKPQDLPGIVPKTSKDIVPHKLIQDLSQGKKALETIPYLITVITGSDRKAGTPGPVWISCVDKDKMNSEKFILCDCYNRTMLKRGTTRYFRFAGVKLNDLTEIQVGNDAPESPSMGWYIQSLYLSFPTIGKMYLFDCKEWLSTNRGNKKRTCNLKISNTNIVKFKPKITYHLKITTANVKRAGTDCSINLQIFGTNGVTNCYILEKTSNRFAQGITDNISLEMEDVGKLLKMRIGHDNQRKNKHWNLSCVEVTVANTNQLYRFVYDDWLSLTYGKRKSLWADLPAMIGDTVQLKETCLDIFVKTGNMPASSTDANVYVQLFGEYGDSGEILLKQTVSNQKPFQNNSIDHFKIPSILKLGNLARCRIWHDNKGSSPNWYCEWLEVKEVLIPGEKNLACNWKFAFNKWLSVSDDNKQLLRDAPCSEVYMNDSKGHRTIDQESIETLLTTADSMNISDLKDNPEGKLVYEVVIETGNLKDSGTTCDAWIILEGKHGRSPKLELVNQVGNPILQINQMNTFQLPSFPLGDLETIRLGIQERNINKQTNPNDIQSQKWFCEKVSIKDPVSKRTYIFTIHQWLSVTPTSNLKKDVLVNYSKIIEDPYKKAFNELKNKQTVMYKVSIYTGTKGCANTDANIFITMFSTTPGLNSGRIALKRENNNLFDRKQLDEFYVESIDLESIQRIIIEHDNTGVSPDWYLDKVLITNQTNNQIHLFQCYQWISKKKGDCRLWKELLVSN
					

Structure Viewer

Loading PAE data...

(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	30.9	Very low	32	Very low	225 Å²	225	140.7 Å²	140.7	100%	1.108	73%	0.73	S	S	*	*				0	81.6	0	-61	172.2	-171.1	0	0	106.1
2	N	26.5	Very low	31.7	Very low	133 Å²	133	138.1 Å²	138.1	71%	0.711	72%	0.717	S	S	*	*				80.5	102.7	56.7	-61	46.2	0	0	0	109.3
3	L	31.3	Very low	31.4	Very low	134 Å²	134	140.8 Å²	140.8	70%	0.702	72%	0.719	S	S	*	*				90.1	160.4	68	-74.9	157.8	0	0	0	109.6
4	E	35.5	Very low	31.1	Very low	150 Å²	150	140.6 Å²	140.6	70%	0.701	72%	0.721	S	S	*	*			cis	-153.7	174.9	12.7	-131.2	119.1	-159.5	0	0	107.5
5	D	39.2	Very low	31.2	Very low	123 Å²	123	137.9 Å²	137.9	66%	0.658	72%	0.719	S	S	*	*			cis	-140.8	-132.1	-2.7	-170.3	20.7	0	0	0	108.4
6	S	30.8	Very low	31	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	73%	0.732	S	S	*	*			cis	-165.7	167	-9.5	46.4	0	0	0	0	107.9
7	T	32.5	Very low	31.1	Very low	108 Å²	108	140.5 Å²	140.5	66%	0.663	73%	0.733	S	S	*	*			cis	-154	141	-23.8	25.7	0	0	0	0	105.5
8	N	33.1	Very low	30.8	Very low	125 Å²	125	144.7 Å²	144.7	67%	0.668	74%	0.738	S	S	*	*				90.1	153.8	51.2	-66.2	42.7	0	0	0	114.1
9	D	31.9	Very low	30.4	Very low	136 Å²	136	144.6 Å²	144.6	73%	0.727	73%	0.732	S	S	*	*			cis	-175.1	-177.5	-24.8	-90	-18.4	0	0	0	107.7
10	D	30.1	Very low	30	Very low	125 Å²	125	142.4 Å²	142.4	67%	0.668	73%	0.73	S	S	*	*			cis	-135.5	-116.5	-6.1	-165.6	-25	0	0	0	108.6
11	Y	30.1	Very low	29.7	Very low	195 Å²	195	142.3 Å²	142.3	77%	0.765	73%	0.725	S	S	*	*			cis	-161.2	157.7	-12.5	-113.4	-13.2	0	0	0	104.8
12	L	28.7	Very low	29.5	Very low	109 Å²	109	139.5 Å²	139.5	57%	0.571	71%	0.709	S	S	*	*			cis	-158.2	-147.1	-5.8	-123.2	167.4	0	0	0	105.5
13	K	27.2	Very low	29.8	Very low	173 Å²	173	144.5 Å²	144.5	75%	0.752	72%	0.718	S	S	*	*			cis	-160.4	124	3.6	-140.7	157.4	-169.4	171.7	0	111.5
14	N	27.4	Very low	29.7	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	72%	0.716	S	S	*	*			trans	28.6	158	134.6	-65.6	1	0	0	0	123.8
15	S	32.6	Very low	29.6	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	72%	0.717	S	S	*	*			cis	174.7	157.2	-18.8	59.3	0	0	0	0	109.9
16	K	29.1	Very low	29.1	Very low	214 Å²	214	146.6 Å²	146.6	93%	0.93	72%	0.717	S	S	*	*			trans	-161.3	169.3	152.7	-114.1	152.5	-171.6	172.2	0	113
17	S	31.3	Very low	28.9	Very low	107 Å²	107	149.1 Å²	149.1	75%	0.748	72%	0.717	S	S	*	*			trans	-169.1	157.1	-159.1	55.9	0	0	0	0	112.5
18	R	25.5	Very low	28.9	Very low	215 Å²	215	151.1 Å²	151.1	81%	0.811	72%	0.719	S	S	*	*			trans	170.4	144.5	148.8	-95.7	172.1	-177.9	-174.3	0.2	110
19	F	25	Very low	28.8	Very low	144 Å²	144	151.3 Å²	151.3	63%	0.632	72%	0.715	S	S	*	*			cis	-160.4	-166.6	-4	-119.1	168.6	0	0	0	107.3	F21	F19-F21 HydrophobicContact CD2-CD2 4.24Å; F19-F21 AromaticContact CD2-CE2 3.78Å; F19-F21 HydrophobicContact CD2-CE2 3.78Å; F19-F21 HydrophobicContact CE1-CE2 4.35Å; F19-F21 HydrophobicContact CE2-CD2 4.33Å; F19-F21 AromaticContact CE2-CE2 3.46Å; F19-F21 HydrophobicContact CE2-CE2 3.46Å; F19-F21 VanDerWaalsContact CE2-CE2 3.46Å; F19-F21 HydrophobicContact CE2-CZ 4.09Å; F19-F21 HydrophobicContact CG-CE2 4.4Å; F19-F21 AromaticContact CZ-CE2 3.78Å; F19-F21 HydrophobicContact CZ-CE2 3.78Å
20	S	22.2	Very low	29.5	Very low	100 Å²	100	152.9 Å²	152.9	70%	0.699	72%	0.716	S	S	*	*			cis	-179.6	160.4	0.2	35.2	0	0	0	0	107.7
21	F	23.9	Very low	30.1	Very low	140 Å²	140	150.1 Å²	150.1	61%	0.614	72%	0.717	S	S	*	*			cis	-169.1	147.4	-23.2	-114.7	-63	0	0	0	110.2	F19	F19-F21 HydrophobicContact CD2-CD2 4.24Å; F19-F21 AromaticContact CD2-CE2 3.78Å; F19-F21 HydrophobicContact CD2-CE2 3.78Å; F19-F21 HydrophobicContact CE1-CE2 4.35Å; F19-F21 HydrophobicContact CE2-CD2 4.33Å; F19-F21 AromaticContact CE2-CE2 3.46Å; F19-F21 HydrophobicContact CE2-CE2 3.46Å; F19-F21 VanDerWaalsContact CE2-CE2 3.46Å; F19-F21 HydrophobicContact CE2-CZ 4.09Å; F19-F21 HydrophobicContact CG-CE2 4.4Å; F19-F21 AromaticContact CZ-CE2 3.78Å; F19-F21 HydrophobicContact CZ-CE2 3.78Å
22	H	26.1	Very low	30.5	Very low	166 Å²	166	148.3 Å²	148.3	77%	0.769	72%	0.718	S	S	*	*			trans	67.6	159.7	158.2	-66.4	-30.9	0	0	0	120.3
23	R	31.5	Very low	31.1	Very low	238 Å²	238	150.3 Å²	150.3	90%	0.898	73%	0.728	S	S	*	*			cis	-131.5	-136	19.3	-147.1	-179.7	-175.7	-167.1	0.9	117
24	K	30.9	Very low	31.8	Very low	155 Å²	155	147.3 Å²	147.3	67%	0.674	73%	0.728	S	S	*	*			trans	-157.1	164.2	-136.9	-160.2	-159.5	-179.3	-152.1	0	116.2
25	E	33.2	Very low	31.9	Very low	153 Å²	153	147.1 Å²	147.1	72%	0.715	74%	0.736	S	S	*	*			trans	86.3	-168.3	144	-139.5	131.5	-113.7	0	0	123.1
26	E	29.1	Very low	31.5	Very low	143 Å²	143	145.7 Å²	145.7	67%	0.668	74%	0.737	S	S	*	*			trans	-91.4	162.4	-142.9	-141.6	-155.5	172.8	0	0	116
27	K	26.1	Very low	31.5	Very low	147 Å²	147	144.3 Å²	144.3	64%	0.639	73%	0.733	S	S	*	*			trans	44.1	128.1	160.7	-78.6	-172.6	-175.6	87.4	0	119.3
28	E	31.5	Very low	32	Very low	151 Å²	151	145.8 Å²	145.8	71%	0.706	73%	0.733	S	S	*	*			trans	31.5	119.4	132.1	-67.4	-164.1	117.6	0	0	117.5
29	H	31.6	Very low	32.1	Very low	128 Å²	128	139.9 Å²	139.9	59%	0.593	72%	0.721	S	S	*	*				177.8	154.1	58.2	-116.9	-7.4	0	0	0	108.3
30	K	47	Very low	32.7	Very low	170 Å²	170	138.4 Å²	138.4	74%	0.739	73%	0.727	S	S	*	*			cis	-135.2	33.9	5.7	-56.7	-172.9	-176.1	-104	0	110.7
31	G	42.8	Very low	33	Very low	67 Å²	67	140.1 Å²	140.1	69%	0.691	72%	0.724	S	S	*	*			trans	87.5	-173	-163.8	0	0	0	0	0	112.5
32	I	38.9	Very low	33.2	Very low	156 Å²	156	139.3 Å²	139.3	80%	0.8	73%	0.725	S	S	*	*			trans	72	106.1	167.7	-52.6	-179.5	0	0	0	117.4
33	I	41	Very low	33.2	Very low	151 Å²	151	136.3 Å²	136.3	77%	0.774	72%	0.715	S	S	*	*			trans	76.7	157.3	147.1	-65.2	173.2	0	0	0	120.2
34	C	41.7	Very low	32.8	Very low	111 Å²	111	133.1 Å²	133.1	75%	0.75	70%	0.703	S	S	*	*			trans	-86.6	171.5	-169	-37.5	0	0	0	0	115.6
35	C	29.8	Very low	32.7	Very low	135 Å²	135	134.1 Å²	134.1	91%	0.912	70%	0.703	S	S	*	*			trans	-161.8	149.9	146.9	-93.7	0	0	0	0	107.6
36	G	23.5	Very low	32.3	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	71%	0.705	S	S	*	*	S	Bend	cis	179.2	166.3	-6.2	0	0	0	0	0	107.1
37	H	29.9	Very low	32.2	Very low	184 Å²	184	133.5 Å²	133.5	85%	0.852	71%	0.709	S	S	*	*	S	Bend	cis	-78.9	161.2	5.2	-74.3	82.3	0	0	0	114.2
38	N	40.2	Very low	32.3	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	72%	0.715	S	S	*	*			trans	55.6	96.2	164.7	-64.1	13.6	0	0	0	114.9
39	T	28.7	Very low	32	Very low	92 Å²	92	131 Å²	131	56%	0.564	71%	0.713	S	S	*	*			cis	42.1	94.4	36.5	46.5	0	0	0	0	110.7
40	C	37.9	Very low	31.7	Very low	113 Å²	113	128.4 Å²	128.4	76%	0.764	71%	0.71	S	S	*	*				-138.5	148.4	70.9	-82.6	0	0	0	0	111.3
41	H	28.6	Very low	30.8	Very low	135 Å²	135	127.5 Å²	127.5	63%	0.625	72%	0.718	S	S	*	*				62.1	138.3	57.1	-57.3	-47.5	0	0	0	111.2
42	L	28.1	Very low	30.2	Very low	123 Å²	123	129.9 Å²	129.9	64%	0.644	71%	0.71	S	S	*	*			cis	-156.1	163.1	6.2	-145.1	70.5	0	0	0	109.2
43	D	25.6	Very low	29.8	Very low	103 Å²	103	127.5 Å²	127.5	55%	0.551	70%	0.704	S	S	*	*				35.4	151.1	128.1	-70.3	3.5	0	0	0	122.3
44	R	23.6	Very low	29.4	Very low	172 Å²	172	127.6 Å²	127.6	65%	0.649	70%	0.699	S	S	*	*			cis	-163.5	160.6	14.9	-126	159.9	-143.3	-175.7	16.4	112.8
45	Y	27.2	Very low	29.1	Very low	175 Å²	175	124.2 Å²	124.2	69%	0.686	68%	0.675	S	S	*	*			trans	49.9	118.5	152.8	-58.9	-36.7	0	0	0	119.6
46	N	25.3	Very low	29.7	Very low	139 Å²	139	121.6 Å²	121.6	74%	0.743	66%	0.663	S	S	*	*				64.3	136.5	76.5	-64	-12.3	0	0	0	112.2
47	L	26.6	Very low	31	Very low	144 Å²	144	122.3 Å²	122.3	75%	0.754	64%	0.644	S	S	*	*			cis	-146.2	146.3	45	-91.7	81.1	0	0	0	114.6
48	I	29.2	Very low	32.3	Very low	150 Å²	150	118.5 Å²	118.5	77%	0.769	64%	0.636	S	S	*	*			trans	60.1	150.8	135.5	-59	-176.3	0	0	0	120.9
49	S	24.8	Very low	33.7	Very low	96 Å²	96	119.4 Å²	119.4	67%	0.671	63%	0.63	S	S	*	*				-172.7	167.9	-74.6	61.9	0	0	0	0	113
50	S	25.6	Very low	36	Very low	74 Å²	74	115.7 Å²	115.7	52%	0.517	61%	0.607	S	S	.	*			trans	86.6	84.4	149.8	76.3	0	0	0	0	123.1	K1323	S50-K1323 PolarHBondContact O-NZ 2.8Å; S50-K1323 PolarHBondContact OG-NZ 3.07Å
51	V	28.4	Very low	38.2	Very low	151 Å²	151	114.8 Å²	114.8	92%	0.915	59%	0.594	S	S	*	*			trans	-140.1	149.9	130.8	-175.4	0	0	0	0	107.9
52	K	28.6	Very low	40.9	Very low	117 Å²	117	108.3 Å²	108.3	51%	0.509	56%	0.564	S	S	.	*			trans	-140.3	151.2	-172.4	-132.5	-159.9	171.2	-155.1	0	113.8	L1170 D1171	K52-L1170 HydrophobicContact CD-CD1 4.34Å; K52-L1170 HydrophobicContact CD-CD2 3.59Å; K52-D1171 IonicContact NZ-OD1 2.73Å; K52-D1171 PolarHBondContact NZ-OD1 2.89Å; K52-D1171 IonicContact NZ-OD2 2.88Å; K52-D1171 PolarHBondContact NZ-OD2 3.4Å
53	P	31.2	Very low	43.6	Very low	105 Å²	105	107.5 Å²	107.5	68%	0.682	56%	0.556	S	S	*	*			trans	-121.8	178.1	-172.1	43.3	-32.1	0	0	0	117	T55	P53-T55 PolarHBondContact O-N 3.35Å
54	F	32.2	Very low	46.7	Very low	153 Å²	153	102.6 Å²	102.6	67%	0.671	53%	0.529	S	S	*	.			trans	-73.8	91	-176.5	-78.6	-85.5	0	0	0	116.7	P1174	F54-P1174 HydrophobicContact CB-CG 3.87Å; F54-P1174 HydrophobicContact CD1-CB 3.92Å; F54-P1174 HydrophobicContact CD1-CG 3.95Å; F54-P1174 HydrophobicContact CE1-CB 4.16Å; F54-P1174 HydrophobicContact CG-CB 4.34Å; F54-P1174 HydrophobicContact CG-CG 4.05Å
55	T	36.1	Very low	49.6	Very low	40 Å²	40	95.9 Å²	95.9	25%	0.245	51%	0.507	C	S	.	.				18.4	152.9	120.5	150.4	0	0	0	0	121.9	P53 D1171 G1172 S1173 P1174	P53-T55 PolarHBondContact O-N 3.35Å; T55-D1171 WeakPolarHBondContact CB-O 3.27Å; T55-D1171 VanDerWaalsContact CG2-C 3.42Å; T55-D1171 HydrophobicContact CG2-CB 4.07Å; T55-D1171 PolarHBondContact OG1-O 3.16Å; T55-G1172 WeakPolarHBondContact CG2-O 3.39Å; T55-G1172 VanDerWaalsContact OG1-C 3.27Å; T55-S1173 WeakPolarHBondContact O-CA 3.22Å; T55-S1173 WeakPolarHBondContact O-CB 3.31Å; T55-S1173 PolarHBondContact O-OG 3.43Å; T55-S1173 WeakPolarHBondContact OG1-CA 3.27Å; T55-S1173 PolarHBondContact OG1-N 2.85Å; T55-S1173 VanDerWaalsContact OG1-N 3.12Å; T55-S1173 PolarHBondContact OG1-OG 3.3Å; T55-P1174 WeakPolarHBondContact O-CD 3.43Å
56	A	42.1	Very low	52.5	Low	80 Å²	80	87.6 Å²	87.6	66%	0.661	48%	0.475	S	S	*	.			trans	-133.8	165.8	-163.6	0	0	0	0	0	117.4	S1173	A56-S1173 VanDerWaalsContact C-OG 3.27Å; A56-S1173 WeakPolarHBondContact CA-OG 3.32Å; A56-S1173 PolarHBondContact N-OG 3.04Å; A56-S1173 PolarHBondContact O-OG 3.02Å
57	R	52	Low	55.2	Low	85 Å²	85	81.3 Å²	81.3	32%	0.321	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-89.4	157.6	-178.6	-62.6	-174.2	-159.7	157.3	6	113.9	W88 P123	R57-W88 PolarHBondContact NH1-O 3.38Å; R57-P123 HydrophobicContact CB-CB 4.28Å
58	P	57.3	Low	57.9	Low	104 Å²	104	74.5 Å²	74.5	68%	0.675	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-68.8	143.8	178.1	28.4	-36.5	0	0	0	114	P123 D124	P58-P123 WeakPolarHBondContact O-CA 3.44Å; P58-D124 PolarHBondContact O-N 3.06Å; P58-D124 VanDerWaalsContact O-N 3.15Å
59	Y	69.2	Low	60	Low	157 Å²	157	67.4 Å²	67.4	62%	0.616	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.7	-180	-72.1	-99	0	0	0	112.9	V121 S122 P123	Y59-V121 HydrophobicContact CD1-CG1 3.85Å; Y59-V121 HydrophobicContact CG-CG1 4.31Å; Y59-S122 CarbonylContact C-O 3.57Å; Y59-S122 WeakPolarHBondContact CA-O 3.26Å; Y59-P123 HydrophobicContact CD1-CG 4.12Å; Y59-P123 HydrophobicContact CE1-CG 3.84Å
60	T	77.3	Confident	62.5	Low	13 Å²	13	63.9 Å²	63.9	8%	0.08	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.8	-178.2	-72.7	0	0	0	0	110.9	Y62 S122 P154	T60-Y62 HydrophobicContact CG2-CD2 4.11Å; T60-Y62 HydrophobicContact CG2-CE1 4.3Å; T60-Y62 HydrophobicContact CG2-CE2 3.72Å; T60-Y62 PolarHBondContact O-N 2.89Å; T60-S122 PolarHBondContact N-O 3.29Å; T60-S122 PolarHBondContact O-N 2.96Å; T60-P154 HydrophobicContact CG2-CG 3.61Å
61	L	82.8	Confident	64.1	Low	94 Å²	94	61.7 Å²	61.7	49%	0.492	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	83	-176.6	-171	74.3	0	0	0	112	K63 V120 V121 P154	L61-K63 PolarHBondContact O-N 3.41Å; L61-V120 CarbonylContact C-O 3.55Å; L61-V120 WeakPolarHBondContact CA-O 3.45Å; L61-V121 HydrophobicContact CD1-CG2 3.45Å; L61-V121 VanDerWaalsContact CD1-CG2 3.45Å; L61-P154 VanDerWaalsContact O-CD 3.31Å; L61-P154 WeakPolarHBondContact O-CD 3.34Å; L61-P154 VanDerWaalsContact O-CG 3.23Å; L61-P154 WeakPolarHBondContact O-CG 3.49Å
62	Y	86.4	Confident	65.7	Low	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	128.8	177	-64.4	-88.9	0	0	0	111	T60 L84 S119 V120 D124 L125 L128 V151 H153	T60-Y62 HydrophobicContact CG2-CD2 4.11Å; T60-Y62 HydrophobicContact CG2-CE1 4.3Å; T60-Y62 HydrophobicContact CG2-CE2 3.72Å; T60-Y62 PolarHBondContact O-N 2.89Å; Y62-L84 HydrophobicContact CD1-CD1 4.37Å; Y62-L84 HydrophobicContact CD2-CD1 3.94Å; Y62-L84 HydrophobicContact CG-CD1 3.75Å; Y62-S119 CarbonylContact O-C 3.51Å; Y62-S119 WeakPolarHBondContact O-CA 3.4Å; Y62-V120 PolarHBondContact N-O 2.96Å; Y62-V120 PolarHBondContact O-N 2.72Å; Y62-D124 PolarHBondContact OH-OD1 3.24Å; Y62-L125 HydrophobicContact CE2-CG 4.44Å; Y62-L125 PolarHBondContact OH-N 3.48Å; Y62-L128 HydrophobicContact CD1-CD1 4.3Å; Y62-L128 HydrophobicContact CE1-CD1 4.48Å; Y62-V151 HydrophobicContact CD1-CG1 4.32Å; Y62-H153 HydrophobicContact CD1-CB 4.15Å; Y62-H153 HydrophobicContact CE1-CB 4.01Å; Y62-H153 AromaticContact CE1-CD2 3.78Å; Y62-H153 AromaticContact CE1-CG 3.6Å; Y62-H153 AromaticContact CE1-ND1 3.81Å
63	K	85.2	Confident	67.6	Low	106 Å²	106	56.4 Å²	56.4	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	116	179.4	-173.9	168	-175.7	163.6	0	110	L61 T117 F118 F152	L61-K63 PolarHBondContact O-N 3.41Å; K63-T117 HydrophobicContact CD-CG2 4.35Å; K63-T117 VanDerWaalsContact CE-CG2 3.44Å; K63-T117 HydrophobicContact CG-CG2 3.98Å; K63-F118 CarbonylContact C-O 3.48Å; K63-F118 WeakPolarHBondContact CA-O 3.27Å; K63-F152 HydrophobicContact CB-CB 4.29Å; K63-F152 HydrophobicContact CB-CD1 4.13Å; K63-F152 PolarHBondContact N-O 3.48Å; K63-F152 PolarHBondContact O-N 3Å
64	V	88.7	Confident	69.6	Low	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.1	-173.6	-175.7	0	0	0	0	109.9	L66 I82 L96 T117 F118 V120 V149 Q150 V151	V64-L66 HydrophobicContact CG1-CD1 3.74Å; V64-L66 HydrophobicContact CG1-CG 4.25Å; V64-I82 HydrophobicContact CG1-CD1 3.7Å; V64-I82 HydrophobicContact CG2-CD1 4.12Å; V64-L96 HydrophobicContact CB-CD2 4.21Å; V64-L96 HydrophobicContact CG1-CD2 4.24Å; V64-T117 CarbonylContact O-C 3.53Å; V64-T117 VanDerWaalsContact O-CA 3.31Å; V64-T117 WeakPolarHBondContact O-CA 3.44Å; V64-F118 PolarHBondContact N-O 2.93Å; V64-F118 PolarHBondContact O-N 3.08Å; V64-V120 HydrophobicContact CB-CG2 4.47Å; V64-V120 HydrophobicContact CG2-CB 4.25Å; V64-V120 HydrophobicContact CG2-CG2 3.58Å; V64-V149 HydrophobicContact CG1-CG1 3.87Å; V64-Q150 CarbonylContact C-O 3.6Å; V64-Q150 WeakPolarHBondContact CA-O 3.33Å; V64-V151 HydrophobicContact CG1-CG2 4.37Å; V64-V151 HydrophobicContact CG2-CG1 4.22Å; V64-V151 HydrophobicContact CG2-CG2 4.25Å
65	V	84.9	Confident	71.6	Confident	31 Å²	31	44.1 Å²	44.1	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.6	173.4	-170.3	0	0	0	0	107.9	T115 N116 T117 V149 Q150	V65-T115 HydrophobicContact CG1-CG2 3.47Å; V65-T115 VanDerWaalsContact CG1-CG2 3.47Å; V65-N116 CarbonylContact C-O 3.57Å; V65-N116 VanDerWaalsContact CA-O 3.28Å; V65-N116 WeakPolarHBondContact CA-O 3.16Å; V65-T117 HydrophobicContact CG2-CG2 4.08Å; V65-V149 CarbonylContact O-C 3.5Å; V65-V149 WeakPolarHBondContact O-CA 3.38Å; V65-Q150 HydrophobicContact CB-CB 4.21Å; V65-Q150 PolarHBondContact N-O 2.98Å; V65-Q150 PolarHBondContact O-N 3.16Å
66	L	88	Confident	73.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.1	175.7	-54.5	94.1	0	0	0	109.4	V64 I80 L96 F110 T115 N116 F118 I133 W144 L146 S148 V149	V64-L66 HydrophobicContact CG1-CD1 3.74Å; V64-L66 HydrophobicContact CG1-CG 4.25Å; L66-I80 HydrophobicContact CD2-CG2 4.34Å; L66-L96 HydrophobicContact CD1-CD1 3.68Å; L66-L96 HydrophobicContact CD1-CD2 4.27Å; L66-L96 HydrophobicContact CD2-CD1 3.83Å; L66-L96 HydrophobicContact CG-CD1 4.45Å; L66-F110 HydrophobicContact CB-CE1 4.42Å; L66-T115 CarbonylContact O-C 3.53Å; L66-T115 WeakPolarHBondContact O-CA 3.39Å; L66-N116 PolarHBondContact N-O 3.08Å; L66-N116 PolarHBondContact O-N 3.29Å; L66-F118 HydrophobicContact CD1-CD2 3.38Å; L66-F118 HydrophobicContact CD1-CE2 3.38Å; L66-I133 HydrophobicContact CD2-CD1 3.5Å; L66-W144 HydrophobicContact CB-CZ2 4.28Å; L66-W144 HydrophobicContact CD2-CH2 3.61Å; L66-W144 HydrophobicContact CD2-CZ2 4.09Å; L66-L146 HydrophobicContact CB-CD1 4.47Å; L66-S148 WeakPolarHBondContact CA-O 3.34Å; L66-V149 HydrophobicContact CD2-CG2 4.17Å; L66-V149 HydrophobicContact CG-CG1 4.27Å; L66-V149 HydrophobicContact CG-CG2 4.46Å
67	T	82.8	Confident	75.6	Confident	8 Å²	8	39.4 Å²	39.4	5%	0.049	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.6	178.5	-63	0	0	0	0	109.9	S114 T115 L146 E147 S148	T67-S114 CarbonylContact C-O 3.58Å; T67-S114 WeakPolarHBondContact CA-O 3.15Å; T67-T115 WeakPolarHBondContact CG2-OG1 3.38Å; T67-T115 WeakPolarHBondContact OG1-CG2 3.49Å; T67-T115 PolarHBondContact OG1-OG1 3.37Å; T67-L146 WeakPolarHBondContact O-CD1 3.48Å; T67-E147 HydrophobicContact CG2-CB 4.02Å; T67-E147 VanDerWaalsContact CG2-OE1 3.29Å; T67-E147 WeakPolarHBondContact CG2-OE1 3.41Å; T67-E147 WeakPolarHBondContact O-CA 3.48Å; T67-E147 WeakPolarHBondContact O-CB 3.39Å; T67-E147 PolarHBondContact O-N 2.83Å; T67-S148 PolarHBondContact N-O 3.25Å; T67-S148 PolarHBondContact O-N 3.12Å
68	T	82.8	Confident	76.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.3	178.7	-52.9	0	0	0	0	109.4	A74 Y111 G113 S114 W144	T68-A74 WeakPolarHBondContact CG2-O 3.17Å; T68-Y111 WeakPolarHBondContact CB-O 3.31Å; T68-Y111 WeakPolarHBondContact CG2-O 3.19Å; T68-G113 CarbonylContact O-C 3.59Å; T68-G113 WeakPolarHBondContact O-CA 3.42Å; T68-G113 PolarHBondContact O-N 3.47Å; T68-S114 PolarHBondContact N-O 3.05Å; T68-S114 PolarHBondContact OG1-OG 2.9Å; T68-W144 VanDerWaalsContact CG2-CD1 3.47Å; T68-W144 PolarHBondContact OG1-NE1 2.76Å
69	A	73.8	Confident	78	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.008	18%	0.18	C	C	.	.			trans	-68.7	146.9	-175.7	0	0	0	0	0	113.2	V71 A74 P112 G113 L145 E147	A69-V71 PolarHBondContact O-N 3.26Å; A69-A74 WeakPolarHBondContact O-CB 3.16Å; A69-P112 WeakPolarHBondContact O-CA 3.3Å; A69-G113 PolarHBondContact O-N 3.18Å; A69-G113 VanDerWaalsContact O-N 3.08Å; A69-L145 HydrophobicContact CB-CB 3.93Å; A69-L145 HydrophobicContact CB-CD2 3.66Å; A69-L145 HydrophobicContact CB-CG 3.58Å; A69-L145 WeakPolarHBondContact CB-O 3.45Å; A69-L145 PolarHBondContact N-O 3.19Å; A69-E147 WeakPolarHBondContact CA-OE2 3.16Å; A69-E147 HydrophobicContact CB-CB 4.33Å; A69-E147 HydrophobicContact CB-CG 4.36Å
70	D	76.4	Confident	78.8	Confident	22 Å²	22	26 Å²	26	12%	0.118	15%	0.151	C	C	.	.	S	Bend	trans	-83	42.8	-176.9	-179.3	64.2	0	0	0	113.3	R222 R263	D70-R222 HydrophobicContact CB-CB 4.47Å; D70-R222 WeakPolarHBondContact OD1-CD 3.43Å; D70-R222 IonicContact OD1-NH1 2.82Å; D70-R222 PolarHBondContact OD1-NH1 3.05Å; D70-R222 VanDerWaalsContact OD2-CD 3.29Å; D70-R222 WeakPolarHBondContact OD2-CD 3.29Å; D70-R263 PolarHBondContact O-NH1 2.99Å; D70-R263 IonicContact OD2-NH1 3.07Å
71	V	60.9	Low	79.4	Confident	28 Å²	28	26.4 Å²	26.4	17%	0.17	15%	0.151	C	C	.	.	S	Bend	trans	-102.4	149.9	171.5	-64.6	0	0	0	0	111.5	A69 G73 A74 P112 L145 W167 R263	A69-V71 PolarHBondContact O-N 3.26Å; V71-G73 PolarHBondContact O-N 2.88Å; V71-A74 HydrophobicContact CG2-CB 3.36Å; V71-A74 PolarHBondContact O-N 2.81Å; V71-P112 WeakPolarHBondContact O-CB 3.33Å; V71-L145 HydrophobicContact CG2-CB 4.48Å; V71-L145 HydrophobicContact CG2-CD2 3.75Å; V71-W167 HydrophobicContact CG2-CH2 3.72Å; V71-W167 HydrophobicContact CG2-CZ2 3.74Å; V71-R263 VanDerWaalsContact CG1-NH2 3.28Å
72	P	61.5	Low	79.8	Confident	128 Å²	128	21.9 Å²	21.9	83%	0.831	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	122.3	174.5	-26.1	35.4	0	0	0	111.8
73	G	68.5	Low	80.1	Confident	30 Å²	30	22.7 Å²	22.7	31%	0.309	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	38.5	-179	0	0	0	0	0	114.8	V71 W167 K172	V71-G73 PolarHBondContact O-N 2.88Å; G73-W167 WeakPolarHBondContact O-CH2 3.37Å; G73-W167 VanDerWaalsContact O-CZ3 3.22Å; G73-W167 WeakPolarHBondContact O-CZ3 3.42Å; G73-K172 PolarHBondContact O-NZ 2.77Å
74	A	72.4	Confident	80.3	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.11	C	C	.	.			trans	-103.3	-5.1	163.5	0	0	0	0	0	115	T68 A69 V71 L145 W167	T68-A74 WeakPolarHBondContact CG2-O 3.17Å; A69-A74 WeakPolarHBondContact O-CB 3.16Å; V71-A74 HydrophobicContact CG2-CB 3.36Å; V71-A74 PolarHBondContact O-N 2.81Å; A74-L145 HydrophobicContact CB-CB 3.63Å; A74-L145 PolarHBondContact O-N 2.73Å; A74-W167 HydrophobicContact CB-CH2 3.78Å; A74-W167 HydrophobicContact CB-CZ3 3.93Å
75	G	75.1	Confident	80	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.121	C	C	.	.			trans	-76	156.2	177.5	0	0	0	0	0	112.2	F110 D142	G75-F110 CarbonylContact C-O 3.58Å; G75-F110 WeakPolarHBondContact CA-O 3.36Å; G75-D142 CarbonylContact O-C 3.54Å; G75-D142 WeakPolarHBondContact O-CA 3.46Å
76	T	83.9	Confident	79.8	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-137.2	134.1	-176.5	-164.1	0	0	0	0	114.8	A78 I80 Y109 F110 D142 W144	T76-A78 VanDerWaalsContact C-N 3.3Å; T76-A78 WeakPolarHBondContact OG1-CB 3.5Å; T76-A78 PolarHBondContact OG1-N 3.42Å; T76-I80 HydrophobicContact CG2-CD1 3.77Å; T76-I80 HydrophobicContact CG2-CG1 4.35Å; T76-Y109 VanDerWaalsContact C-CE2 3.42Å; T76-Y109 WeakPolarHBondContact O-CD2 3.39Å; T76-F110 HydrophobicContact CG2-CB 3.74Å; T76-F110 HydrophobicContact CG2-CD2 3.92Å; T76-F110 HydrophobicContact CG2-CG 4.04Å; T76-F110 PolarHBondContact N-O 2.63Å; T76-F110 PolarHBondContact O-N 2.79Å; T76-D142 WeakPolarHBondContact CA-O 3.3Å; T76-D142 WeakPolarHBondContact CB-O 3.31Å; T76-D142 PolarHBondContact OG1-O 2.75Å; T76-W144 HydrophobicContact CG2-CB 3.98Å; T76-W144 VanDerWaalsContact CG2-CD1 3.43Å; T76-W144 HydrophobicContact CG2-CD2 4.02Å; T76-W144 HydrophobicContact CG2-CG 3.57Å
77	S	77.5	Confident	79.1	Confident	21 Å²	21	24.5 Å²	24.5	15%	0.147	14%	0.14	C	C	.	.			trans	-82.9	-8.1	161.2	-40.1	0	0	0	0	112.7	Y109 D142	S77-Y109 VanDerWaalsContact N-CD2 3.31Å; S77-Y109 VanDerWaalsContact N-CE2 3.34Å; S77-Y109 VanDerWaalsContact OG-CD2 3.23Å; S77-Y109 WeakPolarHBondContact OG-CD2 3.29Å; S77-Y109 WeakPolarHBondContact OG-CE2 3.4Å; S77-D142 WeakPolarHBondContact CB-OD1 3.08Å; S77-D142 VanDerWaalsContact CB-OD2 3.27Å; S77-D142 WeakPolarHBondContact CB-OD2 3.32Å; S77-D142 PolarHBondContact N-OD1 3.12Å; S77-D142 PolarHBondContact OG-OD1 2.77Å; S77-D142 PolarHBondContact OG-OD2 3.31Å
78	A	77.7	Confident	78.4	Confident	2 Å²	2	30.2 Å²	30.2	2%	0.017	16%	0.161	C	C	.	.	S	Bend	trans	-66.4	154.6	-172.4	0	0	0	0	0	111.7	T76 I80 H135 T2239	T76-A78 VanDerWaalsContact C-N 3.3Å; T76-A78 WeakPolarHBondContact OG1-CB 3.5Å; T76-A78 PolarHBondContact OG1-N 3.42Å; A78-I80 WeakPolarHBondContact O-CG1 3Å; A78-I80 PolarHBondContact O-N 2.72Å; A78-H135 HydrophobicContact CB-CB 3.79Å; A78-T2239 HydrophobicContact CB-CG2 4.34Å
79	Q	81.8	Confident	77.8	Confident	63 Å²	63	32 Å²	32	29%	0.294	18%	0.178	S	C	.	.			trans	-103.9	66.4	-163.9	-70.5	-157.7	-24.9	0	0	110.4	Y81 D136 T2243	Q79-Y81 WeakPolarHBondContact O-CD2 3.24Å; Q79-Y81 WeakPolarHBondContact O-CE2 3.35Å; Q79-Y81 PolarHBondContact O-N 2.87Å; Q79-D136 PolarHBondContact N-OD1 3.24Å; Q79-T2243 HydrophobicContact CB-CG2 3.85Å
80	I	86.9	Confident	78	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.2	C	C	.	.			trans	-44.2	123.9	-170.3	-36.4	-167.7	0	0	0	112.1	L66 T76 A78 L96 F110 I133 H135 W144	L66-I80 HydrophobicContact CD2-CG2 4.34Å; T76-I80 HydrophobicContact CG2-CD1 3.77Å; T76-I80 HydrophobicContact CG2-CG1 4.35Å; A78-I80 WeakPolarHBondContact O-CG1 3Å; A78-I80 PolarHBondContact O-N 2.72Å; I80-L96 HydrophobicContact CB-CD1 4.02Å; I80-L96 HydrophobicContact CG2-CD1 3.96Å; I80-L96 WeakPolarHBondContact O-CB 3.46Å; I80-L96 PolarHBondContact O-N 3.44Å; I80-F110 HydrophobicContact CB-CZ 4.36Å; I80-F110 HydrophobicContact CD1-CD1 3.96Å; I80-F110 HydrophobicContact CD1-CD2 3.76Å; I80-F110 HydrophobicContact CD1-CE1 3.64Å; I80-F110 HydrophobicContact CD1-CE2 3.45Å; I80-F110 VanDerWaalsContact CD1-CE2 3.45Å; I80-F110 HydrophobicContact CD1-CG 4.01Å; I80-F110 HydrophobicContact CD1-CZ 3.37Å; I80-F110 HydrophobicContact CG1-CD2 4.24Å; I80-F110 HydrophobicContact CG1-CE2 3.63Å; I80-F110 HydrophobicContact CG1-CZ 3.78Å; I80-I133 HydrophobicContact CG2-CG2 4.21Å; I80-H135 HydrophobicContact CG1-CB 4.34Å; I80-W144 HydrophobicContact CD1-CD2 3.88Å; I80-W144 HydrophobicContact CD1-CE3 3.92Å; I80-W144 HydrophobicContact CD1-CH2 3.35Å; I80-W144 HydrophobicContact CD1-CZ2 3.26Å; I80-W144 HydrophobicContact CD1-CZ3 3.67Å; I80-W144 HydrophobicContact CG1-CH2 4.43Å; I80-W144 HydrophobicContact CG1-CZ3 4.46Å; I80-W144 HydrophobicContact CG2-CH2 3.7Å; I80-W144 HydrophobicContact CG2-CZ3 3.63Å
81	Y	89.8	Confident	78.3	Confident	20 Å²	20	34.3 Å²	34.3	8%	0.078	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	156.7	171.4	-68.4	-107.4	0	0	0	110.2	Q79 R93 Q94 K95 E134 D136 T2242 T2243	Q79-Y81 WeakPolarHBondContact O-CD2 3.24Å; Q79-Y81 WeakPolarHBondContact O-CE2 3.35Å; Q79-Y81 PolarHBondContact O-N 2.87Å; Y81-R93 HydrophobicContact CD1-CG 3.78Å; Y81-R93 HydrophobicContact CE1-CG 4.48Å; Y81-R93 VanDerWaalsContact CE1-NH1 3.32Å; Y81-R93 HydrophobicContact CG-CG 4.31Å; Y81-R93 VanDerWaalsContact CZ-NH1 3.27Å; Y81-Q94 CarbonylContact C-O 3.56Å; Y81-Q94 VanDerWaalsContact CA-O 3.26Å; Y81-Q94 WeakPolarHBondContact CA-O 3.42Å; Y81-K95 HydrophobicContact CD1-CB 3.8Å; Y81-K95 HydrophobicContact CE1-CB 3.73Å; Y81-K95 HydrophobicContact CE1-CD 4.36Å; Y81-K95 HydrophobicContact CE1-CG 4.39Å; Y81-K95 HydrophobicContact CE2-CD 4.47Å; Y81-K95 HydrophobicContact CG-CB 4.38Å; Y81-E134 PolarHBondContact N-O 3.43Å; Y81-E134 PolarHBondContact O-N 3.1Å; Y81-E134 VanDerWaalsContact O-O 3.07Å; Y81-D136 HydrophobicContact CD2-CB 3.79Å; Y81-D136 HydrophobicContact CE2-CB 3.67Å; Y81-T2242 PolarHBondContact OH-O 2.98Å; Y81-T2243 HydrophobicContact CE2-CG2 3.55Å; Y81-T2243 WeakPolarHBondContact OH-CG2 3.37Å
82	I	91.9	Very high	79	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.1	176.2	-166.3	170.1	0	0	0	109.5	V64 L84 Q94 L96 V120 V131 I133 V149	V64-I82 HydrophobicContact CG1-CD1 3.7Å; V64-I82 HydrophobicContact CG2-CD1 4.12Å; I82-L84 HydrophobicContact CD1-CD2 3.58Å; I82-L84 HydrophobicContact CG1-CD2 3.9Å; I82-Q94 PolarHBondContact N-O 3.06Å; I82-Q94 PolarHBondContact O-N 3.16Å; I82-L96 HydrophobicContact CB-CD1 4.22Å; I82-L96 HydrophobicContact CB-CG 4.47Å; I82-L96 HydrophobicContact CG2-CD1 4.31Å; I82-L96 HydrophobicContact CG2-CD2 3.92Å; I82-L96 HydrophobicContact CG2-CG 4.04Å; I82-V120 HydrophobicContact CG2-CG1 4.44Å; I82-V120 HydrophobicContact CG2-CG2 3.78Å; I82-V131 HydrophobicContact CD1-CG1 3.62Å; I82-V131 HydrophobicContact CG1-CG1 3.65Å; I82-I133 HydrophobicContact CB-CD1 4.34Å; I82-I133 HydrophobicContact CD1-CD1 3.99Å; I82-I133 HydrophobicContact CG1-CD1 4.02Å; I82-I133 HydrophobicContact CG1-CG1 4.29Å; I82-V149 HydrophobicContact CD1-CG1 4.35Å
83	T	90.8	Very high	80	Confident	16 Å²	16	36.2 Å²	36.2	10%	0.098	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.5	165.5	-55.8	0	0	0	0	107.9	S90 S91 R93 F132	T83-S90 WeakPolarHBondContact CG2-OG 3.21Å; T83-S91 WeakPolarHBondContact CG2-O 3.22Å; T83-R93 WeakPolarHBondContact OG1-CA 3Å; T83-F132 PolarHBondContact N-O 3.19Å; T83-F132 PolarHBondContact O-N 3.36Å
84	L	90.5	Very high	80.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.1	178.4	-59.1	-179.3	0	0	0	108.8	Y62 I82 S90 S91 V120 L125 L128 V131 V151	Y62-L84 HydrophobicContact CD1-CD1 4.37Å; Y62-L84 HydrophobicContact CD2-CD1 3.94Å; Y62-L84 HydrophobicContact CG-CD1 3.75Å; I82-L84 HydrophobicContact CD1-CD2 3.58Å; I82-L84 HydrophobicContact CG1-CD2 3.9Å; L84-S90 CarbonylContact O-C 3.13Å; L84-S90 WeakPolarHBondContact O-CA 3.35Å; L84-S91 PolarHBondContact N-OG 3.48Å; L84-S91 PolarHBondContact O-N 2.63Å; L84-V120 HydrophobicContact CD1-CB 4.41Å; L84-V120 HydrophobicContact CD1-CG1 3.89Å; L84-V120 HydrophobicContact CG-CG1 4.36Å; L84-L125 HydrophobicContact CB-CD1 3.54Å; L84-L125 WeakPolarHBondContact O-CD1 3.47Å; L84-L128 HydrophobicContact CB-CD2 4.05Å; L84-V131 HydrophobicContact CD2-CG2 3.72Å; L84-V151 HydrophobicContact CD1-CG1 4.33Å; L84-V151 HydrophobicContact CD2-CG1 4.22Å; L84-V151 HydrophobicContact CD2-CG2 3.9Å
85	K	83.2	Confident	81.3	Confident	53 Å²	53	38.2 Å²	38.2	23%	0.23	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.9	173.3	-60.6	179.4	-176	179.8	0	110.7	L128 H129 S130 E180	K85-L128 WeakPolarHBondContact O-CA 3.28Å; K85-H129 VanDerWaalsContact CB-CE1 3.42Å; K85-H129 WeakPolarHBondContact CB-CE1 3.19Å; K85-H129 PolarHBondContact O-N 2.88Å; K85-S130 PolarHBondContact N-O 2.96Å; K85-S130 PolarHBondContact O-N 2.76Å; K85-S130 VanDerWaalsContact O-O 3.06Å; K85-E180 VanDerWaalsContact CD-OE1 3.28Å; K85-E180 WeakPolarHBondContact CD-OE1 3.08Å; K85-E180 IonicContact NZ-OE1 2.79Å; K85-E180 PolarHBondContact NZ-OE1 2.95Å; K85-E180 IonicContact NZ-OE2 2.71Å; K85-E180 PolarHBondContact NZ-OE2 3.35Å
86	G	79.8	Confident	81.7	Confident	3 Å²	3	38.8 Å²	38.8	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	176.6	-178.5	0	0	0	0	0	113.4	W88 G89 L125 G127	G86-W88 PolarHBondContact O-N 3Å; G86-G89 PolarHBondContact N-O 3.01Å; G86-G89 PolarHBondContact O-N 2.64Å; G86-G89 VanDerWaalsContact O-O 3.1Å; G86-L125 CarbonylContact C-O 3.36Å; G86-L125 VanDerWaalsContact C-O 3.22Å; G86-L125 WeakPolarHBondContact CA-O 3.46Å; G86-G127 CarbonylContact C-O 3.53Å; G86-G127 WeakPolarHBondContact CA-O 3.4Å
87	E	74	Confident	80.8	Confident	119 Å²	119	45.4 Å²	45.4	56%	0.556	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-27	-177.9	-72.9	165.7	158.8	0	0	114.7	L125 G127	E87-L125 PolarHBondContact N-O 3.21Å; E87-G127 PolarHBondContact N-O 2.95Å; E87-G127 WeakPolarHBondContact OE2-CA 3.44Å; E87-G127 PolarHBondContact OE2-N 3.46Å
88	W	66.4	Low	79.8	Confident	129 Å²	129	50.2 Å²	50.2	49%	0.489	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	2.4	-178.3	-55	-29.1	0	0	0	115.5	R57 G86 D124 L125 G126	R57-W88 PolarHBondContact NH1-O 3.38Å; G86-W88 PolarHBondContact O-N 3Å; W88-D124 HydrophobicContact CE3-CB 4.34Å; W88-D124 HydrophobicContact CZ3-CB 4.26Å; W88-L125 PolarHBondContact N-O 3.22Å; W88-G126 VanDerWaalsContact CE3-N 3.29Å
89	G	71.2	Confident	78.4	Confident	36 Å²	36	58 Å²	58	37%	0.371	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	145	-161.9	174.5	0	0	0	0	0	114.8	G86	G86-G89 PolarHBondContact N-O 3.01Å; G86-G89 PolarHBondContact O-N 2.64Å; G86-G89 VanDerWaalsContact O-O 3.1Å
90	S	78.5	Confident	76.6	Confident	65 Å²	65	64.6 Å²	64.6	46%	0.455	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	145.5	173.9	-174.2	0	0	0	0	110	T83 L84	T83-S90 WeakPolarHBondContact CG2-OG 3.21Å; L84-S90 CarbonylContact O-C 3.13Å; L84-S90 WeakPolarHBondContact O-CA 3.35Å
91	S	83.2	Confident	74.5	Confident	7 Å²	7	69.8 Å²	69.8	5%	0.049	34%	0.337	C	S	.	.			trans	-64.5	165.7	159.8	74.1	0	0	0	0	110.1	T83 L84 S122	T83-S91 WeakPolarHBondContact CG2-O 3.22Å; L84-S91 PolarHBondContact N-OG 3.48Å; L84-S91 PolarHBondContact O-N 2.63Å; S91-S122 WeakPolarHBondContact CA-OG 3.47Å; S91-S122 VanDerWaalsContact CB-OG 3.28Å; S91-S122 WeakPolarHBondContact CB-OG 3.36Å
92	T	74.2	Confident	71.9	Confident	94 Å²	94	74.5 Å²	74.5	58%	0.577	37%	0.37	S	S	*	.			trans	-64.9	156.1	154.3	48.6	0	0	0	0	110.3	Q94	T92-Q94 PolarHBondContact O-N 3.12Å; T92-Q94 PolarHBondContact OG1-NE2 3.11Å; T92-Q94 VanDerWaalsContact OG1-NE2 3.16Å
93	R	83.8	Confident	69.3	Low	102 Å²	102	80.9 Å²	80.9	39%	0.385	41%	0.409	S	S	.	.			trans	-63.7	114.8	173.3	-175	-171.7	-174.3	-119.7	3.1	109.6	Y81 T83 E134	Y81-R93 HydrophobicContact CD1-CG 3.78Å; Y81-R93 HydrophobicContact CE1-CG 4.48Å; Y81-R93 VanDerWaalsContact CE1-NH1 3.32Å; Y81-R93 HydrophobicContact CG-CG 4.31Å; Y81-R93 VanDerWaalsContact CZ-NH1 3.27Å; T83-R93 WeakPolarHBondContact OG1-CA 3Å; R93-E134 WeakPolarHBondContact CG-OE1 3.29Å; R93-E134 IonicContact CZ-OE1 3.95Å; R93-E134 IonicContact CZ-OE2 3.71Å; R93-E134 IonicContact NE-OE1 2.69Å; R93-E134 PolarHBondContact NE-OE1 2.59Å; R93-E134 IonicContact NE-OE2 3.35Å; R93-E134 PolarHBondContact NE-OE2 3.09Å; R93-E134 IonicContact NH2-OE1 3.45Å; R93-E134 IonicContact NH2-OE2 3.7Å; R93-E134 PolarHBondContact NH2-OE2 2.91Å
94	Q	83	Confident	66.7	Low	35 Å²	35	91.2 Å²	91.2	16%	0.164	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.4	-172.5	-78	178.1	52.2	0	0	113	Y81 I82 T92 V120 V121	Y81-Q94 CarbonylContact C-O 3.56Å; Y81-Q94 VanDerWaalsContact CA-O 3.26Å; Y81-Q94 WeakPolarHBondContact CA-O 3.42Å; I82-Q94 PolarHBondContact N-O 3.06Å; I82-Q94 PolarHBondContact O-N 3.16Å; T92-Q94 PolarHBondContact O-N 3.12Å; T92-Q94 PolarHBondContact OG1-NE2 3.11Å; T92-Q94 VanDerWaalsContact OG1-NE2 3.16Å; Q94-V120 HydrophobicContact CB-CG1 4.23Å; Q94-V120 VanDerWaalsContact OE1-CG1 3.3Å; Q94-V121 PolarHBondContact NE2-O 2.96Å; Q94-V121 PolarHBondContact OE1-O 2.78Å
95	K	84.7	Confident	64.2	Low	38 Å²	38	98.7 Å²	98.7	17%	0.165	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.7	-176.9	-179.4	169.4	171.8	166.3	0	110.9	Y81 R97 T2243 S2246	Y81-K95 HydrophobicContact CD1-CB 3.8Å; Y81-K95 HydrophobicContact CE1-CB 3.73Å; Y81-K95 HydrophobicContact CE1-CD 4.36Å; Y81-K95 HydrophobicContact CE1-CG 4.39Å; Y81-K95 HydrophobicContact CE2-CD 4.47Å; Y81-K95 HydrophobicContact CG-CB 4.38Å; K95-R97 HydrophobicContact CG-CG 4.44Å; K95-R97 PolarHBondContact O-N 3.37Å; K95-T2243 HydrophobicContact CD-CG2 4.16Å; K95-T2243 VanDerWaalsContact NZ-CB 3.25Å; K95-T2243 PolarHBondContact NZ-O 3.38Å; K95-S2246 PolarHBondContact NZ-OG 2.77Å
96	L	82.1	Confident	62.5	Low	12 Å²	12	104.2 Å²	104.2	6%	0.063	52%	0.518	C	S	.	.			trans	-74.5	113.3	-175.8	-68.1	158.7	0	0	0	110.7	V64 L66 I80 I82 F118 V120	V64-L96 HydrophobicContact CB-CD2 4.21Å; V64-L96 HydrophobicContact CG1-CD2 4.24Å; L66-L96 HydrophobicContact CD1-CD1 3.68Å; L66-L96 HydrophobicContact CD1-CD2 4.27Å; L66-L96 HydrophobicContact CD2-CD1 3.83Å; L66-L96 HydrophobicContact CG-CD1 4.45Å; I80-L96 HydrophobicContact CB-CD1 4.02Å; I80-L96 HydrophobicContact CG2-CD1 3.96Å; I80-L96 WeakPolarHBondContact O-CB 3.46Å; I80-L96 PolarHBondContact O-N 3.44Å; I82-L96 HydrophobicContact CB-CD1 4.22Å; I82-L96 HydrophobicContact CB-CG 4.47Å; I82-L96 HydrophobicContact CG2-CD1 4.31Å; I82-L96 HydrophobicContact CG2-CD2 3.92Å; I82-L96 HydrophobicContact CG2-CG 4.04Å; L96-F118 HydrophobicContact CB-CB 4.49Å; L96-F118 HydrophobicContact CB-CD1 3.83Å; L96-F118 HydrophobicContact CB-CD2 4.25Å; L96-F118 HydrophobicContact CB-CE1 4.08Å; L96-F118 HydrophobicContact CB-CE2 4.5Å; L96-F118 HydrophobicContact CB-CG 3.91Å; L96-F118 HydrophobicContact CB-CZ 4.41Å; L96-F118 HydrophobicContact CD2-CB 3.56Å; L96-F118 HydrophobicContact CD2-CD1 4.42Å; L96-F118 HydrophobicContact CD2-CD2 3.87Å; L96-F118 HydrophobicContact CD2-CG 3.68Å; L96-F118 HydrophobicContact CG-CG 4.39Å; L96-V120 HydrophobicContact CD2-CG2 4.03Å
97	R	66.7	Low	61.2	Low	139 Å²	139	111.6 Å²	111.6	53%	0.525	54%	0.544	S	S	.	.			trans	-125	131.8	-179.4	-65	-179.9	175.3	-151.8	-5.9	110.7	K95 S2246	K95-R97 HydrophobicContact CG-CG 4.44Å; K95-R97 PolarHBondContact O-N 3.37Å; R97-S2246 PolarHBondContact NH2-O 3.31Å; R97-S2246 PolarHBondContact NH2-OG 2.88Å
98	K	56	Low	60.8	Low	122 Å²	122	109.4 Å²	109.4	53%	0.53	53%	0.533	S	S	.	.			trans	-90.2	125.5	177	-171.1	-179.7	178.6	-173.6	0	109.8	F108 F118	K98-F108 HydrophobicContact CB-CD2 4.23Å; K98-F108 HydrophobicContact CB-CE2 3.77Å; K98-F108 HydrophobicContact CB-CZ 3.99Å; K98-F108 HydrophobicContact CD-CD2 4.35Å; K98-F108 HydrophobicContact CD-CE2 3.49Å; K98-F108 VanDerWaalsContact CD-CE2 3.49Å; K98-F108 HydrophobicContact CD-CZ 4.08Å; K98-F108 HydrophobicContact CG-CE2 4.27Å; K98-F118 HydrophobicContact CB-CD1 4.45Å; K98-F118 HydrophobicContact CB-CE1 4.18Å
99	E	48.1	Very low	61	Low	165 Å²	165	106.1 Å²	106.1	77%	0.771	52%	0.521	S	S	*	.	S	Bend	trans	-70.7	135	179.8	-62.4	-178.3	127.9	0	0	111.7
100	K	44.3	Very low	61.3	Low	202 Å²	202	104.6 Å²	104.6	88%	0.878	50%	0.504	S	S	*	.			trans	54.6	99.7	171.7	-64.9	177.9	178.6	176.7	0	116.7
101	V	41.6	Very low	61.2	Low	109 Å²	109	108.2 Å²	108.2	66%	0.661	51%	0.509	S	S	*	.			trans	-128.9	114.7	150.7	-179.8	0	0	0	0	107.9
102	P	36.3	Very low	60.5	Low	119 Å²	119	110.2 Å²	110.2	77%	0.773	52%	0.522	S	S	*	.			trans	-98.6	90.6	-172.8	35.3	-32	0	0	0	113.1
103	T	36.2	Very low	60.1	Low	134 Å²	134	106.8 Å²	106.8	82%	0.822	51%	0.505	S	S	*	.	S	Bend	trans	-171.1	156.1	153.4	7.6	0	0	0	0	109.8
104	R	36.8	Very low	59.6	Low	232 Å²	232	102.8 Å²	102.8	88%	0.875	49%	0.493	S	S	*	.	S	Bend	trans	-72.2	145	-175.1	-71.1	174.4	167.9	164.5	-7.9	111.8
105	N	39.1	Very low	59.4	Low	157 Å²	157	104.4 Å²	104.4	84%	0.84	51%	0.505	S	S	*	.	S	Bend	trans	80.1	31.7	161.4	-56.8	-6.1	0	0	0	120.7
106	L	46.5	Very low	59.2	Low	170 Å²	170	103.4 Å²	103.4	89%	0.89	50%	0.502	S	S	*	.			trans	-126.1	124.1	164	-75.1	171.3	0	0	0	112.7
107	R	53.4	Low	59.2	Low	157 Å²	157	105.5 Å²	105.5	59%	0.592	52%	0.515	S	S	*	.			trans	-68.6	141.9	168.3	-83.7	-174.4	174.1	-178.6	-2.6	109.7	Y109 L2240	R107-Y109 PolarHBondContact O-N 2.87Å; R107-L2240 VanDerWaalsContact NH1-CD2 3.34Å
108	F	64.4	Low	60.1	Low	73 Å²	73	99.1 Å²	99.1	32%	0.32	49%	0.491	S	S	.	.			trans	-69.2	119	173.3	-179.7	-98.6	0	0	0	110.2	K98 F110 N116 F118	K98-F108 HydrophobicContact CB-CD2 4.23Å; K98-F108 HydrophobicContact CB-CE2 3.77Å; K98-F108 HydrophobicContact CB-CZ 3.99Å; K98-F108 HydrophobicContact CD-CD2 4.35Å; K98-F108 HydrophobicContact CD-CE2 3.49Å; K98-F108 VanDerWaalsContact CD-CE2 3.49Å; K98-F108 HydrophobicContact CD-CZ 4.08Å; K98-F108 HydrophobicContact CG-CE2 4.27Å; F108-F110 HydrophobicContact CD1-CD2 4.33Å; F108-F110 AromaticContact CD1-CE2 3.99Å; F108-F110 HydrophobicContact CD1-CE2 3.99Å; F108-F110 HydrophobicContact CE1-CD2 4.01Å; F108-F110 HydrophobicContact CE1-CE1 4.41Å; F108-F110 AromaticContact CE1-CE2 3.6Å; F108-F110 HydrophobicContact CE1-CE2 3.6Å; F108-F110 AromaticContact CE1-CZ 3.84Å; F108-F110 HydrophobicContact CE1-CZ 3.84Å; F108-N116 HydrophobicContact CZ-CB 4.15Å; F108-N116 WeakPolarHBondContact CZ-ND2 3.33Å; F108-F118 AromaticContact CE1-CE1 3.66Å; F108-F118 HydrophobicContact CE1-CE1 3.66Å; F108-F118 AromaticContact CE1-CZ 3.59Å; F108-F118 HydrophobicContact CE1-CZ 3.59Å; F108-F118 AromaticContact CZ-CE1 3.82Å; F108-F118 HydrophobicContact CZ-CE1 3.82Å; F108-F118 AromaticContact CZ-CZ 3.73Å; F108-F118 HydrophobicContact CZ-CZ 3.73Å
109	Y	72	Confident	61.2	Low	61 Å²	61	95.9 Å²	95.9	24%	0.239	48%	0.484	C	S	.	.			trans	-119.8	137.5	-174.5	-173	-99.4	0	0	0	110.4	T76 S77 R107 Y111	T76-Y109 VanDerWaalsContact C-CE2 3.42Å; T76-Y109 WeakPolarHBondContact O-CD2 3.39Å; S77-Y109 VanDerWaalsContact N-CD2 3.31Å; S77-Y109 VanDerWaalsContact N-CE2 3.34Å; S77-Y109 VanDerWaalsContact OG-CD2 3.23Å; S77-Y109 WeakPolarHBondContact OG-CD2 3.29Å; S77-Y109 WeakPolarHBondContact OG-CE2 3.4Å; R107-Y109 PolarHBondContact O-N 2.87Å; Y109-Y111 AromaticContact CD1-CD1 3.4Å; Y109-Y111 HydrophobicContact CD1-CD1 3.4Å; Y109-Y111 AromaticContact CD1-CD2 3.99Å; Y109-Y111 HydrophobicContact CD1-CD2 3.99Å; Y109-Y111 AromaticContact CD1-CE1 3.52Å; Y109-Y111 HydrophobicContact CD1-CE1 3.52Å; Y109-Y111 HydrophobicContact CD1-CE2 4.09Å; Y109-Y111 AromaticContact CD1-CG 3.62Å; Y109-Y111 HydrophobicContact CD1-CG 3.62Å; Y109-Y111 AromaticContact CD1-CZ 3.86Å; Y109-Y111 AromaticContact CE1-CD1 3.72Å; Y109-Y111 HydrophobicContact CE1-CD1 3.72Å; Y109-Y111 HydrophobicContact CE1-CE1 4.15Å; Y109-Y111 HydrophobicContact CE1-CG 4.09Å; Y109-Y111 HydrophobicContact CG-CE1 4.39Å; Y109-Y111 WeakPolarHBondContact O-CD2 3.35Å; Y109-Y111 VanDerWaalsContact O-CE2 3.3Å; Y109-Y111 WeakPolarHBondContact O-CE2 3.48Å; Y109-Y111 PolarHBondContact O-N 2.75Å
110	F	77.4	Confident	62.9	Low	3 Å²	3	88.2 Å²	88.2	1%	0.013	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-91.5	89.7	171.8	-67.6	-107.4	0	0	0	107.9	L66 G75 T76 I80 F108 S114 N116 F118	L66-F110 HydrophobicContact CB-CE1 4.42Å; G75-F110 CarbonylContact C-O 3.58Å; G75-F110 WeakPolarHBondContact CA-O 3.36Å; T76-F110 HydrophobicContact CG2-CB 3.74Å; T76-F110 HydrophobicContact CG2-CD2 3.92Å; T76-F110 HydrophobicContact CG2-CG 4.04Å; T76-F110 PolarHBondContact N-O 2.63Å; T76-F110 PolarHBondContact O-N 2.79Å; I80-F110 HydrophobicContact CB-CZ 4.36Å; I80-F110 HydrophobicContact CD1-CD1 3.96Å; I80-F110 HydrophobicContact CD1-CD2 3.76Å; I80-F110 HydrophobicContact CD1-CE1 3.64Å; I80-F110 HydrophobicContact CD1-CE2 3.45Å; I80-F110 VanDerWaalsContact CD1-CE2 3.45Å; I80-F110 HydrophobicContact CD1-CG 4.01Å; I80-F110 HydrophobicContact CD1-CZ 3.37Å; I80-F110 HydrophobicContact CG1-CD2 4.24Å; I80-F110 HydrophobicContact CG1-CE2 3.63Å; I80-F110 HydrophobicContact CG1-CZ 3.78Å; F108-F110 HydrophobicContact CD1-CD2 4.33Å; F108-F110 AromaticContact CD1-CE2 3.99Å; F108-F110 HydrophobicContact CD1-CE2 3.99Å; F108-F110 HydrophobicContact CE1-CD2 4.01Å; F108-F110 HydrophobicContact CE1-CE1 4.41Å; F108-F110 AromaticContact CE1-CE2 3.6Å; F108-F110 HydrophobicContact CE1-CE2 3.6Å; F108-F110 AromaticContact CE1-CZ 3.84Å; F108-F110 HydrophobicContact CE1-CZ 3.84Å; F110-S114 WeakPolarHBondContact CA-OG 3.35Å; F110-N116 HydrophobicContact CD1-CB 3.8Å; F110-N116 HydrophobicContact CE1-CB 3.7Å; F110-F118 AromaticContact CE1-CE2 3.73Å; F110-F118 HydrophobicContact CE1-CE2 3.73Å; F110-F118 AromaticContact CE1-CZ 3.55Å; F110-F118 HydrophobicContact CE1-CZ 3.55Å; F110-F118 HydrophobicContact CE2-CZ 4.34Å; F110-F118 HydrophobicContact CZ-CE1 4.23Å; F110-F118 AromaticContact CZ-CE2 3.88Å; F110-F118 HydrophobicContact CZ-CE2 3.88Å; F110-F118 AromaticContact CZ-CZ 3.34Å; F110-F118 HydrophobicContact CZ-CZ 3.34Å
111	Y	75.6	Confident	64.6	Low	141 Å²	141	82 Å²	82	55%	0.553	43%	0.427	S	S	*	.			trans	-57.2	154.2	-179	-55.1	-93.8	0	0	0	112.6	T68 Y109 G113 S114	T68-Y111 WeakPolarHBondContact CB-O 3.31Å; T68-Y111 WeakPolarHBondContact CG2-O 3.19Å; Y109-Y111 AromaticContact CD1-CD1 3.4Å; Y109-Y111 HydrophobicContact CD1-CD1 3.4Å; Y109-Y111 AromaticContact CD1-CD2 3.99Å; Y109-Y111 HydrophobicContact CD1-CD2 3.99Å; Y109-Y111 AromaticContact CD1-CE1 3.52Å; Y109-Y111 HydrophobicContact CD1-CE1 3.52Å; Y109-Y111 HydrophobicContact CD1-CE2 4.09Å; Y109-Y111 AromaticContact CD1-CG 3.62Å; Y109-Y111 HydrophobicContact CD1-CG 3.62Å; Y109-Y111 AromaticContact CD1-CZ 3.86Å; Y109-Y111 AromaticContact CE1-CD1 3.72Å; Y109-Y111 HydrophobicContact CE1-CD1 3.72Å; Y109-Y111 HydrophobicContact CE1-CE1 4.15Å; Y109-Y111 HydrophobicContact CE1-CG 4.09Å; Y109-Y111 HydrophobicContact CG-CE1 4.39Å; Y109-Y111 WeakPolarHBondContact O-CD2 3.35Å; Y109-Y111 VanDerWaalsContact O-CE2 3.3Å; Y109-Y111 WeakPolarHBondContact O-CE2 3.48Å; Y109-Y111 PolarHBondContact O-N 2.75Å; Y111-G113 PolarHBondContact O-N 3.29Å; Y111-S114 PolarHBondContact N-OG 1.84Å; Y111-S114 WeakPolarHBondContact O-CB 3.28Å; Y111-S114 PolarHBondContact O-N 3.15Å; Y111-S114 PolarHBondContact O-OG 2.74Å
112	P	68.9	Low	66.3	Low	49 Å²	49	76.8 Å²	76.8	32%	0.318	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	130.4	167.3	-15.6	27.4	0	0	0	109.4	A69 V71 S114	A69-P112 WeakPolarHBondContact O-CA 3.3Å; V71-P112 WeakPolarHBondContact O-CB 3.33Å; P112-S114 VanDerWaalsContact C-N 3.29Å; P112-S114 PolarHBondContact O-N 2.94Å
113	G	65.1	Low	68.2	Low	23 Å²	23	72.8 Å²	72.8	24%	0.237	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	1.5	-173.6	0	0	0	0	0	115.7	T68 A69 Y111	T68-G113 CarbonylContact O-C 3.59Å; T68-G113 WeakPolarHBondContact O-CA 3.42Å; T68-G113 PolarHBondContact O-N 3.47Å; A69-G113 PolarHBondContact O-N 3.18Å; A69-G113 VanDerWaalsContact O-N 3.08Å; Y111-G113 PolarHBondContact O-N 3.29Å
114	S	74.1	Confident	70.4	Confident	18 Å²	18	67.8 Å²	67.8	13%	0.126	34%	0.338	C	S	.	.			trans	-73.7	151.6	-178.6	66.5	0	0	0	0	113.4	T67 T68 F110 Y111 P112 N116	T67-S114 CarbonylContact C-O 3.58Å; T67-S114 WeakPolarHBondContact CA-O 3.15Å; T68-S114 PolarHBondContact N-O 3.05Å; T68-S114 PolarHBondContact OG1-OG 2.9Å; F110-S114 WeakPolarHBondContact CA-OG 3.35Å; Y111-S114 PolarHBondContact N-OG 1.84Å; Y111-S114 WeakPolarHBondContact O-CB 3.28Å; Y111-S114 PolarHBondContact O-N 3.15Å; Y111-S114 PolarHBondContact O-OG 2.74Å; P112-S114 VanDerWaalsContact C-N 3.29Å; P112-S114 PolarHBondContact O-N 2.94Å; S114-N116 VanDerWaalsContact CB-OD1 3.22Å; S114-N116 WeakPolarHBondContact CB-OD1 3.17Å; S114-N116 PolarHBondContact OG-OD1 3.31Å; S114-N116 VanDerWaalsContact OG-OD1 3.13Å
115	T	78.9	Confident	72.4	Confident	68 Å²	68	56.9 Å²	56.9	42%	0.417	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	119.8	169.1	-64.4	0	0	0	0	109.8	V65 L66 T67	V65-T115 HydrophobicContact CG1-CG2 3.47Å; V65-T115 VanDerWaalsContact CG1-CG2 3.47Å; L66-T115 CarbonylContact O-C 3.53Å; L66-T115 WeakPolarHBondContact O-CA 3.39Å; T67-T115 WeakPolarHBondContact CG2-OG1 3.38Å; T67-T115 WeakPolarHBondContact OG1-CG2 3.49Å; T67-T115 PolarHBondContact OG1-OG1 3.37Å
116	N	80	Confident	74.4	Confident	17 Å²	17	49.8 Å²	49.8	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.8	-164.4	-62.1	42.1	0	0	0	109.4	V65 L66 F108 F110 S114 F118	V65-N116 CarbonylContact C-O 3.57Å; V65-N116 VanDerWaalsContact CA-O 3.28Å; V65-N116 WeakPolarHBondContact CA-O 3.16Å; L66-N116 PolarHBondContact N-O 3.08Å; L66-N116 PolarHBondContact O-N 3.29Å; F108-N116 HydrophobicContact CZ-CB 4.15Å; F108-N116 WeakPolarHBondContact CZ-ND2 3.33Å; F110-N116 HydrophobicContact CD1-CB 3.8Å; F110-N116 HydrophobicContact CE1-CB 3.7Å; S114-N116 VanDerWaalsContact CB-OD1 3.22Å; S114-N116 WeakPolarHBondContact CB-OD1 3.17Å; S114-N116 PolarHBondContact OG-OD1 3.31Å; S114-N116 VanDerWaalsContact OG-OD1 3.13Å; N116-F118 VanDerWaalsContact C-CE2 3.46Å; N116-F118 HydrophobicContact CB-CE2 3.59Å; N116-F118 HydrophobicContact CB-CZ 3.61Å; N116-F118 WeakPolarHBondContact O-CE2 3.45Å
117	T	81.3	Confident	75.9	Confident	56 Å²	56	42.1 Å²	42.1	34%	0.344	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.9	-173.4	-57.9	0	0	0	0	112.2	K63 V64 V65	K63-T117 HydrophobicContact CD-CG2 4.35Å; K63-T117 VanDerWaalsContact CE-CG2 3.44Å; K63-T117 HydrophobicContact CG-CG2 3.98Å; V64-T117 CarbonylContact O-C 3.53Å; V64-T117 VanDerWaalsContact O-CA 3.31Å; V64-T117 WeakPolarHBondContact O-CA 3.44Å; V65-T117 HydrophobicContact CG2-CG2 4.08Å
118	F	85.4	Confident	77	Confident	6 Å²	6	35.1 Å²	35.1	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	172.4	-169.1	-49.8	-87.4	0	0	0	111.2	K63 V64 L66 L96 K98 F108 F110 N116	K63-F118 CarbonylContact C-O 3.48Å; K63-F118 WeakPolarHBondContact CA-O 3.27Å; V64-F118 PolarHBondContact N-O 2.93Å; V64-F118 PolarHBondContact O-N 3.08Å; L66-F118 HydrophobicContact CD1-CD2 3.38Å; L66-F118 HydrophobicContact CD1-CE2 3.38Å; L96-F118 HydrophobicContact CB-CB 4.49Å; L96-F118 HydrophobicContact CB-CD1 3.83Å; L96-F118 HydrophobicContact CB-CD2 4.25Å; L96-F118 HydrophobicContact CB-CE1 4.08Å; L96-F118 HydrophobicContact CB-CE2 4.5Å; L96-F118 HydrophobicContact CB-CG 3.91Å; L96-F118 HydrophobicContact CB-CZ 4.41Å; L96-F118 HydrophobicContact CD2-CB 3.56Å; L96-F118 HydrophobicContact CD2-CD1 4.42Å; L96-F118 HydrophobicContact CD2-CD2 3.87Å; L96-F118 HydrophobicContact CD2-CG 3.68Å; L96-F118 HydrophobicContact CG-CG 4.39Å; K98-F118 HydrophobicContact CB-CD1 4.45Å; K98-F118 HydrophobicContact CB-CE1 4.18Å; F108-F118 AromaticContact CE1-CE1 3.66Å; F108-F118 HydrophobicContact CE1-CE1 3.66Å; F108-F118 AromaticContact CE1-CZ 3.59Å; F108-F118 HydrophobicContact CE1-CZ 3.59Å; F108-F118 AromaticContact CZ-CE1 3.82Å; F108-F118 HydrophobicContact CZ-CE1 3.82Å; F108-F118 AromaticContact CZ-CZ 3.73Å; F108-F118 HydrophobicContact CZ-CZ 3.73Å; F110-F118 AromaticContact CE1-CE2 3.73Å; F110-F118 HydrophobicContact CE1-CE2 3.73Å; F110-F118 AromaticContact CE1-CZ 3.55Å; F110-F118 HydrophobicContact CE1-CZ 3.55Å; F110-F118 HydrophobicContact CE2-CZ 4.34Å; F110-F118 HydrophobicContact CZ-CE1 4.23Å; F110-F118 AromaticContact CZ-CE2 3.88Å; F110-F118 HydrophobicContact CZ-CE2 3.88Å; F110-F118 AromaticContact CZ-CZ 3.34Å; F110-F118 HydrophobicContact CZ-CZ 3.34Å; N116-F118 VanDerWaalsContact C-CE2 3.46Å; N116-F118 HydrophobicContact CB-CE2 3.59Å; N116-F118 HydrophobicContact CB-CZ 3.61Å; N116-F118 WeakPolarHBondContact O-CE2 3.45Å
119	S	80.6	Confident	77.6	Confident	54 Å²	54	36 Å²	36	38%	0.378	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.4	172.7	-55	0	0	0	0	110.2	Y62	Y62-S119 CarbonylContact O-C 3.51Å; Y62-S119 WeakPolarHBondContact O-CA 3.4Å
120	V	82.8	Confident	78.1	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.018	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.3	-173.4	173.8	0	0	0	0	108.3	L61 Y62 V64 I82 L84 Q94 L96	L61-V120 CarbonylContact C-O 3.55Å; L61-V120 WeakPolarHBondContact CA-O 3.45Å; Y62-V120 PolarHBondContact N-O 2.96Å; Y62-V120 PolarHBondContact O-N 2.72Å; V64-V120 HydrophobicContact CB-CG2 4.47Å; V64-V120 HydrophobicContact CG2-CB 4.25Å; V64-V120 HydrophobicContact CG2-CG2 3.58Å; I82-V120 HydrophobicContact CG2-CG1 4.44Å; I82-V120 HydrophobicContact CG2-CG2 3.78Å; L84-V120 HydrophobicContact CD1-CB 4.41Å; L84-V120 HydrophobicContact CD1-CG1 3.89Å; L84-V120 HydrophobicContact CG-CG1 4.36Å; Q94-V120 HydrophobicContact CB-CG1 4.23Å; Q94-V120 VanDerWaalsContact OE1-CG1 3.3Å; L96-V120 HydrophobicContact CD2-CG2 4.03Å
121	V	79.4	Confident	78.6	Confident	71 Å²	71	33 Å²	33	43%	0.43	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	100.2	-172.1	179.3	0	0	0	0	109.2	Y59 L61 Q94	Y59-V121 HydrophobicContact CD1-CG1 3.85Å; Y59-V121 HydrophobicContact CG-CG1 4.31Å; L61-V121 HydrophobicContact CD1-CG2 3.45Å; L61-V121 VanDerWaalsContact CD1-CG2 3.45Å; Q94-V121 PolarHBondContact NE2-O 2.96Å; Q94-V121 PolarHBondContact OE1-O 2.78Å
122	S	78.1	Confident	79.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149	-178.4	179	0	0	0	0	110	Y59 T60 S91	Y59-S122 CarbonylContact C-O 3.57Å; Y59-S122 WeakPolarHBondContact CA-O 3.26Å; T60-S122 PolarHBondContact N-O 3.29Å; T60-S122 PolarHBondContact O-N 2.96Å; S91-S122 WeakPolarHBondContact CA-OG 3.47Å; S91-S122 VanDerWaalsContact CB-OG 3.28Å; S91-S122 WeakPolarHBondContact CB-OG 3.36Å
123	P	75.1	Confident	80.3	Confident	36 Å²	36	26.9 Å²	26.9	23%	0.234	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.4	145.1	158.2	-23.2	35.2	0	0	0	109.9	R57 P58 Y59 L125	R57-P123 HydrophobicContact CB-CB 4.28Å; P58-P123 WeakPolarHBondContact O-CA 3.44Å; Y59-P123 HydrophobicContact CD1-CG 4.12Å; Y59-P123 HydrophobicContact CE1-CG 3.84Å; P123-L125 VanDerWaalsContact O-CD2 3.3Å; P123-L125 WeakPolarHBondContact O-CD2 3.25Å; P123-L125 WeakPolarHBondContact O-CG 3.2Å; P123-L125 PolarHBondContact O-N 2.92Å
124	D	82.6	Confident	81.4	Confident	29 Å²	29	27 Å²	27	16%	0.155	16%	0.156	C	C	.	.			trans	-58.7	128.3	-176.1	-160.3	-25.4	0	0	0	111.2	P58 Y62 W88 G126 H153	P58-D124 PolarHBondContact O-N 3.06Å; P58-D124 VanDerWaalsContact O-N 3.15Å; Y62-D124 PolarHBondContact OH-OD1 3.24Å; W88-D124 HydrophobicContact CE3-CB 4.34Å; W88-D124 HydrophobicContact CZ3-CB 4.26Å; D124-G126 PolarHBondContact OD1-N 2.83Å; D124-H153 IonicContact OD1-CE1 3.42Å; D124-H153 IonicContact OD1-NE2 3.13Å; D124-H153 PolarHBondContact OD1-NE2 2.9Å; D124-H153 IonicContact OD2-CE1 3.25Å; D124-H153 IonicContact OD2-NE2 2.72Å
125	L	80.6	Confident	81.7	Confident	3 Å²	3	26.2 Å²	26.2	2%	0.016	15%	0.15	C	C	.	.			trans	-104	-7.8	-175.1	-54.5	-178.5	0	0	0	112.9	Y62 L84 G86 E87 W88 P123 L128	Y62-L125 HydrophobicContact CE2-CG 4.44Å; Y62-L125 PolarHBondContact OH-N 3.48Å; L84-L125 HydrophobicContact CB-CD1 3.54Å; L84-L125 WeakPolarHBondContact O-CD1 3.47Å; G86-L125 CarbonylContact C-O 3.36Å; G86-L125 VanDerWaalsContact C-O 3.22Å; G86-L125 WeakPolarHBondContact CA-O 3.46Å; E87-L125 PolarHBondContact N-O 3.21Å; W88-L125 PolarHBondContact N-O 3.22Å; P123-L125 VanDerWaalsContact O-CD2 3.3Å; P123-L125 WeakPolarHBondContact O-CD2 3.25Å; P123-L125 WeakPolarHBondContact O-CG 3.2Å; P123-L125 PolarHBondContact O-N 2.92Å; L125-L128 HydrophobicContact CB-CD2 4.06Å; L125-L128 HydrophobicContact CD1-CD2 3.94Å
126	G	79.3	Confident	81.4	Confident	7 Å²	7	23.4 Å²	23.4	7%	0.072	13%	0.133	C	C	.	.			trans	70.3	-136.7	-176.2	0	0	0	0	0	113.3	W88 D124 L128	W88-G126 VanDerWaalsContact CE3-N 3.29Å; D124-G126 PolarHBondContact OD1-N 2.83Å; G126-L128 PolarHBondContact O-N 2.92Å
127	G	78.2	Confident	80.8	Confident	10 Å²	10	22.7 Å²	22.7	10%	0.103	13%	0.129	C	C	.	.	S	Bend	trans	-70.4	115.7	175	0	0	0	0	0	112.2	G86 E87 H129	G86-G127 CarbonylContact C-O 3.53Å; G86-G127 WeakPolarHBondContact CA-O 3.4Å; E87-G127 PolarHBondContact N-O 2.95Å; E87-G127 WeakPolarHBondContact OE2-CA 3.44Å; E87-G127 PolarHBondContact OE2-N 3.46Å; G127-H129 PolarHBondContact O-N 2.81Å
128	L	77.3	Confident	79.9	Confident	9 Å²	9	20.9 Å²	20.9	5%	0.047	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.5	176	-61.8	177.3	0	0	0	110.7	Y62 L84 K85 L125 G126 V151 Y160 F162	Y62-L128 HydrophobicContact CD1-CD1 4.3Å; Y62-L128 HydrophobicContact CE1-CD1 4.48Å; L84-L128 HydrophobicContact CB-CD2 4.05Å; K85-L128 WeakPolarHBondContact O-CA 3.28Å; L125-L128 HydrophobicContact CB-CD2 4.06Å; L125-L128 HydrophobicContact CD1-CD2 3.94Å; G126-L128 PolarHBondContact O-N 2.92Å; L128-V151 HydrophobicContact CD1-CB 3.84Å; L128-V151 HydrophobicContact CD1-CG1 3.41Å; L128-V151 VanDerWaalsContact CD1-CG1 3.41Å; L128-V151 HydrophobicContact CD1-CG2 4.47Å; L128-Y160 HydrophobicContact CB-CD1 4.4Å; L128-Y160 HydrophobicContact CB-CD2 4.25Å; L128-Y160 HydrophobicContact CB-CE2 4.42Å; L128-Y160 HydrophobicContact CB-CG 4.24Å; L128-Y160 HydrophobicContact CD1-CD2 4.19Å; L128-Y160 HydrophobicContact CG-CD2 4.49Å; L128-F162 HydrophobicContact CB-CZ 4.26Å
129	H	76.3	Confident	78.8	Confident	92 Å²	92	23.2 Å²	23.2	43%	0.426	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-38.9	-180	60.6	71.8	0	0	0	112.4	K85 G127 G183	K85-H129 VanDerWaalsContact CB-CE1 3.42Å; K85-H129 WeakPolarHBondContact CB-CE1 3.19Å; K85-H129 PolarHBondContact O-N 2.88Å; G127-H129 PolarHBondContact O-N 2.81Å; H129-G183 PolarHBondContact O-N 2.73Å; H129-G183 VanDerWaalsContact O-N 3.07Å
130	S	82.5	Confident	77.7	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	159.3	176.7	54.5	0	0	0	0	111.5	K85 E180 L181	K85-S130 PolarHBondContact N-O 2.96Å; K85-S130 PolarHBondContact O-N 2.76Å; K85-S130 VanDerWaalsContact O-O 3.06Å; S130-E180 WeakPolarHBondContact CB-OE1 3.45Å; S130-E180 PolarHBondContact OG-OE1 2.74Å; S130-L181 CarbonylContact C-O 3.51Å; S130-L181 WeakPolarHBondContact CA-O 3.16Å; S130-L181 VanDerWaalsContact CB-O 3.3Å; S130-L181 WeakPolarHBondContact CB-O 3.05Å
131	V	87.8	Confident	76.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	112.1	178.5	164.1	0	0	0	0	106.3	I82 L84 I133 V149 V151 F162 L181	I82-V131 HydrophobicContact CD1-CG1 3.62Å; I82-V131 HydrophobicContact CG1-CG1 3.65Å; L84-V131 HydrophobicContact CD2-CG2 3.72Å; V131-I133 HydrophobicContact CG1-CD1 4.21Å; V131-I133 HydrophobicContact CG1-CG1 3.55Å; V131-I133 PolarHBondContact O-N 3.42Å; V131-V149 HydrophobicContact CG1-CG1 4.5Å; V131-V151 HydrophobicContact CG2-CG2 4.12Å; V131-F162 HydrophobicContact CB-CD1 3.85Å; V131-F162 HydrophobicContact CB-CD2 4.24Å; V131-F162 HydrophobicContact CB-CE1 4Å; V131-F162 HydrophobicContact CB-CE2 4.38Å; V131-F162 HydrophobicContact CB-CG 4Å; V131-F162 HydrophobicContact CB-CZ 4.29Å; V131-F162 HydrophobicContact CG2-CD1 3.87Å; V131-F162 HydrophobicContact CG2-CD2 3.85Å; V131-F162 HydrophobicContact CG2-CE1 3.55Å; V131-F162 HydrophobicContact CG2-CE2 3.53Å; V131-F162 HydrophobicContact CG2-CG 4.04Å; V131-F162 HydrophobicContact CG2-CZ 3.39Å; V131-L181 PolarHBondContact N-O 3.04Å; V131-L181 PolarHBondContact O-N 3.34Å
132	F	90	Very high	76.4	Confident	63 Å²	63	19.3 Å²	19.3	28%	0.276	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	111	170.5	-165.9	-92.6	0	0	0	107.1	T83 E134 A178 R179 E180	T83-F132 PolarHBondContact N-O 3.19Å; T83-F132 PolarHBondContact O-N 3.36Å; F132-E134 HydrophobicContact CE1-CB 4.44Å; F132-A178 HydrophobicContact CE1-CB 3.79Å; F132-A178 HydrophobicContact CE2-CB 4.5Å; F132-A178 HydrophobicContact CZ-CB 3.61Å; F132-R179 WeakPolarHBondContact CA-O 3.19Å; F132-E180 HydrophobicContact CD2-CB 4.01Å
133	I	90.9	Very high	76.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.2	172.3	-72.1	-109.4	0	0	0	107.7	L66 I80 I82 V131 W144 L146 V149 F168 A178 R179 L181	L66-I133 HydrophobicContact CD2-CD1 3.5Å; I80-I133 HydrophobicContact CG2-CG2 4.21Å; I82-I133 HydrophobicContact CB-CD1 4.34Å; I82-I133 HydrophobicContact CD1-CD1 3.99Å; I82-I133 HydrophobicContact CG1-CD1 4.02Å; I82-I133 HydrophobicContact CG1-CG1 4.29Å; V131-I133 HydrophobicContact CG1-CD1 4.21Å; V131-I133 HydrophobicContact CG1-CG1 3.55Å; V131-I133 PolarHBondContact O-N 3.42Å; I133-W144 HydrophobicContact CG2-CH2 4.21Å; I133-W144 HydrophobicContact CG2-CZ3 3.68Å; I133-L146 HydrophobicContact CB-CD2 4.5Å; I133-L146 HydrophobicContact CG2-CD2 3.92Å; I133-V149 HydrophobicContact CD1-CG1 4.35Å; I133-V149 HydrophobicContact CD1-CG2 3.63Å; I133-V149 HydrophobicContact CG1-CG2 3.96Å; I133-F168 HydrophobicContact CB-CE1 4.38Å; I133-F168 HydrophobicContact CB-CZ 4.01Å; I133-F168 HydrophobicContact CG2-CE1 3.89Å; I133-F168 HydrophobicContact CG2-CE2 4.15Å; I133-F168 HydrophobicContact CG2-CZ 3.6Å; I133-F168 WeakPolarHBondContact O-CE1 3.49Å; I133-A178 CarbonylContact O-C 3.52Å; I133-A178 WeakPolarHBondContact O-CA 3.48Å; I133-R179 PolarHBondContact N-O 3.32Å; I133-R179 PolarHBondContact O-N 3.07Å; I133-L181 HydrophobicContact CB-CD1 4.43Å; I133-L181 HydrophobicContact CG1-CD1 4.32Å
134	E	87.7	Confident	77	Confident	26 Å²	26	17.6 Å²	17.6	12%	0.121	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	131.3	169	63.1	-160.8	123.4	0	0	105.8	Y81 R93 F132 I177 A178	Y81-E134 PolarHBondContact N-O 3.43Å; Y81-E134 PolarHBondContact O-N 3.1Å; Y81-E134 VanDerWaalsContact O-O 3.07Å; R93-E134 WeakPolarHBondContact CG-OE1 3.29Å; R93-E134 IonicContact CZ-OE1 3.95Å; R93-E134 IonicContact CZ-OE2 3.71Å; R93-E134 IonicContact NE-OE1 2.69Å; R93-E134 PolarHBondContact NE-OE1 2.59Å; R93-E134 IonicContact NE-OE2 3.35Å; R93-E134 PolarHBondContact NE-OE2 3.09Å; R93-E134 IonicContact NH2-OE1 3.45Å; R93-E134 IonicContact NH2-OE2 3.7Å; R93-E134 PolarHBondContact NH2-OE2 2.91Å; F132-E134 HydrophobicContact CE1-CB 4.44Å; E134-I177 WeakPolarHBondContact CA-O 3.49Å; E134-A178 HydrophobicContact CB-CB 3.8Å
135	H	81.2	Confident	77.1	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.086	C	C	.	.			trans	-87.3	153	142.5	70.6	7.4	0	0	0	107.6	A78 I80 S137 W144 F168 I177 E2235	A78-H135 HydrophobicContact CB-CB 3.79Å; I80-H135 HydrophobicContact CG1-CB 4.34Å; H135-S137 VanDerWaalsContact C-N 3.34Å; H135-S137 VanDerWaalsContact C-OG 3.27Å; H135-S137 WeakPolarHBondContact ND1-CB 3.36Å; H135-S137 PolarHBondContact ND1-OG 2.69Å; H135-S137 WeakPolarHBondContact O-CB 3.43Å; H135-S137 PolarHBondContact O-N 2.98Å; H135-W144 HydrophobicContact CB-CE3 4.47Å; H135-W144 VanDerWaalsContact CD2-CB 3.41Å; H135-W144 WeakPolarHBondContact CD2-CB 3.38Å; H135-W144 VanDerWaalsContact NE2-CB 3.35Å; H135-W144 WeakPolarHBondContact NE2-CB 3.4Å; H135-W144 PolarHBondContact NE2-N 2.89Å; H135-F168 WeakPolarHBondContact CE1-CB 3.18Å; H135-F168 PolarHBondContact CE1-O 3.14Å; H135-F168 PolarHBondContact NE2-O 3.03Å; H135-I177 WeakPolarHBondContact O-CG2 3.37Å; H135-E2235 IonicContact CE1-OE2 3.31Å; H135-E2235 PolarHBondContact CE1-OE2 3.27Å; H135-E2235 IonicContact ND1-OE2 3.26Å; H135-E2235 PolarHBondContact ND1-OE2 3.04Å
136	D	71.9	Confident	77.3	Confident	9 Å²	9	17 Å²	17	5%	0.048	9%	0.086	C	C	.	.			trans	-89.2	32.5	-144.9	42.7	-36.1	0	0	0	115.7	Q79 Y81 E2238 T2239 T2242 T2243	Q79-D136 PolarHBondContact N-OD1 3.24Å; Y81-D136 HydrophobicContact CD2-CB 3.79Å; Y81-D136 HydrophobicContact CE2-CB 3.67Å; D136-E2238 CarbonylContact O-C 3.5Å; D136-T2239 PolarHBondContact N-OG1 2.95Å; D136-T2239 WeakPolarHBondContact O-CA 3.3Å; D136-T2239 PolarHBondContact O-N 3.13Å; D136-T2239 WeakPolarHBondContact OD1-CB 3.22Å; D136-T2239 VanDerWaalsContact OD1-CG2 3.29Å; D136-T2239 WeakPolarHBondContact OD1-CG2 3.5Å; D136-T2239 PolarHBondContact OD1-OG1 2.99Å; D136-T2239 WeakPolarHBondContact OD2-CA 3.45Å; D136-T2239 VanDerWaalsContact OD2-CB 3.3Å; D136-T2239 WeakPolarHBondContact OD2-CB 3.22Å; D136-T2239 WeakPolarHBondContact OD2-CG2 3.4Å; D136-T2239 PolarHBondContact OD2-OG1 2.81Å; D136-T2242 PolarHBondContact O-OG1 3.06Å; D136-T2243 WeakPolarHBondContact OD2-CG2 3.49Å
137	S	67.2	Low	77.2	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.014	8%	0.083	C	C	.	.				-122.6	142.9	-106.2	-101.4	0	0	0	0	118.4	H135 I177 E2235 S2236 T2239	H135-S137 VanDerWaalsContact C-N 3.34Å; H135-S137 VanDerWaalsContact C-OG 3.27Å; H135-S137 WeakPolarHBondContact ND1-CB 3.36Å; H135-S137 PolarHBondContact ND1-OG 2.69Å; H135-S137 WeakPolarHBondContact O-CB 3.43Å; H135-S137 PolarHBondContact O-N 2.98Å; S137-I177 VanDerWaalsContact N-CG2 3.33Å; S137-E2235 VanDerWaalsContact C-CG 3.47Å; S137-E2235 WeakPolarHBondContact CB-OE2 3.47Å; S137-E2235 WeakPolarHBondContact O-CG 3.41Å; S137-S2236 VanDerWaalsContact CA-CA 3.42Å; S137-S2236 VanDerWaalsContact CA-N 3.32Å; S137-S2236 WeakPolarHBondContact OG-CA 3.29Å; S137-S2236 WeakPolarHBondContact OG-CB 3.47Å; S137-S2236 PolarHBondContact OG-N 2.95Å; S137-T2239 VanDerWaalsContact CA-OG1 3.25Å; S137-T2239 WeakPolarHBondContact CA-OG1 3.26Å; S137-T2239 PolarHBondContact OG-OG1 2.87Å
138	L	62.5	Low	77.3	Confident	19 Å²	19	16.6 Å²	16.6	10%	0.099	8%	0.08	C	C	.	.			trans	-139.5	53.4	149.2	-63.1	-169.2	0	0	0	123.9	L170 Q2234 E2235 S2236 I2237 E2238	L138-L170 HydrophobicContact CD2-CD1 3.31Å; L138-L170 HydrophobicContact CD2-CG 4.21Å; L138-Q2234 CarbonylContact C-O 3.54Å; L138-Q2234 VanDerWaalsContact CA-C 3.48Å; L138-Q2234 WeakPolarHBondContact CA-O 3.43Å; L138-Q2234 HydrophobicContact CB-CG 4.35Å; L138-Q2234 WeakPolarHBondContact CB-O 3.4Å; L138-Q2234 CarbonylContact O-C 3.5Å; L138-Q2234 WeakPolarHBondContact O-CA 3.31Å; L138-E2235 VanDerWaalsContact C-C 3.45Å; L138-E2235 VanDerWaalsContact C-CA 3.44Å; L138-E2235 HydrophobicContact CD2-CG 4.19Å; L138-S2236 VanDerWaalsContact C-CA 3.42Å; L138-I2237 HydrophobicContact CB-CB 3.78Å; L138-I2237 HydrophobicContact CB-CG2 4.41Å; L138-I2237 WeakPolarHBondContact O-CB 3.42Å; L138-I2237 WeakPolarHBondContact O-CG1 3.38Å; L138-I2237 PolarHBondContact O-N 3.38Å; L138-E2238 HydrophobicContact CB-CB 4.39Å; L138-E2238 HydrophobicContact CB-CG 4.39Å; L138-E2238 HydrophobicContact CD1-CB 4.37Å; L138-E2238 HydrophobicContact CD1-CG 3.64Å; L138-E2238 VanDerWaalsContact CD1-OE1 3.31Å; L138-E2238 WeakPolarHBondContact CD1-OE1 3.42Å; L138-E2238 WeakPolarHBondContact CD1-OE2 3.35Å; L138-E2238 HydrophobicContact CG-CB 3.96Å; L138-E2238 HydrophobicContact CG-CG 3.81Å
139	R	61.9	Low	77.7	Confident	55 Å²	55	16.1 Å²	16.1	21%	0.208	8%	0.077	C	C	.	.			trans	-129	108.9	157.4	-47.9	168.8	172.5	-121.7	-7.1	122.4	S141 D142 S143 I2232 D2233 E2235 S2236 I2237	R139-S141 PolarHBondContact O-N 3.48Å; R139-S141 VanDerWaalsContact O-N 3.1Å; R139-D142 PolarHBondContact O-N 3.35Å; R139-S143 PolarHBondContact O-N 3.42Å; R139-I2232 VanDerWaalsContact CB-C 3.47Å; R139-I2232 HydrophobicContact CB-CB 4.06Å; R139-I2232 HydrophobicContact CB-CG2 3.41Å; R139-I2232 VanDerWaalsContact CB-CG2 3.41Å; R139-I2232 VanDerWaalsContact CB-O 3.25Å; R139-I2232 WeakPolarHBondContact CB-O 3.39Å; R139-I2232 VanDerWaalsContact CD-CG2 3.45Å; R139-I2232 WeakPolarHBondContact CD-O 3.26Å; R139-I2232 HydrophobicContact CG-CB 4.3Å; R139-I2232 HydrophobicContact CG-CG2 3.98Å; R139-I2232 WeakPolarHBondContact CG-O 3.48Å; R139-I2232 PolarHBondContact NH1-O 2.99Å; R139-D2233 WeakPolarHBondContact CA-O 3.29Å; R139-E2235 CarbonylContact C-O 3.54Å; R139-E2235 VanDerWaalsContact CA-C 3.42Å; R139-E2235 PolarHBondContact N-O 2.9Å; R139-E2235 CarbonylContact O-C 3.59Å; R139-S2236 WeakPolarHBondContact CA-OG 3.3Å; R139-S2236 WeakPolarHBondContact CB-OG 3.21Å; R139-S2236 WeakPolarHBondContact CD-O 3.25Å; R139-S2236 VanDerWaalsContact CG-C 3.45Å; R139-S2236 WeakPolarHBondContact CG-O 3.29Å; R139-S2236 PolarHBondContact N-OG 3.32Å; R139-S2236 PolarHBondContact O-OG 3.49Å; R139-I2237 HydrophobicContact CG-CB 4.1Å; R139-I2237 HydrophobicContact CG-CD1 4.36Å; R139-I2237 HydrophobicContact CG-CG1 3.51Å
140	K	59.4	Low	78	Confident	8 Å²	8	13.3 Å²	13.3	4%	0.035	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-20.9	-163.8	-173.4	175.2	172.9	-105.1	0	120.8	S143 Y171 K172 E2220 V2221 D2233	K140-S143 VanDerWaalsContact C-OG 3.23Å; K140-S143 WeakPolarHBondContact CA-OG 3.43Å; K140-S143 WeakPolarHBondContact O-CB 3.49Å; K140-S143 PolarHBondContact O-N 3.03Å; K140-S143 PolarHBondContact O-OG 2.88Å; K140-S143 VanDerWaalsContact O-OG 3.08Å; K140-Y171 HydrophobicContact CB-CD2 3.39Å; K140-Y171 HydrophobicContact CB-CE2 3.54Å; K140-Y171 HydrophobicContact CB-CG 4.16Å; K140-Y171 HydrophobicContact CD-CD1 4.01Å; K140-Y171 HydrophobicContact CD-CD2 3.69Å; K140-Y171 HydrophobicContact CD-CE1 4.5Å; K140-Y171 HydrophobicContact CD-CE2 4.16Å; K140-Y171 HydrophobicContact CD-CG 3.53Å; K140-Y171 HydrophobicContact CG-CD2 3.46Å; K140-Y171 VanDerWaalsContact CG-CD2 3.46Å; K140-Y171 HydrophobicContact CG-CE2 4.07Å; K140-Y171 HydrophobicContact CG-CG 3.74Å; K140-K172 PolarHBondContact O-NZ 3.02Å; K140-E2220 WeakPolarHBondContact CE-OE1 3.43Å; K140-E2220 IonicContact NZ-OE1 2.78Å; K140-E2220 PolarHBondContact NZ-OE1 3.49Å; K140-E2220 IonicContact NZ-OE2 3.81Å; K140-E2220 PolarHBondContact NZ-OE2 2.62Å; K140-V2221 WeakPolarHBondContact CD-O 3.49Å; K140-D2233 VanDerWaalsContact C-CG 3.49Å; K140-D2233 VanDerWaalsContact C-OD1 3.28Å; K140-D2233 WeakPolarHBondContact CA-OD1 3.41Å; K140-D2233 WeakPolarHBondContact CA-OD2 3.41Å; K140-D2233 HydrophobicContact CB-CB 3.45Å; K140-D2233 VanDerWaalsContact CB-CB 3.45Å; K140-D2233 VanDerWaalsContact CB-OD1 3.27Å; K140-D2233 WeakPolarHBondContact CB-OD1 3.3Å; K140-D2233 VanDerWaalsContact N-CB 3.3Å; K140-D2233 PolarHBondContact N-OD2 3Å
141	S	61.1	Low	78.2	Confident	29 Å²	29	13.3 Å²	13.3	20%	0.203	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-3.8	-173.5	56.5	0	0	0	0	114.6	R139 D2233	R139-S141 PolarHBondContact O-N 3.48Å; R139-S141 VanDerWaalsContact O-N 3.1Å; S141-D2233 WeakPolarHBondContact CB-OD1 3.48Å; S141-D2233 PolarHBondContact N-OD1 2.72Å; S141-D2233 PolarHBondContact N-OD2 3.28Å; S141-D2233 PolarHBondContact OG-OD1 3.12Å; S141-D2233 PolarHBondContact OG-OD2 2.9Å
142	D	72.6	Confident	77.9	Confident	8 Å²	8	16.1 Å²	16.1	4%	0.043	8%	0.077	C	C	.	.	S	Bend	trans	-71.9	-10.9	135.7	-87.8	-15.6	0	0	0	111.4	G75 T76 S77 R139 W144 I2232 S2236	G75-D142 CarbonylContact O-C 3.54Å; G75-D142 WeakPolarHBondContact O-CA 3.46Å; T76-D142 WeakPolarHBondContact CA-O 3.3Å; T76-D142 WeakPolarHBondContact CB-O 3.31Å; T76-D142 PolarHBondContact OG1-O 2.75Å; S77-D142 WeakPolarHBondContact CB-OD1 3.08Å; S77-D142 VanDerWaalsContact CB-OD2 3.27Å; S77-D142 WeakPolarHBondContact CB-OD2 3.32Å; S77-D142 PolarHBondContact N-OD1 3.12Å; S77-D142 PolarHBondContact OG-OD1 2.77Å; S77-D142 PolarHBondContact OG-OD2 3.31Å; R139-D142 PolarHBondContact O-N 3.35Å; D142-W144 PolarHBondContact O-N 3.34Å; D142-I2232 HydrophobicContact CB-CG2 3.95Å; D142-I2232 VanDerWaalsContact OD2-CG2 3.3Å; D142-I2232 WeakPolarHBondContact OD2-CG2 3.39Å; D142-S2236 WeakPolarHBondContact CB-OG 3.38Å
143	S	78	Confident	77.6	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.065	C	C	.	.			trans	-61	137	176.8	-65.3	0	0	0	0	112	R139 K140 W167 F168 S169 E2235	R139-S143 PolarHBondContact O-N 3.42Å; K140-S143 VanDerWaalsContact C-OG 3.23Å; K140-S143 WeakPolarHBondContact CA-OG 3.43Å; K140-S143 WeakPolarHBondContact O-CB 3.49Å; K140-S143 PolarHBondContact O-N 3.03Å; K140-S143 PolarHBondContact O-OG 2.88Å; K140-S143 VanDerWaalsContact O-OG 3.08Å; S143-W167 WeakPolarHBondContact O-CZ3 3.28Å; S143-F168 WeakPolarHBondContact CB-O 3.23Å; S143-S169 VanDerWaalsContact CB-CB 3.47Å; S143-S169 WeakPolarHBondContact CB-OG 3.37Å; S143-S169 WeakPolarHBondContact OG-CB 3.4Å; S143-S169 PolarHBondContact OG-OG 2.9Å; S143-E2235 PolarHBondContact OG-O 3.23Å; S143-E2235 VanDerWaalsContact OG-O 3.06Å
144	W	88.7	Confident	76.4	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	111.4	-152.5	-178	49.5	0	0	0	110	L66 T68 T76 I80 I133 H135 D142 L146 F168	L66-W144 HydrophobicContact CB-CZ2 4.28Å; L66-W144 HydrophobicContact CD2-CH2 3.61Å; L66-W144 HydrophobicContact CD2-CZ2 4.09Å; T68-W144 VanDerWaalsContact CG2-CD1 3.47Å; T68-W144 PolarHBondContact OG1-NE1 2.76Å; T76-W144 HydrophobicContact CG2-CB 3.98Å; T76-W144 VanDerWaalsContact CG2-CD1 3.43Å; T76-W144 HydrophobicContact CG2-CD2 4.02Å; T76-W144 HydrophobicContact CG2-CG 3.57Å; I80-W144 HydrophobicContact CD1-CD2 3.88Å; I80-W144 HydrophobicContact CD1-CE3 3.92Å; I80-W144 HydrophobicContact CD1-CH2 3.35Å; I80-W144 HydrophobicContact CD1-CZ2 3.26Å; I80-W144 HydrophobicContact CD1-CZ3 3.67Å; I80-W144 HydrophobicContact CG1-CH2 4.43Å; I80-W144 HydrophobicContact CG1-CZ3 4.46Å; I80-W144 HydrophobicContact CG2-CH2 3.7Å; I80-W144 HydrophobicContact CG2-CZ3 3.63Å; I133-W144 HydrophobicContact CG2-CH2 4.21Å; I133-W144 HydrophobicContact CG2-CZ3 3.68Å; H135-W144 HydrophobicContact CB-CE3 4.47Å; H135-W144 VanDerWaalsContact CD2-CB 3.41Å; H135-W144 WeakPolarHBondContact CD2-CB 3.38Å; H135-W144 VanDerWaalsContact NE2-CB 3.35Å; H135-W144 WeakPolarHBondContact NE2-CB 3.4Å; H135-W144 PolarHBondContact NE2-N 2.89Å; D142-W144 PolarHBondContact O-N 3.34Å; W144-L146 HydrophobicContact CD2-CB 4Å; W144-L146 HydrophobicContact CE3-CB 3.94Å; W144-L146 HydrophobicContact CH2-CB 3.96Å; W144-L146 HydrophobicContact CH2-CD1 3.61Å; W144-L146 HydrophobicContact CH2-CD2 3.56Å; W144-L146 HydrophobicContact CH2-CG 3.88Å; W144-L146 HydrophobicContact CZ2-CB 4.05Å; W144-L146 HydrophobicContact CZ2-CD1 3.52Å; W144-L146 HydrophobicContact CZ2-CD2 4.31Å; W144-L146 HydrophobicContact CZ2-CG 4.14Å; W144-L146 HydrophobicContact CZ3-CB 3.92Å; W144-L146 HydrophobicContact CZ3-CD1 4.41Å; W144-L146 HydrophobicContact CZ3-CD2 3.71Å; W144-L146 HydrophobicContact CZ3-CG 4.21Å; W144-L146 PolarHBondContact O-N 3.09Å; W144-F168 HydrophobicContact CB-CB 4.44Å; W144-F168 HydrophobicContact CE3-CB 4.25Å; W144-F168 AromaticContact CE3-CD2 3.79Å; W144-F168 HydrophobicContact CE3-CD2 3.79Å; W144-F168 HydrophobicContact CE3-CE2 4.45Å; W144-F168 HydrophobicContact CE3-CG 4.08Å; W144-F168 HydrophobicContact CZ3-CD2 4.1Å; W144-F168 HydrophobicContact CZ3-CE2 4.32Å; W144-F168 PolarHBondContact N-O 2.82Å; W144-F168 PolarHBondContact O-N 3.01Å
145	L	84.8	Confident	75.4	Confident	20 Å²	20	20.4 Å²	20.4	11%	0.105	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	85.3	166.3	-173.3	53.2	0	0	0	107.4	A69 V71 A74 E147 N165 W167	A69-L145 HydrophobicContact CB-CB 3.93Å; A69-L145 HydrophobicContact CB-CD2 3.66Å; A69-L145 HydrophobicContact CB-CG 3.58Å; A69-L145 WeakPolarHBondContact CB-O 3.45Å; A69-L145 PolarHBondContact N-O 3.19Å; V71-L145 HydrophobicContact CG2-CB 4.48Å; V71-L145 HydrophobicContact CG2-CD2 3.75Å; A74-L145 HydrophobicContact CB-CB 3.63Å; A74-L145 PolarHBondContact O-N 2.73Å; L145-E147 PolarHBondContact O-N 2.83Å; L145-N165 VanDerWaalsContact CD1-O 3.3Å; L145-N165 WeakPolarHBondContact CD1-O 3.42Å; L145-W167 HydrophobicContact CB-CD2 3.71Å; L145-W167 HydrophobicContact CB-CE3 3.66Å; L145-W167 HydrophobicContact CB-CG 4.41Å; L145-W167 HydrophobicContact CB-CH2 3.92Å; L145-W167 HydrophobicContact CB-CZ2 3.94Å; L145-W167 HydrophobicContact CB-CZ3 3.77Å; L145-W167 HydrophobicContact CD1-CD2 4.01Å; L145-W167 HydrophobicContact CD1-CG 3.88Å; L145-W167 HydrophobicContact CD2-CZ2 3.88Å; L145-W167 HydrophobicContact CG-CD2 4.28Å; L145-W167 HydrophobicContact CG-CZ2 4.41Å
146	L	84.3	Confident	75	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	121.1	170.3	174	52.6	0	0	0	108	L66 T67 I133 W144 S148 V149 C164 N165 F168 L181	L66-L146 HydrophobicContact CB-CD1 4.47Å; T67-L146 WeakPolarHBondContact O-CD1 3.48Å; I133-L146 HydrophobicContact CB-CD2 4.5Å; I133-L146 HydrophobicContact CG2-CD2 3.92Å; W144-L146 HydrophobicContact CD2-CB 4Å; W144-L146 HydrophobicContact CE3-CB 3.94Å; W144-L146 HydrophobicContact CH2-CB 3.96Å; W144-L146 HydrophobicContact CH2-CD1 3.61Å; W144-L146 HydrophobicContact CH2-CD2 3.56Å; W144-L146 HydrophobicContact CH2-CG 3.88Å; W144-L146 HydrophobicContact CZ2-CB 4.05Å; W144-L146 HydrophobicContact CZ2-CD1 3.52Å; W144-L146 HydrophobicContact CZ2-CD2 4.31Å; W144-L146 HydrophobicContact CZ2-CG 4.14Å; W144-L146 HydrophobicContact CZ3-CB 3.92Å; W144-L146 HydrophobicContact CZ3-CD1 4.41Å; W144-L146 HydrophobicContact CZ3-CD2 3.71Å; W144-L146 HydrophobicContact CZ3-CG 4.21Å; W144-L146 PolarHBondContact O-N 3.09Å; L146-S148 WeakPolarHBondContact CD1-O 3.31Å; L146-V149 HydrophobicContact CD1-CG2 4.2Å; L146-V149 HydrophobicContact CD2-CG2 3.72Å; L146-V149 HydrophobicContact CG-CG2 4.46Å; L146-C164 HydrophobicContact CB-CB 4.08Å; L146-C164 HydrophobicContact CD2-CB 4.02Å; L146-C164 HydrophobicContact CG-CB 3.79Å; L146-C164 WeakPolarHBondContact O-CB 3.41Å; L146-N165 PolarHBondContact O-N 2.92Å; L146-F168 HydrophobicContact CB-CD2 3.62Å; L146-F168 HydrophobicContact CB-CE2 3.54Å; L146-F168 HydrophobicContact CD2-CD2 4.22Å; L146-F168 HydrophobicContact CD2-CE2 3.4Å; L146-F168 HydrophobicContact CD2-CZ 4.02Å; L146-F168 HydrophobicContact CG-CE2 4.04Å; L146-L181 HydrophobicContact CD2-CD1 3.96Å
147	E	77.6	Confident	74.9	Confident	3 Å²	3	30.4 Å²	30.4	1%	0.014	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-63.2	175.2	-150.4	-177.9	86.1	0	0	108.6	T67 A69 L145 M163 C164 N165 I219	T67-E147 HydrophobicContact CG2-CB 4.02Å; T67-E147 VanDerWaalsContact CG2-OE1 3.29Å; T67-E147 WeakPolarHBondContact CG2-OE1 3.41Å; T67-E147 WeakPolarHBondContact O-CA 3.48Å; T67-E147 WeakPolarHBondContact O-CB 3.39Å; T67-E147 PolarHBondContact O-N 2.83Å; A69-E147 WeakPolarHBondContact CA-OE2 3.16Å; A69-E147 HydrophobicContact CB-CB 4.33Å; A69-E147 HydrophobicContact CB-CG 4.36Å; L145-E147 PolarHBondContact O-N 2.83Å; E147-M163 WeakPolarHBondContact O-CE 3.37Å; E147-C164 PolarHBondContact O-N 3.33Å; E147-N165 PolarHBondContact O-N 2.63Å; E147-N165 PolarHBondContact O-OD1 2.7Å; E147-I219 HydrophobicContact CG-CB 3.64Å; E147-I219 HydrophobicContact CG-CD1 3.58Å; E147-I219 HydrophobicContact CG-CG1 4.08Å; E147-I219 HydrophobicContact CG-CG2 3.96Å
148	S	79.2	Confident	74.8	Confident	5 Å²	5	34.9 Å²	34.9	4%	0.035	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	157.5	-179.4	66.8	0	0	0	0	113.9	L66 T67 L146 F162 M163	L66-S148 WeakPolarHBondContact CA-O 3.34Å; T67-S148 PolarHBondContact N-O 3.25Å; T67-S148 PolarHBondContact O-N 3.12Å; L146-S148 WeakPolarHBondContact CD1-O 3.31Å; S148-F162 WeakPolarHBondContact CA-O 3.33Å; S148-M163 VanDerWaalsContact CB-SD 3.52Å
149	V	85.9	Confident	75.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.7	169	-172.1	0	0	0	0	108.5	V64 V65 L66 I82 V131 I133 L146 V151 M161 F162 L181	V64-V149 HydrophobicContact CG1-CG1 3.87Å; V65-V149 CarbonylContact O-C 3.5Å; V65-V149 WeakPolarHBondContact O-CA 3.38Å; L66-V149 HydrophobicContact CD2-CG2 4.17Å; L66-V149 HydrophobicContact CG-CG1 4.27Å; L66-V149 HydrophobicContact CG-CG2 4.46Å; I82-V149 HydrophobicContact CD1-CG1 4.35Å; V131-V149 HydrophobicContact CG1-CG1 4.5Å; I133-V149 HydrophobicContact CD1-CG1 4.35Å; I133-V149 HydrophobicContact CD1-CG2 3.63Å; I133-V149 HydrophobicContact CG1-CG2 3.96Å; L146-V149 HydrophobicContact CD1-CG2 4.2Å; L146-V149 HydrophobicContact CD2-CG2 3.72Å; L146-V149 HydrophobicContact CG-CG2 4.46Å; V149-V151 HydrophobicContact CG1-CG2 4.17Å; V149-M161 CarbonylContact O-C 3.58Å; V149-M161 VanDerWaalsContact O-CA 3.24Å; V149-M161 WeakPolarHBondContact O-CA 3.36Å; V149-F162 HydrophobicContact CB-CB 4.22Å; V149-F162 HydrophobicContact CB-CD2 4.33Å; V149-F162 PolarHBondContact N-O 3.32Å; V149-F162 PolarHBondContact O-N 3.01Å; V149-L181 HydrophobicContact CG2-CD1 4.01Å
150	Q	83.1	Confident	75.8	Confident	32 Å²	32	38.3 Å²	38.3	15%	0.15	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134	165.4	-57.6	179.1	13	0	0	109.8	V64 V65 Y160 M161	V64-Q150 CarbonylContact C-O 3.6Å; V64-Q150 WeakPolarHBondContact CA-O 3.33Å; V65-Q150 HydrophobicContact CB-CB 4.21Å; V65-Q150 PolarHBondContact N-O 2.98Å; V65-Q150 PolarHBondContact O-N 3.16Å; Q150-Y160 CarbonylContact C-O 3.39Å; Q150-Y160 WeakPolarHBondContact CA-O 3.36Å; Q150-M161 HydrophobicContact CG-CB 4.15Å; Q150-M161 HydrophobicContact CG-CG 3.82Å; Q150-M161 HydrophobicContact CG-SD 4.03Å; Q150-M161 PolarHBondContact NE2-SD 3.12Å
151	V	87	Confident	76.4	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.3	174.7	-171.5	0	0	0	0	109.5	Y62 V64 L84 L128 V131 V149 R159 Y160 F162	Y62-V151 HydrophobicContact CD1-CG1 4.32Å; V64-V151 HydrophobicContact CG1-CG2 4.37Å; V64-V151 HydrophobicContact CG2-CG1 4.22Å; V64-V151 HydrophobicContact CG2-CG2 4.25Å; L84-V151 HydrophobicContact CD1-CG1 4.33Å; L84-V151 HydrophobicContact CD2-CG1 4.22Å; L84-V151 HydrophobicContact CD2-CG2 3.9Å; L128-V151 HydrophobicContact CD1-CB 3.84Å; L128-V151 HydrophobicContact CD1-CG1 3.41Å; L128-V151 VanDerWaalsContact CD1-CG1 3.41Å; L128-V151 HydrophobicContact CD1-CG2 4.47Å; V131-V151 HydrophobicContact CG2-CG2 4.12Å; V149-V151 HydrophobicContact CG1-CG2 4.17Å; V151-R159 WeakPolarHBondContact O-CA 3.12Å; V151-Y160 PolarHBondContact N-O 2.91Å; V151-Y160 PolarHBondContact O-N 2.74Å; V151-F162 HydrophobicContact CB-CE2 4.17Å; V151-F162 HydrophobicContact CG2-CD2 4.29Å; V151-F162 HydrophobicContact CG2-CE2 3.76Å
152	F	81.9	Confident	77.3	Confident	59 Å²	59	36.8 Å²	36.8	26%	0.259	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.2	177.3	173.2	-98.9	0	0	0	110	K63 K157 K158 R159	K63-F152 HydrophobicContact CB-CB 4.29Å; K63-F152 HydrophobicContact CB-CD1 4.13Å; K63-F152 PolarHBondContact N-O 3.48Å; K63-F152 PolarHBondContact O-N 3Å; F152-K157 HydrophobicContact CE2-CB 4Å; F152-K157 HydrophobicContact CE2-CG 4.46Å; F152-K157 VanDerWaalsContact CE2-O 3.3Å; F152-K157 WeakPolarHBondContact CE2-O 3.35Å; F152-K157 HydrophobicContact CZ-CB 4.18Å; F152-K157 HydrophobicContact CZ-CG 4.14Å; F152-K158 WeakPolarHBondContact CA-O 3.23Å; F152-R159 HydrophobicContact CB-CG 4.44Å; F152-R159 HydrophobicContact CD2-CG 3.78Å
153	H	81.8	Confident	77.2	Confident	4 Å²	4	38 Å²	38	2%	0.019	18%	0.18	C	C	.	.			trans	-85.8	119.8	176.7	-172.5	-18.6	0	0	0	108.6	Y62 D124 T156 K157 K158	Y62-H153 HydrophobicContact CD1-CB 4.15Å; Y62-H153 HydrophobicContact CE1-CB 4.01Å; Y62-H153 AromaticContact CE1-CD2 3.78Å; Y62-H153 AromaticContact CE1-CG 3.6Å; Y62-H153 AromaticContact CE1-ND1 3.81Å; D124-H153 IonicContact OD1-CE1 3.42Å; D124-H153 IonicContact OD1-NE2 3.13Å; D124-H153 PolarHBondContact OD1-NE2 2.9Å; D124-H153 IonicContact OD2-CE1 3.25Å; D124-H153 IonicContact OD2-NE2 2.72Å; H153-T156 WeakPolarHBondContact CB-OG1 3.49Å; H153-T156 PolarHBondContact CD2-OG1 2.79Å; H153-K157 VanDerWaalsContact O-CA 3.31Å; H153-K157 WeakPolarHBondContact O-CA 3.29Å; H153-K157 PolarHBondContact O-N 2.84Å; H153-K158 PolarHBondContact N-O 3.38Å; H153-K158 VanDerWaalsContact N-O 3.07Å
154	P	66.9	Low	77.2	Confident	48 Å²	48	38.4 Å²	38.4	31%	0.312	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-48.4	-168.8	25.9	-37.2	0	0	0	112.4	T60 L61	T60-P154 HydrophobicContact CG2-CG 3.61Å; L61-P154 VanDerWaalsContact O-CD 3.31Å; L61-P154 WeakPolarHBondContact O-CD 3.34Å; L61-P154 VanDerWaalsContact O-CG 3.23Å; L61-P154 WeakPolarHBondContact O-CG 3.49Å
155	L	65.6	Low	76.8	Confident	126 Å²	126	41.2 Å²	41.2	66%	0.66	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-48.5	-178.2	-63.1	172.5	0	0	0	112.4
156	T	73.9	Confident	76.4	Confident	59 Å²	59	44 Å²	44	36%	0.362	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.6	-175.2	65	0	0	0	0	114.4	H153 K158	H153-T156 WeakPolarHBondContact CB-OG1 3.49Å; H153-T156 PolarHBondContact CD2-OG1 2.79Å; T156-K158 PolarHBondContact O-N 2.87Å
157	K	69.8	Low	76.3	Confident	161 Å²	161	45.9 Å²	45.9	70%	0.7	22%	0.217	S	C	*	.			trans	52.5	9.9	-173.8	-60.3	-174.8	179.7	176.2	0	115.9	F152 H153	F152-K157 HydrophobicContact CE2-CB 4Å; F152-K157 HydrophobicContact CE2-CG 4.46Å; F152-K157 VanDerWaalsContact CE2-O 3.3Å; F152-K157 WeakPolarHBondContact CE2-O 3.35Å; F152-K157 HydrophobicContact CZ-CB 4.18Å; F152-K157 HydrophobicContact CZ-CG 4.14Å; H153-K157 VanDerWaalsContact O-CA 3.31Å; H153-K157 WeakPolarHBondContact O-CA 3.29Å; H153-K157 PolarHBondContact O-N 2.84Å
158	K	64.1	Low	76.4	Confident	96 Å²	96	45.8 Å²	45.8	42%	0.417	22%	0.217	S	C	.	.			trans	-71.5	139.5	180	-69.1	167.8	-172.2	165.7	0	110.8	F152 H153 T156 Y160	F152-K158 WeakPolarHBondContact CA-O 3.23Å; H153-K158 PolarHBondContact N-O 3.38Å; H153-K158 VanDerWaalsContact N-O 3.07Å; T156-K158 PolarHBondContact O-N 2.87Å; K158-Y160 HydrophobicContact CB-CE2 3.76Å; K158-Y160 WeakPolarHBondContact CD-OH 3.47Å
159	R	70.2	Confident	76.2	Confident	135 Å²	135	45.5 Å²	45.5	51%	0.509	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.5	171.8	-66.7	-176.6	-171.3	-141.8	1.8	110.7	V151 F152	V151-R159 WeakPolarHBondContact O-CA 3.12Å; F152-R159 HydrophobicContact CB-CG 4.44Å; F152-R159 HydrophobicContact CD2-CG 3.78Å
160	Y	75	Confident	75	Confident	10 Å²	10	47.4 Å²	47.4	4%	0.039	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.4	174.8	-53.9	-93.4	0	0	0	107.7	L128 Q150 V151 K158 R185	L128-Y160 HydrophobicContact CB-CD1 4.4Å; L128-Y160 HydrophobicContact CB-CD2 4.25Å; L128-Y160 HydrophobicContact CB-CE2 4.42Å; L128-Y160 HydrophobicContact CB-CG 4.24Å; L128-Y160 HydrophobicContact CD1-CD2 4.19Å; L128-Y160 HydrophobicContact CG-CD2 4.49Å; Q150-Y160 CarbonylContact C-O 3.39Å; Q150-Y160 WeakPolarHBondContact CA-O 3.36Å; V151-Y160 PolarHBondContact N-O 2.91Å; V151-Y160 PolarHBondContact O-N 2.74Å; K158-Y160 HydrophobicContact CB-CE2 3.76Å; K158-Y160 WeakPolarHBondContact CD-OH 3.47Å; Y160-R185 HydrophobicContact CD1-CG 4.49Å
161	M	74	Confident	73.8	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.4	-179.2	-173.6	165.7	87.5	0	0	109.9	V149 Q150 M163 I184 S186	V149-M161 CarbonylContact O-C 3.58Å; V149-M161 VanDerWaalsContact O-CA 3.24Å; V149-M161 WeakPolarHBondContact O-CA 3.36Å; Q150-M161 HydrophobicContact CG-CB 4.15Å; Q150-M161 HydrophobicContact CG-CG 3.82Å; Q150-M161 HydrophobicContact CG-SD 4.03Å; Q150-M161 PolarHBondContact NE2-SD 3.12Å; M161-M163 HydrophobicContact CE-SD 3.96Å; M161-M163 HydrophobicContact CG-SD 4.36Å; M161-I184 WeakPolarHBondContact CA-O 3.21Å; M161-I184 WeakPolarHBondContact CB-O 3.21Å; M161-I184 PolarHBondContact N-O 2.99Å; M161-I184 WeakPolarHBondContact O-CA 3.19Å; M161-I184 PolarHBondContact O-N 3.3Å; M161-S186 VanDerWaalsContact CB-CB 3.46Å; M161-S186 WeakPolarHBondContact CE-OG 3.26Å; M161-S186 VanDerWaalsContact SD-CB 3.54Å; M161-S186 PolarHBondContact SD-OG 2.97Å
162	F	80	Confident	72.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	109	-173.8	-50.8	-100	0	0	0	106.1	L128 V131 S148 V149 V151 L181 F182	L128-F162 HydrophobicContact CB-CZ 4.26Å; V131-F162 HydrophobicContact CB-CD1 3.85Å; V131-F162 HydrophobicContact CB-CD2 4.24Å; V131-F162 HydrophobicContact CB-CE1 4Å; V131-F162 HydrophobicContact CB-CE2 4.38Å; V131-F162 HydrophobicContact CB-CG 4Å; V131-F162 HydrophobicContact CB-CZ 4.29Å; V131-F162 HydrophobicContact CG2-CD1 3.87Å; V131-F162 HydrophobicContact CG2-CD2 3.85Å; V131-F162 HydrophobicContact CG2-CE1 3.55Å; V131-F162 HydrophobicContact CG2-CE2 3.53Å; V131-F162 HydrophobicContact CG2-CG 4.04Å; V131-F162 HydrophobicContact CG2-CZ 3.39Å; S148-F162 WeakPolarHBondContact CA-O 3.33Å; V149-F162 HydrophobicContact CB-CB 4.22Å; V149-F162 HydrophobicContact CB-CD2 4.33Å; V149-F162 PolarHBondContact N-O 3.32Å; V149-F162 PolarHBondContact O-N 3.01Å; V151-F162 HydrophobicContact CB-CE2 4.17Å; V151-F162 HydrophobicContact CG2-CD2 4.29Å; V151-F162 HydrophobicContact CG2-CE2 3.76Å; F162-L181 HydrophobicContact CB-CB 3.74Å; F162-L181 HydrophobicContact CB-CD1 4.3Å; F162-L181 WeakPolarHBondContact CD1-O 3.5Å; F162-F182 VanDerWaalsContact CD1-C 3.47Å
163	M	69.3	Low	71.3	Confident	33 Å²	33	50.8 Å²	50.8	16%	0.163	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.5	176.2	-66.4	-50.3	-56.4	0	0	109.1	E147 S148 M161 N165 I184	E147-M163 WeakPolarHBondContact O-CE 3.37Å; S148-M163 VanDerWaalsContact CB-SD 3.52Å; M161-M163 HydrophobicContact CE-SD 3.96Å; M161-M163 HydrophobicContact CG-SD 4.36Å; M163-N165 WeakPolarHBondContact CE-OD1 3.34Å; M163-I184 HydrophobicContact CG-CD1 4.44Å
164	C	79	Confident	70.3	Confident	9 Å²	9	54.6 Å²	54.6	6%	0.061	26%	0.261	C	S	.	.			trans	-108.5	-64	164.9	-174	0	0	0	0	108.9	L146 E147 H166 F168 L181	L146-C164 HydrophobicContact CB-CB 4.08Å; L146-C164 HydrophobicContact CD2-CB 4.02Å; L146-C164 HydrophobicContact CG-CB 3.79Å; L146-C164 WeakPolarHBondContact O-CB 3.41Å; E147-C164 PolarHBondContact O-N 3.33Å; C164-H166 PolarHBondContact O-CD2 3.36Å; C164-H166 VanDerWaalsContact O-CD2 3.3Å; C164-H166 PolarHBondContact O-N 3.05Å; C164-H166 PolarHBondContact SG-N 2.87Å; C164-H166 VanDerWaalsContact SG-N 3.44Å; C164-H166 PolarHBondContact SG-O 2.83Å; C164-F168 HydrophobicContact CB-CE2 4.24Å; C164-F168 WeakPolarHBondContact SG-CE2 3.46Å; C164-L181 HydrophobicContact CB-CD1 3.95Å; C164-L181 HydrophobicContact CB-CD2 3.89Å
165	N	78.8	Confident	70.2	Confident	59 Å²	59	52.9 Å²	52.9	32%	0.316	25%	0.252	S	S	.	.			trans	54.2	2	-168.4	-63.7	-5	0	0	0	114.8	L145 L146 E147 M163 I219	L145-N165 VanDerWaalsContact CD1-O 3.3Å; L145-N165 WeakPolarHBondContact CD1-O 3.42Å; L146-N165 PolarHBondContact O-N 2.92Å; E147-N165 PolarHBondContact O-N 2.63Å; E147-N165 PolarHBondContact O-OD1 2.7Å; M163-N165 WeakPolarHBondContact CE-OD1 3.34Å; N165-I219 HydrophobicContact CB-CD1 4.49Å; N165-I219 WeakPolarHBondContact OD1-CD1 3.38Å
166	H	76.8	Confident	70.4	Confident	80 Å²	80	50.9 Å²	50.9	37%	0.37	24%	0.241	S	C	.	.	S	Bend	trans	-104.3	150	176.7	-66.8	-61.2	0	0	0	111.2	C164 F168 E173	C164-H166 PolarHBondContact O-CD2 3.36Å; C164-H166 VanDerWaalsContact O-CD2 3.3Å; C164-H166 PolarHBondContact O-N 3.05Å; C164-H166 PolarHBondContact SG-N 2.87Å; C164-H166 VanDerWaalsContact SG-N 3.44Å; C164-H166 PolarHBondContact SG-O 2.83Å; H166-F168 PolarHBondContact O-N 2.78Å; H166-E173 WeakPolarHBondContact CA-OE2 3.22Å; H166-E173 WeakPolarHBondContact CB-OE2 3.38Å; H166-E173 IonicContact CE1-OE1 2.69Å; H166-E173 IonicContact CG-OE1 4Å; H166-E173 IonicContact CG-OE2 3.21Å; H166-E173 VanDerWaalsContact ND1-CD 3.29Å; H166-E173 IonicContact ND1-OE1 3.05Å; H166-E173 PolarHBondContact ND1-OE1 3.33Å; H166-E173 IonicContact ND1-OE2 2.68Å; H166-E173 PolarHBondContact ND1-OE2 3.5Å
167	W	81.6	Confident	70.4	Confident	39 Å²	39	50.5 Å²	50.5	15%	0.148	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	127.2	172.7	-68.6	90.8	0	0	0	110.3	V71 G73 A74 S143 L145 S169 K172 E173 R179	V71-W167 HydrophobicContact CG2-CH2 3.72Å; V71-W167 HydrophobicContact CG2-CZ2 3.74Å; G73-W167 WeakPolarHBondContact O-CH2 3.37Å; G73-W167 VanDerWaalsContact O-CZ3 3.22Å; G73-W167 WeakPolarHBondContact O-CZ3 3.42Å; A74-W167 HydrophobicContact CB-CH2 3.78Å; A74-W167 HydrophobicContact CB-CZ3 3.93Å; S143-W167 WeakPolarHBondContact O-CZ3 3.28Å; L145-W167 HydrophobicContact CB-CD2 3.71Å; L145-W167 HydrophobicContact CB-CE3 3.66Å; L145-W167 HydrophobicContact CB-CG 4.41Å; L145-W167 HydrophobicContact CB-CH2 3.92Å; L145-W167 HydrophobicContact CB-CZ2 3.94Å; L145-W167 HydrophobicContact CB-CZ3 3.77Å; L145-W167 HydrophobicContact CD1-CD2 4.01Å; L145-W167 HydrophobicContact CD1-CG 3.88Å; L145-W167 HydrophobicContact CD2-CZ2 3.88Å; L145-W167 HydrophobicContact CG-CD2 4.28Å; L145-W167 HydrophobicContact CG-CZ2 4.41Å; W167-S169 VanDerWaalsContact C-N 3.34Å; W167-S169 PolarHBondContact O-N 3.06Å; W167-K172 HydrophobicContact CB-CB 3.65Å; W167-K172 WeakPolarHBondContact CB-O 3.41Å; W167-K172 HydrophobicContact CD2-CB 3.64Å; W167-K172 HydrophobicContact CD2-CD 3.34Å; W167-K172 HydrophobicContact CD2-CG 4.13Å; W167-K172 HydrophobicContact CE3-CB 4.28Å; W167-K172 HydrophobicContact CE3-CD 3.25Å; W167-K172 HydrophobicContact CE3-CG 4.39Å; W167-K172 HydrophobicContact CG-CB 3.33Å; W167-K172 HydrophobicContact CG-CD 4.02Å; W167-K172 HydrophobicContact CG-CG 4.32Å; W167-K172 HydrophobicContact CH2-CD 3.69Å; W167-K172 HydrophobicContact CZ2-CD 3.78Å; W167-K172 HydrophobicContact CZ3-CD 3.43Å; W167-K172 VanDerWaalsContact CZ3-CD 3.43Å; W167-E173 VanDerWaalsContact CD1-OE2 3.32Å; W167-E173 PolarHBondContact N-OE2 3.23Å; W167-R179 PolarHBondContact O-NH2 2.83Å
168	F	81.1	Confident	71.1	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	95.9	151	-68.2	-91.7	0	0	0	105.7	I133 H135 S143 W144 L146 C164 H166 I177 R179	I133-F168 HydrophobicContact CB-CE1 4.38Å; I133-F168 HydrophobicContact CB-CZ 4.01Å; I133-F168 HydrophobicContact CG2-CE1 3.89Å; I133-F168 HydrophobicContact CG2-CE2 4.15Å; I133-F168 HydrophobicContact CG2-CZ 3.6Å; I133-F168 WeakPolarHBondContact O-CE1 3.49Å; H135-F168 WeakPolarHBondContact CE1-CB 3.18Å; H135-F168 PolarHBondContact CE1-O 3.14Å; H135-F168 PolarHBondContact NE2-O 3.03Å; S143-F168 WeakPolarHBondContact CB-O 3.23Å; W144-F168 HydrophobicContact CB-CB 4.44Å; W144-F168 HydrophobicContact CE3-CB 4.25Å; W144-F168 AromaticContact CE3-CD2 3.79Å; W144-F168 HydrophobicContact CE3-CD2 3.79Å; W144-F168 HydrophobicContact CE3-CE2 4.45Å; W144-F168 HydrophobicContact CE3-CG 4.08Å; W144-F168 HydrophobicContact CZ3-CD2 4.1Å; W144-F168 HydrophobicContact CZ3-CE2 4.32Å; W144-F168 PolarHBondContact N-O 2.82Å; W144-F168 PolarHBondContact O-N 3.01Å; L146-F168 HydrophobicContact CB-CD2 3.62Å; L146-F168 HydrophobicContact CB-CE2 3.54Å; L146-F168 HydrophobicContact CD2-CD2 4.22Å; L146-F168 HydrophobicContact CD2-CE2 3.4Å; L146-F168 HydrophobicContact CD2-CZ 4.02Å; L146-F168 HydrophobicContact CG-CE2 4.04Å; C164-F168 HydrophobicContact CB-CE2 4.24Å; C164-F168 WeakPolarHBondContact SG-CE2 3.46Å; H166-F168 PolarHBondContact O-N 2.78Å; F168-I177 VanDerWaalsContact CD1-O 3.27Å; F168-I177 WeakPolarHBondContact CD1-O 3.47Å; F168-R179 HydrophobicContact CD1-CG 4.36Å; F168-R179 HydrophobicContact CE1-CB 3.8Å; F168-R179 HydrophobicContact CE1-CG 3.64Å; F168-R179 HydrophobicContact CZ-CB 3.78Å; F168-R179 HydrophobicContact CZ-CG 3.85Å
169	S	73.5	Confident	72	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-170.7	127.4	-177.1	-160	0	0	0	0	112.3	S143 W167 Y171 G175 E2235	S143-S169 VanDerWaalsContact CB-CB 3.47Å; S143-S169 WeakPolarHBondContact CB-OG 3.37Å; S143-S169 WeakPolarHBondContact OG-CB 3.4Å; S143-S169 PolarHBondContact OG-OG 2.9Å; W167-S169 VanDerWaalsContact C-N 3.34Å; W167-S169 PolarHBondContact O-N 3.06Å; S169-Y171 PolarHBondContact O-N 3.19Å; S169-Y171 PolarHBondContact OG-N 3.49Å; S169-G175 VanDerWaalsContact O-CA 3.32Å; S169-G175 WeakPolarHBondContact O-CA 3.46Å; S169-E2235 WeakPolarHBondContact CA-OE1 3.46Å; S169-E2235 PolarHBondContact N-OE1 3.15Å
170	L	60.7	Low	72.9	Confident	39 Å²	39	37.7 Å²	37.7	20%	0.204	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	17.3	164.9	-66.4	-168.8	0	0	0	113.8	L138 G175 I177 E2235 K2405	L138-L170 HydrophobicContact CD2-CD1 3.31Å; L138-L170 HydrophobicContact CD2-CG 4.21Å; L170-G175 WeakPolarHBondContact CD2-O 3.37Å; L170-I177 HydrophobicContact CD2-CG1 3.99Å; L170-E2235 HydrophobicContact CB-CB 3.83Å; L170-E2235 HydrophobicContact CB-CG 4.32Å; L170-E2235 HydrophobicContact CD1-CB 4.48Å; L170-E2235 HydrophobicContact CD1-CG 4.43Å; L170-E2235 HydrophobicContact CG-CB 3.8Å; L170-E2235 HydrophobicContact CG-CG 3.75Å; L170-E2235 PolarHBondContact N-OE1 2.93Å; L170-K2405 WeakPolarHBondContact O-CE 3.44Å; L170-K2405 PolarHBondContact O-NZ 2.93Å
171	Y	57.9	Low	73.2	Confident	19 Å²	19	37.8 Å²	37.8	8%	0.075	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.6	-4.4	-166.6	-66.2	-68.5	0	0	0	116	K140 S169 V2221 Q2234	K140-Y171 HydrophobicContact CB-CD2 3.39Å; K140-Y171 HydrophobicContact CB-CE2 3.54Å; K140-Y171 HydrophobicContact CB-CG 4.16Å; K140-Y171 HydrophobicContact CD-CD1 4.01Å; K140-Y171 HydrophobicContact CD-CD2 3.69Å; K140-Y171 HydrophobicContact CD-CE1 4.5Å; K140-Y171 HydrophobicContact CD-CE2 4.16Å; K140-Y171 HydrophobicContact CD-CG 3.53Å; K140-Y171 HydrophobicContact CG-CD2 3.46Å; K140-Y171 VanDerWaalsContact CG-CD2 3.46Å; K140-Y171 HydrophobicContact CG-CE2 4.07Å; K140-Y171 HydrophobicContact CG-CG 3.74Å; S169-Y171 PolarHBondContact O-N 3.19Å; S169-Y171 PolarHBondContact OG-N 3.49Å; Y171-V2221 HydrophobicContact CE1-CB 3.57Å; Y171-V2221 HydrophobicContact CE1-CG2 4.03Å; Y171-V2221 WeakPolarHBondContact CE1-O 3.35Å; Y171-V2221 WeakPolarHBondContact OH-CB 3.16Å; Y171-V2221 PolarHBondContact OH-O 3.1Å; Y171-Q2234 HydrophobicContact CE2-CB 3.64Å; Y171-Q2234 WeakPolarHBondContact OH-CB 3.46Å; Y171-Q2234 PolarHBondContact OH-OE1 3.11Å
172	K	53	Low	73.1	Confident	34 Å²	34	44.1 Å²	44.1	15%	0.148	22%	0.22	C	C	.	.	S	Bend	trans	-138.7	125.5	-178.3	-61	172.3	-178.8	163	0	104.9	G73 K140 W167	G73-K172 PolarHBondContact O-NZ 2.77Å; K140-K172 PolarHBondContact O-NZ 3.02Å; W167-K172 HydrophobicContact CB-CB 3.65Å; W167-K172 WeakPolarHBondContact CB-O 3.41Å; W167-K172 HydrophobicContact CD2-CB 3.64Å; W167-K172 HydrophobicContact CD2-CD 3.34Å; W167-K172 HydrophobicContact CD2-CG 4.13Å; W167-K172 HydrophobicContact CE3-CB 4.28Å; W167-K172 HydrophobicContact CE3-CD 3.25Å; W167-K172 HydrophobicContact CE3-CG 4.39Å; W167-K172 HydrophobicContact CG-CB 3.33Å; W167-K172 HydrophobicContact CG-CD 4.02Å; W167-K172 HydrophobicContact CG-CG 4.32Å; W167-K172 HydrophobicContact CH2-CD 3.69Å; W167-K172 HydrophobicContact CZ2-CD 3.78Å; W167-K172 HydrophobicContact CZ3-CD 3.43Å; W167-K172 VanDerWaalsContact CZ3-CD 3.43Å
173	E	64.8	Low	72.1	Confident	111 Å²	111	45.8 Å²	45.8	52%	0.519	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-126.6	-166.3	-59.7	171.5	120.9	0	0	114	H166 W167	H166-E173 WeakPolarHBondContact CA-OE2 3.22Å; H166-E173 WeakPolarHBondContact CB-OE2 3.38Å; H166-E173 IonicContact CE1-OE1 2.69Å; H166-E173 IonicContact CG-OE1 4Å; H166-E173 IonicContact CG-OE2 3.21Å; H166-E173 VanDerWaalsContact ND1-CD 3.29Å; H166-E173 IonicContact ND1-OE1 3.05Å; H166-E173 PolarHBondContact ND1-OE1 3.33Å; H166-E173 IonicContact ND1-OE2 2.68Å; H166-E173 PolarHBondContact ND1-OE2 3.5Å; W167-E173 VanDerWaalsContact CD1-OE2 3.32Å; W167-E173 PolarHBondContact N-OE2 3.23Å
174	D	61.2	Low	71.4	Confident	84 Å²	84	47.9 Å²	47.9	45%	0.449	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.8	-160.8	63.7	13.8	0	0	0	115.4	L176 R179	D174-L176 WeakPolarHBondContact OD1-CG 3.42Å; D174-L176 PolarHBondContact OD1-N 2.91Å; D174-R179 IonicContact OD1-CZ 3.22Å; D174-R179 IonicContact OD1-NH1 3.84Å; D174-R179 PolarHBondContact OD1-NH1 2.92Å; D174-R179 IonicContact OD1-NH2 2.76Å; D174-R179 PolarHBondContact OD1-NH2 2.92Å; D174-R179 IonicContact OD2-CZ 3.45Å; D174-R179 IonicContact OD2-NH1 2.68Å; D174-R179 PolarHBondContact OD2-NH1 2.99Å; D174-R179 IonicContact OD2-NH2 3.76Å
175	G	64	Low	70.1	Confident	12 Å²	12	56 Å²	56	12%	0.124	28%	0.277	C	S	.	.			trans	82.6	34.9	176.2	0	0	0	0	0	115.8	S169 L170	S169-G175 VanDerWaalsContact O-CA 3.32Å; S169-G175 WeakPolarHBondContact O-CA 3.46Å; L170-G175 WeakPolarHBondContact CD2-O 3.37Å
176	L	69.3	Low	68.7	Low	83 Å²	83	54.8 Å²	54.8	44%	0.435	27%	0.273	S	S	.	.			trans	-111.3	115.2	-177.9	-63.7	177.7	0	0	0	114.7	D174 A178 R179	D174-L176 WeakPolarHBondContact OD1-CG 3.42Å; D174-L176 PolarHBondContact OD1-N 2.91Å; L176-A178 VanDerWaalsContact C-N 3.25Å; L176-A178 PolarHBondContact O-N 3.04Å; L176-R179 HydrophobicContact CB-CG 4.47Å
177	I	74.6	Confident	67.8	Low	51 Å²	51	54.1 Å²	54.1	26%	0.262	28%	0.282	S	S	.	.	S	Bend	trans	-66.5	-23.3	174.7	-29	177.6	0	0	0	113.7	E134 H135 S137 F168 L170 E2235	E134-I177 WeakPolarHBondContact CA-O 3.49Å; H135-I177 WeakPolarHBondContact O-CG2 3.37Å; S137-I177 VanDerWaalsContact N-CG2 3.33Å; F168-I177 VanDerWaalsContact CD1-O 3.27Å; F168-I177 WeakPolarHBondContact CD1-O 3.47Å; L170-I177 HydrophobicContact CD2-CG1 3.99Å; I177-E2235 WeakPolarHBondContact CA-OE1 3.21Å; I177-E2235 WeakPolarHBondContact CA-OE2 3.47Å; I177-E2235 HydrophobicContact CG1-CG 4.3Å; I177-E2235 VanDerWaalsContact CG2-CD 3.43Å; I177-E2235 HydrophobicContact CG2-CG 4.1Å; I177-E2235 WeakPolarHBondContact CG2-OE2 3.35Å
178	A	84.4	Confident	66.9	Low	33 Å²	33	59.7 Å²	59.7	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	134.8	-168.4	0	0	0	0	0	109.8	F132 I133 E134 L176	F132-A178 HydrophobicContact CE1-CB 3.79Å; F132-A178 HydrophobicContact CE2-CB 4.5Å; F132-A178 HydrophobicContact CZ-CB 3.61Å; I133-A178 CarbonylContact O-C 3.52Å; I133-A178 WeakPolarHBondContact O-CA 3.48Å; E134-A178 HydrophobicContact CB-CB 3.8Å; L176-A178 VanDerWaalsContact C-N 3.25Å; L176-A178 PolarHBondContact O-N 3.04Å
179	R	83	Confident	66.7	Low	23 Å²	23	60.1 Å²	60.1	9%	0.087	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.6	-174.7	-59.9	-179.7	-173.4	-82.6	-2.6	110.2	F132 I133 W167 F168 D174 L176 L181	F132-R179 WeakPolarHBondContact CA-O 3.19Å; I133-R179 PolarHBondContact N-O 3.32Å; I133-R179 PolarHBondContact O-N 3.07Å; W167-R179 PolarHBondContact O-NH2 2.83Å; F168-R179 HydrophobicContact CD1-CG 4.36Å; F168-R179 HydrophobicContact CE1-CB 3.8Å; F168-R179 HydrophobicContact CE1-CG 3.64Å; F168-R179 HydrophobicContact CZ-CB 3.78Å; F168-R179 HydrophobicContact CZ-CG 3.85Å; D174-R179 IonicContact OD1-CZ 3.22Å; D174-R179 IonicContact OD1-NH1 3.84Å; D174-R179 PolarHBondContact OD1-NH1 2.92Å; D174-R179 IonicContact OD1-NH2 2.76Å; D174-R179 PolarHBondContact OD1-NH2 2.92Å; D174-R179 IonicContact OD2-CZ 3.45Å; D174-R179 IonicContact OD2-NH1 2.68Å; D174-R179 PolarHBondContact OD2-NH1 2.99Å; D174-R179 IonicContact OD2-NH2 3.76Å; L176-R179 HydrophobicContact CB-CG 4.47Å; R179-L181 HydrophobicContact CB-CD2 3.8Å; R179-L181 HydrophobicContact CB-CG 4.45Å; R179-L181 PolarHBondContact O-N 3.45Å
180	E	88.5	Confident	67.3	Low	67 Å²	67	64.9 Å²	64.9	31%	0.313	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	101.7	165.8	-167.7	152.1	176.2	0	0	109.4	K85 S130 F132 F182	K85-E180 VanDerWaalsContact CD-OE1 3.28Å; K85-E180 WeakPolarHBondContact CD-OE1 3.08Å; K85-E180 IonicContact NZ-OE1 2.79Å; K85-E180 PolarHBondContact NZ-OE1 2.95Å; K85-E180 IonicContact NZ-OE2 2.71Å; K85-E180 PolarHBondContact NZ-OE2 3.35Å; S130-E180 WeakPolarHBondContact CB-OE1 3.45Å; S130-E180 PolarHBondContact OG-OE1 2.74Å; F132-E180 HydrophobicContact CD2-CB 4.01Å; E180-F182 HydrophobicContact CB-CE2 4.39Å; E180-F182 HydrophobicContact CG-CE1 4.46Å; E180-F182 HydrophobicContact CG-CE2 4.17Å; E180-F182 HydrophobicContact CG-CZ 3.92Å; E180-F182 WeakPolarHBondContact O-CD2 3.31Å; E180-F182 VanDerWaalsContact O-CE2 3.3Å; E180-F182 WeakPolarHBondContact O-CE2 3.44Å
181	L	81.7	Confident	68.5	Low	13 Å²	13	63 Å²	63	7%	0.068	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	138.7	178.6	-49.7	178.7	0	0	0	109.3	S130 V131 I133 L146 V149 F162 C164 R179	S130-L181 CarbonylContact C-O 3.51Å; S130-L181 WeakPolarHBondContact CA-O 3.16Å; S130-L181 VanDerWaalsContact CB-O 3.3Å; S130-L181 WeakPolarHBondContact CB-O 3.05Å; V131-L181 PolarHBondContact N-O 3.04Å; V131-L181 PolarHBondContact O-N 3.34Å; I133-L181 HydrophobicContact CB-CD1 4.43Å; I133-L181 HydrophobicContact CG1-CD1 4.32Å; L146-L181 HydrophobicContact CD2-CD1 3.96Å; V149-L181 HydrophobicContact CG2-CD1 4.01Å; F162-L181 HydrophobicContact CB-CB 3.74Å; F162-L181 HydrophobicContact CB-CD1 4.3Å; F162-L181 WeakPolarHBondContact CD1-O 3.5Å; C164-L181 HydrophobicContact CB-CD1 3.95Å; C164-L181 HydrophobicContact CB-CD2 3.89Å; R179-L181 HydrophobicContact CB-CD2 3.8Å; R179-L181 HydrophobicContact CB-CG 4.45Å; R179-L181 PolarHBondContact O-N 3.45Å
182	F	72.1	Confident	70.1	Confident	137 Å²	137	62.6 Å²	62.6	60%	0.601	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	144.3	-177.8	-66.3	-88.7	0	0	0	112.1	F162 E180	F162-F182 VanDerWaalsContact CD1-C 3.47Å; E180-F182 HydrophobicContact CB-CE2 4.39Å; E180-F182 HydrophobicContact CG-CE1 4.46Å; E180-F182 HydrophobicContact CG-CE2 4.17Å; E180-F182 HydrophobicContact CG-CZ 3.92Å; E180-F182 WeakPolarHBondContact O-CD2 3.31Å; E180-F182 VanDerWaalsContact O-CE2 3.3Å; E180-F182 WeakPolarHBondContact O-CE2 3.44Å
183	G	58.8	Low	71.8	Confident	35 Å²	35	61 Å²	61	36%	0.361	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.1	-162.5	0	0	0	0	0	116.1	H129	H129-G183 PolarHBondContact O-N 2.73Å; H129-G183 VanDerWaalsContact O-N 3.07Å
184	I	53.8	Low	72.9	Confident	78 Å²	78	57.2 Å²	57.2	40%	0.4	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.6	168.2	-50.8	176.6	0	0	0	108.6	M161 M163 S186	M161-I184 WeakPolarHBondContact CA-O 3.21Å; M161-I184 WeakPolarHBondContact CB-O 3.21Å; M161-I184 PolarHBondContact N-O 2.99Å; M161-I184 WeakPolarHBondContact O-CA 3.19Å; M161-I184 PolarHBondContact O-N 3.3Å; M163-I184 HydrophobicContact CG-CD1 4.44Å; I184-S186 PolarHBondContact O-N 3.48Å
185	R	52.5	Low	74.2	Confident	179 Å²	179	53.2 Å²	53.2	68%	0.675	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-74.6	119.4	172.8	-73.7	-174.7	179.5	168.2	4.8	110.2	Y160	Y160-R185 HydrophobicContact CD1-CG 4.49Å
186	S	49.9	Very low	75.3	Confident	33 Å²	33	53.5 Å²	53.5	23%	0.231	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-96.4	137.1	-173.3	177.7	0	0	0	0	113.8	M161 I184	M161-S186 VanDerWaalsContact CB-CB 3.46Å; M161-S186 WeakPolarHBondContact CE-OG 3.26Å; M161-S186 VanDerWaalsContact SD-CB 3.54Å; M161-S186 PolarHBondContact SD-OG 2.97Å; I184-S186 PolarHBondContact O-N 3.48Å
187	A	56.6	Low	76.1	Confident	67 Å²	67	49.6 Å²	49.6	55%	0.554	26%	0.256	S	S	*	.			trans	-119.9	150.8	170.4	0	0	0	0	0	110.2	N255	A187-N255 WeakPolarHBondContact O-CB 3.41Å; A187-N255 PolarHBondContact O-N 3Å
188	K	63	Low	76.2	Confident	155 Å²	155	47.3 Å²	47.3	67%	0.674	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	150.4	174.3	-68.8	-167.4	174.7	-165.6	0	111.2	A253	K188-A253 WeakPolarHBondContact CA-O 3.14Å
189	T	77.5	Confident	76.1	Confident	9 Å²	9	51 Å²	51	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	177.7	173	-169.6	0	0	0	0	111.1	Y191 K252 A253 N255 D284 S286	T189-Y191 HydrophobicContact CG2-CD2 3.95Å; T189-Y191 HydrophobicContact CG2-CE1 4.21Å; T189-Y191 HydrophobicContact CG2-CE2 3.26Å; T189-Y191 WeakPolarHBondContact CG2-OH 3.43Å; T189-K252 WeakPolarHBondContact O-CA 2.92Å; T189-A253 PolarHBondContact N-O 3.44Å; T189-A253 PolarHBondContact O-N 3.26Å; T189-A253 VanDerWaalsContact O-N 3.08Å; T189-A253 VanDerWaalsContact O-O 3.1Å; T189-N255 HydrophobicContact CG2-CB 4.07Å; T189-D284 WeakPolarHBondContact CB-OD1 3.38Å; T189-D284 WeakPolarHBondContact CG2-OD1 3.32Å; T189-D284 PolarHBondContact OG1-OD1 3.03Å; T189-S286 WeakPolarHBondContact OG1-CB 3.44Å; T189-S286 PolarHBondContact OG1-N 2.91Å; T189-S286 PolarHBondContact OG1-OG 2.98Å
190	K	85.3	Confident	75.7	Confident	100 Å²	100	54.6 Å²	54.6	44%	0.435	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.8	162.5	-71	179.6	176.2	-174.9	0	108.9	I250 V251 K252 M285	K190-I250 HydrophobicContact CD-CG2 4.25Å; K190-V251 CarbonylContact C-O 3.6Å; K190-V251 VanDerWaalsContact CA-O 3.28Å; K190-V251 WeakPolarHBondContact CA-O 3.42Å; K190-K252 HydrophobicContact CG-CG 3.89Å; K190-M285 HydrophobicContact CB-CB 3.95Å; K190-M285 HydrophobicContact CB-CG 3.99Å; K190-M285 HydrophobicContact CB-SD 3.59Å; K190-M285 VanDerWaalsContact CB-SD 3.59Å; K190-M285 HydrophobicContact CD-SD 3.86Å; K190-M285 HydrophobicContact CG-SD 4.41Å; K190-M285 WeakPolarHBondContact O-CB 3.15Å; K190-M285 PolarHBondContact O-N 2.86Å
191	Y	87.8	Confident	75	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	142.2	167	-70	-79.5	0	0	0	110.2	T189 I213 T220 I250 V251 A253 P254 N255 V256 I259 V282 T283 D284	T189-Y191 HydrophobicContact CG2-CD2 3.95Å; T189-Y191 HydrophobicContact CG2-CE1 4.21Å; T189-Y191 HydrophobicContact CG2-CE2 3.26Å; T189-Y191 WeakPolarHBondContact CG2-OH 3.43Å; Y191-I213 HydrophobicContact CD1-CD1 4.18Å; Y191-I213 HydrophobicContact CD2-CD1 4.14Å; Y191-I213 HydrophobicContact CG-CD1 3.83Å; Y191-T220 HydrophobicContact CD2-CG2 4.35Å; Y191-T220 HydrophobicContact CE2-CG2 4.01Å; Y191-I250 CarbonylContact O-C 3.56Å; Y191-I250 WeakPolarHBondContact O-CA 3.32Å; Y191-V251 PolarHBondContact N-O 3.07Å; Y191-V251 PolarHBondContact O-N 3.3Å; Y191-A253 HydrophobicContact CD2-CB 3.95Å; Y191-A253 HydrophobicContact CE2-CB 4.07Å; Y191-P254 WeakPolarHBondContact CE2-O 3.33Å; Y191-N255 WeakPolarHBondContact OH-CA 3.34Å; Y191-V256 PolarHBondContact OH-N 2.92Å; Y191-I259 HydrophobicContact CD1-CD1 4.3Å; Y191-I259 HydrophobicContact CE1-CD1 4.01Å; Y191-V282 HydrophobicContact CD1-CG1 4.21Å; Y191-T283 CarbonylContact C-O 3.41Å; Y191-T283 VanDerWaalsContact CA-O 3.31Å; Y191-T283 WeakPolarHBondContact CA-O 3.24Å; Y191-D284 HydrophobicContact CD1-CB 4.14Å; Y191-D284 HydrophobicContact CE1-CB 3.62Å; Y191-D284 PolarHBondContact OH-OD2 2.64Å
192	S	89.6	Confident	74.6	Confident	11 Å²	11	60.9 Å²	60.9	8%	0.077	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.4	169.3	163.9	0	0	0	0	108	K248 F249 V282 T283	S192-K248 VanDerWaalsContact OG-CE 3.31Å; S192-K248 WeakPolarHBondContact OG-CE 3.28Å; S192-F249 WeakPolarHBondContact CA-O 3.1Å; S192-V282 CarbonylContact O-C 3.54Å; S192-V282 WeakPolarHBondContact O-CA 3.27Å; S192-T283 PolarHBondContact N-O 3Å; S192-T283 PolarHBondContact O-N 3.18Å
193	I	90.4	Very high	74.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.9	-175.4	-63.3	139.4	0	0	0	108.3	I211 I213 L225 K248 F249 V251 V280 V281 V282	I193-I211 HydrophobicContact CD1-CG2 4.03Å; I193-I211 HydrophobicContact CG1-CD1 4.34Å; I193-I211 HydrophobicContact CG2-CD1 3.79Å; I193-I213 HydrophobicContact CD1-CD1 4.28Å; I193-I213 HydrophobicContact CG1-CD1 4.47Å; I193-L225 HydrophobicContact CD1-CD2 4.15Å; I193-L225 HydrophobicContact CG2-CD1 4.19Å; I193-L225 HydrophobicContact CG2-CD2 4.26Å; I193-K248 CarbonylContact O-C 3.09Å; I193-K248 WeakPolarHBondContact O-CA 3.34Å; I193-F249 HydrophobicContact CB-CB 4.5Å; I193-F249 PolarHBondContact N-O 2.77Å; I193-F249 PolarHBondContact O-N 3.22Å; I193-V251 HydrophobicContact CD1-CG1 4.19Å; I193-V251 HydrophobicContact CD1-CG2 3.48Å; I193-V251 VanDerWaalsContact CD1-CG2 3.48Å; I193-V280 HydrophobicContact CG2-CG1 4.14Å; I193-V281 CarbonylContact C-O 3.53Å; I193-V281 WeakPolarHBondContact CA-O 2.97Å; I193-V282 HydrophobicContact CG1-CG1 4.09Å; I193-V282 HydrophobicContact CG1-CG2 4.1Å; I193-V282 HydrophobicContact CG2-CG2 4.39Å
194	V	88.1	Confident	75.5	Confident	31 Å²	31	53.3 Å²	53.3	19%	0.188	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.7	176.5	-169.7	0	0	0	0	109.4	T247 K248 V280 V281	V194-T247 CarbonylContact C-O 2.96Å; V194-T247 VanDerWaalsContact CA-O 3.27Å; V194-T247 WeakPolarHBondContact CA-O 3.32Å; V194-K248 HydrophobicContact CG2-CB 4.15Å; V194-K248 HydrophobicContact CG2-CD 4.3Å; V194-K248 HydrophobicContact CG2-CG 4.06Å; V194-V280 CarbonylContact O-C 3.17Å; V194-V280 VanDerWaalsContact O-CA 3.26Å; V194-V280 WeakPolarHBondContact O-CA 3.29Å; V194-V280 WeakPolarHBondContact O-CG1 3.47Å; V194-V281 HydrophobicContact CB-CB 4.26Å; V194-V281 PolarHBondContact N-O 2.85Å; V194-V281 PolarHBondContact O-N 3.42Å
195	T	88.4	Confident	76.9	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.6	177.2	53.7	0	0	0	0	110.2	L225 S246 T247 I264 W275 V280	T195-L225 HydrophobicContact CG2-CD1 4.07Å; T195-S246 CarbonylContact O-C 3.11Å; T195-S246 WeakPolarHBondContact O-CA 3.39Å; T195-T247 PolarHBondContact N-O 3.21Å; T195-T247 PolarHBondContact O-N 3.03Å; T195-I264 HydrophobicContact CG2-CD1 4.05Å; T195-W275 HydrophobicContact CG2-CH2 4.28Å; T195-W275 HydrophobicContact CG2-CZ2 4.5Å; T195-V280 HydrophobicContact CG2-CG1 4.22Å; T195-V280 HydrophobicContact CG2-CG2 4.37Å
196	V	86.9	Confident	78.5	Confident	18 Å²	18	45.4 Å²	45.4	11%	0.109	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	110.6	-178.6	-175.4	0	0	0	0	110.3	T245 L277 E278 R279	V196-T245 WeakPolarHBondContact CA-O 3.47Å; V196-L277 WeakPolarHBondContact O-CD1 3.34Å; V196-E278 WeakPolarHBondContact O-CB 3.32Å; V196-E278 PolarHBondContact O-N 2.8Å; V196-R279 HydrophobicContact CB-CG 3.79Å; V196-R279 HydrophobicContact CG2-CG 3.86Å; V196-R279 PolarHBondContact N-O 3.48Å; V196-R279 PolarHBondContact O-N 3.23Å
197	T	85	Confident	80.1	Confident	2 Å²	2	44 Å²	44	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.5	177	-49.6	0	0	0	0	109.7	G242 G244 T245 W275 F276	T197-G242 WeakPolarHBondContact CB-O 3.48Å; T197-G242 VanDerWaalsContact CG2-O 3.23Å; T197-G242 WeakPolarHBondContact CG2-O 3.38Å; T197-G242 PolarHBondContact OG1-O 3.17Å; T197-G244 CarbonylContact O-C 3.48Å; T197-G244 VanDerWaalsContact O-CA 3.26Å; T197-G244 WeakPolarHBondContact O-CA 3.38Å; T197-G244 PolarHBondContact O-N 2.77Å; T197-T245 PolarHBondContact N-O 2.79Å; T197-W275 PolarHBondContact OG1-NE1 3.11Å; T197-F276 WeakPolarHBondContact CA-O 3.33Å; T197-F276 WeakPolarHBondContact CG2-O 3.3Å
198	G	77.6	Confident	81.5	Confident	2 Å²	2	45.3 Å²	45.3	2%	0.021	23%	0.234	C	C	.	.			trans	-71.8	168.9	179.2	0	0	0	0	0	113.7	S203 G244 F276	G198-S203 VanDerWaalsContact O-CB 3.25Å; G198-S203 WeakPolarHBondContact O-CB 3.37Å; G198-G244 PolarHBondContact O-N 3.12Å; G198-F276 PolarHBondContact N-O 3.15Å
199	D	81	Confident	82.7	Confident	112 Å²	112	38 Å²	38	60%	0.599	20%	0.203	S	C	*	.			trans	-105.3	26.2	-177.7	-168.1	26.8	0	0	0	113.5	R243	D199-R243 PolarHBondContact O-NE 2.85Å; D199-R243 PolarHBondContact O-NH2 3.19Å; D199-R243 WeakPolarHBondContact OD1-CG 3.38Å; D199-R243 IonicContact OD1-CZ 2.69Å; D199-R243 IonicContact OD1-NE 3.77Å; D199-R243 PolarHBondContact OD1-NE 3.01Å; D199-R243 IonicContact OD1-NH2 2.89Å; D199-R243 PolarHBondContact OD1-NH2 2.95Å
200	Q	75.8	Confident	83.3	Confident	97 Å²	97	39 Å²	39	45%	0.453	21%	0.206	S	C	.	.	S	Bend	trans	-77.7	152.8	172.3	-58	-175.7	9.9	0	0	110.2	G202 S203 W299	Q200-G202 PolarHBondContact O-N 3.07Å; Q200-S203 WeakPolarHBondContact CA-OG 3.46Å; Q200-S203 WeakPolarHBondContact CB-OG 3.5Å; Q200-S203 PolarHBondContact N-OG 3.49Å; Q200-S203 WeakPolarHBondContact O-CB 3.27Å; Q200-S203 PolarHBondContact O-N 3.46Å; Q200-S203 PolarHBondContact O-OG 2.74Å; Q200-W299 HydrophobicContact CB-CZ2 4.45Å
201	E	72.9	Confident	83.5	Confident	167 Å²	167	34.2 Å²	34.2	78%	0.78	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	132.8	177.9	-170	165	-152.8	0	0	111.5	S203 W299	E201-S203 VanDerWaalsContact C-N 3.35Å; E201-W299 WeakPolarHBondContact O-CH2 3.49Å
202	G	74	Confident	83.4	Confident	45 Å²	45	34.3 Å²	34.3	46%	0.464	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	0.8	-172.8	0	0	0	0	0	116.3	Q200 G204 H274	Q200-G202 PolarHBondContact O-N 3.07Å; G202-G204 PolarHBondContact O-N 2.75Å; G202-H274 VanDerWaalsContact O-O 3.06Å
203	S	71.9	Confident	83.3	Confident	5 Å²	5	33.8 Å²	33.8	4%	0.035	18%	0.182	C	C	.	.			trans	-72.3	110.1	-178.4	-58.3	0	0	0	0	113.1	G198 Q200 E201 R243 F276	G198-S203 VanDerWaalsContact O-CB 3.25Å; G198-S203 WeakPolarHBondContact O-CB 3.37Å; Q200-S203 WeakPolarHBondContact CA-OG 3.46Å; Q200-S203 WeakPolarHBondContact CB-OG 3.5Å; Q200-S203 PolarHBondContact N-OG 3.49Å; Q200-S203 WeakPolarHBondContact O-CB 3.27Å; Q200-S203 PolarHBondContact O-N 3.46Å; Q200-S203 PolarHBondContact O-OG 2.74Å; E201-S203 VanDerWaalsContact C-N 3.35Å; S203-R243 WeakPolarHBondContact O-CA 3.42Å; S203-R243 WeakPolarHBondContact O-CB 3.46Å; S203-R243 PolarHBondContact O-N 3.44Å; S203-R243 VanDerWaalsContact O-N 3.11Å; S203-F276 VanDerWaalsContact OG-CB 3.29Å; S203-F276 WeakPolarHBondContact OG-CB 3.41Å
204	G	77.6	Confident	82.8	Confident	9 Å²	9	35.1 Å²	35.1	9%	0.093	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	171.2	169.1	0	0	0	0	0	114.3	G202 F241 H274 W275	G202-G204 PolarHBondContact O-N 2.75Å; G204-F241 CarbonylContact C-O 3.54Å; G204-F241 WeakPolarHBondContact CA-O 3.2Å; G204-H274 PolarHBondContact N-O 3.32Å; G204-H274 CarbonylContact O-C 3.56Å; G204-H274 WeakPolarHBondContact O-CA 3.46Å; G204-H274 PolarHBondContact O-N 2.89Å; G204-W275 WeakPolarHBondContact O-CA 3.46Å; G204-W275 PolarHBondContact O-N 3.12Å; G204-W275 VanDerWaalsContact O-N 3.1Å
205	T	83.7	Confident	82.2	Confident	7 Å²	7	33.9 Å²	33.9	4%	0.043	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	147.7	166.5	-172.2	0	0	0	0	114.9	S207 V209 F241 Q266 E272 W275	T205-S207 WeakPolarHBondContact OG1-CB 3.46Å; T205-S207 PolarHBondContact OG1-N 2.57Å; T205-S207 PolarHBondContact OG1-OG 3.14Å; T205-V209 HydrophobicContact CG2-CG2 4.29Å; T205-F241 HydrophobicContact CG2-CB 3.73Å; T205-F241 HydrophobicContact CG2-CD2 4.33Å; T205-F241 HydrophobicContact CG2-CG 4.25Å; T205-F241 PolarHBondContact N-O 3Å; T205-Q266 PolarHBondContact OG1-OE1 2.75Å; T205-E272 WeakPolarHBondContact CA-O 3.47Å; T205-W275 HydrophobicContact CG2-CB 3.76Å; T205-W275 HydrophobicContact CG2-CD2 3.84Å; T205-W275 HydrophobicContact CG2-CE3 4.2Å; T205-W275 HydrophobicContact CG2-CG 3.66Å
206	N	84.9	Confident	80.9	Confident	83 Å²	83	44 Å²	44	44%	0.444	22%	0.219	S	C	.	.			trans	-109.3	7.7	168.3	52	11.7	0	0	0	112.7	G270 N271 E272	N206-G270 WeakPolarHBondContact OD1-CA 3.34Å; N206-N271 PolarHBondContact OD1-N 3.2Å; N206-N271 VanDerWaalsContact OD1-N 3.1Å; N206-E272 PolarHBondContact OD1-N 2.8Å
207	S	84.7	Confident	79.4	Confident	4 Å²	4	46 Å²	46	3%	0.028	23%	0.231	C	C	.	.	S	Bend	trans	-80.3	162.2	170.9	-50.3	0	0	0	0	111.3	T205 Q266 E268 S269 G270	T205-S207 WeakPolarHBondContact OG1-CB 3.46Å; T205-S207 PolarHBondContact OG1-N 2.57Å; T205-S207 PolarHBondContact OG1-OG 3.14Å; S207-Q266 VanDerWaalsContact CB-OE1 3.29Å; S207-Q266 PolarHBondContact OG-OE1 3.04Å; S207-E268 WeakPolarHBondContact OG-CA 3.15Å; S207-S269 PolarHBondContact OG-N 2.84Å; S207-G270 PolarHBondContact OG-N 2.8Å
208	K	85.4	Confident	78.2	Confident	95 Å²	95	45.9 Å²	45.9	41%	0.413	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-77.1	132.6	179.5	-60.7	179.2	162	-129.6	0	111.4	Y210 E224 Q266 D267	K208-Y210 HydrophobicContact CB-CE2 3.75Å; K208-Y210 WeakPolarHBondContact CD-OH 3.29Å; K208-E224 IonicContact NZ-OE1 2.68Å; K208-E224 PolarHBondContact NZ-OE1 2.97Å; K208-E224 IonicContact NZ-OE2 2.66Å; K208-E224 PolarHBondContact NZ-OE2 3.12Å; K208-Q266 CarbonylContact O-C 3.57Å; K208-Q266 VanDerWaalsContact O-CA 3.28Å; K208-Q266 WeakPolarHBondContact O-CA 3.49Å; K208-D267 WeakPolarHBondContact CB-OD2 3.23Å; K208-D267 PolarHBondContact N-OD1 3.48Å; K208-D267 PolarHBondContact O-N 3.06Å
209	V	87.6	Confident	78	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.9	177.5	-177.7	0	0	0	0	110.8	T205 L225 F241 I264 K265 Q266 W275	T205-V209 HydrophobicContact CG2-CG2 4.29Å; V209-L225 HydrophobicContact CB-CB 4.4Å; V209-L225 HydrophobicContact CG1-CD1 3.96Å; V209-L225 PolarHBondContact O-N 2.96Å; V209-F241 HydrophobicContact CB-CD2 4.48Å; V209-F241 HydrophobicContact CB-CE1 4.04Å; V209-F241 HydrophobicContact CB-CE2 3.85Å; V209-F241 HydrophobicContact CB-CZ 3.6Å; V209-F241 HydrophobicContact CG1-CE1 4.37Å; V209-F241 HydrophobicContact CG1-CZ 4.35Å; V209-F241 HydrophobicContact CG2-CD1 4.07Å; V209-F241 HydrophobicContact CG2-CD2 3.64Å; V209-F241 HydrophobicContact CG2-CE1 3.92Å; V209-F241 HydrophobicContact CG2-CE2 3.49Å; V209-F241 VanDerWaalsContact CG2-CE2 3.49Å; V209-F241 HydrophobicContact CG2-CG 3.95Å; V209-F241 HydrophobicContact CG2-CZ 3.64Å; V209-I264 HydrophobicContact CG1-CD1 4.01Å; V209-I264 HydrophobicContact CG1-CG1 3.9Å; V209-K265 CarbonylContact C-O 3.57Å; V209-K265 WeakPolarHBondContact CA-O 3.5Å; V209-Q266 HydrophobicContact CG2-CB 4.38Å; V209-W275 HydrophobicContact CB-CH2 4.47Å; V209-W275 HydrophobicContact CB-CZ3 4.37Å; V209-W275 HydrophobicContact CG1-CH2 3.72Å; V209-W275 HydrophobicContact CG1-CZ3 3.66Å; V209-W275 HydrophobicContact CG2-CE3 4.21Å; V209-W275 HydrophobicContact CG2-CH2 3.93Å; V209-W275 HydrophobicContact CG2-CZ3 3.69Å
210	Y	90.7	Very high	77.9	Confident	30 Å²	30	41 Å²	41	12%	0.118	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.8	-179.9	-64	-86.2	0	0	0	111.2	K208 R222 I223 E224 I264 K265 D267	K208-Y210 HydrophobicContact CB-CE2 3.75Å; K208-Y210 WeakPolarHBondContact CD-OH 3.29Å; Y210-R222 HydrophobicContact CD1-CG 4.05Å; Y210-R222 VanDerWaalsContact CE2-NH2 3.33Å; Y210-R222 HydrophobicContact CG-CG 4.35Å; Y210-I223 CarbonylContact C-O 3.59Å; Y210-I223 VanDerWaalsContact CA-O 3.29Å; Y210-I223 WeakPolarHBondContact CA-O 3.37Å; Y210-E224 HydrophobicContact CD1-CB 3.87Å; Y210-E224 HydrophobicContact CD1-CG 4.09Å; Y210-E224 HydrophobicContact CE1-CB 3.58Å; Y210-E224 HydrophobicContact CE1-CG 3.55Å; Y210-E224 WeakPolarHBondContact CE1-OE2 3.4Å; Y210-E224 VanDerWaalsContact CZ-OE2 3.32Å; Y210-E224 PolarHBondContact OH-OE2 2.85Å; Y210-I264 WeakPolarHBondContact O-CA 3.19Å; Y210-K265 PolarHBondContact N-O 3.26Å; Y210-K265 PolarHBondContact O-N 2.76Å; Y210-D267 HydrophobicContact CE2-CB 4.22Å
211	I	89.7	Confident	77.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142.8	176.1	-163.7	172.2	0	0	0	112.4	I193 I213 I223 L225 I262 R263 V280 V282	I193-I211 HydrophobicContact CD1-CG2 4.03Å; I193-I211 HydrophobicContact CG1-CD1 4.34Å; I193-I211 HydrophobicContact CG2-CD1 3.79Å; I211-I213 HydrophobicContact CG1-CG1 4.46Å; I211-I223 HydrophobicContact CG2-CB 4.18Å; I211-I223 PolarHBondContact N-O 2.81Å; I211-I223 PolarHBondContact O-N 2.73Å; I211-L225 HydrophobicContact CB-CD1 4.33Å; I211-L225 HydrophobicContact CB-CG 4.44Å; I211-L225 HydrophobicContact CG2-CD1 4.3Å; I211-L225 HydrophobicContact CG2-CD2 3.71Å; I211-L225 HydrophobicContact CG2-CG 4.03Å; I211-I262 HydrophobicContact CD1-CB 4.31Å; I211-I262 HydrophobicContact CD1-CD1 4.06Å; I211-I262 HydrophobicContact CD1-CG2 4.1Å; I211-I262 HydrophobicContact CG1-CB 4.18Å; I211-I262 HydrophobicContact CG1-CG2 4.32Å; I211-R263 CarbonylContact C-O 3.54Å; I211-R263 VanDerWaalsContact CA-O 3.3Å; I211-R263 WeakPolarHBondContact CA-O 3.27Å; I211-V280 HydrophobicContact CD1-CG1 4.22Å; I211-V282 HydrophobicContact CD1-CG2 3.99Å
212	T	85.5	Confident	77.5	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.9	174.4	-49	0	0	0	0	107.8	Y214 I219 T220 I262 R263	T212-Y214 HydrophobicContact CG2-CE2 3.8Å; T212-Y214 WeakPolarHBondContact O-CD2 3.47Å; T212-Y214 WeakPolarHBondContact O-CE2 3.45Å; T212-I219 HydrophobicContact CG2-CG2 4.03Å; T212-T220 VanDerWaalsContact CG2-O 3.24Å; T212-T220 WeakPolarHBondContact CG2-O 3.46Å; T212-I262 CarbonylContact O-C 3.48Å; T212-I262 VanDerWaalsContact O-CA 3.25Å; T212-I262 WeakPolarHBondContact O-CA 3.49Å; T212-R263 PolarHBondContact N-O 3.31Å; T212-R263 PolarHBondContact O-N 2.79Å
213	I	86.8	Confident	78	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.5	-172.1	-53.5	164.3	0	0	0	109.6	Y191 I193 I211 I219 T220 V256 I259 I262 V282	Y191-I213 HydrophobicContact CD1-CD1 4.18Å; Y191-I213 HydrophobicContact CD2-CD1 4.14Å; Y191-I213 HydrophobicContact CG-CD1 3.83Å; I193-I213 HydrophobicContact CD1-CD1 4.28Å; I193-I213 HydrophobicContact CG1-CD1 4.47Å; I211-I213 HydrophobicContact CG1-CG1 4.46Å; I213-I219 CarbonylContact O-C 3.56Å; I213-I219 WeakPolarHBondContact O-CA 3.45Å; I213-I219 WeakPolarHBondContact O-CG2 3.03Å; I213-T220 HydrophobicContact CB-CG2 3.9Å; I213-T220 HydrophobicContact CD1-CG2 4.3Å; I213-T220 PolarHBondContact N-OG1 2.93Å; I213-T220 PolarHBondContact O-N 3.4Å; I213-V256 HydrophobicContact CG2-CG2 4.13Å; I213-I259 HydrophobicContact CG2-CB 4.42Å; I213-I259 HydrophobicContact CG2-CD1 3.88Å; I213-I259 HydrophobicContact CG2-CG1 3.79Å; I213-I259 HydrophobicContact CG2-CG2 3.73Å; I213-I262 HydrophobicContact CG1-CG2 4.32Å; I213-V282 HydrophobicContact CD1-CG1 3.75Å; I213-V282 HydrophobicContact CG1-CG1 4.23Å; I213-V282 HydrophobicContact CG2-CG1 4.37Å
214	Y	80.9	Confident	78.7	Confident	29 Å²	29	37.2 Å²	37.2	11%	0.114	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.1	-178.3	-65.1	-107.7	0	0	0	110.2	T212 I219 I259 T260 N261 R263 L312	T212-Y214 HydrophobicContact CG2-CE2 3.8Å; T212-Y214 WeakPolarHBondContact O-CD2 3.47Å; T212-Y214 WeakPolarHBondContact O-CE2 3.45Å; Y214-I219 HydrophobicContact CD1-CD1 3.37Å; Y214-I219 HydrophobicContact CD1-CG1 3.76Å; Y214-I219 HydrophobicContact CD1-CG2 4Å; Y214-I219 HydrophobicContact CD2-CG2 4.44Å; Y214-I219 HydrophobicContact CE1-CD1 3.53Å; Y214-I219 HydrophobicContact CE1-CG1 4.26Å; Y214-I219 HydrophobicContact CE1-CG2 4Å; Y214-I219 HydrophobicContact CE2-CG2 4.45Å; Y214-I219 HydrophobicContact CG-CD1 4.35Å; Y214-I219 HydrophobicContact CG-CG1 4.29Å; Y214-I219 HydrophobicContact CG-CG2 4.17Å; Y214-I259 CarbonylContact O-C 3.6Å; Y214-I259 VanDerWaalsContact O-CA 3.27Å; Y214-I259 WeakPolarHBondContact O-CA 3.08Å; Y214-I259 VanDerWaalsContact O-CG2 3.26Å; Y214-I259 WeakPolarHBondContact O-CG2 3.33Å; Y214-T260 PolarHBondContact O-N 3.08Å; Y214-N261 WeakPolarHBondContact CB-O 3.41Å; Y214-N261 HydrophobicContact CD2-CB 4.23Å; Y214-N261 HydrophobicContact CG-CB 4.16Å; Y214-N261 PolarHBondContact N-O 2.91Å; Y214-N261 PolarHBondContact O-N 2.96Å; Y214-R263 HydrophobicContact CE2-CB 4.24Å; Y214-R263 VanDerWaalsContact OH-CZ 3.31Å; Y214-R263 PolarHBondContact OH-NH1 3.15Å; Y214-R263 PolarHBondContact OH-NH2 3.2Å; Y214-L312 HydrophobicContact CE2-CD1 4.3Å
215	G	74.8	Confident	79.2	Confident	5 Å²	5	37.1 Å²	37.1	5%	0.052	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	173.6	177	0	0	0	0	0	115	T217 G218 V256 A258	G215-T217 PolarHBondContact O-N 3.27Å; G215-T217 VanDerWaalsContact O-N 3.11Å; G215-G218 CarbonylContact C-O 3.59Å; G215-G218 WeakPolarHBondContact CA-O 3.49Å; G215-G218 PolarHBondContact N-O 2.87Å; G215-G218 PolarHBondContact O-N 3.14Å; G215-V256 CarbonylContact C-O 3.56Å; G215-V256 VanDerWaalsContact CA-O 3.31Å; G215-V256 WeakPolarHBondContact CA-O 3.32Å; G215-A258 CarbonylContact C-O 3.56Å; G215-A258 WeakPolarHBondContact CA-O 3.4Å
216	R	62.2	Low	78.8	Confident	213 Å²	213	39.8 Å²	39.8	80%	0.804	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.9	-174.3	-96	-168.6	171.8	-171.3	-2	115.4	V256 A258 T260	R216-V256 PolarHBondContact N-O 3.22Å; R216-A258 HydrophobicContact CB-CB 4.45Å; R216-A258 PolarHBondContact N-O 3.15Å; R216-T260 HydrophobicContact CG-CG2 4.5Å
217	T	55.3	Low	77.7	Confident	59 Å²	59	43.1 Å²	43.1	36%	0.362	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	13.2	-176	64.6	0	0	0	0	113.1	G215 V256 G257	G215-T217 PolarHBondContact O-N 3.27Å; G215-T217 VanDerWaalsContact O-N 3.11Å; T217-V256 PolarHBondContact N-O 2.89Å; T217-V256 PolarHBondContact OG1-O 2.8Å; T217-G257 WeakPolarHBondContact OG1-CA 3.44Å; T217-G257 PolarHBondContact OG1-N 2.76Å
218	G	59.6	Low	75.9	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	170.8	-177	0	0	0	0	0	113.5	G215 V256	G215-G218 CarbonylContact C-O 3.59Å; G215-G218 WeakPolarHBondContact CA-O 3.49Å; G215-G218 PolarHBondContact N-O 2.87Å; G215-G218 PolarHBondContact O-N 3.14Å; G218-V256 PolarHBondContact N-O 2.75Å; G218-V256 WeakPolarHBondContact O-CB 3.21Å
219	I	73.6	Confident	73.7	Confident	11 Å²	11	53.9 Å²	53.9	6%	0.056	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.7	162.8	-57.8	173.7	0	0	0	105.7	E147 N165 T212 I213 Y214 V256	E147-I219 HydrophobicContact CG-CB 3.64Å; E147-I219 HydrophobicContact CG-CD1 3.58Å; E147-I219 HydrophobicContact CG-CG1 4.08Å; E147-I219 HydrophobicContact CG-CG2 3.96Å; N165-I219 HydrophobicContact CB-CD1 4.49Å; N165-I219 WeakPolarHBondContact OD1-CD1 3.38Å; T212-I219 HydrophobicContact CG2-CG2 4.03Å; I213-I219 CarbonylContact O-C 3.56Å; I213-I219 WeakPolarHBondContact O-CA 3.45Å; I213-I219 WeakPolarHBondContact O-CG2 3.03Å; Y214-I219 HydrophobicContact CD1-CD1 3.37Å; Y214-I219 HydrophobicContact CD1-CG1 3.76Å; Y214-I219 HydrophobicContact CD1-CG2 4Å; Y214-I219 HydrophobicContact CD2-CG2 4.44Å; Y214-I219 HydrophobicContact CE1-CD1 3.53Å; Y214-I219 HydrophobicContact CE1-CG1 4.26Å; Y214-I219 HydrophobicContact CE1-CG2 4Å; Y214-I219 HydrophobicContact CE2-CG2 4.45Å; Y214-I219 HydrophobicContact CG-CD1 4.35Å; Y214-I219 HydrophobicContact CG-CG1 4.29Å; Y214-I219 HydrophobicContact CG-CG2 4.17Å; I219-V256 VanDerWaalsContact C-CG1 3.5Å
220	T	77.9	Confident	71	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-88.1	148.5	171.8	68.8	0	0	0	0	110.1	Y191 T212 I213 A253 V256	Y191-T220 HydrophobicContact CD2-CG2 4.35Å; Y191-T220 HydrophobicContact CE2-CG2 4.01Å; T212-T220 VanDerWaalsContact CG2-O 3.24Å; T212-T220 WeakPolarHBondContact CG2-O 3.46Å; I213-T220 HydrophobicContact CB-CG2 3.9Å; I213-T220 HydrophobicContact CD1-CG2 4.3Å; I213-T220 PolarHBondContact N-OG1 2.93Å; I213-T220 PolarHBondContact O-N 3.4Å; T220-A253 HydrophobicContact CG2-CB 3.48Å; T220-A253 VanDerWaalsContact CG2-CB 3.48Å; T220-V256 HydrophobicContact CG2-CG1 3.62Å
221	P	66.7	Low	68.1	Low	46 Å²	46	67 Å²	67	30%	0.299	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-50.5	157.1	161	-23.5	33.6	0	0	0	111.2	I223	P221-I223 WeakPolarHBondContact O-CG1 3.43Å; P221-I223 PolarHBondContact O-N 2.89Å
222	R	74	Confident	65.2	Low	90 Å²	90	73.8 Å²	73.8	34%	0.34	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-62	126.4	171.1	173.6	170.2	149.8	-154.8	-5.9	110	D70 Y210	D70-R222 HydrophobicContact CB-CB 4.47Å; D70-R222 WeakPolarHBondContact OD1-CD 3.43Å; D70-R222 IonicContact OD1-NH1 2.82Å; D70-R222 PolarHBondContact OD1-NH1 3.05Å; D70-R222 VanDerWaalsContact OD2-CD 3.29Å; D70-R222 WeakPolarHBondContact OD2-CD 3.29Å; Y210-R222 HydrophobicContact CD1-CG 4.05Å; Y210-R222 VanDerWaalsContact CE2-NH2 3.33Å; Y210-R222 HydrophobicContact CG-CG 4.35Å
223	I	84	Confident	62.5	Low	31 Å²	31	77.4 Å²	77.4	16%	0.159	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.3	-174.9	-38.8	-177.1	0	0	0	108.8	Y210 I211 P221 V251 A253	Y210-I223 CarbonylContact C-O 3.59Å; Y210-I223 VanDerWaalsContact CA-O 3.29Å; Y210-I223 WeakPolarHBondContact CA-O 3.37Å; I211-I223 HydrophobicContact CG2-CB 4.18Å; I211-I223 PolarHBondContact N-O 2.81Å; I211-I223 PolarHBondContact O-N 2.73Å; P221-I223 WeakPolarHBondContact O-CG1 3.43Å; P221-I223 PolarHBondContact O-N 2.89Å; I223-V251 HydrophobicContact CD1-CB 4.23Å; I223-V251 HydrophobicContact CD1-CG2 3.58Å; I223-V251 HydrophobicContact CG2-CB 4Å; I223-V251 HydrophobicContact CG2-CG1 3.82Å; I223-V251 HydrophobicContact CG2-CG2 4.37Å; I223-A253 HydrophobicContact CD1-CB 4.21Å
224	E	88.2	Confident	59.8	Low	68 Å²	68	87 Å²	87	32%	0.318	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.6	171	-166.1	165.4	134	0	0	109.4	K208 Y210 S226	K208-E224 IonicContact NZ-OE1 2.68Å; K208-E224 PolarHBondContact NZ-OE1 2.97Å; K208-E224 IonicContact NZ-OE2 2.66Å; K208-E224 PolarHBondContact NZ-OE2 3.12Å; Y210-E224 HydrophobicContact CD1-CB 3.87Å; Y210-E224 HydrophobicContact CD1-CG 4.09Å; Y210-E224 HydrophobicContact CE1-CB 3.58Å; Y210-E224 HydrophobicContact CE1-CG 3.55Å; Y210-E224 WeakPolarHBondContact CE1-OE2 3.4Å; Y210-E224 VanDerWaalsContact CZ-OE2 3.32Å; Y210-E224 PolarHBondContact OH-OE2 2.85Å; E224-S226 PolarHBondContact O-N 2.71Å; E224-S226 VanDerWaalsContact O-N 3.15Å
225	L	86.9	Confident	57.5	Low	6 Å²	6	93.5 Å²	93.5	3%	0.031	49%	0.488	C	S	.	.			trans	-88.1	65.2	175.5	-65.7	-173.1	0	0	0	110.2	I193 T195 V209 I211 F241 F249	I193-L225 HydrophobicContact CD1-CD2 4.15Å; I193-L225 HydrophobicContact CG2-CD1 4.19Å; I193-L225 HydrophobicContact CG2-CD2 4.26Å; T195-L225 HydrophobicContact CG2-CD1 4.07Å; V209-L225 HydrophobicContact CB-CB 4.4Å; V209-L225 HydrophobicContact CG1-CD1 3.96Å; V209-L225 PolarHBondContact O-N 2.96Å; I211-L225 HydrophobicContact CB-CD1 4.33Å; I211-L225 HydrophobicContact CB-CG 4.44Å; I211-L225 HydrophobicContact CG2-CD1 4.3Å; I211-L225 HydrophobicContact CG2-CD2 3.71Å; I211-L225 HydrophobicContact CG2-CG 4.03Å; L225-F241 HydrophobicContact CB-CZ 4.08Å; L225-F249 HydrophobicContact CB-CD1 4.06Å; L225-F249 HydrophobicContact CB-CD2 4.32Å; L225-F249 HydrophobicContact CB-CE1 3.97Å; L225-F249 HydrophobicContact CB-CE2 4.24Å; L225-F249 HydrophobicContact CB-CG 4.25Å; L225-F249 HydrophobicContact CB-CZ 4.07Å; L225-F249 HydrophobicContact CD1-CD2 4.18Å; L225-F249 HydrophobicContact CD1-CE2 4.23Å; L225-F249 HydrophobicContact CD2-CB 3.97Å; L225-F249 HydrophobicContact CD2-CD1 4.41Å; L225-F249 HydrophobicContact CD2-CD2 4.09Å; L225-F249 HydrophobicContact CD2-CG 3.9Å; L225-F249 HydrophobicContact CG-CD2 4.44Å; L225-F249 VanDerWaalsContact O-CE1 3.26Å; L225-F249 WeakPolarHBondContact O-CE1 3.5Å
226	S	74.8	Confident	55.5	Low	64 Å²	64	100.9 Å²	100.9	45%	0.448	53%	0.525	S	S	.	.			trans	-95	156.3	169.9	54.7	0	0	0	0	110.9	E224 E228	E224-S226 PolarHBondContact O-N 2.71Å; E224-S226 VanDerWaalsContact O-N 3.15Å; S226-E228 PolarHBondContact O-N 2.94Å
227	Q	63.5	Low	54.4	Low	152 Å²	152	98.7 Å²	98.7	71%	0.71	53%	0.528	S	S	*	.			trans	-74.2	113	167.7	-76.4	-179.5	-27.2	0	0	109.2	N229	Q227-N229 VanDerWaalsContact C-N 3.27Å; Q227-N229 PolarHBondContact O-N 2.8Å
228	E	46.1	Very low	54	Low	171 Å²	171	101.2 Å²	101.2	80%	0.799	55%	0.547	S	S	*	.			trans	-68.5	87.2	161.7	-76.3	-166.5	148.8	0	0	109.1	S226	S226-E228 PolarHBondContact O-N 2.94Å
229	N	40	Very low	54.2	Low	155 Å²	155	103.8 Å²	103.8	83%	0.829	57%	0.568	S	S	*	*			trans	-157.6	118.1	155.4	-100.1	-22.6	0	0	0	111	Q227	Q227-N229 VanDerWaalsContact C-N 3.27Å; Q227-N229 PolarHBondContact O-N 2.8Å
230	K	29.5	Very low	54	Low	197 Å²	197	105.5 Å²	105.5	86%	0.857	58%	0.58	S	S	*	*			trans	-98.5	154.5	154.5	-85.6	-172.2	173.1	-175.3	0	108
231	S	29.5	Very low	54.3	Low	108 Å²	108	105.9 Å²	105.9	76%	0.755	58%	0.582	S	S	*	*	S	Bend	trans	82	134.9	172.6	77.2	0	0	0	0	118.2
232	T	30	Very low	54.7	Low	143 Å²	143	104.4 Å²	104.4	88%	0.877	58%	0.575	S	S	*	*			trans	54.4	121	161.6	57.6	0	0	0	0	120.4
233	G	28.6	Very low	55.1	Low	77 Å²	77	106.2 Å²	106.2	79%	0.794	58%	0.582	S	S	*	*			trans	130.9	127.7	161.8	0	0	0	0	0	113
234	K	29.3	Very low	54.8	Low	203 Å²	203	106.8 Å²	106.8	88%	0.883	60%	0.596	S	S	*	*			trans	-75.1	122.7	163.7	-67.6	173.6	178.5	176	0	107.6
235	D	33.7	Very low	54.5	Low	164 Å²	164	104.8 Å²	104.8	88%	0.877	59%	0.588	S	S	*	*				-162.9	121.9	128.6	-96.3	-25.7	0	0	0	109.6
236	I	32.8	Very low	54.3	Low	160 Å²	160	108.3 Å²	108.3	82%	0.821	61%	0.613	S	S	*	*			trans	-113.7	108.6	-179.5	-60.7	167.3	0	0	0	106.2
237	L	38.2	Very low	54.6	Low	168 Å²	168	106.3 Å²	106.3	88%	0.88	60%	0.598	S	S	*	*			trans	171.6	64	153.6	-96	160.7	0	0	0	112.7
238	C	48.2	Very low	55.6	Low	111 Å²	111	105.5 Å²	105.5	75%	0.75	59%	0.592	S	S	*	*			trans	-161.6	117.2	154.7	-106	0	0	0	0	111
239	A	62.4	Low	57.6	Low	55 Å²	55	97.8 Å²	97.8	46%	0.455	56%	0.556	S	S	.	*			trans	-71	132.3	164	0	0	0	0	0	108.5	F241 G242	A239-F241 PolarHBondContact O-N 2.76Å; A239-G242 PolarHBondContact O-N 2.6Å; A239-G242 VanDerWaalsContact O-N 3.07Å
240	P	70.1	Confident	59.8	Low	47 Å²	47	94.1 Å²	94.1	31%	0.305	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-9.6	-171.5	24.1	-34	0	0	0	114.8	T247 F249	P240-T247 HydrophobicContact CB-CG2 4.04Å; P240-T247 WeakPolarHBondContact O-CB 3.42Å; P240-T247 PolarHBondContact O-OG1 3.35Å; P240-F249 HydrophobicContact CB-CZ 4.47Å
241	F	84.3	Confident	62.3	Low	7 Å²	7	85.7 Å²	85.7	3%	0.031	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.5	32.4	175.9	-46.1	-70.5	0	0	0	111.9	G204 T205 V209 L225 A239 F249 W275	G204-F241 CarbonylContact C-O 3.54Å; G204-F241 WeakPolarHBondContact CA-O 3.2Å; T205-F241 HydrophobicContact CG2-CB 3.73Å; T205-F241 HydrophobicContact CG2-CD2 4.33Å; T205-F241 HydrophobicContact CG2-CG 4.25Å; T205-F241 PolarHBondContact N-O 3Å; V209-F241 HydrophobicContact CB-CD2 4.48Å; V209-F241 HydrophobicContact CB-CE1 4.04Å; V209-F241 HydrophobicContact CB-CE2 3.85Å; V209-F241 HydrophobicContact CB-CZ 3.6Å; V209-F241 HydrophobicContact CG1-CE1 4.37Å; V209-F241 HydrophobicContact CG1-CZ 4.35Å; V209-F241 HydrophobicContact CG2-CD1 4.07Å; V209-F241 HydrophobicContact CG2-CD2 3.64Å; V209-F241 HydrophobicContact CG2-CE1 3.92Å; V209-F241 HydrophobicContact CG2-CE2 3.49Å; V209-F241 VanDerWaalsContact CG2-CE2 3.49Å; V209-F241 HydrophobicContact CG2-CG 3.95Å; V209-F241 HydrophobicContact CG2-CZ 3.64Å; L225-F241 HydrophobicContact CB-CZ 4.08Å; A239-F241 PolarHBondContact O-N 2.76Å; F241-F249 AromaticContact CE1-CE2 3.85Å; F241-F249 HydrophobicContact CE1-CE2 3.85Å; F241-F249 AromaticContact CE1-CZ 3.54Å; F241-F249 HydrophobicContact CE1-CZ 3.54Å; F241-F249 HydrophobicContact CZ-CE1 4.26Å; F241-F249 HydrophobicContact CZ-CE2 4.23Å; F241-F249 AromaticContact CZ-CZ 3.53Å; F241-F249 HydrophobicContact CZ-CZ 3.53Å; F241-W275 HydrophobicContact CB-CZ2 4.14Å; F241-W275 AromaticContact CD1-CH2 3.96Å; F241-W275 HydrophobicContact CD1-CH2 3.96Å; F241-W275 AromaticContact CD1-CZ2 3.5Å; F241-W275 HydrophobicContact CD1-CZ2 3.5Å; F241-W275 VanDerWaalsContact CD1-CZ2 3.5Å; F241-W275 HydrophobicContact CE1-CH2 4.33Å; F241-W275 HydrophobicContact CE1-CZ2 4.27Å; F241-W275 HydrophobicContact CG-CZ2 4.08Å
242	G	75.5	Confident	64.7	Low	15 Å²	15	88.5 Å²	88.5	16%	0.155	50%	0.499	C	S	.	.			trans	-75.2	168.6	178.1	0	0	0	0	0	114.2	T197 A239 G244 T245	T197-G242 WeakPolarHBondContact CB-O 3.48Å; T197-G242 VanDerWaalsContact CG2-O 3.23Å; T197-G242 WeakPolarHBondContact CG2-O 3.38Å; T197-G242 PolarHBondContact OG1-O 3.17Å; A239-G242 PolarHBondContact O-N 2.6Å; A239-G242 VanDerWaalsContact O-N 3.07Å; G242-G244 PolarHBondContact O-N 2.82Å; G242-T245 PolarHBondContact N-OG1 2.85Å; G242-T245 VanDerWaalsContact N-OG1 3.14Å; G242-T245 WeakPolarHBondContact O-CB 3.37Å; G242-T245 WeakPolarHBondContact O-CG2 3.23Å; G242-T245 PolarHBondContact O-N 3.45Å; G242-T245 VanDerWaalsContact O-N 3.08Å; G242-T245 PolarHBondContact O-OG1 2.87Å
243	R	81.3	Confident	67	Low	128 Å²	128	82 Å²	82	48%	0.483	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	130.4	178.8	-172.7	173.9	170.2	169.4	4.8	112.3	D199 S203 T245	D199-R243 PolarHBondContact O-NE 2.85Å; D199-R243 PolarHBondContact O-NH2 3.19Å; D199-R243 WeakPolarHBondContact OD1-CG 3.38Å; D199-R243 IonicContact OD1-CZ 2.69Å; D199-R243 IonicContact OD1-NE 3.77Å; D199-R243 PolarHBondContact OD1-NE 3.01Å; D199-R243 IonicContact OD1-NH2 2.89Å; D199-R243 PolarHBondContact OD1-NH2 2.95Å; S203-R243 WeakPolarHBondContact O-CA 3.42Å; S203-R243 WeakPolarHBondContact O-CB 3.46Å; S203-R243 PolarHBondContact O-N 3.44Å; S203-R243 VanDerWaalsContact O-N 3.11Å; R243-T245 PolarHBondContact O-N 2.91Å; R243-T245 VanDerWaalsContact O-N 3.08Å
244	G	78.5	Confident	69	Low	44 Å²	44	79 Å²	79	45%	0.454	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	1.9	-179.9	0	0	0	0	0	116.5	T197 G198 G242	T197-G244 CarbonylContact O-C 3.48Å; T197-G244 VanDerWaalsContact O-CA 3.26Å; T197-G244 WeakPolarHBondContact O-CA 3.38Å; T197-G244 PolarHBondContact O-N 2.77Å; G198-G244 PolarHBondContact O-N 3.12Å; G242-G244 PolarHBondContact O-N 2.82Å
245	T	81.1	Confident	71.3	Confident	25 Å²	25	70.8 Å²	70.8	15%	0.153	39%	0.392	C	S	.	.			trans	-78.6	144.9	-173.6	62.1	0	0	0	0	113.5	V196 T197 G242 R243	V196-T245 WeakPolarHBondContact CA-O 3.47Å; T197-T245 PolarHBondContact N-O 2.79Å; G242-T245 PolarHBondContact N-OG1 2.85Å; G242-T245 VanDerWaalsContact N-OG1 3.14Å; G242-T245 WeakPolarHBondContact O-CB 3.37Å; G242-T245 WeakPolarHBondContact O-CG2 3.23Å; G242-T245 PolarHBondContact O-N 3.45Å; G242-T245 VanDerWaalsContact O-N 3.08Å; G242-T245 PolarHBondContact O-OG1 2.87Å; R243-T245 PolarHBondContact O-N 2.91Å; R243-T245 VanDerWaalsContact O-N 3.08Å
246	S	83.7	Confident	73.2	Confident	80 Å²	80	63 Å²	63	56%	0.559	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	98.4	173.3	168.3	0	0	0	0	110.5	T195	T195-S246 CarbonylContact O-C 3.11Å; T195-S246 WeakPolarHBondContact O-CA 3.39Å
247	T	80.7	Confident	75.2	Confident	23 Å²	23	55.6 Å²	55.6	14%	0.141	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.1	-167.5	-52.3	0	0	0	0	112	V194 T195 P240 F249	V194-T247 CarbonylContact C-O 2.96Å; V194-T247 VanDerWaalsContact CA-O 3.27Å; V194-T247 WeakPolarHBondContact CA-O 3.32Å; T195-T247 PolarHBondContact N-O 3.21Å; T195-T247 PolarHBondContact O-N 3.03Å; P240-T247 HydrophobicContact CB-CG2 4.04Å; P240-T247 WeakPolarHBondContact O-CB 3.42Å; P240-T247 PolarHBondContact O-OG1 3.35Å; T247-F249 HydrophobicContact CG2-CE1 4.24Å; T247-F249 HydrophobicContact CG2-CE2 3.79Å; T247-F249 HydrophobicContact CG2-CZ 3.54Å
248	K	85.2	Confident	76.9	Confident	134 Å²	134	48.8 Å²	48.8	58%	0.583	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.4	-175.4	177.9	172.2	174.3	173.3	0	112.8	S192 I193 V194	S192-K248 VanDerWaalsContact OG-CE 3.31Å; S192-K248 WeakPolarHBondContact OG-CE 3.28Å; I193-K248 CarbonylContact O-C 3.09Å; I193-K248 WeakPolarHBondContact O-CA 3.34Å; V194-K248 HydrophobicContact CG2-CB 4.15Å; V194-K248 HydrophobicContact CG2-CD 4.3Å; V194-K248 HydrophobicContact CG2-CG 4.06Å
249	F	87.1	Confident	78.5	Confident	10 Å²	10	43.9 Å²	43.9	4%	0.044	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.2	179.4	-50.7	-92.4	0	0	0	110	S192 I193 L225 P240 F241 T247	S192-F249 WeakPolarHBondContact CA-O 3.1Å; I193-F249 HydrophobicContact CB-CB 4.5Å; I193-F249 PolarHBondContact N-O 2.77Å; I193-F249 PolarHBondContact O-N 3.22Å; L225-F249 HydrophobicContact CB-CD1 4.06Å; L225-F249 HydrophobicContact CB-CD2 4.32Å; L225-F249 HydrophobicContact CB-CE1 3.97Å; L225-F249 HydrophobicContact CB-CE2 4.24Å; L225-F249 HydrophobicContact CB-CG 4.25Å; L225-F249 HydrophobicContact CB-CZ 4.07Å; L225-F249 HydrophobicContact CD1-CD2 4.18Å; L225-F249 HydrophobicContact CD1-CE2 4.23Å; L225-F249 HydrophobicContact CD2-CB 3.97Å; L225-F249 HydrophobicContact CD2-CD1 4.41Å; L225-F249 HydrophobicContact CD2-CD2 4.09Å; L225-F249 HydrophobicContact CD2-CG 3.9Å; L225-F249 HydrophobicContact CG-CD2 4.44Å; L225-F249 VanDerWaalsContact O-CE1 3.26Å; L225-F249 WeakPolarHBondContact O-CE1 3.5Å; P240-F249 HydrophobicContact CB-CZ 4.47Å; F241-F249 AromaticContact CE1-CE2 3.85Å; F241-F249 HydrophobicContact CE1-CE2 3.85Å; F241-F249 AromaticContact CE1-CZ 3.54Å; F241-F249 HydrophobicContact CE1-CZ 3.54Å; F241-F249 HydrophobicContact CZ-CE1 4.26Å; F241-F249 HydrophobicContact CZ-CE2 4.23Å; F241-F249 AromaticContact CZ-CZ 3.53Å; F241-F249 HydrophobicContact CZ-CZ 3.53Å; T247-F249 HydrophobicContact CG2-CE1 4.24Å; T247-F249 HydrophobicContact CG2-CE2 3.79Å; T247-F249 HydrophobicContact CG2-CZ 3.54Å
250	I	85.4	Confident	79	Confident	77 Å²	77	43.6 Å²	43.6	40%	0.395	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128	174.8	-60.6	178.3	0	0	0	108.7	K190 Y191 M285	K190-I250 HydrophobicContact CD-CG2 4.25Å; Y191-I250 CarbonylContact O-C 3.56Å; Y191-I250 WeakPolarHBondContact O-CA 3.32Å; I250-M285 HydrophobicContact CG2-SD 3.81Å
251	V	83	Confident	79.6	Confident	20 Å²	20	43.3 Å²	43.3	12%	0.121	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.3	-169.5	-55.1	0	0	0	0	111.6	K190 Y191 I193 I223	K190-V251 CarbonylContact C-O 3.6Å; K190-V251 VanDerWaalsContact CA-O 3.28Å; K190-V251 WeakPolarHBondContact CA-O 3.42Å; Y191-V251 PolarHBondContact N-O 3.07Å; Y191-V251 PolarHBondContact O-N 3.3Å; I193-V251 HydrophobicContact CD1-CG1 4.19Å; I193-V251 HydrophobicContact CD1-CG2 3.48Å; I193-V251 VanDerWaalsContact CD1-CG2 3.48Å; I223-V251 HydrophobicContact CD1-CB 4.23Å; I223-V251 HydrophobicContact CD1-CG2 3.58Å; I223-V251 HydrophobicContact CG2-CB 4Å; I223-V251 HydrophobicContact CG2-CG1 3.82Å; I223-V251 HydrophobicContact CG2-CG2 4.37Å
252	K	80.4	Confident	79.8	Confident	168 Å²	168	43 Å²	43	73%	0.73	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.4	177.7	-80.2	177.4	178.7	168.1	0	111.6	T189 K190	T189-K252 WeakPolarHBondContact O-CA 2.92Å; K190-K252 HydrophobicContact CG-CG 3.89Å
253	A	78.1	Confident	80.3	Confident	5 Å²	5	43.1 Å²	43.1	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	171.5	-178.3	0	0	0	0	0	112.3	K188 T189 Y191 T220 I223	K188-A253 WeakPolarHBondContact CA-O 3.14Å; T189-A253 PolarHBondContact N-O 3.44Å; T189-A253 PolarHBondContact O-N 3.26Å; T189-A253 VanDerWaalsContact O-N 3.08Å; T189-A253 VanDerWaalsContact O-O 3.1Å; Y191-A253 HydrophobicContact CD2-CB 3.95Å; Y191-A253 HydrophobicContact CE2-CB 4.07Å; T220-A253 HydrophobicContact CG2-CB 3.48Å; T220-A253 VanDerWaalsContact CG2-CB 3.48Å; I223-A253 HydrophobicContact CD1-CB 4.21Å
254	P	69.8	Low	80.8	Confident	15 Å²	15	37 Å²	37	10%	0.097	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	147.5	169.4	-19.5	33.4	0	0	0	111	Y191 V256	Y191-P254 WeakPolarHBondContact CE2-O 3.33Å; P254-V256 PolarHBondContact O-N 3.05Å
255	N	78.7	Confident	81.2	Confident	30 Å²	30	38.3 Å²	38.3	16%	0.16	20%	0.201	C	C	.	.			trans	-72.2	118.5	174.2	-166.7	-63.2	0	0	0	110.3	A187 T189 Y191 G257 D284	A187-N255 WeakPolarHBondContact O-CB 3.41Å; A187-N255 PolarHBondContact O-N 3Å; T189-N255 HydrophobicContact CG2-CB 4.07Å; Y191-N255 WeakPolarHBondContact OH-CA 3.34Å; N255-G257 PolarHBondContact OD1-N 3.26Å; N255-D284 PolarHBondContact ND2-OD2 2.98Å
256	V	72.9	Confident	81.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.194	C	C	.	.			trans	-89	0.8	-177.6	-55.4	0	0	0	0	114.7	Y191 I213 G215 R216 T217 G218 I219 T220 P254 I259	Y191-V256 PolarHBondContact OH-N 2.92Å; I213-V256 HydrophobicContact CG2-CG2 4.13Å; G215-V256 CarbonylContact C-O 3.56Å; G215-V256 VanDerWaalsContact CA-O 3.31Å; G215-V256 WeakPolarHBondContact CA-O 3.32Å; R216-V256 PolarHBondContact N-O 3.22Å; T217-V256 PolarHBondContact N-O 2.89Å; T217-V256 PolarHBondContact OG1-O 2.8Å; G218-V256 PolarHBondContact N-O 2.75Å; G218-V256 WeakPolarHBondContact O-CB 3.21Å; I219-V256 VanDerWaalsContact C-CG1 3.5Å; T220-V256 HydrophobicContact CG2-CG1 3.62Å; P254-V256 PolarHBondContact O-N 3.05Å; V256-I259 HydrophobicContact CG2-CG1 3.8Å
257	G	74.4	Confident	81.5	Confident	5 Å²	5	36 Å²	36	5%	0.052	18%	0.182	C	C	.	.	S	Bend	trans	70.7	-150.5	-169.2	0	0	0	0	0	111.6	T217 N255 I259	T217-G257 WeakPolarHBondContact OG1-CA 3.44Å; T217-G257 PolarHBondContact OG1-N 2.76Å; N255-G257 PolarHBondContact OD1-N 3.26Å; G257-I259 PolarHBondContact O-N 2.99Å
258	A	75.1	Confident	81.5	Confident	26 Å²	26	38.2 Å²	38.2	22%	0.215	19%	0.19	C	C	.	.	S	Bend	trans	-65.8	116.6	175.3	0	0	0	0	0	110.8	G215 R216 Y292	G215-A258 CarbonylContact C-O 3.56Å; G215-A258 WeakPolarHBondContact CA-O 3.4Å; R216-A258 HydrophobicContact CB-CB 4.45Å; R216-A258 PolarHBondContact N-O 3.15Å; A258-Y292 VanDerWaalsContact CA-OH 3.25Å; A258-Y292 WeakPolarHBondContact CA-OH 3.39Å; A258-Y292 WeakPolarHBondContact CB-OH 3.5Å
259	I	80.3	Confident	81.2	Confident	7 Å²	7	35.6 Å²	35.6	4%	0.036	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	141.7	-177.8	-58.4	163.9	0	0	0	110	Y191 I213 Y214 V256 G257 V282 Y292 F294	Y191-I259 HydrophobicContact CD1-CD1 4.3Å; Y191-I259 HydrophobicContact CE1-CD1 4.01Å; I213-I259 HydrophobicContact CG2-CB 4.42Å; I213-I259 HydrophobicContact CG2-CD1 3.88Å; I213-I259 HydrophobicContact CG2-CG1 3.79Å; I213-I259 HydrophobicContact CG2-CG2 3.73Å; Y214-I259 CarbonylContact O-C 3.6Å; Y214-I259 VanDerWaalsContact O-CA 3.27Å; Y214-I259 WeakPolarHBondContact O-CA 3.08Å; Y214-I259 VanDerWaalsContact O-CG2 3.26Å; Y214-I259 WeakPolarHBondContact O-CG2 3.33Å; V256-I259 HydrophobicContact CG2-CG1 3.8Å; G257-I259 PolarHBondContact O-N 2.99Å; I259-V282 HydrophobicContact CD1-CB 4.38Å; I259-V282 HydrophobicContact CD1-CG1 3.81Å; I259-Y292 HydrophobicContact CB-CD1 4.09Å; I259-Y292 HydrophobicContact CB-CD2 3.59Å; I259-Y292 HydrophobicContact CB-CE1 4.14Å; I259-Y292 HydrophobicContact CB-CE2 3.64Å; I259-Y292 HydrophobicContact CB-CG 3.84Å; I259-Y292 HydrophobicContact CD1-CD2 3.59Å; I259-Y292 HydrophobicContact CD1-CE2 3.86Å; I259-Y292 HydrophobicContact CD1-CG 4.46Å; I259-Y292 HydrophobicContact CG1-CD2 3.95Å; I259-Y292 HydrophobicContact CG1-CE2 3.88Å; I259-Y292 HydrophobicContact CG2-CD2 4.41Å; I259-Y292 HydrophobicContact CG2-CG 4.33Å; I259-Y292 VanDerWaalsContact N-CZ 3.33Å; I259-Y292 PolarHBondContact N-OH 3.43Å; I259-Y292 WeakPolarHBondContact O-CD1 3.18Å; I259-Y292 WeakPolarHBondContact O-CE1 3.46Å; I259-F294 HydrophobicContact CG2-CZ 3.85Å
260	T	74.5	Confident	80.4	Confident	50 Å²	50	35.8 Å²	35.8	31%	0.307	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-35.3	-180	63.7	0	0	0	0	112.7	Y214 R216 R314 G315	Y214-T260 PolarHBondContact O-N 3.08Å; R216-T260 HydrophobicContact CG-CG2 4.5Å; T260-R314 WeakPolarHBondContact O-CG 3.26Å; T260-G315 PolarHBondContact O-N 2.81Å
261	N	81.4	Confident	79.9	Confident	41 Å²	41	39.6 Å²	39.6	22%	0.219	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.4	-175.9	-54.4	77.6	0	0	0	110.5	Y214 L312 V313	Y214-N261 WeakPolarHBondContact CB-O 3.41Å; Y214-N261 HydrophobicContact CD2-CB 4.23Å; Y214-N261 HydrophobicContact CG-CB 4.16Å; Y214-N261 PolarHBondContact N-O 2.91Å; Y214-N261 PolarHBondContact O-N 2.96Å; N261-L312 HydrophobicContact CB-CD1 4.12Å; N261-V313 CarbonylContact C-O 2.9Å; N261-V313 VanDerWaalsContact CA-O 3.25Å; N261-V313 WeakPolarHBondContact CA-O 3.31Å; N261-V313 WeakPolarHBondContact CB-O 3.39Å
262	I	89.5	Confident	79.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	147.7	156.7	63.1	-179.2	0	0	0	109.4	I211 T212 I213 V280 V282 F294 L312 V313	I211-I262 HydrophobicContact CD1-CB 4.31Å; I211-I262 HydrophobicContact CD1-CD1 4.06Å; I211-I262 HydrophobicContact CD1-CG2 4.1Å; I211-I262 HydrophobicContact CG1-CB 4.18Å; I211-I262 HydrophobicContact CG1-CG2 4.32Å; T212-I262 CarbonylContact O-C 3.48Å; T212-I262 VanDerWaalsContact O-CA 3.25Å; T212-I262 WeakPolarHBondContact O-CA 3.49Å; I213-I262 HydrophobicContact CG1-CG2 4.32Å; I262-V280 HydrophobicContact CD1-CB 3.67Å; I262-V280 HydrophobicContact CD1-CG1 3.75Å; I262-V280 HydrophobicContact CD1-CG2 3.91Å; I262-V282 HydrophobicContact CG2-CG2 4.08Å; I262-F294 HydrophobicContact CB-CD1 4.35Å; I262-F294 HydrophobicContact CB-CE1 4.1Å; I262-F294 HydrophobicContact CB-CZ 4.45Å; I262-F294 HydrophobicContact CD1-CB 3.9Å; I262-F294 HydrophobicContact CD1-CD1 3.85Å; I262-F294 HydrophobicContact CD1-CD2 3.87Å; I262-F294 HydrophobicContact CD1-CE1 4.32Å; I262-F294 HydrophobicContact CD1-CE2 4.38Å; I262-F294 HydrophobicContact CD1-CG 3.6Å; I262-F294 HydrophobicContact CG1-CB 4.4Å; I262-F294 HydrophobicContact CG1-CD1 3.55Å; I262-F294 HydrophobicContact CG1-CD2 4.4Å; I262-F294 HydrophobicContact CG1-CE1 3.82Å; I262-F294 HydrophobicContact CG1-CG 3.87Å; I262-F294 HydrophobicContact CG1-CZ 4.4Å; I262-F294 HydrophobicContact CG2-CD1 4.29Å; I262-F294 HydrophobicContact CG2-CE1 3.7Å; I262-F294 HydrophobicContact CG2-CE2 4.01Å; I262-F294 HydrophobicContact CG2-CZ 3.57Å; I262-L312 CarbonylContact O-C 2.9Å; I262-V313 HydrophobicContact CG1-CB 4.25Å; I262-V313 PolarHBondContact N-O 3Å; I262-V313 PolarHBondContact O-N 2.83Å
263	R	86.2	Confident	79.2	Confident	18 Å²	18	37.6 Å²	37.6	7%	0.068	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	129.7	151.4	-172.3	169.1	-60.9	102.3	26.6	107.6	D70 V71 I211 T212 Y214 R311 L312	D70-R263 PolarHBondContact O-NH1 2.99Å; D70-R263 IonicContact OD2-NH1 3.07Å; V71-R263 VanDerWaalsContact CG1-NH2 3.28Å; I211-R263 CarbonylContact C-O 3.54Å; I211-R263 VanDerWaalsContact CA-O 3.3Å; I211-R263 WeakPolarHBondContact CA-O 3.27Å; T212-R263 PolarHBondContact N-O 3.31Å; T212-R263 PolarHBondContact O-N 2.79Å; Y214-R263 HydrophobicContact CE2-CB 4.24Å; Y214-R263 VanDerWaalsContact OH-CZ 3.31Å; Y214-R263 PolarHBondContact OH-NH1 3.15Å; Y214-R263 PolarHBondContact OH-NH2 3.2Å; R263-R311 WeakPolarHBondContact CA-O 3.07Å; R263-L312 HydrophobicContact CB-CD1 4.37Å
264	I	91	Very high	79.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.1	165.7	-166	161	0	0	0	109.3	T195 V209 Y210 W275 L277 V280 L296 L300 R311	T195-I264 HydrophobicContact CG2-CD1 4.05Å; V209-I264 HydrophobicContact CG1-CD1 4.01Å; V209-I264 HydrophobicContact CG1-CG1 3.9Å; Y210-I264 WeakPolarHBondContact O-CA 3.19Å; I264-W275 HydrophobicContact CD1-CH2 3.9Å; I264-W275 HydrophobicContact CD1-CZ3 4.15Å; I264-W275 HydrophobicContact CG1-CZ3 4.33Å; I264-L277 HydrophobicContact CD1-CD2 3.94Å; I264-L277 HydrophobicContact CG2-CD2 4.01Å; I264-V280 HydrophobicContact CD1-CG2 3.71Å; I264-L296 HydrophobicContact CG2-CD2 4.27Å; I264-L300 HydrophobicContact CG2-CD1 4.21Å; I264-R311 HydrophobicContact CG2-CB 4.43Å; I264-R311 PolarHBondContact N-O 3.2Å; I264-R311 PolarHBondContact O-N 3.27Å
265	K	86.8	Confident	80.2	Confident	71 Å²	71	38 Å²	38	31%	0.309	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	138.3	-173.5	172.8	172.2	176.4	178.1	0	109.6	V209 Y210 C310	V209-K265 CarbonylContact C-O 3.57Å; V209-K265 WeakPolarHBondContact CA-O 3.5Å; Y210-K265 PolarHBondContact N-O 3.26Å; Y210-K265 PolarHBondContact O-N 2.76Å; K265-C310 HydrophobicContact CB-CB 4.12Å; K265-C310 HydrophobicContact CD-CB 4.33Å; K265-C310 HydrophobicContact CG-CB 4.06Å
266	Q	87.9	Confident	80.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	156.4	154.4	63.9	159.7	-10	0	0	110.8	T205 S207 K208 V209 E268 P273 L300 S309	T205-Q266 PolarHBondContact OG1-OE1 2.75Å; S207-Q266 VanDerWaalsContact CB-OE1 3.29Å; S207-Q266 PolarHBondContact OG-OE1 3.04Å; K208-Q266 CarbonylContact O-C 3.57Å; K208-Q266 VanDerWaalsContact O-CA 3.28Å; K208-Q266 WeakPolarHBondContact O-CA 3.49Å; V209-Q266 HydrophobicContact CG2-CB 4.38Å; Q266-E268 HydrophobicContact CG-CG 4.44Å; Q266-P273 PolarHBondContact NE2-O 3.2Å; Q266-L300 PolarHBondContact NE2-O 3.47Å; Q266-S309 PolarHBondContact N-O 2.73Å; Q266-S309 VanDerWaalsContact N-O 3.13Å
267	D	83	Confident	81.2	Confident	55 Å²	55	37.5 Å²	37.5	29%	0.294	20%	0.204	S	C	.	.			trans	-96.4	2.1	179.2	68.3	-6.5	0	0	0	115.1	K208 Y210 S269	K208-D267 WeakPolarHBondContact CB-OD2 3.23Å; K208-D267 PolarHBondContact N-OD1 3.48Å; K208-D267 PolarHBondContact O-N 3.06Å; Y210-D267 HydrophobicContact CE2-CB 4.22Å; D267-S269 PolarHBondContact O-N 3.35Å; D267-S269 WeakPolarHBondContact OD1-CB 3.48Å; D267-S269 PolarHBondContact OD1-N 3.09Å; D267-S269 PolarHBondContact OD1-OG 3.3Å
268	E	80.1	Confident	81.5	Confident	70 Å²	70	40.7 Å²	40.7	33%	0.327	22%	0.218	S	C	.	.			trans	59.5	20.9	179.7	-57	-178.8	-126.8	0	0	114.2	S207 Q266 G270 P273 S302 S309	S207-E268 WeakPolarHBondContact OG-CA 3.15Å; Q266-E268 HydrophobicContact CG-CG 4.44Å; E268-G270 PolarHBondContact O-N 3.47Å; E268-P273 HydrophobicContact CB-CB 4.2Å; E268-P273 HydrophobicContact CG-CB 4.26Å; E268-S302 WeakPolarHBondContact OE2-CB 3.31Å; E268-S302 PolarHBondContact OE2-OG 3.13Å; E268-S309 WeakPolarHBondContact OE1-CB 3.4Å; E268-S309 PolarHBondContact OE1-OG 3.34Å
269	S	80.7	Confident	82	Confident	80 Å²	80	43.1 Å²	43.1	56%	0.559	22%	0.222	S	C	*	.			trans	-75	-3.1	-178.3	84.1	0	0	0	0	115.2	S207 D267	S207-S269 PolarHBondContact OG-N 2.84Å; D267-S269 PolarHBondContact O-N 3.35Å; D267-S269 WeakPolarHBondContact OD1-CB 3.48Å; D267-S269 PolarHBondContact OD1-N 3.09Å; D267-S269 PolarHBondContact OD1-OG 3.3Å
270	G	70.4	Confident	82.4	Confident	14 Å²	14	42.8 Å²	42.8	14%	0.144	22%	0.22	C	C	.	.	S	Bend	trans	-111.9	156.3	-172.1	0	0	0	0	0	113.6	N206 S207 E268 E272 P273	N206-G270 WeakPolarHBondContact OD1-CA 3.34Å; S207-G270 PolarHBondContact OG-N 2.8Å; E268-G270 PolarHBondContact O-N 3.47Å; G270-E272 PolarHBondContact O-N 3.18Å; G270-E272 VanDerWaalsContact O-N 3.12Å; G270-P273 WeakPolarHBondContact O-CD 3.45Å
271	N	74.1	Confident	83	Confident	157 Å²	157	41.2 Å²	41.2	84%	0.84	21%	0.21	S	C	*	.	S	Bend	trans	-61.3	-21.8	-174.6	-65.8	-1.1	0	0	0	114.3	N206	N206-N271 PolarHBondContact OD1-N 3.2Å; N206-N271 VanDerWaalsContact OD1-N 3.1Å
272	E	72.8	Confident	83.3	Confident	131 Å²	131	39.3 Å²	39.3	61%	0.612	20%	0.2	S	C	*	.			trans	-127.9	78.3	179.7	-66.8	-177.2	168.7	0	0	109.9	T205 N206 G270 H274	T205-E272 WeakPolarHBondContact CA-O 3.47Å; N206-E272 PolarHBondContact OD1-N 2.8Å; G270-E272 PolarHBondContact O-N 3.18Å; G270-E272 VanDerWaalsContact O-N 3.12Å; E272-H274 PolarHBondContact O-N 2.82Å
273	P	75.8	Confident	83.2	Confident	14 Å²	14	40.4 Å²	40.4	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	42.2	-174.9	35.1	-36.1	0	0	0	112	Q266 E268 G270 S301	Q266-P273 PolarHBondContact NE2-O 3.2Å; E268-P273 HydrophobicContact CB-CB 4.2Å; E268-P273 HydrophobicContact CG-CB 4.26Å; G270-P273 WeakPolarHBondContact O-CD 3.45Å; P273-S301 WeakPolarHBondContact O-CB 3.39Å; P273-S301 PolarHBondContact O-OG 3.37Å
274	H	81.6	Confident	83.1	Confident	30 Å²	30	39.6 Å²	39.6	14%	0.139	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	54.2	-164.3	-60.7	-35.1	0	0	0	112.7	G202 G204 E272 F276 W299 S301 Y304	G202-H274 VanDerWaalsContact O-O 3.06Å; G204-H274 PolarHBondContact N-O 3.32Å; G204-H274 CarbonylContact O-C 3.56Å; G204-H274 WeakPolarHBondContact O-CA 3.46Å; G204-H274 PolarHBondContact O-N 2.89Å; E272-H274 PolarHBondContact O-N 2.82Å; H274-F276 PolarHBondContact O-N 3.11Å; H274-W299 HydrophobicContact CB-CZ3 4.3Å; H274-W299 WeakPolarHBondContact O-CZ3 3.37Å; H274-S301 PolarHBondContact ND1-OG 2.83Å; H274-Y304 HydrophobicContact CB-CD2 4.1Å; H274-Y304 HydrophobicContact CB-CE2 4.29Å; H274-Y304 AromaticContact CD2-CE2 3.77Å; H274-Y304 AromaticContact CG-CD2 3.68Å; H274-Y304 AromaticContact CG-CE2 3.68Å; H274-Y304 AromaticContact ND1-CD2 3.52Å; H274-Y304 AromaticContact ND1-CE2 3.82Å; H274-Y304 AromaticContact NE2-CE2 3.98Å
275	W	87.9	Confident	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	107.4	-170.3	-164	26	0	0	0	112.9	T195 T197 G204 T205 V209 F241 I264 L277 W299 L300	T195-W275 HydrophobicContact CG2-CH2 4.28Å; T195-W275 HydrophobicContact CG2-CZ2 4.5Å; T197-W275 PolarHBondContact OG1-NE1 3.11Å; G204-W275 WeakPolarHBondContact O-CA 3.46Å; G204-W275 PolarHBondContact O-N 3.12Å; G204-W275 VanDerWaalsContact O-N 3.1Å; T205-W275 HydrophobicContact CG2-CB 3.76Å; T205-W275 HydrophobicContact CG2-CD2 3.84Å; T205-W275 HydrophobicContact CG2-CE3 4.2Å; T205-W275 HydrophobicContact CG2-CG 3.66Å; V209-W275 HydrophobicContact CB-CH2 4.47Å; V209-W275 HydrophobicContact CB-CZ3 4.37Å; V209-W275 HydrophobicContact CG1-CH2 3.72Å; V209-W275 HydrophobicContact CG1-CZ3 3.66Å; V209-W275 HydrophobicContact CG2-CE3 4.21Å; V209-W275 HydrophobicContact CG2-CH2 3.93Å; V209-W275 HydrophobicContact CG2-CZ3 3.69Å; F241-W275 HydrophobicContact CB-CZ2 4.14Å; F241-W275 AromaticContact CD1-CH2 3.96Å; F241-W275 HydrophobicContact CD1-CH2 3.96Å; F241-W275 AromaticContact CD1-CZ2 3.5Å; F241-W275 HydrophobicContact CD1-CZ2 3.5Å; F241-W275 VanDerWaalsContact CD1-CZ2 3.5Å; F241-W275 HydrophobicContact CE1-CH2 4.33Å; F241-W275 HydrophobicContact CE1-CZ2 4.27Å; F241-W275 HydrophobicContact CG-CZ2 4.08Å; I264-W275 HydrophobicContact CD1-CH2 3.9Å; I264-W275 HydrophobicContact CD1-CZ3 4.15Å; I264-W275 HydrophobicContact CG1-CZ3 4.33Å; W275-L277 HydrophobicContact CD2-CB 4.19Å; W275-L277 HydrophobicContact CE3-CB 4.45Å; W275-L277 HydrophobicContact CE3-CD2 4.44Å; W275-L277 HydrophobicContact CH2-CD1 3.98Å; W275-L277 HydrophobicContact CH2-CD2 3.85Å; W275-L277 HydrophobicContact CH2-CG 4.41Å; W275-L277 HydrophobicContact CZ2-CD1 3.59Å; W275-L277 HydrophobicContact CZ2-CD2 4.26Å; W275-L277 HydrophobicContact CZ2-CG 4.33Å; W275-L277 HydrophobicContact CZ3-CD2 3.95Å; W275-L277 PolarHBondContact O-N 3.07Å; W275-W299 CarbonylContact O-C 3.51Å; W275-L300 HydrophobicContact CB-CB 4.29Å; W275-L300 HydrophobicContact CD2-CD1 4.45Å; W275-L300 HydrophobicContact CE3-CB 4.24Å; W275-L300 HydrophobicContact CE3-CD1 3.56Å; W275-L300 HydrophobicContact CZ3-CD1 3.75Å; W275-L300 PolarHBondContact O-N 2.91Å
276	F	86.7	Confident	82.2	Confident	18 Å²	18	43.3 Å²	43.3	8%	0.079	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	102.3	162.7	-168.1	-86	0	0	0	109.6	T197 G198 S203 H274 S297 W299	T197-F276 WeakPolarHBondContact CA-O 3.33Å; T197-F276 WeakPolarHBondContact CG2-O 3.3Å; G198-F276 PolarHBondContact N-O 3.15Å; S203-F276 VanDerWaalsContact OG-CB 3.29Å; S203-F276 WeakPolarHBondContact OG-CB 3.41Å; H274-F276 PolarHBondContact O-N 3.11Å; F276-S297 VanDerWaalsContact CZ-O 3.3Å; F276-S297 WeakPolarHBondContact CZ-O 3.4Å; F276-W299 HydrophobicContact CB-CD2 4.15Å; F276-W299 HydrophobicContact CB-CE3 4.02Å; F276-W299 HydrophobicContact CB-CH2 4.33Å; F276-W299 HydrophobicContact CB-CZ2 4.44Å; F276-W299 HydrophobicContact CB-CZ3 4.13Å; F276-W299 AromaticContact CD2-CD1 3.76Å; F276-W299 AromaticContact CD2-CD2 3.83Å; F276-W299 HydrophobicContact CD2-CD2 3.83Å; F276-W299 AromaticContact CD2-CE2 3.66Å; F276-W299 AromaticContact CD2-CG 3.89Å; F276-W299 HydrophobicContact CD2-CG 3.89Å; F276-W299 HydrophobicContact CD2-CZ2 4.22Å; F276-W299 AromaticContact CD2-NE1 3.6Å
277	L	85.7	Confident	81.6	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.4	178.1	-179.6	60.6	0	0	0	109.3	V196 I264 W275 V280 L296 S297 C298 L300	V196-L277 WeakPolarHBondContact O-CD1 3.34Å; I264-L277 HydrophobicContact CD1-CD2 3.94Å; I264-L277 HydrophobicContact CG2-CD2 4.01Å; W275-L277 HydrophobicContact CD2-CB 4.19Å; W275-L277 HydrophobicContact CE3-CB 4.45Å; W275-L277 HydrophobicContact CE3-CD2 4.44Å; W275-L277 HydrophobicContact CH2-CD1 3.98Å; W275-L277 HydrophobicContact CH2-CD2 3.85Å; W275-L277 HydrophobicContact CH2-CG 4.41Å; W275-L277 HydrophobicContact CZ2-CD1 3.59Å; W275-L277 HydrophobicContact CZ2-CD2 4.26Å; W275-L277 HydrophobicContact CZ2-CG 4.33Å; W275-L277 HydrophobicContact CZ3-CD2 3.95Å; W275-L277 PolarHBondContact O-N 3.07Å; L277-V280 HydrophobicContact CD1-CG2 4.34Å; L277-V280 HydrophobicContact CD2-CG2 3.77Å; L277-V280 HydrophobicContact CG-CG2 4.42Å; L277-L296 HydrophobicContact CD2-CD1 3.8Å; L277-L296 HydrophobicContact CD2-CD2 3.99Å; L277-L296 HydrophobicContact CD2-CG 4.42Å; L277-L296 HydrophobicContact CG-CD1 4.01Å; L277-L296 HydrophobicContact CG-CD2 4.46Å; L277-L296 VanDerWaalsContact O-CB 3.27Å; L277-L296 WeakPolarHBondContact O-CB 3.41Å; L277-S297 PolarHBondContact O-N 2.83Å; L277-C298 PolarHBondContact N-O 3.1Å; L277-C298 PolarHBondContact O-N 2.91Å; L277-L300 HydrophobicContact CB-CD1 3.82Å; L277-L300 HydrophobicContact CB-CG 4.48Å; L277-L300 HydrophobicContact CD2-CD1 3.45Å; L277-L300 VanDerWaalsContact CD2-CD1 3.45Å; L277-L300 HydrophobicContact CG-CD1 4.28Å
278	E	81.1	Confident	81	Confident	73 Å²	73	49.4 Å²	49.4	34%	0.341	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-50.3	-177.4	-171	-174.7	-107.4	0	0	111.1	V196 H295 L296 S297	V196-E278 WeakPolarHBondContact O-CB 3.32Å; V196-E278 PolarHBondContact O-N 2.8Å; E278-H295 PolarHBondContact O-ND1 2.81Å; E278-L296 PolarHBondContact O-N 2.83Å; E278-S297 PolarHBondContact O-N 3.1Å
279	R	84.9	Confident	80.2	Confident	77 Å²	77	51.7 Å²	51.7	29%	0.291	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	159.2	175.1	59.8	177.9	173.7	-178.8	-1.3	114.1	V196 F294	V196-R279 HydrophobicContact CB-CG 3.79Å; V196-R279 HydrophobicContact CG2-CG 3.86Å; V196-R279 PolarHBondContact N-O 3.48Å; V196-R279 PolarHBondContact O-N 3.23Å; R279-F294 CarbonylContact C-O 3.08Å; R279-F294 WeakPolarHBondContact CA-O 3.32Å; R279-F294 WeakPolarHBondContact CB-O 3.46Å
280	V	87.5	Confident	79.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	148.7	164.4	-168.2	0	0	0	0	108.9	I193 V194 T195 I211 I262 I264 L277 V282 F294 L296	I193-V280 HydrophobicContact CG2-CG1 4.14Å; V194-V280 CarbonylContact O-C 3.17Å; V194-V280 VanDerWaalsContact O-CA 3.26Å; V194-V280 WeakPolarHBondContact O-CA 3.29Å; V194-V280 WeakPolarHBondContact O-CG1 3.47Å; T195-V280 HydrophobicContact CG2-CG1 4.22Å; T195-V280 HydrophobicContact CG2-CG2 4.37Å; I211-V280 HydrophobicContact CD1-CG1 4.22Å; I262-V280 HydrophobicContact CD1-CB 3.67Å; I262-V280 HydrophobicContact CD1-CG1 3.75Å; I262-V280 HydrophobicContact CD1-CG2 3.91Å; I264-V280 HydrophobicContact CD1-CG2 3.71Å; L277-V280 HydrophobicContact CD1-CG2 4.34Å; L277-V280 HydrophobicContact CD2-CG2 3.77Å; L277-V280 HydrophobicContact CG-CG2 4.42Å; V280-V282 HydrophobicContact CG1-CG2 4.16Å; V280-F294 HydrophobicContact CB-CB 4.16Å; V280-F294 HydrophobicContact CB-CD2 4.46Å; V280-F294 PolarHBondContact N-O 3.04Å; V280-F294 WeakPolarHBondContact O-CD2 3.14Å; V280-F294 PolarHBondContact O-N 2.91Å; V280-L296 HydrophobicContact CG2-CD1 4Å
281	V	87.3	Confident	80.2	Confident	17 Å²	17	51.4 Å²	51.4	10%	0.103	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.7	172.3	-170.7	0	0	0	0	108.7	I193 V194 T291 Y292 Y293	I193-V281 CarbonylContact C-O 3.53Å; I193-V281 WeakPolarHBondContact CA-O 2.97Å; V194-V281 HydrophobicContact CB-CB 4.26Å; V194-V281 PolarHBondContact N-O 2.85Å; V194-V281 PolarHBondContact O-N 3.42Å; V281-T291 HydrophobicContact CG1-CG2 3.46Å; V281-T291 VanDerWaalsContact CG1-CG2 3.46Å; V281-Y292 CarbonylContact C-O 3.51Å; V281-Y292 WeakPolarHBondContact CA-O 3.4Å; V281-Y293 HydrophobicContact CB-CD1 4.43Å; V281-Y293 HydrophobicContact CB-CE1 4.48Å; V281-Y293 HydrophobicContact CG1-CD1 4.08Å; V281-Y293 HydrophobicContact CG1-CD2 4.5Å; V281-Y293 HydrophobicContact CG1-CE1 3.87Å; V281-Y293 HydrophobicContact CG1-CE2 4.3Å; V281-Y293 HydrophobicContact CG1-CG 4.38Å; V281-Y293 HydrophobicContact CG2-CD1 3.6Å; V281-Y293 HydrophobicContact CG2-CE1 3.73Å; V281-Y293 HydrophobicContact CG2-CG 4.42Å
282	V	88.9	Confident	80.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.5	179.3	-175.6	0	0	0	0	110.9	Y191 S192 I193 I211 I213 I259 I262 V280 T291 Y292 F294	Y191-V282 HydrophobicContact CD1-CG1 4.21Å; S192-V282 CarbonylContact O-C 3.54Å; S192-V282 WeakPolarHBondContact O-CA 3.27Å; I193-V282 HydrophobicContact CG1-CG1 4.09Å; I193-V282 HydrophobicContact CG1-CG2 4.1Å; I193-V282 HydrophobicContact CG2-CG2 4.39Å; I211-V282 HydrophobicContact CD1-CG2 3.99Å; I213-V282 HydrophobicContact CD1-CG1 3.75Å; I213-V282 HydrophobicContact CG1-CG1 4.23Å; I213-V282 HydrophobicContact CG2-CG1 4.37Å; I259-V282 HydrophobicContact CD1-CB 4.38Å; I259-V282 HydrophobicContact CD1-CG1 3.81Å; I262-V282 HydrophobicContact CG2-CG2 4.08Å; V280-V282 HydrophobicContact CG1-CG2 4.16Å; V282-T291 CarbonylContact O-C 3.53Å; V282-T291 WeakPolarHBondContact O-CA 3.5Å; V282-Y292 PolarHBondContact N-O 3.29Å; V282-Y292 PolarHBondContact O-N 3.2Å; V282-F294 HydrophobicContact CB-CE2 3.96Å; V282-F294 HydrophobicContact CG2-CD2 4.34Å; V282-F294 HydrophobicContact CG2-CE2 3.84Å
283	T	86.1	Confident	81	Confident	24 Å²	24	39.8 Å²	39.8	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	129.1	-178.3	-53.8	0	0	0	0	111	Y191 S192 M285 W290 T291	Y191-T283 CarbonylContact C-O 3.41Å; Y191-T283 VanDerWaalsContact CA-O 3.31Å; Y191-T283 WeakPolarHBondContact CA-O 3.24Å; S192-T283 PolarHBondContact N-O 3Å; S192-T283 PolarHBondContact O-N 3.18Å; T283-M285 PolarHBondContact O-N 2.95Å; T283-W290 WeakPolarHBondContact CA-O 3.38Å; T283-T291 WeakPolarHBondContact CB-OG1 3.25Å; T283-T291 WeakPolarHBondContact CG2-OG1 3.36Å; T283-T291 WeakPolarHBondContact OG1-CG2 3.49Å; T283-T291 PolarHBondContact OG1-OG1 2.74Å
284	D	85.1	Confident	81.3	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	117.2	163.7	-168.6	-26	0	0	0	109.8	T189 Y191 N255 S286 Y287 W290	T189-D284 WeakPolarHBondContact CB-OD1 3.38Å; T189-D284 WeakPolarHBondContact CG2-OD1 3.32Å; T189-D284 PolarHBondContact OG1-OD1 3.03Å; Y191-D284 HydrophobicContact CD1-CB 4.14Å; Y191-D284 HydrophobicContact CE1-CB 3.62Å; Y191-D284 PolarHBondContact OH-OD2 2.64Å; N255-D284 PolarHBondContact ND2-OD2 2.98Å; D284-S286 PolarHBondContact O-N 3.33Å; D284-S286 WeakPolarHBondContact OD1-CB 3.11Å; D284-S286 PolarHBondContact OD1-N 3.21Å; D284-Y287 CarbonylContact O-C 3.53Å; D284-Y287 PolarHBondContact O-N 2.7Å; D284-Y287 VanDerWaalsContact O-N 3.07Å; D284-W290 HydrophobicContact CB-CB 4.21Å; D284-W290 HydrophobicContact CB-CE3 4.38Å; D284-W290 PolarHBondContact N-O 2.92Å
285	M	81.7	Confident	81.1	Confident	82 Å²	82	41.9 Å²	41.9	40%	0.404	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.3	-178.8	-61	-172.2	69.2	0	0	113.6	K190 I250 T283 Y287	K190-M285 HydrophobicContact CB-CB 3.95Å; K190-M285 HydrophobicContact CB-CG 3.99Å; K190-M285 HydrophobicContact CB-SD 3.59Å; K190-M285 VanDerWaalsContact CB-SD 3.59Å; K190-M285 HydrophobicContact CD-SD 3.86Å; K190-M285 HydrophobicContact CG-SD 4.41Å; K190-M285 WeakPolarHBondContact O-CB 3.15Å; K190-M285 PolarHBondContact O-N 2.86Å; I250-M285 HydrophobicContact CG2-SD 3.81Å; T283-M285 PolarHBondContact O-N 2.95Å; M285-Y287 VanDerWaalsContact C-N 3.29Å
286	S	77.3	Confident	80.6	Confident	67 Å²	67	43.1 Å²	43.1	47%	0.469	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18	169.8	-63.9	0	0	0	0	112.4	T189 D284	T189-S286 WeakPolarHBondContact OG1-CB 3.44Å; T189-S286 PolarHBondContact OG1-N 2.91Å; T189-S286 PolarHBondContact OG1-OG 2.98Å; D284-S286 PolarHBondContact O-N 3.33Å; D284-S286 WeakPolarHBondContact OD1-CB 3.11Å; D284-S286 PolarHBondContact OD1-N 3.21Å
287	Y	74.4	Confident	80.5	Confident	104 Å²	104	45.7 Å²	45.7	41%	0.408	23%	0.231	S	C	.	.	S	Bend	trans	-142.1	74.6	178.3	-58.5	-71.4	0	0	0	109.3	D284 M285 Q289 W290	D284-Y287 CarbonylContact O-C 3.53Å; D284-Y287 PolarHBondContact O-N 2.7Å; D284-Y287 VanDerWaalsContact O-N 3.07Å; M285-Y287 VanDerWaalsContact C-N 3.29Å; Y287-Q289 VanDerWaalsContact C-OE1 3.25Å; Y287-Q289 PolarHBondContact O-N 3.2Å; Y287-W290 HydrophobicContact CD2-CD2 4.22Å; Y287-W290 AromaticContact CD2-CE3 3.64Å; Y287-W290 HydrophobicContact CD2-CE3 3.64Å; Y287-W290 HydrophobicContact CD2-CH2 4.06Å; Y287-W290 AromaticContact CD2-CZ3 3.53Å; Y287-W290 HydrophobicContact CD2-CZ3 3.53Å; Y287-W290 HydrophobicContact CE2-CE3 4.49Å; Y287-W290 HydrophobicContact CE2-CH2 4.21Å; Y287-W290 AromaticContact CE2-CZ3 3.93Å; Y287-W290 HydrophobicContact CE2-CZ3 3.93Å; Y287-W290 HydrophobicContact CG-CD2 4.19Å; Y287-W290 HydrophobicContact CG-CE3 4.07Å; Y287-W290 HydrophobicContact CG-CZ3 4.24Å; Y287-W290 WeakPolarHBondContact O-CA 3.47Å; Y287-W290 WeakPolarHBondContact O-CB 3.39Å; Y287-W290 PolarHBondContact O-N 3.24Å
288	P	71.5	Confident	80.4	Confident	80 Å²	80	46.9 Å²	46.9	52%	0.519	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-28.3	-172.3	-29.6	37.1	0	0	0	115.4	W290 T291	P288-W290 PolarHBondContact O-N 3.35Å; P288-W290 VanDerWaalsContact O-N 3.14Å; P288-T291 PolarHBondContact O-OG1 3.29Å
289	Q	63.5	Low	80.5	Confident	117 Å²	117	45 Å²	45	55%	0.547	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-8.2	169.9	67	-83.2	15.4	0	0	115.1	Y287 T291 R317	Y287-Q289 VanDerWaalsContact C-OE1 3.25Å; Y287-Q289 PolarHBondContact O-N 3.2Å; Q289-T291 VanDerWaalsContact C-N 3.31Å; Q289-T291 PolarHBondContact O-N 3.35Å; Q289-R317 PolarHBondContact O-NE 2.85Å; Q289-R317 VanDerWaalsContact O-NE 3.08Å; Q289-R317 PolarHBondContact O-NH2 2.74Å
290	W	71.5	Confident	80.6	Confident	58 Å²	58	41.3 Å²	41.3	22%	0.22	22%	0.215	C	C	.	.			trans	-97.1	55.5	171.8	-73.6	7.2	0	0	0	109.6	T283 D284 Y287 P288 Y292	T283-W290 WeakPolarHBondContact CA-O 3.38Å; D284-W290 HydrophobicContact CB-CB 4.21Å; D284-W290 HydrophobicContact CB-CE3 4.38Å; D284-W290 PolarHBondContact N-O 2.92Å; Y287-W290 HydrophobicContact CD2-CD2 4.22Å; Y287-W290 AromaticContact CD2-CE3 3.64Å; Y287-W290 HydrophobicContact CD2-CE3 3.64Å; Y287-W290 HydrophobicContact CD2-CH2 4.06Å; Y287-W290 AromaticContact CD2-CZ3 3.53Å; Y287-W290 HydrophobicContact CD2-CZ3 3.53Å; Y287-W290 HydrophobicContact CE2-CE3 4.49Å; Y287-W290 HydrophobicContact CE2-CH2 4.21Å; Y287-W290 AromaticContact CE2-CZ3 3.93Å; Y287-W290 HydrophobicContact CE2-CZ3 3.93Å; Y287-W290 HydrophobicContact CG-CD2 4.19Å; Y287-W290 HydrophobicContact CG-CE3 4.07Å; Y287-W290 HydrophobicContact CG-CZ3 4.24Å; Y287-W290 WeakPolarHBondContact O-CA 3.47Å; Y287-W290 WeakPolarHBondContact O-CB 3.39Å; Y287-W290 PolarHBondContact O-N 3.24Å; P288-W290 PolarHBondContact O-N 3.35Å; P288-W290 VanDerWaalsContact O-N 3.14Å; W290-Y292 VanDerWaalsContact C-CE2 3.47Å; W290-Y292 HydrophobicContact CB-CE2 3.78Å; W290-Y292 HydrophobicContact CG-CE2 4.46Å; W290-Y292 VanDerWaalsContact O-CD2 3.32Å; W290-Y292 WeakPolarHBondContact O-CD2 3.29Å; W290-Y292 VanDerWaalsContact O-CE2 3.3Å; W290-Y292 WeakPolarHBondContact O-CE2 3.45Å
291	T	79.8	Confident	80.3	Confident	30 Å²	30	41.3 Å²	41.3	18%	0.184	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	130.8	168.1	-62.1	0	0	0	0	109.6	V281 V282 T283 P288 Q289 Y293 R317	V281-T291 HydrophobicContact CG1-CG2 3.46Å; V281-T291 VanDerWaalsContact CG1-CG2 3.46Å; V282-T291 CarbonylContact O-C 3.53Å; V282-T291 WeakPolarHBondContact O-CA 3.5Å; T283-T291 WeakPolarHBondContact CB-OG1 3.25Å; T283-T291 WeakPolarHBondContact CG2-OG1 3.36Å; T283-T291 WeakPolarHBondContact OG1-CG2 3.49Å; T283-T291 PolarHBondContact OG1-OG1 2.74Å; P288-T291 PolarHBondContact O-OG1 3.29Å; Q289-T291 VanDerWaalsContact C-N 3.31Å; Q289-T291 PolarHBondContact O-N 3.35Å; T291-Y293 HydrophobicContact CG2-CD2 4.3Å; T291-Y293 HydrophobicContact CG2-CE2 3.58Å; T291-R317 WeakPolarHBondContact O-CG 3.24Å
292	Y	81.3	Confident	79.9	Confident	8 Å²	8	43 Å²	43	3%	0.031	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141	-176.5	-60.8	-102.4	0	0	0	109.6	A258 I259 V281 V282 W290 F294 R317	A258-Y292 VanDerWaalsContact CA-OH 3.25Å; A258-Y292 WeakPolarHBondContact CA-OH 3.39Å; A258-Y292 WeakPolarHBondContact CB-OH 3.5Å; I259-Y292 HydrophobicContact CB-CD1 4.09Å; I259-Y292 HydrophobicContact CB-CD2 3.59Å; I259-Y292 HydrophobicContact CB-CE1 4.14Å; I259-Y292 HydrophobicContact CB-CE2 3.64Å; I259-Y292 HydrophobicContact CB-CG 3.84Å; I259-Y292 HydrophobicContact CD1-CD2 3.59Å; I259-Y292 HydrophobicContact CD1-CE2 3.86Å; I259-Y292 HydrophobicContact CD1-CG 4.46Å; I259-Y292 HydrophobicContact CG1-CD2 3.95Å; I259-Y292 HydrophobicContact CG1-CE2 3.88Å; I259-Y292 HydrophobicContact CG2-CD2 4.41Å; I259-Y292 HydrophobicContact CG2-CG 4.33Å; I259-Y292 VanDerWaalsContact N-CZ 3.33Å; I259-Y292 PolarHBondContact N-OH 3.43Å; I259-Y292 WeakPolarHBondContact O-CD1 3.18Å; I259-Y292 WeakPolarHBondContact O-CE1 3.46Å; V281-Y292 CarbonylContact C-O 3.51Å; V281-Y292 WeakPolarHBondContact CA-O 3.4Å; V282-Y292 PolarHBondContact N-O 3.29Å; V282-Y292 PolarHBondContact O-N 3.2Å; W290-Y292 VanDerWaalsContact C-CE2 3.47Å; W290-Y292 HydrophobicContact CB-CE2 3.78Å; W290-Y292 HydrophobicContact CG-CE2 4.46Å; W290-Y292 VanDerWaalsContact O-CD2 3.32Å; W290-Y292 WeakPolarHBondContact O-CD2 3.29Å; W290-Y292 VanDerWaalsContact O-CE2 3.3Å; W290-Y292 WeakPolarHBondContact O-CE2 3.45Å; Y292-F294 WeakPolarHBondContact O-CE2 3.44Å; Y292-R317 HydrophobicContact CD1-CB 3.56Å; Y292-R317 HydrophobicContact CD1-CG 3.89Å; Y292-R317 HydrophobicContact CE1-CB 3.47Å; Y292-R317 VanDerWaalsContact CE1-CB 3.47Å; Y292-R317 HydrophobicContact CE1-CG 3.61Å; Y292-R317 HydrophobicContact CE2-CG 4.49Å; Y292-R317 HydrophobicContact CG-CB 4.43Å; Y292-R317 HydrophobicContact CG-CG 4.41Å
293	Y	80.6	Confident	79.1	Confident	36 Å²	36	50.6 Å²	50.6	14%	0.141	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.2	-175.8	-65.6	-106.2	0	0	0	109	V281 T291 Y316 E318	V281-Y293 HydrophobicContact CB-CD1 4.43Å; V281-Y293 HydrophobicContact CB-CE1 4.48Å; V281-Y293 HydrophobicContact CG1-CD1 4.08Å; V281-Y293 HydrophobicContact CG1-CD2 4.5Å; V281-Y293 HydrophobicContact CG1-CE1 3.87Å; V281-Y293 HydrophobicContact CG1-CE2 4.3Å; V281-Y293 HydrophobicContact CG1-CG 4.38Å; V281-Y293 HydrophobicContact CG2-CD1 3.6Å; V281-Y293 HydrophobicContact CG2-CE1 3.73Å; V281-Y293 HydrophobicContact CG2-CG 4.42Å; T291-Y293 HydrophobicContact CG2-CD2 4.3Å; T291-Y293 HydrophobicContact CG2-CE2 3.58Å; Y293-Y316 WeakPolarHBondContact CB-OH 3.12Å; Y293-Y316 HydrophobicContact CG-CE2 4.4Å; Y293-Y316 PolarHBondContact N-O 2.85Å; Y293-Y316 WeakPolarHBondContact O-CD1 3.46Å; Y293-Y316 WeakPolarHBondContact O-CE1 3.43Å; Y293-Y316 PolarHBondContact O-N 2.97Å; Y293-E318 HydrophobicContact CD2-CB 3.97Å; Y293-E318 VanDerWaalsContact CD2-CD 3.45Å; Y293-E318 HydrophobicContact CD2-CG 3.47Å; Y293-E318 VanDerWaalsContact CD2-CG 3.47Å; Y293-E318 HydrophobicContact CE2-CB 3.88Å; Y293-E318 HydrophobicContact CE2-CG 3.69Å; Y293-E318 WeakPolarHBondContact CE2-OE2 3.35Å; Y293-E318 HydrophobicContact CG-CG 4.1Å; Y293-E318 VanDerWaalsContact CZ-OE2 3.27Å
294	F	83.2	Confident	78.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	93.3	-172.4	-56.6	-95.3	0	0	0	106.6	I259 I262 R279 V280 V282 Y292 L296 V313	I259-F294 HydrophobicContact CG2-CZ 3.85Å; I262-F294 HydrophobicContact CB-CD1 4.35Å; I262-F294 HydrophobicContact CB-CE1 4.1Å; I262-F294 HydrophobicContact CB-CZ 4.45Å; I262-F294 HydrophobicContact CD1-CB 3.9Å; I262-F294 HydrophobicContact CD1-CD1 3.85Å; I262-F294 HydrophobicContact CD1-CD2 3.87Å; I262-F294 HydrophobicContact CD1-CE1 4.32Å; I262-F294 HydrophobicContact CD1-CE2 4.38Å; I262-F294 HydrophobicContact CD1-CG 3.6Å; I262-F294 HydrophobicContact CG1-CB 4.4Å; I262-F294 HydrophobicContact CG1-CD1 3.55Å; I262-F294 HydrophobicContact CG1-CD2 4.4Å; I262-F294 HydrophobicContact CG1-CE1 3.82Å; I262-F294 HydrophobicContact CG1-CG 3.87Å; I262-F294 HydrophobicContact CG1-CZ 4.4Å; I262-F294 HydrophobicContact CG2-CD1 4.29Å; I262-F294 HydrophobicContact CG2-CE1 3.7Å; I262-F294 HydrophobicContact CG2-CE2 4.01Å; I262-F294 HydrophobicContact CG2-CZ 3.57Å; R279-F294 CarbonylContact C-O 3.08Å; R279-F294 WeakPolarHBondContact CA-O 3.32Å; R279-F294 WeakPolarHBondContact CB-O 3.46Å; V280-F294 HydrophobicContact CB-CB 4.16Å; V280-F294 HydrophobicContact CB-CD2 4.46Å; V280-F294 PolarHBondContact N-O 3.04Å; V280-F294 WeakPolarHBondContact O-CD2 3.14Å; V280-F294 PolarHBondContact O-N 2.91Å; V282-F294 HydrophobicContact CB-CE2 3.96Å; V282-F294 HydrophobicContact CG2-CD2 4.34Å; V282-F294 HydrophobicContact CG2-CE2 3.84Å; Y292-F294 WeakPolarHBondContact O-CE2 3.44Å; F294-L296 WeakPolarHBondContact O-CD1 3.48Å; F294-V313 HydrophobicContact CB-CB 4.32Å; F294-V313 HydrophobicContact CB-CG1 3.83Å; F294-V313 HydrophobicContact CD1-CB 4.22Å; F294-V313 HydrophobicContact CD1-CG1 4.21Å
295	H	76.2	Confident	77.7	Confident	89 Å²	89	58 Å²	58	41%	0.412	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	143.5	172.1	-89.7	-68.8	0	0	0	110.5	E278 V313 Y316	E278-H295 PolarHBondContact O-ND1 2.81Å; H295-V313 WeakPolarHBondContact O-CG1 3.39Å; H295-Y316 AromaticContact CD2-CE1 3.88Å; H295-Y316 AromaticContact CD2-CZ 3.9Å; H295-Y316 PolarHBondContact CD2-OH 2.88Å; H295-Y316 PolarHBondContact NE2-OH 2.81Å
296	L	79.2	Confident	77.1	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.131	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	-47.2	175.3	-75.9	102.8	0	0	0	110.8	I264 L277 E278 V280 F294 C298 L300 R311 V313	I264-L296 HydrophobicContact CG2-CD2 4.27Å; L277-L296 HydrophobicContact CD2-CD1 3.8Å; L277-L296 HydrophobicContact CD2-CD2 3.99Å; L277-L296 HydrophobicContact CD2-CG 4.42Å; L277-L296 HydrophobicContact CG-CD1 4.01Å; L277-L296 HydrophobicContact CG-CD2 4.46Å; L277-L296 VanDerWaalsContact O-CB 3.27Å; L277-L296 WeakPolarHBondContact O-CB 3.41Å; E278-L296 PolarHBondContact O-N 2.83Å; V280-L296 HydrophobicContact CG2-CD1 4Å; F294-L296 WeakPolarHBondContact O-CD1 3.48Å; L296-C298 WeakPolarHBondContact O-CB 3.25Å; L296-C298 PolarHBondContact O-N 2.85Å; L296-C298 VanDerWaalsContact O-N 3.1Å; L296-L300 HydrophobicContact CD2-CD1 4.33Å; L296-R311 HydrophobicContact CD2-CB 3.76Å; L296-R311 HydrophobicContact CD2-CG 3.67Å; L296-V313 HydrophobicContact CD1-CG2 4.03Å; L296-V313 HydrophobicContact CD2-CG2 3.75Å; L296-V313 HydrophobicContact CG-CG2 3.78Å
297	S	84.6	Confident	77	Confident	72 Å²	72	56.4 Å²	56.4	50%	0.503	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.6	41.3	-178.9	-57.3	0	0	0	0	113.1	F276 L277 E278	F276-S297 VanDerWaalsContact CZ-O 3.3Å; F276-S297 WeakPolarHBondContact CZ-O 3.4Å; L277-S297 PolarHBondContact O-N 2.83Å; E278-S297 PolarHBondContact O-N 3.1Å
298	C	82	Confident	77	Confident	26 Å²	26	56.8 Å²	56.8	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	156.3	-169.4	73.8	0	0	0	0	112.6	L277 L296 L300 R311	L277-C298 PolarHBondContact N-O 3.1Å; L277-C298 PolarHBondContact O-N 2.91Å; L296-C298 WeakPolarHBondContact O-CB 3.25Å; L296-C298 PolarHBondContact O-N 2.85Å; L296-C298 VanDerWaalsContact O-N 3.1Å; C298-L300 PolarHBondContact O-N 3.37Å; C298-R311 PolarHBondContact SG-NE 3.18Å
299	W	84.8	Confident	77.5	Confident	33 Å²	33	54 Å²	54	13%	0.125	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	126.8	165.6	-60.5	92.7	0	0	0	110.6	Q200 E201 H274 W275 F276 Y304 R311	Q200-W299 HydrophobicContact CB-CZ2 4.45Å; E201-W299 WeakPolarHBondContact O-CH2 3.49Å; H274-W299 HydrophobicContact CB-CZ3 4.3Å; H274-W299 WeakPolarHBondContact O-CZ3 3.37Å; W275-W299 CarbonylContact O-C 3.51Å; F276-W299 HydrophobicContact CB-CD2 4.15Å; F276-W299 HydrophobicContact CB-CE3 4.02Å; F276-W299 HydrophobicContact CB-CH2 4.33Å; F276-W299 HydrophobicContact CB-CZ2 4.44Å; F276-W299 HydrophobicContact CB-CZ3 4.13Å; F276-W299 AromaticContact CD2-CD1 3.76Å; F276-W299 AromaticContact CD2-CD2 3.83Å; F276-W299 HydrophobicContact CD2-CD2 3.83Å; F276-W299 AromaticContact CD2-CE2 3.66Å; F276-W299 AromaticContact CD2-CG 3.89Å; F276-W299 HydrophobicContact CD2-CG 3.89Å; F276-W299 HydrophobicContact CD2-CZ2 4.22Å; F276-W299 AromaticContact CD2-NE1 3.6Å; W299-Y304 VanDerWaalsContact CB-O 3.26Å; W299-Y304 WeakPolarHBondContact CB-O 3.41Å; W299-Y304 VanDerWaalsContact CD2-CB 3.49Å; W299-Y304 HydrophobicContact CD2-CG 4.31Å; W299-Y304 HydrophobicContact CE3-CG 4.19Å; W299-Y304 HydrophobicContact CZ3-CG 4.36Å; W299-R311 PolarHBondContact O-NH2 2.96Å
300	L	85.3	Confident	78.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	59.5	163.3	-94.5	173.7	0	0	0	108.5	I264 Q266 W275 L277 L296 C298 K308 S309 R311	I264-L300 HydrophobicContact CG2-CD1 4.21Å; Q266-L300 PolarHBondContact NE2-O 3.47Å; W275-L300 HydrophobicContact CB-CB 4.29Å; W275-L300 HydrophobicContact CD2-CD1 4.45Å; W275-L300 HydrophobicContact CE3-CB 4.24Å; W275-L300 HydrophobicContact CE3-CD1 3.56Å; W275-L300 HydrophobicContact CZ3-CD1 3.75Å; W275-L300 PolarHBondContact O-N 2.91Å; L277-L300 HydrophobicContact CB-CD1 3.82Å; L277-L300 HydrophobicContact CB-CG 4.48Å; L277-L300 HydrophobicContact CD2-CD1 3.45Å; L277-L300 VanDerWaalsContact CD2-CD1 3.45Å; L277-L300 HydrophobicContact CG-CD1 4.28Å; L296-L300 HydrophobicContact CD2-CD1 4.33Å; C298-L300 PolarHBondContact O-N 3.37Å; L300-K308 CarbonylContact C-O 3.59Å; L300-K308 VanDerWaalsContact CA-O 3.29Å; L300-K308 WeakPolarHBondContact CA-O 3.49Å; L300-S309 VanDerWaalsContact CD2-C 3.48Å; L300-R311 HydrophobicContact CD2-CB 4.18Å; L300-R311 HydrophobicContact CD2-CG 3.4Å; L300-R311 VanDerWaalsContact CD2-CG 3.4Å; L300-R311 HydrophobicContact CG-CG 4.14Å
301	S	81.9	Confident	78.9	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-140.2	151.2	-172.9	-166.2	0	0	0	0	112.6	P273 H274 K303 G307 K308	P273-S301 WeakPolarHBondContact O-CB 3.39Å; P273-S301 PolarHBondContact O-OG 3.37Å; H274-S301 PolarHBondContact ND1-OG 2.83Å; S301-K303 PolarHBondContact OG-N 3Å; S301-G307 CarbonylContact O-C 3.51Å; S301-G307 WeakPolarHBondContact O-CA 3.39Å; S301-K308 PolarHBondContact N-O 2.83Å; S301-K308 PolarHBondContact O-N 2.8Å
302	S	78.7	Confident	79	Confident	53 Å²	53	53.5 Å²	53.5	37%	0.371	29%	0.294	S	S	.	.	S	Bend	trans	-76	-17.5	172.5	49.1	0	0	0	0	114	E268	E268-S302 WeakPolarHBondContact OE2-CB 3.31Å; E268-S302 PolarHBondContact OE2-OG 3.13Å
303	K	72.9	Confident	78.4	Confident	159 Å²	159	53.9 Å²	53.9	69%	0.691	30%	0.297	S	S	*	.	S	Bend	trans	-111	-21.2	-178.9	-58	-168.9	-167.7	167.9	0	115.8	S301	S301-K303 PolarHBondContact OG-N 3Å
304	Y	69.1	Low	77.8	Confident	114 Å²	114	62 Å²	62	45%	0.447	33%	0.328	S	S	.	.	S	Bend	trans	-120.8	150.7	-177.7	-70.7	-90.1	0	0	0	111.4	H274 W299	H274-Y304 HydrophobicContact CB-CD2 4.1Å; H274-Y304 HydrophobicContact CB-CE2 4.29Å; H274-Y304 AromaticContact CD2-CE2 3.77Å; H274-Y304 AromaticContact CG-CD2 3.68Å; H274-Y304 AromaticContact CG-CE2 3.68Å; H274-Y304 AromaticContact ND1-CD2 3.52Å; H274-Y304 AromaticContact ND1-CE2 3.82Å; H274-Y304 AromaticContact NE2-CE2 3.98Å; W299-Y304 VanDerWaalsContact CB-O 3.26Å; W299-Y304 WeakPolarHBondContact CB-O 3.41Å; W299-Y304 VanDerWaalsContact CD2-CB 3.49Å; W299-Y304 HydrophobicContact CD2-CG 4.31Å; W299-Y304 HydrophobicContact CE3-CG 4.19Å; W299-Y304 HydrophobicContact CZ3-CG 4.36Å
305	G	72	Confident	76.8	Confident	65 Å²	65	62.6 Å²	62.6	67%	0.67	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	-129.6	-176.5	0	0	0	0	0	112.8
306	D	70.1	Confident	75.8	Confident	75 Å²	75	62.7 Å²	62.7	40%	0.401	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	11	-176.9	82.4	-26.1	0	0	0	114.5	K308 R311	D306-K308 PolarHBondContact OD1-N 2.92Å; D306-K308 WeakPolarHBondContact OD2-CD 3.36Å; D306-K308 IonicContact OD2-NZ 2.65Å; D306-K308 PolarHBondContact OD2-NZ 2.81Å; D306-R311 VanDerWaalsContact CG-NH1 3.34Å; D306-R311 IonicContact OD1-CZ 3.16Å; D306-R311 IonicContact OD1-NH1 2.72Å; D306-R311 PolarHBondContact OD1-NH1 2.99Å; D306-R311 VanDerWaalsContact OD1-NH1 3.15Å; D306-R311 IonicContact OD1-NH2 3.29Å; D306-R311 PolarHBondContact OD1-NH2 2.84Å; D306-R311 IonicContact OD2-CZ 3.21Å; D306-R311 IonicContact OD2-NH1 3.67Å; D306-R311 PolarHBondContact OD2-NH1 2.84Å; D306-R311 IonicContact OD2-NH2 2.66Å
307	G	74.9	Confident	74.6	Confident	40 Å²	40	66.8 Å²	66.8	41%	0.412	35%	0.345	S	S	.	.	S	Bend	trans	77.9	17	174.7	0	0	0	0	0	116.2	S301	S301-G307 CarbonylContact O-C 3.51Å; S301-G307 WeakPolarHBondContact O-CA 3.39Å
308	K	73.2	Confident	72.7	Confident	112 Å²	112	64.1 Å²	64.1	49%	0.487	33%	0.325	S	S	.	.			trans	-114.5	118.2	-174.9	-55.7	-171.9	-170.9	101.4	0	113.9	L300 S301 D306	L300-K308 CarbonylContact C-O 3.59Å; L300-K308 VanDerWaalsContact CA-O 3.29Å; L300-K308 WeakPolarHBondContact CA-O 3.49Å; S301-K308 PolarHBondContact N-O 2.83Å; S301-K308 PolarHBondContact O-N 2.8Å; D306-K308 PolarHBondContact OD1-N 2.92Å; D306-K308 WeakPolarHBondContact OD2-CD 3.36Å; D306-K308 IonicContact OD2-NZ 2.65Å; D306-K308 PolarHBondContact OD2-NZ 2.81Å
309	S	82.8	Confident	70.6	Confident	21 Å²	21	68.9 Å²	68.9	15%	0.147	36%	0.355	C	S	.	.	S	Bend	trans	-88	5.7	175.8	52.5	0	0	0	0	115.6	Q266 E268 L300	Q266-S309 PolarHBondContact N-O 2.73Å; Q266-S309 VanDerWaalsContact N-O 3.13Å; E268-S309 WeakPolarHBondContact OE1-CB 3.4Å; E268-S309 PolarHBondContact OE1-OG 3.34Å; L300-S309 VanDerWaalsContact CD2-C 3.48Å
310	C	84.6	Confident	68.1	Low	48 Å²	48	72.5 Å²	72.5	32%	0.324	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.5	176.8	-178.8	0	0	0	0	111.4	K265	K265-C310 HydrophobicContact CB-CB 4.12Å; K265-C310 HydrophobicContact CD-CB 4.33Å; K265-C310 HydrophobicContact CG-CB 4.06Å
311	R	79.6	Confident	65.3	Low	44 Å²	44	75.4 Å²	75.4	17%	0.166	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.9	-179.7	-64.5	-93.2	-170	-123.4	-18.9	110.7	R263 I264 L296 C298 W299 L300 D306 V313	R263-R311 WeakPolarHBondContact CA-O 3.07Å; I264-R311 HydrophobicContact CG2-CB 4.43Å; I264-R311 PolarHBondContact N-O 3.2Å; I264-R311 PolarHBondContact O-N 3.27Å; L296-R311 HydrophobicContact CD2-CB 3.76Å; L296-R311 HydrophobicContact CD2-CG 3.67Å; C298-R311 PolarHBondContact SG-NE 3.18Å; W299-R311 PolarHBondContact O-NH2 2.96Å; L300-R311 HydrophobicContact CD2-CB 4.18Å; L300-R311 HydrophobicContact CD2-CG 3.4Å; L300-R311 VanDerWaalsContact CD2-CG 3.4Å; L300-R311 HydrophobicContact CG-CG 4.14Å; D306-R311 VanDerWaalsContact CG-NH1 3.34Å; D306-R311 IonicContact OD1-CZ 3.16Å; D306-R311 IonicContact OD1-NH1 2.72Å; D306-R311 PolarHBondContact OD1-NH1 2.99Å; D306-R311 VanDerWaalsContact OD1-NH1 3.15Å; D306-R311 IonicContact OD1-NH2 3.29Å; D306-R311 PolarHBondContact OD1-NH2 2.84Å; D306-R311 IonicContact OD2-CZ 3.21Å; D306-R311 IonicContact OD2-NH1 3.67Å; D306-R311 PolarHBondContact OD2-NH1 2.84Å; D306-R311 IonicContact OD2-NH2 2.66Å; R311-V313 HydrophobicContact CB-CG2 3.76Å
312	L	81.6	Confident	62.8	Low	103 Å²	103	79.3 Å²	79.3	54%	0.539	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.1	161.2	178.7	63.7	0	0	0	107.2	Y214 N261 I262 R263	Y214-L312 HydrophobicContact CE2-CD1 4.3Å; N261-L312 HydrophobicContact CB-CD1 4.12Å; I262-L312 CarbonylContact O-C 2.9Å; R263-L312 HydrophobicContact CB-CD1 4.37Å
313	V	70.1	Confident	60.5	Low	17 Å²	17	79 Å²	79	10%	0.103	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130	-173.9	-167.2	0	0	0	0	108.8	N261 I262 F294 H295 L296 R311	N261-V313 CarbonylContact C-O 2.9Å; N261-V313 VanDerWaalsContact CA-O 3.25Å; N261-V313 WeakPolarHBondContact CA-O 3.31Å; N261-V313 WeakPolarHBondContact CB-O 3.39Å; I262-V313 HydrophobicContact CG1-CB 4.25Å; I262-V313 PolarHBondContact N-O 3Å; I262-V313 PolarHBondContact O-N 2.83Å; F294-V313 HydrophobicContact CB-CB 4.32Å; F294-V313 HydrophobicContact CB-CG1 3.83Å; F294-V313 HydrophobicContact CD1-CB 4.22Å; F294-V313 HydrophobicContact CD1-CG1 4.21Å; H295-V313 WeakPolarHBondContact O-CG1 3.39Å; L296-V313 HydrophobicContact CD1-CG2 4.03Å; L296-V313 HydrophobicContact CD2-CG2 3.75Å; L296-V313 HydrophobicContact CG-CG2 3.78Å; R311-V313 HydrophobicContact CB-CG2 3.76Å
314	R	67.3	Low	59.1	Low	205 Å²	205	75.3 Å²	75.3	77%	0.774	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	130	173.1	-169	176.4	-176.3	169.6	0.9	109	T260	T260-R314 WeakPolarHBondContact O-CG 3.26Å
315	G	61.7	Low	58.4	Low	13 Å²	13	75.7 Å²	75.7	13%	0.134	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-80.7	128.3	176.6	0	0	0	0	0	110	T260	T260-G315 PolarHBondContact O-N 2.81Å
316	Y	56.1	Low	57.8	Low	92 Å²	92	72.7 Å²	72.7	36%	0.361	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.6	156.9	67.3	-83.2	0	0	0	107.4	Y293 H295 E318	Y293-Y316 WeakPolarHBondContact CB-OH 3.12Å; Y293-Y316 HydrophobicContact CG-CE2 4.4Å; Y293-Y316 PolarHBondContact N-O 2.85Å; Y293-Y316 WeakPolarHBondContact O-CD1 3.46Å; Y293-Y316 WeakPolarHBondContact O-CE1 3.43Å; Y293-Y316 PolarHBondContact O-N 2.97Å; H295-Y316 AromaticContact CD2-CE1 3.88Å; H295-Y316 AromaticContact CD2-CZ 3.9Å; H295-Y316 PolarHBondContact CD2-OH 2.88Å; H295-Y316 PolarHBondContact NE2-OH 2.81Å; Y316-E318 HydrophobicContact CD2-CG 4.09Å; Y316-E318 HydrophobicContact CE2-CG 3.63Å; Y316-E318 PolarHBondContact O-N 3.44Å
317	R	52.9	Low	58.2	Low	110 Å²	110	73.8 Å²	73.8	42%	0.415	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	125.6	164.3	-160.4	179.8	167.6	-152.8	-13.3	106	Q289 T291 Y292 P319	Q289-R317 PolarHBondContact O-NE 2.85Å; Q289-R317 VanDerWaalsContact O-NE 3.08Å; Q289-R317 PolarHBondContact O-NH2 2.74Å; T291-R317 WeakPolarHBondContact O-CG 3.24Å; Y292-R317 HydrophobicContact CD1-CB 3.56Å; Y292-R317 HydrophobicContact CD1-CG 3.89Å; Y292-R317 HydrophobicContact CE1-CB 3.47Å; Y292-R317 VanDerWaalsContact CE1-CB 3.47Å; Y292-R317 HydrophobicContact CE1-CG 3.61Å; Y292-R317 HydrophobicContact CE2-CG 4.49Å; Y292-R317 HydrophobicContact CG-CB 4.43Å; Y292-R317 HydrophobicContact CG-CG 4.41Å; R317-P319 WeakPolarHBondContact O-CD 3.46Å
318	E	45.1	Very low	58.7	Low	16 Å²	16	71.9 Å²	71.9	8%	0.075	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-66.2	125.7	164.5	-77.1	-177.6	178.6	0	0	107.5	Y293 Y316 T320 G321 T322 G323	Y293-E318 HydrophobicContact CD2-CB 3.97Å; Y293-E318 VanDerWaalsContact CD2-CD 3.45Å; Y293-E318 HydrophobicContact CD2-CG 3.47Å; Y293-E318 VanDerWaalsContact CD2-CG 3.47Å; Y293-E318 HydrophobicContact CE2-CB 3.88Å; Y293-E318 HydrophobicContact CE2-CG 3.69Å; Y293-E318 WeakPolarHBondContact CE2-OE2 3.35Å; Y293-E318 HydrophobicContact CG-CG 4.1Å; Y293-E318 VanDerWaalsContact CZ-OE2 3.27Å; Y316-E318 HydrophobicContact CD2-CG 4.09Å; Y316-E318 HydrophobicContact CE2-CG 3.63Å; Y316-E318 PolarHBondContact O-N 3.44Å; E318-T320 PolarHBondContact O-N 3.02Å; E318-G321 WeakPolarHBondContact OE2-CA 3.13Å; E318-T322 WeakPolarHBondContact OE2-CA 3.26Å; E318-T322 PolarHBondContact OE2-N 3.13Å; E318-G323 VanDerWaalsContact OE1-CA 3.25Å; E318-G323 WeakPolarHBondContact OE1-CA 3.39Å; E318-G323 PolarHBondContact OE1-N 3.1Å; E318-G323 PolarHBondContact OE2-N 3.38Å
319	P	37.1	Very low	59.5	Low	126 Å²	126	68 Å²	68	82%	0.818	37%	0.372	S	S	*	.	S	Bend	trans	-59.9	-30.9	176.9	-23.9	34.8	0	0	0	111.8	R317	R317-P319 WeakPolarHBondContact O-CD 3.46Å
320	T	32.1	Very low	59.9	Low	109 Å²	109	67.1 Å²	67.1	67%	0.669	37%	0.365	S	S	*	.	S	Bend	trans	-141.9	124.4	177.4	50.3	0	0	0	0	107.1	E318 T322	E318-T320 PolarHBondContact O-N 3.02Å; T320-T322 PolarHBondContact O-N 3.15Å
321	G	26.9	Very low	60.2	Low	61 Å²	61	65 Å²	65	63%	0.629	35%	0.35	S	S	*	.	S	Bend	trans	-69.9	99.9	-170.8	0	0	0	0	0	113.8	E318	E318-G321 WeakPolarHBondContact OE2-CA 3.13Å
322	T	30.9	Very low	60.8	Low	83 Å²	83	62.9 Å²	62.9	51%	0.509	34%	0.343	S	S	.	.			trans	-169.6	119.3	161.7	44	0	0	0	0	107.8	E318 T320 V324	E318-T322 WeakPolarHBondContact OE2-CA 3.26Å; E318-T322 PolarHBondContact OE2-N 3.13Å; T320-T322 PolarHBondContact O-N 3.15Å; T322-V324 PolarHBondContact O-N 3.17Å
323	G	30.2	Very low	61.2	Low	46 Å²	46	61.5 Å²	61.5	47%	0.474	33%	0.331	S	S	.	.			trans	-70.8	110.1	168.7	0	0	0	0	0	109.5	E318	E318-G323 VanDerWaalsContact OE1-CA 3.25Å; E318-G323 WeakPolarHBondContact OE1-CA 3.39Å; E318-G323 PolarHBondContact OE1-N 3.1Å; E318-G323 PolarHBondContact OE2-N 3.38Å
324	V	43.2	Very low	62	Low	81 Å²	81	61 Å²	61	49%	0.491	33%	0.328	S	S	.	.			trans	-132.6	144	-172.1	176.3	0	0	0	0	109.7	T322 R424	T322-V324 PolarHBondContact O-N 3.17Å; V324-R424 PolarHBondContact O-NE 2.88Å; V324-R424 PolarHBondContact O-NH1 3.25Å; V324-R424 VanDerWaalsContact O-NH1 3.12Å; V324-R424 PolarHBondContact O-NH2 2.96Å
325	E	53.3	Low	62.9	Low	123 Å²	123	51.6 Å²	51.6	58%	0.575	29%	0.294	S	S	*	.			trans	-62.7	170.8	178.6	-63.1	162.9	132.6	0	0	112.2	P390 R424	E325-P390 HydrophobicContact CB-CB 3.46Å; E325-P390 VanDerWaalsContact CB-CB 3.46Å; E325-P390 HydrophobicContact CG-CB 4.26Å; E325-P390 WeakPolarHBondContact OE2-CB 3.49Å; E325-R424 PolarHBondContact O-NH1 2.83Å
326	T	61.1	Low	64	Low	1 Å²	1	56.3 Å²	56.3	1%	0.006	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-107.5	123.8	173.8	-58.9	0	0	0	0	110.2	Y328 P390 C391 Q393 D422 R424	T326-Y328 HydrophobicContact CG2-CD2 3.97Å; T326-Y328 HydrophobicContact CG2-CE1 4.15Å; T326-Y328 HydrophobicContact CG2-CE2 3.46Å; T326-Y328 VanDerWaalsContact CG2-CE2 3.46Å; T326-Y328 HydrophobicContact CG2-CG 4.49Å; T326-P390 WeakPolarHBondContact O-CA 3.41Å; T326-C391 PolarHBondContact N-O 3.48Å; T326-C391 PolarHBondContact O-N 3.27Å; T326-Q393 WeakPolarHBondContact OG1-CB 3.26Å; T326-Q393 PolarHBondContact OG1-NE2 3.27Å; T326-D422 VanDerWaalsContact CG2-OD1 3.3Å; T326-D422 WeakPolarHBondContact CG2-OD1 3.23Å; T326-R424 HydrophobicContact CG2-CB 3.79Å; T326-R424 WeakPolarHBondContact OG1-CD 3.28Å
327	E	76.5	Confident	65	Low	98 Å²	98	56.9 Å²	56.9	46%	0.458	32%	0.321	S	S	.	.			trans	-85.1	136.5	164.1	-68.9	-178	153.9	0	0	109.9	P390 L423	E327-P390 HydrophobicContact CG-CB 4.27Å; E327-P390 HydrophobicContact CG-CG 3.85Å; E327-L423 HydrophobicContact CB-CD1 3.86Å; E327-L423 VanDerWaalsContact O-CB 3.31Å; E327-L423 WeakPolarHBondContact O-CB 3.19Å; E327-L423 WeakPolarHBondContact O-CG 3.36Å; E327-L423 PolarHBondContact O-N 3.07Å
328	Y	86.9	Confident	66	Low	0 Å²	0	59 Å²	59	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.6	174.8	-70.3	-88.1	0	0	0	109.1	T326 L350 L388 C391 Q393 L394 I397 V420 D421 D422	T326-Y328 HydrophobicContact CG2-CD2 3.97Å; T326-Y328 HydrophobicContact CG2-CE1 4.15Å; T326-Y328 HydrophobicContact CG2-CE2 3.46Å; T326-Y328 VanDerWaalsContact CG2-CE2 3.46Å; T326-Y328 HydrophobicContact CG2-CG 4.49Å; Y328-L350 HydrophobicContact CD1-CD1 3.96Å; Y328-L350 HydrophobicContact CD2-CD1 4.39Å; Y328-L350 HydrophobicContact CG-CD1 3.88Å; Y328-L388 PolarHBondContact O-N 2.78Å; Y328-C391 VanDerWaalsContact CE2-SG 3.56Å; Y328-Q393 PolarHBondContact OH-NE2 3.03Å; Y328-L394 HydrophobicContact CE2-CD1 4.11Å; Y328-L394 HydrophobicContact CE2-CG 4.08Å; Y328-L394 PolarHBondContact OH-N 2.8Å; Y328-I397 HydrophobicContact CE1-CD1 4.17Å; Y328-I397 HydrophobicContact CE1-CG1 4.49Å; Y328-V420 HydrophobicContact CD1-CG1 4.22Å; Y328-D421 WeakPolarHBondContact CA-O 3.3Å; Y328-D422 HydrophobicContact CD1-CB 3.99Å; Y328-D422 HydrophobicContact CE1-CB 3.63Å; Y328-D422 VanDerWaalsContact CE1-CG 3.46Å; Y328-D422 WeakPolarHBondContact CE1-OD2 3.41Å; Y328-D422 VanDerWaalsContact CZ-OD2 3.27Å; Y328-D422 PolarHBondContact OH-OD2 2.97Å
329	K	89.9	Confident	67.6	Low	32 Å²	32	62.9 Å²	62.9	14%	0.139	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	135.8	170.9	152.9	177.7	161.8	161.2	0	108.9	T331 E385 V386 Y387 V420 D421 L423	K329-T331 VanDerWaalsContact CE-OG1 3.24Å; K329-T331 WeakPolarHBondContact CE-OG1 3.11Å; K329-E385 VanDerWaalsContact CE-CD 3.47Å; K329-E385 WeakPolarHBondContact CE-OE1 3.21Å; K329-E385 WeakPolarHBondContact CE-OE2 3.48Å; K329-E385 IonicContact NZ-OE1 2.67Å; K329-E385 PolarHBondContact NZ-OE1 3.21Å; K329-E385 IonicContact NZ-OE2 3.51Å; K329-E385 PolarHBondContact NZ-OE2 2.88Å; K329-V386 CarbonylContact C-O 3.42Å; K329-V386 WeakPolarHBondContact CA-O 3.3Å; K329-Y387 HydrophobicContact CB-CD1 4.08Å; K329-Y387 HydrophobicContact CB-CE1 4Å; K329-Y387 HydrophobicContact CD-CE1 4.23Å; K329-Y387 HydrophobicContact CD-CE2 4.49Å; K329-V420 CarbonylContact O-C 3.53Å; K329-V420 WeakPolarHBondContact O-CA 3.34Å; K329-D421 HydrophobicContact CB-CB 3.94Å; K329-D421 HydrophobicContact CD-CB 4.39Å; K329-D421 WeakPolarHBondContact CE-OD2 3.26Å; K329-D421 HydrophobicContact CG-CB 4.09Å; K329-D421 PolarHBondContact N-O 2.91Å; K329-D421 PolarHBondContact O-N 3.39Å; K329-L423 HydrophobicContact CB-CD1 4.24Å; K329-L423 HydrophobicContact CB-CD2 4.01Å; K329-L423 HydrophobicContact CB-CG 4.26Å
330	L	91.2	Very high	69.7	Low	1 Å²	1	56.9 Å²	56.9	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.7	171.1	-72.7	88	0	0	0	109.7	F332 V348 L350 E385 V386 L388 L400 V418 I419 V420	L330-F332 HydrophobicContact CB-CD2 4.38Å; L330-F332 HydrophobicContact CB-CE2 3.72Å; L330-F332 HydrophobicContact CB-CZ 4.22Å; L330-F332 HydrophobicContact CD2-CE2 4.35Å; L330-F332 HydrophobicContact CD2-CZ 4.01Å; L330-V348 HydrophobicContact CD2-CB 4.36Å; L330-V348 HydrophobicContact CD2-CG1 3.79Å; L330-V348 HydrophobicContact CD2-CG2 3.83Å; L330-L350 HydrophobicContact CD2-CD2 4.48Å; L330-E385 CarbonylContact O-C 3.1Å; L330-E385 WeakPolarHBondContact O-CA 3.5Å; L330-V386 PolarHBondContact N-O 2.85Å; L330-V386 PolarHBondContact O-N 2.85Å; L330-L388 HydrophobicContact CD1-CD1 3.61Å; L330-L388 HydrophobicContact CD1-CD2 4.03Å; L330-L388 HydrophobicContact CD1-CG 3.53Å; L330-L400 HydrophobicContact CD2-CD1 4.07Å; L330-V418 HydrophobicContact CB-CG1 4.5Å; L330-V418 HydrophobicContact CD2-CG1 4.12Å; L330-I419 CarbonylContact C-O 3.03Å; L330-I419 VanDerWaalsContact CA-O 3.26Å; L330-I419 WeakPolarHBondContact CA-O 3.27Å; L330-V420 HydrophobicContact CD2-CG2 4.03Å; L330-V420 HydrophobicContact CG-CG1 4.35Å; L330-V420 HydrophobicContact CG-CG2 4.03Å
331	T	90.4	Very high	72	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.018	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.3	171.2	-53.7	0	0	0	0	109	K329 Y333 T383 V384 E385 V418 I419	K329-T331 VanDerWaalsContact CE-OG1 3.24Å; K329-T331 WeakPolarHBondContact CE-OG1 3.11Å; T331-Y333 HydrophobicContact CG2-CD2 4.28Å; T331-Y333 HydrophobicContact CG2-CE2 3.55Å; T331-T383 HydrophobicContact CG2-CG2 3.43Å; T331-T383 VanDerWaalsContact CG2-CG2 3.43Å; T331-V384 CarbonylContact C-O 3.41Å; T331-V384 WeakPolarHBondContact CA-O 3.45Å; T331-E385 HydrophobicContact CG2-CG 4.13Å; T331-E385 PolarHBondContact OG1-OE1 3.07Å; T331-V418 WeakPolarHBondContact O-CA 3.48Å; T331-I419 PolarHBondContact N-O 3.28Å; T331-I419 PolarHBondContact O-N 2.85Å
332	F	91.6	Very high	74.8	Confident	1 Å²	1	49.8 Å²	49.8	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.8	178.7	-61.1	-99.9	0	0	0	110	L330 V348 F378 T383 V384 V386 V402 W413 L415 V418	L330-F332 HydrophobicContact CB-CD2 4.38Å; L330-F332 HydrophobicContact CB-CE2 3.72Å; L330-F332 HydrophobicContact CB-CZ 4.22Å; L330-F332 HydrophobicContact CD2-CE2 4.35Å; L330-F332 HydrophobicContact CD2-CZ 4.01Å; F332-V348 HydrophobicContact CE1-CG2 4.31Å; F332-V348 HydrophobicContact CZ-CG2 3.98Å; F332-F378 HydrophobicContact CB-CD1 4.3Å; F332-F378 HydrophobicContact CB-CE1 3.94Å; F332-F378 HydrophobicContact CD1-CE1 4.4Å; F332-F378 AromaticContact CD2-CE1 3.86Å; F332-F378 HydrophobicContact CD2-CE1 3.86Å; F332-F378 HydrophobicContact CD2-CZ 4.45Å; F332-F378 HydrophobicContact CE2-CE1 4.45Å; F332-F378 AromaticContact CG-CE1 3.83Å; F332-F378 HydrophobicContact CG-CE1 3.83Å; F332-T383 WeakPolarHBondContact O-CA 3.32Å; F332-V384 PolarHBondContact N-O 3.29Å; F332-V384 PolarHBondContact O-N 2.66Å; F332-V386 HydrophobicContact CD2-CG2 4.26Å; F332-V386 HydrophobicContact CE2-CB 4.26Å; F332-V386 HydrophobicContact CE2-CG2 3.88Å; F332-V402 HydrophobicContact CE1-CG1 4.24Å; F332-W413 HydrophobicContact CB-CZ2 4.35Å; F332-W413 AromaticContact CD1-CH2 3.6Å; F332-W413 HydrophobicContact CD1-CH2 3.6Å; F332-W413 AromaticContact CD1-CZ2 3.99Å; F332-W413 HydrophobicContact CD1-CZ2 3.99Å; F332-W413 AromaticContact CE1-CH2 3.97Å; F332-W413 HydrophobicContact CE1-CH2 3.97Å; F332-W413 HydrophobicContact CG-CH2 4.4Å; F332-W413 HydrophobicContact CG-CZ2 4.45Å; F332-L415 HydrophobicContact CB-CD1 4.24Å; F332-L415 HydrophobicContact CD1-CD1 4.29Å; F332-L415 HydrophobicContact CD1-CD2 4.47Å; F332-V418 HydrophobicContact CD1-CB 4.44Å; F332-V418 HydrophobicContact CD1-CG1 4.02Å; F332-V418 HydrophobicContact CD1-CG2 3.58Å; F332-V418 HydrophobicContact CE1-CG1 4.01Å; F332-V418 HydrophobicContact CE1-CG2 3.9Å; F332-V418 HydrophobicContact CG-CG1 4.4Å; F332-V418 HydrophobicContact CG-CG2 4.45Å; F332-V418 HydrophobicContact CZ-CG1 4.39Å
333	Y	91.2	Very high	77.3	Confident	74 Å²	74	49.1 Å²	49.1	29%	0.29	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	102	178.3	-69.2	-99.5	0	0	0	110.4	T331 T383 N416 K417 I419	T331-Y333 HydrophobicContact CG2-CD2 4.28Å; T331-Y333 HydrophobicContact CG2-CE2 3.55Å; Y333-T383 HydrophobicContact CD1-CG2 4.15Å; Y333-T383 HydrophobicContact CE1-CG2 3.82Å; Y333-T383 HydrophobicContact CE2-CG2 4.45Å; Y333-N416 WeakPolarHBondContact O-CB 3.47Å; Y333-N416 PolarHBondContact O-N 3.09Å; Y333-K417 HydrophobicContact CD2-CD 4.41Å; Y333-K417 HydrophobicContact CD2-CG 3.69Å; Y333-K417 HydrophobicContact CE2-CG 4.44Å; Y333-K417 HydrophobicContact CG-CG 4.04Å; Y333-K417 PolarHBondContact N-O 2.88Å; Y333-I419 HydrophobicContact CE2-CD1 3.83Å; Y333-I419 HydrophobicContact CE2-CG1 4.21Å
334	T	87.1	Confident	79.4	Confident	6 Å²	6	47.1 Å²	47.1	4%	0.037	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	143.2	176.1	-49.1	0	0	0	0	110.1	A340 T379 S382 W413	T334-A340 HydrophobicContact CG2-CB 4.41Å; T334-A340 WeakPolarHBondContact CG2-O 3.38Å; T334-T379 VanDerWaalsContact CB-O 3.31Å; T334-T379 WeakPolarHBondContact CB-O 3.47Å; T334-T379 VanDerWaalsContact CG2-O 3.23Å; T334-T379 WeakPolarHBondContact CG2-O 3.38Å; T334-S382 PolarHBondContact N-O 2.94Å; T334-S382 PolarHBondContact OG1-OG 2.93Å; T334-S382 VanDerWaalsContact OG1-OG 3.11Å; T334-W413 PolarHBondContact OG1-NE1 2.92Å
335	S	85.9	Confident	81.2	Confident	8 Å²	8	47.2 Å²	47.2	6%	0.056	23%	0.233	C	C	.	.			trans	-70.2	153.1	-175.5	-169.3	0	0	0	0	114	Q337 A340 G381 F414 N416	S335-Q337 PolarHBondContact O-N 3.34Å; S335-Q337 PolarHBondContact OG-N 2.72Å; S335-Q337 VanDerWaalsContact OG-N 3.17Å; S335-A340 WeakPolarHBondContact O-CB 3.21Å; S335-G381 PolarHBondContact O-N 2.82Å; S335-F414 VanDerWaalsContact CB-CD1 3.48Å; S335-F414 PolarHBondContact N-O 3.46Å; S335-N416 WeakPolarHBondContact CB-OD1 3.32Å
336	D	84.1	Confident	82.7	Confident	111 Å²	111	41.4 Å²	41.4	59%	0.594	21%	0.206	S	C	*	.	S	Bend	trans	-63.5	-25.9	164.3	-175.6	-78.7	0	0	0	111.5	R380	D336-R380 PolarHBondContact O-NE 3.04Å; D336-R380 PolarHBondContact O-NH2 3Å; D336-R380 IonicContact OD1-CZ 2.6Å; D336-R380 IonicContact OD1-NH2 2.79Å; D336-R380 PolarHBondContact OD1-NH2 2.8Å; D336-R380 IonicContact OD2-NH2 2.65Å
337	Q	78.1	Confident	84	Confident	104 Å²	104	42.9 Å²	42.9	49%	0.486	21%	0.212	S	C	.	.	S	Bend	trans	-54.9	150.3	-171.4	-71.7	-172.9	0.5	0	0	113.4	S335 D339 A340	S335-Q337 PolarHBondContact O-N 3.34Å; S335-Q337 PolarHBondContact OG-N 2.72Å; S335-Q337 VanDerWaalsContact OG-N 3.17Å; Q337-D339 PolarHBondContact O-N 3.19Å; Q337-A340 WeakPolarHBondContact O-CB 3.48Å; Q337-A340 PolarHBondContact O-N 2.79Å
338	K	74.1	Confident	84.6	Confident	155 Å²	155	38.3 Å²	38.3	67%	0.674	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	136.7	180	-158.9	-166.2	167.8	-172	0	109.8	A340	K338-A340 PolarHBondContact O-N 2.93Å; K338-A340 VanDerWaalsContact O-N 3.14Å
339	D	78.6	Confident	84.7	Confident	97 Å²	97	40.5 Å²	40.5	52%	0.519	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	15.8	176.5	-44.2	-42.4	0	0	0	115.1	Q337 G341 W436	Q337-D339 PolarHBondContact O-N 3.19Å; D339-G341 VanDerWaalsContact C-N 3.28Å; D339-G341 PolarHBondContact O-N 2.8Å; D339-W436 WeakPolarHBondContact O-CH2 3.09Å
340	A	80.5	Confident	84.7	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.			trans	-69.2	-11.1	-177.7	0	0	0	0	0	116.4	T334 S335 Q337 K338 W413 F414	T334-A340 HydrophobicContact CG2-CB 4.41Å; T334-A340 WeakPolarHBondContact CG2-O 3.38Å; S335-A340 WeakPolarHBondContact O-CB 3.21Å; Q337-A340 WeakPolarHBondContact O-CB 3.48Å; Q337-A340 PolarHBondContact O-N 2.79Å; K338-A340 PolarHBondContact O-N 2.93Å; K338-A340 VanDerWaalsContact O-N 3.14Å; A340-W413 WeakPolarHBondContact O-CA 3.5Å; A340-F414 HydrophobicContact CB-CB 3.77Å; A340-F414 PolarHBondContact O-N 3.08Å
341	G	81.2	Confident	84.3	Confident	12 Å²	12	42.2 Å²	42.2	12%	0.124	21%	0.206	C	C	.	.			trans	-94.9	140.1	-172.8	0	0	0	0	0	113.9	D339 F378 S410 S412	D339-G341 VanDerWaalsContact C-N 3.28Å; D339-G341 PolarHBondContact O-N 2.8Å; G341-F378 CarbonylContact C-O 3.22Å; G341-F378 WeakPolarHBondContact CA-O 3.3Å; G341-S410 PolarHBondContact O-OG 2.99Å; G341-S412 CarbonylContact C-O 3.56Å
342	T	84.9	Confident	83.6	Confident	9 Å²	9	42.9 Å²	42.9	6%	0.055	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-109.8	142.3	-176.7	-165.8	0	0	0	0	114.2	G344 F378 S410 P411 W413	T342-G344 PolarHBondContact OG1-N 3.14Å; T342-F378 HydrophobicContact CG2-CB 3.93Å; T342-F378 PolarHBondContact N-O 3.03Å; T342-S410 CarbonylContact C-O 3.51Å; T342-S410 VanDerWaalsContact CA-O 3.28Å; T342-S410 WeakPolarHBondContact CA-O 3.44Å; T342-S410 PolarHBondContact OG1-O 2.8Å; T342-P411 PolarHBondContact OG1-O 3.08Å; T342-W413 HydrophobicContact CG2-CB 3.79Å; T342-W413 HydrophobicContact CG2-CD2 3.72Å; T342-W413 HydrophobicContact CG2-CE3 4.2Å; T342-W413 HydrophobicContact CG2-CG 3.53Å
343	T	82.5	Confident	82.4	Confident	69 Å²	69	49.3 Å²	49.3	42%	0.423	24%	0.243	S	C	.	.			trans	-96.9	-7.6	170.4	57.7	0	0	0	0	113.1	G408 S409 S410	T343-G408 VanDerWaalsContact OG1-CA 3.3Å; T343-G408 WeakPolarHBondContact OG1-CA 3.45Å; T343-S409 PolarHBondContact OG1-N 3.17Å; T343-S410 PolarHBondContact N-O 3.01Å; T343-S410 PolarHBondContact OG1-N 2.67Å; T343-S410 PolarHBondContact OG1-O 3Å; T343-S410 VanDerWaalsContact OG1-O 3.12Å
344	G	75.8	Confident	80.7	Confident	5 Å²	5	52.2 Å²	52.2	5%	0.052	26%	0.257	C	S	.	.	S	Bend	trans	-75.8	146.5	-178	0	0	0	0	0	112.7	T342 V346 A407	T342-G344 PolarHBondContact OG1-N 3.14Å; G344-V346 PolarHBondContact O-N 3.22Å; G344-A407 WeakPolarHBondContact CA-O 3.45Å
345	E	79.7	Confident	79.8	Confident	83 Å²	83	56.2 Å²	56.2	39%	0.388	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-69.2	130.5	177.5	-51.7	-167.2	96.6	0	0	110.7	W361 N363 H404 N405	E345-W361 HydrophobicContact CB-CE3 4.39Å; E345-W361 HydrophobicContact CB-CZ3 4.41Å; E345-N363 WeakPolarHBondContact CG-ND2 3.44Å; E345-N363 WeakPolarHBondContact OE1-CB 3.43Å; E345-N363 PolarHBondContact OE1-ND2 2.81Å; E345-H404 CarbonylContact O-C 3.58Å; E345-H404 WeakPolarHBondContact O-CA 3.39Å; E345-N405 WeakPolarHBondContact CB-ND2 3.12Å; E345-N405 WeakPolarHBondContact CG-ND2 3.18Å; E345-N405 PolarHBondContact N-OD1 2.95Å; E345-N405 PolarHBondContact O-N 2.73Å; E345-N405 PolarHBondContact OE2-ND2 2.73Å
346	V	85.8	Confident	79.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	145	-174.3	178	0	0	0	0	111.3	G344 V362 F378 V402 G403 W413	G344-V346 PolarHBondContact O-N 3.22Å; V346-V362 HydrophobicContact CB-CB 4.49Å; V346-V362 HydrophobicContact CB-CG2 4.11Å; V346-V362 HydrophobicContact CG1-CG2 4.05Å; V346-V362 WeakPolarHBondContact O-CB 3.38Å; V346-V362 WeakPolarHBondContact O-CG2 3.42Å; V346-V362 PolarHBondContact O-N 2.75Å; V346-F378 HydrophobicContact CB-CE2 4.02Å; V346-F378 HydrophobicContact CB-CZ 4.32Å; V346-F378 HydrophobicContact CG2-CD2 3.79Å; V346-F378 HydrophobicContact CG2-CE2 3.62Å; V346-F378 HydrophobicContact CG2-CG 4.48Å; V346-F378 HydrophobicContact CG2-CZ 4.17Å; V346-V402 HydrophobicContact CG1-CG1 4.35Å; V346-G403 WeakPolarHBondContact CA-O 3.36Å; V346-W413 HydrophobicContact CG1-CH2 3.9Å; V346-W413 HydrophobicContact CG1-CZ3 3.82Å; V346-W413 HydrophobicContact CG2-CE3 4.37Å; V346-W413 HydrophobicContact CG2-CH2 3.98Å; V346-W413 HydrophobicContact CG2-CZ3 3.78Å
347	Y	88.5	Confident	79.1	Confident	32 Å²	32	53.4 Å²	53.4	13%	0.125	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	159.3	169.5	75.3	-93.3	0	0	0	112.2	E359 I360 W361 K401 G403	Y347-E359 HydrophobicContact CD2-CG 3.84Å; Y347-E359 HydrophobicContact CE2-CG 4.21Å; Y347-E359 VanDerWaalsContact CE2-OE1 3.3Å; Y347-E359 WeakPolarHBondContact CE2-OE1 3.31Å; Y347-I360 CarbonylContact C-O 3.53Å; Y347-I360 WeakPolarHBondContact CA-O 3.44Å; Y347-W361 HydrophobicContact CD1-CE3 4.39Å; Y347-W361 AromaticContact CD1-CH2 3.53Å; Y347-W361 HydrophobicContact CD1-CH2 3.53Å; Y347-W361 AromaticContact CD1-CZ2 3.88Å; Y347-W361 HydrophobicContact CD1-CZ2 3.88Å; Y347-W361 AromaticContact CD1-CZ3 3.81Å; Y347-W361 HydrophobicContact CD1-CZ3 3.81Å; Y347-W361 HydrophobicContact CE1-CH2 4.25Å; Y347-W361 HydrophobicContact CG-CH2 4.22Å; Y347-W361 HydrophobicContact CG-CZ2 4.21Å; Y347-W361 HydrophobicContact CG-CZ3 4.36Å; Y347-K401 HydrophobicContact CE2-CD 4.15Å; Y347-K401 HydrophobicContact CE2-CG 4.3Å; Y347-K401 WeakPolarHBondContact OH-CE 3.41Å; Y347-G403 VanDerWaalsContact CD1-C 3.5Å; Y347-G403 WeakPolarHBondContact CD1-O 3.2Å; Y347-G403 VanDerWaalsContact CE1-C 3.47Å; Y347-G403 VanDerWaalsContact CE1-CA 3.47Å; Y347-G403 PolarHBondContact N-O 2.76Å; Y347-G403 PolarHBondContact O-N 2.8Å
348	V	89.4	Confident	78.8	Confident	1 Å²	1	57 Å²	57	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.1	-178.7	127.9	0	0	0	0	112.8	L330 F332 I360 L388 L400 K401 V402	L330-V348 HydrophobicContact CD2-CB 4.36Å; L330-V348 HydrophobicContact CD2-CG1 3.79Å; L330-V348 HydrophobicContact CD2-CG2 3.83Å; F332-V348 HydrophobicContact CE1-CG2 4.31Å; F332-V348 HydrophobicContact CZ-CG2 3.98Å; V348-I360 PolarHBondContact N-O 3.13Å; V348-I360 PolarHBondContact O-N 2.84Å; V348-L388 HydrophobicContact CG1-CD1 4.29Å; V348-L388 HydrophobicContact CG1-CD2 4.33Å; V348-L400 HydrophobicContact CG1-CD1 4.48Å; V348-L400 HydrophobicContact CG2-CD1 3.87Å; V348-K401 WeakPolarHBondContact CA-O 3.36Å; V348-V402 HydrophobicContact CG2-CG2 4.05Å
349	K	89.3	Confident	79.1	Confident	47 Å²	47	53.3 Å²	53.3	20%	0.204	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	133.5	167.1	-161.2	174.1	-176.5	172.3	0	110.9	Y351 S357 E359 K401	K349-Y351 HydrophobicContact CB-CE2 4.31Å; K349-Y351 HydrophobicContact CD-CE2 4.31Å; K349-Y351 HydrophobicContact CG-CE2 4.19Å; K349-S357 WeakPolarHBondContact CE-O 3.2Å; K349-S357 VanDerWaalsContact CG-O 3.31Å; K349-S357 WeakPolarHBondContact CG-O 3.3Å; K349-E359 HydrophobicContact CB-CG 4.31Å; K349-E359 HydrophobicContact CD-CB 4.09Å; K349-E359 HydrophobicContact CD-CG 4.27Å; K349-E359 HydrophobicContact CG-CB 4.47Å; K349-K401 HydrophobicContact CB-CB 4.11Å; K349-K401 PolarHBondContact N-O 2.74Å; K349-K401 PolarHBondContact O-N 3.2Å
350	L	88.4	Confident	79.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.2	-179.4	-59.3	179.8	0	0	0	110.9	Y328 L330 S356 S357 L388 L394 I397 L400 V420	Y328-L350 HydrophobicContact CD1-CD1 3.96Å; Y328-L350 HydrophobicContact CD2-CD1 4.39Å; Y328-L350 HydrophobicContact CG-CD1 3.88Å; L330-L350 HydrophobicContact CD2-CD2 4.48Å; L350-S356 CarbonylContact O-C 3.52Å; L350-S356 WeakPolarHBondContact O-CA 3.34Å; L350-S356 WeakPolarHBondContact O-CB 3.38Å; L350-S357 PolarHBondContact N-OG 3.35Å; L350-S357 PolarHBondContact O-N 2.82Å; L350-L388 HydrophobicContact CD1-CD1 3.75Å; L350-L388 HydrophobicContact CG-CD1 4.28Å; L350-L394 HydrophobicContact CB-CD1 3.85Å; L350-L394 HydrophobicContact CD1-CD1 4.27Å; L350-I397 HydrophobicContact CB-CD1 4.5Å; L350-I397 HydrophobicContact CB-CG2 4.33Å; L350-I397 HydrophobicContact CD2-CG2 4.32Å; L350-L400 HydrophobicContact CD2-CD1 3.55Å; L350-V420 HydrophobicContact CD1-CG1 4Å; L350-V420 HydrophobicContact CD2-CG1 3.89Å; L350-V420 HydrophobicContact CD2-CG2 3.89Å
351	Y	83.8	Confident	79.4	Confident	69 Å²	69	54.4 Å²	54.4	27%	0.271	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	107.1	175.3	-63.3	-99.7	0	0	0	110	K349 I397 T398 K399 K401	K349-Y351 HydrophobicContact CB-CE2 4.31Å; K349-Y351 HydrophobicContact CD-CE2 4.31Å; K349-Y351 HydrophobicContact CG-CE2 4.19Å; Y351-I397 CarbonylContact O-C 3.53Å; Y351-I397 WeakPolarHBondContact O-CA 3.48Å; Y351-I397 WeakPolarHBondContact O-CG2 3.5Å; Y351-T398 PolarHBondContact O-N 2.87Å; Y351-T398 PolarHBondContact O-OG1 3.45Å; Y351-K399 HydrophobicContact CD2-CB 4.19Å; Y351-K399 HydrophobicContact CG-CB 4.37Å; Y351-K399 PolarHBondContact N-O 2.75Å; Y351-K399 PolarHBondContact O-N 2.69Å; Y351-K401 HydrophobicContact CE2-CB 4.24Å
352	G	74.2	Confident	79.4	Confident	16 Å²	16	54 Å²	54	17%	0.165	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	165.1	178.5	0	0	0	0	0	114	K354 D355 L394 E396	G352-K354 PolarHBondContact O-N 3.33Å; G352-D355 CarbonylContact C-O 3.55Å; G352-D355 VanDerWaalsContact CA-O 3.25Å; G352-D355 WeakPolarHBondContact CA-O 3.44Å; G352-D355 PolarHBondContact N-O 3.37Å; G352-L394 CarbonylContact C-O 3.51Å; G352-L394 WeakPolarHBondContact CA-O 3.18Å; G352-E396 CarbonylContact C-O 3.4Å; G352-E396 VanDerWaalsContact CA-O 3.32Å; G352-E396 WeakPolarHBondContact CA-O 3.48Å
353	E	66.4	Low	78.9	Confident	136 Å²	136	57 Å²	57	64%	0.636	27%	0.271	S	S	*	.	S	Bend	trans	-57.5	-26.4	174.7	-172.6	-170	-157.3	0	0	113.7	L394 E396	E353-L394 PolarHBondContact N-O 3.47Å; E353-E396 HydrophobicContact CB-CB 4.01Å; E353-E396 PolarHBondContact N-O 2.8Å
354	K	57.5	Low	78.2	Confident	135 Å²	135	57.5 Å²	57.5	59%	0.587	28%	0.278	S	S	*	.	S	Bend	trans	-106.5	-35.9	-177.5	-58.3	171.9	-174.7	163.7	0	113.5	G352 L394	G352-K354 PolarHBondContact O-N 3.33Å; K354-L394 WeakPolarHBondContact CB-O 3.07Å; K354-L394 PolarHBondContact N-O 3.03Å
355	D	67.5	Low	77.9	Confident	91 Å²	91	58.4 Å²	58.4	49%	0.487	28%	0.281	S	S	.	.			trans	-162.1	172.8	-177.9	-154.7	-11.1	0	0	0	111	G352 L394	G352-D355 CarbonylContact C-O 3.55Å; G352-D355 VanDerWaalsContact CA-O 3.25Å; G352-D355 WeakPolarHBondContact CA-O 3.44Å; G352-D355 PolarHBondContact N-O 3.37Å; D355-L394 HydrophobicContact CB-CD2 4.01Å; D355-L394 PolarHBondContact N-O 3.05Å
356	S	73.8	Confident	76.5	Confident	52 Å²	52	62 Å²	62	36%	0.364	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-117	146.9	175.4	65.2	0	0	0	0	112.1	L350	L350-S356 CarbonylContact O-C 3.52Å; L350-S356 WeakPolarHBondContact O-CA 3.34Å; L350-S356 WeakPolarHBondContact O-CB 3.38Å
357	S	80.5	Confident	74.7	Confident	8 Å²	8	66.4 Å²	66.4	6%	0.056	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-70.2	155.7	173.8	81.3	0	0	0	0	110.9	K349 L350	K349-S357 WeakPolarHBondContact CE-O 3.2Å; K349-S357 VanDerWaalsContact CG-O 3.31Å; K349-S357 WeakPolarHBondContact CG-O 3.3Å; L350-S357 PolarHBondContact N-OG 3.35Å; L350-S357 PolarHBondContact O-N 2.82Å
358	R	72.8	Confident	72.4	Confident	180 Å²	180	74.4 Å²	74.4	68%	0.679	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-58.6	158.8	154.5	58.1	178.5	169.5	179.8	-5.2	110.5	I360	R358-I360 HydrophobicContact CG-CD1 4.34Å; R358-I360 HydrophobicContact CG-CG1 4.05Å
359	E	80.6	Confident	69.8	Low	77 Å²	77	81.5 Å²	81.5	36%	0.36	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-76.6	126.7	175.2	-154	145	-149.3	0	0	108.3	Y347 K349 K401	Y347-E359 HydrophobicContact CD2-CG 3.84Å; Y347-E359 HydrophobicContact CE2-CG 4.21Å; Y347-E359 VanDerWaalsContact CE2-OE1 3.3Å; Y347-E359 WeakPolarHBondContact CE2-OE1 3.31Å; K349-E359 HydrophobicContact CB-CG 4.31Å; K349-E359 HydrophobicContact CD-CB 4.09Å; K349-E359 HydrophobicContact CD-CG 4.27Å; K349-E359 HydrophobicContact CG-CB 4.47Å; E359-K401 WeakPolarHBondContact OE1-CD 3.46Å; E359-K401 WeakPolarHBondContact OE1-CE 3.32Å; E359-K401 IonicContact OE1-NZ 3.58Å; E359-K401 PolarHBondContact OE1-NZ 3.13Å
360	I	81.6	Confident	67.3	Low	18 Å²	18	89.5 Å²	89.5	9%	0.092	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.4	-168.9	-62.4	159.6	0	0	0	109	Y347 V348 R358 I365 L388	Y347-I360 CarbonylContact C-O 3.53Å; Y347-I360 WeakPolarHBondContact CA-O 3.44Å; V348-I360 PolarHBondContact N-O 3.13Å; V348-I360 PolarHBondContact O-N 2.84Å; R358-I360 HydrophobicContact CG-CD1 4.34Å; R358-I360 HydrophobicContact CG-CG1 4.05Å; I360-I365 HydrophobicContact CG2-CD1 3.9Å; I360-I365 HydrophobicContact CG2-CG1 3.95Å; I360-L388 HydrophobicContact CB-CD2 4.33Å; I360-L388 HydrophobicContact CD1-CB 4.38Å; I360-L388 HydrophobicContact CD1-CD1 4.05Å; I360-L388 HydrophobicContact CD1-CD2 4.1Å; I360-L388 HydrophobicContact CD1-CG 4.42Å; I360-L388 HydrophobicContact CG2-CD2 3.99Å
361	W	84.4	Confident	64.8	Low	102 Å²	102	101.5 Å²	101.5	39%	0.386	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.5	173.3	-69.3	84.9	0	0	0	109.6	E345 Y347 N363 S364 N405	E345-W361 HydrophobicContact CB-CE3 4.39Å; E345-W361 HydrophobicContact CB-CZ3 4.41Å; Y347-W361 HydrophobicContact CD1-CE3 4.39Å; Y347-W361 AromaticContact CD1-CH2 3.53Å; Y347-W361 HydrophobicContact CD1-CH2 3.53Å; Y347-W361 AromaticContact CD1-CZ2 3.88Å; Y347-W361 HydrophobicContact CD1-CZ2 3.88Å; Y347-W361 AromaticContact CD1-CZ3 3.81Å; Y347-W361 HydrophobicContact CD1-CZ3 3.81Å; Y347-W361 HydrophobicContact CE1-CH2 4.25Å; Y347-W361 HydrophobicContact CG-CH2 4.22Å; Y347-W361 HydrophobicContact CG-CZ2 4.21Å; Y347-W361 HydrophobicContact CG-CZ3 4.36Å; W361-N363 VanDerWaalsContact C-N 3.28Å; W361-N363 PolarHBondContact O-N 2.89Å; W361-S364 PolarHBondContact O-N 3.08Å; W361-S364 PolarHBondContact O-OG 3.22Å; W361-N405 HydrophobicContact CH2-CB 3.94Å; W361-N405 HydrophobicContact CZ3-CB 3.82Å
362	V	79.8	Confident	62.3	Low	3 Å²	3	106.7 Å²	106.7	2%	0.018	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-62.3	-37.2	-172	171.6	0	0	0	0	111.6	V346 S364 Y376 F378 V386	V346-V362 HydrophobicContact CB-CB 4.49Å; V346-V362 HydrophobicContact CB-CG2 4.11Å; V346-V362 HydrophobicContact CG1-CG2 4.05Å; V346-V362 WeakPolarHBondContact O-CB 3.38Å; V346-V362 WeakPolarHBondContact O-CG2 3.42Å; V346-V362 PolarHBondContact O-N 2.75Å; V362-S364 PolarHBondContact O-N 3.25Å; V362-Y376 HydrophobicContact CG1-CD2 3.43Å; V362-Y376 VanDerWaalsContact CG1-CD2 3.43Å; V362-Y376 HydrophobicContact CG1-CE2 4.1Å; V362-Y376 HydrophobicContact CG1-CG 3.73Å; V362-F378 HydrophobicContact CG1-CZ 4.37Å; V362-V386 HydrophobicContact CG1-CG1 3.95Å; V362-V386 HydrophobicContact CG1-CG2 3.68Å; V362-V386 HydrophobicContact CG2-CG1 4.33Å; V362-V386 HydrophobicContact CG2-CG2 4.49Å
363	N	74.7	Confident	60.4	Low	71 Å²	71	112 Å²	112	38%	0.38	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-76.3	-15.1	-177.9	-71.1	-6.3	0	0	0	114.7	E345 W361	E345-N363 WeakPolarHBondContact CG-ND2 3.44Å; E345-N363 WeakPolarHBondContact OE1-CB 3.43Å; E345-N363 PolarHBondContact OE1-ND2 2.81Å; W361-N363 VanDerWaalsContact C-N 3.28Å; W361-N363 PolarHBondContact O-N 2.89Å
364	S	68.5	Low	59.4	Low	81 Å²	81	110.9 Å²	110.9	57%	0.566	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-97.2	7.1	-178.3	64.1	0	0	0	0	114.3	W361 V362 N366	W361-S364 PolarHBondContact O-N 3.08Å; W361-S364 PolarHBondContact O-OG 3.22Å; V362-S364 PolarHBondContact O-N 3.25Å; S364-N366 PolarHBondContact O-N 2.95Å
365	I	68.5	Low	59.5	Low	24 Å²	24	107.8 Å²	107.8	12%	0.123	53%	0.527	C	S	.	.			trans	-78.8	85.1	179.3	-54.3	175.3	0	0	0	110.4	I360 Q367 V386 L388 P389	I360-I365 HydrophobicContact CG2-CD1 3.9Å; I360-I365 HydrophobicContact CG2-CG1 3.95Å; I365-Q367 HydrophobicContact CG2-CG 4.26Å; I365-Q367 PolarHBondContact O-N 3.29Å; I365-V386 HydrophobicContact CD1-CG1 3.78Å; I365-L388 HydrophobicContact CD1-CD2 4.09Å; I365-P389 HydrophobicContact CG2-CG 4.17Å
366	N	50.6	Low	59.7	Low	158 Å²	158	106.1 Å²	106.1	85%	0.845	51%	0.514	S	S	*	.			trans	-68.3	89.6	175.9	-96.4	-47.1	0	0	0	112.6	S364 K368	S364-N366 PolarHBondContact O-N 2.95Å; N366-K368 PolarHBondContact O-N 3.17Å; N366-K368 VanDerWaalsContact O-N 3.14Å
367	Q	47.3	Very low	59.8	Low	94 Å²	94	109.8 Å²	109.8	44%	0.439	53%	0.525	S	S	.	.			trans	-75.8	96.5	174.5	-67.5	-169.5	11.3	0	0	111.8	I365 N369	I365-Q367 HydrophobicContact CG2-CG 4.26Å; I365-Q367 PolarHBondContact O-N 3.29Å; Q367-N369 PolarHBondContact O-N 3.33Å
368	K	41.6	Very low	60.1	Low	199 Å²	199	109.6 Å²	109.6	87%	0.865	52%	0.523	S	S	*	.			trans	-70.4	-5.4	178.2	-91.8	-173.4	172.7	-177.8	0	115.9	N366	N366-K368 PolarHBondContact O-N 3.17Å; N366-K368 VanDerWaalsContact O-N 3.14Å
369	N	34.5	Very low	60.7	Low	150 Å²	150	105 Å²	105	80%	0.802	52%	0.516	S	S	*	.	S	Bend	trans	-144.2	62.5	-171.2	-86.2	-38.7	0	0	0	114.7	Q367	Q367-N369 PolarHBondContact O-N 3.33Å
370	R	35.5	Very low	60.8	Low	215 Å²	215	108.3 Å²	108.3	81%	0.811	53%	0.525	S	S	*	.	S	Bend	trans	-168	154.6	151	-105.3	154.1	-165.5	-166.5	4.9	110.9	Q372	R370-Q372 PolarHBondContact O-N 3.23Å
371	R	37.7	Very low	60.7	Low	253 Å²	253	109.6 Å²	109.6	96%	0.955	54%	0.542	S	S	*	.	S	Bend	trans	-91.6	87.5	-173.7	-70.2	-179.1	176	174.4	-2.3	112.5
372	Q	31.5	Very low	60.8	Low	178 Å²	178	105.6 Å²	105.6	83%	0.832	53%	0.53	S	S	*	.			trans	-169.6	136.7	150.6	-112.2	171.4	20.3	0	0	111.3	R370	R370-Q372 PolarHBondContact O-N 3.23Å
373	P	33.9	Very low	61.1	Low	126 Å²	126	109.4 Å²	109.4	82%	0.818	55%	0.553	S	S	*	*			trans	-111.8	105.4	178.4	36.3	-25.4	0	0	0	112.9
374	T	44.7	Very low	61.7	Low	114 Å²	114	106.7 Å²	106.7	70%	0.699	54%	0.539	S	S	*	.			trans	-147.6	136.5	170.9	49.2	0	0	0	0	110.9
375	S	60.2	Low	62.6	Low	69 Å²	69	106.6 Å²	106.6	48%	0.483	53%	0.53	S	S	.	.			trans	-69.3	148	166.7	44	0	0	0	0	111.3	H377	S375-H377 PolarHBondContact O-CD2 3.05Å; S375-H377 PolarHBondContact O-N 3.08Å; S375-H377 PolarHBondContact OG-CE1 3.15Å; S375-H377 PolarHBondContact OG-NE2 2.83Å
376	Y	71.7	Confident	63.4	Low	57 Å²	57	105.5 Å²	105.5	22%	0.224	52%	0.524	C	S	.	.			trans	-77.8	104	-175.5	-62.6	-80.7	0	0	0	111.2	V362 F378 V384 E385 V386	V362-Y376 HydrophobicContact CG1-CD2 3.43Å; V362-Y376 VanDerWaalsContact CG1-CD2 3.43Å; V362-Y376 HydrophobicContact CG1-CE2 4.1Å; V362-Y376 HydrophobicContact CG1-CG 3.73Å; Y376-F378 WeakPolarHBondContact O-CD2 3.13Å; Y376-F378 WeakPolarHBondContact O-CE2 3.37Å; Y376-V384 HydrophobicContact CD1-CG1 3.97Å; Y376-E385 WeakPolarHBondContact CE1-O 3.18Å; Y376-V386 HydrophobicContact CD1-CG2 3.99Å; Y376-V386 HydrophobicContact CE1-CG2 4.13Å; Y376-V386 HydrophobicContact CG-CG2 4.3Å
377	H	75	Confident	65	Low	128 Å²	128	101.7 Å²	101.7	59%	0.593	50%	0.498	S	S	*	.			trans	-99.5	119.4	-179	-66.6	-60.4	0	0	0	112.3	S375 T379 V384	S375-H377 PolarHBondContact O-CD2 3.05Å; S375-H377 PolarHBondContact O-N 3.08Å; S375-H377 PolarHBondContact OG-CE1 3.15Å; S375-H377 PolarHBondContact OG-NE2 2.83Å; H377-T379 PolarHBondContact O-N 2.9Å; H377-V384 WeakPolarHBondContact O-CG2 3.45Å
378	F	86.7	Confident	66.6	Low	5 Å²	5	97.5 Å²	97.5	2%	0.022	48%	0.479	C	S	.	.	B	Isolated β-bridge	trans	-96.4	63.5	-176.4	-62	-88.1	0	0	0	111.6	F332 G341 T342 V346 V362 Y376 V384 W413	F332-F378 HydrophobicContact CB-CD1 4.3Å; F332-F378 HydrophobicContact CB-CE1 3.94Å; F332-F378 HydrophobicContact CD1-CE1 4.4Å; F332-F378 AromaticContact CD2-CE1 3.86Å; F332-F378 HydrophobicContact CD2-CE1 3.86Å; F332-F378 HydrophobicContact CD2-CZ 4.45Å; F332-F378 HydrophobicContact CE2-CE1 4.45Å; F332-F378 AromaticContact CG-CE1 3.83Å; F332-F378 HydrophobicContact CG-CE1 3.83Å; G341-F378 CarbonylContact C-O 3.22Å; G341-F378 WeakPolarHBondContact CA-O 3.3Å; T342-F378 HydrophobicContact CG2-CB 3.93Å; T342-F378 PolarHBondContact N-O 3.03Å; V346-F378 HydrophobicContact CB-CE2 4.02Å; V346-F378 HydrophobicContact CB-CZ 4.32Å; V346-F378 HydrophobicContact CG2-CD2 3.79Å; V346-F378 HydrophobicContact CG2-CE2 3.62Å; V346-F378 HydrophobicContact CG2-CG 4.48Å; V346-F378 HydrophobicContact CG2-CZ 4.17Å; V362-F378 HydrophobicContact CG1-CZ 4.37Å; Y376-F378 WeakPolarHBondContact O-CD2 3.13Å; Y376-F378 WeakPolarHBondContact O-CE2 3.37Å; F378-V384 HydrophobicContact CD1-CB 3.88Å; F378-V384 HydrophobicContact CD1-CG1 4.19Å; F378-V384 HydrophobicContact CD1-CG2 3.71Å; F378-V384 HydrophobicContact CE1-CB 3.67Å; F378-V384 HydrophobicContact CE1-CG1 3.66Å; F378-V384 HydrophobicContact CE1-CG2 4.03Å; F378-V384 HydrophobicContact CG-CG2 4.34Å; F378-V384 HydrophobicContact CZ-CB 4.44Å; F378-V384 HydrophobicContact CZ-CG1 3.94Å; F378-W413 HydrophobicContact CB-CZ2 4.3Å; F378-W413 HydrophobicContact CD1-CH2 4.14Å; F378-W413 AromaticContact CD1-CZ2 3.48Å; F378-W413 HydrophobicContact CD1-CZ2 3.48Å; F378-W413 VanDerWaalsContact CD1-CZ2 3.48Å; F378-W413 HydrophobicContact CE1-CH2 4.22Å; F378-W413 AromaticContact CE1-CZ2 3.97Å; F378-W413 HydrophobicContact CE1-CZ2 3.97Å; F378-W413 AromaticContact CG-CZ2 3.98Å; F378-W413 HydrophobicContact CG-CZ2 3.98Å
379	T	85.6	Confident	68	Low	84 Å²	84	90 Å²	90	52%	0.515	45%	0.451	S	S	.	.			trans	-74.6	165.4	-178	51.2	0	0	0	0	113.5	T334 H377 G381 S382	T334-T379 VanDerWaalsContact CB-O 3.31Å; T334-T379 WeakPolarHBondContact CB-O 3.47Å; T334-T379 VanDerWaalsContact CG2-O 3.23Å; T334-T379 WeakPolarHBondContact CG2-O 3.38Å; H377-T379 PolarHBondContact O-N 2.9Å; T379-G381 PolarHBondContact O-N 2.73Å; T379-S382 PolarHBondContact N-OG 2.87Å; T379-S382 VanDerWaalsContact N-OG 3.16Å; T379-S382 WeakPolarHBondContact O-CB 3.45Å; T379-S382 PolarHBondContact O-N 2.89Å; T379-S382 PolarHBondContact O-OG 3.18Å
380	R	84	Confident	69.5	Low	146 Å²	146	85.2 Å²	85.2	55%	0.551	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	129	172.6	180	-172.4	174.4	-167.2	-3.8	110.8	D336 S382	D336-R380 PolarHBondContact O-NE 3.04Å; D336-R380 PolarHBondContact O-NH2 3Å; D336-R380 IonicContact OD1-CZ 2.6Å; D336-R380 IonicContact OD1-NH2 2.79Å; D336-R380 PolarHBondContact OD1-NH2 2.8Å; D336-R380 IonicContact OD2-NH2 2.65Å; R380-S382 PolarHBondContact O-N 2.84Å
381	G	79.5	Confident	71.1	Confident	44 Å²	44	76 Å²	76	45%	0.454	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	2	-179.1	0	0	0	0	0	116.1	S335 T379	S335-G381 PolarHBondContact O-N 2.82Å; T379-G381 PolarHBondContact O-N 2.73Å
382	S	84.9	Confident	72.2	Confident	18 Å²	18	68.2 Å²	68.2	13%	0.126	38%	0.378	C	S	.	.			trans	-70.7	145.6	-175.5	64.3	0	0	0	0	113.4	T334 T379 R380	T334-S382 PolarHBondContact N-O 2.94Å; T334-S382 PolarHBondContact OG1-OG 2.93Å; T334-S382 VanDerWaalsContact OG1-OG 3.11Å; T379-S382 PolarHBondContact N-OG 2.87Å; T379-S382 VanDerWaalsContact N-OG 3.16Å; T379-S382 WeakPolarHBondContact O-CB 3.45Å; T379-S382 PolarHBondContact O-N 2.89Å; T379-S382 PolarHBondContact O-OG 3.18Å; R380-S382 PolarHBondContact O-N 2.84Å
383	T	87.5	Confident	74.2	Confident	83 Å²	83	62.2 Å²	62.2	51%	0.509	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.1	162.1	-58.7	0	0	0	0	107.7	T331 F332 Y333	T331-T383 HydrophobicContact CG2-CG2 3.43Å; T331-T383 VanDerWaalsContact CG2-CG2 3.43Å; F332-T383 WeakPolarHBondContact O-CA 3.32Å; Y333-T383 HydrophobicContact CD1-CG2 4.15Å; Y333-T383 HydrophobicContact CE1-CG2 3.82Å; Y333-T383 HydrophobicContact CE2-CG2 4.45Å
384	V	86.1	Confident	76.2	Confident	14 Å²	14	56.3 Å²	56.3	9%	0.085	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.1	-172.9	-176.9	0	0	0	0	109.9	T331 F332 Y376 H377 F378 V386	T331-V384 CarbonylContact C-O 3.41Å; T331-V384 WeakPolarHBondContact CA-O 3.45Å; F332-V384 PolarHBondContact N-O 3.29Å; F332-V384 PolarHBondContact O-N 2.66Å; Y376-V384 HydrophobicContact CD1-CG1 3.97Å; H377-V384 WeakPolarHBondContact O-CG2 3.45Å; F378-V384 HydrophobicContact CD1-CB 3.88Å; F378-V384 HydrophobicContact CD1-CG1 4.19Å; F378-V384 HydrophobicContact CD1-CG2 3.71Å; F378-V384 HydrophobicContact CE1-CB 3.67Å; F378-V384 HydrophobicContact CE1-CG1 3.66Å; F378-V384 HydrophobicContact CE1-CG2 4.03Å; F378-V384 HydrophobicContact CG-CG2 4.34Å; F378-V384 HydrophobicContact CZ-CB 4.44Å; F378-V384 HydrophobicContact CZ-CG1 3.94Å; V384-V386 HydrophobicContact CG1-CG2 4.4Å
385	E	87.4	Confident	77.4	Confident	79 Å²	79	51 Å²	51	37%	0.369	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.8	178.9	-49.9	-144.5	129.4	0	0	111.4	K329 L330 T331 Y376	K329-E385 VanDerWaalsContact CE-CD 3.47Å; K329-E385 WeakPolarHBondContact CE-OE1 3.21Å; K329-E385 WeakPolarHBondContact CE-OE2 3.48Å; K329-E385 IonicContact NZ-OE1 2.67Å; K329-E385 PolarHBondContact NZ-OE1 3.21Å; K329-E385 IonicContact NZ-OE2 3.51Å; K329-E385 PolarHBondContact NZ-OE2 2.88Å; L330-E385 CarbonylContact O-C 3.1Å; L330-E385 WeakPolarHBondContact O-CA 3.5Å; T331-E385 HydrophobicContact CG2-CG 4.13Å; T331-E385 PolarHBondContact OG1-OE1 3.07Å; Y376-E385 WeakPolarHBondContact CE1-O 3.18Å
386	V	85.1	Confident	78.1	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.2	-178.6	-179.2	0	0	0	0	108.9	K329 L330 F332 V362 I365 Y376 V384	K329-V386 CarbonylContact C-O 3.42Å; K329-V386 WeakPolarHBondContact CA-O 3.3Å; L330-V386 PolarHBondContact N-O 2.85Å; L330-V386 PolarHBondContact O-N 2.85Å; F332-V386 HydrophobicContact CD2-CG2 4.26Å; F332-V386 HydrophobicContact CE2-CB 4.26Å; F332-V386 HydrophobicContact CE2-CG2 3.88Å; V362-V386 HydrophobicContact CG1-CG1 3.95Å; V362-V386 HydrophobicContact CG1-CG2 3.68Å; V362-V386 HydrophobicContact CG2-CG1 4.33Å; V362-V386 HydrophobicContact CG2-CG2 4.49Å; I365-V386 HydrophobicContact CD1-CG1 3.78Å; Y376-V386 HydrophobicContact CD1-CG2 3.99Å; Y376-V386 HydrophobicContact CE1-CG2 4.13Å; Y376-V386 HydrophobicContact CG-CG2 4.3Å; V384-V386 HydrophobicContact CG1-CG2 4.4Å
387	Y	85.6	Confident	78.7	Confident	79 Å²	79	47.7 Å²	47.7	31%	0.31	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.7	175.2	-68.4	-107.2	0	0	0	109.1	K329 L423	K329-Y387 HydrophobicContact CB-CD1 4.08Å; K329-Y387 HydrophobicContact CB-CE1 4Å; K329-Y387 HydrophobicContact CD-CE1 4.23Å; K329-Y387 HydrophobicContact CD-CE2 4.49Å; Y387-L423 HydrophobicContact CD1-CD1 3.99Å; Y387-L423 HydrophobicContact CE1-CD1 3.92Å
388	L	80.7	Confident	78.8	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-73.4	149.6	175.3	-59.6	-174.2	0	0	0	110.7	Y328 L330 V348 L350 I360 I365	Y328-L388 PolarHBondContact O-N 2.78Å; L330-L388 HydrophobicContact CD1-CD1 3.61Å; L330-L388 HydrophobicContact CD1-CD2 4.03Å; L330-L388 HydrophobicContact CD1-CG 3.53Å; V348-L388 HydrophobicContact CG1-CD1 4.29Å; V348-L388 HydrophobicContact CG1-CD2 4.33Å; L350-L388 HydrophobicContact CD1-CD1 3.75Å; L350-L388 HydrophobicContact CG-CD1 4.28Å; I360-L388 HydrophobicContact CB-CD2 4.33Å; I360-L388 HydrophobicContact CD1-CB 4.38Å; I360-L388 HydrophobicContact CD1-CD1 4.05Å; I360-L388 HydrophobicContact CD1-CD2 4.1Å; I360-L388 HydrophobicContact CD1-CG 4.42Å; I360-L388 HydrophobicContact CG2-CD2 3.99Å; I365-L388 HydrophobicContact CD1-CD2 4.09Å
389	P	70.3	Confident	78.7	Confident	41 Å²	41	49.2 Å²	49.2	27%	0.266	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-53.2	144.9	169.7	-23.7	33.1	0	0	0	111.5	I365 C391	I365-P389 HydrophobicContact CG2-CG 4.17Å; P389-C391 PolarHBondContact O-N 3.41Å
390	P	66	Low	78.8	Confident	50 Å²	50	45.2 Å²	45.2	33%	0.325	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-52.8	137.3	176.5	-21.1	28.5	0	0	0	112	E325 T326 E327	E325-P390 HydrophobicContact CB-CB 3.46Å; E325-P390 VanDerWaalsContact CB-CB 3.46Å; E325-P390 HydrophobicContact CG-CB 4.26Å; E325-P390 WeakPolarHBondContact OE2-CB 3.49Å; T326-P390 WeakPolarHBondContact O-CA 3.41Å; E327-P390 HydrophobicContact CG-CB 4.27Å; E327-P390 HydrophobicContact CG-CG 3.85Å
391	C	69.2	Low	78.8	Confident	20 Å²	20	38.9 Å²	38.9	14%	0.135	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-148.9	173.6	-179.1	71.2	0	0	0	0	112.1	T326 Y328 P389	T326-C391 PolarHBondContact N-O 3.48Å; T326-C391 PolarHBondContact O-N 3.27Å; Y328-C391 VanDerWaalsContact CE2-SG 3.56Å; P389-C391 PolarHBondContact O-N 3.41Å
392	P	60.1	Low	79.3	Confident	91 Å²	91	36.9 Å²	36.9	59%	0.591	20%	0.199	S	C	*	.			trans	-57.4	148	176.9	-26.3	36.6	0	0	0	112.9	L394	P392-L394 WeakPolarHBondContact O-CD2 3.39Å; P392-L394 WeakPolarHBondContact O-CG 3.32Å; P392-L394 PolarHBondContact O-N 3.19Å
393	Q	73.7	Confident	79.2	Confident	51 Å²	51	36.3 Å²	36.3	24%	0.238	20%	0.196	C	C	.	.			trans	-72.9	98.5	-175.9	174.7	34.9	-110.8	0	0	111.4	T326 Y328 G395 D422 M425	T326-Q393 WeakPolarHBondContact OG1-CB 3.26Å; T326-Q393 PolarHBondContact OG1-NE2 3.27Å; Y328-Q393 PolarHBondContact OH-NE2 3.03Å; Q393-G395 VanDerWaalsContact C-N 3.28Å; Q393-G395 PolarHBondContact O-N 2.82Å; Q393-D422 PolarHBondContact NE2-OD1 3.37Å; Q393-D422 PolarHBondContact NE2-OD2 3.07Å; Q393-D422 PolarHBondContact OE1-OD2 3.1Å; Q393-M425 HydrophobicContact CG-CG 4.36Å; Q393-M425 VanDerWaalsContact NE2-CG 3.31Å
394	L	76.3	Confident	79	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.016	18%	0.177	C	C	.	.			trans	-69.2	-15.1	-167.9	-54.3	179.2	0	0	0	114.9	Y328 L350 G352 E353 K354 D355 P392 I397	Y328-L394 HydrophobicContact CE2-CD1 4.11Å; Y328-L394 HydrophobicContact CE2-CG 4.08Å; Y328-L394 PolarHBondContact OH-N 2.8Å; L350-L394 HydrophobicContact CB-CD1 3.85Å; L350-L394 HydrophobicContact CD1-CD1 4.27Å; G352-L394 CarbonylContact C-O 3.51Å; G352-L394 WeakPolarHBondContact CA-O 3.18Å; E353-L394 PolarHBondContact N-O 3.47Å; K354-L394 WeakPolarHBondContact CB-O 3.07Å; K354-L394 PolarHBondContact N-O 3.03Å; D355-L394 HydrophobicContact CB-CD2 4.01Å; D355-L394 PolarHBondContact N-O 3.05Å; P392-L394 WeakPolarHBondContact O-CD2 3.39Å; P392-L394 WeakPolarHBondContact O-CG 3.32Å; P392-L394 PolarHBondContact O-N 3.19Å; L394-I397 HydrophobicContact CB-CD1 3.71Å; L394-I397 HydrophobicContact CD1-CD1 3.91Å; L394-I397 HydrophobicContact CG-CD1 4.43Å
395	G	69.9	Low	78.7	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	19%	0.187	C	C	.	.			trans	82.9	-151.9	-174.6	0	0	0	0	0	112.9	Q393 I397	Q393-G395 VanDerWaalsContact C-N 3.28Å; Q393-G395 PolarHBondContact O-N 2.82Å; G395-I397 PolarHBondContact O-N 3.07Å
396	E	74.4	Confident	77.9	Confident	57 Å²	57	38 Å²	38	27%	0.266	19%	0.193	S	C	.	.	S	Bend	trans	-70.3	116.3	-178.2	-153.8	169.7	-113.2	0	0	111.2	G352 E353 T398 R427 F429 S450	G352-E396 CarbonylContact C-O 3.4Å; G352-E396 VanDerWaalsContact CA-O 3.32Å; G352-E396 WeakPolarHBondContact CA-O 3.48Å; E353-E396 HydrophobicContact CB-CB 4.01Å; E353-E396 PolarHBondContact N-O 2.8Å; E396-T398 PolarHBondContact O-N 2.82Å; E396-R427 IonicContact OE1-CZ 2.69Å; E396-R427 IonicContact OE1-NH1 2.8Å; E396-R427 PolarHBondContact OE1-NH1 2.87Å; E396-R427 IonicContact OE1-NH2 3.17Å; E396-R427 PolarHBondContact OE1-NH2 2.95Å; E396-F429 HydrophobicContact CB-CE1 4.4Å; E396-F429 HydrophobicContact CG-CD1 4.39Å; E396-F429 HydrophobicContact CG-CE1 3.57Å; E396-F429 HydrophobicContact CG-CZ 4.28Å; E396-S450 WeakPolarHBondContact CG-OG 3.34Å; E396-S450 PolarHBondContact OE1-OG 3.07Å
397	I	84.5	Confident	76.9	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	113	-177.1	-45.3	-62.2	0	0	0	109.8	Y328 L350 Y351 L394 G395 F429 F431 C447	Y328-I397 HydrophobicContact CE1-CD1 4.17Å; Y328-I397 HydrophobicContact CE1-CG1 4.49Å; L350-I397 HydrophobicContact CB-CD1 4.5Å; L350-I397 HydrophobicContact CB-CG2 4.33Å; L350-I397 HydrophobicContact CD2-CG2 4.32Å; Y351-I397 CarbonylContact O-C 3.53Å; Y351-I397 WeakPolarHBondContact O-CA 3.48Å; Y351-I397 WeakPolarHBondContact O-CG2 3.5Å; L394-I397 HydrophobicContact CB-CD1 3.71Å; L394-I397 HydrophobicContact CD1-CD1 3.91Å; L394-I397 HydrophobicContact CG-CD1 4.43Å; G395-I397 PolarHBondContact O-N 3.07Å; I397-F429 HydrophobicContact CB-CB 4.06Å; I397-F429 HydrophobicContact CB-CD1 4.13Å; I397-F429 HydrophobicContact CB-CD2 3.55Å; I397-F429 HydrophobicContact CB-CE2 4.04Å; I397-F429 HydrophobicContact CB-CG 3.58Å; I397-F429 HydrophobicContact CG1-CD2 3.37Å; I397-F429 HydrophobicContact CG1-CE2 3.52Å; I397-F429 HydrophobicContact CG1-CG 3.98Å; I397-F429 HydrophobicContact CG1-CZ 4.25Å; I397-F429 WeakPolarHBondContact O-CD1 3.43Å; I397-F431 HydrophobicContact CB-CZ 4.38Å; I397-F431 HydrophobicContact CG2-CE2 4.41Å; I397-F431 HydrophobicContact CG2-CZ 3.83Å; I397-C447 WeakPolarHBondContact O-CB 3.24Å; I397-C447 PolarHBondContact O-SG 2.95Å
398	T	78.2	Confident	75.9	Confident	62 Å²	62	39.2 Å²	39.2	38%	0.38	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-31.8	-175.2	60.3	0	0	0	0	112.8	Y351 E396 C447	Y351-T398 PolarHBondContact O-N 2.87Å; Y351-T398 PolarHBondContact O-OG1 3.45Å; E396-T398 PolarHBondContact O-N 2.82Å; T398-C447 VanDerWaalsContact O-CB 3.24Å; T398-C447 WeakPolarHBondContact O-CB 3.35Å; T398-C447 PolarHBondContact O-N 2.67Å
399	K	83	Confident	75.5	Confident	103 Å²	103	44.8 Å²	44.8	45%	0.448	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.2	-177	-52.4	176.9	-172.2	176.7	0	111.4	Y351 I444	Y351-K399 HydrophobicContact CD2-CB 4.19Å; Y351-K399 HydrophobicContact CG-CB 4.37Å; Y351-K399 PolarHBondContact N-O 2.75Å; Y351-K399 PolarHBondContact O-N 2.69Å; K399-I444 HydrophobicContact CB-CG2 4.22Å; K399-I444 HydrophobicContact CD-CG2 4.37Å
400	L	88.3	Confident	75.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.9	176.6	172.8	72.1	0	0	0	108.1	L330 V348 L350 V402 V418 V420 F431 I444 I445	L330-L400 HydrophobicContact CD2-CD1 4.07Å; V348-L400 HydrophobicContact CG1-CD1 4.48Å; V348-L400 HydrophobicContact CG2-CD1 3.87Å; L350-L400 HydrophobicContact CD2-CD1 3.55Å; L400-V402 HydrophobicContact CD1-CG2 4.29Å; L400-V402 HydrophobicContact CD2-CG2 3.66Å; L400-V402 HydrophobicContact CG-CG2 3.71Å; L400-V418 HydrophobicContact CD2-CB 3.53Å; L400-V418 HydrophobicContact CD2-CG1 3.71Å; L400-V418 HydrophobicContact CD2-CG2 3.88Å; L400-V420 HydrophobicContact CD1-CG2 4.26Å; L400-F431 HydrophobicContact CB-CD1 3.56Å; L400-F431 HydrophobicContact CB-CD2 4.02Å; L400-F431 HydrophobicContact CB-CE1 3.59Å; L400-F431 HydrophobicContact CB-CE2 4.03Å; L400-F431 HydrophobicContact CB-CG 3.8Å; L400-F431 HydrophobicContact CB-CZ 3.84Å; L400-F431 HydrophobicContact CD2-CB 3.83Å; L400-F431 HydrophobicContact CD2-CD1 4.34Å; L400-F431 HydrophobicContact CD2-CD2 3.82Å; L400-F431 HydrophobicContact CD2-CE2 4.48Å; L400-F431 HydrophobicContact CD2-CG 3.74Å; L400-F431 HydrophobicContact CG-CG 4.43Å; L400-I444 CarbonylContact O-C 3.53Å; L400-I444 WeakPolarHBondContact O-CA 3.39Å; L400-I445 HydrophobicContact CD2-CD1 4.23Å; L400-I445 PolarHBondContact N-O 2.87Å; L400-I445 PolarHBondContact O-N 2.91Å
401	K	85.3	Confident	75.6	Confident	13 Å²	13	44.5 Å²	44.5	6%	0.057	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.7	166.8	-174.5	-175	179.1	-173	0	108.4	Y347 V348 K349 Y351 E359 E442	Y347-K401 HydrophobicContact CE2-CD 4.15Å; Y347-K401 HydrophobicContact CE2-CG 4.3Å; Y347-K401 WeakPolarHBondContact OH-CE 3.41Å; V348-K401 WeakPolarHBondContact CA-O 3.36Å; K349-K401 HydrophobicContact CB-CB 4.11Å; K349-K401 PolarHBondContact N-O 2.74Å; K349-K401 PolarHBondContact O-N 3.2Å; Y351-K401 HydrophobicContact CE2-CB 4.24Å; E359-K401 WeakPolarHBondContact OE1-CD 3.46Å; E359-K401 WeakPolarHBondContact OE1-CE 3.32Å; E359-K401 IonicContact OE1-NZ 3.58Å; E359-K401 PolarHBondContact OE1-NZ 3.13Å; K401-E442 WeakPolarHBondContact CE-OE1 3.44Å; K401-E442 VanDerWaalsContact NZ-CD 3.28Å; K401-E442 IonicContact NZ-OE1 3.64Å; K401-E442 PolarHBondContact NZ-OE1 2.75Å; K401-E442 IonicContact NZ-OE2 3.72Å
402	V	88.4	Confident	75.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.8	173.4	-172.6	0	0	0	0	108.8	F332 V346 V348 L400 W413 L415 V418 I437 T443 I445	F332-V402 HydrophobicContact CE1-CG1 4.24Å; V346-V402 HydrophobicContact CG1-CG1 4.35Å; V348-V402 HydrophobicContact CG2-CG2 4.05Å; L400-V402 HydrophobicContact CD1-CG2 4.29Å; L400-V402 HydrophobicContact CD2-CG2 3.66Å; L400-V402 HydrophobicContact CG-CG2 3.71Å; V402-W413 HydrophobicContact CG1-CH2 4.13Å; V402-W413 HydrophobicContact CG1-CZ3 3.62Å; V402-L415 HydrophobicContact CG1-CD2 4.24Å; V402-V418 HydrophobicContact CG2-CG2 4.28Å; V402-I437 HydrophobicContact CB-CD1 4.47Å; V402-I437 HydrophobicContact CG1-CD1 4.17Å; V402-T443 PolarHBondContact N-O 3.31Å; V402-I445 HydrophobicContact CB-CD1 4.39Å; V402-I445 HydrophobicContact CG2-CD1 3.79Å
403	G	83.8	Confident	77	Confident	6 Å²	6	41 Å²	41	6%	0.062	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	178.7	171.6	0	0	0	0	0	112.2	V346 Y347	V346-G403 WeakPolarHBondContact CA-O 3.36Å; Y347-G403 VanDerWaalsContact CD1-C 3.5Å; Y347-G403 WeakPolarHBondContact CD1-O 3.2Å; Y347-G403 VanDerWaalsContact CE1-C 3.47Å; Y347-G403 VanDerWaalsContact CE1-CA 3.47Å; Y347-G403 PolarHBondContact N-O 2.76Å; Y347-G403 PolarHBondContact O-N 2.8Å
404	H	83.6	Confident	77.7	Confident	22 Å²	22	39.6 Å²	39.6	10%	0.102	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	153.5	-178.6	71.6	129.6	0	0	0	110.8	E345 R406 P411	E345-H404 CarbonylContact O-C 3.58Å; E345-H404 WeakPolarHBondContact O-CA 3.39Å; H404-R406 VanDerWaalsContact C-N 3.29Å; H404-R406 PolarHBondContact O-N 2.78Å; H404-P411 PolarHBondContact CE1-O 2.88Å; H404-P411 PolarHBondContact ND1-O 2.82Å
405	N	78.8	Confident	78.1	Confident	57 Å²	57	39.5 Å²	39.5	31%	0.305	23%	0.233	S	C	.	.			trans	-80.8	3.6	-176.7	70.6	-2.6	0	0	0	115.5	E345 W361 A407	E345-N405 WeakPolarHBondContact CB-ND2 3.12Å; E345-N405 WeakPolarHBondContact CG-ND2 3.18Å; E345-N405 PolarHBondContact N-OD1 2.95Å; E345-N405 PolarHBondContact O-N 2.73Å; E345-N405 PolarHBondContact OE2-ND2 2.73Å; W361-N405 HydrophobicContact CH2-CB 3.94Å; W361-N405 HydrophobicContact CZ3-CB 3.82Å; N405-A407 PolarHBondContact O-N 2.74Å; N405-A407 VanDerWaalsContact O-N 3.09Å; N405-A407 WeakPolarHBondContact OD1-CB 3.22Å; N405-A407 PolarHBondContact OD1-N 2.94Å
406	R	70.4	Confident	78.7	Confident	133 Å²	133	41.5 Å²	41.5	50%	0.502	24%	0.243	S	C	.	.			trans	58.6	3.3	-171.1	-77.6	-179.1	160.2	-158.4	-6.4	116.6	H404 G408 P411 T438	H404-R406 VanDerWaalsContact C-N 3.29Å; H404-R406 PolarHBondContact O-N 2.78Å; R406-G408 PolarHBondContact O-N 3.05Å; R406-P411 HydrophobicContact CB-CB 4.47Å; R406-P411 HydrophobicContact CG-CB 4.46Å; R406-T438 PolarHBondContact NH2-O 2.65Å
407	A	64.2	Low	79.5	Confident	60 Å²	60	41.1 Å²	41.1	50%	0.496	24%	0.241	S	C	.	.			trans	-79.5	101.1	-176.7	0	0	0	0	0	111.9	G344 N405	G344-A407 WeakPolarHBondContact CA-O 3.45Å; N405-A407 PolarHBondContact O-N 2.74Å; N405-A407 VanDerWaalsContact O-N 3.09Å; N405-A407 WeakPolarHBondContact OD1-CB 3.22Å; N405-A407 PolarHBondContact OD1-N 2.94Å
408	G	64.6	Low	79.7	Confident	45 Å²	45	41 Å²	41	46%	0.464	24%	0.241	S	C	.	.	S	Bend	trans	152.6	172.1	172	0	0	0	0	0	113.3	T343 R406 S410	T343-G408 VanDerWaalsContact OG1-CA 3.3Å; T343-G408 WeakPolarHBondContact OG1-CA 3.45Å; R406-G408 PolarHBondContact O-N 3.05Å; G408-S410 PolarHBondContact O-N 2.94Å
409	S	72.1	Confident	80.2	Confident	123 Å²	123	38.5 Å²	38.5	86%	0.86	23%	0.225	S	C	*	.	S	Bend	trans	-72.8	-21.8	-170.8	49.9	0	0	0	0	115.5	T343	T343-S409 PolarHBondContact OG1-N 3.17Å
410	S	69.6	Low	80.5	Confident	38 Å²	38	33.6 Å²	33.6	27%	0.266	20%	0.203	S	C	.	.			trans	-131.4	85.8	172	-177.8	0	0	0	0	109	G341 T342 T343 G408	G341-S410 PolarHBondContact O-OG 2.99Å; T342-S410 CarbonylContact C-O 3.51Å; T342-S410 VanDerWaalsContact CA-O 3.28Å; T342-S410 WeakPolarHBondContact CA-O 3.44Å; T342-S410 PolarHBondContact OG1-O 2.8Å; T343-S410 PolarHBondContact N-O 3.01Å; T343-S410 PolarHBondContact OG1-N 2.67Å; T343-S410 PolarHBondContact OG1-O 3Å; T343-S410 VanDerWaalsContact OG1-O 3.12Å; G408-S410 PolarHBondContact O-N 2.94Å
411	P	69	Low	80.4	Confident	48 Å²	48	33.8 Å²	33.8	31%	0.312	20%	0.204	S	C	.	.			trans	-79.2	-17.7	-176	30.4	-34.3	0	0	0	113.3	T342 H404 R406 W413	T342-P411 PolarHBondContact OG1-O 3.08Å; H404-P411 PolarHBondContact CE1-O 2.88Å; H404-P411 PolarHBondContact ND1-O 2.82Å; R406-P411 HydrophobicContact CB-CB 4.47Å; R406-P411 HydrophobicContact CG-CB 4.46Å; P411-W413 PolarHBondContact O-N 2.9Å
412	S	74.6	Confident	80.4	Confident	36 Å²	36	33.1 Å²	33.1	25%	0.252	20%	0.202	S	C	.	.			trans	-69.2	125.2	-177.8	44.8	0	0	0	0	112.5	G341	G341-S412 CarbonylContact C-O 3.56Å
413	W	85.3	Confident	79.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.8	178.6	-164.4	16.7	0	0	0	110.4	F332 T334 A340 T342 V346 F378 V402 P411 L415 W436 I437	F332-W413 HydrophobicContact CB-CZ2 4.35Å; F332-W413 AromaticContact CD1-CH2 3.6Å; F332-W413 HydrophobicContact CD1-CH2 3.6Å; F332-W413 AromaticContact CD1-CZ2 3.99Å; F332-W413 HydrophobicContact CD1-CZ2 3.99Å; F332-W413 AromaticContact CE1-CH2 3.97Å; F332-W413 HydrophobicContact CE1-CH2 3.97Å; F332-W413 HydrophobicContact CG-CH2 4.4Å; F332-W413 HydrophobicContact CG-CZ2 4.45Å; T334-W413 PolarHBondContact OG1-NE1 2.92Å; A340-W413 WeakPolarHBondContact O-CA 3.5Å; T342-W413 HydrophobicContact CG2-CB 3.79Å; T342-W413 HydrophobicContact CG2-CD2 3.72Å; T342-W413 HydrophobicContact CG2-CE3 4.2Å; T342-W413 HydrophobicContact CG2-CG 3.53Å; V346-W413 HydrophobicContact CG1-CH2 3.9Å; V346-W413 HydrophobicContact CG1-CZ3 3.82Å; V346-W413 HydrophobicContact CG2-CE3 4.37Å; V346-W413 HydrophobicContact CG2-CH2 3.98Å; V346-W413 HydrophobicContact CG2-CZ3 3.78Å; F378-W413 HydrophobicContact CB-CZ2 4.3Å; F378-W413 HydrophobicContact CD1-CH2 4.14Å; F378-W413 AromaticContact CD1-CZ2 3.48Å; F378-W413 HydrophobicContact CD1-CZ2 3.48Å; F378-W413 VanDerWaalsContact CD1-CZ2 3.48Å; F378-W413 HydrophobicContact CE1-CH2 4.22Å; F378-W413 AromaticContact CE1-CZ2 3.97Å; F378-W413 HydrophobicContact CE1-CZ2 3.97Å; F378-W413 AromaticContact CG-CZ2 3.98Å; F378-W413 HydrophobicContact CG-CZ2 3.98Å; V402-W413 HydrophobicContact CG1-CH2 4.13Å; V402-W413 HydrophobicContact CG1-CZ3 3.62Å; P411-W413 PolarHBondContact O-N 2.9Å; W413-L415 HydrophobicContact CH2-CD1 4.32Å; W413-L415 HydrophobicContact CH2-CD2 4.04Å; W413-L415 HydrophobicContact CZ2-CD1 3.75Å; W413-L415 HydrophobicContact CZ2-CD2 4.25Å; W413-L415 HydrophobicContact CZ2-CG 4.48Å; W413-L415 HydrophobicContact CZ3-CD2 4.2Å; W413-W436 CarbonylContact O-C 3.57Å; W413-W436 WeakPolarHBondContact O-CA 3.16Å; W413-I437 HydrophobicContact CB-CB 4.38Å; W413-I437 HydrophobicContact CE3-CD1 3.95Å; W413-I437 HydrophobicContact CZ3-CD1 4.29Å; W413-I437 PolarHBondContact N-O 3.34Å; W413-I437 PolarHBondContact O-N 3.46Å
414	F	86.7	Confident	79.3	Confident	23 Å²	23	41.1 Å²	41.1	10%	0.101	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.8	164.1	-163.7	-66.5	0	0	0	109.6	S335 A340 N416 Y434 W436	S335-F414 VanDerWaalsContact CB-CD1 3.48Å; S335-F414 PolarHBondContact N-O 3.46Å; A340-F414 HydrophobicContact CB-CB 3.77Å; A340-F414 PolarHBondContact O-N 3.08Å; F414-N416 WeakPolarHBondContact CE1-OD1 3.41Å; F414-Y434 VanDerWaalsContact CE1-C 3.43Å; F414-Y434 WeakPolarHBondContact CZ-O 3.38Å; F414-W436 HydrophobicContact CB-CD2 4.08Å; F414-W436 HydrophobicContact CB-CE3 3.92Å; F414-W436 HydrophobicContact CB-CH2 4.32Å; F414-W436 HydrophobicContact CB-CZ2 4.46Å; F414-W436 HydrophobicContact CB-CZ3 4.04Å; F414-W436 AromaticContact CD2-CD1 3.67Å; F414-W436 AromaticContact CD2-CD2 3.76Å; F414-W436 HydrophobicContact CD2-CD2 3.76Å; F414-W436 AromaticContact CD2-CE2 3.68Å; F414-W436 HydrophobicContact CD2-CE3 4.47Å; F414-W436 AromaticContact CD2-CG 3.78Å; F414-W436 HydrophobicContact CD2-CG 3.78Å; F414-W436 HydrophobicContact CD2-CZ2 4.31Å; F414-W436 AromaticContact CD2-NE1 3.59Å; F414-W436 AromaticContact CE2-CD1 4Å; F414-W436 HydrophobicContact CE2-CG 4.44Å; F414-W436 HydrophobicContact CG-CD2 4.41Å
415	L	85.3	Confident	78.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.8	-176.8	-174.5	55.9	0	0	0	109.2	F332 V402 W413 V418 C433 Y434 A435 I437 I445	F332-L415 HydrophobicContact CB-CD1 4.24Å; F332-L415 HydrophobicContact CD1-CD1 4.29Å; F332-L415 HydrophobicContact CD1-CD2 4.47Å; V402-L415 HydrophobicContact CG1-CD2 4.24Å; W413-L415 HydrophobicContact CH2-CD1 4.32Å; W413-L415 HydrophobicContact CH2-CD2 4.04Å; W413-L415 HydrophobicContact CZ2-CD1 3.75Å; W413-L415 HydrophobicContact CZ2-CD2 4.25Å; W413-L415 HydrophobicContact CZ2-CG 4.48Å; W413-L415 HydrophobicContact CZ3-CD2 4.2Å; L415-V418 HydrophobicContact CD1-CG2 4.17Å; L415-V418 HydrophobicContact CD2-CG2 3.63Å; L415-V418 HydrophobicContact CG-CG2 4.15Å; L415-C433 HydrophobicContact CB-CB 4.46Å; L415-C433 HydrophobicContact CG-CB 4.35Å; L415-C433 WeakPolarHBondContact O-CB 3.3Å; L415-Y434 WeakPolarHBondContact O-CA 3.17Å; L415-Y434 PolarHBondContact O-N 2.95Å; L415-A435 PolarHBondContact N-O 3.31Å; L415-A435 VanDerWaalsContact N-O 3.14Å; L415-A435 PolarHBondContact O-N 3.44Å; L415-I437 HydrophobicContact CB-CD1 4.21Å; L415-I437 HydrophobicContact CD2-CD1 3.73Å; L415-I445 HydrophobicContact CD2-CD1 4.43Å
416	N	83.4	Confident	78.1	Confident	43 Å²	43	43.7 Å²	43.7	23%	0.23	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-53.8	177.6	-75.6	-16.8	0	0	0	110.3	Y333 S335 F414 C433 Y434	Y333-N416 WeakPolarHBondContact O-CB 3.47Å; Y333-N416 PolarHBondContact O-N 3.09Å; S335-N416 WeakPolarHBondContact CB-OD1 3.32Å; F414-N416 WeakPolarHBondContact CE1-OD1 3.41Å; N416-C433 PolarHBondContact O-N 3.01Å; N416-Y434 HydrophobicContact CB-CD1 4.07Å; N416-Y434 HydrophobicContact CB-CE1 4.01Å; N416-Y434 WeakPolarHBondContact O-CD1 3.15Å; N416-Y434 PolarHBondContact O-N 3.34Å
417	K	89.4	Confident	78	Confident	49 Å²	49	40.2 Å²	40.2	21%	0.213	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161.4	176.2	65.6	-178.7	-175.9	177.4	0	112.1	Y333 E430 F431	Y333-K417 HydrophobicContact CD2-CD 4.41Å; Y333-K417 HydrophobicContact CD2-CG 3.69Å; Y333-K417 HydrophobicContact CE2-CG 4.44Å; Y333-K417 HydrophobicContact CG-CG 4.04Å; Y333-K417 PolarHBondContact N-O 2.88Å; K417-E430 HydrophobicContact CD-CG 4.4Å; K417-E430 VanDerWaalsContact CD-OE1 3.29Å; K417-E430 WeakPolarHBondContact CD-OE1 3.46Å; K417-E430 WeakPolarHBondContact CE-OE1 3.47Å; K417-E430 IonicContact NZ-OE1 2.67Å; K417-E430 PolarHBondContact NZ-OE1 2.82Å; K417-F431 WeakPolarHBondContact CA-O 3.01Å
418	V	89.6	Confident	78.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	143.2	162.6	-170.1	0	0	0	0	109.2	L330 T331 F332 L400 V402 L415 F431 I445	L330-V418 HydrophobicContact CB-CG1 4.5Å; L330-V418 HydrophobicContact CD2-CG1 4.12Å; T331-V418 WeakPolarHBondContact O-CA 3.48Å; F332-V418 HydrophobicContact CD1-CB 4.44Å; F332-V418 HydrophobicContact CD1-CG1 4.02Å; F332-V418 HydrophobicContact CD1-CG2 3.58Å; F332-V418 HydrophobicContact CE1-CG1 4.01Å; F332-V418 HydrophobicContact CE1-CG2 3.9Å; F332-V418 HydrophobicContact CG-CG1 4.4Å; F332-V418 HydrophobicContact CG-CG2 4.45Å; F332-V418 HydrophobicContact CZ-CG1 4.39Å; L400-V418 HydrophobicContact CD2-CB 3.53Å; L400-V418 HydrophobicContact CD2-CG1 3.71Å; L400-V418 HydrophobicContact CD2-CG2 3.88Å; V402-V418 HydrophobicContact CG2-CG2 4.28Å; L415-V418 HydrophobicContact CD1-CG2 4.17Å; L415-V418 HydrophobicContact CD2-CG2 3.63Å; L415-V418 HydrophobicContact CG-CG2 4.15Å; V418-F431 HydrophobicContact CB-CB 4.33Å; V418-F431 PolarHBondContact N-O 2.8Å; V418-F431 WeakPolarHBondContact O-CB 3.34Å; V418-F431 PolarHBondContact O-N 2.93Å; V418-I445 HydrophobicContact CG2-CD1 4.41Å
419	I	88.6	Confident	79.7	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.041	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.5	175.2	-79.4	-173.9	0	0	0	107.2	L330 T331 Y333 V428 E430	L330-I419 CarbonylContact C-O 3.03Å; L330-I419 VanDerWaalsContact CA-O 3.26Å; L330-I419 WeakPolarHBondContact CA-O 3.27Å; T331-I419 PolarHBondContact N-O 3.28Å; T331-I419 PolarHBondContact O-N 2.85Å; Y333-I419 HydrophobicContact CE2-CD1 3.83Å; Y333-I419 HydrophobicContact CE2-CG1 4.21Å; I419-V428 HydrophobicContact CG2-CG1 3.62Å; I419-E430 HydrophobicContact CG1-CG 4.36Å
420	V	90.2	Very high	80.3	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	101.3	176.3	-175.2	0	0	0	0	109	Y328 K329 L330 L350 L400 V428 F429 F431	Y328-V420 HydrophobicContact CD1-CG1 4.22Å; K329-V420 CarbonylContact O-C 3.53Å; K329-V420 WeakPolarHBondContact O-CA 3.34Å; L330-V420 HydrophobicContact CD2-CG2 4.03Å; L330-V420 HydrophobicContact CG-CG1 4.35Å; L330-V420 HydrophobicContact CG-CG2 4.03Å; L350-V420 HydrophobicContact CD1-CG1 4Å; L350-V420 HydrophobicContact CD2-CG1 3.89Å; L350-V420 HydrophobicContact CD2-CG2 3.89Å; L400-V420 HydrophobicContact CD1-CG2 4.26Å; V420-V428 VanDerWaalsContact O-CA 3.24Å; V420-V428 WeakPolarHBondContact O-CA 3.44Å; V420-V428 VanDerWaalsContact O-CG1 3.28Å; V420-V428 WeakPolarHBondContact O-CG1 3.31Å; V420-F429 HydrophobicContact CB-CB 4.39Å; V420-F429 PolarHBondContact N-O 2.8Å; V420-F429 PolarHBondContact O-N 3.45Å; V420-F431 HydrophobicContact CB-CE2 4.08Å; V420-F431 HydrophobicContact CG2-CD2 3.76Å; V420-F431 HydrophobicContact CG2-CE2 3.49Å; V420-F431 VanDerWaalsContact CG2-CE2 3.49Å
421	D	86.2	Confident	81.2	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	112	168.4	-82.8	-69.4	0	0	0	110.1	Y328 K329 L423 V428 K453 K456	Y328-D421 WeakPolarHBondContact CA-O 3.3Å; K329-D421 HydrophobicContact CB-CB 3.94Å; K329-D421 HydrophobicContact CD-CB 4.39Å; K329-D421 WeakPolarHBondContact CE-OD2 3.26Å; K329-D421 HydrophobicContact CG-CB 4.09Å; K329-D421 PolarHBondContact N-O 2.91Å; K329-D421 PolarHBondContact O-N 3.39Å; D421-L423 HydrophobicContact CB-CD2 4.01Å; D421-L423 PolarHBondContact O-N 3Å; D421-V428 WeakPolarHBondContact OD1-CG2 3.3Å; D421-K453 VanDerWaalsContact OD1-CD 3.23Å; D421-K453 WeakPolarHBondContact OD1-CD 3.26Å; D421-K453 WeakPolarHBondContact OD1-CE 3.39Å; D421-K453 IonicContact OD1-NZ 2.74Å; D421-K456 IonicContact OD1-NZ 3.29Å; D421-K456 PolarHBondContact OD1-NZ 2.76Å; D421-K456 IonicContact OD2-NZ 2.68Å; D421-K456 PolarHBondContact OD2-NZ 2.88Å
422	D	85.5	Confident	81.5	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	109.4	156.9	-172.9	-46.7	0	0	0	107.9	T326 Y328 Q393 R424 M425 N426 R427 F429	T326-D422 VanDerWaalsContact CG2-OD1 3.3Å; T326-D422 WeakPolarHBondContact CG2-OD1 3.23Å; Y328-D422 HydrophobicContact CD1-CB 3.99Å; Y328-D422 HydrophobicContact CE1-CB 3.63Å; Y328-D422 VanDerWaalsContact CE1-CG 3.46Å; Y328-D422 WeakPolarHBondContact CE1-OD2 3.41Å; Y328-D422 VanDerWaalsContact CZ-OD2 3.27Å; Y328-D422 PolarHBondContact OH-OD2 2.97Å; Q393-D422 PolarHBondContact NE2-OD1 3.37Å; Q393-D422 PolarHBondContact NE2-OD2 3.07Å; Q393-D422 PolarHBondContact OE1-OD2 3.1Å; D422-R424 PolarHBondContact O-N 3.32Å; D422-R424 WeakPolarHBondContact OD1-CA 3.43Å; D422-R424 PolarHBondContact OD1-N 3.46Å; D422-M425 HydrophobicContact CB-CB 4.13Å; D422-M425 PolarHBondContact OD1-N 2.92Å; D422-M425 WeakPolarHBondContact OD2-CG 3.4Å; D422-N426 PolarHBondContact O-N 2.74Å; D422-R427 PolarHBondContact N-O 3.4Å; D422-R427 PolarHBondContact O-N 3.38Å; D422-F429 HydrophobicContact CB-CE2 4.16Å
423	L	77.1	Confident	81.9	Confident	55 Å²	55	27.4 Å²	27.4	29%	0.288	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.8	-174.9	-59	-179.6	0	0	0	112.9	E327 K329 Y387 D421 K453	E327-L423 HydrophobicContact CB-CD1 3.86Å; E327-L423 VanDerWaalsContact O-CB 3.31Å; E327-L423 WeakPolarHBondContact O-CB 3.19Å; E327-L423 WeakPolarHBondContact O-CG 3.36Å; E327-L423 PolarHBondContact O-N 3.07Å; K329-L423 HydrophobicContact CB-CD1 4.24Å; K329-L423 HydrophobicContact CB-CD2 4.01Å; K329-L423 HydrophobicContact CB-CG 4.26Å; Y387-L423 HydrophobicContact CD1-CD1 3.99Å; Y387-L423 HydrophobicContact CE1-CD1 3.92Å; D421-L423 HydrophobicContact CB-CD2 4.01Å; D421-L423 PolarHBondContact O-N 3Å; L423-K453 VanDerWaalsContact CD2-NZ 3.29Å
424	R	70.9	Confident	81.8	Confident	120 Å²	120	34.5 Å²	34.5	45%	0.453	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-42.1	-172.8	-167.2	-172.4	-169.6	82.3	10.9	113.8	V324 E325 T326 D422 N426	V324-R424 PolarHBondContact O-NE 2.88Å; V324-R424 PolarHBondContact O-NH1 3.25Å; V324-R424 VanDerWaalsContact O-NH1 3.12Å; V324-R424 PolarHBondContact O-NH2 2.96Å; E325-R424 PolarHBondContact O-NH1 2.83Å; T326-R424 HydrophobicContact CG2-CB 3.79Å; T326-R424 WeakPolarHBondContact OG1-CD 3.28Å; D422-R424 PolarHBondContact O-N 3.32Å; D422-R424 WeakPolarHBondContact OD1-CA 3.43Å; D422-R424 PolarHBondContact OD1-N 3.46Å; R424-N426 PolarHBondContact O-N 3.04Å
425	M	66.5	Low	81.6	Confident	74 Å²	74	35.2 Å²	35.2	37%	0.365	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-12	170.3	-75.5	-105	58.5	0	0	112.3	Q393 D422 R427	Q393-M425 HydrophobicContact CG-CG 4.36Å; Q393-M425 VanDerWaalsContact NE2-CG 3.31Å; D422-M425 HydrophobicContact CB-CB 4.13Å; D422-M425 PolarHBondContact OD1-N 2.92Å; D422-M425 WeakPolarHBondContact OD2-CG 3.4Å; M425-R427 VanDerWaalsContact C-N 3.27Å; M425-R427 HydrophobicContact CB-CB 3.88Å; M425-R427 HydrophobicContact CB-CG 4.34Å; M425-R427 PolarHBondContact O-N 3.37Å
426	N	70.4	Confident	81.5	Confident	58 Å²	58	40.3 Å²	40.3	31%	0.31	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	55.4	-165.4	-148.3	39.3	0	0	0	109.1	D422 R424 K453 E454	D422-N426 PolarHBondContact O-N 2.74Å; R424-N426 PolarHBondContact O-N 3.04Å; N426-K453 HydrophobicContact CB-CB 4.34Å; N426-K453 WeakPolarHBondContact O-CB 3.33Å; N426-K453 PolarHBondContact O-N 2.93Å; N426-K453 WeakPolarHBondContact OD1-CB 3.47Å; N426-K453 WeakPolarHBondContact OD1-CD 3.44Å; N426-E454 PolarHBondContact ND2-OE1 2.99Å
427	R	67.8	Low	81.3	Confident	60 Å²	60	38.4 Å²	38.4	23%	0.226	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.9	-176.8	-94.9	179	152.9	-149.2	-20	111.2	E396 D422 M425 F429 I451 K452	E396-R427 IonicContact OE1-CZ 2.69Å; E396-R427 IonicContact OE1-NH1 2.8Å; E396-R427 PolarHBondContact OE1-NH1 2.87Å; E396-R427 IonicContact OE1-NH2 3.17Å; E396-R427 PolarHBondContact OE1-NH2 2.95Å; D422-R427 PolarHBondContact N-O 3.4Å; D422-R427 PolarHBondContact O-N 3.38Å; M425-R427 VanDerWaalsContact C-N 3.27Å; M425-R427 HydrophobicContact CB-CB 3.88Å; M425-R427 HydrophobicContact CB-CG 4.34Å; M425-R427 PolarHBondContact O-N 3.37Å; R427-F429 HydrophobicContact CB-CE2 4.05Å; R427-F429 HydrophobicContact CB-CZ 3.7Å; R427-F429 HydrophobicContact CG-CZ 4.42Å; R427-I451 CarbonylContact C-O 3.52Å; R427-I451 WeakPolarHBondContact CA-O 3.3Å; R427-K452 HydrophobicContact CG-CG 4.16Å
428	V	80.6	Confident	80.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	142.1	-179	-160.8	0	0	0	0	110.7	I419 V420 D421 I451 K453 K456	I419-V428 HydrophobicContact CG2-CG1 3.62Å; V420-V428 VanDerWaalsContact O-CA 3.24Å; V420-V428 WeakPolarHBondContact O-CA 3.44Å; V420-V428 VanDerWaalsContact O-CG1 3.28Å; V420-V428 WeakPolarHBondContact O-CG1 3.31Å; D421-V428 WeakPolarHBondContact OD1-CG2 3.3Å; V428-I451 PolarHBondContact N-O 2.91Å; V428-I451 WeakPolarHBondContact O-CA 3.47Å; V428-I451 WeakPolarHBondContact O-CB 3.48Å; V428-I451 PolarHBondContact O-N 2.82Å; V428-K453 HydrophobicContact CG2-CB 3.72Å; V428-K453 HydrophobicContact CG2-CD 4.19Å; V428-K453 HydrophobicContact CG2-CG 3.74Å; V428-K456 HydrophobicContact CB-CB 3.81Å; V428-K456 HydrophobicContact CB-CD 4.45Å; V428-K456 HydrophobicContact CB-CG 3.68Å; V428-K456 HydrophobicContact CG1-CB 4.49Å; V428-K456 HydrophobicContact CG1-CD 4.33Å; V428-K456 HydrophobicContact CG1-CG 3.79Å; V428-K456 HydrophobicContact CG2-CB 3.52Å; V428-K456 HydrophobicContact CG2-CD 3.95Å; V428-K456 HydrophobicContact CG2-CG 3.58Å
429	F	85.4	Confident	78.5	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.2	-177.3	-51.3	-72.8	0	0	0	107.1	E396 I397 V420 D422 R427 F431	E396-F429 HydrophobicContact CB-CE1 4.4Å; E396-F429 HydrophobicContact CG-CD1 4.39Å; E396-F429 HydrophobicContact CG-CE1 3.57Å; E396-F429 HydrophobicContact CG-CZ 4.28Å; I397-F429 HydrophobicContact CB-CB 4.06Å; I397-F429 HydrophobicContact CB-CD1 4.13Å; I397-F429 HydrophobicContact CB-CD2 3.55Å; I397-F429 HydrophobicContact CB-CE2 4.04Å; I397-F429 HydrophobicContact CB-CG 3.58Å; I397-F429 HydrophobicContact CG1-CD2 3.37Å; I397-F429 HydrophobicContact CG1-CE2 3.52Å; I397-F429 HydrophobicContact CG1-CG 3.98Å; I397-F429 HydrophobicContact CG1-CZ 4.25Å; I397-F429 WeakPolarHBondContact O-CD1 3.43Å; V420-F429 HydrophobicContact CB-CB 4.39Å; V420-F429 PolarHBondContact N-O 2.8Å; V420-F429 PolarHBondContact O-N 3.45Å; D422-F429 HydrophobicContact CB-CE2 4.16Å; R427-F429 HydrophobicContact CB-CE2 4.05Å; R427-F429 HydrophobicContact CB-CZ 3.7Å; R427-F429 HydrophobicContact CG-CZ 4.42Å; F429-F431 HydrophobicContact CB-CD2 4.35Å; F429-F431 HydrophobicContact CB-CE2 3.44Å; F429-F431 VanDerWaalsContact CB-CE2 3.44Å; F429-F431 HydrophobicContact CB-CZ 3.82Å; F429-F431 VanDerWaalsContact O-CD2 3.3Å; F429-F431 WeakPolarHBondContact O-CD2 3.41Å; F429-F431 WeakPolarHBondContact O-CE2 3.18Å
430	E	84.1	Confident	76.4	Confident	35 Å²	35	50.6 Å²	50.6	16%	0.164	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.7	-178.4	-170.4	164.5	-136.3	0	0	110	K417 I419 P432 Q448 K449 I451	K417-E430 HydrophobicContact CD-CG 4.4Å; K417-E430 VanDerWaalsContact CD-OE1 3.29Å; K417-E430 WeakPolarHBondContact CD-OE1 3.46Å; K417-E430 WeakPolarHBondContact CE-OE1 3.47Å; K417-E430 IonicContact NZ-OE1 2.67Å; K417-E430 PolarHBondContact NZ-OE1 2.82Å; I419-E430 HydrophobicContact CG1-CG 4.36Å; E430-P432 HydrophobicContact CG-CG 4.32Å; E430-P432 WeakPolarHBondContact O-CD 3.49Å; E430-Q448 PolarHBondContact O-N 3.16Å; E430-Q448 VanDerWaalsContact O-N 3.09Å; E430-K449 PolarHBondContact N-O 3.17Å; E430-K449 VanDerWaalsContact N-O 3.08Å; E430-I451 HydrophobicContact CB-CD1 3.93Å
431	F	87.8	Confident	74.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	79.7	-175.9	-64.1	-83.2	0	0	0	109.8	I397 L400 K417 V418 V420 F429 I445 C447	I397-F431 HydrophobicContact CB-CZ 4.38Å; I397-F431 HydrophobicContact CG2-CE2 4.41Å; I397-F431 HydrophobicContact CG2-CZ 3.83Å; L400-F431 HydrophobicContact CB-CD1 3.56Å; L400-F431 HydrophobicContact CB-CD2 4.02Å; L400-F431 HydrophobicContact CB-CE1 3.59Å; L400-F431 HydrophobicContact CB-CE2 4.03Å; L400-F431 HydrophobicContact CB-CG 3.8Å; L400-F431 HydrophobicContact CB-CZ 3.84Å; L400-F431 HydrophobicContact CD2-CB 3.83Å; L400-F431 HydrophobicContact CD2-CD1 4.34Å; L400-F431 HydrophobicContact CD2-CD2 3.82Å; L400-F431 HydrophobicContact CD2-CE2 4.48Å; L400-F431 HydrophobicContact CD2-CG 3.74Å; L400-F431 HydrophobicContact CG-CG 4.43Å; K417-F431 WeakPolarHBondContact CA-O 3.01Å; V418-F431 HydrophobicContact CB-CB 4.33Å; V418-F431 PolarHBondContact N-O 2.8Å; V418-F431 WeakPolarHBondContact O-CB 3.34Å; V418-F431 PolarHBondContact O-N 2.93Å; V420-F431 HydrophobicContact CB-CE2 4.08Å; V420-F431 HydrophobicContact CG2-CD2 3.76Å; V420-F431 HydrophobicContact CG2-CE2 3.49Å; V420-F431 VanDerWaalsContact CG2-CE2 3.49Å; F429-F431 HydrophobicContact CB-CD2 4.35Å; F429-F431 HydrophobicContact CB-CE2 3.44Å; F429-F431 VanDerWaalsContact CB-CE2 3.44Å; F429-F431 HydrophobicContact CB-CZ 3.82Å; F429-F431 VanDerWaalsContact O-CD2 3.3Å; F429-F431 WeakPolarHBondContact O-CD2 3.41Å; F429-F431 WeakPolarHBondContact O-CE2 3.18Å; F431-I445 HydrophobicContact CB-CB 4.2Å; F431-I445 HydrophobicContact CB-CG2 3.67Å; F431-I445 HydrophobicContact CD1-CB 4.34Å; F431-I445 HydrophobicContact CD1-CG2 4.28Å; F431-I445 WeakPolarHBondContact CD1-O 2.98Å; F431-I445 HydrophobicContact CG-CG2 4.48Å; F431-C447 HydrophobicContact CD1-CB 4.15Å; F431-C447 VanDerWaalsContact CE1-CA 3.44Å; F431-C447 HydrophobicContact CE1-CB 3.49Å; F431-C447 VanDerWaalsContact CE1-CB 3.49Å; F431-C447 VanDerWaalsContact CE1-N 3.3Å; F431-C447 HydrophobicContact CZ-CB 3.85Å
432	P	77	Confident	72.7	Confident	21 Å²	21	59.7 Å²	59.7	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	135.8	171.8	-20.7	35.4	0	0	0	110.5	E430 Y434 I445 Q448	E430-P432 HydrophobicContact CG-CG 4.32Å; E430-P432 WeakPolarHBondContact O-CD 3.49Å; P432-Y434 HydrophobicContact CB-CD2 4.1Å; P432-Y434 HydrophobicContact CB-CE2 3.72Å; P432-I445 VanDerWaalsContact O-CG2 3.24Å; P432-I445 WeakPolarHBondContact O-CG2 3.28Å; P432-Q448 HydrophobicContact CG-CB 4.1Å; P432-Q448 HydrophobicContact CG-CG 4.15Å
433	C	82.2	Confident	71.6	Confident	25 Å²	25	61.6 Å²	61.6	17%	0.169	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-50.4	-175.9	-176.4	0	0	0	0	110.9	L415 N416 A435 I445	L415-C433 HydrophobicContact CB-CB 4.46Å; L415-C433 HydrophobicContact CG-CB 4.35Å; L415-C433 WeakPolarHBondContact O-CB 3.3Å; N416-C433 PolarHBondContact O-N 3.01Å; C433-A435 WeakPolarHBondContact O-CB 3.4Å; C433-A435 PolarHBondContact O-N 3Å; C433-A435 VanDerWaalsContact O-N 3.12Å; C433-I445 HydrophobicContact CB-CD1 3.95Å; C433-I445 HydrophobicContact CB-CG1 4.5Å
434	Y	84.1	Confident	71.3	Confident	149 Å²	149	62.9 Å²	62.9	58%	0.584	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	43.4	40.8	-179.6	-57.4	-64.2	0	0	0	114	F414 L415 N416 P432	F414-Y434 VanDerWaalsContact CE1-C 3.43Å; F414-Y434 WeakPolarHBondContact CZ-O 3.38Å; L415-Y434 WeakPolarHBondContact O-CA 3.17Å; L415-Y434 PolarHBondContact O-N 2.95Å; N416-Y434 HydrophobicContact CB-CD1 4.07Å; N416-Y434 HydrophobicContact CB-CE1 4.01Å; N416-Y434 WeakPolarHBondContact O-CD1 3.15Å; N416-Y434 PolarHBondContact O-N 3.34Å; P432-Y434 HydrophobicContact CB-CD2 4.1Å; P432-Y434 HydrophobicContact CB-CE2 3.72Å
435	A	81.5	Confident	71.3	Confident	39 Å²	39	57.6 Å²	57.6	32%	0.322	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	158	-170.3	0	0	0	0	0	114.3	L415 C433 I437	L415-A435 PolarHBondContact N-O 3.31Å; L415-A435 VanDerWaalsContact N-O 3.14Å; L415-A435 PolarHBondContact O-N 3.44Å; C433-A435 WeakPolarHBondContact O-CB 3.4Å; C433-A435 PolarHBondContact O-N 3Å; C433-A435 VanDerWaalsContact O-N 3.12Å; A435-I437 PolarHBondContact O-N 3.14Å
436	W	82.7	Confident	71.6	Confident	106 Å²	106	58.3 Å²	58.3	40%	0.402	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	102.6	173.4	-79.4	112.8	0	0	0	112.3	D339 W413 F414 T438	D339-W436 WeakPolarHBondContact O-CH2 3.09Å; W413-W436 CarbonylContact O-C 3.57Å; W413-W436 WeakPolarHBondContact O-CA 3.16Å; F414-W436 HydrophobicContact CB-CD2 4.08Å; F414-W436 HydrophobicContact CB-CE3 3.92Å; F414-W436 HydrophobicContact CB-CH2 4.32Å; F414-W436 HydrophobicContact CB-CZ2 4.46Å; F414-W436 HydrophobicContact CB-CZ3 4.04Å; F414-W436 AromaticContact CD2-CD1 3.67Å; F414-W436 AromaticContact CD2-CD2 3.76Å; F414-W436 HydrophobicContact CD2-CD2 3.76Å; F414-W436 AromaticContact CD2-CE2 3.68Å; F414-W436 HydrophobicContact CD2-CE3 4.47Å; F414-W436 AromaticContact CD2-CG 3.78Å; F414-W436 HydrophobicContact CD2-CG 3.78Å; F414-W436 HydrophobicContact CD2-CZ2 4.31Å; F414-W436 AromaticContact CD2-NE1 3.59Å; F414-W436 AromaticContact CE2-CD1 4Å; F414-W436 HydrophobicContact CE2-CG 4.44Å; F414-W436 HydrophobicContact CG-CD2 4.41Å; W436-T438 HydrophobicContact CB-CG2 3.89Å; W436-T438 HydrophobicContact CE3-CG2 4.34Å; W436-T438 PolarHBondContact O-N 3.13Å; W436-T438 PolarHBondContact O-OG1 3.2Å
437	I	80	Confident	70.9	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	104.5	168.3	-55.6	-180	0	0	0	107.7	V402 W413 L415 A435 T443	V402-I437 HydrophobicContact CB-CD1 4.47Å; V402-I437 HydrophobicContact CG1-CD1 4.17Å; W413-I437 HydrophobicContact CB-CB 4.38Å; W413-I437 HydrophobicContact CE3-CD1 3.95Å; W413-I437 HydrophobicContact CZ3-CD1 4.29Å; W413-I437 PolarHBondContact N-O 3.34Å; W413-I437 PolarHBondContact O-N 3.46Å; L415-I437 HydrophobicContact CB-CD1 4.21Å; L415-I437 HydrophobicContact CD2-CD1 3.73Å; A435-I437 PolarHBondContact O-N 3.14Å; I437-T443 HydrophobicContact CG1-CG2 4.49Å
438	T	67.4	Low	70.5	Confident	56 Å²	56	61.4 Å²	61.4	34%	0.344	32%	0.322	S	S	.	.			trans	-142.4	-11.9	-169.8	49.3	0	0	0	0	114.9	R406 W436	R406-T438 PolarHBondContact NH2-O 2.65Å; W436-T438 HydrophobicContact CB-CG2 3.89Å; W436-T438 HydrophobicContact CE3-CG2 4.34Å; W436-T438 PolarHBondContact O-N 3.13Å; W436-T438 PolarHBondContact O-OG1 3.2Å
439	K	51.9	Low	69.1	Low	146 Å²	146	65.5 Å²	65.5	64%	0.635	34%	0.34	S	S	*	.	S	Bend	trans	-126.3	153.7	-179	-74.3	-175.9	177.6	178.3	0	110.9	S441	K439-S441 PolarHBondContact O-N 3.03Å; K439-S441 VanDerWaalsContact O-N 3.08Å
440	P	44.9	Very low	67.6	Low	110 Å²	110	67.6 Å²	67.6	71%	0.714	36%	0.355	S	S	*	.	S	Bend	trans	-66.7	-5.4	178.9	-20.9	34	0	0	0	115.5	E442	P440-E442 PolarHBondContact O-N 2.93Å
441	S	44.2	Very low	65.9	Low	85 Å²	85	66.2 Å²	66.2	59%	0.594	35%	0.348	S	S	*	.	S	Bend	trans	-64.4	112.6	173.8	49.4	0	0	0	0	110.3	K439 T443	K439-S441 PolarHBondContact O-N 3.03Å; K439-S441 VanDerWaalsContact O-N 3.08Å; S441-T443 PolarHBondContact O-N 3.04Å
442	E	55.1	Low	63.9	Low	110 Å²	110	69.9 Å²	69.9	51%	0.514	36%	0.364	S	S	.	.			trans	-50	115.4	-170.5	-50.6	-166.1	145.8	0	0	112.9	K401 P440 I444	K401-E442 WeakPolarHBondContact CE-OE1 3.44Å; K401-E442 VanDerWaalsContact NZ-CD 3.28Å; K401-E442 IonicContact NZ-OE1 3.64Å; K401-E442 PolarHBondContact NZ-OE1 2.75Å; K401-E442 IonicContact NZ-OE2 3.72Å; P440-E442 PolarHBondContact O-N 2.93Å; E442-I444 VanDerWaalsContact C-N 3.34Å; E442-I444 HydrophobicContact CB-CG1 4.42Å; E442-I444 PolarHBondContact O-N 2.89Å
443	T	61.3	Low	62.3	Low	41 Å²	41	71.9 Å²	71.9	25%	0.252	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	84.4	175.8	-56.2	0	0	0	0	108.8	V402 I437 S441 I445	V402-T443 PolarHBondContact N-O 3.31Å; I437-T443 HydrophobicContact CG1-CG2 4.49Å; S441-T443 PolarHBondContact O-N 3.04Å; T443-I445 HydrophobicContact CG2-CG1 4Å; T443-I445 PolarHBondContact O-N 3.34Å
444	I	70.6	Confident	60.3	Low	81 Å²	81	74 Å²	74	42%	0.415	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	104.2	170.5	-58.6	177.6	0	0	0	107.8	K399 L400 E442	K399-I444 HydrophobicContact CB-CG2 4.22Å; K399-I444 HydrophobicContact CD-CG2 4.37Å; L400-I444 CarbonylContact O-C 3.53Å; L400-I444 WeakPolarHBondContact O-CA 3.39Å; E442-I444 VanDerWaalsContact C-N 3.34Å; E442-I444 HydrophobicContact CB-CG1 4.42Å; E442-I444 PolarHBondContact O-N 2.89Å
445	I	72	Confident	58.1	Low	10 Å²	10	71.9 Å²	71.9	5%	0.051	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.9	175.8	-44.5	167.2	0	0	0	107.6	L400 V402 L415 V418 F431 P432 C433 T443	L400-I445 HydrophobicContact CD2-CD1 4.23Å; L400-I445 PolarHBondContact N-O 2.87Å; L400-I445 PolarHBondContact O-N 2.91Å; V402-I445 HydrophobicContact CB-CD1 4.39Å; V402-I445 HydrophobicContact CG2-CD1 3.79Å; L415-I445 HydrophobicContact CD2-CD1 4.43Å; V418-I445 HydrophobicContact CG2-CD1 4.41Å; F431-I445 HydrophobicContact CB-CB 4.2Å; F431-I445 HydrophobicContact CB-CG2 3.67Å; F431-I445 HydrophobicContact CD1-CB 4.34Å; F431-I445 HydrophobicContact CD1-CG2 4.28Å; F431-I445 WeakPolarHBondContact CD1-O 2.98Å; F431-I445 HydrophobicContact CG-CG2 4.48Å; P432-I445 VanDerWaalsContact O-CG2 3.24Å; P432-I445 WeakPolarHBondContact O-CG2 3.28Å; C433-I445 HydrophobicContact CB-CD1 3.95Å; C433-I445 HydrophobicContact CB-CG1 4.5Å; T443-I445 HydrophobicContact CG2-CG1 4Å; T443-I445 PolarHBondContact O-N 3.34Å
446	V	72.1	Confident	55.8	Low	88 Å²	88	72.8 Å²	72.8	53%	0.533	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	142	178.7	-174.8	0	0	0	0	109.2	Q448	V446-Q448 PolarHBondContact O-N 3Å; V446-Q448 VanDerWaalsContact O-N 3.14Å
447	C	57.3	Low	53.4	Low	26 Å²	26	71.5 Å²	71.5	18%	0.176	37%	0.368	C	S	.	.			trans	-64.4	112.2	177.3	-168.8	0	0	0	0	109.2	I397 T398 F431 K449	I397-C447 WeakPolarHBondContact O-CB 3.24Å; I397-C447 PolarHBondContact O-SG 2.95Å; T398-C447 VanDerWaalsContact O-CB 3.24Å; T398-C447 WeakPolarHBondContact O-CB 3.35Å; T398-C447 PolarHBondContact O-N 2.67Å; F431-C447 HydrophobicContact CD1-CB 4.15Å; F431-C447 VanDerWaalsContact CE1-CA 3.44Å; F431-C447 HydrophobicContact CE1-CB 3.49Å; F431-C447 VanDerWaalsContact CE1-CB 3.49Å; F431-C447 VanDerWaalsContact CE1-N 3.3Å; F431-C447 HydrophobicContact CZ-CB 3.85Å; C447-K449 VanDerWaalsContact C-N 3.3Å; C447-K449 PolarHBondContact SG-O 3.47Å
448	Q	59	Low	51.4	Low	158 Å²	158	73.7 Å²	73.7	74%	0.738	38%	0.38	S	S	*	.	S	Bend	trans	-76.8	-24.2	173.6	-82.7	-159.6	-7.3	0	0	111.6	E430 P432 V446	E430-Q448 PolarHBondContact O-N 3.16Å; E430-Q448 VanDerWaalsContact O-N 3.09Å; P432-Q448 HydrophobicContact CG-CB 4.1Å; P432-Q448 HydrophobicContact CG-CG 4.15Å; V446-Q448 PolarHBondContact O-N 3Å; V446-Q448 VanDerWaalsContact O-N 3.14Å
449	K	51.4	Low	49.9	Very low	86 Å²	86	74.1 Å²	74.1	37%	0.374	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	113.5	-177.5	-141.4	166.6	167	-172.4	0	110	E430 C447 I451 I458	E430-K449 PolarHBondContact N-O 3.17Å; E430-K449 VanDerWaalsContact N-O 3.08Å; C447-K449 VanDerWaalsContact C-N 3.3Å; C447-K449 PolarHBondContact SG-O 3.47Å; K449-I451 HydrophobicContact CB-CD1 4.25Å; K449-I451 HydrophobicContact CB-CG1 3.91Å; K449-I451 HydrophobicContact CG-CG1 3.99Å; K449-I451 WeakPolarHBondContact O-CG1 3.07Å; K449-I458 HydrophobicContact CD-CD1 3.65Å; K449-I458 VanDerWaalsContact NZ-CD1 3.3Å
450	S	52.3	Low	49.3	Very low	44 Å²	44	74.1 Å²	74.1	31%	0.308	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	132.4	156	174.1	0	0	0	0	107.6	E396	E396-S450 WeakPolarHBondContact CG-OG 3.34Å; E396-S450 PolarHBondContact OE1-OG 3.07Å
451	I	49.7	Very low	49.3	Very low	6 Å²	6	72.4 Å²	72.4	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.5	-171.1	-33.1	162.1	0	0	0	106.9	R427 V428 E430 K449 E455 K456 I458	R427-I451 CarbonylContact C-O 3.52Å; R427-I451 WeakPolarHBondContact CA-O 3.3Å; V428-I451 PolarHBondContact N-O 2.91Å; V428-I451 WeakPolarHBondContact O-CA 3.47Å; V428-I451 WeakPolarHBondContact O-CB 3.48Å; V428-I451 PolarHBondContact O-N 2.82Å; E430-I451 HydrophobicContact CB-CD1 3.93Å; K449-I451 HydrophobicContact CB-CD1 4.25Å; K449-I451 HydrophobicContact CB-CG1 3.91Å; K449-I451 HydrophobicContact CG-CG1 3.99Å; K449-I451 WeakPolarHBondContact O-CG1 3.07Å; I451-E455 HydrophobicContact CG2-CB 3.49Å; I451-E455 VanDerWaalsContact CG2-CB 3.49Å; I451-E455 WeakPolarHBondContact CG2-O 3.27Å; I451-K456 HydrophobicContact CB-CB 4.41Å; I451-K456 HydrophobicContact CD1-CB 4.47Å; I451-K456 HydrophobicContact CD1-CG 4.48Å; I451-K456 HydrophobicContact CG2-CB 4.22Å; I451-I458 HydrophobicContact CD1-CD1 3.52Å; I451-I458 HydrophobicContact CD1-CG1 4.35Å; I451-I458 HydrophobicContact CG1-CD1 4.18Å; I451-I458 HydrophobicContact CG2-CD1 4.35Å; I451-I458 HydrophobicContact CG2-CG1 4.24Å
452	K	44.3	Very low	50.1	Low	76 Å²	76	73.5 Å²	73.5	33%	0.33	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	159.8	159.5	-70.6	174.6	134.8	-143.6	0	109.8	R427 E454 E455 K456	R427-K452 HydrophobicContact CG-CG 4.16Å; K452-E454 VanDerWaalsContact C-N 3.26Å; K452-E454 HydrophobicContact CB-CB 4.1Å; K452-E454 IonicContact NZ-OE2 2.82Å; K452-E454 PolarHBondContact NZ-OE2 3.03Å; K452-E455 HydrophobicContact CB-CB 3.97Å; K452-E455 HydrophobicContact CB-CG 3.86Å; K452-E455 VanDerWaalsContact CB-OE2 3.32Å; K452-E455 WeakPolarHBondContact CB-OE2 3.26Å; K452-E455 WeakPolarHBondContact CG-OE2 3.13Å; K452-E455 PolarHBondContact N-OE2 2.75Å; K452-E455 CarbonylContact O-C 3.56Å; K452-E455 VanDerWaalsContact O-C 3.27Å; K452-E455 WeakPolarHBondContact O-CA 3.26Å; K452-E455 WeakPolarHBondContact O-CB 3.3Å; K452-E455 PolarHBondContact O-N 2.88Å; K452-K456 WeakPolarHBondContact O-CB 3.44Å; K452-K456 PolarHBondContact O-N 2.84Å
453	K	44.3	Very low	50.8	Low	63 Å²	63	68.3 Å²	68.3	27%	0.274	33%	0.328	S	S	.	.	H	α-helix	trans	-72.6	-28.2	171.9	-164	164.9	168.8	-163.1	0	110.9	D421 L423 N426 V428 E455 K456	D421-K453 VanDerWaalsContact OD1-CD 3.23Å; D421-K453 WeakPolarHBondContact OD1-CD 3.26Å; D421-K453 WeakPolarHBondContact OD1-CE 3.39Å; D421-K453 IonicContact OD1-NZ 2.74Å; L423-K453 VanDerWaalsContact CD2-NZ 3.29Å; N426-K453 HydrophobicContact CB-CB 4.34Å; N426-K453 WeakPolarHBondContact O-CB 3.33Å; N426-K453 PolarHBondContact O-N 2.93Å; N426-K453 WeakPolarHBondContact OD1-CB 3.47Å; N426-K453 WeakPolarHBondContact OD1-CD 3.44Å; V428-K453 HydrophobicContact CG2-CB 3.72Å; V428-K453 HydrophobicContact CG2-CD 4.19Å; V428-K453 HydrophobicContact CG2-CG 3.74Å; K453-E455 PolarHBondContact O-N 2.92Å; K453-K456 PolarHBondContact O-N 2.6Å
454	E	41	Very low	51.5	Low	69 Å²	69	67.1 Å²	67.1	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-60	-16.3	158.7	-66.4	136.8	-134.7	0	0	114.5	N426 K452	N426-E454 PolarHBondContact ND2-OE1 2.99Å; K452-E454 VanDerWaalsContact C-N 3.26Å; K452-E454 HydrophobicContact CB-CB 4.1Å; K452-E454 IonicContact NZ-OE2 2.82Å; K452-E454 PolarHBondContact NZ-OE2 3.03Å
455	E	36.3	Very low	52	Low	105 Å²	105	63.3 Å²	63.3	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-120.4	-6.7	-178.2	-68.4	165.5	165	0	0	112.2	I451 K452 K453 E457 I458	I451-E455 HydrophobicContact CG2-CB 3.49Å; I451-E455 VanDerWaalsContact CG2-CB 3.49Å; I451-E455 WeakPolarHBondContact CG2-O 3.27Å; K452-E455 HydrophobicContact CB-CB 3.97Å; K452-E455 HydrophobicContact CB-CG 3.86Å; K452-E455 VanDerWaalsContact CB-OE2 3.32Å; K452-E455 WeakPolarHBondContact CB-OE2 3.26Å; K452-E455 WeakPolarHBondContact CG-OE2 3.13Å; K452-E455 PolarHBondContact N-OE2 2.75Å; K452-E455 CarbonylContact O-C 3.56Å; K452-E455 VanDerWaalsContact O-C 3.27Å; K452-E455 WeakPolarHBondContact O-CA 3.26Å; K452-E455 WeakPolarHBondContact O-CB 3.3Å; K452-E455 PolarHBondContact O-N 2.88Å; K453-E455 PolarHBondContact O-N 2.92Å; E455-E457 VanDerWaalsContact C-N 3.3Å; E455-E457 CarbonylContact O-C 3.45Å; E455-E457 VanDerWaalsContact O-O 3.13Å; E455-I458 WeakPolarHBondContact O-CG1 3.48Å; E455-I458 PolarHBondContact O-N 2.82Å
456	K	33	Very low	52.6	Low	59 Å²	59	65.2 Å²	65.2	26%	0.257	31%	0.31	S	S	.	.	H	α-helix	trans	-84.3	-12.6	178.1	176.9	-99.6	-153.8	91.7	0	112.1	D421 V428 I451 K452 K453 I458	D421-K456 IonicContact OD1-NZ 3.29Å; D421-K456 PolarHBondContact OD1-NZ 2.76Å; D421-K456 IonicContact OD2-NZ 2.68Å; D421-K456 PolarHBondContact OD2-NZ 2.88Å; V428-K456 HydrophobicContact CB-CB 3.81Å; V428-K456 HydrophobicContact CB-CD 4.45Å; V428-K456 HydrophobicContact CB-CG 3.68Å; V428-K456 HydrophobicContact CG1-CB 4.49Å; V428-K456 HydrophobicContact CG1-CD 4.33Å; V428-K456 HydrophobicContact CG1-CG 3.79Å; V428-K456 HydrophobicContact CG2-CB 3.52Å; V428-K456 HydrophobicContact CG2-CD 3.95Å; V428-K456 HydrophobicContact CG2-CG 3.58Å; I451-K456 HydrophobicContact CB-CB 4.41Å; I451-K456 HydrophobicContact CD1-CB 4.47Å; I451-K456 HydrophobicContact CD1-CG 4.48Å; I451-K456 HydrophobicContact CG2-CB 4.22Å; K452-K456 WeakPolarHBondContact O-CB 3.44Å; K452-K456 PolarHBondContact O-N 2.84Å; K453-K456 PolarHBondContact O-N 2.6Å; K456-I458 PolarHBondContact O-N 2.78Å
457	E	34.1	Very low	53.3	Low	78 Å²	78	61 Å²	61	36%	0.364	28%	0.284	S	S	.	.				-38.8	53.8	116.5	-72.2	-99.5	93.3	0	0	114.1	E455 I459	E455-E457 VanDerWaalsContact C-N 3.3Å; E455-E457 CarbonylContact O-C 3.45Å; E455-E457 VanDerWaalsContact O-O 3.13Å; E457-I459 HydrophobicContact CB-CD1 4.13Å; E457-I459 HydrophobicContact CB-CG1 3.75Å; E457-I459 VanDerWaalsContact CD-CD1 3.49Å; E457-I459 HydrophobicContact CG-CD1 4.45Å; E457-I459 HydrophobicContact CG-CG1 4.38Å; E457-I459 WeakPolarHBondContact O-CG1 3.26Å; E457-I459 PolarHBondContact O-N 2.95Å; E457-I459 WeakPolarHBondContact OE1-CG2 3.34Å; E457-I459 VanDerWaalsContact OE2-CD1 3.26Å; E457-I459 WeakPolarHBondContact OE2-CD1 3.46Å
458	I	36.2	Very low	54.7	Low	50 Å²	50	63 Å²	63	26%	0.256	29%	0.288	S	S	.	.			trans	-85	48.1	142.1	-41	163	0	0	0	106.3	K449 I451 E455 K456 W460	K449-I458 HydrophobicContact CD-CD1 3.65Å; K449-I458 VanDerWaalsContact NZ-CD1 3.3Å; I451-I458 HydrophobicContact CD1-CD1 3.52Å; I451-I458 HydrophobicContact CD1-CG1 4.35Å; I451-I458 HydrophobicContact CG1-CD1 4.18Å; I451-I458 HydrophobicContact CG2-CD1 4.35Å; I451-I458 HydrophobicContact CG2-CG1 4.24Å; E455-I458 WeakPolarHBondContact O-CG1 3.48Å; E455-I458 PolarHBondContact O-N 2.82Å; K456-I458 PolarHBondContact O-N 2.78Å; I458-W460 PolarHBondContact O-N 3.44Å; I458-W460 VanDerWaalsContact O-N 3.16Å
459	I	36.7	Very low	56.2	Low	66 Å²	66	55.6 Å²	55.6	34%	0.338	25%	0.254	S	S	.	.				-39.2	118.1	124.5	42.6	167.8	0	0	0	106.6	E457 Q461	E457-I459 HydrophobicContact CB-CD1 4.13Å; E457-I459 HydrophobicContact CB-CG1 3.75Å; E457-I459 VanDerWaalsContact CD-CD1 3.49Å; E457-I459 HydrophobicContact CG-CD1 4.45Å; E457-I459 HydrophobicContact CG-CG1 4.38Å; E457-I459 WeakPolarHBondContact O-CG1 3.26Å; E457-I459 PolarHBondContact O-N 2.95Å; E457-I459 WeakPolarHBondContact OE1-CG2 3.34Å; E457-I459 VanDerWaalsContact OE2-CD1 3.26Å; E457-I459 WeakPolarHBondContact OE2-CD1 3.46Å; I459-Q461 HydrophobicContact CD1-CG 3.66Å; I459-Q461 HydrophobicContact CG1-CG 3.9Å; I459-Q461 PolarHBondContact O-N 3.23Å
460	W	39.5	Very low	57.9	Low	146 Å²	146	53.7 Å²	53.7	55%	0.553	24%	0.244	S	C	*	.				13.5	52.1	86	-74.2	123.9	0	0	0	113.4	I458 K462 Y534 P559 V560	I458-W460 PolarHBondContact O-N 3.44Å; I458-W460 VanDerWaalsContact O-N 3.16Å; W460-K462 PolarHBondContact O-N 3.08Å; W460-Y534 WeakPolarHBondContact CZ3-OH 3.38Å; W460-P559 HydrophobicContact CB-CB 3.77Å; W460-P559 HydrophobicContact CD2-CB 4.17Å; W460-P559 VanDerWaalsContact CE3-C 3.49Å; W460-P559 HydrophobicContact CE3-CB 3.7Å; W460-P559 HydrophobicContact CE3-CG 4.35Å; W460-P559 VanDerWaalsContact CE3-O 3.24Å; W460-P559 HydrophobicContact CG-CB 4.29Å; W460-P559 HydrophobicContact CZ3-CB 4.46Å; W460-P559 WeakPolarHBondContact CZ3-O 3.27Å; W460-V560 CarbonylContact C-O 3.59Å; W460-V560 WeakPolarHBondContact CA-O 3.09Å
461	Q	44.7	Very low	59.5	Low	73 Å²	73	51.9 Å²	51.9	34%	0.341	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	118.3	-172.6	-107.6	-172.8	-0.9	0	0	105.5	I459 I463 P559 V560	I459-Q461 HydrophobicContact CD1-CG 3.66Å; I459-Q461 HydrophobicContact CG1-CG 3.9Å; I459-Q461 PolarHBondContact O-N 3.23Å; Q461-I463 HydrophobicContact CB-CG1 4.2Å; Q461-I463 PolarHBondContact O-N 3.23Å; Q461-P559 WeakPolarHBondContact O-CA 3.26Å; Q461-V560 PolarHBondContact N-O 2.97Å; Q461-V560 PolarHBondContact O-N 2.73Å
462	K	61.5	Low	60.9	Low	109 Å²	109	51.9 Å²	51.9	47%	0.474	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	89.3	173.1	-61.4	-176.6	91.6	-150.4	0	105.9	W460 P464 D557	W460-K462 PolarHBondContact O-N 3.08Å; K462-P464 VanDerWaalsContact O-CD 3.29Å; K462-P464 WeakPolarHBondContact O-CD 3Å; K462-D557 HydrophobicContact CB-CB 4.1Å; K462-D557 VanDerWaalsContact CB-CG 3.45Å; K462-D557 HydrophobicContact CD-CB 4.48Å; K462-D557 VanDerWaalsContact CD-OD2 3.32Å; K462-D557 WeakPolarHBondContact CD-OD2 3.49Å; K462-D557 WeakPolarHBondContact CE-O 3.16Å; K462-D557 WeakPolarHBondContact CE-OD2 3.1Å; K462-D557 IonicContact NZ-OD2 2.83Å; K462-D557 PolarHBondContact NZ-OD2 2.94Å
463	I	69.7	Low	62.8	Low	1 Å²	1	52.6 Å²	52.6	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	113.1	176.6	-65	-169	0	0	0	105.3	Q461 L465 I556 L558 V560 F563	Q461-I463 HydrophobicContact CB-CG1 4.2Å; Q461-I463 PolarHBondContact O-N 3.23Å; I463-L465 HydrophobicContact CG2-CD2 3.99Å; I463-L465 HydrophobicContact CG2-CG 4.25Å; I463-L465 PolarHBondContact O-N 3.47Å; I463-I556 VanDerWaalsContact O-O 3.14Å; I463-L558 PolarHBondContact N-O 2.86Å; I463-L558 PolarHBondContact O-N 2.8Å; I463-V560 HydrophobicContact CB-CG2 4.36Å; I463-V560 HydrophobicContact CD1-CG2 3.37Å; I463-V560 HydrophobicContact CG1-CG2 3.71Å; I463-F563 HydrophobicContact CD1-CB 4.45Å; I463-F563 HydrophobicContact CD1-CD1 3.99Å; I463-F563 HydrophobicContact CD1-CD2 4.1Å; I463-F563 HydrophobicContact CD1-CE1 4.17Å; I463-F563 HydrophobicContact CD1-CE2 4.28Å; I463-F563 HydrophobicContact CD1-CG 3.95Å; I463-F563 HydrophobicContact CD1-CZ 4.3Å
464	P	76.4	Confident	64.4	Low	15 Å²	15	51.9 Å²	51.9	10%	0.097	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	123.6	171.9	29.3	-36.5	0	0	0	107.9	K462 P593 L594 Y704	K462-P464 VanDerWaalsContact O-CD 3.29Å; K462-P464 WeakPolarHBondContact O-CD 3Å; P464-P593 HydrophobicContact CB-CG 4.33Å; P464-P593 HydrophobicContact CG-CB 4.28Å; P464-P593 HydrophobicContact CG-CG 4.03Å; P464-P593 VanDerWaalsContact O-CD 3.31Å; P464-P593 WeakPolarHBondContact O-CD 3.33Å; P464-L594 HydrophobicContact CG-CD1 4.39Å; P464-L594 HydrophobicContact CG-CG 4.1Å; P464-Y704 HydrophobicContact CB-CE1 4.3Å; P464-Y704 HydrophobicContact CB-CE2 4.31Å; P464-Y704 HydrophobicContact CG-CD1 4.15Å; P464-Y704 HydrophobicContact CG-CE1 3.57Å; P464-Y704 HydrophobicContact CG-CE2 4.38Å
465	L	80.7	Confident	66.1	Low	2 Å²	2	53 Å²	53	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.3	167.8	-63.8	176.3	0	0	0	107.6	I463 I467 L487 I556 L558 I590 Y591 C592	I463-L465 HydrophobicContact CG2-CD2 3.99Å; I463-L465 HydrophobicContact CG2-CG 4.25Å; I463-L465 PolarHBondContact O-N 3.47Å; L465-I467 HydrophobicContact CB-CG1 4.17Å; L465-L487 HydrophobicContact CD1-CD1 3.48Å; L465-L487 VanDerWaalsContact CD1-CD1 3.48Å; L465-I556 HydrophobicContact CB-CG1 4.29Å; L465-I556 PolarHBondContact N-O 3.08Å; L465-I556 PolarHBondContact O-N 2.85Å; L465-L558 HydrophobicContact CD1-CB 4.32Å; L465-L558 HydrophobicContact CD1-CD1 4.12Å; L465-I590 HydrophobicContact CD2-CG2 4.06Å; L465-Y591 WeakPolarHBondContact CA-O 3.48Å; L465-C592 HydrophobicContact CD2-CB 3.84Å
466	E	84.1	Confident	68	Low	50 Å²	50	54.5 Å²	54.5	23%	0.234	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.7	161	-79.7	-179.1	-121.4	0	0	107.3	R468 L553 I590 Y591	E466-R468 IonicContact OE2-CZ 2.76Å; E466-R468 IonicContact OE2-NE 2.73Å; E466-R468 IonicContact OE2-NH2 3.26Å; E466-R468 PolarHBondContact OE2-NH2 2.92Å; E466-L553 HydrophobicContact CB-CD1 4.15Å; E466-L553 HydrophobicContact CG-CD1 4.29Å; E466-I590 WeakPolarHBondContact O-CA 3.43Å; E466-Y591 HydrophobicContact CB-CD1 4.47Å; E466-Y591 PolarHBondContact N-O 2.66Å; E466-Y591 PolarHBondContact O-N 3.24Å
467	I	86.4	Confident	70.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.9	176.3	-53.1	-167.6	0	0	0	108.8	L465 L469 L485 L553 F554 I556 V588 Q589 I590	L465-I467 HydrophobicContact CB-CG1 4.17Å; I467-L469 HydrophobicContact CG2-CD1 4.12Å; I467-L485 HydrophobicContact CD1-CD1 3.68Å; I467-L485 HydrophobicContact CG2-CD1 3.83Å; I467-L553 WeakPolarHBondContact O-CA 3.26Å; I467-F554 PolarHBondContact N-O 2.9Å; I467-F554 PolarHBondContact O-N 3.29Å; I467-I556 HydrophobicContact CD1-CD1 3.77Å; I467-I556 HydrophobicContact CD1-CG1 4.41Å; I467-I556 HydrophobicContact CG1-CD1 4.39Å; I467-V588 HydrophobicContact CG2-CG1 4.39Å; I467-Q589 WeakPolarHBondContact CA-O 3.21Å; I467-I590 HydrophobicContact CD1-CD1 4.31Å; I467-I590 HydrophobicContact CD1-CG1 4.34Å; I467-I590 HydrophobicContact CG1-CG1 4.12Å; I467-I590 HydrophobicContact CG1-CG2 4.42Å; I467-I590 HydrophobicContact CG2-CG1 4.15Å
468	R	88.2	Confident	72.5	Confident	67 Å²	67	48.7 Å²	48.7	25%	0.253	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.7	177.1	-60.8	176.8	-160.2	140.6	5	109.6	E466 Y470 T552 L553 V588 Q589	E466-R468 IonicContact OE2-CZ 2.76Å; E466-R468 IonicContact OE2-NE 2.73Å; E466-R468 IonicContact OE2-NH2 3.26Å; E466-R468 PolarHBondContact OE2-NH2 2.92Å; R468-Y470 HydrophobicContact CB-CD2 4.45Å; R468-Y470 HydrophobicContact CB-CE2 3.71Å; R468-T552 WeakPolarHBondContact CA-O 3.46Å; R468-L553 HydrophobicContact CG-CB 4.46Å; R468-L553 HydrophobicContact CG-CD1 3.6Å; R468-V588 CarbonylContact O-C 3.56Å; R468-V588 WeakPolarHBondContact O-CA 3.2Å; R468-Q589 HydrophobicContact CB-CB 4.43Å; R468-Q589 PolarHBondContact N-O 3.29Å; R468-Q589 PolarHBondContact O-N 2.81Å
469	L	88.8	Confident	74.9	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.3	171.1	-67.7	98.7	0	0	0	109.9	I467 V483 L541 V551 T552 F554 I572 W583 F585 V588	I467-L469 HydrophobicContact CG2-CD1 4.12Å; L469-V483 HydrophobicContact CD2-CG1 4.34Å; L469-L541 HydrophobicContact CD1-CD1 3.5Å; L469-L541 HydrophobicContact CD2-CD1 4.22Å; L469-V551 WeakPolarHBondContact O-CA 3.2Å; L469-T552 PolarHBondContact N-O 2.85Å; L469-T552 PolarHBondContact O-N 2.84Å; L469-F554 HydrophobicContact CD1-CD2 3.73Å; L469-F554 HydrophobicContact CD1-CE2 3.64Å; L469-I572 HydrophobicContact CD2-CD1 3.59Å; L469-W583 HydrophobicContact CD2-CH2 4.02Å; L469-F585 HydrophobicContact CD2-CE2 4.16Å; L469-V588 HydrophobicContact CD2-CG2 3.97Å; L469-V588 HydrophobicContact CG-CG2 3.71Å
470	Y	88.5	Confident	77.2	Confident	46 Å²	46	47.7 Å²	47.7	18%	0.18	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.4	178.7	-66.3	-106	0	0	0	109.8	R468 V551 D586 K587 Q589	R468-Y470 HydrophobicContact CB-CD2 4.45Å; R468-Y470 HydrophobicContact CB-CE2 3.71Å; Y470-V551 HydrophobicContact CD1-CB 4.4Å; Y470-V551 HydrophobicContact CD1-CG1 4.12Å; Y470-V551 HydrophobicContact CD1-CG2 3.51Å; Y470-V551 HydrophobicContact CD2-CG1 4.45Å; Y470-V551 HydrophobicContact CE1-CB 4.32Å; Y470-V551 HydrophobicContact CE1-CG1 3.78Å; Y470-V551 HydrophobicContact CE1-CG2 3.52Å; Y470-V551 HydrophobicContact CE2-CG1 4.15Å; Y470-V551 HydrophobicContact CG-CG1 4.43Å; Y470-V551 HydrophobicContact CG-CG2 4.34Å; Y470-D586 PolarHBondContact O-N 2.97Å; Y470-K587 HydrophobicContact CD2-CD 4.1Å; Y470-K587 VanDerWaalsContact CD2-CE 3.42Å; Y470-K587 HydrophobicContact CD2-CG 3.57Å; Y470-K587 HydrophobicContact CE2-CD 4.48Å; Y470-K587 HydrophobicContact CE2-CG 4.35Å; Y470-K587 HydrophobicContact CG-CD 4.21Å; Y470-K587 HydrophobicContact CG-CG 3.73Å; Y470-K587 PolarHBondContact N-O 2.99Å; Y470-Q589 HydrophobicContact CE2-CG 4.12Å; Y470-Q589 PolarHBondContact OH-OE1 3.04Å
471	T	86.3	Confident	79.4	Confident	7 Å²	7	41 Å²	41	4%	0.043	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	147.3	169	31.5	0	0	0	0	110.7	D547 G550 W583	T471-D547 VanDerWaalsContact CB-O 3.26Å; T471-D547 WeakPolarHBondContact CB-O 3.27Å; T471-D547 PolarHBondContact OG1-O 3.5Å; T471-G550 PolarHBondContact N-O 3.18Å; T471-G550 WeakPolarHBondContact OG1-CA 3.25Å; T471-G550 PolarHBondContact OG1-N 2.82Å; T471-G550 PolarHBondContact OG1-O 3.17Å; T471-G550 VanDerWaalsContact OG1-O 3.12Å; T471-W583 HydrophobicContact CG2-CE3 3.4Å; T471-W583 HydrophobicContact CG2-CZ3 3.59Å
472	G	77.2	Confident	81.2	Confident	6 Å²	6	42.1 Å²	42.1	6%	0.062	22%	0.223	C	C	.	.			trans	-74.7	159.1	-179.9	0	0	0	0	0	113.7	V474 A477 N549 F584	G472-V474 VanDerWaalsContact C-N 3.33Å; G472-V474 PolarHBondContact O-N 3.04Å; G472-A477 WeakPolarHBondContact O-CB 3.35Å; G472-N549 PolarHBondContact O-N 3.04Å; G472-N549 VanDerWaalsContact O-N 3.13Å; G472-F584 PolarHBondContact N-O 2.83Å
473	D	84.3	Confident	82.5	Confident	91 Å²	91	36.9 Å²	36.9	49%	0.487	20%	0.2	S	C	.	.	S	Bend	trans	-89.7	62.9	173.2	-168.2	24.6	0	0	0	112.2	R548 N549	D473-R548 IonicContact OD1-CZ 2.76Å; D473-R548 IonicContact OD1-NE 3.79Å; D473-R548 PolarHBondContact OD1-NE 2.95Å; D473-R548 IonicContact OD1-NH2 2.75Å; D473-R548 PolarHBondContact OD1-NH2 2.84Å; D473-R548 IonicContact OD2-NH2 3.76Å; D473-N549 HydrophobicContact CB-CB 3.9Å
474	V	78.3	Confident	83.5	Confident	47 Å²	47	36.9 Å²	36.9	29%	0.285	20%	0.2	S	C	.	.	S	Bend	trans	-124.8	157	172	-64.6	0	0	0	0	111	G472 N476 A477 R548 F584 W606	G472-V474 VanDerWaalsContact C-N 3.33Å; G472-V474 PolarHBondContact O-N 3.04Å; V474-N476 PolarHBondContact O-N 2.85Å; V474-A477 HydrophobicContact CG2-CB 3.79Å; V474-A477 WeakPolarHBondContact O-CB 3.26Å; V474-A477 PolarHBondContact O-N 3.27Å; V474-R548 VanDerWaalsContact O-CD 3.26Å; V474-R548 WeakPolarHBondContact O-CD 3.34Å; V474-R548 WeakPolarHBondContact O-CG 3.41Å; V474-F584 HydrophobicContact CG2-CB 3.6Å; V474-F584 HydrophobicContact CG2-CD1 4.37Å; V474-F584 HydrophobicContact CG2-CD2 3.77Å; V474-F584 HydrophobicContact CG2-CG 3.66Å; V474-W606 HydrophobicContact CG2-CZ2 3.96Å
475	P	76.3	Confident	84.2	Confident	93 Å²	93	36.1 Å²	36.1	60%	0.604	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	135.7	176.1	-27.1	36.1	0	0	0	111.8	A477 W606	P475-A477 PolarHBondContact O-N 3.25Å; P475-W606 WeakPolarHBondContact O-CH2 3.23Å
476	N	76.6	Confident	84.6	Confident	136 Å²	136	40.1 Å²	40.1	73%	0.727	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	25.5	-179.5	-52.6	-11.4	0	0	0	115.2	V474 G478 W606	V474-N476 PolarHBondContact O-N 2.85Å; N476-G478 PolarHBondContact O-N 2.78Å; N476-G478 VanDerWaalsContact O-N 3.07Å; N476-W606 HydrophobicContact CB-CH2 4.44Å; N476-W606 WeakPolarHBondContact O-CH2 3.43Å; N476-W606 WeakPolarHBondContact O-CZ3 3.39Å
477	A	80.8	Confident	84.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.			trans	-65.7	-4.7	-175.5	0	0	0	0	0	117.1	G472 V474 P475 R548 W583 F584	G472-A477 WeakPolarHBondContact O-CB 3.35Å; V474-A477 HydrophobicContact CG2-CB 3.79Å; V474-A477 WeakPolarHBondContact O-CB 3.26Å; V474-A477 PolarHBondContact O-N 3.27Å; P475-A477 PolarHBondContact O-N 3.25Å; A477-R548 HydrophobicContact CB-CB 4.27Å; A477-R548 HydrophobicContact CB-CG 4.22Å; A477-W583 VanDerWaalsContact O-CB 3.31Å; A477-W583 WeakPolarHBondContact O-CB 3.33Å; A477-F584 HydrophobicContact CB-CB 3.88Å; A477-F584 PolarHBondContact O-N 3.22Å
478	G	81.1	Confident	84.8	Confident	16 Å²	16	38.1 Å²	38.1	17%	0.165	20%	0.202	C	C	.	.			trans	-99.2	157.9	-173.5	0	0	0	0	0	115.1	N476 Y546	N476-G478 PolarHBondContact O-N 2.78Å; N476-G478 VanDerWaalsContact O-N 3.07Å; G478-Y546 WeakPolarHBondContact CA-O 3.17Å
479	T	86.4	Confident	84.1	Confident	12 Å²	12	35 Å²	35	7%	0.074	19%	0.19	C	C	.	.			trans	-116.4	147.3	177.6	-166.1	0	0	0	0	113.2	A481 V483 Y546 S580 P581 W583	T479-A481 WeakPolarHBondContact OG1-CB 3.31Å; T479-A481 PolarHBondContact OG1-N 2.88Å; T479-V483 HydrophobicContact CG2-CG2 3.92Å; T479-Y546 HydrophobicContact CG2-CD2 3.66Å; T479-Y546 HydrophobicContact CG2-CG 3.96Å; T479-Y546 PolarHBondContact N-O 2.81Å; T479-S580 CarbonylContact C-O 3.58Å; T479-S580 VanDerWaalsContact CA-O 3.29Å; T479-S580 WeakPolarHBondContact CA-O 3.35Å; T479-S580 PolarHBondContact OG1-O 3.48Å; T479-P581 PolarHBondContact OG1-O 2.72Å; T479-W583 HydrophobicContact CG2-CB 4.38Å; T479-W583 HydrophobicContact CG2-CD2 3.68Å; T479-W583 HydrophobicContact CG2-CE3 3.78Å; T479-W583 HydrophobicContact CG2-CG 3.92Å; T479-W583 HydrophobicContact CG2-CZ3 4.38Å
480	T	86.5	Confident	82.9	Confident	82 Å²	82	37.5 Å²	37.5	50%	0.503	21%	0.206	S	C	.	.			trans	-102.8	2.7	166	60.4	0	0	0	0	113.1	G578 H579 S580	T480-G578 WeakPolarHBondContact OG1-CA 3.37Å; T480-H579 PolarHBondContact OG1-N 2.84Å; T480-S580 PolarHBondContact N-O 2.73Å; T480-S580 PolarHBondContact OG1-N 2.82Å; T480-S580 PolarHBondContact OG1-O 2.72Å
481	A	84.3	Confident	81.8	Confident	5 Å²	5	37.2 Å²	37.2	4%	0.041	21%	0.207	C	C	.	.	S	Bend	trans	-80.2	156.1	-178.2	0	0	0	0	0	112.1	T479 V483 H574 D575 T577 P581	T479-A481 WeakPolarHBondContact OG1-CB 3.31Å; T479-A481 PolarHBondContact OG1-N 2.88Å; A481-V483 PolarHBondContact O-N 2.71Å; A481-H574 HydrophobicContact CB-CB 3.87Å; A481-D575 WeakPolarHBondContact CB-OD1 3.13Å; A481-T577 WeakPolarHBondContact CA-O 3.38Å; A481-T577 VanDerWaalsContact CB-O 3.28Å; A481-T577 WeakPolarHBondContact CB-O 3.28Å; A481-P581 HydrophobicContact CB-CB 4.24Å
482	K	84.1	Confident	80.1	Confident	97 Å²	97	44.5 Å²	44.5	42%	0.422	24%	0.24	S	C	.	.			trans	-73.7	112.8	171.5	-70	-161.6	172.8	-165.3	0	109.8	W540 E542 H574 D575	K482-W540 HydrophobicContact CB-CE3 4Å; K482-W540 HydrophobicContact CB-CZ3 3.84Å; K482-E542 IonicContact NZ-OE1 2.74Å; K482-E542 PolarHBondContact NZ-OE1 2.82Å; K482-H574 VanDerWaalsContact O-CA 3.28Å; K482-H574 WeakPolarHBondContact O-CA 3.06Å; K482-D575 PolarHBondContact N-OD1 3.14Å; K482-D575 PolarHBondContact O-N 3.21Å
483	V	87.5	Confident	78.1	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	146.9	176.8	-178.3	0	0	0	0	110.3	L469 T479 A481 L541 Y546 I572 G573 W583	L469-V483 HydrophobicContact CD2-CG1 4.34Å; T479-V483 HydrophobicContact CG2-CG2 3.92Å; A481-V483 PolarHBondContact O-N 2.71Å; V483-L541 HydrophobicContact CG1-CD1 4.19Å; V483-L541 PolarHBondContact O-N 2.94Å; V483-Y546 HydrophobicContact CB-CE2 4.04Å; V483-Y546 HydrophobicContact CG2-CD2 3.96Å; V483-Y546 HydrophobicContact CG2-CE1 4.29Å; V483-Y546 HydrophobicContact CG2-CE2 3.5Å; V483-I572 HydrophobicContact CG1-CD1 4.45Å; V483-I572 HydrophobicContact CG1-CG1 4.27Å; V483-G573 CarbonylContact C-O 3.58Å; V483-G573 WeakPolarHBondContact CA-O 3.38Å; V483-W583 HydrophobicContact CG1-CZ2 4.37Å; V483-W583 HydrophobicContact CG2-CH2 4.29Å; V483-W583 HydrophobicContact CG2-CZ2 4.14Å
484	Y	90.6	Very high	75.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159	172.9	64.1	-98.9	0	0	0	112.3	Y538 I539 W540 G573 K615 E617	Y484-Y538 AromaticContact CD2-CD1 3.44Å; Y484-Y538 HydrophobicContact CD2-CD1 3.44Å; Y484-Y538 VanDerWaalsContact CD2-CD1 3.44Å; Y484-Y538 AromaticContact CD2-CE1 3.91Å; Y484-Y538 HydrophobicContact CD2-CE1 3.91Å; Y484-Y538 HydrophobicContact CD2-CG 4.28Å; Y484-Y538 AromaticContact CE2-CD1 3.53Å; Y484-Y538 HydrophobicContact CE2-CD1 3.53Å; Y484-Y538 AromaticContact CE2-CE1 3.48Å; Y484-Y538 HydrophobicContact CE2-CE1 3.48Å; Y484-Y538 VanDerWaalsContact CE2-CE1 3.48Å; Y484-Y538 HydrophobicContact CE2-CG 4.5Å; Y484-Y538 HydrophobicContact CG-CD1 4.37Å; Y484-I539 CarbonylContact C-O 3.58Å; Y484-I539 VanDerWaalsContact CA-O 3.23Å; Y484-I539 WeakPolarHBondContact CA-O 3.47Å; Y484-I539 WeakPolarHBondContact CB-O 3.48Å; Y484-W540 HydrophobicContact CD1-CE3 4.05Å; Y484-W540 AromaticContact CD1-CH2 3.81Å; Y484-W540 HydrophobicContact CD1-CH2 3.81Å; Y484-W540 HydrophobicContact CD1-CZ2 4.43Å; Y484-W540 AromaticContact CD1-CZ3 3.58Å; Y484-W540 HydrophobicContact CD1-CZ3 3.58Å; Y484-W540 HydrophobicContact CE1-CH2 4.33Å; Y484-W540 HydrophobicContact CE1-CZ3 4.43Å; Y484-W540 HydrophobicContact CG-CE3 4.36Å; Y484-W540 HydrophobicContact CG-CZ3 4.32Å; Y484-G573 PolarHBondContact N-O 2.72Å; Y484-G573 PolarHBondContact O-N 2.83Å; Y484-K615 HydrophobicContact CE1-CB 4.49Å; Y484-K615 HydrophobicContact CE1-CD 4Å; Y484-K615 HydrophobicContact CE1-CG 4.1Å; Y484-K615 WeakPolarHBondContact OH-CB 3.5Å; Y484-K615 WeakPolarHBondContact OH-CD 3.12Å; Y484-E617 HydrophobicContact CE2-CB 4.29Å; Y484-E617 WeakPolarHBondContact CE2-OE2 3.26Å; Y484-E617 PolarHBondContact OH-OE2 3.02Å
485	L	91	Very high	72.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	159.2	174.5	-61.7	177.4	0	0	0	111.4	I467 I539 L541 L570 V571 I572	I467-L485 HydrophobicContact CD1-CD1 3.68Å; I467-L485 HydrophobicContact CG2-CD1 3.83Å; L485-I539 HydrophobicContact CB-CB 4.42Å; L485-I539 PolarHBondContact N-O 2.84Å; L485-I539 PolarHBondContact O-N 2.84Å; L485-L541 HydrophobicContact CD1-CD1 3.89Å; L485-L541 HydrophobicContact CD1-CD2 4.38Å; L485-L541 HydrophobicContact CD1-CG 4.44Å; L485-L541 HydrophobicContact CG-CD1 3.91Å; L485-L541 HydrophobicContact CG-CG 4.35Å; L485-L570 HydrophobicContact CD2-CD1 4.36Å; L485-V571 CarbonylContact C-O 3.53Å; L485-V571 VanDerWaalsContact CA-O 3.29Å; L485-V571 WeakPolarHBondContact CA-O 3.37Å; L485-I572 HydrophobicContact CD2-CB 3.9Å; L485-I572 HydrophobicContact CD2-CD1 4.27Å; L485-I572 HydrophobicContact CD2-CG1 3.84Å
486	R	89.3	Confident	70.4	Confident	85 Å²	85	53.8 Å²	53.8	32%	0.321	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.6	163.3	-150.1	176.6	-175.7	179	-5.5	109.4	T535 T536 Y538 V571	R486-T535 HydrophobicContact CG-CG2 4.12Å; R486-T536 WeakPolarHBondContact CG-O 3.31Å; R486-T536 PolarHBondContact NE-O 2.88Å; R486-Y538 HydrophobicContact CB-CD1 4.22Å; R486-Y538 HydrophobicContact CB-CE1 4.34Å; R486-Y538 HydrophobicContact CG-CD1 4.33Å; R486-Y538 HydrophobicContact CG-CE1 4.46Å; R486-V571 HydrophobicContact CB-CB 3.89Å; R486-V571 HydrophobicContact CB-CG2 4.23Å; R486-V571 PolarHBondContact N-O 3.02Å; R486-V571 PolarHBondContact O-N 3Å
487	L	90.1	Very high	67.8	Low	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	136	-175.1	-55.2	-179.1	0	0	0	109.5	L465 T535 T536 I539 L558 I564 L567 L570 I590	L465-L487 HydrophobicContact CD1-CD1 3.48Å; L465-L487 VanDerWaalsContact CD1-CD1 3.48Å; L487-T535 CarbonylContact O-C 3.32Å; L487-T535 VanDerWaalsContact O-CA 3.31Å; L487-T535 WeakPolarHBondContact O-CA 3.22Å; L487-T536 HydrophobicContact CB-CG2 3.84Å; L487-T536 HydrophobicContact CG-CG2 4.49Å; L487-T536 PolarHBondContact N-OG1 2.83Å; L487-T536 PolarHBondContact O-N 3.03Å; L487-I539 HydrophobicContact CD1-CD1 3.85Å; L487-I539 HydrophobicContact CG-CD1 3.72Å; L487-L558 HydrophobicContact CD1-CD1 3.99Å; L487-I564 HydrophobicContact CB-CD1 3.75Å; L487-L567 HydrophobicContact CB-CD2 3.78Å; L487-L567 HydrophobicContact CD2-CD1 3.97Å; L487-L567 HydrophobicContact CD2-CD2 4.27Å; L487-L567 HydrophobicContact CG-CD2 4.42Å; L487-L570 HydrophobicContact CD2-CD1 3.52Å; L487-I590 HydrophobicContact CD2-CD1 3.86Å
488	S	84.9	Confident	65.1	Low	9 Å²	9	56.4 Å²	56.4	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138.2	173.1	-61.2	0	0	0	0	110.7	Y534 T535 L567 S568 Q569	S488-Y534 WeakPolarHBondContact CA-O 3.47Å; S488-T535 WeakPolarHBondContact CB-OG1 3.38Å; S488-T535 VanDerWaalsContact OG-CG2 3.3Å; S488-T535 WeakPolarHBondContact OG-CG2 3.32Å; S488-T535 PolarHBondContact OG-OG1 3.44Å; S488-L567 CarbonylContact O-C 3.49Å; S488-L567 WeakPolarHBondContact O-CA 3.17Å; S488-S568 PolarHBondContact O-N 2.79Å; S488-S568 PolarHBondContact O-OG 3.26Å; S488-S568 VanDerWaalsContact O-OG 3.13Å; S488-Q569 PolarHBondContact N-O 3.41Å; S488-Q569 PolarHBondContact O-N 2.81Å
489	G	74.1	Confident	62.3	Low	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.7	-173.1	177.6	0	0	0	0	0	114.6	Y534	G489-Y534 PolarHBondContact N-O 3.19Å; G489-Y534 PolarHBondContact O-N 3.19Å; G489-Y534 VanDerWaalsContact O-N 3.1Å
490	P	63.4	Low	59.3	Low	55 Å²	55	71.5 Å²	71.5	36%	0.357	38%	0.379	S	S	.	.	P	Polyproline II helix	cis	-71.7	156.5	-1.5	29.2	-33.4	0	0	0	113.2	Q492 F563 P566	P490-Q492 PolarHBondContact O-N 3.2Å; P490-F563 WeakPolarHBondContact CB-O 3.33Å; P490-F563 WeakPolarHBondContact CD-O 3.46Å; P490-F563 WeakPolarHBondContact CG-O 3.44Å; P490-P566 CarbonylContact C-O 3.53Å; P490-P566 WeakPolarHBondContact CA-O 3.47Å
491	E	64.6	Low	56.4	Low	40 Å²	40	72.6 Å²	72.6	19%	0.187	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-56	125.7	158.3	-175.4	-179.1	-140.9	0	0	108.7	I493 P566 K624 R627	E491-I493 PolarHBondContact O-N 2.99Å; E491-P566 HydrophobicContact CB-CB 4.25Å; E491-P566 PolarHBondContact N-O 3.42Å; E491-K624 WeakPolarHBondContact OE1-CE 3.41Å; E491-K624 IonicContact OE1-NZ 2.7Å; E491-K624 PolarHBondContact OE1-NZ 2.97Å; E491-R627 IonicContact OE2-CZ 2.71Å; E491-R627 IonicContact OE2-NH1 2.75Å; E491-R627 PolarHBondContact OE2-NH1 3.07Å; E491-R627 IonicContact OE2-NH2 3.51Å; E491-R627 PolarHBondContact OE2-NH2 2.87Å
492	Q	51.3	Low	53.6	Low	160 Å²	160	79.3 Å²	79.3	75%	0.748	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-59.1	117.6	173.2	-74.6	-173	-18.1	0	0	108.9	P490 A494	P490-Q492 PolarHBondContact O-N 3.2Å; Q492-A494 VanDerWaalsContact C-N 3.25Å; Q492-A494 PolarHBondContact O-N 2.6Å
493	I	34.7	Very low	50.7	Low	142 Å²	142	84.4 Å²	84.4	73%	0.728	44%	0.44	S	S	*	.			trans	-70.4	86.9	-179	-57.6	178.6	0	0	0	108.2	E491 I495	E491-I493 PolarHBondContact O-N 2.99Å; I493-I495 PolarHBondContact O-N 3.24Å; I493-I495 VanDerWaalsContact O-N 3.1Å
494	A	27.7	Very low	47.6	Very low	85 Å²	85	91.7 Å²	91.7	70%	0.702	47%	0.474	S	S	*	.			trans	-61.9	112.3	171.9	0	0	0	0	0	108.5	Q492 S496	Q492-A494 VanDerWaalsContact C-N 3.25Å; Q492-A494 PolarHBondContact O-N 2.6Å; A494-S496 PolarHBondContact O-N 2.91Å
495	I	23.7	Very low	44.3	Very low	132 Å²	132	98.9 Å²	98.9	68%	0.677	51%	0.511	S	S	*	.	S	Bend	trans	-67.1	85.1	167.6	-56.8	178.1	0	0	0	106.8	I493 N2503	I493-I495 PolarHBondContact O-N 3.24Å; I493-I495 VanDerWaalsContact O-N 3.1Å; I495-N2503 PolarHBondContact O-ND2 3.08Å; I495-N2503 PolarHBondContact O-OD1 2.78Å
496	S	25.6	Very low	41.1	Very low	73 Å²	73	104.7 Å²	104.7	51%	0.51	55%	0.547	S	S	.	.			trans	57.4	131.3	179.9	68.7	0	0	0	0	117.8	A494 N2503	A494-S496 PolarHBondContact O-N 2.91Å; S496-N2503 WeakPolarHBondContact OG-CB 3.14Å
497	K	23.2	Very low	38	Very low	101 Å²	101	107.4 Å²	107.4	44%	0.439	57%	0.568	S	S	.	*				-162.6	153.3	129.1	-104.7	171.1	-165.1	-162	0	109.8	T2498 I2505	K497-T2498 PolarHBondContact NZ-OG1 3.03Å; K497-I2505 HydrophobicContact CD-CD1 3.87Å; K497-I2505 VanDerWaalsContact CE-CD1 3.43Å; K497-I2505 HydrophobicContact CG-CD1 4.09Å
498	P	22.8	Very low	34.9	Very low	90 Å²	90	114.2 Å²	114.2	58%	0.584	61%	0.61	S	S	*	*			trans	-79.7	158.1	-165.3	32.1	-36.1	0	0	0	113.2
499	P	22.9	Very low	32	Very low	121 Å²	121	119.3 Å²	119.3	79%	0.786	64%	0.64	S	S	*	*			trans	-72	138.8	173.3	30.7	-34.5	0	0	0	111.6
500	Y	23.6	Very low	29.7	Very low	225 Å²	225	125 Å²	125	88%	0.882	68%	0.675	S	S	*	*			trans	-107.4	113.9	159.2	-89.8	-83.4	0	0	0	108.6
501	P	24.7	Very low	27.9	Very low	104 Å²	104	131.2 Å²	131.2	68%	0.675	70%	0.699	S	S	*	*			trans	-79.9	144.4	177.3	31.2	-33	0	0	0	112
502	N	25.1	Very low	26	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	73%	0.73	S	S	*	*			trans	63.4	118.6	160.7	-56.5	-25.9	0	0	0	118.4
503	Y	23.2	Very low	24.8	Very low	205 Å²	205	134 Å²	134	80%	0.804	73%	0.727	S	S	*	*				-154.5	120.2	93.1	-121	-87.9	0	0	0	113
504	Q	22.5	Very low	24.4	Very low	152 Å²	152	135.8 Å²	135.8	71%	0.71	73%	0.73	S	S	*	*			trans	24.3	118.9	155.2	-62.3	175.7	-20	0	0	120.6
505	I	22.4	Very low	24.3	Very low	151 Å²	151	136.6 Å²	136.6	77%	0.774	72%	0.723	S	S	*	*			trans	-73.9	127.7	151.7	-63.4	167.8	0	0	0	108.6	N507	I505-N507 WeakPolarHBondContact CG2-OD1 3.39Å
506	T	23.5	Very low	24.4	Very low	123 Å²	123	138.5 Å²	138.5	76%	0.755	73%	0.726	S	S	*	*			trans	-111.2	110.4	157.5	49.8	0	0	0	0	108.8
507	N	23.6	Very low	24.4	Very low	142 Å²	142	140.5 Å²	140.5	76%	0.759	74%	0.735	S	S	*	*			trans	-73.5	131.8	174.2	-79.4	-15.5	0	0	0	110.4	I505	I505-N507 WeakPolarHBondContact CG2-OD1 3.39Å
508	T	25.5	Very low	24.4	Very low	143 Å²	143	142.5 Å²	142.5	88%	0.877	75%	0.75	S	S	*	*			trans	-130.5	146.6	153.7	-20.1	0	0	0	0	107.8
509	T	24.6	Very low	24.5	Very low	116 Å²	116	143.5 Å²	143.5	71%	0.712	75%	0.751	S	S	*	*			trans	-128.9	152.9	-149.6	-23.9	0	0	0	0	112.6
510	V	25.1	Very low	24.7	Very low	120 Å²	120	145.4 Å²	145.4	73%	0.727	75%	0.748	S	S	*	*			trans	74	144.7	165.9	-175.4	0	0	0	0	112.7
511	Q	25.7	Very low	24.7	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	74%	0.74	S	S	*	*			cis	-137.9	-164.3	27.7	-146.4	138.8	35.3	0	0	115.5
512	K	24.9	Very low	24.7	Very low	191 Å²	191	141.1 Å²	141.1	83%	0.83	74%	0.739	S	S	*	*			trans	-121.6	158.4	-160.6	-66.5	178.9	172.8	-177.9	0	115.6
513	G	26.6	Very low	24.7	Very low	67 Å²	67	141.6 Å²	141.6	69%	0.691	74%	0.737	S	S	*	*			trans	170.3	123.5	157	0	0	0	0	0	108.2
514	F	24.5	Very low	24.8	Very low	180 Å²	180	141.3 Å²	141.3	79%	0.789	74%	0.739	S	S	*	*			cis	61.8	124.7	32.1	-75.7	-90	0	0	0	113.4
515	D	26.4	Very low	24.9	Very low	103 Å²	103	140.1 Å²	140.1	55%	0.551	74%	0.743	S	S	*	*			cis	-166.9	158.8	-2	-157.4	1.5	0	0	0	113.2
516	K	25.4	Very low	24.9	Very low	171 Å²	171	139 Å²	139	74%	0.743	74%	0.743	S	S	*	*			trans	60.1	165.1	161.2	-74.5	150	-175.5	140.9	0	119.3
517	T	26.1	Very low	24.9	Very low	115 Å²	115	138.5 Å²	138.5	71%	0.706	75%	0.745	S	S	*	*			cis	-142.8	151.6	8.3	40.3	0	0	0	0	112.9
518	L	23.6	Very low	25	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	74%	0.741	S	S	*	*			trans	37.3	154	137.1	-75.4	59.1	0	0	0	121.5
519	D	24.5	Very low	25.1	Very low	111 Å²	111	140 Å²	140	59%	0.594	74%	0.743	S	S	*	*			cis	-160.6	166.3	11	-133.1	-34.1	0	0	0	114.6
520	H	26.9	Very low	25.3	Very low	160 Å²	160	143 Å²	143	74%	0.741	75%	0.746	S	S	*	*			trans	60.5	152.3	156.2	-64.3	-5.2	0	0	0	120.7
521	V	24.9	Very low	26.1	Very low	117 Å²	117	144 Å²	144	71%	0.709	74%	0.743	S	S	*	*			cis	-158.1	148.4	-14.1	125.9	0	0	0	0	111.8
522	D	24.8	Very low	27.1	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	74%	0.74	S	S	*	*			trans	48.7	118.9	160.3	-74.4	-39.6	0	0	0	127.3
523	Q	24.8	Very low	28.6	Very low	157 Å²	157	136.6 Å²	136.6	73%	0.734	72%	0.721	S	S	*	*				53.6	113.1	125.9	-60.7	174.9	52.5	0	0	122.9
524	K	24.4	Very low	30.9	Very low	198 Å²	198	136.2 Å²	136.2	86%	0.861	70%	0.699	S	S	*	*				-168.3	156.5	98.8	-105.8	168.2	-175	170.2	0	114.8
525	T	23.8	Very low	33.5	Very low	127 Å²	127	130.2 Å²	130.2	78%	0.779	68%	0.677	S	S	*	*			trans	-61.2	153.9	169	54.3	0	0	0	0	111.9
526	T	22.4	Very low	36	Very low	127 Å²	127	125.4 Å²	125.4	78%	0.779	65%	0.651	S	S	*	*			cis	-150.9	158.8	35	44.8	0	0	0	0	112.7
527	S	23.7	Very low	38.5	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	64%	0.643	S	S	*	*			trans	-167.3	131	146.8	6	0	0	0	0	114.6
528	E	27	Very low	41.1	Very low	146 Å²	146	119.9 Å²	119.9	68%	0.682	63%	0.625	S	S	*	*			trans	42.9	107	147.4	-54.8	-168.1	158.9	0	0	120.3	K530 K2210	E528-K530 PolarHBondContact O-N 3.28Å; E528-K2210 IonicContact OE1-NZ 2.74Å; E528-K2210 PolarHBondContact OE1-NZ 3.19Å
529	N	27.2	Very low	44.1	Very low	171 Å²	171	114.3 Å²	114.3	91%	0.914	60%	0.596	S	S	*	*			trans	-56.9	106.1	169.7	-68.9	-14.9	0	0	0	112.2
530	K	29.3	Very low	47	Very low	177 Å²	177	114.3 Å²	114.3	77%	0.77	59%	0.587	S	S	*	*			trans	-71.4	140.2	144.7	-66.1	171.2	-176.3	168.8	0	107.1	E528 D532	E528-K530 PolarHBondContact O-N 3.28Å; K530-D532 PolarHBondContact O-N 3.45Å; K530-D532 VanDerWaalsContact O-N 3.12Å
531	E	41.7	Very low	49.7	Very low	142 Å²	142	107 Å²	107	66%	0.664	55%	0.553	S	S	*	*			trans	-71.3	105.3	161.7	-77	-153	108.3	0	0	107.7	V533 K562	E531-V533 PolarHBondContact O-N 3.27Å; E531-K562 IonicContact OE1-NZ 2.72Å; E531-K562 PolarHBondContact OE1-NZ 2.9Å
532	D	46.3	Very low	51.9	Low	148 Å²	148	105.3 Å²	105.3	79%	0.791	54%	0.538	S	S	*	.			trans	-62.1	128.5	-178.6	-74	-43.8	0	0	0	111.4	K530 Y534	K530-D532 PolarHBondContact O-N 3.45Å; K530-D532 VanDerWaalsContact O-N 3.12Å; D532-Y534 PolarHBondContact O-N 2.74Å
533	V	56.7	Low	54	Low	71 Å²	71	105.6 Å²	105.6	43%	0.43	54%	0.539	S	S	.	.			trans	-68.4	104.7	176.2	177.5	0	0	0	0	108.3	E531 T535 S568	E531-V533 PolarHBondContact O-N 3.27Å; V533-T535 PolarHBondContact O-N 3.44Å; V533-T535 PolarHBondContact O-OG1 3Å; V533-S568 WeakPolarHBondContact CG1-OG 3.47Å
534	Y	73.9	Confident	55.8	Low	60 Å²	60	98.7 Å²	98.7	24%	0.235	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	128.1	-179	179.9	-91.9	0	0	0	109.9	W460 S488 G489 D532 T536 V560 P561 I564	W460-Y534 WeakPolarHBondContact CZ3-OH 3.38Å; S488-Y534 WeakPolarHBondContact CA-O 3.47Å; G489-Y534 PolarHBondContact N-O 3.19Å; G489-Y534 PolarHBondContact O-N 3.19Å; G489-Y534 VanDerWaalsContact O-N 3.1Å; D532-Y534 PolarHBondContact O-N 2.74Å; Y534-T536 HydrophobicContact CE1-CG2 4.14Å; Y534-V560 HydrophobicContact CD1-CG1 4.35Å; Y534-V560 HydrophobicContact CE1-CB 4.16Å; Y534-V560 HydrophobicContact CE1-CG1 3.74Å; Y534-P561 HydrophobicContact CD2-CG 3.56Å; Y534-P561 HydrophobicContact CE2-CG 3.53Å; Y534-P561 HydrophobicContact CG-CG 4.12Å; Y534-P561 VanDerWaalsContact CZ-CD 3.49Å; Y534-I564 HydrophobicContact CD1-CD1 3.94Å; Y534-I564 HydrophobicContact CD1-CG1 4.49Å; Y534-I564 HydrophobicContact CE1-CD1 4.39Å
535	T	78.6	Confident	58.1	Low	54 Å²	54	94.6 Å²	94.6	33%	0.331	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.3	-178	-64.3	0	0	0	0	109.2	R486 L487 S488 V533	R486-T535 HydrophobicContact CG-CG2 4.12Å; L487-T535 CarbonylContact O-C 3.32Å; L487-T535 VanDerWaalsContact O-CA 3.31Å; L487-T535 WeakPolarHBondContact O-CA 3.22Å; S488-T535 WeakPolarHBondContact CB-OG1 3.38Å; S488-T535 VanDerWaalsContact OG-CG2 3.3Å; S488-T535 WeakPolarHBondContact OG-CG2 3.32Å; S488-T535 PolarHBondContact OG-OG1 3.44Å; V533-T535 PolarHBondContact O-N 3.44Å; V533-T535 PolarHBondContact O-OG1 3Å
536	T	80.2	Confident	61	Low	1 Å²	1	89.1 Å²	89.1	1%	0.006	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-67.6	163.3	-175.9	63.7	0	0	0	0	112.4	R486 L487 Y534 I539 L558 V560 I564	R486-T536 WeakPolarHBondContact CG-O 3.31Å; R486-T536 PolarHBondContact NE-O 2.88Å; L487-T536 HydrophobicContact CB-CG2 3.84Å; L487-T536 HydrophobicContact CG-CG2 4.49Å; L487-T536 PolarHBondContact N-OG1 2.83Å; L487-T536 PolarHBondContact O-N 3.03Å; Y534-T536 HydrophobicContact CE1-CG2 4.14Å; T536-I539 HydrophobicContact CG2-CD1 4.33Å; T536-L558 HydrophobicContact CG2-CD2 3.94Å; T536-V560 HydrophobicContact CG2-CG1 4.44Å; T536-I564 HydrophobicContact CG2-CD1 3.73Å
537	P	77.5	Confident	63.8	Low	88 Å²	88	87.7 Å²	87.7	57%	0.571	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-53.7	169.1	151.1	-22.1	34.6	0	0	0	112	I539	P537-I539 PolarHBondContact O-N 3.02Å
538	Y	81.3	Confident	66.6	Low	82 Å²	82	88.4 Å²	88.4	32%	0.322	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.9	120.7	168.1	-71.5	-62.3	0	0	0	109.9	Y484 R486 E617	Y484-Y538 AromaticContact CD2-CD1 3.44Å; Y484-Y538 HydrophobicContact CD2-CD1 3.44Å; Y484-Y538 VanDerWaalsContact CD2-CD1 3.44Å; Y484-Y538 AromaticContact CD2-CE1 3.91Å; Y484-Y538 HydrophobicContact CD2-CE1 3.91Å; Y484-Y538 HydrophobicContact CD2-CG 4.28Å; Y484-Y538 AromaticContact CE2-CD1 3.53Å; Y484-Y538 HydrophobicContact CE2-CD1 3.53Å; Y484-Y538 AromaticContact CE2-CE1 3.48Å; Y484-Y538 HydrophobicContact CE2-CE1 3.48Å; Y484-Y538 VanDerWaalsContact CE2-CE1 3.48Å; Y484-Y538 HydrophobicContact CE2-CG 4.5Å; Y484-Y538 HydrophobicContact CG-CD1 4.37Å; R486-Y538 HydrophobicContact CB-CD1 4.22Å; R486-Y538 HydrophobicContact CB-CE1 4.34Å; R486-Y538 HydrophobicContact CG-CD1 4.33Å; R486-Y538 HydrophobicContact CG-CE1 4.46Å; Y538-E617 PolarHBondContact OH-OE2 2.84Å
539	I	85.8	Confident	69.2	Low	28 Å²	28	86.3 Å²	86.3	14%	0.144	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	105.5	176.8	-58.5	145.1	0	0	0	106.5	Y484 L485 L487 T536 P537 L541 I556 L558	Y484-I539 CarbonylContact C-O 3.58Å; Y484-I539 VanDerWaalsContact CA-O 3.23Å; Y484-I539 WeakPolarHBondContact CA-O 3.47Å; Y484-I539 WeakPolarHBondContact CB-O 3.48Å; L485-I539 HydrophobicContact CB-CB 4.42Å; L485-I539 PolarHBondContact N-O 2.84Å; L485-I539 PolarHBondContact O-N 2.84Å; L487-I539 HydrophobicContact CD1-CD1 3.85Å; L487-I539 HydrophobicContact CG-CD1 3.72Å; T536-I539 HydrophobicContact CG2-CD1 4.33Å; P537-I539 PolarHBondContact O-N 3.02Å; I539-L541 HydrophobicContact CG2-CD2 4.39Å; I539-I556 HydrophobicContact CG2-CD1 3.89Å; I539-L558 HydrophobicContact CD1-CD1 3.59Å; I539-L558 HydrophobicContact CG1-CD1 4.04Å
540	W	84.6	Confident	71.7	Confident	110 Å²	110	79 Å²	79	42%	0.417	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	134.5	177.6	-68	95.4	0	0	0	110.7	K482 Y484 D575	K482-W540 HydrophobicContact CB-CE3 4Å; K482-W540 HydrophobicContact CB-CZ3 3.84Å; Y484-W540 HydrophobicContact CD1-CE3 4.05Å; Y484-W540 AromaticContact CD1-CH2 3.81Å; Y484-W540 HydrophobicContact CD1-CH2 3.81Å; Y484-W540 HydrophobicContact CD1-CZ2 4.43Å; Y484-W540 AromaticContact CD1-CZ3 3.58Å; Y484-W540 HydrophobicContact CD1-CZ3 3.58Å; Y484-W540 HydrophobicContact CE1-CH2 4.33Å; Y484-W540 HydrophobicContact CE1-CZ3 4.43Å; Y484-W540 HydrophobicContact CG-CE3 4.36Å; Y484-W540 HydrophobicContact CG-CZ3 4.32Å; W540-D575 HydrophobicContact CH2-CB 3.93Å; W540-D575 HydrophobicContact CZ3-CB 3.95Å
541	L	84.7	Confident	74.1	Confident	6 Å²	6	74.7 Å²	74.7	3%	0.031	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	82.3	178.4	-60.1	-175.1	0	0	0	108.8	L469 V483 L485 I539 Y546 F554	L469-L541 HydrophobicContact CD1-CD1 3.5Å; L469-L541 HydrophobicContact CD2-CD1 4.22Å; V483-L541 HydrophobicContact CG1-CD1 4.19Å; V483-L541 PolarHBondContact O-N 2.94Å; L485-L541 HydrophobicContact CD1-CD1 3.89Å; L485-L541 HydrophobicContact CD1-CD2 4.38Å; L485-L541 HydrophobicContact CD1-CG 4.44Å; L485-L541 HydrophobicContact CG-CD1 3.91Å; L485-L541 HydrophobicContact CG-CG 4.35Å; I539-L541 HydrophobicContact CG2-CD2 4.39Å; L541-Y546 VanDerWaalsContact CB-OH 3.26Å; L541-Y546 WeakPolarHBondContact CB-OH 3.32Å; L541-Y546 PolarHBondContact O-OH 2.87Å; L541-F554 HydrophobicContact CB-CE1 3.97Å; L541-F554 HydrophobicContact CB-CE2 4.25Å; L541-F554 HydrophobicContact CB-CZ 3.79Å; L541-F554 HydrophobicContact CD1-CD2 4.14Å; L541-F554 HydrophobicContact CD1-CE2 3.92Å; L541-F554 HydrophobicContact CD1-CZ 4.31Å; L541-F554 HydrophobicContact CD2-CB 4.46Å; L541-F554 HydrophobicContact CD2-CD1 4.05Å; L541-F554 HydrophobicContact CD2-CD2 4.19Å; L541-F554 HydrophobicContact CD2-CE1 4.31Å; L541-F554 HydrophobicContact CD2-CE2 4.45Å; L541-F554 HydrophobicContact CD2-CG 3.97Å; L541-F554 HydrophobicContact CD2-CZ 4.5Å; L541-F554 HydrophobicContact CG-CE2 4.45Å; L541-F554 HydrophobicContact CG-CZ 4.43Å
542	E	70.7	Confident	76	Confident	82 Å²	82	68.8 Å²	68.8	38%	0.383	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	147.2	177.5	-62.7	-129.8	129.4	0	0	111.9	K482 G544 K683	K482-E542 IonicContact NZ-OE1 2.74Å; K482-E542 PolarHBondContact NZ-OE1 2.82Å; E542-G544 PolarHBondContact O-N 2.88Å; E542-K683 IonicContact OE2-NZ 3.22Å; E542-K683 PolarHBondContact OE2-NZ 2.87Å
543	D	69.9	Low	77.7	Confident	128 Å²	128	66.2 Å²	66.2	68%	0.684	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	22.2	169.9	-48.2	1.9	0	0	0	115.9	N545 K683	D543-N545 PolarHBondContact O-N 2.54Å; D543-K683 IonicContact OD1-NZ 2.73Å; D543-K683 PolarHBondContact OD1-NZ 2.9Å; D543-K683 WeakPolarHBondContact OD2-CE 3.46Å; D543-K683 IonicContact OD2-NZ 2.92Å; D543-K683 PolarHBondContact OD2-NZ 3.23Å
544	G	61.9	Low	78.8	Confident	13 Å²	13	64.3 Å²	64.3	13%	0.134	33%	0.328	C	S	.	.			trans	-67.3	126.3	171.4	0	0	0	0	0	112	E542 Y546	E542-G544 PolarHBondContact O-N 2.88Å; G544-Y546 WeakPolarHBondContact O-CD2 3.31Å; G544-Y546 WeakPolarHBondContact O-CE2 3.31Å; G544-Y546 PolarHBondContact O-N 2.71Å
545	N	73.3	Confident	78.8	Confident	111 Å²	111	65.9 Å²	65.9	59%	0.594	35%	0.348	S	S	*	.			trans	-84	94.8	176.9	-161.7	54	0	0	0	110.3	D543 D547 T552	D543-N545 PolarHBondContact O-N 2.54Å; N545-D547 VanDerWaalsContact C-N 3.35Å; N545-D547 PolarHBondContact ND2-OD2 2.9Å; N545-D547 PolarHBondContact O-N 3Å; N545-T552 PolarHBondContact O-OG1 2.9Å
546	Y	84.2	Confident	78.7	Confident	13 Å²	13	64.9 Å²	64.9	5%	0.051	34%	0.34	C	S	.	.			trans	-93.8	43.9	-172.2	-51.5	-61.9	0	0	0	113.1	G478 T479 V483 L541 G544 T552 F554 W583	G478-Y546 WeakPolarHBondContact CA-O 3.17Å; T479-Y546 HydrophobicContact CG2-CD2 3.66Å; T479-Y546 HydrophobicContact CG2-CG 3.96Å; T479-Y546 PolarHBondContact N-O 2.81Å; V483-Y546 HydrophobicContact CB-CE2 4.04Å; V483-Y546 HydrophobicContact CG2-CD2 3.96Å; V483-Y546 HydrophobicContact CG2-CE1 4.29Å; V483-Y546 HydrophobicContact CG2-CE2 3.5Å; L541-Y546 VanDerWaalsContact CB-OH 3.26Å; L541-Y546 WeakPolarHBondContact CB-OH 3.32Å; L541-Y546 PolarHBondContact O-OH 2.87Å; G544-Y546 WeakPolarHBondContact O-CD2 3.31Å; G544-Y546 WeakPolarHBondContact O-CE2 3.31Å; G544-Y546 PolarHBondContact O-N 2.71Å; Y546-T552 HydrophobicContact CE1-CG2 4.41Å; Y546-F554 HydrophobicContact CE1-CE2 4.37Å; Y546-F554 HydrophobicContact CE1-CZ 4.34Å; Y546-W583 HydrophobicContact CD1-CH2 4.48Å; Y546-W583 HydrophobicContact CD1-CZ3 4.01Å; Y546-W583 HydrophobicContact CG-CZ3 4.19Å
547	D	80.8	Confident	78.2	Confident	96 Å²	96	66.8 Å²	66.8	51%	0.513	35%	0.35	S	S	.	.			trans	-64.9	165.4	178.4	-80.3	-40.7	0	0	0	113.3	T471 N545 N549 G550	T471-D547 VanDerWaalsContact CB-O 3.26Å; T471-D547 WeakPolarHBondContact CB-O 3.27Å; T471-D547 PolarHBondContact OG1-O 3.5Å; N545-D547 VanDerWaalsContact C-N 3.35Å; N545-D547 PolarHBondContact ND2-OD2 2.9Å; N545-D547 PolarHBondContact O-N 3Å; D547-N549 PolarHBondContact O-N 2.98Å; D547-G550 PolarHBondContact O-N 2.86Å
548	R	83.9	Confident	78	Confident	129 Å²	129	63.4 Å²	63.4	49%	0.487	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	133.7	173.5	172.3	-176	167.7	-173.8	-5.7	111	D473 V474 A477 G550	D473-R548 IonicContact OD1-CZ 2.76Å; D473-R548 IonicContact OD1-NE 3.79Å; D473-R548 PolarHBondContact OD1-NE 2.95Å; D473-R548 IonicContact OD1-NH2 2.75Å; D473-R548 PolarHBondContact OD1-NH2 2.84Å; D473-R548 IonicContact OD2-NH2 3.76Å; V474-R548 VanDerWaalsContact O-CD 3.26Å; V474-R548 WeakPolarHBondContact O-CD 3.34Å; V474-R548 WeakPolarHBondContact O-CG 3.41Å; A477-R548 HydrophobicContact CB-CB 4.27Å; A477-R548 HydrophobicContact CB-CG 4.22Å; R548-G550 PolarHBondContact O-N 2.86Å
549	N	81.5	Confident	77.3	Confident	103 Å²	103	61.6 Å²	61.6	55%	0.551	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	28	-178.5	-157.3	20.8	0	0	0	114.3	G472 D473 D547	G472-N549 PolarHBondContact O-N 3.04Å; G472-N549 VanDerWaalsContact O-N 3.13Å; D473-N549 HydrophobicContact CB-CB 3.9Å; D547-N549 PolarHBondContact O-N 2.98Å
550	G	77.8	Confident	76.5	Confident	17 Å²	17	60.3 Å²	60.3	18%	0.175	32%	0.319	C	S	.	.			trans	-88.6	160.9	179.9	0	0	0	0	0	113.2	T471 D547 R548	T471-G550 PolarHBondContact N-O 3.18Å; T471-G550 WeakPolarHBondContact OG1-CA 3.25Å; T471-G550 PolarHBondContact OG1-N 2.82Å; T471-G550 PolarHBondContact OG1-O 3.17Å; T471-G550 VanDerWaalsContact OG1-O 3.12Å; D547-G550 PolarHBondContact O-N 2.86Å; R548-G550 PolarHBondContact O-N 2.86Å
551	V	81.4	Confident	75	Confident	86 Å²	86	57.5 Å²	57.5	52%	0.521	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.9	172.1	-171.5	0	0	0	0	109.2	L469 Y470	L469-V551 WeakPolarHBondContact O-CA 3.2Å; Y470-V551 HydrophobicContact CD1-CB 4.4Å; Y470-V551 HydrophobicContact CD1-CG1 4.12Å; Y470-V551 HydrophobicContact CD1-CG2 3.51Å; Y470-V551 HydrophobicContact CD2-CG1 4.45Å; Y470-V551 HydrophobicContact CE1-CB 4.32Å; Y470-V551 HydrophobicContact CE1-CG1 3.78Å; Y470-V551 HydrophobicContact CE1-CG2 3.52Å; Y470-V551 HydrophobicContact CE2-CG1 4.15Å; Y470-V551 HydrophobicContact CG-CG1 4.43Å; Y470-V551 HydrophobicContact CG-CG2 4.34Å
552	T	81.9	Confident	74	Confident	18 Å²	18	62.8 Å²	62.8	11%	0.11	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	179	-31.1	0	0	0	0	109.5	R468 L469 N545 Y546 F554	R468-T552 WeakPolarHBondContact CA-O 3.46Å; L469-T552 PolarHBondContact N-O 2.85Å; L469-T552 PolarHBondContact O-N 2.84Å; N545-T552 PolarHBondContact O-OG1 2.9Å; Y546-T552 HydrophobicContact CE1-CG2 4.41Å; T552-F554 HydrophobicContact CG2-CD2 4.34Å; T552-F554 HydrophobicContact CG2-CE2 3.45Å; T552-F554 VanDerWaalsContact CG2-CE2 3.45Å; T552-F554 HydrophobicContact CG2-CZ 3.58Å
553	L	80.4	Confident	73.8	Confident	95 Å²	95	62.2 Å²	62.2	50%	0.497	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130	176.2	172.6	65.7	0	0	0	110.3	E466 I467 R468	E466-L553 HydrophobicContact CB-CD1 4.15Å; E466-L553 HydrophobicContact CG-CD1 4.29Å; I467-L553 WeakPolarHBondContact O-CA 3.26Å; R468-L553 HydrophobicContact CG-CB 4.46Å; R468-L553 HydrophobicContact CG-CD1 3.6Å
554	F	80.3	Confident	74.2	Confident	31 Å²	31	56.2 Å²	56.2	14%	0.136	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.1	170.4	-60.6	-91	0	0	0	109.2	I467 L469 L541 Y546 T552	I467-F554 PolarHBondContact N-O 2.9Å; I467-F554 PolarHBondContact O-N 3.29Å; L469-F554 HydrophobicContact CD1-CD2 3.73Å; L469-F554 HydrophobicContact CD1-CE2 3.64Å; L541-F554 HydrophobicContact CB-CE1 3.97Å; L541-F554 HydrophobicContact CB-CE2 4.25Å; L541-F554 HydrophobicContact CB-CZ 3.79Å; L541-F554 HydrophobicContact CD1-CD2 4.14Å; L541-F554 HydrophobicContact CD1-CE2 3.92Å; L541-F554 HydrophobicContact CD1-CZ 4.31Å; L541-F554 HydrophobicContact CD2-CB 4.46Å; L541-F554 HydrophobicContact CD2-CD1 4.05Å; L541-F554 HydrophobicContact CD2-CD2 4.19Å; L541-F554 HydrophobicContact CD2-CE1 4.31Å; L541-F554 HydrophobicContact CD2-CE2 4.45Å; L541-F554 HydrophobicContact CD2-CG 3.97Å; L541-F554 HydrophobicContact CD2-CZ 4.5Å; L541-F554 HydrophobicContact CG-CE2 4.45Å; L541-F554 HydrophobicContact CG-CZ 4.43Å; Y546-F554 HydrophobicContact CE1-CE2 4.37Å; Y546-F554 HydrophobicContact CE1-CZ 4.34Å; T552-F554 HydrophobicContact CG2-CD2 4.34Å; T552-F554 HydrophobicContact CG2-CE2 3.45Å; T552-F554 VanDerWaalsContact CG2-CE2 3.45Å; T552-F554 HydrophobicContact CG2-CZ 3.58Å
555	S	73.7	Confident	74.7	Confident	92 Å²	92	55.9 Å²	55.9	64%	0.643	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	111.1	170.1	-65.3	0	0	0	0	108.4
556	I	76.6	Confident	75.1	Confident	34 Å²	34	51.3 Å²	51.3	17%	0.174	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.1	-175.9	42.4	-176.5	0	0	0	111.5	I463 L465 I467 I539 L558	I463-I556 VanDerWaalsContact O-O 3.14Å; L465-I556 HydrophobicContact CB-CG1 4.29Å; L465-I556 PolarHBondContact N-O 3.08Å; L465-I556 PolarHBondContact O-N 2.85Å; I467-I556 HydrophobicContact CD1-CD1 3.77Å; I467-I556 HydrophobicContact CD1-CG1 4.41Å; I467-I556 HydrophobicContact CG1-CD1 4.39Å; I539-I556 HydrophobicContact CG2-CD1 3.89Å; I556-L558 VanDerWaalsContact C-N 3.25Å; I556-L558 HydrophobicContact CD1-CD1 3.77Å; I556-L558 HydrophobicContact CG1-CD1 4.25Å; I556-L558 PolarHBondContact O-N 2.83Å
557	D	70	Confident	75.1	Confident	41 Å²	41	50.9 Å²	50.9	22%	0.219	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	70.3	-178.3	-147	28	0	0	0	108	K462 P559 R702 Y704	K462-D557 HydrophobicContact CB-CB 4.1Å; K462-D557 VanDerWaalsContact CB-CG 3.45Å; K462-D557 HydrophobicContact CD-CB 4.48Å; K462-D557 VanDerWaalsContact CD-OD2 3.32Å; K462-D557 WeakPolarHBondContact CD-OD2 3.49Å; K462-D557 WeakPolarHBondContact CE-O 3.16Å; K462-D557 WeakPolarHBondContact CE-OD2 3.1Å; K462-D557 IonicContact NZ-OD2 2.83Å; K462-D557 PolarHBondContact NZ-OD2 2.94Å; D557-P559 WeakPolarHBondContact O-CD 3.17Å; D557-R702 IonicContact OD2-NH1 3.05Å; D557-R702 PolarHBondContact OD2-NH1 3.17Å; D557-Y704 PolarHBondContact OD1-OH 2.91Å
558	L	72.6	Confident	75.1	Confident	16 Å²	16	49 Å²	49	8%	0.084	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	113.5	-156.1	-152.7	147.9	0	0	0	111.6	I463 L465 L487 T536 I539 I556 V560	I463-L558 PolarHBondContact N-O 2.86Å; I463-L558 PolarHBondContact O-N 2.8Å; L465-L558 HydrophobicContact CD1-CB 4.32Å; L465-L558 HydrophobicContact CD1-CD1 4.12Å; L487-L558 HydrophobicContact CD1-CD1 3.99Å; T536-L558 HydrophobicContact CG2-CD2 3.94Å; I539-L558 HydrophobicContact CD1-CD1 3.59Å; I539-L558 HydrophobicContact CG1-CD1 4.04Å; I556-L558 VanDerWaalsContact C-N 3.25Å; I556-L558 HydrophobicContact CD1-CD1 3.77Å; I556-L558 HydrophobicContact CG1-CD1 4.25Å; I556-L558 PolarHBondContact O-N 2.83Å; L558-V560 HydrophobicContact CD2-CG1 3.66Å; L558-V560 PolarHBondContact O-N 2.97Å
559	P	66.8	Low	75.2	Confident	44 Å²	44	46.5 Å²	46.5	29%	0.286	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	123.6	-176.9	28.5	-33.8	0	0	0	110.6	W460 Q461 D557	W460-P559 HydrophobicContact CB-CB 3.77Å; W460-P559 HydrophobicContact CD2-CB 4.17Å; W460-P559 VanDerWaalsContact CE3-C 3.49Å; W460-P559 HydrophobicContact CE3-CB 3.7Å; W460-P559 HydrophobicContact CE3-CG 4.35Å; W460-P559 VanDerWaalsContact CE3-O 3.24Å; W460-P559 HydrophobicContact CG-CB 4.29Å; W460-P559 HydrophobicContact CZ3-CB 4.46Å; W460-P559 WeakPolarHBondContact CZ3-O 3.27Å; Q461-P559 WeakPolarHBondContact O-CA 3.26Å; D557-P559 WeakPolarHBondContact O-CD 3.17Å
560	V	68.7	Low	75.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	150.5	173.7	-66.8	0	0	0	0	113.2	W460 Q461 I463 Y534 T536 L558 K562	W460-V560 CarbonylContact C-O 3.59Å; W460-V560 WeakPolarHBondContact CA-O 3.09Å; Q461-V560 PolarHBondContact N-O 2.97Å; Q461-V560 PolarHBondContact O-N 2.73Å; I463-V560 HydrophobicContact CB-CG2 4.36Å; I463-V560 HydrophobicContact CD1-CG2 3.37Å; I463-V560 HydrophobicContact CG1-CG2 3.71Å; Y534-V560 HydrophobicContact CD1-CG1 4.35Å; Y534-V560 HydrophobicContact CE1-CB 4.16Å; Y534-V560 HydrophobicContact CE1-CG1 3.74Å; T536-V560 HydrophobicContact CG2-CG1 4.44Å; L558-V560 HydrophobicContact CD2-CG1 3.66Å; L558-V560 PolarHBondContact O-N 2.97Å; V560-K562 WeakPolarHBondContact CG2-O 3.03Å
561	P	54.6	Low	76.2	Confident	52 Å²	52	41.8 Å²	41.8	34%	0.338	23%	0.232	S	C	.	.	S	Bend	trans	-82.4	-8.5	-175.1	32.8	-37	0	0	0	115.3	Y534	Y534-P561 HydrophobicContact CD2-CG 3.56Å; Y534-P561 HydrophobicContact CE2-CG 3.53Å; Y534-P561 HydrophobicContact CG-CG 4.12Å; Y534-P561 VanDerWaalsContact CZ-CD 3.49Å
562	K	62.6	Low	76.7	Confident	116 Å²	116	37.7 Å²	37.7	50%	0.504	21%	0.207	S	C	.	.	S	Bend	trans	-151.6	161.8	172	-82.1	-169.9	178.9	-179.5	0	108.2	E531 V560 I564	E531-K562 IonicContact OE1-NZ 2.72Å; E531-K562 PolarHBondContact OE1-NZ 2.9Å; V560-K562 WeakPolarHBondContact CG2-O 3.03Å; K562-I564 PolarHBondContact O-N 3.3Å; K562-I564 VanDerWaalsContact O-N 3.11Å
563	F	66.2	Low	77.1	Confident	71 Å²	71	36.8 Å²	36.8	31%	0.311	20%	0.202	S	C	.	.			trans	-56.7	114.3	171.3	-99.1	-100.5	0	0	0	111.9	I463 P490 L594 N595	I463-F563 HydrophobicContact CD1-CB 4.45Å; I463-F563 HydrophobicContact CD1-CD1 3.99Å; I463-F563 HydrophobicContact CD1-CD2 4.1Å; I463-F563 HydrophobicContact CD1-CE1 4.17Å; I463-F563 HydrophobicContact CD1-CE2 4.28Å; I463-F563 HydrophobicContact CD1-CG 3.95Å; I463-F563 HydrophobicContact CD1-CZ 4.3Å; P490-F563 WeakPolarHBondContact CB-O 3.33Å; P490-F563 WeakPolarHBondContact CD-O 3.46Å; P490-F563 WeakPolarHBondContact CG-O 3.44Å; F563-L594 HydrophobicContact CE1-CB 3.74Å; F563-L594 HydrophobicContact CE1-CD1 4.49Å; F563-L594 HydrophobicContact CZ-CB 3.54Å; F563-L594 HydrophobicContact CZ-CD1 3.82Å; F563-L594 HydrophobicContact CZ-CG 4.35Å; F563-N595 HydrophobicContact CD1-CB 4.12Å; F563-N595 HydrophobicContact CE1-CB 3.94Å
564	I	79.7	Confident	77.5	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.178	C	C	.	.			trans	-87	-17.8	-179.4	-155.7	176.2	0	0	0	113.1	L487 Y534 T536 K562 P566 L567	L487-I564 HydrophobicContact CB-CD1 3.75Å; Y534-I564 HydrophobicContact CD1-CD1 3.94Å; Y534-I564 HydrophobicContact CD1-CG1 4.49Å; Y534-I564 HydrophobicContact CE1-CD1 4.39Å; T536-I564 HydrophobicContact CG2-CD1 3.73Å; K562-I564 PolarHBondContact O-N 3.3Å; K562-I564 VanDerWaalsContact O-N 3.11Å; I564-P566 CarbonylContact O-C 3.57Å; I564-L567 HydrophobicContact CD1-CD2 4.35Å; I564-L567 HydrophobicContact CG1-CD2 4.02Å; I564-L567 HydrophobicContact CG2-CD2 4.17Å; I564-L567 WeakPolarHBondContact O-CA 3.21Å
565	S	71.9	Confident	77.7	Confident	5 Å²	5	32.2 Å²	32.2	4%	0.035	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-100.2	138.5	177	177.7	0	0	0	0	110.9	N595 Q599	S565-N595 WeakPolarHBondContact CB-ND2 3.24Å; S565-N595 PolarHBondContact O-ND2 2.86Å; S565-N595 PolarHBondContact OG-ND2 2.98Å; S565-Q599 PolarHBondContact OG-OE1 2.88Å
566	P	80.4	Confident	78.1	Confident	16 Å²	16	28.6 Å²	28.6	10%	0.104	15%	0.153	C	C	.	.	S	Bend	cis	-63.7	135.3	1	-17.6	30.6	0	0	0	111.9	P490 E491 I564 V597	P490-P566 CarbonylContact C-O 3.53Å; P490-P566 WeakPolarHBondContact CA-O 3.47Å; E491-P566 HydrophobicContact CB-CB 4.25Å; E491-P566 PolarHBondContact N-O 3.42Å; I564-P566 CarbonylContact O-C 3.57Å; P566-V597 HydrophobicContact CG-CG1 4.49Å; P566-V597 HydrophobicContact CG-CG2 4.37Å
567	L	85.8	Confident	78.2	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.016	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-69.2	137.4	178.6	-65.5	165.4	0	0	0	110.1	L487 S488 I564 I590 Q599 F601	L487-L567 HydrophobicContact CB-CD2 3.78Å; L487-L567 HydrophobicContact CD2-CD1 3.97Å; L487-L567 HydrophobicContact CD2-CD2 4.27Å; L487-L567 HydrophobicContact CG-CD2 4.42Å; S488-L567 CarbonylContact O-C 3.49Å; S488-L567 WeakPolarHBondContact O-CA 3.17Å; I564-L567 HydrophobicContact CD1-CD2 4.35Å; I564-L567 HydrophobicContact CG1-CD2 4.02Å; I564-L567 HydrophobicContact CG2-CD2 4.17Å; I564-L567 WeakPolarHBondContact O-CA 3.21Å; L567-I590 HydrophobicContact CD1-CB 4.4Å; L567-I590 HydrophobicContact CD1-CD1 3.48Å; L567-I590 VanDerWaalsContact CD1-CD1 3.48Å; L567-I590 HydrophobicContact CD1-CG1 4.49Å; L567-I590 HydrophobicContact CD1-CG2 4.18Å; L567-Q599 VanDerWaalsContact N-NE2 3.13Å; L567-Q599 PolarHBondContact O-NE2 3.34Å; L567-F601 HydrophobicContact CB-CZ 4.26Å; L567-F601 HydrophobicContact CD1-CE2 4.31Å; L567-F601 HydrophobicContact CD1-CZ 4.19Å
568	S	80.8	Confident	78.3	Confident	57 Å²	57	30.8 Å²	30.8	40%	0.399	18%	0.179	S	C	.	.	S	Bend	trans	-81.8	-30.4	170.8	58.2	0	0	0	0	112.1	S488 V533	S488-S568 PolarHBondContact O-N 2.79Å; S488-S568 PolarHBondContact O-OG 3.26Å; S488-S568 VanDerWaalsContact O-OG 3.13Å; V533-S568 WeakPolarHBondContact CG1-OG 3.47Å
569	Q	84.8	Confident	78.5	Confident	77 Å²	77	39.3 Å²	39.3	36%	0.36	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	143.7	-177.3	-165.2	175.6	-5.2	0	0	110.5	S488 I619	S488-Q569 PolarHBondContact N-O 3.41Å; S488-Q569 PolarHBondContact O-N 2.81Å; Q569-I619 HydrophobicContact CG-CG2 3.84Å; Q569-I619 VanDerWaalsContact NE2-CG2 3.32Å
570	L	91.7	Very high	79	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138	173.4	173.8	64.6	0	0	0	108.8	L485 L487 V588 I590 F601 L620	L485-L570 HydrophobicContact CD2-CD1 4.36Å; L487-L570 HydrophobicContact CD2-CD1 3.52Å; L570-V588 HydrophobicContact CD2-CB 4.06Å; L570-V588 HydrophobicContact CD2-CG1 3.57Å; L570-I590 HydrophobicContact CD1-CD1 3.9Å; L570-I590 HydrophobicContact CD2-CD1 4.15Å; L570-F601 HydrophobicContact CB-CD1 3.87Å; L570-F601 HydrophobicContact CB-CE1 3.67Å; L570-F601 HydrophobicContact CB-CG 4.42Å; L570-F601 HydrophobicContact CB-CZ 4.06Å; L570-F601 HydrophobicContact CD2-CB 3.88Å; L570-F601 HydrophobicContact CD2-CD1 3.81Å; L570-F601 HydrophobicContact CD2-CD2 3.64Å; L570-F601 HydrophobicContact CD2-CE1 4.24Å; L570-F601 HydrophobicContact CD2-CE2 4.07Å; L570-F601 HydrophobicContact CD2-CG 3.51Å; L570-F601 HydrophobicContact CD2-CZ 4.36Å; L570-F601 HydrophobicContact CG-CD1 4.49Å; L570-L620 HydrophobicContact CB-CB 4.29Å; L570-L620 HydrophobicContact CD2-CB 4.3Å; L570-L620 HydrophobicContact CD2-CD1 3.81Å; L570-L620 HydrophobicContact CG-CB 4.41Å; L570-L620 HydrophobicContact CG-CD1 4.29Å; L570-L620 PolarHBondContact N-O 2.67Å; L570-L620 PolarHBondContact O-N 3.17Å
571	V	90.1	Very high	79.3	Confident	20 Å²	20	40.4 Å²	40.4	12%	0.121	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.7	166.3	-172.8	0	0	0	0	108.4	L485 R486 E617 Q618 I619	L485-V571 CarbonylContact C-O 3.53Å; L485-V571 VanDerWaalsContact CA-O 3.29Å; L485-V571 WeakPolarHBondContact CA-O 3.37Å; R486-V571 HydrophobicContact CB-CB 3.89Å; R486-V571 HydrophobicContact CB-CG2 4.23Å; R486-V571 PolarHBondContact N-O 3.02Å; R486-V571 PolarHBondContact O-N 3Å; V571-E617 HydrophobicContact CG1-CB 4.02Å; V571-Q618 WeakPolarHBondContact CA-O 3.09Å; V571-I619 HydrophobicContact CG2-CG1 4.25Å
572	I	91.7	Very high	80.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	144.1	165.6	-173.2	167.8	0	0	0	108.9	L469 V483 L485 W583 F585 V588 L607 E617 Q618 L620	L469-I572 HydrophobicContact CD2-CD1 3.59Å; V483-I572 HydrophobicContact CG1-CD1 4.45Å; V483-I572 HydrophobicContact CG1-CG1 4.27Å; L485-I572 HydrophobicContact CD2-CB 3.9Å; L485-I572 HydrophobicContact CD2-CD1 4.27Å; L485-I572 HydrophobicContact CD2-CG1 3.84Å; I572-W583 HydrophobicContact CD1-CH2 4.25Å; I572-W583 HydrophobicContact CD1-CZ2 3.99Å; I572-F585 HydrophobicContact CD1-CD1 4.25Å; I572-F585 HydrophobicContact CD1-CD2 4.06Å; I572-F585 HydrophobicContact CD1-CE1 3.96Å; I572-F585 HydrophobicContact CD1-CE2 3.72Å; I572-F585 HydrophobicContact CD1-CG 4.32Å; I572-F585 HydrophobicContact CD1-CZ 3.67Å; I572-F585 HydrophobicContact CG2-CE1 4.23Å; I572-V588 HydrophobicContact CD1-CG2 4.47Å; I572-L607 HydrophobicContact CG2-CD1 4.25Å; I572-E617 CarbonylContact O-C 3.57Å; I572-E617 VanDerWaalsContact O-CA 3.32Å; I572-E617 WeakPolarHBondContact O-CA 3.48Å; I572-Q618 PolarHBondContact N-O 2.88Å; I572-Q618 PolarHBondContact O-N 2.81Å; I572-L620 HydrophobicContact CB-CD1 4.33Å; I572-L620 HydrophobicContact CG2-CD1 3.71Å; I572-L620 HydrophobicContact CG2-CG 4.1Å
573	G	89	Confident	81.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	176.9	174.8	0	0	0	0	0	113.4	V483 Y484 V616	V483-G573 CarbonylContact C-O 3.58Å; V483-G573 WeakPolarHBondContact CA-O 3.38Å; Y484-G573 PolarHBondContact N-O 2.72Å; Y484-G573 PolarHBondContact O-N 2.83Å; G573-V616 CarbonylContact C-O 3.5Å; G573-V616 WeakPolarHBondContact CA-O 3.1Å
574	H	88.5	Confident	82.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.4	173.2	62.2	109.6	0	0	0	111.2	A481 K482 N576 P581 V616	A481-H574 HydrophobicContact CB-CB 3.87Å; K482-H574 VanDerWaalsContact O-CA 3.28Å; K482-H574 WeakPolarHBondContact O-CA 3.06Å; H574-N576 PolarHBondContact ND1-N 2.9Å; H574-N576 PolarHBondContact O-N 2.99Å; H574-P581 PolarHBondContact CE1-O 3.31Å; H574-P581 PolarHBondContact ND1-O 2.61Å; H574-V616 PolarHBondContact N-O 2.93Å; H574-V616 WeakPolarHBondContact NE2-CB 3.24Å; H574-V616 PolarHBondContact O-N 2.75Å
575	D	85.7	Confident	83	Confident	30 Å²	30	32 Å²	32	16%	0.16	19%	0.188	C	C	.	.			trans	-71.6	-7.9	179.6	68.9	-13.6	0	0	0	114.8	A481 K482 W540 T577	A481-D575 WeakPolarHBondContact CB-OD1 3.13Å; K482-D575 PolarHBondContact N-OD1 3.14Å; K482-D575 PolarHBondContact O-N 3.21Å; W540-D575 HydrophobicContact CH2-CB 3.93Å; W540-D575 HydrophobicContact CZ3-CB 3.95Å; D575-T577 VanDerWaalsContact C-N 3.35Å; D575-T577 HydrophobicContact CB-CG2 4.32Å; D575-T577 PolarHBondContact OD1-N 3.48Å; D575-T577 PolarHBondContact OD1-OG1 3.02Å; D575-T577 WeakPolarHBondContact OD2-CB 3.35Å; D575-T577 WeakPolarHBondContact OD2-CG2 3.35Å; D575-T577 PolarHBondContact OD2-OG1 3.06Å
576	N	82.6	Confident	83.6	Confident	16 Å²	16	33.3 Å²	33.3	9%	0.086	19%	0.194	C	C	.	.			trans	66.9	29.6	-177.4	-156.4	34.4	0	0	0	113.7	H574 S609 S610 K611 M614 V616	H574-N576 PolarHBondContact ND1-N 2.9Å; H574-N576 PolarHBondContact O-N 2.99Å; N576-S609 WeakPolarHBondContact OD1-CA 3.45Å; N576-S609 WeakPolarHBondContact OD1-CB 3.11Å; N576-S610 VanDerWaalsContact ND2-C 3.27Å; N576-S610 PolarHBondContact ND2-N 3.19Å; N576-S610 PolarHBondContact ND2-O 3.23Å; N576-S610 PolarHBondContact OD1-N 3Å; N576-K611 PolarHBondContact ND2-O 2.97Å; N576-K611 VanDerWaalsContact ND2-O 3.11Å; N576-M614 WeakPolarHBondContact CB-O 3.49Å; N576-M614 PolarHBondContact ND2-O 3.26Å; N576-V616 HydrophobicContact CB-CG2 4.3Å
577	T	77.2	Confident	84.1	Confident	71 Å²	71	34.3 Å²	34.3	44%	0.436	20%	0.197	S	C	.	.			trans	-102.8	176.2	174.8	72.9	0	0	0	0	113.4	A481 D575	A481-T577 WeakPolarHBondContact CA-O 3.38Å; A481-T577 VanDerWaalsContact CB-O 3.28Å; A481-T577 WeakPolarHBondContact CB-O 3.28Å; D575-T577 VanDerWaalsContact C-N 3.35Å; D575-T577 HydrophobicContact CB-CG2 4.32Å; D575-T577 PolarHBondContact OD1-N 3.48Å; D575-T577 PolarHBondContact OD1-OG1 3.02Å; D575-T577 WeakPolarHBondContact OD2-CB 3.35Å; D575-T577 WeakPolarHBondContact OD2-CG2 3.35Å; D575-T577 PolarHBondContact OD2-OG1 3.06Å
578	G	73.9	Confident	84.3	Confident	49 Å²	49	34.2 Å²	34.2	51%	0.505	20%	0.196	S	C	.	.	S	Bend	trans	84.1	178.9	-179.4	0	0	0	0	0	114.5	T480	T480-G578 WeakPolarHBondContact OG1-CA 3.37Å
579	H	74.8	Confident	84.8	Confident	196 Å²	196	32.4 Å²	32.4	91%	0.907	18%	0.182	S	C	*	.	S	Bend	trans	-79.7	-30.8	-175.1	-65.8	-70.2	0	0	0	113.9	T480	T480-H579 PolarHBondContact OG1-N 2.84Å
580	S	77.6	Confident	85.1	Confident	46 Å²	46	28.8 Å²	28.8	32%	0.322	17%	0.165	S	C	.	.			trans	-128	83.7	171.1	-171.6	0	0	0	0	109.6	T479 T480 S582	T479-S580 CarbonylContact C-O 3.58Å; T479-S580 VanDerWaalsContact CA-O 3.29Å; T479-S580 WeakPolarHBondContact CA-O 3.35Å; T479-S580 PolarHBondContact OG1-O 3.48Å; T480-S580 PolarHBondContact N-O 2.73Å; T480-S580 PolarHBondContact OG1-N 2.82Å; T480-S580 PolarHBondContact OG1-O 2.72Å; S580-S582 VanDerWaalsContact C-N 3.35Å; S580-S582 PolarHBondContact OG-O 3.05Å
581	P	76.1	Confident	84.8	Confident	22 Å²	22	29.6 Å²	29.6	14%	0.143	17%	0.168	C	C	.	.			trans	-72	-27.7	176.6	21.6	-28.6	0	0	0	113.3	T479 A481 H574	T479-P581 PolarHBondContact OG1-O 2.72Å; A481-P581 HydrophobicContact CB-CB 4.24Å; H574-P581 PolarHBondContact CE1-O 3.31Å; H574-P581 PolarHBondContact ND1-O 2.61Å
582	S	81.2	Confident	84.6	Confident	27 Å²	27	28.6 Å²	28.6	19%	0.189	16%	0.162	C	C	.	.			trans	-78.5	137.3	178.8	-64.4	0	0	0	0	111.9	S580 L607 S609	S580-S582 VanDerWaalsContact C-N 3.35Å; S580-S582 PolarHBondContact OG-O 3.05Å; S582-L607 VanDerWaalsContact CA-O 3.3Å; S582-L607 WeakPolarHBondContact CA-O 3.45Å; S582-S609 WeakPolarHBondContact OG-CB 3.34Å; S582-S609 PolarHBondContact OG-N 2.75Å; S582-S609 PolarHBondContact OG-OG 2.63Å; S582-S609 VanDerWaalsContact OG-OG 3.14Å
583	W	87.3	Confident	83.8	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	157.9	-179.2	65.4	-40.9	0	0	0	113	L469 T471 A477 T479 V483 Y546 I572 F585 W606 L607	L469-W583 HydrophobicContact CD2-CH2 4.02Å; T471-W583 HydrophobicContact CG2-CE3 3.4Å; T471-W583 HydrophobicContact CG2-CZ3 3.59Å; A477-W583 VanDerWaalsContact O-CB 3.31Å; A477-W583 WeakPolarHBondContact O-CB 3.33Å; T479-W583 HydrophobicContact CG2-CB 4.38Å; T479-W583 HydrophobicContact CG2-CD2 3.68Å; T479-W583 HydrophobicContact CG2-CE3 3.78Å; T479-W583 HydrophobicContact CG2-CG 3.92Å; T479-W583 HydrophobicContact CG2-CZ3 4.38Å; V483-W583 HydrophobicContact CG1-CZ2 4.37Å; V483-W583 HydrophobicContact CG2-CH2 4.29Å; V483-W583 HydrophobicContact CG2-CZ2 4.14Å; Y546-W583 HydrophobicContact CD1-CH2 4.48Å; Y546-W583 HydrophobicContact CD1-CZ3 4.01Å; Y546-W583 HydrophobicContact CG-CZ3 4.19Å; I572-W583 HydrophobicContact CD1-CH2 4.25Å; I572-W583 HydrophobicContact CD1-CZ2 3.99Å; W583-F585 HydrophobicContact CD2-CB 4.48Å; W583-F585 HydrophobicContact CH2-CB 4.5Å; W583-F585 AromaticContact CH2-CD2 3.8Å; W583-F585 HydrophobicContact CH2-CD2 3.8Å; W583-F585 HydrophobicContact CH2-CG 4.4Å; W583-F585 HydrophobicContact CZ2-CB 4.24Å; W583-F585 HydrophobicContact CZ2-CD2 4.14Å; W583-F585 HydrophobicContact CZ2-CG 4.31Å; W583-F585 HydrophobicContact CZ3-CD2 4.31Å; W583-W606 CarbonylContact O-C 3.59Å; W583-W606 VanDerWaalsContact O-CA 3.28Å; W583-W606 WeakPolarHBondContact O-CA 3.49Å; W583-L607 HydrophobicContact CZ2-CD1 4.18Å; W583-L607 PolarHBondContact N-O 3.47Å; W583-L607 VanDerWaalsContact N-O 3.09Å; W583-L607 PolarHBondContact O-N 2.81Å
584	F	86.9	Confident	83.3	Confident	37 Å²	37	30.3 Å²	30.3	16%	0.162	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	112	174.8	-168.7	-74.3	0	0	0	109.6	G472 V474 A477 R604 W606	G472-F584 PolarHBondContact N-O 2.83Å; V474-F584 HydrophobicContact CG2-CB 3.6Å; V474-F584 HydrophobicContact CG2-CD1 4.37Å; V474-F584 HydrophobicContact CG2-CD2 3.77Å; V474-F584 HydrophobicContact CG2-CG 3.66Å; A477-F584 HydrophobicContact CB-CB 3.88Å; A477-F584 PolarHBondContact O-N 3.22Å; F584-R604 WeakPolarHBondContact CZ-O 3.43Å; F584-W606 HydrophobicContact CB-CD2 4.1Å; F584-W606 HydrophobicContact CB-CE3 4.25Å; F584-W606 HydrophobicContact CB-CZ2 4.37Å; F584-W606 HydrophobicContact CB-CZ3 4.45Å; F584-W606 AromaticContact CD2-CD1 3.72Å; F584-W606 HydrophobicContact CD2-CD2 4.22Å; F584-W606 AromaticContact CD2-CE2 3.99Å; F584-W606 HydrophobicContact CD2-CG 4.04Å; F584-W606 AromaticContact CD2-NE1 3.67Å
585	F	85.7	Confident	82.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.4	-176.6	171.9	-111.3	0	0	0	109.9	L469 I572 W583 K587 V588 Y603 R604 K605 L607 L620	L469-F585 HydrophobicContact CD2-CE2 4.16Å; I572-F585 HydrophobicContact CD1-CD1 4.25Å; I572-F585 HydrophobicContact CD1-CD2 4.06Å; I572-F585 HydrophobicContact CD1-CE1 3.96Å; I572-F585 HydrophobicContact CD1-CE2 3.72Å; I572-F585 HydrophobicContact CD1-CG 4.32Å; I572-F585 HydrophobicContact CD1-CZ 3.67Å; I572-F585 HydrophobicContact CG2-CE1 4.23Å; W583-F585 HydrophobicContact CD2-CB 4.48Å; W583-F585 HydrophobicContact CH2-CB 4.5Å; W583-F585 AromaticContact CH2-CD2 3.8Å; W583-F585 HydrophobicContact CH2-CD2 3.8Å; W583-F585 HydrophobicContact CH2-CG 4.4Å; W583-F585 HydrophobicContact CZ2-CB 4.24Å; W583-F585 HydrophobicContact CZ2-CD2 4.14Å; W583-F585 HydrophobicContact CZ2-CG 4.31Å; W583-F585 HydrophobicContact CZ3-CD2 4.31Å; F585-K587 VanDerWaalsContact CE2-C 3.47Å; F585-K587 WeakPolarHBondContact CE2-O 3.41Å; F585-V588 HydrophobicContact CE2-CG2 3.9Å; F585-V588 HydrophobicContact CZ-CB 3.97Å; F585-V588 HydrophobicContact CZ-CG2 3.57Å; F585-Y603 HydrophobicContact CB-CD1 4.26Å; F585-Y603 VanDerWaalsContact CD1-CB 3.5Å; F585-Y603 AromaticContact CD1-CD1 3.72Å; F585-Y603 HydrophobicContact CD1-CD1 3.72Å; F585-Y603 AromaticContact CD1-CG 3.89Å; F585-Y603 HydrophobicContact CD1-CG 3.89Å; F585-Y603 HydrophobicContact CE1-CG 4.4Å; F585-Y603 HydrophobicContact CG-CD1 4.49Å; F585-R604 WeakPolarHBondContact O-CA 3.44Å; F585-R604 PolarHBondContact O-N 2.91Å; F585-K605 PolarHBondContact N-O 2.82Å; F585-K605 PolarHBondContact O-N 2.86Å; F585-L607 HydrophobicContact CB-CD1 4.2Å; F585-L607 HydrophobicContact CD1-CD1 4.37Å; F585-L607 HydrophobicContact CG-CD1 4.46Å; F585-L620 HydrophobicContact CE1-CD1 3.76Å; F585-L620 HydrophobicContact CZ-CD1 4.23Å
586	D	84.6	Confident	82.3	Confident	31 Å²	31	29.8 Å²	29.8	17%	0.166	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-58.6	-178	179.7	67.5	0	0	0	111.2	Y470 Y603 R604	Y470-D586 PolarHBondContact O-N 2.97Å; D586-Y603 PolarHBondContact O-N 3.04Å; D586-R604 PolarHBondContact O-N 2.8Å; D586-R604 VanDerWaalsContact O-N 3.07Å; D586-R604 WeakPolarHBondContact OD1-CG 3.43Å; D586-R604 IonicContact OD1-CZ 3.87Å; D586-R604 IonicContact OD1-NE 3.5Å; D586-R604 PolarHBondContact OD1-NE 2.95Å
587	K	90	Very high	82.2	Confident	38 Å²	38	29.7 Å²	29.7	17%	0.165	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	157.1	-174.8	66.4	-173.2	174.7	-176	0	114.2	Y470 F585 F601 L602	Y470-K587 HydrophobicContact CD2-CD 4.1Å; Y470-K587 VanDerWaalsContact CD2-CE 3.42Å; Y470-K587 HydrophobicContact CD2-CG 3.57Å; Y470-K587 HydrophobicContact CE2-CD 4.48Å; Y470-K587 HydrophobicContact CE2-CG 4.35Å; Y470-K587 HydrophobicContact CG-CD 4.21Å; Y470-K587 HydrophobicContact CG-CG 3.73Å; Y470-K587 PolarHBondContact N-O 2.99Å; F585-K587 VanDerWaalsContact CE2-C 3.47Å; F585-K587 WeakPolarHBondContact CE2-O 3.41Å; K587-F601 CarbonylContact C-O 3.55Å; K587-F601 WeakPolarHBondContact CA-O 3.39Å; K587-F601 WeakPolarHBondContact CB-O 3.16Å; K587-L602 HydrophobicContact CB-CD2 4.12Å
588	V	91.1	Very high	82.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141.3	160.3	147.4	0	0	0	0	108.8	I467 R468 L469 L570 I572 F585 I590 F601	I467-V588 HydrophobicContact CG2-CG1 4.39Å; R468-V588 CarbonylContact O-C 3.56Å; R468-V588 WeakPolarHBondContact O-CA 3.2Å; L469-V588 HydrophobicContact CD2-CG2 3.97Å; L469-V588 HydrophobicContact CG-CG2 3.71Å; L570-V588 HydrophobicContact CD2-CB 4.06Å; L570-V588 HydrophobicContact CD2-CG1 3.57Å; I572-V588 HydrophobicContact CD1-CG2 4.47Å; F585-V588 HydrophobicContact CE2-CG2 3.9Å; F585-V588 HydrophobicContact CZ-CB 3.97Å; F585-V588 HydrophobicContact CZ-CG2 3.57Å; V588-I590 HydrophobicContact CG1-CD1 3.92Å; V588-I590 HydrophobicContact CG1-CG1 3.6Å; V588-F601 HydrophobicContact CB-CB 4.39Å; V588-F601 HydrophobicContact CG1-CD2 4.17Å; V588-F601 PolarHBondContact N-O 2.98Å; V588-F601 PolarHBondContact O-N 3.11Å
589	Q	90.4	Very high	83.3	Confident	20 Å²	20	24.9 Å²	24.9	9%	0.093	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.1	159.2	-58.4	-163.6	-78.9	0	0	110.3	I467 R468 Y470 E598 Q599 T600	I467-Q589 WeakPolarHBondContact CA-O 3.21Å; R468-Q589 HydrophobicContact CB-CB 4.43Å; R468-Q589 PolarHBondContact N-O 3.29Å; R468-Q589 PolarHBondContact O-N 2.81Å; Y470-Q589 HydrophobicContact CE2-CG 4.12Å; Y470-Q589 PolarHBondContact OH-OE1 3.04Å; Q589-E598 PolarHBondContact NE2-OE1 3.23Å; Q589-Q599 WeakPolarHBondContact CA-O 3.45Å; Q589-T600 HydrophobicContact CG-CG2 4.23Å; Q589-T600 PolarHBondContact NE2-OG1 3.33Å; Q589-T600 VanDerWaalsContact NE2-OG1 3.1Å
590	I	90.1	Very high	84	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119.9	175.3	-60.5	178.3	0	0	0	108.5	L465 E466 I467 L487 L567 L570 V588 E598 Q599 F601	L465-I590 HydrophobicContact CD2-CG2 4.06Å; E466-I590 WeakPolarHBondContact O-CA 3.43Å; I467-I590 HydrophobicContact CD1-CD1 4.31Å; I467-I590 HydrophobicContact CD1-CG1 4.34Å; I467-I590 HydrophobicContact CG1-CG1 4.12Å; I467-I590 HydrophobicContact CG1-CG2 4.42Å; I467-I590 HydrophobicContact CG2-CG1 4.15Å; L487-I590 HydrophobicContact CD2-CD1 3.86Å; L567-I590 HydrophobicContact CD1-CB 4.4Å; L567-I590 HydrophobicContact CD1-CD1 3.48Å; L567-I590 VanDerWaalsContact CD1-CD1 3.48Å; L567-I590 HydrophobicContact CD1-CG1 4.49Å; L567-I590 HydrophobicContact CD1-CG2 4.18Å; L570-I590 HydrophobicContact CD1-CD1 3.9Å; L570-I590 HydrophobicContact CD2-CD1 4.15Å; V588-I590 HydrophobicContact CG1-CD1 3.92Å; V588-I590 HydrophobicContact CG1-CG1 3.6Å; I590-E598 WeakPolarHBondContact O-CA 3.31Å; I590-Q599 PolarHBondContact N-O 3.27Å; I590-Q599 PolarHBondContact O-N 3.02Å; I590-F601 HydrophobicContact CD1-CE2 4.32Å
591	Y	86.2	Confident	84.6	Confident	17 Å²	17	13.8 Å²	13.8	7%	0.067	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.2	175.6	172.9	-121.9	0	0	0	111	L465 E466 P593 V597 E598 T630 K633	L465-Y591 WeakPolarHBondContact CA-O 3.48Å; E466-Y591 HydrophobicContact CB-CD1 4.47Å; E466-Y591 PolarHBondContact N-O 2.66Å; E466-Y591 PolarHBondContact O-N 3.24Å; Y591-P593 HydrophobicContact CD1-CG 4.05Å; Y591-P593 HydrophobicContact CE1-CB 4.26Å; Y591-P593 HydrophobicContact CE1-CG 3.72Å; Y591-V597 WeakPolarHBondContact CA-O 2.88Å; Y591-E598 HydrophobicContact CD2-CB 4.01Å; Y591-T630 HydrophobicContact CE2-CG2 4.07Å; Y591-T630 PolarHBondContact OH-OG1 3.31Å; Y591-T630 VanDerWaalsContact OH-OG1 3.09Å; Y591-K633 PolarHBondContact OH-NZ 2.78Å; Y591-K633 VanDerWaalsContact OH-NZ 3.11Å
592	C	86.1	Confident	85	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	101.7	173.1	175.5	0	0	0	0	109.9	L465 L594 N595 G596 V597	L465-C592 HydrophobicContact CD2-CB 3.84Å; C592-L594 PolarHBondContact O-N 3.1Å; C592-L594 VanDerWaalsContact O-N 3.1Å; C592-N595 VanDerWaalsContact CB-OD1 3.25Å; C592-N595 WeakPolarHBondContact CB-OD1 3.3Å; C592-N595 PolarHBondContact O-N 3.11Å; C592-N595 PolarHBondContact O-OD1 3.2Å; C592-G596 PolarHBondContact O-N 3.28Å; C592-V597 PolarHBondContact N-O 3.34Å
593	P	74.6	Confident	85.3	Confident	6 Å²	6	16.1 Å²	16.1	4%	0.039	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-36.2	177.5	-31.4	35.4	0	0	0	114.8	P464 Y591 K633 Y704	P464-P593 HydrophobicContact CB-CG 4.33Å; P464-P593 HydrophobicContact CG-CB 4.28Å; P464-P593 HydrophobicContact CG-CG 4.03Å; P464-P593 VanDerWaalsContact O-CD 3.31Å; P464-P593 WeakPolarHBondContact O-CD 3.33Å; Y591-P593 HydrophobicContact CD1-CG 4.05Å; Y591-P593 HydrophobicContact CE1-CB 4.26Å; Y591-P593 HydrophobicContact CE1-CG 3.72Å; P593-K633 HydrophobicContact CB-CB 4.37Å; P593-K633 HydrophobicContact CB-CD 3.89Å; P593-K633 WeakPolarHBondContact O-CB 3.2Å; P593-K633 PolarHBondContact O-N 2.96Å; P593-Y704 HydrophobicContact CB-CG 4.46Å
594	L	78.8	Confident	85.2	Confident	29 Å²	29	23.4 Å²	23.4	15%	0.152	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-32.9	-171.4	-57.9	179.4	0	0	0	113.7	P464 F563 C592 K633 P635 Y704	P464-L594 HydrophobicContact CG-CD1 4.39Å; P464-L594 HydrophobicContact CG-CG 4.1Å; F563-L594 HydrophobicContact CE1-CB 3.74Å; F563-L594 HydrophobicContact CE1-CD1 4.49Å; F563-L594 HydrophobicContact CZ-CB 3.54Å; F563-L594 HydrophobicContact CZ-CD1 3.82Å; F563-L594 HydrophobicContact CZ-CG 4.35Å; C592-L594 PolarHBondContact O-N 3.1Å; C592-L594 VanDerWaalsContact O-N 3.1Å; L594-K633 WeakPolarHBondContact CD2-O 3.43Å; L594-P635 HydrophobicContact CD2-CG 4.28Å; L594-Y704 HydrophobicContact CD2-CD1 3.96Å; L594-Y704 HydrophobicContact CD2-CE1 4.21Å
595	N	79.9	Confident	85.1	Confident	18 Å²	18	27.7 Å²	27.7	10%	0.096	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-12.7	175	75.1	2.2	0	0	0	113.2	F563 S565 C592 V597 K632	F563-N595 HydrophobicContact CD1-CB 4.12Å; F563-N595 HydrophobicContact CE1-CB 3.94Å; S565-N595 WeakPolarHBondContact CB-ND2 3.24Å; S565-N595 PolarHBondContact O-ND2 2.86Å; S565-N595 PolarHBondContact OG-ND2 2.98Å; C592-N595 VanDerWaalsContact CB-OD1 3.25Å; C592-N595 WeakPolarHBondContact CB-OD1 3.3Å; C592-N595 PolarHBondContact O-N 3.11Å; C592-N595 PolarHBondContact O-OD1 3.2Å; N595-V597 WeakPolarHBondContact OD1-CB 3.41Å; N595-V597 PolarHBondContact OD1-N 3.05Å; N595-K632 VanDerWaalsContact O-CE 3.27Å; N595-K632 WeakPolarHBondContact O-CE 3.47Å; N595-K632 WeakPolarHBondContact O-CG 3.45Å
596	G	74.1	Confident	85	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.01	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	8.6	179.1	0	0	0	0	0	115	C592 C629 T630	C592-G596 PolarHBondContact O-N 3.28Å; G596-C629 CarbonylContact O-C 3.51Å; G596-C629 WeakPolarHBondContact O-CA 3.41Å; G596-T630 WeakPolarHBondContact CA-OG1 3.45Å; G596-T630 PolarHBondContact O-N 3.22Å; G596-T630 PolarHBondContact O-OG1 3.05Å
597	V	80.1	Confident	85	Confident	14 Å²	14	31.4 Å²	31.4	9%	0.085	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.8	-172.1	-171.5	0	0	0	0	111.1	P566 Y591 C592 N595 Q599 R627	P566-V597 HydrophobicContact CG-CG1 4.49Å; P566-V597 HydrophobicContact CG-CG2 4.37Å; Y591-V597 WeakPolarHBondContact CA-O 2.88Å; C592-V597 PolarHBondContact N-O 3.34Å; N595-V597 WeakPolarHBondContact OD1-CB 3.41Å; N595-V597 PolarHBondContact OD1-N 3.05Å; V597-Q599 HydrophobicContact CG1-CG 3.83Å; V597-R627 HydrophobicContact CG1-CG 4.02Å
598	E	85.4	Confident	84.4	Confident	20 Å²	20	33.7 Å²	33.7	9%	0.093	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	113.4	167.1	-175.2	-174	148.7	0	0	108.2	Q589 I590 Y591 R627 K628	Q589-E598 PolarHBondContact NE2-OE1 3.23Å; I590-E598 WeakPolarHBondContact O-CA 3.31Å; Y591-E598 HydrophobicContact CD2-CB 4.01Å; E598-R627 WeakPolarHBondContact O-CA 3.22Å; E598-K628 HydrophobicContact CB-CB 4.18Å; E598-K628 PolarHBondContact N-O 3.19Å; E598-K628 PolarHBondContact O-N 3.22Å; E598-K628 IonicContact OE1-NZ 2.8Å; E598-K628 PolarHBondContact OE1-NZ 2.62Å; E598-K628 WeakPolarHBondContact OE2-CD 3.37Å; E598-K628 IonicContact OE2-NZ 3.33Å; E598-K628 PolarHBondContact OE2-NZ 3.17Å
599	Q	89.3	Confident	83.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139.3	178.5	-61.3	178.4	-94.9	0	0	109.8	S565 L567 Q589 I590 V597 F601 E622	S565-Q599 PolarHBondContact OG-OE1 2.88Å; L567-Q599 VanDerWaalsContact N-NE2 3.13Å; L567-Q599 PolarHBondContact O-NE2 3.34Å; Q589-Q599 WeakPolarHBondContact CA-O 3.45Å; I590-Q599 PolarHBondContact N-O 3.27Å; I590-Q599 PolarHBondContact O-N 3.02Å; V597-Q599 HydrophobicContact CG1-CG 3.83Å; Q599-F601 HydrophobicContact CB-CD2 4.43Å; Q599-F601 HydrophobicContact CB-CE2 3.62Å; Q599-F601 HydrophobicContact CB-CZ 4.19Å; Q599-E622 HydrophobicContact CB-CG 4.13Å; Q599-E622 PolarHBondContact NE2-OE2 3.36Å
600	T	87.7	Confident	82.4	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.037	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.9	178.8	-58.9	0	0	0	0	110.6	Q589 E622 E623 L626	Q589-T600 HydrophobicContact CG-CG2 4.23Å; Q589-T600 PolarHBondContact NE2-OG1 3.33Å; Q589-T600 VanDerWaalsContact NE2-OG1 3.1Å; T600-E622 WeakPolarHBondContact O-CG 3.46Å; T600-E623 PolarHBondContact O-N 3.3Å; T600-L626 HydrophobicContact CG2-CB 4.4Å; T600-L626 HydrophobicContact CG2-CD1 3.96Å
601	F	91.6	Very high	81.2	Confident	2 Å²	2	46 Å²	46	1%	0.009	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	109.8	-176.2	-64	-96.5	0	0	0	109.2	L567 L570 K587 V588 I590 Q599 L620 C621 E622	L567-F601 HydrophobicContact CB-CZ 4.26Å; L567-F601 HydrophobicContact CD1-CE2 4.31Å; L567-F601 HydrophobicContact CD1-CZ 4.19Å; L570-F601 HydrophobicContact CB-CD1 3.87Å; L570-F601 HydrophobicContact CB-CE1 3.67Å; L570-F601 HydrophobicContact CB-CG 4.42Å; L570-F601 HydrophobicContact CB-CZ 4.06Å; L570-F601 HydrophobicContact CD2-CB 3.88Å; L570-F601 HydrophobicContact CD2-CD1 3.81Å; L570-F601 HydrophobicContact CD2-CD2 3.64Å; L570-F601 HydrophobicContact CD2-CE1 4.24Å; L570-F601 HydrophobicContact CD2-CE2 4.07Å; L570-F601 HydrophobicContact CD2-CG 3.51Å; L570-F601 HydrophobicContact CD2-CZ 4.36Å; L570-F601 HydrophobicContact CG-CD1 4.49Å; K587-F601 CarbonylContact C-O 3.55Å; K587-F601 WeakPolarHBondContact CA-O 3.39Å; K587-F601 WeakPolarHBondContact CB-O 3.16Å; V588-F601 HydrophobicContact CB-CB 4.39Å; V588-F601 HydrophobicContact CG1-CD2 4.17Å; V588-F601 PolarHBondContact N-O 2.98Å; V588-F601 PolarHBondContact O-N 3.11Å; I590-F601 HydrophobicContact CD1-CE2 4.32Å; Q599-F601 HydrophobicContact CB-CD2 4.43Å; Q599-F601 HydrophobicContact CB-CE2 3.62Å; Q599-F601 HydrophobicContact CB-CZ 4.19Å; F601-L620 HydrophobicContact CB-CB 4.14Å; F601-L620 HydrophobicContact CB-CD1 4.17Å; F601-L620 HydrophobicContact CD1-CB 3.98Å; F601-L620 HydrophobicContact CG-CB 4.47Å; F601-C621 VanDerWaalsContact CD1-C 3.45Å; F601-C621 WeakPolarHBondContact CD1-O 3.42Å; F601-E622 HydrophobicContact CD1-CB 4.23Å; F601-E622 HydrophobicContact CE1-CB 3.83Å; F601-E622 HydrophobicContact CZ-CB 4.1Å
602	L	83.9	Confident	79.6	Confident	53 Å²	53	51.1 Å²	51.1	28%	0.277	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	144.8	-180	-71.5	166.1	0	0	0	111.4	K587 R604 E623 L626	K587-L602 HydrophobicContact CB-CD2 4.12Å; L602-R604 HydrophobicContact CD2-CG 4.48Å; L602-E623 HydrophobicContact CD1-CB 3.99Å; L602-E623 HydrophobicContact CD1-CG 3.87Å; L602-E623 HydrophobicContact CG-CB 4.41Å; L602-L626 HydrophobicContact CD1-CD1 4.22Å
603	Y	87.4	Confident	78.4	Confident	46 Å²	46	55 Å²	55	18%	0.18	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	-47.7	170.2	-170	-120.3	0	0	0	113.2	F585 D586 K605 L607 Q618 L620	F585-Y603 HydrophobicContact CB-CD1 4.26Å; F585-Y603 VanDerWaalsContact CD1-CB 3.5Å; F585-Y603 AromaticContact CD1-CD1 3.72Å; F585-Y603 HydrophobicContact CD1-CD1 3.72Å; F585-Y603 AromaticContact CD1-CG 3.89Å; F585-Y603 HydrophobicContact CD1-CG 3.89Å; F585-Y603 HydrophobicContact CE1-CG 4.4Å; F585-Y603 HydrophobicContact CG-CD1 4.49Å; D586-Y603 PolarHBondContact O-N 3.04Å; Y603-K605 VanDerWaalsContact C-N 3.28Å; Y603-K605 HydrophobicContact CD1-CB 3.71Å; Y603-K605 WeakPolarHBondContact CD1-O 3.28Å; Y603-K605 HydrophobicContact CE1-CB 3.45Å; Y603-K605 VanDerWaalsContact CE1-CB 3.45Å; Y603-K605 WeakPolarHBondContact CE1-O 2.82Å; Y603-K605 HydrophobicContact CE2-CB 4.39Å; Y603-K605 HydrophobicContact CE2-CD 4.39Å; Y603-K605 HydrophobicContact CG-CB 4.32Å; Y603-K605 WeakPolarHBondContact O-CG 3.24Å; Y603-K605 PolarHBondContact O-N 3.25Å; Y603-L607 HydrophobicContact CE1-CG 3.99Å; Y603-Q618 HydrophobicContact CD2-CG 4.42Å; Y603-Q618 HydrophobicContact CE2-CG 3.6Å; Y603-Q618 PolarHBondContact OH-NE2 2.98Å; Y603-L620 HydrophobicContact CD2-CD2 3.65Å; Y603-L620 HydrophobicContact CG-CD2 4.05Å
604	R	86	Confident	77.9	Confident	153 Å²	153	60.5 Å²	60.5	58%	0.577	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.1	39.2	176.4	-55.4	-156.3	154.4	152.1	-0.6	114.9	F584 F585 D586 L602	F584-R604 WeakPolarHBondContact CZ-O 3.43Å; F585-R604 WeakPolarHBondContact O-CA 3.44Å; F585-R604 PolarHBondContact O-N 2.91Å; D586-R604 PolarHBondContact O-N 2.8Å; D586-R604 VanDerWaalsContact O-N 3.07Å; D586-R604 WeakPolarHBondContact OD1-CG 3.43Å; D586-R604 IonicContact OD1-CZ 3.87Å; D586-R604 IonicContact OD1-NE 3.5Å; D586-R604 PolarHBondContact OD1-NE 2.95Å; L602-R604 HydrophobicContact CD2-CG 4.48Å
605	K	84.1	Confident	77.5	Confident	128 Å²	128	63.2 Å²	63.2	56%	0.557	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.6	161.7	-172.7	-76.3	174	-172.9	171.8	0	111.8	F585 Y603	F585-K605 PolarHBondContact N-O 2.82Å; F585-K605 PolarHBondContact O-N 2.86Å; Y603-K605 VanDerWaalsContact C-N 3.28Å; Y603-K605 HydrophobicContact CD1-CB 3.71Å; Y603-K605 WeakPolarHBondContact CD1-O 3.28Å; Y603-K605 HydrophobicContact CE1-CB 3.45Å; Y603-K605 VanDerWaalsContact CE1-CB 3.45Å; Y603-K605 WeakPolarHBondContact CE1-O 2.82Å; Y603-K605 HydrophobicContact CE2-CB 4.39Å; Y603-K605 HydrophobicContact CE2-CD 4.39Å; Y603-K605 HydrophobicContact CG-CB 4.32Å; Y603-K605 WeakPolarHBondContact O-CG 3.24Å; Y603-K605 PolarHBondContact O-N 3.25Å
606	W	84.7	Confident	77.5	Confident	105 Å²	105	63.3 Å²	63.3	40%	0.398	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	126.6	168	-70.3	96.7	0	0	0	111.2	V474 P475 N476 W583 F584 T608	V474-W606 HydrophobicContact CG2-CZ2 3.96Å; P475-W606 WeakPolarHBondContact O-CH2 3.23Å; N476-W606 HydrophobicContact CB-CH2 4.44Å; N476-W606 WeakPolarHBondContact O-CH2 3.43Å; N476-W606 WeakPolarHBondContact O-CZ3 3.39Å; W583-W606 CarbonylContact O-C 3.59Å; W583-W606 VanDerWaalsContact O-CA 3.28Å; W583-W606 WeakPolarHBondContact O-CA 3.49Å; F584-W606 HydrophobicContact CB-CD2 4.1Å; F584-W606 HydrophobicContact CB-CE3 4.25Å; F584-W606 HydrophobicContact CB-CZ2 4.37Å; F584-W606 HydrophobicContact CB-CZ3 4.45Å; F584-W606 AromaticContact CD2-CD1 3.72Å; F584-W606 HydrophobicContact CD2-CD2 4.22Å; F584-W606 AromaticContact CD2-CE2 3.99Å; F584-W606 HydrophobicContact CD2-CG 4.04Å; F584-W606 AromaticContact CD2-NE1 3.67Å; W606-T608 HydrophobicContact CB-CG2 3.71Å
607	L	83.6	Confident	78.1	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.016	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	105	155.7	-93.7	158.2	0	0	0	106.3	I572 S582 W583 F585 Y603 V616 Q618	I572-L607 HydrophobicContact CG2-CD1 4.25Å; S582-L607 VanDerWaalsContact CA-O 3.3Å; S582-L607 WeakPolarHBondContact CA-O 3.45Å; W583-L607 HydrophobicContact CZ2-CD1 4.18Å; W583-L607 PolarHBondContact N-O 3.47Å; W583-L607 VanDerWaalsContact N-O 3.09Å; W583-L607 PolarHBondContact O-N 2.81Å; F585-L607 HydrophobicContact CB-CD1 4.2Å; F585-L607 HydrophobicContact CD1-CD1 4.37Å; F585-L607 HydrophobicContact CG-CD1 4.46Å; Y603-L607 HydrophobicContact CE1-CG 3.99Å; L607-V616 HydrophobicContact CD2-CG1 3.99Å; L607-Q618 HydrophobicContact CD2-CB 4.18Å
608	T	78.5	Confident	78.4	Confident	87 Å²	87	70.6 Å²	70.6	53%	0.534	37%	0.367	S	S	.	.			trans	-99.5	136.8	-171.5	55.4	0	0	0	0	112.3	W606	W606-T608 HydrophobicContact CB-CG2 3.71Å
609	S	72	Confident	78.6	Confident	59 Å²	59	74.3 Å²	74.3	41%	0.413	39%	0.386	S	S	.	.			trans	-55.5	135.7	178.7	54.6	0	0	0	0	114.1	N576 S582	N576-S609 WeakPolarHBondContact OD1-CA 3.45Å; N576-S609 WeakPolarHBondContact OD1-CB 3.11Å; S582-S609 WeakPolarHBondContact OG-CB 3.34Å; S582-S609 PolarHBondContact OG-N 2.75Å; S582-S609 PolarHBondContact OG-OG 2.63Å; S582-S609 VanDerWaalsContact OG-OG 3.14Å
610	S	66.8	Low	78.4	Confident	55 Å²	55	74.5 Å²	74.5	39%	0.385	39%	0.388	S	S	.	.			trans	-99	-161.1	172.4	85.3	0	0	0	0	111.3	N576 M614	N576-S610 VanDerWaalsContact ND2-C 3.27Å; N576-S610 PolarHBondContact ND2-N 3.19Å; N576-S610 PolarHBondContact ND2-O 3.23Å; N576-S610 PolarHBondContact OD1-N 3Å; S610-M614 WeakPolarHBondContact OG-CB 3.22Å; S610-M614 PolarHBondContact OG-O 3.48Å
611	K	63.7	Low	78.1	Confident	165 Å²	165	79.1 Å²	79.1	72%	0.717	42%	0.419	S	S	*	.	S	Bend	trans	-64	147.5	174.4	-73.2	-167.7	173.9	-168.9	0	111	N576 G613 M614	N576-K611 PolarHBondContact ND2-O 2.97Å; N576-K611 VanDerWaalsContact ND2-O 3.11Å; K611-G613 PolarHBondContact O-N 2.84Å; K611-M614 PolarHBondContact O-N 2.97Å; K611-M614 VanDerWaalsContact O-N 3.14Å
612	P	54.2	Low	77.9	Confident	124 Å²	124	80.3 Å²	80.3	81%	0.805	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	138.8	175	-27.4	35.4	0	0	0	112.2	M614	P612-M614 VanDerWaalsContact C-N 3.29Å; P612-M614 PolarHBondContact O-N 2.85Å
613	G	60.9	Low	77.8	Confident	80 Å²	80	81.5 Å²	81.5	83%	0.825	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-8.5	-177.9	0	0	0	0	0	115.7	K611	K611-G613 PolarHBondContact O-N 2.84Å
614	M	64.2	Low	77	Confident	123 Å²	123	85.1 Å²	85.1	61%	0.606	45%	0.445	S	S	*	.			trans	-98.3	118.1	170.5	-66.4	-161.8	75.5	0	0	111.3	N576 S610 K611 P612	N576-M614 WeakPolarHBondContact CB-O 3.49Å; N576-M614 PolarHBondContact ND2-O 3.26Å; S610-M614 WeakPolarHBondContact OG-CB 3.22Å; S610-M614 PolarHBondContact OG-O 3.48Å; K611-M614 PolarHBondContact O-N 2.97Å; K611-M614 VanDerWaalsContact O-N 3.14Å; P612-M614 VanDerWaalsContact C-N 3.29Å; P612-M614 PolarHBondContact O-N 2.85Å
615	K	69.1	Low	75.7	Confident	85 Å²	85	82.4 Å²	82.4	37%	0.37	45%	0.45	S	S	.	.			trans	-53.4	142.4	167.7	-80.4	176.4	159.7	-119.3	0	110.9	Y484	Y484-K615 HydrophobicContact CE1-CB 4.49Å; Y484-K615 HydrophobicContact CE1-CD 4Å; Y484-K615 HydrophobicContact CE1-CG 4.1Å; Y484-K615 WeakPolarHBondContact OH-CB 3.5Å; Y484-K615 WeakPolarHBondContact OH-CD 3.12Å
616	V	79.8	Confident	75.1	Confident	20 Å²	20	80.1 Å²	80.1	12%	0.121	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.6	174.5	178.8	0	0	0	0	107.8	G573 H574 N576 L607	G573-V616 CarbonylContact C-O 3.5Å; G573-V616 WeakPolarHBondContact CA-O 3.1Å; H574-V616 PolarHBondContact N-O 2.93Å; H574-V616 WeakPolarHBondContact NE2-CB 3.24Å; H574-V616 PolarHBondContact O-N 2.75Å; N576-V616 HydrophobicContact CB-CG2 4.3Å; L607-V616 HydrophobicContact CD2-CG1 3.99Å
617	E	87.4	Confident	75	Confident	88 Å²	88	78.8 Å²	78.8	41%	0.411	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.4	-178.6	55.8	-173.5	-157	0	0	112.6	Y484 Y538 V571 I572	Y484-E617 HydrophobicContact CE2-CB 4.29Å; Y484-E617 WeakPolarHBondContact CE2-OE2 3.26Å; Y484-E617 PolarHBondContact OH-OE2 3.02Å; Y538-E617 PolarHBondContact OH-OE2 2.84Å; V571-E617 HydrophobicContact CG1-CB 4.02Å; I572-E617 CarbonylContact O-C 3.57Å; I572-E617 VanDerWaalsContact O-CA 3.32Å; I572-E617 WeakPolarHBondContact O-CA 3.48Å
618	Q	87.3	Confident	74.2	Confident	81 Å²	81	84 Å²	84	38%	0.379	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	137.8	-175.1	-160.5	66.4	-101	0	0	111.2	V571 I572 Y603 L607	V571-Q618 WeakPolarHBondContact CA-O 3.09Å; I572-Q618 PolarHBondContact N-O 2.88Å; I572-Q618 PolarHBondContact O-N 2.81Å; Y603-Q618 HydrophobicContact CD2-CG 4.42Å; Y603-Q618 HydrophobicContact CE2-CG 3.6Å; Y603-Q618 PolarHBondContact OH-NE2 2.98Å; L607-Q618 HydrophobicContact CD2-CB 4.18Å
619	I	87.6	Confident	73.5	Confident	97 Å²	97	83.3 Å²	83.3	50%	0.497	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.2	175.2	-67.1	160.4	0	0	0	108.9	Q569 V571	Q569-I619 HydrophobicContact CG-CG2 3.84Å; Q569-I619 VanDerWaalsContact NE2-CG2 3.32Å; V571-I619 HydrophobicContact CG2-CG1 4.25Å
620	L	86.1	Confident	73.2	Confident	5 Å²	5	83.1 Å²	83.1	3%	0.026	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138	176	-57.3	175.5	0	0	0	110.3	L570 I572 F585 F601 Y603	L570-L620 HydrophobicContact CB-CB 4.29Å; L570-L620 HydrophobicContact CD2-CB 4.3Å; L570-L620 HydrophobicContact CD2-CD1 3.81Å; L570-L620 HydrophobicContact CG-CB 4.41Å; L570-L620 HydrophobicContact CG-CD1 4.29Å; L570-L620 PolarHBondContact N-O 2.67Å; L570-L620 PolarHBondContact O-N 3.17Å; I572-L620 HydrophobicContact CB-CD1 4.33Å; I572-L620 HydrophobicContact CG2-CD1 3.71Å; I572-L620 HydrophobicContact CG2-CG 4.1Å; F585-L620 HydrophobicContact CE1-CD1 3.76Å; F585-L620 HydrophobicContact CZ-CD1 4.23Å; F601-L620 HydrophobicContact CB-CB 4.14Å; F601-L620 HydrophobicContact CB-CD1 4.17Å; F601-L620 HydrophobicContact CD1-CB 3.98Å; F601-L620 HydrophobicContact CG-CB 4.47Å; Y603-L620 HydrophobicContact CD2-CD2 3.65Å; Y603-L620 HydrophobicContact CG-CD2 4.05Å
621	C	82.4	Confident	73	Confident	102 Å²	102	84.9 Å²	84.9	69%	0.689	46%	0.46	S	S	*	.			trans	-102.3	150.1	169.9	-60.9	0	0	0	0	109.6	F601	F601-C621 VanDerWaalsContact CD1-C 3.45Å; F601-C621 WeakPolarHBondContact CD1-O 3.42Å
622	E	86.5	Confident	73.5	Confident	27 Å²	27	83.8 Å²	83.8	13%	0.126	46%	0.455	C	S	.	.			trans	-74.3	134.2	178.2	-174.3	-172.7	169.2	0	0	111.4	Q599 T600 F601 K624 R627	Q599-E622 HydrophobicContact CB-CG 4.13Å; Q599-E622 PolarHBondContact NE2-OE2 3.36Å; T600-E622 WeakPolarHBondContact O-CG 3.46Å; F601-E622 HydrophobicContact CD1-CB 4.23Å; F601-E622 HydrophobicContact CE1-CB 3.83Å; F601-E622 HydrophobicContact CZ-CB 4.1Å; E622-K624 HydrophobicContact CG-CG 4.46Å; E622-K624 PolarHBondContact O-N 3.41Å; E622-K624 VanDerWaalsContact O-N 3.09Å; E622-R627 WeakPolarHBondContact OE1-CB 3.43Å; E622-R627 WeakPolarHBondContact OE1-CG 3.42Å; E622-R627 IonicContact OE1-CZ 2.71Å; E622-R627 IonicContact OE1-NE 2.8Å; E622-R627 PolarHBondContact OE1-NE 2.8Å; E622-R627 IonicContact OE1-NH2 2.74Å; E622-R627 IonicContact OE2-CZ 3.79Å; E622-R627 IonicContact OE2-NE 3.17Å; E622-R627 PolarHBondContact OE2-NE 2.82Å; E622-R627 IonicContact OE2-NH2 3.05Å; E622-R627 PolarHBondContact OE2-NH2 2.83Å
623	E	81.1	Confident	74.7	Confident	78 Å²	78	81.2 Å²	81.2	36%	0.364	43%	0.431	S	S	.	.			trans	-78.7	88.2	167.1	-178.4	48.7	-109.6	0	0	109.4	T600 L602 S625 L626	T600-E623 PolarHBondContact O-N 3.3Å; L602-E623 HydrophobicContact CD1-CB 3.99Å; L602-E623 HydrophobicContact CD1-CG 3.87Å; L602-E623 HydrophobicContact CG-CB 4.41Å; E623-S625 VanDerWaalsContact CD-OG 3.31Å; E623-S625 WeakPolarHBondContact CG-OG 3.36Å; E623-S625 PolarHBondContact O-N 2.87Å; E623-S625 WeakPolarHBondContact OE1-CB 3.5Å; E623-S625 PolarHBondContact OE1-N 2.97Å; E623-S625 PolarHBondContact OE1-OG 2.86Å; E623-L626 HydrophobicContact CB-CD1 4.24Å; E623-L626 HydrophobicContact CB-CG 4.49Å; E623-L626 HydrophobicContact CG-CB 4.37Å; E623-L626 HydrophobicContact CG-CD1 3.8Å; E623-L626 HydrophobicContact CG-CG 3.84Å; E623-L626 WeakPolarHBondContact O-CB 3.41Å; E623-L626 PolarHBondContact O-N 3.37Å
624	K	72.1	Confident	75.7	Confident	123 Å²	123	78.3 Å²	78.3	54%	0.535	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-61.6	-18.6	-171.5	-68.9	-175	175.5	-176.6	0	114.3	E491 E622 L626	E491-K624 WeakPolarHBondContact OE1-CE 3.41Å; E491-K624 IonicContact OE1-NZ 2.7Å; E491-K624 PolarHBondContact OE1-NZ 2.97Å; E622-K624 HydrophobicContact CG-CG 4.46Å; E622-K624 PolarHBondContact O-N 3.41Å; E622-K624 VanDerWaalsContact O-N 3.09Å; K624-L626 PolarHBondContact O-N 3.23Å
625	S	57.2	Low	76.6	Confident	96 Å²	96	73.7 Å²	73.7	67%	0.671	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68.4	-17.5	171.4	63.3	0	0	0	0	113.7	E623	E623-S625 VanDerWaalsContact CD-OG 3.31Å; E623-S625 WeakPolarHBondContact CG-OG 3.36Å; E623-S625 PolarHBondContact O-N 2.87Å; E623-S625 WeakPolarHBondContact OE1-CB 3.5Å; E623-S625 PolarHBondContact OE1-N 2.97Å; E623-S625 PolarHBondContact OE1-OG 2.86Å
626	L	72.9	Confident	77.5	Confident	79 Å²	79	69.9 Å²	69.9	41%	0.414	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-106.7	6.6	-179	-62.2	179.4	0	0	0	113.8	T600 L602 E623 K624 K628	T600-L626 HydrophobicContact CG2-CB 4.4Å; T600-L626 HydrophobicContact CG2-CD1 3.96Å; L602-L626 HydrophobicContact CD1-CD1 4.22Å; E623-L626 HydrophobicContact CB-CD1 4.24Å; E623-L626 HydrophobicContact CB-CG 4.49Å; E623-L626 HydrophobicContact CG-CB 4.37Å; E623-L626 HydrophobicContact CG-CD1 3.8Å; E623-L626 HydrophobicContact CG-CG 3.84Å; E623-L626 WeakPolarHBondContact O-CB 3.41Å; E623-L626 PolarHBondContact O-N 3.37Å; K624-L626 PolarHBondContact O-N 3.23Å; L626-K628 PolarHBondContact O-N 2.92Å
627	R	81.1	Confident	78	Confident	77 Å²	77	69.9 Å²	69.9	29%	0.291	36%	0.358	S	S	.	.			trans	-68.9	127.5	177.2	-172.6	-176.5	-75.6	-170.4	-1.8	110.3	E491 V597 E598 E622	E491-R627 IonicContact OE2-CZ 2.71Å; E491-R627 IonicContact OE2-NH1 2.75Å; E491-R627 PolarHBondContact OE2-NH1 3.07Å; E491-R627 IonicContact OE2-NH2 3.51Å; E491-R627 PolarHBondContact OE2-NH2 2.87Å; V597-R627 HydrophobicContact CG1-CG 4.02Å; E598-R627 WeakPolarHBondContact O-CA 3.22Å; E622-R627 WeakPolarHBondContact OE1-CB 3.43Å; E622-R627 WeakPolarHBondContact OE1-CG 3.42Å; E622-R627 IonicContact OE1-CZ 2.71Å; E622-R627 IonicContact OE1-NE 2.8Å; E622-R627 PolarHBondContact OE1-NE 2.8Å; E622-R627 IonicContact OE1-NH2 2.74Å; E622-R627 IonicContact OE2-CZ 3.79Å; E622-R627 IonicContact OE2-NE 3.17Å; E622-R627 PolarHBondContact OE2-NE 2.82Å; E622-R627 IonicContact OE2-NH2 3.05Å; E622-R627 PolarHBondContact OE2-NH2 2.83Å
628	K	68.3	Low	78.1	Confident	112 Å²	112	65.8 Å²	65.8	49%	0.487	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.8	172.2	-53.4	174.5	-163.8	147.1	0	111.1	E598 L626	E598-K628 HydrophobicContact CB-CB 4.18Å; E598-K628 PolarHBondContact N-O 3.19Å; E598-K628 PolarHBondContact O-N 3.22Å; E598-K628 IonicContact OE1-NZ 2.8Å; E598-K628 PolarHBondContact OE1-NZ 2.62Å; E598-K628 WeakPolarHBondContact OE2-CD 3.37Å; E598-K628 IonicContact OE2-NZ 3.33Å; E598-K628 PolarHBondContact OE2-NZ 3.17Å; L626-K628 PolarHBondContact O-N 2.92Å
629	C	62.4	Low	78.3	Confident	73 Å²	73	62.1 Å²	62.1	49%	0.493	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	106	176.2	-68.5	0	0	0	0	110.4	G596 Q1024	G596-C629 CarbonylContact O-C 3.51Å; G596-C629 WeakPolarHBondContact O-CA 3.41Å; C629-Q1024 PolarHBondContact O-NE2 3.32Å
630	T	66.7	Low	78.5	Confident	55 Å²	55	57.5 Å²	57.5	34%	0.337	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-85.1	167.6	169.8	75.8	0	0	0	0	111	Y591 G596	Y591-T630 HydrophobicContact CE2-CG2 4.07Å; Y591-T630 PolarHBondContact OH-OG1 3.31Å; Y591-T630 VanDerWaalsContact OH-OG1 3.09Å; G596-T630 WeakPolarHBondContact CA-OG1 3.45Å; G596-T630 PolarHBondContact O-N 3.22Å; G596-T630 PolarHBondContact O-OG1 3.05Å
631	D	62.9	Low	78.6	Confident	93 Å²	93	59.8 Å²	59.8	50%	0.497	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-58.6	148.5	164.7	-64.4	-73.5	0	0	0	110.4	K971	D631-K971 IonicContact OD1-NZ 2.74Å; D631-K971 PolarHBondContact OD1-NZ 2.92Å
632	K	72.9	Confident	79	Confident	141 Å²	141	55 Å²	55	61%	0.613	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-74.4	131.8	178.5	-63	-169.6	177.3	-176.6	0	110.7	N595	N595-K632 VanDerWaalsContact O-CE 3.27Å; N595-K632 WeakPolarHBondContact O-CE 3.47Å; N595-K632 WeakPolarHBondContact O-CG 3.45Å
633	K	80.4	Confident	78.9	Confident	70 Å²	70	53.8 Å²	53.8	30%	0.304	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	140.8	176.6	-66.1	161.1	169.9	170.6	0	111.1	Y591 P593 L594 Y704 I705	Y591-K633 PolarHBondContact OH-NZ 2.78Å; Y591-K633 VanDerWaalsContact OH-NZ 3.11Å; P593-K633 HydrophobicContact CB-CB 4.37Å; P593-K633 HydrophobicContact CB-CD 3.89Å; P593-K633 WeakPolarHBondContact O-CB 3.2Å; P593-K633 PolarHBondContact O-N 2.96Å; L594-K633 WeakPolarHBondContact CD2-O 3.43Å; K633-Y704 WeakPolarHBondContact CD-O 3.5Å; K633-I705 CarbonylContact C-O 3.59Å; K633-I705 WeakPolarHBondContact CA-O 3.31Å
634	I	80.7	Confident	78.9	Confident	20 Å²	20	54.3 Å²	54.3	10%	0.103	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.2	170.3	-58.6	179.7	0	0	0	107.5	Y704 I705 D707	I634-Y704 WeakPolarHBondContact O-CA 3.28Å; I634-I705 PolarHBondContact N-O 2.85Å; I634-I705 PolarHBondContact O-N 2.79Å; I634-D707 HydrophobicContact CD1-CB 3.91Å
635	P	83.3	Confident	79.3	Confident	25 Å²	25	51.9 Å²	51.9	16%	0.162	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	136.5	173	32.4	-33.3	0	0	0	110.9	L594 Y704 L737	L594-P635 HydrophobicContact CD2-CG 4.28Å; P635-Y704 HydrophobicContact CB-CD1 3.87Å; P635-Y704 HydrophobicContact CB-CE1 3.74Å; P635-L737 HydrophobicContact CB-CB 4.03Å; P635-L737 HydrophobicContact CB-CD1 4.26Å; P635-L737 HydrophobicContact CG-CB 4.04Å; P635-L737 PolarHBondContact O-N 2.9Å
636	W	87.7	Confident	80	Confident	6 Å²	6	51 Å²	51	2%	0.023	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150	172.9	-62.7	73.2	0	0	0	110.3	R702 I703 I705 P711 L734 T735 N736 Y743	W636-R702 WeakPolarHBondContact O-CA 3.21Å; W636-I703 HydrophobicContact CB-CD1 4.47Å; W636-I703 HydrophobicContact CB-CG1 4.07Å; W636-I703 PolarHBondContact N-O 3.32Å; W636-I703 PolarHBondContact O-N 3.38Å; W636-I705 HydrophobicContact CD2-CD1 4.36Å; W636-I705 HydrophobicContact CG-CD1 4.05Å; W636-I705 HydrophobicContact CG-CG1 4.13Å; W636-P711 HydrophobicContact CH2-CG 3.59Å; W636-P711 HydrophobicContact CZ2-CG 4.48Å; W636-P711 HydrophobicContact CZ3-CG 3.99Å; W636-L734 HydrophobicContact CB-CD1 4.1Å; W636-L734 HydrophobicContact CD2-CD1 4.13Å; W636-L734 HydrophobicContact CD2-CG 4.46Å; W636-L734 HydrophobicContact CE3-CD1 3.59Å; W636-L734 HydrophobicContact CE3-CD2 4.11Å; W636-L734 HydrophobicContact CE3-CG 3.51Å; W636-L734 HydrophobicContact CG-CD1 4.39Å; W636-L734 HydrophobicContact CZ3-CD1 4.3Å; W636-L734 HydrophobicContact CZ3-CD2 3.98Å; W636-L734 HydrophobicContact CZ3-CG 3.73Å; W636-T735 CarbonylContact C-O 3.55Å; W636-T735 VanDerWaalsContact CA-O 3.26Å; W636-T735 WeakPolarHBondContact CA-O 3.32Å; W636-T735 WeakPolarHBondContact CB-O 3.37Å; W636-N736 HydrophobicContact CD2-CB 4.09Å; W636-N736 VanDerWaalsContact CE3-CA 3.42Å; W636-N736 HydrophobicContact CE3-CB 3.71Å; W636-N736 HydrophobicContact CH2-CB 3.93Å; W636-N736 WeakPolarHBondContact CH2-ND2 3.46Å; W636-N736 HydrophobicContact CZ2-CB 4.28Å; W636-N736 WeakPolarHBondContact CZ2-ND2 3.42Å; W636-N736 HydrophobicContact CZ3-CB 3.62Å; W636-Y743 HydrophobicContact CH2-CD2 4.49Å; W636-Y743 HydrophobicContact CH2-CE2 4.37Å; W636-Y743 HydrophobicContact CZ3-CD2 4.06Å; W636-Y743 HydrophobicContact CZ3-CE2 4.31Å
637	E	90.1	Very high	80.1	Confident	20 Å²	20	52.7 Å²	52.7	9%	0.093	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	141.5	167.2	166.2	-151.2	60.8	0	0	108.3	K700 F701 T735 L737	E637-K700 WeakPolarHBondContact OE2-CE 3.42Å; E637-K700 IonicContact OE2-NZ 2.64Å; E637-K700 PolarHBondContact OE2-NZ 3.41Å; E637-F701 CarbonylContact C-O 3.37Å; E637-F701 WeakPolarHBondContact CA-O 3.42Å; E637-T735 PolarHBondContact N-O 2.76Å; E637-T735 PolarHBondContact O-N 3.07Å; E637-T735 WeakPolarHBondContact OE1-CB 3.12Å; E637-T735 PolarHBondContact OE1-OG1 3.31Å; E637-L737 HydrophobicContact CB-CD1 4.13Å; E637-L737 HydrophobicContact CB-CD2 3.93Å; E637-L737 HydrophobicContact CB-CG 4.06Å
638	I	90.9	Very high	79.9	Confident	1 Å²	1	49 Å²	49	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	119.6	172.1	-68.5	-175.5	0	0	0	108.8	V640 I656 I658 K700 F701 I703 I732 V733 L734	I638-V640 HydrophobicContact CG2-CG2 3.7Å; I638-I656 HydrophobicContact CD1-CD1 3.27Å; I638-I658 HydrophobicContact CD1-CD1 4.09Å; I638-K700 CarbonylContact O-C 3.56Å; I638-K700 WeakPolarHBondContact O-CA 3.42Å; I638-F701 PolarHBondContact N-O 3.08Å; I638-F701 PolarHBondContact O-N 3.3Å; I638-I703 HydrophobicContact CD1-CD1 3.47Å; I638-I703 VanDerWaalsContact CD1-CD1 3.47Å; I638-I703 HydrophobicContact CD1-CG1 4.14Å; I638-I703 HydrophobicContact CG1-CD1 4.11Å; I638-I703 HydrophobicContact CG1-CG1 4.35Å; I638-I732 HydrophobicContact CG2-CG2 3.96Å; I638-V733 WeakPolarHBondContact CA-O 3.48Å; I638-L734 HydrophobicContact CD1-CD1 3.99Å; I638-L734 HydrophobicContact CG1-CD1 3.57Å
639	S	90.9	Very high	80.4	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.028	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.9	163.8	-96.4	0	0	0	0	109.5	E698 K700 I732 V733	S639-E698 WeakPolarHBondContact CB-OE1 3.45Å; S639-E698 PolarHBondContact OG-OE1 2.9Å; S639-K700 VanDerWaalsContact OG-CE 3.28Å; S639-K700 WeakPolarHBondContact OG-CE 3.47Å; S639-K700 WeakPolarHBondContact OG-CG 3.41Å; S639-I732 CarbonylContact O-C 3.53Å; S639-I732 VanDerWaalsContact O-CA 3.3Å; S639-I732 WeakPolarHBondContact O-CA 3.46Å; S639-I732 WeakPolarHBondContact O-CG2 3.43Å; S639-V733 PolarHBondContact N-O 3.38Å; S639-V733 PolarHBondContact O-N 3.25Å
640	V	91.5	Very high	81.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.3	172.2	-175.5	0	0	0	0	109.2	I638 L670 F693 E698 S699 F701 W727 L729 I732	I638-V640 HydrophobicContact CG2-CG2 3.7Å; V640-L670 HydrophobicContact CG2-CD1 3.84Å; V640-F693 HydrophobicContact CB-CD1 4.27Å; V640-F693 HydrophobicContact CB-CE1 3.93Å; V640-F693 HydrophobicContact CG1-CD1 3.94Å; V640-F693 HydrophobicContact CG1-CE1 3.83Å; V640-F693 HydrophobicContact CG2-CE1 4.23Å; V640-E698 WeakPolarHBondContact O-CA 3.19Å; V640-S699 PolarHBondContact N-O 2.83Å; V640-S699 PolarHBondContact O-N 2.92Å; V640-F701 HydrophobicContact CB-CE2 4.5Å; V640-F701 HydrophobicContact CG2-CD2 4.34Å; V640-F701 HydrophobicContact CG2-CE2 4.13Å; V640-W727 HydrophobicContact CG1-CH2 3.86Å; V640-W727 HydrophobicContact CG1-CZ2 3.62Å; V640-L729 HydrophobicContact CG1-CD1 3.81Å; V640-I732 HydrophobicContact CG1-CG1 4.25Å; V640-I732 HydrophobicContact CG2-CG1 4.36Å
641	K	89.6	Confident	82.3	Confident	54 Å²	54	45.1 Å²	45.1	24%	0.235	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	112.8	-174.7	-161.5	-179.9	-166.6	161.8	0	111.2	E698 Q730 E731	K641-E698 HydrophobicContact CG-CB 4.49Å; K641-Q730 WeakPolarHBondContact O-CB 3.42Å; K641-Q730 PolarHBondContact O-N 3.23Å; K641-E731 HydrophobicContact CB-CG 3.97Å; K641-E731 HydrophobicContact CD-CG 3.76Å; K641-E731 WeakPolarHBondContact CD-OE1 3.45Å; K641-E731 WeakPolarHBondContact CE-OE1 3.19Å; K641-E731 PolarHBondContact N-O 3.2Å; K641-E731 IonicContact NZ-OE1 2.73Å; K641-E731 PolarHBondContact NZ-OE1 3.13Å
642	T	89.4	Confident	83.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	140.6	173.2	-54.2	0	0	0	0	109.4	S648 F693 R694 N696 V697 W727	T642-S648 WeakPolarHBondContact CG2-O 3.13Å; T642-S648 WeakPolarHBondContact CG2-OG 3.42Å; T642-F693 PolarHBondContact OG1-O 2.9Å; T642-R694 VanDerWaalsContact CB-O 3.31Å; T642-R694 WeakPolarHBondContact CB-O 3.25Å; T642-N696 VanDerWaalsContact O-CA 3.3Å; T642-N696 WeakPolarHBondContact O-CA 3.18Å; T642-N696 PolarHBondContact O-N 3Å; T642-N696 VanDerWaalsContact O-N 3.12Å; T642-V697 PolarHBondContact N-O 2.78Å; T642-W727 PolarHBondContact OG1-NE1 3.46Å
643	S	85.1	Confident	83.7	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.021	20%	0.202	C	C	.	.			trans	-66.6	161.7	-179.7	76.3	0	0	0	0	112.9	I645 S648 N696 H728	S643-I645 PolarHBondContact O-N 3.23Å; S643-S648 PolarHBondContact O-OG 3.3Å; S643-N696 PolarHBondContact O-N 3.46Å; S643-N696 VanDerWaalsContact O-N 3.11Å; S643-H728 VanDerWaalsContact CB-ND1 3.34Å; S643-H728 WeakPolarHBondContact CB-ND1 3.42Å; S643-H728 WeakPolarHBondContact CB-O 3.13Å; S643-H728 PolarHBondContact N-O 3.26Å; S643-H728 PolarHBondContact OG-ND1 2.54Å; S643-H728 PolarHBondContact OG-O 3.2Å
644	P	80.8	Confident	84.1	Confident	88 Å²	88	32.5 Å²	32.5	57%	0.571	19%	0.188	S	C	*	.	S	Bend	trans	-76.2	8.8	175.6	31	-36.9	0	0	0	115	N696	P644-N696 HydrophobicContact CB-CB 3.99Å
645	I	80.7	Confident	84.6	Confident	72 Å²	72	31.7 Å²	31.7	37%	0.369	19%	0.185	S	C	.	.	S	Bend	trans	-68.9	142.6	179.4	-58.6	176.9	0	0	0	109.8	S643 S648 W750	S643-I645 PolarHBondContact O-N 3.23Å; I645-S648 WeakPolarHBondContact O-CB 3.44Å; I645-S648 PolarHBondContact O-N 3.34Å; I645-S648 PolarHBondContact O-OG 3.44Å; I645-W750 HydrophobicContact CG2-CH2 4.35Å; I645-W750 HydrophobicContact CG2-CZ2 4.09Å
646	A	71.8	Confident	85	Confident	79 Å²	79	30.7 Å²	30.7	65%	0.653	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	143.4	176.9	0	0	0	0	0	111.7	S648	A646-S648 PolarHBondContact O-N 3.2Å
647	N	74.8	Confident	85.1	Confident	113 Å²	113	31.6 Å²	31.6	60%	0.604	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	10.8	-176.8	-62.7	-23.9	0	0	0	116.5	Y649 N724	N647-Y649 PolarHBondContact O-N 2.71Å; N647-N724 PolarHBondContact O-ND2 2.72Å
648	S	77	Confident	85.1	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.178	C	C	.	.			trans	-69.3	2.3	-176.2	66.5	0	0	0	0	116.3	T642 S643 I645 A646 N726 W727 H728	T642-S648 WeakPolarHBondContact CG2-O 3.13Å; T642-S648 WeakPolarHBondContact CG2-OG 3.42Å; S643-S648 PolarHBondContact O-OG 3.3Å; I645-S648 WeakPolarHBondContact O-CB 3.44Å; I645-S648 PolarHBondContact O-N 3.34Å; I645-S648 PolarHBondContact O-OG 3.44Å; A646-S648 PolarHBondContact O-N 3.2Å; S648-N726 CarbonylContact C-O 3.5Å; S648-W727 WeakPolarHBondContact O-CA 3.49Å; S648-H728 PolarHBondContact O-N 2.96Å
649	Y	79	Confident	85.1	Confident	89 Å²	89	30.9 Å²	30.9	35%	0.349	18%	0.18	S	C	.	.			trans	-85.3	152.8	-174.1	65.2	-86.7	0	0	0	112.7	N647 T651 P695 N724	N647-Y649 PolarHBondContact O-N 2.71Å; Y649-T651 HydrophobicContact CD2-CG2 4.37Å; Y649-T651 HydrophobicContact CE2-CG2 4.29Å; Y649-P695 HydrophobicContact CD1-CG 4Å; Y649-P695 HydrophobicContact CG-CG 4.46Å; Y649-N724 HydrophobicContact CD2-CB 4.32Å; Y649-N724 HydrophobicContact CE2-CB 3.73Å; Y649-N724 PolarHBondContact O-ND2 2.93Å
650	V	84.1	Confident	84.9	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.03	19%	0.185	C	C	.	.			trans	-119.5	135.1	-177.3	68.4	0	0	0	0	112.8	A652 V654 F693 W727	V650-A652 HydrophobicContact CG2-CB 3.88Å; V650-V654 HydrophobicContact CG1-CG2 3.59Å; V650-V654 HydrophobicContact CG2-CG2 4.45Å; V650-F693 HydrophobicContact CG1-CB 3.72Å; V650-F693 HydrophobicContact CG1-CD2 3.82Å; V650-F693 HydrophobicContact CG1-CG 3.9Å; V650-W727 HydrophobicContact CB-CB 3.77Å; V650-W727 HydrophobicContact CB-CD2 4.14Å; V650-W727 HydrophobicContact CB-CG 3.6Å; V650-W727 HydrophobicContact CG1-CB 4.37Å; V650-W727 HydrophobicContact CG1-CD2 3.74Å; V650-W727 HydrophobicContact CG1-CE3 4.4Å; V650-W727 HydrophobicContact CG1-CG 3.69Å; V650-W727 HydrophobicContact CG1-CZ2 4.34Å; V650-W727 HydrophobicContact CG2-CB 4.1Å; V650-W727 HydrophobicContact CG2-CG 4.29Å
651	T	85	Confident	84.4	Confident	65 Å²	65	35.2 Å²	35.2	40%	0.399	21%	0.212	S	C	.	.			trans	-110.4	-13.7	172	59.4	0	0	0	0	112.6	Y649 G722 S723 N724	Y649-T651 HydrophobicContact CD2-CG2 4.37Å; Y649-T651 HydrophobicContact CE2-CG2 4.29Å; T651-G722 WeakPolarHBondContact OG1-CA 3.26Å; T651-S723 PolarHBondContact OG1-N 2.74Å; T651-S723 VanDerWaalsContact OG1-N 3.09Å; T651-N724 PolarHBondContact N-O 2.99Å; T651-N724 PolarHBondContact OG1-N 3.04Å; T651-N724 PolarHBondContact OG1-O 3.12Å
652	A	82.5	Confident	83.7	Confident	4 Å²	4	39.1 Å²	39.1	3%	0.033	23%	0.229	C	C	.	.	S	Bend	trans	-69.6	152.2	172.8	0	0	0	0	0	111.8	V650 V654 H718 D719 K721 P725	V650-A652 HydrophobicContact CG2-CB 3.88Å; A652-V654 PolarHBondContact O-N 3.17Å; A652-V654 VanDerWaalsContact O-N 3.09Å; A652-H718 HydrophobicContact CB-CB 3.99Å; A652-D719 WeakPolarHBondContact CB-OD1 3.46Å; A652-K721 WeakPolarHBondContact CA-O 3.37Å; A652-P725 HydrophobicContact CB-CB 4.33Å
653	A	83	Confident	82.9	Confident	32 Å²	32	42.3 Å²	42.3	26%	0.264	25%	0.246	S	C	.	.			trans	-71.3	107.6	-171.1	0	0	0	0	0	111.9	H718 D719	A653-H718 WeakPolarHBondContact O-CA 3.33Å; A653-D719 HydrophobicContact CB-CB 4.49Å; A653-D719 PolarHBondContact N-OD1 2.97Å; A653-D719 PolarHBondContact O-N 3.46Å
654	V	88.9	Confident	82.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	25%	0.254	C	S	.	.			trans	-77.3	137.9	-178.2	-178.1	0	0	0	0	111	V650 A652 L670 F693 I716 W727	V650-V654 HydrophobicContact CG1-CG2 3.59Å; V650-V654 HydrophobicContact CG2-CG2 4.45Å; A652-V654 PolarHBondContact O-N 3.17Å; A652-V654 VanDerWaalsContact O-N 3.09Å; V654-L670 HydrophobicContact CB-CB 4.5Å; V654-L670 HydrophobicContact CG1-CD1 4.07Å; V654-L670 PolarHBondContact O-N 2.75Å; V654-F693 HydrophobicContact CB-CE2 3.96Å; V654-F693 HydrophobicContact CB-CZ 3.95Å; V654-F693 HydrophobicContact CG1-CZ 4.23Å; V654-F693 HydrophobicContact CG2-CD2 4Å; V654-F693 HydrophobicContact CG2-CE2 3.64Å; V654-F693 HydrophobicContact CG2-CZ 3.99Å; V654-I716 HydrophobicContact CG1-CD1 3.86Å; V654-I716 HydrophobicContact CG1-CG1 4.18Å; V654-W727 HydrophobicContact CG1-CH2 3.71Å; V654-W727 HydrophobicContact CG1-CZ3 3.79Å; V654-W727 HydrophobicContact CG2-CH2 4.23Å; V654-W727 HydrophobicContact CG2-CZ3 4.17Å
655	S	89.6	Confident	83	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.028	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.5	179.1	52.9	0	0	0	0	113.2	K667 I668 I716 Q717	S655-K667 WeakPolarHBondContact OG-CE 3.47Å; S655-I668 CarbonylContact C-O 3.5Å; S655-I668 WeakPolarHBondContact CA-O 3.02Å; S655-I668 VanDerWaalsContact CB-O 3.32Å; S655-I668 WeakPolarHBondContact CB-O 3.13Å; S655-I716 WeakPolarHBondContact O-CA 3.35Å; S655-Q717 PolarHBondContact N-O 3.21Å; S655-Q717 PolarHBondContact O-N 3.38Å; S655-Q717 VanDerWaalsContact O-O 3.11Å; S655-Q717 WeakPolarHBondContact OG-CG 3.31Å; S655-Q717 PolarHBondContact OG-O 2.98Å
656	I	92	Very high	82.8	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	155.3	-170	59.2	174.6	0	0	0	112.9	I638 K667 I668 L670 R715 I716	I638-I656 HydrophobicContact CD1-CD1 3.27Å; I656-K667 WeakPolarHBondContact O-CA 3.21Å; I656-I668 HydrophobicContact CD1-CB 4.45Å; I656-I668 HydrophobicContact CD1-CD1 4.4Å; I656-I668 HydrophobicContact CG1-CB 3.84Å; I656-I668 HydrophobicContact CG1-CD1 4.41Å; I656-I668 HydrophobicContact CG1-CG1 4.39Å; I656-I668 PolarHBondContact N-O 2.99Å; I656-I668 PolarHBondContact O-N 2.9Å; I656-L670 HydrophobicContact CD1-CD1 4.48Å; I656-L670 HydrophobicContact CD1-CD2 4.07Å; I656-L670 HydrophobicContact CD1-CG 4.48Å; I656-L670 HydrophobicContact CG2-CD1 4.29Å; I656-R715 CarbonylContact C-O 3.48Å; I656-R715 VanDerWaalsContact CA-O 3.25Å; I656-R715 WeakPolarHBondContact CA-O 3.36Å; I656-I716 HydrophobicContact CG2-CB 3.95Å; I656-I716 HydrophobicContact CG2-CD1 3.56Å; I656-I716 HydrophobicContact CG2-CG1 3.67Å
657	I	90.6	Very high	83.3	Confident	25 Å²	25	45.4 Å²	45.4	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	126.1	166.5	-60.6	171.6	0	0	0	107.9	F659 K667 R715	I657-F659 HydrophobicContact CB-CE2 4.08Å; I657-F659 HydrophobicContact CG2-CD2 4.12Å; I657-F659 HydrophobicContact CG2-CE2 3.49Å; I657-F659 VanDerWaalsContact CG2-CE2 3.49Å; I657-F659 HydrophobicContact CG2-CZ 3.78Å; I657-K667 HydrophobicContact CD1-CB 4.46Å; I657-K667 HydrophobicContact CG1-CB 4.25Å; I657-R715 HydrophobicContact CB-CB 4.36Å; I657-R715 PolarHBondContact N-O 3.28Å; I657-R715 PolarHBondContact O-N 2.68Å
658	I	90.8	Very high	83.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126	179.3	-49.5	164.5	0	0	0	108.2	I638 K664 T665 I703 I705 I708 P711 L714 L734	I638-I658 HydrophobicContact CD1-CD1 4.09Å; I658-K664 CarbonylContact O-C 3.51Å; I658-K664 VanDerWaalsContact O-CA 3.28Å; I658-K664 WeakPolarHBondContact O-CA 3.34Å; I658-T665 HydrophobicContact CB-CG2 3.92Å; I658-T665 HydrophobicContact CD1-CG2 4.38Å; I658-T665 HydrophobicContact CG1-CG2 4.42Å; I658-T665 PolarHBondContact N-OG1 2.92Å; I658-T665 PolarHBondContact O-N 2.7Å; I658-I703 HydrophobicContact CD1-CD1 4.16Å; I658-I705 HydrophobicContact CD1-CD1 4.09Å; I658-I708 HydrophobicContact CB-CD1 4.07Å; I658-I708 HydrophobicContact CG2-CD1 3.55Å; I658-P711 HydrophobicContact CG2-CB 4.14Å; I658-L714 HydrophobicContact CG1-CD1 4.28Å; I658-L734 HydrophobicContact CD1-CD1 3.91Å; I658-L734 HydrophobicContact CD1-CD2 4Å; I658-L734 HydrophobicContact CG2-CD2 3.81Å
659	F	89.3	Confident	84.1	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.2	175.4	-64.3	-102.4	0	0	0	108.7	I657 K664 P711 C712 K713 R715	I657-F659 HydrophobicContact CB-CE2 4.08Å; I657-F659 HydrophobicContact CG2-CD2 4.12Å; I657-F659 HydrophobicContact CG2-CE2 3.49Å; I657-F659 VanDerWaalsContact CG2-CE2 3.49Å; I657-F659 HydrophobicContact CG2-CZ 3.78Å; F659-K664 HydrophobicContact CD1-CB 3.71Å; F659-K664 HydrophobicContact CD1-CD 4.19Å; F659-K664 HydrophobicContact CE1-CB 3.98Å; F659-K664 HydrophobicContact CE1-CD 3.6Å; F659-K664 HydrophobicContact CE1-CG 4.39Å; F659-K664 HydrophobicContact CG-CB 4.15Å; F659-K664 HydrophobicContact CZ-CD 4.13Å; F659-P711 CarbonylContact O-C 3.57Å; F659-P711 WeakPolarHBondContact O-CA 3.36Å; F659-C712 PolarHBondContact O-N 3.24Å; F659-C712 PolarHBondContact O-SG 2.98Å; F659-C712 VanDerWaalsContact O-SG 3.38Å; F659-K713 HydrophobicContact CB-CG 3.67Å; F659-K713 WeakPolarHBondContact CB-O 3.33Å; F659-K713 HydrophobicContact CD2-CD 4.35Å; F659-K713 HydrophobicContact CD2-CG 3.78Å; F659-K713 HydrophobicContact CG-CD 4.47Å; F659-K713 HydrophobicContact CG-CG 3.83Å; F659-K713 PolarHBondContact N-O 2.96Å; F659-K713 PolarHBondContact O-N 2.85Å; F659-R715 HydrophobicContact CE2-CB 4.22Å
660	G	87.2	Confident	84.5	Confident	13 Å²	13	42.5 Å²	42.5	13%	0.134	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	178.7	175	0	0	0	0	0	113.4	K662 D663 I708 I710	G660-K662 PolarHBondContact O-N 2.68Å; G660-K662 VanDerWaalsContact O-N 3.11Å; G660-D663 WeakPolarHBondContact CA-O 3.27Å; G660-D663 PolarHBondContact N-O 2.69Å; G660-I708 CarbonylContact C-O 3.59Å; G660-I708 VanDerWaalsContact CA-O 3.24Å; G660-I708 WeakPolarHBondContact CA-O 3.2Å; G660-I710 CarbonylContact C-O 3.58Å; G660-I710 WeakPolarHBondContact CA-O 3.31Å
661	S	81.2	Confident	84.2	Confident	81 Å²	81	44.6 Å²	44.6	57%	0.566	24%	0.235	S	C	*	.	S	Bend	trans	-70	-1.7	-173.9	75.4	0	0	0	0	115.7	I708 I710	S661-I708 PolarHBondContact N-O 3.29Å; S661-I708 VanDerWaalsContact N-O 3.09Å; S661-I710 PolarHBondContact N-O 2.79Å; S661-I710 PolarHBondContact OG-N 2.9Å
662	K	74.7	Confident	83.4	Confident	136 Å²	136	47.7 Å²	47.7	59%	0.591	24%	0.239	S	C	*	.	S	Bend	trans	-120.5	-38.8	174.5	-61.8	172.7	-175.1	159.2	0	112.7	G660 D707 I708	G660-K662 PolarHBondContact O-N 2.68Å; G660-K662 VanDerWaalsContact O-N 3.11Å; K662-D707 IonicContact NZ-OD1 3.99Å; K662-D707 PolarHBondContact NZ-OD1 3Å; K662-D707 IonicContact NZ-OD2 3.22Å; K662-D707 PolarHBondContact NZ-OD2 3.34Å; K662-I708 PolarHBondContact N-O 2.83Å
663	D	73.7	Confident	82.4	Confident	67 Å²	67	52.6 Å²	52.6	36%	0.358	27%	0.273	S	S	.	.			trans	-163.9	175.5	-164.1	-155.6	-25.5	0	0	0	110	G660 K706 I708	G660-D663 WeakPolarHBondContact CA-O 3.27Å; G660-D663 PolarHBondContact N-O 2.69Å; D663-K706 VanDerWaalsContact CG-CE 3.48Å; D663-K706 WeakPolarHBondContact OD1-CE 3.29Å; D663-K706 IonicContact OD1-NZ 3.63Å; D663-K706 PolarHBondContact OD1-NZ 2.86Å; D663-K706 VanDerWaalsContact OD2-CE 3.24Å; D663-K706 WeakPolarHBondContact OD2-CE 3.44Å; D663-K706 IonicContact OD2-NZ 3.34Å; D663-K706 PolarHBondContact OD2-NZ 2.89Å; D663-I708 HydrophobicContact CB-CG2 4.42Å; D663-I708 PolarHBondContact N-O 3.36Å; D663-I708 WeakPolarHBondContact O-CB 3.46Å
664	K	82.6	Confident	81.8	Confident	44 Å²	44	53.1 Å²	53.1	19%	0.191	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-119.8	158.5	172.3	64.4	176.4	177.6	175	0	111.6	I658 F659 K706 D808 E936	I658-K664 CarbonylContact O-C 3.51Å; I658-K664 VanDerWaalsContact O-CA 3.28Å; I658-K664 WeakPolarHBondContact O-CA 3.34Å; F659-K664 HydrophobicContact CD1-CB 3.71Å; F659-K664 HydrophobicContact CD1-CD 4.19Å; F659-K664 HydrophobicContact CE1-CB 3.98Å; F659-K664 HydrophobicContact CE1-CD 3.6Å; F659-K664 HydrophobicContact CE1-CG 4.39Å; F659-K664 HydrophobicContact CG-CB 4.15Å; F659-K664 HydrophobicContact CZ-CD 4.13Å; K664-K706 WeakPolarHBondContact O-CE 3.34Å; K664-K706 PolarHBondContact O-NZ 2.95Å; K664-D808 IonicContact NZ-OD2 3.58Å; K664-D808 PolarHBondContact NZ-OD2 3.21Å; K664-E936 WeakPolarHBondContact CE-OE1 3.2Å; K664-E936 IonicContact NZ-OE1 3.43Å; K664-E936 PolarHBondContact NZ-OE1 3.49Å
665	T	83.9	Confident	80.9	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.043	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-72.9	163.9	169.6	67.8	0	0	0	0	111.1	I658 I668 I705 I708	I658-T665 HydrophobicContact CB-CG2 3.92Å; I658-T665 HydrophobicContact CD1-CG2 4.38Å; I658-T665 HydrophobicContact CG1-CG2 4.42Å; I658-T665 PolarHBondContact N-OG1 2.92Å; I658-T665 PolarHBondContact O-N 2.7Å; T665-I668 HydrophobicContact CG2-CD1 4.3Å; T665-I705 HydrophobicContact CG2-CB 4.06Å; T665-I705 HydrophobicContact CG2-CD1 3.84Å; T665-I705 HydrophobicContact CG2-CG2 3.89Å; T665-I708 HydrophobicContact CG2-CD1 4.45Å; T665-I708 HydrophobicContact CG2-CG2 4.13Å
666	M	77.8	Confident	79.5	Confident	140 Å²	140	57.9 Å²	57.9	69%	0.69	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-69.5	173.4	156.3	-62.9	-174.8	75.5	0	0	109.7	I668	M666-I668 WeakPolarHBondContact O-CG1 3.3Å; M666-I668 PolarHBondContact O-N 3.31Å
667	K	81.3	Confident	77.6	Confident	117 Å²	117	62.8 Å²	62.8	51%	0.509	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-63.5	116.8	170.7	-173.5	175.8	-178.2	175.1	0	109.4	S655 I656 I657	S655-K667 WeakPolarHBondContact OG-CE 3.47Å; I656-K667 WeakPolarHBondContact O-CA 3.21Å; I657-K667 HydrophobicContact CD1-CB 4.46Å; I657-K667 HydrophobicContact CG1-CB 4.25Å
668	I	83.7	Confident	75.2	Confident	28 Å²	28	66.8 Å²	66.8	14%	0.144	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	131	175.8	-43	177.3	0	0	0	107.3	S655 I656 T665 M666 I703 I705	S655-I668 CarbonylContact C-O 3.5Å; S655-I668 WeakPolarHBondContact CA-O 3.02Å; S655-I668 VanDerWaalsContact CB-O 3.32Å; S655-I668 WeakPolarHBondContact CB-O 3.13Å; I656-I668 HydrophobicContact CD1-CB 4.45Å; I656-I668 HydrophobicContact CD1-CD1 4.4Å; I656-I668 HydrophobicContact CG1-CB 3.84Å; I656-I668 HydrophobicContact CG1-CD1 4.41Å; I656-I668 HydrophobicContact CG1-CG1 4.39Å; I656-I668 PolarHBondContact N-O 2.99Å; I656-I668 PolarHBondContact O-N 2.9Å; T665-I668 HydrophobicContact CG2-CD1 4.3Å; M666-I668 WeakPolarHBondContact O-CG1 3.3Å; M666-I668 PolarHBondContact O-N 3.31Å; I668-I703 HydrophobicContact CD1-CD1 3.64Å; I668-I703 HydrophobicContact CG2-CG2 4.08Å; I668-I705 HydrophobicContact CD1-CG2 3.69Å
669	Q	86.4	Confident	72.4	Confident	105 Å²	105	72.6 Å²	72.6	49%	0.491	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136.5	173.8	-162.9	153.1	-34.2	0	0	108.8	N674	Q669-N674 PolarHBondContact O-ND2 2.72Å
670	L	85.5	Confident	69.6	Low	8 Å²	8	80.1 Å²	80.1	4%	0.042	43%	0.43	C	S	.	.			trans	-98	112.2	-179.5	-63	-176.9	0	0	0	109	V640 V654 I656 F693 F701	V640-L670 HydrophobicContact CG2-CD1 3.84Å; V654-L670 HydrophobicContact CB-CB 4.5Å; V654-L670 HydrophobicContact CG1-CD1 4.07Å; V654-L670 PolarHBondContact O-N 2.75Å; I656-L670 HydrophobicContact CD1-CD1 4.48Å; I656-L670 HydrophobicContact CD1-CD2 4.07Å; I656-L670 HydrophobicContact CD1-CG 4.48Å; I656-L670 HydrophobicContact CG2-CD1 4.29Å; L670-F693 HydrophobicContact CB-CZ 3.94Å; L670-F693 HydrophobicContact CD1-CE1 4.44Å; L670-F693 HydrophobicContact CD1-CZ 4.22Å; L670-F701 HydrophobicContact CB-CD1 4.41Å; L670-F701 HydrophobicContact CB-CE1 4.07Å; L670-F701 HydrophobicContact CB-CE2 4.43Å; L670-F701 HydrophobicContact CB-CZ 4.08Å; L670-F701 HydrophobicContact CD1-CD2 4.35Å; L670-F701 HydrophobicContact CD1-CE2 4.21Å; L670-F701 HydrophobicContact CD2-CB 4.34Å; L670-F701 HydrophobicContact CD2-CD1 4.38Å; L670-F701 HydrophobicContact CD2-CD2 4.27Å; L670-F701 HydrophobicContact CD2-CG 4.09Å
671	D	79.6	Confident	66.8	Low	49 Å²	49	91.1 Å²	91.1	26%	0.262	47%	0.468	S	S	.	.			trans	-147.5	178.4	-171.1	62.3	49.5	0	0	0	111.4	S673 N674 L675	D671-S673 VanDerWaalsContact C-N 3.27Å; D671-S673 PolarHBondContact O-N 2.83Å; D671-S673 WeakPolarHBondContact OD1-CA 3.24Å; D671-S673 WeakPolarHBondContact OD1-CB 3.47Å; D671-S673 PolarHBondContact OD1-N 2.67Å; D671-S673 PolarHBondContact OD1-OG 2.95Å; D671-N674 PolarHBondContact O-N 3.11Å; D671-L675 PolarHBondContact O-N 2.89Å
672	R	66.8	Low	64.1	Low	129 Å²	129	92.2 Å²	92.2	49%	0.487	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-59.5	-30.9	-178.4	-81.4	-174.5	170.3	-158.5	-4.4	114.3	N674 L675 E688 V690 M692	R672-N674 PolarHBondContact O-N 2.92Å; R672-L675 PolarHBondContact O-N 2.86Å; R672-E688 PolarHBondContact NH1-O 3.48Å; R672-E688 PolarHBondContact NH2-O 3.03Å; R672-V690 PolarHBondContact NH2-O 2.79Å; R672-M692 HydrophobicContact CG-CE 4.27Å; R672-M692 HydrophobicContact CG-SD 4.4Å
673	S	61.5	Low	62	Low	108 Å²	108	91.8 Å²	91.8	76%	0.755	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-63.9	-27.2	-179.5	-12.6	0	0	0	0	111.9	D671	D671-S673 VanDerWaalsContact C-N 3.27Å; D671-S673 PolarHBondContact O-N 2.83Å; D671-S673 WeakPolarHBondContact OD1-CA 3.24Å; D671-S673 WeakPolarHBondContact OD1-CB 3.47Å; D671-S673 PolarHBondContact OD1-N 2.67Å; D671-S673 PolarHBondContact OD1-OG 2.95Å
674	N	70	Confident	60.1	Low	42 Å²	42	93 Å²	93	23%	0.225	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-95.8	-10.9	-179.8	-60.1	-42	0	0	0	112.5	Q669 D671 R672 F701 R702	Q669-N674 PolarHBondContact O-ND2 2.72Å; D671-N674 PolarHBondContact O-N 3.11Å; R672-N674 PolarHBondContact O-N 2.92Å; N674-F701 HydrophobicContact CB-CB 4.22Å; N674-F701 HydrophobicContact CB-CD1 4.06Å; N674-F701 CarbonylContact O-C 3.57Å; N674-F701 WeakPolarHBondContact O-CA 3.25Å; N674-R702 PolarHBondContact O-N 2.86Å
675	L	70.8	Confident	57.7	Low	39 Å²	39	95.3 Å²	95.3	20%	0.204	50%	0.501	C	S	.	.	B	Isolated β-bridge	trans	-72.2	130.8	-169.2	-162.1	79.1	0	0	0	112.3	D671 R672 V677 V690 M692 K700 F701	D671-L675 PolarHBondContact O-N 2.89Å; R672-L675 PolarHBondContact O-N 2.86Å; L675-V677 PolarHBondContact O-N 2.84Å; L675-V690 HydrophobicContact CD2-CG1 4.05Å; L675-M692 HydrophobicContact CD1-CG 4.28Å; L675-M692 HydrophobicContact CD1-SD 4.27Å; L675-K700 WeakPolarHBondContact CA-O 3.48Å; L675-K700 WeakPolarHBondContact CD1-O 3.44Å; L675-F701 HydrophobicContact CB-CD1 4.45Å; L675-F701 HydrophobicContact CD1-CD1 3.89Å; L675-F701 HydrophobicContact CD1-CE1 3.5Å; L675-F701 HydrophobicContact CD1-CZ 3.88Å
676	E	60.2	Low	55.2	Low	68 Å²	68	99 Å²	99	32%	0.318	54%	0.54	S	S	.	.			trans	-83.8	96.9	-178.7	-151.9	-179.7	-149.9	0	0	110.9	K700 R702	E676-K700 HydrophobicContact CB-CB 4.22Å; E676-K700 PolarHBondContact N-O 2.89Å; E676-R702 HydrophobicContact CG-CG 4.29Å; E676-R702 IonicContact OE1-CZ 3.05Å; E676-R702 IonicContact OE1-NE 2.75Å; E676-R702 PolarHBondContact OE1-NE 3.4Å; E676-R702 IonicContact OE1-NH2 2.69Å; E676-R702 PolarHBondContact OE1-NH2 3.11Å
677	V	52.7	Low	53.3	Low	106 Å²	106	99.9 Å²	99.9	64%	0.642	55%	0.547	S	S	*	.			trans	-81.1	139.9	174.3	-175	0	0	0	0	110	L675	L675-V677 PolarHBondContact O-N 2.84Å
678	S	39	Very low	51.3	Low	109 Å²	109	100.7 Å²	100.7	76%	0.762	55%	0.553	S	S	*	*			trans	-59.4	149.6	-173.7	52.1	0	0	0	0	113.8	E680	S678-E680 PolarHBondContact O-N 2.88Å
679	S	31.6	Very low	49.6	Very low	121 Å²	121	104.7 Å²	104.7	85%	0.846	58%	0.579	S	S	*	*	S	Bend	trans	-70.5	90.1	-164.8	56.2	0	0	0	0	115.7
680	E	31	Very low	48	Very low	165 Å²	165	103.1 Å²	103.1	77%	0.771	58%	0.576	S	S	*	*	S	Bend	trans	-154.5	159.9	154.8	-115.8	163	-143.3	0	0	110.9	S678 T682	S678-E680 PolarHBondContact O-N 2.88Å; E680-T682 VanDerWaalsContact C-N 3.29Å; E680-T682 PolarHBondContact O-N 2.87Å
681	W	28.2	Very low	46.9	Very low	244 Å²	244	108 Å²	108	92%	0.924	60%	0.599	S	S	*	*			trans	-84.6	64.9	-178	-81.9	82.9	0	0	0	111.5
682	T	25.8	Very low	46.5	Very low	105 Å²	105	108.2 Å²	108.2	64%	0.644	60%	0.599	S	S	*	*			trans	-116.7	127.6	-176.7	36.5	0	0	0	0	112.9	E680 V684	E680-T682 VanDerWaalsContact C-N 3.29Å; E680-T682 PolarHBondContact O-N 2.87Å; T682-V684 PolarHBondContact O-N 2.9Å
683	K	30.7	Very low	47.4	Very low	127 Å²	127	102.5 Å²	102.5	55%	0.552	58%	0.577	S	S	*	*			trans	-65.2	114.6	170.4	-90.9	170.4	165	168.4	0	109.5	E542 D543 S685	E542-K683 IonicContact OE2-NZ 3.22Å; E542-K683 PolarHBondContact OE2-NZ 2.87Å; D543-K683 IonicContact OD1-NZ 2.73Å; D543-K683 PolarHBondContact OD1-NZ 2.9Å; D543-K683 WeakPolarHBondContact OD2-CE 3.46Å; D543-K683 IonicContact OD2-NZ 2.92Å; D543-K683 PolarHBondContact OD2-NZ 3.23Å; K683-S685 PolarHBondContact O-N 3.44Å
684	V	32.3	Very low	48.1	Very low	93 Å²	93	103.1 Å²	103.1	56%	0.564	56%	0.563	S	S	*	*			trans	-75.3	106.5	162.3	179.5	0	0	0	0	107.7	T682	T682-V684 PolarHBondContact O-N 2.9Å
685	S	32.7	Very low	48.5	Very low	92 Å²	92	103.5 Å²	103.5	64%	0.643	57%	0.568	S	S	*	*			trans	-65.8	144.2	177.2	65.5	0	0	0	0	111.3	K683 N687	K683-S685 PolarHBondContact O-N 3.44Å; S685-N687 PolarHBondContact O-N 2.82Å
686	G	32	Very low	49	Very low	84 Å²	84	106.6 Å²	106.6	87%	0.866	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	26	-156.1	0	0	0	0	0	119.5
687	N	38.5	Very low	49.9	Very low	158 Å²	158	106.4 Å²	106.4	85%	0.845	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-5.6	-177.5	-87.7	-22.1	0	0	0	115.8	S685	S685-N687 PolarHBondContact O-N 2.82Å
688	E	38.4	Very low	51.4	Low	134 Å²	134	105.9 Å²	105.9	63%	0.626	58%	0.579	S	S	*	*			trans	-85.1	125.1	179.1	-69.4	-163.2	137.9	0	0	113.4	R672 V690	R672-E688 PolarHBondContact NH1-O 3.48Å; R672-E688 PolarHBondContact NH2-O 3.03Å; E688-V690 PolarHBondContact O-N 3.46Å
689	V	48.9	Very low	53.7	Low	113 Å²	113	101.1 Å²	101.1	69%	0.685	55%	0.546	S	S	*	.			trans	-89.9	75.4	177.5	-169.5	0	0	0	0	110.3	E691	V689-E691 HydrophobicContact CG1-CG 4.24Å; V689-E691 PolarHBondContact O-N 3.21Å
690	V	52.4	Low	56.2	Low	72 Å²	72	99.1 Å²	99.1	44%	0.436	52%	0.522	S	S	.	.			trans	-55.3	107	158.9	-176	0	0	0	0	108.8	R672 L675 E688	R672-V690 PolarHBondContact NH2-O 2.79Å; L675-V690 HydrophobicContact CD2-CG1 4.05Å; E688-V690 PolarHBondContact O-N 3.46Å
691	E	62.4	Low	58.8	Low	110 Å²	110	91.3 Å²	91.3	51%	0.514	49%	0.485	S	S	.	.			trans	-87.3	127.9	175.6	-76	172.5	-152.7	0	0	110.8	V689 R694	V689-E691 HydrophobicContact CG1-CG 4.24Å; V689-E691 PolarHBondContact O-N 3.21Å; E691-R694 HydrophobicContact CB-CG 4.33Å; E691-R694 IonicContact OE1-NH2 3.46Å; E691-R694 PolarHBondContact OE1-NH2 2.77Å; E691-R694 IonicContact OE2-CZ 3.62Å; E691-R694 IonicContact OE2-NE 3.58Å; E691-R694 PolarHBondContact OE2-NE 2.69Å; E691-R694 IonicContact OE2-NH2 3.54Å; E691-R694 PolarHBondContact OE2-NH2 2.79Å
692	M	71.1	Confident	61.4	Low	53 Å²	53	83.1 Å²	83.1	26%	0.261	45%	0.454	S	S	.	.			trans	-92	157.6	-179.9	-62.6	172.1	-72.7	0	0	111	R672 L675 R694 F701	R672-M692 HydrophobicContact CG-CE 4.27Å; R672-M692 HydrophobicContact CG-SD 4.4Å; L675-M692 HydrophobicContact CD1-CG 4.28Å; L675-M692 HydrophobicContact CD1-SD 4.27Å; M692-R694 VanDerWaalsContact C-N 3.31Å; M692-R694 PolarHBondContact O-N 3.13Å; M692-F701 HydrophobicContact SD-CE1 4.11Å; M692-F701 HydrophobicContact SD-CZ 4.42Å
693	F	84.8	Confident	64.2	Low	9 Å²	9	78.4 Å²	78.4	4%	0.039	43%	0.425	C	S	.	.	S	Bend	trans	59.5	24.8	172.3	-45.1	-68	0	0	0	117.3	V640 T642 V650 V654 L670 S699 F701 W727	V640-F693 HydrophobicContact CB-CD1 4.27Å; V640-F693 HydrophobicContact CB-CE1 3.93Å; V640-F693 HydrophobicContact CG1-CD1 3.94Å; V640-F693 HydrophobicContact CG1-CE1 3.83Å; V640-F693 HydrophobicContact CG2-CE1 4.23Å; T642-F693 PolarHBondContact OG1-O 2.9Å; V650-F693 HydrophobicContact CG1-CB 3.72Å; V650-F693 HydrophobicContact CG1-CD2 3.82Å; V650-F693 HydrophobicContact CG1-CG 3.9Å; V654-F693 HydrophobicContact CB-CE2 3.96Å; V654-F693 HydrophobicContact CB-CZ 3.95Å; V654-F693 HydrophobicContact CG1-CZ 4.23Å; V654-F693 HydrophobicContact CG2-CD2 4Å; V654-F693 HydrophobicContact CG2-CE2 3.64Å; V654-F693 HydrophobicContact CG2-CZ 3.99Å; L670-F693 HydrophobicContact CB-CZ 3.94Å; L670-F693 HydrophobicContact CD1-CE1 4.44Å; L670-F693 HydrophobicContact CD1-CZ 4.22Å; F693-S699 PolarHBondContact N-OG 2.82Å; F693-S699 VanDerWaalsContact N-OG 3.17Å; F693-F701 AromaticContact CE1-CE2 3.75Å; F693-F701 HydrophobicContact CE1-CE2 3.75Å; F693-F701 AromaticContact CE1-CZ 3.75Å; F693-F701 HydrophobicContact CE1-CZ 3.75Å; F693-F701 HydrophobicContact CE2-CZ 4.36Å; F693-F701 AromaticContact CZ-CE2 3.93Å; F693-F701 HydrophobicContact CZ-CE2 3.93Å; F693-F701 AromaticContact CZ-CZ 3.51Å; F693-F701 HydrophobicContact CZ-CZ 3.51Å; F693-W727 HydrophobicContact CD1-CZ2 4.02Å; F693-W727 HydrophobicContact CE1-CZ2 4.46Å; F693-W727 HydrophobicContact CG-CZ2 4.48Å
694	R	76.8	Confident	66.7	Low	121 Å²	121	75.2 Å²	75.2	46%	0.457	41%	0.41	S	S	.	.			trans	-54.6	154.6	171.7	-77.7	-178.1	168.7	177.7	-1.6	112.7	T642 E691 M692 V697	T642-R694 VanDerWaalsContact CB-O 3.31Å; T642-R694 WeakPolarHBondContact CB-O 3.25Å; E691-R694 HydrophobicContact CB-CG 4.33Å; E691-R694 IonicContact OE1-NH2 3.46Å; E691-R694 PolarHBondContact OE1-NH2 2.77Å; E691-R694 IonicContact OE2-CZ 3.62Å; E691-R694 IonicContact OE2-NE 3.58Å; E691-R694 PolarHBondContact OE2-NE 2.69Å; E691-R694 IonicContact OE2-NH2 3.54Å; E691-R694 PolarHBondContact OE2-NH2 2.79Å; M692-R694 VanDerWaalsContact C-N 3.31Å; M692-R694 PolarHBondContact O-N 3.13Å; R694-V697 HydrophobicContact CB-CB 4.07Å; R694-V697 HydrophobicContact CB-CG2 3.81Å; R694-V697 WeakPolarHBondContact O-CB 3.48Å; R694-V697 PolarHBondContact O-N 3.19Å
695	P	77.5	Confident	69.2	Low	51 Å²	51	71.5 Å²	71.5	33%	0.331	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	139.3	-177	-19.2	34.2	0	0	0	111.6	Y649 V697	Y649-P695 HydrophobicContact CD1-CG 4Å; Y649-P695 HydrophobicContact CG-CG 4.46Å; P695-V697 PolarHBondContact O-N 3.05Å; P695-V697 VanDerWaalsContact O-N 3.11Å
696	N	81.7	Confident	71.4	Confident	103 Å²	103	70.1 Å²	70.1	55%	0.551	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	15.9	-175.8	-155.6	48.6	0	0	0	115.3	T642 S643 P644	T642-N696 VanDerWaalsContact O-CA 3.3Å; T642-N696 WeakPolarHBondContact O-CA 3.18Å; T642-N696 PolarHBondContact O-N 3Å; T642-N696 VanDerWaalsContact O-N 3.12Å; S643-N696 PolarHBondContact O-N 3.46Å; S643-N696 VanDerWaalsContact O-N 3.11Å; P644-N696 HydrophobicContact CB-CB 3.99Å
697	V	79.9	Confident	73.8	Confident	65 Å²	65	69.9 Å²	69.9	39%	0.394	35%	0.348	S	S	.	.			trans	-106.1	140.5	178	179	0	0	0	0	110.5	T642 R694 P695	T642-V697 PolarHBondContact N-O 2.78Å; R694-V697 HydrophobicContact CB-CB 4.07Å; R694-V697 HydrophobicContact CB-CG2 3.81Å; R694-V697 WeakPolarHBondContact O-CB 3.48Å; R694-V697 PolarHBondContact O-N 3.19Å; P695-V697 PolarHBondContact O-N 3.05Å; P695-V697 VanDerWaalsContact O-N 3.11Å
698	E	84.4	Confident	76	Confident	94 Å²	94	62.4 Å²	62.4	44%	0.439	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.5	173.7	-170.3	173.8	167.9	0	0	109.6	S639 V640 K641	S639-E698 WeakPolarHBondContact CB-OE1 3.45Å; S639-E698 PolarHBondContact OG-OE1 2.9Å; V640-E698 WeakPolarHBondContact O-CA 3.19Å; K641-E698 HydrophobicContact CG-CB 4.49Å
699	S	86.2	Confident	78.2	Confident	10 Å²	10	56.8 Å²	56.8	7%	0.07	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.5	179.7	-58.3	0	0	0	0	110	V640 F693 F701	V640-S699 PolarHBondContact N-O 2.83Å; V640-S699 PolarHBondContact O-N 2.92Å; F693-S699 PolarHBondContact N-OG 2.82Å; F693-S699 VanDerWaalsContact N-OG 3.17Å; S699-F701 WeakPolarHBondContact O-CE2 3.38Å
700	K	85.3	Confident	80	Confident	79 Å²	79	54.6 Å²	54.6	34%	0.343	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.4	-175.4	-78.1	-168.7	168.6	-155	0	113.6	E637 I638 S639 L675 E676	E637-K700 WeakPolarHBondContact OE2-CE 3.42Å; E637-K700 IonicContact OE2-NZ 2.64Å; E637-K700 PolarHBondContact OE2-NZ 3.41Å; I638-K700 CarbonylContact O-C 3.56Å; I638-K700 WeakPolarHBondContact O-CA 3.42Å; S639-K700 VanDerWaalsContact OG-CE 3.28Å; S639-K700 WeakPolarHBondContact OG-CE 3.47Å; S639-K700 WeakPolarHBondContact OG-CG 3.41Å; L675-K700 WeakPolarHBondContact CA-O 3.48Å; L675-K700 WeakPolarHBondContact CD1-O 3.44Å; E676-K700 HydrophobicContact CB-CB 4.22Å; E676-K700 PolarHBondContact N-O 2.89Å
701	F	86.1	Confident	81.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.1	-178.5	-53.9	-91.8	0	0	0	112	E637 I638 V640 L670 N674 L675 M692 F693 S699	E637-F701 CarbonylContact C-O 3.37Å; E637-F701 WeakPolarHBondContact CA-O 3.42Å; I638-F701 PolarHBondContact N-O 3.08Å; I638-F701 PolarHBondContact O-N 3.3Å; V640-F701 HydrophobicContact CB-CE2 4.5Å; V640-F701 HydrophobicContact CG2-CD2 4.34Å; V640-F701 HydrophobicContact CG2-CE2 4.13Å; L670-F701 HydrophobicContact CB-CD1 4.41Å; L670-F701 HydrophobicContact CB-CE1 4.07Å; L670-F701 HydrophobicContact CB-CE2 4.43Å; L670-F701 HydrophobicContact CB-CZ 4.08Å; L670-F701 HydrophobicContact CD1-CD2 4.35Å; L670-F701 HydrophobicContact CD1-CE2 4.21Å; L670-F701 HydrophobicContact CD2-CB 4.34Å; L670-F701 HydrophobicContact CD2-CD1 4.38Å; L670-F701 HydrophobicContact CD2-CD2 4.27Å; L670-F701 HydrophobicContact CD2-CG 4.09Å; N674-F701 HydrophobicContact CB-CB 4.22Å; N674-F701 HydrophobicContact CB-CD1 4.06Å; N674-F701 CarbonylContact O-C 3.57Å; N674-F701 WeakPolarHBondContact O-CA 3.25Å; L675-F701 HydrophobicContact CB-CD1 4.45Å; L675-F701 HydrophobicContact CD1-CD1 3.89Å; L675-F701 HydrophobicContact CD1-CE1 3.5Å; L675-F701 HydrophobicContact CD1-CZ 3.88Å; M692-F701 HydrophobicContact SD-CE1 4.11Å; M692-F701 HydrophobicContact SD-CZ 4.42Å; F693-F701 AromaticContact CE1-CE2 3.75Å; F693-F701 HydrophobicContact CE1-CE2 3.75Å; F693-F701 AromaticContact CE1-CZ 3.75Å; F693-F701 HydrophobicContact CE1-CZ 3.75Å; F693-F701 HydrophobicContact CE2-CZ 4.36Å; F693-F701 AromaticContact CZ-CE2 3.93Å; F693-F701 HydrophobicContact CZ-CE2 3.93Å; F693-F701 AromaticContact CZ-CZ 3.51Å; F693-F701 HydrophobicContact CZ-CZ 3.51Å; S699-F701 WeakPolarHBondContact O-CE2 3.38Å
702	R	81.3	Confident	83	Confident	72 Å²	72	47.1 Å²	47.1	27%	0.272	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.7	164.1	-80.4	-170.4	-176.6	-160.5	-5.5	111	D557 W636 N674 E676 L737	D557-R702 IonicContact OD2-NH1 3.05Å; D557-R702 PolarHBondContact OD2-NH1 3.17Å; W636-R702 WeakPolarHBondContact O-CA 3.21Å; N674-R702 PolarHBondContact O-N 2.86Å; E676-R702 HydrophobicContact CG-CG 4.29Å; E676-R702 IonicContact OE1-CZ 3.05Å; E676-R702 IonicContact OE1-NE 2.75Å; E676-R702 PolarHBondContact OE1-NE 3.4Å; E676-R702 IonicContact OE1-NH2 2.69Å; E676-R702 PolarHBondContact OE1-NH2 3.11Å; R702-L737 HydrophobicContact CG-CD1 4.19Å
703	I	84.9	Confident	83.9	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.031	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	152.7	174.3	58	158.4	0	0	0	111.2	W636 I638 I658 I668 I705	W636-I703 HydrophobicContact CB-CD1 4.47Å; W636-I703 HydrophobicContact CB-CG1 4.07Å; W636-I703 PolarHBondContact N-O 3.32Å; W636-I703 PolarHBondContact O-N 3.38Å; I638-I703 HydrophobicContact CD1-CD1 3.47Å; I638-I703 VanDerWaalsContact CD1-CD1 3.47Å; I638-I703 HydrophobicContact CD1-CG1 4.14Å; I638-I703 HydrophobicContact CG1-CD1 4.11Å; I638-I703 HydrophobicContact CG1-CG1 4.35Å; I658-I703 HydrophobicContact CD1-CD1 4.16Å; I668-I703 HydrophobicContact CD1-CD1 3.64Å; I668-I703 HydrophobicContact CG2-CG2 4.08Å; I703-I705 HydrophobicContact CD1-CD1 4.14Å; I703-I705 HydrophobicContact CD1-CG1 4.43Å; I703-I705 HydrophobicContact CD1-CG2 3.95Å
704	Y	83	Confident	84.3	Confident	61 Å²	61	44.2 Å²	44.2	24%	0.239	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	105.9	178.5	-58.5	-88.7	0	0	0	110	P464 D557 P593 L594 K633 I634 P635	P464-Y704 HydrophobicContact CB-CE1 4.3Å; P464-Y704 HydrophobicContact CB-CE2 4.31Å; P464-Y704 HydrophobicContact CG-CD1 4.15Å; P464-Y704 HydrophobicContact CG-CE1 3.57Å; P464-Y704 HydrophobicContact CG-CE2 4.38Å; D557-Y704 PolarHBondContact OD1-OH 2.91Å; P593-Y704 HydrophobicContact CB-CG 4.46Å; L594-Y704 HydrophobicContact CD2-CD1 3.96Å; L594-Y704 HydrophobicContact CD2-CE1 4.21Å; K633-Y704 WeakPolarHBondContact CD-O 3.5Å; I634-Y704 WeakPolarHBondContact O-CA 3.28Å; P635-Y704 HydrophobicContact CB-CD1 3.87Å; P635-Y704 HydrophobicContact CB-CE1 3.74Å
705	I	84.5	Confident	85	Confident	15 Å²	15	39 Å²	39	8%	0.077	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	151.9	-170.8	53.1	170.4	0	0	0	112.6	K633 I634 W636 I658 T665 I668 I703 I708	K633-I705 CarbonylContact C-O 3.59Å; K633-I705 WeakPolarHBondContact CA-O 3.31Å; I634-I705 PolarHBondContact N-O 2.85Å; I634-I705 PolarHBondContact O-N 2.79Å; W636-I705 HydrophobicContact CD2-CD1 4.36Å; W636-I705 HydrophobicContact CG-CD1 4.05Å; W636-I705 HydrophobicContact CG-CG1 4.13Å; I658-I705 HydrophobicContact CD1-CD1 4.09Å; T665-I705 HydrophobicContact CG2-CB 4.06Å; T665-I705 HydrophobicContact CG2-CD1 3.84Å; T665-I705 HydrophobicContact CG2-CG2 3.89Å; I668-I705 HydrophobicContact CD1-CG2 3.69Å; I703-I705 HydrophobicContact CD1-CD1 4.14Å; I703-I705 HydrophobicContact CD1-CG1 4.43Å; I703-I705 HydrophobicContact CD1-CG2 3.95Å; I705-I708 HydrophobicContact CD1-CD1 4.3Å
706	K	79.5	Confident	85.7	Confident	62 Å²	62	36.5 Å²	36.5	27%	0.27	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	161.6	176.1	61.4	176.7	176.6	170.3	0	112.1	D663 K664 I708	D663-K706 VanDerWaalsContact CG-CE 3.48Å; D663-K706 WeakPolarHBondContact OD1-CE 3.29Å; D663-K706 IonicContact OD1-NZ 3.63Å; D663-K706 PolarHBondContact OD1-NZ 2.86Å; D663-K706 VanDerWaalsContact OD2-CE 3.24Å; D663-K706 WeakPolarHBondContact OD2-CE 3.44Å; D663-K706 IonicContact OD2-NZ 3.34Å; D663-K706 PolarHBondContact OD2-NZ 2.89Å; K664-K706 WeakPolarHBondContact O-CE 3.34Å; K664-K706 PolarHBondContact O-NZ 2.95Å; K706-I708 VanDerWaalsContact C-N 3.35Å; K706-I708 HydrophobicContact CG-CG2 4.31Å; K706-I708 PolarHBondContact O-N 3.09Å
707	D	82.5	Confident	86.2	Confident	80 Å²	80	33.9 Å²	33.9	43%	0.428	17%	0.167	S	C	.	.			trans	-67.4	85	177.3	178.1	9.5	0	0	0	112.3	I634 K662 G709	I634-D707 HydrophobicContact CD1-CB 3.91Å; K662-D707 IonicContact NZ-OD1 3.99Å; K662-D707 PolarHBondContact NZ-OD1 3Å; K662-D707 IonicContact NZ-OD2 3.22Å; K662-D707 PolarHBondContact NZ-OD2 3.34Å; D707-G709 PolarHBondContact O-N 3.19Å; D707-G709 PolarHBondContact OD1-N 2.81Å
708	I	84.4	Confident	86.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.149	C	C	.	.			trans	-73.7	-5	176.2	61.2	174.7	0	0	0	113.9	I658 G660 S661 K662 D663 T665 I705 K706 P711	I658-I708 HydrophobicContact CB-CD1 4.07Å; I658-I708 HydrophobicContact CG2-CD1 3.55Å; G660-I708 CarbonylContact C-O 3.59Å; G660-I708 VanDerWaalsContact CA-O 3.24Å; G660-I708 WeakPolarHBondContact CA-O 3.2Å; S661-I708 PolarHBondContact N-O 3.29Å; S661-I708 VanDerWaalsContact N-O 3.09Å; K662-I708 PolarHBondContact N-O 2.83Å; D663-I708 HydrophobicContact CB-CG2 4.42Å; D663-I708 PolarHBondContact N-O 3.36Å; D663-I708 WeakPolarHBondContact O-CB 3.46Å; T665-I708 HydrophobicContact CG2-CD1 4.45Å; T665-I708 HydrophobicContact CG2-CG2 4.13Å; I705-I708 HydrophobicContact CD1-CD1 4.3Å; K706-I708 VanDerWaalsContact C-N 3.35Å; K706-I708 HydrophobicContact CG-CG2 4.31Å; K706-I708 PolarHBondContact O-N 3.09Å; I708-P711 HydrophobicContact CD1-CG 4.41Å
709	G	85	Confident	86.7	Confident	16 Å²	16	29.6 Å²	29.6	17%	0.165	15%	0.145	C	C	.	.			trans	75.4	-148.6	-169.1	0	0	0	0	0	112.6	D707 P711	D707-G709 PolarHBondContact O-N 3.19Å; D707-G709 PolarHBondContact OD1-N 2.81Å; G709-P711 WeakPolarHBondContact O-CD 2.95Å
710	I	86.1	Confident	86.7	Confident	66 Å²	66	31.8 Å²	31.8	34%	0.338	16%	0.156	S	C	.	.	S	Bend	trans	-75.8	118.7	-179.4	-61.5	167.3	0	0	0	108.7	G660 S661 C712 Y743 I771	G660-I710 CarbonylContact C-O 3.58Å; G660-I710 WeakPolarHBondContact CA-O 3.31Å; S661-I710 PolarHBondContact N-O 2.79Å; S661-I710 PolarHBondContact OG-N 2.9Å; I710-C712 PolarHBondContact O-N 2.85Å; I710-Y743 HydrophobicContact CG2-CE1 3.81Å; I710-I771 HydrophobicContact CG2-CD1 4.13Å; I710-I771 HydrophobicContact CG2-CG1 4.03Å
711	P	89.4	Confident	86.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	124.2	177.7	-22.4	33.6	0	0	0	111.3	W636 I658 F659 I708 G709 L734 Y743 F745 A766 I771	W636-P711 HydrophobicContact CH2-CG 3.59Å; W636-P711 HydrophobicContact CZ2-CG 4.48Å; W636-P711 HydrophobicContact CZ3-CG 3.99Å; I658-P711 HydrophobicContact CG2-CB 4.14Å; F659-P711 CarbonylContact O-C 3.57Å; F659-P711 WeakPolarHBondContact O-CA 3.36Å; I708-P711 HydrophobicContact CD1-CG 4.41Å; G709-P711 WeakPolarHBondContact O-CD 2.95Å; P711-L734 HydrophobicContact CB-CD2 3.97Å; P711-L734 HydrophobicContact CG-CD2 3.83Å; P711-Y743 HydrophobicContact CB-CD1 4.34Å; P711-Y743 HydrophobicContact CB-CG 4.25Å; P711-Y743 HydrophobicContact CG-CD1 4.35Å; P711-Y743 HydrophobicContact CG-CD2 3.93Å; P711-Y743 HydrophobicContact CG-CE2 4.15Å; P711-Y743 HydrophobicContact CG-CG 4.04Å; P711-F745 HydrophobicContact CB-CZ 4.25Å; P711-A766 WeakPolarHBondContact O-CB 3.35Å; P711-I771 WeakPolarHBondContact O-CD1 3.42Å
712	C	87.8	Confident	85.7	Confident	26 Å²	26	37.8 Å²	37.8	18%	0.176	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-27.4	-172.3	64	0	0	0	0	114.1	F659 I710 A766 L775	F659-C712 PolarHBondContact O-N 3.24Å; F659-C712 PolarHBondContact O-SG 2.98Å; F659-C712 VanDerWaalsContact O-SG 3.38Å; I710-C712 PolarHBondContact O-N 2.85Å; C712-A766 WeakPolarHBondContact O-CB 3.26Å; C712-A766 PolarHBondContact O-N 3.18Å; C712-L775 HydrophobicContact CB-CD1 4.47Å
713	K	91.1	Very high	85.7	Confident	1 Å²	1	40 Å²	40	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	157.8	165.4	69.1	171.7	-176.1	174.6	0	111.3	F659 E763 I764 D808 V838 L840	F659-K713 HydrophobicContact CB-CG 3.67Å; F659-K713 WeakPolarHBondContact CB-O 3.33Å; F659-K713 HydrophobicContact CD2-CD 4.35Å; F659-K713 HydrophobicContact CD2-CG 3.78Å; F659-K713 HydrophobicContact CG-CD 4.47Å; F659-K713 HydrophobicContact CG-CG 3.83Å; F659-K713 PolarHBondContact N-O 2.96Å; F659-K713 PolarHBondContact O-N 2.85Å; K713-E763 IonicContact NZ-OE1 3.95Å; K713-E763 PolarHBondContact NZ-OE1 3.05Å; K713-E763 IonicContact NZ-OE2 3.73Å; K713-E763 PolarHBondContact NZ-OE2 3.43Å; K713-I764 CarbonylContact C-O 3.59Å; K713-I764 VanDerWaalsContact CA-O 3.32Å; K713-I764 WeakPolarHBondContact CA-O 3.41Å; K713-I764 WeakPolarHBondContact CB-O 3.32Å; K713-D808 PolarHBondContact NZ-O 3.09Å; K713-V838 HydrophobicContact CB-CB 4.34Å; K713-V838 HydrophobicContact CB-CG1 4.04Å; K713-V838 HydrophobicContact CD-CB 3.69Å; K713-V838 HydrophobicContact CD-CG1 3.94Å; K713-V838 HydrophobicContact CD-CG2 4.45Å; K713-L840 VanDerWaalsContact NZ-CD2 3.34Å
714	L	92.6	Very high	85.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.9	173.3	178.8	151.7	0	0	0	108.6	I658 I716 I732 F745 E763 I764	I658-L714 HydrophobicContact CG1-CD1 4.28Å; L714-I716 HydrophobicContact CD2-CB 3.89Å; L714-I716 HydrophobicContact CD2-CG2 4.14Å; L714-I732 HydrophobicContact CD1-CD1 4.35Å; L714-I732 HydrophobicContact CD1-CG2 4.06Å; L714-I732 HydrophobicContact CD2-CD1 3.86Å; L714-F745 HydrophobicContact CB-CD1 3.49Å; L714-F745 VanDerWaalsContact CB-CD1 3.49Å; L714-F745 HydrophobicContact CB-CD2 4.37Å; L714-F745 HydrophobicContact CB-CE1 3.4Å; L714-F745 HydrophobicContact CB-CE2 4.31Å; L714-F745 HydrophobicContact CB-CG 3.99Å; L714-F745 HydrophobicContact CB-CZ 3.84Å; L714-F745 HydrophobicContact CD1-CD2 4.13Å; L714-F745 HydrophobicContact CD1-CE2 4.21Å; L714-F745 HydrophobicContact CD1-CG 4.36Å; L714-F745 HydrophobicContact CD1-CZ 4.5Å; L714-E763 CarbonylContact O-C 3.57Å; L714-E763 WeakPolarHBondContact O-CA 3.49Å; L714-I764 HydrophobicContact CD2-CD1 4.32Å; L714-I764 PolarHBondContact N-O 2.93Å; L714-I764 PolarHBondContact O-N 2.69Å
715	R	92	Very high	85.6	Confident	10 Å²	10	38.8 Å²	38.8	4%	0.038	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.2	167.3	-177.6	-176.2	-55.6	144.8	10.5	108.6	I656 I657 F659 L761 R762 E763 D808 C809 G810	I656-R715 CarbonylContact C-O 3.48Å; I656-R715 VanDerWaalsContact CA-O 3.25Å; I656-R715 WeakPolarHBondContact CA-O 3.36Å; I657-R715 HydrophobicContact CB-CB 4.36Å; I657-R715 PolarHBondContact N-O 3.28Å; I657-R715 PolarHBondContact O-N 2.68Å; F659-R715 HydrophobicContact CE2-CB 4.22Å; R715-L761 HydrophobicContact CG-CD2 3.87Å; R715-L761 HydrophobicContact CG-CG 4.19Å; R715-R762 WeakPolarHBondContact CA-O 3.44Å; R715-E763 HydrophobicContact CB-CG 4.24Å; R715-E763 HydrophobicContact CG-CG 4.17Å; R715-E763 IonicContact CZ-OE1 3.2Å; R715-E763 IonicContact NE-OE1 3.27Å; R715-E763 PolarHBondContact NE-OE1 2.86Å; R715-E763 IonicContact NH2-OE1 2.89Å; R715-E763 PolarHBondContact NH2-OE1 3.16Å; R715-D808 IonicContact CZ-OD1 3.4Å; R715-D808 IonicContact NH1-OD1 2.8Å; R715-D808 PolarHBondContact NH1-OD1 3.29Å; R715-D808 VanDerWaalsContact NH2-C 3.32Å; R715-D808 PolarHBondContact NH2-O 3.4Å; R715-D808 IonicContact NH2-OD1 2.66Å; R715-D808 PolarHBondContact NH2-OD1 3.11Å; R715-C809 VanDerWaalsContact CZ-O 3.29Å; R715-C809 PolarHBondContact NE-O 3.46Å; R715-C809 PolarHBondContact NH2-O 2.89Å; R715-G810 VanDerWaalsContact CZ-CA 3.47Å; R715-G810 VanDerWaalsContact CZ-N 3.33Å; R715-G810 VanDerWaalsContact NH2-N 3.17Å
716	I	92.7	Very high	85.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	142.5	174.8	-173.2	158	0	0	0	111.1	V654 S655 I656 L714 W727 L729 I732 L751 L761 R762 I764	V654-I716 HydrophobicContact CG1-CD1 3.86Å; V654-I716 HydrophobicContact CG1-CG1 4.18Å; S655-I716 WeakPolarHBondContact O-CA 3.35Å; I656-I716 HydrophobicContact CG2-CB 3.95Å; I656-I716 HydrophobicContact CG2-CD1 3.56Å; I656-I716 HydrophobicContact CG2-CG1 3.67Å; L714-I716 HydrophobicContact CD2-CB 3.89Å; L714-I716 HydrophobicContact CD2-CG2 4.14Å; I716-W727 HydrophobicContact CD1-CH2 3.44Å; I716-W727 VanDerWaalsContact CD1-CH2 3.44Å; I716-W727 HydrophobicContact CD1-CZ3 3.49Å; I716-W727 VanDerWaalsContact CD1-CZ3 3.49Å; I716-W727 HydrophobicContact CG1-CH2 4.32Å; I716-W727 HydrophobicContact CG1-CZ3 3.87Å; I716-L729 HydrophobicContact CD1-CD2 4.29Å; I716-L729 HydrophobicContact CG2-CD2 3.89Å; I716-I732 HydrophobicContact CD1-CD1 3.55Å; I716-L751 HydrophobicContact CG2-CD2 4.2Å; I716-L761 CarbonylContact O-C 3.58Å; I716-L761 WeakPolarHBondContact O-CA 3.39Å; I716-R762 HydrophobicContact CG2-CB 4.3Å; I716-R762 PolarHBondContact N-O 3.35Å; I716-R762 PolarHBondContact O-N 3.17Å; I716-I764 HydrophobicContact CG2-CD1 4.12Å
717	Q	91.2	Very high	86.2	Confident	48 Å²	48	36.9 Å²	36.9	22%	0.224	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	165.2	176.3	65.4	176.4	105.7	0	0	111	S655 I760 L761	S655-Q717 PolarHBondContact N-O 3.21Å; S655-Q717 PolarHBondContact O-N 3.38Å; S655-Q717 VanDerWaalsContact O-O 3.11Å; S655-Q717 WeakPolarHBondContact OG-CG 3.31Å; S655-Q717 PolarHBondContact OG-O 2.98Å; Q717-I760 VanDerWaalsContact CA-O 3.29Å; Q717-I760 WeakPolarHBondContact CA-O 3.33Å; Q717-I760 WeakPolarHBondContact CB-O 3.2Å; Q717-L761 HydrophobicContact CB-CB 4.09Å; Q717-L761 HydrophobicContact CB-CD1 4.41Å; Q717-L761 HydrophobicContact CB-CG 4.07Å
718	H	89.7	Confident	86.6	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.196	C	C	.	.			trans	-117.7	172.2	161.2	58.6	116	0	0	0	110	A652 A653 N720 P725 L751 I760	A652-H718 HydrophobicContact CB-CB 3.99Å; A653-H718 WeakPolarHBondContact O-CA 3.33Å; H718-N720 PolarHBondContact ND1-N 2.87Å; H718-P725 PolarHBondContact CE1-O 2.98Å; H718-L751 PolarHBondContact NE2-O 2.66Å; H718-I760 PolarHBondContact CD2-O 3.34Å; H718-I760 PolarHBondContact N-O 3.4Å; H718-I760 VanDerWaalsContact NE2-CB 3.33Å; H718-I760 WeakPolarHBondContact NE2-CB 3.42Å; H718-I760 WeakPolarHBondContact NE2-CG2 3.48Å
719	D	85.6	Confident	86.9	Confident	68 Å²	68	33.8 Å²	33.8	36%	0.364	20%	0.196	S	C	.	.			trans	-92.2	2.2	178.7	74.7	-19.6	0	0	0	114	A652 A653 K721	A652-D719 WeakPolarHBondContact CB-OD1 3.46Å; A653-D719 HydrophobicContact CB-CB 4.49Å; A653-D719 PolarHBondContact N-OD1 2.97Å; A653-D719 PolarHBondContact O-N 3.46Å; D719-K721 PolarHBondContact O-N 2.83Å; D719-K721 PolarHBondContact OD1-N 3.05Å
720	N	86.1	Confident	87.2	Confident	57 Å²	57	35.1 Å²	35.1	31%	0.305	20%	0.197	S	C	.	.	S	Bend	trans	59.1	19.4	-176.1	-160.8	67.8	0	0	0	114.8	H718 I760	H718-N720 PolarHBondContact ND1-N 2.87Å; N720-I760 HydrophobicContact CB-CD1 4.1Å
721	K	76.5	Confident	87.5	Confident	163 Å²	163	33.5 Å²	33.5	71%	0.709	19%	0.188	S	C	*	.			trans	-112.4	99	179.5	-64.5	176.7	-178.7	-179.7	0	112	A652 D719	A652-K721 WeakPolarHBondContact CA-O 3.37Å; D719-K721 PolarHBondContact O-N 2.83Å; D719-K721 PolarHBondContact OD1-N 3.05Å
722	G	74.6	Confident	87.7	Confident	42 Å²	42	33.5 Å²	33.5	43%	0.433	19%	0.188	S	C	.	.	S	Bend	trans	-177.6	174.3	176.5	0	0	0	0	0	111.4	T651 N724	T651-G722 WeakPolarHBondContact OG1-CA 3.26Å; G722-N724 VanDerWaalsContact C-N 3.34Å
723	S	81.4	Confident	88	Confident	118 Å²	118	33.6 Å²	33.6	83%	0.825	19%	0.188	S	C	*	.	S	Bend	trans	-69.6	-31.5	177	51.4	0	0	0	0	112.8	T651	T651-S723 PolarHBondContact OG1-N 2.74Å; T651-S723 VanDerWaalsContact OG1-N 3.09Å
724	N	83.3	Confident	88.1	Confident	15 Å²	15	33.5 Å²	33.5	8%	0.08	19%	0.188	C	C	.	.			trans	-129.2	112.4	164	-172.8	12.6	0	0	0	110.7	N647 Y649 T651 G722 N726	N647-N724 PolarHBondContact O-ND2 2.72Å; Y649-N724 HydrophobicContact CD2-CB 4.32Å; Y649-N724 HydrophobicContact CE2-CB 3.73Å; Y649-N724 PolarHBondContact O-ND2 2.93Å; T651-N724 PolarHBondContact N-O 2.99Å; T651-N724 PolarHBondContact OG1-N 3.04Å; T651-N724 PolarHBondContact OG1-O 3.12Å; G722-N724 VanDerWaalsContact C-N 3.34Å; N724-N726 WeakPolarHBondContact OD1-CB 3.48Å; N724-N726 PolarHBondContact OD1-N 3.48Å
725	P	82.4	Confident	88	Confident	26 Å²	26	34 Å²	34	17%	0.169	19%	0.191	C	C	.	.			trans	-97.4	-0.6	172.2	37.9	-34.3	0	0	0	113.7	A652 H718 W727	A652-P725 HydrophobicContact CB-CB 4.33Å; H718-P725 PolarHBondContact CE1-O 2.98Å; P725-W727 PolarHBondContact O-N 3.34Å
726	N	86.2	Confident	87.8	Confident	37 Å²	37	33.9 Å²	33.9	20%	0.198	19%	0.191	C	C	.	.			trans	-83.8	97.7	-177.5	-66.4	-32.1	0	0	0	110.9	S648 N724 W750 S752	S648-N726 CarbonylContact C-O 3.5Å; N724-N726 WeakPolarHBondContact OD1-CB 3.48Å; N724-N726 PolarHBondContact OD1-N 3.48Å; N726-W750 HydrophobicContact CB-CE3 4.47Å; N726-W750 HydrophobicContact CB-CZ3 4.07Å; N726-S752 PolarHBondContact OD1-OG 2.89Å
727	W	89.8	Confident	87.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.6	-177.7	-163.3	32.3	0	0	0	111.7	V640 T642 S648 V650 V654 F693 I716 P725 L729 W750 L751	V640-W727 HydrophobicContact CG1-CH2 3.86Å; V640-W727 HydrophobicContact CG1-CZ2 3.62Å; T642-W727 PolarHBondContact OG1-NE1 3.46Å; S648-W727 WeakPolarHBondContact O-CA 3.49Å; V650-W727 HydrophobicContact CB-CB 3.77Å; V650-W727 HydrophobicContact CB-CD2 4.14Å; V650-W727 HydrophobicContact CB-CG 3.6Å; V650-W727 HydrophobicContact CG1-CB 4.37Å; V650-W727 HydrophobicContact CG1-CD2 3.74Å; V650-W727 HydrophobicContact CG1-CE3 4.4Å; V650-W727 HydrophobicContact CG1-CG 3.69Å; V650-W727 HydrophobicContact CG1-CZ2 4.34Å; V650-W727 HydrophobicContact CG2-CB 4.1Å; V650-W727 HydrophobicContact CG2-CG 4.29Å; V654-W727 HydrophobicContact CG1-CH2 3.71Å; V654-W727 HydrophobicContact CG1-CZ3 3.79Å; V654-W727 HydrophobicContact CG2-CH2 4.23Å; V654-W727 HydrophobicContact CG2-CZ3 4.17Å; F693-W727 HydrophobicContact CD1-CZ2 4.02Å; F693-W727 HydrophobicContact CE1-CZ2 4.46Å; F693-W727 HydrophobicContact CG-CZ2 4.48Å; I716-W727 HydrophobicContact CD1-CH2 3.44Å; I716-W727 VanDerWaalsContact CD1-CH2 3.44Å; I716-W727 HydrophobicContact CD1-CZ3 3.49Å; I716-W727 VanDerWaalsContact CD1-CZ3 3.49Å; I716-W727 HydrophobicContact CG1-CH2 4.32Å; I716-W727 HydrophobicContact CG1-CZ3 3.87Å; P725-W727 PolarHBondContact O-N 3.34Å; W727-L729 HydrophobicContact CH2-CD1 4.01Å; W727-L729 HydrophobicContact CH2-CD2 4.48Å; W727-L729 HydrophobicContact CZ2-CD1 3.83Å; W727-W750 CarbonylContact O-C 3.6Å; W727-W750 WeakPolarHBondContact O-CA 3.26Å; W727-W750 VanDerWaalsContact O-CE3 3.28Å; W727-L751 HydrophobicContact CB-CB 4.35Å; W727-L751 HydrophobicContact CE3-CB 4.41Å; W727-L751 HydrophobicContact CE3-CD1 4.09Å; W727-L751 HydrophobicContact CE3-CD2 4.23Å; W727-L751 HydrophobicContact CE3-CG 4.47Å; W727-L751 HydrophobicContact CZ3-CD2 4.48Å; W727-L751 PolarHBondContact N-O 3.13Å; W727-L751 PolarHBondContact O-N 2.91Å
728	H	91.9	Very high	86.5	Confident	17 Å²	17	40.9 Å²	40.9	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	103.2	165.5	-170.9	-69.8	0	0	0	111	S643 S648 N748 R749 W750	S643-H728 VanDerWaalsContact CB-ND1 3.34Å; S643-H728 WeakPolarHBondContact CB-ND1 3.42Å; S643-H728 WeakPolarHBondContact CB-O 3.13Å; S643-H728 PolarHBondContact N-O 3.26Å; S643-H728 PolarHBondContact OG-ND1 2.54Å; S643-H728 PolarHBondContact OG-O 3.2Å; S648-H728 PolarHBondContact O-N 2.96Å; H728-N748 VanDerWaalsContact CE1-C 3.48Å; H728-R749 VanDerWaalsContact CD2-C 3.48Å; H728-W750 HydrophobicContact CB-CD2 3.92Å; H728-W750 HydrophobicContact CB-CE3 3.79Å; H728-W750 HydrophobicContact CB-CH2 4.26Å; H728-W750 HydrophobicContact CB-CZ2 4.41Å; H728-W750 HydrophobicContact CB-CZ3 3.96Å; H728-W750 AromaticContact CD2-CD1 3.68Å; H728-W750 AromaticContact CD2-CD2 3.84Å; H728-W750 AromaticContact CD2-CE2 3.82Å; H728-W750 AromaticContact CD2-CG 3.75Å; H728-W750 AromaticContact CD2-NE1 3.74Å
729	L	90.2	Very high	86	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128.9	-177.4	178	64	0	0	0	110.5	V640 I716 W727 I732 C747 N748 R749 L751 I764	V640-L729 HydrophobicContact CG1-CD1 3.81Å; I716-L729 HydrophobicContact CD1-CD2 4.29Å; I716-L729 HydrophobicContact CG2-CD2 3.89Å; W727-L729 HydrophobicContact CH2-CD1 4.01Å; W727-L729 HydrophobicContact CH2-CD2 4.48Å; W727-L729 HydrophobicContact CZ2-CD1 3.83Å; L729-I732 HydrophobicContact CD1-CD1 4.36Å; L729-I732 HydrophobicContact CD1-CG1 3.98Å; L729-I732 HydrophobicContact CD2-CD1 3.85Å; L729-I732 HydrophobicContact CD2-CG1 4.15Å; L729-C747 HydrophobicContact CB-CB 4.1Å; L729-C747 HydrophobicContact CD2-CB 3.75Å; L729-C747 HydrophobicContact CG-CB 3.77Å; L729-N748 VanDerWaalsContact O-CA 3.32Å; L729-N748 WeakPolarHBondContact O-CA 3.47Å; L729-N748 PolarHBondContact O-N 2.8Å; L729-R749 PolarHBondContact N-O 2.7Å; L729-L751 HydrophobicContact CB-CD1 3.84Å; L729-L751 HydrophobicContact CD2-CD1 4.47Å; L729-I764 HydrophobicContact CD2-CD1 4.04Å
730	Q	90	Very high	85.8	Confident	43 Å²	43	44.9 Å²	44.9	20%	0.201	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-67.6	173.6	175.6	170.6	-15.8	0	0	110.5	K641 C747 N748	K641-Q730 WeakPolarHBondContact O-CB 3.42Å; K641-Q730 PolarHBondContact O-N 3.23Å; Q730-C747 PolarHBondContact O-N 2.88Å; Q730-N748 WeakPolarHBondContact CA-OD1 3.26Å; Q730-N748 PolarHBondContact O-N 2.84Å
731	E	93.1	Very high	85.8	Confident	33 Å²	33	45.8 Å²	45.8	15%	0.154	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	157.6	-176	68.1	-159.9	177.3	0	0	111.8	K641 F745 Y746	K641-E731 HydrophobicContact CB-CG 3.97Å; K641-E731 HydrophobicContact CD-CG 3.76Å; K641-E731 WeakPolarHBondContact CD-OE1 3.45Å; K641-E731 WeakPolarHBondContact CE-OE1 3.19Å; K641-E731 PolarHBondContact N-O 3.2Å; K641-E731 IonicContact NZ-OE1 2.73Å; K641-E731 PolarHBondContact NZ-OE1 3.13Å; E731-F745 CarbonylContact C-O 3.58Å; E731-F745 WeakPolarHBondContact CA-O 3.18Å; E731-Y746 HydrophobicContact CB-CD1 4.12Å; E731-Y746 HydrophobicContact CB-CE1 4.45Å; E731-Y746 VanDerWaalsContact OE2-CE1 3.26Å; E731-Y746 WeakPolarHBondContact OE2-CE1 3.4Å
732	I	94.1	Very high	86.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.6	167.6	-60.7	174.5	0	0	0	108	I638 S639 V640 L714 I716 L729 F745	I638-I732 HydrophobicContact CG2-CG2 3.96Å; S639-I732 CarbonylContact O-C 3.53Å; S639-I732 VanDerWaalsContact O-CA 3.3Å; S639-I732 WeakPolarHBondContact O-CA 3.46Å; S639-I732 WeakPolarHBondContact O-CG2 3.43Å; V640-I732 HydrophobicContact CG1-CG1 4.25Å; V640-I732 HydrophobicContact CG2-CG1 4.36Å; L714-I732 HydrophobicContact CD1-CD1 4.35Å; L714-I732 HydrophobicContact CD1-CG2 4.06Å; L714-I732 HydrophobicContact CD2-CD1 3.86Å; I716-I732 HydrophobicContact CD1-CD1 3.55Å; L729-I732 HydrophobicContact CD1-CD1 4.36Å; L729-I732 HydrophobicContact CD1-CG1 3.98Å; L729-I732 HydrophobicContact CD2-CD1 3.85Å; L729-I732 HydrophobicContact CD2-CG1 4.15Å; I732-F745 HydrophobicContact CB-CB 4.17Å; I732-F745 PolarHBondContact N-O 2.8Å; I732-F745 PolarHBondContact O-N 2.88Å
733	V	93.5	Very high	87.3	Confident	27 Å²	27	41.1 Å²	41.1	16%	0.164	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.4	172.2	-177.2	0	0	0	0	108.6	I638 S639 Q742	I638-V733 WeakPolarHBondContact CA-O 3.48Å; S639-V733 PolarHBondContact N-O 3.38Å; S639-V733 PolarHBondContact O-N 3.25Å; V733-Q742 HydrophobicContact CG1-CB 4.19Å; V733-Q742 HydrophobicContact CG1-CG 4.3Å
734	L	93.6	Very high	87.9	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	106.2	-179.1	173	67.5	0	0	0	108.9	W636 I638 I658 P711 Q742 Y743 F745	W636-L734 HydrophobicContact CB-CD1 4.1Å; W636-L734 HydrophobicContact CD2-CD1 4.13Å; W636-L734 HydrophobicContact CD2-CG 4.46Å; W636-L734 HydrophobicContact CE3-CD1 3.59Å; W636-L734 HydrophobicContact CE3-CD2 4.11Å; W636-L734 HydrophobicContact CE3-CG 3.51Å; W636-L734 HydrophobicContact CG-CD1 4.39Å; W636-L734 HydrophobicContact CZ3-CD1 4.3Å; W636-L734 HydrophobicContact CZ3-CD2 3.98Å; W636-L734 HydrophobicContact CZ3-CG 3.73Å; I638-L734 HydrophobicContact CD1-CD1 3.99Å; I638-L734 HydrophobicContact CG1-CD1 3.57Å; I658-L734 HydrophobicContact CD1-CD1 3.91Å; I658-L734 HydrophobicContact CD1-CD2 4Å; I658-L734 HydrophobicContact CG2-CD2 3.81Å; P711-L734 HydrophobicContact CB-CD2 3.97Å; P711-L734 HydrophobicContact CG-CD2 3.83Å; L734-Q742 WeakPolarHBondContact O-CA 3.38Å; L734-Y743 PolarHBondContact N-O 2.86Å; L734-Y743 PolarHBondContact O-N 2.61Å; L734-F745 HydrophobicContact CB-CD2 4.5Å; L734-F745 HydrophobicContact CB-CE2 3.92Å; L734-F745 HydrophobicContact CD2-CE2 4.04Å; L734-F745 HydrophobicContact CD2-CZ 4.43Å
735	T	90.4	Very high	88.3	Confident	10 Å²	10	37.9 Å²	37.9	6%	0.061	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.3	-178.6	-48	0	0	0	0	110.5	W636 E637 L737 Q742	W636-T735 CarbonylContact C-O 3.55Å; W636-T735 VanDerWaalsContact CA-O 3.26Å; W636-T735 WeakPolarHBondContact CA-O 3.32Å; W636-T735 WeakPolarHBondContact CB-O 3.37Å; E637-T735 PolarHBondContact N-O 2.76Å; E637-T735 PolarHBondContact O-N 3.07Å; E637-T735 WeakPolarHBondContact OE1-CB 3.12Å; E637-T735 PolarHBondContact OE1-OG1 3.31Å; T735-L737 PolarHBondContact O-N 3.21Å; T735-Q742 HydrophobicContact CG2-CG 3.84Å; T735-Q742 PolarHBondContact OG1-NE2 2.92Å
736	N	87.2	Confident	88.7	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.043	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	111.4	170.5	-170.4	-56.1	0	0	0	109.7	W636 R738 T739 H740 E741	W636-N736 HydrophobicContact CD2-CB 4.09Å; W636-N736 VanDerWaalsContact CE3-CA 3.42Å; W636-N736 HydrophobicContact CE3-CB 3.71Å; W636-N736 HydrophobicContact CH2-CB 3.93Å; W636-N736 WeakPolarHBondContact CH2-ND2 3.46Å; W636-N736 HydrophobicContact CZ2-CB 4.28Å; W636-N736 WeakPolarHBondContact CZ2-ND2 3.42Å; W636-N736 HydrophobicContact CZ3-CB 3.62Å; N736-R738 PolarHBondContact O-N 3.25Å; N736-R738 WeakPolarHBondContact OD1-CA 3.4Å; N736-R738 PolarHBondContact OD1-N 2.93Å; N736-T739 VanDerWaalsContact CB-OG1 3.27Å; N736-T739 WeakPolarHBondContact CB-OG1 3.43Å; N736-T739 PolarHBondContact O-N 3.42Å; N736-T739 PolarHBondContact OD1-N 3.16Å; N736-T739 PolarHBondContact OD1-OG1 2.87Å; N736-H740 WeakPolarHBondContact O-CA 3.27Å; N736-H740 PolarHBondContact O-N 2.92Å; N736-E741 HydrophobicContact CB-CB 4.49Å; N736-E741 PolarHBondContact N-O 2.86Å
737	L	80.7	Confident	88.8	Confident	42 Å²	42	41 Å²	41	22%	0.22	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	2.2	-175.2	-68	172.9	0	0	0	114	P635 E637 R702 T735	P635-L737 HydrophobicContact CB-CB 4.03Å; P635-L737 HydrophobicContact CB-CD1 4.26Å; P635-L737 HydrophobicContact CG-CB 4.04Å; P635-L737 PolarHBondContact O-N 2.9Å; E637-L737 HydrophobicContact CB-CD1 4.13Å; E637-L737 HydrophobicContact CB-CD2 3.93Å; E637-L737 HydrophobicContact CB-CG 4.06Å; R702-L737 HydrophobicContact CG-CD1 4.19Å; T735-L737 PolarHBondContact O-N 3.21Å
738	R	76.3	Confident	88.8	Confident	152 Å²	152	45.7 Å²	45.7	57%	0.574	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-16.5	176.9	-163.4	-169.8	63.8	126	3.8	113.7	N736	N736-R738 PolarHBondContact O-N 3.25Å; N736-R738 WeakPolarHBondContact OD1-CA 3.4Å; N736-R738 PolarHBondContact OD1-N 2.93Å
739	T	79.6	Confident	88.6	Confident	51 Å²	51	48.2 Å²	48.2	31%	0.313	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-9.4	174.7	63.3	0	0	0	0	113.3	N736 E741	N736-T739 VanDerWaalsContact CB-OG1 3.27Å; N736-T739 WeakPolarHBondContact CB-OG1 3.43Å; N736-T739 PolarHBondContact O-N 3.42Å; N736-T739 PolarHBondContact OD1-N 3.16Å; N736-T739 PolarHBondContact OD1-OG1 2.87Å; T739-E741 PolarHBondContact O-N 2.96Å; T739-E741 VanDerWaalsContact O-N 3.13Å; T739-E741 WeakPolarHBondContact OG1-CG 3.34Å; T739-E741 PolarHBondContact OG1-OE2 3Å
740	H	81.2	Confident	88.6	Confident	101 Å²	101	50.1 Å²	50.1	47%	0.468	23%	0.232	S	C	.	.			trans	54.7	17.2	-170.8	-47.7	-71.1	0	0	0	114.5	N736	N736-H740 WeakPolarHBondContact O-CA 3.27Å; N736-H740 PolarHBondContact O-N 2.92Å
741	E	85.4	Confident	88.6	Confident	77 Å²	77	48.1 Å²	48.1	36%	0.36	22%	0.222	S	C	.	.			trans	-71.1	126.7	171.5	-69.3	173.4	139	0	0	110.2	N736 T739 Y743 P769	N736-E741 HydrophobicContact CB-CB 4.49Å; N736-E741 PolarHBondContact N-O 2.86Å; T739-E741 PolarHBondContact O-N 2.96Å; T739-E741 VanDerWaalsContact O-N 3.13Å; T739-E741 WeakPolarHBondContact OG1-CG 3.34Å; T739-E741 PolarHBondContact OG1-OE2 3Å; E741-Y743 HydrophobicContact CB-CE2 3.79Å; E741-P769 HydrophobicContact CB-CG 4.07Å; E741-P769 HydrophobicContact CG-CB 4.22Å; E741-P769 HydrophobicContact CG-CG 4.09Å
742	Q	90.3	Very high	88.2	Confident	103 Å²	103	46.5 Å²	46.5	48%	0.481	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.9	174.7	-69.5	-168.3	-51.1	0	0	111.8	V733 L734 T735 P769	V733-Q742 HydrophobicContact CG1-CB 4.19Å; V733-Q742 HydrophobicContact CG1-CG 4.3Å; L734-Q742 WeakPolarHBondContact O-CA 3.38Å; T735-Q742 HydrophobicContact CG2-CG 3.84Å; T735-Q742 PolarHBondContact OG1-NE2 2.92Å; Q742-P769 WeakPolarHBondContact O-CD 3.42Å
743	Y	93.2	Very high	87.7	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.2	176.9	-66.2	-91.9	0	0	0	109.8	W636 I710 P711 L734 E741 P769	W636-Y743 HydrophobicContact CH2-CD2 4.49Å; W636-Y743 HydrophobicContact CH2-CE2 4.37Å; W636-Y743 HydrophobicContact CZ3-CD2 4.06Å; W636-Y743 HydrophobicContact CZ3-CE2 4.31Å; I710-Y743 HydrophobicContact CG2-CE1 3.81Å; P711-Y743 HydrophobicContact CB-CD1 4.34Å; P711-Y743 HydrophobicContact CB-CG 4.25Å; P711-Y743 HydrophobicContact CG-CD1 4.35Å; P711-Y743 HydrophobicContact CG-CD2 3.93Å; P711-Y743 HydrophobicContact CG-CE2 4.15Å; P711-Y743 HydrophobicContact CG-CG 4.04Å; L734-Y743 PolarHBondContact N-O 2.86Å; L734-Y743 PolarHBondContact O-N 2.61Å; E741-Y743 HydrophobicContact CB-CE2 3.79Å; Y743-P769 VanDerWaalsContact CE1-O 3.26Å; Y743-P769 WeakPolarHBondContact CE1-O 3.07Å; Y743-P769 PolarHBondContact OH-O 2.84Å
744	E	92.7	Very high	87.2	Confident	65 Å²	65	58.7 Å²	58.7	30%	0.304	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	139.5	-178.5	-59.2	170.5	177.5	0	0	111	Y746 K767	E744-Y746 HydrophobicContact CB-CD2 4.38Å; E744-Y746 HydrophobicContact CB-CE2 3.71Å; E744-Y746 VanDerWaalsContact CD-OH 3.29Å; E744-Y746 HydrophobicContact CG-CE2 4.35Å; E744-Y746 WeakPolarHBondContact OE2-CE2 3.39Å; E744-Y746 PolarHBondContact OE2-OH 3.28Å; E744-K767 HydrophobicContact CB-CB 4.37Å; E744-K767 PolarHBondContact N-O 3.4Å; E744-K767 PolarHBondContact O-N 3.26Å; E744-K767 IonicContact OE2-NZ 3.97Å; E744-K767 PolarHBondContact OE2-NZ 3Å
745	F	93.4	Very high	86.8	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	93	177.1	-63.4	-86.4	0	0	0	109.7	P711 L714 E731 I732 L734 I764 A766	P711-F745 HydrophobicContact CB-CZ 4.25Å; L714-F745 HydrophobicContact CB-CD1 3.49Å; L714-F745 VanDerWaalsContact CB-CD1 3.49Å; L714-F745 HydrophobicContact CB-CD2 4.37Å; L714-F745 HydrophobicContact CB-CE1 3.4Å; L714-F745 HydrophobicContact CB-CE2 4.31Å; L714-F745 HydrophobicContact CB-CG 3.99Å; L714-F745 HydrophobicContact CB-CZ 3.84Å; L714-F745 HydrophobicContact CD1-CD2 4.13Å; L714-F745 HydrophobicContact CD1-CE2 4.21Å; L714-F745 HydrophobicContact CD1-CG 4.36Å; L714-F745 HydrophobicContact CD1-CZ 4.5Å; E731-F745 CarbonylContact C-O 3.58Å; E731-F745 WeakPolarHBondContact CA-O 3.18Å; I732-F745 HydrophobicContact CB-CB 4.17Å; I732-F745 PolarHBondContact N-O 2.8Å; I732-F745 PolarHBondContact O-N 2.88Å; L734-F745 HydrophobicContact CB-CD2 4.5Å; L734-F745 HydrophobicContact CB-CE2 3.92Å; L734-F745 HydrophobicContact CD2-CE2 4.04Å; L734-F745 HydrophobicContact CD2-CZ 4.43Å; F745-I764 HydrophobicContact CB-CB 4.24Å; F745-I764 HydrophobicContact CB-CG2 3.67Å; F745-I764 HydrophobicContact CD1-CB 4.3Å; F745-I764 HydrophobicContact CD1-CG2 4.17Å; F745-I764 HydrophobicContact CG-CG2 4.45Å; F745-A766 HydrophobicContact CD1-CB 4.22Å; F745-A766 VanDerWaalsContact CE1-CA 3.44Å; F745-A766 HydrophobicContact CE1-CB 3.4Å; F745-A766 HydrophobicContact CZ-CB 3.67Å
746	Y	90.6	Very high	86.4	Confident	108 Å²	108	66.2 Å²	66.2	42%	0.424	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	126.1	178.6	-62.5	-85.7	0	0	0	111.3	E731 E744 I764 K767	E731-Y746 HydrophobicContact CB-CD1 4.12Å; E731-Y746 HydrophobicContact CB-CE1 4.45Å; E731-Y746 VanDerWaalsContact OE2-CE1 3.26Å; E731-Y746 WeakPolarHBondContact OE2-CE1 3.4Å; E744-Y746 HydrophobicContact CB-CD2 4.38Å; E744-Y746 HydrophobicContact CB-CE2 3.71Å; E744-Y746 VanDerWaalsContact CD-OH 3.29Å; E744-Y746 HydrophobicContact CG-CE2 4.35Å; E744-Y746 WeakPolarHBondContact OE2-CE2 3.39Å; E744-Y746 PolarHBondContact OE2-OH 3.28Å; Y746-I764 WeakPolarHBondContact O-CG2 3.39Å; Y746-K767 HydrophobicContact CE2-CD 4.18Å
747	C	88	Confident	86.1	Confident	21 Å²	21	69.6 Å²	69.6	14%	0.142	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-61.8	178.6	-167.3	0	0	0	0	111.9	L729 Q730 R749 I764	L729-C747 HydrophobicContact CB-CB 4.1Å; L729-C747 HydrophobicContact CD2-CB 3.75Å; L729-C747 HydrophobicContact CG-CB 3.77Å; Q730-C747 PolarHBondContact O-N 2.88Å; C747-R749 PolarHBondContact O-N 2.87Å; C747-I764 HydrophobicContact CB-CD1 3.73Å; C747-I764 HydrophobicContact CB-CG1 4.31Å
748	N	88.8	Confident	86	Confident	98 Å²	98	69.3 Å²	69.3	52%	0.524	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	42.6	45.9	-173.2	-80.5	-21.7	0	0	0	114.3	H728 L729 Q730	H728-N748 VanDerWaalsContact CE1-C 3.48Å; L729-N748 VanDerWaalsContact O-CA 3.32Å; L729-N748 WeakPolarHBondContact O-CA 3.47Å; L729-N748 PolarHBondContact O-N 2.8Å; Q730-N748 WeakPolarHBondContact CA-OD1 3.26Å; Q730-N748 PolarHBondContact O-N 2.84Å
749	R	89.3	Confident	86.3	Confident	70 Å²	70	63.6 Å²	63.6	26%	0.264	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	161.9	174.2	-70.2	-168.2	76.5	-179	1.8	111.1	H728 L729 C747 D756 D757 E836	H728-R749 VanDerWaalsContact CD2-C 3.48Å; L729-R749 PolarHBondContact N-O 2.7Å; C747-R749 PolarHBondContact O-N 2.87Å; R749-D756 IonicContact CZ-OD1 2.82Å; R749-D756 IonicContact CZ-OD2 3.85Å; R749-D756 IonicContact NE-OD1 2.87Å; R749-D756 IonicContact NE-OD2 3.91Å; R749-D756 PolarHBondContact NE-OD2 2.88Å; R749-D756 VanDerWaalsContact NH2-CG 3.27Å; R749-D756 IonicContact NH2-OD1 3.4Å; R749-D756 PolarHBondContact NH2-OD1 3.39Å; R749-D756 IonicContact NH2-OD2 2.69Å; R749-D756 PolarHBondContact NH2-OD2 3.21Å; R749-D757 IonicContact CZ-OD2 2.82Å; R749-D757 IonicContact NH1-OD2 3.64Å; R749-D757 IonicContact NH2-OD2 3.35Å; R749-D757 PolarHBondContact NH2-OD2 3.47Å; R749-E836 IonicContact NH1-OE1 2.9Å; R749-E836 IonicContact NH1-OE2 3.18Å; R749-E836 PolarHBondContact NH1-OE2 3.15Å
750	W	88.7	Confident	86.7	Confident	40 Å²	40	63.5 Å²	63.5	15%	0.152	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	147.4	171.4	-69.2	97.4	0	0	0	111.6	I645 N726 W727 H728 E755 D756 R762	I645-W750 HydrophobicContact CG2-CH2 4.35Å; I645-W750 HydrophobicContact CG2-CZ2 4.09Å; N726-W750 HydrophobicContact CB-CE3 4.47Å; N726-W750 HydrophobicContact CB-CZ3 4.07Å; W727-W750 CarbonylContact O-C 3.6Å; W727-W750 WeakPolarHBondContact O-CA 3.26Å; W727-W750 VanDerWaalsContact O-CE3 3.28Å; H728-W750 HydrophobicContact CB-CD2 3.92Å; H728-W750 HydrophobicContact CB-CE3 3.79Å; H728-W750 HydrophobicContact CB-CH2 4.26Å; H728-W750 HydrophobicContact CB-CZ2 4.41Å; H728-W750 HydrophobicContact CB-CZ3 3.96Å; H728-W750 AromaticContact CD2-CD1 3.68Å; H728-W750 AromaticContact CD2-CD2 3.84Å; H728-W750 AromaticContact CD2-CE2 3.82Å; H728-W750 AromaticContact CD2-CG 3.75Å; H728-W750 AromaticContact CD2-NE1 3.74Å; W750-E755 HydrophobicContact CB-CB 3.86Å; W750-E755 HydrophobicContact CD2-CB 3.65Å; W750-E755 HydrophobicContact CD2-CG 3.77Å; W750-E755 HydrophobicContact CE3-CB 4.19Å; W750-E755 HydrophobicContact CE3-CG 3.99Å; W750-E755 HydrophobicContact CG-CB 3.48Å; W750-E755 VanDerWaalsContact CG-CB 3.48Å; W750-E755 HydrophobicContact CG-CG 4.17Å; W750-E755 HydrophobicContact CZ2-CG 4.29Å; W750-E755 HydrophobicContact CZ3-CG 4.38Å; W750-D756 HydrophobicContact CB-CB 3.87Å; W750-D756 HydrophobicContact CG-CB 4.32Å; W750-R762 PolarHBondContact O-NE 3.49Å; W750-R762 PolarHBondContact O-NH2 3.43Å
751	L	90.2	Very high	87.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	102.8	155.3	-65	88.1	0	0	0	105.7	I716 H718 W727 L729 S759 R762	I716-L751 HydrophobicContact CG2-CD2 4.2Å; H718-L751 PolarHBondContact NE2-O 2.66Å; W727-L751 HydrophobicContact CB-CB 4.35Å; W727-L751 HydrophobicContact CE3-CB 4.41Å; W727-L751 HydrophobicContact CE3-CD1 4.09Å; W727-L751 HydrophobicContact CE3-CD2 4.23Å; W727-L751 HydrophobicContact CE3-CG 4.47Å; W727-L751 HydrophobicContact CZ3-CD2 4.48Å; W727-L751 PolarHBondContact N-O 3.13Å; W727-L751 PolarHBondContact O-N 2.91Å; L729-L751 HydrophobicContact CB-CD1 3.84Å; L729-L751 HydrophobicContact CD2-CD1 4.47Å; L751-S759 WeakPolarHBondContact CA-O 3.32Å; L751-R762 HydrophobicContact CD1-CG 3.94Å; L751-R762 HydrophobicContact CD2-CB 4.49Å; L751-R762 HydrophobicContact CD2-CG 4.12Å; L751-R762 HydrophobicContact CG-CG 3.81Å
752	S	85.9	Confident	87.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.276	C	S	.	.			trans	-164.6	151.7	-171.5	173.5	0	0	0	0	109.8	N726 R754 E755 G758 S759	N726-S752 PolarHBondContact OD1-OG 2.89Å; S752-R754 VanDerWaalsContact C-N 3.34Å; S752-R754 PolarHBondContact OG-N 2.93Å; S752-E755 PolarHBondContact OG-N 2.8Å; S752-E755 VanDerWaalsContact OG-N 3.14Å; S752-G758 CarbonylContact O-C 3.6Å; S752-G758 WeakPolarHBondContact O-CA 3.05Å; S752-G758 VanDerWaalsContact O-O 3.12Å; S752-S759 PolarHBondContact N-O 2.8Å; S752-S759 VanDerWaalsContact N-O 3.12Å; S752-S759 CarbonylContact O-C 3.57Å; S752-S759 PolarHBondContact O-N 3.16Å
753	T	83.2	Confident	87.3	Confident	71 Å²	71	52 Å²	52	44%	0.436	26%	0.255	S	S	.	.	S	Bend	trans	-85.7	-3.5	169.3	46	0	0	0	0	113.7	I760	T753-I760 HydrophobicContact CG2-CG2 3.65Å
754	R	82.5	Confident	87.3	Confident	212 Å²	212	52 Å²	52	80%	0.8	26%	0.256	S	S	*	.	S	Bend	trans	-122	-30	-174	-62.4	-173.9	179.9	-166.1	0	114.2	S752	S752-R754 VanDerWaalsContact C-N 3.34Å; S752-R754 PolarHBondContact OG-N 2.93Å
755	E	84.4	Confident	87.2	Confident	84 Å²	84	50.3 Å²	50.3	39%	0.393	25%	0.25	S	C	.	.	S	Bend	trans	-98	161.1	179.6	-62.7	-68.1	158.3	0	0	112.2	W750 S752 D757 G758	W750-E755 HydrophobicContact CB-CB 3.86Å; W750-E755 HydrophobicContact CD2-CB 3.65Å; W750-E755 HydrophobicContact CD2-CG 3.77Å; W750-E755 HydrophobicContact CE3-CB 4.19Å; W750-E755 HydrophobicContact CE3-CG 3.99Å; W750-E755 HydrophobicContact CG-CB 3.48Å; W750-E755 VanDerWaalsContact CG-CB 3.48Å; W750-E755 HydrophobicContact CG-CG 4.17Å; W750-E755 HydrophobicContact CZ2-CG 4.29Å; W750-E755 HydrophobicContact CZ3-CG 4.38Å; S752-E755 PolarHBondContact OG-N 2.8Å; S752-E755 VanDerWaalsContact OG-N 3.14Å; E755-D757 PolarHBondContact O-N 3.3Å; E755-G758 PolarHBondContact O-N 2.93Å
756	D	83	Confident	87.1	Confident	84 Å²	84	50.2 Å²	50.2	45%	0.449	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-114.6	172.3	-162.5	-4.7	0	0	0	113.2	R749 W750 R762	R749-D756 IonicContact CZ-OD1 2.82Å; R749-D756 IonicContact CZ-OD2 3.85Å; R749-D756 IonicContact NE-OD1 2.87Å; R749-D756 IonicContact NE-OD2 3.91Å; R749-D756 PolarHBondContact NE-OD2 2.88Å; R749-D756 VanDerWaalsContact NH2-CG 3.27Å; R749-D756 IonicContact NH2-OD1 3.4Å; R749-D756 PolarHBondContact NH2-OD1 3.39Å; R749-D756 IonicContact NH2-OD2 2.69Å; R749-D756 PolarHBondContact NH2-OD2 3.21Å; W750-D756 HydrophobicContact CB-CB 3.87Å; W750-D756 HydrophobicContact CG-CB 4.32Å; D756-R762 IonicContact OD2-NH2 3.28Å
757	D	80.4	Confident	87.1	Confident	78 Å²	78	49.6 Å²	49.6	42%	0.417	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	5.1	178	59.3	20	0	0	0	113.9	R749 E755 S759 R762	R749-D757 IonicContact CZ-OD2 2.82Å; R749-D757 IonicContact NH1-OD2 3.64Å; R749-D757 IonicContact NH2-OD2 3.35Å; R749-D757 PolarHBondContact NH2-OD2 3.47Å; E755-D757 PolarHBondContact O-N 3.3Å; D757-S759 VanDerWaalsContact C-N 3.29Å; D757-S759 PolarHBondContact O-N 2.86Å; D757-S759 WeakPolarHBondContact OD1-CB 3.33Å; D757-S759 PolarHBondContact OD1-N 2.85Å; D757-R762 IonicContact OD1-CZ 2.9Å; D757-R762 IonicContact OD1-NH1 3.97Å; D757-R762 PolarHBondContact OD1-NH1 3.03Å; D757-R762 IonicContact OD1-NH2 2.94Å; D757-R762 PolarHBondContact OD1-NH2 3.23Å; D757-R762 IonicContact OD2-CZ 3.42Å; D757-R762 IonicContact OD2-NH1 3.65Å; D757-R762 PolarHBondContact OD2-NH1 2.74Å; D757-R762 IonicContact OD2-NH2 2.72Å; D757-R762 PolarHBondContact OD2-NH2 3.47Å
758	G	79.3	Confident	87	Confident	36 Å²	36	49.8 Å²	49.8	37%	0.371	25%	0.254	S	S	.	.	S	Bend	trans	76.9	6.9	-177.1	0	0	0	0	0	115.2	S752 E755	S752-G758 CarbonylContact O-C 3.6Å; S752-G758 WeakPolarHBondContact O-CA 3.05Å; S752-G758 VanDerWaalsContact O-O 3.12Å; E755-G758 PolarHBondContact O-N 2.93Å
759	S	83.1	Confident	86.4	Confident	33 Å²	33	47.5 Å²	47.5	23%	0.231	25%	0.245	C	C	.	.			trans	-81.2	129.8	175.8	-171.7	0	0	0	0	112.8	L751 S752 D757 L761	L751-S759 WeakPolarHBondContact CA-O 3.32Å; S752-S759 PolarHBondContact N-O 2.8Å; S752-S759 VanDerWaalsContact N-O 3.12Å; S752-S759 CarbonylContact O-C 3.57Å; S752-S759 PolarHBondContact O-N 3.16Å; D757-S759 VanDerWaalsContact C-N 3.29Å; D757-S759 PolarHBondContact O-N 2.86Å; D757-S759 WeakPolarHBondContact OD1-CB 3.33Å; D757-S759 PolarHBondContact OD1-N 2.85Å; S759-L761 VanDerWaalsContact C-N 3.32Å; S759-L761 PolarHBondContact OG-N 2.65Å; S759-L761 VanDerWaalsContact OG-N 3.17Å; S759-L761 PolarHBondContact OG-O 3.08Å
760	I	87.8	Confident	85.9	Confident	48 Å²	48	47.5 Å²	47.5	25%	0.246	27%	0.267	C	S	.	.	S	Bend	trans	-91.7	13.4	169	61.1	172.4	0	0	0	113.3	Q717 H718 N720 T753	Q717-I760 VanDerWaalsContact CA-O 3.29Å; Q717-I760 WeakPolarHBondContact CA-O 3.33Å; Q717-I760 WeakPolarHBondContact CB-O 3.2Å; H718-I760 PolarHBondContact CD2-O 3.34Å; H718-I760 PolarHBondContact N-O 3.4Å; H718-I760 VanDerWaalsContact NE2-CB 3.33Å; H718-I760 WeakPolarHBondContact NE2-CB 3.42Å; H718-I760 WeakPolarHBondContact NE2-CG2 3.48Å; N720-I760 HydrophobicContact CB-CD1 4.1Å; T753-I760 HydrophobicContact CG2-CG2 3.65Å
761	L	89.4	Confident	85.5	Confident	21 Å²	21	47.5 Å²	47.5	11%	0.11	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	132.1	-175.3	-173.9	165.7	0	0	0	110.6	R715 I716 Q717 S759 E763	R715-L761 HydrophobicContact CG-CD2 3.87Å; R715-L761 HydrophobicContact CG-CG 4.19Å; I716-L761 CarbonylContact O-C 3.58Å; I716-L761 WeakPolarHBondContact O-CA 3.39Å; Q717-L761 HydrophobicContact CB-CB 4.09Å; Q717-L761 HydrophobicContact CB-CD1 4.41Å; Q717-L761 HydrophobicContact CB-CG 4.07Å; S759-L761 VanDerWaalsContact C-N 3.32Å; S759-L761 PolarHBondContact OG-N 2.65Å; S759-L761 VanDerWaalsContact OG-N 3.17Å; S759-L761 PolarHBondContact OG-O 3.08Å; L761-E763 HydrophobicContact CD2-CG 4.49Å
762	R	89	Confident	84.8	Confident	9 Å²	9	54 Å²	54	3%	0.034	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	145	172.8	-62.8	-71	171.4	-147	-10.9	111.2	R715 I716 W750 L751 D756 D757 I764	R715-R762 WeakPolarHBondContact CA-O 3.44Å; I716-R762 HydrophobicContact CG2-CB 4.3Å; I716-R762 PolarHBondContact N-O 3.35Å; I716-R762 PolarHBondContact O-N 3.17Å; W750-R762 PolarHBondContact O-NE 3.49Å; W750-R762 PolarHBondContact O-NH2 3.43Å; L751-R762 HydrophobicContact CD1-CG 3.94Å; L751-R762 HydrophobicContact CD2-CB 4.49Å; L751-R762 HydrophobicContact CD2-CG 4.12Å; L751-R762 HydrophobicContact CG-CG 3.81Å; D756-R762 IonicContact OD2-NH2 3.28Å; D757-R762 IonicContact OD1-CZ 2.9Å; D757-R762 IonicContact OD1-NH1 3.97Å; D757-R762 PolarHBondContact OD1-NH1 3.03Å; D757-R762 IonicContact OD1-NH2 2.94Å; D757-R762 PolarHBondContact OD1-NH2 3.23Å; D757-R762 IonicContact OD2-CZ 3.42Å; D757-R762 IonicContact OD2-NH1 3.65Å; D757-R762 PolarHBondContact OD2-NH1 2.74Å; D757-R762 IonicContact OD2-NH2 2.72Å; D757-R762 PolarHBondContact OD2-NH2 3.47Å; R762-I764 HydrophobicContact CB-CG1 4.43Å
763	E	90.6	Very high	84.5	Confident	9 Å²	9	60.4 Å²	60.4	4%	0.042	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131.7	161	-67.2	-154.5	141.9	0	0	109.3	K713 L714 R715 L761 V838	K713-E763 IonicContact NZ-OE1 3.95Å; K713-E763 PolarHBondContact NZ-OE1 3.05Å; K713-E763 IonicContact NZ-OE2 3.73Å; K713-E763 PolarHBondContact NZ-OE2 3.43Å; L714-E763 CarbonylContact O-C 3.57Å; L714-E763 WeakPolarHBondContact O-CA 3.49Å; R715-E763 HydrophobicContact CB-CG 4.24Å; R715-E763 HydrophobicContact CG-CG 4.17Å; R715-E763 IonicContact CZ-OE1 3.2Å; R715-E763 IonicContact NE-OE1 3.27Å; R715-E763 PolarHBondContact NE-OE1 2.86Å; R715-E763 IonicContact NH2-OE1 2.89Å; R715-E763 PolarHBondContact NH2-OE1 3.16Å; L761-E763 HydrophobicContact CD2-CG 4.49Å; E763-V838 HydrophobicContact CB-CB 4.44Å; E763-V838 HydrophobicContact CB-CG2 3.82Å; E763-V838 PolarHBondContact OE2-N 3.44Å
764	I	92.3	Very high	84.4	Confident	5 Å²	5	60 Å²	60	3%	0.026	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.8	-172.8	-52.8	163.1	0	0	0	107.9	K713 L714 I716 L729 F745 Y746 C747 R762	K713-I764 CarbonylContact C-O 3.59Å; K713-I764 VanDerWaalsContact CA-O 3.32Å; K713-I764 WeakPolarHBondContact CA-O 3.41Å; K713-I764 WeakPolarHBondContact CB-O 3.32Å; L714-I764 HydrophobicContact CD2-CD1 4.32Å; L714-I764 PolarHBondContact N-O 2.93Å; L714-I764 PolarHBondContact O-N 2.69Å; I716-I764 HydrophobicContact CG2-CD1 4.12Å; L729-I764 HydrophobicContact CD2-CD1 4.04Å; F745-I764 HydrophobicContact CB-CB 4.24Å; F745-I764 HydrophobicContact CB-CG2 3.67Å; F745-I764 HydrophobicContact CD1-CB 4.3Å; F745-I764 HydrophobicContact CD1-CG2 4.17Å; F745-I764 HydrophobicContact CG-CG2 4.45Å; Y746-I764 WeakPolarHBondContact O-CG2 3.39Å; C747-I764 HydrophobicContact CB-CD1 3.73Å; C747-I764 HydrophobicContact CB-CG1 4.31Å; R762-I764 HydrophobicContact CB-CG1 4.43Å
765	P	92.2	Very high	84.5	Confident	28 Å²	28	51.3 Å²	51.3	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	143.2	177	31.2	-34.2	0	0	0	111	P774 L775 V838	P765-P774 HydrophobicContact CB-CB 4.19Å; P765-P774 HydrophobicContact CG-CB 4.45Å; P765-L775 HydrophobicContact CB-CB 4.29Å; P765-L775 WeakPolarHBondContact CB-O 3.32Å; P765-L775 WeakPolarHBondContact CG-O 3.21Å; P765-V838 HydrophobicContact CB-CG1 4.09Å; P765-V838 HydrophobicContact CB-CG2 4.28Å
766	A	91.2	Very high	84.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	31%	0.311	C	S	.	.			trans	-74.9	148.8	178.2	0	0	0	0	0	112.2	P711 C712 F745 I771	P711-A766 WeakPolarHBondContact O-CB 3.35Å; C712-A766 WeakPolarHBondContact O-CB 3.26Å; C712-A766 PolarHBondContact O-N 3.18Å; F745-A766 HydrophobicContact CD1-CB 4.22Å; F745-A766 VanDerWaalsContact CE1-CA 3.44Å; F745-A766 HydrophobicContact CE1-CB 3.4Å; F745-A766 HydrophobicContact CZ-CB 3.67Å; A766-I771 HydrophobicContact CB-CD1 3.75Å
767	K	89.1	Confident	84.8	Confident	94 Å²	94	49.5 Å²	49.5	41%	0.409	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-134.3	124.2	170.5	179.9	179	165.8	-118.3	0	108.4	E744 Y746 P774	E744-K767 HydrophobicContact CB-CB 4.37Å; E744-K767 PolarHBondContact N-O 3.4Å; E744-K767 PolarHBondContact O-N 3.26Å; E744-K767 IonicContact OE2-NZ 3.97Å; E744-K767 PolarHBondContact OE2-NZ 3Å; Y746-K767 HydrophobicContact CE2-CD 4.18Å; K767-P774 HydrophobicContact CB-CG 4.21Å; K767-P774 HydrophobicContact CG-CG 4.38Å
768	G	86.6	Confident	85.1	Confident	25 Å²	25	48.2 Å²	48.2	26%	0.258	30%	0.297	S	S	.	.	S	Bend	trans	165	-169.8	-173.5	0	0	0	0	0	113.9	G770 I771	G768-G770 PolarHBondContact O-N 3.07Å; G768-I771 PolarHBondContact O-N 3.01Å
769	P	76.6	Confident	85.7	Confident	51 Å²	51	49.2 Å²	49.2	33%	0.331	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	128.7	-177.9	-29.4	36.9	0	0	0	113.5	E741 Q742 Y743 I771	E741-P769 HydrophobicContact CB-CG 4.07Å; E741-P769 HydrophobicContact CG-CB 4.22Å; E741-P769 HydrophobicContact CG-CG 4.09Å; Q742-P769 WeakPolarHBondContact O-CD 3.42Å; Y743-P769 VanDerWaalsContact CE1-O 3.26Å; Y743-P769 WeakPolarHBondContact CE1-O 3.07Å; Y743-P769 PolarHBondContact OH-O 2.84Å; P769-I771 VanDerWaalsContact C-N 3.3Å; P769-I771 PolarHBondContact O-N 3Å
770	G	77.8	Confident	86	Confident	70 Å²	70	47.7 Å²	47.7	72%	0.722	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-7.5	-178	0	0	0	0	0	115.8	G768	G768-G770 PolarHBondContact O-N 3.07Å
771	I	81.9	Confident	86.2	Confident	40 Å²	40	47 Å²	47	21%	0.205	28%	0.277	C	S	.	.			trans	-106	104.5	177.9	-62.4	-177.7	0	0	0	109.9	I710 P711 A766 G768 P769	I710-I771 HydrophobicContact CG2-CD1 4.13Å; I710-I771 HydrophobicContact CG2-CG1 4.03Å; P711-I771 WeakPolarHBondContact O-CD1 3.42Å; A766-I771 HydrophobicContact CB-CD1 3.75Å; G768-I771 PolarHBondContact O-N 3.01Å; P769-I771 VanDerWaalsContact C-N 3.3Å; P769-I771 PolarHBondContact O-N 3Å
772	T	75.1	Confident	86.4	Confident	137 Å²	137	46 Å²	46	84%	0.84	27%	0.272	S	S	*	.	S	Bend	trans	-77.9	-41.4	178.1	49.8	0	0	0	0	112.8
773	N	78.4	Confident	86.6	Confident	134 Å²	134	47.5 Å²	47.5	72%	0.717	28%	0.28	S	S	*	.	S	Bend	trans	-126.2	121.8	173.5	-71.8	1.7	0	0	0	108.6
774	P	82.2	Confident	86.7	Confident	61 Å²	61	47 Å²	47	40%	0.396	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-56	150.8	167.8	-25.4	35.7	0	0	0	111.7	P765 K767	P765-P774 HydrophobicContact CB-CB 4.19Å; P765-P774 HydrophobicContact CG-CB 4.45Å; K767-P774 HydrophobicContact CB-CG 4.21Å; K767-P774 HydrophobicContact CG-CG 4.38Å
775	L	84.2	Confident	86.7	Confident	31 Å²	31	49.6 Å²	49.6	16%	0.162	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-69.3	133.7	177.1	-67.2	175	0	0	0	110.4	C712 P765 K806 V838	C712-L775 HydrophobicContact CB-CD1 4.47Å; P765-L775 HydrophobicContact CB-CB 4.29Å; P765-L775 WeakPolarHBondContact CB-O 3.32Å; P765-L775 WeakPolarHBondContact CG-O 3.21Å; L775-K806 HydrophobicContact CD1-CD 4.21Å; L775-K806 HydrophobicContact CD2-CD 3.94Å; L775-V838 HydrophobicContact CB-CG1 3.42Å; L775-V838 VanDerWaalsContact CB-CG1 3.42Å; L775-V838 HydrophobicContact CD1-CG1 3.99Å; L775-V838 HydrophobicContact CG-CG1 4.36Å
776	P	85.5	Confident	86.6	Confident	60 Å²	60	48.4 Å²	48.4	39%	0.39	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-70.6	150.4	176.8	29.1	-34	0	0	0	111.5	Y778 Q839	P776-Y778 HydrophobicContact CB-CD1 4.28Å; P776-Y778 HydrophobicContact CB-CE1 4.1Å; P776-Y778 HydrophobicContact CG-CD1 4.18Å; P776-Y778 HydrophobicContact CG-CE1 3.69Å; P776-Q839 HydrophobicContact CG-CB 4.2Å; P776-Q839 WeakPolarHBondContact O-CB 3.49Å; P776-Q839 PolarHBondContact O-N 3.03Å
777	L	87.3	Confident	86.2	Confident	70 Å²	70	48.7 Å²	48.7	37%	0.366	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	132.5	162.3	-76.3	150.6	0	0	0	108.9	E836 V838	L777-E836 HydrophobicContact CD2-CG 3.98Å; L777-V838 HydrophobicContact CD2-CG2 3.68Å; L777-V838 HydrophobicContact CG-CG2 4.1Å
778	Y	88.7	Confident	85.9	Confident	51 Å²	51	49.5 Å²	49.5	20%	0.2	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151	178.8	-84.2	4.7	0	0	0	110.2	P776 A837 Q839 I868 E870	P776-Y778 HydrophobicContact CB-CD1 4.28Å; P776-Y778 HydrophobicContact CB-CE1 4.1Å; P776-Y778 HydrophobicContact CG-CD1 4.18Å; P776-Y778 HydrophobicContact CG-CE1 3.69Å; Y778-A837 PolarHBondContact N-O 3.04Å; Y778-A837 PolarHBondContact O-N 2.87Å; Y778-Q839 HydrophobicContact CD2-CB 4.3Å; Y778-Q839 HydrophobicContact CD2-CG 3.91Å; Y778-Q839 HydrophobicContact CE2-CB 4.43Å; Y778-Q839 HydrophobicContact CE2-CG 3.7Å; Y778-Q839 HydrophobicContact CG-CB 4.5Å; Y778-Q839 VanDerWaalsContact CZ-NE2 3.29Å; Y778-Q839 PolarHBondContact OH-NE2 3.14Å; Y778-I868 HydrophobicContact CD2-CD1 4.45Å; Y778-I868 HydrophobicContact CD2-CG2 3.69Å; Y778-I868 HydrophobicContact CE2-CG2 4.1Å; Y778-I868 HydrophobicContact CG-CG2 4.23Å; Y778-E870 WeakPolarHBondContact CA-OE2 3.44Å; Y778-E870 HydrophobicContact CD1-CB 4.15Å; Y778-E870 HydrophobicContact CD1-CG 3.86Å; Y778-E870 HydrophobicContact CE1-CB 4.03Å; Y778-E870 HydrophobicContact CE1-CG 4.1Å; Y778-E870 HydrophobicContact CG-CG 4.5Å
779	H	90.5	Very high	85.4	Confident	56 Å²	56	53 Å²	53	26%	0.259	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109.8	174.7	-57.4	84.7	0	0	0	109.6	V834 K869 E870	H779-V834 HydrophobicContact CB-CG1 3.98Å; H779-K869 HydrophobicContact CB-CB 3.79Å; H779-K869 HydrophobicContact CB-CD 3.71Å; H779-K869 HydrophobicContact CB-CG 4.44Å; H779-K869 WeakPolarHBondContact O-CB 3.4Å; H779-K869 PolarHBondContact O-N 2.97Å; H779-E870 IonicContact CE1-OE1 3.82Å; H779-E870 IonicContact CG-OE1 2.76Å; H779-E870 PolarHBondContact N-OE1 3.03Å; H779-E870 PolarHBondContact N-OE2 3.36Å; H779-E870 IonicContact ND1-OE1 3.09Å; H779-E870 PolarHBondContact ND1-OE1 3.19Å
780	Y	90.4	Very high	85.4	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	111.6	176.4	-61.6	-91.7	0	0	0	108.9	I802 V834 I835 A837 L840 I843 L866 I868	Y780-I802 HydrophobicContact CD1-CD1 4.42Å; Y780-I802 HydrophobicContact CG-CD1 4.03Å; Y780-V834 WeakPolarHBondContact O-CA 3.28Å; Y780-I835 PolarHBondContact N-O 3.16Å; Y780-I835 PolarHBondContact O-N 3.22Å; Y780-A837 HydrophobicContact CD2-CB 4.18Å; Y780-A837 HydrophobicContact CE2-CB 3.97Å; Y780-L840 HydrophobicContact CE1-CD1 4.35Å; Y780-L840 HydrophobicContact CE2-CD1 4.32Å; Y780-L840 HydrophobicContact CE2-CG 4.34Å; Y780-L840 PolarHBondContact OH-N 2.92Å; Y780-I843 HydrophobicContact CE1-CD1 4.01Å; Y780-I843 HydrophobicContact CE1-CG1 4.48Å; Y780-L866 HydrophobicContact CD1-CD2 4.34Å; Y780-I868 HydrophobicContact CD1-CD1 4.48Å; Y780-I868 HydrophobicContact CD1-CG1 3.95Å; Y780-I868 HydrophobicContact CE1-CD1 3.92Å; Y780-I868 HydrophobicContact CE1-CG1 3.87Å
781	I	91.5	Very high	85.5	Confident	34 Å²	34	58.5 Å²	58.5	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.2	174.4	-52.7	174.8	0	0	0	107.5	E832 F833 V834 L866 T867 K869	I781-E832 VanDerWaalsContact CG2-CD 3.47Å; I781-E832 HydrophobicContact CG2-CG 3.6Å; I781-F833 CarbonylContact C-O 3.11Å; I781-F833 WeakPolarHBondContact CA-O 3.15Å; I781-V834 HydrophobicContact CG1-CG2 4.24Å; I781-L866 CarbonylContact O-C 3.6Å; I781-L866 WeakPolarHBondContact O-CA 3.45Å; I781-T867 PolarHBondContact N-O 3.4Å; I781-T867 PolarHBondContact O-N 2.66Å; I781-K869 HydrophobicContact CD1-CB 4.13Å; I781-K869 HydrophobicContact CD1-CG 4.38Å; I781-K869 HydrophobicContact CG1-CB 4.33Å
782	I	93.4	Very high	85.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.9	-178.4	-55.1	-60.9	0	0	0	108.3	I784 I800 I802 E832 F833 I835 I864 L866	I782-I784 HydrophobicContact CG2-CD1 4.05Å; I782-I784 HydrophobicContact CG2-CG1 3.74Å; I782-I800 HydrophobicContact CG2-CD1 3.85Å; I782-I802 HydrophobicContact CD1-CD1 3.92Å; I782-I802 HydrophobicContact CG1-CD1 4.48Å; I782-E832 CarbonylContact O-C 3.49Å; I782-E832 WeakPolarHBondContact O-CA 3.19Å; I782-F833 PolarHBondContact N-O 3.24Å; I782-F833 PolarHBondContact O-N 2.84Å; I782-I835 HydrophobicContact CG1-CD1 4.09Å; I782-I864 HydrophobicContact CG2-CG2 3.65Å; I782-L866 HydrophobicContact CD1-CB 3.98Å; I782-L866 HydrophobicContact CD1-CD1 3.64Å; I782-L866 HydrophobicContact CD1-CG 3.69Å
783	Q	93.3	Very high	86.1	Confident	40 Å²	40	51.2 Å²	51.2	19%	0.187	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.4	171.8	-67.8	174.3	-21.6	0	0	108.9	F785 M830 D831 E832 I864 V865	Q783-F785 HydrophobicContact CB-CE2 4.02Å; Q783-M830 HydrophobicContact CB-CG 4.45Å; Q783-M830 HydrophobicContact CB-SD 3.88Å; Q783-M830 HydrophobicContact CG-SD 3.93Å; Q783-D831 CarbonylContact C-O 3.53Å; Q783-D831 WeakPolarHBondContact CA-O 3.33Å; Q783-E832 HydrophobicContact CG-CB 4.18Å; Q783-E832 HydrophobicContact CG-CG 3.9Å; Q783-E832 WeakPolarHBondContact CG-OE2 3.28Å; Q783-E832 PolarHBondContact NE2-OE2 3.15Å; Q783-I864 CarbonylContact O-C 3.51Å; Q783-I864 WeakPolarHBondContact O-CA 3.21Å; Q783-V865 HydrophobicContact CB-CB 4.16Å; Q783-V865 PolarHBondContact N-O 2.8Å; Q783-V865 PolarHBondContact O-N 2.95Å
784	I	93.6	Very high	86.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.2	-176.6	-56.7	-172	0	0	0	108.6	I782 L814 F825 M830 D831 F833 I848 W859 L861 I864	I782-I784 HydrophobicContact CG2-CD1 4.05Å; I782-I784 HydrophobicContact CG2-CG1 3.74Å; I784-L814 HydrophobicContact CD1-CD1 3.39Å; I784-F825 HydrophobicContact CB-CE1 4.25Å; I784-F825 HydrophobicContact CD1-CE1 4.07Å; I784-F825 HydrophobicContact CG2-CD1 4.29Å; I784-F825 HydrophobicContact CG2-CE1 4.12Å; I784-M830 CarbonylContact O-C 3.53Å; I784-M830 VanDerWaalsContact O-CA 3.28Å; I784-M830 WeakPolarHBondContact O-CA 3.28Å; I784-D831 PolarHBondContact N-O 3.35Å; I784-D831 PolarHBondContact O-N 3.07Å; I784-F833 HydrophobicContact CD1-CD2 4.24Å; I784-F833 HydrophobicContact CD1-CE2 4.23Å; I784-F833 HydrophobicContact CG1-CD2 4.46Å; I784-I848 HydrophobicContact CD1-CD1 3.95Å; I784-W859 HydrophobicContact CG2-CH2 3.79Å; I784-W859 HydrophobicContact CG2-CZ2 3.54Å; I784-L861 HydrophobicContact CG2-CD1 3.77Å; I784-I864 HydrophobicContact CG1-CG1 4.39Å; I784-I864 HydrophobicContact CG1-CG2 4.37Å
785	F	91.7	Very high	86.7	Confident	58 Å²	58	48.3 Å²	48.3	25%	0.254	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110	-178.6	-65.5	-104	0	0	0	110.3	Q783 Q829 M830 A862 K863 V865	Q783-F785 HydrophobicContact CB-CE2 4.02Å; F785-Q829 WeakPolarHBondContact CA-O 3.13Å; F785-M830 HydrophobicContact CD1-CB 3.9Å; F785-M830 HydrophobicContact CD1-CG 3.79Å; F785-M830 HydrophobicContact CD2-CG 4.11Å; F785-M830 HydrophobicContact CE1-CB 3.91Å; F785-M830 HydrophobicContact CE1-CG 3.51Å; F785-M830 HydrophobicContact CE2-CG 3.84Å; F785-M830 HydrophobicContact CG-CB 4.43Å; F785-M830 HydrophobicContact CG-CG 4.08Å; F785-M830 HydrophobicContact CZ-CB 4.43Å; F785-M830 HydrophobicContact CZ-CG 3.54Å; F785-A862 HydrophobicContact CB-CB 4.45Å; F785-A862 WeakPolarHBondContact O-CB 3.5Å; F785-A862 PolarHBondContact O-N 2.96Å; F785-K863 HydrophobicContact CB-CG 4Å; F785-K863 HydrophobicContact CD2-CG 3.89Å; F785-K863 HydrophobicContact CG-CG 4.08Å; F785-K863 PolarHBondContact N-O 2.9Å; F785-K863 PolarHBondContact O-N 2.93Å; F785-V865 HydrophobicContact CE2-CB 4.26Å; F785-V865 HydrophobicContact CE2-CG2 3.88Å
786	T	90.6	Very high	86.7	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.025	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	138.7	167.6	-62.4	0	0	0	0	109.1	S792 F825 Q826 N828 Q829 W859	T786-S792 VanDerWaalsContact CG2-O 3.31Å; T786-S792 WeakPolarHBondContact CG2-O 3.46Å; T786-F825 WeakPolarHBondContact CG2-O 3.48Å; T786-F825 PolarHBondContact OG1-O 2.76Å; T786-Q826 WeakPolarHBondContact CB-O 3.49Å; T786-Q826 VanDerWaalsContact CG2-O 3.29Å; T786-Q826 WeakPolarHBondContact CG2-O 3.05Å; T786-N828 WeakPolarHBondContact O-CA 3.49Å; T786-Q829 PolarHBondContact N-O 2.83Å; T786-W859 PolarHBondContact OG1-NE1 3.49Å
787	G	81.2	Confident	86.7	Confident	6 Å²	6	48.8 Å²	48.8	6%	0.062	26%	0.26	C	S	.	.			trans	-76.4	171.7	-178.2	0	0	0	0	0	114.3	K789 S792 N828 Y860	G787-K789 PolarHBondContact O-N 2.98Å; G787-S792 VanDerWaalsContact O-CB 3.3Å; G787-S792 WeakPolarHBondContact O-CB 3.48Å; G787-S792 PolarHBondContact O-OG 3.06Å; G787-N828 PolarHBondContact O-N 3.01Å; G787-N828 VanDerWaalsContact O-N 3.12Å; G787-Y860 PolarHBondContact N-O 3.12Å
788	N	83.5	Confident	86.8	Confident	110 Å²	110	45.6 Å²	45.6	59%	0.588	24%	0.243	S	C	*	.	S	Bend	trans	-99.9	50.4	177.5	-164	16	0	0	0	112.5	Q827 N828	N788-Q827 PolarHBondContact OD1-NE2 3.01Å; N788-N828 HydrophobicContact CB-CB 4.07Å
789	K	76.7	Confident	86.9	Confident	98 Å²	98	44 Å²	44	43%	0.426	24%	0.237	S	C	.	.	S	Bend	trans	-90.8	148.9	163.9	-73.4	-75.4	-172.3	169.9	0	108.1	G787 N791 S792 Q827 Y860 W883	G787-K789 PolarHBondContact O-N 2.98Å; K789-N791 PolarHBondContact O-N 2.75Å; K789-S792 WeakPolarHBondContact O-CB 3.38Å; K789-S792 PolarHBondContact O-N 2.98Å; K789-S792 PolarHBondContact O-OG 2.98Å; K789-Q827 PolarHBondContact O-NE2 2.88Å; K789-Q827 PolarHBondContact O-OE1 3.08Å; K789-Y860 HydrophobicContact CB-CG 4.33Å; K789-Y860 HydrophobicContact CG-CD1 4.06Å; K789-Y860 HydrophobicContact CG-CD2 3.89Å; K789-Y860 HydrophobicContact CG-CE1 4.05Å; K789-Y860 HydrophobicContact CG-CE2 3.86Å; K789-Y860 HydrophobicContact CG-CG 3.96Å; K789-W883 HydrophobicContact CB-CZ2 4.34Å
790	P	75.7	Confident	86.9	Confident	97 Å²	97	41.3 Å²	41.3	63%	0.63	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	136	169.3	-22.8	33.5	0	0	0	110.3	S792	P790-S792 PolarHBondContact O-N 3.01Å
791	N	80.8	Confident	86.9	Confident	141 Å²	141	42 Å²	42	75%	0.754	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	32.1	-178.9	-53.9	-7.7	0	0	0	113.9	K789 G793 W883	K789-N791 PolarHBondContact O-N 2.75Å; N791-G793 VanDerWaalsContact C-N 3.33Å; N791-G793 PolarHBondContact O-N 2.89Å; N791-W883 WeakPolarHBondContact O-CH2 3.38Å; N791-W883 WeakPolarHBondContact O-CZ3 3.39Å
792	S	83.9	Confident	86.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.			trans	-75	-15.8	-179.1	55.3	0	0	0	0	115.7	T786 G787 K789 P790 Q827 W859 Y860	T786-S792 VanDerWaalsContact CG2-O 3.31Å; T786-S792 WeakPolarHBondContact CG2-O 3.46Å; G787-S792 VanDerWaalsContact O-CB 3.3Å; G787-S792 WeakPolarHBondContact O-CB 3.48Å; G787-S792 PolarHBondContact O-OG 3.06Å; K789-S792 WeakPolarHBondContact O-CB 3.38Å; K789-S792 PolarHBondContact O-N 2.98Å; K789-S792 PolarHBondContact O-OG 2.98Å; P790-S792 PolarHBondContact O-N 3.01Å; S792-Q827 VanDerWaalsContact OG-CA 3.29Å; S792-Q827 WeakPolarHBondContact OG-CA 3.43Å; S792-Q827 VanDerWaalsContact OG-CB 3.27Å; S792-Q827 WeakPolarHBondContact OG-CB 3.46Å; S792-Q827 VanDerWaalsContact OG-CG 3.27Å; S792-Q827 WeakPolarHBondContact OG-CG 3.2Å; S792-W859 WeakPolarHBondContact O-CA 3.34Å; S792-Y860 PolarHBondContact O-N 2.99Å
793	G	85.7	Confident	86.5	Confident	23 Å²	23	42.4 Å²	42.4	24%	0.237	23%	0.229	C	C	.	.			trans	-87.2	153.7	-176.5	0	0	0	0	0	113.2	N791 F825	N791-G793 VanDerWaalsContact C-N 3.33Å; N791-G793 PolarHBondContact O-N 2.89Å; G793-F825 WeakPolarHBondContact CA-O 3.35Å
794	T	88	Confident	86	Confident	6 Å²	6	41 Å²	41	4%	0.037	23%	0.225	C	C	.	.			trans	-132.5	153.9	-178.1	-169	0	0	0	0	112.5	A796 I798 F825 Y857 W859	T794-A796 PolarHBondContact OG1-N 2.94Å; T794-A796 VanDerWaalsContact OG1-N 3.15Å; T794-I798 HydrophobicContact CG2-CD1 3.95Å; T794-I798 HydrophobicContact CG2-CG1 4.46Å; T794-F825 HydrophobicContact CG2-CB 4.22Å; T794-Y857 WeakPolarHBondContact CB-O 3.31Å; T794-Y857 PolarHBondContact OG1-O 2.72Å; T794-W859 HydrophobicContact CG2-CB 3.68Å; T794-W859 HydrophobicContact CG2-CD2 4.35Å; T794-W859 HydrophobicContact CG2-CG 3.63Å
795	N	85.2	Confident	85	Confident	128 Å²	128	47.1 Å²	47.1	68%	0.684	25%	0.253	S	S	*	.			trans	-107.8	2.9	170.8	58.9	-9.8	0	0	0	112.7	Y857	N795-Y857 WeakPolarHBondContact OD1-CD1 3.25Å; N795-Y857 WeakPolarHBondContact OD1-CE1 3.29Å
796	A	84.2	Confident	84.4	Confident	8 Å²	8	48.3 Å²	48.3	7%	0.066	26%	0.258	C	S	.	.	S	Bend	trans	-74.2	146.2	175.8	0	0	0	0	0	111.9	T794 I798 H850 E852 Y857	T794-A796 PolarHBondContact OG1-N 2.94Å; T794-A796 VanDerWaalsContact OG1-N 3.15Å; A796-I798 PolarHBondContact O-N 2.9Å; A796-H850 HydrophobicContact CB-CB 3.97Å; A796-E852 HydrophobicContact CB-CB 3.95Å; A796-E852 HydrophobicContact CB-CG 4.14Å; A796-Y857 HydrophobicContact CB-CD1 4.29Å
797	N	84.5	Confident	83.9	Confident	93 Å²	93	49.1 Å²	49.1	50%	0.497	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-65.9	124	176.7	-72.2	-55.2	0	0	0	111	W813 H850 E851	N797-W813 HydrophobicContact CB-CE3 4.02Å; N797-W813 HydrophobicContact CB-CZ3 3.97Å; N797-H850 VanDerWaalsContact O-CA 3.28Å; N797-H850 WeakPolarHBondContact O-CA 3.44Å; N797-H850 WeakPolarHBondContact O-CB 3.46Å; N797-E851 HydrophobicContact CB-CG 4.33Å; N797-E851 WeakPolarHBondContact CB-OE1 3.48Å; N797-E851 PolarHBondContact ND2-OE1 2.77Å; N797-E851 PolarHBondContact O-N 3.48Å
798	I	89.1	Confident	84.2	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	137.4	179.2	-54.6	-164.7	0	0	0	110.5	T794 A796 L814 F825 I848 G849 H850 W859	T794-I798 HydrophobicContact CG2-CD1 3.95Å; T794-I798 HydrophobicContact CG2-CG1 4.46Å; A796-I798 PolarHBondContact O-N 2.9Å; I798-L814 HydrophobicContact CG2-CD1 4.09Å; I798-L814 PolarHBondContact O-N 2.83Å; I798-F825 HydrophobicContact CB-CE2 3.88Å; I798-F825 HydrophobicContact CB-CZ 4.02Å; I798-F825 HydrophobicContact CD1-CB 4.33Å; I798-F825 HydrophobicContact CD1-CD1 3.9Å; I798-F825 HydrophobicContact CD1-CD2 3.48Å; I798-F825 VanDerWaalsContact CD1-CD2 3.48Å; I798-F825 HydrophobicContact CD1-CE1 4.02Å; I798-F825 HydrophobicContact CD1-CE2 3.63Å; I798-F825 HydrophobicContact CD1-CG 3.63Å; I798-F825 HydrophobicContact CD1-CZ 3.89Å; I798-F825 HydrophobicContact CG1-CD2 3.87Å; I798-F825 HydrophobicContact CG1-CE2 3.69Å; I798-F825 HydrophobicContact CG1-CZ 4.17Å; I798-I848 HydrophobicContact CG2-CD1 4.01Å; I798-I848 HydrophobicContact CG2-CG1 3.88Å; I798-G849 CarbonylContact C-O 3.49Å; I798-G849 WeakPolarHBondContact CA-O 3.14Å; I798-G849 WeakPolarHBondContact CG2-O 3.32Å; I798-H850 HydrophobicContact CG1-CB 4.43Å; I798-W859 HydrophobicContact CD1-CD2 3.79Å; I798-W859 HydrophobicContact CD1-CE3 3.83Å; I798-W859 HydrophobicContact CD1-CG 4.49Å; I798-W859 HydrophobicContact CD1-CH2 3.71Å; I798-W859 HydrophobicContact CD1-CZ2 3.68Å; I798-W859 HydrophobicContact CD1-CZ3 3.8Å; I798-W859 HydrophobicContact CG2-CH2 4.36Å; I798-W859 HydrophobicContact CG2-CZ3 4.34Å
799	F	90.4	Very high	84.4	Confident	17 Å²	17	43.9 Å²	43.9	8%	0.075	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	150.2	170.3	72.8	-88.8	0	0	0	111.4	E811 R812 W813 I848 G849 V894	F799-E811 HydrophobicContact CD2-CB 4.18Å; F799-E811 HydrophobicContact CD2-CG 3.79Å; F799-E811 HydrophobicContact CE2-CG 4.09Å; F799-R812 CarbonylContact C-O 3.59Å; F799-R812 VanDerWaalsContact CA-O 3.3Å; F799-R812 WeakPolarHBondContact CA-O 3.39Å; F799-W813 HydrophobicContact CB-CD2 3.88Å; F799-W813 HydrophobicContact CB-CE3 3.78Å; F799-W813 HydrophobicContact CB-CG 4.5Å; F799-W813 HydrophobicContact CB-CH2 4.26Å; F799-W813 HydrophobicContact CB-CZ2 4.32Å; F799-W813 HydrophobicContact CB-CZ3 3.99Å; F799-W813 AromaticContact CD1-CH2 3.95Å; F799-W813 HydrophobicContact CD1-CH2 3.95Å; F799-W813 HydrophobicContact CD1-CZ3 4.04Å; F799-W813 HydrophobicContact CG-CH2 4.42Å; F799-W813 HydrophobicContact CG-CZ3 4.47Å; F799-I848 WeakPolarHBondContact O-CA 3.42Å; F799-I848 WeakPolarHBondContact O-CG1 3.16Å; F799-G849 VanDerWaalsContact CD1-O 3.23Å; F799-G849 WeakPolarHBondContact CD1-O 3.38Å; F799-G849 VanDerWaalsContact CE1-C 3.47Å; F799-G849 PolarHBondContact N-O 2.93Å; F799-G849 PolarHBondContact O-N 3.05Å; F799-V894 HydrophobicContact CE1-CG2 4.08Å; F799-V894 HydrophobicContact CE2-CG1 4.38Å; F799-V894 HydrophobicContact CZ-CB 4.44Å; F799-V894 HydrophobicContact CZ-CG1 3.79Å; F799-V894 HydrophobicContact CZ-CG2 3.77Å
800	I	91.6	Very high	84.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149	173.3	-164.6	175.4	0	0	0	111.1	I782 E811 R812 L814 I835 I846 C847 I848 I864	I782-I800 HydrophobicContact CG2-CD1 3.85Å; I800-E811 CarbonylContact O-C 3.56Å; I800-R812 HydrophobicContact CG2-CB 4.27Å; I800-R812 PolarHBondContact N-O 2.83Å; I800-R812 PolarHBondContact O-N 3Å; I800-L814 HydrophobicContact CB-CD1 4.35Å; I800-L814 HydrophobicContact CG2-CD1 4.12Å; I800-L814 HydrophobicContact CG2-CD2 3.85Å; I800-L814 HydrophobicContact CG2-CG 4.24Å; I800-I835 HydrophobicContact CG2-CD1 3.42Å; I800-I835 VanDerWaalsContact CG2-CD1 3.42Å; I800-I846 HydrophobicContact CD1-CB 4.44Å; I800-I846 HydrophobicContact CD1-CD1 4.23Å; I800-I846 HydrophobicContact CD1-CG2 4.03Å; I800-I846 HydrophobicContact CG1-CB 4.38Å; I800-I846 HydrophobicContact CG1-CG2 4.09Å; I800-C847 CarbonylContact C-O 3.59Å; I800-C847 WeakPolarHBondContact CA-O 3.18Å; I800-C847 WeakPolarHBondContact CG1-O 3.38Å; I800-I848 HydrophobicContact CB-CG1 4.37Å; I800-I848 HydrophobicContact CD1-CD1 4.43Å; I800-I848 HydrophobicContact CG1-CB 4.28Å; I800-I848 HydrophobicContact CG1-CG1 4.41Å; I800-I864 HydrophobicContact CD1-CD1 4.27Å
801	N	90.9	Very high	85.1	Confident	17 Å²	17	39.9 Å²	39.9	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	121.5	174.2	-177.1	-2.5	0	0	0	109.8	F803 G810 E811 I846 C847	N801-F803 HydrophobicContact CB-CE2 4Å; N801-F803 WeakPolarHBondContact O-CD2 3.22Å; N801-F803 WeakPolarHBondContact O-CE2 3.35Å; N801-G810 WeakPolarHBondContact CA-O 3.4Å; N801-G810 WeakPolarHBondContact OD1-CA 3.23Å; N801-G810 PolarHBondContact OD1-N 3Å; N801-G810 PolarHBondContact OD1-O 2.76Å; N801-E811 HydrophobicContact CB-CG 4.27Å; N801-I846 CarbonylContact O-C 3.2Å; N801-I846 VanDerWaalsContact O-CA 3.27Å; N801-I846 WeakPolarHBondContact O-CA 3.37Å; N801-C847 HydrophobicContact CB-CB 4.38Å; N801-C847 PolarHBondContact N-O 3.29Å; N801-C847 PolarHBondContact O-N 3.16Å
802	I	90.3	Very high	85.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.7	-174.6	-48.2	166.7	0	0	0	109.8	Y780 I782 D808 C809 I835 L840 I843 I846 L866	Y780-I802 HydrophobicContact CD1-CD1 4.42Å; Y780-I802 HydrophobicContact CG-CD1 4.03Å; I782-I802 HydrophobicContact CD1-CD1 3.92Å; I782-I802 HydrophobicContact CG1-CD1 4.48Å; I802-D808 CarbonylContact O-C 3.53Å; I802-D808 WeakPolarHBondContact O-CA 3.36Å; I802-C809 PolarHBondContact N-SG 3.35Å; I802-C809 PolarHBondContact O-N 3.02Å; I802-I835 HydrophobicContact CD1-CD1 4.15Å; I802-I835 HydrophobicContact CD1-CG2 4.31Å; I802-L840 HydrophobicContact CB-CD1 3.78Å; I802-L840 HydrophobicContact CG2-CD1 3.62Å; I802-I843 HydrophobicContact CG2-CD1 3.88Å; I802-I843 HydrophobicContact CG2-CG1 4.34Å; I802-I843 HydrophobicContact CG2-CG2 3.76Å; I802-I846 HydrophobicContact CB-CG2 3.93Å; I802-I846 HydrophobicContact CG1-CG2 3.69Å; I802-I846 HydrophobicContact CG2-CG2 4.04Å; I802-L866 HydrophobicContact CD1-CD1 4.21Å; I802-L866 HydrophobicContact CG1-CD1 4.41Å; I802-L866 HydrophobicContact CG2-CD1 3.82Å
803	F	85.3	Confident	85.4	Confident	42 Å²	42	41.2 Å²	41.2	18%	0.184	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.5	-178.4	-62.6	-107.6	0	0	0	111.4	N801 D808 I843 N844 K845 C847	N801-F803 HydrophobicContact CB-CE2 4Å; N801-F803 WeakPolarHBondContact O-CD2 3.22Å; N801-F803 WeakPolarHBondContact O-CE2 3.35Å; F803-D808 HydrophobicContact CD1-CB 3.65Å; F803-D808 HydrophobicContact CE1-CB 3.81Å; F803-D808 HydrophobicContact CG-CB 4.06Å; F803-D808 HydrophobicContact CZ-CB 4.35Å; F803-I843 WeakPolarHBondContact O-CA 3.5Å; F803-I843 WeakPolarHBondContact O-CG2 3.32Å; F803-N844 WeakPolarHBondContact CB-OD1 3.45Å; F803-N844 PolarHBondContact O-N 3.1Å; F803-N844 PolarHBondContact O-OD1 2.89Å; F803-N844 VanDerWaalsContact O-OD1 3.08Å; F803-K845 HydrophobicContact CB-CB 4.03Å; F803-K845 HydrophobicContact CB-CG 4.25Å; F803-K845 WeakPolarHBondContact CB-O 3.21Å; F803-K845 HydrophobicContact CD2-CB 4.47Å; F803-K845 HydrophobicContact CD2-CD 4.14Å; F803-K845 HydrophobicContact CD2-CG 3.8Å; F803-K845 HydrophobicContact CE2-CD 4.49Å; F803-K845 HydrophobicContact CE2-CG 4.42Å; F803-K845 HydrophobicContact CG-CB 4.45Å; F803-K845 HydrophobicContact CG-CD 4.21Å; F803-K845 HydrophobicContact CG-CG 4.12Å; F803-K845 PolarHBondContact N-O 3.04Å; F803-K845 PolarHBondContact O-N 3.06Å; F803-C847 HydrophobicContact CE2-CB 3.9Å
804	G	82.7	Confident	85.5	Confident	9 Å²	9	40.7 Å²	40.7	9%	0.093	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	-176.2	173.3	0	0	0	0	0	113.5	K806 G807 L840 S842	G804-K806 PolarHBondContact O-N 2.8Å; G804-G807 PolarHBondContact N-O 3.45Å; G804-G807 PolarHBondContact O-N 2.79Å; G804-L840 CarbonylContact C-O 3.52Å; G804-L840 WeakPolarHBondContact CA-O 3.15Å; G804-S842 CarbonylContact C-O 3.04Å; G804-S842 WeakPolarHBondContact CA-O 3.22Å
805	E	73.9	Confident	84.9	Confident	129 Å²	129	43.2 Å²	43.2	60%	0.603	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-20.8	-177.1	-67.8	176.7	121.3	0	0	115.5	L840 S842	E805-L840 PolarHBondContact N-O 2.8Å; E805-S842 PolarHBondContact N-O 2.85Å; E805-S842 VanDerWaalsContact N-O 3.07Å; E805-S842 WeakPolarHBondContact OE2-CB 3.41Å; E805-S842 PolarHBondContact OE2-N 2.88Å; E805-S842 VanDerWaalsContact OE2-N 3.1Å; E805-S842 PolarHBondContact OE2-OG 2.84Å
806	K	78.3	Confident	84.5	Confident	83 Å²	83	47.8 Å²	47.8	36%	0.361	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	19.7	178.5	-59.2	-180	175.5	-177.3	0	113.1	L775 G804 Q839 L840	L775-K806 HydrophobicContact CD1-CD 4.21Å; L775-K806 HydrophobicContact CD2-CD 3.94Å; G804-K806 PolarHBondContact O-N 2.8Å; K806-Q839 WeakPolarHBondContact CB-O 3.42Å; K806-Q839 VanDerWaalsContact CD-O 3.26Å; K806-Q839 WeakPolarHBondContact CD-O 3.35Å; K806-L840 PolarHBondContact N-O 2.68Å
807	G	79.2	Confident	84.4	Confident	22 Å²	22	48.3 Å²	48.3	23%	0.227	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.3	-166.9	178.5	0	0	0	0	0	113.7	G804	G804-G807 PolarHBondContact N-O 3.45Å; G804-G807 PolarHBondContact O-N 2.79Å
808	D	88.3	Confident	84.2	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.032	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	166.6	179.5	60.9	76.5	0	0	0	112.2	K664 K713 R715 I802 F803 G810 L840	K664-D808 IonicContact NZ-OD2 3.58Å; K664-D808 PolarHBondContact NZ-OD2 3.21Å; K713-D808 PolarHBondContact NZ-O 3.09Å; R715-D808 IonicContact CZ-OD1 3.4Å; R715-D808 IonicContact NH1-OD1 2.8Å; R715-D808 PolarHBondContact NH1-OD1 3.29Å; R715-D808 VanDerWaalsContact NH2-C 3.32Å; R715-D808 PolarHBondContact NH2-O 3.4Å; R715-D808 IonicContact NH2-OD1 2.66Å; R715-D808 PolarHBondContact NH2-OD1 3.11Å; I802-D808 CarbonylContact O-C 3.53Å; I802-D808 WeakPolarHBondContact O-CA 3.36Å; F803-D808 HydrophobicContact CD1-CB 3.65Å; F803-D808 HydrophobicContact CE1-CB 3.81Å; F803-D808 HydrophobicContact CG-CB 4.06Å; F803-D808 HydrophobicContact CZ-CB 4.35Å; D808-G810 PolarHBondContact OD1-N 2.88Å; D808-L840 WeakPolarHBondContact O-CD2 3.37Å
809	C	88.7	Confident	84	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.			trans	-93	-14.4	170.7	68.2	0	0	0	0	113.7	R715 I802 R812 A837 L840	R715-C809 VanDerWaalsContact CZ-O 3.29Å; R715-C809 PolarHBondContact NE-O 3.46Å; R715-C809 PolarHBondContact NH2-O 2.89Å; I802-C809 PolarHBondContact N-SG 3.35Å; I802-C809 PolarHBondContact O-N 3.02Å; C809-R812 PolarHBondContact O-NH1 2.6Å; C809-R812 PolarHBondContact O-NH2 3.02Å; C809-A837 HydrophobicContact CB-CB 3.56Å; C809-L840 HydrophobicContact CB-CD1 4.17Å; C809-L840 HydrophobicContact CB-CD2 4.35Å
810	G	81.9	Confident	83.4	Confident	3 Å²	3	60.3 Å²	60.3	3%	0.031	29%	0.288	C	S	.	.			trans	85.6	171.5	-173.3	0	0	0	0	0	111.6	R715 N801 D808 R812	R715-G810 VanDerWaalsContact CZ-CA 3.47Å; R715-G810 VanDerWaalsContact CZ-N 3.33Å; R715-G810 VanDerWaalsContact NH2-N 3.17Å; N801-G810 WeakPolarHBondContact CA-O 3.4Å; N801-G810 WeakPolarHBondContact OD1-CA 3.23Å; N801-G810 PolarHBondContact OD1-N 3Å; N801-G810 PolarHBondContact OD1-O 2.76Å; D808-G810 PolarHBondContact OD1-N 2.88Å; G810-R812 PolarHBondContact O-N 2.96Å
811	E	84.5	Confident	82.6	Confident	108 Å²	108	62.7 Å²	62.7	51%	0.505	30%	0.301	S	S	.	.			trans	-66.3	130.6	179.2	-66.4	167.2	168.1	0	0	110.1	F799 I800 N801	F799-E811 HydrophobicContact CD2-CB 4.18Å; F799-E811 HydrophobicContact CD2-CG 3.79Å; F799-E811 HydrophobicContact CE2-CG 4.09Å; I800-E811 CarbonylContact O-C 3.56Å; N801-E811 HydrophobicContact CB-CG 4.27Å
812	R	85.5	Confident	81.9	Confident	32 Å²	32	67.8 Å²	67.8	12%	0.121	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.3	179.2	-72.5	-72	-170.5	-66.9	-7	107.9	F799 I800 C809 G810 I835 E836	F799-R812 CarbonylContact C-O 3.59Å; F799-R812 VanDerWaalsContact CA-O 3.3Å; F799-R812 WeakPolarHBondContact CA-O 3.39Å; I800-R812 HydrophobicContact CG2-CB 4.27Å; I800-R812 PolarHBondContact N-O 2.83Å; I800-R812 PolarHBondContact O-N 3Å; C809-R812 PolarHBondContact O-NH1 2.6Å; C809-R812 PolarHBondContact O-NH2 3.02Å; G810-R812 PolarHBondContact O-N 2.96Å; R812-I835 HydrophobicContact CB-CD1 3.75Å; R812-I835 HydrophobicContact CB-CG1 4.09Å; R812-I835 HydrophobicContact CG-CD1 3.95Å; R812-I835 HydrophobicContact CG-CG1 4.04Å; R812-I835 HydrophobicContact CG-CG2 3.86Å; R812-E836 PolarHBondContact NH2-O 2.93Å
813	W	85.7	Confident	81.5	Confident	137 Å²	137	73.8 Å²	73.8	52%	0.519	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	133.6	177.8	-63.7	94.5	0	0	0	110.6	N797 F799 G815 E851	N797-W813 HydrophobicContact CB-CE3 4.02Å; N797-W813 HydrophobicContact CB-CZ3 3.97Å; F799-W813 HydrophobicContact CB-CD2 3.88Å; F799-W813 HydrophobicContact CB-CE3 3.78Å; F799-W813 HydrophobicContact CB-CG 4.5Å; F799-W813 HydrophobicContact CB-CH2 4.26Å; F799-W813 HydrophobicContact CB-CZ2 4.32Å; F799-W813 HydrophobicContact CB-CZ3 3.99Å; F799-W813 AromaticContact CD1-CH2 3.95Å; F799-W813 HydrophobicContact CD1-CH2 3.95Å; F799-W813 HydrophobicContact CD1-CZ3 4.04Å; F799-W813 HydrophobicContact CG-CH2 4.42Å; F799-W813 HydrophobicContact CG-CZ3 4.47Å; W813-G815 PolarHBondContact O-N 3.34Å; W813-E851 HydrophobicContact CH2-CB 4.23Å; W813-E851 HydrophobicContact CZ3-CB 4.41Å
814	L	87	Confident	81.6	Confident	12 Å²	12	73.6 Å²	73.6	6%	0.063	37%	0.367	C	S	.	.			trans	-99.3	63.4	-166.4	-61	-175.7	0	0	0	112.2	I784 I798 I800 F825 F833 I835	I784-L814 HydrophobicContact CD1-CD1 3.39Å; I798-L814 HydrophobicContact CG2-CD1 4.09Å; I798-L814 PolarHBondContact O-N 2.83Å; I800-L814 HydrophobicContact CB-CD1 4.35Å; I800-L814 HydrophobicContact CG2-CD1 4.12Å; I800-L814 HydrophobicContact CG2-CD2 3.85Å; I800-L814 HydrophobicContact CG2-CG 4.24Å; L814-F825 HydrophobicContact CB-CZ 4.09Å; L814-F825 HydrophobicContact CD1-CZ 4.24Å; L814-F833 HydrophobicContact CB-CD1 3.93Å; L814-F833 HydrophobicContact CB-CE1 3.74Å; L814-F833 HydrophobicContact CB-CE2 4.35Å; L814-F833 HydrophobicContact CB-CG 4.33Å; L814-F833 HydrophobicContact CB-CZ 3.97Å; L814-F833 HydrophobicContact CD1-CD2 4.19Å; L814-F833 HydrophobicContact CD1-CE2 4.28Å; L814-F833 HydrophobicContact CD2-CB 4.03Å; L814-F833 HydrophobicContact CD2-CD1 4.1Å; L814-F833 HydrophobicContact CD2-CD2 4.38Å; L814-F833 HydrophobicContact CD2-CG 3.91Å; L814-F833 HydrophobicContact CG-CG 4.49Å; L814-F833 WeakPolarHBondContact O-CE1 3.16Å; L814-I835 HydrophobicContact CD2-CD1 4.47Å
815	G	76	Confident	82	Confident	59 Å²	59	73.5 Å²	73.5	61%	0.608	36%	0.364	S	S	*	.			trans	-86.7	-8.2	-170.9	0	0	0	0	0	117.5	W813	W813-G815 PolarHBondContact O-N 3.34Å
816	R	76.6	Confident	82.8	Confident	224 Å²	224	70.9 Å²	70.9	85%	0.845	35%	0.352	S	S	*	.			trans	-146.2	121.3	177.8	-73.9	-172.1	177.6	167.1	1	112.6	F833	R816-F833 WeakPolarHBondContact O-CD1 3.27Å
817	S	81.1	Confident	83.2	Confident	18 Å²	18	70.9 Å²	70.9	13%	0.126	35%	0.353	C	S	.	.			trans	-72.7	136	172.1	148.7	0	0	0	0	111.8	N819 R820 N821 L824 E832	S817-N819 PolarHBondContact OG-N 2.79Å; S817-N819 PolarHBondContact OG-OD1 3.26Å; S817-R820 PolarHBondContact O-N 3Å; S817-R820 PolarHBondContact OG-N 3.41Å; S817-N821 PolarHBondContact OG-N 3.07Å; S817-N821 VanDerWaalsContact OG-N 3.16Å; S817-L824 VanDerWaalsContact CB-CD2 3.48Å; S817-E832 CarbonylContact C-O 3.56Å; S817-E832 WeakPolarHBondContact CA-O 3.3Å
818	V	82.2	Confident	83.6	Confident	75 Å²	75	75.1 Å²	75.1	46%	0.455	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-39.2	171.8	179.1	0	0	0	0	110.7	R820 E832 V834	V818-R820 PolarHBondContact O-N 3.06Å; V818-E832 HydrophobicContact CB-CB 4.34Å; V818-E832 HydrophobicContact CB-CG 4.31Å; V818-E832 WeakPolarHBondContact CG2-O 3.49Å; V818-E832 PolarHBondContact N-O 2.91Å; V818-V834 HydrophobicContact CG2-CB 4.47Å; V818-V834 HydrophobicContact CG2-CG2 3.94Å
819	N	82.9	Confident	83.8	Confident	61 Å²	61	76.8 Å²	76.8	33%	0.326	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	5.8	175.4	48.9	-26.7	0	0	0	114.2	S817 N821 M830 E832	S817-N819 PolarHBondContact OG-N 2.79Å; S817-N819 PolarHBondContact OG-OD1 3.26Å; N819-N821 VanDerWaalsContact C-N 3.28Å; N819-N821 PolarHBondContact ND2-ND2 3.27Å; N819-N821 PolarHBondContact O-N 2.75Å; N819-M830 PolarHBondContact ND2-O 3.3Å; N819-E832 PolarHBondContact OD1-N 2.93Å
820	R	78	Confident	83.9	Confident	230 Å²	230	79.7 Å²	79.7	87%	0.868	39%	0.392	S	S	*	.			trans	59.2	31.1	174.2	-54.1	-176	179.2	-173.2	-0.8	114.8	S817 V818 S822	S817-R820 PolarHBondContact O-N 3Å; S817-R820 PolarHBondContact OG-N 3.41Å; V818-R820 PolarHBondContact O-N 3.06Å; R820-S822 PolarHBondContact O-N 2.93Å
821	N	76.4	Confident	84.4	Confident	49 Å²	49	79.5 Å²	79.5	26%	0.262	39%	0.391	S	S	.	.			trans	-62.3	127.1	170.7	-66.6	-12.8	0	0	0	109.2	S817 N819 L824 Q829 M830 D831	S817-N821 PolarHBondContact OG-N 3.07Å; S817-N821 VanDerWaalsContact OG-N 3.16Å; N819-N821 VanDerWaalsContact C-N 3.28Å; N819-N821 PolarHBondContact ND2-ND2 3.27Å; N819-N821 PolarHBondContact O-N 2.75Å; N821-L824 HydrophobicContact CB-CD2 4.31Å; N821-Q829 VanDerWaalsContact CG-NE2 3.3Å; N821-Q829 PolarHBondContact ND2-NE2 3.45Å; N821-M830 PolarHBondContact ND2-O 3.24Å; N821-M830 VanDerWaalsContact ND2-O 3.11Å; N821-D831 PolarHBondContact ND2-OD1 3.18Å
822	S	75.5	Confident	84.8	Confident	124 Å²	124	76.3 Å²	76.3	87%	0.867	38%	0.376	S	S	*	.	S	Bend	trans	-75.4	-32.5	-178.2	51.4	0	0	0	0	112.9	R820	R820-S822 PolarHBondContact O-N 2.93Å
823	E	82.7	Confident	85.1	Confident	127 Å²	127	75.1 Å²	75.1	59%	0.593	37%	0.371	S	S	*	.	S	Bend	trans	-117.2	136.5	168.8	-65.3	177.6	-178.5	0	0	107.4	Q826 Q829	E823-Q826 HydrophobicContact CB-CG 4.16Å; E823-Q829 PolarHBondContact O-NE2 2.98Å; E823-Q829 PolarHBondContact O-OE1 2.82Å
824	L	87.5	Confident	85.3	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.199	37%	0.365	C	S	.	.			trans	-98.7	157.4	-176.9	-56.1	177.4	0	0	0	110.3	S817 N821 Q826 F833	S817-L824 VanDerWaalsContact CB-CD2 3.48Å; N821-L824 HydrophobicContact CB-CD2 4.31Å; L824-Q826 PolarHBondContact O-N 2.86Å; L824-Q826 VanDerWaalsContact O-N 3.08Å; L824-Q826 PolarHBondContact O-NE2 3.3Å; L824-F833 HydrophobicContact CD1-CE1 4.31Å; L824-F833 HydrophobicContact CD1-CZ 4.26Å; L824-F833 HydrophobicContact CD2-CZ 4.32Å
825	F	90.4	Very high	85.4	Confident	7 Å²	7	71.4 Å²	71.4	3%	0.031	36%	0.364	C	S	.	.	S	Bend	trans	59.6	18.6	164.6	-49.9	-59.9	0	0	0	116.9	I784 T786 G793 T794 I798 L814 D831 F833 W859	I784-F825 HydrophobicContact CB-CE1 4.25Å; I784-F825 HydrophobicContact CD1-CE1 4.07Å; I784-F825 HydrophobicContact CG2-CD1 4.29Å; I784-F825 HydrophobicContact CG2-CE1 4.12Å; T786-F825 WeakPolarHBondContact CG2-O 3.48Å; T786-F825 PolarHBondContact OG1-O 2.76Å; G793-F825 WeakPolarHBondContact CA-O 3.35Å; T794-F825 HydrophobicContact CG2-CB 4.22Å; I798-F825 HydrophobicContact CB-CE2 3.88Å; I798-F825 HydrophobicContact CB-CZ 4.02Å; I798-F825 HydrophobicContact CD1-CB 4.33Å; I798-F825 HydrophobicContact CD1-CD1 3.9Å; I798-F825 HydrophobicContact CD1-CD2 3.48Å; I798-F825 VanDerWaalsContact CD1-CD2 3.48Å; I798-F825 HydrophobicContact CD1-CE1 4.02Å; I798-F825 HydrophobicContact CD1-CE2 3.63Å; I798-F825 HydrophobicContact CD1-CG 3.63Å; I798-F825 HydrophobicContact CD1-CZ 3.89Å; I798-F825 HydrophobicContact CG1-CD2 3.87Å; I798-F825 HydrophobicContact CG1-CE2 3.69Å; I798-F825 HydrophobicContact CG1-CZ 4.17Å; L814-F825 HydrophobicContact CB-CZ 4.09Å; L814-F825 HydrophobicContact CD1-CZ 4.24Å; F825-D831 WeakPolarHBondContact CA-OD2 3.48Å; F825-D831 HydrophobicContact CD1-CB 4.38Å; F825-D831 HydrophobicContact CE1-CB 4.19Å; F825-D831 PolarHBondContact N-OD2 3Å; F825-F833 AromaticContact CE1-CE2 3.65Å; F825-F833 HydrophobicContact CE1-CE2 3.65Å; F825-F833 AromaticContact CE1-CZ 3.84Å; F825-F833 HydrophobicContact CE1-CZ 3.84Å; F825-F833 HydrophobicContact CE2-CZ 4.26Å; F825-F833 HydrophobicContact CZ-CE1 4.46Å; F825-F833 AromaticContact CZ-CE2 3.64Å; F825-F833 HydrophobicContact CZ-CE2 3.64Å; F825-F833 AromaticContact CZ-CZ 3.42Å; F825-F833 HydrophobicContact CZ-CZ 3.42Å; F825-F833 VanDerWaalsContact CZ-CZ 3.42Å; F825-W859 HydrophobicContact CD1-CZ2 4.17Å
826	Q	89.7	Confident	86	Confident	74 Å²	74	71.1 Å²	71.1	35%	0.346	35%	0.347	S	S	.	.			trans	-62.9	164.5	178.4	-58	-54.5	-54.3	0	0	113.4	T786 E823 L824 N828 Q829	T786-Q826 WeakPolarHBondContact CB-O 3.49Å; T786-Q826 VanDerWaalsContact CG2-O 3.29Å; T786-Q826 WeakPolarHBondContact CG2-O 3.05Å; E823-Q826 HydrophobicContact CB-CG 4.16Å; L824-Q826 PolarHBondContact O-N 2.86Å; L824-Q826 VanDerWaalsContact O-N 3.08Å; L824-Q826 PolarHBondContact O-NE2 3.3Å; Q826-N828 PolarHBondContact O-N 2.86Å; Q826-Q829 HydrophobicContact CB-CB 4.24Å; Q826-Q829 VanDerWaalsContact CG-OE1 3.29Å; Q826-Q829 WeakPolarHBondContact O-CB 3.33Å; Q826-Q829 PolarHBondContact O-N 2.91Å
827	Q	88.1	Confident	86.6	Confident	83 Å²	83	60.5 Å²	60.5	39%	0.388	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	127.3	-179.9	172.7	167.7	-13.5	0	0	111.7	N788 K789 S792 Q829	N788-Q827 PolarHBondContact OD1-NE2 3.01Å; K789-Q827 PolarHBondContact O-NE2 2.88Å; K789-Q827 PolarHBondContact O-OE1 3.08Å; S792-Q827 VanDerWaalsContact OG-CA 3.29Å; S792-Q827 WeakPolarHBondContact OG-CA 3.43Å; S792-Q827 VanDerWaalsContact OG-CB 3.27Å; S792-Q827 WeakPolarHBondContact OG-CB 3.46Å; S792-Q827 VanDerWaalsContact OG-CG 3.27Å; S792-Q827 WeakPolarHBondContact OG-CG 3.2Å; Q827-Q829 PolarHBondContact O-N 3.17Å
828	N	87.6	Confident	87.1	Confident	111 Å²	111	59.6 Å²	59.6	59%	0.594	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	17.8	-178.9	-162.2	62.9	0	0	0	115.4	T786 G787 N788 Q826	T786-N828 WeakPolarHBondContact O-CA 3.49Å; G787-N828 PolarHBondContact O-N 3.01Å; G787-N828 VanDerWaalsContact O-N 3.12Å; N788-N828 HydrophobicContact CB-CB 4.07Å; Q826-N828 PolarHBondContact O-N 2.86Å
829	Q	91	Very high	87.4	Confident	40 Å²	40	58 Å²	58	19%	0.187	29%	0.288	C	S	.	.			trans	-84	159.7	177.9	-168.8	173.1	12.2	0	0	113.2	F785 T786 N821 E823 Q826 Q827 D831	F785-Q829 WeakPolarHBondContact CA-O 3.13Å; T786-Q829 PolarHBondContact N-O 2.83Å; N821-Q829 VanDerWaalsContact CG-NE2 3.3Å; N821-Q829 PolarHBondContact ND2-NE2 3.45Å; E823-Q829 PolarHBondContact O-NE2 2.98Å; E823-Q829 PolarHBondContact O-OE1 2.82Å; Q826-Q829 HydrophobicContact CB-CB 4.24Å; Q826-Q829 VanDerWaalsContact CG-OE1 3.29Å; Q826-Q829 WeakPolarHBondContact O-CB 3.33Å; Q826-Q829 PolarHBondContact O-N 2.91Å; Q827-Q829 PolarHBondContact O-N 3.17Å; Q829-D831 PolarHBondContact NE2-OD1 3.02Å
830	M	92.4	Very high	87.6	Confident	61 Å²	61	55.1 Å²	55.1	30%	0.3	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.1	164.7	-173.8	-77.7	-65	0	0	111.1	Q783 I784 F785 N819 N821 E832	Q783-M830 HydrophobicContact CB-CG 4.45Å; Q783-M830 HydrophobicContact CB-SD 3.88Å; Q783-M830 HydrophobicContact CG-SD 3.93Å; I784-M830 CarbonylContact O-C 3.53Å; I784-M830 VanDerWaalsContact O-CA 3.28Å; I784-M830 WeakPolarHBondContact O-CA 3.28Å; F785-M830 HydrophobicContact CD1-CB 3.9Å; F785-M830 HydrophobicContact CD1-CG 3.79Å; F785-M830 HydrophobicContact CD2-CG 4.11Å; F785-M830 HydrophobicContact CE1-CB 3.91Å; F785-M830 HydrophobicContact CE1-CG 3.51Å; F785-M830 HydrophobicContact CE2-CG 3.84Å; F785-M830 HydrophobicContact CG-CB 4.43Å; F785-M830 HydrophobicContact CG-CG 4.08Å; F785-M830 HydrophobicContact CZ-CB 4.43Å; F785-M830 HydrophobicContact CZ-CG 3.54Å; N819-M830 PolarHBondContact ND2-O 3.3Å; N821-M830 PolarHBondContact ND2-O 3.24Å; N821-M830 VanDerWaalsContact ND2-O 3.11Å; M830-E832 HydrophobicContact SD-CB 4.4Å
831	D	92.5	Very high	87.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.2	-179.7	-67.3	-74.8	0	0	0	111.1	Q783 I784 N821 F825 Q829 F833	Q783-D831 CarbonylContact C-O 3.53Å; Q783-D831 WeakPolarHBondContact CA-O 3.33Å; I784-D831 PolarHBondContact N-O 3.35Å; I784-D831 PolarHBondContact O-N 3.07Å; N821-D831 PolarHBondContact ND2-OD1 3.18Å; F825-D831 WeakPolarHBondContact CA-OD2 3.48Å; F825-D831 HydrophobicContact CD1-CB 4.38Å; F825-D831 HydrophobicContact CE1-CB 4.19Å; F825-D831 PolarHBondContact N-OD2 3Å; Q829-D831 PolarHBondContact NE2-OD1 3.02Å; D831-F833 HydrophobicContact CB-CE2 3.53Å; D831-F833 HydrophobicContact CB-CZ 3.89Å
832	E	93.1	Very high	87.8	Confident	41 Å²	41	45.6 Å²	45.6	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.1	-179.5	-172.1	173.6	111.2	0	0	111.8	I781 I782 Q783 S817 V818 N819 M830	I781-E832 VanDerWaalsContact CG2-CD 3.47Å; I781-E832 HydrophobicContact CG2-CG 3.6Å; I782-E832 CarbonylContact O-C 3.49Å; I782-E832 WeakPolarHBondContact O-CA 3.19Å; Q783-E832 HydrophobicContact CG-CB 4.18Å; Q783-E832 HydrophobicContact CG-CG 3.9Å; Q783-E832 WeakPolarHBondContact CG-OE2 3.28Å; Q783-E832 PolarHBondContact NE2-OE2 3.15Å; S817-E832 CarbonylContact C-O 3.56Å; S817-E832 WeakPolarHBondContact CA-O 3.3Å; V818-E832 HydrophobicContact CB-CB 4.34Å; V818-E832 HydrophobicContact CB-CG 4.31Å; V818-E832 WeakPolarHBondContact CG2-O 3.49Å; V818-E832 PolarHBondContact N-O 2.91Å; N819-E832 PolarHBondContact OD1-N 2.93Å; M830-E832 HydrophobicContact SD-CB 4.4Å
833	F	91.2	Very high	88.1	Confident	6 Å²	6	40 Å²	40	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	153.4	179.8	-57.1	-88.7	0	0	0	110.8	I781 I782 I784 L814 R816 L824 F825 D831	I781-F833 CarbonylContact C-O 3.11Å; I781-F833 WeakPolarHBondContact CA-O 3.15Å; I782-F833 PolarHBondContact N-O 3.24Å; I782-F833 PolarHBondContact O-N 2.84Å; I784-F833 HydrophobicContact CD1-CD2 4.24Å; I784-F833 HydrophobicContact CD1-CE2 4.23Å; I784-F833 HydrophobicContact CG1-CD2 4.46Å; L814-F833 HydrophobicContact CB-CD1 3.93Å; L814-F833 HydrophobicContact CB-CE1 3.74Å; L814-F833 HydrophobicContact CB-CE2 4.35Å; L814-F833 HydrophobicContact CB-CG 4.33Å; L814-F833 HydrophobicContact CB-CZ 3.97Å; L814-F833 HydrophobicContact CD1-CD2 4.19Å; L814-F833 HydrophobicContact CD1-CE2 4.28Å; L814-F833 HydrophobicContact CD2-CB 4.03Å; L814-F833 HydrophobicContact CD2-CD1 4.1Å; L814-F833 HydrophobicContact CD2-CD2 4.38Å; L814-F833 HydrophobicContact CD2-CG 3.91Å; L814-F833 HydrophobicContact CG-CG 4.49Å; L814-F833 WeakPolarHBondContact O-CE1 3.16Å; R816-F833 WeakPolarHBondContact O-CD1 3.27Å; L824-F833 HydrophobicContact CD1-CE1 4.31Å; L824-F833 HydrophobicContact CD1-CZ 4.26Å; L824-F833 HydrophobicContact CD2-CZ 4.32Å; F825-F833 AromaticContact CE1-CE2 3.65Å; F825-F833 HydrophobicContact CE1-CE2 3.65Å; F825-F833 AromaticContact CE1-CZ 3.84Å; F825-F833 HydrophobicContact CE1-CZ 3.84Å; F825-F833 HydrophobicContact CE2-CZ 4.26Å; F825-F833 HydrophobicContact CZ-CE1 4.46Å; F825-F833 AromaticContact CZ-CE2 3.64Å; F825-F833 HydrophobicContact CZ-CE2 3.64Å; F825-F833 AromaticContact CZ-CZ 3.42Å; F825-F833 HydrophobicContact CZ-CZ 3.42Å; F825-F833 VanDerWaalsContact CZ-CZ 3.42Å; D831-F833 HydrophobicContact CB-CE2 3.53Å; D831-F833 HydrophobicContact CB-CZ 3.89Å
834	V	89.5	Confident	87.6	Confident	65 Å²	65	37.7 Å²	37.7	39%	0.394	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.8	172.6	168.3	0	0	0	0	110	H779 Y780 I781 V818	H779-V834 HydrophobicContact CB-CG1 3.98Å; Y780-V834 WeakPolarHBondContact O-CA 3.28Å; I781-V834 HydrophobicContact CG1-CG2 4.24Å; V818-V834 HydrophobicContact CG2-CB 4.47Å; V818-V834 HydrophobicContact CG2-CG2 3.94Å
835	I	88.8	Confident	87.3	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.4	175.7	-71.6	169.4	0	0	0	109.5	Y780 I782 I800 I802 R812 L814 A837	Y780-I835 PolarHBondContact N-O 3.16Å; Y780-I835 PolarHBondContact O-N 3.22Å; I782-I835 HydrophobicContact CG1-CD1 4.09Å; I800-I835 HydrophobicContact CG2-CD1 3.42Å; I800-I835 VanDerWaalsContact CG2-CD1 3.42Å; I802-I835 HydrophobicContact CD1-CD1 4.15Å; I802-I835 HydrophobicContact CD1-CG2 4.31Å; R812-I835 HydrophobicContact CB-CD1 3.75Å; R812-I835 HydrophobicContact CB-CG1 4.09Å; R812-I835 HydrophobicContact CG-CD1 3.95Å; R812-I835 HydrophobicContact CG-CG1 4.04Å; R812-I835 HydrophobicContact CG-CG2 3.86Å; L814-I835 HydrophobicContact CD2-CD1 4.47Å; I835-A837 HydrophobicContact CG2-CB 4.43Å
836	E	88.9	Confident	87.2	Confident	54 Å²	54	36.5 Å²	36.5	25%	0.252	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	126	166.6	-167.5	-172.2	83.2	0	0	109.6	R749 L777 R812	R749-E836 IonicContact NH1-OE1 2.9Å; R749-E836 IonicContact NH1-OE2 3.18Å; R749-E836 PolarHBondContact NH1-OE2 3.15Å; L777-E836 HydrophobicContact CD2-CG 3.98Å; R812-E836 PolarHBondContact NH2-O 2.93Å
837	A	89.9	Confident	87	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	153.7	175	0	0	0	0	0	111.6	Y778 Y780 C809 I835	Y778-A837 PolarHBondContact N-O 3.04Å; Y778-A837 PolarHBondContact O-N 2.87Å; Y780-A837 HydrophobicContact CD2-CB 4.18Å; Y780-A837 HydrophobicContact CE2-CB 3.97Å; C809-A837 HydrophobicContact CB-CB 3.56Å; I835-A837 HydrophobicContact CG2-CB 4.43Å
838	V	89.9	Confident	87.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.2	176.1	173.7	0	0	0	0	109.1	K713 E763 P765 L775 L777 L840	K713-V838 HydrophobicContact CB-CB 4.34Å; K713-V838 HydrophobicContact CB-CG1 4.04Å; K713-V838 HydrophobicContact CD-CB 3.69Å; K713-V838 HydrophobicContact CD-CG1 3.94Å; K713-V838 HydrophobicContact CD-CG2 4.45Å; E763-V838 HydrophobicContact CB-CB 4.44Å; E763-V838 HydrophobicContact CB-CG2 3.82Å; E763-V838 PolarHBondContact OE2-N 3.44Å; P765-V838 HydrophobicContact CB-CG1 4.09Å; P765-V838 HydrophobicContact CB-CG2 4.28Å; L775-V838 HydrophobicContact CB-CG1 3.42Å; L775-V838 VanDerWaalsContact CB-CG1 3.42Å; L775-V838 HydrophobicContact CD1-CG1 3.99Å; L775-V838 HydrophobicContact CG-CG1 4.36Å; L777-V838 HydrophobicContact CD2-CG2 3.68Å; L777-V838 HydrophobicContact CG-CG2 4.1Å; V838-L840 WeakPolarHBondContact O-CD2 3.45Å; V838-L840 PolarHBondContact O-N 3.47Å; V838-L840 VanDerWaalsContact O-N 3.09Å
839	Q	89.6	Confident	87.1	Confident	41 Å²	41	24.3 Å²	24.3	19%	0.192	13%	0.134	C	C	.	.			trans	-39.6	109.9	-167.5	-175.4	-167.7	65	0	0	114	P776 Y778 K806 G841	P776-Q839 HydrophobicContact CG-CB 4.2Å; P776-Q839 WeakPolarHBondContact O-CB 3.49Å; P776-Q839 PolarHBondContact O-N 3.03Å; Y778-Q839 HydrophobicContact CD2-CB 4.3Å; Y778-Q839 HydrophobicContact CD2-CG 3.91Å; Y778-Q839 HydrophobicContact CE2-CB 4.43Å; Y778-Q839 HydrophobicContact CE2-CG 3.7Å; Y778-Q839 HydrophobicContact CG-CB 4.5Å; Y778-Q839 VanDerWaalsContact CZ-NE2 3.29Å; Y778-Q839 PolarHBondContact OH-NE2 3.14Å; K806-Q839 WeakPolarHBondContact CB-O 3.42Å; K806-Q839 VanDerWaalsContact CD-O 3.26Å; K806-Q839 WeakPolarHBondContact CD-O 3.35Å; Q839-G841 VanDerWaalsContact C-N 3.31Å; Q839-G841 PolarHBondContact O-N 3.36Å
840	L	86.1	Confident	86.9	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.126	C	C	.	.			trans	-78	-5.3	-175.3	-55.1	176	0	0	0	115	K713 Y780 I802 G804 E805 K806 D808 C809 V838 I843	K713-L840 VanDerWaalsContact NZ-CD2 3.34Å; Y780-L840 HydrophobicContact CE1-CD1 4.35Å; Y780-L840 HydrophobicContact CE2-CD1 4.32Å; Y780-L840 HydrophobicContact CE2-CG 4.34Å; Y780-L840 PolarHBondContact OH-N 2.92Å; I802-L840 HydrophobicContact CB-CD1 3.78Å; I802-L840 HydrophobicContact CG2-CD1 3.62Å; G804-L840 CarbonylContact C-O 3.52Å; G804-L840 WeakPolarHBondContact CA-O 3.15Å; E805-L840 PolarHBondContact N-O 2.8Å; K806-L840 PolarHBondContact N-O 2.68Å; D808-L840 WeakPolarHBondContact O-CD2 3.37Å; C809-L840 HydrophobicContact CB-CD1 4.17Å; C809-L840 HydrophobicContact CB-CD2 4.35Å; V838-L840 WeakPolarHBondContact O-CD2 3.45Å; V838-L840 PolarHBondContact O-N 3.47Å; V838-L840 VanDerWaalsContact O-N 3.09Å; L840-I843 HydrophobicContact CB-CD1 3.63Å; L840-I843 HydrophobicContact CD1-CD1 3.91Å; L840-I843 HydrophobicContact CG-CD1 4.4Å
841	G	81.8	Confident	86.3	Confident	21 Å²	21	24.6 Å²	24.6	22%	0.216	14%	0.135	C	C	.	.			trans	76.3	-148.1	-173.7	0	0	0	0	0	112.4	Q839 I843	Q839-G841 VanDerWaalsContact C-N 3.31Å; Q839-G841 PolarHBondContact O-N 3.36Å; G841-I843 PolarHBondContact O-N 2.84Å
842	S	77.4	Confident	85.6	Confident	58 Å²	58	27.4 Å²	27.4	41%	0.406	15%	0.148	S	C	.	.	S	Bend	trans	-70.3	121.8	173.2	-48	0	0	0	0	109.6	G804 E805	G804-S842 CarbonylContact C-O 3.04Å; G804-S842 WeakPolarHBondContact CA-O 3.22Å; E805-S842 PolarHBondContact N-O 2.85Å; E805-S842 VanDerWaalsContact N-O 3.07Å; E805-S842 WeakPolarHBondContact OE2-CB 3.41Å; E805-S842 PolarHBondContact OE2-N 2.88Å; E805-S842 VanDerWaalsContact OE2-N 3.1Å; E805-S842 PolarHBondContact OE2-OG 2.84Å
843	I	83.2	Confident	84.4	Confident	6 Å²	6	34.6 Å²	34.6	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.7	178.1	-51.8	-50.7	0	0	0	109.1	Y780 I802 F803 L840 G841 L866 Y874 L876 F878	Y780-I843 HydrophobicContact CE1-CD1 4.01Å; Y780-I843 HydrophobicContact CE1-CG1 4.48Å; I802-I843 HydrophobicContact CG2-CD1 3.88Å; I802-I843 HydrophobicContact CG2-CG1 4.34Å; I802-I843 HydrophobicContact CG2-CG2 3.76Å; F803-I843 WeakPolarHBondContact O-CA 3.5Å; F803-I843 WeakPolarHBondContact O-CG2 3.32Å; L840-I843 HydrophobicContact CB-CD1 3.63Å; L840-I843 HydrophobicContact CD1-CD1 3.91Å; L840-I843 HydrophobicContact CG-CD1 4.4Å; G841-I843 PolarHBondContact O-N 2.84Å; I843-L866 HydrophobicContact CG1-CD2 4.3Å; I843-L866 HydrophobicContact CG2-CD1 4.21Å; I843-Y874 HydrophobicContact CB-CE1 4.48Å; I843-Y874 HydrophobicContact CG1-CE1 4.05Å; I843-Y874 PolarHBondContact N-OH 3.23Å; I843-L876 HydrophobicContact CB-CD1 3.75Å; I843-L876 HydrophobicContact CG2-CD1 4.2Å; I843-F878 HydrophobicContact CG2-CZ 3.95Å
844	N	72	Confident	83.2	Confident	80 Å²	80	36.8 Å²	36.8	43%	0.428	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	-26.1	-176.9	55.7	28.2	0	0	0	113.3	F803 A899	F803-N844 WeakPolarHBondContact CB-OD1 3.45Å; F803-N844 PolarHBondContact O-N 3.1Å; F803-N844 PolarHBondContact O-OD1 2.89Å; F803-N844 VanDerWaalsContact O-OD1 3.08Å; N844-A899 PolarHBondContact O-N 2.85Å
845	K	79.9	Confident	81.6	Confident	20 Å²	20	39 Å²	39	9%	0.087	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	152.2	-175.2	157.7	-178.3	152.3	175.4	0	110.9	F803 E896 L897 F898	F803-K845 HydrophobicContact CB-CB 4.03Å; F803-K845 HydrophobicContact CB-CG 4.25Å; F803-K845 WeakPolarHBondContact CB-O 3.21Å; F803-K845 HydrophobicContact CD2-CB 4.47Å; F803-K845 HydrophobicContact CD2-CD 4.14Å; F803-K845 HydrophobicContact CD2-CG 3.8Å; F803-K845 HydrophobicContact CE2-CD 4.49Å; F803-K845 HydrophobicContact CE2-CG 4.42Å; F803-K845 HydrophobicContact CG-CB 4.45Å; F803-K845 HydrophobicContact CG-CD 4.21Å; F803-K845 HydrophobicContact CG-CG 4.12Å; F803-K845 PolarHBondContact N-O 3.04Å; F803-K845 PolarHBondContact O-N 3.06Å; K845-E896 HydrophobicContact CD-CB 4.43Å; K845-E896 WeakPolarHBondContact CE-OE1 3.2Å; K845-E896 VanDerWaalsContact CE-OE2 3.31Å; K845-E896 WeakPolarHBondContact CE-OE2 3.42Å; K845-E896 IonicContact NZ-OE1 3.28Å; K845-E896 PolarHBondContact NZ-OE1 3.23Å; K845-E896 IonicContact NZ-OE2 3.61Å; K845-E896 PolarHBondContact NZ-OE2 3.42Å; K845-L897 CarbonylContact C-O 3.51Å; K845-L897 VanDerWaalsContact CA-O 3.29Å; K845-L897 WeakPolarHBondContact CA-O 2.82Å; K845-F898 HydrophobicContact CB-CD1 3.91Å; K845-F898 HydrophobicContact CB-CE1 3.97Å; K845-F898 HydrophobicContact CD-CE1 3.77Å; K845-F898 HydrophobicContact CD-CZ 4.06Å; K845-F898 HydrophobicContact CG-CD1 4.44Å; K845-F898 HydrophobicContact CG-CE1 4.13Å
846	I	88.2	Confident	80.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.3	157.1	27.9	173.6	0	0	0	108.7	I800 N801 I802 I864 F878 E896 L897	I800-I846 HydrophobicContact CD1-CB 4.44Å; I800-I846 HydrophobicContact CD1-CD1 4.23Å; I800-I846 HydrophobicContact CD1-CG2 4.03Å; I800-I846 HydrophobicContact CG1-CB 4.38Å; I800-I846 HydrophobicContact CG1-CG2 4.09Å; N801-I846 CarbonylContact O-C 3.2Å; N801-I846 VanDerWaalsContact O-CA 3.27Å; N801-I846 WeakPolarHBondContact O-CA 3.37Å; I802-I846 HydrophobicContact CB-CG2 3.93Å; I802-I846 HydrophobicContact CG1-CG2 3.69Å; I802-I846 HydrophobicContact CG2-CG2 4.04Å; I846-I864 HydrophobicContact CD1-CB 3.99Å; I846-I864 HydrophobicContact CD1-CD1 3.63Å; I846-I864 HydrophobicContact CD1-CG1 4.42Å; I846-I864 HydrophobicContact CD1-CG2 3.87Å; I846-F878 HydrophobicContact CD1-CB 3.89Å; I846-F878 HydrophobicContact CD1-CD1 3.91Å; I846-F878 HydrophobicContact CD1-CD2 3.56Å; I846-F878 HydrophobicContact CD1-CE1 4.28Å; I846-F878 HydrophobicContact CD1-CE2 3.98Å; I846-F878 HydrophobicContact CD1-CG 3.52Å; I846-F878 HydrophobicContact CD1-CZ 4.32Å; I846-F878 HydrophobicContact CG1-CB 4.34Å; I846-F878 HydrophobicContact CG1-CD1 3.52Å; I846-F878 HydrophobicContact CG1-CD2 4.03Å; I846-F878 HydrophobicContact CG1-CE1 3.65Å; I846-F878 HydrophobicContact CG1-CE2 4.16Å; I846-F878 HydrophobicContact CG1-CG 3.72Å; I846-F878 HydrophobicContact CG1-CZ 3.98Å; I846-E896 WeakPolarHBondContact O-CA 3.43Å; I846-L897 HydrophobicContact CG1-CB 4.29Å; I846-L897 PolarHBondContact N-O 2.83Å; I846-L897 PolarHBondContact O-N 3.07Å
847	C	85.5	Confident	79.9	Confident	12 Å²	12	43.2 Å²	43.2	8%	0.081	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	139.1	160.6	-164.3	0	0	0	0	107.8	I800 N801 F803 V894 R895	I800-C847 CarbonylContact C-O 3.59Å; I800-C847 WeakPolarHBondContact CA-O 3.18Å; I800-C847 WeakPolarHBondContact CG1-O 3.38Å; N801-C847 HydrophobicContact CB-CB 4.38Å; N801-C847 PolarHBondContact N-O 3.29Å; N801-C847 PolarHBondContact O-N 3.16Å; F803-C847 HydrophobicContact CE2-CB 3.9Å; C847-V894 VanDerWaalsContact SG-CG1 3.56Å; C847-R895 WeakPolarHBondContact CA-O 3.28Å
848	I	90.8	Very high	79.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150.4	175.1	-168.4	168.2	0	0	0	109.5	I784 I798 F799 I800 W859 L861 I864 F884 V894 R895 L897	I784-I848 HydrophobicContact CD1-CD1 3.95Å; I798-I848 HydrophobicContact CG2-CD1 4.01Å; I798-I848 HydrophobicContact CG2-CG1 3.88Å; F799-I848 WeakPolarHBondContact O-CA 3.42Å; F799-I848 WeakPolarHBondContact O-CG1 3.16Å; I800-I848 HydrophobicContact CB-CG1 4.37Å; I800-I848 HydrophobicContact CD1-CD1 4.43Å; I800-I848 HydrophobicContact CG1-CB 4.28Å; I800-I848 HydrophobicContact CG1-CG1 4.41Å; I848-W859 HydrophobicContact CD1-CH2 3.64Å; I848-W859 HydrophobicContact CD1-CZ3 3.92Å; I848-W859 HydrophobicContact CG1-CH2 4.43Å; I848-W859 HydrophobicContact CG1-CZ3 4.23Å; I848-L861 HydrophobicContact CD1-CD2 4.46Å; I848-L861 HydrophobicContact CG2-CD2 4.01Å; I848-I864 HydrophobicContact CB-CD1 4.33Å; I848-I864 HydrophobicContact CD1-CD1 3.49Å; I848-I864 VanDerWaalsContact CD1-CD1 3.49Å; I848-I864 HydrophobicContact CD1-CG1 4.45Å; I848-I864 HydrophobicContact CG1-CD1 4.49Å; I848-I864 HydrophobicContact CG2-CD1 4.14Å; I848-F884 HydrophobicContact CG2-CE1 3.87Å; I848-F884 HydrophobicContact CG2-CZ 3.76Å; I848-F884 WeakPolarHBondContact O-CE1 3.48Å; I848-V894 CarbonylContact O-C 3.59Å; I848-V894 WeakPolarHBondContact O-CA 3.22Å; I848-R895 PolarHBondContact N-O 2.94Å; I848-R895 PolarHBondContact O-N 2.82Å; I848-L897 HydrophobicContact CG2-CD1 4.07Å
849	G	88.4	Confident	79.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-176.1	174.5	0	0	0	0	0	113.1	I798 F799 I893	I798-G849 CarbonylContact C-O 3.49Å; I798-G849 WeakPolarHBondContact CA-O 3.14Å; I798-G849 WeakPolarHBondContact CG2-O 3.32Å; F799-G849 VanDerWaalsContact CD1-O 3.23Å; F799-G849 WeakPolarHBondContact CD1-O 3.38Å; F799-G849 VanDerWaalsContact CE1-C 3.47Å; F799-G849 PolarHBondContact N-O 2.93Å; F799-G849 PolarHBondContact O-N 3.05Å; G849-I893 CarbonylContact C-O 2.93Å; G849-I893 WeakPolarHBondContact CA-O 3.38Å
850	H	86.8	Confident	79	Confident	3 Å²	3	43.4 Å²	43.4	1%	0.014	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	168.4	174.7	66.3	83.5	0	0	0	111.2	A796 N797 I798 E852 F884 I893	A796-H850 HydrophobicContact CB-CB 3.97Å; N797-H850 VanDerWaalsContact O-CA 3.28Å; N797-H850 WeakPolarHBondContact O-CA 3.44Å; N797-H850 WeakPolarHBondContact O-CB 3.46Å; I798-H850 HydrophobicContact CG1-CB 4.43Å; H850-E852 PolarHBondContact CE1-O 2.97Å; H850-E852 PolarHBondContact ND1-N 3.35Å; H850-E852 PolarHBondContact ND1-O 3.05Å; H850-F884 VanDerWaalsContact NE2-CB 3.29Å; H850-F884 WeakPolarHBondContact NE2-CB 3.42Å; H850-F884 PolarHBondContact NE2-O 3.32Å; H850-I893 WeakPolarHBondContact CE1-CG2 3.48Å; H850-I893 PolarHBondContact N-O 3.06Å
851	E	80	Confident	79	Confident	104 Å²	104	43.4 Å²	43.4	49%	0.486	24%	0.242	S	C	.	.	S	Bend	trans	-91.3	-21.6	-173.9	64.7	-175.6	167.4	0	0	115	N797 W813	N797-E851 HydrophobicContact CB-CG 4.33Å; N797-E851 WeakPolarHBondContact CB-OE1 3.48Å; N797-E851 PolarHBondContact ND2-OE1 2.77Å; N797-E851 PolarHBondContact O-N 3.48Å; W813-E851 HydrophobicContact CH2-CB 4.23Å; W813-E851 HydrophobicContact CZ3-CB 4.41Å
852	E	76.4	Confident	78.9	Confident	59 Å²	59	43 Å²	43	28%	0.276	24%	0.237	S	C	.	.			trans	-72.4	135.7	-174.9	-93.4	-67.7	171.9	0	0	112.8	A796 H850 S854 Y857 I893	A796-E852 HydrophobicContact CB-CB 3.95Å; A796-E852 HydrophobicContact CB-CG 4.14Å; H850-E852 PolarHBondContact CE1-O 2.97Å; H850-E852 PolarHBondContact ND1-N 3.35Å; H850-E852 PolarHBondContact ND1-O 3.05Å; E852-S854 PolarHBondContact OE2-OG 2.79Å; E852-Y857 HydrophobicContact CB-CD1 4.07Å; E852-Y857 HydrophobicContact CB-CD2 4.29Å; E852-Y857 HydrophobicContact CB-CG 3.81Å; E852-Y857 HydrophobicContact CG-CD1 3.68Å; E852-Y857 HydrophobicContact CG-CD2 4.23Å; E852-Y857 HydrophobicContact CG-CE1 3.88Å; E852-Y857 HydrophobicContact CG-CE2 4.43Å; E852-Y857 HydrophobicContact CG-CG 3.85Å; E852-I893 VanDerWaalsContact O-CD1 3.25Å; E852-I893 WeakPolarHBondContact O-CD1 3.23Å
853	R	67.6	Low	79.2	Confident	191 Å²	191	43.2 Å²	43.2	72%	0.721	23%	0.23	S	C	*	.			trans	-116.1	5	-176.8	-62.7	-174.1	179.4	-152.4	-0.9	112.9	I893	R853-I893 HydrophobicContact CG-CD1 3.79Å
854	S	66.1	Low	79.6	Confident	52 Å²	52	43 Å²	43	36%	0.364	23%	0.229	S	C	.	.	S	Bend	trans	-92	137.5	-175.7	-46.3	0	0	0	0	110	E852 G856	E852-S854 PolarHBondContact OE2-OG 2.79Å; S854-G856 PolarHBondContact O-N 3.36Å
855	P	57.6	Low	80.5	Confident	112 Å²	112	39.5 Å²	39.5	73%	0.727	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	133.5	173.5	-23.3	33.9	0	0	0	111.3
856	G	66.8	Low	81.1	Confident	71 Å²	71	38.5 Å²	38.5	73%	0.732	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	107.7	-1.1	177.6	0	0	0	0	0	115.8	S854 G858 D885	S854-G856 PolarHBondContact O-N 3.36Å; G856-G858 VanDerWaalsContact C-N 3.33Å; G856-D885 PolarHBondContact N-OD2 2.77Å
857	Y	74.6	Confident	81.2	Confident	78 Å²	78	39.4 Å²	39.4	31%	0.306	21%	0.212	S	C	.	.			trans	-94.3	10.1	171	-71.4	-96.1	0	0	0	112.9	T794 N795 A796 E852	T794-Y857 WeakPolarHBondContact CB-O 3.31Å; T794-Y857 PolarHBondContact OG1-O 2.72Å; N795-Y857 WeakPolarHBondContact OD1-CD1 3.25Å; N795-Y857 WeakPolarHBondContact OD1-CE1 3.29Å; A796-Y857 HydrophobicContact CB-CD1 4.29Å; E852-Y857 HydrophobicContact CB-CD1 4.07Å; E852-Y857 HydrophobicContact CB-CD2 4.29Å; E852-Y857 HydrophobicContact CB-CG 3.81Å; E852-Y857 HydrophobicContact CG-CD1 3.68Å; E852-Y857 HydrophobicContact CG-CD2 4.23Å; E852-Y857 HydrophobicContact CG-CE1 3.88Å; E852-Y857 HydrophobicContact CG-CE2 4.43Å; E852-Y857 HydrophobicContact CG-CG 3.85Å
858	G	75.2	Confident	81.3	Confident	6 Å²	6	39.2 Å²	39.2	6%	0.062	21%	0.21	C	C	.	.			trans	-56.3	132.5	-169.2	0	0	0	0	0	115.4	G856 F884 D885	G856-G858 VanDerWaalsContact C-N 3.33Å; G858-F884 WeakPolarHBondContact CA-O 3.44Å; G858-D885 WeakPolarHBondContact CA-OD2 3.38Å; G858-D885 PolarHBondContact N-OD2 2.63Å
859	W	88.9	Confident	81.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.1	-178.5	-178.9	48.9	0	0	0	111.8	I784 T786 S792 T794 I798 F825 I848 L861 W883 F884	I784-W859 HydrophobicContact CG2-CH2 3.79Å; I784-W859 HydrophobicContact CG2-CZ2 3.54Å; T786-W859 PolarHBondContact OG1-NE1 3.49Å; S792-W859 WeakPolarHBondContact O-CA 3.34Å; T794-W859 HydrophobicContact CG2-CB 3.68Å; T794-W859 HydrophobicContact CG2-CD2 4.35Å; T794-W859 HydrophobicContact CG2-CG 3.63Å; I798-W859 HydrophobicContact CD1-CD2 3.79Å; I798-W859 HydrophobicContact CD1-CE3 3.83Å; I798-W859 HydrophobicContact CD1-CG 4.49Å; I798-W859 HydrophobicContact CD1-CH2 3.71Å; I798-W859 HydrophobicContact CD1-CZ2 3.68Å; I798-W859 HydrophobicContact CD1-CZ3 3.8Å; I798-W859 HydrophobicContact CG2-CH2 4.36Å; I798-W859 HydrophobicContact CG2-CZ3 4.34Å; F825-W859 HydrophobicContact CD1-CZ2 4.17Å; I848-W859 HydrophobicContact CD1-CH2 3.64Å; I848-W859 HydrophobicContact CD1-CZ3 3.92Å; I848-W859 HydrophobicContact CG1-CH2 4.43Å; I848-W859 HydrophobicContact CG1-CZ3 4.23Å; W859-L861 HydrophobicContact CD2-CB 4.31Å; W859-L861 HydrophobicContact CE3-CB 4.15Å; W859-L861 HydrophobicContact CH2-CB 3.98Å; W859-L861 HydrophobicContact CH2-CD1 3.68Å; W859-L861 HydrophobicContact CH2-CD2 3.94Å; W859-L861 HydrophobicContact CH2-CG 4.07Å; W859-L861 HydrophobicContact CZ2-CB 4.11Å; W859-L861 HydrophobicContact CZ2-CD1 3.75Å; W859-L861 HydrophobicContact CZ2-CG 4.38Å; W859-L861 HydrophobicContact CZ3-CB 3.98Å; W859-L861 HydrophobicContact CZ3-CD1 4.47Å; W859-L861 HydrophobicContact CZ3-CD2 4.02Å; W859-L861 HydrophobicContact CZ3-CG 4.37Å; W859-W883 CarbonylContact O-C 3.39Å; W859-W883 WeakPolarHBondContact O-CA 3.37Å; W859-F884 HydrophobicContact CB-CB 4.28Å; W859-F884 HydrophobicContact CE3-CB 4.28Å; W859-F884 HydrophobicContact CE3-CD1 4.32Å; W859-F884 HydrophobicContact CE3-CD2 4.04Å; W859-F884 HydrophobicContact CE3-CE2 4.44Å; W859-F884 AromaticContact CE3-CG 3.99Å; W859-F884 HydrophobicContact CE3-CG 3.99Å; W859-F884 HydrophobicContact CZ3-CE2 4.5Å; W859-F884 HydrophobicContact CZ3-CZ 4.47Å; W859-F884 PolarHBondContact N-O 2.93Å; W859-F884 PolarHBondContact O-N 3.27Å
860	Y	86.1	Confident	81	Confident	38 Å²	38	48.8 Å²	48.8	15%	0.149	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	94.9	174.9	-167.9	-82.5	0	0	0	110.4	G787 K789 S792 A862 Y881 R882 W883	G787-Y860 PolarHBondContact N-O 3.12Å; K789-Y860 HydrophobicContact CB-CG 4.33Å; K789-Y860 HydrophobicContact CG-CD1 4.06Å; K789-Y860 HydrophobicContact CG-CD2 3.89Å; K789-Y860 HydrophobicContact CG-CE1 4.05Å; K789-Y860 HydrophobicContact CG-CE2 3.86Å; K789-Y860 HydrophobicContact CG-CG 3.96Å; S792-Y860 PolarHBondContact O-N 2.99Å; Y860-A862 PolarHBondContact O-N 2.89Å; Y860-Y881 VanDerWaalsContact CZ-C 3.5Å; Y860-Y881 PolarHBondContact OH-O 3.15Å; Y860-Y881 VanDerWaalsContact OH-O 3.06Å; Y860-R882 WeakPolarHBondContact CA-O 3.42Å; Y860-W883 AromaticContact CD2-CD1 3.93Å; Y860-W883 AromaticContact CD2-CD2 3.79Å; Y860-W883 HydrophobicContact CD2-CD2 3.79Å; Y860-W883 AromaticContact CD2-CE2 3.86Å; Y860-W883 HydrophobicContact CD2-CE3 4.42Å; Y860-W883 AromaticContact CD2-CG 3.83Å; Y860-W883 HydrophobicContact CD2-CG 3.83Å; Y860-W883 AromaticContact CD2-NE1 3.98Å; Y860-W883 HydrophobicContact CG-CD2 4.42Å
861	L	85.9	Confident	80.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122.9	175.5	174.1	60.2	0	0	0	110.1	I784 I848 W859 I864 C880 Y881 R882 F884 L897	I784-L861 HydrophobicContact CG2-CD1 3.77Å; I848-L861 HydrophobicContact CD1-CD2 4.46Å; I848-L861 HydrophobicContact CG2-CD2 4.01Å; W859-L861 HydrophobicContact CD2-CB 4.31Å; W859-L861 HydrophobicContact CE3-CB 4.15Å; W859-L861 HydrophobicContact CH2-CB 3.98Å; W859-L861 HydrophobicContact CH2-CD1 3.68Å; W859-L861 HydrophobicContact CH2-CD2 3.94Å; W859-L861 HydrophobicContact CH2-CG 4.07Å; W859-L861 HydrophobicContact CZ2-CB 4.11Å; W859-L861 HydrophobicContact CZ2-CD1 3.75Å; W859-L861 HydrophobicContact CZ2-CG 4.38Å; W859-L861 HydrophobicContact CZ3-CB 3.98Å; W859-L861 HydrophobicContact CZ3-CD1 4.47Å; W859-L861 HydrophobicContact CZ3-CD2 4.02Å; W859-L861 HydrophobicContact CZ3-CG 4.37Å; L861-I864 HydrophobicContact CD1-CG1 4.02Å; L861-I864 HydrophobicContact CD2-CD1 4.02Å; L861-I864 HydrophobicContact CD2-CG1 4.13Å; L861-C880 HydrophobicContact CB-CB 4.42Å; L861-C880 HydrophobicContact CD2-CB 3.92Å; L861-C880 HydrophobicContact CG-CB 3.89Å; L861-Y881 VanDerWaalsContact O-CA 3.29Å; L861-Y881 WeakPolarHBondContact O-CA 3.44Å; L861-Y881 PolarHBondContact O-N 2.76Å; L861-R882 PolarHBondContact N-O 3.17Å; L861-R882 VanDerWaalsContact N-O 3.08Å; L861-R882 PolarHBondContact O-N 2.97Å; L861-R882 VanDerWaalsContact O-N 3.16Å; L861-F884 HydrophobicContact CB-CD2 4.15Å; L861-F884 HydrophobicContact CB-CE2 3.67Å; L861-F884 HydrophobicContact CB-CZ 4.47Å; L861-F884 HydrophobicContact CD2-CE2 3.87Å; L861-F884 HydrophobicContact CD2-CZ 3.86Å; L861-F884 HydrophobicContact CG-CE2 4.39Å; L861-L897 HydrophobicContact CD2-CD1 3.95Å
862	A	79.8	Confident	80.7	Confident	12 Å²	12	51.7 Å²	51.7	10%	0.099	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-61.4	171.5	0	0	0	0	0	110.8	F785 Y860 C880 Y881	F785-A862 HydrophobicContact CB-CB 4.45Å; F785-A862 WeakPolarHBondContact O-CB 3.5Å; F785-A862 PolarHBondContact O-N 2.96Å; Y860-A862 PolarHBondContact O-N 2.89Å; A862-C880 PolarHBondContact O-N 2.76Å; A862-Y881 HydrophobicContact CB-CD1 3.98Å; A862-Y881 HydrophobicContact CB-CE1 3.89Å; A862-Y881 PolarHBondContact O-N 3.12Å
863	K	84.8	Confident	80.7	Confident	64 Å²	64	57.5 Å²	57.5	28%	0.278	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	163.5	-178.3	64.8	-172.9	174.7	-165.4	0	112.7	F785 T877 F878 E879	F785-K863 HydrophobicContact CB-CG 4Å; F785-K863 HydrophobicContact CD2-CG 3.89Å; F785-K863 HydrophobicContact CG-CG 4.08Å; F785-K863 PolarHBondContact N-O 2.9Å; F785-K863 PolarHBondContact O-N 2.93Å; K863-T877 HydrophobicContact CB-CG2 4.43Å; K863-T877 HydrophobicContact CD-CG2 4.1Å; K863-F878 CarbonylContact C-O 3.59Å; K863-F878 VanDerWaalsContact CA-O 3.3Å; K863-F878 WeakPolarHBondContact CA-O 3.47Å; K863-E879 HydrophobicContact CB-CG 4.28Å
864	I	91.3	Very high	81.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.9	170.8	-56	170	0	0	0	108.5	I782 Q783 I784 I800 I846 I848 L861 T877 F878 L897	I782-I864 HydrophobicContact CG2-CG2 3.65Å; Q783-I864 CarbonylContact O-C 3.51Å; Q783-I864 WeakPolarHBondContact O-CA 3.21Å; I784-I864 HydrophobicContact CG1-CG1 4.39Å; I784-I864 HydrophobicContact CG1-CG2 4.37Å; I800-I864 HydrophobicContact CD1-CD1 4.27Å; I846-I864 HydrophobicContact CD1-CB 3.99Å; I846-I864 HydrophobicContact CD1-CD1 3.63Å; I846-I864 HydrophobicContact CD1-CG1 4.42Å; I846-I864 HydrophobicContact CD1-CG2 3.87Å; I848-I864 HydrophobicContact CB-CD1 4.33Å; I848-I864 HydrophobicContact CD1-CD1 3.49Å; I848-I864 VanDerWaalsContact CD1-CD1 3.49Å; I848-I864 HydrophobicContact CD1-CG1 4.45Å; I848-I864 HydrophobicContact CG1-CD1 4.49Å; I848-I864 HydrophobicContact CG2-CD1 4.14Å; L861-I864 HydrophobicContact CD1-CG1 4.02Å; L861-I864 HydrophobicContact CD2-CD1 4.02Å; L861-I864 HydrophobicContact CD2-CG1 4.13Å; I864-T877 CarbonylContact O-C 3.58Å; I864-T877 WeakPolarHBondContact O-CA 3.37Å; I864-F878 HydrophobicContact CB-CB 4.38Å; I864-F878 PolarHBondContact N-O 2.92Å; I864-F878 PolarHBondContact O-N 2.96Å; I864-L897 HydrophobicContact CD1-CD1 3.93Å
865	V	89.8	Confident	82.2	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.042	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.7	173.7	169.9	0	0	0	0	108.6	Q783 F785 K875 L876 T877	Q783-V865 HydrophobicContact CB-CB 4.16Å; Q783-V865 PolarHBondContact N-O 2.8Å; Q783-V865 PolarHBondContact O-N 2.95Å; F785-V865 HydrophobicContact CE2-CB 4.26Å; F785-V865 HydrophobicContact CE2-CG2 3.88Å; V865-K875 HydrophobicContact CG1-CD 4.28Å; V865-K875 HydrophobicContact CG1-CG 4.11Å; V865-L876 CarbonylContact C-O 3.56Å; V865-L876 WeakPolarHBondContact CA-O 3.35Å; V865-T877 HydrophobicContact CG2-CG2 4.05Å
866	L	92.6	Very high	83.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.8	-179.8	-179.8	156.1	0	0	0	109.6	Y780 I781 I782 I802 I843 I868 Y874 K875 L876 F878	Y780-L866 HydrophobicContact CD1-CD2 4.34Å; I781-L866 CarbonylContact O-C 3.6Å; I781-L866 WeakPolarHBondContact O-CA 3.45Å; I782-L866 HydrophobicContact CD1-CB 3.98Å; I782-L866 HydrophobicContact CD1-CD1 3.64Å; I782-L866 HydrophobicContact CD1-CG 3.69Å; I802-L866 HydrophobicContact CD1-CD1 4.21Å; I802-L866 HydrophobicContact CG1-CD1 4.41Å; I802-L866 HydrophobicContact CG2-CD1 3.82Å; I843-L866 HydrophobicContact CG1-CD2 4.3Å; I843-L866 HydrophobicContact CG2-CD1 4.21Å; L866-I868 HydrophobicContact CD2-CG1 4.47Å; L866-Y874 HydrophobicContact CD2-CE1 4.44Å; L866-K875 CarbonylContact O-C 3.56Å; L866-K875 WeakPolarHBondContact O-CA 3.39Å; L866-L876 PolarHBondContact N-O 3.04Å; L866-L876 PolarHBondContact O-N 2.93Å; L866-F878 HydrophobicContact CB-CE2 4Å; L866-F878 HydrophobicContact CD1-CE2 4.4Å
867	T	89.6	Confident	84	Confident	18 Å²	18	50.2 Å²	50.2	11%	0.11	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.7	177.4	-38.6	0	0	0	0	110	I781 Y874 K875	I781-T867 PolarHBondContact N-O 3.4Å; I781-T867 PolarHBondContact O-N 2.66Å; T867-Y874 WeakPolarHBondContact CA-O 3.47Å; T867-K875 HydrophobicContact CG2-CB 4.49Å
868	I	88.6	Confident	84.3	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.041	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123	176	-59.9	176.9	0	0	0	109.2	Y778 Y780 L866 E870 N871 P872 Y874	Y778-I868 HydrophobicContact CD2-CD1 4.45Å; Y778-I868 HydrophobicContact CD2-CG2 3.69Å; Y778-I868 HydrophobicContact CE2-CG2 4.1Å; Y778-I868 HydrophobicContact CG-CG2 4.23Å; Y780-I868 HydrophobicContact CD1-CD1 4.48Å; Y780-I868 HydrophobicContact CD1-CG1 3.95Å; Y780-I868 HydrophobicContact CE1-CD1 3.92Å; Y780-I868 HydrophobicContact CE1-CG1 3.87Å; L866-I868 HydrophobicContact CD2-CG1 4.47Å; I868-E870 VanDerWaalsContact C-N 3.3Å; I868-E870 HydrophobicContact CG2-CB 4.28Å; I868-E870 PolarHBondContact O-N 3.44Å; I868-N871 HydrophobicContact CB-CB 4.45Å; I868-N871 HydrophobicContact CG2-CB 4.35Å; I868-N871 CarbonylContact O-C 3.54Å; I868-N871 PolarHBondContact O-N 2.92Å; I868-N871 VanDerWaalsContact O-O 3.14Å; I868-P872 WeakPolarHBondContact O-CA 3.29Å; I868-P872 VanDerWaalsContact O-N 3.12Å; I868-Y874 HydrophobicContact CD1-CD1 3.47Å; I868-Y874 VanDerWaalsContact CD1-CD1 3.47Å; I868-Y874 HydrophobicContact CD1-CE1 3.95Å; I868-Y874 HydrophobicContact CD1-CG 3.97Å; I868-Y874 HydrophobicContact CG1-CD1 3.84Å; I868-Y874 HydrophobicContact CG1-CG 4.5Å; I868-Y874 PolarHBondContact N-O 2.91Å
869	K	85.5	Confident	84.2	Confident	122 Å²	122	50.9 Å²	50.9	53%	0.53	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-38.9	-177.7	-169.9	-178	-179.6	-178.2	0	112.5	H779 I781 N871	H779-K869 HydrophobicContact CB-CB 3.79Å; H779-K869 HydrophobicContact CB-CD 3.71Å; H779-K869 HydrophobicContact CB-CG 4.44Å; H779-K869 WeakPolarHBondContact O-CB 3.4Å; H779-K869 PolarHBondContact O-N 2.97Å; I781-K869 HydrophobicContact CD1-CB 4.13Å; I781-K869 HydrophobicContact CD1-CG 4.38Å; I781-K869 HydrophobicContact CG1-CB 4.33Å; K869-N871 VanDerWaalsContact C-N 3.26Å; K869-N871 PolarHBondContact O-N 2.82Å
870	E	88	Confident	83.7	Confident	80 Å²	80	51.7 Å²	51.7	37%	0.374	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.4	177.6	-63	68.5	-145.7	0	0	113	Y778 H779 I868	Y778-E870 WeakPolarHBondContact CA-OE2 3.44Å; Y778-E870 HydrophobicContact CD1-CB 4.15Å; Y778-E870 HydrophobicContact CD1-CG 3.86Å; Y778-E870 HydrophobicContact CE1-CB 4.03Å; Y778-E870 HydrophobicContact CE1-CG 4.1Å; Y778-E870 HydrophobicContact CG-CG 4.5Å; H779-E870 IonicContact CE1-OE1 3.82Å; H779-E870 IonicContact CG-OE1 2.76Å; H779-E870 PolarHBondContact N-OE1 3.03Å; H779-E870 PolarHBondContact N-OE2 3.36Å; H779-E870 IonicContact ND1-OE1 3.09Å; H779-E870 PolarHBondContact ND1-OE1 3.19Å; I868-E870 VanDerWaalsContact C-N 3.3Å; I868-E870 HydrophobicContact CG2-CB 4.28Å; I868-E870 PolarHBondContact O-N 3.44Å
871	N	81.7	Confident	83.3	Confident	72 Å²	72	54.8 Å²	54.8	39%	0.385	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	74.2	177.9	-177.2	12.2	0	0	0	110.4	I868 K869 K873 Y874	I868-N871 HydrophobicContact CB-CB 4.45Å; I868-N871 HydrophobicContact CG2-CB 4.35Å; I868-N871 CarbonylContact O-C 3.54Å; I868-N871 PolarHBondContact O-N 2.92Å; I868-N871 VanDerWaalsContact O-O 3.14Å; K869-N871 VanDerWaalsContact C-N 3.26Å; K869-N871 PolarHBondContact O-N 2.82Å; N871-K873 PolarHBondContact O-N 2.9Å; N871-Y874 WeakPolarHBondContact O-CB 3.42Å; N871-Y874 PolarHBondContact O-N 2.84Å
872	P	78.8	Confident	83	Confident	96 Å²	96	59.2 Å²	59.2	62%	0.623	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	-2.3	-172.4	26.7	-35.3	0	0	0	114.4	I868 Y874	I868-P872 WeakPolarHBondContact O-CA 3.29Å; I868-P872 VanDerWaalsContact O-N 3.12Å; P872-Y874 VanDerWaalsContact C-N 3.34Å
873	K	76	Confident	83	Confident	181 Å²	181	60.5 Å²	60.5	79%	0.787	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	-17.2	166.9	-66.8	-171.3	175.5	-172.2	0	112.9	N871 K875	N871-K873 PolarHBondContact O-N 2.9Å; K873-K875 PolarHBondContact O-N 3.13Å
874	Y	80.8	Confident	83.1	Confident	60 Å²	60	57.5 Å²	57.5	24%	0.235	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	96.8	173.3	-166.3	-86.4	0	0	0	108.9	I843 L866 T867 I868 N871 P872 L876	I843-Y874 HydrophobicContact CB-CE1 4.48Å; I843-Y874 HydrophobicContact CG1-CE1 4.05Å; I843-Y874 PolarHBondContact N-OH 3.23Å; L866-Y874 HydrophobicContact CD2-CE1 4.44Å; T867-Y874 WeakPolarHBondContact CA-O 3.47Å; I868-Y874 HydrophobicContact CD1-CD1 3.47Å; I868-Y874 VanDerWaalsContact CD1-CD1 3.47Å; I868-Y874 HydrophobicContact CD1-CE1 3.95Å; I868-Y874 HydrophobicContact CD1-CG 3.97Å; I868-Y874 HydrophobicContact CG1-CD1 3.84Å; I868-Y874 HydrophobicContact CG1-CG 4.5Å; I868-Y874 PolarHBondContact N-O 2.91Å; N871-Y874 WeakPolarHBondContact O-CB 3.42Å; N871-Y874 PolarHBondContact O-N 2.84Å; P872-Y874 VanDerWaalsContact C-N 3.34Å; Y874-L876 HydrophobicContact CE1-CD1 3.77Å; Y874-L876 HydrophobicContact CE1-CG 4.07Å
875	K	83.9	Confident	82.5	Confident	126 Å²	126	58 Å²	58	55%	0.548	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.1	178.4	-171.5	175.1	-173.3	172.8	0	109.3	V865 L866 T867 K873	V865-K875 HydrophobicContact CG1-CD 4.28Å; V865-K875 HydrophobicContact CG1-CG 4.11Å; L866-K875 CarbonylContact O-C 3.56Å; L866-K875 WeakPolarHBondContact O-CA 3.39Å; T867-K875 HydrophobicContact CG2-CB 4.49Å; K873-K875 PolarHBondContact O-N 3.13Å
876	L	81.4	Confident	81.5	Confident	25 Å²	25	60.6 Å²	60.6	13%	0.131	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	149	175.4	-69.1	174.2	0	0	0	109.8	I843 V865 L866 Y874 F878 A899	I843-L876 HydrophobicContact CB-CD1 3.75Å; I843-L876 HydrophobicContact CG2-CD1 4.2Å; V865-L876 CarbonylContact C-O 3.56Å; V865-L876 WeakPolarHBondContact CA-O 3.35Å; L866-L876 PolarHBondContact N-O 3.04Å; L866-L876 PolarHBondContact O-N 2.93Å; Y874-L876 HydrophobicContact CE1-CD1 3.77Å; Y874-L876 HydrophobicContact CE1-CG 4.07Å; L876-F878 HydrophobicContact CB-CD2 4.42Å; L876-F878 HydrophobicContact CB-CE2 3.72Å; L876-F878 HydrophobicContact CB-CZ 4.27Å; L876-F878 HydrophobicContact CD1-CE2 4.28Å; L876-F878 HydrophobicContact CD1-CZ 4.08Å; L876-A899 HydrophobicContact CD1-CB 4.06Å; L876-A899 HydrophobicContact CD2-CB 4.4Å
877	T	80.5	Confident	80.3	Confident	62 Å²	62	63.6 Å²	63.6	38%	0.38	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.5	172.5	-53.8	0	0	0	0	108.2	K863 I864 V865 E879	K863-T877 HydrophobicContact CB-CG2 4.43Å; K863-T877 HydrophobicContact CD-CG2 4.1Å; I864-T877 CarbonylContact O-C 3.58Å; I864-T877 WeakPolarHBondContact O-CA 3.37Å; V865-T877 HydrophobicContact CG2-CG2 4.05Å; T877-E879 HydrophobicContact CG2-CG 4.06Å
878	F	80.5	Confident	79.3	Confident	1 Å²	1	67.5 Å²	67.5	0%	0.004	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	101.8	178.8	-61.9	-100.4	0	0	0	107.3	I843 I846 K863 I864 L866 L876 L897 F898 A899	I843-F878 HydrophobicContact CG2-CZ 3.95Å; I846-F878 HydrophobicContact CD1-CB 3.89Å; I846-F878 HydrophobicContact CD1-CD1 3.91Å; I846-F878 HydrophobicContact CD1-CD2 3.56Å; I846-F878 HydrophobicContact CD1-CE1 4.28Å; I846-F878 HydrophobicContact CD1-CE2 3.98Å; I846-F878 HydrophobicContact CD1-CG 3.52Å; I846-F878 HydrophobicContact CD1-CZ 4.32Å; I846-F878 HydrophobicContact CG1-CB 4.34Å; I846-F878 HydrophobicContact CG1-CD1 3.52Å; I846-F878 HydrophobicContact CG1-CD2 4.03Å; I846-F878 HydrophobicContact CG1-CE1 3.65Å; I846-F878 HydrophobicContact CG1-CE2 4.16Å; I846-F878 HydrophobicContact CG1-CG 3.72Å; I846-F878 HydrophobicContact CG1-CZ 3.98Å; K863-F878 CarbonylContact C-O 3.59Å; K863-F878 VanDerWaalsContact CA-O 3.3Å; K863-F878 WeakPolarHBondContact CA-O 3.47Å; I864-F878 HydrophobicContact CB-CB 4.38Å; I864-F878 PolarHBondContact N-O 2.92Å; I864-F878 PolarHBondContact O-N 2.96Å; L866-F878 HydrophobicContact CB-CE2 4Å; L866-F878 HydrophobicContact CD1-CE2 4.4Å; L876-F878 HydrophobicContact CB-CD2 4.42Å; L876-F878 HydrophobicContact CB-CE2 3.72Å; L876-F878 HydrophobicContact CB-CZ 4.27Å; L876-F878 HydrophobicContact CD1-CE2 4.28Å; L876-F878 HydrophobicContact CD1-CZ 4.08Å; F878-L897 HydrophobicContact CB-CB 4.11Å; F878-L897 HydrophobicContact CB-CD1 4.43Å; F878-L897 HydrophobicContact CD1-CB 4.23Å; F878-F898 VanDerWaalsContact CD1-C 3.46Å; F878-F898 WeakPolarHBondContact CD1-O 3.36Å; F878-A899 VanDerWaalsContact CE1-CA 3.41Å; F878-A899 HydrophobicContact CE1-CB 3.68Å; F878-A899 VanDerWaalsContact CE1-N 3.33Å; F878-A899 HydrophobicContact CZ-CB 3.86Å
879	E	73.5	Confident	78.1	Confident	97 Å²	97	70.6 Å²	70.6	45%	0.453	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	146.6	-179.5	-57.5	-154.6	126	0	0	111.2	K863 T877 Y881	K863-E879 HydrophobicContact CB-CG 4.28Å; T877-E879 HydrophobicContact CG2-CG 4.06Å; E879-Y881 HydrophobicContact CB-CD2 4.17Å; E879-Y881 HydrophobicContact CB-CE2 3.7Å; E879-Y881 VanDerWaalsContact CD-CE2 3.49Å; E879-Y881 HydrophobicContact CG-CE2 4.08Å; E879-Y881 PolarHBondContact OE1-OH 2.8Å; E879-Y881 WeakPolarHBondContact OE2-CE2 3.41Å
880	C	77.7	Confident	77	Confident	16 Å²	16	66.4 Å²	66.4	11%	0.108	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	-52.3	-175.3	-169.7	0	0	0	0	112.5	L861 A862 R882 L897	L861-C880 HydrophobicContact CB-CB 4.42Å; L861-C880 HydrophobicContact CD2-CB 3.92Å; L861-C880 HydrophobicContact CG-CB 3.89Å; A862-C880 PolarHBondContact O-N 2.76Å; C880-R882 VanDerWaalsContact C-N 3.29Å; C880-R882 WeakPolarHBondContact O-CG 3.44Å; C880-R882 PolarHBondContact O-N 3.18Å; C880-L897 HydrophobicContact CB-CD1 4.06Å; C880-L897 HydrophobicContact CB-CD2 3.93Å
881	Y	78.5	Confident	75.8	Confident	104 Å²	104	64.2 Å²	64.2	41%	0.408	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.2	45.9	179.9	-56.4	-64.2	0	0	0	114.4	Y860 L861 A862 E879	Y860-Y881 VanDerWaalsContact CZ-C 3.5Å; Y860-Y881 PolarHBondContact OH-O 3.15Å; Y860-Y881 VanDerWaalsContact OH-O 3.06Å; L861-Y881 VanDerWaalsContact O-CA 3.29Å; L861-Y881 WeakPolarHBondContact O-CA 3.44Å; L861-Y881 PolarHBondContact O-N 2.76Å; A862-Y881 HydrophobicContact CB-CD1 3.98Å; A862-Y881 HydrophobicContact CB-CE1 3.89Å; A862-Y881 PolarHBondContact O-N 3.12Å; E879-Y881 HydrophobicContact CB-CD2 4.17Å; E879-Y881 HydrophobicContact CB-CE2 3.7Å; E879-Y881 VanDerWaalsContact CD-CE2 3.49Å; E879-Y881 HydrophobicContact CG-CE2 4.08Å; E879-Y881 PolarHBondContact OE1-OH 2.8Å; E879-Y881 WeakPolarHBondContact OE2-CE2 3.41Å
882	R	78.9	Confident	75.2	Confident	92 Å²	92	64.4 Å²	64.4	35%	0.347	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.9	-172.3	-81.3	174.5	163.2	-112.8	0.1	113.4	Y860 L861 C880 D889 D890	Y860-R882 WeakPolarHBondContact CA-O 3.42Å; L861-R882 PolarHBondContact N-O 3.17Å; L861-R882 VanDerWaalsContact N-O 3.08Å; L861-R882 PolarHBondContact O-N 2.97Å; L861-R882 VanDerWaalsContact O-N 3.16Å; C880-R882 VanDerWaalsContact C-N 3.29Å; C880-R882 WeakPolarHBondContact O-CG 3.44Å; C880-R882 PolarHBondContact O-N 3.18Å; R882-D889 WeakPolarHBondContact CD-OD2 3.43Å; R882-D889 VanDerWaalsContact CG-OD2 3.29Å; R882-D889 WeakPolarHBondContact CG-OD2 3.44Å; R882-D889 IonicContact CZ-OD1 3.07Å; R882-D889 IonicContact CZ-OD2 3.18Å; R882-D889 IonicContact NE-OD2 3.59Å; R882-D889 IonicContact NH1-OD1 2.74Å; R882-D889 PolarHBondContact NH1-OD1 2.7Å; R882-D889 IonicContact NH1-OD2 2.69Å; R882-D889 PolarHBondContact NH1-OD2 3Å; R882-D890 IonicContact CZ-OD2 3.49Å; R882-D890 IonicContact NH1-OD1 3.45Å; R882-D890 IonicContact NH1-OD2 2.68Å; R882-D890 PolarHBondContact NH1-OD2 3.46Å
883	W	81.7	Confident	75.4	Confident	40 Å²	40	60.9 Å²	60.9	15%	0.152	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	150.2	170.3	-71.6	115.3	0	0	0	112.4	K789 N791 W859 Y860 E888 D889 R895	K789-W883 HydrophobicContact CB-CZ2 4.34Å; N791-W883 WeakPolarHBondContact O-CH2 3.38Å; N791-W883 WeakPolarHBondContact O-CZ3 3.39Å; W859-W883 CarbonylContact O-C 3.39Å; W859-W883 WeakPolarHBondContact O-CA 3.37Å; Y860-W883 AromaticContact CD2-CD1 3.93Å; Y860-W883 AromaticContact CD2-CD2 3.79Å; Y860-W883 HydrophobicContact CD2-CD2 3.79Å; Y860-W883 AromaticContact CD2-CE2 3.86Å; Y860-W883 HydrophobicContact CD2-CE3 4.42Å; Y860-W883 AromaticContact CD2-CG 3.83Å; Y860-W883 HydrophobicContact CD2-CG 3.83Å; Y860-W883 AromaticContact CD2-NE1 3.98Å; Y860-W883 HydrophobicContact CG-CD2 4.42Å; W883-E888 HydrophobicContact CB-CB 3.82Å; W883-E888 HydrophobicContact CD2-CB 4.15Å; W883-E888 HydrophobicContact CD2-CG 4.38Å; W883-E888 HydrophobicContact CG-CB 3.66Å; W883-E888 HydrophobicContact CG-CG 4.35Å; W883-E888 PolarHBondContact NE1-OE2 3.03Å; W883-D889 HydrophobicContact CB-CB 4.04Å; W883-R895 PolarHBondContact O-NE 3.22Å; W883-R895 PolarHBondContact O-NH2 3.4Å
884	F	85.7	Confident	75.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	84.6	164.4	-70.3	-120.7	0	0	0	105.1	I848 H850 G858 W859 L861 R895	I848-F884 HydrophobicContact CG2-CE1 3.87Å; I848-F884 HydrophobicContact CG2-CZ 3.76Å; I848-F884 WeakPolarHBondContact O-CE1 3.48Å; H850-F884 VanDerWaalsContact NE2-CB 3.29Å; H850-F884 WeakPolarHBondContact NE2-CB 3.42Å; H850-F884 PolarHBondContact NE2-O 3.32Å; G858-F884 WeakPolarHBondContact CA-O 3.44Å; W859-F884 HydrophobicContact CB-CB 4.28Å; W859-F884 HydrophobicContact CE3-CB 4.28Å; W859-F884 HydrophobicContact CE3-CD1 4.32Å; W859-F884 HydrophobicContact CE3-CD2 4.04Å; W859-F884 HydrophobicContact CE3-CE2 4.44Å; W859-F884 AromaticContact CE3-CG 3.99Å; W859-F884 HydrophobicContact CE3-CG 3.99Å; W859-F884 HydrophobicContact CZ3-CE2 4.5Å; W859-F884 HydrophobicContact CZ3-CZ 4.47Å; W859-F884 PolarHBondContact N-O 2.93Å; W859-F884 PolarHBondContact O-N 3.27Å; L861-F884 HydrophobicContact CB-CD2 4.15Å; L861-F884 HydrophobicContact CB-CE2 3.67Å; L861-F884 HydrophobicContact CB-CZ 4.47Å; L861-F884 HydrophobicContact CD2-CE2 3.87Å; L861-F884 HydrophobicContact CD2-CZ 3.86Å; L861-F884 HydrophobicContact CG-CE2 4.39Å; F884-R895 HydrophobicContact CD1-CG 4.23Å; F884-R895 HydrophobicContact CE1-CB 3.76Å; F884-R895 HydrophobicContact CE1-CG 3.6Å; F884-R895 HydrophobicContact CE2-CG 4.12Å; F884-R895 HydrophobicContact CZ-CB 3.65Å; F884-R895 VanDerWaalsContact CZ-CD 3.48Å; F884-R895 HydrophobicContact CZ-CG 3.54Å
885	D	78.4	Confident	75.5	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.064	27%	0.274	C	S	.	.	S	Bend	trans	-142.3	167.9	172.5	-163.1	-67.3	0	0	0	106.5	G856 G858 G887 E888 G891 Q892	G856-D885 PolarHBondContact N-OD2 2.77Å; G858-D885 WeakPolarHBondContact CA-OD2 3.38Å; G858-D885 PolarHBondContact N-OD2 2.63Å; D885-G887 PolarHBondContact OD1-N 3.14Å; D885-E888 HydrophobicContact CB-CB 4.01Å; D885-G891 CarbonylContact O-C 3.55Å; D885-G891 WeakPolarHBondContact O-CA 3.38Å; D885-Q892 PolarHBondContact O-N 2.75Å
886	V	68.9	Low	75.2	Confident	60 Å²	60	47.3 Å²	47.3	36%	0.364	26%	0.255	S	S	.	.	S	Bend	trans	-84.4	-26.8	172.5	-174.9	0	0	0	0	111.2	G891 I893	V886-G891 WeakPolarHBondContact O-CA 3.09Å; V886-I893 HydrophobicContact CG2-CG2 3.84Å
887	G	67.9	Low	74.9	Confident	64 Å²	64	46.9 Å²	46.9	66%	0.66	25%	0.252	S	S	*	.	S	Bend	trans	-100.8	-8.8	-179.3	0	0	0	0	0	116.8	D885	D885-G887 PolarHBondContact OD1-N 3.14Å
888	E	67.8	Low	74.4	Confident	100 Å²	100	45.5 Å²	45.5	47%	0.467	24%	0.241	S	C	.	.	S	Bend	trans	-116.6	155.3	-178.1	-76.8	-77.9	169.3	0	0	113.5	W883 D885 D890 G891	W883-E888 HydrophobicContact CB-CB 3.82Å; W883-E888 HydrophobicContact CD2-CB 4.15Å; W883-E888 HydrophobicContact CD2-CG 4.38Å; W883-E888 HydrophobicContact CG-CB 3.66Å; W883-E888 HydrophobicContact CG-CG 4.35Å; W883-E888 PolarHBondContact NE1-OE2 3.03Å; D885-E888 HydrophobicContact CB-CB 4.01Å; E888-D890 VanDerWaalsContact C-N 3.35Å; E888-D890 PolarHBondContact O-N 2.9Å; E888-G891 PolarHBondContact O-N 3.5Å; E888-G891 VanDerWaalsContact O-N 3.12Å
889	D	65.1	Low	73.5	Confident	73 Å²	73	46 Å²	46	39%	0.39	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-78.3	-176.2	176.7	25.4	0	0	0	115.5	R882 W883 R895	R882-D889 WeakPolarHBondContact CD-OD2 3.43Å; R882-D889 VanDerWaalsContact CG-OD2 3.29Å; R882-D889 WeakPolarHBondContact CG-OD2 3.44Å; R882-D889 IonicContact CZ-OD1 3.07Å; R882-D889 IonicContact CZ-OD2 3.18Å; R882-D889 IonicContact NE-OD2 3.59Å; R882-D889 IonicContact NH1-OD1 2.74Å; R882-D889 PolarHBondContact NH1-OD1 2.7Å; R882-D889 IonicContact NH1-OD2 2.69Å; R882-D889 PolarHBondContact NH1-OD2 3Å; W883-D889 HydrophobicContact CB-CB 4.04Å; D889-R895 IonicContact OD2-CZ 2.7Å; D889-R895 IonicContact OD2-NH2 3.35Å; D889-R895 PolarHBondContact OD2-NH2 3.09Å; D889-R895 VanDerWaalsContact OD2-NH2 3.09Å
890	D	60.8	Low	72.6	Confident	34 Å²	34	47.2 Å²	47.2	18%	0.182	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.2	25.6	179.4	68.6	18.2	0	0	0	116.4	R882 E888 Q892 R895 K945	R882-D890 IonicContact CZ-OD2 3.49Å; R882-D890 IonicContact NH1-OD1 3.45Å; R882-D890 IonicContact NH1-OD2 2.68Å; R882-D890 PolarHBondContact NH1-OD2 3.46Å; E888-D890 VanDerWaalsContact C-N 3.35Å; E888-D890 PolarHBondContact O-N 2.9Å; D890-Q892 PolarHBondContact O-N 3.2Å; D890-Q892 VanDerWaalsContact O-N 3.14Å; D890-R895 IonicContact OD1-CZ 3.71Å; D890-R895 IonicContact OD1-NH1 3.77Å; D890-R895 PolarHBondContact OD1-NH1 2.89Å; D890-R895 IonicContact OD1-NH2 3.34Å; D890-R895 PolarHBondContact OD1-NH2 3.26Å; D890-R895 IonicContact OD2-NH1 3.76Å; D890-K945 HydrophobicContact CB-CD 4.32Å; D890-K945 IonicContact OD2-NZ 2.75Å; D890-K945 PolarHBondContact OD2-NZ 3.43Å
891	G	64.2	Low	71.2	Confident	34 Å²	34	47 Å²	47	35%	0.351	25%	0.249	S	C	.	.	S	Bend	trans	69.8	9.8	167.5	0	0	0	0	0	115.2	D885 V886 E888	D885-G891 CarbonylContact O-C 3.55Å; D885-G891 WeakPolarHBondContact O-CA 3.38Å; V886-G891 WeakPolarHBondContact O-CA 3.09Å; E888-G891 PolarHBondContact O-N 3.5Å; E888-G891 VanDerWaalsContact O-N 3.12Å
892	Q	69.3	Low	69.8	Low	76 Å²	76	44.8 Å²	44.8	36%	0.355	25%	0.249	S	C	.	.			trans	-99.5	103.7	-177.2	-78.5	-171.4	86.8	0	0	112.7	D885 D890 V894	D885-Q892 PolarHBondContact O-N 2.75Å; D890-Q892 PolarHBondContact O-N 3.2Å; D890-Q892 VanDerWaalsContact O-N 3.14Å; Q892-V894 PolarHBondContact O-N 2.99Å; Q892-V894 PolarHBondContact OE1-O 2.84Å
893	I	82.5	Confident	68.4	Low	21 Å²	21	40.4 Å²	40.4	11%	0.108	23%	0.232	C	C	.	.	S	Bend	trans	-75.3	2.1	168.7	64.9	174	0	0	0	114.1	G849 H850 E852 R853 V886	G849-I893 CarbonylContact C-O 2.93Å; G849-I893 WeakPolarHBondContact CA-O 3.38Å; H850-I893 WeakPolarHBondContact CE1-CG2 3.48Å; H850-I893 PolarHBondContact N-O 3.06Å; E852-I893 VanDerWaalsContact O-CD1 3.25Å; E852-I893 WeakPolarHBondContact O-CD1 3.23Å; R853-I893 HydrophobicContact CG-CD1 3.79Å; V886-I893 HydrophobicContact CG2-CG2 3.84Å
894	V	81	Confident	66.9	Low	35 Å²	35	40.5 Å²	40.5	21%	0.212	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	125.2	175.5	-174.3	0	0	0	0	110.7	F799 C847 I848 Q892 K938	F799-V894 HydrophobicContact CE1-CG2 4.08Å; F799-V894 HydrophobicContact CE2-CG1 4.38Å; F799-V894 HydrophobicContact CZ-CB 4.44Å; F799-V894 HydrophobicContact CZ-CG1 3.79Å; F799-V894 HydrophobicContact CZ-CG2 3.77Å; C847-V894 VanDerWaalsContact SG-CG1 3.56Å; I848-V894 CarbonylContact O-C 3.59Å; I848-V894 WeakPolarHBondContact O-CA 3.22Å; Q892-V894 PolarHBondContact O-N 2.99Å; Q892-V894 PolarHBondContact OE1-O 2.84Å; V894-K938 PolarHBondContact O-NZ 3Å
895	R	77.3	Confident	65.6	Low	17 Å²	17	40.9 Å²	40.9	6%	0.064	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.5	-179.3	-60.3	-172.5	-175.8	-77.3	-3	112.8	C847 I848 W883 F884 D889 D890 L897	C847-R895 WeakPolarHBondContact CA-O 3.28Å; I848-R895 PolarHBondContact N-O 2.94Å; I848-R895 PolarHBondContact O-N 2.82Å; W883-R895 PolarHBondContact O-NE 3.22Å; W883-R895 PolarHBondContact O-NH2 3.4Å; F884-R895 HydrophobicContact CD1-CG 4.23Å; F884-R895 HydrophobicContact CE1-CB 3.76Å; F884-R895 HydrophobicContact CE1-CG 3.6Å; F884-R895 HydrophobicContact CE2-CG 4.12Å; F884-R895 HydrophobicContact CZ-CB 3.65Å; F884-R895 VanDerWaalsContact CZ-CD 3.48Å; F884-R895 HydrophobicContact CZ-CG 3.54Å; D889-R895 IonicContact OD2-CZ 2.7Å; D889-R895 IonicContact OD2-NH2 3.35Å; D889-R895 PolarHBondContact OD2-NH2 3.09Å; D889-R895 VanDerWaalsContact OD2-NH2 3.09Å; D890-R895 IonicContact OD1-CZ 3.71Å; D890-R895 IonicContact OD1-NH1 3.77Å; D890-R895 PolarHBondContact OD1-NH1 2.89Å; D890-R895 IonicContact OD1-NH2 3.34Å; D890-R895 PolarHBondContact OD1-NH2 3.26Å; D890-R895 IonicContact OD2-NH1 3.76Å; R895-L897 HydrophobicContact CB-CD2 4.39Å
896	E	77.7	Confident	65.1	Low	31 Å²	31	40.6 Å²	40.6	15%	0.145	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.6	166.6	-54.1	-165.6	161.3	0	0	109.3	K845 I846 F898 K938	K845-E896 HydrophobicContact CD-CB 4.43Å; K845-E896 WeakPolarHBondContact CE-OE1 3.2Å; K845-E896 VanDerWaalsContact CE-OE2 3.31Å; K845-E896 WeakPolarHBondContact CE-OE2 3.42Å; K845-E896 IonicContact NZ-OE1 3.28Å; K845-E896 PolarHBondContact NZ-OE1 3.23Å; K845-E896 IonicContact NZ-OE2 3.61Å; K845-E896 PolarHBondContact NZ-OE2 3.42Å; I846-E896 WeakPolarHBondContact O-CA 3.43Å; E896-F898 HydrophobicContact CB-CE2 3.91Å; E896-F898 HydrophobicContact CB-CZ 4.04Å; E896-K938 HydrophobicContact CG-CD 4.44Å
897	L	75.9	Confident	65.2	Low	15 Å²	15	37.9 Å²	37.9	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.3	178.4	-50.6	175.2	0	0	0	108.8	K845 I846 I848 L861 I864 F878 C880 R895	K845-L897 CarbonylContact C-O 3.51Å; K845-L897 VanDerWaalsContact CA-O 3.29Å; K845-L897 WeakPolarHBondContact CA-O 2.82Å; I846-L897 HydrophobicContact CG1-CB 4.29Å; I846-L897 PolarHBondContact N-O 2.83Å; I846-L897 PolarHBondContact O-N 3.07Å; I848-L897 HydrophobicContact CG2-CD1 4.07Å; L861-L897 HydrophobicContact CD2-CD1 3.95Å; I864-L897 HydrophobicContact CD1-CD1 3.93Å; F878-L897 HydrophobicContact CB-CB 4.11Å; F878-L897 HydrophobicContact CB-CD1 4.43Å; F878-L897 HydrophobicContact CD1-CB 4.23Å; C880-L897 HydrophobicContact CB-CD1 4.06Å; C880-L897 HydrophobicContact CB-CD2 3.93Å; R895-L897 HydrophobicContact CB-CD2 4.39Å
898	F	70	Confident	65.8	Low	34 Å²	34	34.9 Å²	34.9	15%	0.149	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	147.5	-171.5	-64.1	-90.2	0	0	0	111.3	K845 F878 E896 H900 S904 A905	K845-F898 HydrophobicContact CB-CD1 3.91Å; K845-F898 HydrophobicContact CB-CE1 3.97Å; K845-F898 HydrophobicContact CD-CE1 3.77Å; K845-F898 HydrophobicContact CD-CZ 4.06Å; K845-F898 HydrophobicContact CG-CD1 4.44Å; K845-F898 HydrophobicContact CG-CE1 4.13Å; F878-F898 VanDerWaalsContact CD1-C 3.46Å; F878-F898 WeakPolarHBondContact CD1-O 3.36Å; E896-F898 HydrophobicContact CB-CE2 3.91Å; E896-F898 HydrophobicContact CB-CZ 4.04Å; F898-H900 PolarHBondContact O-N 3.05Å; F898-H900 VanDerWaalsContact O-N 3.13Å; F898-S904 WeakPolarHBondContact CB-OG 3.45Å; F898-A905 HydrophobicContact CD2-CB 4.22Å; F898-A905 HydrophobicContact CE2-CB 3.88Å
899	A	61.1	Low	66.5	Low	10 Å²	10	30.4 Å²	30.4	8%	0.083	17%	0.173	C	C	.	.	S	Bend	trans	-69.7	-11.4	-170.7	0	0	0	0	0	114.5	N844 L876 F878	N844-A899 PolarHBondContact O-N 2.85Å; L876-A899 HydrophobicContact CD1-CB 4.06Å; L876-A899 HydrophobicContact CD2-CB 4.4Å; F878-A899 VanDerWaalsContact CE1-CA 3.41Å; F878-A899 HydrophobicContact CE1-CB 3.68Å; F878-A899 VanDerWaalsContact CE1-N 3.33Å; F878-A899 HydrophobicContact CZ-CB 3.86Å
900	H	54	Low	67.4	Low	123 Å²	123	27 Å²	27	57%	0.569	15%	0.154	S	C	*	.	S	Bend	trans	-141.7	80	-173.6	-58.8	-33.1	0	0	0	110.5	F898 S904	F898-H900 PolarHBondContact O-N 3.05Å; F898-H900 VanDerWaalsContact O-N 3.13Å; H900-S904 WeakPolarHBondContact O-CB 3.4Å; H900-S904 PolarHBondContact O-OG 3.03Å
901	S	48.6	Very low	68.5	Low	13 Å²	13	26.4 Å²	26.4	9%	0.091	15%	0.152	C	C	.	.			trans	60.2	154.2	-178.1	79.7	0	0	0	0	117.7	L903 S904 E1187	S901-L903 PolarHBondContact O-N 2.83Å; S901-L903 PolarHBondContact OG-N 3.18Å; S901-S904 PolarHBondContact O-N 2.94Å; S901-S904 PolarHBondContact O-OG 2.9Å; S901-E1187 WeakPolarHBondContact CA-OE1 3.39Å; S901-E1187 VanDerWaalsContact CB-CD 3.42Å; S901-E1187 WeakPolarHBondContact CB-OE1 3.22Å; S901-E1187 WeakPolarHBondContact CB-OE2 3.06Å; S901-E1187 PolarHBondContact N-OE1 2.91Å
902	S	48.1	Very low	69.6	Low	56 Å²	56	24.8 Å²	24.8	39%	0.392	14%	0.135	S	C	.	.	G	3₁₀ helix	trans	-59.5	-23.8	170	71.8	0	0	0	0	112.9	S904 A905 R1089	S902-S904 PolarHBondContact O-N 2.87Å; S902-A905 PolarHBondContact O-N 2.9Å; S902-R1089 VanDerWaalsContact O-CZ 3.29Å; S902-R1089 PolarHBondContact O-NH1 3.33Å; S902-R1089 PolarHBondContact O-NH2 3.22Å
903	L	49.6	Very low	70.3	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-68.4	-15	-179.6	-71.5	166.9	0	0	0	113.3	S901 A905 P1036 E1038 R1122 A1189	S901-L903 PolarHBondContact O-N 2.83Å; S901-L903 PolarHBondContact OG-N 3.18Å; L903-A905 VanDerWaalsContact C-N 3.33Å; L903-P1036 HydrophobicContact CD2-CB 4.25Å; L903-P1036 HydrophobicContact CD2-CG 4.45Å; L903-E1038 HydrophobicContact CD2-CB 4Å; L903-R1122 HydrophobicContact CD1-CB 4.17Å; L903-A1189 HydrophobicContact CD1-CB 3.9Å
904	S	52	Low	70.4	Confident	41 Å²	41	22.2 Å²	22.2	29%	0.287	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-75.3	-16.9	177.5	61.8	0	0	0	0	114.3	F898 H900 S901 S902	F898-S904 WeakPolarHBondContact CB-OG 3.45Å; H900-S904 WeakPolarHBondContact O-CB 3.4Å; H900-S904 PolarHBondContact O-OG 3.03Å; S901-S904 PolarHBondContact O-N 2.94Å; S901-S904 PolarHBondContact O-OG 2.9Å; S902-S904 PolarHBondContact O-N 2.87Å
905	A	58.1	Low	70.2	Confident	9 Å²	9	20.5 Å²	20.5	7%	0.074	11%	0.114	C	C	.	.	S	Bend	trans	-72.3	127.5	171.2	0	0	0	0	0	111.5	F898 S902 L903 C964 R1089	F898-A905 HydrophobicContact CD2-CB 4.22Å; F898-A905 HydrophobicContact CE2-CB 3.88Å; S902-A905 PolarHBondContact O-N 2.9Å; L903-A905 VanDerWaalsContact C-N 3.33Å; A905-C964 CarbonylContact C-O 3.58Å; A905-C964 WeakPolarHBondContact CA-O 3.26Å; A905-R1089 PolarHBondContact O-NH2 2.89Å
906	I	67.7	Low	70.2	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	134.4	175.5	-58.5	-171	0	0	0	108.2	Y908 A963 C964 K966 F997	I906-Y908 HydrophobicContact CB-CE2 3.98Å; I906-Y908 HydrophobicContact CG2-CD2 4.35Å; I906-Y908 HydrophobicContact CG2-CE2 3.74Å; I906-A963 WeakPolarHBondContact O-CA 3.23Å; I906-C964 PolarHBondContact N-O 3.12Å; I906-C964 PolarHBondContact O-N 3.49Å; I906-K966 HydrophobicContact CD1-CB 3.73Å; I906-K966 HydrophobicContact CD1-CD 4.46Å; I906-K966 HydrophobicContact CD1-CG 3.63Å; I906-K966 HydrophobicContact CG1-CB 4.39Å; I906-F997 HydrophobicContact CD1-CB 3.96Å; I906-F997 HydrophobicContact CD1-CD1 3.71Å; I906-F997 HydrophobicContact CD1-CD2 4.46Å; I906-F997 HydrophobicContact CD1-CE1 4.39Å; I906-F997 HydrophobicContact CD1-CG 3.75Å; I906-F997 HydrophobicContact CG2-CB 4.06Å
907	A	71.5	Confident	69.9	Low	4 Å²	4	26.4 Å²	26.4	3%	0.033	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.5	171.7	0	0	0	0	0	110.7	I961 L962 F1091	A907-I961 HydrophobicContact CB-CG2 3.79Å; A907-L962 CarbonylContact C-O 3.56Å; A907-L962 WeakPolarHBondContact CA-O 3.4Å; A907-F1091 HydrophobicContact CB-CD2 4.49Å; A907-F1091 HydrophobicContact CB-CE1 4.33Å; A907-F1091 HydrophobicContact CB-CE2 3.44Å; A907-F1091 VanDerWaalsContact CB-CE2 3.44Å; A907-F1091 HydrophobicContact CB-CZ 3.34Å
908	Y	79	Confident	69.7	Low	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.9	170.7	-66.9	-90.1	0	0	0	106.9	I906 L930 L962 L967 I970 V993 I994 D995	I906-Y908 HydrophobicContact CB-CE2 3.98Å; I906-Y908 HydrophobicContact CG2-CD2 4.35Å; I906-Y908 HydrophobicContact CG2-CE2 3.74Å; Y908-L930 HydrophobicContact CD1-CD1 4.48Å; Y908-L930 HydrophobicContact CD2-CD1 4.47Å; Y908-L930 HydrophobicContact CG-CD1 4Å; Y908-L962 PolarHBondContact N-O 2.73Å; Y908-L962 PolarHBondContact O-N 2.95Å; Y908-L967 HydrophobicContact CD2-CD1 4.15Å; Y908-L967 HydrophobicContact CE1-CD1 4.35Å; Y908-L967 HydrophobicContact CE2-CB 4.32Å; Y908-L967 HydrophobicContact CE2-CD1 3.82Å; Y908-L967 HydrophobicContact CE2-CG 3.76Å; Y908-L967 PolarHBondContact OH-N 3.04Å; Y908-I970 HydrophobicContact CD1-CD1 4.23Å; Y908-I970 HydrophobicContact CE1-CD1 3.82Å; Y908-I970 HydrophobicContact CE1-CG1 4.25Å; Y908-V993 HydrophobicContact CD1-CG1 4.11Å; Y908-I994 WeakPolarHBondContact CA-O 3.36Å; Y908-D995 HydrophobicContact CD1-CB 4.04Å; Y908-D995 HydrophobicContact CE1-CB 3.68Å; Y908-D995 WeakPolarHBondContact CE1-OD2 3.26Å; Y908-D995 PolarHBondContact OH-OD2 3.14Å
909	N	82	Confident	70	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.037	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	122.6	176.1	-174.5	23.3	0	0	0	108.9	E959 F960 V993 I994 Y996	N909-E959 VanDerWaalsContact ND2-CD 3.31Å; N909-E959 PolarHBondContact ND2-OE1 2.81Å; N909-E959 WeakPolarHBondContact OD1-CG 3.34Å; N909-F960 PolarHBondContact OD1-O 3.01Å; N909-V993 CarbonylContact O-C 3.59Å; N909-V993 WeakPolarHBondContact O-CA 3.42Å; N909-I994 HydrophobicContact CB-CB 4.32Å; N909-I994 PolarHBondContact N-O 2.7Å; N909-I994 VanDerWaalsContact N-O 3.14Å; N909-I994 PolarHBondContact O-N 3.25Å; N909-Y996 HydrophobicContact CB-CE2 3.77Å
910	V	85.5	Confident	71	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.7	-172.1	-176.3	0	0	0	0	109.3	V912 F960 L962 V991 V992 V993	V910-V912 HydrophobicContact CG1-CG2 4.22Å; V910-F960 PolarHBondContact N-O 3.22Å; V910-F960 PolarHBondContact O-N 3.42Å; V910-L962 HydrophobicContact CB-CD1 4.23Å; V910-L962 HydrophobicContact CG2-CD1 3.61Å; V910-L962 HydrophobicContact CG2-CG 4.1Å; V910-V991 HydrophobicContact CG1-CG1 3.87Å; V910-V992 CarbonylContact C-O 3.53Å; V910-V992 VanDerWaalsContact CA-O 3.28Å; V910-V992 WeakPolarHBondContact CA-O 3.3Å; V910-V993 HydrophobicContact CG1-CG2 4.42Å; V910-V993 HydrophobicContact CG2-CG1 4.37Å; V910-V993 HydrophobicContact CG2-CG2 4.2Å
911	T	83.7	Confident	72.4	Confident	22 Å²	22	36 Å²	36	14%	0.135	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	137.4	173.3	-30.7	0	0	0	0	109.3	E958 E959 V991 V992	T911-E958 CarbonylContact C-O 3.53Å; T911-E958 WeakPolarHBondContact CA-O 3.37Å; T911-E958 WeakPolarHBondContact CG2-O 3.1Å; T911-E959 HydrophobicContact CG2-CB 4.31Å; T911-E959 PolarHBondContact OG1-OE1 3.39Å; T911-V991 WeakPolarHBondContact O-CA 3.15Å; T911-V992 PolarHBondContact N-O 3.49Å; T911-V992 PolarHBondContact O-N 3.39Å
912	V	86.7	Confident	74.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.3	-177.4	-179.6	0	0	0	0	108.7	V910 L942 F952 S957 E958 F960 W986 L988 V991	V910-V912 HydrophobicContact CG1-CG2 4.22Å; V912-L942 HydrophobicContact CG2-CD1 3.81Å; V912-F952 HydrophobicContact CB-CE1 4.46Å; V912-F952 HydrophobicContact CG1-CD1 4.36Å; V912-F952 HydrophobicContact CG1-CE1 4.2Å; V912-S957 CarbonylContact O-C 3.55Å; V912-S957 WeakPolarHBondContact O-CA 3.43Å; V912-E958 PolarHBondContact N-O 2.71Å; V912-E958 PolarHBondContact O-N 2.88Å; V912-F960 HydrophobicContact CB-CE2 4.36Å; V912-F960 HydrophobicContact CG2-CD2 4.19Å; V912-F960 HydrophobicContact CG2-CE2 4.07Å; V912-W986 HydrophobicContact CG1-CH2 3.7Å; V912-W986 HydrophobicContact CG1-CZ2 3.46Å; V912-W986 VanDerWaalsContact CG1-CZ2 3.46Å; V912-L988 HydrophobicContact CG1-CD1 3.72Å; V912-V991 HydrophobicContact CG2-CG1 4.41Å
913	L	84.7	Confident	75.8	Confident	42 Å²	42	35.1 Å²	35.1	22%	0.22	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	106.3	-176.4	-169.6	72.6	0	0	0	110.5	K956 D989 E990	L913-K956 WeakPolarHBondContact CA-O 3.5Å; L913-D989 HydrophobicContact CD2-CB 4.11Å; L913-D989 HydrophobicContact CG-CB 4.33Å; L913-D989 PolarHBondContact O-N 3.35Å; L913-E990 HydrophobicContact CB-CB 4.1Å; L913-E990 HydrophobicContact CD2-CB 4.18Å; L913-E990 PolarHBondContact N-O 3.01Å; L913-E990 PolarHBondContact O-N 2.93Å
914	T	85.1	Confident	77.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.4	177.5	-59.8	0	0	0	0	110.1	A920 E953 G955 K956 W986	T914-A920 HydrophobicContact CG2-CB 4.44Å; T914-A920 WeakPolarHBondContact CG2-O 3.42Å; T914-E953 VanDerWaalsContact CB-O 3.29Å; T914-E953 WeakPolarHBondContact CB-O 3.34Å; T914-E953 VanDerWaalsContact CG2-O 3.32Å; T914-E953 WeakPolarHBondContact CG2-O 3.47Å; T914-G955 CarbonylContact O-C 3.6Å; T914-G955 WeakPolarHBondContact O-CA 3.38Å; T914-G955 PolarHBondContact O-N 3.24Å; T914-K956 PolarHBondContact N-O 2.77Å; T914-W986 PolarHBondContact OG1-NE1 3.17Å
915	G	75.2	Confident	78.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.192	C	C	.	.			trans	-68.2	165.2	-170.5	0	0	0	0	0	115.6	A920 A954 G955 F987 D989	G915-A920 WeakPolarHBondContact O-CB 3.34Å; G915-A954 CarbonylContact O-C 3.56Å; G915-A954 WeakPolarHBondContact O-CA 3.46Å; G915-G955 PolarHBondContact O-N 2.8Å; G915-F987 PolarHBondContact N-O 3.01Å; G915-D989 WeakPolarHBondContact CA-OD1 3.45Å; G915-D989 WeakPolarHBondContact CA-OD2 3.42Å
916	T	77.1	Confident	80.1	Confident	122 Å²	122	35.2 Å²	35.2	75%	0.748	19%	0.188	S	C	*	.	S	Bend	trans	-90.9	-1.6	-173.4	54.1	0	0	0	0	114.7
917	C	72.1	Confident	81.1	Confident	49 Å²	49	36.9 Å²	36.9	33%	0.331	20%	0.195	S	C	.	.	S	Bend	trans	-72.9	163.1	-178.6	66.6	0	0	0	0	112.8	N919 A920 F987	C917-N919 PolarHBondContact O-N 2.95Å; C917-A920 WeakPolarHBondContact O-CB 3.42Å; C917-A920 PolarHBondContact O-N 3.35Å; C917-A920 VanDerWaalsContact O-N 3.13Å; C917-F987 VanDerWaalsContact SG-CG 3.53Å
918	R	72.1	Confident	81.9	Confident	227 Å²	227	36.7 Å²	36.7	86%	0.857	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	129.9	-174.7	-156.6	177.5	-165.4	175.3	4.5	109.7	A920	R918-A920 VanDerWaalsContact C-N 3.29Å; R918-A920 PolarHBondContact O-N 3.01Å
919	N	76.7	Confident	82.3	Confident	131 Å²	131	37.6 Å²	37.6	70%	0.701	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	18.5	-174.8	-52.1	-10.2	0	0	0	115.5	C917 G921 W1009	C917-N919 PolarHBondContact O-N 2.95Å; N919-G921 PolarHBondContact O-N 2.76Å; N919-G921 VanDerWaalsContact O-N 3.13Å; N919-W1009 WeakPolarHBondContact O-CH2 3.31Å
920	A	81.8	Confident	82.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.			trans	-60.1	-21.2	-178.2	0	0	0	0	0	116.3	T914 G915 C917 R918 A954 W986 F987	T914-A920 HydrophobicContact CG2-CB 4.44Å; T914-A920 WeakPolarHBondContact CG2-O 3.42Å; G915-A920 WeakPolarHBondContact O-CB 3.34Å; C917-A920 WeakPolarHBondContact O-CB 3.42Å; C917-A920 PolarHBondContact O-N 3.35Å; C917-A920 VanDerWaalsContact O-N 3.13Å; R918-A920 VanDerWaalsContact C-N 3.29Å; R918-A920 PolarHBondContact O-N 3.01Å; A920-A954 HydrophobicContact CB-CB 3.9Å; A920-W986 CarbonylContact O-C 3.53Å; A920-W986 WeakPolarHBondContact O-CA 3.3Å; A920-W986 VanDerWaalsContact O-CD1 3.31Å; A920-F987 HydrophobicContact CB-CB 3.73Å; A920-F987 PolarHBondContact O-N 3.1Å
921	G	82.4	Confident	82.3	Confident	25 Å²	25	39.2 Å²	39.2	26%	0.258	20%	0.204	S	C	.	.			trans	-86.7	150.3	-174.1	0	0	0	0	0	114.4	N919 F952	N919-G921 PolarHBondContact O-N 2.76Å; N919-G921 VanDerWaalsContact O-N 3.13Å; G921-F952 CarbonylContact C-O 3.59Å; G921-F952 VanDerWaalsContact C-O 3.3Å; G921-F952 WeakPolarHBondContact CA-O 3.32Å
922	T	85.1	Confident	82	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.018	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-124.6	152.7	-178.1	-166.4	0	0	0	0	114.3	A924 V926 F952 S984 W986	T922-A924 PolarHBondContact OG1-N 2.93Å; T922-A924 VanDerWaalsContact OG1-N 3.15Å; T922-V926 HydrophobicContact CG2-CG2 4.2Å; T922-F952 HydrophobicContact CG2-CB 4.09Å; T922-F952 HydrophobicContact CG2-CD2 4.16Å; T922-F952 HydrophobicContact CG2-CG 4.43Å; T922-F952 PolarHBondContact N-O 2.97Å; T922-F952 PolarHBondContact O-N 2.87Å; T922-F952 VanDerWaalsContact O-N 3.07Å; T922-S984 VanDerWaalsContact OG1-C 3.29Å; T922-S984 WeakPolarHBondContact OG1-CA 3.25Å; T922-S984 PolarHBondContact OG1-O 3.06Å; T922-W986 HydrophobicContact CG2-CB 3.71Å; T922-W986 HydrophobicContact CG2-CD2 3.86Å; T922-W986 HydrophobicContact CG2-CG 3.45Å; T922-W986 VanDerWaalsContact CG2-CG 3.45Å
923	V	82.6	Confident	81	Confident	48 Å²	48	44 Å²	44	29%	0.291	23%	0.232	S	C	.	.			trans	-108.1	-0.2	172	-82.3	0	0	0	0	112.8	K951 A981 P982	V923-K951 HydrophobicContact CG1-CD 4.27Å; V923-K951 HydrophobicContact CG1-CG 3.81Å; V923-A981 HydrophobicContact CB-CB 4.05Å; V923-A981 HydrophobicContact CG2-CB 3.65Å; V923-P982 WeakPolarHBondContact CG2-O 3.22Å
924	A	81.8	Confident	80	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.008	25%	0.248	C	C	.	.	S	Bend	trans	-72.4	153.7	177	0	0	0	0	0	111.9	T922 V926 H977	T922-A924 PolarHBondContact OG1-N 2.93Å; T922-A924 VanDerWaalsContact OG1-N 3.15Å; A924-V926 PolarHBondContact O-N 3.03Å; A924-H977 HydrophobicContact CB-CB 3.85Å
925	N	82.3	Confident	79	Confident	52 Å²	52	49.2 Å²	49.2	28%	0.278	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-71.7	118.2	174.8	-65.4	-72.1	0	0	0	109.2	F927 Q941 H977 D978	N925-F927 HydrophobicContact CB-CE2 3.64Å; N925-F927 HydrophobicContact CB-CZ 3.96Å; N925-F927 VanDerWaalsContact O-CD2 3.26Å; N925-F927 WeakPolarHBondContact O-CD2 3.34Å; N925-F927 WeakPolarHBondContact O-CE2 3.45Å; N925-Q941 PolarHBondContact OD1-NE2 3.39Å; N925-H977 WeakPolarHBondContact O-CA 3.3Å; N925-D978 VanDerWaalsContact CB-OD2 3.31Å; N925-D978 WeakPolarHBondContact CB-OD2 3.43Å; N925-D978 PolarHBondContact N-OD1 2.89Å; N925-D978 VanDerWaalsContact N-OD1 3.1Å; N925-D978 PolarHBondContact ND2-OD2 3.42Å; N925-D978 PolarHBondContact O-N 2.98Å; N925-D978 VanDerWaalsContact O-N 3.1Å
926	V	86.7	Confident	78.8	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.5	178.1	-179.5	0	0	0	0	110.7	T922 A924 Q941 L942 F952 I975 W976 H977 W986	T922-V926 HydrophobicContact CG2-CG2 4.2Å; A924-V926 PolarHBondContact O-N 3.03Å; V926-Q941 VanDerWaalsContact O-CG 3.28Å; V926-Q941 WeakPolarHBondContact O-CG 3.01Å; V926-L942 HydrophobicContact CB-CB 4.5Å; V926-L942 HydrophobicContact CG1-CD1 3.85Å; V926-L942 HydrophobicContact CG1-CG 4.32Å; V926-L942 PolarHBondContact O-N 3.06Å; V926-F952 HydrophobicContact CB-CE2 3.7Å; V926-F952 HydrophobicContact CB-CZ 3.83Å; V926-F952 HydrophobicContact CG1-CZ 4.33Å; V926-F952 HydrophobicContact CG2-CD2 3.75Å; V926-F952 HydrophobicContact CG2-CE2 3.4Å; V926-F952 VanDerWaalsContact CG2-CE2 3.4Å; V926-F952 HydrophobicContact CG2-CZ 3.9Å; V926-I975 HydrophobicContact CG1-CD1 4.32Å; V926-I975 HydrophobicContact CG1-CG1 4.1Å; V926-W976 CarbonylContact C-O 3.53Å; V926-W976 WeakPolarHBondContact CA-O 3.49Å; V926-H977 HydrophobicContact CG2-CB 4.29Å; V926-W986 HydrophobicContact CB-CZ3 4.47Å; V926-W986 HydrophobicContact CG1-CH2 3.7Å; V926-W986 HydrophobicContact CG1-CZ3 3.63Å; V926-W986 HydrophobicContact CG2-CE3 4.14Å; V926-W986 HydrophobicContact CG2-CH2 4.13Å; V926-W986 HydrophobicContact CG2-CZ3 3.9Å
927	F	88.5	Confident	78.8	Confident	40 Å²	40	47 Å²	47	18%	0.175	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	152.3	-177.8	-60.2	-96.2	0	0	0	111.1	N925 M940 Q941 I975 W976 D978	N925-F927 HydrophobicContact CB-CE2 3.64Å; N925-F927 HydrophobicContact CB-CZ 3.96Å; N925-F927 VanDerWaalsContact O-CD2 3.26Å; N925-F927 WeakPolarHBondContact O-CD2 3.34Å; N925-F927 WeakPolarHBondContact O-CE2 3.45Å; F927-M940 CarbonylContact C-O 3.44Å; F927-M940 WeakPolarHBondContact CA-O 3.36Å; F927-Q941 HydrophobicContact CD1-CB 3.7Å; F927-Q941 HydrophobicContact CD1-CG 3.9Å; F927-Q941 HydrophobicContact CE1-CB 3.64Å; F927-Q941 HydrophobicContact CE1-CG 3.66Å; F927-Q941 HydrophobicContact CG-CG 4.44Å; F927-Q941 HydrophobicContact CZ-CB 4.47Å; F927-Q941 HydrophobicContact CZ-CG 4.01Å; F927-I975 WeakPolarHBondContact O-CA 3.31Å; F927-W976 HydrophobicContact CB-CD2 3.79Å; F927-W976 VanDerWaalsContact CB-CE2 3.4Å; F927-W976 HydrophobicContact CB-CE3 4.18Å; F927-W976 HydrophobicContact CB-CG 4.38Å; F927-W976 HydrophobicContact CB-CH2 3.91Å; F927-W976 HydrophobicContact CB-CZ2 3.5Å; F927-W976 VanDerWaalsContact CB-CZ2 3.5Å; F927-W976 HydrophobicContact CB-CZ3 4.23Å; F927-W976 AromaticContact CD2-NE1 3.85Å; F927-W976 HydrophobicContact CG-CZ2 4.19Å; F927-W976 AromaticContact CG-NE1 3.94Å; F927-W976 PolarHBondContact N-O 3.35Å; F927-W976 PolarHBondContact O-N 3.18Å; F927-D978 HydrophobicContact CE2-CB 4.2Å
928	V	89.3	Confident	78.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.5	179.9	97.2	0	0	0	0	111.9	M940 L942 L962 I973 K974 I975	V928-M940 HydrophobicContact CG1-CB 4.48Å; V928-M940 HydrophobicContact CG1-CE 4.22Å; V928-M940 PolarHBondContact N-O 2.79Å; V928-M940 PolarHBondContact O-N 2.89Å; V928-L942 HydrophobicContact CB-CD2 4.15Å; V928-L942 HydrophobicContact CB-CG 4.39Å; V928-L942 HydrophobicContact CG1-CD2 3.91Å; V928-L962 HydrophobicContact CG1-CD1 3.37Å; V928-I973 HydrophobicContact CG2-CD1 3.56Å; V928-I973 HydrophobicContact CG2-CG1 3.61Å; V928-K974 CarbonylContact C-O 3.59Å; V928-K974 VanDerWaalsContact CA-O 3.3Å; V928-K974 WeakPolarHBondContact CA-O 3.27Å; V928-K974 VanDerWaalsContact CG2-O 3.27Å; V928-K974 WeakPolarHBondContact CG2-O 3.45Å; V928-I975 HydrophobicContact CG2-CB 4.1Å; V928-I975 HydrophobicContact CG2-CD1 4.31Å; V928-I975 HydrophobicContact CG2-CG1 4.12Å
929	H	87.2	Confident	78.9	Confident	19 Å²	19	40.2 Å²	40.2	9%	0.088	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	131	174.7	-170.8	126.2	0	0	0	108.9	Y931 S937 D939 I973 K974 W976	H929-Y931 AromaticContact CD2-CD1 3.92Å; H929-Y931 AromaticContact CD2-CD2 3.99Å; H929-Y931 AromaticContact CD2-CE1 3.43Å; H929-Y931 VanDerWaalsContact CD2-CE1 3.43Å; H929-Y931 WeakPolarHBondContact CD2-CE1 3.31Å; H929-Y931 AromaticContact CD2-CE2 3.54Å; H929-Y931 AromaticContact CD2-CZ 3.22Å; H929-Y931 AromaticContact NE2-CD1 3.81Å; H929-Y931 AromaticContact NE2-CE1 3.18Å; H929-Y931 WeakPolarHBondContact NE2-CE1 3.39Å; H929-Y931 AromaticContact NE2-CZ 3.41Å; H929-S937 PolarHBondContact CE1-O 2.62Å; H929-S937 PolarHBondContact NE2-O 2.74Å; H929-D939 IonicContact CE1-OD1 2.76Å; H929-D939 IonicContact CG-OD1 3.51Å; H929-D939 IonicContact ND1-OD1 3.38Å; H929-D939 PolarHBondContact ND1-OD1 2.96Å; H929-I973 CarbonylContact O-C 3.59Å; H929-I973 WeakPolarHBondContact O-CA 3.23Å; H929-K974 HydrophobicContact CB-CB 4.22Å; H929-K974 PolarHBondContact N-O 2.93Å; H929-K974 PolarHBondContact O-N 2.76Å; H929-W976 HydrophobicContact CB-CH2 4.13Å; H929-W976 HydrophobicContact CB-CZ3 3.93Å
930	L	84.8	Confident	79	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.8	-173.8	-65.9	172.5	0	0	0	110.4	Y908 E936 S937 M940 L967 I970 I973 V993	Y908-L930 HydrophobicContact CD1-CD1 4.48Å; Y908-L930 HydrophobicContact CD2-CD1 4.47Å; Y908-L930 HydrophobicContact CG-CD1 4Å; L930-E936 WeakPolarHBondContact O-CA 3.39Å; L930-S937 PolarHBondContact N-OG 3.12Å; L930-S937 PolarHBondContact O-N 2.97Å; L930-M940 HydrophobicContact CD1-CE 4.2Å; L930-M940 HydrophobicContact CG-CE 4.4Å; L930-L967 HydrophobicContact CB-CD1 3.36Å; L930-L967 HydrophobicContact CD1-CD1 4.04Å; L930-L967 HydrophobicContact CG-CD1 4.35Å; L930-I970 HydrophobicContact CB-CD1 4.47Å; L930-I973 HydrophobicContact CD2-CB 4.32Å; L930-I973 HydrophobicContact CD2-CD1 3.82Å; L930-I973 HydrophobicContact CD2-CG1 3.85Å; L930-V993 HydrophobicContact CD1-CG1 4.46Å; L930-V993 HydrophobicContact CD2-CG1 4.2Å; L930-V993 HydrophobicContact CD2-CG2 3.92Å
931	Y	82.4	Confident	79.1	Confident	40 Å²	40	37.8 Å²	37.8	16%	0.157	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.3	178	-56.2	-86.9	0	0	0	110.6	H929 E936 I970 K971 K972 K974	H929-Y931 AromaticContact CD2-CD1 3.92Å; H929-Y931 AromaticContact CD2-CD2 3.99Å; H929-Y931 AromaticContact CD2-CE1 3.43Å; H929-Y931 VanDerWaalsContact CD2-CE1 3.43Å; H929-Y931 WeakPolarHBondContact CD2-CE1 3.31Å; H929-Y931 AromaticContact CD2-CE2 3.54Å; H929-Y931 AromaticContact CD2-CZ 3.22Å; H929-Y931 AromaticContact NE2-CD1 3.81Å; H929-Y931 AromaticContact NE2-CE1 3.18Å; H929-Y931 WeakPolarHBondContact NE2-CE1 3.39Å; H929-Y931 AromaticContact NE2-CZ 3.41Å; Y931-E936 HydrophobicContact CD1-CB 3.92Å; Y931-E936 HydrophobicContact CE1-CB 4.38Å; Y931-I970 WeakPolarHBondContact O-CA 3.46Å; Y931-K971 PolarHBondContact O-N 3.13Å; Y931-K972 HydrophobicContact CD2-CB 3.97Å; Y931-K972 HydrophobicContact CD2-CD 3.6Å; Y931-K972 HydrophobicContact CD2-CG 3.72Å; Y931-K972 HydrophobicContact CE2-CD 3.83Å; Y931-K972 HydrophobicContact CE2-CG 4.26Å; Y931-K972 HydrophobicContact CG-CB 4.41Å; Y931-K972 HydrophobicContact CG-CD 4.31Å; Y931-K972 PolarHBondContact N-O 3.06Å; Y931-K972 PolarHBondContact O-N 3.49Å; Y931-K974 HydrophobicContact CE2-CB 4.12Å
932	G	76.9	Confident	79.1	Confident	16 Å²	16	36.7 Å²	36.7	17%	0.165	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	173.7	175.8	0	0	0	0	0	114.5	Q934 G935 L967 E969	G932-Q934 PolarHBondContact O-N 3.44Å; G932-Q934 VanDerWaalsContact O-N 3.08Å; G932-G935 PolarHBondContact N-O 3.34Å; G932-G935 PolarHBondContact O-N 3.48Å; G932-L967 CarbonylContact C-O 3.54Å; G932-L967 WeakPolarHBondContact CA-O 3.49Å; G932-E969 CarbonylContact C-O 3.55Å; G932-E969 WeakPolarHBondContact CA-O 3.48Å
933	L	65.4	Low	78.4	Confident	107 Å²	107	40.5 Å²	40.5	56%	0.56	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-11	-175.9	-75.7	-175.4	0	0	0	116	L967 E969 K971	L933-L967 PolarHBondContact N-O 3.38Å; L933-L967 VanDerWaalsContact N-O 3.15Å; L933-E969 HydrophobicContact CB-CB 4.37Å; L933-E969 HydrophobicContact CD1-CB 3.81Å; L933-E969 HydrophobicContact CG-CB 4.05Å; L933-E969 PolarHBondContact N-O 3.06Å; L933-K971 HydrophobicContact CD2-CD 4.18Å; L933-K971 HydrophobicContact CD2-CG 4.35Å
934	Q	65.2	Low	77.3	Confident	121 Å²	121	42.3 Å²	42.3	57%	0.565	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.6	-0.3	-175.8	-59.7	-176.8	7.4	0	0	113	G932 L967	G932-Q934 PolarHBondContact O-N 3.44Å; G932-Q934 VanDerWaalsContact O-N 3.08Å; Q934-L967 WeakPolarHBondContact CA-O 3.21Å; Q934-L967 PolarHBondContact N-O 3.18Å
935	G	63.7	Low	75.8	Confident	32 Å²	32	48 Å²	48	33%	0.33	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	170.1	170.4	176.5	0	0	0	0	0	113.8	G932 L967	G932-G935 PolarHBondContact N-O 3.34Å; G932-G935 PolarHBondContact O-N 3.48Å; G935-L967 PolarHBondContact N-O 3.24Å
936	E	71	Confident	74.1	Confident	68 Å²	68	49.1 Å²	49.1	32%	0.318	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	148.9	172.4	65.7	-162.6	170.9	0	0	109.3	K664 L930 Y931 L967	K664-E936 WeakPolarHBondContact CE-OE1 3.2Å; K664-E936 IonicContact NZ-OE1 3.43Å; K664-E936 PolarHBondContact NZ-OE1 3.49Å; L930-E936 WeakPolarHBondContact O-CA 3.39Å; Y931-E936 HydrophobicContact CD1-CB 3.92Å; Y931-E936 HydrophobicContact CE1-CB 4.38Å; E936-L967 VanDerWaalsContact C-CD2 3.45Å
937	S	76.1	Confident	72.3	Confident	6 Å²	6	52.6 Å²	52.6	4%	0.042	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-79	169.8	175.3	71.5	0	0	0	0	111.4	H929 L930 M940	H929-S937 PolarHBondContact CE1-O 2.62Å; H929-S937 PolarHBondContact NE2-O 2.74Å; L930-S937 PolarHBondContact N-OG 3.12Å; L930-S937 PolarHBondContact O-N 2.97Å; S937-M940 VanDerWaalsContact CB-CE 3.5Å; S937-M940 VanDerWaalsContact OG-CE 3.31Å; S937-M940 WeakPolarHBondContact OG-CE 3.34Å
938	K	72.7	Confident	70.4	Confident	49 Å²	49	58.9 Å²	58.9	21%	0.213	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-68.7	168.7	155.2	62.6	170	-180	162.2	0	110.5	V894 E896 M940	V894-K938 PolarHBondContact O-NZ 3Å; E896-K938 HydrophobicContact CG-CD 4.44Å; K938-M940 HydrophobicContact CG-CG 3.91Å; K938-M940 PolarHBondContact O-N 2.83Å
939	D	74.7	Confident	68.7	Low	86 Å²	86	64.4 Å²	64.4	46%	0.46	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-64.5	124.2	162.6	-72	2.2	0	0	0	108.4	H929 W976	H929-D939 IonicContact CE1-OD1 2.76Å; H929-D939 IonicContact CG-OD1 3.51Å; H929-D939 IonicContact ND1-OD1 3.38Å; H929-D939 PolarHBondContact ND1-OD1 2.96Å; D939-W976 HydrophobicContact CB-CH2 3.87Å; D939-W976 HydrophobicContact CB-CZ2 4.02Å; D939-W976 WeakPolarHBondContact OD1-CH2 3.46Å; D939-W976 VanDerWaalsContact OD2-CZ2 3.29Å; D939-W976 WeakPolarHBondContact OD2-CZ2 3.29Å
940	M	78.3	Confident	67.5	Low	15 Å²	15	64 Å²	64	7%	0.074	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	122	-174.8	-67.1	173.9	-62.2	0	0	110	F927 V928 L930 S937 K938 L962	F927-M940 CarbonylContact C-O 3.44Å; F927-M940 WeakPolarHBondContact CA-O 3.36Å; V928-M940 HydrophobicContact CG1-CB 4.48Å; V928-M940 HydrophobicContact CG1-CE 4.22Å; V928-M940 PolarHBondContact N-O 2.79Å; V928-M940 PolarHBondContact O-N 2.89Å; L930-M940 HydrophobicContact CD1-CE 4.2Å; L930-M940 HydrophobicContact CG-CE 4.4Å; S937-M940 VanDerWaalsContact CB-CE 3.5Å; S937-M940 VanDerWaalsContact OG-CE 3.31Å; S937-M940 WeakPolarHBondContact OG-CE 3.34Å; K938-M940 HydrophobicContact CG-CG 3.91Å; K938-M940 PolarHBondContact O-N 2.83Å; M940-L962 HydrophobicContact CB-CD1 4.45Å; M940-L962 HydrophobicContact CE-CB 4.16Å; M940-L962 HydrophobicContact CE-CD1 3.86Å; M940-L962 HydrophobicContact SD-CB 3.95Å; M940-L962 HydrophobicContact SD-CD1 4.39Å
941	Q	83.1	Confident	66.6	Low	65 Å²	65	70.2 Å²	70.2	30%	0.304	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.6	174.7	-163.7	-178.2	-17.8	0	0	110.5	N925 V926 F927 K943	N925-Q941 PolarHBondContact OD1-NE2 3.39Å; V926-Q941 VanDerWaalsContact O-CG 3.28Å; V926-Q941 WeakPolarHBondContact O-CG 3.01Å; F927-Q941 HydrophobicContact CD1-CB 3.7Å; F927-Q941 HydrophobicContact CD1-CG 3.9Å; F927-Q941 HydrophobicContact CE1-CB 3.64Å; F927-Q941 HydrophobicContact CE1-CG 3.66Å; F927-Q941 HydrophobicContact CG-CG 4.44Å; F927-Q941 HydrophobicContact CZ-CB 4.47Å; F927-Q941 HydrophobicContact CZ-CG 4.01Å; Q941-K943 HydrophobicContact CG-CG 4.11Å; Q941-K943 PolarHBondContact O-N 2.68Å
942	L	83.3	Confident	66.5	Low	1 Å²	1	68.4 Å²	68.4	1%	0.005	34%	0.341	C	S	.	.			trans	-82.6	91.4	172.7	-57.6	-170.9	0	0	0	109.2	V912 V926 V928 F952 F960 L962 I975	V912-L942 HydrophobicContact CG2-CD1 3.81Å; V926-L942 HydrophobicContact CB-CB 4.5Å; V926-L942 HydrophobicContact CG1-CD1 3.85Å; V926-L942 HydrophobicContact CG1-CG 4.32Å; V926-L942 PolarHBondContact O-N 3.06Å; V928-L942 HydrophobicContact CB-CD2 4.15Å; V928-L942 HydrophobicContact CB-CG 4.39Å; V928-L942 HydrophobicContact CG1-CD2 3.91Å; L942-F952 HydrophobicContact CB-CZ 4.08Å; L942-F960 HydrophobicContact CB-CD1 3.94Å; L942-F960 HydrophobicContact CB-CD2 4.14Å; L942-F960 HydrophobicContact CB-CE1 3.85Å; L942-F960 HydrophobicContact CB-CE2 4.06Å; L942-F960 HydrophobicContact CB-CG 4.09Å; L942-F960 HydrophobicContact CB-CZ 3.91Å; L942-F960 HydrophobicContact CD1-CD2 4.04Å; L942-F960 HydrophobicContact CD1-CE2 4.09Å; L942-F960 HydrophobicContact CD2-CB 4.05Å; L942-F960 HydrophobicContact CD2-CD2 4.14Å; L942-F960 HydrophobicContact CD2-CG 3.99Å; L942-F960 HydrophobicContact CG-CD2 4.34Å; L942-F960 HydrophobicContact CG-CG 4.46Å; L942-L962 HydrophobicContact CD2-CD1 3.87Å; L942-L962 HydrophobicContact CD2-CD2 4.16Å; L942-I975 HydrophobicContact CD1-CD1 4.46Å
943	K	71.3	Confident	66.6	Low	84 Å²	84	71.9 Å²	71.9	37%	0.365	35%	0.353	S	S	.	.			trans	-117.5	139.4	171.4	-73.4	-155.6	179.6	-162.8	0	112.1	Q941 E948 T950	Q941-K943 HydrophobicContact CG-CG 4.11Å; Q941-K943 PolarHBondContact O-N 2.68Å; K943-E948 PolarHBondContact NZ-O 2.86Å; K943-T950 WeakPolarHBondContact CA-OG1 3.46Å
944	H	58.8	Low	67.2	Low	85 Å²	85	69.3 Å²	69.3	39%	0.394	35%	0.348	S	S	.	.			trans	-74.2	135.1	159.6	-92.5	-91.8	0	0	0	110	E946 T947 T950 F960	H944-E946 PolarHBondContact O-N 2.9Å; H944-T947 PolarHBondContact O-N 2.82Å; H944-T950 PolarHBondContact N-OG1 3.45Å; H944-F960 AromaticContact CD2-CE1 3.75Å
945	K	50	Low	67.3	Low	121 Å²	121	65.5 Å²	65.5	53%	0.526	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-12.8	-175.3	-83.4	-158	170.7	-151.3	0	115.9	D890	D890-K945 HydrophobicContact CB-CD 4.32Å; D890-K945 IonicContact OD2-NZ 2.75Å; D890-K945 PolarHBondContact OD2-NZ 3.43Å
946	E	47.2	Very low	67.6	Low	76 Å²	76	67.9 Å²	67.9	36%	0.355	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	7.6	-168.4	-61.6	176.5	174.8	0	0	112.7	H944 T1076	H944-E946 PolarHBondContact O-N 2.9Å; E946-T1076 VanDerWaalsContact CD-OG1 3.24Å; E946-T1076 PolarHBondContact OE1-N 3.05Å; E946-T1076 VanDerWaalsContact OE1-N 3.15Å; E946-T1076 PolarHBondContact OE1-OG1 2.96Å; E946-T1076 WeakPolarHBondContact OE2-CB 3.44Å; E946-T1076 PolarHBondContact OE2-OG1 2.87Å
947	T	48.2	Very low	67.8	Low	73 Å²	73	65.5 Å²	65.5	45%	0.448	33%	0.332	S	S	.	.			trans	-144.2	124	179.9	54.5	0	0	0	0	111.1	H944 I949	H944-T947 PolarHBondContact O-N 2.82Å; T947-I949 PolarHBondContact O-N 2.72Å
948	E	48.4	Very low	68	Low	173 Å²	173	66 Å²	66	81%	0.808	33%	0.334	S	S	*	.	S	Bend	trans	-58.2	-34.4	179.7	-61.9	-176.5	143.6	0	0	113.2	K943	K943-E948 PolarHBondContact NZ-O 2.86Å
949	I	53.7	Low	68.1	Low	115 Å²	115	68.1 Å²	68.1	59%	0.59	35%	0.345	S	S	*	.	S	Bend	trans	-115.3	121.5	178.4	-54.4	173.4	0	0	0	108.5	T947	T947-I949 PolarHBondContact O-N 2.72Å
950	T	61.8	Low	68.3	Low	12 Å²	12	64.5 Å²	64.5	7%	0.074	33%	0.325	C	S	.	.			trans	-92	117.5	172.3	-54.5	0	0	0	0	109	K943 H944 F952 F960	K943-T950 WeakPolarHBondContact CA-OG1 3.46Å; H944-T950 PolarHBondContact N-OG1 3.45Å; T950-F952 HydrophobicContact CG2-CD2 4.45Å; T950-F952 HydrophobicContact CG2-CE2 3.89Å; T950-F952 HydrophobicContact CG2-CZ 4.1Å; T950-F960 HydrophobicContact CG2-CE1 4.2Å; T950-F960 HydrophobicContact CG2-CZ 4.22Å
951	K	67.4	Low	68.1	Low	129 Å²	129	69.7 Å²	69.7	56%	0.561	35%	0.352	S	S	*	.			trans	-95.8	124.1	172.9	-85	179.8	174	179.1	0	109.7	V923	V923-K951 HydrophobicContact CG1-CD 4.27Å; V923-K951 HydrophobicContact CG1-CG 3.81Å
952	F	80	Confident	67.7	Low	3 Å²	3	67.4 Å²	67.4	1%	0.013	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-93.1	109.4	170.8	-67.3	-93.3	0	0	0	107.4	V912 G921 T922 V926 L942 T950 E958 F960 W986	V912-F952 HydrophobicContact CB-CE1 4.46Å; V912-F952 HydrophobicContact CG1-CD1 4.36Å; V912-F952 HydrophobicContact CG1-CE1 4.2Å; G921-F952 CarbonylContact C-O 3.59Å; G921-F952 VanDerWaalsContact C-O 3.3Å; G921-F952 WeakPolarHBondContact CA-O 3.32Å; T922-F952 HydrophobicContact CG2-CB 4.09Å; T922-F952 HydrophobicContact CG2-CD2 4.16Å; T922-F952 HydrophobicContact CG2-CG 4.43Å; T922-F952 PolarHBondContact N-O 2.97Å; T922-F952 PolarHBondContact O-N 2.87Å; T922-F952 VanDerWaalsContact O-N 3.07Å; V926-F952 HydrophobicContact CB-CE2 3.7Å; V926-F952 HydrophobicContact CB-CZ 3.83Å; V926-F952 HydrophobicContact CG1-CZ 4.33Å; V926-F952 HydrophobicContact CG2-CD2 3.75Å; V926-F952 HydrophobicContact CG2-CE2 3.4Å; V926-F952 VanDerWaalsContact CG2-CE2 3.4Å; V926-F952 HydrophobicContact CG2-CZ 3.9Å; L942-F952 HydrophobicContact CB-CZ 4.08Å; T950-F952 HydrophobicContact CG2-CD2 4.45Å; T950-F952 HydrophobicContact CG2-CE2 3.89Å; T950-F952 HydrophobicContact CG2-CZ 4.1Å; F952-E958 HydrophobicContact CD1-CB 4.37Å; F952-E958 HydrophobicContact CD1-CG 4.19Å; F952-E958 WeakPolarHBondContact CD1-OE2 3.44Å; F952-E958 HydrophobicContact CE1-CB 4.23Å; F952-E958 HydrophobicContact CE1-CG 4.42Å; F952-F960 AromaticContact CE1-CE2 3.77Å; F952-F960 HydrophobicContact CE1-CE2 3.77Å; F952-F960 AromaticContact CE1-CZ 3.62Å; F952-F960 HydrophobicContact CE1-CZ 3.62Å; F952-F960 HydrophobicContact CZ-CE2 4.09Å; F952-F960 AromaticContact CZ-CZ 3.61Å; F952-F960 HydrophobicContact CZ-CZ 3.61Å; F952-W986 AromaticContact CD1-CZ2 3.88Å; F952-W986 HydrophobicContact CD1-CZ2 3.88Å; F952-W986 HydrophobicContact CE1-CZ2 4.28Å; F952-W986 HydrophobicContact CG-CZ2 4.25Å
953	E	78.8	Confident	67.1	Low	88 Å²	88	70.3 Å²	70.3	41%	0.411	37%	0.366	S	S	.	.			trans	-96.2	149.2	-173.4	-61.3	-173.9	151	0	0	112.5	T914 G955 K956	T914-E953 VanDerWaalsContact CB-O 3.29Å; T914-E953 WeakPolarHBondContact CB-O 3.34Å; T914-E953 VanDerWaalsContact CG2-O 3.32Å; T914-E953 WeakPolarHBondContact CG2-O 3.47Å; E953-G955 PolarHBondContact O-N 2.85Å; E953-K956 HydrophobicContact CB-CB 4.44Å; E953-K956 HydrophobicContact CB-CD 4Å; E953-K956 HydrophobicContact CB-CG 4.13Å; E953-K956 WeakPolarHBondContact O-CB 3.23Å; E953-K956 PolarHBondContact O-N 2.91Å; E953-K956 VanDerWaalsContact O-N 3.08Å; E953-K956 WeakPolarHBondContact OE2-CE 3.29Å; E953-K956 IonicContact OE2-NZ 3.88Å; E953-K956 PolarHBondContact OE2-NZ 2.86Å
954	A	76.8	Confident	67	Low	54 Å²	54	66.3 Å²	66.3	45%	0.446	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	124	178.6	0	0	0	0	0	111.8	G915 A920	G915-A954 CarbonylContact O-C 3.56Å; G915-A954 WeakPolarHBondContact O-CA 3.46Å; A920-A954 HydrophobicContact CB-CB 3.9Å
955	G	66.9	Low	67.3	Low	40 Å²	40	63 Å²	63	41%	0.412	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	15	-178.8	0	0	0	0	0	115.7	T914 G915 E953	T914-G955 CarbonylContact O-C 3.6Å; T914-G955 WeakPolarHBondContact O-CA 3.38Å; T914-G955 PolarHBondContact O-N 3.24Å; G915-G955 PolarHBondContact O-N 2.8Å; E953-G955 PolarHBondContact O-N 2.85Å
956	K	71.6	Confident	68.2	Low	83 Å²	83	60.2 Å²	60.2	36%	0.361	33%	0.325	S	S	.	.			trans	-103.9	162.8	178.6	-76.7	-158	177.3	165	0	115	L913 T914 E953 E958	L913-K956 WeakPolarHBondContact CA-O 3.5Å; T914-K956 PolarHBondContact N-O 2.77Å; E953-K956 HydrophobicContact CB-CB 4.44Å; E953-K956 HydrophobicContact CB-CD 4Å; E953-K956 HydrophobicContact CB-CG 4.13Å; E953-K956 WeakPolarHBondContact O-CB 3.23Å; E953-K956 PolarHBondContact O-N 2.91Å; E953-K956 VanDerWaalsContact O-N 3.08Å; E953-K956 WeakPolarHBondContact OE2-CE 3.29Å; E953-K956 IonicContact OE2-NZ 3.88Å; E953-K956 PolarHBondContact OE2-NZ 2.86Å; K956-E958 WeakPolarHBondContact CB-OE1 3.43Å
957	S	74.3	Confident	69.4	Low	17 Å²	17	56.6 Å²	56.6	12%	0.119	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	91.4	-176.2	179.7	0	0	0	0	108.7	V912 R1485 Q1491	V912-S957 CarbonylContact O-C 3.55Å; V912-S957 WeakPolarHBondContact O-CA 3.43Å; S957-R1485 PolarHBondContact OG-NH1 2.96Å; S957-R1485 VanDerWaalsContact OG-NH1 3.17Å; S957-Q1491 PolarHBondContact O-NE2 3.15Å; S957-Q1491 VanDerWaalsContact O-NE2 3.07Å
958	E	79.8	Confident	70.5	Confident	18 Å²	18	53.1 Å²	53.1	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	152.1	174.4	-69.1	75.2	-145.5	0	0	111.3	T911 V912 F952 K956 F960	T911-E958 CarbonylContact C-O 3.53Å; T911-E958 WeakPolarHBondContact CA-O 3.37Å; T911-E958 WeakPolarHBondContact CG2-O 3.1Å; V912-E958 PolarHBondContact N-O 2.71Å; V912-E958 PolarHBondContact O-N 2.88Å; F952-E958 HydrophobicContact CD1-CB 4.37Å; F952-E958 HydrophobicContact CD1-CG 4.19Å; F952-E958 WeakPolarHBondContact CD1-OE2 3.44Å; F952-E958 HydrophobicContact CE1-CB 4.23Å; F952-E958 HydrophobicContact CE1-CG 4.42Å; K956-E958 WeakPolarHBondContact CB-OE1 3.43Å; E958-F960 HydrophobicContact CB-CE2 3.61Å; E958-F960 HydrophobicContact CB-CZ 3.69Å; E958-F960 HydrophobicContact CG-CZ 4.48Å
959	E	75.3	Confident	71.7	Confident	93 Å²	93	48.1 Å²	48.1	44%	0.435	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	131.5	-174.3	-173	169.4	-123.6	0	0	113.1	N909 T911	N909-E959 VanDerWaalsContact ND2-CD 3.31Å; N909-E959 PolarHBondContact ND2-OE1 2.81Å; N909-E959 WeakPolarHBondContact OD1-CG 3.34Å; T911-E959 HydrophobicContact CG2-CB 4.31Å; T911-E959 PolarHBondContact OG1-OE1 3.39Å
960	F	78.7	Confident	73.2	Confident	9 Å²	9	42.8 Å²	42.8	4%	0.039	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	122.1	-168.3	-52.3	-86.9	0	0	0	112.1	N909 V910 V912 L942 H944 T950 F952 E958 L962	N909-F960 PolarHBondContact OD1-O 3.01Å; V910-F960 PolarHBondContact N-O 3.22Å; V910-F960 PolarHBondContact O-N 3.42Å; V912-F960 HydrophobicContact CB-CE2 4.36Å; V912-F960 HydrophobicContact CG2-CD2 4.19Å; V912-F960 HydrophobicContact CG2-CE2 4.07Å; L942-F960 HydrophobicContact CB-CD1 3.94Å; L942-F960 HydrophobicContact CB-CD2 4.14Å; L942-F960 HydrophobicContact CB-CE1 3.85Å; L942-F960 HydrophobicContact CB-CE2 4.06Å; L942-F960 HydrophobicContact CB-CG 4.09Å; L942-F960 HydrophobicContact CB-CZ 3.91Å; L942-F960 HydrophobicContact CD1-CD2 4.04Å; L942-F960 HydrophobicContact CD1-CE2 4.09Å; L942-F960 HydrophobicContact CD2-CB 4.05Å; L942-F960 HydrophobicContact CD2-CD2 4.14Å; L942-F960 HydrophobicContact CD2-CG 3.99Å; L942-F960 HydrophobicContact CG-CD2 4.34Å; L942-F960 HydrophobicContact CG-CG 4.46Å; H944-F960 AromaticContact CD2-CE1 3.75Å; T950-F960 HydrophobicContact CG2-CE1 4.2Å; T950-F960 HydrophobicContact CG2-CZ 4.22Å; F952-F960 AromaticContact CE1-CE2 3.77Å; F952-F960 HydrophobicContact CE1-CE2 3.77Å; F952-F960 AromaticContact CE1-CZ 3.62Å; F952-F960 HydrophobicContact CE1-CZ 3.62Å; F952-F960 HydrophobicContact CZ-CE2 4.09Å; F952-F960 AromaticContact CZ-CZ 3.61Å; F952-F960 HydrophobicContact CZ-CZ 3.61Å; E958-F960 HydrophobicContact CB-CE2 3.61Å; E958-F960 HydrophobicContact CB-CZ 3.69Å; E958-F960 HydrophobicContact CG-CZ 4.48Å; F960-L962 HydrophobicContact CB-CD2 4.21Å
961	I	74.2	Confident	74	Confident	125 Å²	125	47 Å²	47	64%	0.641	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	110.8	176.3	-58.1	178.2	0	0	0	109.8	A907	A907-I961 HydrophobicContact CB-CG2 3.79Å
962	L	74.8	Confident	74.6	Confident	17 Å²	17	43.4 Å²	43.4	9%	0.089	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	113.4	-175.2	-53.8	-176.6	0	0	0	110.8	A907 Y908 V910 V928 M940 L942 F960	A907-L962 CarbonylContact C-O 3.56Å; A907-L962 WeakPolarHBondContact CA-O 3.4Å; Y908-L962 PolarHBondContact N-O 2.73Å; Y908-L962 PolarHBondContact O-N 2.95Å; V910-L962 HydrophobicContact CB-CD1 4.23Å; V910-L962 HydrophobicContact CG2-CD1 3.61Å; V910-L962 HydrophobicContact CG2-CG 4.1Å; V928-L962 HydrophobicContact CG1-CD1 3.37Å; M940-L962 HydrophobicContact CB-CD1 4.45Å; M940-L962 HydrophobicContact CE-CB 4.16Å; M940-L962 HydrophobicContact CE-CD1 3.86Å; M940-L962 HydrophobicContact SD-CB 3.95Å; M940-L962 HydrophobicContact SD-CD1 4.39Å; L942-L962 HydrophobicContact CD2-CD1 3.87Å; L942-L962 HydrophobicContact CD2-CD2 4.16Å; F960-L962 HydrophobicContact CB-CD2 4.21Å
963	A	70.9	Confident	75	Confident	61 Å²	61	43.3 Å²	43.3	50%	0.504	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.5	-179.5	0	0	0	0	0	111.7	I906	I906-A963 WeakPolarHBondContact O-CA 3.23Å
964	C	70.1	Confident	75.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	-175	178.1	66.1	0	0	0	0	112	A905 I906	A905-C964 CarbonylContact C-O 3.58Å; A905-C964 WeakPolarHBondContact CA-O 3.26Å; I906-C964 PolarHBondContact N-O 3.12Å; I906-C964 PolarHBondContact O-N 3.49Å
965	G	64.4	Low	76.2	Confident	15 Å²	15	38.8 Å²	38.8	16%	0.155	21%	0.206	C	C	.	.	S	Bend	trans	-61	164.3	169.9	0	0	0	0	0	112.9	L967	G965-L967 PolarHBondContact O-N 2.81Å
966	K	68.6	Low	77.3	Confident	62 Å²	62	38.6 Å²	38.6	27%	0.27	19%	0.193	S	C	.	.			trans	-65.5	99.7	178.6	-179.3	-171.2	-170.3	-153.2	0	111.4	I906 G968 M1131	I906-K966 HydrophobicContact CD1-CB 3.73Å; I906-K966 HydrophobicContact CD1-CD 4.46Å; I906-K966 HydrophobicContact CD1-CG 3.63Å; I906-K966 HydrophobicContact CG1-CB 4.39Å; K966-G968 VanDerWaalsContact C-N 3.3Å; K966-G968 PolarHBondContact O-N 3.28Å; K966-M1131 HydrophobicContact CD-SD 3.74Å; K966-M1131 WeakPolarHBondContact CE-SD 3.43Å; K966-M1131 PolarHBondContact NZ-SD 2.53Å
967	L	73.3	Confident	78	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.176	C	C	.	.			trans	-73.7	-23.7	179	-51.7	-177.8	0	0	0	112.5	Y908 L930 G932 L933 Q934 G935 E936 G965 I970	Y908-L967 HydrophobicContact CD2-CD1 4.15Å; Y908-L967 HydrophobicContact CE1-CD1 4.35Å; Y908-L967 HydrophobicContact CE2-CB 4.32Å; Y908-L967 HydrophobicContact CE2-CD1 3.82Å; Y908-L967 HydrophobicContact CE2-CG 3.76Å; Y908-L967 PolarHBondContact OH-N 3.04Å; L930-L967 HydrophobicContact CB-CD1 3.36Å; L930-L967 HydrophobicContact CD1-CD1 4.04Å; L930-L967 HydrophobicContact CG-CD1 4.35Å; G932-L967 CarbonylContact C-O 3.54Å; G932-L967 WeakPolarHBondContact CA-O 3.49Å; L933-L967 PolarHBondContact N-O 3.38Å; L933-L967 VanDerWaalsContact N-O 3.15Å; Q934-L967 WeakPolarHBondContact CA-O 3.21Å; Q934-L967 PolarHBondContact N-O 3.18Å; G935-L967 PolarHBondContact N-O 3.24Å; E936-L967 VanDerWaalsContact C-CD2 3.45Å; G965-L967 PolarHBondContact O-N 2.81Å; L967-I970 HydrophobicContact CB-CD1 3.91Å; L967-I970 HydrophobicContact CD1-CD1 3.74Å; L967-I970 HydrophobicContact CG-CD1 4.48Å
968	G	70	Confident	78.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.			trans	70.1	-151	-170.8	0	0	0	0	0	111.2	K966 I970 L998	K966-G968 VanDerWaalsContact C-N 3.3Å; K966-G968 PolarHBondContact O-N 3.28Å; G968-I970 PolarHBondContact O-N 2.92Å; G968-L998 VanDerWaalsContact C-CD1 3.49Å
969	E	75.2	Confident	78.3	Confident	68 Å²	68	35.9 Å²	35.9	32%	0.318	18%	0.183	S	C	.	.	S	Bend	trans	-68.7	117.6	-174.3	-167.5	167.1	162.2	0	0	110.7	G932 L933 K971 L998 R1000 Y1002	G932-E969 CarbonylContact C-O 3.55Å; G932-E969 WeakPolarHBondContact CA-O 3.48Å; L933-E969 HydrophobicContact CB-CB 4.37Å; L933-E969 HydrophobicContact CD1-CB 3.81Å; L933-E969 HydrophobicContact CG-CB 4.05Å; L933-E969 PolarHBondContact N-O 3.06Å; E969-K971 PolarHBondContact O-N 3.31Å; E969-L998 HydrophobicContact CB-CD1 4.24Å; E969-R1000 IonicContact OE1-CZ 3.08Å; E969-R1000 IonicContact OE1-NH1 3.94Å; E969-R1000 PolarHBondContact OE1-NH1 2.78Å; E969-R1000 IonicContact OE1-NH2 3.63Å; E969-R1000 PolarHBondContact OE1-NH2 3.14Å; E969-R1000 IonicContact OE2-CZ 2.82Å; E969-R1000 IonicContact OE2-NH1 3.71Å; E969-R1000 PolarHBondContact OE2-NH1 2.99Å; E969-R1000 IonicContact OE2-NH2 3.08Å; E969-R1000 PolarHBondContact OE2-NH2 3.35Å; E969-Y1002 WeakPolarHBondContact CA-OH 3.31Å; E969-Y1002 HydrophobicContact CG-CE1 4.38Å
970	I	83.3	Confident	78.4	Confident	3 Å²	3	38 Å²	38	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.5	-175.1	-56.7	-62.8	0	0	0	109.3	Y908 L930 Y931 L967 G968 Y1002 F1004	Y908-I970 HydrophobicContact CD1-CD1 4.23Å; Y908-I970 HydrophobicContact CE1-CD1 3.82Å; Y908-I970 HydrophobicContact CE1-CG1 4.25Å; L930-I970 HydrophobicContact CB-CD1 4.47Å; Y931-I970 WeakPolarHBondContact O-CA 3.46Å; L967-I970 HydrophobicContact CB-CD1 3.91Å; L967-I970 HydrophobicContact CD1-CD1 3.74Å; L967-I970 HydrophobicContact CG-CD1 4.48Å; G968-I970 PolarHBondContact O-N 2.92Å; I970-Y1002 HydrophobicContact CB-CD1 3.95Å; I970-Y1002 HydrophobicContact CB-CD2 4.09Å; I970-Y1002 HydrophobicContact CB-CE1 3.76Å; I970-Y1002 HydrophobicContact CB-CE2 3.91Å; I970-Y1002 HydrophobicContact CB-CG 4.12Å; I970-Y1002 HydrophobicContact CG1-CD2 3.99Å; I970-Y1002 HydrophobicContact CG1-CE1 4.4Å; I970-Y1002 HydrophobicContact CG1-CE2 3.64Å; I970-Y1002 PolarHBondContact N-OH 3.07Å; I970-Y1002 VanDerWaalsContact N-OH 3.16Å; I970-Y1002 WeakPolarHBondContact O-CE1 3.46Å; I970-F1004 HydrophobicContact CG2-CZ 4.01Å
971	K	79.5	Confident	77.9	Confident	101 Å²	101	38.7 Å²	38.7	44%	0.439	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-38.5	174.8	-92.6	-170.7	156.8	-162.8	0	112.1	D631 Y931 L933 E969 P1025	D631-K971 IonicContact OD1-NZ 2.74Å; D631-K971 PolarHBondContact OD1-NZ 2.92Å; Y931-K971 PolarHBondContact O-N 3.13Å; L933-K971 HydrophobicContact CD2-CD 4.18Å; L933-K971 HydrophobicContact CD2-CG 4.35Å; E969-K971 PolarHBondContact O-N 3.31Å; K971-P1025 WeakPolarHBondContact O-CD 3.39Å
972	K	80.7	Confident	77.2	Confident	53 Å²	53	37.7 Å²	37.7	23%	0.23	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	148.6	-166.2	173.2	-166.8	172.4	-166.1	0	110.7	Y931 D1022 L1023	Y931-K972 HydrophobicContact CD2-CB 3.97Å; Y931-K972 HydrophobicContact CD2-CD 3.6Å; Y931-K972 HydrophobicContact CD2-CG 3.72Å; Y931-K972 HydrophobicContact CE2-CD 3.83Å; Y931-K972 HydrophobicContact CE2-CG 4.26Å; Y931-K972 HydrophobicContact CG-CB 4.41Å; Y931-K972 HydrophobicContact CG-CD 4.31Å; Y931-K972 PolarHBondContact N-O 3.06Å; Y931-K972 PolarHBondContact O-N 3.49Å; K972-D1022 WeakPolarHBondContact CE-OD1 3.43Å; K972-D1022 WeakPolarHBondContact CE-OD2 3.45Å; K972-D1022 IonicContact NZ-OD1 3.31Å; K972-D1022 PolarHBondContact NZ-OD1 3.49Å; K972-D1022 IonicContact NZ-OD2 3.09Å; K972-D1022 PolarHBondContact NZ-OD2 3.17Å; K972-L1023 CarbonylContact C-O 3.54Å; K972-L1023 VanDerWaalsContact CA-O 3.24Å; K972-L1023 WeakPolarHBondContact CA-O 3.49Å; K972-L1023 WeakPolarHBondContact CG-O 3.37Å
973	I	88.1	Confident	76.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.4	164.7	-168.9	167.3	0	0	0	109.2	V928 H929 L930 V991 V993 F1004 L1023	V928-I973 HydrophobicContact CG2-CD1 3.56Å; V928-I973 HydrophobicContact CG2-CG1 3.61Å; H929-I973 CarbonylContact O-C 3.59Å; H929-I973 WeakPolarHBondContact O-CA 3.23Å; L930-I973 HydrophobicContact CD2-CB 4.32Å; L930-I973 HydrophobicContact CD2-CD1 3.82Å; L930-I973 HydrophobicContact CD2-CG1 3.85Å; I973-V991 HydrophobicContact CD1-CG1 3.83Å; I973-V993 HydrophobicContact CD1-CG2 3.84Å; I973-F1004 HydrophobicContact CB-CD1 4.42Å; I973-F1004 HydrophobicContact CB-CE1 3.97Å; I973-F1004 HydrophobicContact CB-CE2 4.47Å; I973-F1004 HydrophobicContact CB-CZ 4.01Å; I973-F1004 HydrophobicContact CG2-CD1 3.4Å; I973-F1004 VanDerWaalsContact CG2-CD1 3.4Å; I973-F1004 HydrophobicContact CG2-CD2 4.19Å; I973-F1004 HydrophobicContact CG2-CE1 3.42Å; I973-F1004 VanDerWaalsContact CG2-CE1 3.42Å; I973-F1004 HydrophobicContact CG2-CE2 4.22Å; I973-F1004 HydrophobicContact CG2-CG 3.81Å; I973-F1004 HydrophobicContact CG2-CZ 3.86Å; I973-L1023 HydrophobicContact CG2-CB 3.76Å; I973-L1023 HydrophobicContact CG2-CD1 4.32Å; I973-L1023 PolarHBondContact N-O 2.99Å; I973-L1023 PolarHBondContact O-N 2.81Å
974	K	89.4	Confident	77.2	Confident	47 Å²	47	43.1 Å²	43.1	20%	0.204	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135	162.4	-178.7	-166	168.1	-143.8	0	108	V928 H929 Y931 W976 S1020 L1021 D1022	V928-K974 CarbonylContact C-O 3.59Å; V928-K974 VanDerWaalsContact CA-O 3.3Å; V928-K974 WeakPolarHBondContact CA-O 3.27Å; V928-K974 VanDerWaalsContact CG2-O 3.27Å; V928-K974 WeakPolarHBondContact CG2-O 3.45Å; H929-K974 HydrophobicContact CB-CB 4.22Å; H929-K974 PolarHBondContact N-O 2.93Å; H929-K974 PolarHBondContact O-N 2.76Å; Y931-K974 HydrophobicContact CE2-CB 4.12Å; K974-W976 HydrophobicContact CB-CE3 4.47Å; K974-W976 HydrophobicContact CB-CZ3 4.25Å; K974-W976 HydrophobicContact CD-CE3 3.76Å; K974-W976 HydrophobicContact CD-CH2 4.37Å; K974-W976 HydrophobicContact CD-CZ3 3.63Å; K974-W976 VanDerWaalsContact CE-CE3 3.49Å; K974-W976 HydrophobicContact CG-CE3 3.7Å; K974-W976 HydrophobicContact CG-CZ3 3.82Å; K974-S1020 WeakPolarHBondContact CE-OG 3.49Å; K974-L1021 CarbonylContact C-O 3.51Å; K974-L1021 VanDerWaalsContact CA-O 3.22Å; K974-L1021 WeakPolarHBondContact CA-O 3.24Å; K974-L1021 WeakPolarHBondContact CG-O 3.5Å; K974-D1022 VanDerWaalsContact CB-OD1 3.26Å; K974-D1022 WeakPolarHBondContact CB-OD1 3.44Å; K974-D1022 VanDerWaalsContact CG-OD1 3.3Å; K974-D1022 WeakPolarHBondContact CG-OD1 3.17Å
975	I	90.8	Very high	77.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.6	177.3	-165.8	166.8	0	0	0	110.2	V926 F927 V928 L942 W986 L988 V991 L1021 L1023	V926-I975 HydrophobicContact CG1-CD1 4.32Å; V926-I975 HydrophobicContact CG1-CG1 4.1Å; F927-I975 WeakPolarHBondContact O-CA 3.31Å; V928-I975 HydrophobicContact CG2-CB 4.1Å; V928-I975 HydrophobicContact CG2-CD1 4.31Å; V928-I975 HydrophobicContact CG2-CG1 4.12Å; L942-I975 HydrophobicContact CD1-CD1 4.46Å; I975-W986 HydrophobicContact CD1-CH2 3.86Å; I975-W986 HydrophobicContact CD1-CZ3 4.14Å; I975-W986 HydrophobicContact CG1-CH2 4.46Å; I975-W986 HydrophobicContact CG1-CZ3 4.26Å; I975-L988 HydrophobicContact CD1-CD2 4.09Å; I975-L988 HydrophobicContact CG2-CD2 3.96Å; I975-V991 HydrophobicContact CD1-CG2 3.86Å; I975-L1021 HydrophobicContact CG2-CB 4Å; I975-L1021 PolarHBondContact N-O 3.25Å; I975-L1021 PolarHBondContact O-N 3.47Å; I975-L1023 HydrophobicContact CG2-CD1 4.37Å
976	W	90.3	Very high	78.7	Confident	37 Å²	37	43.2 Å²	43.2	14%	0.14	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	170.6	-176.2	70.4	100.7	0	0	0	112.3	V926 F927 H929 D939 K974 I1019	V926-W976 CarbonylContact C-O 3.53Å; V926-W976 WeakPolarHBondContact CA-O 3.49Å; F927-W976 HydrophobicContact CB-CD2 3.79Å; F927-W976 VanDerWaalsContact CB-CE2 3.4Å; F927-W976 HydrophobicContact CB-CE3 4.18Å; F927-W976 HydrophobicContact CB-CG 4.38Å; F927-W976 HydrophobicContact CB-CH2 3.91Å; F927-W976 HydrophobicContact CB-CZ2 3.5Å; F927-W976 VanDerWaalsContact CB-CZ2 3.5Å; F927-W976 HydrophobicContact CB-CZ3 4.23Å; F927-W976 AromaticContact CD2-NE1 3.85Å; F927-W976 HydrophobicContact CG-CZ2 4.19Å; F927-W976 AromaticContact CG-NE1 3.94Å; F927-W976 PolarHBondContact N-O 3.35Å; F927-W976 PolarHBondContact O-N 3.18Å; H929-W976 HydrophobicContact CB-CH2 4.13Å; H929-W976 HydrophobicContact CB-CZ3 3.93Å; D939-W976 HydrophobicContact CB-CH2 3.87Å; D939-W976 HydrophobicContact CB-CZ2 4.02Å; D939-W976 WeakPolarHBondContact OD1-CH2 3.46Å; D939-W976 VanDerWaalsContact OD2-CZ2 3.29Å; D939-W976 WeakPolarHBondContact OD2-CZ2 3.29Å; K974-W976 HydrophobicContact CB-CE3 4.47Å; K974-W976 HydrophobicContact CB-CZ3 4.25Å; K974-W976 HydrophobicContact CD-CE3 3.76Å; K974-W976 HydrophobicContact CD-CH2 4.37Å; K974-W976 HydrophobicContact CD-CZ3 3.63Å; K974-W976 VanDerWaalsContact CE-CE3 3.49Å; K974-W976 HydrophobicContact CG-CE3 3.7Å; K974-W976 HydrophobicContact CG-CZ3 3.82Å; W976-I1019 VanDerWaalsContact CA-O 3.24Å; W976-I1019 WeakPolarHBondContact CA-O 3.5Å; W976-I1019 VanDerWaalsContact CB-O 3.27Å; W976-I1019 WeakPolarHBondContact CB-O 3.41Å
977	H	87.2	Confident	79.5	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	156.1	172.4	66.9	111.1	0	0	0	112.1	A924 N925 V926 S979 S984 L1010 I1019	A924-H977 HydrophobicContact CB-CB 3.85Å; N925-H977 WeakPolarHBondContact O-CA 3.3Å; V926-H977 HydrophobicContact CG2-CB 4.29Å; H977-S979 PolarHBondContact CE1-OG 3.46Å; H977-S979 VanDerWaalsContact CE1-OG 3.3Å; H977-S979 PolarHBondContact ND1-OG 2.98Å; H977-S984 PolarHBondContact CE1-O 3.37Å; H977-S984 PolarHBondContact ND1-O 3.34Å; H977-L1010 PolarHBondContact NE2-O 2.71Å; H977-I1019 PolarHBondContact CD2-O 2.7Å; H977-I1019 VanDerWaalsContact CD2-O 3.29Å; H977-I1019 PolarHBondContact N-O 3.14Å; H977-I1019 VanDerWaalsContact N-O 3.15Å; H977-I1019 VanDerWaalsContact NE2-CB 3.33Å; H977-I1019 WeakPolarHBondContact NE2-CB 3.45Å; H977-I1019 WeakPolarHBondContact NE2-CG2 3.37Å
978	D	81.7	Confident	80.1	Confident	41 Å²	41	42.1 Å²	42.1	22%	0.219	22%	0.218	C	C	.	.			trans	-75.1	-20.9	-175.9	66.4	0.4	0	0	0	115	N925 F927 I980	N925-D978 VanDerWaalsContact CB-OD2 3.31Å; N925-D978 WeakPolarHBondContact CB-OD2 3.43Å; N925-D978 PolarHBondContact N-OD1 2.89Å; N925-D978 VanDerWaalsContact N-OD1 3.1Å; N925-D978 PolarHBondContact ND2-OD2 3.42Å; N925-D978 PolarHBondContact O-N 2.98Å; N925-D978 VanDerWaalsContact O-N 3.1Å; F927-D978 HydrophobicContact CE2-CB 4.2Å; D978-I980 HydrophobicContact CB-CD1 4.15Å; D978-I980 HydrophobicContact CB-CG1 3.96Å; D978-I980 PolarHBondContact O-N 2.94Å; D978-I980 PolarHBondContact OD1-N 2.93Å; D978-I980 WeakPolarHBondContact OD2-CD1 3.45Å; D978-I980 WeakPolarHBondContact OD2-CG1 3.48Å
979	S	77.9	Confident	80.6	Confident	18 Å²	18	43.8 Å²	43.8	13%	0.126	23%	0.227	C	C	.	.			trans	59.2	24	-172.5	-47.3	0	0	0	0	115.3	H977 I1019	H977-S979 PolarHBondContact CE1-OG 3.46Å; H977-S979 VanDerWaalsContact CE1-OG 3.3Å; H977-S979 PolarHBondContact ND1-OG 2.98Å; S979-I1019 WeakPolarHBondContact OG-CD1 3.38Å; S979-I1019 WeakPolarHBondContact OG-CG2 3.35Å
980	I	76.5	Confident	81.1	Confident	137 Å²	137	41.9 Å²	41.9	70%	0.703	22%	0.218	S	C	*	.			trans	-75.2	-35	-179.3	-66.6	-179.4	0	0	0	111.4	D978	D978-I980 HydrophobicContact CB-CD1 4.15Å; D978-I980 HydrophobicContact CB-CG1 3.96Å; D978-I980 PolarHBondContact O-N 2.94Å; D978-I980 PolarHBondContact OD1-N 2.93Å; D978-I980 WeakPolarHBondContact OD2-CD1 3.45Å; D978-I980 WeakPolarHBondContact OD2-CG1 3.48Å
981	A	68.6	Low	81.3	Confident	24 Å²	24	41.8 Å²	41.8	20%	0.198	22%	0.218	C	C	.	.	S	Bend	trans	-78.9	146.4	180	0	0	0	0	0	112.9	V923 S984	V923-A981 HydrophobicContact CB-CB 4.05Å; V923-A981 HydrophobicContact CG2-CB 3.65Å; A981-S984 WeakPolarHBondContact O-CB 3.44Å; A981-S984 PolarHBondContact O-OG 2.8Å
982	P	59.4	Low	81.7	Confident	103 Å²	103	37.2 Å²	37.2	67%	0.669	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	148.9	166.8	28.8	-34.1	0	0	0	110.6	V923	V923-P982 WeakPolarHBondContact CG2-O 3.22Å
983	H	68.1	Low	82.1	Confident	169 Å²	169	34.7 Å²	34.7	78%	0.782	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.8	47.4	-168.8	-51.5	-75.8	0	0	0	112.9
984	S	77.3	Confident	81.8	Confident	24 Å²	24	35.9 Å²	35.9	17%	0.168	19%	0.193	C	C	.	.			trans	-81.6	-6.5	-177.5	29.3	0	0	0	0	115.5	T922 H977 A981	T922-S984 VanDerWaalsContact OG1-C 3.29Å; T922-S984 WeakPolarHBondContact OG1-CA 3.25Å; T922-S984 PolarHBondContact OG1-O 3.06Å; H977-S984 PolarHBondContact CE1-O 3.37Å; H977-S984 PolarHBondContact ND1-O 3.34Å; A981-S984 WeakPolarHBondContact O-CB 3.44Å; A981-S984 PolarHBondContact O-OG 2.8Å
985	G	77.7	Confident	81.6	Confident	18 Å²	18	33.6 Å²	33.6	19%	0.186	18%	0.183	C	C	.	.			trans	-63.6	141.5	175.8	0	0	0	0	0	112.2	L1010	G985-L1010 WeakPolarHBondContact CA-O 3.46Å
986	W	88.5	Confident	80.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	125.8	-170.5	-173.8	32.4	0	0	0	110.9	V912 T914 A920 T922 V926 F952 I975 L988 W1009 L1010	V912-W986 HydrophobicContact CG1-CH2 3.7Å; V912-W986 HydrophobicContact CG1-CZ2 3.46Å; V912-W986 VanDerWaalsContact CG1-CZ2 3.46Å; T914-W986 PolarHBondContact OG1-NE1 3.17Å; A920-W986 CarbonylContact O-C 3.53Å; A920-W986 WeakPolarHBondContact O-CA 3.3Å; A920-W986 VanDerWaalsContact O-CD1 3.31Å; T922-W986 HydrophobicContact CG2-CB 3.71Å; T922-W986 HydrophobicContact CG2-CD2 3.86Å; T922-W986 HydrophobicContact CG2-CG 3.45Å; T922-W986 VanDerWaalsContact CG2-CG 3.45Å; V926-W986 HydrophobicContact CB-CZ3 4.47Å; V926-W986 HydrophobicContact CG1-CH2 3.7Å; V926-W986 HydrophobicContact CG1-CZ3 3.63Å; V926-W986 HydrophobicContact CG2-CE3 4.14Å; V926-W986 HydrophobicContact CG2-CH2 4.13Å; V926-W986 HydrophobicContact CG2-CZ3 3.9Å; F952-W986 AromaticContact CD1-CZ2 3.88Å; F952-W986 HydrophobicContact CD1-CZ2 3.88Å; F952-W986 HydrophobicContact CE1-CZ2 4.28Å; F952-W986 HydrophobicContact CG-CZ2 4.25Å; I975-W986 HydrophobicContact CD1-CH2 3.86Å; I975-W986 HydrophobicContact CD1-CZ3 4.14Å; I975-W986 HydrophobicContact CG1-CH2 4.46Å; I975-W986 HydrophobicContact CG1-CZ3 4.26Å; W986-L988 HydrophobicContact CH2-CD1 4.01Å; W986-L988 HydrophobicContact CH2-CD2 4.01Å; W986-L988 HydrophobicContact CH2-CG 4.49Å; W986-L988 HydrophobicContact CZ2-CD1 3.87Å; W986-L988 HydrophobicContact CZ3-CD2 4.07Å; W986-W1009 VanDerWaalsContact C-CE3 3.44Å; W986-W1009 CarbonylContact O-C 3.48Å; W986-W1009 WeakPolarHBondContact O-CA 3.38Å; W986-L1010 HydrophobicContact CB-CB 4.41Å; W986-L1010 HydrophobicContact CD2-CD1 4.45Å; W986-L1010 HydrophobicContact CE3-CB 4.5Å; W986-L1010 HydrophobicContact CE3-CD1 3.47Å; W986-L1010 VanDerWaalsContact CE3-CD1 3.47Å; W986-L1010 HydrophobicContact CZ3-CD1 3.73Å; W986-L1010 PolarHBondContact N-O 2.84Å; W986-L1010 PolarHBondContact O-N 2.92Å
987	F	86.2	Confident	80	Confident	39 Å²	39	35.2 Å²	35.2	17%	0.171	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.8	170.8	-160.5	-80.9	0	0	0	109.6	G915 C917 A920 D989 N1007 R1008 W1009	G915-F987 PolarHBondContact N-O 3.01Å; C917-F987 VanDerWaalsContact SG-CG 3.53Å; A920-F987 HydrophobicContact CB-CB 3.73Å; A920-F987 PolarHBondContact O-N 3.1Å; F987-D989 WeakPolarHBondContact CD1-OD1 3.35Å; F987-D989 WeakPolarHBondContact CE1-OD1 3.36Å; F987-N1007 WeakPolarHBondContact CZ-O 3.25Å; F987-R1008 WeakPolarHBondContact CA-O 3.47Å; F987-W1009 HydrophobicContact CB-CD2 4.06Å; F987-W1009 HydrophobicContact CB-CE3 3.93Å; F987-W1009 HydrophobicContact CB-CH2 4.36Å; F987-W1009 HydrophobicContact CB-CZ2 4.48Å; F987-W1009 HydrophobicContact CB-CZ3 4.09Å; F987-W1009 HydrophobicContact CD2-CB 4.44Å; F987-W1009 AromaticContact CD2-CD1 3.65Å; F987-W1009 AromaticContact CD2-CD2 3.71Å; F987-W1009 HydrophobicContact CD2-CD2 3.71Å; F987-W1009 AromaticContact CD2-CE2 3.7Å; F987-W1009 HydrophobicContact CD2-CE3 4.43Å; F987-W1009 AromaticContact CD2-CG 3.67Å; F987-W1009 HydrophobicContact CD2-CG 3.67Å; F987-W1009 HydrophobicContact CD2-CZ2 4.39Å; F987-W1009 AromaticContact CD2-NE1 3.66Å; F987-W1009 AromaticContact CE2-CD1 3.98Å; F987-W1009 HydrophobicContact CE2-CG 4.34Å; F987-W1009 HydrophobicContact CG-CD2 4.39Å
988	L	86	Confident	79.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.8	-177.1	178	57.3	0	0	0	109	V912 I975 W986 V991 V1006 N1007 R1008 L1010	V912-L988 HydrophobicContact CG1-CD1 3.72Å; I975-L988 HydrophobicContact CD1-CD2 4.09Å; I975-L988 HydrophobicContact CG2-CD2 3.96Å; W986-L988 HydrophobicContact CH2-CD1 4.01Å; W986-L988 HydrophobicContact CH2-CD2 4.01Å; W986-L988 HydrophobicContact CH2-CG 4.49Å; W986-L988 HydrophobicContact CZ2-CD1 3.87Å; W986-L988 HydrophobicContact CZ3-CD2 4.07Å; L988-V991 HydrophobicContact CD1-CG2 3.96Å; L988-V991 HydrophobicContact CD2-CG2 3.92Å; L988-V991 HydrophobicContact CG-CG2 4.31Å; L988-V1006 HydrophobicContact CB-CB 4.39Å; L988-V1006 HydrophobicContact CB-CG1 3.95Å; L988-V1006 HydrophobicContact CD2-CB 4.39Å; L988-V1006 HydrophobicContact CD2-CG1 4.06Å; L988-V1006 HydrophobicContact CD2-CG2 4.07Å; L988-V1006 HydrophobicContact CG-CB 3.95Å; L988-V1006 HydrophobicContact CG-CG1 3.88Å; L988-V1006 HydrophobicContact CG-CG2 3.99Å; L988-V1006 CarbonylContact O-C 3.59Å; L988-V1006 WeakPolarHBondContact O-CB 3.21Å; L988-V1006 WeakPolarHBondContact O-CG1 3.45Å; L988-N1007 WeakPolarHBondContact O-CA 3.37Å; L988-N1007 PolarHBondContact O-N 3.01Å; L988-R1008 PolarHBondContact N-O 3.03Å; L988-R1008 PolarHBondContact O-N 3.46Å; L988-L1010 HydrophobicContact CB-CD1 4.41Å; L988-L1010 HydrophobicContact CD2-CD1 3.96Å
989	D	79.6	Confident	79	Confident	35 Å²	35	34.8 Å²	34.8	19%	0.187	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-52.3	-179.7	-78.4	9.5	0	0	0	110.9	L913 G915 F987 V1006 N1007	L913-D989 HydrophobicContact CD2-CB 4.11Å; L913-D989 HydrophobicContact CG-CB 4.33Å; L913-D989 PolarHBondContact O-N 3.35Å; G915-D989 WeakPolarHBondContact CA-OD1 3.45Å; G915-D989 WeakPolarHBondContact CA-OD2 3.42Å; F987-D989 WeakPolarHBondContact CD1-OD1 3.35Å; F987-D989 WeakPolarHBondContact CE1-OD1 3.36Å; D989-V1006 PolarHBondContact O-N 3.08Å; D989-N1007 PolarHBondContact O-N 3.34Å; D989-N1007 VanDerWaalsContact O-N 3.11Å
990	E	85.8	Confident	79	Confident	29 Å²	29	36.5 Å²	36.5	14%	0.136	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.7	-175.6	178.9	174.1	97.1	0	0	111.9	L913 V992 V1003 F1004 H1005	L913-E990 HydrophobicContact CB-CB 4.1Å; L913-E990 HydrophobicContact CD2-CB 4.18Å; L913-E990 PolarHBondContact N-O 3.01Å; L913-E990 PolarHBondContact O-N 2.93Å; E990-V992 HydrophobicContact CG-CG2 4.02Å; E990-V992 WeakPolarHBondContact OE1-CG2 3.32Å; E990-V1003 HydrophobicContact CG-CG1 4.03Å; E990-V1003 WeakPolarHBondContact OE2-CG1 3.42Å; E990-F1004 WeakPolarHBondContact CA-O 3.39Å; E990-H1005 IonicContact OE2-CE1 2.74Å; E990-H1005 PolarHBondContact OE2-CE1 3.37Å; E990-H1005 IonicContact OE2-ND1 2.73Å; E990-H1005 PolarHBondContact OE2-ND1 3.15Å
991	V	88.5	Confident	79.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.4	160.2	-175.1	0	0	0	0	109.2	V910 T911 V912 I973 I975 L988 F1004	V910-V991 HydrophobicContact CG1-CG1 3.87Å; T911-V991 WeakPolarHBondContact O-CA 3.15Å; V912-V991 HydrophobicContact CG2-CG1 4.41Å; I973-V991 HydrophobicContact CD1-CG1 3.83Å; I975-V991 HydrophobicContact CD1-CG2 3.86Å; L988-V991 HydrophobicContact CD1-CG2 3.96Å; L988-V991 HydrophobicContact CD2-CG2 3.92Å; L988-V991 HydrophobicContact CG-CG2 4.31Å; V991-F1004 HydrophobicContact CB-CB 4.38Å; V991-F1004 PolarHBondContact N-O 2.77Å; V991-F1004 WeakPolarHBondContact O-CB 2.95Å; V991-F1004 PolarHBondContact O-N 2.8Å
992	V	86.8	Confident	80.1	Confident	6 Å²	6	32.7 Å²	32.7	4%	0.036	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.8	175.3	-179.5	0	0	0	0	108.7	V910 T911 E990 I994 R1001 Y1002	V910-V992 CarbonylContact C-O 3.53Å; V910-V992 VanDerWaalsContact CA-O 3.28Å; V910-V992 WeakPolarHBondContact CA-O 3.3Å; T911-V992 PolarHBondContact N-O 3.49Å; T911-V992 PolarHBondContact O-N 3.39Å; E990-V992 HydrophobicContact CG-CG2 4.02Å; E990-V992 WeakPolarHBondContact OE1-CG2 3.32Å; V992-I994 HydrophobicContact CG1-CG1 4.23Å; V992-R1001 HydrophobicContact CG1-CG 3.67Å; V992-R1001 VanDerWaalsContact CG1-NE 3.34Å; V992-Y1002 WeakPolarHBondContact CA-O 3.43Å
993	V	89.6	Confident	81.2	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.1	172.2	-177.3	0	0	0	0	109.1	Y908 N909 V910 L930 I973 Y1002 F1004	Y908-V993 HydrophobicContact CD1-CG1 4.11Å; N909-V993 CarbonylContact O-C 3.59Å; N909-V993 WeakPolarHBondContact O-CA 3.42Å; V910-V993 HydrophobicContact CG1-CG2 4.42Å; V910-V993 HydrophobicContact CG2-CG1 4.37Å; V910-V993 HydrophobicContact CG2-CG2 4.2Å; L930-V993 HydrophobicContact CD1-CG1 4.46Å; L930-V993 HydrophobicContact CD2-CG1 4.2Å; L930-V993 HydrophobicContact CD2-CG2 3.92Å; I973-V993 HydrophobicContact CD1-CG2 3.84Å; V993-Y1002 PolarHBondContact N-O 2.9Å; V993-Y1002 WeakPolarHBondContact O-CD2 3.42Å; V993-Y1002 PolarHBondContact O-N 2.94Å; V993-F1004 HydrophobicContact CB-CE2 4.18Å; V993-F1004 HydrophobicContact CG2-CD2 4.34Å; V993-F1004 HydrophobicContact CG2-CE2 3.74Å
994	I	82.8	Confident	82.1	Confident	24 Å²	24	20 Å²	20	12%	0.123	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.9	176.9	-57.1	176.3	0	0	0	109.4	Y908 N909 V992 Y996 R1001 I1031	Y908-I994 WeakPolarHBondContact CA-O 3.36Å; N909-I994 HydrophobicContact CB-CB 4.32Å; N909-I994 PolarHBondContact N-O 2.7Å; N909-I994 VanDerWaalsContact N-O 3.14Å; N909-I994 PolarHBondContact O-N 3.25Å; V992-I994 HydrophobicContact CG1-CG1 4.23Å; I994-Y996 HydrophobicContact CB-CE2 4.48Å; I994-Y996 HydrophobicContact CG2-CD1 3.83Å; I994-Y996 HydrophobicContact CG2-CD2 4.17Å; I994-Y996 HydrophobicContact CG2-CE1 3.68Å; I994-Y996 HydrophobicContact CG2-CE2 4.04Å; I994-Y996 HydrophobicContact CG2-CG 4.06Å; I994-R1001 HydrophobicContact CG1-CB 4.32Å; I994-R1001 HydrophobicContact CG1-CG 4.19Å; I994-I1031 HydrophobicContact CG2-CD1 3.51Å
995	D	84	Confident	82.1	Confident	0 Å²	0	24 Å²	24	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	94.8	164.9	-173.6	-31.1	0	0	0	108.6	Y908 F997 L998 G999 R1000 Y1002	Y908-D995 HydrophobicContact CD1-CB 4.04Å; Y908-D995 HydrophobicContact CE1-CB 3.68Å; Y908-D995 WeakPolarHBondContact CE1-OD2 3.26Å; Y908-D995 PolarHBondContact OH-OD2 3.14Å; D995-F997 PolarHBondContact O-N 2.79Å; D995-F997 WeakPolarHBondContact OD1-CA 3.25Å; D995-F997 WeakPolarHBondContact OD1-CB 3.44Å; D995-F997 PolarHBondContact OD1-N 3.06Å; D995-L998 HydrophobicContact CB-CB 4.36Å; D995-L998 PolarHBondContact OD1-N 3.33Å; D995-L998 WeakPolarHBondContact OD2-CD1 3.42Å; D995-L998 WeakPolarHBondContact OD2-CG 3.3Å; D995-G999 PolarHBondContact O-N 3.48Å; D995-R1000 PolarHBondContact N-O 3.25Å; D995-R1000 PolarHBondContact O-N 3.07Å; D995-Y1002 HydrophobicContact CB-CE2 3.85Å
996	Y	73.4	Confident	82.3	Confident	53 Å²	53	24.1 Å²	24.1	21%	0.208	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.5	176.5	-73	-65.8	0	0	0	113.4	N909 I994 I1031 R1033 M1034 F1091	N909-Y996 HydrophobicContact CB-CE2 3.77Å; I994-Y996 HydrophobicContact CB-CE2 4.48Å; I994-Y996 HydrophobicContact CG2-CD1 3.83Å; I994-Y996 HydrophobicContact CG2-CD2 4.17Å; I994-Y996 HydrophobicContact CG2-CE1 3.68Å; I994-Y996 HydrophobicContact CG2-CE2 4.04Å; I994-Y996 HydrophobicContact CG2-CG 4.06Å; Y996-I1031 HydrophobicContact CD1-CD1 4.38Å; Y996-R1033 WeakPolarHBondContact O-CA 3.36Å; Y996-M1034 HydrophobicContact CD1-CG 4.4Å; Y996-M1034 HydrophobicContact CD1-SD 3.79Å; Y996-M1034 HydrophobicContact CE1-SD 4.12Å; Y996-M1034 PolarHBondContact O-N 3.4Å; Y996-F1091 HydrophobicContact CD2-CB 4.46Å; Y996-F1091 HydrophobicContact CD2-CG 4.35Å; Y996-F1091 HydrophobicContact CG-CB 4.43Å
997	F	73.8	Confident	82	Confident	18 Å²	18	29 Å²	29	8%	0.079	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-45.8	-177.3	166.5	-100	0	0	0	112	I906 D995 G999 R1033 F1127 F1128 M1131	I906-F997 HydrophobicContact CD1-CB 3.96Å; I906-F997 HydrophobicContact CD1-CD1 3.71Å; I906-F997 HydrophobicContact CD1-CD2 4.46Å; I906-F997 HydrophobicContact CD1-CE1 4.39Å; I906-F997 HydrophobicContact CD1-CG 3.75Å; I906-F997 HydrophobicContact CG2-CB 4.06Å; D995-F997 PolarHBondContact O-N 2.79Å; D995-F997 WeakPolarHBondContact OD1-CA 3.25Å; D995-F997 WeakPolarHBondContact OD1-CB 3.44Å; D995-F997 PolarHBondContact OD1-N 3.06Å; F997-G999 VanDerWaalsContact C-N 3.26Å; F997-R1033 WeakPolarHBondContact O-CD 3.42Å; F997-F1127 HydrophobicContact CD2-CD1 4.09Å; F997-F1127 AromaticContact CD2-CE1 3.51Å; F997-F1127 HydrophobicContact CD2-CE1 3.51Å; F997-F1127 HydrophobicContact CD2-CZ 4.23Å; F997-F1127 HydrophobicContact CE2-CD1 4.05Å; F997-F1127 AromaticContact CE2-CE1 3.83Å; F997-F1127 HydrophobicContact CE2-CE1 3.83Å; F997-F1127 HydrophobicContact CE2-CZ 4.47Å; F997-F1128 HydrophobicContact CD2-CD1 4.43Å; F997-F1128 AromaticContact CD2-CE1 3.78Å; F997-F1128 HydrophobicContact CD2-CE1 3.78Å; F997-F1128 AromaticContact CE2-CD1 3.82Å; F997-F1128 HydrophobicContact CE2-CD1 3.82Å; F997-F1128 AromaticContact CE2-CE1 3.63Å; F997-F1128 HydrophobicContact CE2-CE1 3.63Å; F997-M1131 HydrophobicContact CD2-CE 4.41Å; F997-M1131 HydrophobicContact CE1-SD 4.14Å; F997-M1131 HydrophobicContact CE2-CE 3.6Å; F997-M1131 HydrophobicContact CE2-SD 3.97Å; F997-M1131 HydrophobicContact CZ-CE 3.71Å; F997-M1131 HydrophobicContact CZ-CG 4.49Å; F997-M1131 HydrophobicContact CZ-SD 3.42Å; F997-M1131 WeakPolarHBondContact CZ-SD 3.48Å
998	L	73.4	Confident	81.7	Confident	32 Å²	32	29.5 Å²	29.5	17%	0.168	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.1	172.1	-71.2	-176.2	0	0	0	112.3	G968 E969 D995 R1000 R1033	G968-L998 VanDerWaalsContact C-CD1 3.49Å; E969-L998 HydrophobicContact CB-CD1 4.24Å; D995-L998 HydrophobicContact CB-CB 4.36Å; D995-L998 PolarHBondContact OD1-N 3.33Å; D995-L998 WeakPolarHBondContact OD2-CD1 3.42Å; D995-L998 WeakPolarHBondContact OD2-CG 3.3Å; L998-R1000 HydrophobicContact CB-CG 4.19Å; L998-R1033 PolarHBondContact O-NE 2.89Å; L998-R1033 PolarHBondContact O-NH2 2.94Å
999	G	74.2	Confident	81.6	Confident	2 Å²	2	31.3 Å²	31.3	2%	0.021	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	50.9	-172.5	0	0	0	0	0	110.2	D995 F997 N1030 I1031	D995-G999 PolarHBondContact O-N 3.48Å; F997-G999 VanDerWaalsContact C-N 3.26Å; G999-N1030 WeakPolarHBondContact O-CA 3.45Å; G999-I1031 WeakPolarHBondContact CA-O 3.08Å; G999-I1031 PolarHBondContact O-N 3.31Å
1000	R	79	Confident	81.9	Confident	54 Å²	54	29.7 Å²	29.7	20%	0.204	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134	-177.1	-66.8	-176.7	-178.8	-152	26.3	112.6	E969 D995 L998 Y1002 I1028 I1029	E969-R1000 IonicContact OE1-CZ 3.08Å; E969-R1000 IonicContact OE1-NH1 3.94Å; E969-R1000 PolarHBondContact OE1-NH1 2.78Å; E969-R1000 IonicContact OE1-NH2 3.63Å; E969-R1000 PolarHBondContact OE1-NH2 3.14Å; E969-R1000 IonicContact OE2-CZ 2.82Å; E969-R1000 IonicContact OE2-NH1 3.71Å; E969-R1000 PolarHBondContact OE2-NH1 2.99Å; E969-R1000 IonicContact OE2-NH2 3.08Å; E969-R1000 PolarHBondContact OE2-NH2 3.35Å; D995-R1000 PolarHBondContact N-O 3.25Å; D995-R1000 PolarHBondContact O-N 3.07Å; L998-R1000 HydrophobicContact CB-CG 4.19Å; R1000-Y1002 HydrophobicContact CB-CD2 4.49Å; R1000-Y1002 HydrophobicContact CB-CE2 3.82Å; R1000-Y1002 WeakPolarHBondContact CD-OH 3.38Å; R1000-I1028 HydrophobicContact CB-CG2 4.32Å; R1000-I1028 HydrophobicContact CG-CG2 4.35Å; R1000-I1029 CarbonylContact C-O 3.54Å; R1000-I1029 WeakPolarHBondContact CA-O 3.41Å
1001	R	82.3	Confident	81.7	Confident	80 Å²	80	28.4 Å²	28.4	30%	0.302	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.4	164.5	174.1	179.4	173.3	-174.7	-2.2	108.6	V992 I994 V1003 I1028 I1029 I1031	V992-R1001 HydrophobicContact CG1-CG 3.67Å; V992-R1001 VanDerWaalsContact CG1-NE 3.34Å; I994-R1001 HydrophobicContact CG1-CB 4.32Å; I994-R1001 HydrophobicContact CG1-CG 4.19Å; R1001-V1003 HydrophobicContact CG-CG2 4.19Å; R1001-I1028 WeakPolarHBondContact O-CA 3.36Å; R1001-I1029 HydrophobicContact CB-CB 4.38Å; R1001-I1029 PolarHBondContact N-O 2.86Å; R1001-I1029 PolarHBondContact O-N 2.86Å; R1001-I1031 HydrophobicContact CB-CG2 4.42Å
1002	Y	86.5	Confident	81	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.2	173.4	-53.9	-95.5	0	0	0	108.5	E969 I970 V992 V993 D995 R1000 P1025 I1028	E969-Y1002 WeakPolarHBondContact CA-OH 3.31Å; E969-Y1002 HydrophobicContact CG-CE1 4.38Å; I970-Y1002 HydrophobicContact CB-CD1 3.95Å; I970-Y1002 HydrophobicContact CB-CD2 4.09Å; I970-Y1002 HydrophobicContact CB-CE1 3.76Å; I970-Y1002 HydrophobicContact CB-CE2 3.91Å; I970-Y1002 HydrophobicContact CB-CG 4.12Å; I970-Y1002 HydrophobicContact CG1-CD2 3.99Å; I970-Y1002 HydrophobicContact CG1-CE1 4.4Å; I970-Y1002 HydrophobicContact CG1-CE2 3.64Å; I970-Y1002 PolarHBondContact N-OH 3.07Å; I970-Y1002 VanDerWaalsContact N-OH 3.16Å; I970-Y1002 WeakPolarHBondContact O-CE1 3.46Å; V992-Y1002 WeakPolarHBondContact CA-O 3.43Å; V993-Y1002 PolarHBondContact N-O 2.9Å; V993-Y1002 WeakPolarHBondContact O-CD2 3.42Å; V993-Y1002 PolarHBondContact O-N 2.94Å; D995-Y1002 HydrophobicContact CB-CE2 3.85Å; R1000-Y1002 HydrophobicContact CB-CD2 4.49Å; R1000-Y1002 HydrophobicContact CB-CE2 3.82Å; R1000-Y1002 WeakPolarHBondContact CD-OH 3.38Å; Y1002-P1025 HydrophobicContact CD1-CB 4.23Å; Y1002-P1025 HydrophobicContact CD1-CG 4.25Å; Y1002-I1028 HydrophobicContact CD1-CD1 3.97Å; Y1002-I1028 HydrophobicContact CD1-CG1 3.85Å; Y1002-I1028 HydrophobicContact CD1-CG2 4.09Å; Y1002-I1028 HydrophobicContact CE1-CD1 3.97Å; Y1002-I1028 HydrophobicContact CE1-CG1 4.28Å; Y1002-I1028 HydrophobicContact CE1-CG2 4.04Å
1003	V	81.1	Confident	80.5	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.036	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.9	-179	-176	0	0	0	0	109.5	E990 R1001 P1025 T1026 S1027	E990-V1003 HydrophobicContact CG-CG1 4.03Å; E990-V1003 WeakPolarHBondContact OE2-CG1 3.42Å; R1001-V1003 HydrophobicContact CG-CG2 4.19Å; V1003-P1025 CarbonylContact O-C 3.58Å; V1003-T1026 PolarHBondContact O-N 2.81Å; V1003-T1026 PolarHBondContact O-OG1 2.93Å; V1003-S1027 PolarHBondContact N-O 2.82Å; V1003-S1027 PolarHBondContact O-N 3.12Å
1004	F	86.9	Confident	79.5	Confident	1 Å²	1	45.1 Å²	45.1	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	97.5	-177.9	-55.6	-99.8	0	0	0	108.8	I970 I973 E990 V991 V993 L1023 Q1024 P1025	I970-F1004 HydrophobicContact CG2-CZ 4.01Å; I973-F1004 HydrophobicContact CB-CD1 4.42Å; I973-F1004 HydrophobicContact CB-CE1 3.97Å; I973-F1004 HydrophobicContact CB-CE2 4.47Å; I973-F1004 HydrophobicContact CB-CZ 4.01Å; I973-F1004 HydrophobicContact CG2-CD1 3.4Å; I973-F1004 VanDerWaalsContact CG2-CD1 3.4Å; I973-F1004 HydrophobicContact CG2-CD2 4.19Å; I973-F1004 HydrophobicContact CG2-CE1 3.42Å; I973-F1004 VanDerWaalsContact CG2-CE1 3.42Å; I973-F1004 HydrophobicContact CG2-CE2 4.22Å; I973-F1004 HydrophobicContact CG2-CG 3.81Å; I973-F1004 HydrophobicContact CG2-CZ 3.86Å; E990-F1004 WeakPolarHBondContact CA-O 3.39Å; V991-F1004 HydrophobicContact CB-CB 4.38Å; V991-F1004 PolarHBondContact N-O 2.77Å; V991-F1004 WeakPolarHBondContact O-CB 2.95Å; V991-F1004 PolarHBondContact O-N 2.8Å; V993-F1004 HydrophobicContact CB-CE2 4.18Å; V993-F1004 HydrophobicContact CG2-CD2 4.34Å; V993-F1004 HydrophobicContact CG2-CE2 3.74Å; F1004-L1023 HydrophobicContact CD1-CB 3.98Å; F1004-Q1024 VanDerWaalsContact CD1-C 3.42Å; F1004-Q1024 WeakPolarHBondContact CD1-O 3.28Å; F1004-P1025 HydrophobicContact CD1-CB 4.25Å; F1004-P1025 HydrophobicContact CE1-CB 3.84Å; F1004-P1025 HydrophobicContact CE1-CG 4.29Å; F1004-P1025 VanDerWaalsContact CE1-N 3.28Å; F1004-P1025 HydrophobicContact CE2-CB 4.43Å; F1004-P1025 HydrophobicContact CZ-CB 3.94Å; F1004-P1025 HydrophobicContact CZ-CG 4.46Å
1005	H	78.2	Confident	78.8	Confident	106 Å²	106	47.8 Å²	47.8	49%	0.491	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	142.7	170.6	-72.7	10	0	0	0	110.7	E990 T1026	E990-H1005 IonicContact OE2-CE1 2.74Å; E990-H1005 PolarHBondContact OE2-CE1 3.37Å; E990-H1005 IonicContact OE2-ND1 2.73Å; E990-H1005 PolarHBondContact OE2-ND1 3.15Å; H1005-T1026 HydrophobicContact CB-CG2 4.48Å; H1005-T1026 PolarHBondContact N-OG1 3.02Å
1006	V	82	Confident	78	Confident	21 Å²	21	51 Å²	51	13%	0.127	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	-54.1	-174.1	-177.5	0	0	0	0	112.2	L988 D989 R1008 L1021 L1023	L988-V1006 HydrophobicContact CB-CB 4.39Å; L988-V1006 HydrophobicContact CB-CG1 3.95Å; L988-V1006 HydrophobicContact CD2-CB 4.39Å; L988-V1006 HydrophobicContact CD2-CG1 4.06Å; L988-V1006 HydrophobicContact CD2-CG2 4.07Å; L988-V1006 HydrophobicContact CG-CB 3.95Å; L988-V1006 HydrophobicContact CG-CG1 3.88Å; L988-V1006 HydrophobicContact CG-CG2 3.99Å; L988-V1006 CarbonylContact O-C 3.59Å; L988-V1006 WeakPolarHBondContact O-CB 3.21Å; L988-V1006 WeakPolarHBondContact O-CG1 3.45Å; D989-V1006 PolarHBondContact O-N 3.08Å; V1006-R1008 HydrophobicContact CG1-CB 4.03Å; V1006-R1008 WeakPolarHBondContact O-CB 3.28Å; V1006-R1008 PolarHBondContact O-N 3.33Å; V1006-L1021 HydrophobicContact CG1-CD1 3.42Å; V1006-L1021 VanDerWaalsContact CG1-CD1 3.42Å; V1006-L1023 HydrophobicContact CG2-CD1 3.57Å
1007	N	82.6	Confident	77.8	Confident	104 Å²	104	50.1 Å²	50.1	56%	0.556	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	42.4	52.5	-179.9	-72.9	-41.8	0	0	0	114.7	F987 L988 D989	F987-N1007 WeakPolarHBondContact CZ-O 3.25Å; L988-N1007 WeakPolarHBondContact O-CA 3.37Å; L988-N1007 PolarHBondContact O-N 3.01Å; D989-N1007 PolarHBondContact O-N 3.34Å; D989-N1007 VanDerWaalsContact O-N 3.11Å
1008	R	79.8	Confident	77.6	Confident	49 Å²	49	54 Å²	54	19%	0.185	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	150.5	-166.9	149.7	-176	164.6	129.1	17.3	114.1	F987 L988 V1006 D1016 L1018	F987-R1008 WeakPolarHBondContact CA-O 3.47Å; L988-R1008 PolarHBondContact N-O 3.03Å; L988-R1008 PolarHBondContact O-N 3.46Å; V1006-R1008 HydrophobicContact CG1-CB 4.03Å; V1006-R1008 WeakPolarHBondContact O-CB 3.28Å; V1006-R1008 PolarHBondContact O-N 3.33Å; R1008-D1016 IonicContact CZ-OD1 3.9Å; R1008-D1016 VanDerWaalsContact CZ-OD1 3.26Å; R1008-D1016 IonicContact CZ-OD2 2.73Å; R1008-D1016 VanDerWaalsContact NH1-CG 3.32Å; R1008-D1016 IonicContact NH1-OD1 3.6Å; R1008-D1016 PolarHBondContact NH1-OD1 3.49Å; R1008-D1016 IonicContact NH1-OD2 3.22Å; R1008-D1016 PolarHBondContact NH1-OD2 2.95Å; R1008-D1016 IonicContact NH2-OD1 2.76Å; R1008-D1016 PolarHBondContact NH2-OD1 3.49Å; R1008-D1016 IonicContact NH2-OD2 2.63Å; R1008-L1018 PolarHBondContact NH2-O 3.11Å
1009	W	83.5	Confident	78.1	Confident	38 Å²	38	54.5 Å²	54.5	14%	0.144	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136	163.3	-69.3	109.5	0	0	0	113.7	N919 W986 F987 E1014 A1015	N919-W1009 WeakPolarHBondContact O-CH2 3.31Å; W986-W1009 VanDerWaalsContact C-CE3 3.44Å; W986-W1009 CarbonylContact O-C 3.48Å; W986-W1009 WeakPolarHBondContact O-CA 3.38Å; F987-W1009 HydrophobicContact CB-CD2 4.06Å; F987-W1009 HydrophobicContact CB-CE3 3.93Å; F987-W1009 HydrophobicContact CB-CH2 4.36Å; F987-W1009 HydrophobicContact CB-CZ2 4.48Å; F987-W1009 HydrophobicContact CB-CZ3 4.09Å; F987-W1009 HydrophobicContact CD2-CB 4.44Å; F987-W1009 AromaticContact CD2-CD1 3.65Å; F987-W1009 AromaticContact CD2-CD2 3.71Å; F987-W1009 HydrophobicContact CD2-CD2 3.71Å; F987-W1009 AromaticContact CD2-CE2 3.7Å; F987-W1009 HydrophobicContact CD2-CE3 4.43Å; F987-W1009 AromaticContact CD2-CG 3.67Å; F987-W1009 HydrophobicContact CD2-CG 3.67Å; F987-W1009 HydrophobicContact CD2-CZ2 4.39Å; F987-W1009 AromaticContact CD2-NE1 3.66Å; F987-W1009 AromaticContact CE2-CD1 3.98Å; F987-W1009 HydrophobicContact CE2-CG 4.34Å; F987-W1009 HydrophobicContact CG-CD2 4.39Å; W1009-E1014 HydrophobicContact CB-CB 4.23Å; W1009-E1014 HydrophobicContact CD2-CB 4.49Å; W1009-E1014 VanDerWaalsContact CE2-OE2 3.25Å; W1009-E1014 HydrophobicContact CG-CB 4.1Å; W1009-E1014 PolarHBondContact NE1-OE2 2.87Å; W1009-A1015 HydrophobicContact CB-CB 3.88Å
1010	L	86.1	Confident	78.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	105.1	159	-72.6	163.3	0	0	0	106.4	H977 G985 W986 L988 L1018 L1021	H977-L1010 PolarHBondContact NE2-O 2.71Å; G985-L1010 WeakPolarHBondContact CA-O 3.46Å; W986-L1010 HydrophobicContact CB-CB 4.41Å; W986-L1010 HydrophobicContact CD2-CD1 4.45Å; W986-L1010 HydrophobicContact CE3-CB 4.5Å; W986-L1010 HydrophobicContact CE3-CD1 3.47Å; W986-L1010 VanDerWaalsContact CE3-CD1 3.47Å; W986-L1010 HydrophobicContact CZ3-CD1 3.73Å; W986-L1010 PolarHBondContact N-O 2.84Å; W986-L1010 PolarHBondContact O-N 2.92Å; L988-L1010 HydrophobicContact CB-CD1 4.41Å; L988-L1010 HydrophobicContact CD2-CD1 3.96Å; L1010-L1018 WeakPolarHBondContact CD2-O 3.4Å; L1010-L1021 HydrophobicContact CD1-CD1 4.31Å; L1010-L1021 HydrophobicContact CD2-CB 4.17Å; L1010-L1021 HydrophobicContact CD2-CD1 3.84Å; L1010-L1021 HydrophobicContact CD2-CG 3.76Å; L1010-L1021 HydrophobicContact CG-CD1 4.15Å
1011	A	80.6	Confident	78.6	Confident	2 Å²	2	54.8 Å²	54.8	2%	0.017	29%	0.291	C	S	.	.			trans	-162.9	151.8	-177.7	0	0	0	0	0	110	N1013 E1014 G1017	A1011-N1013 PolarHBondContact O-N 3.11Å; A1011-E1014 HydrophobicContact CB-CB 4Å; A1011-G1017 CarbonylContact O-C 3.59Å; A1011-G1017 WeakPolarHBondContact O-CA 3.3Å
1012	K	75.5	Confident	78.5	Confident	136 Å²	136	55.5 Å²	55.5	59%	0.591	30%	0.3	S	S	*	.	S	Bend	trans	-69.8	-19.5	173.9	-69.3	-174	178.2	172.2	0	113.5	I1019	K1012-I1019 HydrophobicContact CB-CG2 4.47Å; K1012-I1019 HydrophobicContact CG-CG2 3.64Å
1013	N	74.5	Confident	78.1	Confident	137 Å²	137	56.8 Å²	56.8	73%	0.733	31%	0.307	S	S	*	.	S	Bend	trans	-137.9	18.1	-164.1	53.7	-79.4	0	0	0	113	A1011	A1011-N1013 PolarHBondContact O-N 3.11Å
1014	E	70	Confident	78.1	Confident	84 Å²	84	62 Å²	62	39%	0.393	33%	0.331	S	S	.	.	S	Bend	trans	-137.9	163.6	167.9	-64.7	-164.5	-136.5	0	0	110.8	W1009 A1011 D1016 G1017	W1009-E1014 HydrophobicContact CB-CB 4.23Å; W1009-E1014 HydrophobicContact CD2-CB 4.49Å; W1009-E1014 VanDerWaalsContact CE2-OE2 3.25Å; W1009-E1014 HydrophobicContact CG-CB 4.1Å; W1009-E1014 PolarHBondContact NE1-OE2 2.87Å; A1011-E1014 HydrophobicContact CB-CB 4Å; E1014-D1016 PolarHBondContact O-N 3.32Å; E1014-G1017 PolarHBondContact O-N 3.05Å; E1014-G1017 VanDerWaalsContact O-N 3.07Å
1015	A	66.6	Low	77.6	Confident	80 Å²	80	63.4 Å²	63.4	66%	0.661	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	-95.4	-174.7	0	0	0	0	0	115.3	W1009	W1009-A1015 HydrophobicContact CB-CB 3.88Å
1016	D	67.6	Low	77.5	Confident	68 Å²	68	62.8 Å²	62.8	36%	0.364	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	14.1	-179.4	71	-4.8	0	0	0	113.5	R1008 E1014 L1018	R1008-D1016 IonicContact CZ-OD1 3.9Å; R1008-D1016 VanDerWaalsContact CZ-OD1 3.26Å; R1008-D1016 IonicContact CZ-OD2 2.73Å; R1008-D1016 VanDerWaalsContact NH1-CG 3.32Å; R1008-D1016 IonicContact NH1-OD1 3.6Å; R1008-D1016 PolarHBondContact NH1-OD1 3.49Å; R1008-D1016 IonicContact NH1-OD2 3.22Å; R1008-D1016 PolarHBondContact NH1-OD2 2.95Å; R1008-D1016 IonicContact NH2-OD1 2.76Å; R1008-D1016 PolarHBondContact NH2-OD1 3.49Å; R1008-D1016 IonicContact NH2-OD2 2.63Å; E1014-D1016 PolarHBondContact O-N 3.32Å; D1016-L1018 PolarHBondContact O-N 3.25Å; D1016-L1018 WeakPolarHBondContact OD1-CB 3.17Å; D1016-L1018 PolarHBondContact OD1-N 3.46Å
1017	G	68.8	Low	76.9	Confident	35 Å²	35	64.2 Å²	64.2	36%	0.361	36%	0.355	S	S	.	.	S	Bend	trans	74.1	-2	177.1	0	0	0	0	0	115.3	A1011 E1014	A1011-G1017 CarbonylContact O-C 3.59Å; A1011-G1017 WeakPolarHBondContact O-CA 3.3Å; E1014-G1017 PolarHBondContact O-N 3.05Å; E1014-G1017 VanDerWaalsContact O-N 3.07Å
1018	L	70.8	Confident	76.6	Confident	98 Å²	98	62.7 Å²	62.7	51%	0.513	35%	0.346	S	S	.	.			trans	-91.2	117.1	-177	-70.3	170.2	0	0	0	112.1	R1008 L1010 D1016 S1020	R1008-L1018 PolarHBondContact NH2-O 3.11Å; L1010-L1018 WeakPolarHBondContact CD2-O 3.4Å; D1016-L1018 PolarHBondContact O-N 3.25Å; D1016-L1018 WeakPolarHBondContact OD1-CB 3.17Å; D1016-L1018 PolarHBondContact OD1-N 3.46Å; L1018-S1020 PolarHBondContact O-N 2.91Å
1019	I	84.7	Confident	75.9	Confident	43 Å²	43	63.6 Å²	63.6	22%	0.221	35%	0.354	C	S	.	.	S	Bend	trans	-83.1	6.5	174.3	62.6	175.4	0	0	0	113.8	W976 H977 S979 K1012	W976-I1019 VanDerWaalsContact CA-O 3.24Å; W976-I1019 WeakPolarHBondContact CA-O 3.5Å; W976-I1019 VanDerWaalsContact CB-O 3.27Å; W976-I1019 WeakPolarHBondContact CB-O 3.41Å; H977-I1019 PolarHBondContact CD2-O 2.7Å; H977-I1019 VanDerWaalsContact CD2-O 3.29Å; H977-I1019 PolarHBondContact N-O 3.14Å; H977-I1019 VanDerWaalsContact N-O 3.15Å; H977-I1019 VanDerWaalsContact NE2-CB 3.33Å; H977-I1019 WeakPolarHBondContact NE2-CB 3.45Å; H977-I1019 WeakPolarHBondContact NE2-CG2 3.37Å; S979-I1019 WeakPolarHBondContact OG-CD1 3.38Å; S979-I1019 WeakPolarHBondContact OG-CG2 3.35Å; K1012-I1019 HydrophobicContact CB-CG2 4.47Å; K1012-I1019 HydrophobicContact CG-CG2 3.64Å
1020	S	83.8	Confident	75.1	Confident	43 Å²	43	68 Å²	68	30%	0.301	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138.1	-178.4	-179.7	0	0	0	0	110.4	K974 L1018	K974-S1020 WeakPolarHBondContact CE-OG 3.49Å; L1018-S1020 PolarHBondContact O-N 2.91Å
1021	L	78.8	Confident	74.1	Confident	20 Å²	20	70.2 Å²	70.2	11%	0.105	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	143.1	177.8	-94.8	170.3	0	0	0	111.4	K974 I975 V1006 L1010 L1023	K974-L1021 CarbonylContact C-O 3.51Å; K974-L1021 VanDerWaalsContact CA-O 3.22Å; K974-L1021 WeakPolarHBondContact CA-O 3.24Å; K974-L1021 WeakPolarHBondContact CG-O 3.5Å; I975-L1021 HydrophobicContact CG2-CB 4Å; I975-L1021 PolarHBondContact N-O 3.25Å; I975-L1021 PolarHBondContact O-N 3.47Å; V1006-L1021 HydrophobicContact CG1-CD1 3.42Å; V1006-L1021 VanDerWaalsContact CG1-CD1 3.42Å; L1010-L1021 HydrophobicContact CD1-CD1 4.31Å; L1010-L1021 HydrophobicContact CD2-CB 4.17Å; L1010-L1021 HydrophobicContact CD2-CD1 3.84Å; L1010-L1021 HydrophobicContact CD2-CG 3.76Å; L1010-L1021 HydrophobicContact CG-CD1 4.15Å; L1021-L1023 HydrophobicContact CB-CD1 4.26Å; L1021-L1023 HydrophobicContact CB-CG 4.28Å; L1021-L1023 HydrophobicContact CD1-CD1 4.35Å; L1021-L1023 HydrophobicContact CD2-CD2 4.18Å; L1021-L1023 HydrophobicContact CD2-CG 4.5Å
1022	D	79.8	Confident	73.4	Confident	95 Å²	95	75 Å²	75	51%	0.508	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.1	170.9	-95.4	-15.3	0	0	0	107.8	K972 K974	K972-D1022 WeakPolarHBondContact CE-OD1 3.43Å; K972-D1022 WeakPolarHBondContact CE-OD2 3.45Å; K972-D1022 IonicContact NZ-OD1 3.31Å; K972-D1022 PolarHBondContact NZ-OD1 3.49Å; K972-D1022 IonicContact NZ-OD2 3.09Å; K972-D1022 PolarHBondContact NZ-OD2 3.17Å; K974-D1022 VanDerWaalsContact CB-OD1 3.26Å; K974-D1022 WeakPolarHBondContact CB-OD1 3.44Å; K974-D1022 VanDerWaalsContact CG-OD1 3.3Å; K974-D1022 WeakPolarHBondContact CG-OD1 3.17Å
1023	L	79.2	Confident	73.2	Confident	27 Å²	27	75 Å²	75	14%	0.141	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	143	-167.8	-62.9	161.8	0	0	0	111.9	K972 I973 I975 F1004 V1006 L1021	K972-L1023 CarbonylContact C-O 3.54Å; K972-L1023 VanDerWaalsContact CA-O 3.24Å; K972-L1023 WeakPolarHBondContact CA-O 3.49Å; K972-L1023 WeakPolarHBondContact CG-O 3.37Å; I973-L1023 HydrophobicContact CG2-CB 3.76Å; I973-L1023 HydrophobicContact CG2-CD1 4.32Å; I973-L1023 PolarHBondContact N-O 2.99Å; I973-L1023 PolarHBondContact O-N 2.81Å; I975-L1023 HydrophobicContact CG2-CD1 4.37Å; F1004-L1023 HydrophobicContact CD1-CB 3.98Å; V1006-L1023 HydrophobicContact CG2-CD1 3.57Å; L1021-L1023 HydrophobicContact CB-CD1 4.26Å; L1021-L1023 HydrophobicContact CB-CG 4.28Å; L1021-L1023 HydrophobicContact CD1-CD1 4.35Å; L1021-L1023 HydrophobicContact CD2-CD2 4.18Å; L1021-L1023 HydrophobicContact CD2-CG 4.5Å
1024	Q	80.4	Confident	73.2	Confident	115 Å²	115	69.9 Å²	69.9	54%	0.537	38%	0.382	S	S	.	.			trans	-103.9	152.8	168.8	-69.4	-179.7	7.6	0	0	109.6	C629 F1004 T1026	C629-Q1024 PolarHBondContact O-NE2 3.32Å; F1004-Q1024 VanDerWaalsContact CD1-C 3.42Å; F1004-Q1024 WeakPolarHBondContact CD1-O 3.28Å; Q1024-T1026 PolarHBondContact O-N 3.29Å
1025	P	76.9	Confident	73.3	Confident	31 Å²	31	65.9 Å²	65.9	20%	0.201	36%	0.363	C	S	.	.			trans	-69.5	120.5	-175.6	27.5	-33.8	0	0	0	111.3	K971 Y1002 V1003 F1004 S1027 I1028	K971-P1025 WeakPolarHBondContact O-CD 3.39Å; Y1002-P1025 HydrophobicContact CD1-CB 4.23Å; Y1002-P1025 HydrophobicContact CD1-CG 4.25Å; V1003-P1025 CarbonylContact O-C 3.58Å; F1004-P1025 HydrophobicContact CD1-CB 4.25Å; F1004-P1025 HydrophobicContact CE1-CB 3.84Å; F1004-P1025 HydrophobicContact CE1-CG 4.29Å; F1004-P1025 VanDerWaalsContact CE1-N 3.28Å; F1004-P1025 HydrophobicContact CE2-CB 4.43Å; F1004-P1025 HydrophobicContact CZ-CB 3.94Å; F1004-P1025 HydrophobicContact CZ-CG 4.46Å; P1025-S1027 VanDerWaalsContact C-N 3.3Å; P1025-S1027 PolarHBondContact O-N 2.91Å; P1025-I1028 HydrophobicContact CB-CG1 4.28Å; P1025-I1028 HydrophobicContact CG-CD1 4.22Å; P1025-I1028 HydrophobicContact CG-CG1 4.3Å
1026	T	74.9	Confident	73.7	Confident	92 Å²	92	62.2 Å²	62.2	56%	0.564	33%	0.333	S	S	*	.	S	Bend	trans	-66.5	-27.8	173.9	27.7	0	0	0	0	113.3	V1003 H1005 Q1024	V1003-T1026 PolarHBondContact O-N 2.81Å; V1003-T1026 PolarHBondContact O-OG1 2.93Å; H1005-T1026 HydrophobicContact CB-CG2 4.48Å; H1005-T1026 PolarHBondContact N-OG1 3.02Å; Q1024-T1026 PolarHBondContact O-N 3.29Å
1027	S	69.4	Low	74.3	Confident	52 Å²	52	59 Å²	59	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	156.8	169.3	71.7	0	0	0	0	112.3	V1003 P1025	V1003-S1027 PolarHBondContact N-O 2.82Å; V1003-S1027 PolarHBondContact O-N 3.12Å; P1025-S1027 VanDerWaalsContact C-N 3.3Å; P1025-S1027 PolarHBondContact O-N 2.91Å
1028	I	77.1	Confident	74.9	Confident	71 Å²	71	58.5 Å²	58.5	36%	0.364	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	119.1	177.9	-50.9	-180	0	0	0	108.3	R1000 R1001 Y1002 P1025	R1000-I1028 HydrophobicContact CB-CG2 4.32Å; R1000-I1028 HydrophobicContact CG-CG2 4.35Å; R1001-I1028 WeakPolarHBondContact O-CA 3.36Å; Y1002-I1028 HydrophobicContact CD1-CD1 3.97Å; Y1002-I1028 HydrophobicContact CD1-CG1 3.85Å; Y1002-I1028 HydrophobicContact CD1-CG2 4.09Å; Y1002-I1028 HydrophobicContact CE1-CD1 3.97Å; Y1002-I1028 HydrophobicContact CE1-CG1 4.28Å; Y1002-I1028 HydrophobicContact CE1-CG2 4.04Å; P1025-I1028 HydrophobicContact CB-CG1 4.28Å; P1025-I1028 HydrophobicContact CG-CD1 4.22Å; P1025-I1028 HydrophobicContact CG-CG1 4.3Å
1029	I	66	Low	75.6	Confident	69 Å²	69	53.8 Å²	53.8	35%	0.354	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.6	-176.2	-57	170.7	0	0	0	108.7	R1000 R1001	R1000-I1029 CarbonylContact C-O 3.54Å; R1000-I1029 WeakPolarHBondContact CA-O 3.41Å; R1001-I1029 HydrophobicContact CB-CB 4.38Å; R1001-I1029 PolarHBondContact N-O 2.86Å; R1001-I1029 PolarHBondContact O-N 2.86Å
1030	N	64.9	Low	75.5	Confident	130 Å²	130	52.8 Å²	52.8	70%	0.695	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	134.6	174.1	-69.4	-40.8	0	0	0	110.6	G999	G999-N1030 WeakPolarHBondContact O-CA 3.45Å
1031	I	65.2	Low	75.7	Confident	46 Å²	46	50.8 Å²	50.8	24%	0.236	26%	0.26	C	S	.	.			trans	-131	172.4	176.6	63.3	166	0	0	0	110.5	I994 Y996 G999 R1001	I994-I1031 HydrophobicContact CG2-CD1 3.51Å; Y996-I1031 HydrophobicContact CD1-CD1 4.38Å; G999-I1031 WeakPolarHBondContact CA-O 3.08Å; G999-I1031 PolarHBondContact O-N 3.31Å; R1001-I1031 HydrophobicContact CB-CG2 4.42Å
1032	E	66.7	Low	75.9	Confident	103 Å²	103	51.8 Å²	51.8	48%	0.481	26%	0.264	S	S	.	.			trans	-66.2	134.5	178	-169.7	149.2	-174.9	0	0	111.5	P1093 K1448	E1032-P1093 HydrophobicContact CG-CG 4.36Å; E1032-K1448 IonicContact OE2-NZ 2.94Å; E1032-K1448 PolarHBondContact OE2-NZ 3.04Å
1033	R	71.8	Confident	76	Confident	137 Å²	137	47.5 Å²	47.5	52%	0.517	24%	0.241	S	C	.	.			trans	-76.9	136.1	-179.5	-72.9	-174.4	-179.5	165.3	3	111.3	Y996 F997 L998 F1128	Y996-R1033 WeakPolarHBondContact O-CA 3.36Å; F997-R1033 WeakPolarHBondContact O-CD 3.42Å; L998-R1033 PolarHBondContact O-NE 2.89Å; L998-R1033 PolarHBondContact O-NH2 2.94Å; R1033-F1128 HydrophobicContact CB-CE1 4.48Å; R1033-F1128 HydrophobicContact CB-CZ 3.98Å
1034	M	74.1	Confident	75.9	Confident	29 Å²	29	46.3 Å²	46.3	14%	0.143	24%	0.235	C	C	.	.			trans	-126.6	157.2	179.1	-57.5	-176.8	-179.8	0	0	111.2	Y996 F1091 A1092 P1093	Y996-M1034 HydrophobicContact CD1-CG 4.4Å; Y996-M1034 HydrophobicContact CD1-SD 3.79Å; Y996-M1034 HydrophobicContact CE1-SD 4.12Å; Y996-M1034 PolarHBondContact O-N 3.4Å; M1034-F1091 HydrophobicContact CB-CB 4.14Å; M1034-F1091 HydrophobicContact SD-CB 4.28Å; M1034-A1092 CarbonylContact C-O 3.57Å; M1034-A1092 VanDerWaalsContact CA-O 3.26Å; M1034-A1092 WeakPolarHBondContact CA-O 3.43Å; M1034-A1092 WeakPolarHBondContact CB-O 3.32Å; M1034-P1093 HydrophobicContact CG-CG 4.48Å
1035	I	72.9	Confident	75.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	152.9	175.4	70	173.4	0	0	0	109.4	Y1037 F1091 A1092 D1094 K1123 P1124 F1127 F1128	I1035-Y1037 HydrophobicContact CD1-CE1 4.38Å; I1035-Y1037 HydrophobicContact CD1-CE2 3.88Å; I1035-Y1037 HydrophobicContact CG1-CD2 3.97Å; I1035-Y1037 HydrophobicContact CG1-CE2 3.41Å; I1035-Y1037 VanDerWaalsContact CG1-CE2 3.41Å; I1035-F1091 WeakPolarHBondContact O-CA 3.19Å; I1035-A1092 PolarHBondContact N-O 3.38Å; I1035-A1092 PolarHBondContact O-N 2.73Å; I1035-D1094 HydrophobicContact CD1-CB 3.99Å; I1035-D1094 HydrophobicContact CG1-CB 4.49Å; I1035-D1094 HydrophobicContact CG2-CB 4.14Å; I1035-K1123 HydrophobicContact CD1-CD 4.32Å; I1035-K1123 VanDerWaalsContact CD1-CE 3.41Å; I1035-K1123 HydrophobicContact CD1-CG 3.94Å; I1035-P1124 HydrophobicContact CD1-CG 4.47Å; I1035-F1127 HydrophobicContact CB-CD1 3.97Å; I1035-F1127 HydrophobicContact CB-CE1 4.22Å; I1035-F1127 HydrophobicContact CG2-CD1 3.55Å; I1035-F1127 HydrophobicContact CG2-CE1 4.12Å; I1035-F1127 HydrophobicContact CG2-CG 4.48Å; I1035-F1128 HydrophobicContact CG2-CD2 4.18Å; I1035-F1128 HydrophobicContact CG2-CE2 3.32Å; I1035-F1128 HydrophobicContact CG2-CZ 3.52Å
1036	P	74.3	Confident	75.4	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.019	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131	171	28.2	-31.9	0	0	0	110.2	L903 I1090 F1091 P1124 F1127	L903-P1036 HydrophobicContact CD2-CB 4.25Å; L903-P1036 HydrophobicContact CD2-CG 4.45Å; P1036-I1090 WeakPolarHBondContact CA-O 3.23Å; P1036-F1091 HydrophobicContact CB-CD1 4.36Å; P1036-F1091 HydrophobicContact CB-CE1 3.74Å; P1036-F1091 HydrophobicContact CB-CZ 3.94Å; P1036-F1091 HydrophobicContact CG-CE1 4.27Å; P1036-P1124 HydrophobicContact CG-CG 4.34Å; P1036-P1124 WeakPolarHBondContact O-CD 3.22Å; P1036-F1127 HydrophobicContact CG-CZ 4.19Å
1037	Y	80.3	Confident	75	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	142.1	161.4	-64.8	-100.4	0	0	0	108.5	I1035 L1059 R1089 I1090 A1092 P1093 L1098 I1121 K1123	I1035-Y1037 HydrophobicContact CD1-CE1 4.38Å; I1035-Y1037 HydrophobicContact CD1-CE2 3.88Å; I1035-Y1037 HydrophobicContact CG1-CD2 3.97Å; I1035-Y1037 HydrophobicContact CG1-CE2 3.41Å; I1035-Y1037 VanDerWaalsContact CG1-CE2 3.41Å; Y1037-L1059 HydrophobicContact CD1-CD1 3.88Å; Y1037-L1059 HydrophobicContact CE1-CD1 4.03Å; Y1037-L1059 HydrophobicContact CG-CD1 4.17Å; Y1037-R1089 WeakPolarHBondContact O-CA 3.42Å; Y1037-I1090 PolarHBondContact N-O 3.01Å; Y1037-I1090 PolarHBondContact O-N 3.31Å; Y1037-A1092 HydrophobicContact CD2-CB 4.12Å; Y1037-A1092 HydrophobicContact CE2-CB 3.95Å; Y1037-P1093 PolarHBondContact OH-O 3.35Å; Y1037-P1093 VanDerWaalsContact OH-O 3.05Å; Y1037-L1098 HydrophobicContact CE1-CD2 4.21Å; Y1037-I1121 HydrophobicContact CD1-CG2 4.06Å; Y1037-K1123 HydrophobicContact CD1-CB 4.21Å; Y1037-K1123 HydrophobicContact CD1-CG 4.1Å; Y1037-K1123 HydrophobicContact CE1-CB 4.27Å; Y1037-K1123 HydrophobicContact CE1-CD 3.99Å; Y1037-K1123 HydrophobicContact CE1-CG 3.77Å
1038	E	80.2	Confident	75	Confident	24 Å²	24	52.6 Å²	52.6	11%	0.112	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	113	171.9	-179.5	167.8	-99.5	0	0	108.2	L903 I1040 T1087 I1121 R1122	L903-E1038 HydrophobicContact CD2-CB 4Å; E1038-I1040 HydrophobicContact CG-CD1 4.47Å; E1038-I1040 HydrophobicContact CG-CG1 4.28Å; E1038-T1087 HydrophobicContact CG-CG2 3.6Å; E1038-I1121 CarbonylContact O-C 3.57Å; E1038-I1121 WeakPolarHBondContact O-CA 3.27Å; E1038-R1122 HydrophobicContact CB-CB 4.29Å; E1038-R1122 PolarHBondContact N-O 2.81Å; E1038-R1122 PolarHBondContact O-N 2.72Å; E1038-R1122 IonicContact OE2-NH1 2.95Å; E1038-R1122 PolarHBondContact OE2-NH1 3.02Å
1039	I	85.9	Confident	74.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.8	-177.5	-58.6	-175.5	0	0	0	107.8	I1041 V1057 L1059 T1087 F1088 I1090 V1119 I1121	I1039-I1041 HydrophobicContact CG2-CD1 4.44Å; I1039-I1041 HydrophobicContact CG2-CG1 4.08Å; I1039-V1057 HydrophobicContact CD1-CG2 3.79Å; I1039-L1059 HydrophobicContact CD1-CD2 4.12Å; I1039-T1087 WeakPolarHBondContact O-CA 3.15Å; I1039-F1088 PolarHBondContact N-O 3.33Å; I1039-F1088 PolarHBondContact O-N 2.73Å; I1039-I1090 HydrophobicContact CD1-CD1 3.56Å; I1039-I1090 HydrophobicContact CD1-CG1 4.3Å; I1039-I1090 HydrophobicContact CG1-CD1 4.33Å; I1039-V1119 HydrophobicContact CG2-CG1 3.71Å; I1039-I1121 HydrophobicContact CD1-CD1 4.31Å; I1039-I1121 HydrophobicContact CG1-CD1 4.23Å; I1039-I1121 HydrophobicContact CG1-CG1 4.15Å; I1039-I1121 HydrophobicContact CG1-CG2 4.19Å; I1039-I1121 HydrophobicContact CG2-CG1 4.35Å
1040	I	84.1	Confident	75.2	Confident	22 Å²	22	51 Å²	51	11%	0.113	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	113.2	-177.7	-54.7	172.9	0	0	0	107.5	E1038 F1042 P1085 E1086 T1087 V1119 L1120	E1038-I1040 HydrophobicContact CG-CD1 4.47Å; E1038-I1040 HydrophobicContact CG-CG1 4.28Å; I1040-F1042 HydrophobicContact CB-CE2 4.34Å; I1040-F1042 HydrophobicContact CG2-CD2 4.41Å; I1040-F1042 HydrophobicContact CG2-CE2 3.74Å; I1040-F1042 HydrophobicContact CG2-CZ 3.98Å; I1040-P1085 HydrophobicContact CG2-CB 4Å; I1040-E1086 WeakPolarHBondContact CA-O 3.35Å; I1040-T1087 HydrophobicContact CG1-CG2 3.98Å; I1040-V1119 WeakPolarHBondContact O-CA 3.4Å; I1040-L1120 HydrophobicContact CB-CB 4.29Å; I1040-L1120 HydrophobicContact CD1-CD2 4.06Å; I1040-L1120 HydrophobicContact CD1-CG 4.41Å; I1040-L1120 PolarHBondContact N-O 2.99Å; I1040-L1120 PolarHBondContact O-N 2.83Å
1041	I	86.2	Confident	75.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	125.8	-175.4	-68.1	-176.6	0	0	0	109.5	I1039 L1073 F1080 P1085 E1086 F1088 W1114 L1116 V1119	I1039-I1041 HydrophobicContact CG2-CD1 4.44Å; I1039-I1041 HydrophobicContact CG2-CG1 4.08Å; I1041-L1073 HydrophobicContact CD1-CD1 3.43Å; I1041-L1073 VanDerWaalsContact CD1-CD1 3.43Å; I1041-F1080 HydrophobicContact CB-CE1 4.32Å; I1041-F1080 HydrophobicContact CD1-CE1 3.96Å; I1041-F1080 HydrophobicContact CD1-CZ 4.45Å; I1041-F1080 HydrophobicContact CG2-CD1 4.17Å; I1041-F1080 HydrophobicContact CG2-CE1 3.97Å; I1041-P1085 CarbonylContact O-C 3.49Å; I1041-P1085 WeakPolarHBondContact O-CA 3.48Å; I1041-E1086 PolarHBondContact N-O 3.25Å; I1041-E1086 PolarHBondContact O-N 2.8Å; I1041-F1088 HydrophobicContact CD1-CD2 4.35Å; I1041-F1088 HydrophobicContact CD1-CE2 4.19Å; I1041-W1114 HydrophobicContact CG2-CH2 4.43Å; I1041-W1114 HydrophobicContact CG2-CZ2 3.84Å; I1041-L1116 HydrophobicContact CG2-CD1 3.78Å; I1041-V1119 HydrophobicContact CG1-CG1 4.27Å; I1041-V1119 HydrophobicContact CG1-CG2 4.19Å
1042	F	84.2	Confident	75.7	Confident	42 Å²	42	48 Å²	48	18%	0.184	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	106.7	177.1	-62.7	-102.3	0	0	0	109.5	I1040 P1085 E1117 K1118 L1120 W1193	I1040-F1042 HydrophobicContact CB-CE2 4.34Å; I1040-F1042 HydrophobicContact CG2-CD2 4.41Å; I1040-F1042 HydrophobicContact CG2-CE2 3.74Å; I1040-F1042 HydrophobicContact CG2-CZ 3.98Å; F1042-P1085 HydrophobicContact CD1-CB 3.92Å; F1042-P1085 HydrophobicContact CE1-CB 3.84Å; F1042-P1085 HydrophobicContact CG-CB 4.47Å; F1042-P1085 HydrophobicContact CZ-CB 4.32Å; F1042-E1117 PolarHBondContact O-N 2.81Å; F1042-E1117 VanDerWaalsContact O-N 3.15Å; F1042-K1118 HydrophobicContact CB-CG 3.73Å; F1042-K1118 WeakPolarHBondContact CB-O 3.37Å; F1042-K1118 HydrophobicContact CD2-CD 4.49Å; F1042-K1118 HydrophobicContact CD2-CG 3.71Å; F1042-K1118 HydrophobicContact CE2-CG 4.48Å; F1042-K1118 HydrophobicContact CG-CD 4.43Å; F1042-K1118 HydrophobicContact CG-CG 3.78Å; F1042-K1118 PolarHBondContact N-O 2.76Å; F1042-L1120 HydrophobicContact CE2-CB 4.1Å; F1042-W1193 HydrophobicContact CD2-CZ3 4.35Å; F1042-W1193 HydrophobicContact CE2-CH2 4.06Å; F1042-W1193 AromaticContact CE2-CZ3 3.69Å; F1042-W1193 HydrophobicContact CE2-CZ3 3.69Å; F1042-W1193 AromaticContact CZ-CH2 3.95Å; F1042-W1193 HydrophobicContact CZ-CH2 3.95Å; F1042-W1193 HydrophobicContact CZ-CZ3 4.01Å
1043	T	82.5	Confident	75.9	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.025	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.6	172.5	-59.7	0	0	0	0	109.2	S1049 K1081 G1083 W1114	T1043-S1049 WeakPolarHBondContact CG2-O 3.28Å; T1043-K1081 WeakPolarHBondContact CB-O 3.45Å; T1043-G1083 WeakPolarHBondContact O-CA 3.39Å; T1043-G1083 PolarHBondContact O-N 3.14Å; T1043-W1114 PolarHBondContact OG1-NE1 3.02Å
1044	G	76.8	Confident	76	Confident	3 Å²	3	38.8 Å²	38.8	3%	0.031	21%	0.205	C	C	.	.			trans	-66.8	169.5	-173.6	0	0	0	0	0	115.7	S1049 G1083 F1115	G1044-S1049 WeakPolarHBondContact O-CB 3.34Å; G1044-G1083 PolarHBondContact O-N 3.05Å; G1044-F1115 PolarHBondContact N-O 3.13Å
1045	D	74	Confident	76.2	Confident	118 Å²	118	37.4 Å²	37.4	63%	0.631	20%	0.198	S	C	*	.	S	Bend	trans	-96.8	20.4	-176.6	66.2	-19.2	0	0	0	113.6	F1082	D1045-F1082 HydrophobicContact CB-CE1 4.28Å; D1045-F1082 HydrophobicContact CB-CZ 4.19Å; D1045-F1082 VanDerWaalsContact O-CE2 3.24Å; D1045-F1082 WeakPolarHBondContact O-CE2 3.37Å; D1045-F1082 WeakPolarHBondContact O-CZ 3.07Å
1046	R	71.9	Confident	76.7	Confident	142 Å²	142	38.5 Å²	38.5	54%	0.536	21%	0.205	S	C	.	.	S	Bend	trans	-93.9	138.5	178.8	-59	-177	-179.4	-159.1	0.5	110.5	G1048 S1049 F1082 W1199	R1046-G1048 PolarHBondContact O-N 2.61Å; R1046-S1049 WeakPolarHBondContact O-CB 3.19Å; R1046-S1049 PolarHBondContact O-N 3.06Å; R1046-S1049 PolarHBondContact O-OG 2.77Å; R1046-F1082 WeakPolarHBondContact O-CE2 3.12Å; R1046-W1199 HydrophobicContact CB-CZ2 4.24Å
1047	S	66.9	Low	77.3	Confident	118 Å²	118	38.4 Å²	38.4	83%	0.825	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	133	-176.7	-168.1	0	0	0	0	111.4
1048	G	69.1	Low	77.7	Confident	44 Å²	44	39.2 Å²	39.2	45%	0.454	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	0.1	-175.2	0	0	0	0	0	116.4	R1046 Q1050	R1046-G1048 PolarHBondContact O-N 2.61Å; G1048-Q1050 PolarHBondContact O-N 3.38Å
1049	S	71.2	Confident	78.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.			trans	-67.4	6.9	-174.9	-63.3	0	0	0	0	117.1	T1043 G1044 R1046 F1115	T1043-S1049 WeakPolarHBondContact CG2-O 3.28Å; G1044-S1049 WeakPolarHBondContact O-CB 3.34Å; R1046-S1049 WeakPolarHBondContact O-CB 3.19Å; R1046-S1049 PolarHBondContact O-N 3.06Å; R1046-S1049 PolarHBondContact O-OG 2.77Å; S1049-F1115 PolarHBondContact O-N 3.46Å; S1049-F1115 VanDerWaalsContact OG-CB 3.26Å; S1049-F1115 WeakPolarHBondContact OG-CB 3.44Å
1050	Q	75.1	Confident	78.2	Confident	106 Å²	106	38.1 Å²	38.1	50%	0.495	20%	0.203	S	C	.	.			trans	-102.2	143	-168.7	61.9	177.5	-3.7	0	0	114.1	G1048 F1080 S1111	G1048-Q1050 PolarHBondContact O-N 3.38Å; Q1050-F1080 WeakPolarHBondContact CA-O 3.34Å; Q1050-F1080 WeakPolarHBondContact CB-O 3.41Å; Q1050-S1111 WeakPolarHBondContact O-CB 3.22Å; Q1050-S1111 PolarHBondContact O-OG 3.26Å
1051	T	71.8	Confident	78.3	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-127.5	145.4	179.9	-174.4	0	0	0	0	115.6	S1053 V1055 H1079 F1080 R1105 S1111 W1114	T1051-S1053 VanDerWaalsContact OG1-CB 3.26Å; T1051-S1053 WeakPolarHBondContact OG1-CB 3.37Å; T1051-S1053 PolarHBondContact OG1-N 2.74Å; T1051-S1053 PolarHBondContact OG1-OG 2.67Å; T1051-S1053 VanDerWaalsContact OG1-OG 3.12Å; T1051-V1055 HydrophobicContact CG2-CG2 4.35Å; T1051-H1079 CarbonylContact O-C 3.55Å; T1051-F1080 HydrophobicContact CG2-CB 3.69Å; T1051-F1080 HydrophobicContact CG2-CD2 3.62Å; T1051-F1080 HydrophobicContact CG2-CG 3.85Å; T1051-F1080 PolarHBondContact N-O 2.89Å; T1051-F1080 PolarHBondContact O-N 3.34Å; T1051-R1105 WeakPolarHBondContact OG1-CD 3.37Å; T1051-R1105 PolarHBondContact OG1-NH1 3.44Å; T1051-S1111 WeakPolarHBondContact CA-OG 3.17Å; T1051-W1114 HydrophobicContact CG2-CB 4.09Å; T1051-W1114 VanDerWaalsContact CG2-CD1 3.46Å; T1051-W1114 HydrophobicContact CG2-CD2 3.69Å; T1051-W1114 HydrophobicContact CG2-CE3 4.38Å; T1051-W1114 HydrophobicContact CG2-CG 3.49Å; T1051-W1114 VanDerWaalsContact CG2-CG 3.49Å
1052	K	70	Confident	77.9	Confident	112 Å²	112	38.4 Å²	38.4	49%	0.487	21%	0.206	S	C	.	.			trans	-106.5	-7.2	167.9	-53.2	-160	168	-151.5	0	113.9	H1079	K1052-H1079 VanDerWaalsContact CD-CD2 3.4Å; K1052-H1079 WeakPolarHBondContact CD-CD2 3.47Å; K1052-H1079 VanDerWaalsContact CE-CD2 3.48Å; K1052-H1079 WeakPolarHBondContact CE-CD2 3.42Å; K1052-H1079 VanDerWaalsContact CE-NE2 3.35Å; K1052-H1079 WeakPolarHBondContact CE-NE2 3.44Å; K1052-H1079 HydrophobicContact CG-CB 4.33Å; K1052-H1079 VanDerWaalsContact CG-CD2 3.42Å; K1052-H1079 WeakPolarHBondContact CG-CD2 3.45Å; K1052-H1079 PolarHBondContact NZ-CE1 2.93Å; K1052-H1079 VanDerWaalsContact NZ-CE1 3.29Å; K1052-H1079 PolarHBondContact NZ-NE2 2.82Å
1053	S	70.4	Confident	77.3	Confident	6 Å²	6	40.2 Å²	40.2	4%	0.042	22%	0.222	C	C	.	.	S	Bend	trans	-63.9	155.9	177.5	-52.3	0	0	0	0	112.3	T1051 V1055 R1105 D1106 T1108	T1051-S1053 VanDerWaalsContact OG1-CB 3.26Å; T1051-S1053 WeakPolarHBondContact OG1-CB 3.37Å; T1051-S1053 PolarHBondContact OG1-N 2.74Å; T1051-S1053 PolarHBondContact OG1-OG 2.67Å; T1051-S1053 VanDerWaalsContact OG1-OG 3.12Å; S1053-V1055 PolarHBondContact O-N 3.41Å; S1053-R1105 PolarHBondContact OG-NH1 2.78Å; S1053-D1106 VanDerWaalsContact CB-OD1 3.23Å; S1053-D1106 WeakPolarHBondContact CB-OD1 3.48Å; S1053-T1108 WeakPolarHBondContact CA-O 3.25Å; S1053-T1108 VanDerWaalsContact CB-O 3.28Å; S1053-T1108 WeakPolarHBondContact CB-O 3.46Å; S1053-T1108 PolarHBondContact N-O 3.08Å; S1053-T1108 PolarHBondContact OG-O 2.79Å
1054	I	73.4	Confident	77.1	Confident	40 Å²	40	40.8 Å²	40.8	21%	0.205	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.4	130	167.7	-68.4	108.3	0	0	0	109.1	R1072 R1105 D1106	I1054-R1072 HydrophobicContact CG2-CG 3.61Å; I1054-R1105 WeakPolarHBondContact O-CA 3.48Å; I1054-D1106 HydrophobicContact CB-CB 4.34Å; I1054-D1106 VanDerWaalsContact CD1-OD2 3.23Å; I1054-D1106 WeakPolarHBondContact CD1-OD2 3.47Å; I1054-D1106 PolarHBondContact N-OD1 2.72Å; I1054-D1106 PolarHBondContact O-N 3.28Å
1055	V	78.9	Confident	76.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.7	171.9	174.5	0	0	0	0	109.2	T1051 S1053 L1073 F1080 V1103 E1104 W1114	T1051-V1055 HydrophobicContact CG2-CG2 4.35Å; S1053-V1055 PolarHBondContact O-N 3.41Å; V1055-L1073 HydrophobicContact CB-CB 4.44Å; V1055-L1073 HydrophobicContact CG1-CD1 4.29Å; V1055-L1073 WeakPolarHBondContact O-CA 3.36Å; V1055-L1073 WeakPolarHBondContact O-CB 3.36Å; V1055-L1073 PolarHBondContact O-N 2.89Å; V1055-F1080 HydrophobicContact CB-CE2 3.89Å; V1055-F1080 HydrophobicContact CB-CZ 3.79Å; V1055-F1080 HydrophobicContact CG1-CZ 4.31Å; V1055-F1080 HydrophobicContact CG2-CD2 4.09Å; V1055-F1080 HydrophobicContact CG2-CE1 4.49Å; V1055-F1080 HydrophobicContact CG2-CE2 3.44Å; V1055-F1080 VanDerWaalsContact CG2-CE2 3.44Å; V1055-F1080 HydrophobicContact CG2-CZ 3.68Å; V1055-V1103 HydrophobicContact CG1-CG1 3.93Å; V1055-E1104 CarbonylContact C-O 3.43Å; V1055-E1104 WeakPolarHBondContact CA-O 3.42Å; V1055-W1114 HydrophobicContact CB-CH2 4.42Å; V1055-W1114 HydrophobicContact CG1-CH2 3.73Å; V1055-W1114 HydrophobicContact CG1-CZ3 3.98Å; V1055-W1114 HydrophobicContact CG2-CE3 4.23Å; V1055-W1114 HydrophobicContact CG2-CH2 3.74Å; V1055-W1114 HydrophobicContact CG2-CZ2 4.27Å; V1055-W1114 HydrophobicContact CG2-CZ3 3.7Å
1056	T	83	Confident	77.1	Confident	23 Å²	23	49.1 Å²	49.1	14%	0.141	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.6	176	41.7	0	0	0	0	110.2	I1070 I1071 R1072 V1103 E1104	T1056-I1070 HydrophobicContact CG2-CG2 3.86Å; T1056-I1071 CarbonylContact C-O 2.94Å; T1056-I1071 VanDerWaalsContact CA-O 3.24Å; T1056-I1071 WeakPolarHBondContact CA-O 3.31Å; T1056-R1072 HydrophobicContact CG2-CB 4.41Å; T1056-R1072 HydrophobicContact CG2-CG 4.46Å; T1056-V1103 WeakPolarHBondContact O-CA 3.39Å; T1056-E1104 PolarHBondContact N-O 2.75Å; T1056-E1104 PolarHBondContact O-N 3.38Å; T1056-E1104 WeakPolarHBondContact OG1-CB 3.31Å; T1056-E1104 PolarHBondContact OG1-O 3.07Å
1057	V	87.7	Confident	77.6	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.1	179.2	-61.8	0	0	0	0	111.6	I1039 I1071 L1073 L1101 I1102 V1103	I1039-V1057 HydrophobicContact CD1-CG2 3.79Å; V1057-I1071 HydrophobicContact CG2-CB 3.93Å; V1057-I1071 HydrophobicContact CG2-CD1 4.26Å; V1057-I1071 HydrophobicContact CG2-CG2 4.35Å; V1057-I1071 PolarHBondContact N-O 3.45Å; V1057-I1071 PolarHBondContact O-N 2.92Å; V1057-L1073 HydrophobicContact CB-CD1 4.48Å; V1057-L1073 HydrophobicContact CG1-CD1 3.62Å; V1057-L1073 HydrophobicContact CG1-CG 4.28Å; V1057-L1073 HydrophobicContact CG2-CD1 4Å; V1057-L1073 HydrophobicContact CG2-CD2 4.08Å; V1057-L1073 HydrophobicContact CG2-CG 4.02Å; V1057-L1101 HydrophobicContact CB-CD1 4.34Å; V1057-I1102 WeakPolarHBondContact CA-O 3.34Å; V1057-V1103 HydrophobicContact CG1-CB 4.46Å; V1057-V1103 HydrophobicContact CG1-CG1 4.13Å; V1057-V1103 HydrophobicContact CG1-CG2 4.08Å
1058	Q	88.4	Confident	78.2	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.075	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	122.7	176.3	-164	-177.8	-1.3	0	0	109.9	Y1060 T1068 I1102 E1259	Q1058-Y1060 HydrophobicContact CB-CE2 4.21Å; Q1058-Y1060 HydrophobicContact CG-CE2 3.99Å; Q1058-Y1060 PolarHBondContact NE2-OH 2.75Å; Q1058-Y1060 PolarHBondContact OE1-OH 2.69Å; Q1058-Y1060 VanDerWaalsContact OE1-OH 3.1Å; Q1058-T1068 WeakPolarHBondContact CG-O 3.46Å; Q1058-T1068 PolarHBondContact NE2-O 2.98Å; Q1058-I1102 HydrophobicContact CB-CB 4.42Å; Q1058-I1102 PolarHBondContact N-O 2.86Å; Q1058-I1102 PolarHBondContact O-N 2.83Å; Q1058-E1259 PolarHBondContact NE2-OE1 3.01Å; Q1058-E1259 VanDerWaalsContact NE2-OE1 3.11Å
1059	L	90.1	Very high	78.4	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	141.7	-173	-36.6	-176.3	0	0	0	110.1	Y1037 I1039 K1067 T1068 I1071 I1095 L1098 L1101 I1121	Y1037-L1059 HydrophobicContact CD1-CD1 3.88Å; Y1037-L1059 HydrophobicContact CE1-CD1 4.03Å; Y1037-L1059 HydrophobicContact CG-CD1 4.17Å; I1039-L1059 HydrophobicContact CD1-CD2 4.12Å; L1059-K1067 CarbonylContact O-C 3.54Å; L1059-K1067 WeakPolarHBondContact O-CA 3.5Å; L1059-T1068 HydrophobicContact CB-CG2 3.89Å; L1059-T1068 HydrophobicContact CD1-CG2 4.11Å; L1059-T1068 HydrophobicContact CG-CG2 3.95Å; L1059-T1068 PolarHBondContact N-OG1 3.47Å; L1059-T1068 PolarHBondContact O-N 3.08Å; L1059-I1071 HydrophobicContact CG-CD1 4.17Å; L1059-I1095 HydrophobicContact CB-CD1 3.74Å; L1059-I1095 VanDerWaalsContact O-CD1 3.31Å; L1059-I1095 WeakPolarHBondContact O-CD1 3.17Å; L1059-L1098 HydrophobicContact CB-CD2 4.31Å; L1059-L1101 HydrophobicContact CD2-CD1 3.49Å; L1059-L1101 VanDerWaalsContact CD2-CD1 3.49Å; L1059-I1121 HydrophobicContact CD2-CD1 3.53Å
1060	Y	87.5	Confident	78.5	Confident	1 Å²	1	42.4 Å²	42.4	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.9	176.2	-61.4	-103.7	0	0	0	109.6	Q1058 K1067 Q1099 K1100 I1102 E1259	Q1058-Y1060 HydrophobicContact CB-CE2 4.21Å; Q1058-Y1060 HydrophobicContact CG-CE2 3.99Å; Q1058-Y1060 PolarHBondContact NE2-OH 2.75Å; Q1058-Y1060 PolarHBondContact OE1-OH 2.69Å; Q1058-Y1060 VanDerWaalsContact OE1-OH 3.1Å; Y1060-K1067 HydrophobicContact CD1-CB 3.57Å; Y1060-K1067 HydrophobicContact CE1-CB 3.58Å; Y1060-K1067 HydrophobicContact CE1-CD 3.8Å; Y1060-K1067 HydrophobicContact CE1-CG 4.31Å; Y1060-K1067 HydrophobicContact CG-CB 4.18Å; Y1060-Q1099 PolarHBondContact O-N 3.11Å; Y1060-K1100 WeakPolarHBondContact CB-O 3.37Å; Y1060-K1100 HydrophobicContact CD2-CB 4.41Å; Y1060-K1100 HydrophobicContact CD2-CG 4.15Å; Y1060-K1100 HydrophobicContact CG-CB 4.35Å; Y1060-K1100 HydrophobicContact CG-CG 4.44Å; Y1060-K1100 PolarHBondContact N-O 3.02Å; Y1060-K1100 PolarHBondContact O-N 2.9Å; Y1060-I1102 HydrophobicContact CE2-CB 4.47Å; Y1060-I1102 HydrophobicContact CE2-CD1 3.62Å; Y1060-I1102 HydrophobicContact CE2-CG1 3.75Å; Y1060-I1102 WeakPolarHBondContact OH-CD1 3.44Å; Y1060-E1259 HydrophobicContact CE1-CG 3.93Å; Y1060-E1259 VanDerWaalsContact OH-CG 3.23Å; Y1060-E1259 WeakPolarHBondContact OH-CG 3.47Å; Y1060-E1259 PolarHBondContact OH-OE1 2.89Å
1061	G	85.6	Confident	78.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	178.9	-175.9	0	0	0	0	0	113.1	P1063 L1064 R1066 I1095 P1097 Q1099	G1061-P1063 CarbonylContact O-C 3.55Å; G1061-L1064 WeakPolarHBondContact O-CA 3.34Å; G1061-L1064 PolarHBondContact O-N 2.85Å; G1061-L1064 VanDerWaalsContact O-N 3.13Å; G1061-R1066 PolarHBondContact N-O 3.08Å; G1061-I1095 CarbonylContact C-O 3.54Å; G1061-I1095 VanDerWaalsContact C-O 3.22Å; G1061-P1097 CarbonylContact C-O 3.56Å; G1061-P1097 WeakPolarHBondContact CA-O 3.21Å; G1061-Q1099 PolarHBondContact O-OE1 2.89Å
1062	T	76.6	Confident	78.8	Confident	28 Å²	28	44.1 Å²	44.1	17%	0.172	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	128.6	-161.4	-49	0	0	0	0	114.2	I1095 P1097 Q1099 I1177	T1062-I1095 PolarHBondContact N-O 3.25Å; T1062-P1097 PolarHBondContact N-O 3.38Å; T1062-P1097 PolarHBondContact OG1-O 2.72Å; T1062-Q1099 VanDerWaalsContact OG1-CD 3.24Å; T1062-Q1099 PolarHBondContact OG1-OE1 2.92Å; T1062-I1177 HydrophobicContact CG2-CD1 3.61Å
1063	P	72.2	Confident	79	Confident	79 Å²	79	39 Å²	39	51%	0.513	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	cis	-77.7	144.5	-12.3	32.4	-34.2	0	0	0	111	G1061 K1065 R1066	G1061-P1063 CarbonylContact O-C 3.55Å; P1063-K1065 PolarHBondContact O-N 3.26Å; P1063-R1066 PolarHBondContact O-N 3.02Å
1064	L	77.9	Confident	78.5	Confident	16 Å²	16	41.7 Å²	41.7	8%	0.084	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.6	-23.1	-163	-78.4	99.4	0	0	0	118.2	G1061 R1066 Q1099 K1100 L1226 N1257	G1061-L1064 WeakPolarHBondContact O-CA 3.34Å; G1061-L1064 PolarHBondContact O-N 2.85Å; G1061-L1064 VanDerWaalsContact O-N 3.13Å; L1064-R1066 PolarHBondContact O-N 2.79Å; L1064-R1066 VanDerWaalsContact O-N 3.16Å; L1064-Q1099 HydrophobicContact CD1-CB 4.41Å; L1064-Q1099 HydrophobicContact CD2-CB 4.39Å; L1064-Q1099 HydrophobicContact CG-CB 4.08Å; L1064-Q1099 VanDerWaalsContact CG-OE1 3.31Å; L1064-K1100 HydrophobicContact CD2-CB 4.22Å; L1064-L1226 HydrophobicContact CD1-CD2 3.87Å; L1064-L1226 HydrophobicContact CD2-CD1 4.37Å; L1064-L1226 HydrophobicContact CD2-CD2 4.17Å; L1064-N1257 CarbonylContact C-O 3.58Å; L1064-N1257 WeakPolarHBondContact CB-O 3.38Å
1065	K	74.2	Confident	77.5	Confident	166 Å²	166	45.1 Å²	45.1	72%	0.722	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.6	171.8	81.9	165.4	-163.3	168.1	0	113.2	P1063 K1067 N1257	P1063-K1065 PolarHBondContact O-N 3.26Å; K1065-K1067 PolarHBondContact O-N 2.84Å; K1065-N1257 WeakPolarHBondContact CA-O 3.45Å; K1065-N1257 PolarHBondContact N-O 2.88Å
1066	R	76.3	Confident	75.9	Confident	130 Å²	130	51 Å²	51	49%	0.491	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	102.7	170.3	-68.9	-169.3	173	-147.5	0.3	108.4	G1061 P1063 L1064 D1094 I1095	G1061-R1066 PolarHBondContact N-O 3.08Å; P1063-R1066 PolarHBondContact O-N 3.02Å; L1064-R1066 PolarHBondContact O-N 2.79Å; L1064-R1066 VanDerWaalsContact O-N 3.16Å; R1066-D1094 PolarHBondContact NH1-O 3.46Å; R1066-I1095 HydrophobicContact CB-CB 3.88Å; R1066-I1095 HydrophobicContact CB-CG2 4.31Å; R1066-I1095 WeakPolarHBondContact CD-O 3.47Å
1067	K	82.8	Confident	74	Confident	48 Å²	48	56.7 Å²	56.7	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.9	-179	64.1	-175.4	-174.6	168.2	0	110.9	L1059 Y1060 K1065 E1259	L1059-K1067 CarbonylContact O-C 3.54Å; L1059-K1067 WeakPolarHBondContact O-CA 3.5Å; Y1060-K1067 HydrophobicContact CD1-CB 3.57Å; Y1060-K1067 HydrophobicContact CE1-CB 3.58Å; Y1060-K1067 HydrophobicContact CE1-CD 3.8Å; Y1060-K1067 HydrophobicContact CE1-CG 4.31Å; Y1060-K1067 HydrophobicContact CG-CB 4.18Å; K1065-K1067 PolarHBondContact O-N 2.84Å; K1067-E1259 WeakPolarHBondContact CD-OE1 3.46Å; K1067-E1259 IonicContact NZ-OE1 2.68Å; K1067-E1259 PolarHBondContact NZ-OE1 3.37Å; K1067-E1259 IonicContact NZ-OE2 3.25Å; K1067-E1259 PolarHBondContact NZ-OE2 3.37Å
1068	T	79.1	Confident	72.1	Confident	4 Å²	4	61.4 Å²	61.4	3%	0.025	30%	0.295	C	S	.	.			trans	-74.7	169.2	165.1	62.4	0	0	0	0	110.7	Q1058 L1059 I1071 A1092 I1095	Q1058-T1068 WeakPolarHBondContact CG-O 3.46Å; Q1058-T1068 PolarHBondContact NE2-O 2.98Å; L1059-T1068 HydrophobicContact CB-CG2 3.89Å; L1059-T1068 HydrophobicContact CD1-CG2 4.11Å; L1059-T1068 HydrophobicContact CG-CG2 3.95Å; L1059-T1068 PolarHBondContact N-OG1 3.47Å; L1059-T1068 PolarHBondContact O-N 3.08Å; T1068-I1071 HydrophobicContact CG2-CD1 4.12Å; T1068-I1071 WeakPolarHBondContact OG1-CD1 3.43Å; T1068-A1092 HydrophobicContact CG2-CB 3.71Å; T1068-I1095 HydrophobicContact CG2-CD1 4.22Å; T1068-I1095 HydrophobicContact CG2-CG2 4.44Å
1069	E	73.2	Confident	70.7	Confident	58 Å²	58	64.5 Å²	64.5	27%	0.271	31%	0.309	S	S	.	.			trans	-63.3	169	155.2	-50.7	-175.1	-160.3	0	0	110.6	I1071 Y1403 K1449	E1069-I1071 PolarHBondContact O-N 2.82Å; E1069-Y1403 HydrophobicContact CB-CE1 4.41Å; E1069-Y1403 HydrophobicContact CG-CE1 3.8Å; E1069-Y1403 WeakPolarHBondContact OE2-CE1 3.43Å; E1069-Y1403 PolarHBondContact OE2-OH 3.17Å; E1069-K1449 WeakPolarHBondContact OE1-CE 3.49Å; E1069-K1449 IonicContact OE1-NZ 3.02Å; E1069-K1449 PolarHBondContact OE1-NZ 3.43Å; E1069-K1449 IonicContact OE2-NZ 2.74Å; E1069-K1449 PolarHBondContact OE2-NZ 2.79Å
1070	I	74.9	Confident	69.7	Low	54 Å²	54	64.8 Å²	64.8	28%	0.277	31%	0.311	S	S	.	.			trans	-70.8	113.2	169.4	-58	174.2	0	0	0	108	T1056	T1056-I1070 HydrophobicContact CG2-CG2 3.86Å
1071	I	77.6	Confident	68.6	Low	26 Å²	26	70.2 Å²	70.2	13%	0.133	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.6	-179.1	-59.2	131.5	0	0	0	108.8	T1056 V1057 L1059 T1068 E1069 L1073 I1090	T1056-I1071 CarbonylContact C-O 2.94Å; T1056-I1071 VanDerWaalsContact CA-O 3.24Å; T1056-I1071 WeakPolarHBondContact CA-O 3.31Å; V1057-I1071 HydrophobicContact CG2-CB 3.93Å; V1057-I1071 HydrophobicContact CG2-CD1 4.26Å; V1057-I1071 HydrophobicContact CG2-CG2 4.35Å; V1057-I1071 PolarHBondContact N-O 3.45Å; V1057-I1071 PolarHBondContact O-N 2.92Å; L1059-I1071 HydrophobicContact CG-CD1 4.17Å; T1068-I1071 HydrophobicContact CG2-CD1 4.12Å; T1068-I1071 WeakPolarHBondContact OG1-CD1 3.43Å; E1069-I1071 PolarHBondContact O-N 2.82Å; I1071-L1073 HydrophobicContact CG2-CD2 4.1Å; I1071-I1090 HydrophobicContact CB-CD1 4.39Å; I1071-I1090 HydrophobicContact CD1-CD1 3.61Å; I1071-I1090 HydrophobicContact CG1-CD1 4.04Å; I1071-I1090 HydrophobicContact CG2-CB 4.32Å; I1071-I1090 HydrophobicContact CG2-CD1 3.85Å; I1071-I1090 HydrophobicContact CG2-CG2 3.93Å
1072	R	74.9	Confident	67.7	Low	117 Å²	117	75 Å²	75	44%	0.442	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.2	178.3	-169.2	179.1	178.2	135.9	0.9	110.4	I1054 T1056 S1074	I1054-R1072 HydrophobicContact CG2-CG 3.61Å; T1056-R1072 HydrophobicContact CG2-CB 4.41Å; T1056-R1072 HydrophobicContact CG2-CG 4.46Å; R1072-S1074 PolarHBondContact NE-OG 3.37Å; R1072-S1074 PolarHBondContact O-N 3.49Å
1073	L	74.4	Confident	67.2	Low	5 Å²	5	76 Å²	76	3%	0.026	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	78.1	177.7	-57.9	-172.6	0	0	0	109.8	I1041 V1055 V1057 I1071 F1088 I1090	I1041-L1073 HydrophobicContact CD1-CD1 3.43Å; I1041-L1073 VanDerWaalsContact CD1-CD1 3.43Å; V1055-L1073 HydrophobicContact CB-CB 4.44Å; V1055-L1073 HydrophobicContact CG1-CD1 4.29Å; V1055-L1073 WeakPolarHBondContact O-CA 3.36Å; V1055-L1073 WeakPolarHBondContact O-CB 3.36Å; V1055-L1073 PolarHBondContact O-N 2.89Å; V1057-L1073 HydrophobicContact CB-CD1 4.48Å; V1057-L1073 HydrophobicContact CG1-CD1 3.62Å; V1057-L1073 HydrophobicContact CG1-CG 4.28Å; V1057-L1073 HydrophobicContact CG2-CD1 4Å; V1057-L1073 HydrophobicContact CG2-CD2 4.08Å; V1057-L1073 HydrophobicContact CG2-CG 4.02Å; I1071-L1073 HydrophobicContact CG2-CD2 4.1Å; L1073-F1088 HydrophobicContact CB-CD1 3.96Å; L1073-F1088 HydrophobicContact CB-CE1 3.98Å; L1073-F1088 HydrophobicContact CB-CG 4.38Å; L1073-F1088 HydrophobicContact CB-CZ 4.42Å; L1073-F1088 HydrophobicContact CD1-CD2 4.19Å; L1073-F1088 HydrophobicContact CD1-CG 4.28Å; L1073-F1088 HydrophobicContact CD2-CB 3.93Å; L1073-F1088 HydrophobicContact CD2-CD1 4.17Å; L1073-F1088 HydrophobicContact CD2-CG 4.03Å; L1073-F1088 HydrophobicContact CG-CD1 4.49Å; L1073-F1088 HydrophobicContact CG-CG 4.47Å; L1073-I1090 HydrophobicContact CD2-CG2 4.18Å
1074	S	59.8	Low	66.8	Low	62 Å²	62	77.3 Å²	77.3	43%	0.434	37%	0.37	S	S	.	.			trans	-138.6	117.5	176	58.4	0	0	0	0	112.1	R1072	R1072-S1074 PolarHBondContact NE-OG 3.37Å; R1072-S1074 PolarHBondContact O-N 3.49Å
1075	R	52.5	Low	66.5	Low	111 Å²	111	80.2 Å²	80.2	42%	0.419	39%	0.39	S	S	.	.			trans	-94.9	157	146.3	-67	-166.4	-169.6	124.3	6.1	107.9	Q1077 H1078	R1075-Q1077 PolarHBondContact O-N 3.35Å; R1075-Q1077 VanDerWaalsContact O-N 3.14Å; R1075-H1078 PolarHBondContact NH1-NE2 2.82Å; R1075-H1078 VanDerWaalsContact NH1-NE2 3.12Å
1076	T	45	Very low	66.6	Low	125 Å²	125	73.6 Å²	73.6	77%	0.767	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-9.9	-164.4	4	0	0	0	0	114.9	E946	E946-T1076 VanDerWaalsContact CD-OG1 3.24Å; E946-T1076 PolarHBondContact OE1-N 3.05Å; E946-T1076 VanDerWaalsContact OE1-N 3.15Å; E946-T1076 PolarHBondContact OE1-OG1 2.96Å; E946-T1076 WeakPolarHBondContact OE2-CB 3.44Å; E946-T1076 PolarHBondContact OE2-OG1 2.87Å
1077	Q	43.1	Very low	66.6	Low	141 Å²	141	70.5 Å²	70.5	66%	0.659	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.4	11.5	177.6	-59.8	-164.8	12.1	0	0	117.5	R1075	R1075-Q1077 PolarHBondContact O-N 3.35Å; R1075-Q1077 VanDerWaalsContact O-N 3.14Å
1078	H	49.1	Very low	66.2	Low	101 Å²	101	69.1 Å²	69.1	47%	0.468	35%	0.351	S	S	.	.			trans	-89.7	112.7	176.4	-66.2	-29.4	0	0	0	112.2	R1075	R1075-H1078 PolarHBondContact NH1-NE2 2.82Å; R1075-H1078 VanDerWaalsContact NH1-NE2 3.12Å
1079	H	59	Low	65.8	Low	82 Å²	82	72.7 Å²	72.7	38%	0.38	36%	0.364	S	S	.	.			trans	-85.4	136.5	163.1	-42.7	120	0	0	0	109	T1051 K1052 K1081	T1051-H1079 CarbonylContact O-C 3.55Å; K1052-H1079 VanDerWaalsContact CD-CD2 3.4Å; K1052-H1079 WeakPolarHBondContact CD-CD2 3.47Å; K1052-H1079 VanDerWaalsContact CE-CD2 3.48Å; K1052-H1079 WeakPolarHBondContact CE-CD2 3.42Å; K1052-H1079 VanDerWaalsContact CE-NE2 3.35Å; K1052-H1079 WeakPolarHBondContact CE-NE2 3.44Å; K1052-H1079 HydrophobicContact CG-CB 4.33Å; K1052-H1079 VanDerWaalsContact CG-CD2 3.42Å; K1052-H1079 WeakPolarHBondContact CG-CD2 3.45Å; K1052-H1079 PolarHBondContact NZ-CE1 2.93Å; K1052-H1079 VanDerWaalsContact NZ-CE1 3.29Å; K1052-H1079 PolarHBondContact NZ-NE2 2.82Å; H1079-K1081 PolarHBondContact O-N 3.21Å; H1079-K1081 VanDerWaalsContact O-N 3.12Å
1080	F	68.5	Low	65.9	Low	7 Å²	7	71 Å²	71	3%	0.031	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-67.3	106.4	175.9	-74.7	-95.5	0	0	0	110.6	I1041 Q1050 T1051 V1055 E1086 F1088 W1114	I1041-F1080 HydrophobicContact CB-CE1 4.32Å; I1041-F1080 HydrophobicContact CD1-CE1 3.96Å; I1041-F1080 HydrophobicContact CD1-CZ 4.45Å; I1041-F1080 HydrophobicContact CG2-CD1 4.17Å; I1041-F1080 HydrophobicContact CG2-CE1 3.97Å; Q1050-F1080 WeakPolarHBondContact CA-O 3.34Å; Q1050-F1080 WeakPolarHBondContact CB-O 3.41Å; T1051-F1080 HydrophobicContact CG2-CB 3.69Å; T1051-F1080 HydrophobicContact CG2-CD2 3.62Å; T1051-F1080 HydrophobicContact CG2-CG 3.85Å; T1051-F1080 PolarHBondContact N-O 2.89Å; T1051-F1080 PolarHBondContact O-N 3.34Å; V1055-F1080 HydrophobicContact CB-CE2 3.89Å; V1055-F1080 HydrophobicContact CB-CZ 3.79Å; V1055-F1080 HydrophobicContact CG1-CZ 4.31Å; V1055-F1080 HydrophobicContact CG2-CD2 4.09Å; V1055-F1080 HydrophobicContact CG2-CE1 4.49Å; V1055-F1080 HydrophobicContact CG2-CE2 3.44Å; V1055-F1080 VanDerWaalsContact CG2-CE2 3.44Å; V1055-F1080 HydrophobicContact CG2-CZ 3.68Å; F1080-E1086 VanDerWaalsContact CA-OE1 3.3Å; F1080-E1086 WeakPolarHBondContact CA-OE1 3.37Å; F1080-F1088 AromaticContact CE1-CE2 3.73Å; F1080-F1088 HydrophobicContact CE1-CE2 3.73Å; F1080-F1088 AromaticContact CE1-CZ 3.71Å; F1080-F1088 HydrophobicContact CE1-CZ 3.71Å; F1080-F1088 HydrophobicContact CE2-CZ 4.4Å; F1080-F1088 HydrophobicContact CZ-CE1 4.45Å; F1080-F1088 AromaticContact CZ-CE2 3.95Å; F1080-F1088 HydrophobicContact CZ-CE2 3.95Å; F1080-F1088 AromaticContact CZ-CZ 3.52Å; F1080-F1088 HydrophobicContact CZ-CZ 3.52Å; F1080-W1114 HydrophobicContact CD1-CZ2 4.02Å; F1080-W1114 HydrophobicContact CE1-CZ2 4.19Å; F1080-W1114 HydrophobicContact CG-CZ2 4.47Å
1081	K	64.6	Low	65.9	Low	115 Å²	115	70.5 Å²	70.5	50%	0.5	35%	0.352	S	S	.	.			trans	-84.1	142.4	-173.1	-70.7	-179.7	-174.2	174.8	0	113	T1043 H1079 G1083 Q1084 E1086	T1043-K1081 WeakPolarHBondContact CB-O 3.45Å; H1079-K1081 PolarHBondContact O-N 3.21Å; H1079-K1081 VanDerWaalsContact O-N 3.12Å; K1081-G1083 PolarHBondContact O-N 3.49Å; K1081-Q1084 HydrophobicContact CB-CB 4.34Å; K1081-Q1084 PolarHBondContact O-N 2.77Å; K1081-E1086 PolarHBondContact N-OE1 3.45Å
1082	F	66.5	Low	65.8	Low	101 Å²	101	69.4 Å²	69.4	44%	0.443	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	128.1	171.4	176.6	-78.6	0	0	0	111.7	D1045 R1046 Q1084	D1045-F1082 HydrophobicContact CB-CE1 4.28Å; D1045-F1082 HydrophobicContact CB-CZ 4.19Å; D1045-F1082 VanDerWaalsContact O-CE2 3.24Å; D1045-F1082 WeakPolarHBondContact O-CE2 3.37Å; D1045-F1082 WeakPolarHBondContact O-CZ 3.07Å; R1046-F1082 WeakPolarHBondContact O-CE2 3.12Å; F1082-Q1084 PolarHBondContact O-N 3.22Å; F1082-Q1084 VanDerWaalsContact O-N 3.1Å
1083	G	65.7	Low	65.8	Low	48 Å²	48	65.2 Å²	65.2	50%	0.495	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	11.4	173.4	0	0	0	0	0	116.5	T1043 G1044 K1081	T1043-G1083 WeakPolarHBondContact O-CA 3.39Å; T1043-G1083 PolarHBondContact O-N 3.14Å; G1044-G1083 PolarHBondContact O-N 3.05Å; K1081-G1083 PolarHBondContact O-N 3.49Å
1084	Q	64.2	Low	66.1	Low	107 Å²	107	67.1 Å²	67.1	50%	0.5	35%	0.346	S	S	.	.			trans	-114.6	134.3	177.6	-65.7	-167.2	-15	0	0	111.1	K1081 F1082	K1081-Q1084 HydrophobicContact CB-CB 4.34Å; K1081-Q1084 PolarHBondContact O-N 2.77Å; F1082-Q1084 PolarHBondContact O-N 3.22Å; F1082-Q1084 VanDerWaalsContact O-N 3.1Å
1085	P	71.5	Confident	67.2	Low	76 Å²	76	64.5 Å²	64.5	49%	0.494	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	132.8	173.1	31	-32.6	0	0	0	110.7	I1040 I1041 F1042	I1040-P1085 HydrophobicContact CG2-CB 4Å; I1041-P1085 CarbonylContact O-C 3.49Å; I1041-P1085 WeakPolarHBondContact O-CA 3.48Å; F1042-P1085 HydrophobicContact CD1-CB 3.92Å; F1042-P1085 HydrophobicContact CE1-CB 3.84Å; F1042-P1085 HydrophobicContact CG-CB 4.47Å; F1042-P1085 HydrophobicContact CZ-CB 4.32Å
1086	E	76.8	Confident	68.5	Low	27 Å²	27	59.8 Å²	59.8	13%	0.126	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.2	-178.6	-71.9	-178.7	-162.6	0	0	111.8	I1040 I1041 F1080 K1081 F1088	I1040-E1086 WeakPolarHBondContact CA-O 3.35Å; I1041-E1086 PolarHBondContact N-O 3.25Å; I1041-E1086 PolarHBondContact O-N 2.8Å; F1080-E1086 VanDerWaalsContact CA-OE1 3.3Å; F1080-E1086 WeakPolarHBondContact CA-OE1 3.37Å; K1081-E1086 PolarHBondContact N-OE1 3.45Å; E1086-F1088 HydrophobicContact CB-CE2 3.88Å; E1086-F1088 HydrophobicContact CB-CZ 4.36Å
1087	T	74.6	Confident	70.3	Confident	66 Å²	66	55.2 Å²	55.2	41%	0.405	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.1	-169.9	-55.8	0	0	0	0	112.4	E1038 I1039 I1040	E1038-T1087 HydrophobicContact CG-CG2 3.6Å; I1039-T1087 WeakPolarHBondContact O-CA 3.15Å; I1040-T1087 HydrophobicContact CG1-CG2 3.98Å
1088	F	74.8	Confident	72.4	Confident	18 Å²	18	48.8 Å²	48.8	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.2	177.1	-57.5	-95.1	0	0	0	109.7	I1039 I1041 L1073 F1080 E1086	I1039-F1088 PolarHBondContact N-O 3.33Å; I1039-F1088 PolarHBondContact O-N 2.73Å; I1041-F1088 HydrophobicContact CD1-CD2 4.35Å; I1041-F1088 HydrophobicContact CD1-CE2 4.19Å; L1073-F1088 HydrophobicContact CB-CD1 3.96Å; L1073-F1088 HydrophobicContact CB-CE1 3.98Å; L1073-F1088 HydrophobicContact CB-CG 4.38Å; L1073-F1088 HydrophobicContact CB-CZ 4.42Å; L1073-F1088 HydrophobicContact CD1-CD2 4.19Å; L1073-F1088 HydrophobicContact CD1-CG 4.28Å; L1073-F1088 HydrophobicContact CD2-CB 3.93Å; L1073-F1088 HydrophobicContact CD2-CD1 4.17Å; L1073-F1088 HydrophobicContact CD2-CG 4.03Å; L1073-F1088 HydrophobicContact CG-CD1 4.49Å; L1073-F1088 HydrophobicContact CG-CG 4.47Å; F1080-F1088 AromaticContact CE1-CE2 3.73Å; F1080-F1088 HydrophobicContact CE1-CE2 3.73Å; F1080-F1088 AromaticContact CE1-CZ 3.71Å; F1080-F1088 HydrophobicContact CE1-CZ 3.71Å; F1080-F1088 HydrophobicContact CE2-CZ 4.4Å; F1080-F1088 HydrophobicContact CZ-CE1 4.45Å; F1080-F1088 AromaticContact CZ-CE2 3.95Å; F1080-F1088 HydrophobicContact CZ-CE2 3.95Å; F1080-F1088 AromaticContact CZ-CZ 3.52Å; F1080-F1088 HydrophobicContact CZ-CZ 3.52Å; E1086-F1088 HydrophobicContact CB-CE2 3.88Å; E1086-F1088 HydrophobicContact CB-CZ 4.36Å
1089	R	72.1	Confident	74.1	Confident	80 Å²	80	44.2 Å²	44.2	30%	0.302	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.7	174.2	-171.8	176.7	-178.8	139.2	-11	109.2	S902 A905 Y1037	S902-R1089 VanDerWaalsContact O-CZ 3.29Å; S902-R1089 PolarHBondContact O-NH1 3.33Å; S902-R1089 PolarHBondContact O-NH2 3.22Å; A905-R1089 PolarHBondContact O-NH2 2.89Å; Y1037-R1089 WeakPolarHBondContact O-CA 3.42Å
1090	I	75.2	Confident	75.5	Confident	21 Å²	21	40.3 Å²	40.3	11%	0.108	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	162.4	-171.7	65.7	165.2	0	0	0	110.5	P1036 Y1037 I1039 I1071 L1073	P1036-I1090 WeakPolarHBondContact CA-O 3.23Å; Y1037-I1090 PolarHBondContact N-O 3.01Å; Y1037-I1090 PolarHBondContact O-N 3.31Å; I1039-I1090 HydrophobicContact CD1-CD1 3.56Å; I1039-I1090 HydrophobicContact CD1-CG1 4.3Å; I1039-I1090 HydrophobicContact CG1-CD1 4.33Å; I1071-I1090 HydrophobicContact CB-CD1 4.39Å; I1071-I1090 HydrophobicContact CD1-CD1 3.61Å; I1071-I1090 HydrophobicContact CG1-CD1 4.04Å; I1071-I1090 HydrophobicContact CG2-CB 4.32Å; I1071-I1090 HydrophobicContact CG2-CD1 3.85Å; I1071-I1090 HydrophobicContact CG2-CG2 3.93Å; L1073-I1090 HydrophobicContact CD2-CG2 4.18Å
1091	F	73.9	Confident	76.5	Confident	44 Å²	44	40 Å²	40	19%	0.193	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126	172.6	-71.2	-93	0	0	0	109.6	A907 Y996 M1034 I1035 P1036	A907-F1091 HydrophobicContact CB-CD2 4.49Å; A907-F1091 HydrophobicContact CB-CE1 4.33Å; A907-F1091 HydrophobicContact CB-CE2 3.44Å; A907-F1091 VanDerWaalsContact CB-CE2 3.44Å; A907-F1091 HydrophobicContact CB-CZ 3.34Å; Y996-F1091 HydrophobicContact CD2-CB 4.46Å; Y996-F1091 HydrophobicContact CD2-CG 4.35Å; Y996-F1091 HydrophobicContact CG-CB 4.43Å; M1034-F1091 HydrophobicContact CB-CB 4.14Å; M1034-F1091 HydrophobicContact SD-CB 4.28Å; I1035-F1091 WeakPolarHBondContact O-CA 3.19Å; P1036-F1091 HydrophobicContact CB-CD1 4.36Å; P1036-F1091 HydrophobicContact CB-CE1 3.74Å; P1036-F1091 HydrophobicContact CB-CZ 3.94Å; P1036-F1091 HydrophobicContact CG-CE1 4.27Å
1092	A	76.5	Confident	77.6	Confident	4 Å²	4	35.2 Å²	35.2	3%	0.033	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	162.4	177.3	0	0	0	0	0	111	M1034 I1035 Y1037 T1068	M1034-A1092 CarbonylContact C-O 3.57Å; M1034-A1092 VanDerWaalsContact CA-O 3.26Å; M1034-A1092 WeakPolarHBondContact CA-O 3.43Å; M1034-A1092 WeakPolarHBondContact CB-O 3.32Å; I1035-A1092 PolarHBondContact N-O 3.38Å; I1035-A1092 PolarHBondContact O-N 2.73Å; Y1037-A1092 HydrophobicContact CD2-CB 4.12Å; Y1037-A1092 HydrophobicContact CE2-CB 3.95Å; T1068-A1092 HydrophobicContact CG2-CB 3.71Å
1093	P	75	Confident	78.7	Confident	28 Å²	28	30.4 Å²	30.4	18%	0.182	17%	0.173	C	C	.	.			trans	-58.8	152.4	178.5	-25.5	35.8	0	0	0	113.8	E1032 M1034 Y1037 I1095	E1032-P1093 HydrophobicContact CG-CG 4.36Å; M1034-P1093 HydrophobicContact CG-CG 4.48Å; Y1037-P1093 PolarHBondContact OH-O 3.35Å; Y1037-P1093 VanDerWaalsContact OH-O 3.05Å; P1093-I1095 PolarHBondContact O-N 2.62Å
1094	D	80.7	Confident	79.5	Confident	46 Å²	46	31 Å²	31	25%	0.246	16%	0.163	C	C	.	.			trans	-74.6	96.1	175	-175.3	2.2	0	0	0	111.6	I1035 R1066 G1096 K1123 F1128	I1035-D1094 HydrophobicContact CD1-CB 3.99Å; I1035-D1094 HydrophobicContact CG1-CB 4.49Å; I1035-D1094 HydrophobicContact CG2-CB 4.14Å; R1066-D1094 PolarHBondContact NH1-O 3.46Å; D1094-G1096 PolarHBondContact O-N 2.84Å; D1094-G1096 PolarHBondContact OD1-N 2.88Å; D1094-K1123 VanDerWaalsContact OD1-CE 3.27Å; D1094-K1123 WeakPolarHBondContact OD1-CE 3.17Å; D1094-K1123 IonicContact OD1-NZ 2.75Å; D1094-K1123 PolarHBondContact OD1-NZ 3.03Å; D1094-F1128 HydrophobicContact CB-CD2 4.27Å; D1094-F1128 HydrophobicContact CB-CE2 3.96Å
1095	I	82.5	Confident	80.2	Confident	7 Å²	7	26 Å²	26	4%	0.036	14%	0.14	C	C	.	.			trans	-80.8	7.2	179.1	65.3	176.6	0	0	0	114.5	L1059 G1061 T1062 R1066 T1068 P1093 L1098	L1059-I1095 HydrophobicContact CB-CD1 3.74Å; L1059-I1095 VanDerWaalsContact O-CD1 3.31Å; L1059-I1095 WeakPolarHBondContact O-CD1 3.17Å; G1061-I1095 CarbonylContact C-O 3.54Å; G1061-I1095 VanDerWaalsContact C-O 3.22Å; T1062-I1095 PolarHBondContact N-O 3.25Å; R1066-I1095 HydrophobicContact CB-CB 3.88Å; R1066-I1095 HydrophobicContact CB-CG2 4.31Å; R1066-I1095 WeakPolarHBondContact CD-O 3.47Å; T1068-I1095 HydrophobicContact CG2-CD1 4.22Å; T1068-I1095 HydrophobicContact CG2-CG2 4.44Å; P1093-I1095 PolarHBondContact O-N 2.62Å; I1095-L1098 HydrophobicContact CD1-CD2 3.68Å; I1095-L1098 HydrophobicContact CG1-CD2 3.84Å
1096	G	79	Confident	80	Confident	11 Å²	11	26 Å²	26	11%	0.113	14%	0.135	C	C	.	.			trans	84	-168.7	-174.3	0	0	0	0	0	113.1	D1094 L1098 K1123	D1094-G1096 PolarHBondContact O-N 2.84Å; D1094-G1096 PolarHBondContact OD1-N 2.88Å; G1096-L1098 PolarHBondContact O-N 3.16Å; G1096-K1123 PolarHBondContact O-NZ 3.27Å
1097	P	83	Confident	79.3	Confident	30 Å²	30	25.1 Å²	25.1	20%	0.195	13%	0.134	C	C	.	.	S	Bend	trans	-56.9	133	173.3	-25.7	34.8	0	0	0	111	G1061 T1062 V1179 Y1192	G1061-P1097 CarbonylContact C-O 3.56Å; G1061-P1097 WeakPolarHBondContact CA-O 3.21Å; T1062-P1097 PolarHBondContact N-O 3.38Å; T1062-P1097 PolarHBondContact OG1-O 2.72Å; P1097-V1179 HydrophobicContact CB-CG2 4.13Å; P1097-V1179 HydrophobicContact CG-CG2 3.85Å; P1097-Y1192 WeakPolarHBondContact CA-OH 3.01Å; P1097-Y1192 WeakPolarHBondContact CB-OH 3.45Å
1098	L	87.6	Confident	78.8	Confident	5 Å²	5	25.2 Å²	25.2	3%	0.026	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	148	-177	-58.2	-178.3	0	0	0	111.4	Y1037 L1059 I1095 G1096 I1121 Y1192 F1194 S1215	Y1037-L1098 HydrophobicContact CE1-CD2 4.21Å; L1059-L1098 HydrophobicContact CB-CD2 4.31Å; I1095-L1098 HydrophobicContact CD1-CD2 3.68Å; I1095-L1098 HydrophobicContact CG1-CD2 3.84Å; G1096-L1098 PolarHBondContact O-N 3.16Å; L1098-I1121 HydrophobicContact CD1-CB 3.94Å; L1098-I1121 HydrophobicContact CD1-CD1 4.38Å; L1098-I1121 HydrophobicContact CD1-CG2 3.62Å; L1098-Y1192 HydrophobicContact CB-CD1 3.89Å; L1098-Y1192 HydrophobicContact CB-CD2 3.99Å; L1098-Y1192 HydrophobicContact CB-CE1 4.18Å; L1098-Y1192 HydrophobicContact CB-CE2 4.26Å; L1098-Y1192 HydrophobicContact CB-CG 3.81Å; L1098-Y1192 HydrophobicContact CD1-CD2 3.78Å; L1098-Y1192 HydrophobicContact CD1-CE2 4.42Å; L1098-Y1192 HydrophobicContact CD1-CG 4.11Å; L1098-Y1192 HydrophobicContact CG-CD2 3.91Å; L1098-Y1192 HydrophobicContact CG-CE2 4.11Å; L1098-Y1192 HydrophobicContact CG-CG 4.22Å; L1098-F1194 HydrophobicContact CB-CZ 4.13Å; L1098-F1194 HydrophobicContact CD1-CE2 4.43Å; L1098-F1194 HydrophobicContact CD1-CZ 4.48Å; L1098-S1215 PolarHBondContact O-OG 3.46Å
1099	Q	85.6	Confident	77.9	Confident	5 Å²	5	26.8 Å²	26.8	2%	0.023	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	-37.7	-172.5	-66.9	-172.7	-67.3	0	0	113.4	Y1060 G1061 T1062 L1064 F1214 S1215 Q1224 L1226	Y1060-Q1099 PolarHBondContact O-N 3.11Å; G1061-Q1099 PolarHBondContact O-OE1 2.89Å; T1062-Q1099 VanDerWaalsContact OG1-CD 3.24Å; T1062-Q1099 PolarHBondContact OG1-OE1 2.92Å; L1064-Q1099 HydrophobicContact CD1-CB 4.41Å; L1064-Q1099 HydrophobicContact CD2-CB 4.39Å; L1064-Q1099 HydrophobicContact CG-CB 4.08Å; L1064-Q1099 VanDerWaalsContact CG-OE1 3.31Å; Q1099-F1214 WeakPolarHBondContact O-CA 3.4Å; Q1099-S1215 WeakPolarHBondContact CA-OG 3.28Å; Q1099-S1215 PolarHBondContact O-N 2.71Å; Q1099-S1215 PolarHBondContact O-OG 3.35Å; Q1099-Q1224 VanDerWaalsContact NE2-CD 3.32Å; Q1099-L1226 HydrophobicContact CB-CD1 4.19Å
1100	K	88	Confident	77	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	148.5	-179.2	170.3	179.6	-173.6	174.7	0	110.4	Y1060 L1064 E1212 T1213 E1259 V1288	Y1060-K1100 WeakPolarHBondContact CB-O 3.37Å; Y1060-K1100 HydrophobicContact CD2-CB 4.41Å; Y1060-K1100 HydrophobicContact CD2-CG 4.15Å; Y1060-K1100 HydrophobicContact CG-CB 4.35Å; Y1060-K1100 HydrophobicContact CG-CG 4.44Å; Y1060-K1100 PolarHBondContact N-O 3.02Å; Y1060-K1100 PolarHBondContact O-N 2.9Å; L1064-K1100 HydrophobicContact CD2-CB 4.22Å; K1100-E1212 WeakPolarHBondContact CE-OE1 3.4Å; K1100-E1212 WeakPolarHBondContact CE-OE2 3.33Å; K1100-E1212 IonicContact NZ-OE1 2.71Å; K1100-E1212 PolarHBondContact NZ-OE1 3.38Å; K1100-E1212 IonicContact NZ-OE2 2.66Å; K1100-E1212 PolarHBondContact NZ-OE2 3.48Å; K1100-T1213 WeakPolarHBondContact CA-O 3.41Å; K1100-E1259 PolarHBondContact NZ-O 2.88Å; K1100-V1288 PolarHBondContact NZ-O 2.59Å
1101	L	89.3	Confident	76.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.2	176.3	173.7	63.3	0	0	0	109.2	V1057 L1059 V1103 V1119 I1121 F1194 F1196 E1212 T1213	V1057-L1101 HydrophobicContact CB-CD1 4.34Å; L1059-L1101 HydrophobicContact CD2-CD1 3.49Å; L1059-L1101 VanDerWaalsContact CD2-CD1 3.49Å; L1101-V1103 HydrophobicContact CD1-CG2 4.29Å; L1101-V1103 HydrophobicContact CD2-CG2 3.98Å; L1101-V1103 HydrophobicContact CG-CG2 3.91Å; L1101-V1119 HydrophobicContact CD2-CB 3.96Å; L1101-V1119 HydrophobicContact CD2-CG1 4.05Å; L1101-V1119 HydrophobicContact CD2-CG2 4.26Å; L1101-I1121 HydrophobicContact CD1-CD1 4.06Å; L1101-I1121 HydrophobicContact CD2-CD1 4.13Å; L1101-F1194 HydrophobicContact CB-CD1 3.45Å; L1101-F1194 VanDerWaalsContact CB-CD1 3.45Å; L1101-F1194 HydrophobicContact CB-CD2 4.34Å; L1101-F1194 HydrophobicContact CB-CE1 3.56Å; L1101-F1194 HydrophobicContact CB-CE2 4.43Å; L1101-F1194 HydrophobicContact CB-CG 3.87Å; L1101-F1194 HydrophobicContact CB-CZ 4.06Å; L1101-F1194 HydrophobicContact CD2-CB 3.8Å; L1101-F1194 HydrophobicContact CD2-CD1 4.17Å; L1101-F1194 HydrophobicContact CD2-CD2 3.83Å; L1101-F1194 HydrophobicContact CD2-CE2 4.45Å; L1101-F1194 HydrophobicContact CD2-CG 3.67Å; L1101-F1194 HydrophobicContact CG-CD1 4.47Å; L1101-F1194 HydrophobicContact CG-CG 4.44Å; L1101-F1196 HydrophobicContact CB-CZ 4.44Å; L1101-F1196 HydrophobicContact CD2-CE2 3.81Å; L1101-F1196 HydrophobicContact CD2-CZ 3.81Å; L1101-F1196 HydrophobicContact CG-CE2 4.5Å; L1101-F1196 HydrophobicContact CG-CZ 4Å; L1101-E1212 VanDerWaalsContact O-CA 3.3Å; L1101-E1212 WeakPolarHBondContact O-CA 3.42Å; L1101-T1213 PolarHBondContact N-O 2.79Å; L1101-T1213 PolarHBondContact O-N 2.65Å
1102	I	88.4	Confident	75.4	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.067	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.4	165.4	-56.5	179.3	0	0	0	108.1	V1057 Q1058 Y1060 C1211 E1212 K1261	V1057-I1102 WeakPolarHBondContact CA-O 3.34Å; Q1058-I1102 HydrophobicContact CB-CB 4.42Å; Q1058-I1102 PolarHBondContact N-O 2.86Å; Q1058-I1102 PolarHBondContact O-N 2.83Å; Y1060-I1102 HydrophobicContact CE2-CB 4.47Å; Y1060-I1102 HydrophobicContact CE2-CD1 3.62Å; Y1060-I1102 HydrophobicContact CE2-CG1 3.75Å; Y1060-I1102 WeakPolarHBondContact OH-CD1 3.44Å; I1102-C1211 WeakPolarHBondContact CA-O 3.47Å; I1102-E1212 HydrophobicContact CG1-CB 3.91Å; I1102-K1261 HydrophobicContact CD1-CB 4.39Å; I1102-K1261 HydrophobicContact CG2-CB 4Å
1103	V	87.6	Confident	74.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.4	173.5	-173.7	0	0	0	0	108.6	V1055 T1056 V1057 L1101 W1114 L1116 F1196 N1210 C1211	V1055-V1103 HydrophobicContact CG1-CG1 3.93Å; T1056-V1103 WeakPolarHBondContact O-CA 3.39Å; V1057-V1103 HydrophobicContact CG1-CB 4.46Å; V1057-V1103 HydrophobicContact CG1-CG1 4.13Å; V1057-V1103 HydrophobicContact CG1-CG2 4.08Å; L1101-V1103 HydrophobicContact CD1-CG2 4.29Å; L1101-V1103 HydrophobicContact CD2-CG2 3.98Å; L1101-V1103 HydrophobicContact CG-CG2 3.91Å; V1103-W1114 HydrophobicContact CG1-CH2 4.04Å; V1103-W1114 HydrophobicContact CG1-CZ3 4.01Å; V1103-L1116 HydrophobicContact CB-CD2 4.06Å; V1103-L1116 HydrophobicContact CG1-CD2 3.95Å; V1103-L1116 HydrophobicContact CG2-CD2 4.08Å; V1103-F1196 HydrophobicContact CB-CZ 4.5Å; V1103-F1196 HydrophobicContact CG2-CE1 4.42Å; V1103-F1196 HydrophobicContact CG2-CE2 3.96Å; V1103-F1196 HydrophobicContact CG2-CZ 3.64Å; V1103-N1210 CarbonylContact O-C 3.2Å; V1103-N1210 VanDerWaalsContact O-CA 3.23Å; V1103-N1210 WeakPolarHBondContact O-CA 3.48Å; V1103-N1210 WeakPolarHBondContact O-CB 3.35Å; V1103-C1211 PolarHBondContact N-O 3.49Å; V1103-C1211 PolarHBondContact O-N 3.32Å
1104	E	83.3	Confident	75.1	Confident	60 Å²	60	31.1 Å²	31.1	28%	0.28	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.6	-178.1	171.7	165.2	-104	0	0	111.1	V1055 T1056 N1210	V1055-E1104 CarbonylContact C-O 3.43Å; V1055-E1104 WeakPolarHBondContact CA-O 3.42Å; T1056-E1104 PolarHBondContact N-O 2.75Å; T1056-E1104 PolarHBondContact O-N 3.38Å; T1056-E1104 WeakPolarHBondContact OG1-CB 3.31Å; T1056-E1104 PolarHBondContact OG1-O 3.07Å; E1104-N1210 HydrophobicContact CB-CB 3.72Å; E1104-N1210 HydrophobicContact CG-CB 3.95Å; E1104-N1210 PolarHBondContact OE1-ND2 2.74Å
1105	R	78.1	Confident	75.3	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.4	178	-179	172.1	84.5	114.3	-10.9	108.9	T1051 S1053 I1054 G1107 S1111 D1112 W1114 L1200 M1209	T1051-R1105 WeakPolarHBondContact OG1-CD 3.37Å; T1051-R1105 PolarHBondContact OG1-NH1 3.44Å; S1053-R1105 PolarHBondContact OG-NH1 2.78Å; I1054-R1105 WeakPolarHBondContact O-CA 3.48Å; R1105-G1107 PolarHBondContact O-N 2.95Å; R1105-S1111 PolarHBondContact NH1-O 3.33Å; R1105-D1112 PolarHBondContact NH2-O 3Å; R1105-W1114 HydrophobicContact CB-CE3 4.34Å; R1105-L1200 VanDerWaalsContact CZ-O 3.3Å; R1105-L1200 PolarHBondContact NE-O 3.48Å; R1105-L1200 PolarHBondContact NH2-O 2.79Å; R1105-M1209 HydrophobicContact CB-CE 3.93Å; R1105-M1209 HydrophobicContact CG-CE 3.84Å; R1105-M1209 PolarHBondContact N-O 2.8Å; R1105-M1209 VanDerWaalsContact O-CE 3.22Å; R1105-M1209 WeakPolarHBondContact O-CE 3.4Å
1106	D	68.9	Low	75.4	Confident	75 Å²	75	29.1 Å²	29.1	40%	0.401	18%	0.177	S	C	.	.			trans	-66.8	-20.1	-174.9	79.2	-26	0	0	0	114.1	S1053 I1054 T1108	S1053-D1106 VanDerWaalsContact CB-OD1 3.23Å; S1053-D1106 WeakPolarHBondContact CB-OD1 3.48Å; I1054-D1106 HydrophobicContact CB-CB 4.34Å; I1054-D1106 VanDerWaalsContact CD1-OD2 3.23Å; I1054-D1106 WeakPolarHBondContact CD1-OD2 3.47Å; I1054-D1106 PolarHBondContact N-OD1 2.72Å; I1054-D1106 PolarHBondContact O-N 3.28Å; D1106-T1108 PolarHBondContact OD1-N 2.88Å; D1106-T1108 PolarHBondContact OD1-OG1 2.79Å; D1106-T1108 WeakPolarHBondContact OD2-CB 3.45Å; D1106-T1108 WeakPolarHBondContact OD2-CG2 3.45Å; D1106-T1108 PolarHBondContact OD2-OG1 2.65Å
1107	G	62.2	Low	75.7	Confident	9 Å²	9	31.2 Å²	31.2	9%	0.093	18%	0.184	C	C	.	.			trans	78.8	21.3	179	0	0	0	0	0	114.7	R1105 K1202	R1105-G1107 PolarHBondContact O-N 2.95Å; G1107-K1202 WeakPolarHBondContact O-CE 3.49Å; G1107-K1202 PolarHBondContact O-NZ 3.22Å
1108	T	62.6	Low	76	Confident	68 Å²	68	31.9 Å²	31.9	42%	0.417	18%	0.184	S	C	.	.			trans	-88	157	170.1	61.9	0	0	0	0	111.8	S1053 D1106	S1053-T1108 WeakPolarHBondContact CA-O 3.25Å; S1053-T1108 VanDerWaalsContact CB-O 3.28Å; S1053-T1108 WeakPolarHBondContact CB-O 3.46Å; S1053-T1108 PolarHBondContact N-O 3.08Å; S1053-T1108 PolarHBondContact OG-O 2.79Å; D1106-T1108 PolarHBondContact OD1-N 2.88Å; D1106-T1108 PolarHBondContact OD1-OG1 2.79Å; D1106-T1108 WeakPolarHBondContact OD2-CB 3.45Å; D1106-T1108 WeakPolarHBondContact OD2-CG2 3.45Å; D1106-T1108 PolarHBondContact OD2-OG1 2.65Å
1109	G	56.8	Low	76.1	Confident	51 Å²	51	31.7 Å²	31.7	53%	0.526	18%	0.183	S	C	.	.	S	Bend	trans	90.9	169.8	178.2	0	0	0	0	0	116	S1111	G1109-S1111 PolarHBondContact O-N 3.27Å
1110	L	52.3	Low	76.2	Confident	175 Å²	175	32.3 Å²	32.3	92%	0.916	19%	0.186	S	C	*	.	S	Bend	trans	-83.5	6.3	-163	-79.7	162.2	0	0	0	116.7
1111	S	58.3	Low	76.2	Confident	24 Å²	24	32.2 Å²	32.2	17%	0.168	19%	0.186	C	C	.	.			trans	-122.1	119.4	176.5	61.2	0	0	0	0	112.3	Q1050 T1051 R1105 G1109	Q1050-S1111 WeakPolarHBondContact O-CB 3.22Å; Q1050-S1111 PolarHBondContact O-OG 3.26Å; T1051-S1111 WeakPolarHBondContact CA-OG 3.17Å; R1105-S1111 PolarHBondContact NH1-O 3.33Å; G1109-S1111 PolarHBondContact O-N 3.27Å
1112	D	56.9	Low	76	Confident	57 Å²	57	34.1 Å²	34.1	31%	0.305	19%	0.193	S	C	.	.			trans	-89	-4.6	-166.3	-114.4	-11.8	0	0	0	114.5	R1105 S1201 K1202 Q1203	R1105-D1112 PolarHBondContact NH2-O 3Å; D1112-S1201 VanDerWaalsContact O-CA 3.31Å; D1112-S1201 WeakPolarHBondContact O-CA 3.28Å; D1112-S1201 VanDerWaalsContact O-CB 3.3Å; D1112-S1201 WeakPolarHBondContact O-CB 2.97Å; D1112-S1201 PolarHBondContact O-OG 2.91Å; D1112-K1202 WeakPolarHBondContact OD1-CD 3.36Å; D1112-K1202 IonicContact OD1-NZ 3.37Å; D1112-Q1203 HydrophobicContact CB-CG 4.2Å; D1112-Q1203 PolarHBondContact OD2-NE2 3.29Å
1113	G	67.3	Low	75.5	Confident	12 Å²	12	33.8 Å²	33.8	12%	0.124	19%	0.191	C	C	.	.			trans	-122.1	146.4	174	0	0	0	0	0	112.6
1114	W	79.2	Confident	74.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.195	C	C	.	.			trans	-141.3	131.4	167.1	-176.2	41.1	0	0	0	107.1	I1041 T1043 T1051 V1055 F1080 V1103 R1105 L1116 W1199 L1200	I1041-W1114 HydrophobicContact CG2-CH2 4.43Å; I1041-W1114 HydrophobicContact CG2-CZ2 3.84Å; T1043-W1114 PolarHBondContact OG1-NE1 3.02Å; T1051-W1114 HydrophobicContact CG2-CB 4.09Å; T1051-W1114 VanDerWaalsContact CG2-CD1 3.46Å; T1051-W1114 HydrophobicContact CG2-CD2 3.69Å; T1051-W1114 HydrophobicContact CG2-CE3 4.38Å; T1051-W1114 HydrophobicContact CG2-CG 3.49Å; T1051-W1114 VanDerWaalsContact CG2-CG 3.49Å; V1055-W1114 HydrophobicContact CB-CH2 4.42Å; V1055-W1114 HydrophobicContact CG1-CH2 3.73Å; V1055-W1114 HydrophobicContact CG1-CZ3 3.98Å; V1055-W1114 HydrophobicContact CG2-CE3 4.23Å; V1055-W1114 HydrophobicContact CG2-CH2 3.74Å; V1055-W1114 HydrophobicContact CG2-CZ2 4.27Å; V1055-W1114 HydrophobicContact CG2-CZ3 3.7Å; F1080-W1114 HydrophobicContact CD1-CZ2 4.02Å; F1080-W1114 HydrophobicContact CE1-CZ2 4.19Å; F1080-W1114 HydrophobicContact CG-CZ2 4.47Å; V1103-W1114 HydrophobicContact CG1-CH2 4.04Å; V1103-W1114 HydrophobicContact CG1-CZ3 4.01Å; R1105-W1114 HydrophobicContact CB-CE3 4.34Å; W1114-L1116 HydrophobicContact CH2-CD1 4.11Å; W1114-L1116 HydrophobicContact CH2-CD2 4.32Å; W1114-L1116 HydrophobicContact CZ2-CD1 4.01Å; W1114-W1199 CarbonylContact O-C 3.54Å; W1114-W1199 WeakPolarHBondContact O-CA 3.46Å; W1114-L1200 HydrophobicContact CB-CB 4.44Å; W1114-L1200 HydrophobicContact CD2-CD1 4.36Å; W1114-L1200 HydrophobicContact CE3-CB 4.1Å; W1114-L1200 HydrophobicContact CE3-CD1 3.36Å; W1114-L1200 HydrophobicContact CE3-CG 4.35Å; W1114-L1200 HydrophobicContact CZ3-CD1 3.45Å; W1114-L1200 VanDerWaalsContact CZ3-CD1 3.45Å; W1114-L1200 PolarHBondContact O-N 3.15Å
1115	F	84.2	Confident	73.8	Confident	10 Å²	10	31.9 Å²	31.9	4%	0.044	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	109.8	175.9	-170.9	-91.8	0	0	0	109.9	G1044 S1049 E1117 N1197 A1198 W1199	G1044-F1115 PolarHBondContact N-O 3.13Å; S1049-F1115 PolarHBondContact O-N 3.46Å; S1049-F1115 VanDerWaalsContact OG-CB 3.26Å; S1049-F1115 WeakPolarHBondContact OG-CB 3.44Å; F1115-E1117 HydrophobicContact CE1-CB 4.43Å; F1115-N1197 WeakPolarHBondContact CE2-O 3.45Å; F1115-N1197 HydrophobicContact CZ-CB 4.27Å; F1115-N1197 WeakPolarHBondContact CZ-O 3.19Å; F1115-A1198 WeakPolarHBondContact CA-O 3.46Å; F1115-W1199 HydrophobicContact CB-CD2 4.14Å; F1115-W1199 HydrophobicContact CB-CE3 3.99Å; F1115-W1199 HydrophobicContact CB-CH2 4.23Å; F1115-W1199 HydrophobicContact CB-CZ2 4.35Å; F1115-W1199 HydrophobicContact CB-CZ3 4.05Å; F1115-W1199 AromaticContact CD2-CD1 3.75Å; F1115-W1199 AromaticContact CD2-CD2 3.8Å; F1115-W1199 HydrophobicContact CD2-CD2 3.8Å; F1115-W1199 AromaticContact CD2-CE2 3.73Å; F1115-W1199 AromaticContact CD2-CG 3.83Å; F1115-W1199 HydrophobicContact CD2-CG 3.83Å; F1115-W1199 HydrophobicContact CD2-CZ2 4.36Å; F1115-W1199 AromaticContact CD2-NE1 3.68Å; F1115-W1199 HydrophobicContact CG-CD2 4.47Å
1116	L	85.2	Confident	73	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	110.3	177.1	-177.7	60.3	0	0	0	108.6	I1041 V1103 W1114 V1119 F1196 N1197 A1198 L1200	I1041-L1116 HydrophobicContact CG2-CD1 3.78Å; V1103-L1116 HydrophobicContact CB-CD2 4.06Å; V1103-L1116 HydrophobicContact CG1-CD2 3.95Å; V1103-L1116 HydrophobicContact CG2-CD2 4.08Å; W1114-L1116 HydrophobicContact CH2-CD1 4.11Å; W1114-L1116 HydrophobicContact CH2-CD2 4.32Å; W1114-L1116 HydrophobicContact CZ2-CD1 4.01Å; L1116-V1119 HydrophobicContact CD1-CG2 3.9Å; L1116-V1119 HydrophobicContact CD2-CG2 4.34Å; L1116-V1119 HydrophobicContact CG-CG2 4.49Å; L1116-F1196 HydrophobicContact CB-CB 4.45Å; L1116-F1196 HydrophobicContact CD2-CB 4.18Å; L1116-F1196 HydrophobicContact CD2-CD1 4.4Å; L1116-F1196 HydrophobicContact CD2-CD2 3.52Å; L1116-F1196 HydrophobicContact CD2-CE2 3.9Å; L1116-F1196 HydrophobicContact CD2-CG 3.79Å; L1116-F1196 HydrophobicContact CD2-CZ 4.47Å; L1116-F1196 HydrophobicContact CG-CB 4.07Å; L1116-F1196 HydrophobicContact CG-CD2 3.85Å; L1116-F1196 HydrophobicContact CG-CG 4.14Å; L1116-N1197 WeakPolarHBondContact O-CA 3.37Å; L1116-N1197 PolarHBondContact O-N 3.45Å; L1116-A1198 PolarHBondContact N-O 3.25Å; L1116-A1198 PolarHBondContact O-N 2.95Å; L1116-A1198 VanDerWaalsContact O-N 3.08Å; L1116-L1200 HydrophobicContact CB-CD1 4.14Å; L1116-L1200 HydrophobicContact CD2-CD1 4.25Å
1117	E	85.4	Confident	72.4	Confident	56 Å²	56	33.3 Å²	33.3	26%	0.262	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	-64.1	176.9	-171	-153.3	156.7	0	0	109.4	F1042 F1115 F1196 N1197	F1042-E1117 PolarHBondContact O-N 2.81Å; F1042-E1117 VanDerWaalsContact O-N 3.15Å; F1115-E1117 HydrophobicContact CE1-CB 4.43Å; E1117-F1196 PolarHBondContact O-N 2.71Å; E1117-N1197 PolarHBondContact O-N 2.74Å; E1117-N1197 PolarHBondContact O-OD1 3.46Å
1118	K	88.5	Confident	71.8	Confident	43 Å²	43	35.2 Å²	35.2	19%	0.187	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	162.2	-173.7	62.8	-164.6	175.6	-141.8	0	111.7	F1042 W1193 F1194 F1195	F1042-K1118 HydrophobicContact CB-CG 3.73Å; F1042-K1118 WeakPolarHBondContact CB-O 3.37Å; F1042-K1118 HydrophobicContact CD2-CD 4.49Å; F1042-K1118 HydrophobicContact CD2-CG 3.71Å; F1042-K1118 HydrophobicContact CE2-CG 4.48Å; F1042-K1118 HydrophobicContact CG-CD 4.43Å; F1042-K1118 HydrophobicContact CG-CG 3.78Å; F1042-K1118 PolarHBondContact N-O 2.76Å; K1118-W1193 HydrophobicContact CD-CE3 4.26Å; K1118-W1193 HydrophobicContact CD-CZ3 3.82Å; K1118-W1193 HydrophobicContact CG-CE3 4.48Å; K1118-W1193 HydrophobicContact CG-CZ3 4.17Å; K1118-F1194 CarbonylContact C-O 3.45Å; K1118-F1194 WeakPolarHBondContact CA-O 3.49Å; K1118-F1195 HydrophobicContact CB-CD1 3.79Å; K1118-F1195 HydrophobicContact CB-CE1 4.05Å; K1118-F1195 HydrophobicContact CB-CG 4.35Å; K1118-F1195 HydrophobicContact CD-CD1 4.24Å; K1118-F1195 HydrophobicContact CD-CE1 3.7Å; K1118-F1195 HydrophobicContact CD-CZ 4.41Å; K1118-F1195 HydrophobicContact CG-CE1 4.49Å
1119	V	89.6	Confident	71	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.2	173.7	-176.9	0	0	0	0	108.8	I1039 I1040 I1041 L1101 L1116 I1121 F1194 F1196	I1039-V1119 HydrophobicContact CG2-CG1 3.71Å; I1040-V1119 WeakPolarHBondContact O-CA 3.4Å; I1041-V1119 HydrophobicContact CG1-CG1 4.27Å; I1041-V1119 HydrophobicContact CG1-CG2 4.19Å; L1101-V1119 HydrophobicContact CD2-CB 3.96Å; L1101-V1119 HydrophobicContact CD2-CG1 4.05Å; L1101-V1119 HydrophobicContact CD2-CG2 4.26Å; L1116-V1119 HydrophobicContact CD1-CG2 3.9Å; L1116-V1119 HydrophobicContact CD2-CG2 4.34Å; L1116-V1119 HydrophobicContact CG-CG2 4.49Å; V1119-I1121 HydrophobicContact CG1-CD1 4.47Å; V1119-I1121 HydrophobicContact CG1-CG1 3.96Å; V1119-F1194 HydrophobicContact CB-CB 4.38Å; V1119-F1194 PolarHBondContact N-O 2.92Å; V1119-F1194 PolarHBondContact O-N 3.26Å; V1119-F1196 HydrophobicContact CB-CE2 4.36Å; V1119-F1196 HydrophobicContact CG2-CD2 4.2Å; V1119-F1196 HydrophobicContact CG2-CE2 3.82Å
1120	L	88.6	Confident	70.4	Confident	18 Å²	18	42.1 Å²	42.1	9%	0.094	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.4	167.5	165.3	59.5	0	0	0	108.4	I1040 F1042 R1122 N1191 W1193	I1040-L1120 HydrophobicContact CB-CB 4.29Å; I1040-L1120 HydrophobicContact CD1-CD2 4.06Å; I1040-L1120 HydrophobicContact CD1-CG 4.41Å; I1040-L1120 PolarHBondContact N-O 2.99Å; I1040-L1120 PolarHBondContact O-N 2.83Å; F1042-L1120 HydrophobicContact CE2-CB 4.1Å; L1120-R1122 HydrophobicContact CD1-CG 4.17Å; L1120-R1122 HydrophobicContact CD2-CG 4.21Å; L1120-R1122 HydrophobicContact CG-CG 4.02Å; L1120-N1191 HydrophobicContact CD1-CB 3.91Å; L1120-W1193 HydrophobicContact CB-CD2 4.11Å; L1120-W1193 HydrophobicContact CB-CE3 3.9Å; L1120-W1193 HydrophobicContact CB-CH2 4.15Å; L1120-W1193 HydrophobicContact CB-CZ2 4.35Å; L1120-W1193 HydrophobicContact CB-CZ3 3.9Å; L1120-W1193 HydrophobicContact CD1-CD2 4.17Å; L1120-W1193 HydrophobicContact CD1-CG 4.35Å; L1120-W1193 HydrophobicContact CD1-CZ2 4.43Å; L1120-W1193 HydrophobicContact CD2-CH2 4.12Å; L1120-W1193 HydrophobicContact CD2-CZ2 3.84Å; L1120-W1193 HydrophobicContact CG-CZ2 4.44Å
1121	I	88.6	Confident	69.7	Low	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	112	171.9	-53.6	-171.9	0	0	0	109.1	Y1037 E1038 I1039 L1059 L1098 L1101 V1119 Y1192 F1194	Y1037-I1121 HydrophobicContact CD1-CG2 4.06Å; E1038-I1121 CarbonylContact O-C 3.57Å; E1038-I1121 WeakPolarHBondContact O-CA 3.27Å; I1039-I1121 HydrophobicContact CD1-CD1 4.31Å; I1039-I1121 HydrophobicContact CG1-CD1 4.23Å; I1039-I1121 HydrophobicContact CG1-CG1 4.15Å; I1039-I1121 HydrophobicContact CG1-CG2 4.19Å; I1039-I1121 HydrophobicContact CG2-CG1 4.35Å; L1059-I1121 HydrophobicContact CD2-CD1 3.53Å; L1098-I1121 HydrophobicContact CD1-CB 3.94Å; L1098-I1121 HydrophobicContact CD1-CD1 4.38Å; L1098-I1121 HydrophobicContact CD1-CG2 3.62Å; L1101-I1121 HydrophobicContact CD1-CD1 4.06Å; L1101-I1121 HydrophobicContact CD2-CD1 4.13Å; V1119-I1121 HydrophobicContact CG1-CD1 4.47Å; V1119-I1121 HydrophobicContact CG1-CG1 3.96Å; I1121-Y1192 PolarHBondContact N-O 2.72Å; I1121-Y1192 PolarHBondContact O-N 3.32Å; I1121-F1194 HydrophobicContact CB-CE2 4.28Å; I1121-F1194 HydrophobicContact CD1-CD2 4.24Å; I1121-F1194 HydrophobicContact CD1-CE2 3.88Å; I1121-F1194 HydrophobicContact CG1-CD2 4.18Å; I1121-F1194 HydrophobicContact CG1-CE2 4Å
1122	R	83.4	Confident	68.6	Low	40 Å²	40	42.2 Å²	42.2	15%	0.151	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127	173.7	-47.4	-174.5	64.3	-154.9	6.8	109.3	L903 E1038 L1120 D1185 E1187 N1191	L903-R1122 HydrophobicContact CD1-CB 4.17Å; E1038-R1122 HydrophobicContact CB-CB 4.29Å; E1038-R1122 PolarHBondContact N-O 2.81Å; E1038-R1122 PolarHBondContact O-N 2.72Å; E1038-R1122 IonicContact OE2-NH1 2.95Å; E1038-R1122 PolarHBondContact OE2-NH1 3.02Å; L1120-R1122 HydrophobicContact CD1-CG 4.17Å; L1120-R1122 HydrophobicContact CD2-CG 4.21Å; L1120-R1122 HydrophobicContact CG-CG 4.02Å; R1122-D1185 IonicContact CZ-OD2 2.74Å; R1122-D1185 IonicContact NE-OD2 2.89Å; R1122-D1185 IonicContact NH2-OD2 3.61Å; R1122-D1185 PolarHBondContact NH2-OD2 2.96Å; R1122-E1187 IonicContact NH2-OE2 3.5Å; R1122-E1187 PolarHBondContact NH2-OE2 2.97Å; R1122-N1191 WeakPolarHBondContact CB-OD1 3.25Å; R1122-N1191 WeakPolarHBondContact CG-OD1 3.24Å; R1122-N1191 PolarHBondContact NE-OD1 2.88Å; R1122-N1191 VanDerWaalsContact NE-OD1 3.13Å
1123	K	79.6	Confident	67.3	Low	6 Å²	6	48.7 Å²	48.7	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.6	-178.6	-176.6	-161.8	175.8	-164.2	0	110	I1035 Y1037 D1094 G1096 S1125 A1189 E1190 Y1192	I1035-K1123 HydrophobicContact CD1-CD 4.32Å; I1035-K1123 VanDerWaalsContact CD1-CE 3.41Å; I1035-K1123 HydrophobicContact CD1-CG 3.94Å; Y1037-K1123 HydrophobicContact CD1-CB 4.21Å; Y1037-K1123 HydrophobicContact CD1-CG 4.1Å; Y1037-K1123 HydrophobicContact CE1-CB 4.27Å; Y1037-K1123 HydrophobicContact CE1-CD 3.99Å; Y1037-K1123 HydrophobicContact CE1-CG 3.77Å; D1094-K1123 VanDerWaalsContact OD1-CE 3.27Å; D1094-K1123 WeakPolarHBondContact OD1-CE 3.17Å; D1094-K1123 IonicContact OD1-NZ 2.75Å; D1094-K1123 PolarHBondContact OD1-NZ 3.03Å; G1096-K1123 PolarHBondContact O-NZ 3.27Å; K1123-S1125 PolarHBondContact O-N 2.82Å; K1123-A1189 CarbonylContact O-C 3.52Å; K1123-A1189 WeakPolarHBondContact O-CA 3.32Å; K1123-E1190 HydrophobicContact CB-CB 4.45Å; K1123-E1190 PolarHBondContact N-O 2.59Å; K1123-E1190 PolarHBondContact O-N 2.8Å; K1123-Y1192 HydrophobicContact CB-CE2 4.39Å; K1123-Y1192 HydrophobicContact CD-CE2 4.49Å
1124	P	70.7	Confident	65.3	Low	11 Å²	11	52.1 Å²	52.1	7%	0.071	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	121.6	179	26.7	-34.6	0	0	0	113	I1035 P1036 N1126 F1127	I1035-P1124 HydrophobicContact CD1-CG 4.47Å; P1036-P1124 HydrophobicContact CG-CG 4.34Å; P1036-P1124 WeakPolarHBondContact O-CD 3.22Å; P1124-N1126 PolarHBondContact O-N 2.79Å; P1124-F1127 HydrophobicContact CB-CB 4.21Å; P1124-F1127 HydrophobicContact CB-CD2 3.56Å; P1124-F1127 HydrophobicContact CB-CE2 4.08Å; P1124-F1127 HydrophobicContact CB-CG 4.09Å; P1124-F1127 HydrophobicContact CG-CB 4.07Å; P1124-F1127 HydrophobicContact CG-CD1 4.4Å; P1124-F1127 HydrophobicContact CG-CD2 3.75Å; P1124-F1127 HydrophobicContact CG-CE2 4.16Å; P1124-F1127 HydrophobicContact CG-CG 3.87Å
1125	S	64.4	Low	62.8	Low	9 Å²	9	58 Å²	58	6%	0.063	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	126.3	-176.2	-49.8	0	0	0	0	112.9	K1123 F1127 G1188 E1190	K1123-S1125 PolarHBondContact O-N 2.82Å; S1125-F1127 PolarHBondContact O-N 3.38Å; S1125-G1188 WeakPolarHBondContact CB-O 3.31Å; S1125-G1188 PolarHBondContact N-O 2.77Å; S1125-G1188 PolarHBondContact OG-O 2.64Å; S1125-E1190 WeakPolarHBondContact CA-OE1 3.34Å; S1125-E1190 WeakPolarHBondContact OG-CG 3.26Å
1126	N	60	Low	59.9	Low	89 Å²	89	63 Å²	63	48%	0.476	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	37.2	173.9	-75.5	-24.8	0	0	0	114.1	P1124 F1128 Q1129 K1130	P1124-N1126 PolarHBondContact O-N 2.79Å; N1126-F1128 PolarHBondContact O-N 2.73Å; N1126-Q1129 HydrophobicContact CB-CB 4.25Å; N1126-Q1129 PolarHBondContact O-N 3.07Å; N1126-K1130 HydrophobicContact CB-CG 4.48Å; N1126-K1130 PolarHBondContact O-N 2.82Å
1127	F	56	Low	57	Low	20 Å²	20	69.5 Å²	69.5	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-49	-51.1	-169.5	-162.7	-126.5	0	0	0	114.1	F997 I1035 P1036 P1124 S1125 M1131	F997-F1127 HydrophobicContact CD2-CD1 4.09Å; F997-F1127 AromaticContact CD2-CE1 3.51Å; F997-F1127 HydrophobicContact CD2-CE1 3.51Å; F997-F1127 HydrophobicContact CD2-CZ 4.23Å; F997-F1127 HydrophobicContact CE2-CD1 4.05Å; F997-F1127 AromaticContact CE2-CE1 3.83Å; F997-F1127 HydrophobicContact CE2-CE1 3.83Å; F997-F1127 HydrophobicContact CE2-CZ 4.47Å; I1035-F1127 HydrophobicContact CB-CD1 3.97Å; I1035-F1127 HydrophobicContact CB-CE1 4.22Å; I1035-F1127 HydrophobicContact CG2-CD1 3.55Å; I1035-F1127 HydrophobicContact CG2-CE1 4.12Å; I1035-F1127 HydrophobicContact CG2-CG 4.48Å; P1036-F1127 HydrophobicContact CG-CZ 4.19Å; P1124-F1127 HydrophobicContact CB-CB 4.21Å; P1124-F1127 HydrophobicContact CB-CD2 3.56Å; P1124-F1127 HydrophobicContact CB-CE2 4.08Å; P1124-F1127 HydrophobicContact CB-CG 4.09Å; P1124-F1127 HydrophobicContact CG-CB 4.07Å; P1124-F1127 HydrophobicContact CG-CD1 4.4Å; P1124-F1127 HydrophobicContact CG-CD2 3.75Å; P1124-F1127 HydrophobicContact CG-CE2 4.16Å; P1124-F1127 HydrophobicContact CG-CG 3.87Å; S1125-F1127 PolarHBondContact O-N 3.38Å; F1127-M1131 HydrophobicContact CD2-CE 3.95Å; F1127-M1131 HydrophobicContact CE1-CE 4.29Å; F1127-M1131 HydrophobicContact CE2-CE 3.64Å; F1127-M1131 HydrophobicContact CG-CE 4.41Å; F1127-M1131 HydrophobicContact CZ-CE 3.84Å
1128	F	51	Low	54.1	Low	49 Å²	49	71.4 Å²	71.4	22%	0.215	38%	0.378	C	S	.	.	H	α-helix	trans	-75.9	-25.6	177.7	-64.8	-61.7	0	0	0	114.2	F997 R1033 I1035 D1094 N1126	F997-F1128 HydrophobicContact CD2-CD1 4.43Å; F997-F1128 AromaticContact CD2-CE1 3.78Å; F997-F1128 HydrophobicContact CD2-CE1 3.78Å; F997-F1128 AromaticContact CE2-CD1 3.82Å; F997-F1128 HydrophobicContact CE2-CD1 3.82Å; F997-F1128 AromaticContact CE2-CE1 3.63Å; F997-F1128 HydrophobicContact CE2-CE1 3.63Å; R1033-F1128 HydrophobicContact CB-CE1 4.48Å; R1033-F1128 HydrophobicContact CB-CZ 3.98Å; I1035-F1128 HydrophobicContact CG2-CD2 4.18Å; I1035-F1128 HydrophobicContact CG2-CE2 3.32Å; I1035-F1128 HydrophobicContact CG2-CZ 3.52Å; D1094-F1128 HydrophobicContact CB-CD2 4.27Å; D1094-F1128 HydrophobicContact CB-CE2 3.96Å; N1126-F1128 PolarHBondContact O-N 2.73Å
1129	Q	45.9	Very low	51.1	Low	141 Å²	141	75 Å²	75	66%	0.659	41%	0.406	S	S	*	.	H	α-helix	trans	-78.2	-38.6	178.3	-76.8	-170.5	-5.2	0	0	112.8	N1126 M1131	N1126-Q1129 HydrophobicContact CB-CB 4.25Å; N1126-Q1129 PolarHBondContact O-N 3.07Å; Q1129-M1131 VanDerWaalsContact C-N 3.32Å; Q1129-M1131 PolarHBondContact O-N 3.43Å
1130	K	43.7	Very low	47.9	Very low	123 Å²	123	81.7 Å²	81.7	54%	0.535	45%	0.446	S	S	.	.	H	α-helix	trans	-62.3	-39.2	176.6	-76.1	-179.8	178.9	171.5	0	111.5	N1126	N1126-K1130 HydrophobicContact CB-CG 4.48Å; N1126-K1130 PolarHBondContact O-N 2.82Å
1131	M	38	Very low	44.9	Very low	61 Å²	61	91.9 Å²	91.9	30%	0.3	48%	0.484	S	S	.	.	H	α-helix	trans	-81.8	-14.1	-173.6	-65.3	-152	-138.1	0	0	116.1	K966 F997 F1127 Q1129 R1133	K966-M1131 HydrophobicContact CD-SD 3.74Å; K966-M1131 WeakPolarHBondContact CE-SD 3.43Å; K966-M1131 PolarHBondContact NZ-SD 2.53Å; F997-M1131 HydrophobicContact CD2-CE 4.41Å; F997-M1131 HydrophobicContact CE1-SD 4.14Å; F997-M1131 HydrophobicContact CE2-CE 3.6Å; F997-M1131 HydrophobicContact CE2-SD 3.97Å; F997-M1131 HydrophobicContact CZ-CE 3.71Å; F997-M1131 HydrophobicContact CZ-CG 4.49Å; F997-M1131 HydrophobicContact CZ-SD 3.42Å; F997-M1131 WeakPolarHBondContact CZ-SD 3.48Å; F1127-M1131 HydrophobicContact CD2-CE 3.95Å; F1127-M1131 HydrophobicContact CE1-CE 4.29Å; F1127-M1131 HydrophobicContact CE2-CE 3.64Å; F1127-M1131 HydrophobicContact CG-CE 4.41Å; F1127-M1131 HydrophobicContact CZ-CE 3.84Å; Q1129-M1131 VanDerWaalsContact C-N 3.32Å; Q1129-M1131 PolarHBondContact O-N 3.43Å; M1131-R1133 VanDerWaalsContact C-N 3.26Å; M1131-R1133 PolarHBondContact O-N 3.49Å
1132	N	35.2	Very low	42	Very low	141 Å²	141	96.2 Å²	96.2	75%	0.754	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	1.5	175.2	-79.5	-9	0	0	0	113.4
1133	R	29.4	Very low	39.1	Very low	193 Å²	193	101.8 Å²	101.8	73%	0.728	55%	0.545	S	S	*	.	S	Bend	trans	-85.5	111.4	168.4	-67.9	-176.7	176.5	178.4	-0.5	108.9	M1131	M1131-R1133 VanDerWaalsContact C-N 3.26Å; M1131-R1133 PolarHBondContact O-N 3.49Å
1134	S	25.6	Very low	36.7	Very low	84 Å²	84	106.6 Å²	106.6	59%	0.587	58%	0.576	S	S	*	*			trans	-59.4	149.9	165.8	49.9	0	0	0	0	110.2	T1136	S1134-T1136 PolarHBondContact O-N 2.9Å
1135	P	26.5	Very low	34.5	Very low	123 Å²	123	116.4 Å²	116.4	80%	0.799	61%	0.611	S	S	*	*			trans	-72.4	75.6	179	29.9	-35.1	0	0	0	110.8	V1137	P1135-V1137 PolarHBondContact O-N 2.58Å
1136	T	23.8	Very low	32.7	Very low	115 Å²	115	123.9 Å²	123.9	71%	0.706	65%	0.645	S	S	*	*			trans	-73.9	114	171.5	47.2	0	0	0	0	109.3	S1134 S1138	S1134-T1136 PolarHBondContact O-N 2.9Å; T1136-S1138 PolarHBondContact O-N 3.41Å
1137	V	24	Very low	31	Very low	136 Å²	136	127 Å²	127	82%	0.824	66%	0.66	S	S	*	*			trans	-48.6	109.9	-175	-177.8	0	0	0	0	112	P1135 P1139	P1135-V1137 PolarHBondContact O-N 2.58Å; V1137-P1139 WeakPolarHBondContact O-CD 3.38Å
1138	S	24.1	Very low	29.7	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	69%	0.693	S	S	*	*			trans	-77.1	117.1	170.2	51.5	0	0	0	0	109.8	T1136 V1140	T1136-S1138 PolarHBondContact O-N 3.41Å; S1138-V1140 PolarHBondContact O-N 3.41Å
1139	P	24.3	Very low	28.5	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	72%	0.721	S	S	*	*			trans	-72.5	113.6	-178.8	28.6	-33.6	0	0	0	110.7	V1137 R1141	V1137-P1139 WeakPolarHBondContact O-CD 3.38Å; P1139-R1141 PolarHBondContact O-N 2.83Å
1140	V	23.3	Very low	27.6	Very low	140 Å²	140	136.1 Å²	136.1	85%	0.848	72%	0.717	S	S	*	*			trans	-67.9	114.3	173.1	177.7	0	0	0	0	109.4	S1138	S1138-V1140 PolarHBondContact O-N 3.41Å
1141	R	26.5	Very low	26.9	Very low	232 Å²	232	136.8 Å²	136.8	88%	0.875	72%	0.721	S	S	*	*			trans	-118.6	98.2	161.3	-89.9	-168.7	171.3	-171.8	-2.4	110.6	P1139	P1139-R1141 PolarHBondContact O-N 2.83Å
1142	S	26.9	Very low	26.3	Very low	92 Å²	92	140.5 Å²	140.5	64%	0.643	74%	0.739	S	S	*	*			trans	34.3	105.1	139.8	57.8	0	0	0	0	118.3
1143	I	23.2	Very low	25.8	Very low	156 Å²	156	139.8 Å²	139.8	80%	0.8	73%	0.734	S	S	*	*			trans	-86	118.4	155.6	-63.8	170	0	0	0	108.3
1144	T	28.4	Very low	25.6	Very low	108 Å²	108	135.3 Å²	135.3	66%	0.663	73%	0.733	S	S	*	*			trans	-144.8	91.6	172.6	-45.5	0	0	0	0	113.1
1145	R	23.6	Very low	25.6	Very low	217 Å²	217	139.5 Å²	139.5	82%	0.819	74%	0.743	S	S	*	*			trans	58.5	162.9	150	-57.6	176.9	176.1	169.4	-1.6	117.8
1146	Q	26.8	Very low	25.4	Very low	165 Å²	165	141.1 Å²	141.1	77%	0.771	74%	0.737	S	S	*	*			cis	-121.1	160.2	-16.1	-98	118.4	-56.8	0	0	106.9
1147	I	25.7	Very low	25.5	Very low	156 Å²	156	141.5 Å²	141.5	80%	0.8	74%	0.735	S	S	*	*			cis	71	84.6	42	-50.2	-177.9	0	0	0	115.6
1148	S	28.2	Very low	25.6	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	73%	0.725	S	S	*	*			trans	-176.1	117.2	145.8	50.9	0	0	0	0	105.9
1149	K	26.6	Very low	25.6	Very low	184 Å²	184	140.4 Å²	140.4	80%	0.8	72%	0.724	S	S	*	*				56.5	137.8	53.5	-83.9	-171.1	161.8	-102.2	0	114.5
1150	D	26.4	Very low	25.7	Very low	106 Å²	106	142 Å²	142	57%	0.567	72%	0.721	S	S	*	*			cis	-114.1	-123	1.5	-145.6	-112.4	0	0	0	111
1151	H	29	Very low	25.7	Very low	136 Å²	136	141.7 Å²	141.7	63%	0.63	71%	0.714	S	S	*	*			cis	-159.9	132.5	-10.3	-144.3	31.7	0	0	0	110.7
1152	M	24.5	Very low	25.6	Very low	139 Å²	139	136.7 Å²	136.7	69%	0.685	71%	0.705	S	S	*	*			trans	61.4	151.1	145	-67.2	-169.5	168.7	0	0	121.4
1153	I	26	Very low	25.5	Very low	127 Å²	127	137.6 Å²	137.6	65%	0.651	71%	0.706	S	S	*	*			cis	-159.4	147.4	-2.7	-121.2	167.8	0	0	0	111.1
1154	S	23.6	Very low	25.5	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	71%	0.707	S	S	*	*			trans	44.6	174.1	155	82.3	0	0	0	0	121.7
1155	Q	25.8	Very low	25.3	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	71%	0.714	S	S	*	*			cis	-155.1	145.1	-11	-135.3	164.2	-0	0	0	111.4
1156	K	23.5	Very low	25.7	Very low	158 Å²	158	134.3 Å²	134.3	69%	0.687	71%	0.707	S	S	*	*			trans	12.9	150.7	144.7	-85.3	177.3	133.1	-72.5	0	125.8
1157	D	25.7	Very low	25.6	Very low	122 Å²	122	133.5 Å²	133.5	65%	0.652	71%	0.708	S	S	*	*			trans	65.8	155.5	142.2	-54.8	-13.1	0	0	0	120.3
1158	S	25.3	Very low	25.7	Very low	89 Å²	89	135.7 Å²	135.7	62%	0.622	71%	0.712	S	S	*	*			cis	-169.2	165.2	-31.3	62.2	0	0	0	0	111.7
1159	N	25.3	Very low	25.6	Very low	120 Å²	120	137.3 Å²	137.3	64%	0.642	71%	0.712	S	S	*	*			trans	71.8	115.7	158	-66.4	-47	0	0	0	120.7
1160	Q	24.7	Very low	25.6	Very low	155 Å²	155	134.3 Å²	134.3	72%	0.724	70%	0.704	S	S	*	*				88.1	153.5	107.4	-70	178.9	44.2	0	0	114.1
1161	L	24.8	Very low	25.5	Very low	133 Å²	133	133.3 Å²	133.3	70%	0.696	70%	0.699	S	S	*	*			cis	-162	176.8	-13.5	-100.8	170	0	0	0	106.4
1162	N	23.7	Very low	25.4	Very low	127 Å²	127	129.9 Å²	129.9	68%	0.679	70%	0.7	S	S	*	*			cis	-157.9	-175.3	6.8	-144.8	-18.7	0	0	0	112.6
1163	V	24.5	Very low	25.5	Very low	111 Å²	111	125 Å²	125	67%	0.673	68%	0.68	S	S	*	*			trans	14	125	152.1	-179.8	0	0	0	0	119
1164	T	23.2	Very low	25.6	Very low	132 Å²	132	122.7 Å²	122.7	81%	0.81	67%	0.673	S	S	*	*				-161.1	172.6	65.6	-29	0	0	0	0	114
1165	Q	24	Very low	25.9	Very low	176 Å²	176	121.5 Å²	121.5	82%	0.822	67%	0.665	S	S	*	*			trans	-86.8	-172.1	-176.6	-52	174.1	-23	0	0	114.6
1166	P	33.2	Very low	26.3	Very low	104 Å²	104	118.3 Å²	118.3	68%	0.675	65%	0.652	S	S	*	*			cis	-133.5	179.9	-24.7	20.9	4.1	0	0	0	116.1
1167	D	25.1	Very low	27.5	Very low	148 Å²	148	113.6 Å²	113.6	79%	0.791	63%	0.633	S	S	*	*			trans	58.5	119.6	150.4	-72.7	-11.5	0	0	0	124.8
1168	K	27.4	Very low	28.4	Very low	201 Å²	201	112.6 Å²	112.6	87%	0.874	64%	0.636	S	S	*	*				180	98.5	116.8	-97.5	159.7	-173.7	166.3	0	116.1
1169	N	26.4	Very low	29.9	Very low	146 Å²	146	109.2 Å²	109.2	78%	0.781	61%	0.612	S	S	*	*				31.7	112.9	124.5	-103.9	-35.9	0	0	0	121.6
1170	L	24.9	Very low	31.6	Very low	121 Å²	121	105.9 Å²	105.9	63%	0.634	60%	0.597	S	S	*	*				147.1	149.6	115.3	-78.7	155.2	0	0	0	118.6	K52	K52-L1170 HydrophobicContact CD-CD1 4.34Å; K52-L1170 HydrophobicContact CD-CD2 3.59Å
1171	D	24.8	Very low	33.5	Very low	85 Å²	85	106.8 Å²	106.8	46%	0.455	60%	0.601	S	S	.	*			trans	79.3	61.6	152.5	-60.3	-8.4	0	0	0	123.2	K52 T55	K52-D1171 IonicContact NZ-OD1 2.73Å; K52-D1171 PolarHBondContact NZ-OD1 2.89Å; K52-D1171 IonicContact NZ-OD2 2.88Å; K52-D1171 PolarHBondContact NZ-OD2 3.4Å; T55-D1171 WeakPolarHBondContact CB-O 3.27Å; T55-D1171 VanDerWaalsContact CG2-C 3.42Å; T55-D1171 HydrophobicContact CG2-CB 4.07Å; T55-D1171 PolarHBondContact OG1-O 3.16Å
1172	G	27	Very low	35.4	Very low	63 Å²	63	106.9 Å²	106.9	65%	0.649	60%	0.598	S	S	*	*			trans	-99.6	139.2	160.6	0	0	0	0	0	118.2	T55	T55-G1172 WeakPolarHBondContact CG2-O 3.39Å; T55-G1172 VanDerWaalsContact OG1-C 3.27Å
1173	S	26.3	Very low	37.4	Very low	38 Å²	38	101.1 Å²	101.1	27%	0.266	57%	0.567	S	S	.	*			trans	-80.5	168.2	-161.4	-35.1	0	0	0	0	117.6	T55 A56 S1175	T55-S1173 WeakPolarHBondContact O-CA 3.22Å; T55-S1173 WeakPolarHBondContact O-CB 3.31Å; T55-S1173 PolarHBondContact O-OG 3.43Å; T55-S1173 WeakPolarHBondContact OG1-CA 3.27Å; T55-S1173 PolarHBondContact OG1-N 2.85Å; T55-S1173 VanDerWaalsContact OG1-N 3.12Å; T55-S1173 PolarHBondContact OG1-OG 3.3Å; A56-S1173 VanDerWaalsContact C-OG 3.27Å; A56-S1173 WeakPolarHBondContact CA-OG 3.32Å; A56-S1173 PolarHBondContact N-OG 3.04Å; A56-S1173 PolarHBondContact O-OG 3.02Å; S1173-S1175 PolarHBondContact O-N 2.88Å
1174	P	27.9	Very low	39	Very low	77 Å²	77	99.9 Å²	99.9	50%	0.5	55%	0.552	S	S	.	*			trans	-80.4	89.6	171.1	25.7	-11.8	0	0	0	109	F54 T55	F54-P1174 HydrophobicContact CB-CG 3.87Å; F54-P1174 HydrophobicContact CD1-CB 3.92Å; F54-P1174 HydrophobicContact CD1-CG 3.95Å; F54-P1174 HydrophobicContact CE1-CB 4.16Å; F54-P1174 HydrophobicContact CG-CB 4.34Å; F54-P1174 HydrophobicContact CG-CG 4.05Å; T55-P1174 WeakPolarHBondContact O-CD 3.43Å
1175	S	31.2	Very low	40.9	Very low	75 Å²	75	95.4 Å²	95.4	52%	0.524	52%	0.524	S	S	.	.			trans	-73.1	152.3	177.8	49.3	0	0	0	0	111.9	S1173 I1177	S1173-S1175 PolarHBondContact O-N 2.88Å; S1175-I1177 PolarHBondContact O-N 3.09Å
1176	I	34.8	Very low	42	Very low	103 Å²	103	92.6 Å²	92.6	53%	0.528	53%	0.53	S	S	.	.			trans	-67.9	112.9	155.2	-66	165.3	0	0	0	104.5	S1178	I1176-S1178 PolarHBondContact O-N 3.18Å
1177	I	46.7	Very low	42.9	Very low	59 Å²	59	90.8 Å²	90.8	30%	0.303	51%	0.513	S	S	.	.			trans	-67.1	98.9	179.4	-67.2	119.8	0	0	0	108.2	T1062 S1175 V1179	T1062-I1177 HydrophobicContact CG2-CD1 3.61Å; S1175-I1177 PolarHBondContact O-N 3.09Å; I1177-V1179 PolarHBondContact O-N 3.35Å; I1177-V1179 VanDerWaalsContact O-N 3.17Å
1178	S	46	Very low	44.4	Very low	101 Å²	101	84.7 Å²	84.7	71%	0.706	49%	0.485	S	S	*	.			trans	-64.1	110.3	165.6	50.6	0	0	0	0	107.7	I1176 P1180	I1176-S1178 PolarHBondContact O-N 3.18Å; S1178-P1180 WeakPolarHBondContact O-CD 3.27Å; S1178-P1180 VanDerWaalsContact O-N 3.12Å
1179	V	56.4	Low	46.2	Very low	19 Å²	19	75.2 Å²	75.2	12%	0.115	44%	0.444	C	S	.	.			trans	-46	119.9	173	179.1	0	0	0	0	108.3	P1097 I1177 L1183 K1184 E1190	P1097-V1179 HydrophobicContact CB-CG2 4.13Å; P1097-V1179 HydrophobicContact CG-CG2 3.85Å; I1177-V1179 PolarHBondContact O-N 3.35Å; I1177-V1179 VanDerWaalsContact O-N 3.17Å; V1179-L1183 HydrophobicContact CG1-CB 4.02Å; V1179-L1183 HydrophobicContact CG1-CD1 3.98Å; V1179-K1184 PolarHBondContact O-NZ 2.73Å; V1179-E1190 HydrophobicContact CG1-CB 4.44Å; V1179-E1190 HydrophobicContact CG1-CG 4.19Å
1180	P	61.9	Low	48.8	Very low	50 Å²	50	68.5 Å²	68.5	33%	0.325	41%	0.408	S	S	.	.			trans	-49.7	149.8	179.6	-33.1	36.5	0	0	0	113.2	S1178 E1182 L1183 K1184 L1223	S1178-P1180 WeakPolarHBondContact O-CD 3.27Å; S1178-P1180 VanDerWaalsContact O-N 3.12Å; P1180-E1182 PolarHBondContact O-N 2.89Å; P1180-L1183 HydrophobicContact CB-CD1 4.43Å; P1180-L1183 HydrophobicContact CB-CG 4.33Å; P1180-L1183 HydrophobicContact CG-CD1 4.29Å; P1180-L1183 PolarHBondContact O-N 2.96Å; P1180-K1184 PolarHBondContact O-NZ 3.13Å; P1180-L1223 HydrophobicContact CG-CD2 4.35Å
1181	E	62.6	Low	51.6	Low	173 Å²	173	64 Å²	64	81%	0.808	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-67.7	-32.1	179	-152.9	140.4	-126	0	0	110.8	L1183 K1184	E1181-L1183 PolarHBondContact O-N 3.16Å; E1181-L1183 VanDerWaalsContact O-N 3.08Å; E1181-K1184 PolarHBondContact O-N 2.61Å; E1181-K1184 VanDerWaalsContact O-N 3.08Å
1182	E	64.9	Low	54.7	Low	135 Å²	135	60.1 Å²	60.1	63%	0.631	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-54.4	-19.9	169.9	-61.7	174.5	-162.7	0	0	114.9	P1180 K1221	P1180-E1182 PolarHBondContact O-N 2.89Å; E1182-K1221 IonicContact OE2-NZ 3.6Å
1183	L	66.1	Low	57.6	Low	6 Å²	6	58.4 Å²	58.4	3%	0.031	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-97.7	-4.1	179.9	-65	177.4	0	0	0	113.9	V1179 P1180 E1181 N1191 Y1192 T1217 L1223	V1179-L1183 HydrophobicContact CG1-CB 4.02Å; V1179-L1183 HydrophobicContact CG1-CD1 3.98Å; P1180-L1183 HydrophobicContact CB-CD1 4.43Å; P1180-L1183 HydrophobicContact CB-CG 4.33Å; P1180-L1183 HydrophobicContact CG-CD1 4.29Å; P1180-L1183 PolarHBondContact O-N 2.96Å; E1181-L1183 PolarHBondContact O-N 3.16Å; E1181-L1183 VanDerWaalsContact O-N 3.08Å; L1183-N1191 WeakPolarHBondContact CD2-O 3.32Å; L1183-N1191 PolarHBondContact O-N 2.73Å; L1183-Y1192 HydrophobicContact CD1-CD1 4.35Å; L1183-Y1192 HydrophobicContact CD1-CE1 4.04Å; L1183-T1217 HydrophobicContact CD2-CG2 4.04Å; L1183-L1223 HydrophobicContact CD1-CD1 3.49Å; L1183-L1223 VanDerWaalsContact CD1-CD1 3.49Å; L1183-L1223 HydrophobicContact CD1-CD2 3.73Å; L1183-L1223 HydrophobicContact CD1-CG 4.25Å; L1183-L1223 HydrophobicContact CD2-CD1 4.05Å; L1183-L1223 HydrophobicContact CD2-CD2 4.06Å; L1183-L1223 HydrophobicContact CG-CD1 4.36Å; L1183-L1223 HydrophobicContact CG-CD2 4.12Å
1184	K	59.5	Low	60.6	Low	85 Å²	85	56.7 Å²	56.7	37%	0.37	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-101.2	118	-177.5	-60.1	-171.3	-162.4	74.4	0	109.9	V1179 P1180 E1181 A1189	V1179-K1184 PolarHBondContact O-NZ 2.73Å; P1180-K1184 PolarHBondContact O-NZ 3.13Å; E1181-K1184 PolarHBondContact O-N 2.61Å; E1181-K1184 VanDerWaalsContact O-N 3.08Å; K1184-A1189 WeakPolarHBondContact CA-O 3.48Å
1185	D	62.1	Low	63.5	Low	39 Å²	39	55.7 Å²	55.7	21%	0.209	31%	0.313	C	S	.	.			trans	-71	170.4	168.2	56.5	37.3	0	0	0	111.9	R1122 E1187 G1188 A1189 N1191	R1122-D1185 IonicContact CZ-OD2 2.74Å; R1122-D1185 IonicContact NE-OD2 2.89Å; R1122-D1185 IonicContact NH2-OD2 3.61Å; R1122-D1185 PolarHBondContact NH2-OD2 2.96Å; D1185-E1187 PolarHBondContact O-N 2.74Å; D1185-E1187 VanDerWaalsContact O-N 3.1Å; D1185-E1187 WeakPolarHBondContact OD1-CB 3.2Å; D1185-E1187 PolarHBondContact OD1-N 3.11Å; D1185-E1187 VanDerWaalsContact OD1-N 3.15Å; D1185-G1188 PolarHBondContact O-N 3.32Å; D1185-G1188 PolarHBondContact OD1-N 3.03Å; D1185-A1189 PolarHBondContact N-O 3.38Å; D1185-A1189 PolarHBondContact OD1-N 2.67Å; D1185-N1191 WeakPolarHBondContact CB-ND2 3.38Å; D1185-N1191 PolarHBondContact OD2-ND2 3.47Å; D1185-N1191 PolarHBondContact OD2-OD1 2.9Å
1186	A	47.3	Very low	66	Low	116 Å²	116	53.4 Å²	53.4	96%	0.959	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.3	178.5	0	0	0	0	0	113.8
1187	E	51	Low	68.4	Low	66 Å²	66	53 Å²	53	31%	0.308	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-16.8	176.6	-43.7	-166.6	94.2	0	0	112.3	S901 R1122 D1185	S901-E1187 WeakPolarHBondContact CA-OE1 3.39Å; S901-E1187 VanDerWaalsContact CB-CD 3.42Å; S901-E1187 WeakPolarHBondContact CB-OE1 3.22Å; S901-E1187 WeakPolarHBondContact CB-OE2 3.06Å; S901-E1187 PolarHBondContact N-OE1 2.91Å; R1122-E1187 IonicContact NH2-OE2 3.5Å; R1122-E1187 PolarHBondContact NH2-OE2 2.97Å; D1185-E1187 PolarHBondContact O-N 2.74Å; D1185-E1187 VanDerWaalsContact O-N 3.1Å; D1185-E1187 WeakPolarHBondContact OD1-CB 3.2Å; D1185-E1187 PolarHBondContact OD1-N 3.11Å; D1185-E1187 VanDerWaalsContact OD1-N 3.15Å
1188	G	56.4	Low	70	Confident	21 Å²	21	51.8 Å²	51.8	22%	0.216	29%	0.291	C	S	.	.			trans	82.2	33.2	-177.7	0	0	0	0	0	113.9	S1125 D1185	S1125-G1188 WeakPolarHBondContact CB-O 3.31Å; S1125-G1188 PolarHBondContact N-O 2.77Å; S1125-G1188 PolarHBondContact OG-O 2.64Å; D1185-G1188 PolarHBondContact O-N 3.32Å; D1185-G1188 PolarHBondContact OD1-N 3.03Å
1189	A	65.5	Low	71.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.008	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	156.4	158.8	0	0	0	0	0	111.1	L903 K1123 K1184 D1185	L903-A1189 HydrophobicContact CD1-CB 3.9Å; K1123-A1189 CarbonylContact O-C 3.52Å; K1123-A1189 WeakPolarHBondContact O-CA 3.32Å; K1184-A1189 WeakPolarHBondContact CA-O 3.48Å; D1185-A1189 PolarHBondContact N-O 3.38Å; D1185-A1189 PolarHBondContact OD1-N 2.67Å
1190	E	81.8	Confident	72.6	Confident	5 Å²	5	49.7 Å²	49.7	2%	0.023	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	115.2	175	-49.9	176.9	-180	0	0	107.9	K1123 S1125 V1179 Y1192	K1123-E1190 HydrophobicContact CB-CB 4.45Å; K1123-E1190 PolarHBondContact N-O 2.59Å; K1123-E1190 PolarHBondContact O-N 2.8Å; S1125-E1190 WeakPolarHBondContact CA-OE1 3.34Å; S1125-E1190 WeakPolarHBondContact OG-CG 3.26Å; V1179-E1190 HydrophobicContact CG1-CB 4.44Å; V1179-E1190 HydrophobicContact CG1-CG 4.19Å; E1190-Y1192 HydrophobicContact CB-CD2 4.22Å; E1190-Y1192 HydrophobicContact CB-CE2 3.42Å; E1190-Y1192 VanDerWaalsContact CB-CE2 3.42Å; E1190-Y1192 HydrophobicContact CG-CE2 4.47Å; E1190-Y1192 WeakPolarHBondContact OE2-CE2 3.41Å; E1190-Y1192 PolarHBondContact OE2-OH 2.81Å
1191	N	84.3	Confident	73.1	Confident	27 Å²	27	47.4 Å²	47.4	14%	0.144	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	99.5	-172.6	-67.8	-27.5	0	0	0	110.7	L1120 R1122 L1183 D1185	L1120-N1191 HydrophobicContact CD1-CB 3.91Å; R1122-N1191 WeakPolarHBondContact CB-OD1 3.25Å; R1122-N1191 WeakPolarHBondContact CG-OD1 3.24Å; R1122-N1191 PolarHBondContact NE-OD1 2.88Å; R1122-N1191 VanDerWaalsContact NE-OD1 3.13Å; L1183-N1191 WeakPolarHBondContact CD2-O 3.32Å; L1183-N1191 PolarHBondContact O-N 2.73Å; D1185-N1191 WeakPolarHBondContact CB-ND2 3.38Å; D1185-N1191 PolarHBondContact OD2-ND2 3.47Å; D1185-N1191 PolarHBondContact OD2-OD1 2.9Å
1192	Y	88.4	Confident	73.1	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.5	-177.8	-61.3	-89.3	0	0	0	111	P1097 L1098 I1121 K1123 L1183 E1190 L1223	P1097-Y1192 WeakPolarHBondContact CA-OH 3.01Å; P1097-Y1192 WeakPolarHBondContact CB-OH 3.45Å; L1098-Y1192 HydrophobicContact CB-CD1 3.89Å; L1098-Y1192 HydrophobicContact CB-CD2 3.99Å; L1098-Y1192 HydrophobicContact CB-CE1 4.18Å; L1098-Y1192 HydrophobicContact CB-CE2 4.26Å; L1098-Y1192 HydrophobicContact CB-CG 3.81Å; L1098-Y1192 HydrophobicContact CD1-CD2 3.78Å; L1098-Y1192 HydrophobicContact CD1-CE2 4.42Å; L1098-Y1192 HydrophobicContact CD1-CG 4.11Å; L1098-Y1192 HydrophobicContact CG-CD2 3.91Å; L1098-Y1192 HydrophobicContact CG-CE2 4.11Å; L1098-Y1192 HydrophobicContact CG-CG 4.22Å; I1121-Y1192 PolarHBondContact N-O 2.72Å; I1121-Y1192 PolarHBondContact O-N 3.32Å; K1123-Y1192 HydrophobicContact CB-CE2 4.39Å; K1123-Y1192 HydrophobicContact CD-CE2 4.49Å; L1183-Y1192 HydrophobicContact CD1-CD1 4.35Å; L1183-Y1192 HydrophobicContact CD1-CE1 4.04Å; E1190-Y1192 HydrophobicContact CB-CD2 4.22Å; E1190-Y1192 HydrophobicContact CB-CE2 3.42Å; E1190-Y1192 VanDerWaalsContact CB-CE2 3.42Å; E1190-Y1192 HydrophobicContact CG-CE2 4.47Å; E1190-Y1192 WeakPolarHBondContact OE2-CE2 3.41Å; E1190-Y1192 PolarHBondContact OE2-OH 2.81Å; Y1192-L1223 HydrophobicContact CD1-CD1 3.86Å; Y1192-L1223 HydrophobicContact CE1-CD1 4.24Å
1193	W	89.2	Confident	72.9	Confident	28 Å²	28	44.3 Å²	44.3	11%	0.106	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	147	176.6	-71.1	88.5	0	0	0	111.5	F1042 K1118 L1120 F1195 S1215 S1216 E1218	F1042-W1193 HydrophobicContact CD2-CZ3 4.35Å; F1042-W1193 HydrophobicContact CE2-CH2 4.06Å; F1042-W1193 AromaticContact CE2-CZ3 3.69Å; F1042-W1193 HydrophobicContact CE2-CZ3 3.69Å; F1042-W1193 AromaticContact CZ-CH2 3.95Å; F1042-W1193 HydrophobicContact CZ-CH2 3.95Å; F1042-W1193 HydrophobicContact CZ-CZ3 4.01Å; K1118-W1193 HydrophobicContact CD-CE3 4.26Å; K1118-W1193 HydrophobicContact CD-CZ3 3.82Å; K1118-W1193 HydrophobicContact CG-CE3 4.48Å; K1118-W1193 HydrophobicContact CG-CZ3 4.17Å; L1120-W1193 HydrophobicContact CB-CD2 4.11Å; L1120-W1193 HydrophobicContact CB-CE3 3.9Å; L1120-W1193 HydrophobicContact CB-CH2 4.15Å; L1120-W1193 HydrophobicContact CB-CZ2 4.35Å; L1120-W1193 HydrophobicContact CB-CZ3 3.9Å; L1120-W1193 HydrophobicContact CD1-CD2 4.17Å; L1120-W1193 HydrophobicContact CD1-CG 4.35Å; L1120-W1193 HydrophobicContact CD1-CZ2 4.43Å; L1120-W1193 HydrophobicContact CD2-CH2 4.12Å; L1120-W1193 HydrophobicContact CD2-CZ2 3.84Å; L1120-W1193 HydrophobicContact CG-CZ2 4.44Å; W1193-F1195 HydrophobicContact CB-CE2 3.89Å; W1193-F1195 HydrophobicContact CE3-CZ 4.45Å; W1193-S1215 WeakPolarHBondContact O-CA 3.29Å; W1193-S1216 PolarHBondContact N-O 3.49Å; W1193-S1216 VanDerWaalsContact N-O 3.14Å; W1193-S1216 PolarHBondContact O-N 2.88Å; W1193-S1216 PolarHBondContact O-OG 3.25Å; W1193-E1218 HydrophobicContact CG-CB 4.49Å; W1193-E1218 HydrophobicContact CZ2-CG 3.9Å
1194	F	89.6	Confident	72.7	Confident	1 Å²	1	48 Å²	48	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	113.7	-180	-64.6	-87.8	0	0	0	108.4	L1098 L1101 K1118 V1119 I1121 F1196 T1213 F1214	L1098-F1194 HydrophobicContact CB-CZ 4.13Å; L1098-F1194 HydrophobicContact CD1-CE2 4.43Å; L1098-F1194 HydrophobicContact CD1-CZ 4.48Å; L1101-F1194 HydrophobicContact CB-CD1 3.45Å; L1101-F1194 VanDerWaalsContact CB-CD1 3.45Å; L1101-F1194 HydrophobicContact CB-CD2 4.34Å; L1101-F1194 HydrophobicContact CB-CE1 3.56Å; L1101-F1194 HydrophobicContact CB-CE2 4.43Å; L1101-F1194 HydrophobicContact CB-CG 3.87Å; L1101-F1194 HydrophobicContact CB-CZ 4.06Å; L1101-F1194 HydrophobicContact CD2-CB 3.8Å; L1101-F1194 HydrophobicContact CD2-CD1 4.17Å; L1101-F1194 HydrophobicContact CD2-CD2 3.83Å; L1101-F1194 HydrophobicContact CD2-CE2 4.45Å; L1101-F1194 HydrophobicContact CD2-CG 3.67Å; L1101-F1194 HydrophobicContact CG-CD1 4.47Å; L1101-F1194 HydrophobicContact CG-CG 4.44Å; K1118-F1194 CarbonylContact C-O 3.45Å; K1118-F1194 WeakPolarHBondContact CA-O 3.49Å; V1119-F1194 HydrophobicContact CB-CB 4.38Å; V1119-F1194 PolarHBondContact N-O 2.92Å; V1119-F1194 PolarHBondContact O-N 3.26Å; I1121-F1194 HydrophobicContact CB-CE2 4.28Å; I1121-F1194 HydrophobicContact CD1-CD2 4.24Å; I1121-F1194 HydrophobicContact CD1-CE2 3.88Å; I1121-F1194 HydrophobicContact CG1-CD2 4.18Å; I1121-F1194 HydrophobicContact CG1-CE2 4Å; F1194-F1196 HydrophobicContact CB-CE2 3.99Å; F1194-T1213 HydrophobicContact CB-CG2 3.66Å; F1194-T1213 HydrophobicContact CD1-CG2 3.9Å; F1194-T1213 HydrophobicContact CG-CG2 4.28Å; F1194-F1214 WeakPolarHBondContact CD1-O 3.36Å
1195	F	87.4	Confident	72.1	Confident	57 Å²	57	51 Å²	51	25%	0.25	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	136	-179.9	-67	-93.9	0	0	0	110.3	K1118 W1193 T1213 S1216 E1218	K1118-F1195 HydrophobicContact CB-CD1 3.79Å; K1118-F1195 HydrophobicContact CB-CE1 4.05Å; K1118-F1195 HydrophobicContact CB-CG 4.35Å; K1118-F1195 HydrophobicContact CD-CD1 4.24Å; K1118-F1195 HydrophobicContact CD-CE1 3.7Å; K1118-F1195 HydrophobicContact CD-CZ 4.41Å; K1118-F1195 HydrophobicContact CG-CE1 4.49Å; W1193-F1195 HydrophobicContact CB-CE2 3.89Å; W1193-F1195 HydrophobicContact CE3-CZ 4.45Å; F1195-T1213 WeakPolarHBondContact O-CB 3.42Å; F1195-T1213 WeakPolarHBondContact O-CG2 3.06Å; F1195-T1213 PolarHBondContact O-OG1 2.74Å; F1195-S1216 WeakPolarHBondContact CD2-OG 3.33Å; F1195-S1216 WeakPolarHBondContact CE2-OG 3.49Å; F1195-E1218 WeakPolarHBondContact CZ-O 3.31Å
1196	F	85	Confident	71.8	Confident	27 Å²	27	54.6 Å²	54.6	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	-47.8	-176.8	-70.3	-79.9	0	0	0	112.4	L1101 V1103 L1116 E1117 V1119 F1194 A1198 C1211 T1213	L1101-F1196 HydrophobicContact CB-CZ 4.44Å; L1101-F1196 HydrophobicContact CD2-CE2 3.81Å; L1101-F1196 HydrophobicContact CD2-CZ 3.81Å; L1101-F1196 HydrophobicContact CG-CE2 4.5Å; L1101-F1196 HydrophobicContact CG-CZ 4Å; V1103-F1196 HydrophobicContact CB-CZ 4.5Å; V1103-F1196 HydrophobicContact CG2-CE1 4.42Å; V1103-F1196 HydrophobicContact CG2-CE2 3.96Å; V1103-F1196 HydrophobicContact CG2-CZ 3.64Å; L1116-F1196 HydrophobicContact CB-CB 4.45Å; L1116-F1196 HydrophobicContact CD2-CB 4.18Å; L1116-F1196 HydrophobicContact CD2-CD1 4.4Å; L1116-F1196 HydrophobicContact CD2-CD2 3.52Å; L1116-F1196 HydrophobicContact CD2-CE2 3.9Å; L1116-F1196 HydrophobicContact CD2-CG 3.79Å; L1116-F1196 HydrophobicContact CD2-CZ 4.47Å; L1116-F1196 HydrophobicContact CG-CB 4.07Å; L1116-F1196 HydrophobicContact CG-CD2 3.85Å; L1116-F1196 HydrophobicContact CG-CG 4.14Å; E1117-F1196 PolarHBondContact O-N 2.71Å; V1119-F1196 HydrophobicContact CB-CE2 4.36Å; V1119-F1196 HydrophobicContact CG2-CD2 4.2Å; V1119-F1196 HydrophobicContact CG2-CE2 3.82Å; F1194-F1196 HydrophobicContact CB-CE2 3.99Å; F1196-A1198 PolarHBondContact O-N 3.38Å; F1196-C1211 HydrophobicContact CD1-CB 3.84Å; F1196-C1211 WeakPolarHBondContact CD1-SG 3.24Å; F1196-C1211 HydrophobicContact CE1-CB 4.07Å; F1196-C1211 VanDerWaalsContact CE1-SG 3.52Å; F1196-T1213 HydrophobicContact CD1-CG2 3.9Å; F1196-T1213 HydrophobicContact CD2-CG2 4.23Å; F1196-T1213 HydrophobicContact CE1-CG2 3.43Å; F1196-T1213 VanDerWaalsContact CE1-CG2 3.43Å; F1196-T1213 HydrophobicContact CE2-CG2 3.79Å; F1196-T1213 HydrophobicContact CG-CG2 4.29Å; F1196-T1213 HydrophobicContact CZ-CG2 3.37Å
1197	N	85.4	Confident	72.4	Confident	95 Å²	95	55.1 Å²	55.1	51%	0.508	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.8	40	-179	-64.1	-45	0	0	0	114.3	F1115 L1116 E1117	F1115-N1197 WeakPolarHBondContact CE2-O 3.45Å; F1115-N1197 HydrophobicContact CZ-CB 4.27Å; F1115-N1197 WeakPolarHBondContact CZ-O 3.19Å; L1116-N1197 WeakPolarHBondContact O-CA 3.37Å; L1116-N1197 PolarHBondContact O-N 3.45Å; E1117-N1197 PolarHBondContact O-N 2.74Å; E1117-N1197 PolarHBondContact O-OD1 3.46Å
1198	A	80	Confident	73.3	Confident	32 Å²	32	54.5 Å²	54.5	26%	0.264	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.8	-165.5	0	0	0	0	0	114.2	F1115 L1116 F1196	F1115-A1198 WeakPolarHBondContact CA-O 3.46Å; L1116-A1198 PolarHBondContact N-O 3.25Å; L1116-A1198 PolarHBondContact O-N 2.95Å; L1116-A1198 VanDerWaalsContact O-N 3.08Å; F1196-A1198 PolarHBondContact O-N 3.38Å
1199	W	79.2	Confident	74.2	Confident	73 Å²	73	55.2 Å²	55.2	28%	0.277	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.4	170.8	-76.6	106.6	0	0	0	111.6	R1046 W1114 F1115 H1204	R1046-W1199 HydrophobicContact CB-CZ2 4.24Å; W1114-W1199 CarbonylContact O-C 3.54Å; W1114-W1199 WeakPolarHBondContact O-CA 3.46Å; F1115-W1199 HydrophobicContact CB-CD2 4.14Å; F1115-W1199 HydrophobicContact CB-CE3 3.99Å; F1115-W1199 HydrophobicContact CB-CH2 4.23Å; F1115-W1199 HydrophobicContact CB-CZ2 4.35Å; F1115-W1199 HydrophobicContact CB-CZ3 4.05Å; F1115-W1199 AromaticContact CD2-CD1 3.75Å; F1115-W1199 AromaticContact CD2-CD2 3.8Å; F1115-W1199 HydrophobicContact CD2-CD2 3.8Å; F1115-W1199 AromaticContact CD2-CE2 3.73Å; F1115-W1199 AromaticContact CD2-CG 3.83Å; F1115-W1199 HydrophobicContact CD2-CG 3.83Å; F1115-W1199 HydrophobicContact CD2-CZ2 4.36Å; F1115-W1199 AromaticContact CD2-NE1 3.68Å; F1115-W1199 HydrophobicContact CG-CD2 4.47Å; W1199-H1204 HydrophobicContact CB-CB 4.46Å
1200	L	77.6	Confident	74.9	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.016	27%	0.27	C	S	.	.			trans	-102.2	78	175.2	-67.8	165.4	0	0	0	109.2	R1105 W1114 L1116 Q1208 C1211	R1105-L1200 VanDerWaalsContact CZ-O 3.3Å; R1105-L1200 PolarHBondContact NE-O 3.48Å; R1105-L1200 PolarHBondContact NH2-O 2.79Å; W1114-L1200 HydrophobicContact CB-CB 4.44Å; W1114-L1200 HydrophobicContact CD2-CD1 4.36Å; W1114-L1200 HydrophobicContact CE3-CB 4.1Å; W1114-L1200 HydrophobicContact CE3-CD1 3.36Å; W1114-L1200 HydrophobicContact CE3-CG 4.35Å; W1114-L1200 HydrophobicContact CZ3-CD1 3.45Å; W1114-L1200 VanDerWaalsContact CZ3-CD1 3.45Å; W1114-L1200 PolarHBondContact O-N 3.15Å; L1116-L1200 HydrophobicContact CB-CD1 4.14Å; L1116-L1200 HydrophobicContact CD2-CD1 4.25Å; L1200-Q1208 CarbonylContact C-O 3.6Å; L1200-Q1208 WeakPolarHBondContact CA-O 3.31Å; L1200-C1211 HydrophobicContact CD2-CB 4.12Å
1201	S	70.9	Confident	75	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.021	27%	0.272	C	S	.	.			trans	-134.7	149.9	-164.3	-179	0	0	0	0	113.2	D1112 Q1203 H1204 K1207 Q1208	D1112-S1201 VanDerWaalsContact O-CA 3.31Å; D1112-S1201 WeakPolarHBondContact O-CA 3.28Å; D1112-S1201 VanDerWaalsContact O-CB 3.3Å; D1112-S1201 WeakPolarHBondContact O-CB 2.97Å; D1112-S1201 PolarHBondContact O-OG 2.91Å; S1201-Q1203 PolarHBondContact OG-N 3.14Å; S1201-H1204 PolarHBondContact OG-N 2.88Å; S1201-K1207 CarbonylContact O-C 3.52Å; S1201-K1207 WeakPolarHBondContact O-CA 3.44Å; S1201-Q1208 PolarHBondContact N-O 3.44Å
1202	K	62.6	Low	75.1	Confident	99 Å²	99	55.8 Å²	55.8	43%	0.43	27%	0.271	S	S	.	.	S	Bend	trans	-78.2	-19.4	169.1	-64.2	-178.7	-169.1	154.3	0	113.6	G1107 D1112 M1209	G1107-K1202 WeakPolarHBondContact O-CE 3.49Å; G1107-K1202 PolarHBondContact O-NZ 3.22Å; D1112-K1202 WeakPolarHBondContact OD1-CD 3.36Å; D1112-K1202 IonicContact OD1-NZ 3.37Å; K1202-M1209 HydrophobicContact CG-SD 3.88Å
1203	Q	60.7	Low	74.9	Confident	143 Å²	143	56.6 Å²	56.6	67%	0.668	28%	0.276	S	S	*	.	S	Bend	trans	-105.3	-31.6	-169.5	-59.9	-166.3	12.8	0	0	114	D1112 S1201	D1112-Q1203 HydrophobicContact CB-CG 4.2Å; D1112-Q1203 PolarHBondContact OD2-NE2 3.29Å; S1201-Q1203 PolarHBondContact OG-N 3.14Å
1204	H	62.1	Low	74.8	Confident	85 Å²	85	58 Å²	58	39%	0.394	28%	0.283	S	S	.	.	S	Bend	trans	-73.7	159.9	175.8	-76.3	-75.8	0	0	0	113.3	W1199 S1201 N1206 K1207	W1199-H1204 HydrophobicContact CB-CB 4.46Å; S1201-H1204 PolarHBondContact OG-N 2.88Å; H1204-N1206 VanDerWaalsContact C-N 3.27Å; H1204-N1206 PolarHBondContact O-N 3.41Å; H1204-K1207 PolarHBondContact O-N 2.87Å
1205	D	48.1	Very low	74.6	Confident	146 Å²	146	58.1 Å²	58.1	78%	0.781	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-30.6	-155.7	-54	-66.4	0	0	0	117
1206	N	55	Low	74.5	Confident	116 Å²	116	55.5 Å²	55.5	62%	0.62	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-12.8	-178.7	-72.3	-34.5	0	0	0	114.5	H1204 Q1208	H1204-N1206 VanDerWaalsContact C-N 3.27Å; H1204-N1206 PolarHBondContact O-N 3.41Å; N1206-Q1208 PolarHBondContact O-N 3.12Å
1207	K	60.9	Low	74.3	Confident	126 Å²	126	54.7 Å²	54.7	55%	0.548	27%	0.27	S	S	.	.			trans	47.3	33.2	-177.4	-56.3	-170.6	176.5	178.2	0	114.7	S1201 H1204	S1201-K1207 CarbonylContact O-C 3.52Å; S1201-K1207 WeakPolarHBondContact O-CA 3.44Å; H1204-K1207 PolarHBondContact O-N 2.87Å
1208	Q	68.5	Low	74	Confident	53 Å²	53	56.4 Å²	56.4	25%	0.248	28%	0.275	C	S	.	.			trans	-97.4	135.1	-177.7	-79.6	177.5	15.9	0	0	111.4	L1200 S1201 N1206	L1200-Q1208 CarbonylContact C-O 3.6Å; L1200-Q1208 WeakPolarHBondContact CA-O 3.31Å; S1201-Q1208 PolarHBondContact N-O 3.44Å; N1206-Q1208 PolarHBondContact O-N 3.12Å
1209	M	75	Confident	73.8	Confident	36 Å²	36	62.2 Å²	62.2	18%	0.177	30%	0.301	C	S	.	.	S	Bend	trans	-104.6	1	-178.8	-65	-61.3	-59	0	0	112.7	R1105 K1202	R1105-M1209 HydrophobicContact CB-CE 3.93Å; R1105-M1209 HydrophobicContact CG-CE 3.84Å; R1105-M1209 PolarHBondContact N-O 2.8Å; R1105-M1209 VanDerWaalsContact O-CE 3.22Å; R1105-M1209 WeakPolarHBondContact O-CE 3.4Å; K1202-M1209 HydrophobicContact CG-SD 3.88Å
1210	N	80.5	Confident	73.5	Confident	10 Å²	10	60.3 Å²	60.3	5%	0.053	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	156.7	179.6	59.4	30.8	0	0	0	112.3	V1103 E1104 K1261 E1262	V1103-N1210 CarbonylContact O-C 3.2Å; V1103-N1210 VanDerWaalsContact O-CA 3.23Å; V1103-N1210 WeakPolarHBondContact O-CA 3.48Å; V1103-N1210 WeakPolarHBondContact O-CB 3.35Å; E1104-N1210 HydrophobicContact CB-CB 3.72Å; E1104-N1210 HydrophobicContact CG-CB 3.95Å; E1104-N1210 PolarHBondContact OE1-ND2 2.74Å; N1210-K1261 PolarHBondContact O-NZ 3.2Å; N1210-K1261 WeakPolarHBondContact OD1-CD 3.1Å; N1210-E1262 PolarHBondContact ND2-O 2.91Å; N1210-E1262 PolarHBondContact OD1-O 3.42Å
1211	C	83.6	Confident	73.4	Confident	10 Å²	10	65.9 Å²	65.9	7%	0.068	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.2	179.1	55.5	0	0	0	0	111.5	I1102 V1103 F1196 L1200	I1102-C1211 WeakPolarHBondContact CA-O 3.47Å; V1103-C1211 PolarHBondContact N-O 3.49Å; V1103-C1211 PolarHBondContact O-N 3.32Å; F1196-C1211 HydrophobicContact CD1-CB 3.84Å; F1196-C1211 WeakPolarHBondContact CD1-SG 3.24Å; F1196-C1211 HydrophobicContact CE1-CB 4.07Å; F1196-C1211 VanDerWaalsContact CE1-SG 3.52Å; L1200-C1211 HydrophobicContact CD2-CB 4.12Å
1212	E	87	Confident	73.5	Confident	26 Å²	26	69.1 Å²	69.1	12%	0.121	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	147.3	174.7	68.5	171.4	-129.1	0	0	110.4	K1100 L1101 I1102 S1260 K1261 V1288	K1100-E1212 WeakPolarHBondContact CE-OE1 3.4Å; K1100-E1212 WeakPolarHBondContact CE-OE2 3.33Å; K1100-E1212 IonicContact NZ-OE1 2.71Å; K1100-E1212 PolarHBondContact NZ-OE1 3.38Å; K1100-E1212 IonicContact NZ-OE2 2.66Å; K1100-E1212 PolarHBondContact NZ-OE2 3.48Å; L1101-E1212 VanDerWaalsContact O-CA 3.3Å; L1101-E1212 WeakPolarHBondContact O-CA 3.42Å; I1102-E1212 HydrophobicContact CG1-CB 3.91Å; E1212-S1260 VanDerWaalsContact OE2-CA 3.31Å; E1212-S1260 WeakPolarHBondContact OE2-CA 3.18Å; E1212-K1261 HydrophobicContact CB-CB 4.42Å; E1212-K1261 HydrophobicContact CB-CD 4.38Å; E1212-K1261 HydrophobicContact CG-CD 4.16Å; E1212-K1261 HydrophobicContact CG-CG 4.27Å; E1212-K1261 PolarHBondContact OE2-N 3.5Å; E1212-V1288 PolarHBondContact OE1-N 3.22Å
1213	T	85.6	Confident	73.9	Confident	19 Å²	19	66.4 Å²	66.4	12%	0.117	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	164.9	176.7	-161.6	0	0	0	0	111.1	K1100 L1101 F1194 F1195 F1196	K1100-T1213 WeakPolarHBondContact CA-O 3.41Å; L1101-T1213 PolarHBondContact N-O 2.79Å; L1101-T1213 PolarHBondContact O-N 2.65Å; F1194-T1213 HydrophobicContact CB-CG2 3.66Å; F1194-T1213 HydrophobicContact CD1-CG2 3.9Å; F1194-T1213 HydrophobicContact CG-CG2 4.28Å; F1195-T1213 WeakPolarHBondContact O-CB 3.42Å; F1195-T1213 WeakPolarHBondContact O-CG2 3.06Å; F1195-T1213 PolarHBondContact O-OG1 2.74Å; F1196-T1213 HydrophobicContact CD1-CG2 3.9Å; F1196-T1213 HydrophobicContact CD2-CG2 4.23Å; F1196-T1213 HydrophobicContact CE1-CG2 3.43Å; F1196-T1213 VanDerWaalsContact CE1-CG2 3.43Å; F1196-T1213 HydrophobicContact CE2-CG2 3.79Å; F1196-T1213 HydrophobicContact CG-CG2 4.29Å; F1196-T1213 HydrophobicContact CZ-CG2 3.37Å
1214	F	85.8	Confident	74.2	Confident	57 Å²	57	62.5 Å²	62.5	25%	0.25	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	162.8	177.9	53.8	-103.4	0	0	0	112.3	Q1099 F1194 P1222 L1226 V1288	Q1099-F1214 WeakPolarHBondContact O-CA 3.4Å; F1194-F1214 WeakPolarHBondContact CD1-O 3.36Å; F1214-P1222 HydrophobicContact CD2-CB 4.13Å; F1214-P1222 HydrophobicContact CE2-CB 3.75Å; F1214-P1222 HydrophobicContact CE2-CG 3.72Å; F1214-P1222 HydrophobicContact CZ-CB 4.48Å; F1214-P1222 HydrophobicContact CZ-CG 4.15Å; F1214-L1226 HydrophobicContact CB-CD1 4.29Å; F1214-V1288 HydrophobicContact CB-CG1 4.31Å; F1214-V1288 HydrophobicContact CD1-CG1 4.25Å
1215	S	86.5	Confident	74.1	Confident	4 Å²	4	64.2 Å²	64.2	3%	0.028	34%	0.343	C	S	.	.			trans	-77.4	136.9	178.5	61.9	0	0	0	0	113	L1098 Q1099 W1193 L1223	L1098-S1215 PolarHBondContact O-OG 3.46Å; Q1099-S1215 WeakPolarHBondContact CA-OG 3.28Å; Q1099-S1215 PolarHBondContact O-N 2.71Å; Q1099-S1215 PolarHBondContact O-OG 3.35Å; W1193-S1215 WeakPolarHBondContact O-CA 3.29Å; S1215-L1223 WeakPolarHBondContact O-CB 3.39Å; S1215-L1223 PolarHBondContact O-N 2.87Å
1216	S	83.9	Confident	74.9	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.021	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-129.3	171.5	179.2	69.5	0	0	0	0	112.5	W1193 F1195 K1221	W1193-S1216 PolarHBondContact N-O 3.49Å; W1193-S1216 VanDerWaalsContact N-O 3.14Å; W1193-S1216 PolarHBondContact O-N 2.88Å; W1193-S1216 PolarHBondContact O-OG 3.25Å; F1195-S1216 WeakPolarHBondContact CD2-OG 3.33Å; F1195-S1216 WeakPolarHBondContact CE2-OG 3.49Å; S1216-K1221 CarbonylContact C-O 3.59Å; S1216-K1221 WeakPolarHBondContact CA-O 3.36Å; S1216-K1221 VanDerWaalsContact CB-O 3.27Å; S1216-K1221 WeakPolarHBondContact CB-O 3.31Å
1217	T	81	Confident	75.4	Confident	9 Å²	9	58.4 Å²	58.4	6%	0.055	31%	0.309	C	S	.	.			trans	-75.1	173.3	159.9	70.6	0	0	0	0	110.9	L1183 N1219 G1220 K1221 L1223	L1183-T1217 HydrophobicContact CD2-CG2 4.04Å; T1217-N1219 PolarHBondContact O-N 2.85Å; T1217-G1220 PolarHBondContact O-N 3.33Å; T1217-K1221 PolarHBondContact N-O 3.19Å; T1217-L1223 HydrophobicContact CG2-CD2 3.68Å
1218	E	79.4	Confident	75.9	Confident	131 Å²	131	57.8 Å²	57.8	61%	0.612	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.4	176.3	-172.4	163.8	-157.8	0	0	113.3	W1193 F1195 G1220	W1193-E1218 HydrophobicContact CG-CB 4.49Å; W1193-E1218 HydrophobicContact CZ2-CG 3.9Å; F1195-E1218 WeakPolarHBondContact CZ-O 3.31Å; E1218-G1220 PolarHBondContact O-N 3.15Å
1219	N	76.1	Confident	76.4	Confident	154 Å²	154	55.8 Å²	55.8	82%	0.824	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	18.4	177.4	-62.8	-38.6	0	0	0	113.4	T1217 K1221	T1217-N1219 PolarHBondContact O-N 2.85Å; N1219-K1221 PolarHBondContact O-N 3Å; N1219-K1221 VanDerWaalsContact O-N 3.15Å
1220	G	71.7	Confident	76.8	Confident	33 Å²	33	56.4 Å²	56.4	34%	0.34	31%	0.308	S	S	.	.	S	Bend	trans	71.6	3.2	178.1	0	0	0	0	0	116	T1217 E1218 P1222	T1217-G1220 PolarHBondContact O-N 3.33Å; E1218-G1220 PolarHBondContact O-N 3.15Å; G1220-P1222 WeakPolarHBondContact O-CD 3.39Å
1221	K	75.9	Confident	77.2	Confident	120 Å²	120	55.9 Å²	55.9	52%	0.522	31%	0.305	S	S	.	.			trans	-70.4	122.3	-179.8	-174.8	-176.2	173.5	-168.7	0	110.4	E1182 S1216 T1217 N1219	E1182-K1221 IonicContact OE2-NZ 3.6Å; S1216-K1221 CarbonylContact C-O 3.59Å; S1216-K1221 WeakPolarHBondContact CA-O 3.36Å; S1216-K1221 VanDerWaalsContact CB-O 3.27Å; S1216-K1221 WeakPolarHBondContact CB-O 3.31Å; T1217-K1221 PolarHBondContact N-O 3.19Å; N1219-K1221 PolarHBondContact O-N 3Å; N1219-K1221 VanDerWaalsContact O-N 3.15Å
1222	P	74.2	Confident	77.5	Confident	71 Å²	71	57.7 Å²	57.7	46%	0.461	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-60.1	139.3	-179.8	-21.4	30.9	0	0	0	112.2	F1214 G1220	F1214-P1222 HydrophobicContact CD2-CB 4.13Å; F1214-P1222 HydrophobicContact CE2-CB 3.75Å; F1214-P1222 HydrophobicContact CE2-CG 3.72Å; F1214-P1222 HydrophobicContact CZ-CB 4.48Å; F1214-P1222 HydrophobicContact CZ-CG 4.15Å; G1220-P1222 WeakPolarHBondContact O-CD 3.39Å
1223	L	71.3	Confident	77.7	Confident	42 Å²	42	56.4 Å²	56.4	22%	0.22	31%	0.307	C	S	.	.	S	Bend	trans	-82.1	-19.4	-179	-69.8	174.2	0	0	0	114.3	P1180 L1183 Y1192 S1215 T1217	P1180-L1223 HydrophobicContact CG-CD2 4.35Å; L1183-L1223 HydrophobicContact CD1-CD1 3.49Å; L1183-L1223 VanDerWaalsContact CD1-CD1 3.49Å; L1183-L1223 HydrophobicContact CD1-CD2 3.73Å; L1183-L1223 HydrophobicContact CD1-CG 4.25Å; L1183-L1223 HydrophobicContact CD2-CD1 4.05Å; L1183-L1223 HydrophobicContact CD2-CD2 4.06Å; L1183-L1223 HydrophobicContact CG-CD1 4.36Å; L1183-L1223 HydrophobicContact CG-CD2 4.12Å; Y1192-L1223 HydrophobicContact CD1-CD1 3.86Å; Y1192-L1223 HydrophobicContact CE1-CD1 4.24Å; S1215-L1223 WeakPolarHBondContact O-CB 3.39Å; S1215-L1223 PolarHBondContact O-N 2.87Å; T1217-L1223 HydrophobicContact CG2-CD2 3.68Å
1224	Q	65.8	Low	78.1	Confident	62 Å²	62	56.5 Å²	56.5	29%	0.29	31%	0.306	S	S	.	.	S	Bend	trans	-149.4	159.3	174.7	-64.9	-172.8	7.9	0	0	109.9	Q1099 L1226	Q1099-Q1224 VanDerWaalsContact NE2-CD 3.32Å; Q1224-L1226 HydrophobicContact CB-CG 4.47Å; Q1224-L1226 PolarHBondContact O-N 2.92Å
1225	S	61.2	Low	78.5	Confident	120 Å²	120	53.8 Å²	53.8	84%	0.839	30%	0.295	S	S	*	.			trans	-75.7	59.8	171.7	60.2	0	0	0	0	111.8	M1227	S1225-M1227 PolarHBondContact O-N 3.19Å
1226	L	64.4	Low	78.8	Confident	31 Å²	31	54.8 Å²	54.8	16%	0.162	30%	0.298	C	S	.	.			trans	-76.6	99.3	168	-76.9	168.4	0	0	0	108.3	L1064 Q1099 F1214 Q1224 V1288	L1064-L1226 HydrophobicContact CD1-CD2 3.87Å; L1064-L1226 HydrophobicContact CD2-CD1 4.37Å; L1064-L1226 HydrophobicContact CD2-CD2 4.17Å; Q1099-L1226 HydrophobicContact CB-CD1 4.19Å; F1214-L1226 HydrophobicContact CB-CD1 4.29Å; Q1224-L1226 HydrophobicContact CB-CG 4.47Å; Q1224-L1226 PolarHBondContact O-N 2.92Å; L1226-V1288 HydrophobicContact CB-CG1 4.15Å
1227	M	64.1	Low	79.2	Confident	110 Å²	110	54.7 Å²	54.7	54%	0.542	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-65.2	136.7	175.5	-69.6	176	170	0	0	110.8	S1225 G1289	S1225-M1227 PolarHBondContact O-N 3.19Å; M1227-G1289 PolarHBondContact O-N 3.06Å
1228	E	73.2	Confident	79.4	Confident	112 Å²	112	54.2 Å²	54.2	52%	0.523	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.8	162.2	-174.8	-179.8	163.7	0	0	107.6	N1286 V1288	E1228-N1286 HydrophobicContact CG-CB 3.97Å; E1228-N1286 WeakPolarHBondContact OE1-CB 3.33Å; E1228-N1286 PolarHBondContact OE1-ND2 3.32Å; E1228-V1288 HydrophobicContact CB-CG2 4.25Å; E1228-V1288 HydrophobicContact CG-CG2 4.19Å
1229	S	78.1	Confident	79.4	Confident	12 Å²	12	50 Å²	50	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.8	-178.9	-70	0	0	0	0	110.4	Y1231 N1286 A1287	S1229-Y1231 VanDerWaalsContact CB-CE2 3.49Å; S1229-Y1231 WeakPolarHBondContact CB-OH 3.46Å; S1229-Y1231 VanDerWaalsContact O-CD2 3.31Å; S1229-Y1231 WeakPolarHBondContact O-CD2 3.3Å; S1229-Y1231 VanDerWaalsContact O-CE2 3.31Å; S1229-Y1231 WeakPolarHBondContact O-CE2 3.19Å; S1229-N1286 WeakPolarHBondContact O-CA 3.4Å; S1229-A1287 PolarHBondContact N-O 3.1Å; S1229-A1287 PolarHBondContact O-N 3.02Å
1230	S	84.1	Confident	79.5	Confident	48 Å²	48	49.1 Å²	49.1	34%	0.336	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.8	173.3	-178.8	0	0	0	0	110.8	S1319	S1230-S1319 PolarHBondContact O-N 2.8Å
1231	Y	87.4	Confident	79.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.7	-176.3	-61.1	-84.9	0	0	0	111	S1229 M1253 N1284 L1285 A1287 L1290 L1293 I1316 R1317 E1318	S1229-Y1231 VanDerWaalsContact CB-CE2 3.49Å; S1229-Y1231 WeakPolarHBondContact CB-OH 3.46Å; S1229-Y1231 VanDerWaalsContact O-CD2 3.31Å; S1229-Y1231 WeakPolarHBondContact O-CD2 3.3Å; S1229-Y1231 VanDerWaalsContact O-CE2 3.31Å; S1229-Y1231 WeakPolarHBondContact O-CE2 3.19Å; Y1231-M1253 HydrophobicContact CD2-CE 3.94Å; Y1231-M1253 HydrophobicContact CD2-SD 4.47Å; Y1231-M1253 HydrophobicContact CE2-CE 4.47Å; Y1231-M1253 HydrophobicContact CG-CE 4.25Å; Y1231-M1253 HydrophobicContact CG-SD 4.23Å; Y1231-N1284 WeakPolarHBondContact O-CA 3.38Å; Y1231-L1285 WeakPolarHBondContact CB-O 3.12Å; Y1231-L1285 PolarHBondContact N-O 3.31Å; Y1231-L1285 PolarHBondContact O-N 3.11Å; Y1231-A1287 HydrophobicContact CD2-CB 4.27Å; Y1231-A1287 HydrophobicContact CE2-CB 3.91Å; Y1231-L1290 HydrophobicContact CE2-CD1 4.01Å; Y1231-L1293 HydrophobicContact CE1-CD1 4.43Å; Y1231-I1316 HydrophobicContact CD1-CG2 3.81Å; Y1231-I1316 HydrophobicContact CG-CG2 4.33Å; Y1231-R1317 CarbonylContact C-O 2.94Å; Y1231-R1317 VanDerWaalsContact CA-O 3.27Å; Y1231-R1317 WeakPolarHBondContact CA-O 3.24Å; Y1231-E1318 HydrophobicContact CD1-CB 3.85Å; Y1231-E1318 HydrophobicContact CD1-CG 4.2Å; Y1231-E1318 HydrophobicContact CE1-CB 3.66Å; Y1231-E1318 HydrophobicContact CE1-CG 3.59Å; Y1231-E1318 VanDerWaalsContact CE1-OE1 3.25Å; Y1231-E1318 WeakPolarHBondContact CE1-OE1 3.46Å; Y1231-E1318 VanDerWaalsContact CZ-OE1 3.28Å; Y1231-E1318 PolarHBondContact OH-OE1 2.93Å
1232	E	90.7	Very high	79.9	Confident	47 Å²	47	55.8 Å²	55.8	22%	0.22	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	111.1	165.4	-59.8	174.1	153.1	0	0	107.8	L1282 I1316 R1317 K1324	E1232-L1282 HydrophobicContact CB-CD1 4.01Å; E1232-I1316 CarbonylContact O-C 3.57Å; E1232-I1316 WeakPolarHBondContact O-CA 3.41Å; E1232-R1317 HydrophobicContact CB-CB 4.12Å; E1232-R1317 PolarHBondContact N-O 2.99Å; E1232-R1317 PolarHBondContact O-N 2.81Å; E1232-R1317 WeakPolarHBondContact OE2-CD 3.12Å; E1232-K1324 IonicContact OE1-NZ 2.91Å; E1232-K1324 IonicContact OE2-NZ 2.61Å; E1232-K1324 PolarHBondContact OE2-NZ 3.43Å
1233	V	92.2	Very high	80.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115	178.5	179.8	0	0	0	0	109.4	V1235 I1251 M1253 L1282 F1283 L1285 I1314 I1316	V1233-V1235 HydrophobicContact CG1-CG2 4.12Å; V1233-I1251 HydrophobicContact CG1-CD1 4.08Å; V1233-M1253 HydrophobicContact CG2-SD 4.47Å; V1233-L1282 CarbonylContact O-C 3.59Å; V1233-L1282 WeakPolarHBondContact O-CA 3.42Å; V1233-F1283 PolarHBondContact N-O 3.16Å; V1233-F1283 PolarHBondContact O-N 2.65Å; V1233-L1285 HydrophobicContact CG2-CD1 3.73Å; V1233-L1285 HydrophobicContact CG2-CG 4.12Å; V1233-I1314 HydrophobicContact CG1-CG2 3.86Å; V1233-I1316 HydrophobicContact CG1-CD1 4.49Å; V1233-I1316 HydrophobicContact CG1-CG1 4.27Å; V1233-I1316 HydrophobicContact CG2-CD1 4.11Å; V1233-I1316 HydrophobicContact CG2-CG1 4.07Å; V1233-I1316 HydrophobicContact CG2-CG2 4.14Å
1234	I	93.7	Very high	81.2	Confident	21 Å²	21	51 Å²	51	11%	0.108	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.7	178.6	-61.2	160.5	0	0	0	108.4	D1281 L1282 I1314 L1315	I1234-D1281 CarbonylContact C-O 3.54Å; I1234-D1281 WeakPolarHBondContact CA-O 3.47Å; I1234-L1282 HydrophobicContact CG1-CD1 3.71Å; I1234-I1314 CarbonylContact O-C 3.6Å; I1234-I1314 VanDerWaalsContact O-CA 3.31Å; I1234-I1314 WeakPolarHBondContact O-CA 3.33Å; I1234-L1315 HydrophobicContact CB-CB 4.34Å; I1234-L1315 HydrophobicContact CD1-CD2 4.21Å; I1234-L1315 PolarHBondContact N-O 3.02Å; I1234-L1315 PolarHBondContact O-N 3.15Å
1235	V	93.9	Very high	82.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.2	-175.6	-175.7	0	0	0	0	109.9	V1233 L1265 F1275 E1280 D1281 F1283 W1309 L1311 I1314	V1233-V1235 HydrophobicContact CG1-CG2 4.12Å; V1235-L1265 HydrophobicContact CG2-CD1 4.06Å; V1235-F1275 HydrophobicContact CB-CE1 4.23Å; V1235-F1275 HydrophobicContact CG1-CD1 4.17Å; V1235-F1275 HydrophobicContact CG1-CE1 4Å; V1235-F1275 HydrophobicContact CG2-CE1 4.49Å; V1235-E1280 WeakPolarHBondContact O-CA 3.26Å; V1235-D1281 PolarHBondContact N-O 3.3Å; V1235-D1281 PolarHBondContact O-N 2.78Å; V1235-F1283 HydrophobicContact CB-CE2 4.5Å; V1235-F1283 HydrophobicContact CG2-CD2 4.2Å; V1235-F1283 HydrophobicContact CG2-CE2 4.06Å; V1235-W1309 HydrophobicContact CG1-CH2 3.86Å; V1235-W1309 HydrophobicContact CG1-CZ2 3.58Å; V1235-L1311 HydrophobicContact CG1-CD1 3.76Å; V1235-I1314 HydrophobicContact CG1-CG1 4.22Å; V1235-I1314 HydrophobicContact CG2-CG1 4.28Å
1236	K	93.8	Very high	83.4	Confident	25 Å²	25	46.6 Å²	46.6	11%	0.109	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.8	176	179.6	71.6	177	-173.8	0	111.2	N1278 E1280 L1311 D1312 Y1313	K1236-N1278 WeakPolarHBondContact CE-OD1 3.37Å; K1236-N1278 PolarHBondContact NZ-O 3.16Å; K1236-N1278 PolarHBondContact NZ-OD1 2.78Å; K1236-N1278 VanDerWaalsContact NZ-OD1 3.16Å; K1236-E1280 HydrophobicContact CB-CG 4.21Å; K1236-E1280 HydrophobicContact CD-CG 3.26Å; K1236-E1280 WeakPolarHBondContact CD-OE1 3.38Å; K1236-E1280 HydrophobicContact CG-CG 4.35Å; K1236-E1280 IonicContact NZ-OE1 3.65Å; K1236-E1280 PolarHBondContact NZ-OE1 3.2Å; K1236-L1311 WeakPolarHBondContact O-CD1 3.48Å; K1236-D1312 HydrophobicContact CB-CB 4.16Å; K1236-D1312 HydrophobicContact CG-CB 3.69Å; K1236-D1312 PolarHBondContact O-N 2.66Å; K1236-Y1313 HydrophobicContact CB-CD1 3.78Å; K1236-Y1313 HydrophobicContact CB-CD2 3.92Å; K1236-Y1313 HydrophobicContact CB-CE1 3.53Å; K1236-Y1313 HydrophobicContact CB-CE2 3.66Å; K1236-Y1313 HydrophobicContact CB-CG 3.96Å; K1236-Y1313 VanDerWaalsContact CB-CZ 3.44Å; K1236-Y1313 HydrophobicContact CD-CE1 4.31Å; K1236-Y1313 HydrophobicContact CG-CD1 4.04Å; K1236-Y1313 HydrophobicContact CG-CE1 3.58Å; K1236-Y1313 PolarHBondContact N-O 2.56Å
1237	T	91.8	Very high	84.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	135.8	167	-60.4	0	0	0	0	109.3	A1243 F1275 E1276 N1278 H1279 W1309	T1237-A1243 HydrophobicContact CG2-CB 4.33Å; T1237-A1243 WeakPolarHBondContact CG2-O 3.18Å; T1237-F1275 WeakPolarHBondContact OG1-CA 3.38Å; T1237-E1276 WeakPolarHBondContact CB-O 3.42Å; T1237-E1276 VanDerWaalsContact CG2-O 3.26Å; T1237-E1276 WeakPolarHBondContact CG2-O 3.5Å; T1237-N1278 CarbonylContact O-C 3.53Å; T1237-N1278 WeakPolarHBondContact O-CA 3.34Å; T1237-N1278 PolarHBondContact O-N 2.87Å; T1237-H1279 PolarHBondContact N-O 2.8Å; T1237-W1309 PolarHBondContact OG1-NE1 3.12Å
1238	G	84.2	Confident	85.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.			trans	-76.3	166	-170.2	0	0	0	0	0	115.3	R1240 A1243 N1278 F1310 D1312	G1238-R1240 VanDerWaalsContact C-N 3.34Å; G1238-R1240 PolarHBondContact O-N 3.42Å; G1238-A1243 WeakPolarHBondContact O-CB 3.24Å; G1238-N1278 PolarHBondContact O-N 2.83Å; G1238-F1310 PolarHBondContact N-O 3.43Å; G1238-D1312 VanDerWaalsContact CA-OD1 3.3Å; G1238-D1312 WeakPolarHBondContact CA-OD1 3.35Å; G1238-D1312 VanDerWaalsContact CA-OD2 3.24Å; G1238-D1312 WeakPolarHBondContact CA-OD2 3.26Å
1239	G	80.5	Confident	86.2	Confident	43 Å²	43	39.3 Å²	39.3	44%	0.443	20%	0.196	S	C	.	.	S	Bend	trans	-80.5	-1.5	-176.5	0	0	0	0	0	116.2	Q1277	G1239-Q1277 PolarHBondContact O-NE2 2.93Å
1240	R	78.5	Confident	86.7	Confident	134 Å²	134	41.1 Å²	41.1	51%	0.506	20%	0.201	S	C	.	.	S	Bend	trans	-67.8	148.5	-176.3	-60.5	-171.5	-174.3	-136.1	3.7	111.6	G1238 Y1242 A1243 Q1277 F1310 W1334	G1238-R1240 VanDerWaalsContact C-N 3.34Å; G1238-R1240 PolarHBondContact O-N 3.42Å; R1240-Y1242 PolarHBondContact O-N 3.11Å; R1240-A1243 HydrophobicContact CB-CB 4.36Å; R1240-A1243 WeakPolarHBondContact O-CB 3.49Å; R1240-A1243 PolarHBondContact O-N 2.78Å; R1240-Q1277 WeakPolarHBondContact O-CG 3.48Å; R1240-Q1277 PolarHBondContact O-NE2 2.76Å; R1240-Q1277 PolarHBondContact O-OE1 2.79Å; R1240-F1310 HydrophobicContact CG-CD1 4.41Å; R1240-F1310 HydrophobicContact CG-CE1 4.42Å; R1240-W1334 HydrophobicContact CB-CZ2 4.42Å
1241	K	74	Confident	87.1	Confident	148 Å²	148	38.9 Å²	38.9	64%	0.643	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	125.6	179.6	-164.4	-177.1	-176.6	-178.6	0	111.1
1242	Y	81.1	Confident	87.1	Confident	145 Å²	145	39.4 Å²	39.4	57%	0.569	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	38.7	-173.4	-41.2	-72.4	0	0	0	113.6	R1240 Q1277 W1334	R1240-Y1242 PolarHBondContact O-N 3.11Å; Y1242-Q1277 VanDerWaalsContact N-OE1 3.09Å; Y1242-W1334 WeakPolarHBondContact O-CH2 3.34Å; Y1242-W1334 WeakPolarHBondContact O-CZ3 3.37Å
1243	A	84.9	Confident	87.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.178	C	C	.	.			trans	-79.5	-22.7	175.1	0	0	0	0	0	114.3	T1237 G1238 R1240 Q1277 W1309 F1310 W1334	T1237-A1243 HydrophobicContact CG2-CB 4.33Å; T1237-A1243 WeakPolarHBondContact CG2-O 3.18Å; G1238-A1243 WeakPolarHBondContact O-CB 3.24Å; R1240-A1243 HydrophobicContact CB-CB 4.36Å; R1240-A1243 WeakPolarHBondContact O-CB 3.49Å; R1240-A1243 PolarHBondContact O-N 2.78Å; A1243-Q1277 HydrophobicContact CB-CG 4.24Å; A1243-W1309 CarbonylContact O-C 3.48Å; A1243-W1309 WeakPolarHBondContact O-CA 3.28Å; A1243-W1309 VanDerWaalsContact O-CD1 3.27Å; A1243-F1310 HydrophobicContact CB-CB 3.72Å; A1243-F1310 PolarHBondContact O-N 2.87Å; A1243-W1334 HydrophobicContact CB-CH2 4.45Å
1244	G	87.3	Confident	86.8	Confident	12 Å²	12	37.8 Å²	37.8	12%	0.124	18%	0.18	C	C	.	.			trans	-71	163.5	-179.4	0	0	0	0	0	113.9	F1275	G1244-F1275 CarbonylContact C-O 3.58Å; G1244-F1275 WeakPolarHBondContact CA-O 3.44Å
1245	T	88.7	Confident	86.4	Confident	8 Å²	8	37.3 Å²	37.3	5%	0.049	18%	0.181	C	C	.	.			trans	-141.4	133.1	-179.9	-168.3	0	0	0	0	114.8	S1247 V1249 F1275 A1306 P1307 W1309	T1245-S1247 PolarHBondContact O-N 3.33Å; T1245-S1247 VanDerWaalsContact OG1-CB 3.3Å; T1245-S1247 WeakPolarHBondContact OG1-CB 3.46Å; T1245-S1247 PolarHBondContact OG1-N 2.87Å; T1245-S1247 VanDerWaalsContact OG1-N 3.17Å; T1245-V1249 HydrophobicContact CG2-CG2 4.11Å; T1245-F1275 HydrophobicContact CG2-CB 3.85Å; T1245-F1275 HydrophobicContact CG2-CD2 4.46Å; T1245-F1275 HydrophobicContact CG2-CG 4.4Å; T1245-F1275 PolarHBondContact N-O 2.84Å; T1245-A1306 WeakPolarHBondContact CA-O 3.36Å; T1245-A1306 PolarHBondContact OG1-O 2.88Å; T1245-P1307 PolarHBondContact OG1-O 3.04Å; T1245-W1309 HydrophobicContact CG2-CB 3.73Å; T1245-W1309 HydrophobicContact CG2-CD2 3.97Å; T1245-W1309 HydrophobicContact CG2-CG 3.48Å; T1245-W1309 VanDerWaalsContact CG2-CG 3.48Å
1246	D	84	Confident	85.7	Confident	83 Å²	83	41 Å²	41	44%	0.444	20%	0.2	S	C	.	.			trans	-76.7	-9.6	169.7	-57.1	-43.5	0	0	0	112.8	I1305 A1306	D1246-I1305 WeakPolarHBondContact OD2-CA 3.35Å; D1246-I1305 WeakPolarHBondContact OD2-CB 3.2Å; D1246-I1305 PolarHBondContact OD2-N 2.78Å; D1246-A1306 PolarHBondContact N-O 3.39Å; D1246-A1306 PolarHBondContact OD2-N 3.38Å
1247	S	87	Confident	84.9	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.028	21%	0.214	C	C	.	.	S	Bend	trans	-79	144.9	-166	-167.6	0	0	0	0	112.3	T1245 V1249 H1300 T1301 N1302 T1303	T1245-S1247 PolarHBondContact O-N 3.33Å; T1245-S1247 VanDerWaalsContact OG1-CB 3.3Å; T1245-S1247 WeakPolarHBondContact OG1-CB 3.46Å; T1245-S1247 PolarHBondContact OG1-N 2.87Å; T1245-S1247 VanDerWaalsContact OG1-N 3.17Å; S1247-V1249 WeakPolarHBondContact O-CG2 3.28Å; S1247-V1249 PolarHBondContact O-N 3.07Å; S1247-H1300 PolarHBondContact OG-ND1 3.4Å; S1247-T1301 PolarHBondContact OG-N 2.77Å; S1247-T1301 VanDerWaalsContact OG-N 3.13Å; S1247-T1301 PolarHBondContact OG-OG1 2.82Å; S1247-N1302 PolarHBondContact OG-N 3.36Å; S1247-T1303 VanDerWaalsContact CA-O 3.28Å; S1247-T1303 WeakPolarHBondContact CA-O 3.24Å; S1247-T1303 VanDerWaalsContact CB-O 3.26Å; S1247-T1303 WeakPolarHBondContact CB-O 3.32Å; S1247-T1303 PolarHBondContact OG-N 3.19Å; S1247-T1303 VanDerWaalsContact OG-N 3.16Å
1248	H	85.4	Confident	84.4	Confident	95 Å²	95	43.8 Å²	43.8	44%	0.44	22%	0.217	S	C	.	.			trans	-63.4	113.9	174.5	-60.8	-68.3	0	0	0	110.7	Y1250 H1264 H1300 T1301	H1248-Y1250 HydrophobicContact CB-CE2 3.65Å; H1248-Y1250 WeakPolarHBondContact O-CD2 3.41Å; H1248-Y1250 WeakPolarHBondContact O-CE2 3.44Å; H1248-H1264 AromaticContact CG-NE2 3.71Å; H1248-H1264 AromaticContact ND1-CE1 3.56Å; H1248-H1264 AromaticContact ND1-NE2 3.17Å; H1248-H1264 PolarHBondContact ND1-NE2 3.41Å; H1248-H1264 VanDerWaalsContact ND1-NE2 3.17Å; H1248-H1300 VanDerWaalsContact O-CA 3.27Å; H1248-H1300 WeakPolarHBondContact O-CA 3.18Å; H1248-T1301 HydrophobicContact CB-CG2 4.17Å; H1248-T1301 WeakPolarHBondContact CB-OG1 3.5Å; H1248-T1301 PolarHBondContact N-OG1 2.75Å; H1248-T1301 VanDerWaalsContact N-OG1 3.14Å; H1248-T1301 PolarHBondContact O-N 2.87Å; H1248-T1301 PolarHBondContact O-OG1 2.82Å
1249	V	89	Confident	84.4	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	137.9	179.6	-178.2	0	0	0	0	111	T1245 S1247 H1264 L1265 F1275 V1298 R1299 H1300 W1309	T1245-V1249 HydrophobicContact CG2-CG2 4.11Å; S1247-V1249 WeakPolarHBondContact O-CG2 3.28Å; S1247-V1249 PolarHBondContact O-N 3.07Å; V1249-H1264 PolarHBondContact O-CD2 2.98Å; V1249-L1265 HydrophobicContact CG1-CD1 4.2Å; V1249-L1265 PolarHBondContact O-N 2.89Å; V1249-F1275 HydrophobicContact CB-CD2 4.29Å; V1249-F1275 HydrophobicContact CB-CE2 3.64Å; V1249-F1275 HydrophobicContact CB-CZ 3.79Å; V1249-F1275 HydrophobicContact CG1-CE2 4.5Å; V1249-F1275 HydrophobicContact CG1-CZ 4.19Å; V1249-F1275 HydrophobicContact CG2-CD2 3.63Å; V1249-F1275 HydrophobicContact CG2-CE2 3.51Å; V1249-F1275 HydrophobicContact CG2-CG 4.19Å; V1249-F1275 HydrophobicContact CG2-CZ 3.99Å; V1249-V1298 HydrophobicContact CG1-CG2 4.07Å; V1249-R1299 CarbonylContact C-O 3.55Å; V1249-R1299 WeakPolarHBondContact CA-O 3.49Å; V1249-H1300 HydrophobicContact CG2-CB 4.31Å; V1249-W1309 HydrophobicContact CG1-CH2 3.72Å; V1249-W1309 HydrophobicContact CG1-CZ3 3.74Å; V1249-W1309 HydrophobicContact CG2-CE3 4.4Å; V1249-W1309 HydrophobicContact CG2-CH2 4.33Å; V1249-W1309 HydrophobicContact CG2-CZ3 4.21Å
1250	Y	89.2	Confident	84.8	Confident	50 Å²	50	42.8 Å²	42.8	20%	0.196	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	148.2	-177.9	-64.1	-106.7	0	0	0	111.3	H1248 E1262 Y1263 H1264 V1298 R1299 T1301	H1248-Y1250 HydrophobicContact CB-CE2 3.65Å; H1248-Y1250 WeakPolarHBondContact O-CD2 3.41Å; H1248-Y1250 WeakPolarHBondContact O-CE2 3.44Å; Y1250-E1262 HydrophobicContact CD1-CG 4.16Å; Y1250-E1262 HydrophobicContact CG-CG 4.45Å; Y1250-Y1263 CarbonylContact C-O 3.43Å; Y1250-Y1263 WeakPolarHBondContact CA-O 3.24Å; Y1250-H1264 HydrophobicContact CD1-CB 3.91Å; Y1250-H1264 HydrophobicContact CE1-CB 3.66Å; Y1250-V1298 WeakPolarHBondContact O-CA 3.47Å; Y1250-R1299 PolarHBondContact N-O 3Å; Y1250-R1299 PolarHBondContact O-N 2.78Å; Y1250-T1301 HydrophobicContact CE2-CG2 3.78Å
1251	I	91.4	Very high	85	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139.6	176.9	-167.5	173.9	0	0	0	112.6	V1233 E1262 Y1263 L1265 L1285 I1296 R1297 I1314 I1316	V1233-I1251 HydrophobicContact CG1-CD1 4.08Å; I1251-E1262 CarbonylContact O-C 3.56Å; I1251-E1262 WeakPolarHBondContact O-CA 3.43Å; I1251-Y1263 PolarHBondContact N-O 2.92Å; I1251-Y1263 PolarHBondContact O-N 3.04Å; I1251-L1265 HydrophobicContact CB-CD1 4.43Å; I1251-L1265 HydrophobicContact CG2-CD1 4.18Å; I1251-L1265 HydrophobicContact CG2-CD2 3.74Å; I1251-L1265 HydrophobicContact CG2-CG 4.04Å; I1251-L1285 HydrophobicContact CG2-CD1 3.82Å; I1251-I1296 HydrophobicContact CD1-CB 4.38Å; I1251-I1296 HydrophobicContact CD1-CD1 4.04Å; I1251-I1296 HydrophobicContact CD1-CG2 4.33Å; I1251-I1296 HydrophobicContact CG1-CB 4.35Å; I1251-R1297 CarbonylContact C-O 3.46Å; I1251-R1297 VanDerWaalsContact CA-O 3.31Å; I1251-R1297 WeakPolarHBondContact CA-O 3.1Å; I1251-I1314 HydrophobicContact CD1-CD1 4.36Å; I1251-I1314 HydrophobicContact CD1-CG2 4.37Å; I1251-I1316 HydrophobicContact CD1-CD1 4.17Å
1252	T	88.7	Confident	85.5	Confident	11 Å²	11	31.9 Å²	31.9	7%	0.067	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.9	168.7	-40.7	0	0	0	0	109.1	F1254 S1260 I1296 R1297	T1252-F1254 HydrophobicContact CG2-CE2 3.86Å; T1252-F1254 HydrophobicContact CG2-CZ 3.92Å; T1252-S1260 VanDerWaalsContact CG2-O 3.26Å; T1252-S1260 WeakPolarHBondContact CG2-O 3.19Å; T1252-I1296 CarbonylContact O-C 3.56Å; T1252-I1296 VanDerWaalsContact O-CA 3.25Å; T1252-I1296 WeakPolarHBondContact O-CA 3.38Å; T1252-R1297 PolarHBondContact N-O 2.81Å; T1252-R1297 PolarHBondContact O-N 2.85Å
1253	M	90.2	Very high	85.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.3	-179.4	-61.4	-179.9	-69.9	0	0	110.8	Y1231 V1233 E1259 S1260 Y1263 L1285 A1287 L1290 L1293 I1296 I1316	Y1231-M1253 HydrophobicContact CD2-CE 3.94Å; Y1231-M1253 HydrophobicContact CD2-SD 4.47Å; Y1231-M1253 HydrophobicContact CE2-CE 4.47Å; Y1231-M1253 HydrophobicContact CG-CE 4.25Å; Y1231-M1253 HydrophobicContact CG-SD 4.23Å; V1233-M1253 HydrophobicContact CG2-SD 4.47Å; M1253-E1259 CarbonylContact O-C 3.54Å; M1253-E1259 VanDerWaalsContact O-CA 3.25Å; M1253-E1259 WeakPolarHBondContact O-CA 3.43Å; M1253-S1260 PolarHBondContact N-OG 2.78Å; M1253-S1260 PolarHBondContact O-N 2.88Å; M1253-Y1263 HydrophobicContact CE-CD2 4.45Å; M1253-Y1263 HydrophobicContact CE-CE2 4.01Å; M1253-L1285 HydrophobicContact CE-CB 4.28Å; M1253-L1285 HydrophobicContact CE-CD1 4.12Å; M1253-A1287 HydrophobicContact CE-CB 4.01Å; M1253-L1290 HydrophobicContact CB-CD1 3.77Å; M1253-L1290 HydrophobicContact CE-CD1 4.25Å; M1253-L1293 HydrophobicContact CB-CD2 4.23Å; M1253-I1296 HydrophobicContact CG-CG2 4.18Å; M1253-I1316 HydrophobicContact CG-CD1 4.21Å; M1253-I1316 HydrophobicContact SD-CD1 3.97Å; M1253-I1316 HydrophobicContact SD-CG2 4.45Å
1254	F	86	Confident	85.9	Confident	13 Å²	13	27 Å²	27	6%	0.057	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.4	-178.1	-54.1	-111	0	0	0	109.9	T1252 E1259 K1294 K1295 R1297	T1252-F1254 HydrophobicContact CG2-CE2 3.86Å; T1252-F1254 HydrophobicContact CG2-CZ 3.92Å; F1254-E1259 HydrophobicContact CB-CB 4.43Å; F1254-E1259 HydrophobicContact CD1-CB 3.57Å; F1254-E1259 HydrophobicContact CD1-CG 4.43Å; F1254-E1259 VanDerWaalsContact CD1-OE2 3.27Å; F1254-E1259 WeakPolarHBondContact CD1-OE2 3.21Å; F1254-E1259 HydrophobicContact CE1-CB 4.05Å; F1254-E1259 WeakPolarHBondContact CE1-OE2 3.5Å; F1254-E1259 HydrophobicContact CG-CB 4.05Å; F1254-K1294 PolarHBondContact O-N 2.86Å; F1254-K1295 HydrophobicContact CB-CG 3.6Å; F1254-K1295 WeakPolarHBondContact CB-O 3.27Å; F1254-K1295 HydrophobicContact CD1-CG 4.4Å; F1254-K1295 HydrophobicContact CD2-CD 4.26Å; F1254-K1295 HydrophobicContact CD2-CG 3.69Å; F1254-K1295 WeakPolarHBondContact CD2-O 3.35Å; F1254-K1295 HydrophobicContact CE2-CG 4.44Å; F1254-K1295 HydrophobicContact CG-CD 4.26Å; F1254-K1295 HydrophobicContact CG-CG 3.67Å; F1254-K1295 PolarHBondContact N-O 2.61Å; F1254-K1295 PolarHBondContact O-N 3.27Å; F1254-R1297 HydrophobicContact CE2-CB 3.7Å; F1254-R1297 HydrophobicContact CZ-CB 4.19Å
1255	G	85.2	Confident	85.9	Confident	11 Å²	11	26.5 Å²	26.5	11%	0.113	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-170.5	179.5	0	0	0	0	0	115.1	N1257 S1258 L1290 S1292	G1255-N1257 PolarHBondContact O-N 2.84Å; G1255-S1258 PolarHBondContact N-O 2.92Å; G1255-L1290 CarbonylContact C-O 3.56Å; G1255-L1290 WeakPolarHBondContact CA-O 3.42Å; G1255-S1292 CarbonylContact C-O 3.5Å; G1255-S1292 WeakPolarHBondContact CA-O 3.44Å
1256	I	77.8	Confident	85.5	Confident	79 Å²	79	27 Å²	27	41%	0.405	14%	0.139	S	C	.	.	S	Bend	trans	-63.4	-30.7	174.1	52.1	160.5	0	0	0	112.7	L1290 S1292 K1294	I1256-L1290 PolarHBondContact N-O 2.97Å; I1256-S1292 PolarHBondContact N-O 3.4Å; I1256-K1294 HydrophobicContact CG2-CD 4.46Å; I1256-K1294 VanDerWaalsContact CG2-CE 3.48Å; I1256-K1294 HydrophobicContact CG2-CG 4.38Å
1257	N	77.1	Confident	85.4	Confident	75 Å²	75	28.2 Å²	28.2	40%	0.401	15%	0.145	S	C	.	.	S	Bend	trans	-108.8	-44.1	-170.1	-61.8	-29	0	0	0	113	L1064 K1065 G1255 L1290	L1064-N1257 CarbonylContact C-O 3.58Å; L1064-N1257 WeakPolarHBondContact CB-O 3.38Å; K1065-N1257 WeakPolarHBondContact CA-O 3.45Å; K1065-N1257 PolarHBondContact N-O 2.88Å; G1255-N1257 PolarHBondContact O-N 2.84Å; N1257-L1290 WeakPolarHBondContact CB-O 3.5Å; N1257-L1290 PolarHBondContact N-O 3.19Å
1258	S	81.6	Confident	85.3	Confident	8 Å²	8	29 Å²	29	6%	0.056	15%	0.151	C	C	.	.			trans	-150.2	179.6	179.6	71.7	0	0	0	0	112.8	G1255 G1289 L1290	G1255-S1258 PolarHBondContact N-O 2.92Å; S1258-G1289 PolarHBondContact OG-O 2.78Å; S1258-L1290 PolarHBondContact N-O 2.76Å; S1258-L1290 WeakPolarHBondContact OG-CA 3.3Å; S1258-L1290 PolarHBondContact OG-N 2.83Å
1259	E	85.4	Confident	85.3	Confident	19 Å²	19	31.5 Å²	31.5	9%	0.089	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-113.5	159.9	168.8	69.9	-151.8	178.5	0	0	110.6	Q1058 Y1060 K1067 K1100 M1253 F1254	Q1058-E1259 PolarHBondContact NE2-OE1 3.01Å; Q1058-E1259 VanDerWaalsContact NE2-OE1 3.11Å; Y1060-E1259 HydrophobicContact CE1-CG 3.93Å; Y1060-E1259 VanDerWaalsContact OH-CG 3.23Å; Y1060-E1259 WeakPolarHBondContact OH-CG 3.47Å; Y1060-E1259 PolarHBondContact OH-OE1 2.89Å; K1067-E1259 WeakPolarHBondContact CD-OE1 3.46Å; K1067-E1259 IonicContact NZ-OE1 2.68Å; K1067-E1259 PolarHBondContact NZ-OE1 3.37Å; K1067-E1259 IonicContact NZ-OE2 3.25Å; K1067-E1259 PolarHBondContact NZ-OE2 3.37Å; K1100-E1259 PolarHBondContact NZ-O 2.88Å; M1253-E1259 CarbonylContact O-C 3.54Å; M1253-E1259 VanDerWaalsContact O-CA 3.25Å; M1253-E1259 WeakPolarHBondContact O-CA 3.43Å; F1254-E1259 HydrophobicContact CB-CB 4.43Å; F1254-E1259 HydrophobicContact CD1-CB 3.57Å; F1254-E1259 HydrophobicContact CD1-CG 4.43Å; F1254-E1259 VanDerWaalsContact CD1-OE2 3.27Å; F1254-E1259 WeakPolarHBondContact CD1-OE2 3.21Å; F1254-E1259 HydrophobicContact CE1-CB 4.05Å; F1254-E1259 WeakPolarHBondContact CE1-OE2 3.5Å; F1254-E1259 HydrophobicContact CG-CB 4.05Å
1260	S	88.5	Confident	85.1	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.021	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-87.6	166.5	175.2	73.8	0	0	0	0	111.6	E1212 T1252 M1253	E1212-S1260 VanDerWaalsContact OE2-CA 3.31Å; E1212-S1260 WeakPolarHBondContact OE2-CA 3.18Å; T1252-S1260 VanDerWaalsContact CG2-O 3.26Å; T1252-S1260 WeakPolarHBondContact CG2-O 3.19Å; M1253-S1260 PolarHBondContact N-OG 2.78Å; M1253-S1260 PolarHBondContact O-N 2.88Å
1261	K	83.4	Confident	84.6	Confident	20 Å²	20	35.5 Å²	35.5	9%	0.087	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-58.9	167.3	154.9	74	179.3	-160.2	171.3	0	111.1	I1102 N1210 E1212 Y1263	I1102-K1261 HydrophobicContact CD1-CB 4.39Å; I1102-K1261 HydrophobicContact CG2-CB 4Å; N1210-K1261 PolarHBondContact O-NZ 3.2Å; N1210-K1261 WeakPolarHBondContact OD1-CD 3.1Å; E1212-K1261 HydrophobicContact CB-CB 4.42Å; E1212-K1261 HydrophobicContact CB-CD 4.38Å; E1212-K1261 HydrophobicContact CG-CD 4.16Å; E1212-K1261 HydrophobicContact CG-CG 4.27Å; E1212-K1261 PolarHBondContact OE2-N 3.5Å; K1261-Y1263 HydrophobicContact CD-CE1 4.4Å; K1261-Y1263 VanDerWaalsContact CE-CE1 3.47Å; K1261-Y1263 HydrophobicContact CG-CE1 4.13Å; K1261-Y1263 HydrophobicContact CG-CE2 4.01Å; K1261-Y1263 WeakPolarHBondContact O-CD2 3.5Å; K1261-Y1263 VanDerWaalsContact O-CE2 3.3Å; K1261-Y1263 WeakPolarHBondContact O-CE2 3.33Å
1262	E	84.2	Confident	83.9	Confident	33 Å²	33	43.7 Å²	43.7	15%	0.154	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-88.8	117.5	177.3	-171.2	179.3	-119.4	0	0	111.3	N1210 Y1250 I1251 R1299	N1210-E1262 PolarHBondContact ND2-O 2.91Å; N1210-E1262 PolarHBondContact OD1-O 3.42Å; Y1250-E1262 HydrophobicContact CD1-CG 4.16Å; Y1250-E1262 HydrophobicContact CG-CG 4.45Å; I1251-E1262 CarbonylContact O-C 3.56Å; I1251-E1262 WeakPolarHBondContact O-CA 3.43Å; E1262-R1299 WeakPolarHBondContact OE1-CD 3.24Å; E1262-R1299 IonicContact OE1-CZ 3.93Å; E1262-R1299 IonicContact OE1-NE 3.16Å; E1262-R1299 PolarHBondContact OE1-NE 3.1Å; E1262-R1299 IonicContact OE1-NH2 3.2Å; E1262-R1299 IonicContact OE2-CZ 3.7Å; E1262-R1299 VanDerWaalsContact OE2-CZ 3.24Å; E1262-R1299 IonicContact OE2-NE 2.95Å; E1262-R1299 PolarHBondContact OE2-NE 3.17Å; E1262-R1299 IonicContact OE2-NH2 2.8Å; E1262-R1299 PolarHBondContact OE2-NH2 2.93Å
1263	Y	86.5	Confident	83.5	Confident	8 Å²	8	47.9 Å²	47.9	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	129.3	-179.4	-59.8	-93	0	0	0	111.3	Y1250 I1251 M1253 K1261 L1285 N1286 A1287	Y1250-Y1263 CarbonylContact C-O 3.43Å; Y1250-Y1263 WeakPolarHBondContact CA-O 3.24Å; I1251-Y1263 PolarHBondContact N-O 2.92Å; I1251-Y1263 PolarHBondContact O-N 3.04Å; M1253-Y1263 HydrophobicContact CE-CD2 4.45Å; M1253-Y1263 HydrophobicContact CE-CE2 4.01Å; K1261-Y1263 HydrophobicContact CD-CE1 4.4Å; K1261-Y1263 VanDerWaalsContact CE-CE1 3.47Å; K1261-Y1263 HydrophobicContact CG-CE1 4.13Å; K1261-Y1263 HydrophobicContact CG-CE2 4.01Å; K1261-Y1263 WeakPolarHBondContact O-CD2 3.5Å; K1261-Y1263 VanDerWaalsContact O-CE2 3.3Å; K1261-Y1263 WeakPolarHBondContact O-CE2 3.33Å; Y1263-L1285 HydrophobicContact CD1-CB 4.4Å; Y1263-L1285 HydrophobicContact CD1-CD1 4.47Å; Y1263-L1285 HydrophobicContact CD1-CD2 3.86Å; Y1263-L1285 HydrophobicContact CD1-CG 4.47Å; Y1263-L1285 HydrophobicContact CD2-CD1 3.92Å; Y1263-L1285 HydrophobicContact CE1-CB 4.42Å; Y1263-L1285 HydrophobicContact CG-CD1 3.88Å; Y1263-L1285 HydrophobicContact CG-CD2 3.92Å; Y1263-L1285 HydrophobicContact CG-CG 4.35Å; Y1263-N1286 PolarHBondContact OH-O 3.39Å; Y1263-A1287 WeakPolarHBondContact OH-CB 3.42Å
1264	H	86.4	Confident	83.3	Confident	34 Å²	34	50.6 Å²	50.6	16%	0.157	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.5	165.6	177.9	-155.4	0	0	0	109.6	H1248 V1249 Y1250 A1266	H1248-H1264 AromaticContact CG-NE2 3.71Å; H1248-H1264 AromaticContact ND1-CE1 3.56Å; H1248-H1264 AromaticContact ND1-NE2 3.17Å; H1248-H1264 PolarHBondContact ND1-NE2 3.41Å; H1248-H1264 VanDerWaalsContact ND1-NE2 3.17Å; V1249-H1264 PolarHBondContact O-CD2 2.98Å; Y1250-H1264 HydrophobicContact CD1-CB 3.91Å; Y1250-H1264 HydrophobicContact CE1-CB 3.66Å; H1264-A1266 PolarHBondContact O-N 2.89Å
1265	L	88.5	Confident	83.5	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	26%	0.261	C	S	.	.			trans	-82.2	64.8	-179.4	-62.7	-174.6	0	0	0	111	V1235 V1249 I1251 K1274 F1275 F1283 L1285	V1235-L1265 HydrophobicContact CG2-CD1 4.06Å; V1249-L1265 HydrophobicContact CG1-CD1 4.2Å; V1249-L1265 PolarHBondContact O-N 2.89Å; I1251-L1265 HydrophobicContact CB-CD1 4.43Å; I1251-L1265 HydrophobicContact CG2-CD1 4.18Å; I1251-L1265 HydrophobicContact CG2-CD2 3.74Å; I1251-L1265 HydrophobicContact CG2-CG 4.04Å; L1265-K1274 WeakPolarHBondContact O-CD 3.21Å; L1265-K1274 WeakPolarHBondContact O-CE 3.43Å; L1265-F1275 HydrophobicContact CB-CZ 3.77Å; L1265-F1275 HydrophobicContact CD1-CZ 4.27Å; L1265-F1283 HydrophobicContact CB-CD1 4.02Å; L1265-F1283 HydrophobicContact CB-CD2 4.38Å; L1265-F1283 HydrophobicContact CB-CE1 3.78Å; L1265-F1283 HydrophobicContact CB-CE2 4.16Å; L1265-F1283 HydrophobicContact CB-CG 4.32Å; L1265-F1283 HydrophobicContact CB-CZ 3.86Å; L1265-F1283 HydrophobicContact CD1-CD2 4.18Å; L1265-F1283 HydrophobicContact CD1-CE2 4.17Å; L1265-F1283 HydrophobicContact CD2-CB 4.01Å; L1265-F1283 HydrophobicContact CD2-CD1 4.18Å; L1265-F1283 HydrophobicContact CD2-CD2 4.1Å; L1265-F1283 HydrophobicContact CD2-CG 3.84Å; L1265-F1283 HydrophobicContact CG-CD2 4.46Å; L1265-F1283 WeakPolarHBondContact O-CE1 3.2Å; L1265-L1285 HydrophobicContact CD2-CD1 4.29Å; L1265-L1285 HydrophobicContact CD2-CD2 4.25Å
1266	A	81.1	Confident	83.7	Confident	18 Å²	18	52.9 Å²	52.9	15%	0.149	27%	0.271	C	S	.	.			trans	-78.6	-40.8	-172.1	0	0	0	0	0	114	H1264 K1274	H1264-A1266 PolarHBondContact O-N 2.89Å; A1266-K1274 WeakPolarHBondContact O-CE 3.5Å; A1266-K1274 PolarHBondContact O-NZ 3.26Å
1267	N	81.5	Confident	84.2	Confident	109 Å²	109	52.7 Å²	52.7	58%	0.583	27%	0.269	S	S	*	.			trans	-121.7	90.4	-163.8	-61.5	-12.6	0	0	0	110.4	F1283	N1267-F1283 WeakPolarHBondContact O-CD1 3.26Å
1268	S	84.8	Confident	84.6	Confident	20 Å²	20	53.6 Å²	53.6	14%	0.14	27%	0.273	C	S	.	.			trans	-70.4	148.4	174	172.2	0	0	0	0	110.5	T1270 H1271 D1281 L1282	S1268-T1270 PolarHBondContact OG-N 3.19Å; S1268-T1270 PolarHBondContact OG-OG1 3Å; S1268-H1271 WeakPolarHBondContact CB-O 3.37Å; S1268-H1271 PolarHBondContact OG-N 2.86Å; S1268-D1281 VanDerWaalsContact CB-OD1 3.31Å; S1268-D1281 WeakPolarHBondContact CB-OD1 3.47Å; S1268-D1281 PolarHBondContact OG-OD1 3.27Å; S1268-L1282 CarbonylContact C-O 3.54Å; S1268-L1282 WeakPolarHBondContact CA-O 3.28Å
1269	K	84.6	Confident	85	Confident	147 Å²	147	57 Å²	57	64%	0.639	29%	0.288	S	S	*	.	S	Bend	trans	-93	-14.4	176.7	-64.6	-62.8	-174.6	180	0	112.9	L1282	K1269-L1282 HydrophobicContact CB-CB 4.24Å; K1269-L1282 HydrophobicContact CB-CD2 4.08Å; K1269-L1282 HydrophobicContact CB-CG 4.06Å; K1269-L1282 WeakPolarHBondContact CB-O 3.31Å; K1269-L1282 HydrophobicContact CG-CG 4.47Å; K1269-L1282 PolarHBondContact N-O 2.91Å
1270	T	84.1	Confident	85.2	Confident	73 Å²	73	59.8 Å²	59.8	45%	0.448	30%	0.301	S	S	.	.	S	Bend	trans	-102.6	-35.6	-179.3	40.6	0	0	0	0	112.6	S1268 E1280 D1281 L1282	S1268-T1270 PolarHBondContact OG-N 3.19Å; S1268-T1270 PolarHBondContact OG-OG1 3Å; T1270-E1280 PolarHBondContact OG1-O 2.83Å; T1270-D1281 WeakPolarHBondContact OG1-CA 3.34Å; T1270-L1282 HydrophobicContact CG2-CB 4.04Å; T1270-L1282 PolarHBondContact OG1-N 3.01Å
1271	H	80.1	Confident	85.4	Confident	62 Å²	62	59.6 Å²	59.6	29%	0.287	30%	0.3	S	S	.	.			trans	-138.5	140.3	-176.5	-47.3	108.8	0	0	0	113.4	S1268 N1273 H1279 E1280 D1281	S1268-H1271 WeakPolarHBondContact CB-O 3.37Å; S1268-H1271 PolarHBondContact OG-N 2.86Å; H1271-N1273 WeakPolarHBondContact CB-O 3.3Å; H1271-H1279 AromaticContact CD2-ND1 3.97Å; H1271-H1279 AromaticContact CE1-ND1 3.88Å; H1271-H1279 AromaticContact ND1-ND1 4Å; H1271-H1279 AromaticContact NE2-ND1 3.86Å; H1271-E1280 PolarHBondContact CE1-O 3.19Å; H1271-E1280 PolarHBondContact ND1-O 3.36Å; H1271-D1281 IonicContact CG-OD1 3.21Å; H1271-D1281 IonicContact ND1-OD1 2.7Å; H1271-D1281 PolarHBondContact ND1-OD1 2.88Å; H1271-D1281 VanDerWaalsContact ND1-OD1 3.08Å
1272	N	76.5	Confident	85.8	Confident	173 Å²	173	60.7 Å²	60.7	93%	0.925	31%	0.307	S	S	*	.	S	Bend	trans	-71.4	-39	174	-71	-22.5	0	0	0	112
1273	N	79.3	Confident	86.2	Confident	98 Å²	98	59.4 Å²	59.4	52%	0.524	30%	0.301	S	S	.	.	S	Bend	trans	-100.1	127.9	167.6	-169.4	24.5	0	0	0	108.5	H1271 E1276	H1271-N1273 WeakPolarHBondContact CB-O 3.3Å; N1273-E1276 PolarHBondContact ND2-OE1 2.76Å
1274	K	86.2	Confident	86.3	Confident	57 Å²	57	63 Å²	63	25%	0.248	32%	0.32	C	S	.	.			trans	-127.1	154.9	-160	57	174	175.2	-73.9	0	110.9	L1265 A1266 E1276 D1281 F1283	L1265-K1274 WeakPolarHBondContact O-CD 3.21Å; L1265-K1274 WeakPolarHBondContact O-CE 3.43Å; A1266-K1274 WeakPolarHBondContact O-CE 3.5Å; A1266-K1274 PolarHBondContact O-NZ 3.26Å; K1274-E1276 VanDerWaalsContact C-N 3.26Å; K1274-D1281 WeakPolarHBondContact CA-OD2 3.24Å; K1274-F1283 HydrophobicContact CD-CE1 4.27Å; K1274-F1283 HydrophobicContact CD-CZ 4.23Å
1275	F	90.1	Very high	86.3	Confident	3 Å²	3	62.1 Å²	62.1	1%	0.013	32%	0.316	C	S	.	.	S	Bend	trans	59.9	35.9	-172.7	-42.7	-58.9	0	0	0	112.9	V1235 T1237 G1244 T1245 V1249 L1265 D1281 F1283 W1309	V1235-F1275 HydrophobicContact CB-CE1 4.23Å; V1235-F1275 HydrophobicContact CG1-CD1 4.17Å; V1235-F1275 HydrophobicContact CG1-CE1 4Å; V1235-F1275 HydrophobicContact CG2-CE1 4.49Å; T1237-F1275 WeakPolarHBondContact OG1-CA 3.38Å; G1244-F1275 CarbonylContact C-O 3.58Å; G1244-F1275 WeakPolarHBondContact CA-O 3.44Å; T1245-F1275 HydrophobicContact CG2-CB 3.85Å; T1245-F1275 HydrophobicContact CG2-CD2 4.46Å; T1245-F1275 HydrophobicContact CG2-CG 4.4Å; T1245-F1275 PolarHBondContact N-O 2.84Å; V1249-F1275 HydrophobicContact CB-CD2 4.29Å; V1249-F1275 HydrophobicContact CB-CE2 3.64Å; V1249-F1275 HydrophobicContact CB-CZ 3.79Å; V1249-F1275 HydrophobicContact CG1-CE2 4.5Å; V1249-F1275 HydrophobicContact CG1-CZ 4.19Å; V1249-F1275 HydrophobicContact CG2-CD2 3.63Å; V1249-F1275 HydrophobicContact CG2-CE2 3.51Å; V1249-F1275 HydrophobicContact CG2-CG 4.19Å; V1249-F1275 HydrophobicContact CG2-CZ 3.99Å; L1265-F1275 HydrophobicContact CB-CZ 3.77Å; L1265-F1275 HydrophobicContact CD1-CZ 4.27Å; F1275-D1281 HydrophobicContact CE1-CB 4.46Å; F1275-D1281 PolarHBondContact N-OD2 3.45Å; F1275-F1283 AromaticContact CE1-CE2 3.79Å; F1275-F1283 HydrophobicContact CE1-CE2 3.79Å; F1275-F1283 AromaticContact CE1-CZ 3.75Å; F1275-F1283 HydrophobicContact CE1-CZ 3.75Å; F1275-F1283 HydrophobicContact CE2-CZ 4.39Å; F1275-F1283 HydrophobicContact CZ-CE1 4.41Å; F1275-F1283 AromaticContact CZ-CE2 3.9Å; F1275-F1283 HydrophobicContact CZ-CE2 3.9Å; F1275-F1283 AromaticContact CZ-CZ 3.47Å; F1275-F1283 HydrophobicContact CZ-CZ 3.47Å; F1275-F1283 VanDerWaalsContact CZ-CZ 3.47Å; F1275-W1309 AromaticContact CD1-CZ2 3.82Å; F1275-W1309 HydrophobicContact CD1-CZ2 3.82Å; F1275-W1309 HydrophobicContact CE1-CZ2 4.33Å; F1275-W1309 HydrophobicContact CG-CZ2 4.36Å
1276	E	89.9	Confident	86.1	Confident	69 Å²	69	65.8 Å²	65.8	32%	0.322	34%	0.336	S	S	.	.			trans	-77.1	157.3	174.5	-82.6	-61.8	166.6	0	0	112.8	T1237 N1273 K1274 N1278 H1279	T1237-E1276 WeakPolarHBondContact CB-O 3.42Å; T1237-E1276 VanDerWaalsContact CG2-O 3.26Å; T1237-E1276 WeakPolarHBondContact CG2-O 3.5Å; N1273-E1276 PolarHBondContact ND2-OE1 2.76Å; K1274-E1276 VanDerWaalsContact C-N 3.26Å; E1276-N1278 PolarHBondContact O-N 3.27Å; E1276-H1279 HydrophobicContact CB-CB 4.03Å; E1276-H1279 WeakPolarHBondContact O-CB 3.25Å; E1276-H1279 PolarHBondContact O-N 2.96Å
1277	Q	88.3	Confident	86.2	Confident	76 Å²	76	65 Å²	65	36%	0.355	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	125.2	-178	-179.4	174.5	-31	0	0	111	G1239 R1240 Y1242 A1243 H1279	G1239-Q1277 PolarHBondContact O-NE2 2.93Å; R1240-Q1277 WeakPolarHBondContact O-CG 3.48Å; R1240-Q1277 PolarHBondContact O-NE2 2.76Å; R1240-Q1277 PolarHBondContact O-OE1 2.79Å; Y1242-Q1277 VanDerWaalsContact N-OE1 3.09Å; A1243-Q1277 HydrophobicContact CB-CG 4.24Å; Q1277-H1279 VanDerWaalsContact C-N 3.28Å; Q1277-H1279 PolarHBondContact O-CD2 2.92Å; Q1277-H1279 PolarHBondContact O-N 3.31Å
1278	N	86.5	Confident	86.2	Confident	94 Å²	94	60.1 Å²	60.1	50%	0.503	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	4.8	-174.3	-158.9	22.1	0	0	0	117.1	K1236 T1237 G1238 E1276	K1236-N1278 WeakPolarHBondContact CE-OD1 3.37Å; K1236-N1278 PolarHBondContact NZ-O 3.16Å; K1236-N1278 PolarHBondContact NZ-OD1 2.78Å; K1236-N1278 VanDerWaalsContact NZ-OD1 3.16Å; T1237-N1278 CarbonylContact O-C 3.53Å; T1237-N1278 WeakPolarHBondContact O-CA 3.34Å; T1237-N1278 PolarHBondContact O-N 2.87Å; G1238-N1278 PolarHBondContact O-N 2.83Å; E1276-N1278 PolarHBondContact O-N 3.27Å
1279	H	88.3	Confident	85.8	Confident	78 Å²	78	59.7 Å²	59.7	36%	0.361	30%	0.303	S	S	.	.			trans	-86.3	159.6	-176.4	-78.7	-145.9	0	0	0	114.3	T1237 H1271 E1276 Q1277	T1237-H1279 PolarHBondContact N-O 2.8Å; H1271-H1279 AromaticContact CD2-ND1 3.97Å; H1271-H1279 AromaticContact CE1-ND1 3.88Å; H1271-H1279 AromaticContact ND1-ND1 4Å; H1271-H1279 AromaticContact NE2-ND1 3.86Å; E1276-H1279 HydrophobicContact CB-CB 4.03Å; E1276-H1279 WeakPolarHBondContact O-CB 3.25Å; E1276-H1279 PolarHBondContact O-N 2.96Å; Q1277-H1279 VanDerWaalsContact C-N 3.28Å; Q1277-H1279 PolarHBondContact O-CD2 2.92Å; Q1277-H1279 PolarHBondContact O-N 3.31Å
1280	E	90.4	Very high	85.7	Confident	78 Å²	78	52.8 Å²	52.8	36%	0.364	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.5	176.1	-74.6	177.2	-128.5	0	0	111.8	V1235 K1236 T1270 H1271 Y1313	V1235-E1280 WeakPolarHBondContact O-CA 3.26Å; K1236-E1280 HydrophobicContact CB-CG 4.21Å; K1236-E1280 HydrophobicContact CD-CG 3.26Å; K1236-E1280 WeakPolarHBondContact CD-OE1 3.38Å; K1236-E1280 HydrophobicContact CG-CG 4.35Å; K1236-E1280 IonicContact NZ-OE1 3.65Å; K1236-E1280 PolarHBondContact NZ-OE1 3.2Å; T1270-E1280 PolarHBondContact OG1-O 2.83Å; H1271-E1280 PolarHBondContact CE1-O 3.19Å; H1271-E1280 PolarHBondContact ND1-O 3.36Å; E1280-Y1313 PolarHBondContact OE1-OH 2.8Å; E1280-Y1313 PolarHBondContact OE2-OH 2.87Å
1281	D	93	Very high	85.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.2	-175.9	-76.1	-65.6	0	0	0	112.6	I1234 V1235 S1268 T1270 H1271 K1274 F1275 F1283	I1234-D1281 CarbonylContact C-O 3.54Å; I1234-D1281 WeakPolarHBondContact CA-O 3.47Å; V1235-D1281 PolarHBondContact N-O 3.3Å; V1235-D1281 PolarHBondContact O-N 2.78Å; S1268-D1281 VanDerWaalsContact CB-OD1 3.31Å; S1268-D1281 WeakPolarHBondContact CB-OD1 3.47Å; S1268-D1281 PolarHBondContact OG-OD1 3.27Å; T1270-D1281 WeakPolarHBondContact OG1-CA 3.34Å; H1271-D1281 IonicContact CG-OD1 3.21Å; H1271-D1281 IonicContact ND1-OD1 2.7Å; H1271-D1281 PolarHBondContact ND1-OD1 2.88Å; H1271-D1281 VanDerWaalsContact ND1-OD1 3.08Å; K1274-D1281 WeakPolarHBondContact CA-OD2 3.24Å; F1275-D1281 HydrophobicContact CE1-CB 4.46Å; F1275-D1281 PolarHBondContact N-OD2 3.45Å; D1281-F1283 HydrophobicContact CB-CE2 3.53Å; D1281-F1283 HydrophobicContact CB-CZ 3.77Å
1282	L	91.8	Very high	85.5	Confident	43 Å²	43	50 Å²	50	23%	0.225	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128	-178.6	171.7	63.1	0	0	0	111.1	E1232 V1233 I1234 S1268 K1269 T1270	E1232-L1282 HydrophobicContact CB-CD1 4.01Å; V1233-L1282 CarbonylContact O-C 3.59Å; V1233-L1282 WeakPolarHBondContact O-CA 3.42Å; I1234-L1282 HydrophobicContact CG1-CD1 3.71Å; S1268-L1282 CarbonylContact C-O 3.54Å; S1268-L1282 WeakPolarHBondContact CA-O 3.28Å; K1269-L1282 HydrophobicContact CB-CB 4.24Å; K1269-L1282 HydrophobicContact CB-CD2 4.08Å; K1269-L1282 HydrophobicContact CB-CG 4.06Å; K1269-L1282 WeakPolarHBondContact CB-O 3.31Å; K1269-L1282 HydrophobicContact CG-CG 4.47Å; K1269-L1282 PolarHBondContact N-O 2.91Å; T1270-L1282 HydrophobicContact CG2-CB 4.04Å; T1270-L1282 PolarHBondContact OG1-N 3.01Å
1283	F	91.7	Very high	86	Confident	6 Å²	6	42.3 Å²	42.3	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.5	176.7	-53.5	-90.9	0	0	0	110.1	V1233 V1235 L1265 N1267 K1274 F1275 D1281	V1233-F1283 PolarHBondContact N-O 3.16Å; V1233-F1283 PolarHBondContact O-N 2.65Å; V1235-F1283 HydrophobicContact CB-CE2 4.5Å; V1235-F1283 HydrophobicContact CG2-CD2 4.2Å; V1235-F1283 HydrophobicContact CG2-CE2 4.06Å; L1265-F1283 HydrophobicContact CB-CD1 4.02Å; L1265-F1283 HydrophobicContact CB-CD2 4.38Å; L1265-F1283 HydrophobicContact CB-CE1 3.78Å; L1265-F1283 HydrophobicContact CB-CE2 4.16Å; L1265-F1283 HydrophobicContact CB-CG 4.32Å; L1265-F1283 HydrophobicContact CB-CZ 3.86Å; L1265-F1283 HydrophobicContact CD1-CD2 4.18Å; L1265-F1283 HydrophobicContact CD1-CE2 4.17Å; L1265-F1283 HydrophobicContact CD2-CB 4.01Å; L1265-F1283 HydrophobicContact CD2-CD1 4.18Å; L1265-F1283 HydrophobicContact CD2-CD2 4.1Å; L1265-F1283 HydrophobicContact CD2-CG 3.84Å; L1265-F1283 HydrophobicContact CG-CD2 4.46Å; L1265-F1283 WeakPolarHBondContact O-CE1 3.2Å; N1267-F1283 WeakPolarHBondContact O-CD1 3.26Å; K1274-F1283 HydrophobicContact CD-CE1 4.27Å; K1274-F1283 HydrophobicContact CD-CZ 4.23Å; F1275-F1283 AromaticContact CE1-CE2 3.79Å; F1275-F1283 HydrophobicContact CE1-CE2 3.79Å; F1275-F1283 AromaticContact CE1-CZ 3.75Å; F1275-F1283 HydrophobicContact CE1-CZ 3.75Å; F1275-F1283 HydrophobicContact CE2-CZ 4.39Å; F1275-F1283 HydrophobicContact CZ-CE1 4.41Å; F1275-F1283 AromaticContact CZ-CE2 3.9Å; F1275-F1283 HydrophobicContact CZ-CE2 3.9Å; F1275-F1283 AromaticContact CZ-CZ 3.47Å; F1275-F1283 HydrophobicContact CZ-CZ 3.47Å; F1275-F1283 VanDerWaalsContact CZ-CZ 3.47Å; D1281-F1283 HydrophobicContact CB-CE2 3.53Å; D1281-F1283 HydrophobicContact CB-CZ 3.77Å
1284	N	88.7	Confident	86.2	Confident	84 Å²	84	43.1 Å²	43.1	45%	0.449	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	122.9	175.7	-65.6	24.1	0	0	0	109	Y1231	Y1231-N1284 WeakPolarHBondContact O-CA 3.38Å
1285	L	87.4	Confident	86.2	Confident	14 Å²	14	41.1 Å²	41.1	7%	0.073	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.6	-178.1	-50.7	-179.6	0	0	0	110.2	Y1231 V1233 I1251 M1253 Y1263 L1265	Y1231-L1285 WeakPolarHBondContact CB-O 3.12Å; Y1231-L1285 PolarHBondContact N-O 3.31Å; Y1231-L1285 PolarHBondContact O-N 3.11Å; V1233-L1285 HydrophobicContact CG2-CD1 3.73Å; V1233-L1285 HydrophobicContact CG2-CG 4.12Å; I1251-L1285 HydrophobicContact CG2-CD1 3.82Å; M1253-L1285 HydrophobicContact CE-CB 4.28Å; M1253-L1285 HydrophobicContact CE-CD1 4.12Å; Y1263-L1285 HydrophobicContact CD1-CB 4.4Å; Y1263-L1285 HydrophobicContact CD1-CD1 4.47Å; Y1263-L1285 HydrophobicContact CD1-CD2 3.86Å; Y1263-L1285 HydrophobicContact CD1-CG 4.47Å; Y1263-L1285 HydrophobicContact CD2-CD1 3.92Å; Y1263-L1285 HydrophobicContact CE1-CB 4.42Å; Y1263-L1285 HydrophobicContact CG-CD1 3.88Å; Y1263-L1285 HydrophobicContact CG-CD2 3.92Å; Y1263-L1285 HydrophobicContact CG-CG 4.35Å; L1265-L1285 HydrophobicContact CD2-CD1 4.29Å; L1265-L1285 HydrophobicContact CD2-CD2 4.25Å
1286	N	83.9	Confident	86.2	Confident	80 Å²	80	41 Å²	41	43%	0.428	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.6	168.9	-67.7	10.9	0	0	0	110	E1228 S1229 Y1263	E1228-N1286 HydrophobicContact CG-CB 3.97Å; E1228-N1286 WeakPolarHBondContact OE1-CB 3.33Å; E1228-N1286 PolarHBondContact OE1-ND2 3.32Å; S1229-N1286 WeakPolarHBondContact O-CA 3.4Å; Y1263-N1286 PolarHBondContact OH-O 3.39Å
1287	A	83.5	Confident	86.1	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.5	174.5	0	0	0	0	0	112.5	S1229 Y1231 M1253 Y1263 L1290	S1229-A1287 PolarHBondContact N-O 3.1Å; S1229-A1287 PolarHBondContact O-N 3.02Å; Y1231-A1287 HydrophobicContact CD2-CB 4.27Å; Y1231-A1287 HydrophobicContact CE2-CB 3.91Å; M1253-A1287 HydrophobicContact CE-CB 4.01Å; Y1263-A1287 WeakPolarHBondContact OH-CB 3.42Å; A1287-L1290 HydrophobicContact CB-CD1 3.81Å; A1287-L1290 HydrophobicContact CB-CD2 4.36Å; A1287-L1290 HydrophobicContact CB-CG 4.04Å
1288	V	81.5	Confident	86.2	Confident	7 Å²	7	35.9 Å²	35.9	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.3	-173.1	-177.7	0	0	0	0	111	K1100 E1212 F1214 L1226 E1228 L1290	K1100-V1288 PolarHBondContact NZ-O 2.59Å; E1212-V1288 PolarHBondContact OE1-N 3.22Å; F1214-V1288 HydrophobicContact CB-CG1 4.31Å; F1214-V1288 HydrophobicContact CD1-CG1 4.25Å; L1226-V1288 HydrophobicContact CB-CG1 4.15Å; E1228-V1288 HydrophobicContact CB-CG2 4.25Å; E1228-V1288 HydrophobicContact CG-CG2 4.19Å; V1288-L1290 PolarHBondContact O-N 2.67Å
1289	G	76.8	Confident	86.3	Confident	11 Å²	11	34.2 Å²	34.2	11%	0.113	18%	0.176	C	C	.	.	S	Bend	trans	69.1	25.1	161.4	0	0	0	0	0	117	M1227 S1258	M1227-G1289 PolarHBondContact O-N 3.06Å; S1258-G1289 PolarHBondContact OG-O 2.78Å
1290	L	81	Confident	86.2	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.159	C	C	.	.			trans	-65.1	-43.2	179.3	-54.6	-171.4	0	0	0	112.2	Y1231 M1253 G1255 I1256 N1257 S1258 A1287 V1288 L1293	Y1231-L1290 HydrophobicContact CE2-CD1 4.01Å; M1253-L1290 HydrophobicContact CB-CD1 3.77Å; M1253-L1290 HydrophobicContact CE-CD1 4.25Å; G1255-L1290 CarbonylContact C-O 3.56Å; G1255-L1290 WeakPolarHBondContact CA-O 3.42Å; I1256-L1290 PolarHBondContact N-O 2.97Å; N1257-L1290 WeakPolarHBondContact CB-O 3.5Å; N1257-L1290 PolarHBondContact N-O 3.19Å; S1258-L1290 PolarHBondContact N-O 2.76Å; S1258-L1290 WeakPolarHBondContact OG-CA 3.3Å; S1258-L1290 PolarHBondContact OG-N 2.83Å; A1287-L1290 HydrophobicContact CB-CD1 3.81Å; A1287-L1290 HydrophobicContact CB-CD2 4.36Å; A1287-L1290 HydrophobicContact CB-CG 4.04Å; V1288-L1290 PolarHBondContact O-N 2.67Å; L1290-L1293 HydrophobicContact CB-CD2 4.31Å; L1290-L1293 HydrophobicContact CD1-CD2 3.82Å
1291	G	78.3	Confident	85.7	Confident	21 Å²	21	28.9 Å²	28.9	22%	0.216	15%	0.154	C	C	.	.			trans	65.1	-177	-160	0	0	0	0	0	111.5	L1293	G1291-L1293 PolarHBondContact O-N 3.34Å
1292	S	82.5	Confident	85.2	Confident	56 Å²	56	31.2 Å²	31.2	39%	0.392	17%	0.167	S	C	.	.	S	Bend	trans	-46.4	128.1	-178.8	-47.9	0	0	0	0	113.2	G1255 I1256 Y1327	G1255-S1292 CarbonylContact C-O 3.5Å; G1255-S1292 WeakPolarHBondContact CA-O 3.44Å; I1256-S1292 PolarHBondContact N-O 3.4Å; S1292-Y1327 WeakPolarHBondContact CA-OH 3.26Å
1293	L	87	Confident	84.6	Confident	11 Å²	11	32.2 Å²	32.2	6%	0.058	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	152.3	-174.2	-60.4	-175.6	0	0	0	112.4	Y1231 M1253 L1290 G1291 I1316 Y1327 F1329 V1350	Y1231-L1293 HydrophobicContact CE1-CD1 4.43Å; M1253-L1293 HydrophobicContact CB-CD2 4.23Å; L1290-L1293 HydrophobicContact CB-CD2 4.31Å; L1290-L1293 HydrophobicContact CD1-CD2 3.82Å; G1291-L1293 PolarHBondContact O-N 3.34Å; L1293-I1316 HydrophobicContact CD1-CB 4.22Å; L1293-I1316 HydrophobicContact CD1-CD1 4.17Å; L1293-I1316 HydrophobicContact CD1-CG2 3.9Å; L1293-Y1327 HydrophobicContact CB-CD1 3.89Å; L1293-Y1327 HydrophobicContact CB-CD2 4.18Å; L1293-Y1327 HydrophobicContact CB-CE1 4.1Å; L1293-Y1327 HydrophobicContact CB-CE2 4.37Å; L1293-Y1327 HydrophobicContact CB-CG 3.93Å; L1293-Y1327 HydrophobicContact CD1-CD2 3.75Å; L1293-Y1327 HydrophobicContact CD1-CE2 4.24Å; L1293-Y1327 HydrophobicContact CD1-CG 4.09Å; L1293-Y1327 HydrophobicContact CG-CD2 3.98Å; L1293-Y1327 HydrophobicContact CG-CE2 4.04Å; L1293-Y1327 HydrophobicContact CG-CG 4.24Å; L1293-F1329 HydrophobicContact CB-CZ 4.16Å; L1293-F1329 HydrophobicContact CD1-CE2 4.37Å; L1293-F1329 HydrophobicContact CD1-CZ 4.22Å; L1293-V1350 HydrophobicContact CB-CG2 4.24Å
1294	K	83.4	Confident	83.9	Confident	115 Å²	115	34.5 Å²	34.5	50%	0.5	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	-47.1	178.8	-74.4	-177.8	176	164.5	0	113.2	F1254 I1256 V1350	F1254-K1294 PolarHBondContact O-N 2.86Å; I1256-K1294 HydrophobicContact CG2-CD 4.46Å; I1256-K1294 VanDerWaalsContact CG2-CE 3.48Å; I1256-K1294 HydrophobicContact CG2-CG 4.38Å; K1294-V1350 PolarHBondContact O-N 3.07Å
1295	K	86.2	Confident	83.2	Confident	16 Å²	16	38.5 Å²	38.5	7%	0.07	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	159.9	176.2	69.4	167.9	179.8	173.6	0	110.5	F1254 E1347 L1348 D1407 I1442	F1254-K1295 HydrophobicContact CB-CG 3.6Å; F1254-K1295 WeakPolarHBondContact CB-O 3.27Å; F1254-K1295 HydrophobicContact CD1-CG 4.4Å; F1254-K1295 HydrophobicContact CD2-CD 4.26Å; F1254-K1295 HydrophobicContact CD2-CG 3.69Å; F1254-K1295 WeakPolarHBondContact CD2-O 3.35Å; F1254-K1295 HydrophobicContact CE2-CG 4.44Å; F1254-K1295 HydrophobicContact CG-CD 4.26Å; F1254-K1295 HydrophobicContact CG-CG 3.67Å; F1254-K1295 PolarHBondContact N-O 2.61Å; F1254-K1295 PolarHBondContact O-N 3.27Å; K1295-E1347 IonicContact NZ-OE1 3.91Å; K1295-E1347 PolarHBondContact NZ-OE1 3.34Å; K1295-E1347 IonicContact NZ-OE2 2.72Å; K1295-E1347 PolarHBondContact NZ-OE2 3.16Å; K1295-L1348 CarbonylContact C-O 3.49Å; K1295-L1348 WeakPolarHBondContact CA-O 3.3Å; K1295-L1348 WeakPolarHBondContact CB-O 3.3Å; K1295-D1407 IonicContact NZ-OD2 2.87Å; K1295-D1407 PolarHBondContact NZ-OD2 3.4Å; K1295-I1442 HydrophobicContact CB-CD1 3.87Å; K1295-I1442 HydrophobicContact CD-CD1 3.55Å; K1295-I1442 HydrophobicContact CG-CD1 4.31Å
1296	I	90.1	Very high	82.8	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	155.8	160.8	59.6	178.3	0	0	0	109.5	I1251 T1252 M1253 I1314 I1316 F1329 E1347 L1348	I1251-I1296 HydrophobicContact CD1-CB 4.38Å; I1251-I1296 HydrophobicContact CD1-CD1 4.04Å; I1251-I1296 HydrophobicContact CD1-CG2 4.33Å; I1251-I1296 HydrophobicContact CG1-CB 4.35Å; T1252-I1296 CarbonylContact O-C 3.56Å; T1252-I1296 VanDerWaalsContact O-CA 3.25Å; T1252-I1296 WeakPolarHBondContact O-CA 3.38Å; M1253-I1296 HydrophobicContact CG-CG2 4.18Å; I1296-I1314 HydrophobicContact CD1-CB 3.89Å; I1296-I1314 HydrophobicContact CD1-CD1 3.73Å; I1296-I1314 HydrophobicContact CD1-CG1 4.32Å; I1296-I1314 HydrophobicContact CD1-CG2 3.95Å; I1296-I1316 HydrophobicContact CG2-CD1 3.8Å; I1296-F1329 HydrophobicContact CB-CD1 4.45Å; I1296-F1329 HydrophobicContact CB-CE1 4.37Å; I1296-F1329 HydrophobicContact CD1-CB 3.66Å; I1296-F1329 HydrophobicContact CD1-CD1 3.95Å; I1296-F1329 HydrophobicContact CD1-CD2 3.91Å; I1296-F1329 HydrophobicContact CD1-CG 3.58Å; I1296-F1329 HydrophobicContact CG1-CB 4.2Å; I1296-F1329 HydrophobicContact CG1-CD1 3.66Å; I1296-F1329 HydrophobicContact CG1-CD2 4.43Å; I1296-F1329 HydrophobicContact CG1-CE1 4.07Å; I1296-F1329 HydrophobicContact CG1-CG 3.86Å; I1296-F1329 HydrophobicContact CG2-CD1 4.25Å; I1296-F1329 HydrophobicContact CG2-CD2 4.4Å; I1296-F1329 HydrophobicContact CG2-CE1 3.82Å; I1296-F1329 HydrophobicContact CG2-CE2 4Å; I1296-F1329 HydrophobicContact CG2-CZ 3.68Å; I1296-E1347 CarbonylContact O-C 3.57Å; I1296-E1347 WeakPolarHBondContact O-CA 3.36Å; I1296-L1348 HydrophobicContact CD1-CD1 4.28Å; I1296-L1348 HydrophobicContact CG1-CB 3.95Å; I1296-L1348 HydrophobicContact CG1-CD1 4.42Å; I1296-L1348 PolarHBondContact N-O 2.84Å; I1296-L1348 PolarHBondContact O-N 2.88Å
1297	R	87.9	Confident	82.7	Confident	38 Å²	38	37.7 Å²	37.7	14%	0.143	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.2	163.1	-176.2	-177.3	-63.2	159.2	-3.9	107.2	I1251 T1252 F1254 I1345 R1346 E1347	I1251-R1297 CarbonylContact C-O 3.46Å; I1251-R1297 VanDerWaalsContact CA-O 3.31Å; I1251-R1297 WeakPolarHBondContact CA-O 3.1Å; T1252-R1297 PolarHBondContact N-O 2.81Å; T1252-R1297 PolarHBondContact O-N 2.85Å; F1254-R1297 HydrophobicContact CE2-CB 3.7Å; F1254-R1297 HydrophobicContact CZ-CB 4.19Å; R1297-I1345 HydrophobicContact CG-CG2 4.05Å; R1297-R1346 CarbonylContact C-O 3.54Å; R1297-R1346 WeakPolarHBondContact CA-O 3.47Å; R1297-E1347 HydrophobicContact CB-CG 4.29Å; R1297-E1347 HydrophobicContact CG-CG 4.17Å; R1297-E1347 IonicContact CZ-OE1 4Å; R1297-E1347 IonicContact NE-OE1 3.71Å; R1297-E1347 PolarHBondContact NE-OE1 3.14Å; R1297-E1347 IonicContact NH2-OE1 3.72Å; R1297-E1347 PolarHBondContact NH2-OE1 2.78Å
1298	V	90.5	Very high	82.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.6	175.5	61.6	0	0	0	0	109	V1249 Y1250 W1309 L1311 I1314 L1335 I1345 R1346 L1348	V1249-V1298 HydrophobicContact CG1-CG2 4.07Å; Y1250-V1298 WeakPolarHBondContact O-CA 3.47Å; V1298-W1309 HydrophobicContact CG2-CH2 4.15Å; V1298-W1309 HydrophobicContact CG2-CZ3 3.81Å; V1298-L1311 HydrophobicContact CG1-CD2 3.9Å; V1298-I1314 HydrophobicContact CB-CD1 4.22Å; V1298-I1314 HydrophobicContact CG1-CD1 4.4Å; V1298-I1314 HydrophobicContact CG2-CD1 4.12Å; V1298-L1335 HydrophobicContact CG1-CD2 4.39Å; V1298-I1345 CarbonylContact O-C 3.38Å; V1298-I1345 WeakPolarHBondContact O-CA 3.46Å; V1298-R1346 HydrophobicContact CG1-CB 4.03Å; V1298-R1346 PolarHBondContact N-O 2.9Å; V1298-R1346 PolarHBondContact O-N 2.98Å; V1298-L1348 HydrophobicContact CG1-CD1 4.14Å
1299	R	87.5	Confident	83	Confident	58 Å²	58	37.9 Å²	37.9	22%	0.219	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	164.6	179	67.9	171.4	-171.8	81.3	1.7	112.2	V1249 Y1250 E1262 V1344 I1345	V1249-R1299 CarbonylContact C-O 3.55Å; V1249-R1299 WeakPolarHBondContact CA-O 3.49Å; Y1250-R1299 PolarHBondContact N-O 3Å; Y1250-R1299 PolarHBondContact O-N 2.78Å; E1262-R1299 WeakPolarHBondContact OE1-CD 3.24Å; E1262-R1299 IonicContact OE1-CZ 3.93Å; E1262-R1299 IonicContact OE1-NE 3.16Å; E1262-R1299 PolarHBondContact OE1-NE 3.1Å; E1262-R1299 IonicContact OE1-NH2 3.2Å; E1262-R1299 IonicContact OE2-CZ 3.7Å; E1262-R1299 VanDerWaalsContact OE2-CZ 3.24Å; E1262-R1299 IonicContact OE2-NE 2.95Å; E1262-R1299 PolarHBondContact OE2-NE 3.17Å; E1262-R1299 IonicContact OE2-NH2 2.8Å; E1262-R1299 PolarHBondContact OE2-NH2 2.93Å; R1299-V1344 VanDerWaalsContact CA-O 3.26Å; R1299-V1344 WeakPolarHBondContact CA-O 3.5Å; R1299-V1344 WeakPolarHBondContact CB-O 3.35Å; R1299-I1345 HydrophobicContact CB-CB 4.24Å; R1299-I1345 HydrophobicContact CB-CG1 3.82Å; R1299-I1345 HydrophobicContact CB-CG2 4.24Å
1300	H	87.3	Confident	83.6	Confident	3 Å²	3	37.7 Å²	37.7	1%	0.014	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	168.8	165.7	70.2	114.4	0	0	0	111.5	S1247 H1248 V1249 N1302 P1307 L1335 V1344	S1247-H1300 PolarHBondContact OG-ND1 3.4Å; H1248-H1300 VanDerWaalsContact O-CA 3.27Å; H1248-H1300 WeakPolarHBondContact O-CA 3.18Å; V1249-H1300 HydrophobicContact CG2-CB 4.31Å; H1300-N1302 PolarHBondContact ND1-N 3.19Å; H1300-P1307 PolarHBondContact CE1-O 2.82Å; H1300-P1307 PolarHBondContact ND1-O 2.94Å; H1300-P1307 VanDerWaalsContact ND1-O 3.11Å; H1300-L1335 VanDerWaalsContact NE2-C 3.33Å; H1300-L1335 PolarHBondContact NE2-O 2.76Å; H1300-V1344 PolarHBondContact CD2-O 3.02Å; H1300-V1344 PolarHBondContact N-O 2.85Å; H1300-V1344 VanDerWaalsContact NE2-CB 3.3Å; H1300-V1344 WeakPolarHBondContact NE2-CB 3.34Å; H1300-V1344 WeakPolarHBondContact NE2-CG1 3.33Å
1301	T	79.8	Confident	84	Confident	42 Å²	42	37.6 Å²	37.6	26%	0.258	22%	0.222	S	C	.	.			trans	-87.1	-7.4	-173.9	37.1	0	0	0	0	114.3	S1247 H1248 Y1250 T1303	S1247-T1301 PolarHBondContact OG-N 2.77Å; S1247-T1301 VanDerWaalsContact OG-N 3.13Å; S1247-T1301 PolarHBondContact OG-OG1 2.82Å; H1248-T1301 HydrophobicContact CB-CG2 4.17Å; H1248-T1301 WeakPolarHBondContact CB-OG1 3.5Å; H1248-T1301 PolarHBondContact N-OG1 2.75Å; H1248-T1301 VanDerWaalsContact N-OG1 3.14Å; H1248-T1301 PolarHBondContact O-N 2.87Å; H1248-T1301 PolarHBondContact O-OG1 2.82Å; Y1250-T1301 HydrophobicContact CE2-CG2 3.78Å; T1301-T1303 VanDerWaalsContact C-N 3.28Å; T1301-T1303 PolarHBondContact O-N 2.97Å; T1301-T1303 PolarHBondContact OG1-OG1 2.76Å
1302	N	81.7	Confident	84.4	Confident	49 Å²	49	37.9 Å²	37.9	26%	0.262	22%	0.219	S	C	.	.			trans	54.1	42.6	-171.1	-158.9	92.9	0	0	0	113	S1247 H1300 A1337 V1344	S1247-N1302 PolarHBondContact OG-N 3.36Å; H1300-N1302 PolarHBondContact ND1-N 3.19Å; N1302-A1337 VanDerWaalsContact OD1-CB 3.26Å; N1302-A1337 WeakPolarHBondContact OD1-CB 3.22Å; N1302-A1337 PolarHBondContact OD1-N 2.83Å; N1302-V1344 HydrophobicContact CB-CG1 4.13Å
1303	T	79.4	Confident	84.9	Confident	63 Å²	63	36.1 Å²	36.1	39%	0.387	20%	0.203	S	C	.	.			trans	-113.5	161.6	176.7	56	0	0	0	0	111.2	S1247 T1301	S1247-T1303 VanDerWaalsContact CA-O 3.28Å; S1247-T1303 WeakPolarHBondContact CA-O 3.24Å; S1247-T1303 VanDerWaalsContact CB-O 3.26Å; S1247-T1303 WeakPolarHBondContact CB-O 3.32Å; S1247-T1303 PolarHBondContact OG-N 3.19Å; S1247-T1303 VanDerWaalsContact OG-N 3.16Å; T1301-T1303 VanDerWaalsContact C-N 3.28Å; T1301-T1303 PolarHBondContact O-N 2.97Å; T1301-T1303 PolarHBondContact OG1-OG1 2.76Å
1304	G	77.2	Confident	85.2	Confident	54 Å²	54	35.6 Å²	35.6	56%	0.557	20%	0.201	S	C	*	.	S	Bend	trans	97.6	-172.9	-177.7	0	0	0	0	0	113.4
1305	I	75	Confident	85.6	Confident	169 Å²	169	30.4 Å²	30.4	87%	0.867	18%	0.178	S	C	*	.	S	Bend	trans	-85.3	-43.1	-173.5	-61	171.8	0	0	0	110	D1246 P1307	D1246-I1305 WeakPolarHBondContact OD2-CA 3.35Å; D1246-I1305 WeakPolarHBondContact OD2-CB 3.2Å; D1246-I1305 PolarHBondContact OD2-N 2.78Å; I1305-P1307 VanDerWaalsContact C-CD 3.43Å; I1305-P1307 VanDerWaalsContact O-CD 3.26Å; I1305-P1307 WeakPolarHBondContact O-CD 3.42Å
1306	A	78.2	Confident	85.9	Confident	46 Å²	46	29.6 Å²	29.6	38%	0.38	18%	0.175	S	C	.	.	S	Bend	trans	-113.7	76.5	171.9	0	0	0	0	0	110.5	T1245 D1246 G1308	T1245-A1306 WeakPolarHBondContact CA-O 3.36Å; T1245-A1306 PolarHBondContact OG1-O 2.88Å; D1246-A1306 PolarHBondContact N-O 3.39Å; D1246-A1306 PolarHBondContact OD2-N 3.38Å; A1306-G1308 VanDerWaalsContact C-N 3.32Å; A1306-G1308 PolarHBondContact O-N 3.36Å
1307	P	81.5	Confident	85.9	Confident	31 Å²	31	33 Å²	33	20%	0.201	19%	0.188	C	C	.	.			trans	-73	-18.7	-175.5	27.1	-35	0	0	0	114.4	T1245 H1300 I1305	T1245-P1307 PolarHBondContact OG1-O 3.04Å; H1300-P1307 PolarHBondContact CE1-O 2.82Å; H1300-P1307 PolarHBondContact ND1-O 2.94Å; H1300-P1307 VanDerWaalsContact ND1-O 3.11Å; I1305-P1307 VanDerWaalsContact C-CD 3.43Å; I1305-P1307 VanDerWaalsContact O-CD 3.26Å; I1305-P1307 WeakPolarHBondContact O-CD 3.42Å
1308	G	81.8	Confident	85.8	Confident	11 Å²	11	31.5 Å²	31.5	11%	0.113	18%	0.182	C	C	.	.			trans	-84.6	117.9	-174	0	0	0	0	0	113.2	A1306	A1306-G1308 VanDerWaalsContact C-N 3.32Å; A1306-G1308 PolarHBondContact O-N 3.36Å
1309	W	90.1	Very high	84.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.7	-170.9	-171.5	35.7	0	0	0	112	V1235 T1237 A1243 T1245 V1249 F1275 V1298 L1311 W1334 L1335	V1235-W1309 HydrophobicContact CG1-CH2 3.86Å; V1235-W1309 HydrophobicContact CG1-CZ2 3.58Å; T1237-W1309 PolarHBondContact OG1-NE1 3.12Å; A1243-W1309 CarbonylContact O-C 3.48Å; A1243-W1309 WeakPolarHBondContact O-CA 3.28Å; A1243-W1309 VanDerWaalsContact O-CD1 3.27Å; T1245-W1309 HydrophobicContact CG2-CB 3.73Å; T1245-W1309 HydrophobicContact CG2-CD2 3.97Å; T1245-W1309 HydrophobicContact CG2-CG 3.48Å; T1245-W1309 VanDerWaalsContact CG2-CG 3.48Å; V1249-W1309 HydrophobicContact CG1-CH2 3.72Å; V1249-W1309 HydrophobicContact CG1-CZ3 3.74Å; V1249-W1309 HydrophobicContact CG2-CE3 4.4Å; V1249-W1309 HydrophobicContact CG2-CH2 4.33Å; V1249-W1309 HydrophobicContact CG2-CZ3 4.21Å; F1275-W1309 AromaticContact CD1-CZ2 3.82Å; F1275-W1309 HydrophobicContact CD1-CZ2 3.82Å; F1275-W1309 HydrophobicContact CE1-CZ2 4.33Å; F1275-W1309 HydrophobicContact CG-CZ2 4.36Å; V1298-W1309 HydrophobicContact CG2-CH2 4.15Å; V1298-W1309 HydrophobicContact CG2-CZ3 3.81Å; W1309-L1311 HydrophobicContact CD2-CB 4.39Å; W1309-L1311 HydrophobicContact CE3-CB 4.4Å; W1309-L1311 HydrophobicContact CH2-CB 4.4Å; W1309-L1311 HydrophobicContact CH2-CD1 3.81Å; W1309-L1311 HydrophobicContact CH2-CD2 4.14Å; W1309-L1311 HydrophobicContact CH2-CG 4.34Å; W1309-L1311 HydrophobicContact CZ2-CB 4.38Å; W1309-L1311 HydrophobicContact CZ2-CD1 3.75Å; W1309-L1311 HydrophobicContact CZ3-CB 4.41Å; W1309-L1311 HydrophobicContact CZ3-CD2 4.2Å; W1309-W1334 CarbonylContact O-C 3.47Å; W1309-W1334 VanDerWaalsContact O-CA 3.26Å; W1309-W1334 WeakPolarHBondContact O-CA 3.46Å; W1309-W1334 VanDerWaalsContact O-CE3 3.27Å; W1309-L1335 HydrophobicContact CE3-CB 4.47Å; W1309-L1335 HydrophobicContact CE3-CD1 4.2Å; W1309-L1335 HydrophobicContact CE3-CD2 4.15Å; W1309-L1335 HydrophobicContact CZ3-CD2 4.33Å; W1309-L1335 PolarHBondContact N-O 2.83Å; W1309-L1335 PolarHBondContact O-N 2.82Å
1310	F	88.6	Confident	83.8	Confident	7 Å²	7	34.3 Å²	34.3	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	109.7	166.4	-166.9	-88.7	0	0	0	110	G1238 R1240 A1243 D1312 Y1332 W1334	G1238-F1310 PolarHBondContact N-O 3.43Å; R1240-F1310 HydrophobicContact CG-CD1 4.41Å; R1240-F1310 HydrophobicContact CG-CE1 4.42Å; A1243-F1310 HydrophobicContact CB-CB 3.72Å; A1243-F1310 PolarHBondContact O-N 2.87Å; F1310-D1312 WeakPolarHBondContact CD1-OD1 3.34Å; F1310-D1312 VanDerWaalsContact CE1-OD1 3.23Å; F1310-D1312 WeakPolarHBondContact CE1-OD1 3.33Å; F1310-Y1332 WeakPolarHBondContact CZ-O 3.46Å; F1310-W1334 HydrophobicContact CB-CD2 4.1Å; F1310-W1334 HydrophobicContact CB-CE3 3.92Å; F1310-W1334 HydrophobicContact CB-CH2 3.98Å; F1310-W1334 HydrophobicContact CB-CZ2 4.24Å; F1310-W1334 HydrophobicContact CB-CZ3 3.84Å; F1310-W1334 HydrophobicContact CD2-CB 4.44Å; F1310-W1334 AromaticContact CD2-CD1 3.69Å; F1310-W1334 AromaticContact CD2-CD2 3.72Å; F1310-W1334 HydrophobicContact CD2-CD2 3.72Å; F1310-W1334 AromaticContact CD2-CE2 3.61Å; F1310-W1334 HydrophobicContact CD2-CE3 4.39Å; F1310-W1334 AromaticContact CD2-CG 3.74Å; F1310-W1334 HydrophobicContact CD2-CG 3.74Å; F1310-W1334 HydrophobicContact CD2-CZ2 4.15Å; F1310-W1334 AromaticContact CD2-NE1 3.64Å; F1310-W1334 HydrophobicContact CE2-CG 4.42Å; F1310-W1334 HydrophobicContact CG-CD2 4.41Å
1311	L	89.7	Confident	82.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.4	-178.5	175.2	63.8	0	0	0	109.6	V1235 K1236 V1298 W1309 I1314 C1331 Y1332 Q1333 L1335 L1348	V1235-L1311 HydrophobicContact CG1-CD1 3.76Å; K1236-L1311 WeakPolarHBondContact O-CD1 3.48Å; V1298-L1311 HydrophobicContact CG1-CD2 3.9Å; W1309-L1311 HydrophobicContact CD2-CB 4.39Å; W1309-L1311 HydrophobicContact CE3-CB 4.4Å; W1309-L1311 HydrophobicContact CH2-CB 4.4Å; W1309-L1311 HydrophobicContact CH2-CD1 3.81Å; W1309-L1311 HydrophobicContact CH2-CD2 4.14Å; W1309-L1311 HydrophobicContact CH2-CG 4.34Å; W1309-L1311 HydrophobicContact CZ2-CB 4.38Å; W1309-L1311 HydrophobicContact CZ2-CD1 3.75Å; W1309-L1311 HydrophobicContact CZ3-CB 4.41Å; W1309-L1311 HydrophobicContact CZ3-CD2 4.2Å; L1311-I1314 HydrophobicContact CD1-CD1 4.41Å; L1311-I1314 HydrophobicContact CD1-CG1 3.96Å; L1311-I1314 HydrophobicContact CD2-CD1 3.98Å; L1311-I1314 HydrophobicContact CD2-CG1 4.19Å; L1311-C1331 HydrophobicContact CB-CB 4.36Å; L1311-C1331 HydrophobicContact CD2-CB 3.95Å; L1311-C1331 HydrophobicContact CG-CB 3.88Å; L1311-Y1332 VanDerWaalsContact O-CA 3.22Å; L1311-Y1332 WeakPolarHBondContact O-CA 3.36Å; L1311-Y1332 PolarHBondContact O-N 2.73Å; L1311-Q1333 PolarHBondContact N-O 2.88Å; L1311-Q1333 VanDerWaalsContact N-O 3.12Å; L1311-Q1333 PolarHBondContact O-N 2.83Å; L1311-Q1333 VanDerWaalsContact O-N 3.15Å; L1311-L1335 HydrophobicContact CB-CD1 3.89Å; L1311-L1335 HydrophobicContact CD2-CD1 4.4Å; L1311-L1348 HydrophobicContact CD2-CD1 4.25Å
1312	D	87.9	Confident	81	Confident	26 Å²	26	49.5 Å²	49.5	14%	0.139	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-60.5	174.9	-78.5	-3.6	0	0	0	110.3	K1236 G1238 F1310 C1331 Y1332	K1236-D1312 HydrophobicContact CB-CB 4.16Å; K1236-D1312 HydrophobicContact CG-CB 3.69Å; K1236-D1312 PolarHBondContact O-N 2.66Å; G1238-D1312 VanDerWaalsContact CA-OD1 3.3Å; G1238-D1312 WeakPolarHBondContact CA-OD1 3.35Å; G1238-D1312 VanDerWaalsContact CA-OD2 3.24Å; G1238-D1312 WeakPolarHBondContact CA-OD2 3.26Å; F1310-D1312 WeakPolarHBondContact CD1-OD1 3.34Å; F1310-D1312 VanDerWaalsContact CE1-OD1 3.23Å; F1310-D1312 WeakPolarHBondContact CE1-OD1 3.33Å; D1312-C1331 WeakPolarHBondContact O-CA 3.39Å; D1312-C1331 PolarHBondContact O-N 3.05Å; D1312-Y1332 HydrophobicContact CB-CD1 3.81Å; D1312-Y1332 HydrophobicContact CB-CE1 3.65Å; D1312-Y1332 PolarHBondContact O-N 3.28Å
1313	Y	91.5	Very high	79.8	Confident	19 Å²	19	52.6 Å²	52.6	8%	0.075	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	164.3	178.8	63.7	-100.7	0	0	0	113	K1236 E1280 F1328 F1329 W1359	K1236-Y1313 HydrophobicContact CB-CD1 3.78Å; K1236-Y1313 HydrophobicContact CB-CD2 3.92Å; K1236-Y1313 HydrophobicContact CB-CE1 3.53Å; K1236-Y1313 HydrophobicContact CB-CE2 3.66Å; K1236-Y1313 HydrophobicContact CB-CG 3.96Å; K1236-Y1313 VanDerWaalsContact CB-CZ 3.44Å; K1236-Y1313 HydrophobicContact CD-CE1 4.31Å; K1236-Y1313 HydrophobicContact CG-CD1 4.04Å; K1236-Y1313 HydrophobicContact CG-CE1 3.58Å; K1236-Y1313 PolarHBondContact N-O 2.56Å; E1280-Y1313 PolarHBondContact OE1-OH 2.8Å; E1280-Y1313 PolarHBondContact OE2-OH 2.87Å; Y1313-F1328 HydrophobicContact CD1-CE2 4.21Å; Y1313-F1328 HydrophobicContact CD1-CZ 4.45Å; Y1313-F1328 HydrophobicContact CD2-CD2 4.45Å; Y1313-F1328 AromaticContact CD2-CE2 3.76Å; Y1313-F1328 HydrophobicContact CD2-CE2 3.76Å; Y1313-F1328 HydrophobicContact CE2-CE2 4.5Å; Y1313-F1328 AromaticContact CG-CE2 3.62Å; Y1313-F1328 HydrophobicContact CG-CE2 3.62Å; Y1313-F1328 HydrophobicContact CG-CZ 4.12Å; Y1313-F1329 WeakPolarHBondContact CA-O 3.38Å; Y1313-W1359 AromaticContact CD1-NE1 3.96Å; Y1313-W1359 HydrophobicContact CD2-CZ2 4.42Å; Y1313-W1359 AromaticContact CE1-CZ2 3.97Å; Y1313-W1359 HydrophobicContact CE1-CZ2 3.97Å; Y1313-W1359 AromaticContact CE1-NE1 3.73Å; Y1313-W1359 AromaticContact CE2-CZ2 3.83Å; Y1313-W1359 HydrophobicContact CE2-CZ2 3.83Å; Y1313-W1359 AromaticContact CZ-CZ2 3.58Å
1314	I	93.7	Very high	79.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.5	164.9	-60.7	177.6	0	0	0	108.3	V1233 I1234 V1235 I1251 I1296 V1298 L1311 I1316 F1329	V1233-I1314 HydrophobicContact CG1-CG2 3.86Å; I1234-I1314 CarbonylContact O-C 3.6Å; I1234-I1314 VanDerWaalsContact O-CA 3.31Å; I1234-I1314 WeakPolarHBondContact O-CA 3.33Å; V1235-I1314 HydrophobicContact CG1-CG1 4.22Å; V1235-I1314 HydrophobicContact CG2-CG1 4.28Å; I1251-I1314 HydrophobicContact CD1-CD1 4.36Å; I1251-I1314 HydrophobicContact CD1-CG2 4.37Å; I1296-I1314 HydrophobicContact CD1-CB 3.89Å; I1296-I1314 HydrophobicContact CD1-CD1 3.73Å; I1296-I1314 HydrophobicContact CD1-CG1 4.32Å; I1296-I1314 HydrophobicContact CD1-CG2 3.95Å; V1298-I1314 HydrophobicContact CB-CD1 4.22Å; V1298-I1314 HydrophobicContact CG1-CD1 4.4Å; V1298-I1314 HydrophobicContact CG2-CD1 4.12Å; L1311-I1314 HydrophobicContact CD1-CD1 4.41Å; L1311-I1314 HydrophobicContact CD1-CG1 3.96Å; L1311-I1314 HydrophobicContact CD2-CD1 3.98Å; L1311-I1314 HydrophobicContact CD2-CG1 4.19Å; I1314-I1316 HydrophobicContact CG2-CD1 4.33Å; I1314-I1316 HydrophobicContact CG2-CG1 3.95Å; I1314-F1329 HydrophobicContact CB-CB 4.24Å; I1314-F1329 PolarHBondContact N-O 3.04Å; I1314-F1329 WeakPolarHBondContact O-CA 3.47Å; I1314-F1329 WeakPolarHBondContact O-CB 3.47Å; I1314-F1329 PolarHBondContact O-N 2.87Å
1315	L	92.6	Very high	79.3	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.2	173.6	174.8	67.6	0	0	0	108.5	I1234 E1326 F1328 F1356 W1359	I1234-L1315 HydrophobicContact CB-CB 4.34Å; I1234-L1315 HydrophobicContact CD1-CD2 4.21Å; I1234-L1315 PolarHBondContact N-O 3.02Å; I1234-L1315 PolarHBondContact O-N 3.15Å; L1315-E1326 HydrophobicContact CD1-CB 4.32Å; L1315-F1328 HydrophobicContact CD1-CB 4.31Å; L1315-F1328 HydrophobicContact CD1-CD2 4.3Å; L1315-F1356 HydrophobicContact CD1-CE2 3.9Å; L1315-F1356 HydrophobicContact CD1-CZ 3.99Å; L1315-W1359 HydrophobicContact CD2-CH2 4.08Å; L1315-W1359 HydrophobicContact CD2-CZ3 4.42Å
1316	I	93	Very high	80	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	124.9	179.9	-54.4	-171	0	0	0	109.6	Y1231 E1232 V1233 I1251 M1253 L1293 I1296 I1314 E1326 Y1327 F1329	Y1231-I1316 HydrophobicContact CD1-CG2 3.81Å; Y1231-I1316 HydrophobicContact CG-CG2 4.33Å; E1232-I1316 CarbonylContact O-C 3.57Å; E1232-I1316 WeakPolarHBondContact O-CA 3.41Å; V1233-I1316 HydrophobicContact CG1-CD1 4.49Å; V1233-I1316 HydrophobicContact CG1-CG1 4.27Å; V1233-I1316 HydrophobicContact CG2-CD1 4.11Å; V1233-I1316 HydrophobicContact CG2-CG1 4.07Å; V1233-I1316 HydrophobicContact CG2-CG2 4.14Å; I1251-I1316 HydrophobicContact CD1-CD1 4.17Å; M1253-I1316 HydrophobicContact CG-CD1 4.21Å; M1253-I1316 HydrophobicContact SD-CD1 3.97Å; M1253-I1316 HydrophobicContact SD-CG2 4.45Å; L1293-I1316 HydrophobicContact CD1-CB 4.22Å; L1293-I1316 HydrophobicContact CD1-CD1 4.17Å; L1293-I1316 HydrophobicContact CD1-CG2 3.9Å; I1296-I1316 HydrophobicContact CG2-CD1 3.8Å; I1314-I1316 HydrophobicContact CG2-CD1 4.33Å; I1314-I1316 HydrophobicContact CG2-CG1 3.95Å; I1316-E1326 CarbonylContact O-C 3.55Å; I1316-E1326 WeakPolarHBondContact O-CA 3.29Å; I1316-Y1327 PolarHBondContact N-O 2.97Å; I1316-Y1327 PolarHBondContact O-N 3.36Å; I1316-F1329 HydrophobicContact CB-CE2 4.19Å; I1316-F1329 HydrophobicContact CD1-CD2 4.24Å; I1316-F1329 HydrophobicContact CD1-CE2 3.77Å; I1316-F1329 HydrophobicContact CG1-CD2 4.12Å; I1316-F1329 HydrophobicContact CG1-CE2 3.85Å
1317	R	89.8	Confident	80.5	Confident	71 Å²	71	50.8 Å²	50.8	27%	0.268	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	126.1	173.5	-47.9	-175.8	158.9	123.3	3.6	110.8	Y1231 E1232 M1325 E1326	Y1231-R1317 CarbonylContact C-O 2.94Å; Y1231-R1317 VanDerWaalsContact CA-O 3.27Å; Y1231-R1317 WeakPolarHBondContact CA-O 3.24Å; E1232-R1317 HydrophobicContact CB-CB 4.12Å; E1232-R1317 PolarHBondContact N-O 2.99Å; E1232-R1317 PolarHBondContact O-N 2.81Å; E1232-R1317 WeakPolarHBondContact OE2-CD 3.12Å; R1317-M1325 CarbonylContact C-O 3.58Å; R1317-M1325 VanDerWaalsContact CA-O 3.28Å; R1317-M1325 WeakPolarHBondContact CA-O 3.13Å; R1317-E1326 HydrophobicContact CG-CG 4.14Å; R1317-E1326 IonicContact CZ-OE1 2.96Å; R1317-E1326 IonicContact NE-OE1 2.83Å; R1317-E1326 PolarHBondContact NE-OE1 3.48Å; R1317-E1326 IonicContact NH2-OE1 2.75Å; R1317-E1326 PolarHBondContact NH2-OE1 3.14Å; R1317-E1326 VanDerWaalsContact NH2-OE1 3.08Å
1318	E	85.5	Confident	81	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.028	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.3	176.5	177.1	171.1	-128.9	0	0	109.4	Y1231 I1320 M1325 Y1327	Y1231-E1318 HydrophobicContact CD1-CB 3.85Å; Y1231-E1318 HydrophobicContact CD1-CG 4.2Å; Y1231-E1318 HydrophobicContact CE1-CB 3.66Å; Y1231-E1318 HydrophobicContact CE1-CG 3.59Å; Y1231-E1318 VanDerWaalsContact CE1-OE1 3.25Å; Y1231-E1318 WeakPolarHBondContact CE1-OE1 3.46Å; Y1231-E1318 VanDerWaalsContact CZ-OE1 3.28Å; Y1231-E1318 PolarHBondContact OH-OE1 2.93Å; E1318-I1320 HydrophobicContact CG-CD1 3.71Å; E1318-I1320 HydrophobicContact CG-CG1 3.93Å; E1318-M1325 HydrophobicContact CB-CB 4.32Å; E1318-M1325 PolarHBondContact N-O 2.51Å; E1318-M1325 PolarHBondContact O-N 2.92Å; E1318-Y1327 HydrophobicContact CB-CE2 3.85Å; E1318-Y1327 VanDerWaalsContact OE2-CE2 3.31Å; E1318-Y1327 WeakPolarHBondContact OE2-CE2 3.26Å; E1318-Y1327 PolarHBondContact OE2-OH 3.06Å
1319	S	71.4	Confident	81.4	Confident	55 Å²	55	48.9 Å²	48.9	39%	0.385	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	95.6	-178.9	-66.2	0	0	0	0	111.2	S1230	S1230-S1319 PolarHBondContact O-N 2.8Å
1320	I	64.1	Low	81.2	Confident	63 Å²	63	49.8 Å²	49.8	32%	0.323	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.9	176.6	-63.5	170.4	0	0	0	108.9	E1318 Q1322 K1323	E1318-I1320 HydrophobicContact CG-CD1 3.71Å; E1318-I1320 HydrophobicContact CG-CG1 3.93Å; I1320-Q1322 VanDerWaalsContact C-N 3.33Å; I1320-Q1322 PolarHBondContact O-N 3.18Å; I1320-K1323 PolarHBondContact O-N 3.2Å; I1320-K1323 VanDerWaalsContact O-O 3.11Å
1321	E	56.9	Low	81	Confident	157 Å²	157	49.8 Å²	49.8	73%	0.734	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	40	53.4	166.7	-60.7	-175.5	165.3	0	0	114.9	K1323	E1321-K1323 PolarHBondContact O-N 3.29Å; E1321-K1323 VanDerWaalsContact O-N 3.07Å
1322	Q	52.3	Low	80.8	Confident	206 Å²	206	51.7 Å²	51.7	96%	0.963	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	-2.8	-179.5	-55.7	-177.1	-8.4	0	0	117.2	I1320	I1320-Q1322 VanDerWaalsContact C-N 3.33Å; I1320-Q1322 PolarHBondContact O-N 3.18Å
1323	K	55.9	Low	80.5	Confident	115 Å²	115	53.5 Å²	53.5	50%	0.5	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	111.5	168.2	-72.7	-169.9	177.3	-174.2	0	110.4	S50 I1320 E1321 M1325	S50-K1323 PolarHBondContact O-NZ 2.8Å; S50-K1323 PolarHBondContact OG-NZ 3.07Å; I1320-K1323 PolarHBondContact O-N 3.2Å; I1320-K1323 VanDerWaalsContact O-O 3.11Å; E1321-K1323 PolarHBondContact O-N 3.29Å; E1321-K1323 VanDerWaalsContact O-N 3.07Å; K1323-M1325 PolarHBondContact O-N 3.03Å
1324	K	67.4	Low	80	Confident	128 Å²	128	54.1 Å²	54.1	56%	0.557	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	118.3	166.6	-73.1	-159	170.6	-152.8	0	109.4	E1232	E1232-K1324 IonicContact OE1-NZ 2.91Å; E1232-K1324 IonicContact OE2-NZ 2.61Å; E1232-K1324 PolarHBondContact OE2-NZ 3.43Å
1325	M	79.2	Confident	79.7	Confident	94 Å²	94	54.1 Å²	54.1	46%	0.463	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139	169.7	-63	-65	-67	0	0	108.9	R1317 E1318 K1323 Y1327	R1317-M1325 CarbonylContact C-O 3.58Å; R1317-M1325 VanDerWaalsContact CA-O 3.28Å; R1317-M1325 WeakPolarHBondContact CA-O 3.13Å; E1318-M1325 HydrophobicContact CB-CB 4.32Å; E1318-M1325 PolarHBondContact N-O 2.51Å; E1318-M1325 PolarHBondContact O-N 2.92Å; K1323-M1325 PolarHBondContact O-N 3.03Å; M1325-Y1327 HydrophobicContact CB-CE2 4.12Å
1326	E	88.4	Confident	79.1	Confident	55 Å²	55	53.9 Å²	53.9	26%	0.257	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.9	179.8	-57.3	-170.5	117.5	0	0	110.9	L1315 I1316 R1317 F1356 K1360	L1315-E1326 HydrophobicContact CD1-CB 4.32Å; I1316-E1326 CarbonylContact O-C 3.55Å; I1316-E1326 WeakPolarHBondContact O-CA 3.29Å; R1317-E1326 HydrophobicContact CG-CG 4.14Å; R1317-E1326 IonicContact CZ-OE1 2.96Å; R1317-E1326 IonicContact NE-OE1 2.83Å; R1317-E1326 PolarHBondContact NE-OE1 3.48Å; R1317-E1326 IonicContact NH2-OE1 2.75Å; R1317-E1326 PolarHBondContact NH2-OE1 3.14Å; R1317-E1326 VanDerWaalsContact NH2-OE1 3.08Å; E1326-F1356 HydrophobicContact CB-CE1 3.83Å; E1326-F1356 HydrophobicContact CB-CZ 3.59Å; E1326-F1356 HydrophobicContact CG-CZ 4.5Å; E1326-K1360 WeakPolarHBondContact OE2-CE 3.42Å; E1326-K1360 IonicContact OE2-NZ 3.91Å; E1326-K1360 PolarHBondContact OE2-NZ 3.37Å
1327	Y	89.8	Confident	78.2	Confident	17 Å²	17	54.6 Å²	54.6	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.7	-179.5	-54.6	-83.3	0	0	0	109.9	S1292 L1293 I1316 E1318 M1325 V1350	S1292-Y1327 WeakPolarHBondContact CA-OH 3.26Å; L1293-Y1327 HydrophobicContact CB-CD1 3.89Å; L1293-Y1327 HydrophobicContact CB-CD2 4.18Å; L1293-Y1327 HydrophobicContact CB-CE1 4.1Å; L1293-Y1327 HydrophobicContact CB-CE2 4.37Å; L1293-Y1327 HydrophobicContact CB-CG 3.93Å; L1293-Y1327 HydrophobicContact CD1-CD2 3.75Å; L1293-Y1327 HydrophobicContact CD1-CE2 4.24Å; L1293-Y1327 HydrophobicContact CD1-CG 4.09Å; L1293-Y1327 HydrophobicContact CG-CD2 3.98Å; L1293-Y1327 HydrophobicContact CG-CE2 4.04Å; L1293-Y1327 HydrophobicContact CG-CG 4.24Å; I1316-Y1327 PolarHBondContact N-O 2.97Å; I1316-Y1327 PolarHBondContact O-N 3.36Å; E1318-Y1327 HydrophobicContact CB-CE2 3.85Å; E1318-Y1327 VanDerWaalsContact OE2-CE2 3.31Å; E1318-Y1327 WeakPolarHBondContact OE2-CE2 3.26Å; E1318-Y1327 PolarHBondContact OE2-OH 3.06Å; M1325-Y1327 HydrophobicContact CB-CE2 4.12Å; Y1327-V1350 HydrophobicContact CD1-CG1 4.42Å; Y1327-V1350 HydrophobicContact CD1-CG2 4.23Å
1328	F	90.6	Very high	77.3	Confident	1 Å²	1	56.8 Å²	56.8	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.2	-174.2	-177.7	-111.6	0	0	0	111.8	Y1313 L1315 P1330 A1351 F1356 W1359 I1365	Y1313-F1328 HydrophobicContact CD1-CE2 4.21Å; Y1313-F1328 HydrophobicContact CD1-CZ 4.45Å; Y1313-F1328 HydrophobicContact CD2-CD2 4.45Å; Y1313-F1328 AromaticContact CD2-CE2 3.76Å; Y1313-F1328 HydrophobicContact CD2-CE2 3.76Å; Y1313-F1328 HydrophobicContact CE2-CE2 4.5Å; Y1313-F1328 AromaticContact CG-CE2 3.62Å; Y1313-F1328 HydrophobicContact CG-CE2 3.62Å; Y1313-F1328 HydrophobicContact CG-CZ 4.12Å; L1315-F1328 HydrophobicContact CD1-CB 4.31Å; L1315-F1328 HydrophobicContact CD1-CD2 4.3Å; F1328-P1330 HydrophobicContact CD1-CG 4.28Å; F1328-P1330 HydrophobicContact CE1-CB 3.87Å; F1328-P1330 HydrophobicContact CE1-CG 3.97Å; F1328-P1330 HydrophobicContact CZ-CB 4.25Å; F1328-A1351 HydrophobicContact CD1-CB 3.96Å; F1328-A1351 PolarHBondContact O-N 2.79Å; F1328-F1356 HydrophobicContact CB-CD2 3.45Å; F1328-F1356 VanDerWaalsContact CB-CD2 3.45Å; F1328-F1356 HydrophobicContact CB-CE2 3.68Å; F1328-F1356 HydrophobicContact CB-CG 4.06Å; F1328-F1356 HydrophobicContact CB-CZ 4.43Å; F1328-F1356 HydrophobicContact CD1-CD2 4.19Å; F1328-F1356 HydrophobicContact CD2-CD2 4.32Å; F1328-F1356 HydrophobicContact CD2-CE2 4.35Å; F1328-F1356 AromaticContact CG-CD2 3.76Å; F1328-F1356 HydrophobicContact CG-CD2 3.76Å; F1328-F1356 HydrophobicContact CG-CE2 4.13Å; F1328-W1359 HydrophobicContact CD2-CD2 4.18Å; F1328-W1359 HydrophobicContact CD2-CE3 4.12Å; F1328-W1359 HydrophobicContact CD2-CZ3 4.31Å; F1328-W1359 HydrophobicContact CE1-CB 4.3Å; F1328-W1359 HydrophobicContact CE1-CD2 4.39Å; F1328-W1359 HydrophobicContact CE1-CG 4.09Å; F1328-W1359 AromaticContact CE2-CD2 3.57Å; F1328-W1359 HydrophobicContact CE2-CD2 3.57Å; F1328-W1359 AromaticContact CE2-CE2 3.52Å; F1328-W1359 AromaticContact CE2-CE3 3.97Å; F1328-W1359 HydrophobicContact CE2-CE3 3.97Å; F1328-W1359 HydrophobicContact CE2-CG 4.01Å; F1328-W1359 HydrophobicContact CE2-CH2 4.32Å; F1328-W1359 AromaticContact CE2-CZ2 3.93Å; F1328-W1359 HydrophobicContact CE2-CZ2 3.93Å; F1328-W1359 HydrophobicContact CE2-CZ3 4.33Å; F1328-W1359 AromaticContact CE2-NE1 3.84Å; F1328-W1359 HydrophobicContact CZ-CB 4.28Å; F1328-W1359 AromaticContact CZ-CD1 3.65Å; F1328-W1359 AromaticContact CZ-CD2 3.69Å; F1328-W1359 HydrophobicContact CZ-CD2 3.69Å; F1328-W1359 AromaticContact CZ-CE2 3.85Å; F1328-W1359 HydrophobicContact CZ-CE3 4.39Å; F1328-W1359 AromaticContact CZ-CG 3.6Å; F1328-W1359 HydrophobicContact CZ-CG 3.6Å; F1328-W1359 AromaticContact CZ-NE1 3.76Å; F1328-I1365 HydrophobicContact CE1-CD1 3.58Å; F1328-I1365 HydrophobicContact CZ-CD1 3.88Å
1329	F	90.7	Very high	76.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	83.3	-174	-59	-88.4	0	0	0	110.4	L1293 I1296 Y1313 I1314 I1316 L1348 S1349 V1350	L1293-F1329 HydrophobicContact CB-CZ 4.16Å; L1293-F1329 HydrophobicContact CD1-CE2 4.37Å; L1293-F1329 HydrophobicContact CD1-CZ 4.22Å; I1296-F1329 HydrophobicContact CB-CD1 4.45Å; I1296-F1329 HydrophobicContact CB-CE1 4.37Å; I1296-F1329 HydrophobicContact CD1-CB 3.66Å; I1296-F1329 HydrophobicContact CD1-CD1 3.95Å; I1296-F1329 HydrophobicContact CD1-CD2 3.91Å; I1296-F1329 HydrophobicContact CD1-CG 3.58Å; I1296-F1329 HydrophobicContact CG1-CB 4.2Å; I1296-F1329 HydrophobicContact CG1-CD1 3.66Å; I1296-F1329 HydrophobicContact CG1-CD2 4.43Å; I1296-F1329 HydrophobicContact CG1-CE1 4.07Å; I1296-F1329 HydrophobicContact CG1-CG 3.86Å; I1296-F1329 HydrophobicContact CG2-CD1 4.25Å; I1296-F1329 HydrophobicContact CG2-CD2 4.4Å; I1296-F1329 HydrophobicContact CG2-CE1 3.82Å; I1296-F1329 HydrophobicContact CG2-CE2 4Å; I1296-F1329 HydrophobicContact CG2-CZ 3.68Å; Y1313-F1329 WeakPolarHBondContact CA-O 3.38Å; I1314-F1329 HydrophobicContact CB-CB 4.24Å; I1314-F1329 PolarHBondContact N-O 3.04Å; I1314-F1329 WeakPolarHBondContact O-CA 3.47Å; I1314-F1329 WeakPolarHBondContact O-CB 3.47Å; I1314-F1329 PolarHBondContact O-N 2.87Å; I1316-F1329 HydrophobicContact CB-CE2 4.19Å; I1316-F1329 HydrophobicContact CD1-CD2 4.24Å; I1316-F1329 HydrophobicContact CD1-CE2 3.77Å; I1316-F1329 HydrophobicContact CG1-CD2 4.12Å; I1316-F1329 HydrophobicContact CG1-CE2 3.85Å; F1329-L1348 HydrophobicContact CB-CB 4.27Å; F1329-L1348 HydrophobicContact CB-CD1 4.42Å; F1329-L1348 HydrophobicContact CD1-CB 4.4Å; F1329-S1349 WeakPolarHBondContact CD1-O 3.43Å; F1329-V1350 HydrophobicContact CD1-CG2 4.28Å; F1329-V1350 HydrophobicContact CE1-CB 4.2Å; F1329-V1350 HydrophobicContact CE1-CG2 3.34Å; F1329-V1350 HydrophobicContact CE2-CG2 4.33Å; F1329-V1350 HydrophobicContact CZ-CG2 3.38Å
1330	P	86.6	Confident	76.2	Confident	20 Å²	20	61.9 Å²	61.9	13%	0.13	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	149.4	177	28.3	-33.2	0	0	0	111.9	F1328 Y1332 A1351 I1365 L1371	F1328-P1330 HydrophobicContact CD1-CG 4.28Å; F1328-P1330 HydrophobicContact CE1-CB 3.87Å; F1328-P1330 HydrophobicContact CE1-CG 3.97Å; F1328-P1330 HydrophobicContact CZ-CB 4.25Å; P1330-Y1332 HydrophobicContact CB-CD2 4.32Å; P1330-Y1332 HydrophobicContact CB-CE2 3.92Å; P1330-A1351 HydrophobicContact CG-CB 4.06Å; P1330-I1365 HydrophobicContact CB-CD1 4.44Å; P1330-L1371 HydrophobicContact CB-CD2 3.8Å; P1330-L1371 HydrophobicContact CG-CD2 3.32Å
1331	C	84.5	Confident	76.2	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.047	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	-54.6	-177.9	-170	0	0	0	0	113.1	L1311 D1312 Q1333 L1348	L1311-C1331 HydrophobicContact CB-CB 4.36Å; L1311-C1331 HydrophobicContact CD2-CB 3.95Å; L1311-C1331 HydrophobicContact CG-CB 3.88Å; D1312-C1331 WeakPolarHBondContact O-CA 3.39Å; D1312-C1331 PolarHBondContact O-N 3.05Å; C1331-Q1333 WeakPolarHBondContact O-CG 3.42Å; C1331-Q1333 PolarHBondContact O-N 3.3Å; C1331-Q1333 PolarHBondContact O-NE2 3.46Å; C1331-L1348 HydrophobicContact CB-CD1 3.88Å; C1331-L1348 HydrophobicContact CB-CD2 4.05Å
1332	Y	84.8	Confident	76.8	Confident	39 Å²	39	53.5 Å²	53.5	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	43.6	41.6	-177.8	-56.5	-72.4	0	0	0	114.8	F1310 L1311 D1312 P1330 I1365 L1371	F1310-Y1332 WeakPolarHBondContact CZ-O 3.46Å; L1311-Y1332 VanDerWaalsContact O-CA 3.22Å; L1311-Y1332 WeakPolarHBondContact O-CA 3.36Å; L1311-Y1332 PolarHBondContact O-N 2.73Å; D1312-Y1332 HydrophobicContact CB-CD1 3.81Å; D1312-Y1332 HydrophobicContact CB-CE1 3.65Å; D1312-Y1332 PolarHBondContact O-N 3.28Å; P1330-Y1332 HydrophobicContact CB-CD2 4.32Å; P1330-Y1332 HydrophobicContact CB-CE2 3.92Å; Y1332-I1365 HydrophobicContact CE2-CD1 4.02Å; Y1332-I1365 HydrophobicContact CE2-CG1 4.03Å; Y1332-L1371 HydrophobicContact CD2-CD1 4.21Å; Y1332-L1371 HydrophobicContact CE2-CD1 4.36Å
1333	Q	81.5	Confident	77.8	Confident	65 Å²	65	44.5 Å²	44.5	30%	0.304	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	154.3	-172	-82.1	163.6	59.3	0	0	113	L1311 C1331	L1311-Q1333 PolarHBondContact N-O 2.88Å; L1311-Q1333 VanDerWaalsContact N-O 3.12Å; L1311-Q1333 PolarHBondContact O-N 2.83Å; L1311-Q1333 VanDerWaalsContact O-N 3.15Å; C1331-Q1333 WeakPolarHBondContact O-CG 3.42Å; C1331-Q1333 PolarHBondContact O-N 3.3Å; C1331-Q1333 PolarHBondContact O-NE2 3.46Å
1334	W	81.4	Confident	79.1	Confident	31 Å²	31	39.3 Å²	39.3	12%	0.117	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.9	167.9	-69	98.2	0	0	0	110.9	R1240 Y1242 A1243 W1309 F1310 R1339 L1340 R1346	R1240-W1334 HydrophobicContact CB-CZ2 4.42Å; Y1242-W1334 WeakPolarHBondContact O-CH2 3.34Å; Y1242-W1334 WeakPolarHBondContact O-CZ3 3.37Å; A1243-W1334 HydrophobicContact CB-CH2 4.45Å; W1309-W1334 CarbonylContact O-C 3.47Å; W1309-W1334 VanDerWaalsContact O-CA 3.26Å; W1309-W1334 WeakPolarHBondContact O-CA 3.46Å; W1309-W1334 VanDerWaalsContact O-CE3 3.27Å; F1310-W1334 HydrophobicContact CB-CD2 4.1Å; F1310-W1334 HydrophobicContact CB-CE3 3.92Å; F1310-W1334 HydrophobicContact CB-CH2 3.98Å; F1310-W1334 HydrophobicContact CB-CZ2 4.24Å; F1310-W1334 HydrophobicContact CB-CZ3 3.84Å; F1310-W1334 HydrophobicContact CD2-CB 4.44Å; F1310-W1334 AromaticContact CD2-CD1 3.69Å; F1310-W1334 AromaticContact CD2-CD2 3.72Å; F1310-W1334 HydrophobicContact CD2-CD2 3.72Å; F1310-W1334 AromaticContact CD2-CE2 3.61Å; F1310-W1334 HydrophobicContact CD2-CE3 4.39Å; F1310-W1334 AromaticContact CD2-CG 3.74Å; F1310-W1334 HydrophobicContact CD2-CG 3.74Å; F1310-W1334 HydrophobicContact CD2-CZ2 4.15Å; F1310-W1334 AromaticContact CD2-NE1 3.64Å; F1310-W1334 HydrophobicContact CE2-CG 4.42Å; F1310-W1334 HydrophobicContact CG-CD2 4.41Å; W1334-R1339 HydrophobicContact CB-CB 4.42Å; W1334-R1339 HydrophobicContact CG-CB 4.31Å; W1334-L1340 HydrophobicContact CB-CD1 3.88Å; W1334-L1340 HydrophobicContact CB-CG 4.13Å; W1334-L1340 HydrophobicContact CG-CD1 4.28Å; W1334-L1340 HydrophobicContact CG-CG 4.37Å; W1334-R1346 PolarHBondContact O-NH2 2.91Å
1335	L	86.5	Confident	79.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	113.6	156.7	-68.9	81.6	0	0	0	106.5	V1298 H1300 W1309 L1311 L1343 R1346	V1298-L1335 HydrophobicContact CG1-CD2 4.39Å; H1300-L1335 VanDerWaalsContact NE2-C 3.33Å; H1300-L1335 PolarHBondContact NE2-O 2.76Å; W1309-L1335 HydrophobicContact CE3-CB 4.47Å; W1309-L1335 HydrophobicContact CE3-CD1 4.2Å; W1309-L1335 HydrophobicContact CE3-CD2 4.15Å; W1309-L1335 HydrophobicContact CZ3-CD2 4.33Å; W1309-L1335 PolarHBondContact N-O 2.83Å; W1309-L1335 PolarHBondContact O-N 2.82Å; L1311-L1335 HydrophobicContact CB-CD1 3.89Å; L1311-L1335 HydrophobicContact CD2-CD1 4.4Å; L1335-L1343 WeakPolarHBondContact CA-O 3.22Å; L1335-R1346 HydrophobicContact CD1-CG 3.9Å; L1335-R1346 HydrophobicContact CD2-CG 3.87Å; L1335-R1346 HydrophobicContact CG-CG 3.74Å
1336	S	81.5	Confident	80	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.007	16%	0.155	C	C	.	.			trans	-169.1	137.5	-171.4	178.8	0	0	0	0	111.3	T1338 R1339 G1342 L1343	S1336-T1338 PolarHBondContact O-N 3.26Å; S1336-T1338 PolarHBondContact OG-N 3.23Å; S1336-T1338 VanDerWaalsContact OG-N 3.17Å; S1336-T1338 PolarHBondContact OG-OG1 3.44Å; S1336-R1339 PolarHBondContact OG-N 2.91Å; S1336-R1339 VanDerWaalsContact OG-N 3.16Å; S1336-G1342 CarbonylContact O-C 3.49Å; S1336-G1342 WeakPolarHBondContact O-CA 3.34Å; S1336-L1343 PolarHBondContact N-O 2.97Å; S1336-L1343 PolarHBondContact O-N 3.12Å
1337	A	73.6	Confident	79.7	Confident	15 Å²	15	29.3 Å²	29.3	12%	0.124	15%	0.148	C	C	.	.	S	Bend	trans	-70.8	-14.1	171.9	0	0	0	0	0	113.9	N1302 V1344 Y1415	N1302-A1337 VanDerWaalsContact OD1-CB 3.26Å; N1302-A1337 WeakPolarHBondContact OD1-CB 3.22Å; N1302-A1337 PolarHBondContact OD1-N 2.83Å; A1337-V1344 HydrophobicContact CB-CG1 4.08Å; A1337-Y1415 HydrophobicContact CB-CD1 4.39Å; A1337-Y1415 HydrophobicContact CB-CG 4.29Å
1338	T	70.5	Confident	79.4	Confident	118 Å²	118	29.2 Å²	29.2	72%	0.724	15%	0.149	S	C	*	.	S	Bend	trans	-117.9	-17.7	-173.6	57.4	0	0	0	0	114.8	S1336	S1336-T1338 PolarHBondContact O-N 3.26Å; S1336-T1338 PolarHBondContact OG-N 3.23Å; S1336-T1338 VanDerWaalsContact OG-N 3.17Å; S1336-T1338 PolarHBondContact OG-OG1 3.44Å
1339	R	66.8	Low	78.9	Confident	98 Å²	98	30.4 Å²	30.4	37%	0.37	16%	0.157	S	C	.	.	S	Bend	trans	-109.3	156.2	179.2	-59.9	-178	177.8	168.6	2.3	111.9	W1334 S1336 D1341 G1342	W1334-R1339 HydrophobicContact CB-CB 4.42Å; W1334-R1339 HydrophobicContact CG-CB 4.31Å; S1336-R1339 PolarHBondContact OG-N 2.91Å; S1336-R1339 VanDerWaalsContact OG-N 3.16Å; R1339-D1341 PolarHBondContact O-N 3.19Å; R1339-G1342 PolarHBondContact O-N 3.06Å; R1339-G1342 VanDerWaalsContact O-N 3.16Å
1340	L	66.4	Low	78.7	Confident	70 Å²	70	32.4 Å²	32.4	37%	0.366	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	-119.3	-176.5	-62.5	-174.7	0	0	0	113.2	W1334	W1334-L1340 HydrophobicContact CB-CD1 3.88Å; W1334-L1340 HydrophobicContact CB-CG 4.13Å; W1334-L1340 HydrophobicContact CG-CD1 4.28Å; W1334-L1340 HydrophobicContact CG-CG 4.37Å
1341	D	65.6	Low	78.4	Confident	38 Å²	38	32 Å²	32	20%	0.203	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-6.3	-175.3	59.8	-5.7	0	0	0	113.8	R1339 L1343 R1346	R1339-D1341 PolarHBondContact O-N 3.19Å; D1341-L1343 PolarHBondContact OD1-N 3.15Å; D1341-L1343 WeakPolarHBondContact OD2-CD1 3.46Å; D1341-R1346 IonicContact OD1-CZ 2.67Å; D1341-R1346 IonicContact OD1-NH1 2.65Å; D1341-R1346 IonicContact OD1-NH2 3.74Å; D1341-R1346 PolarHBondContact OD1-NH2 2.8Å; D1341-R1346 IonicContact OD2-CZ 3.4Å; D1341-R1346 IonicContact OD2-NH1 3.24Å; D1341-R1346 PolarHBondContact OD2-NH1 2.9Å; D1341-R1346 IonicContact OD2-NH2 3.52Å; D1341-R1346 PolarHBondContact OD2-NH2 2.93Å
1342	G	69.1	Low	78.1	Confident	5 Å²	5	32.9 Å²	32.9	5%	0.052	17%	0.174	C	C	.	.			trans	80.4	13.1	-177.4	0	0	0	0	0	114.2	S1336 R1339	S1336-G1342 CarbonylContact O-C 3.49Å; S1336-G1342 WeakPolarHBondContact O-CA 3.34Å; R1339-G1342 PolarHBondContact O-N 3.06Å; R1339-G1342 VanDerWaalsContact O-N 3.16Å
1343	L	73.9	Confident	77.6	Confident	18 Å²	18	38.5 Å²	38.5	9%	0.094	20%	0.202	C	C	.	.			trans	-94.4	134.2	-179.6	-64	-176.1	0	0	0	112.5	L1335 S1336 D1341 K1440	L1335-L1343 WeakPolarHBondContact CA-O 3.22Å; S1336-L1343 PolarHBondContact N-O 2.97Å; S1336-L1343 PolarHBondContact O-N 3.12Å; D1341-L1343 PolarHBondContact OD1-N 3.15Å; D1341-L1343 WeakPolarHBondContact OD2-CD1 3.46Å; L1343-K1440 HydrophobicContact CD1-CB 3.96Å
1344	V	82	Confident	77.2	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.03	21%	0.211	C	C	.	.	S	Bend	trans	-104.6	15	177.3	-57.9	0	0	0	0	112.2	R1299 H1300 N1302 A1337 Y1415	R1299-V1344 VanDerWaalsContact CA-O 3.26Å; R1299-V1344 WeakPolarHBondContact CA-O 3.5Å; R1299-V1344 WeakPolarHBondContact CB-O 3.35Å; H1300-V1344 PolarHBondContact CD2-O 3.02Å; H1300-V1344 PolarHBondContact N-O 2.85Å; H1300-V1344 VanDerWaalsContact NE2-CB 3.3Å; H1300-V1344 WeakPolarHBondContact NE2-CB 3.34Å; H1300-V1344 WeakPolarHBondContact NE2-CG1 3.33Å; N1302-V1344 HydrophobicContact CB-CG1 4.13Å; A1337-V1344 HydrophobicContact CB-CG1 4.08Å; V1344-Y1415 HydrophobicContact CG1-CE2 4.5Å; V1344-Y1415 HydrophobicContact CG2-CD2 4.36Å; V1344-Y1415 HydrophobicContact CG2-CE2 3.53Å
1345	I	83.6	Confident	77	Confident	34 Å²	34	38.4 Å²	38.4	17%	0.174	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.9	-175	-51	178.4	0	0	0	108.2	R1297 V1298 R1299 I1412	R1297-I1345 HydrophobicContact CG-CG2 4.05Å; V1298-I1345 CarbonylContact O-C 3.38Å; V1298-I1345 WeakPolarHBondContact O-CA 3.46Å; R1299-I1345 HydrophobicContact CB-CB 4.24Å; R1299-I1345 HydrophobicContact CB-CG1 3.82Å; R1299-I1345 HydrophobicContact CB-CG2 4.24Å; I1345-I1412 HydrophobicContact CD1-CG1 4.38Å
1346	R	81.6	Confident	76.8	Confident	10 Å²	10	39.3 Å²	39.3	4%	0.038	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.1	168.7	-59.3	-67.7	171.6	-147.3	1.3	110.2	R1297 V1298 W1334 L1335 D1341 L1348	R1297-R1346 CarbonylContact C-O 3.54Å; R1297-R1346 WeakPolarHBondContact CA-O 3.47Å; V1298-R1346 HydrophobicContact CG1-CB 4.03Å; V1298-R1346 PolarHBondContact N-O 2.9Å; V1298-R1346 PolarHBondContact O-N 2.98Å; W1334-R1346 PolarHBondContact O-NH2 2.91Å; L1335-R1346 HydrophobicContact CD1-CG 3.9Å; L1335-R1346 HydrophobicContact CD2-CG 3.87Å; L1335-R1346 HydrophobicContact CG-CG 3.74Å; D1341-R1346 IonicContact OD1-CZ 2.67Å; D1341-R1346 IonicContact OD1-NH1 2.65Å; D1341-R1346 IonicContact OD1-NH2 3.74Å; D1341-R1346 PolarHBondContact OD1-NH2 2.8Å; D1341-R1346 IonicContact OD2-CZ 3.4Å; D1341-R1346 IonicContact OD2-NH1 3.24Å; D1341-R1346 PolarHBondContact OD2-NH1 2.9Å; D1341-R1346 IonicContact OD2-NH2 3.52Å; D1341-R1346 PolarHBondContact OD2-NH2 2.93Å; R1346-L1348 HydrophobicContact CB-CD2 4.08Å; R1346-L1348 HydrophobicContact CB-CG 4.32Å
1347	E	82.5	Confident	76.7	Confident	23 Å²	23	44.1 Å²	44.1	11%	0.107	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.2	157.4	-62.7	-160.4	140.7	0	0	108.3	K1295 I1296 R1297 I1442	K1295-E1347 IonicContact NZ-OE1 3.91Å; K1295-E1347 PolarHBondContact NZ-OE1 3.34Å; K1295-E1347 IonicContact NZ-OE2 2.72Å; K1295-E1347 PolarHBondContact NZ-OE2 3.16Å; I1296-E1347 CarbonylContact O-C 3.57Å; I1296-E1347 WeakPolarHBondContact O-CA 3.36Å; R1297-E1347 HydrophobicContact CB-CG 4.29Å; R1297-E1347 HydrophobicContact CG-CG 4.17Å; R1297-E1347 IonicContact CZ-OE1 4Å; R1297-E1347 IonicContact NE-OE1 3.71Å; R1297-E1347 PolarHBondContact NE-OE1 3.14Å; R1297-E1347 IonicContact NH2-OE1 3.72Å; R1297-E1347 PolarHBondContact NH2-OE1 2.78Å; E1347-I1442 HydrophobicContact CB-CD1 4.06Å; E1347-I1442 HydrophobicContact CB-CG1 4.21Å; E1347-I1442 WeakPolarHBondContact OE2-CB 3.38Å; E1347-I1442 PolarHBondContact OE2-N 2.73Å
1348	L	83.4	Confident	76.8	Confident	16 Å²	16	48 Å²	48	8%	0.084	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.5	-175.6	-54	175.6	0	0	0	109.3	K1295 I1296 V1298 L1311 F1329 C1331 R1346	K1295-L1348 CarbonylContact C-O 3.49Å; K1295-L1348 WeakPolarHBondContact CA-O 3.3Å; K1295-L1348 WeakPolarHBondContact CB-O 3.3Å; I1296-L1348 HydrophobicContact CD1-CD1 4.28Å; I1296-L1348 HydrophobicContact CG1-CB 3.95Å; I1296-L1348 HydrophobicContact CG1-CD1 4.42Å; I1296-L1348 PolarHBondContact N-O 2.84Å; I1296-L1348 PolarHBondContact O-N 2.88Å; V1298-L1348 HydrophobicContact CG1-CD1 4.14Å; L1311-L1348 HydrophobicContact CD2-CD1 4.25Å; F1329-L1348 HydrophobicContact CB-CB 4.27Å; F1329-L1348 HydrophobicContact CB-CD1 4.42Å; F1329-L1348 HydrophobicContact CD1-CB 4.4Å; C1331-L1348 HydrophobicContact CB-CD1 3.88Å; C1331-L1348 HydrophobicContact CB-CD2 4.05Å; R1346-L1348 HydrophobicContact CB-CD2 4.08Å; R1346-L1348 HydrophobicContact CB-CG 4.32Å
1349	S	81.1	Confident	77.5	Confident	25 Å²	25	45.2 Å²	45.2	18%	0.175	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	155.4	173.3	-55.4	0	0	0	0	111.4	F1329 A1351	F1329-S1349 WeakPolarHBondContact CD1-O 3.43Å; S1349-A1351 PolarHBondContact O-N 2.92Å
1350	V	85.7	Confident	78.2	Confident	42 Å²	42	44.9 Å²	44.9	26%	0.255	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-61.6	127.2	160.7	175.4	0	0	0	0	108.5	L1293 K1294 Y1327 F1329	L1293-V1350 HydrophobicContact CB-CG2 4.24Å; K1294-V1350 PolarHBondContact O-N 3.07Å; Y1327-V1350 HydrophobicContact CD1-CG1 4.42Å; Y1327-V1350 HydrophobicContact CD1-CG2 4.23Å; F1329-V1350 HydrophobicContact CD1-CG2 4.28Å; F1329-V1350 HydrophobicContact CE1-CB 4.2Å; F1329-V1350 HydrophobicContact CE1-CG2 3.34Å; F1329-V1350 HydrophobicContact CE2-CG2 4.33Å; F1329-V1350 HydrophobicContact CZ-CG2 3.38Å
1351	A	81.2	Confident	78.8	Confident	12 Å²	12	45.1 Å²	45.1	10%	0.099	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-70	150.3	174.5	0	0	0	0	0	111.8	F1328 P1330 S1349 I1355 E1374	F1328-A1351 HydrophobicContact CD1-CB 3.96Å; F1328-A1351 PolarHBondContact O-N 2.79Å; P1330-A1351 HydrophobicContact CG-CB 4.06Å; S1349-A1351 PolarHBondContact O-N 2.92Å; A1351-I1355 HydrophobicContact CB-CB 4.24Å; A1351-I1355 HydrophobicContact CB-CG2 4.24Å; A1351-E1374 WeakPolarHBondContact CA-OE2 3.45Å
1352	S	76.6	Confident	79.3	Confident	26 Å²	26	46.6 Å²	46.6	18%	0.182	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-65.4	153.8	175.1	73.2	0	0	0	0	112.1	N1354 I1355 F1356 E1374	S1352-N1354 PolarHBondContact O-N 3.47Å; S1352-N1354 VanDerWaalsContact O-N 3.12Å; S1352-I1355 PolarHBondContact O-N 3.33Å; S1352-F1356 PolarHBondContact O-N 2.81Å; S1352-E1374 WeakPolarHBondContact CB-OE1 3.47Å; S1352-E1374 PolarHBondContact N-OE2 3.39Å; S1352-E1374 PolarHBondContact OG-OE1 3.17Å
1353	E	75.2	Confident	79.5	Confident	157 Å²	157	50.8 Å²	50.8	73%	0.734	27%	0.271	S	S	*	.	H	α-helix	trans	-53	-34	176.8	-157.1	162.1	-153.1	0	0	111.6	I1355 F1356 E1357	E1353-I1355 VanDerWaalsContact C-N 3.33Å; E1353-I1355 PolarHBondContact O-N 2.97Å; E1353-F1356 PolarHBondContact O-N 2.87Å; E1353-E1357 WeakPolarHBondContact O-CB 3.4Å; E1353-E1357 WeakPolarHBondContact O-CG 3.25Å; E1353-E1357 PolarHBondContact O-N 2.82Å
1354	N	72.9	Confident	79.3	Confident	93 Å²	93	55.9 Å²	55.9	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-69.3	-20.1	175.4	-67	-45.6	0	0	0	115	S1352 R1370	S1352-N1354 PolarHBondContact O-N 3.47Å; S1352-N1354 VanDerWaalsContact O-N 3.12Å; N1354-R1370 PolarHBondContact O-NH1 2.86Å; N1354-R1370 PolarHBondContact O-NH2 2.94Å
1355	I	77	Confident	79.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-90	-44.6	170.3	-62.5	-170.7	0	0	0	109.3	A1351 S1352 E1353 E1357 R1358 W1359 I1365 R1370 L1371 E1374	A1351-I1355 HydrophobicContact CB-CB 4.24Å; A1351-I1355 HydrophobicContact CB-CG2 4.24Å; S1352-I1355 PolarHBondContact O-N 3.33Å; E1353-I1355 VanDerWaalsContact C-N 3.33Å; E1353-I1355 PolarHBondContact O-N 2.97Å; I1355-E1357 PolarHBondContact O-N 3.06Å; I1355-R1358 PolarHBondContact O-N 2.86Å; I1355-R1358 VanDerWaalsContact O-N 3.14Å; I1355-W1359 PolarHBondContact O-N 3.26Å; I1355-I1365 HydrophobicContact CG2-CD1 3.93Å; I1355-R1370 HydrophobicContact CD1-CB 3.68Å; I1355-R1370 HydrophobicContact CG1-CB 4.12Å; I1355-L1371 HydrophobicContact CD1-CD2 3.8Å; I1355-L1371 HydrophobicContact CD1-CG 4.33Å; I1355-L1371 HydrophobicContact CG2-CD2 3.98Å; I1355-E1374 VanDerWaalsContact CD1-CD 3.48Å; I1355-E1374 WeakPolarHBondContact CD1-OE1 3.2Å; I1355-E1374 WeakPolarHBondContact CD1-OE2 3.46Å
1356	F	82.5	Confident	78.3	Confident	20 Å²	20	56.1 Å²	56.1	9%	0.088	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-42.2	-177.5	-171.7	-148.3	0	0	0	112.6	L1315 E1326 F1328 S1352 E1353 R1358 W1359 K1360	L1315-F1356 HydrophobicContact CD1-CE2 3.9Å; L1315-F1356 HydrophobicContact CD1-CZ 3.99Å; E1326-F1356 HydrophobicContact CB-CE1 3.83Å; E1326-F1356 HydrophobicContact CB-CZ 3.59Å; E1326-F1356 HydrophobicContact CG-CZ 4.5Å; F1328-F1356 HydrophobicContact CB-CD2 3.45Å; F1328-F1356 VanDerWaalsContact CB-CD2 3.45Å; F1328-F1356 HydrophobicContact CB-CE2 3.68Å; F1328-F1356 HydrophobicContact CB-CG 4.06Å; F1328-F1356 HydrophobicContact CB-CZ 4.43Å; F1328-F1356 HydrophobicContact CD1-CD2 4.19Å; F1328-F1356 HydrophobicContact CD2-CD2 4.32Å; F1328-F1356 HydrophobicContact CD2-CE2 4.35Å; F1328-F1356 AromaticContact CG-CD2 3.76Å; F1328-F1356 HydrophobicContact CG-CD2 3.76Å; F1328-F1356 HydrophobicContact CG-CE2 4.13Å; S1352-F1356 PolarHBondContact O-N 2.81Å; E1353-F1356 PolarHBondContact O-N 2.87Å; F1356-R1358 PolarHBondContact O-N 2.86Å; F1356-W1359 AromaticContact CD2-CE3 3.81Å; F1356-W1359 HydrophobicContact CD2-CE3 3.81Å; F1356-W1359 HydrophobicContact CD2-CZ3 4.26Å; F1356-W1359 AromaticContact CE2-CE3 3.77Å; F1356-W1359 HydrophobicContact CE2-CE3 3.77Å; F1356-W1359 AromaticContact CE2-CZ3 3.73Å; F1356-W1359 HydrophobicContact CE2-CZ3 3.73Å; F1356-W1359 PolarHBondContact O-N 3Å; F1356-K1360 HydrophobicContact CD1-CD 4.47Å; F1356-K1360 HydrophobicContact CD2-CD 4.36Å; F1356-K1360 HydrophobicContact CD2-CG 4.35Å; F1356-K1360 HydrophobicContact CE1-CD 4.3Å; F1356-K1360 HydrophobicContact CE2-CD 4.17Å; F1356-K1360 HydrophobicContact CE2-CG 4.22Å; F1356-K1360 HydrophobicContact CZ-CD 4.15Å; F1356-K1360 VanDerWaalsContact CZ-NZ 3.35Å; F1356-K1360 WeakPolarHBondContact O-CB 3.26Å; F1356-K1360 PolarHBondContact O-N 3.06Å
1357	E	79.6	Confident	77.3	Confident	101 Å²	101	60.2 Å²	60.2	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-71.9	-25.4	177.2	-69.8	-56.5	132.9	0	0	113.7	E1353 I1355 K1360 S1361	E1353-E1357 WeakPolarHBondContact O-CB 3.4Å; E1353-E1357 WeakPolarHBondContact O-CG 3.25Å; E1353-E1357 PolarHBondContact O-N 2.82Å; I1355-E1357 PolarHBondContact O-N 3.06Å; E1357-K1360 VanDerWaalsContact OE1-CD 3.27Å; E1357-K1360 WeakPolarHBondContact OE1-CD 3.34Å; E1357-K1360 IonicContact OE1-NZ 3.03Å; E1357-S1361 WeakPolarHBondContact O-CB 3.45Å; E1357-S1361 PolarHBondContact O-N 3.24Å; E1357-S1361 PolarHBondContact O-OG 3.34Å
1358	R	75.8	Confident	76.5	Confident	98 Å²	98	60 Å²	60	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-70.4	-43	169.9	-73.9	-165.7	86.2	-157.9	4.4	111.6	I1355 F1356 S1361 G1362 H1363 I1365 D1368	I1355-R1358 PolarHBondContact O-N 2.86Å; I1355-R1358 VanDerWaalsContact O-N 3.14Å; F1356-R1358 PolarHBondContact O-N 2.86Å; R1358-S1361 WeakPolarHBondContact CA-OG 3.06Å; R1358-S1361 PolarHBondContact O-N 2.88Å; R1358-S1361 PolarHBondContact O-OG 3.27Å; R1358-G1362 PolarHBondContact O-N 2.73Å; R1358-H1363 HydrophobicContact CB-CB 4.36Å; R1358-H1363 WeakPolarHBondContact O-CB 3.45Å; R1358-H1363 PolarHBondContact O-N 2.85Å; R1358-H1363 VanDerWaalsContact O-N 3.08Å; R1358-H1363 PolarHBondContact O-ND1 2.97Å; R1358-I1365 HydrophobicContact CB-CG2 4.16Å; R1358-D1368 IonicContact NH1-OD2 3.56Å; R1358-D1368 PolarHBondContact NH1-OD2 2.82Å
1359	W	84.5	Confident	75.3	Confident	59 Å²	59	59.8 Å²	59.8	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-63.3	-45.1	175.1	175.9	79.6	0	0	0	111.5	Y1313 L1315 F1328 I1355 F1356 S1361 G1362 I1365	Y1313-W1359 AromaticContact CD1-NE1 3.96Å; Y1313-W1359 HydrophobicContact CD2-CZ2 4.42Å; Y1313-W1359 AromaticContact CE1-CZ2 3.97Å; Y1313-W1359 HydrophobicContact CE1-CZ2 3.97Å; Y1313-W1359 AromaticContact CE1-NE1 3.73Å; Y1313-W1359 AromaticContact CE2-CZ2 3.83Å; Y1313-W1359 HydrophobicContact CE2-CZ2 3.83Å; Y1313-W1359 AromaticContact CZ-CZ2 3.58Å; L1315-W1359 HydrophobicContact CD2-CH2 4.08Å; L1315-W1359 HydrophobicContact CD2-CZ3 4.42Å; F1328-W1359 HydrophobicContact CD2-CD2 4.18Å; F1328-W1359 HydrophobicContact CD2-CE3 4.12Å; F1328-W1359 HydrophobicContact CD2-CZ3 4.31Å; F1328-W1359 HydrophobicContact CE1-CB 4.3Å; F1328-W1359 HydrophobicContact CE1-CD2 4.39Å; F1328-W1359 HydrophobicContact CE1-CG 4.09Å; F1328-W1359 AromaticContact CE2-CD2 3.57Å; F1328-W1359 HydrophobicContact CE2-CD2 3.57Å; F1328-W1359 AromaticContact CE2-CE2 3.52Å; F1328-W1359 AromaticContact CE2-CE3 3.97Å; F1328-W1359 HydrophobicContact CE2-CE3 3.97Å; F1328-W1359 HydrophobicContact CE2-CG 4.01Å; F1328-W1359 HydrophobicContact CE2-CH2 4.32Å; F1328-W1359 AromaticContact CE2-CZ2 3.93Å; F1328-W1359 HydrophobicContact CE2-CZ2 3.93Å; F1328-W1359 HydrophobicContact CE2-CZ3 4.33Å; F1328-W1359 AromaticContact CE2-NE1 3.84Å; F1328-W1359 HydrophobicContact CZ-CB 4.28Å; F1328-W1359 AromaticContact CZ-CD1 3.65Å; F1328-W1359 AromaticContact CZ-CD2 3.69Å; F1328-W1359 HydrophobicContact CZ-CD2 3.69Å; F1328-W1359 AromaticContact CZ-CE2 3.85Å; F1328-W1359 HydrophobicContact CZ-CE3 4.39Å; F1328-W1359 AromaticContact CZ-CG 3.6Å; F1328-W1359 HydrophobicContact CZ-CG 3.6Å; F1328-W1359 AromaticContact CZ-NE1 3.76Å; I1355-W1359 PolarHBondContact O-N 3.26Å; F1356-W1359 AromaticContact CD2-CE3 3.81Å; F1356-W1359 HydrophobicContact CD2-CE3 3.81Å; F1356-W1359 HydrophobicContact CD2-CZ3 4.26Å; F1356-W1359 AromaticContact CE2-CE3 3.77Å; F1356-W1359 HydrophobicContact CE2-CE3 3.77Å; F1356-W1359 AromaticContact CE2-CZ3 3.73Å; F1356-W1359 HydrophobicContact CE2-CZ3 3.73Å; F1356-W1359 PolarHBondContact O-N 3Å; W1359-S1361 VanDerWaalsContact C-N 3.29Å; W1359-S1361 PolarHBondContact O-N 2.89Å; W1359-G1362 PolarHBondContact O-N 2.9Å; W1359-I1365 HydrophobicContact CB-CD1 4.03Å; W1359-I1365 HydrophobicContact CB-CG1 4.4Å; W1359-I1365 HydrophobicContact CB-CG2 4.42Å; W1359-I1365 HydrophobicContact CG-CD1 4.3Å
1360	K	81.1	Confident	74.5	Confident	91 Å²	91	60.6 Å²	60.6	40%	0.396	32%	0.324	S	S	.	.	H	α-helix	trans	-59.7	-34.2	173.8	-83	175.9	160.5	172.1	0	114	E1326 F1356 E1357 G1362	E1326-K1360 WeakPolarHBondContact OE2-CE 3.42Å; E1326-K1360 IonicContact OE2-NZ 3.91Å; E1326-K1360 PolarHBondContact OE2-NZ 3.37Å; F1356-K1360 HydrophobicContact CD1-CD 4.47Å; F1356-K1360 HydrophobicContact CD2-CD 4.36Å; F1356-K1360 HydrophobicContact CD2-CG 4.35Å; F1356-K1360 HydrophobicContact CE1-CD 4.3Å; F1356-K1360 HydrophobicContact CE2-CD 4.17Å; F1356-K1360 HydrophobicContact CE2-CG 4.22Å; F1356-K1360 HydrophobicContact CZ-CD 4.15Å; F1356-K1360 VanDerWaalsContact CZ-NZ 3.35Å; F1356-K1360 WeakPolarHBondContact O-CB 3.26Å; F1356-K1360 PolarHBondContact O-N 3.06Å; E1357-K1360 VanDerWaalsContact OE1-CD 3.27Å; E1357-K1360 WeakPolarHBondContact OE1-CD 3.34Å; E1357-K1360 IonicContact OE1-NZ 3.03Å; K1360-G1362 PolarHBondContact O-N 3.29Å
1361	S	80.4	Confident	73.5	Confident	75 Å²	75	60.1 Å²	60.1	52%	0.524	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	15.3	174.7	53.7	0	0	0	0	113.9	E1357 R1358 W1359 H1363	E1357-S1361 WeakPolarHBondContact O-CB 3.45Å; E1357-S1361 PolarHBondContact O-N 3.24Å; E1357-S1361 PolarHBondContact O-OG 3.34Å; R1358-S1361 WeakPolarHBondContact CA-OG 3.06Å; R1358-S1361 PolarHBondContact O-N 2.88Å; R1358-S1361 PolarHBondContact O-OG 3.27Å; W1359-S1361 VanDerWaalsContact C-N 3.29Å; W1359-S1361 PolarHBondContact O-N 2.89Å; S1361-H1363 VanDerWaalsContact C-N 3.31Å; S1361-H1363 PolarHBondContact O-N 3.2Å; S1361-H1363 PolarHBondContact OG-ND1 2.94Å; S1361-H1363 VanDerWaalsContact OG-ND1 3.11Å
1362	G	76.7	Confident	72.6	Confident	69 Å²	69	61.6 Å²	61.6	71%	0.711	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	12.6	172.1	0	0	0	0	0	115.1	R1358 W1359 K1360	R1358-G1362 PolarHBondContact O-N 2.73Å; W1359-G1362 PolarHBondContact O-N 2.9Å; K1360-G1362 PolarHBondContact O-N 3.29Å
1363	H	72.1	Confident	71.7	Confident	93 Å²	93	61.1 Å²	61.1	43%	0.431	32%	0.321	S	S	.	.			trans	-76.8	133.6	172.5	-65.2	82.6	0	0	0	110.2	R1358 S1361 I1365	R1358-H1363 HydrophobicContact CB-CB 4.36Å; R1358-H1363 WeakPolarHBondContact O-CB 3.45Å; R1358-H1363 PolarHBondContact O-N 2.85Å; R1358-H1363 VanDerWaalsContact O-N 3.08Å; R1358-H1363 PolarHBondContact O-ND1 2.97Å; S1361-H1363 VanDerWaalsContact C-N 3.31Å; S1361-H1363 PolarHBondContact O-N 3.2Å; S1361-H1363 PolarHBondContact OG-ND1 2.94Å; S1361-H1363 VanDerWaalsContact OG-ND1 3.11Å; H1363-I1365 PolarHBondContact O-N 2.91Å
1364	D	70.9	Confident	71.1	Confident	124 Å²	124	55.3 Å²	55.3	66%	0.663	29%	0.294	S	S	*	.			trans	-62.1	128.5	164.4	-171.4	-4.5	0	0	0	109.4	S1366	D1364-S1366 VanDerWaalsContact OD1-CB 3.31Å; D1364-S1366 WeakPolarHBondContact OD1-CB 3.5Å; D1364-S1366 PolarHBondContact OD1-N 3.34Å; D1364-S1366 PolarHBondContact OD1-OG 2.86Å; D1364-S1366 PolarHBondContact OD2-OG 2.86Å
1365	I	77.3	Confident	70.6	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.282	C	S	.	.			trans	-116.7	0.1	179.8	57.9	153.8	0	0	0	112.6	F1328 P1330 Y1332 I1355 R1358 W1359 H1363 D1367 D1368 L1371	F1328-I1365 HydrophobicContact CE1-CD1 3.58Å; F1328-I1365 HydrophobicContact CZ-CD1 3.88Å; P1330-I1365 HydrophobicContact CB-CD1 4.44Å; Y1332-I1365 HydrophobicContact CE2-CD1 4.02Å; Y1332-I1365 HydrophobicContact CE2-CG1 4.03Å; I1355-I1365 HydrophobicContact CG2-CD1 3.93Å; R1358-I1365 HydrophobicContact CB-CG2 4.16Å; W1359-I1365 HydrophobicContact CB-CD1 4.03Å; W1359-I1365 HydrophobicContact CB-CG1 4.4Å; W1359-I1365 HydrophobicContact CB-CG2 4.42Å; W1359-I1365 HydrophobicContact CG-CD1 4.3Å; H1363-I1365 PolarHBondContact O-N 2.91Å; I1365-D1367 PolarHBondContact O-N 3.41Å; I1365-D1367 VanDerWaalsContact O-N 3.17Å; I1365-D1368 HydrophobicContact CB-CB 4.24Å; I1365-D1368 WeakPolarHBondContact O-CB 3.14Å; I1365-D1368 PolarHBondContact O-N 2.92Å; I1365-L1371 WeakPolarHBondContact O-CD1 3.29Å
1366	S	66.6	Low	70.1	Confident	43 Å²	43	59.1 Å²	59.1	30%	0.301	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-32.5	-172.8	60.1	0	0	0	0	113.3	D1364	D1364-S1366 VanDerWaalsContact OD1-CB 3.31Å; D1364-S1366 WeakPolarHBondContact OD1-CB 3.5Å; D1364-S1366 PolarHBondContact OD1-N 3.34Å; D1364-S1366 PolarHBondContact OD1-OG 2.86Å; D1364-S1366 PolarHBondContact OD2-OG 2.86Å
1367	D	60.5	Low	69.5	Low	97 Å²	97	58.6 Å²	58.6	52%	0.519	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	10.1	174.5	-81.2	-13	0	0	0	113.9	I1365 S1369 Y1566	I1365-D1367 PolarHBondContact O-N 3.41Å; I1365-D1367 VanDerWaalsContact O-N 3.17Å; D1367-S1369 PolarHBondContact O-N 2.96Å; D1367-Y1566 PolarHBondContact O-OH 3.33Å
1368	D	65.5	Low	69.3	Low	19 Å²	19	53.8 Å²	53.8	10%	0.102	29%	0.287	C	S	.	.			trans	-71.2	116.3	-177.1	-168	-43.2	0	0	0	112.1	R1358 I1365 R1370 L1371	R1358-D1368 IonicContact NH1-OD2 3.56Å; R1358-D1368 PolarHBondContact NH1-OD2 2.82Å; I1365-D1368 HydrophobicContact CB-CB 4.24Å; I1365-D1368 WeakPolarHBondContact O-CB 3.14Å; I1365-D1368 PolarHBondContact O-N 2.92Å; D1368-R1370 PolarHBondContact O-N 2.9Å; D1368-R1370 WeakPolarHBondContact OD1-CB 3.37Å; D1368-R1370 WeakPolarHBondContact OD1-CG 3.43Å; D1368-R1370 IonicContact OD1-CZ 3.48Å; D1368-R1370 PolarHBondContact OD1-N 2.94Å; D1368-R1370 IonicContact OD1-NE 2.74Å; D1368-R1370 PolarHBondContact OD1-NE 3.22Å; D1368-R1370 IonicContact OD1-NH2 3.56Å; D1368-R1370 IonicContact OD2-CZ 3.45Å; D1368-R1370 IonicContact OD2-NE 3.84Å; D1368-R1370 PolarHBondContact OD2-NE 2.87Å; D1368-R1370 IonicContact OD2-NH2 2.82Å; D1368-R1370 PolarHBondContact OD2-NH2 3.39Å; D1368-L1371 WeakPolarHBondContact O-CB 3.31Å; D1368-L1371 PolarHBondContact O-N 3.45Å
1369	S	58.4	Low	69.4	Low	11 Å²	11	51.7 Å²	51.7	8%	0.077	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-20.9	-178.6	54.5	0	0	0	0	115.7	D1367 I1372 L1373 Y1566 R1600	D1367-S1369 PolarHBondContact O-N 2.96Å; S1369-I1372 PolarHBondContact O-N 2.98Å; S1369-L1373 PolarHBondContact O-N 3.29Å; S1369-Y1566 WeakPolarHBondContact CA-OH 3.35Å; S1369-Y1566 WeakPolarHBondContact CB-OH 3.34Å; S1369-Y1566 PolarHBondContact N-OH 2.92Å; S1369-R1600 PolarHBondContact OG-NH1 2.82Å
1370	R	63.6	Low	69.5	Low	41 Å²	41	48.9 Å²	48.9	16%	0.155	27%	0.271	C	S	.	.	H	α-helix	trans	-74.9	-25	180	-60.9	171.7	-61.7	144.8	17	112.4	N1354 I1355 D1368 I1372 L1373 E1374	N1354-R1370 PolarHBondContact O-NH1 2.86Å; N1354-R1370 PolarHBondContact O-NH2 2.94Å; I1355-R1370 HydrophobicContact CD1-CB 3.68Å; I1355-R1370 HydrophobicContact CG1-CB 4.12Å; D1368-R1370 PolarHBondContact O-N 2.9Å; D1368-R1370 WeakPolarHBondContact OD1-CB 3.37Å; D1368-R1370 WeakPolarHBondContact OD1-CG 3.43Å; D1368-R1370 IonicContact OD1-CZ 3.48Å; D1368-R1370 PolarHBondContact OD1-N 2.94Å; D1368-R1370 IonicContact OD1-NE 2.74Å; D1368-R1370 PolarHBondContact OD1-NE 3.22Å; D1368-R1370 IonicContact OD1-NH2 3.56Å; D1368-R1370 IonicContact OD2-CZ 3.45Å; D1368-R1370 IonicContact OD2-NE 3.84Å; D1368-R1370 PolarHBondContact OD2-NE 2.87Å; D1368-R1370 IonicContact OD2-NH2 2.82Å; D1368-R1370 PolarHBondContact OD2-NH2 3.39Å; R1370-I1372 PolarHBondContact O-N 3.13Å; R1370-L1373 HydrophobicContact CG-CD1 4.46Å; R1370-L1373 WeakPolarHBondContact O-CB 3.33Å; R1370-L1373 PolarHBondContact O-N 2.99Å; R1370-L1373 VanDerWaalsContact O-N 3.13Å; R1370-E1374 WeakPolarHBondContact O-CG 3.23Å; R1370-E1374 PolarHBondContact O-N 2.64Å
1371	L	66.1	Low	69.6	Low	33 Å²	33	46.8 Å²	46.8	17%	0.173	26%	0.263	C	S	.	.	H	α-helix	trans	-57.7	-35.4	169.9	-65.1	179.3	0	0	0	112	P1330 Y1332 I1355 I1365 D1368 D1375	P1330-L1371 HydrophobicContact CB-CD2 3.8Å; P1330-L1371 HydrophobicContact CG-CD2 3.32Å; Y1332-L1371 HydrophobicContact CD2-CD1 4.21Å; Y1332-L1371 HydrophobicContact CE2-CD1 4.36Å; I1355-L1371 HydrophobicContact CD1-CD2 3.8Å; I1355-L1371 HydrophobicContact CD1-CG 4.33Å; I1355-L1371 HydrophobicContact CG2-CD2 3.98Å; I1365-L1371 WeakPolarHBondContact O-CD1 3.29Å; D1368-L1371 WeakPolarHBondContact O-CB 3.31Å; D1368-L1371 PolarHBondContact O-N 3.45Å; L1371-D1375 PolarHBondContact O-N 3.45Å; L1371-D1375 VanDerWaalsContact O-N 3.15Å
1372	I	62.1	Low	69.9	Low	43 Å²	43	43.2 Å²	43.2	22%	0.221	24%	0.238	C	C	.	.	H	α-helix	trans	-82.4	-21.8	-179.1	-63.8	168.1	0	0	0	112	S1369 R1370 N1511 Y1566 I1602	S1369-I1372 PolarHBondContact O-N 2.98Å; R1370-I1372 PolarHBondContact O-N 3.13Å; I1372-N1511 HydrophobicContact CG2-CB 4.18Å; I1372-N1511 WeakPolarHBondContact CG2-ND2 3.36Å; I1372-Y1566 HydrophobicContact CD1-CD1 3.52Å; I1372-Y1566 HydrophobicContact CD1-CD2 3.56Å; I1372-Y1566 HydrophobicContact CD1-CE1 3.92Å; I1372-Y1566 HydrophobicContact CD1-CE2 3.96Å; I1372-Y1566 HydrophobicContact CD1-CG 3.3Å; I1372-I1602 HydrophobicContact CG2-CD1 4.46Å
1373	L	56.2	Low	70.4	Confident	16 Å²	16	42.2 Å²	42.2	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-71.4	-41.6	167.2	-79.7	169.6	0	0	0	111.7	S1369 R1370 D1375 I1602 K1603 F1609	S1369-L1373 PolarHBondContact O-N 3.29Å; R1370-L1373 HydrophobicContact CG-CD1 4.46Å; R1370-L1373 WeakPolarHBondContact O-CB 3.33Å; R1370-L1373 PolarHBondContact O-N 2.99Å; R1370-L1373 VanDerWaalsContact O-N 3.13Å; L1373-D1375 VanDerWaalsContact C-N 3.3Å; L1373-I1602 HydrophobicContact CD2-CG2 3.34Å; L1373-I1602 HydrophobicContact CG-CG2 3.57Å; L1373-K1603 VanDerWaalsContact CD2-C 3.47Å; L1373-K1603 WeakPolarHBondContact CD2-O 3.47Å; L1373-F1609 HydrophobicContact CD1-CE1 3.59Å; L1373-F1609 HydrophobicContact CD1-CZ 3.52Å
1374	E	63.3	Low	71.1	Confident	35 Å²	35	37.8 Å²	37.8	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-82.1	-8.2	-175.7	-66.1	174.9	-158.5	0	0	112.9	A1351 S1352 I1355 R1370 Q1376	A1351-E1374 WeakPolarHBondContact CA-OE2 3.45Å; S1352-E1374 WeakPolarHBondContact CB-OE1 3.47Å; S1352-E1374 PolarHBondContact N-OE2 3.39Å; S1352-E1374 PolarHBondContact OG-OE1 3.17Å; I1355-E1374 VanDerWaalsContact CD1-CD 3.48Å; I1355-E1374 WeakPolarHBondContact CD1-OE1 3.2Å; I1355-E1374 WeakPolarHBondContact CD1-OE2 3.46Å; R1370-E1374 WeakPolarHBondContact O-CG 3.23Å; R1370-E1374 PolarHBondContact O-N 2.64Å; E1374-Q1376 PolarHBondContact O-N 2.86Å
1375	D	62.7	Low	71.7	Confident	46 Å²	46	33 Å²	33	25%	0.246	17%	0.166	C	C	.	.			trans	-69.5	88.4	169.8	-168	-9.1	0	0	0	111.6	L1371 L1373 S1377 K1440 K1474	L1371-D1375 PolarHBondContact O-N 3.45Å; L1371-D1375 VanDerWaalsContact O-N 3.15Å; L1373-D1375 VanDerWaalsContact C-N 3.3Å; D1375-S1377 VanDerWaalsContact CG-OG 3.22Å; D1375-S1377 PolarHBondContact O-N 3.01Å; D1375-S1377 WeakPolarHBondContact OD1-CB 3.35Å; D1375-S1377 PolarHBondContact OD1-N 3.2Å; D1375-S1377 PolarHBondContact OD1-OG 2.94Å; D1375-S1377 PolarHBondContact OD2-OG 3.37Å; D1375-K1440 WeakPolarHBondContact OD2-CE 3.44Å; D1375-K1440 IonicContact OD2-NZ 3.65Å; D1375-K1440 PolarHBondContact OD2-NZ 2.69Å; D1375-K1474 PolarHBondContact O-NZ 2.81Å
1376	Q	65.3	Low	71.7	Confident	127 Å²	127	33.2 Å²	33.2	59%	0.593	17%	0.167	S	C	*	.			trans	-71.7	4.2	174.5	-60.6	-170.7	16	0	0	113.8	E1374 I1442 N1443	E1374-Q1376 PolarHBondContact O-N 2.86Å; Q1376-I1442 HydrophobicContact CB-CG2 4.37Å; Q1376-N1443 PolarHBondContact O-N 2.94Å; Q1376-N1443 VanDerWaalsContact O-N 3.14Å
1377	S	69.8	Low	71.7	Confident	8 Å²	8	31.6 Å²	31.6	6%	0.056	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	155.7	175.8	74.2	0	0	0	0	113.8	D1375 K1440 A1441 K1474	D1375-S1377 VanDerWaalsContact CG-OG 3.22Å; D1375-S1377 PolarHBondContact O-N 3.01Å; D1375-S1377 WeakPolarHBondContact OD1-CB 3.35Å; D1375-S1377 PolarHBondContact OD1-N 3.2Å; D1375-S1377 PolarHBondContact OD1-OG 2.94Å; D1375-S1377 PolarHBondContact OD2-OG 3.37Å; S1377-K1440 WeakPolarHBondContact OG-CE 3.44Å; S1377-A1441 CarbonylContact C-O 3.19Å; S1377-A1441 WeakPolarHBondContact CA-O 3.48Å; S1377-A1441 WeakPolarHBondContact CB-O 3.2Å; S1377-K1474 VanDerWaalsContact O-CD 3.25Å; S1377-K1474 WeakPolarHBondContact O-CD 3.5Å; S1377-K1474 WeakPolarHBondContact O-CE 3.47Å; S1377-K1474 PolarHBondContact O-NZ 3.32Å
1378	T	75.6	Confident	72	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.5	172.2	-69.1	0	0	0	0	107.5	Y1380 A1441 A1472 K1474 L1475	T1378-Y1380 HydrophobicContact CG2-CD2 4.02Å; T1378-Y1380 HydrophobicContact CG2-CE1 4.13Å; T1378-Y1380 HydrophobicContact CG2-CE2 3.49Å; T1378-Y1380 VanDerWaalsContact CG2-CE2 3.49Å; T1378-Y1380 WeakPolarHBondContact O-CD2 3.47Å; T1378-A1441 PolarHBondContact N-O 2.82Å; T1378-A1441 PolarHBondContact O-N 3.18Å; T1378-A1472 HydrophobicContact CG2-CB 3.99Å; T1378-K1474 HydrophobicContact CG2-CB 4.14Å; T1378-L1475 HydrophobicContact CG2-CD1 4.48Å; T1378-L1475 HydrophobicContact CG2-CG 4.3Å
1379	I	79.5	Confident	71.5	Confident	53 Å²	53	38.2 Å²	38.2	27%	0.272	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123.3	170.5	-62.8	173.5	0	0	0	108.4	I1438 K1440	I1379-I1438 HydrophobicContact CG2-CG2 3.92Å; I1379-K1440 HydrophobicContact CG1-CG 4.37Å
1380	Y	85	Confident	71.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	109.4	173	-61.2	-95.5	0	0	0	107.5	T1378 L1402 V1439 I1444 I1447 V1470 E1471 A1472 L1475 W1479	T1378-Y1380 HydrophobicContact CG2-CD2 4.02Å; T1378-Y1380 HydrophobicContact CG2-CE1 4.13Å; T1378-Y1380 HydrophobicContact CG2-CE2 3.49Å; T1378-Y1380 VanDerWaalsContact CG2-CE2 3.49Å; T1378-Y1380 WeakPolarHBondContact O-CD2 3.47Å; Y1380-L1402 HydrophobicContact CD1-CD1 4.17Å; Y1380-L1402 HydrophobicContact CG-CD1 3.93Å; Y1380-V1439 PolarHBondContact N-O 3.14Å; Y1380-V1439 PolarHBondContact O-N 3.21Å; Y1380-I1444 HydrophobicContact CE1-CD1 4.3Å; Y1380-I1444 HydrophobicContact CE1-CG1 4.06Å; Y1380-I1444 HydrophobicContact CE2-CG1 4.18Å; Y1380-I1444 VanDerWaalsContact OH-CG1 3.23Å; Y1380-I1444 WeakPolarHBondContact OH-CG1 3.42Å; Y1380-I1444 PolarHBondContact OH-N 3.37Å; Y1380-I1447 HydrophobicContact CD1-CD1 4.23Å; Y1380-I1447 HydrophobicContact CE1-CD1 4.4Å; Y1380-V1470 HydrophobicContact CD1-CG1 4.1Å; Y1380-E1471 WeakPolarHBondContact CA-O 2.99Å; Y1380-A1472 HydrophobicContact CD1-CB 3.65Å; Y1380-A1472 HydrophobicContact CE1-CB 3.64Å; Y1380-A1472 HydrophobicContact CG-CB 4.44Å; Y1380-L1475 HydrophobicContact CE1-CD1 4.24Å; Y1380-W1479 HydrophobicContact CE1-CZ3 4.5Å
1381	H	84.7	Confident	70.9	Confident	47 Å²	47	47 Å²	47	22%	0.218	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.3	170.9	-59.8	-79.6	0	0	0	108.5	F1437 V1470 E1471	H1381-F1437 WeakPolarHBondContact CA-O 3.19Å; H1381-V1470 CarbonylContact O-C 3.6Å; H1381-V1470 WeakPolarHBondContact O-CA 3.14Å; H1381-E1471 HydrophobicContact CB-CB 4.3Å; H1381-E1471 PolarHBondContact N-O 3.12Å; H1381-E1471 PolarHBondContact O-N 2.96Å
1382	V	87.1	Confident	70.6	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.5	179.4	-179	0	0	0	0	108.5	I1384 I1400 L1402 F1437 V1439 V1468 E1469 V1470	V1382-I1384 HydrophobicContact CG1-CG1 4.19Å; V1382-I1400 HydrophobicContact CG1-CD1 3.89Å; V1382-I1400 HydrophobicContact CG2-CD1 4.37Å; V1382-L1402 HydrophobicContact CG2-CD1 4.48Å; V1382-F1437 HydrophobicContact CB-CB 4.41Å; V1382-F1437 PolarHBondContact N-O 3.39Å; V1382-F1437 PolarHBondContact O-N 3.38Å; V1382-V1439 HydrophobicContact CG2-CG2 4.15Å; V1382-V1468 HydrophobicContact CG1-CG1 3.99Å; V1382-E1469 CarbonylContact C-O 3.59Å; V1382-E1469 WeakPolarHBondContact CA-O 3.42Å; V1382-V1470 HydrophobicContact CG2-CG1 4.29Å; V1382-V1470 HydrophobicContact CG2-CG2 4.34Å
1383	R	86.9	Confident	70.5	Confident	49 Å²	49	46.4 Å²	46.4	19%	0.185	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128.5	171.9	-46.2	-170.3	175.6	93.2	13.9	109.6	I1434 A1435 N1436 V1468 E1469 E1471	R1383-I1434 HydrophobicContact CB-CG2 3.92Å; R1383-A1435 WeakPolarHBondContact CA-O 3.44Å; R1383-N1436 WeakPolarHBondContact CD-OD1 3.45Å; R1383-N1436 WeakPolarHBondContact CG-OD1 3.23Å; R1383-N1436 PolarHBondContact NE-OD1 3.27Å; R1383-V1468 CarbonylContact O-C 3.2Å; R1383-V1468 WeakPolarHBondContact O-CA 3.49Å; R1383-E1469 HydrophobicContact CB-CB 4.12Å; R1383-E1469 HydrophobicContact CG-CB 4.34Å; R1383-E1469 IonicContact CZ-OE2 3.67Å; R1383-E1469 PolarHBondContact N-O 3.45Å; R1383-E1469 IonicContact NH1-OE2 3.79Å; R1383-E1469 PolarHBondContact NH1-OE2 2.89Å; R1383-E1469 PolarHBondContact O-N 3.08Å; R1383-E1471 IonicContact CZ-OE2 3.62Å; R1383-E1471 IonicContact NH1-OE2 3.04Å; R1383-E1471 PolarHBondContact NH1-OE2 2.82Å; R1383-E1471 VanDerWaalsContact NH1-OE2 3.11Å; R1383-E1471 IonicContact NH2-OE2 3.22Å; R1383-E1471 PolarHBondContact NH2-OE2 2.97Å
1384	I	85.9	Confident	70.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.6	175	-54.9	-179.6	0	0	0	108.2	V1382 L1414 F1429 A1435 F1437 W1463 V1465 V1468	V1382-I1384 HydrophobicContact CG1-CG1 4.19Å; I1384-L1414 HydrophobicContact CD1-CD1 3.96Å; I1384-F1429 HydrophobicContact CD1-CE1 4.24Å; I1384-A1435 PolarHBondContact N-O 2.88Å; I1384-A1435 PolarHBondContact O-N 3.49Å; I1384-F1437 HydrophobicContact CD1-CD2 4.39Å; I1384-F1437 HydrophobicContact CD1-CE2 4.07Å; I1384-F1437 HydrophobicContact CG1-CD2 4.49Å; I1384-F1437 HydrophobicContact CG1-CE2 4.33Å; I1384-W1463 HydrophobicContact CD1-CH2 4.25Å; I1384-W1463 HydrophobicContact CG2-CH2 4.14Å; I1384-W1463 HydrophobicContact CG2-CZ2 3.78Å; I1384-V1465 HydrophobicContact CG2-CG1 4.1Å; I1384-V1465 HydrophobicContact CG2-CG2 4.46Å; I1384-V1468 HydrophobicContact CG1-CG1 4.37Å; I1384-V1468 HydrophobicContact CG1-CG2 4.33Å; I1384-V1468 HydrophobicContact CG2-CG2 4.38Å
1385	H	84.6	Confident	70.8	Confident	23 Å²	23	47.6 Å²	47.6	11%	0.106	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	129.9	175.2	-74.9	-112.1	0	0	0	109.9	I1434 E1466 R1467	H1385-I1434 VanDerWaalsContact CE1-CD1 3.45Å; H1385-I1434 WeakPolarHBondContact CE1-CD1 3.23Å; H1385-E1466 HydrophobicContact CB-CB 4.14Å; H1385-E1466 IonicContact ND1-OE2 3.35Å; H1385-E1466 PolarHBondContact O-N 3.05Å; H1385-R1467 HydrophobicContact CB-CG 3.58Å; H1385-R1467 WeakPolarHBondContact CB-O 3.43Å; H1385-R1467 PolarHBondContact CD2-NE 2.91Å; H1385-R1467 PolarHBondContact CE1-NE 2.94Å; H1385-R1467 PolarHBondContact CE1-NH2 2.99Å; H1385-R1467 PolarHBondContact N-O 3.04Å; H1385-R1467 PolarHBondContact NE2-NE 3.1Å; H1385-R1467 PolarHBondContact NE2-NH2 3.14Å
1386	T	75.9	Confident	70.8	Confident	5 Å²	5	46 Å²	46	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	143	178.8	58.4	0	0	0	0	110.8	F1429 Q1430 G1432 Q1433	T1386-F1429 HydrophobicContact CG2-CB 4.39Å; T1386-Q1430 PolarHBondContact OG1-O 2.81Å; T1386-G1432 PolarHBondContact O-N 3.24Å; T1386-G1432 PolarHBondContact OG1-N 3.48Å; T1386-Q1433 PolarHBondContact N-O 2.74Å; T1386-Q1433 PolarHBondContact OG1-N 2.73Å; T1386-Q1433 VanDerWaalsContact OG1-N 3.17Å; T1386-Q1433 PolarHBondContact OG1-O 2.7Å
1387	G	67.4	Low	71.1	Confident	9 Å²	9	41.9 Å²	41.9	9%	0.093	24%	0.239	C	C	.	.			trans	-63.9	166.3	179.7	0	0	0	0	0	113.1	I1392 A1431 G1432 F1464	G1387-I1392 VanDerWaalsContact C-CD1 3.43Å; G1387-I1392 WeakPolarHBondContact O-CD1 3.5Å; G1387-A1431 CarbonylContact O-C 3.57Å; G1387-A1431 WeakPolarHBondContact O-CA 3.43Å; G1387-A1431 WeakPolarHBondContact O-CB 3.09Å; G1387-G1432 PolarHBondContact O-N 2.88Å; G1387-F1464 PolarHBondContact N-O 3.47Å
1388	S	66.2	Low	71.2	Confident	112 Å²	112	41.5 Å²	41.5	78%	0.783	24%	0.236	S	C	*	.	S	Bend	trans	-102.4	3.8	-169.7	54.6	0	0	0	0	116.4
1389	Q	55	Low	71.4	Confident	143 Å²	143	43.6 Å²	43.6	67%	0.668	25%	0.245	S	C	*	.	S	Bend	trans	-82.5	164	177.5	-60.6	-178.5	-4.8	0	0	112.4	I1392	Q1389-I1392 HydrophobicContact CB-CD1 4.02Å; Q1389-I1392 VanDerWaalsContact O-CD1 3.3Å; Q1389-I1392 WeakPolarHBondContact O-CD1 3.48Å; Q1389-I1392 VanDerWaalsContact O-CG1 3.31Å; Q1389-I1392 WeakPolarHBondContact O-CG1 3.26Å
1390	S	52.3	Low	71.6	Confident	103 Å²	103	41.1 Å²	41.1	72%	0.72	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	149.6	176.5	51.2	0	0	0	0	113.1
1391	N	56.6	Low	71.6	Confident	135 Å²	135	41.5 Å²	41.5	72%	0.722	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	27.9	175	-58.9	-8	0	0	0	116.6
1392	I	61.1	Low	71.7	Confident	10 Å²	10	39.2 Å²	39.2	5%	0.051	22%	0.224	C	C	.	.			trans	-118.1	8.1	179.8	71.8	-171	0	0	0	114.6	G1387 Q1389 A1431 R1462 F1464 F1486	G1387-I1392 VanDerWaalsContact C-CD1 3.43Å; G1387-I1392 WeakPolarHBondContact O-CD1 3.5Å; Q1389-I1392 HydrophobicContact CB-CD1 4.02Å; Q1389-I1392 VanDerWaalsContact O-CD1 3.3Å; Q1389-I1392 WeakPolarHBondContact O-CD1 3.48Å; Q1389-I1392 VanDerWaalsContact O-CG1 3.31Å; Q1389-I1392 WeakPolarHBondContact O-CG1 3.26Å; I1392-A1431 HydrophobicContact CD1-CB 4.48Å; I1392-A1431 HydrophobicContact CG1-CB 3.92Å; I1392-R1462 WeakPolarHBondContact CA-O 3.49Å; I1392-F1464 HydrophobicContact CB-CB 4.06Å; I1392-F1464 HydrophobicContact CD1-CB 4.03Å; I1392-F1464 HydrophobicContact CG1-CB 4.34Å; I1392-F1464 PolarHBondContact O-N 3.3Å; I1392-F1486 HydrophobicContact CB-CE1 4.24Å; I1392-F1486 HydrophobicContact CG2-CE1 3.66Å; I1392-F1486 HydrophobicContact CG2-CZ 4.13Å
1393	S	60.6	Low	71.3	Confident	53 Å²	53	39.9 Å²	39.9	37%	0.371	23%	0.226	S	C	.	.			trans	-83.1	149	176.6	54	0	0	0	0	112.4	F1429	S1393-F1429 CarbonylContact C-O 3.37Å; S1393-F1429 WeakPolarHBondContact CA-O 3.46Å; S1393-F1429 VanDerWaalsContact CB-O 3.23Å; S1393-F1429 WeakPolarHBondContact CB-O 3.3Å
1394	S	62.8	Low	70.8	Confident	3 Å²	3	38 Å²	38	2%	0.021	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-127.2	144.1	-178.7	-175.5	0	0	0	0	112.6	F1429 H1454	S1394-F1429 PolarHBondContact N-O 3.17Å; S1394-F1429 WeakPolarHBondContact O-CB 3.49Å; S1394-F1429 PolarHBondContact O-N 3.48Å; S1394-H1454 PolarHBondContact OG-NE2 2.86Å
1395	D	62.7	Low	69.9	Low	73 Å²	73	41.9 Å²	41.9	39%	0.39	24%	0.244	S	C	.	.			trans	-111.6	-22.6	172.6	60.3	-25.7	0	0	0	112.8	S1460	D1395-S1460 WeakPolarHBondContact OD1-CB 3.3Å; D1395-S1460 PolarHBondContact OD1-OG 2.91Å
1396	A	62.6	Low	69	Low	11 Å²	11	47.5 Å²	47.5	9%	0.091	27%	0.268	C	S	.	.	S	Bend	trans	-51.1	160.2	173.1	0	0	0	0	0	114.2
1397	N	70	Confident	68.7	Low	42 Å²	42	49 Å²	49	23%	0.225	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-87.4	129.2	-175.2	-49.3	-87.5	0	0	0	111	R1413 K1428 D1455	N1397-R1413 PolarHBondContact ND2-NH2 3.09Å; N1397-K1428 PolarHBondContact OD1-NZ 3.01Å; N1397-D1455 WeakPolarHBondContact CA-OD1 3.3Å; N1397-D1455 VanDerWaalsContact CB-OD1 3.25Å; N1397-D1455 WeakPolarHBondContact CB-OD1 3.41Å; N1397-D1455 PolarHBondContact N-OD1 3.14Å; N1397-D1455 PolarHBondContact ND2-OD1 3Å; N1397-D1455 PolarHBondContact ND2-OD2 3.05Å; N1397-D1455 VanDerWaalsContact ND2-OD2 3.17Å; N1397-D1455 PolarHBondContact O-N 2.94Å
1398	V	73.9	Confident	69	Low	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.4	176.9	177.7	0	0	0	0	109.4	L1414 F1429 I1452 E1453 W1463	V1398-L1414 HydrophobicContact CB-CD1 4.29Å; V1398-L1414 HydrophobicContact CG1-CD1 3.95Å; V1398-L1414 WeakPolarHBondContact O-CB 3.47Å; V1398-L1414 PolarHBondContact O-N 2.92Å; V1398-F1429 HydrophobicContact CB-CE2 4.1Å; V1398-F1429 HydrophobicContact CB-CZ 3.78Å; V1398-F1429 HydrophobicContact CG2-CD2 4.31Å; V1398-F1429 HydrophobicContact CG2-CE1 4.4Å; V1398-F1429 HydrophobicContact CG2-CE2 3.47Å; V1398-F1429 VanDerWaalsContact CG2-CE2 3.47Å; V1398-F1429 HydrophobicContact CG2-CZ 3.53Å; V1398-I1452 HydrophobicContact CG1-CG2 3.51Å; V1398-E1453 CarbonylContact C-O 3.3Å; V1398-E1453 VanDerWaalsContact CA-O 3.24Å; V1398-E1453 WeakPolarHBondContact CA-O 3.47Å; V1398-W1463 HydrophobicContact CB-CZ3 4.47Å; V1398-W1463 HydrophobicContact CG1-CH2 4.1Å; V1398-W1463 HydrophobicContact CG1-CZ3 4.07Å; V1398-W1463 HydrophobicContact CG2-CE3 4.17Å; V1398-W1463 HydrophobicContact CG2-CH2 3.74Å; V1398-W1463 HydrophobicContact CG2-CZ3 3.51Å
1399	Q	79.3	Confident	69.3	Low	44 Å²	44	44.5 Å²	44.5	21%	0.206	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	152.8	167.6	-49.9	-172.2	57.2	0	0	109.6	N1411 I1412 R1413 I1452 E1453	Q1399-N1411 PolarHBondContact OE1-ND2 3.31Å; Q1399-I1412 CarbonylContact C-O 3.02Å; Q1399-I1412 VanDerWaalsContact CA-O 3.3Å; Q1399-I1412 WeakPolarHBondContact CA-O 3.16Å; Q1399-R1413 HydrophobicContact CG-CB 4.16Å; Q1399-R1413 HydrophobicContact CG-CG 4.17Å; Q1399-I1452 CarbonylContact O-C 3.54Å; Q1399-I1452 WeakPolarHBondContact O-CA 3.23Å; Q1399-E1453 HydrophobicContact CB-CB 4.31Å; Q1399-E1453 PolarHBondContact N-O 2.9Å; Q1399-E1453 PolarHBondContact O-N 3.18Å
1400	I	84	Confident	69.9	Low	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	143	175.8	-166.6	167.5	0	0	0	111.1	V1382 L1402 I1412 L1414 V1439 R1451 I1452	V1382-I1400 HydrophobicContact CG1-CD1 3.89Å; V1382-I1400 HydrophobicContact CG2-CD1 4.37Å; I1400-L1402 HydrophobicContact CD1-CD2 3.72Å; I1400-L1402 HydrophobicContact CG1-CD2 3.99Å; I1400-I1412 HydrophobicContact CG2-CB 4.42Å; I1400-I1412 PolarHBondContact N-O 2.96Å; I1400-I1412 PolarHBondContact O-N 2.96Å; I1400-L1414 HydrophobicContact CG2-CD2 3.87Å; I1400-L1414 HydrophobicContact CG2-CG 4.32Å; I1400-V1439 HydrophobicContact CG2-CG2 4.38Å; I1400-R1451 CarbonylContact C-O 3.55Å; I1400-R1451 VanDerWaalsContact CA-O 3.32Å; I1400-R1451 WeakPolarHBondContact CA-O 3.26Å; I1400-R1451 WeakPolarHBondContact CG1-O 3.4Å; I1400-I1452 HydrophobicContact CD1-CG1 4.29Å; I1400-I1452 HydrophobicContact CG1-CG1 4.17Å
1401	Q	84.5	Confident	70.7	Confident	8 Å²	8	36 Å²	36	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.2	163.9	-48.5	-173.3	-10.9	0	0	109.1	Y1403 N1411 I1450 R1451	Q1401-Y1403 HydrophobicContact CB-CD2 4.24Å; Q1401-Y1403 HydrophobicContact CB-CE2 3.78Å; Q1401-Y1403 VanDerWaalsContact OE1-CZ 3.25Å; Q1401-Y1403 PolarHBondContact OE1-OH 2.71Å; Q1401-N1411 WeakPolarHBondContact CG-OD1 3.42Å; Q1401-N1411 PolarHBondContact NE2-OD1 3.08Å; Q1401-I1450 WeakPolarHBondContact O-CA 3.07Å; Q1401-R1451 HydrophobicContact CB-CB 4.22Å; Q1401-R1451 HydrophobicContact CG-CG 4.48Å; Q1401-R1451 PolarHBondContact N-O 2.99Å; Q1401-R1451 PolarHBondContact O-N 3.37Å
1402	L	86.2	Confident	71.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.6	170.1	-49.1	177.5	0	0	0	108.6	Y1380 V1382 I1400 F1408 T1409 V1439 I1444 I1450 V1470	Y1380-L1402 HydrophobicContact CD1-CD1 4.17Å; Y1380-L1402 HydrophobicContact CG-CD1 3.93Å; V1382-L1402 HydrophobicContact CG2-CD1 4.48Å; I1400-L1402 HydrophobicContact CD1-CD2 3.72Å; I1400-L1402 HydrophobicContact CG1-CD2 3.99Å; L1402-F1408 WeakPolarHBondContact O-CA 3.3Å; L1402-F1408 WeakPolarHBondContact O-CB 3.33Å; L1402-T1409 HydrophobicContact CB-CG2 3.8Å; L1402-T1409 HydrophobicContact CD1-CG2 4.29Å; L1402-T1409 HydrophobicContact CG-CG2 4.18Å; L1402-T1409 PolarHBondContact N-OG1 2.83Å; L1402-T1409 PolarHBondContact O-N 2.82Å; L1402-V1439 HydrophobicContact CD1-CG1 4.07Å; L1402-I1444 HydrophobicContact CB-CD1 3.69Å; L1402-I1450 HydrophobicContact CD2-CB 4.25Å; L1402-I1450 HydrophobicContact CD2-CG2 3.46Å; L1402-I1450 VanDerWaalsContact CD2-CG2 3.46Å; L1402-V1470 HydrophobicContact CD1-CG1 4.21Å; L1402-V1470 HydrophobicContact CD2-CG2 4.3Å
1403	Y	79.8	Confident	72.2	Confident	13 Å²	13	33.3 Å²	33.3	5%	0.051	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.5	179.7	-67	-103.3	0	0	0	110.3	E1069 Q1401 F1408 I1447 K1448 K1449 R1451	E1069-Y1403 HydrophobicContact CB-CE1 4.41Å; E1069-Y1403 HydrophobicContact CG-CE1 3.8Å; E1069-Y1403 WeakPolarHBondContact OE2-CE1 3.43Å; E1069-Y1403 PolarHBondContact OE2-OH 3.17Å; Q1401-Y1403 HydrophobicContact CB-CD2 4.24Å; Q1401-Y1403 HydrophobicContact CB-CE2 3.78Å; Q1401-Y1403 VanDerWaalsContact OE1-CZ 3.25Å; Q1401-Y1403 PolarHBondContact OE1-OH 2.71Å; Y1403-F1408 HydrophobicContact CD1-CB 3.86Å; Y1403-F1408 HydrophobicContact CD1-CD2 4.42Å; Y1403-F1408 HydrophobicContact CD1-CG 4.18Å; Y1403-F1408 HydrophobicContact CE1-CD2 4.28Å; Y1403-F1408 HydrophobicContact CE1-CG 4.43Å; Y1403-F1408 HydrophobicContact CG-CB 4.19Å; Y1403-I1447 CarbonylContact O-C 3.54Å; Y1403-I1447 WeakPolarHBondContact O-CA 3.38Å; Y1403-K1448 PolarHBondContact O-N 3.43Å; Y1403-K1449 WeakPolarHBondContact CB-O 3.25Å; Y1403-K1449 HydrophobicContact CD2-CD 4.2Å; Y1403-K1449 VanDerWaalsContact CD2-CE 3.42Å; Y1403-K1449 HydrophobicContact CD2-CG 3.65Å; Y1403-K1449 HydrophobicContact CE2-CD 4.4Å; Y1403-K1449 HydrophobicContact CE2-CG 4.3Å; Y1403-K1449 HydrophobicContact CG-CD 4.35Å; Y1403-K1449 HydrophobicContact CG-CG 3.79Å; Y1403-K1449 PolarHBondContact N-O 3.05Å; Y1403-R1451 HydrophobicContact CE2-CB 4.01Å; Y1403-R1451 PolarHBondContact OH-NH1 2.69Å
1404	G	75.7	Confident	72.9	Confident	11 Å²	11	31.1 Å²	31.1	11%	0.113	16%	0.156	C	C	.	.			trans	-99.2	-172.6	178.2	0	0	0	0	0	113.9	D1407 I1444 N1446	G1404-D1407 WeakPolarHBondContact CA-O 3.06Å; G1404-D1407 PolarHBondContact N-O 3.23Å; G1404-I1444 CarbonylContact C-O 2.94Å; G1404-I1444 VanDerWaalsContact CA-O 3.28Å; G1404-I1444 WeakPolarHBondContact CA-O 3.22Å; G1404-N1446 CarbonylContact C-O 3.55Å; G1404-N1446 VanDerWaalsContact CA-O 3.22Å; G1404-N1446 WeakPolarHBondContact CA-O 3.47Å
1405	D	66.1	Low	73.1	Confident	81 Å²	81	34 Å²	34	43%	0.433	17%	0.167	S	C	.	.	S	Bend	trans	-87.3	-10.2	173	64.4	-9.3	0	0	0	113.7	I1444 G1445 N1446	D1405-I1444 PolarHBondContact N-O 3.3Å; D1405-G1445 VanDerWaalsContact OD1-CA 3.26Å; D1405-G1445 WeakPolarHBondContact OD1-CA 3.4Å; D1405-N1446 PolarHBondContact N-O 3.48Å; D1405-N1446 PolarHBondContact OD1-N 2.86Å
1406	K	67.3	Low	73.1	Confident	140 Å²	140	33.2 Å²	33.2	61%	0.609	16%	0.16	S	C	*	.	S	Bend	trans	-109.9	-41.3	177.2	-57.1	170	-168.7	166.5	0	114.2	N1443 I1444	K1406-N1443 PolarHBondContact NZ-OD1 3.41Å; K1406-I1444 WeakPolarHBondContact CB-O 3.34Å; K1406-I1444 PolarHBondContact N-O 3.38Å
1407	D	68.2	Low	73.3	Confident	37 Å²	37	33.6 Å²	33.6	20%	0.198	16%	0.163	C	C	.	.			trans	-158.8	-174.2	-176.5	-161.5	5.9	0	0	0	110.1	K1295 G1404 I1444	K1295-D1407 IonicContact NZ-OD2 2.87Å; K1295-D1407 PolarHBondContact NZ-OD2 3.4Å; G1404-D1407 WeakPolarHBondContact CA-O 3.06Å; G1404-D1407 PolarHBondContact N-O 3.23Å; D1407-I1444 HydrophobicContact CB-CG2 4.21Å; D1407-I1444 PolarHBondContact N-O 3.03Å; D1407-I1444 WeakPolarHBondContact O-CB 3.31Å
1408	F	73.8	Confident	73	Confident	22 Å²	22	34.9 Å²	34.9	10%	0.096	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-142	156.9	174.2	72.2	-76.3	0	0	0	112.4	L1402 Y1403 G1410	L1402-F1408 WeakPolarHBondContact O-CA 3.3Å; L1402-F1408 WeakPolarHBondContact O-CB 3.33Å; Y1403-F1408 HydrophobicContact CD1-CB 3.86Å; Y1403-F1408 HydrophobicContact CD1-CD2 4.42Å; Y1403-F1408 HydrophobicContact CD1-CG 4.18Å; Y1403-F1408 HydrophobicContact CE1-CD2 4.28Å; Y1403-F1408 HydrophobicContact CE1-CG 4.43Å; Y1403-F1408 HydrophobicContact CG-CB 4.19Å; F1408-G1410 VanDerWaalsContact C-N 3.33Å; F1408-G1410 PolarHBondContact O-N 3.26Å
1409	T	72.2	Confident	72	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.031	18%	0.178	C	C	.	.			trans	-72.6	-19.7	-170.5	57.6	0	0	0	0	115.4	L1402 I1412 V1439 A1441 I1444	L1402-T1409 HydrophobicContact CB-CG2 3.8Å; L1402-T1409 HydrophobicContact CD1-CG2 4.29Å; L1402-T1409 HydrophobicContact CG-CG2 4.18Å; L1402-T1409 PolarHBondContact N-OG1 2.83Å; L1402-T1409 PolarHBondContact O-N 2.82Å; T1409-I1412 HydrophobicContact CG2-CD1 4.29Å; T1409-V1439 HydrophobicContact CG2-CG1 4.12Å; T1409-A1441 HydrophobicContact CG2-CB 3.92Å; T1409-I1444 HydrophobicContact CG2-CD1 4.45Å; T1409-I1444 HydrophobicContact CG2-CG2 4.5Å
1410	G	67.5	Low	70.5	Confident	4 Å²	4	39.7 Å²	39.7	4%	0.041	21%	0.205	C	C	.	.			trans	66.7	-173	-158.2	0	0	0	0	0	112.4	F1408 I1412	F1408-G1410 VanDerWaalsContact C-N 3.33Å; F1408-G1410 PolarHBondContact O-N 3.26Å; G1410-I1412 PolarHBondContact O-N 3.44Å
1411	N	70.4	Confident	68.5	Low	64 Å²	64	49.9 Å²	49.9	34%	0.342	25%	0.249	S	C	.	.			trans	-72.4	116.4	178.9	-98.5	-4.4	0	0	0	111.7	Q1399 Q1401	Q1399-N1411 PolarHBondContact OE1-ND2 3.31Å; Q1401-N1411 WeakPolarHBondContact CG-OD1 3.42Å; Q1401-N1411 PolarHBondContact NE2-OD1 3.08Å
1412	I	75	Confident	66.4	Low	13 Å²	13	57.6 Å²	57.6	7%	0.067	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.9	174.4	-61.8	-179.2	0	0	0	109.2	I1345 Q1399 I1400 T1409 G1410 V1439	I1345-I1412 HydrophobicContact CD1-CG1 4.38Å; Q1399-I1412 CarbonylContact C-O 3.02Å; Q1399-I1412 VanDerWaalsContact CA-O 3.3Å; Q1399-I1412 WeakPolarHBondContact CA-O 3.16Å; I1400-I1412 HydrophobicContact CG2-CB 4.42Å; I1400-I1412 PolarHBondContact N-O 2.96Å; I1400-I1412 PolarHBondContact O-N 2.96Å; T1409-I1412 HydrophobicContact CG2-CD1 4.29Å; G1410-I1412 PolarHBondContact O-N 3.44Å; I1412-V1439 HydrophobicContact CD1-CG1 3.63Å; I1412-V1439 HydrophobicContact CG2-CG2 4.32Å
1413	R	73.9	Confident	64.2	Low	75 Å²	75	64.2 Å²	64.2	28%	0.283	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	129.5	-179.9	-168	166.1	-179.7	130.1	-2	110.7	N1397 Q1399 Y1415 D1455	N1397-R1413 PolarHBondContact ND2-NH2 3.09Å; Q1399-R1413 HydrophobicContact CG-CB 4.16Å; Q1399-R1413 HydrophobicContact CG-CG 4.17Å; R1413-Y1415 HydrophobicContact CB-CD2 4.41Å; R1413-Y1415 HydrophobicContact CB-CE2 3.79Å; R1413-Y1415 HydrophobicContact CG-CE1 4.21Å; R1413-Y1415 HydrophobicContact CG-CE2 4.17Å; R1413-Y1415 WeakPolarHBondContact O-CD2 3.3Å; R1413-Y1415 PolarHBondContact O-N 3.46Å; R1413-D1455 IonicContact CZ-OD2 2.84Å; R1413-D1455 IonicContact NH1-OD2 3.96Å; R1413-D1455 IonicContact NH2-OD2 2.72Å; R1413-D1455 PolarHBondContact NH2-OD2 3.45Å
1414	L	75.6	Confident	62.4	Low	6 Å²	6	70.2 Å²	70.2	3%	0.031	35%	0.353	C	S	.	.			trans	-86.6	90.8	-173.8	-61	-176.7	0	0	0	110.7	I1384 V1398 I1400 F1437	I1384-L1414 HydrophobicContact CD1-CD1 3.96Å; V1398-L1414 HydrophobicContact CB-CD1 4.29Å; V1398-L1414 HydrophobicContact CG1-CD1 3.95Å; V1398-L1414 WeakPolarHBondContact O-CB 3.47Å; V1398-L1414 PolarHBondContact O-N 2.92Å; I1400-L1414 HydrophobicContact CG2-CD2 3.87Å; I1400-L1414 HydrophobicContact CG2-CG 4.32Å; L1414-F1437 HydrophobicContact CB-CD1 3.88Å; L1414-F1437 HydrophobicContact CB-CE1 3.8Å; L1414-F1437 HydrophobicContact CB-CG 4.48Å; L1414-F1437 HydrophobicContact CB-CZ 4.35Å; L1414-F1437 HydrophobicContact CD1-CD1 4.39Å; L1414-F1437 HydrophobicContact CD1-CD2 4.08Å; L1414-F1437 HydrophobicContact CD1-CE1 4.45Å; L1414-F1437 HydrophobicContact CD1-CE2 4.15Å; L1414-F1437 HydrophobicContact CD1-CG 4.21Å; L1414-F1437 HydrophobicContact CD1-CZ 4.34Å; L1414-F1437 HydrophobicContact CD2-CB 4.05Å; L1414-F1437 HydrophobicContact CD2-CD1 4.1Å; L1414-F1437 HydrophobicContact CD2-CG 4.02Å; L1414-F1437 HydrophobicContact CG-CD1 4.35Å; L1414-F1437 HydrophobicContact CG-CG 4.47Å
1415	Y	65.6	Low	60.8	Low	65 Å²	65	77.2 Å²	77.2	26%	0.255	39%	0.386	S	S	.	.			trans	-80.8	-46.7	-175.1	-68.8	-76.7	0	0	0	114.3	A1337 V1344 R1413 K1428	A1337-Y1415 HydrophobicContact CB-CD1 4.39Å; A1337-Y1415 HydrophobicContact CB-CG 4.29Å; V1344-Y1415 HydrophobicContact CG1-CE2 4.5Å; V1344-Y1415 HydrophobicContact CG2-CD2 4.36Å; V1344-Y1415 HydrophobicContact CG2-CE2 3.53Å; R1413-Y1415 HydrophobicContact CB-CD2 4.41Å; R1413-Y1415 HydrophobicContact CB-CE2 3.79Å; R1413-Y1415 HydrophobicContact CG-CE1 4.21Å; R1413-Y1415 HydrophobicContact CG-CE2 4.17Å; R1413-Y1415 WeakPolarHBondContact O-CD2 3.3Å; R1413-Y1415 PolarHBondContact O-N 3.46Å; Y1415-K1428 WeakPolarHBondContact O-CE 3.47Å
1416	K	63.7	Low	59.9	Low	56 Å²	56	77.5 Å²	77.5	24%	0.243	39%	0.391	C	S	.	.			trans	-127.9	121.4	-170.6	-172.9	176	175.1	-162.9	0	111.3	Y1418 F1437	K1416-Y1418 HydrophobicContact CD-CE1 4.23Å; K1416-Y1418 HydrophobicContact CD-CE2 4.43Å; K1416-Y1418 WeakPolarHBondContact CD-OH 3.25Å; K1416-Y1418 WeakPolarHBondContact CE-OH 3.19Å; K1416-Y1418 HydrophobicContact CG-CE2 4.27Å; K1416-Y1418 PolarHBondContact NZ-OH 3.25Å; K1416-F1437 WeakPolarHBondContact O-CD1 3.12Å
1417	A	65.8	Low	59.3	Low	19 Å²	19	75.2 Å²	75.2	16%	0.157	39%	0.386	C	S	.	.			trans	-97	152.4	173.4	0	0	0	0	0	110.7	Y1419 A1435 N1436 F1437	A1417-Y1419 HydrophobicContact CB-CE2 4.27Å; A1417-A1435 HydrophobicContact CB-CB 4.31Å; A1417-N1436 CarbonylContact C-O 3.58Å; A1417-N1436 WeakPolarHBondContact CA-O 3.32Å; A1417-F1437 HydrophobicContact CB-CD1 4.36Å; A1417-F1437 HydrophobicContact CB-CE1 3.63Å; A1417-F1437 HydrophobicContact CB-CZ 3.77Å
1418	Y	63.8	Low	58.9	Low	68 Å²	68	75.8 Å²	75.8	27%	0.267	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-122.1	132.7	176.8	-62.1	-88.8	0	0	0	111.3	K1416 N1436	K1416-Y1418 HydrophobicContact CD-CE1 4.23Å; K1416-Y1418 HydrophobicContact CD-CE2 4.43Å; K1416-Y1418 WeakPolarHBondContact CD-OH 3.25Å; K1416-Y1418 WeakPolarHBondContact CE-OH 3.19Å; K1416-Y1418 HydrophobicContact CG-CE2 4.27Å; K1416-Y1418 PolarHBondContact NZ-OH 3.25Å; Y1418-N1436 PolarHBondContact N-O 3.5Å; Y1418-N1436 WeakPolarHBondContact O-CB 3.42Å; Y1418-N1436 PolarHBondContact O-N 2.59Å; Y1418-N1436 PolarHBondContact O-ND2 3.46Å
1419	Y	53.9	Low	58.7	Low	71 Å²	71	74.7 Å²	74.7	28%	0.278	38%	0.381	S	S	.	.			trans	-128.5	89	-177.1	-64.3	-70.8	0	0	0	111.2	A1417 N1427 K1428 Q1433 I1434 A1435	A1417-Y1419 HydrophobicContact CB-CE2 4.27Å; Y1419-N1427 PolarHBondContact OH-O 2.84Å; Y1419-K1428 PolarHBondContact OH-O 2.95Å; Y1419-Q1433 HydrophobicContact CE1-CB 3.86Å; Y1419-I1434 VanDerWaalsContact CD1-O 3.32Å; Y1419-I1434 WeakPolarHBondContact CD1-O 3.24Å; Y1419-I1434 WeakPolarHBondContact CE1-O 3.31Å; Y1419-A1435 HydrophobicContact CE1-CB 4.15Å
1420	G	48	Very low	58.5	Low	75 Å²	75	78.2 Å²	78.2	77%	0.773	40%	0.397	S	S	*	.	S	Bend	trans	78.6	-148.2	179.1	0	0	0	0	0	113.6
1421	K	42.1	Very low	58.5	Low	214 Å²	214	79.8 Å²	79.8	93%	0.93	41%	0.41	S	S	*	.	S	Bend	trans	-102.7	-6.6	-158.1	-110.7	-172.2	178.4	-173.9	0	117
1422	E	41	Very low	58.4	Low	170 Å²	170	79 Å²	79	79%	0.794	42%	0.417	S	S	*	.	S	Bend	trans	-136.7	145.2	-175.8	-62.7	-172.2	154.5	0	0	111.2	I1424	E1422-I1424 PolarHBondContact O-N 3.01Å; E1422-I1424 VanDerWaalsContact O-N 3.14Å
1423	D	39.2	Very low	58.3	Low	139 Å²	139	82.8 Å²	82.8	74%	0.743	43%	0.434	S	S	*	.			trans	-77.4	93.9	-170.1	-74.4	-77.4	0	0	0	112.8
1424	I	41.3	Very low	58.4	Low	140 Å²	140	82.5 Å²	82.5	72%	0.718	44%	0.438	S	S	*	.			trans	-125.4	120.4	167.7	-52.1	-178.1	0	0	0	110	E1422 V1426	E1422-I1424 PolarHBondContact O-N 3.01Å; E1422-I1424 VanDerWaalsContact O-N 3.14Å; I1424-V1426 HydrophobicContact CG2-CG2 4.09Å
1425	L	42.7	Very low	58.4	Low	157 Å²	157	82.2 Å²	82.2	82%	0.822	44%	0.436	S	S	*	.			trans	-87.6	107.4	-178.1	-79.5	159.8	0	0	0	111.5
1426	V	47.6	Very low	59	Low	88 Å²	88	81.4 Å²	81.4	53%	0.533	44%	0.436	S	S	.	.			trans	-138.8	159.8	170.1	-160.3	0	0	0	0	109.6	I1424	I1424-V1426 HydrophobicContact CG2-CG2 4.09Å
1427	N	54.4	Low	59.8	Low	92 Å²	92	79 Å²	79	49%	0.492	43%	0.426	S	S	.	.			trans	-30.6	129	-170.4	-90.5	-9	0	0	0	117.1	Y1419 F1429 Q1430	Y1419-N1427 PolarHBondContact OH-O 2.84Å; N1427-F1429 PolarHBondContact O-N 3.13Å; N1427-Q1430 HydrophobicContact CB-CG 4.06Å
1428	K	59.1	Low	60.3	Low	48 Å²	48	80.5 Å²	80.5	21%	0.209	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.8	-170.7	-60.4	176.8	-174.5	173.1	0	115.6	N1397 Y1415 Y1419 A1435	N1397-K1428 PolarHBondContact OD1-NZ 3.01Å; Y1415-K1428 WeakPolarHBondContact O-CE 3.47Å; Y1419-K1428 PolarHBondContact OH-O 2.95Å; K1428-A1435 WeakPolarHBondContact O-CB 3.42Å
1429	F	70	Confident	61	Low	0 Å²	0	77.3 Å²	77.3	0%	0	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-140	61.3	-177.8	-47.8	-77.9	0	0	0	111.9	I1384 T1386 S1393 S1394 V1398 N1427 A1435 F1437 W1463	I1384-F1429 HydrophobicContact CD1-CE1 4.24Å; T1386-F1429 HydrophobicContact CG2-CB 4.39Å; S1393-F1429 CarbonylContact C-O 3.37Å; S1393-F1429 WeakPolarHBondContact CA-O 3.46Å; S1393-F1429 VanDerWaalsContact CB-O 3.23Å; S1393-F1429 WeakPolarHBondContact CB-O 3.3Å; S1394-F1429 PolarHBondContact N-O 3.17Å; S1394-F1429 WeakPolarHBondContact O-CB 3.49Å; S1394-F1429 PolarHBondContact O-N 3.48Å; V1398-F1429 HydrophobicContact CB-CE2 4.1Å; V1398-F1429 HydrophobicContact CB-CZ 3.78Å; V1398-F1429 HydrophobicContact CG2-CD2 4.31Å; V1398-F1429 HydrophobicContact CG2-CE1 4.4Å; V1398-F1429 HydrophobicContact CG2-CE2 3.47Å; V1398-F1429 VanDerWaalsContact CG2-CE2 3.47Å; V1398-F1429 HydrophobicContact CG2-CZ 3.53Å; N1427-F1429 PolarHBondContact O-N 3.13Å; F1429-A1435 HydrophobicContact CD1-CB 4.22Å; F1429-A1435 HydrophobicContact CE1-CB 4.44Å; F1429-F1437 HydrophobicContact CD1-CZ 4.41Å; F1429-F1437 AromaticContact CE1-CE2 3.75Å; F1429-F1437 HydrophobicContact CE1-CE2 3.75Å; F1429-F1437 AromaticContact CE1-CZ 3.47Å; F1429-F1437 HydrophobicContact CE1-CZ 3.47Å; F1429-F1437 VanDerWaalsContact CE1-CZ 3.47Å; F1429-F1437 HydrophobicContact CZ-CE2 4.37Å; F1429-F1437 AromaticContact CZ-CZ 3.75Å; F1429-F1437 HydrophobicContact CZ-CZ 3.75Å; F1429-W1463 HydrophobicContact CB-CZ2 4.36Å; F1429-W1463 HydrophobicContact CD1-CH2 4.22Å; F1429-W1463 AromaticContact CD1-CZ2 3.43Å; F1429-W1463 HydrophobicContact CD1-CZ2 3.43Å; F1429-W1463 VanDerWaalsContact CD1-CZ2 3.43Å; F1429-W1463 HydrophobicContact CD2-CZ2 4.46Å; F1429-W1463 HydrophobicContact CE1-CH2 4.08Å; F1429-W1463 AromaticContact CE1-CZ2 3.75Å; F1429-W1463 HydrophobicContact CE1-CZ2 3.75Å; F1429-W1463 AromaticContact CG-CE2 3.98Å; F1429-W1463 AromaticContact CG-CZ2 3.83Å; F1429-W1463 HydrophobicContact CG-CZ2 3.83Å; F1429-W1463 AromaticContact CG-NE1 3.98Å; F1429-W1463 HydrophobicContact CZ-CH2 4.45Å; F1429-W1463 HydrophobicContact CZ-CZ2 4.41Å
1430	Q	67.2	Low	62	Low	78 Å²	78	76.4 Å²	76.4	36%	0.364	42%	0.416	S	S	.	.			trans	-63.3	142.5	167.5	-74.3	-172.3	-20.8	0	0	111.8	T1386 N1427 Q1433	T1386-Q1430 PolarHBondContact OG1-O 2.81Å; N1427-Q1430 HydrophobicContact CB-CG 4.06Å; Q1430-Q1433 HydrophobicContact CB-CB 4.44Å; Q1430-Q1433 HydrophobicContact CB-CG 4.04Å; Q1430-Q1433 WeakPolarHBondContact O-CB 3.11Å; Q1430-Q1433 PolarHBondContact O-N 3.35Å
1431	A	67.4	Low	63.3	Low	38 Å²	38	73 Å²	73	31%	0.314	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	143.4	178.6	0	0	0	0	0	112.4	G1387 I1392 Q1433	G1387-A1431 CarbonylContact O-C 3.57Å; G1387-A1431 WeakPolarHBondContact O-CA 3.43Å; G1387-A1431 WeakPolarHBondContact O-CB 3.09Å; I1392-A1431 HydrophobicContact CD1-CB 4.48Å; I1392-A1431 HydrophobicContact CG1-CB 3.92Å; A1431-Q1433 PolarHBondContact O-N 3.18Å
1432	G	69.1	Low	64.8	Low	46 Å²	46	63.9 Å²	63.9	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	6.1	-177.8	0	0	0	0	0	114.9	T1386 G1387	T1386-G1432 PolarHBondContact O-N 3.24Å; T1386-G1432 PolarHBondContact OG1-N 3.48Å; G1387-G1432 PolarHBondContact O-N 2.88Å
1433	Q	72.7	Confident	66.5	Low	93 Å²	93	58 Å²	58	44%	0.435	32%	0.315	S	S	.	.			trans	-108.7	157.2	-177.1	-64.1	-66	-15.2	0	0	112.8	T1386 Y1419 Q1430 A1431	T1386-Q1433 PolarHBondContact N-O 2.74Å; T1386-Q1433 PolarHBondContact OG1-N 2.73Å; T1386-Q1433 VanDerWaalsContact OG1-N 3.17Å; T1386-Q1433 PolarHBondContact OG1-O 2.7Å; Y1419-Q1433 HydrophobicContact CE1-CB 3.86Å; Q1430-Q1433 HydrophobicContact CB-CB 4.44Å; Q1430-Q1433 HydrophobicContact CB-CG 4.04Å; Q1430-Q1433 WeakPolarHBondContact O-CB 3.11Å; Q1430-Q1433 PolarHBondContact O-N 3.35Å; A1431-Q1433 PolarHBondContact O-N 3.18Å
1434	I	76	Confident	68.2	Low	69 Å²	69	51.4 Å²	51.4	35%	0.354	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	101.3	176.9	-53.3	174.9	0	0	0	108.6	R1383 H1385 Y1419 N1436	R1383-I1434 HydrophobicContact CB-CG2 3.92Å; H1385-I1434 VanDerWaalsContact CE1-CD1 3.45Å; H1385-I1434 WeakPolarHBondContact CE1-CD1 3.23Å; Y1419-I1434 VanDerWaalsContact CD1-O 3.32Å; Y1419-I1434 WeakPolarHBondContact CD1-O 3.24Å; Y1419-I1434 WeakPolarHBondContact CE1-O 3.31Å; I1434-N1436 PolarHBondContact O-ND2 3.29Å; I1434-N1436 VanDerWaalsContact O-ND2 3.12Å
1435	A	76	Confident	69.7	Low	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	117.9	177.9	0	0	0	0	0	110.2	R1383 I1384 A1417 Y1419 K1428 F1429 F1437	R1383-A1435 WeakPolarHBondContact CA-O 3.44Å; I1384-A1435 PolarHBondContact N-O 2.88Å; I1384-A1435 PolarHBondContact O-N 3.49Å; A1417-A1435 HydrophobicContact CB-CB 4.31Å; Y1419-A1435 HydrophobicContact CE1-CB 4.15Å; K1428-A1435 WeakPolarHBondContact O-CB 3.42Å; F1429-A1435 HydrophobicContact CD1-CB 4.22Å; F1429-A1435 HydrophobicContact CE1-CB 4.44Å; A1435-F1437 HydrophobicContact CB-CE2 3.54Å; A1435-F1437 HydrophobicContact CB-CZ 3.84Å
1436	N	78.5	Confident	71.4	Confident	48 Å²	48	41.1 Å²	41.1	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.8	-179.7	-55.5	-93.2	0	0	0	111	R1383 A1417 Y1418 I1434	R1383-N1436 WeakPolarHBondContact CD-OD1 3.45Å; R1383-N1436 WeakPolarHBondContact CG-OD1 3.23Å; R1383-N1436 PolarHBondContact NE-OD1 3.27Å; A1417-N1436 CarbonylContact C-O 3.58Å; A1417-N1436 WeakPolarHBondContact CA-O 3.32Å; Y1418-N1436 PolarHBondContact N-O 3.5Å; Y1418-N1436 WeakPolarHBondContact O-CB 3.42Å; Y1418-N1436 PolarHBondContact O-N 2.59Å; Y1418-N1436 PolarHBondContact O-ND2 3.46Å; I1434-N1436 PolarHBondContact O-ND2 3.29Å; I1434-N1436 VanDerWaalsContact O-ND2 3.12Å
1437	F	79.4	Confident	72.9	Confident	5 Å²	5	37.2 Å²	37.2	2%	0.022	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	162.4	179.9	-56.4	-85.1	0	0	0	111.4	H1381 V1382 I1384 L1414 K1416 A1417 F1429 A1435	H1381-F1437 WeakPolarHBondContact CA-O 3.19Å; V1382-F1437 HydrophobicContact CB-CB 4.41Å; V1382-F1437 PolarHBondContact N-O 3.39Å; V1382-F1437 PolarHBondContact O-N 3.38Å; I1384-F1437 HydrophobicContact CD1-CD2 4.39Å; I1384-F1437 HydrophobicContact CD1-CE2 4.07Å; I1384-F1437 HydrophobicContact CG1-CD2 4.49Å; I1384-F1437 HydrophobicContact CG1-CE2 4.33Å; L1414-F1437 HydrophobicContact CB-CD1 3.88Å; L1414-F1437 HydrophobicContact CB-CE1 3.8Å; L1414-F1437 HydrophobicContact CB-CG 4.48Å; L1414-F1437 HydrophobicContact CB-CZ 4.35Å; L1414-F1437 HydrophobicContact CD1-CD1 4.39Å; L1414-F1437 HydrophobicContact CD1-CD2 4.08Å; L1414-F1437 HydrophobicContact CD1-CE1 4.45Å; L1414-F1437 HydrophobicContact CD1-CE2 4.15Å; L1414-F1437 HydrophobicContact CD1-CG 4.21Å; L1414-F1437 HydrophobicContact CD1-CZ 4.34Å; L1414-F1437 HydrophobicContact CD2-CB 4.05Å; L1414-F1437 HydrophobicContact CD2-CD1 4.1Å; L1414-F1437 HydrophobicContact CD2-CG 4.02Å; L1414-F1437 HydrophobicContact CG-CD1 4.35Å; L1414-F1437 HydrophobicContact CG-CG 4.47Å; K1416-F1437 WeakPolarHBondContact O-CD1 3.12Å; A1417-F1437 HydrophobicContact CB-CD1 4.36Å; A1417-F1437 HydrophobicContact CB-CE1 3.63Å; A1417-F1437 HydrophobicContact CB-CZ 3.77Å; F1429-F1437 HydrophobicContact CD1-CZ 4.41Å; F1429-F1437 AromaticContact CE1-CE2 3.75Å; F1429-F1437 HydrophobicContact CE1-CE2 3.75Å; F1429-F1437 AromaticContact CE1-CZ 3.47Å; F1429-F1437 HydrophobicContact CE1-CZ 3.47Å; F1429-F1437 VanDerWaalsContact CE1-CZ 3.47Å; F1429-F1437 HydrophobicContact CZ-CE2 4.37Å; F1429-F1437 AromaticContact CZ-CZ 3.75Å; F1429-F1437 HydrophobicContact CZ-CZ 3.75Å; A1435-F1437 HydrophobicContact CB-CE2 3.54Å; A1435-F1437 HydrophobicContact CB-CZ 3.84Å
1438	I	76.3	Confident	74	Confident	51 Å²	51	37.6 Å²	37.6	26%	0.262	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128.3	179.7	-63.2	179.7	0	0	0	108.9	I1379	I1379-I1438 HydrophobicContact CG2-CG2 3.92Å
1439	V	78.3	Confident	74.8	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.5	174.5	166.9	0	0	0	0	108.7	Y1380 V1382 I1400 L1402 T1409 I1412	Y1380-V1439 PolarHBondContact N-O 3.14Å; Y1380-V1439 PolarHBondContact O-N 3.21Å; V1382-V1439 HydrophobicContact CG2-CG2 4.15Å; I1400-V1439 HydrophobicContact CG2-CG2 4.38Å; L1402-V1439 HydrophobicContact CD1-CG1 4.07Å; T1409-V1439 HydrophobicContact CG2-CG1 4.12Å; I1412-V1439 HydrophobicContact CD1-CG1 3.63Å; I1412-V1439 HydrophobicContact CG2-CG2 4.32Å
1440	K	76.6	Confident	75.5	Confident	52 Å²	52	36.1 Å²	36.1	23%	0.226	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117	175.3	-172.8	-179.9	-179.4	-176.2	0	109.5	L1343 D1375 S1377 I1379	L1343-K1440 HydrophobicContact CD1-CB 3.96Å; D1375-K1440 WeakPolarHBondContact OD2-CE 3.44Å; D1375-K1440 IonicContact OD2-NZ 3.65Å; D1375-K1440 PolarHBondContact OD2-NZ 2.69Å; S1377-K1440 WeakPolarHBondContact OG-CE 3.44Å; I1379-K1440 HydrophobicContact CG1-CG 4.37Å
1441	A	73.6	Confident	76.2	Confident	4 Å²	4	33.8 Å²	33.8	3%	0.033	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	159.5	-179.9	0	0	0	0	0	111	S1377 T1378 T1409	S1377-A1441 CarbonylContact C-O 3.19Å; S1377-A1441 WeakPolarHBondContact CA-O 3.48Å; S1377-A1441 WeakPolarHBondContact CB-O 3.2Å; T1378-A1441 PolarHBondContact N-O 2.82Å; T1378-A1441 PolarHBondContact O-N 3.18Å; T1409-A1441 HydrophobicContact CG2-CB 3.92Å
1442	I	75.5	Confident	76.8	Confident	22 Å²	22	32 Å²	32	11%	0.113	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	140.7	174.1	-74.6	168.8	0	0	0	110.2	K1295 E1347 Q1376 I1444	K1295-I1442 HydrophobicContact CB-CD1 3.87Å; K1295-I1442 HydrophobicContact CD-CD1 3.55Å; K1295-I1442 HydrophobicContact CG-CD1 4.31Å; E1347-I1442 HydrophobicContact CB-CD1 4.06Å; E1347-I1442 HydrophobicContact CB-CG1 4.21Å; E1347-I1442 WeakPolarHBondContact OE2-CB 3.38Å; E1347-I1442 PolarHBondContact OE2-N 2.73Å; Q1376-I1442 HydrophobicContact CB-CG2 4.37Å; I1442-I1444 WeakPolarHBondContact O-CG2 3.47Å; I1442-I1444 PolarHBondContact O-N 3.05Å
1443	N	75.9	Confident	77.1	Confident	46 Å²	46	31.4 Å²	31.4	25%	0.246	15%	0.153	C	C	.	.			trans	-49.2	93.3	-168.9	-178.8	-20.9	0	0	0	113.4	Q1376 K1406 G1445	Q1376-N1443 PolarHBondContact O-N 2.94Å; Q1376-N1443 VanDerWaalsContact O-N 3.14Å; K1406-N1443 PolarHBondContact NZ-OD1 3.41Å; N1443-G1445 PolarHBondContact O-N 2.97Å; N1443-G1445 WeakPolarHBondContact OD1-CA 3.43Å; N1443-G1445 PolarHBondContact OD1-N 3.17Å
1444	I	73.9	Confident	77	Confident	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.136	C	C	.	.			trans	-68.9	-11.7	-179.9	61.1	164.5	0	0	0	112.7	Y1380 L1402 G1404 D1405 K1406 D1407 T1409 I1442 I1447	Y1380-I1444 HydrophobicContact CE1-CD1 4.3Å; Y1380-I1444 HydrophobicContact CE1-CG1 4.06Å; Y1380-I1444 HydrophobicContact CE2-CG1 4.18Å; Y1380-I1444 VanDerWaalsContact OH-CG1 3.23Å; Y1380-I1444 WeakPolarHBondContact OH-CG1 3.42Å; Y1380-I1444 PolarHBondContact OH-N 3.37Å; L1402-I1444 HydrophobicContact CB-CD1 3.69Å; G1404-I1444 CarbonylContact C-O 2.94Å; G1404-I1444 VanDerWaalsContact CA-O 3.28Å; G1404-I1444 WeakPolarHBondContact CA-O 3.22Å; D1405-I1444 PolarHBondContact N-O 3.3Å; K1406-I1444 WeakPolarHBondContact CB-O 3.34Å; K1406-I1444 PolarHBondContact N-O 3.38Å; D1407-I1444 HydrophobicContact CB-CG2 4.21Å; D1407-I1444 PolarHBondContact N-O 3.03Å; D1407-I1444 WeakPolarHBondContact O-CB 3.31Å; T1409-I1444 HydrophobicContact CG2-CD1 4.45Å; T1409-I1444 HydrophobicContact CG2-CG2 4.5Å; I1442-I1444 WeakPolarHBondContact O-CG2 3.47Å; I1442-I1444 PolarHBondContact O-N 3.05Å; I1444-I1447 HydrophobicContact CD1-CG1 4.34Å
1445	G	73.4	Confident	76.5	Confident	2 Å²	2	26.6 Å²	26.6	2%	0.021	13%	0.13	C	C	.	.			trans	80.9	-142.5	-177	0	0	0	0	0	113.1	D1405 N1443 L1475	D1405-G1445 VanDerWaalsContact OD1-CA 3.26Å; D1405-G1445 WeakPolarHBondContact OD1-CA 3.4Å; N1443-G1445 PolarHBondContact O-N 2.97Å; N1443-G1445 WeakPolarHBondContact OD1-CA 3.43Å; N1443-G1445 PolarHBondContact OD1-N 3.17Å; G1445-L1475 WeakPolarHBondContact O-CD1 3.5Å
1446	N	77.6	Confident	75.6	Confident	79 Å²	79	30.3 Å²	30.3	42%	0.422	15%	0.153	S	C	.	.	S	Bend	trans	-79.5	125.3	-175.9	-71.4	-32.7	0	0	0	111.2	G1404 D1405 K1448 L1477 W1479	G1404-N1446 CarbonylContact C-O 3.55Å; G1404-N1446 VanDerWaalsContact CA-O 3.22Å; G1404-N1446 WeakPolarHBondContact CA-O 3.47Å; D1405-N1446 PolarHBondContact N-O 3.48Å; D1405-N1446 PolarHBondContact OD1-N 2.86Å; N1446-K1448 PolarHBondContact O-N 3.24Å; N1446-L1477 WeakPolarHBondContact OD1-CD1 3.06Å; N1446-W1479 HydrophobicContact CB-CZ2 4.41Å
1447	I	81.1	Confident	74.3	Confident	7 Å²	7	32 Å²	32	4%	0.036	17%	0.174	C	C	.	.			trans	-67.1	120	-177.8	-54.5	-177.2	0	0	0	110.4	Y1380 Y1403 I1444 K1449 I1450 V1470 W1479 F1481	Y1380-I1447 HydrophobicContact CD1-CD1 4.23Å; Y1380-I1447 HydrophobicContact CE1-CD1 4.4Å; Y1403-I1447 CarbonylContact O-C 3.54Å; Y1403-I1447 WeakPolarHBondContact O-CA 3.38Å; I1444-I1447 HydrophobicContact CD1-CG1 4.34Å; I1447-K1449 WeakPolarHBondContact CG2-O 3.39Å; I1447-I1450 HydrophobicContact CG2-CG2 3.82Å; I1447-V1470 HydrophobicContact CD1-CB 4.02Å; I1447-V1470 HydrophobicContact CD1-CG1 3.58Å; I1447-W1479 HydrophobicContact CB-CD2 3.99Å; I1447-W1479 HydrophobicContact CB-CE3 4.43Å; I1447-W1479 HydrophobicContact CB-CG 4.25Å; I1447-W1479 HydrophobicContact CB-CZ2 4.42Å; I1447-W1479 HydrophobicContact CD1-CD2 3.95Å; I1447-W1479 HydrophobicContact CD1-CE3 3.55Å; I1447-W1479 HydrophobicContact CD1-CZ3 3.86Å; I1447-W1479 HydrophobicContact CG1-CD2 3.95Å; I1447-W1479 HydrophobicContact CG1-CE3 3.88Å; I1447-W1479 HydrophobicContact CG1-CH2 4.13Å; I1447-W1479 HydrophobicContact CG1-CZ2 4.19Å; I1447-W1479 HydrophobicContact CG1-CZ3 3.97Å; I1447-F1481 HydrophobicContact CG2-CZ 3.87Å
1448	K	75.5	Confident	72.8	Confident	100 Å²	100	36.9 Å²	36.9	44%	0.435	20%	0.204	S	C	.	.			trans	-88.9	-36.4	175.4	-73	-179.8	167.6	-173.6	0	112.8	E1032 Y1403 N1446 P1498	E1032-K1448 IonicContact OE2-NZ 2.94Å; E1032-K1448 PolarHBondContact OE2-NZ 3.04Å; Y1403-K1448 PolarHBondContact O-N 3.43Å; N1446-K1448 PolarHBondContact O-N 3.24Å; K1448-P1498 WeakPolarHBondContact O-CD 3.19Å
1449	K	77.8	Confident	71.3	Confident	16 Å²	16	38.9 Å²	38.9	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	163.6	177.5	72.6	177.6	-162.1	-173.1	0	110.6	E1069 Y1403 I1447 I1495 L1496 Y1497	E1069-K1449 WeakPolarHBondContact OE1-CE 3.49Å; E1069-K1449 IonicContact OE1-NZ 3.02Å; E1069-K1449 PolarHBondContact OE1-NZ 3.43Å; E1069-K1449 IonicContact OE2-NZ 2.74Å; E1069-K1449 PolarHBondContact OE2-NZ 2.79Å; Y1403-K1449 WeakPolarHBondContact CB-O 3.25Å; Y1403-K1449 HydrophobicContact CD2-CD 4.2Å; Y1403-K1449 VanDerWaalsContact CD2-CE 3.42Å; Y1403-K1449 HydrophobicContact CD2-CG 3.65Å; Y1403-K1449 HydrophobicContact CE2-CD 4.4Å; Y1403-K1449 HydrophobicContact CE2-CG 4.3Å; Y1403-K1449 HydrophobicContact CG-CD 4.35Å; Y1403-K1449 HydrophobicContact CG-CG 3.79Å; Y1403-K1449 PolarHBondContact N-O 3.05Å; I1447-K1449 WeakPolarHBondContact CG2-O 3.39Å; K1449-I1495 HydrophobicContact CD-CG2 4.1Å; K1449-L1496 CarbonylContact C-O 3.49Å; K1449-L1496 WeakPolarHBondContact CA-O 3.06Å; K1449-L1496 WeakPolarHBondContact CB-O 3.03Å; K1449-Y1497 HydrophobicContact CB-CD1 3.71Å; K1449-Y1497 HydrophobicContact CB-CE1 3.74Å; K1449-Y1497 HydrophobicContact CB-CG 4.25Å; K1449-Y1497 HydrophobicContact CD-CE1 3.94Å; K1449-Y1497 HydrophobicContact CG-CE1 4.39Å
1450	I	83.6	Confident	69.9	Low	0 Å²	0	41 Å²	41	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.1	165.7	64.1	174.9	0	0	0	110	Q1401 L1402 I1447 I1452 V1468 F1481 I1495 L1496	Q1401-I1450 WeakPolarHBondContact O-CA 3.07Å; L1402-I1450 HydrophobicContact CD2-CB 4.25Å; L1402-I1450 HydrophobicContact CD2-CG2 3.46Å; L1402-I1450 VanDerWaalsContact CD2-CG2 3.46Å; I1447-I1450 HydrophobicContact CG2-CG2 3.82Å; I1450-I1452 HydrophobicContact CD1-CD1 4.34Å; I1450-V1468 HydrophobicContact CD1-CB 4.07Å; I1450-V1468 HydrophobicContact CD1-CG1 3.86Å; I1450-F1481 HydrophobicContact CD1-CB 4.32Å; I1450-F1481 HydrophobicContact CD1-CD1 4.14Å; I1450-F1481 HydrophobicContact CD1-CD2 3.72Å; I1450-F1481 HydrophobicContact CD1-CE1 4.37Å; I1450-F1481 HydrophobicContact CD1-CE2 4.01Å; I1450-F1481 HydrophobicContact CD1-CG 3.81Å; I1450-F1481 HydrophobicContact CD1-CZ 4.33Å; I1450-F1481 HydrophobicContact CG1-CD1 4.02Å; I1450-F1481 HydrophobicContact CG1-CD2 4.39Å; I1450-F1481 HydrophobicContact CG1-CE1 4Å; I1450-F1481 HydrophobicContact CG1-CE2 4.4Å; I1450-F1481 HydrophobicContact CG1-CG 4.22Å; I1450-F1481 HydrophobicContact CG1-CZ 4.22Å; I1450-F1481 HydrophobicContact CG2-CE1 4.22Å; I1450-F1481 HydrophobicContact CG2-CE2 4.04Å; I1450-F1481 HydrophobicContact CG2-CZ 3.73Å; I1450-I1495 WeakPolarHBondContact O-CA 3.22Å; I1450-L1496 HydrophobicContact CD1-CB 4.4Å; I1450-L1496 HydrophobicContact CD1-CD1 3.87Å; I1450-L1496 HydrophobicContact CG1-CB 3.8Å; I1450-L1496 HydrophobicContact CG1-CD1 4.01Å; I1450-L1496 HydrophobicContact CG1-CG 4.46Å; I1450-L1496 PolarHBondContact N-O 2.94Å; I1450-L1496 PolarHBondContact O-N 2.83Å
1451	R	81.3	Confident	68.8	Low	30 Å²	30	40.7 Å²	40.7	11%	0.113	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.4	171.6	161.6	-175	-88	173.9	-25.9	108.2	I1400 Q1401 Y1403 E1453 E1493 L1494 I1495	I1400-R1451 CarbonylContact C-O 3.55Å; I1400-R1451 VanDerWaalsContact CA-O 3.32Å; I1400-R1451 WeakPolarHBondContact CA-O 3.26Å; I1400-R1451 WeakPolarHBondContact CG1-O 3.4Å; Q1401-R1451 HydrophobicContact CB-CB 4.22Å; Q1401-R1451 HydrophobicContact CG-CG 4.48Å; Q1401-R1451 PolarHBondContact N-O 2.99Å; Q1401-R1451 PolarHBondContact O-N 3.37Å; Y1403-R1451 HydrophobicContact CE2-CB 4.01Å; Y1403-R1451 PolarHBondContact OH-NH1 2.69Å; R1451-E1453 HydrophobicContact CG-CG 4.27Å; R1451-E1493 HydrophobicContact CG-CG 4.19Å; R1451-E1493 IonicContact CZ-OE1 2.73Å; R1451-E1493 IonicContact NE-OE1 2.69Å; R1451-E1493 PolarHBondContact NE-OE1 3.4Å; R1451-E1493 IonicContact NH2-OE1 3.16Å; R1451-E1493 PolarHBondContact NH2-OE1 2.81Å; R1451-E1493 IonicContact NH2-OE2 2.69Å; R1451-L1494 CarbonylContact C-O 3.6Å; R1451-L1494 WeakPolarHBondContact CA-O 3.41Å; R1451-I1495 HydrophobicContact CB-CG1 4.42Å
1452	I	81.6	Confident	68.1	Low	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130.6	177.4	-60.3	176.3	0	0	0	107.7	V1398 Q1399 I1400 I1450 W1463 V1468 I1487 E1493 L1494 L1496	V1398-I1452 HydrophobicContact CG1-CG2 3.51Å; Q1399-I1452 CarbonylContact O-C 3.54Å; Q1399-I1452 WeakPolarHBondContact O-CA 3.23Å; I1400-I1452 HydrophobicContact CD1-CG1 4.29Å; I1400-I1452 HydrophobicContact CG1-CG1 4.17Å; I1450-I1452 HydrophobicContact CD1-CD1 4.34Å; I1452-W1463 HydrophobicContact CG2-CZ3 4.14Å; I1452-V1468 HydrophobicContact CD1-CG2 3.86Å; I1452-I1487 HydrophobicContact CG2-CD1 4.2Å; I1452-E1493 CarbonylContact O-C 3.49Å; I1452-E1493 WeakPolarHBondContact O-CA 3.04Å; I1452-L1494 HydrophobicContact CB-CB 4.5Å; I1452-L1494 PolarHBondContact N-O 2.9Å; I1452-L1494 PolarHBondContact O-N 3.44Å; I1452-L1496 HydrophobicContact CD1-CD1 4.26Å
1453	E	75.2	Confident	67.9	Low	33 Å²	33	46.7 Å²	46.7	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145.3	178.6	-65.6	175.6	-163.2	0	0	110.3	V1398 Q1399 R1451 P1492 E1493	V1398-E1453 CarbonylContact C-O 3.3Å; V1398-E1453 VanDerWaalsContact CA-O 3.24Å; V1398-E1453 WeakPolarHBondContact CA-O 3.47Å; Q1399-E1453 HydrophobicContact CB-CB 4.31Å; Q1399-E1453 PolarHBondContact N-O 2.9Å; Q1399-E1453 PolarHBondContact O-N 3.18Å; R1451-E1453 HydrophobicContact CG-CG 4.27Å; E1453-P1492 CarbonylContact C-O 3.48Å; E1453-P1492 WeakPolarHBondContact CA-O 3.42Å; E1453-E1493 HydrophobicContact CG-CG 4.19Å
1454	H	70.1	Confident	67.8	Low	18 Å²	18	46.3 Å²	46.3	8%	0.083	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128	-175.3	-179.5	-86.5	0	0	0	110.5	S1394 W1463 I1487 P1492	S1394-H1454 PolarHBondContact OG-NE2 2.86Å; H1454-W1463 AromaticContact CD2-CE3 3.76Å; H1454-I1487 HydrophobicContact CB-CG2 3.71Å; H1454-P1492 PolarHBondContact N-O 2.68Å; H1454-P1492 WeakPolarHBondContact O-CB 3.26Å
1455	D	64.3	Low	67.9	Low	43 Å²	43	46.3 Å²	46.3	23%	0.23	28%	0.276	C	S	.	.			trans	-85.9	113.8	-178.5	73.8	-0.4	0	0	0	114.1	N1397 R1413 A1457	N1397-D1455 WeakPolarHBondContact CA-OD1 3.3Å; N1397-D1455 VanDerWaalsContact CB-OD1 3.25Å; N1397-D1455 WeakPolarHBondContact CB-OD1 3.41Å; N1397-D1455 PolarHBondContact N-OD1 3.14Å; N1397-D1455 PolarHBondContact ND2-OD1 3Å; N1397-D1455 PolarHBondContact ND2-OD2 3.05Å; N1397-D1455 VanDerWaalsContact ND2-OD2 3.17Å; N1397-D1455 PolarHBondContact O-N 2.94Å; R1413-D1455 IonicContact CZ-OD2 2.84Å; R1413-D1455 IonicContact NH1-OD2 3.96Å; R1413-D1455 IonicContact NH2-OD2 2.72Å; R1413-D1455 PolarHBondContact NH2-OD2 3.45Å; D1455-A1457 PolarHBondContact O-N 2.95Å
1456	T	57.3	Low	68.1	Low	79 Å²	79	49.8 Å²	49.8	49%	0.485	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	14.7	-169.3	58.3	0	0	0	0	114.6	V1458 P1489 P1492	T1456-V1458 PolarHBondContact O-N 3.47Å; T1456-P1489 HydrophobicContact CG2-CB 4.1Å; T1456-P1492 HydrophobicContact CG2-CB 3.95Å
1457	A	52.3	Low	68.4	Low	84 Å²	84	48.2 Å²	48.2	69%	0.694	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-14	-163.1	0	0	0	0	0	115.2	D1455	D1455-A1457 PolarHBondContact O-N 2.95Å
1458	V	47.5	Very low	68.7	Low	106 Å²	106	47.9 Å²	47.9	64%	0.642	28%	0.278	S	S	*	.	S	Bend	trans	-139.9	83.3	-173.7	-169.4	0	0	0	0	112.1	T1456 S1460	T1456-V1458 PolarHBondContact O-N 3.47Å; V1458-S1460 PolarHBondContact O-N 2.86Å
1459	G	44.9	Very low	69.4	Low	93 Å²	93	43.8 Å²	43.8	96%	0.959	26%	0.26	S	S	*	.			trans	54.7	-9.6	145.8	0	0	0	0	0	123
1460	S	47.9	Very low	70	Confident	47 Å²	47	43 Å²	43	33%	0.329	26%	0.257	S	S	.	.			trans	-102.9	176.3	-168.6	76.8	0	0	0	0	114.1	D1395 V1458	D1395-S1460 WeakPolarHBondContact OD1-CB 3.3Å; D1395-S1460 PolarHBondContact OD1-OG 2.91Å; V1458-S1460 PolarHBondContact O-N 2.86Å
1461	A	53.7	Low	70.2	Confident	45 Å²	45	43.7 Å²	43.7	37%	0.372	26%	0.26	S	S	.	.			trans	-87.7	174.5	-151.6	0	0	0	0	0	116	W1463	A1461-W1463 PolarHBondContact O-N 2.89Å
1462	R	59.7	Low	70.4	Confident	151 Å²	151	42.2 Å²	42.2	57%	0.57	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-56.7	121.7	175	-56.6	177.7	179.1	165.8	-2.4	110.2	I1392 F1486 T1488	I1392-R1462 WeakPolarHBondContact CA-O 3.49Å; R1462-F1486 HydrophobicContact CB-CB 4.48Å; R1462-F1486 HydrophobicContact CB-CD1 3.6Å; R1462-F1486 HydrophobicContact CB-CE1 4.15Å; R1462-F1486 HydrophobicContact CB-CG 4.32Å; R1462-T1488 HydrophobicContact CB-CG2 4.33Å; R1462-T1488 HydrophobicContact CG-CG2 4.05Å
1463	W	70.4	Confident	70	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.8	-176	179.6	39.9	0	0	0	111	I1384 V1398 F1429 I1452 H1454 A1461 V1465 F1486 I1487	I1384-W1463 HydrophobicContact CD1-CH2 4.25Å; I1384-W1463 HydrophobicContact CG2-CH2 4.14Å; I1384-W1463 HydrophobicContact CG2-CZ2 3.78Å; V1398-W1463 HydrophobicContact CB-CZ3 4.47Å; V1398-W1463 HydrophobicContact CG1-CH2 4.1Å; V1398-W1463 HydrophobicContact CG1-CZ3 4.07Å; V1398-W1463 HydrophobicContact CG2-CE3 4.17Å; V1398-W1463 HydrophobicContact CG2-CH2 3.74Å; V1398-W1463 HydrophobicContact CG2-CZ3 3.51Å; F1429-W1463 HydrophobicContact CB-CZ2 4.36Å; F1429-W1463 HydrophobicContact CD1-CH2 4.22Å; F1429-W1463 AromaticContact CD1-CZ2 3.43Å; F1429-W1463 HydrophobicContact CD1-CZ2 3.43Å; F1429-W1463 VanDerWaalsContact CD1-CZ2 3.43Å; F1429-W1463 HydrophobicContact CD2-CZ2 4.46Å; F1429-W1463 HydrophobicContact CE1-CH2 4.08Å; F1429-W1463 AromaticContact CE1-CZ2 3.75Å; F1429-W1463 HydrophobicContact CE1-CZ2 3.75Å; F1429-W1463 AromaticContact CG-CE2 3.98Å; F1429-W1463 AromaticContact CG-CZ2 3.83Å; F1429-W1463 HydrophobicContact CG-CZ2 3.83Å; F1429-W1463 AromaticContact CG-NE1 3.98Å; F1429-W1463 HydrophobicContact CZ-CH2 4.45Å; F1429-W1463 HydrophobicContact CZ-CZ2 4.41Å; I1452-W1463 HydrophobicContact CG2-CZ3 4.14Å; H1454-W1463 AromaticContact CD2-CE3 3.76Å; A1461-W1463 PolarHBondContact O-N 2.89Å; W1463-V1465 HydrophobicContact CD2-CG2 4.07Å; W1463-V1465 HydrophobicContact CE3-CG2 4.12Å; W1463-V1465 HydrophobicContact CH2-CG2 3.93Å; W1463-V1465 HydrophobicContact CZ2-CG2 3.88Å; W1463-V1465 HydrophobicContact CZ3-CG2 4.05Å; W1463-F1486 CarbonylContact O-C 3.51Å; W1463-F1486 WeakPolarHBondContact O-CA 3.18Å; W1463-I1487 HydrophobicContact CE3-CB 4.24Å; W1463-I1487 HydrophobicContact CE3-CD1 3.71Å; W1463-I1487 HydrophobicContact CE3-CG1 4.45Å; W1463-I1487 HydrophobicContact CZ3-CD1 3.69Å; W1463-I1487 PolarHBondContact N-O 2.92Å; W1463-I1487 PolarHBondContact O-N 2.86Å
1464	F	74.7	Confident	69.8	Low	39 Å²	39	47.6 Å²	47.6	17%	0.171	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.3	179.5	-168.9	-92.8	0	0	0	112.1	G1387 I1392 E1466 N1484 F1486	G1387-F1464 PolarHBondContact N-O 3.47Å; I1392-F1464 HydrophobicContact CB-CB 4.06Å; I1392-F1464 HydrophobicContact CD1-CB 4.03Å; I1392-F1464 HydrophobicContact CG1-CB 4.34Å; I1392-F1464 PolarHBondContact O-N 3.3Å; F1464-E1466 HydrophobicContact CE1-CB 4.23Å; F1464-N1484 HydrophobicContact CZ-CB 4.29Å; F1464-F1486 HydrophobicContact CB-CD1 3.86Å; F1464-F1486 HydrophobicContact CB-CE1 3.71Å; F1464-F1486 HydrophobicContact CB-CZ 4.27Å; F1464-F1486 AromaticContact CD2-CD1 3.99Å; F1464-F1486 HydrophobicContact CD2-CD1 3.99Å; F1464-F1486 AromaticContact CD2-CD2 3.76Å; F1464-F1486 HydrophobicContact CD2-CD2 3.76Å; F1464-F1486 AromaticContact CD2-CE1 3.93Å; F1464-F1486 HydrophobicContact CD2-CE1 3.93Å; F1464-F1486 AromaticContact CD2-CE2 3.67Å; F1464-F1486 HydrophobicContact CD2-CE2 3.67Å; F1464-F1486 AromaticContact CD2-CG 3.92Å; F1464-F1486 HydrophobicContact CD2-CG 3.92Å; F1464-F1486 AromaticContact CD2-CZ 3.76Å; F1464-F1486 HydrophobicContact CD2-CZ 3.76Å; F1464-F1486 HydrophobicContact CE2-CD2 4.3Å; F1464-F1486 HydrophobicContact CE2-CE2 4.19Å; F1464-F1486 HydrophobicContact CG-CD1 4.45Å; F1464-F1486 HydrophobicContact CG-CE1 4.28Å; F1464-F1486 HydrophobicContact CG-CZ 4.4Å
1465	V	75.8	Confident	69.9	Low	0 Å²	0	49 Å²	49	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.2	171.1	-175.9	0	0	0	0	108.2	I1384 W1463 V1468 C1483 N1484 R1485 I1487	I1384-V1465 HydrophobicContact CG2-CG1 4.1Å; I1384-V1465 HydrophobicContact CG2-CG2 4.46Å; W1463-V1465 HydrophobicContact CD2-CG2 4.07Å; W1463-V1465 HydrophobicContact CE3-CG2 4.12Å; W1463-V1465 HydrophobicContact CH2-CG2 3.93Å; W1463-V1465 HydrophobicContact CZ2-CG2 3.88Å; W1463-V1465 HydrophobicContact CZ3-CG2 4.05Å; V1465-V1468 HydrophobicContact CG1-CG2 3.88Å; V1465-C1483 HydrophobicContact CB-CB 4.21Å; V1465-C1483 HydrophobicContact CG1-CB 3.88Å; V1465-C1483 WeakPolarHBondContact O-CB 3.36Å; V1465-N1484 WeakPolarHBondContact O-CA 3.37Å; V1465-N1484 PolarHBondContact O-N 3.44Å; V1465-N1484 VanDerWaalsContact O-N 3.08Å; V1465-R1485 PolarHBondContact N-O 3.44Å; V1465-R1485 PolarHBondContact O-N 2.82Å; V1465-I1487 HydrophobicContact CG2-CD1 4.08Å
1466	E	77.1	Confident	70.4	Confident	75 Å²	75	47.3 Å²	47.3	35%	0.35	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-53.9	172.1	-179.5	-172.8	-158	0	0	108.8	H1385 F1464 C1483 N1484	H1385-E1466 HydrophobicContact CB-CB 4.14Å; H1385-E1466 IonicContact ND1-OE2 3.35Å; H1385-E1466 PolarHBondContact O-N 3.05Å; F1464-E1466 HydrophobicContact CE1-CB 4.23Å; E1466-C1483 WeakPolarHBondContact O-CA 3.39Å; E1466-C1483 WeakPolarHBondContact O-CB 3.34Å; E1466-C1483 PolarHBondContact O-N 3.39Å; E1466-N1484 PolarHBondContact O-N 3.03Å
1467	R	85.2	Confident	71.5	Confident	46 Å²	46	44.5 Å²	44.5	17%	0.174	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	165.3	-177.9	61.5	-178.5	-153.5	139.7	17.3	112.8	H1385 E1469 F1481 E1482	H1385-R1467 HydrophobicContact CB-CG 3.58Å; H1385-R1467 WeakPolarHBondContact CB-O 3.43Å; H1385-R1467 PolarHBondContact CD2-NE 2.91Å; H1385-R1467 PolarHBondContact CE1-NE 2.94Å; H1385-R1467 PolarHBondContact CE1-NH2 2.99Å; H1385-R1467 PolarHBondContact N-O 3.04Å; H1385-R1467 PolarHBondContact NE2-NE 3.1Å; H1385-R1467 PolarHBondContact NE2-NH2 3.14Å; R1467-E1469 IonicContact CZ-OE1 2.73Å; R1467-E1469 IonicContact NH1-OE1 3.64Å; R1467-E1469 IonicContact NH2-OE1 3.42Å; R1467-E1469 PolarHBondContact NH2-OE1 3.02Å; R1467-F1481 CarbonylContact C-O 3.56Å; R1467-F1481 WeakPolarHBondContact CA-O 3.49Å; R1467-F1481 WeakPolarHBondContact CB-O 3.32Å; R1467-E1482 WeakPolarHBondContact CB-OE2 3.45Å; R1467-E1482 VanDerWaalsContact CD-OE1 3.29Å; R1467-E1482 WeakPolarHBondContact CD-OE1 3.35Å; R1467-E1482 WeakPolarHBondContact CD-OE2 3.33Å; R1467-E1482 IonicContact NH1-OE1 2.8Å
1468	V	86.8	Confident	73	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.7	174.5	-177.5	0	0	0	0	110	V1382 R1383 I1384 I1450 I1452 V1465 V1470 K1480 F1481	V1382-V1468 HydrophobicContact CG1-CG1 3.99Å; R1383-V1468 CarbonylContact O-C 3.2Å; R1383-V1468 WeakPolarHBondContact O-CA 3.49Å; I1384-V1468 HydrophobicContact CG1-CG1 4.37Å; I1384-V1468 HydrophobicContact CG1-CG2 4.33Å; I1384-V1468 HydrophobicContact CG2-CG2 4.38Å; I1450-V1468 HydrophobicContact CD1-CB 4.07Å; I1450-V1468 HydrophobicContact CD1-CG1 3.86Å; I1452-V1468 HydrophobicContact CD1-CG2 3.86Å; V1465-V1468 HydrophobicContact CG1-CG2 3.88Å; V1468-V1470 HydrophobicContact CG1-CG2 4.32Å; V1468-K1480 CarbonylContact O-C 3.56Å; V1468-K1480 WeakPolarHBondContact O-CA 3.3Å; V1468-F1481 HydrophobicContact CB-CB 4.33Å; V1468-F1481 PolarHBondContact N-O 2.72Å; V1468-F1481 PolarHBondContact O-N 2.84Å
1469	E	90.5	Very high	75	Confident	15 Å²	15	36.5 Å²	36.5	7%	0.07	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	143.2	168.1	-59.7	-163.5	153.3	0	0	110.1	V1382 R1383 R1467 L1478 W1479 K1480	V1382-E1469 CarbonylContact C-O 3.59Å; V1382-E1469 WeakPolarHBondContact CA-O 3.42Å; R1383-E1469 HydrophobicContact CB-CB 4.12Å; R1383-E1469 HydrophobicContact CG-CB 4.34Å; R1383-E1469 IonicContact CZ-OE2 3.67Å; R1383-E1469 PolarHBondContact N-O 3.45Å; R1383-E1469 IonicContact NH1-OE2 3.79Å; R1383-E1469 PolarHBondContact NH1-OE2 2.89Å; R1383-E1469 PolarHBondContact O-N 3.08Å; R1467-E1469 IonicContact CZ-OE1 2.73Å; R1467-E1469 IonicContact NH1-OE1 3.64Å; R1467-E1469 IonicContact NH2-OE1 3.42Å; R1467-E1469 PolarHBondContact NH2-OE1 3.02Å; E1469-L1478 HydrophobicContact CB-CD1 3.97Å; E1469-W1479 CarbonylContact C-O 3.57Å; E1469-W1479 WeakPolarHBondContact CA-O 3.33Å; E1469-K1480 HydrophobicContact CG-CD 4.36Å; E1469-K1480 HydrophobicContact CG-CG 4.15Å; E1469-K1480 WeakPolarHBondContact OE1-CE 3.18Å; E1469-K1480 IonicContact OE1-NZ 2.72Å; E1469-K1480 PolarHBondContact OE1-NZ 3.22Å
1470	V	90.5	Very high	76.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	117.6	171.9	-172.4	0	0	0	0	109.7	Y1380 H1381 V1382 L1402 I1447 V1468 L1478 W1479 F1481	Y1380-V1470 HydrophobicContact CD1-CG1 4.1Å; H1381-V1470 CarbonylContact O-C 3.6Å; H1381-V1470 WeakPolarHBondContact O-CA 3.14Å; V1382-V1470 HydrophobicContact CG2-CG1 4.29Å; V1382-V1470 HydrophobicContact CG2-CG2 4.34Å; L1402-V1470 HydrophobicContact CD1-CG1 4.21Å; L1402-V1470 HydrophobicContact CD2-CG2 4.3Å; I1447-V1470 HydrophobicContact CD1-CB 4.02Å; I1447-V1470 HydrophobicContact CD1-CG1 3.58Å; V1468-V1470 HydrophobicContact CG1-CG2 4.32Å; V1470-L1478 CarbonylContact O-C 3.59Å; V1470-L1478 WeakPolarHBondContact O-CA 3.36Å; V1470-W1479 PolarHBondContact N-O 2.9Å; V1470-W1479 PolarHBondContact O-N 2.91Å; V1470-F1481 HydrophobicContact CG2-CE2 4.07Å
1471	E	87.6	Confident	78.4	Confident	13 Å²	13	32.6 Å²	32.6	6%	0.061	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.9	-176.2	-173.6	-179.6	137.6	0	0	111.1	Y1380 H1381 R1383 R1473 L1478 V1506	Y1380-E1471 WeakPolarHBondContact CA-O 2.99Å; H1381-E1471 HydrophobicContact CB-CB 4.3Å; H1381-E1471 PolarHBondContact N-O 3.12Å; H1381-E1471 PolarHBondContact O-N 2.96Å; R1383-E1471 IonicContact CZ-OE2 3.62Å; R1383-E1471 IonicContact NH1-OE2 3.04Å; R1383-E1471 PolarHBondContact NH1-OE2 2.82Å; R1383-E1471 VanDerWaalsContact NH1-OE2 3.11Å; R1383-E1471 IonicContact NH2-OE2 3.22Å; R1383-E1471 PolarHBondContact NH2-OE2 2.97Å; E1471-R1473 HydrophobicContact CG-CG 4.34Å; E1471-R1473 IonicContact OE1-CZ 3.26Å; E1471-R1473 IonicContact OE1-NE 2.69Å; E1471-R1473 PolarHBondContact OE1-NE 2.66Å; E1471-R1473 IonicContact OE1-NH2 3.64Å; E1471-R1473 PolarHBondContact OE1-NH2 2.79Å; E1471-L1478 HydrophobicContact CB-CD1 4.11Å; E1471-V1506 HydrophobicContact CG-CG2 4.26Å
1472	A	84.9	Confident	79.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	91.2	178.1	0	0	0	0	0	110.7	T1378 Y1380 K1474 L1475 G1476 L1477 W1479	T1378-A1472 HydrophobicContact CG2-CB 3.99Å; Y1380-A1472 HydrophobicContact CD1-CB 3.65Å; Y1380-A1472 HydrophobicContact CE1-CB 3.64Å; Y1380-A1472 HydrophobicContact CG-CB 4.44Å; A1472-K1474 PolarHBondContact O-N 2.76Å; A1472-L1475 HydrophobicContact CB-CB 4.09Å; A1472-L1475 HydrophobicContact CB-CD1 3.97Å; A1472-L1475 HydrophobicContact CB-CG 4.19Å; A1472-L1475 CarbonylContact O-C 3.51Å; A1472-L1475 WeakPolarHBondContact O-CA 3.07Å; A1472-L1475 PolarHBondContact O-N 3.28Å; A1472-G1476 PolarHBondContact O-N 3.28Å; A1472-L1477 PolarHBondContact N-O 3.08Å; A1472-L1477 PolarHBondContact O-N 2.84Å; A1472-W1479 HydrophobicContact CB-CH2 4.37Å; A1472-W1479 HydrophobicContact CB-CZ3 3.78Å
1473	R	74.3	Confident	80	Confident	76 Å²	76	28 Å²	28	29%	0.287	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-62.1	-37.9	-173.6	-67.1	-174.7	175.4	164	3.8	113.7	E1471 L1475 G1476 P1508 M1509	E1471-R1473 HydrophobicContact CG-CG 4.34Å; E1471-R1473 IonicContact OE1-CZ 3.26Å; E1471-R1473 IonicContact OE1-NE 2.69Å; E1471-R1473 PolarHBondContact OE1-NE 2.66Å; E1471-R1473 IonicContact OE1-NH2 3.64Å; E1471-R1473 PolarHBondContact OE1-NH2 2.79Å; R1473-L1475 PolarHBondContact O-N 2.89Å; R1473-L1475 VanDerWaalsContact O-N 3.15Å; R1473-G1476 PolarHBondContact O-N 2.94Å; R1473-P1508 WeakPolarHBondContact O-CA 3.27Å; R1473-M1509 HydrophobicContact CB-CB 4.27Å; R1473-M1509 HydrophobicContact CB-CG 3.74Å; R1473-M1509 HydrophobicContact CG-CG 4.34Å
1474	K	71.2	Confident	80.1	Confident	69 Å²	69	32.5 Å²	32.5	30%	0.3	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-65.4	-12.6	174.7	-159.9	172	179.4	174.6	0	113.4	D1375 S1377 T1378 A1472	D1375-K1474 PolarHBondContact O-NZ 2.81Å; S1377-K1474 VanDerWaalsContact O-CD 3.25Å; S1377-K1474 WeakPolarHBondContact O-CD 3.5Å; S1377-K1474 WeakPolarHBondContact O-CE 3.47Å; S1377-K1474 PolarHBondContact O-NZ 3.32Å; T1378-K1474 HydrophobicContact CG2-CB 4.14Å; A1472-K1474 PolarHBondContact O-N 2.76Å
1475	L	72.2	Confident	79.6	Confident	47 Å²	47	35.1 Å²	35.1	25%	0.246	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-106.4	-10.1	171.9	-61.7	178.7	0	0	0	113.3	T1378 Y1380 G1445 A1472 R1473 L1477 W1479	T1378-L1475 HydrophobicContact CG2-CD1 4.48Å; T1378-L1475 HydrophobicContact CG2-CG 4.3Å; Y1380-L1475 HydrophobicContact CE1-CD1 4.24Å; G1445-L1475 WeakPolarHBondContact O-CD1 3.5Å; A1472-L1475 HydrophobicContact CB-CB 4.09Å; A1472-L1475 HydrophobicContact CB-CD1 3.97Å; A1472-L1475 HydrophobicContact CB-CG 4.19Å; A1472-L1475 CarbonylContact O-C 3.51Å; A1472-L1475 WeakPolarHBondContact O-CA 3.07Å; A1472-L1475 PolarHBondContact O-N 3.28Å; R1473-L1475 PolarHBondContact O-N 2.89Å; R1473-L1475 VanDerWaalsContact O-N 3.15Å; L1475-L1477 VanDerWaalsContact C-N 3.3Å; L1475-L1477 HydrophobicContact CB-CB 4.5Å; L1475-L1477 HydrophobicContact CB-CD1 4.39Å; L1475-L1477 PolarHBondContact O-N 3.08Å; L1475-W1479 HydrophobicContact CD1-CH2 4.04Å
1476	G	73.2	Confident	79.2	Confident	9 Å²	9	39.1 Å²	39.1	9%	0.093	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	26.2	-174.2	0	0	0	0	0	114.6	A1472 R1473 F1505 V1506	A1472-G1476 PolarHBondContact O-N 3.28Å; R1473-G1476 PolarHBondContact O-N 2.94Å; G1476-F1505 CarbonylContact O-C 3.5Å; G1476-F1505 VanDerWaalsContact O-CA 3.28Å; G1476-F1505 WeakPolarHBondContact O-CA 3.44Å; G1476-V1506 VanDerWaalsContact CA-O 3.28Å; G1476-V1506 WeakPolarHBondContact CA-O 3.21Å; G1476-V1506 PolarHBondContact O-N 2.96Å
1477	L	80.3	Confident	78.7	Confident	19 Å²	19	35.8 Å²	35.8	10%	0.099	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.2	-171.9	-69.9	167.8	0	0	0	113.6	N1446 A1472 L1475 W1479 I1503 S1504 F1505	N1446-L1477 WeakPolarHBondContact OD1-CD1 3.06Å; A1472-L1477 PolarHBondContact N-O 3.08Å; A1472-L1477 PolarHBondContact O-N 2.84Å; L1475-L1477 VanDerWaalsContact C-N 3.3Å; L1475-L1477 HydrophobicContact CB-CB 4.5Å; L1475-L1477 HydrophobicContact CB-CD1 4.39Å; L1475-L1477 PolarHBondContact O-N 3.08Å; L1477-W1479 HydrophobicContact CB-CE3 4.46Å; L1477-W1479 HydrophobicContact CB-CH2 3.61Å; L1477-W1479 HydrophobicContact CB-CZ2 3.93Å; L1477-W1479 HydrophobicContact CB-CZ3 3.92Å; L1477-W1479 HydrophobicContact CD1-CH2 3.85Å; L1477-W1479 HydrophobicContact CD1-CZ2 3.68Å; L1477-W1479 HydrophobicContact CG-CH2 4.39Å; L1477-W1479 HydrophobicContact CG-CZ2 4.41Å; L1477-I1503 HydrophobicContact CD2-CG2 4.1Å; L1477-S1504 CarbonylContact C-O 3.53Å; L1477-S1504 WeakPolarHBondContact CA-O 3.22Å; L1477-F1505 HydrophobicContact CD2-CD1 3.77Å; L1477-F1505 HydrophobicContact CD2-CE1 3.7Å; L1477-F1505 HydrophobicContact CD2-CZ 4.43Å
1478	L	85.7	Confident	77.7	Confident	20 Å²	20	34.5 Å²	34.5	11%	0.105	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	112.5	175.3	164.3	60.8	0	0	0	108.9	E1469 V1470 E1471 S1504 V1506	E1469-L1478 HydrophobicContact CB-CD1 3.97Å; V1470-L1478 CarbonylContact O-C 3.59Å; V1470-L1478 WeakPolarHBondContact O-CA 3.36Å; E1471-L1478 HydrophobicContact CB-CD1 4.11Å; L1478-S1504 WeakPolarHBondContact CB-OG 3.4Å; L1478-S1504 WeakPolarHBondContact CD2-OG 3.43Å; L1478-S1504 WeakPolarHBondContact CG-OG 3.29Å; L1478-S1504 PolarHBondContact N-O 2.85Å; L1478-S1504 PolarHBondContact O-N 2.78Å; L1478-S1504 PolarHBondContact O-OG 2.79Å; L1478-S1504 VanDerWaalsContact O-OG 3.08Å; L1478-V1506 HydrophobicContact CB-CG2 3.79Å
1479	W	88.5	Confident	76.3	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.008	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	145.9	172.9	-63	-94	0	0	0	110.7	Y1380 N1446 I1447 E1469 V1470 A1472 L1475 L1477 F1481	Y1380-W1479 HydrophobicContact CE1-CZ3 4.5Å; N1446-W1479 HydrophobicContact CB-CZ2 4.41Å; I1447-W1479 HydrophobicContact CB-CD2 3.99Å; I1447-W1479 HydrophobicContact CB-CE3 4.43Å; I1447-W1479 HydrophobicContact CB-CG 4.25Å; I1447-W1479 HydrophobicContact CB-CZ2 4.42Å; I1447-W1479 HydrophobicContact CD1-CD2 3.95Å; I1447-W1479 HydrophobicContact CD1-CE3 3.55Å; I1447-W1479 HydrophobicContact CD1-CZ3 3.86Å; I1447-W1479 HydrophobicContact CG1-CD2 3.95Å; I1447-W1479 HydrophobicContact CG1-CE3 3.88Å; I1447-W1479 HydrophobicContact CG1-CH2 4.13Å; I1447-W1479 HydrophobicContact CG1-CZ2 4.19Å; I1447-W1479 HydrophobicContact CG1-CZ3 3.97Å; E1469-W1479 CarbonylContact C-O 3.57Å; E1469-W1479 WeakPolarHBondContact CA-O 3.33Å; V1470-W1479 PolarHBondContact N-O 2.9Å; V1470-W1479 PolarHBondContact O-N 2.91Å; A1472-W1479 HydrophobicContact CB-CH2 4.37Å; A1472-W1479 HydrophobicContact CB-CZ3 3.78Å; L1475-W1479 HydrophobicContact CD1-CH2 4.04Å; L1477-W1479 HydrophobicContact CB-CE3 4.46Å; L1477-W1479 HydrophobicContact CB-CH2 3.61Å; L1477-W1479 HydrophobicContact CB-CZ2 3.93Å; L1477-W1479 HydrophobicContact CB-CZ3 3.92Å; L1477-W1479 HydrophobicContact CD1-CH2 3.85Å; L1477-W1479 HydrophobicContact CD1-CZ2 3.68Å; L1477-W1479 HydrophobicContact CG-CH2 4.39Å; L1477-W1479 HydrophobicContact CG-CZ2 4.41Å; W1479-F1481 HydrophobicContact CB-CE2 3.69Å; W1479-F1481 HydrophobicContact CB-CZ 4.17Å
1480	K	82.9	Confident	74.8	Confident	54 Å²	54	44 Å²	44	24%	0.235	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.3	171	-50.6	-169.4	-175.7	-154.8	0	110.4	V1468 E1469 D1502	V1468-K1480 CarbonylContact O-C 3.56Å; V1468-K1480 WeakPolarHBondContact O-CA 3.3Å; E1469-K1480 HydrophobicContact CG-CD 4.36Å; E1469-K1480 HydrophobicContact CG-CG 4.15Å; E1469-K1480 WeakPolarHBondContact OE1-CE 3.18Å; E1469-K1480 IonicContact OE1-NZ 2.72Å; E1469-K1480 PolarHBondContact OE1-NZ 3.22Å; K1480-D1502 HydrophobicContact CB-CB 4.23Å; K1480-D1502 PolarHBondContact N-O 3.37Å; K1480-D1502 WeakPolarHBondContact O-CB 3.46Å
1481	F	81.9	Confident	73.4	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	96.1	-178.2	-59.6	-96	0	0	0	107.5	I1447 I1450 R1467 V1468 V1470 W1479 C1483 L1496 P1498	I1447-F1481 HydrophobicContact CG2-CZ 3.87Å; I1450-F1481 HydrophobicContact CD1-CB 4.32Å; I1450-F1481 HydrophobicContact CD1-CD1 4.14Å; I1450-F1481 HydrophobicContact CD1-CD2 3.72Å; I1450-F1481 HydrophobicContact CD1-CE1 4.37Å; I1450-F1481 HydrophobicContact CD1-CE2 4.01Å; I1450-F1481 HydrophobicContact CD1-CG 3.81Å; I1450-F1481 HydrophobicContact CD1-CZ 4.33Å; I1450-F1481 HydrophobicContact CG1-CD1 4.02Å; I1450-F1481 HydrophobicContact CG1-CD2 4.39Å; I1450-F1481 HydrophobicContact CG1-CE1 4Å; I1450-F1481 HydrophobicContact CG1-CE2 4.4Å; I1450-F1481 HydrophobicContact CG1-CG 4.22Å; I1450-F1481 HydrophobicContact CG1-CZ 4.22Å; I1450-F1481 HydrophobicContact CG2-CE1 4.22Å; I1450-F1481 HydrophobicContact CG2-CE2 4.04Å; I1450-F1481 HydrophobicContact CG2-CZ 3.73Å; R1467-F1481 CarbonylContact C-O 3.56Å; R1467-F1481 WeakPolarHBondContact CA-O 3.49Å; R1467-F1481 WeakPolarHBondContact CB-O 3.32Å; V1468-F1481 HydrophobicContact CB-CB 4.33Å; V1468-F1481 PolarHBondContact N-O 2.72Å; V1468-F1481 PolarHBondContact O-N 2.84Å; V1470-F1481 HydrophobicContact CG2-CE2 4.07Å; W1479-F1481 HydrophobicContact CB-CE2 3.69Å; W1479-F1481 HydrophobicContact CB-CZ 4.17Å; F1481-C1483 PolarHBondContact O-N 2.75Å; F1481-C1483 PolarHBondContact O-SG 3.23Å; F1481-L1496 HydrophobicContact CB-CB 4.23Å; F1481-L1496 HydrophobicContact CB-CD1 4.26Å; F1481-L1496 HydrophobicContact CD1-CB 3.79Å; F1481-L1496 HydrophobicContact CG-CB 4.34Å; F1481-P1498 HydrophobicContact CD1-CB 4.29Å; F1481-P1498 HydrophobicContact CE1-CB 3.76Å; F1481-P1498 HydrophobicContact CE1-CG 3.91Å; F1481-P1498 HydrophobicContact CZ-CB 4.06Å; F1481-P1498 HydrophobicContact CZ-CG 4.18Å
1482	E	75.9	Confident	72.3	Confident	90 Å²	90	50.1 Å²	50.1	42%	0.421	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.8	174.3	-59.6	-60.5	145.9	0	0	108.8	R1467	R1467-E1482 WeakPolarHBondContact CB-OE2 3.45Å; R1467-E1482 VanDerWaalsContact CD-OE1 3.29Å; R1467-E1482 WeakPolarHBondContact CD-OE1 3.35Å; R1467-E1482 WeakPolarHBondContact CD-OE2 3.33Å; R1467-E1482 IonicContact NH1-OE1 2.8Å
1483	C	70.8	Confident	71.6	Confident	11 Å²	11	53.1 Å²	53.1	7%	0.074	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-54.8	-166.8	-61.2	0	0	0	0	112.1	V1465 E1466 F1481 R1485 L1496	V1465-C1483 HydrophobicContact CB-CB 4.21Å; V1465-C1483 HydrophobicContact CG1-CB 3.88Å; V1465-C1483 WeakPolarHBondContact O-CB 3.36Å; E1466-C1483 WeakPolarHBondContact O-CA 3.39Å; E1466-C1483 WeakPolarHBondContact O-CB 3.34Å; E1466-C1483 PolarHBondContact O-N 3.39Å; F1481-C1483 PolarHBondContact O-N 2.75Å; F1481-C1483 PolarHBondContact O-SG 3.23Å; C1483-R1485 WeakPolarHBondContact O-CG 3.47Å; C1483-R1485 PolarHBondContact O-N 2.75Å; C1483-R1485 VanDerWaalsContact O-N 3.13Å; C1483-L1496 HydrophobicContact CB-CD2 4.3Å; C1483-L1496 WeakPolarHBondContact SG-CD1 3.16Å
1484	N	71.6	Confident	71.5	Confident	93 Å²	93	50.5 Å²	50.5	50%	0.497	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	42.9	42.4	-179.2	-66	-63.6	0	0	0	114.8	F1464 V1465 E1466	F1464-N1484 HydrophobicContact CZ-CB 4.29Å; V1465-N1484 WeakPolarHBondContact O-CA 3.37Å; V1465-N1484 PolarHBondContact O-N 3.44Å; V1465-N1484 VanDerWaalsContact O-N 3.08Å; E1466-N1484 PolarHBondContact O-N 3.03Å
1485	R	65	Low	71.6	Confident	94 Å²	94	50.2 Å²	50.2	36%	0.355	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.6	-174.6	-79.5	179.3	-179.3	-131.3	-2.8	112.3	S957 V1465 C1483	S957-R1485 PolarHBondContact OG-NH1 2.96Å; S957-R1485 VanDerWaalsContact OG-NH1 3.17Å; V1465-R1485 PolarHBondContact N-O 3.44Å; V1465-R1485 PolarHBondContact O-N 2.82Å; C1483-R1485 WeakPolarHBondContact O-CG 3.47Å; C1483-R1485 PolarHBondContact O-N 2.75Å; C1483-R1485 VanDerWaalsContact O-N 3.13Å
1486	F	66.2	Low	71.6	Confident	85 Å²	85	48.9 Å²	48.9	37%	0.373	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128	168.7	-73.9	-81	0	0	0	111	I1392 R1462 W1463 F1464 T1488	I1392-F1486 HydrophobicContact CB-CE1 4.24Å; I1392-F1486 HydrophobicContact CG2-CE1 3.66Å; I1392-F1486 HydrophobicContact CG2-CZ 4.13Å; R1462-F1486 HydrophobicContact CB-CB 4.48Å; R1462-F1486 HydrophobicContact CB-CD1 3.6Å; R1462-F1486 HydrophobicContact CB-CE1 4.15Å; R1462-F1486 HydrophobicContact CB-CG 4.32Å; W1463-F1486 CarbonylContact O-C 3.51Å; W1463-F1486 WeakPolarHBondContact O-CA 3.18Å; F1464-F1486 HydrophobicContact CB-CD1 3.86Å; F1464-F1486 HydrophobicContact CB-CE1 3.71Å; F1464-F1486 HydrophobicContact CB-CZ 4.27Å; F1464-F1486 AromaticContact CD2-CD1 3.99Å; F1464-F1486 HydrophobicContact CD2-CD1 3.99Å; F1464-F1486 AromaticContact CD2-CD2 3.76Å; F1464-F1486 HydrophobicContact CD2-CD2 3.76Å; F1464-F1486 AromaticContact CD2-CE1 3.93Å; F1464-F1486 HydrophobicContact CD2-CE1 3.93Å; F1464-F1486 AromaticContact CD2-CE2 3.67Å; F1464-F1486 HydrophobicContact CD2-CE2 3.67Å; F1464-F1486 AromaticContact CD2-CG 3.92Å; F1464-F1486 HydrophobicContact CD2-CG 3.92Å; F1464-F1486 AromaticContact CD2-CZ 3.76Å; F1464-F1486 HydrophobicContact CD2-CZ 3.76Å; F1464-F1486 HydrophobicContact CE2-CD2 4.3Å; F1464-F1486 HydrophobicContact CE2-CE2 4.19Å; F1464-F1486 HydrophobicContact CG-CD1 4.45Å; F1464-F1486 HydrophobicContact CG-CE1 4.28Å; F1464-F1486 HydrophobicContact CG-CZ 4.4Å; F1486-T1488 HydrophobicContact CB-CG2 4.04Å
1487	I	68.2	Low	71.5	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	136.5	159.5	-63.1	174.7	0	0	0	107.3	I1452 H1454 W1463 V1465 L1494	I1452-I1487 HydrophobicContact CG2-CD1 4.2Å; H1454-I1487 HydrophobicContact CB-CG2 3.71Å; W1463-I1487 HydrophobicContact CE3-CB 4.24Å; W1463-I1487 HydrophobicContact CE3-CD1 3.71Å; W1463-I1487 HydrophobicContact CE3-CG1 4.45Å; W1463-I1487 HydrophobicContact CZ3-CD1 3.69Å; W1463-I1487 PolarHBondContact N-O 2.92Å; W1463-I1487 PolarHBondContact O-N 2.86Å; V1465-I1487 HydrophobicContact CG2-CD1 4.08Å; I1487-L1494 HydrophobicContact CD1-CB 3.85Å; I1487-L1494 HydrophobicContact CD1-CD2 3.88Å; I1487-L1494 HydrophobicContact CG1-CB 4.07Å; I1487-L1494 HydrophobicContact CG1-CD2 4.12Å
1488	T	64.3	Low	70.8	Confident	20 Å²	20	54.8 Å²	54.8	12%	0.123	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-139.3	160.7	-169.8	67.6	0	0	0	0	111.7	R1462 F1486 Q1490 Q1491 P1492	R1462-T1488 HydrophobicContact CB-CG2 4.33Å; R1462-T1488 HydrophobicContact CG-CG2 4.05Å; F1486-T1488 HydrophobicContact CB-CG2 4.04Å; T1488-Q1490 PolarHBondContact O-N 2.62Å; T1488-Q1491 PolarHBondContact N-O 2.65Å; T1488-Q1491 CarbonylContact O-C 3.57Å; T1488-Q1491 PolarHBondContact O-N 3.4Å; T1488-Q1491 PolarHBondContact OG1-N 3.14Å; T1488-P1492 VanDerWaalsContact O-N 3.16Å
1489	P	57.6	Low	69.5	Low	67 Å²	67	58.2 Å²	58.2	44%	0.435	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.1	177.2	-26.8	36.5	0	0	0	115.2	T1456	T1456-P1489 HydrophobicContact CG2-CB 4.1Å
1490	Q	57.4	Low	67.9	Low	147 Å²	147	64 Å²	64	69%	0.687	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-22.5	174.4	-62.5	78.7	18.7	0	0	113.4	T1488	T1488-Q1490 PolarHBondContact O-N 2.62Å
1491	Q	60.9	Low	66.5	Low	96 Å²	96	68.1 Å²	68.1	45%	0.449	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-134.4	77.3	175.5	-73.4	177.7	-14.4	0	0	108.7	S957 T1488 E1493	S957-Q1491 PolarHBondContact O-NE2 3.15Å; S957-Q1491 VanDerWaalsContact O-NE2 3.07Å; T1488-Q1491 PolarHBondContact N-O 2.65Å; T1488-Q1491 CarbonylContact O-C 3.57Å; T1488-Q1491 PolarHBondContact O-N 3.4Å; T1488-Q1491 PolarHBondContact OG1-N 3.14Å; Q1491-E1493 VanDerWaalsContact C-N 3.25Å; Q1491-E1493 PolarHBondContact O-N 2.75Å
1492	P	66	Low	65.6	Low	46 Å²	46	69.5 Å²	69.5	30%	0.299	35%	0.345	S	S	.	.			trans	-80.9	-0.4	-176.2	32.7	-36.9	0	0	0	113.8	E1453 H1454 T1456 T1488	E1453-P1492 CarbonylContact C-O 3.48Å; E1453-P1492 WeakPolarHBondContact CA-O 3.42Å; H1454-P1492 PolarHBondContact N-O 2.68Å; H1454-P1492 WeakPolarHBondContact O-CB 3.26Å; T1456-P1492 HydrophobicContact CG2-CB 3.95Å; T1488-P1492 VanDerWaalsContact O-N 3.16Å
1493	E	69.2	Low	65.5	Low	63 Å²	63	68.3 Å²	68.3	29%	0.294	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136.1	-178.2	-172.1	-175.4	149.4	0	0	110.7	R1451 I1452 E1453 Q1491 I1495	R1451-E1493 HydrophobicContact CG-CG 4.19Å; R1451-E1493 IonicContact CZ-OE1 2.73Å; R1451-E1493 IonicContact NE-OE1 2.69Å; R1451-E1493 PolarHBondContact NE-OE1 3.4Å; R1451-E1493 IonicContact NH2-OE1 3.16Å; R1451-E1493 PolarHBondContact NH2-OE1 2.81Å; R1451-E1493 IonicContact NH2-OE2 2.69Å; I1452-E1493 CarbonylContact O-C 3.49Å; I1452-E1493 WeakPolarHBondContact O-CA 3.04Å; E1453-E1493 HydrophobicContact CG-CG 4.19Å; Q1491-E1493 VanDerWaalsContact C-N 3.25Å; Q1491-E1493 PolarHBondContact O-N 2.75Å; E1493-I1495 WeakPolarHBondContact OE1-CD1 3.33Å; E1493-I1495 WeakPolarHBondContact OE1-CG1 3.34Å
1494	L	71.7	Confident	65.5	Low	21 Å²	21	69.7 Å²	69.7	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	116.6	176.1	180	64.3	0	0	0	110.1	R1451 I1452 I1487 L1496	R1451-L1494 CarbonylContact C-O 3.6Å; R1451-L1494 WeakPolarHBondContact CA-O 3.41Å; I1452-L1494 HydrophobicContact CB-CB 4.5Å; I1452-L1494 PolarHBondContact N-O 2.9Å; I1452-L1494 PolarHBondContact O-N 3.44Å; I1487-L1494 HydrophobicContact CD1-CB 3.85Å; I1487-L1494 HydrophobicContact CD1-CD2 3.88Å; I1487-L1494 HydrophobicContact CG1-CB 4.07Å; I1487-L1494 HydrophobicContact CG1-CD2 4.12Å; L1494-L1496 HydrophobicContact CD1-CD2 4.13Å; L1494-L1496 HydrophobicContact CD1-CG 4.47Å; L1494-L1496 HydrophobicContact CD2-CD1 3.99Å; L1494-L1496 HydrophobicContact CD2-CD2 4.25Å; L1494-L1496 HydrophobicContact CD2-CG 4.28Å; L1494-L1496 HydrophobicContact CG-CD1 4.13Å; L1494-L1496 HydrophobicContact CG-CD2 4.09Å; L1494-L1496 HydrophobicContact CG-CG 3.97Å
1495	I	73.7	Confident	65.3	Low	63 Å²	63	73.9 Å²	73.9	32%	0.323	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.6	173.8	-54.6	179.5	0	0	0	109.5	K1449 I1450 R1451 E1493 Y1497	K1449-I1495 HydrophobicContact CD-CG2 4.1Å; I1450-I1495 WeakPolarHBondContact O-CA 3.22Å; R1451-I1495 HydrophobicContact CB-CG1 4.42Å; E1493-I1495 WeakPolarHBondContact OE1-CD1 3.33Å; E1493-I1495 WeakPolarHBondContact OE1-CG1 3.34Å; I1495-Y1497 HydrophobicContact CG2-CD2 4.44Å; I1495-Y1497 HydrophobicContact CG2-CE2 3.74Å
1496	L	71.7	Confident	65.6	Low	18 Å²	18	71.4 Å²	71.4	9%	0.094	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.9	-175.2	-58.5	156.5	0	0	0	110.7	K1449 I1450 I1452 F1481 C1483 L1494	K1449-L1496 CarbonylContact C-O 3.49Å; K1449-L1496 WeakPolarHBondContact CA-O 3.06Å; K1449-L1496 WeakPolarHBondContact CB-O 3.03Å; I1450-L1496 HydrophobicContact CD1-CB 4.4Å; I1450-L1496 HydrophobicContact CD1-CD1 3.87Å; I1450-L1496 HydrophobicContact CG1-CB 3.8Å; I1450-L1496 HydrophobicContact CG1-CD1 4.01Å; I1450-L1496 HydrophobicContact CG1-CG 4.46Å; I1450-L1496 PolarHBondContact N-O 2.94Å; I1450-L1496 PolarHBondContact O-N 2.83Å; I1452-L1496 HydrophobicContact CD1-CD1 4.26Å; F1481-L1496 HydrophobicContact CB-CB 4.23Å; F1481-L1496 HydrophobicContact CB-CD1 4.26Å; F1481-L1496 HydrophobicContact CD1-CB 3.79Å; F1481-L1496 HydrophobicContact CG-CB 4.34Å; C1483-L1496 HydrophobicContact CB-CD2 4.3Å; C1483-L1496 WeakPolarHBondContact SG-CD1 3.16Å; L1494-L1496 HydrophobicContact CD1-CD2 4.13Å; L1494-L1496 HydrophobicContact CD1-CG 4.47Å; L1494-L1496 HydrophobicContact CD2-CD1 3.99Å; L1494-L1496 HydrophobicContact CD2-CD2 4.25Å; L1494-L1496 HydrophobicContact CD2-CG 4.28Å; L1494-L1496 HydrophobicContact CG-CD1 4.13Å; L1494-L1496 HydrophobicContact CG-CD2 4.09Å; L1494-L1496 HydrophobicContact CG-CG 3.97Å
1497	Y	72.5	Confident	65.3	Low	126 Å²	126	72.6 Å²	72.6	49%	0.494	37%	0.365	S	S	.	.			trans	-120.7	140.9	179.4	-65	-96.5	0	0	0	109.2	K1449 I1495	K1449-Y1497 HydrophobicContact CB-CD1 3.71Å; K1449-Y1497 HydrophobicContact CB-CE1 3.74Å; K1449-Y1497 HydrophobicContact CB-CG 4.25Å; K1449-Y1497 HydrophobicContact CD-CE1 3.94Å; K1449-Y1497 HydrophobicContact CG-CE1 4.39Å; I1495-Y1497 HydrophobicContact CG2-CD2 4.44Å; I1495-Y1497 HydrophobicContact CG2-CE2 3.74Å
1498	P	65.1	Low	65.1	Low	27 Å²	27	75.2 Å²	75.2	18%	0.175	38%	0.382	C	S	.	.			trans	-87.1	136.5	179.8	32.8	-25.8	0	0	0	110.5	K1448 F1481	K1448-P1498 WeakPolarHBondContact O-CD 3.19Å; F1481-P1498 HydrophobicContact CD1-CB 4.29Å; F1481-P1498 HydrophobicContact CE1-CB 3.76Å; F1481-P1498 HydrophobicContact CE1-CG 3.91Å; F1481-P1498 HydrophobicContact CZ-CB 4.06Å; F1481-P1498 HydrophobicContact CZ-CG 4.18Å
1499	E	59.1	Low	65.4	Low	91 Å²	91	75.2 Å²	75.2	43%	0.425	38%	0.381	S	S	.	.			trans	-83.9	155.6	167.5	-73.5	-174.1	-134.1	0	0	111.3	K1501 D1502	E1499-K1501 HydrophobicContact CB-CD 4.26Å; E1499-K1501 HydrophobicContact CB-CG 4.13Å; E1499-K1501 PolarHBondContact O-N 2.79Å; E1499-K1501 IonicContact OE1-NZ 2.73Å; E1499-K1501 PolarHBondContact OE1-NZ 2.88Å; E1499-K1501 WeakPolarHBondContact OE2-CD 3.37Å; E1499-K1501 VanDerWaalsContact OE2-CE 3.29Å; E1499-K1501 WeakPolarHBondContact OE2-CE 3.07Å; E1499-K1501 IonicContact OE2-NZ 3.15Å; E1499-K1501 PolarHBondContact OE2-NZ 2.79Å; E1499-D1502 WeakPolarHBondContact CB-OD2 3.13Å; E1499-D1502 PolarHBondContact O-N 2.95Å
1500	P	54.5	Low	65.9	Low	123 Å²	123	72.9 Å²	72.9	80%	0.799	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.1	179.7	-25.9	35.4	0	0	0	115.3
1501	K	53	Low	66.7	Low	141 Å²	141	67.9 Å²	67.9	61%	0.613	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.5	177.2	76.9	-160.7	179.1	-158	0	113.3	E1499	E1499-K1501 HydrophobicContact CB-CD 4.26Å; E1499-K1501 HydrophobicContact CB-CG 4.13Å; E1499-K1501 PolarHBondContact O-N 2.79Å; E1499-K1501 IonicContact OE1-NZ 2.73Å; E1499-K1501 PolarHBondContact OE1-NZ 2.88Å; E1499-K1501 WeakPolarHBondContact OE2-CD 3.37Å; E1499-K1501 VanDerWaalsContact OE2-CE 3.29Å; E1499-K1501 WeakPolarHBondContact OE2-CE 3.07Å; E1499-K1501 IonicContact OE2-NZ 3.15Å; E1499-K1501 PolarHBondContact OE2-NZ 2.79Å
1502	D	63	Low	67.6	Low	33 Å²	33	63.3 Å²	63.3	18%	0.176	32%	0.322	C	S	.	.	S	Bend	trans	-100.6	13.3	-169	-60.7	-45.3	0	0	0	112.9	K1480 E1499	K1480-D1502 HydrophobicContact CB-CB 4.23Å; K1480-D1502 PolarHBondContact N-O 3.37Å; K1480-D1502 WeakPolarHBondContact O-CB 3.46Å; E1499-D1502 WeakPolarHBondContact CB-OD2 3.13Å; E1499-D1502 PolarHBondContact O-N 2.95Å
1503	I	73.2	Confident	68.5	Low	66 Å²	66	61.9 Å²	61.9	34%	0.338	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	131.9	179.2	-50.2	-178.3	0	0	0	109.2	L1477	L1477-I1503 HydrophobicContact CD2-CG2 4.1Å
1504	S	71.3	Confident	69.4	Low	39 Å²	39	59 Å²	59	27%	0.273	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	161.2	-173.5	54.9	0	0	0	0	112.3	L1477 L1478	L1477-S1504 CarbonylContact C-O 3.53Å; L1477-S1504 WeakPolarHBondContact CA-O 3.22Å; L1478-S1504 WeakPolarHBondContact CB-OG 3.4Å; L1478-S1504 WeakPolarHBondContact CD2-OG 3.43Å; L1478-S1504 WeakPolarHBondContact CG-OG 3.29Å; L1478-S1504 PolarHBondContact N-O 2.85Å; L1478-S1504 PolarHBondContact O-N 2.78Å; L1478-S1504 PolarHBondContact O-OG 2.79Å; L1478-S1504 VanDerWaalsContact O-OG 3.08Å
1505	F	68.1	Low	70.2	Confident	181 Å²	181	61 Å²	61	79%	0.794	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	149	-172.6	-65.4	-84	0	0	0	113.3	G1476 L1477	G1476-F1505 CarbonylContact O-C 3.5Å; G1476-F1505 VanDerWaalsContact O-CA 3.28Å; G1476-F1505 WeakPolarHBondContact O-CA 3.44Å; L1477-F1505 HydrophobicContact CD2-CD1 3.77Å; L1477-F1505 HydrophobicContact CD2-CE1 3.7Å; L1477-F1505 HydrophobicContact CD2-CZ 4.43Å
1506	V	70.6	Confident	71	Confident	42 Å²	42	58 Å²	58	26%	0.255	29%	0.29	S	S	.	.			trans	-135	147.7	-176.5	-172.9	0	0	0	0	109.7	E1471 G1476 L1478	E1471-V1506 HydrophobicContact CG-CG2 4.26Å; G1476-V1506 VanDerWaalsContact CA-O 3.28Å; G1476-V1506 WeakPolarHBondContact CA-O 3.21Å; G1476-V1506 PolarHBondContact O-N 2.96Å; L1478-V1506 HydrophobicContact CB-CG2 3.79Å
1507	K	60.5	Low	72.1	Confident	110 Å²	110	58.5 Å²	58.5	48%	0.478	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-60.8	131.1	175.6	-77.2	-159.3	179.7	-167.6	0	109.8	K1859	K1507-K1859 PolarHBondContact NZ-O 2.87Å
1508	P	64.5	Low	73	Confident	59 Å²	59	52.6 Å²	52.6	38%	0.383	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-70.6	151.5	179.4	29.4	-34.9	0	0	0	112.1	R1473 E1571	R1473-P1508 WeakPolarHBondContact O-CA 3.27Å; P1508-E1571 PolarHBondContact O-N 3.06Å
1509	M	69	Low	74	Confident	20 Å²	20	51.4 Å²	51.4	10%	0.099	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	149.4	175.1	-71	-80.1	167.2	0	0	110.6	R1473 E1568 L1569 E1570	R1473-M1509 HydrophobicContact CB-CB 4.27Å; R1473-M1509 HydrophobicContact CB-CG 3.74Å; R1473-M1509 HydrophobicContact CG-CG 4.34Å; M1509-E1568 HydrophobicContact CB-CG 3.62Å; M1509-E1568 VanDerWaalsContact CB-OE1 3.31Å; M1509-E1568 WeakPolarHBondContact CB-OE1 3.37Å; M1509-E1568 HydrophobicContact CG-CG 4.17Å; M1509-E1568 HydrophobicContact SD-CG 4.23Å; M1509-L1569 CarbonylContact C-O 3.57Å; M1509-L1569 WeakPolarHBondContact CA-O 3.42Å; M1509-L1569 VanDerWaalsContact SD-O 3.4Å; M1509-E1570 HydrophobicContact CE-CG 3.86Å; M1509-E1570 HydrophobicContact SD-CG 4.37Å; M1509-E1570 PolarHBondContact SD-N 2.82Å; M1509-E1570 VanDerWaalsContact SD-N 3.43Å
1510	T	69.7	Low	75.4	Confident	19 Å²	19	50.8 Å²	50.8	12%	0.117	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.7	177	-68.8	0	0	0	0	110.3	Y1512 L1569 E1571 K1601	T1510-Y1512 HydrophobicContact CG2-CD2 4.47Å; T1510-Y1512 HydrophobicContact CG2-CE2 3.95Å; T1510-Y1512 VanDerWaalsContact O-CD2 3.29Å; T1510-Y1512 WeakPolarHBondContact O-CD2 3.34Å; T1510-Y1512 WeakPolarHBondContact O-CE2 3.49Å; T1510-L1569 PolarHBondContact N-O 3.38Å; T1510-L1569 PolarHBondContact O-N 2.69Å; T1510-L1569 VanDerWaalsContact O-O 3.14Å; T1510-E1571 WeakPolarHBondContact OG1-CB 3.43Å; T1510-K1601 HydrophobicContact CG2-CD 4.32Å; T1510-K1601 HydrophobicContact CG2-CG 3.76Å
1511	N	73.7	Confident	76.9	Confident	42 Å²	42	48.4 Å²	48.4	23%	0.225	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137.1	175.2	-71.3	-31.1	0	0	0	111.7	I1372 I1602	I1372-N1511 HydrophobicContact CG2-CB 4.18Å; I1372-N1511 WeakPolarHBondContact CG2-ND2 3.36Å; N1511-I1602 HydrophobicContact CB-CB 4.09Å; N1511-I1602 HydrophobicContact CB-CD1 4.18Å; N1511-I1602 VanDerWaalsContact O-CB 3.31Å; N1511-I1602 WeakPolarHBondContact O-CB 2.85Å; N1511-I1602 PolarHBondContact O-N 2.93Å
1512	Y	79.9	Confident	78.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130	174.7	-64.3	-94.9	0	0	0	109.8	T1510 L1534 Y1566 V1567 L1569 L1572 F1576 I1599 R1600 K1601	T1510-Y1512 HydrophobicContact CG2-CD2 4.47Å; T1510-Y1512 HydrophobicContact CG2-CE2 3.95Å; T1510-Y1512 VanDerWaalsContact O-CD2 3.29Å; T1510-Y1512 WeakPolarHBondContact O-CD2 3.34Å; T1510-Y1512 WeakPolarHBondContact O-CE2 3.49Å; Y1512-L1534 HydrophobicContact CD1-CD2 4.29Å; Y1512-L1534 HydrophobicContact CE1-CD2 4.26Å; Y1512-Y1566 WeakPolarHBondContact O-CA 3.44Å; Y1512-V1567 PolarHBondContact N-O 2.73Å; Y1512-V1567 PolarHBondContact O-N 2.78Å; Y1512-L1569 HydrophobicContact CD2-CB 3.82Å; Y1512-L1569 HydrophobicContact CD2-CD1 4.07Å; Y1512-L1569 HydrophobicContact CD2-CG 4.15Å; Y1512-L1569 HydrophobicContact CE2-CB 3.81Å; Y1512-L1569 HydrophobicContact CE2-CD1 4.49Å; Y1512-L1569 HydrophobicContact CG-CD1 4.49Å; Y1512-L1572 PolarHBondContact OH-N 2.88Å; Y1512-F1576 HydrophobicContact CD1-CZ 4.31Å; Y1512-F1576 HydrophobicContact CE1-CE1 4.13Å; Y1512-F1576 AromaticContact CE1-CZ 3.66Å; Y1512-F1576 HydrophobicContact CE1-CZ 3.66Å; Y1512-I1599 HydrophobicContact CD1-CG2 4.22Å; Y1512-R1600 CarbonylContact C-O 3.57Å; Y1512-R1600 WeakPolarHBondContact CA-O 3.25Å; Y1512-K1601 HydrophobicContact CD1-CB 4Å; Y1512-K1601 HydrophobicContact CD1-CG 4.13Å; Y1512-K1601 HydrophobicContact CE1-CB 3.82Å; Y1512-K1601 HydrophobicContact CE1-CD 3.97Å; Y1512-K1601 HydrophobicContact CE1-CG 3.63Å
1513	Q	84.3	Confident	79.1	Confident	16 Å²	16	47.2 Å²	47.2	8%	0.075	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.5	165.5	174.8	178.4	62.5	0	0	108.1	T1564 F1565 Y1566 I1599 R1600 I1602	Q1513-T1564 HydrophobicContact CG-CG2 3.88Å; Q1513-F1565 CarbonylContact C-O 3.54Å; Q1513-F1565 WeakPolarHBondContact CA-O 3.38Å; Q1513-Y1566 HydrophobicContact CB-CD1 3.83Å; Q1513-Y1566 HydrophobicContact CB-CE1 3.65Å; Q1513-Y1566 HydrophobicContact CG-CD1 4.21Å; Q1513-Y1566 HydrophobicContact CG-CE1 3.7Å; Q1513-Y1566 PolarHBondContact NE2-OH 2.88Å; Q1513-I1599 CarbonylContact O-C 3.46Å; Q1513-I1599 WeakPolarHBondContact O-CA 3.28Å; Q1513-R1600 HydrophobicContact CB-CB 4.23Å; Q1513-R1600 PolarHBondContact N-O 2.85Å; Q1513-R1600 PolarHBondContact O-N 3.26Å; Q1513-R1600 VanDerWaalsContact OE1-NH1 3.16Å; Q1513-I1602 HydrophobicContact CB-CD1 4.12Å
1514	I	88.1	Confident	79.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.2	-179.1	-63.2	162.6	0	0	0	107.5	I1532 L1547 T1564 F1565 V1567 V1597 E1598 I1599	I1514-I1532 HydrophobicContact CD1-CD1 4.2Å; I1514-I1532 HydrophobicContact CD1-CG2 4.27Å; I1514-I1532 HydrophobicContact CG2-CD1 3.73Å; I1514-L1547 HydrophobicContact CD1-CD2 4.17Å; I1514-L1547 HydrophobicContact CG2-CD2 4.12Å; I1514-T1564 CarbonylContact O-C 3.5Å; I1514-F1565 PolarHBondContact N-O 3.25Å; I1514-F1565 PolarHBondContact O-N 3.14Å; I1514-V1567 HydrophobicContact CD1-CB 3.88Å; I1514-V1567 HydrophobicContact CD1-CG2 3.74Å; I1514-V1597 HydrophobicContact CG2-CG1 3.79Å; I1514-E1598 CarbonylContact C-O 3.5Å; I1514-E1598 VanDerWaalsContact CA-O 3.32Å; I1514-E1598 WeakPolarHBondContact CA-O 3.38Å; I1514-I1599 HydrophobicContact CG1-CD1 4.35Å; I1514-I1599 HydrophobicContact CG1-CG1 4.13Å; I1514-I1599 HydrophobicContact CG1-CG2 4.35Å; I1514-I1599 HydrophobicContact CG2-CG1 4.37Å
1515	K	88.3	Confident	80.5	Confident	62 Å²	62	46 Å²	46	27%	0.27	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.1	174.5	-59.1	-177.5	177.3	174.4	0	110.8	F1517 D1563 T1564 V1597 E1598	K1515-F1517 HydrophobicContact CB-CD2 4.39Å; K1515-F1517 HydrophobicContact CB-CE2 3.76Å; K1515-F1517 HydrophobicContact CD-CE2 4.39Å; K1515-F1517 HydrophobicContact CD-CZ 4.45Å; K1515-D1563 CarbonylContact C-O 3.58Å; K1515-D1563 VanDerWaalsContact CA-O 3.24Å; K1515-D1563 WeakPolarHBondContact CA-O 3.47Å; K1515-T1564 HydrophobicContact CG-CG2 4.08Å; K1515-V1597 CarbonylContact O-C 3.58Å; K1515-V1597 WeakPolarHBondContact O-CA 3.3Å; K1515-V1597 WeakPolarHBondContact O-CG1 3.45Å; K1515-E1598 HydrophobicContact CB-CB 4.24Å; K1515-E1598 PolarHBondContact N-O 3.45Å; K1515-E1598 PolarHBondContact O-N 2.6Å
1516	T	91.8	Very high	81.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.8	171.5	57.3	0	0	0	0	110.3	L1547 F1557 I1562 D1563 F1565 I1581 W1592 V1597	T1516-L1547 HydrophobicContact CG2-CD1 3.92Å; T1516-F1557 HydrophobicContact CG2-CE1 4.34Å; T1516-F1557 WeakPolarHBondContact OG1-CE1 3.32Å; T1516-I1562 WeakPolarHBondContact O-CA 3.37Å; T1516-D1563 PolarHBondContact N-O 2.66Å; T1516-D1563 PolarHBondContact O-N 3.24Å; T1516-F1565 HydrophobicContact CG2-CE2 4.15Å; T1516-I1581 HydrophobicContact CG2-CD1 3.95Å; T1516-W1592 HydrophobicContact CG2-CH2 4.35Å; T1516-V1597 HydrophobicContact CG2-CG1 4.37Å; T1516-V1597 HydrophobicContact CG2-CG2 4.32Å
1517	F	93.2	Very high	82.1	Confident	30 Å²	30	36.8 Å²	36.8	13%	0.132	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	98.9	-179.4	-67.6	-113.8	0	0	0	108.9	K1515 I1562 N1595 K1596 E1598	K1515-F1517 HydrophobicContact CB-CD2 4.39Å; K1515-F1517 HydrophobicContact CB-CE2 3.76Å; K1515-F1517 HydrophobicContact CD-CE2 4.39Å; K1515-F1517 HydrophobicContact CD-CZ 4.45Å; F1517-I1562 HydrophobicContact CD1-CB 4.45Å; F1517-I1562 HydrophobicContact CD1-CD1 3.76Å; F1517-I1562 HydrophobicContact CD1-CG1 3.62Å; F1517-I1562 HydrophobicContact CD1-CG2 4.09Å; F1517-I1562 HydrophobicContact CD2-CG2 4.35Å; F1517-I1562 HydrophobicContact CE1-CD1 3.57Å; F1517-I1562 HydrophobicContact CE1-CG1 3.89Å; F1517-I1562 HydrophobicContact CE1-CG2 3.9Å; F1517-I1562 HydrophobicContact CE2-CG2 4.17Å; F1517-I1562 HydrophobicContact CG-CG1 4.3Å; F1517-I1562 HydrophobicContact CG-CG2 4.31Å; F1517-I1562 HydrophobicContact CZ-CG2 3.94Å; F1517-N1595 HydrophobicContact CB-CB 4.11Å; F1517-N1595 WeakPolarHBondContact O-CB 3.24Å; F1517-N1595 PolarHBondContact O-N 2.91Å; F1517-K1596 HydrophobicContact CB-CG 3.82Å; F1517-K1596 HydrophobicContact CD1-CG 4.36Å; F1517-K1596 HydrophobicContact CD2-CD 4.17Å; F1517-K1596 HydrophobicContact CD2-CG 3.63Å; F1517-K1596 VanDerWaalsContact CE1-CE 3.44Å; F1517-K1596 HydrophobicContact CE2-CD 4.33Å; F1517-K1596 HydrophobicContact CE2-CG 4.26Å; F1517-K1596 HydrophobicContact CG-CD 4.31Å; F1517-K1596 HydrophobicContact CG-CG 3.69Å; F1517-K1596 PolarHBondContact N-O 3.39Å; F1517-E1598 HydrophobicContact CE2-CB 4.33Å; F1517-E1598 VanDerWaalsContact CE2-CD 3.43Å; F1517-E1598 HydrophobicContact CE2-CG 3.69Å; F1517-E1598 VanDerWaalsContact CZ-CD 3.46Å; F1517-E1598 HydrophobicContact CZ-CG 4.24Å; F1517-E1598 WeakPolarHBondContact CZ-OE1 3.37Å; F1517-E1598 WeakPolarHBondContact CZ-OE2 3.4Å
1518	T	91.4	Very high	83.3	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.2	175.5	-53.5	0	0	0	0	109.9	A1524 Q1558 N1560 K1561 W1592	T1518-A1524 WeakPolarHBondContact CG2-O 3.43Å; T1518-Q1558 VanDerWaalsContact CB-O 3.24Å; T1518-Q1558 WeakPolarHBondContact CB-O 3.49Å; T1518-Q1558 WeakPolarHBondContact CG2-O 3.48Å; T1518-N1560 WeakPolarHBondContact O-CA 3.36Å; T1518-K1561 WeakPolarHBondContact CB-O 3.38Å; T1518-K1561 PolarHBondContact N-O 3.09Å; T1518-W1592 PolarHBondContact OG1-NE1 2.9Å
1519	S	87.6	Confident	84.2	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.014	17%	0.169	C	C	.	.			trans	-78.7	157.3	-172.5	-54.9	0	0	0	0	113.4	I1521 N1560 H1593 N1595	S1519-I1521 PolarHBondContact O-N 2.71Å; S1519-N1560 PolarHBondContact O-N 2.75Å; S1519-H1593 WeakPolarHBondContact CB-ND1 3.45Å; S1519-H1593 PolarHBondContact N-O 3.09Å; S1519-H1593 PolarHBondContact OG-ND1 2.8Å; S1519-H1593 PolarHBondContact OG-O 2.75Å; S1519-N1595 WeakPolarHBondContact CB-OD1 3.44Å; S1519-N1595 PolarHBondContact OG-N 2.94Å; S1519-N1595 PolarHBondContact OG-OD1 3.45Å
1520	D	87.7	Confident	85.1	Confident	77 Å²	77	28.3 Å²	28.3	41%	0.412	17%	0.165	S	C	.	.			trans	-82.9	18.1	172.5	-163.6	51.1	0	0	0	113	R1559 N1560	D1520-R1559 PolarHBondContact O-NE 2.66Å; D1520-R1559 PolarHBondContact O-NH2 2.8Å; D1520-R1559 IonicContact OD1-CZ 2.61Å; D1520-R1559 IonicContact OD1-NE 3.32Å; D1520-R1559 IonicContact OD1-NH1 3.82Å; D1520-R1559 PolarHBondContact OD1-NH1 3.43Å; D1520-R1559 IonicContact OD1-NH2 3.03Å; D1520-R1559 PolarHBondContact OD1-NH2 3.3Å; D1520-R1559 IonicContact OD2-CZ 2.72Å; D1520-R1559 IonicContact OD2-NH2 2.76Å; D1520-R1559 PolarHBondContact OD2-NH2 2.87Å; D1520-N1560 HydrophobicContact CB-CB 3.92Å; D1520-N1560 VanDerWaalsContact OD1-CB 3.3Å; D1520-N1560 WeakPolarHBondContact OD1-CB 3.25Å; D1520-N1560 PolarHBondContact OD1-ND2 2.96Å
1521	I	85.1	Confident	86.1	Confident	74 Å²	74	30.3 Å²	30.3	38%	0.379	17%	0.17	S	C	.	.	S	Bend	trans	-72.9	145.3	177.4	-62.5	170.6	0	0	0	108.9	S1519 G1523 A1524 R1559 W1619	S1519-I1521 PolarHBondContact O-N 2.71Å; I1521-G1523 PolarHBondContact O-N 2.7Å; I1521-A1524 HydrophobicContact CB-CB 4.02Å; I1521-A1524 VanDerWaalsContact O-CB 3.24Å; I1521-A1524 WeakPolarHBondContact O-CB 3.42Å; I1521-A1524 PolarHBondContact O-N 3.4Å; I1521-A1524 VanDerWaalsContact O-N 3.16Å; I1521-R1559 VanDerWaalsContact O-CD 3.26Å; I1521-R1559 WeakPolarHBondContact O-CD 3.32Å; I1521-R1559 PolarHBondContact O-NE 2.94Å; I1521-W1619 HydrophobicContact CG2-CH2 4.01Å; I1521-W1619 HydrophobicContact CG2-CZ2 3.67Å
1522	S	81.9	Confident	86.9	Confident	106 Å²	106	28.4 Å²	28.4	74%	0.741	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	132.6	178.5	-167	0	0	0	0	110.8	A1524	S1522-A1524 PolarHBondContact O-N 3.06Å
1523	G	82	Confident	87.4	Confident	43 Å²	43	29.6 Å²	29.6	44%	0.443	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	0.1	-176.6	0	0	0	0	0	116	I1521 E1525	I1521-G1523 PolarHBondContact O-N 2.7Å; G1523-E1525 VanDerWaalsContact C-N 3.34Å; G1523-E1525 PolarHBondContact O-N 2.91Å
1524	A	85.8	Confident	87.5	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.			trans	-75.6	77.6	-178.4	0	0	0	0	0	113	T1518 I1521 S1522 R1559 H1593 W1619	T1518-A1524 WeakPolarHBondContact CG2-O 3.43Å; I1521-A1524 HydrophobicContact CB-CB 4.02Å; I1521-A1524 VanDerWaalsContact O-CB 3.24Å; I1521-A1524 WeakPolarHBondContact O-CB 3.42Å; I1521-A1524 PolarHBondContact O-N 3.4Å; I1521-A1524 VanDerWaalsContact O-N 3.16Å; S1522-A1524 PolarHBondContact O-N 3.06Å; A1524-R1559 WeakPolarHBondContact O-CA 3.33Å; A1524-R1559 PolarHBondContact O-N 2.85Å; A1524-H1593 HydrophobicContact CB-CB 3.6Å; A1524-W1619 HydrophobicContact CB-CH2 4.34Å; A1524-W1619 HydrophobicContact CB-CZ3 4.3Å
1525	E	87.8	Confident	87.3	Confident	80 Å²	80	29 Å²	29	37%	0.374	16%	0.163	S	C	.	.			trans	-151.6	160	178	57.3	178.8	-150.4	0	0	112.2	G1523 F1557 S1589 D1591	G1523-E1525 VanDerWaalsContact C-N 3.34Å; G1523-E1525 PolarHBondContact O-N 2.91Å; E1525-F1557 CarbonylContact C-O 3.58Å; E1525-F1557 WeakPolarHBondContact CA-O 3.38Å; E1525-F1557 WeakPolarHBondContact CB-O 3.49Å; E1525-S1589 PolarHBondContact O-OG 3.17Å; E1525-D1591 PolarHBondContact N-O 3.13Å; E1525-D1591 CarbonylContact O-C 3.59Å; E1525-D1591 VanDerWaalsContact O-C 3.26Å
1526	T	86.4	Confident	86.8	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.018	15%	0.15	C	C	.	.			trans	-148.4	133.1	174.4	-160.4	0	0	0	0	114.3	S1528 V1530 F1557 S1589 T1590 W1592	T1526-S1528 VanDerWaalsContact OG1-CB 3.24Å; T1526-S1528 WeakPolarHBondContact OG1-CB 3.44Å; T1526-S1528 PolarHBondContact OG1-N 3.06Å; T1526-S1528 PolarHBondContact OG1-OG 2.83Å; T1526-V1530 HydrophobicContact CG2-CG2 4.1Å; T1526-F1557 HydrophobicContact CG2-CB 3.86Å; T1526-F1557 HydrophobicContact CG2-CD2 4.44Å; T1526-F1557 HydrophobicContact CG2-CG 4.3Å; T1526-F1557 PolarHBondContact N-O 2.94Å; T1526-F1557 VanDerWaalsContact N-O 3.07Å; T1526-S1589 PolarHBondContact OG1-O 2.84Å; T1526-T1590 PolarHBondContact OG1-O 3.33Å; T1526-W1592 HydrophobicContact CG2-CB 3.8Å; T1526-W1592 HydrophobicContact CG2-CD2 3.81Å; T1526-W1592 HydrophobicContact CG2-CE3 4.23Å; T1526-W1592 HydrophobicContact CG2-CG 3.6Å
1527	T	85.5	Confident	85.9	Confident	25 Å²	25	28.9 Å²	28.9	15%	0.153	17%	0.165	C	C	.	.			trans	-92.7	-4.2	167.5	59	0	0	0	0	111.7	G1587 S1588 S1589	T1527-G1587 WeakPolarHBondContact OG1-CA 3.24Å; T1527-S1588 PolarHBondContact OG1-N 3.24Å; T1527-S1588 PolarHBondContact OG1-OG 3.25Å; T1527-S1589 PolarHBondContact N-O 2.93Å; T1527-S1589 PolarHBondContact OG1-N 2.85Å; T1527-S1589 PolarHBondContact OG1-O 2.66Å
1528	S	85.5	Confident	84.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-63.3	153.9	175.6	-63.9	0	0	0	0	111.5	T1526 V1530 H1583 K1586	T1526-S1528 VanDerWaalsContact OG1-CB 3.24Å; T1526-S1528 WeakPolarHBondContact OG1-CB 3.44Å; T1526-S1528 PolarHBondContact OG1-N 3.06Å; T1526-S1528 PolarHBondContact OG1-OG 2.83Å; S1528-V1530 PolarHBondContact O-N 3.13Å; S1528-H1583 WeakPolarHBondContact CB-ND1 3.36Å; S1528-H1583 PolarHBondContact OG-ND1 3.44Å; S1528-H1583 VanDerWaalsContact OG-ND1 3.15Å; S1528-K1586 PolarHBondContact OG-N 2.84Å
1529	S	83.7	Confident	83.3	Confident	12 Å²	12	30.1 Å²	30.1	8%	0.084	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-77.2	119.8	178.1	-59.5	0	0	0	0	111.8	Y1531 R1546 H1548 H1583 N1584	S1529-Y1531 WeakPolarHBondContact O-CD2 3.39Å; S1529-Y1531 WeakPolarHBondContact O-CE2 3.5Å; S1529-R1546 PolarHBondContact OG-NH2 2.89Å; S1529-H1548 VanDerWaalsContact CA-NE2 3.27Å; S1529-H1548 WeakPolarHBondContact CA-NE2 3.21Å; S1529-H1583 CarbonylContact O-C 3.53Å; S1529-H1583 WeakPolarHBondContact O-CA 3.01Å; S1529-N1584 WeakPolarHBondContact CB-OD1 3.4Å; S1529-N1584 PolarHBondContact N-OD1 2.81Å; S1529-N1584 PolarHBondContact O-N 2.88Å
1530	V	87.9	Confident	82.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.6	-175.6	-174.6	0	0	0	0	111.7	T1526 S1528 R1546 L1547 H1548 F1557 I1581 W1582 H1583 W1592	T1526-V1530 HydrophobicContact CG2-CG2 4.1Å; S1528-V1530 PolarHBondContact O-N 3.13Å; V1530-R1546 WeakPolarHBondContact O-CA 3.49Å; V1530-R1546 WeakPolarHBondContact O-CG 3.49Å; V1530-L1547 HydrophobicContact CB-CD1 4.48Å; V1530-L1547 HydrophobicContact CG1-CD1 3.79Å; V1530-L1547 HydrophobicContact CG1-CG 4.49Å; V1530-L1547 PolarHBondContact O-N 2.72Å; V1530-H1548 PolarHBondContact N-NE2 3.02Å; V1530-H1548 VanDerWaalsContact N-NE2 3.19Å; V1530-F1557 HydrophobicContact CB-CE1 4.23Å; V1530-F1557 HydrophobicContact CB-CE2 3.85Å; V1530-F1557 HydrophobicContact CB-CZ 3.64Å; V1530-F1557 HydrophobicContact CG1-CE1 4.32Å; V1530-F1557 HydrophobicContact CG1-CZ 4.16Å; V1530-F1557 HydrophobicContact CG2-CD1 4.28Å; V1530-F1557 HydrophobicContact CG2-CD2 3.72Å; V1530-F1557 HydrophobicContact CG2-CE1 4.03Å; V1530-F1557 HydrophobicContact CG2-CE2 3.45Å; V1530-F1557 VanDerWaalsContact CG2-CE2 3.45Å; V1530-F1557 HydrophobicContact CG2-CG 4.13Å; V1530-F1557 HydrophobicContact CG2-CZ 3.62Å; V1530-I1581 HydrophobicContact CG1-CD1 4.3Å; V1530-I1581 HydrophobicContact CG1-CG1 4.09Å; V1530-W1582 CarbonylContact C-O 3.56Å; V1530-W1582 WeakPolarHBondContact CA-O 3.24Å; V1530-H1583 HydrophobicContact CG2-CB 4.28Å; V1530-W1592 HydrophobicContact CG1-CH2 3.79Å; V1530-W1592 HydrophobicContact CG1-CZ3 3.7Å; V1530-W1592 HydrophobicContact CG2-CE3 4.45Å; V1530-W1592 HydrophobicContact CG2-CH2 4.31Å; V1530-W1592 HydrophobicContact CG2-CZ3 4.09Å
1531	Y	90.5	Very high	81.6	Confident	60 Å²	60	30 Å²	30	24%	0.235	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	153.9	-176.8	-62.4	-98.7	0	0	0	111.5	S1529 I1544 R1545 R1546 I1581 W1582 N1584	S1529-Y1531 WeakPolarHBondContact O-CD2 3.39Å; S1529-Y1531 WeakPolarHBondContact O-CE2 3.5Å; Y1531-I1544 HydrophobicContact CD1-CG2 4.17Å; Y1531-R1545 CarbonylContact C-O 3.37Å; Y1531-R1545 VanDerWaalsContact CA-O 3.27Å; Y1531-R1545 WeakPolarHBondContact CA-O 3.27Å; Y1531-R1546 HydrophobicContact CD1-CB 3.89Å; Y1531-R1546 HydrophobicContact CD1-CG 4.33Å; Y1531-R1546 HydrophobicContact CE1-CB 3.83Å; Y1531-R1546 HydrophobicContact CE1-CG 4.1Å; Y1531-I1581 WeakPolarHBondContact O-CA 3.35Å; Y1531-I1581 WeakPolarHBondContact O-CG1 3.34Å; Y1531-W1582 VanDerWaalsContact CB-CE2 3.43Å; Y1531-W1582 AromaticContact CD2-NE1 3.95Å; Y1531-W1582 HydrophobicContact CG-CZ2 4.17Å; Y1531-W1582 PolarHBondContact N-O 3.45Å; Y1531-W1582 PolarHBondContact O-N 3.47Å; Y1531-N1584 HydrophobicContact CE2-CB 3.94Å
1532	I	90.7	Very high	81.4	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.7	-176.1	-151	166.7	0	0	0	111.8	I1514 R1545 L1547 L1579 R1580 I1581 I1599	I1514-I1532 HydrophobicContact CD1-CD1 4.2Å; I1514-I1532 HydrophobicContact CD1-CG2 4.27Å; I1514-I1532 HydrophobicContact CG2-CD1 3.73Å; I1532-R1545 HydrophobicContact CG2-CB 4.3Å; I1532-R1545 PolarHBondContact N-O 2.75Å; I1532-R1545 PolarHBondContact O-N 3.43Å; I1532-L1547 HydrophobicContact CB-CD2 4.1Å; I1532-L1547 HydrophobicContact CB-CG 4.32Å; I1532-L1547 HydrophobicContact CD1-CD1 4.49Å; I1532-L1547 HydrophobicContact CD1-CD2 4.17Å; I1532-L1547 HydrophobicContact CG2-CD2 3.69Å; I1532-L1547 HydrophobicContact CG2-CG 4.33Å; I1532-L1579 HydrophobicContact CD1-CD1 3.74Å; I1532-L1579 HydrophobicContact CD1-CD2 4.34Å; I1532-L1579 HydrophobicContact CD1-CG 4.41Å; I1532-L1579 HydrophobicContact CG1-CD1 3.54Å; I1532-L1579 HydrophobicContact CG1-CG 4.33Å; I1532-R1580 CarbonylContact C-O 3.59Å; I1532-R1580 WeakPolarHBondContact CA-O 3.45Å; I1532-I1581 HydrophobicContact CD1-CD1 4.36Å; I1532-I1581 HydrophobicContact CG1-CB 4.47Å; I1532-I1599 HydrophobicContact CD1-CD1 4.42Å
1533	Q	89.9	Confident	81.1	Confident	25 Å²	25	23.8 Å²	23.8	12%	0.117	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	121.2	172.1	-170.5	166.3	31.9	0	0	109.8	Y1535 P1541 S1542 I1544 R1580 W1582	Q1533-Y1535 HydrophobicContact CB-CE2 4.46Å; Q1533-Y1535 HydrophobicContact CG-CE2 4.09Å; Q1533-P1541 HydrophobicContact CG-CB 4.08Å; Q1533-S1542 PolarHBondContact NE2-O 2.92Å; Q1533-I1544 HydrophobicContact CB-CG1 4.43Å; Q1533-I1544 HydrophobicContact CG-CG1 4.35Å; Q1533-R1580 HydrophobicContact CB-CB 4.41Å; Q1533-R1580 PolarHBondContact N-O 2.69Å; Q1533-R1580 PolarHBondContact O-N 3.03Å; Q1533-W1582 HydrophobicContact CB-CH2 4.47Å; Q1533-W1582 HydrophobicContact CB-CZ3 4.15Å
1534	L	87.3	Confident	81	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	141.3	-175.9	-177.1	62.7	0	0	0	109.9	Y1512 S1542 L1569 L1572 F1576 L1579 I1599 F1614	Y1512-L1534 HydrophobicContact CD1-CD2 4.29Å; Y1512-L1534 HydrophobicContact CE1-CD2 4.26Å; L1534-S1542 PolarHBondContact N-OG 2.94Å; L1534-S1542 VanDerWaalsContact N-OG 3.14Å; L1534-S1542 PolarHBondContact O-N 3.28Å; L1534-S1542 PolarHBondContact O-OG 2.82Å; L1534-L1569 HydrophobicContact CB-CD1 4.12Å; L1534-L1569 HydrophobicContact CD2-CD1 4.27Å; L1534-L1572 HydrophobicContact CB-CD1 3.87Å; L1534-L1572 HydrophobicContact CD2-CD1 3.86Å; L1534-L1572 HydrophobicContact CG-CD1 3.62Å; L1534-L1572 WeakPolarHBondContact O-CD1 3.46Å; L1534-F1576 HydrophobicContact CD1-CB 3.91Å; L1534-F1576 HydrophobicContact CD1-CD1 4.28Å; L1534-F1576 HydrophobicContact CD1-CD2 3.95Å; L1534-F1576 HydrophobicContact CD1-CG 3.75Å; L1534-F1576 HydrophobicContact CD2-CD1 4Å; L1534-F1576 HydrophobicContact CD2-CD2 4.17Å; L1534-F1576 HydrophobicContact CD2-CE1 4.02Å; L1534-F1576 HydrophobicContact CD2-CE2 4.14Å; L1534-F1576 HydrophobicContact CD2-CG 4.13Å; L1534-F1576 HydrophobicContact CD2-CZ 4.13Å; L1534-F1576 HydrophobicContact CG-CD1 4.14Å; L1534-F1576 HydrophobicContact CG-CD2 4.49Å; L1534-F1576 HydrophobicContact CG-CG 4.12Å; L1534-L1579 HydrophobicContact CB-CD1 4.37Å; L1534-L1579 HydrophobicContact CD1-CD1 3.98Å; L1534-I1599 HydrophobicContact CD1-CD1 3.89Å; L1534-I1599 HydrophobicContact CD2-CG2 4.04Å; L1534-F1614 HydrophobicContact CD1-CZ 4.02Å
1535	Y	83.1	Confident	80.9	Confident	4 Å²	4	29 Å²	29	2%	0.016	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-115.5	130.7	-179.6	-67.9	-115.7	0	0	0	111.2	Q1533 L1540 P1541 F1576 S1577 K1578 R1580 D1689	Q1533-Y1535 HydrophobicContact CB-CE2 4.46Å; Q1533-Y1535 HydrophobicContact CG-CE2 4.09Å; Y1535-L1540 CarbonylContact C-O 3.33Å; Y1535-L1540 VanDerWaalsContact CA-O 3.25Å; Y1535-L1540 WeakPolarHBondContact CA-O 3.46Å; Y1535-P1541 HydrophobicContact CD1-CB 3.98Å; Y1535-P1541 HydrophobicContact CE1-CB 3.73Å; Y1535-P1541 HydrophobicContact CE1-CG 4.31Å; Y1535-P1541 HydrophobicContact CE2-CB 4.36Å; Y1535-P1541 HydrophobicContact CG-CB 4.43Å; Y1535-F1576 CarbonylContact O-C 3.56Å; Y1535-F1576 WeakPolarHBondContact O-CA 3.35Å; Y1535-F1576 WeakPolarHBondContact O-CB 3.37Å; Y1535-S1577 VanDerWaalsContact CB-OG 3.31Å; Y1535-S1577 WeakPolarHBondContact CB-OG 3.4Å; Y1535-S1577 PolarHBondContact O-N 2.92Å; Y1535-S1577 PolarHBondContact O-OG 2.92Å; Y1535-K1578 WeakPolarHBondContact CB-O 3.47Å; Y1535-K1578 HydrophobicContact CD1-CG 4.31Å; Y1535-K1578 HydrophobicContact CD2-CG 3.76Å; Y1535-K1578 HydrophobicContact CE2-CG 4.36Å; Y1535-K1578 HydrophobicContact CG-CG 3.74Å; Y1535-K1578 PolarHBondContact N-O 3.15Å; Y1535-R1580 HydrophobicContact CE2-CB 4.25Å; Y1535-R1580 VanDerWaalsContact OH-CZ 3.24Å; Y1535-R1580 PolarHBondContact OH-NH1 2.86Å; Y1535-R1580 PolarHBondContact OH-NH2 3.18Å; Y1535-D1689 PolarHBondContact OH-OD2 3.08Å; Y1535-D1689 VanDerWaalsContact OH-OD2 3.06Å
1536	G	77.8	Confident	80.7	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.			trans	-71.8	173.8	177.3	0	0	0	0	0	113.5	D1538 S1539 L1540 Q1573 S1577	G1536-D1538 WeakPolarHBondContact CA-OD1 3.47Å; G1536-D1538 PolarHBondContact O-N 2.99Å; G1536-S1539 WeakPolarHBondContact O-CA 3.45Å; G1536-S1539 PolarHBondContact O-N 2.86Å; G1536-L1540 PolarHBondContact N-O 3.21Å; G1536-Q1573 CarbonylContact C-O 3.53Å; G1536-Q1573 WeakPolarHBondContact CA-O 3.42Å; G1536-S1577 WeakPolarHBondContact O-CB 3.33Å; G1536-S1577 PolarHBondContact O-OG 3Å
1537	N	73.4	Confident	80.5	Confident	58 Å²	58	29.2 Å²	29.2	31%	0.31	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.8	174.7	-162.9	19	0	0	0	112.8	S1539 Q1573 P1575	N1537-S1539 PolarHBondContact O-N 3.22Å; N1537-Q1573 HydrophobicContact CB-CB 4.35Å; N1537-Q1573 HydrophobicContact CB-CG 4.07Å; N1537-Q1573 PolarHBondContact N-O 3.29Å; N1537-P1575 WeakPolarHBondContact CA-O 3.39Å; N1537-P1575 WeakPolarHBondContact CB-O 3.31Å; N1537-P1575 PolarHBondContact N-O 2.61Å
1538	D	63.7	Low	80	Confident	31 Å²	31	28.7 Å²	28.7	17%	0.166	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-6.2	170.6	51.1	13.6	0	0	0	113.7	G1536 L1540 D1860	G1536-D1538 WeakPolarHBondContact CA-OD1 3.47Å; G1536-D1538 PolarHBondContact O-N 2.99Å; D1538-L1540 PolarHBondContact O-N 3.36Å; D1538-L1540 WeakPolarHBondContact OD1-CB 3.49Å; D1538-L1540 PolarHBondContact OD1-N 2.91Å; D1538-D1860 HydrophobicContact CB-CB 4.4Å
1539	S	65.6	Low	79	Confident	27 Å²	27	34.2 Å²	34.2	19%	0.189	17%	0.172	C	C	.	.			trans	63.5	15.9	-169.8	-47.6	0	0	0	0	114.8	G1536 N1537 P1541	G1536-S1539 WeakPolarHBondContact O-CA 3.45Å; G1536-S1539 PolarHBondContact O-N 2.86Å; N1537-S1539 PolarHBondContact O-N 3.22Å; S1539-P1541 WeakPolarHBondContact O-CD 3.36Å
1540	L	65.2	Low	77.6	Confident	19 Å²	19	38.7 Å²	38.7	10%	0.099	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-67.5	127.9	168.2	-97.1	-175.3	0	0	0	110	Y1535 G1536 D1538 D1860 K1861	Y1535-L1540 CarbonylContact C-O 3.33Å; Y1535-L1540 VanDerWaalsContact CA-O 3.25Å; Y1535-L1540 WeakPolarHBondContact CA-O 3.46Å; G1536-L1540 PolarHBondContact N-O 3.21Å; D1538-L1540 PolarHBondContact O-N 3.36Å; D1538-L1540 WeakPolarHBondContact OD1-CB 3.49Å; D1538-L1540 PolarHBondContact OD1-N 2.91Å; L1540-D1860 HydrophobicContact CD1-CB 4.11Å; L1540-D1860 VanDerWaalsContact CD2-O 3.23Å; L1540-D1860 WeakPolarHBondContact CD2-O 3.29Å; L1540-D1860 HydrophobicContact CG-CB 4.02Å; L1540-D1860 WeakPolarHBondContact CG-O 3.25Å; L1540-K1861 HydrophobicContact CD2-CB 4.25Å; L1540-K1861 HydrophobicContact CD2-CG 4.24Å
1541	P	74.3	Confident	76.1	Confident	58 Å²	58	45.9 Å²	45.9	38%	0.377	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-75.1	143.2	164.9	30.1	-32.5	0	0	0	111.4	Q1533 Y1535 S1539	Q1533-P1541 HydrophobicContact CG-CB 4.08Å; Y1535-P1541 HydrophobicContact CD1-CB 3.98Å; Y1535-P1541 HydrophobicContact CE1-CB 3.73Å; Y1535-P1541 HydrophobicContact CE1-CG 4.31Å; Y1535-P1541 HydrophobicContact CE2-CB 4.36Å; Y1535-P1541 HydrophobicContact CG-CB 4.43Å; S1539-P1541 WeakPolarHBondContact O-CD 3.36Å
1542	S	80.6	Confident	74.6	Confident	4 Å²	4	46.1 Å²	46.1	3%	0.028	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-63.5	170	159.9	71.3	0	0	0	0	111.5	Q1533 L1534	Q1533-S1542 PolarHBondContact NE2-O 2.92Å; L1534-S1542 PolarHBondContact N-OG 2.94Å; L1534-S1542 VanDerWaalsContact N-OG 3.14Å; L1534-S1542 PolarHBondContact O-N 3.28Å; L1534-S1542 PolarHBondContact O-OG 2.82Å
1543	S	76	Confident	72.9	Confident	45 Å²	45	47.1 Å²	47.1	32%	0.315	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-53.3	145	154.3	-78.1	0	0	0	0	110.7	E1570	S1543-E1570 VanDerWaalsContact CB-OE1 3.26Å; S1543-E1570 WeakPolarHBondContact CB-OE1 3.29Å; S1543-E1570 PolarHBondContact N-OE2 3.05Å; S1543-E1570 PolarHBondContact OG-OE1 3.14Å
1544	I	81	Confident	71.6	Confident	86 Å²	86	53.3 Å²	53.3	44%	0.441	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-65	140.1	167.4	-61	175.5	0	0	0	109	Y1531 Q1533 W1582	Y1531-I1544 HydrophobicContact CD1-CG2 4.17Å; Q1533-I1544 HydrophobicContact CB-CG1 4.43Å; Q1533-I1544 HydrophobicContact CG-CG1 4.35Å; I1544-W1582 HydrophobicContact CB-CH2 4.34Å; I1544-W1582 HydrophobicContact CD1-CH2 3.92Å; I1544-W1582 HydrophobicContact CD1-CZ2 4.2Å; I1544-W1582 HydrophobicContact CG1-CH2 3.95Å; I1544-W1582 HydrophobicContact CG2-CH2 3.53Å; I1544-W1582 HydrophobicContact CG2-CZ2 3.77Å
1545	R	82.5	Confident	70.6	Confident	67 Å²	67	59.9 Å²	59.9	25%	0.253	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	145.8	172.2	-67.5	-75.5	-170.6	-88.6	-9.9	110.3	Y1531 I1532 V1567 E1568 L1569	Y1531-R1545 CarbonylContact C-O 3.37Å; Y1531-R1545 VanDerWaalsContact CA-O 3.27Å; Y1531-R1545 WeakPolarHBondContact CA-O 3.27Å; I1532-R1545 HydrophobicContact CG2-CB 4.3Å; I1532-R1545 PolarHBondContact N-O 2.75Å; I1532-R1545 PolarHBondContact O-N 3.43Å; R1545-V1567 HydrophobicContact CB-CG1 3.76Å; R1545-V1567 HydrophobicContact CG-CG1 3.5Å; R1545-V1567 VanDerWaalsContact CG-CG1 3.5Å; R1545-E1568 VanDerWaalsContact CZ-O 3.29Å; R1545-E1568 PolarHBondContact NE-O 3.38Å; R1545-E1568 PolarHBondContact NH2-O 2.84Å; R1545-L1569 HydrophobicContact CB-CD2 4.44Å; R1545-L1569 HydrophobicContact CG-CD2 3.43Å; R1545-L1569 VanDerWaalsContact CG-CD2 3.43Å
1546	R	84.7	Confident	70.3	Confident	75 Å²	75	62.8 Å²	62.8	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	140.2	163.7	-170.1	-174.2	179.5	-178.3	3.6	107.8	S1529 V1530 Y1531 H1548 N1550	S1529-R1546 PolarHBondContact OG-NH2 2.89Å; V1530-R1546 WeakPolarHBondContact O-CA 3.49Å; V1530-R1546 WeakPolarHBondContact O-CG 3.49Å; Y1531-R1546 HydrophobicContact CD1-CB 3.89Å; Y1531-R1546 HydrophobicContact CD1-CG 4.33Å; Y1531-R1546 HydrophobicContact CE1-CB 3.83Å; Y1531-R1546 HydrophobicContact CE1-CG 4.1Å; R1546-H1548 VanDerWaalsContact CD-O 3.25Å; R1546-H1548 WeakPolarHBondContact CD-O 3.4Å; R1546-H1548 WeakPolarHBondContact CG-O 3.46Å; R1546-H1548 PolarHBondContact NE-CE1 3.25Å; R1546-H1548 PolarHBondContact NE-NE2 3.16Å; R1546-H1548 PolarHBondContact NE-O 3.14Å; R1546-N1550 VanDerWaalsContact CZ-OD1 3.29Å; R1546-N1550 PolarHBondContact NH1-OD1 3.14Å; R1546-N1550 PolarHBondContact NH2-OD1 3.44Å
1547	L	81.7	Confident	70.7	Confident	13 Å²	13	62.8 Å²	62.8	7%	0.068	32%	0.316	C	S	.	.	S	Bend	trans	-76.5	-29.3	-175.6	-71.4	179.5	0	0	0	113.5	I1514 T1516 V1530 I1532 F1557 F1565 V1567 I1581	I1514-L1547 HydrophobicContact CD1-CD2 4.17Å; I1514-L1547 HydrophobicContact CG2-CD2 4.12Å; T1516-L1547 HydrophobicContact CG2-CD1 3.92Å; V1530-L1547 HydrophobicContact CB-CD1 4.48Å; V1530-L1547 HydrophobicContact CG1-CD1 3.79Å; V1530-L1547 HydrophobicContact CG1-CG 4.49Å; V1530-L1547 PolarHBondContact O-N 2.72Å; I1532-L1547 HydrophobicContact CB-CD2 4.1Å; I1532-L1547 HydrophobicContact CB-CG 4.32Å; I1532-L1547 HydrophobicContact CD1-CD1 4.49Å; I1532-L1547 HydrophobicContact CD1-CD2 4.17Å; I1532-L1547 HydrophobicContact CG2-CD2 3.69Å; I1532-L1547 HydrophobicContact CG2-CG 4.33Å; L1547-F1557 HydrophobicContact CB-CZ 4.22Å; L1547-F1557 HydrophobicContact CD1-CE1 4.34Å; L1547-F1557 HydrophobicContact CD1-CZ 4.31Å; L1547-F1565 HydrophobicContact CB-CD1 4.01Å; L1547-F1565 HydrophobicContact CB-CD2 3.98Å; L1547-F1565 HydrophobicContact CB-CE1 4.11Å; L1547-F1565 HydrophobicContact CB-CE2 4.08Å; L1547-F1565 HydrophobicContact CB-CG 3.93Å; L1547-F1565 HydrophobicContact CB-CZ 4.15Å; L1547-F1565 HydrophobicContact CD1-CD2 3.94Å; L1547-F1565 HydrophobicContact CD1-CE2 3.89Å; L1547-F1565 HydrophobicContact CD2-CB 4.21Å; L1547-F1565 HydrophobicContact CD2-CD2 4.02Å; L1547-F1565 HydrophobicContact CD2-CG 4.16Å; L1547-F1565 HydrophobicContact CG-CD2 4.21Å; L1547-F1565 HydrophobicContact CG-CE2 4.46Å; L1547-F1565 HydrophobicContact CG-CG 4.48Å; L1547-F1565 WeakPolarHBondContact O-CD1 3.29Å; L1547-V1567 HydrophobicContact CD2-CG2 4.28Å; L1547-I1581 HydrophobicContact CD1-CD1 4.35Å
1548	H	75.1	Confident	71.3	Confident	14 Å²	14	63.4 Å²	63.4	7%	0.065	32%	0.317	C	S	.	.	S	Bend	trans	-131	165.9	-173.1	68.3	97.8	0	0	0	111.8	S1529 V1530 R1546 F1557 F1565	S1529-H1548 VanDerWaalsContact CA-NE2 3.27Å; S1529-H1548 WeakPolarHBondContact CA-NE2 3.21Å; V1530-H1548 PolarHBondContact N-NE2 3.02Å; V1530-H1548 VanDerWaalsContact N-NE2 3.19Å; R1546-H1548 VanDerWaalsContact CD-O 3.25Å; R1546-H1548 WeakPolarHBondContact CD-O 3.4Å; R1546-H1548 WeakPolarHBondContact CG-O 3.46Å; R1546-H1548 PolarHBondContact NE-CE1 3.25Å; R1546-H1548 PolarHBondContact NE-NE2 3.16Å; R1546-H1548 PolarHBondContact NE-O 3.14Å; H1548-F1557 AromaticContact CD2-CE2 3.75Å; H1548-F1565 HydrophobicContact CB-CE1 4.27Å
1549	Q	65.4	Low	72.5	Confident	115 Å²	115	67.4 Å²	67.4	54%	0.537	33%	0.33	S	S	.	.			trans	-88	168.7	175.5	-57.7	-170.2	17.8	0	0	111.8	N1551 D1552	Q1549-N1551 PolarHBondContact O-N 3.33Å; Q1549-N1551 VanDerWaalsContact O-N 3.12Å; Q1549-D1552 PolarHBondContact O-N 3.12Å
1550	N	53.4	Low	73.5	Confident	107 Å²	107	70.9 Å²	70.9	57%	0.572	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.1	-175.6	-89.2	-14	0	0	0	114.8	R1546	R1546-N1550 VanDerWaalsContact CZ-OD1 3.29Å; R1546-N1550 PolarHBondContact NH1-OD1 3.14Å; R1546-N1550 PolarHBondContact NH2-OD1 3.44Å
1551	N	55.3	Low	74.6	Confident	150 Å²	150	73 Å²	73	80%	0.802	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-4.2	-166.9	-60.3	23	0	0	0	113.7	Q1549	Q1549-N1551 PolarHBondContact O-N 3.33Å; Q1549-N1551 VanDerWaalsContact O-N 3.12Å
1552	D	59.7	Low	75.2	Confident	66 Å²	66	74.9 Å²	74.9	35%	0.353	36%	0.361	S	S	.	.	S	Bend	trans	-99.6	-5.3	-175	-67.5	-15.1	0	0	0	113.1	Q1549 E1554 Q1555 R1556	Q1549-D1552 PolarHBondContact O-N 3.12Å; D1552-E1554 VanDerWaalsContact C-N 3.32Å; D1552-E1554 PolarHBondContact O-N 2.89Å; D1552-Q1555 PolarHBondContact O-N 3.44Å; D1552-Q1555 VanDerWaalsContact O-N 3.16Å; D1552-R1556 HydrophobicContact CB-CG 4.34Å; D1552-R1556 WeakPolarHBondContact O-CG 3.26Å; D1552-R1556 PolarHBondContact O-N 2.86Å
1553	S	56.1	Low	75.4	Confident	22 Å²	22	74.8 Å²	74.8	15%	0.154	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23	-167.3	43	0	0	0	0	115.5	Q1555	S1553-Q1555 VanDerWaalsContact C-N 3.26Å; S1553-Q1555 PolarHBondContact O-N 2.95Å
1554	E	61.1	Low	75.7	Confident	155 Å²	155	74.1 Å²	74.1	72%	0.724	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.1	176.9	-62.7	-178.5	163.6	0	0	112.9	D1552 Q1558	D1552-E1554 VanDerWaalsContact C-N 3.32Å; D1552-E1554 PolarHBondContact O-N 2.89Å; E1554-Q1558 PolarHBondContact O-NE2 2.8Å
1555	Q	67.8	Low	75.7	Confident	141 Å²	141	70.6 Å²	70.6	66%	0.659	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-1.3	-178.5	-63	-167.8	4.2	0	0	113.9	D1552 S1553 K1561	D1552-Q1555 PolarHBondContact O-N 3.44Å; D1552-Q1555 VanDerWaalsContact O-N 3.16Å; S1553-Q1555 VanDerWaalsContact C-N 3.26Å; S1553-Q1555 PolarHBondContact O-N 2.95Å; Q1555-K1561 WeakPolarHBondContact O-CE 3.4Å; Q1555-K1561 PolarHBondContact O-NZ 3.12Å
1556	R	75.8	Confident	75.4	Confident	65 Å²	65	70.5 Å²	70.5	25%	0.245	34%	0.336	C	S	.	.	S	Bend	trans	-107.2	155.6	177.1	-62.5	-63.1	-174.5	176.9	1.8	109.8	D1552 Q1558 D1563	D1552-R1556 HydrophobicContact CB-CG 4.34Å; D1552-R1556 WeakPolarHBondContact O-CG 3.26Å; D1552-R1556 PolarHBondContact O-N 2.86Å; R1556-Q1558 VanDerWaalsContact C-N 3.27Å; R1556-Q1558 PolarHBondContact O-N 2.86Å; R1556-D1563 WeakPolarHBondContact CD-OD1 3.31Å; R1556-D1563 IonicContact CZ-OD1 2.78Å; R1556-D1563 IonicContact NE-OD1 3.31Å; R1556-D1563 IonicContact NH1-OD1 3.53Å; R1556-D1563 PolarHBondContact NH1-OD1 3.23Å
1557	F	86.5	Confident	74.9	Confident	1 Å²	1	67.4 Å²	67.4	0%	0.004	33%	0.325	C	S	.	.	S	Bend	trans	58.4	31.1	176.1	-41.2	-72.1	0	0	0	115.2	T1516 E1525 T1526 V1530 L1547 H1548 D1563 F1565 W1592	T1516-F1557 HydrophobicContact CG2-CE1 4.34Å; T1516-F1557 WeakPolarHBondContact OG1-CE1 3.32Å; E1525-F1557 CarbonylContact C-O 3.58Å; E1525-F1557 WeakPolarHBondContact CA-O 3.38Å; E1525-F1557 WeakPolarHBondContact CB-O 3.49Å; T1526-F1557 HydrophobicContact CG2-CB 3.86Å; T1526-F1557 HydrophobicContact CG2-CD2 4.44Å; T1526-F1557 HydrophobicContact CG2-CG 4.3Å; T1526-F1557 PolarHBondContact N-O 2.94Å; T1526-F1557 VanDerWaalsContact N-O 3.07Å; V1530-F1557 HydrophobicContact CB-CE1 4.23Å; V1530-F1557 HydrophobicContact CB-CE2 3.85Å; V1530-F1557 HydrophobicContact CB-CZ 3.64Å; V1530-F1557 HydrophobicContact CG1-CE1 4.32Å; V1530-F1557 HydrophobicContact CG1-CZ 4.16Å; V1530-F1557 HydrophobicContact CG2-CD1 4.28Å; V1530-F1557 HydrophobicContact CG2-CD2 3.72Å; V1530-F1557 HydrophobicContact CG2-CE1 4.03Å; V1530-F1557 HydrophobicContact CG2-CE2 3.45Å; V1530-F1557 VanDerWaalsContact CG2-CE2 3.45Å; V1530-F1557 HydrophobicContact CG2-CG 4.13Å; V1530-F1557 HydrophobicContact CG2-CZ 3.62Å; L1547-F1557 HydrophobicContact CB-CZ 4.22Å; L1547-F1557 HydrophobicContact CD1-CE1 4.34Å; L1547-F1557 HydrophobicContact CD1-CZ 4.31Å; H1548-F1557 AromaticContact CD2-CE2 3.75Å; F1557-D1563 PolarHBondContact N-OD2 2.99Å; F1557-F1565 HydrophobicContact CD1-CZ 4.45Å; F1557-F1565 AromaticContact CE1-CE2 3.69Å; F1557-F1565 HydrophobicContact CE1-CE2 3.69Å; F1557-F1565 AromaticContact CE1-CZ 3.44Å; F1557-F1565 HydrophobicContact CE1-CZ 3.44Å; F1557-F1565 VanDerWaalsContact CE1-CZ 3.44Å; F1557-F1565 HydrophobicContact CE2-CZ 4.27Å; F1557-F1565 HydrophobicContact CZ-CE1 4.13Å; F1557-F1565 AromaticContact CZ-CE2 3.92Å; F1557-F1565 HydrophobicContact CZ-CE2 3.92Å; F1557-F1565 AromaticContact CZ-CZ 3.32Å; F1557-F1565 HydrophobicContact CZ-CZ 3.32Å; F1557-W1592 HydrophobicContact CB-CZ2 4.44Å; F1557-W1592 HydrophobicContact CD1-CH2 4.08Å; F1557-W1592 AromaticContact CD1-CZ2 3.46Å; F1557-W1592 HydrophobicContact CD1-CZ2 3.46Å; F1557-W1592 VanDerWaalsContact CD1-CZ2 3.46Å; F1557-W1592 HydrophobicContact CE1-CH2 4.22Å; F1557-W1592 HydrophobicContact CE1-CZ2 4.03Å; F1557-W1592 HydrophobicContact CG-CZ2 4.22Å
1558	Q	86.2	Confident	74.5	Confident	70 Å²	70	69.8 Å²	69.8	33%	0.327	34%	0.336	S	S	.	.			trans	-75.8	161	173.9	-60.2	170.5	-37.2	0	0	111.2	T1518 E1554 R1556 N1560 K1561	T1518-Q1558 VanDerWaalsContact CB-O 3.24Å; T1518-Q1558 WeakPolarHBondContact CB-O 3.49Å; T1518-Q1558 WeakPolarHBondContact CG2-O 3.48Å; E1554-Q1558 PolarHBondContact O-NE2 2.8Å; R1556-Q1558 VanDerWaalsContact C-N 3.27Å; R1556-Q1558 PolarHBondContact O-N 2.86Å; Q1558-N1560 PolarHBondContact O-N 3.18Å; Q1558-K1561 HydrophobicContact CB-CB 4.27Å; Q1558-K1561 HydrophobicContact CB-CD 4.04Å; Q1558-K1561 HydrophobicContact CG-CD 4.36Å; Q1558-K1561 WeakPolarHBondContact O-CB 3.42Å; Q1558-K1561 PolarHBondContact O-N 3.29Å
1559	R	87.4	Confident	74.6	Confident	116 Å²	116	69.1 Å²	69.1	44%	0.438	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	133.4	175.9	-178.5	176.3	172.9	-95.5	-9.6	111.5	D1520 I1521 A1524 K1561	D1520-R1559 PolarHBondContact O-NE 2.66Å; D1520-R1559 PolarHBondContact O-NH2 2.8Å; D1520-R1559 IonicContact OD1-CZ 2.61Å; D1520-R1559 IonicContact OD1-NE 3.32Å; D1520-R1559 IonicContact OD1-NH1 3.82Å; D1520-R1559 PolarHBondContact OD1-NH1 3.43Å; D1520-R1559 IonicContact OD1-NH2 3.03Å; D1520-R1559 PolarHBondContact OD1-NH2 3.3Å; D1520-R1559 IonicContact OD2-CZ 2.72Å; D1520-R1559 IonicContact OD2-NH2 2.76Å; D1520-R1559 PolarHBondContact OD2-NH2 2.87Å; I1521-R1559 VanDerWaalsContact O-CD 3.26Å; I1521-R1559 WeakPolarHBondContact O-CD 3.32Å; I1521-R1559 PolarHBondContact O-NE 2.94Å; A1524-R1559 WeakPolarHBondContact O-CA 3.33Å; A1524-R1559 PolarHBondContact O-N 2.85Å; R1559-K1561 PolarHBondContact O-N 3.48Å; R1559-K1561 VanDerWaalsContact O-N 3.17Å
1560	N	87.5	Confident	75.2	Confident	100 Å²	100	65.2 Å²	65.2	54%	0.535	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	14.5	-178.2	-151.8	4	0	0	0	116.1	T1518 S1519 D1520 Q1558	T1518-N1560 WeakPolarHBondContact O-CA 3.36Å; S1519-N1560 PolarHBondContact O-N 2.75Å; D1520-N1560 HydrophobicContact CB-CB 3.92Å; D1520-N1560 VanDerWaalsContact OD1-CB 3.3Å; D1520-N1560 WeakPolarHBondContact OD1-CB 3.25Å; D1520-N1560 PolarHBondContact OD1-ND2 2.96Å; Q1558-N1560 PolarHBondContact O-N 3.18Å
1561	K	88	Confident	76.3	Confident	63 Å²	63	65 Å²	65	27%	0.274	31%	0.31	S	S	.	.			trans	-89	139.5	-175.6	-159.1	164	-163.1	159.8	0	113.1	T1518 Q1555 Q1558 R1559	T1518-K1561 WeakPolarHBondContact CB-O 3.38Å; T1518-K1561 PolarHBondContact N-O 3.09Å; Q1555-K1561 WeakPolarHBondContact O-CE 3.4Å; Q1555-K1561 PolarHBondContact O-NZ 3.12Å; Q1558-K1561 HydrophobicContact CB-CB 4.27Å; Q1558-K1561 HydrophobicContact CB-CD 4.04Å; Q1558-K1561 HydrophobicContact CG-CD 4.36Å; Q1558-K1561 WeakPolarHBondContact O-CB 3.42Å; Q1558-K1561 PolarHBondContact O-N 3.29Å; R1559-K1561 PolarHBondContact O-N 3.48Å; R1559-K1561 VanDerWaalsContact O-N 3.17Å
1562	I	87.7	Confident	77.3	Confident	98 Å²	98	58.2 Å²	58.2	50%	0.503	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	109.9	168.1	-52.3	172.7	0	0	0	107.7	T1516 F1517	T1516-I1562 WeakPolarHBondContact O-CA 3.37Å; F1517-I1562 HydrophobicContact CD1-CB 4.45Å; F1517-I1562 HydrophobicContact CD1-CD1 3.76Å; F1517-I1562 HydrophobicContact CD1-CG1 3.62Å; F1517-I1562 HydrophobicContact CD1-CG2 4.09Å; F1517-I1562 HydrophobicContact CD2-CG2 4.35Å; F1517-I1562 HydrophobicContact CE1-CD1 3.57Å; F1517-I1562 HydrophobicContact CE1-CG1 3.89Å; F1517-I1562 HydrophobicContact CE1-CG2 3.9Å; F1517-I1562 HydrophobicContact CE2-CG2 4.17Å; F1517-I1562 HydrophobicContact CG-CG1 4.3Å; F1517-I1562 HydrophobicContact CG-CG2 4.31Å; F1517-I1562 HydrophobicContact CZ-CG2 3.94Å
1563	D	84.9	Confident	77.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.8	178.3	-74.9	-66.7	0	0	0	110.9	K1515 T1516 R1556 F1557 F1565	K1515-D1563 CarbonylContact C-O 3.58Å; K1515-D1563 VanDerWaalsContact CA-O 3.24Å; K1515-D1563 WeakPolarHBondContact CA-O 3.47Å; T1516-D1563 PolarHBondContact N-O 2.66Å; T1516-D1563 PolarHBondContact O-N 3.24Å; R1556-D1563 WeakPolarHBondContact CD-OD1 3.31Å; R1556-D1563 IonicContact CZ-OD1 2.78Å; R1556-D1563 IonicContact NE-OD1 3.31Å; R1556-D1563 IonicContact NH1-OD1 3.53Å; R1556-D1563 PolarHBondContact NH1-OD1 3.23Å; F1557-D1563 PolarHBondContact N-OD2 2.99Å; D1563-F1565 HydrophobicContact CB-CE1 4.41Å; D1563-F1565 HydrophobicContact CB-CE2 3.81Å; D1563-F1565 HydrophobicContact CB-CZ 3.55Å
1564	T	81.2	Confident	78.6	Confident	32 Å²	32	61 Å²	61	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135	-180	-56.4	0	0	0	0	110	Q1513 I1514 K1515 Y1566	Q1513-T1564 HydrophobicContact CG-CG2 3.88Å; I1514-T1564 CarbonylContact O-C 3.5Å; K1515-T1564 HydrophobicContact CG-CG2 4.08Å; T1564-Y1566 HydrophobicContact CG2-CE2 4.2Å
1565	F	81.6	Confident	79.4	Confident	12 Å²	12	56.1 Å²	56.1	5%	0.053	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.8	179.7	-49.6	-75.8	0	0	0	109.7	Q1513 I1514 T1516 L1547 H1548 F1557 D1563 V1567	Q1513-F1565 CarbonylContact C-O 3.54Å; Q1513-F1565 WeakPolarHBondContact CA-O 3.38Å; I1514-F1565 PolarHBondContact N-O 3.25Å; I1514-F1565 PolarHBondContact O-N 3.14Å; T1516-F1565 HydrophobicContact CG2-CE2 4.15Å; L1547-F1565 HydrophobicContact CB-CD1 4.01Å; L1547-F1565 HydrophobicContact CB-CD2 3.98Å; L1547-F1565 HydrophobicContact CB-CE1 4.11Å; L1547-F1565 HydrophobicContact CB-CE2 4.08Å; L1547-F1565 HydrophobicContact CB-CG 3.93Å; L1547-F1565 HydrophobicContact CB-CZ 4.15Å; L1547-F1565 HydrophobicContact CD1-CD2 3.94Å; L1547-F1565 HydrophobicContact CD1-CE2 3.89Å; L1547-F1565 HydrophobicContact CD2-CB 4.21Å; L1547-F1565 HydrophobicContact CD2-CD2 4.02Å; L1547-F1565 HydrophobicContact CD2-CG 4.16Å; L1547-F1565 HydrophobicContact CG-CD2 4.21Å; L1547-F1565 HydrophobicContact CG-CE2 4.46Å; L1547-F1565 HydrophobicContact CG-CG 4.48Å; L1547-F1565 WeakPolarHBondContact O-CD1 3.29Å; H1548-F1565 HydrophobicContact CB-CE1 4.27Å; F1557-F1565 HydrophobicContact CD1-CZ 4.45Å; F1557-F1565 AromaticContact CE1-CE2 3.69Å; F1557-F1565 HydrophobicContact CE1-CE2 3.69Å; F1557-F1565 AromaticContact CE1-CZ 3.44Å; F1557-F1565 HydrophobicContact CE1-CZ 3.44Å; F1557-F1565 VanDerWaalsContact CE1-CZ 3.44Å; F1557-F1565 HydrophobicContact CE2-CZ 4.27Å; F1557-F1565 HydrophobicContact CZ-CE1 4.13Å; F1557-F1565 AromaticContact CZ-CE2 3.92Å; F1557-F1565 HydrophobicContact CZ-CE2 3.92Å; F1557-F1565 AromaticContact CZ-CZ 3.32Å; F1557-F1565 HydrophobicContact CZ-CZ 3.32Å; D1563-F1565 HydrophobicContact CB-CE1 4.41Å; D1563-F1565 HydrophobicContact CB-CE2 3.81Å; D1563-F1565 HydrophobicContact CB-CZ 3.55Å; F1565-V1567 HydrophobicContact CB-CG2 4.36Å
1566	Y	75.3	Confident	80	Confident	65 Å²	65	49.6 Å²	49.6	26%	0.255	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.6	173	-63.7	-80.6	0	0	0	108.9	D1367 S1369 I1372 Y1512 Q1513 T1564 I1602	D1367-Y1566 PolarHBondContact O-OH 3.33Å; S1369-Y1566 WeakPolarHBondContact CA-OH 3.35Å; S1369-Y1566 WeakPolarHBondContact CB-OH 3.34Å; S1369-Y1566 PolarHBondContact N-OH 2.92Å; I1372-Y1566 HydrophobicContact CD1-CD1 3.52Å; I1372-Y1566 HydrophobicContact CD1-CD2 3.56Å; I1372-Y1566 HydrophobicContact CD1-CE1 3.92Å; I1372-Y1566 HydrophobicContact CD1-CE2 3.96Å; I1372-Y1566 HydrophobicContact CD1-CG 3.3Å; Y1512-Y1566 WeakPolarHBondContact O-CA 3.44Å; Q1513-Y1566 HydrophobicContact CB-CD1 3.83Å; Q1513-Y1566 HydrophobicContact CB-CE1 3.65Å; Q1513-Y1566 HydrophobicContact CG-CD1 4.21Å; Q1513-Y1566 HydrophobicContact CG-CE1 3.7Å; Q1513-Y1566 PolarHBondContact NE2-OH 2.88Å; T1564-Y1566 HydrophobicContact CG2-CE2 4.2Å; Y1566-I1602 HydrophobicContact CD1-CD1 3.91Å; Y1566-I1602 HydrophobicContact CE1-CD1 4.15Å
1567	V	75.5	Confident	80	Confident	9 Å²	9	46.8 Å²	46.8	6%	0.055	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.8	-167.3	-176.4	0	0	0	0	110.2	Y1512 I1514 R1545 L1547 F1565 L1569	Y1512-V1567 PolarHBondContact N-O 2.73Å; Y1512-V1567 PolarHBondContact O-N 2.78Å; I1514-V1567 HydrophobicContact CD1-CB 3.88Å; I1514-V1567 HydrophobicContact CD1-CG2 3.74Å; R1545-V1567 HydrophobicContact CB-CG1 3.76Å; R1545-V1567 HydrophobicContact CG-CG1 3.5Å; R1545-V1567 VanDerWaalsContact CG-CG1 3.5Å; L1547-V1567 HydrophobicContact CD2-CG2 4.28Å; F1565-V1567 HydrophobicContact CB-CG2 4.36Å; V1567-L1569 HydrophobicContact CG1-CD2 3.88Å; V1567-L1569 HydrophobicContact CG1-CG 3.98Å
1568	E	73.5	Confident	79.9	Confident	63 Å²	63	47.1 Å²	47.1	29%	0.294	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	114.8	172.3	-172.6	174.1	-146.2	0	0	109.5	M1509 R1545	M1509-E1568 HydrophobicContact CB-CG 3.62Å; M1509-E1568 VanDerWaalsContact CB-OE1 3.31Å; M1509-E1568 WeakPolarHBondContact CB-OE1 3.37Å; M1509-E1568 HydrophobicContact CG-CG 4.17Å; M1509-E1568 HydrophobicContact SD-CG 4.23Å; R1545-E1568 VanDerWaalsContact CZ-O 3.29Å; R1545-E1568 PolarHBondContact NE-O 3.38Å; R1545-E1568 PolarHBondContact NH2-O 2.84Å
1569	L	76.8	Confident	80	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	165.1	177.9	-62.8	177.3	0	0	0	109.9	M1509 T1510 Y1512 L1534 R1545 V1567	M1509-L1569 CarbonylContact C-O 3.57Å; M1509-L1569 WeakPolarHBondContact CA-O 3.42Å; M1509-L1569 VanDerWaalsContact SD-O 3.4Å; T1510-L1569 PolarHBondContact N-O 3.38Å; T1510-L1569 PolarHBondContact O-N 2.69Å; T1510-L1569 VanDerWaalsContact O-O 3.14Å; Y1512-L1569 HydrophobicContact CD2-CB 3.82Å; Y1512-L1569 HydrophobicContact CD2-CD1 4.07Å; Y1512-L1569 HydrophobicContact CD2-CG 4.15Å; Y1512-L1569 HydrophobicContact CE2-CB 3.81Å; Y1512-L1569 HydrophobicContact CE2-CD1 4.49Å; Y1512-L1569 HydrophobicContact CG-CD1 4.49Å; L1534-L1569 HydrophobicContact CB-CD1 4.12Å; L1534-L1569 HydrophobicContact CD2-CD1 4.27Å; R1545-L1569 HydrophobicContact CB-CD2 4.44Å; R1545-L1569 HydrophobicContact CG-CD2 3.43Å; R1545-L1569 VanDerWaalsContact CG-CD2 3.43Å; V1567-L1569 HydrophobicContact CG1-CD2 3.88Å; V1567-L1569 HydrophobicContact CG1-CG 3.98Å
1570	E	77.8	Confident	79.9	Confident	33 Å²	33	39.3 Å²	39.3	15%	0.154	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	143.8	167.4	-60.3	76.1	-170.8	0	0	110	M1509 S1543 L1572	M1509-E1570 HydrophobicContact CE-CG 3.86Å; M1509-E1570 HydrophobicContact SD-CG 4.37Å; M1509-E1570 PolarHBondContact SD-N 2.82Å; M1509-E1570 VanDerWaalsContact SD-N 3.43Å; S1543-E1570 VanDerWaalsContact CB-OE1 3.26Å; S1543-E1570 WeakPolarHBondContact CB-OE1 3.29Å; S1543-E1570 PolarHBondContact N-OE2 3.05Å; S1543-E1570 PolarHBondContact OG-OE1 3.14Å; E1570-L1572 PolarHBondContact O-N 3Å
1571	E	76.8	Confident	80.1	Confident	101 Å²	101	34.5 Å²	34.5	47%	0.472	17%	0.167	S	C	.	.			trans	-67.8	105.7	176.7	-170.7	172.6	-167.7	0	0	111	P1508 T1510 K1601	P1508-E1571 PolarHBondContact O-N 3.06Å; T1510-E1571 WeakPolarHBondContact OG1-CB 3.43Å; E1571-K1601 VanDerWaalsContact OE1-CE 3.26Å; E1571-K1601 WeakPolarHBondContact OE1-CE 3.4Å; E1571-K1601 IonicContact OE1-NZ 3.06Å; E1571-K1601 PolarHBondContact OE1-NZ 2.86Å
1572	L	76.2	Confident	80.2	Confident	8 Å²	8	34 Å²	34	4%	0.042	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-86.3	153.5	178.7	-59.1	-178.5	0	0	0	112.7	Y1512 L1534 E1570 F1576	Y1512-L1572 PolarHBondContact OH-N 2.88Å; L1534-L1572 HydrophobicContact CB-CD1 3.87Å; L1534-L1572 HydrophobicContact CD2-CD1 3.86Å; L1534-L1572 HydrophobicContact CG-CD1 3.62Å; L1534-L1572 WeakPolarHBondContact O-CD1 3.46Å; E1570-L1572 PolarHBondContact O-N 3Å; L1572-F1576 HydrophobicContact CB-CD1 4.49Å; L1572-F1576 HydrophobicContact CB-CE1 4.27Å
1573	Q	72.4	Confident	80.2	Confident	100 Å²	100	29.5 Å²	29.5	47%	0.467	14%	0.14	S	C	.	.	P	Polyproline II helix	trans	-71.2	126	172.5	-168	178.3	67.5	0	0	111.4	G1536 N1537	G1536-Q1573 CarbonylContact C-O 3.53Å; G1536-Q1573 WeakPolarHBondContact CA-O 3.42Å; N1537-Q1573 HydrophobicContact CB-CB 4.35Å; N1537-Q1573 HydrophobicContact CB-CG 4.07Å; N1537-Q1573 PolarHBondContact N-O 3.29Å
1574	E	71.5	Confident	80.1	Confident	48 Å²	48	32 Å²	32	22%	0.224	15%	0.153	C	C	.	.	S	Bend	trans	-91.3	149.5	177.9	-63.9	167.9	106.5	0	0	110.8	F1576 K1601 K1603	E1574-F1576 HydrophobicContact CG-CE1 3.78Å; E1574-F1576 HydrophobicContact CG-CZ 3.88Å; E1574-K1601 HydrophobicContact CG-CD 4.16Å; E1574-K1601 WeakPolarHBondContact OE1-CD 3.21Å; E1574-K1601 WeakPolarHBondContact OE2-CD 3.34Å; E1574-K1601 IonicContact OE2-NZ 3Å; E1574-K1601 PolarHBondContact OE2-NZ 2.96Å; E1574-K1603 IonicContact OE2-NZ 2.97Å; E1574-K1603 PolarHBondContact OE2-NZ 2.81Å
1575	P	76	Confident	80.1	Confident	51 Å²	51	31.6 Å²	31.6	33%	0.331	15%	0.15	S	C	.	.	S	Bend	cis	-74.6	151.2	-6.8	33.6	-37.1	0	0	0	112.5	N1537 Y1612	N1537-P1575 WeakPolarHBondContact CA-O 3.39Å; N1537-P1575 WeakPolarHBondContact CB-O 3.31Å; N1537-P1575 PolarHBondContact N-O 2.61Å; P1575-Y1612 WeakPolarHBondContact CA-OH 3.26Å; P1575-Y1612 HydrophobicContact CB-CE1 3.49Å; P1575-Y1612 VanDerWaalsContact CB-CE1 3.49Å
1576	F	82.4	Confident	79.7	Confident	5 Å²	5	38.6 Å²	38.6	2%	0.022	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-62.8	147.1	179.8	-48.8	-48.8	0	0	0	112	Y1512 L1534 Y1535 L1572 E1574 I1599 Y1612 F1614 P1635	Y1512-F1576 HydrophobicContact CD1-CZ 4.31Å; Y1512-F1576 HydrophobicContact CE1-CE1 4.13Å; Y1512-F1576 AromaticContact CE1-CZ 3.66Å; Y1512-F1576 HydrophobicContact CE1-CZ 3.66Å; L1534-F1576 HydrophobicContact CD1-CB 3.91Å; L1534-F1576 HydrophobicContact CD1-CD1 4.28Å; L1534-F1576 HydrophobicContact CD1-CD2 3.95Å; L1534-F1576 HydrophobicContact CD1-CG 3.75Å; L1534-F1576 HydrophobicContact CD2-CD1 4Å; L1534-F1576 HydrophobicContact CD2-CD2 4.17Å; L1534-F1576 HydrophobicContact CD2-CE1 4.02Å; L1534-F1576 HydrophobicContact CD2-CE2 4.14Å; L1534-F1576 HydrophobicContact CD2-CG 4.13Å; L1534-F1576 HydrophobicContact CD2-CZ 4.13Å; L1534-F1576 HydrophobicContact CG-CD1 4.14Å; L1534-F1576 HydrophobicContact CG-CD2 4.49Å; L1534-F1576 HydrophobicContact CG-CG 4.12Å; Y1535-F1576 CarbonylContact O-C 3.56Å; Y1535-F1576 WeakPolarHBondContact O-CA 3.35Å; Y1535-F1576 WeakPolarHBondContact O-CB 3.37Å; L1572-F1576 HydrophobicContact CB-CD1 4.49Å; L1572-F1576 HydrophobicContact CB-CE1 4.27Å; E1574-F1576 HydrophobicContact CG-CE1 3.78Å; E1574-F1576 HydrophobicContact CG-CZ 3.88Å; F1576-I1599 HydrophobicContact CE2-CG2 4.11Å; F1576-Y1612 AromaticContact CD2-CD2 3.55Å; F1576-Y1612 HydrophobicContact CD2-CD2 3.55Å; F1576-Y1612 AromaticContact CD2-CE2 3.99Å; F1576-Y1612 HydrophobicContact CD2-CE2 3.99Å; F1576-Y1612 AromaticContact CD2-CG 3.83Å; F1576-Y1612 HydrophobicContact CD2-CG 3.83Å; F1576-Y1612 AromaticContact CE2-CD2 3.29Å; F1576-Y1612 HydrophobicContact CE2-CD2 3.29Å; F1576-Y1612 AromaticContact CE2-CE2 3.58Å; F1576-Y1612 HydrophobicContact CE2-CE2 3.58Å; F1576-Y1612 HydrophobicContact CE2-CG 4.06Å; F1576-Y1612 HydrophobicContact CZ-CD2 4.26Å; F1576-Y1612 HydrophobicContact CZ-CE2 4.14Å; F1576-F1614 HydrophobicContact CB-CZ 4.05Å; F1576-F1614 HydrophobicContact CD2-CZ 4.26Å; F1576-P1635 VanDerWaalsContact O-CG 3.31Å; F1576-P1635 WeakPolarHBondContact O-CG 3.47Å
1577	S	75.9	Confident	79.6	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.042	19%	0.19	C	C	.	.			trans	-87	-51.2	-179.8	52.6	0	0	0	0	112	Y1535 G1536 P1635	Y1535-S1577 VanDerWaalsContact CB-OG 3.31Å; Y1535-S1577 WeakPolarHBondContact CB-OG 3.4Å; Y1535-S1577 PolarHBondContact O-N 2.92Å; Y1535-S1577 PolarHBondContact O-OG 2.92Å; G1536-S1577 WeakPolarHBondContact O-CB 3.33Å; G1536-S1577 PolarHBondContact O-OG 3Å; S1577-P1635 WeakPolarHBondContact O-CD 3.36Å
1578	K	82.8	Confident	79.7	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.035	23%	0.226	C	C	.	.			trans	-150.4	170.3	176.8	71	176.9	-175.9	176.8	0	112.7	Y1535 E1632 L1633 D1689	Y1535-K1578 WeakPolarHBondContact CB-O 3.47Å; Y1535-K1578 HydrophobicContact CD1-CG 4.31Å; Y1535-K1578 HydrophobicContact CD2-CG 3.76Å; Y1535-K1578 HydrophobicContact CE2-CG 4.36Å; Y1535-K1578 HydrophobicContact CG-CG 3.74Å; Y1535-K1578 PolarHBondContact N-O 3.15Å; K1578-E1632 VanDerWaalsContact CE-OE1 3.29Å; K1578-E1632 WeakPolarHBondContact CE-OE1 3.09Å; K1578-E1632 IonicContact NZ-OE1 3.69Å; K1578-E1632 PolarHBondContact NZ-OE1 2.91Å; K1578-E1632 IonicContact NZ-OE2 2.76Å; K1578-E1632 PolarHBondContact NZ-OE2 2.97Å; K1578-L1633 CarbonylContact C-O 3.54Å; K1578-L1633 WeakPolarHBondContact CA-O 3.5Å; K1578-D1689 PolarHBondContact NZ-O 3.05Å
1579	L	87.9	Confident	80.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.8	176.8	178.1	64.8	0	0	0	109.3	I1532 L1534 V1597 I1599 F1614 E1632 L1633	I1532-L1579 HydrophobicContact CD1-CD1 3.74Å; I1532-L1579 HydrophobicContact CD1-CD2 4.34Å; I1532-L1579 HydrophobicContact CD1-CG 4.41Å; I1532-L1579 HydrophobicContact CG1-CD1 3.54Å; I1532-L1579 HydrophobicContact CG1-CG 4.33Å; L1534-L1579 HydrophobicContact CB-CD1 4.37Å; L1534-L1579 HydrophobicContact CD1-CD1 3.98Å; L1579-V1597 HydrophobicContact CD2-CB 3.79Å; L1579-V1597 HydrophobicContact CD2-CG1 3.85Å; L1579-V1597 HydrophobicContact CD2-CG2 4.08Å; L1579-I1599 HydrophobicContact CD1-CD1 3.54Å; L1579-I1599 HydrophobicContact CD2-CD1 3.62Å; L1579-I1599 HydrophobicContact CD2-CG1 4.49Å; L1579-I1599 HydrophobicContact CG-CD1 4.17Å; L1579-F1614 HydrophobicContact CB-CD1 3.5Å; L1579-F1614 HydrophobicContact CB-CE1 3.46Å; L1579-F1614 VanDerWaalsContact CB-CE1 3.46Å; L1579-F1614 HydrophobicContact CB-CG 4.12Å; L1579-F1614 HydrophobicContact CB-CZ 4.07Å; L1579-F1614 HydrophobicContact CD2-CB 4.07Å; L1579-F1614 HydrophobicContact CD2-CD1 4.08Å; L1579-F1614 HydrophobicContact CD2-CD2 4.01Å; L1579-F1614 HydrophobicContact CD2-CE1 4.49Å; L1579-F1614 HydrophobicContact CD2-CE2 4.44Å; L1579-F1614 HydrophobicContact CD2-CG 3.82Å; L1579-F1614 HydrophobicContact CG-CD1 4.46Å; L1579-E1632 CarbonylContact O-C 3.58Å; L1579-E1632 WeakPolarHBondContact O-CA 3.12Å; L1579-L1633 HydrophobicContact CB-CB 4.38Å; L1579-L1633 HydrophobicContact CD2-CD1 4.37Å; L1579-L1633 PolarHBondContact N-O 3.22Å; L1579-L1633 PolarHBondContact O-N 2.75Å
1580	R	86.3	Confident	80.4	Confident	21 Å²	21	42.4 Å²	42.4	8%	0.079	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.4	169.1	-172.3	176.8	-65.2	171.1	0.4	109.1	I1532 Q1533 Y1535 W1582 E1630 E1632 D1689 G1691	I1532-R1580 CarbonylContact C-O 3.59Å; I1532-R1580 WeakPolarHBondContact CA-O 3.45Å; Q1533-R1580 HydrophobicContact CB-CB 4.41Å; Q1533-R1580 PolarHBondContact N-O 2.69Å; Q1533-R1580 PolarHBondContact O-N 3.03Å; Y1535-R1580 HydrophobicContact CE2-CB 4.25Å; Y1535-R1580 VanDerWaalsContact OH-CZ 3.24Å; Y1535-R1580 PolarHBondContact OH-NH1 2.86Å; Y1535-R1580 PolarHBondContact OH-NH2 3.18Å; R1580-W1582 HydrophobicContact CB-CZ3 4.47Å; R1580-W1582 HydrophobicContact CG-CE3 3.92Å; R1580-W1582 HydrophobicContact CG-CZ3 4.03Å; R1580-E1630 HydrophobicContact CG-CG 3.84Å; R1580-E1630 IonicContact NE-OE1 2.67Å; R1580-E1632 IonicContact CZ-OE1 2.89Å; R1580-E1632 VanDerWaalsContact CZ-OE1 3.25Å; R1580-E1632 IonicContact NE-OE1 3.58Å; R1580-E1632 PolarHBondContact NE-OE1 2.9Å; R1580-E1632 IonicContact NH2-OE1 2.76Å; R1580-E1632 PolarHBondContact NH2-OE1 3.02Å; R1580-D1689 IonicContact CZ-OD1 2.67Å; R1580-D1689 VanDerWaalsContact CZ-OD1 3.31Å; R1580-D1689 IonicContact CZ-OD2 2.76Å; R1580-D1689 IonicContact NH1-OD1 2.68Å; R1580-D1689 PolarHBondContact NH1-OD1 2.87Å; R1580-D1689 IonicContact NH1-OD2 2.8Å; R1580-D1689 PolarHBondContact NH2-O 3.5Å; R1580-D1689 IonicContact NH2-OD1 2.87Å; R1580-D1689 PolarHBondContact NH2-OD1 3.06Å; R1580-D1689 IonicContact NH2-OD2 2.7Å; R1580-D1689 PolarHBondContact NH2-OD2 3.02Å; R1580-D1689 VanDerWaalsContact NH2-OD2 3.09Å; R1580-G1691 VanDerWaalsContact NH2-N 3.15Å
1581	I	91.1	Very high	80.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.9	176.6	-168.2	166.9	0	0	0	109.9	T1516 V1530 Y1531 I1532 L1547 W1592 L1594 V1597 L1620 E1630 R1631 L1633	T1516-I1581 HydrophobicContact CG2-CD1 3.95Å; V1530-I1581 HydrophobicContact CG1-CD1 4.3Å; V1530-I1581 HydrophobicContact CG1-CG1 4.09Å; Y1531-I1581 WeakPolarHBondContact O-CA 3.35Å; Y1531-I1581 WeakPolarHBondContact O-CG1 3.34Å; I1532-I1581 HydrophobicContact CD1-CD1 4.36Å; I1532-I1581 HydrophobicContact CG1-CB 4.47Å; L1547-I1581 HydrophobicContact CD1-CD1 4.35Å; I1581-W1592 HydrophobicContact CD1-CH2 3.87Å; I1581-W1592 HydrophobicContact CD1-CZ3 4.23Å; I1581-W1592 HydrophobicContact CG1-CH2 4.44Å; I1581-W1592 HydrophobicContact CG1-CZ3 4.31Å; I1581-L1594 HydrophobicContact CD1-CD2 4.11Å; I1581-L1594 HydrophobicContact CG2-CD2 3.93Å; I1581-V1597 HydrophobicContact CD1-CG2 3.92Å; I1581-L1620 HydrophobicContact CG2-CD2 4.44Å; I1581-E1630 WeakPolarHBondContact O-CA 3.4Å; I1581-R1631 PolarHBondContact N-O 3.06Å; I1581-R1631 PolarHBondContact O-N 3.09Å; I1581-L1633 HydrophobicContact CG2-CD1 3.99Å; I1581-L1633 HydrophobicContact CG2-CG 4.31Å
1582	W	90.3	Very high	81.3	Confident	51 Å²	51	37.8 Å²	37.8	19%	0.193	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	169.9	-177.7	72.7	102.7	0	0	0	112.1	V1530 Y1531 Q1533 I1544 R1580 L1629 E1630	V1530-W1582 CarbonylContact C-O 3.56Å; V1530-W1582 WeakPolarHBondContact CA-O 3.24Å; Y1531-W1582 VanDerWaalsContact CB-CE2 3.43Å; Y1531-W1582 AromaticContact CD2-NE1 3.95Å; Y1531-W1582 HydrophobicContact CG-CZ2 4.17Å; Y1531-W1582 PolarHBondContact N-O 3.45Å; Y1531-W1582 PolarHBondContact O-N 3.47Å; Q1533-W1582 HydrophobicContact CB-CH2 4.47Å; Q1533-W1582 HydrophobicContact CB-CZ3 4.15Å; I1544-W1582 HydrophobicContact CB-CH2 4.34Å; I1544-W1582 HydrophobicContact CD1-CH2 3.92Å; I1544-W1582 HydrophobicContact CD1-CZ2 4.2Å; I1544-W1582 HydrophobicContact CG1-CH2 3.95Å; I1544-W1582 HydrophobicContact CG2-CH2 3.53Å; I1544-W1582 HydrophobicContact CG2-CZ2 3.77Å; R1580-W1582 HydrophobicContact CB-CZ3 4.47Å; R1580-W1582 HydrophobicContact CG-CE3 3.92Å; R1580-W1582 HydrophobicContact CG-CZ3 4.03Å; W1582-L1629 WeakPolarHBondContact CA-O 3.42Å; W1582-L1629 VanDerWaalsContact CB-O 3.24Å; W1582-L1629 WeakPolarHBondContact CB-O 3.4Å; W1582-E1630 HydrophobicContact CB-CB 3.7Å; W1582-E1630 HydrophobicContact CB-CG 3.91Å
1583	H	88.1	Confident	82	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.019	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	159	169.6	65.2	118	0	0	0	111.5	S1528 S1529 V1530 D1585 T1590 L1620 L1629	S1528-H1583 WeakPolarHBondContact CB-ND1 3.36Å; S1528-H1583 PolarHBondContact OG-ND1 3.44Å; S1528-H1583 VanDerWaalsContact OG-ND1 3.15Å; S1529-H1583 CarbonylContact O-C 3.53Å; S1529-H1583 WeakPolarHBondContact O-CA 3.01Å; V1530-H1583 HydrophobicContact CG2-CB 4.28Å; H1583-D1585 VanDerWaalsContact C-N 3.3Å; H1583-D1585 IonicContact CE1-OD1 3.15Å; H1583-D1585 PolarHBondContact O-N 2.81Å; H1583-T1590 PolarHBondContact CE1-O 2.82Å; H1583-L1620 VanDerWaalsContact NE2-C 3.35Å; H1583-L1620 PolarHBondContact NE2-O 2.91Å; H1583-L1629 PolarHBondContact CD2-O 2.78Å; H1583-L1629 VanDerWaalsContact CD2-O 3.29Å; H1583-L1629 WeakPolarHBondContact CE1-CD2 3.32Å; H1583-L1629 PolarHBondContact N-O 2.84Å; H1583-L1629 VanDerWaalsContact NE2-CD2 3.3Å; H1583-L1629 WeakPolarHBondContact NE2-CD2 3.17Å
1584	N	82.5	Confident	82.8	Confident	53 Å²	53	33.4 Å²	33.4	28%	0.283	19%	0.189	S	C	.	.			trans	-85.4	5.4	-178.4	71.7	-13	0	0	0	115	S1529 Y1531 K1586	S1529-N1584 WeakPolarHBondContact CB-OD1 3.4Å; S1529-N1584 PolarHBondContact N-OD1 2.81Å; S1529-N1584 PolarHBondContact O-N 2.88Å; Y1531-N1584 HydrophobicContact CE2-CB 3.94Å; N1584-K1586 PolarHBondContact O-N 3.36Å; N1584-K1586 PolarHBondContact OD1-N 3.43Å
1585	D	81.4	Confident	83.7	Confident	25 Å²	25	34 Å²	34	13%	0.134	19%	0.193	C	C	.	.	S	Bend	trans	55.8	35.5	176.6	-151.9	31.5	0	0	0	113.9	H1583 T1590 R1622 L1629	H1583-D1585 VanDerWaalsContact C-N 3.3Å; H1583-D1585 IonicContact CE1-OD1 3.15Å; H1583-D1585 PolarHBondContact O-N 2.81Å; D1585-T1590 WeakPolarHBondContact OD1-CB 3.25Å; D1585-R1622 IonicContact OD2-CZ 2.87Å; D1585-R1622 IonicContact OD2-NE 2.69Å; D1585-R1622 PolarHBondContact OD2-NE 3.27Å; D1585-R1622 IonicContact OD2-NH2 2.77Å; D1585-R1622 PolarHBondContact OD2-NH2 3.41Å; D1585-L1629 HydrophobicContact CB-CD1 3.81Å; D1585-L1629 HydrophobicContact CB-CD2 3.93Å; D1585-L1629 HydrophobicContact CB-CG 4.5Å
1586	K	73.8	Confident	84.4	Confident	159 Å²	159	34.3 Å²	34.3	69%	0.691	19%	0.19	S	C	*	.			trans	-127.5	95.7	178.3	-69.9	-177.4	179.8	-171.2	0	109.9	S1528 N1584	S1528-K1586 PolarHBondContact OG-N 2.84Å; N1584-K1586 PolarHBondContact O-N 3.36Å; N1584-K1586 PolarHBondContact OD1-N 3.43Å
1587	G	73.3	Confident	84.9	Confident	43 Å²	43	34.1 Å²	34.1	44%	0.443	19%	0.189	S	C	.	.	S	Bend	trans	-174.2	174.1	179.4	0	0	0	0	0	111	T1527	T1527-G1587 WeakPolarHBondContact OG1-CA 3.24Å
1588	S	77.8	Confident	85.7	Confident	117 Å²	117	35 Å²	35	82%	0.818	19%	0.192	S	C	*	.	S	Bend	trans	-77.2	-32.5	174.4	50.3	0	0	0	0	112.6	T1527	T1527-S1588 PolarHBondContact OG1-N 3.24Å; T1527-S1588 PolarHBondContact OG1-OG 3.25Å
1589	S	80.4	Confident	86	Confident	29 Å²	29	34.7 Å²	34.7	20%	0.203	19%	0.191	C	C	.	.			trans	-118.3	133.7	163.5	-178.1	0	0	0	0	110.1	E1525 T1526 T1527	E1525-S1589 PolarHBondContact O-OG 3.17Å; T1526-S1589 PolarHBondContact OG1-O 2.84Å; T1527-S1589 PolarHBondContact N-O 2.93Å; T1527-S1589 PolarHBondContact OG1-N 2.85Å; T1527-S1589 PolarHBondContact OG1-O 2.66Å
1590	T	83	Confident	85.7	Confident	29 Å²	29	36.1 Å²	36.1	18%	0.178	20%	0.196	C	C	.	.			trans	-121.2	-18.1	-175.4	55.1	0	0	0	0	113.9	T1526 H1583 D1585 W1592	T1526-T1590 PolarHBondContact OG1-O 3.33Å; H1583-T1590 PolarHBondContact CE1-O 2.82Å; D1585-T1590 WeakPolarHBondContact OD1-CB 3.25Å; T1590-W1592 PolarHBondContact O-N 2.87Å; T1590-W1592 VanDerWaalsContact O-N 3.12Å
1591	D	85.1	Confident	85.3	Confident	37 Å²	37	35.5 Å²	35.5	20%	0.198	19%	0.194	C	C	.	.			trans	-88.2	80.7	-166.9	-69.8	-29.9	0	0	0	112.1	E1525 W1619 S1621 N1623	E1525-D1591 PolarHBondContact N-O 3.13Å; E1525-D1591 CarbonylContact O-C 3.59Å; E1525-D1591 VanDerWaalsContact O-C 3.26Å; D1591-W1619 HydrophobicContact CB-CE3 4.44Å; D1591-W1619 HydrophobicContact CB-CZ3 4.26Å; D1591-W1619 WeakPolarHBondContact O-CZ3 3.23Å; D1591-S1621 VanDerWaalsContact OD1-CB 3.31Å; D1591-S1621 WeakPolarHBondContact OD1-CB 3.41Å; D1591-S1621 PolarHBondContact OD1-OG 2.96Å; D1591-N1623 PolarHBondContact OD1-ND2 2.83Å; D1591-N1623 PolarHBondContact OD2-ND2 2.63Å
1592	W	89.4	Confident	84.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	147.2	-177.7	-161.8	23.3	0	0	0	112	T1516 T1518 T1526 V1530 F1557 I1581 T1590 L1594 W1619 L1620	T1516-W1592 HydrophobicContact CG2-CH2 4.35Å; T1518-W1592 PolarHBondContact OG1-NE1 2.9Å; T1526-W1592 HydrophobicContact CG2-CB 3.8Å; T1526-W1592 HydrophobicContact CG2-CD2 3.81Å; T1526-W1592 HydrophobicContact CG2-CE3 4.23Å; T1526-W1592 HydrophobicContact CG2-CG 3.6Å; V1530-W1592 HydrophobicContact CG1-CH2 3.79Å; V1530-W1592 HydrophobicContact CG1-CZ3 3.7Å; V1530-W1592 HydrophobicContact CG2-CE3 4.45Å; V1530-W1592 HydrophobicContact CG2-CH2 4.31Å; V1530-W1592 HydrophobicContact CG2-CZ3 4.09Å; F1557-W1592 HydrophobicContact CB-CZ2 4.44Å; F1557-W1592 HydrophobicContact CD1-CH2 4.08Å; F1557-W1592 AromaticContact CD1-CZ2 3.46Å; F1557-W1592 HydrophobicContact CD1-CZ2 3.46Å; F1557-W1592 VanDerWaalsContact CD1-CZ2 3.46Å; F1557-W1592 HydrophobicContact CE1-CH2 4.22Å; F1557-W1592 HydrophobicContact CE1-CZ2 4.03Å; F1557-W1592 HydrophobicContact CG-CZ2 4.22Å; I1581-W1592 HydrophobicContact CD1-CH2 3.87Å; I1581-W1592 HydrophobicContact CD1-CZ3 4.23Å; I1581-W1592 HydrophobicContact CG1-CH2 4.44Å; I1581-W1592 HydrophobicContact CG1-CZ3 4.31Å; T1590-W1592 PolarHBondContact O-N 2.87Å; T1590-W1592 VanDerWaalsContact O-N 3.12Å; W1592-L1594 HydrophobicContact CH2-CD1 4.09Å; W1592-L1594 HydrophobicContact CH2-CD2 4.16Å; W1592-L1594 HydrophobicContact CZ2-CD1 3.78Å; W1592-L1594 HydrophobicContact CZ3-CD2 4.42Å; W1592-W1619 CarbonylContact O-C 3.57Å; W1592-W1619 VanDerWaalsContact O-CA 3.23Å; W1592-W1619 WeakPolarHBondContact O-CA 3.38Å; W1592-W1619 VanDerWaalsContact O-CE3 3.31Å; W1592-L1620 HydrophobicContact CB-CB 4.29Å; W1592-L1620 HydrophobicContact CD2-CD1 4.43Å; W1592-L1620 HydrophobicContact CE3-CB 4.12Å; W1592-L1620 HydrophobicContact CE3-CD1 3.9Å; W1592-L1620 HydrophobicContact CE3-CD2 4.12Å; W1592-L1620 HydrophobicContact CE3-CG 4.26Å; W1592-L1620 HydrophobicContact CZ3-CD1 4.33Å; W1592-L1620 HydrophobicContact CZ3-CD2 4.2Å; W1592-L1620 PolarHBondContact N-O 3.09Å; W1592-L1620 PolarHBondContact O-N 2.98Å
1593	H	91.4	Very high	82.7	Confident	16 Å²	16	37.5 Å²	37.5	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.6	160.2	-167.6	-69.6	0	0	0	110.9	S1519 A1524 N1617 K1618 W1619	S1519-H1593 WeakPolarHBondContact CB-ND1 3.45Å; S1519-H1593 PolarHBondContact N-O 3.09Å; S1519-H1593 PolarHBondContact OG-ND1 2.8Å; S1519-H1593 PolarHBondContact OG-O 2.75Å; A1524-H1593 HydrophobicContact CB-CB 3.6Å; H1593-N1617 VanDerWaalsContact CE1-C 3.43Å; H1593-K1618 PolarHBondContact CE1-N 2.78Å; H1593-W1619 HydrophobicContact CB-CD2 4Å; H1593-W1619 HydrophobicContact CB-CE3 3.94Å; H1593-W1619 HydrophobicContact CB-CG 4.45Å; H1593-W1619 HydrophobicContact CB-CZ3 4.25Å; H1593-W1619 AromaticContact CD2-CD1 3.48Å; H1593-W1619 VanDerWaalsContact CD2-CD1 3.48Å; H1593-W1619 AromaticContact CD2-CD2 3.77Å; H1593-W1619 AromaticContact CD2-CE2 3.74Å; H1593-W1619 AromaticContact CD2-CG 3.61Å; H1593-W1619 PolarHBondContact CD2-N 2.91Å; H1593-W1619 AromaticContact CD2-NE1 3.57Å
1594	L	89.5	Confident	81	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.7	-171.3	178	64.8	0	0	0	109.9	I1581 W1592 K1596 V1597 C1616 N1617 K1618 L1620 L1633	I1581-L1594 HydrophobicContact CD1-CD2 4.11Å; I1581-L1594 HydrophobicContact CG2-CD2 3.93Å; W1592-L1594 HydrophobicContact CH2-CD1 4.09Å; W1592-L1594 HydrophobicContact CH2-CD2 4.16Å; W1592-L1594 HydrophobicContact CZ2-CD1 3.78Å; W1592-L1594 HydrophobicContact CZ3-CD2 4.42Å; L1594-K1596 WeakPolarHBondContact CD1-O 3.27Å; L1594-V1597 HydrophobicContact CD1-CG2 4.33Å; L1594-V1597 HydrophobicContact CD2-CG2 3.92Å; L1594-C1616 HydrophobicContact CB-CB 4.3Å; L1594-C1616 HydrophobicContact CD2-CB 4.07Å; L1594-C1616 HydrophobicContact CG-CB 3.94Å; L1594-C1616 WeakPolarHBondContact O-CB 3.44Å; L1594-N1617 WeakPolarHBondContact O-CA 3.48Å; L1594-N1617 PolarHBondContact O-N 2.93Å; L1594-K1618 PolarHBondContact N-O 2.82Å; L1594-K1618 VanDerWaalsContact N-O 3.15Å; L1594-K1618 PolarHBondContact O-N 2.91Å; L1594-L1620 HydrophobicContact CB-CD1 3.64Å; L1594-L1620 HydrophobicContact CD2-CD1 4.08Å; L1594-L1633 HydrophobicContact CD2-CD1 4.33Å
1595	N	89.1	Confident	79.5	Confident	59 Å²	59	45.7 Å²	45.7	32%	0.316	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	-59.3	173.1	-75.7	-24.4	0	0	0	110.6	F1517 S1519 C1616 N1617	F1517-N1595 HydrophobicContact CB-CB 4.11Å; F1517-N1595 WeakPolarHBondContact O-CB 3.24Å; F1517-N1595 PolarHBondContact O-N 2.91Å; S1519-N1595 WeakPolarHBondContact CB-OD1 3.44Å; S1519-N1595 PolarHBondContact OG-N 2.94Å; S1519-N1595 PolarHBondContact OG-OD1 3.45Å; N1595-C1616 WeakPolarHBondContact O-CA 3.37Å; N1595-C1616 PolarHBondContact O-N 3.2Å; N1595-N1617 VanDerWaalsContact CA-OD1 3.32Å; N1595-N1617 WeakPolarHBondContact CA-OD1 3.46Å; N1595-N1617 PolarHBondContact O-N 2.95Å; N1595-N1617 PolarHBondContact O-OD1 2.77Å
1596	K	92	Very high	78	Confident	59 Å²	59	50.8 Å²	50.8	26%	0.257	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	165	-175.9	60.7	169.5	175.2	168.7	0	112.4	F1517 L1594 E1598 I1613 F1614	F1517-K1596 HydrophobicContact CB-CG 3.82Å; F1517-K1596 HydrophobicContact CD1-CG 4.36Å; F1517-K1596 HydrophobicContact CD2-CD 4.17Å; F1517-K1596 HydrophobicContact CD2-CG 3.63Å; F1517-K1596 VanDerWaalsContact CE1-CE 3.44Å; F1517-K1596 HydrophobicContact CE2-CD 4.33Å; F1517-K1596 HydrophobicContact CE2-CG 4.26Å; F1517-K1596 HydrophobicContact CG-CD 4.31Å; F1517-K1596 HydrophobicContact CG-CG 3.69Å; F1517-K1596 PolarHBondContact N-O 3.39Å; L1594-K1596 WeakPolarHBondContact CD1-O 3.27Å; K1596-E1598 HydrophobicContact CD-CG 4.44Å; K1596-E1598 WeakPolarHBondContact CE-OE1 3.3Å; K1596-E1598 IonicContact NZ-OE1 2.65Å; K1596-E1598 PolarHBondContact NZ-OE1 2.81Å; K1596-I1613 HydrophobicContact CD-CG2 3.89Å; K1596-F1614 CarbonylContact C-O 3.54Å; K1596-F1614 VanDerWaalsContact CA-O 3.3Å; K1596-F1614 WeakPolarHBondContact CA-O 3.35Å; K1596-F1614 WeakPolarHBondContact CB-O 3.17Å
1597	V	92.3	Very high	77.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.7	165.3	-168	0	0	0	0	109.6	I1514 K1515 T1516 L1579 I1581 L1594 I1599 F1614 L1633	I1514-V1597 HydrophobicContact CG2-CG1 3.79Å; K1515-V1597 CarbonylContact O-C 3.58Å; K1515-V1597 WeakPolarHBondContact O-CA 3.3Å; K1515-V1597 WeakPolarHBondContact O-CG1 3.45Å; T1516-V1597 HydrophobicContact CG2-CG1 4.37Å; T1516-V1597 HydrophobicContact CG2-CG2 4.32Å; L1579-V1597 HydrophobicContact CD2-CB 3.79Å; L1579-V1597 HydrophobicContact CD2-CG1 3.85Å; L1579-V1597 HydrophobicContact CD2-CG2 4.08Å; I1581-V1597 HydrophobicContact CD1-CG2 3.92Å; L1594-V1597 HydrophobicContact CD1-CG2 4.33Å; L1594-V1597 HydrophobicContact CD2-CG2 3.92Å; V1597-I1599 HydrophobicContact CG1-CD1 4.37Å; V1597-I1599 HydrophobicContact CG1-CG1 4.06Å; V1597-F1614 HydrophobicContact CB-CB 4.32Å; V1597-F1614 PolarHBondContact N-O 3.06Å; V1597-F1614 PolarHBondContact O-N 2.91Å; V1597-L1633 HydrophobicContact CG2-CD1 3.8Å
1598	E	92.2	Very high	76.1	Confident	26 Å²	26	48 Å²	48	12%	0.121	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.8	170.1	-63.4	174.9	172.4	0	0	109.6	I1514 K1515 F1517 K1596 T1611 Y1612 I1613	I1514-E1598 CarbonylContact C-O 3.5Å; I1514-E1598 VanDerWaalsContact CA-O 3.32Å; I1514-E1598 WeakPolarHBondContact CA-O 3.38Å; K1515-E1598 HydrophobicContact CB-CB 4.24Å; K1515-E1598 PolarHBondContact N-O 3.45Å; K1515-E1598 PolarHBondContact O-N 2.6Å; F1517-E1598 HydrophobicContact CE2-CB 4.33Å; F1517-E1598 VanDerWaalsContact CE2-CD 3.43Å; F1517-E1598 HydrophobicContact CE2-CG 3.69Å; F1517-E1598 VanDerWaalsContact CZ-CD 3.46Å; F1517-E1598 HydrophobicContact CZ-CG 4.24Å; F1517-E1598 WeakPolarHBondContact CZ-OE1 3.37Å; F1517-E1598 WeakPolarHBondContact CZ-OE2 3.4Å; K1596-E1598 HydrophobicContact CD-CG 4.44Å; K1596-E1598 WeakPolarHBondContact CE-OE1 3.3Å; K1596-E1598 IonicContact NZ-OE1 2.65Å; K1596-E1598 PolarHBondContact NZ-OE1 2.81Å; E1598-T1611 HydrophobicContact CB-CG2 4.02Å; E1598-Y1612 CarbonylContact C-O 3.57Å; E1598-Y1612 WeakPolarHBondContact CA-O 3.23Å; E1598-I1613 HydrophobicContact CG-CG1 4.39Å; E1598-I1613 HydrophobicContact CG-CG2 4.38Å
1599	I	89.3	Confident	75.4	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	120.8	-178.3	-58.7	-171.2	0	0	0	110.8	Y1512 Q1513 I1514 I1532 L1534 F1576 L1579 V1597 T1611 Y1612 F1614	Y1512-I1599 HydrophobicContact CD1-CG2 4.22Å; Q1513-I1599 CarbonylContact O-C 3.46Å; Q1513-I1599 WeakPolarHBondContact O-CA 3.28Å; I1514-I1599 HydrophobicContact CG1-CD1 4.35Å; I1514-I1599 HydrophobicContact CG1-CG1 4.13Å; I1514-I1599 HydrophobicContact CG1-CG2 4.35Å; I1514-I1599 HydrophobicContact CG2-CG1 4.37Å; I1532-I1599 HydrophobicContact CD1-CD1 4.42Å; L1534-I1599 HydrophobicContact CD1-CD1 3.89Å; L1534-I1599 HydrophobicContact CD2-CG2 4.04Å; F1576-I1599 HydrophobicContact CE2-CG2 4.11Å; L1579-I1599 HydrophobicContact CD1-CD1 3.54Å; L1579-I1599 HydrophobicContact CD2-CD1 3.62Å; L1579-I1599 HydrophobicContact CD2-CG1 4.49Å; L1579-I1599 HydrophobicContact CG-CD1 4.17Å; V1597-I1599 HydrophobicContact CG1-CD1 4.37Å; V1597-I1599 HydrophobicContact CG1-CG1 4.06Å; I1599-T1611 CarbonylContact O-C 3.6Å; I1599-T1611 WeakPolarHBondContact O-CA 3.29Å; I1599-Y1612 PolarHBondContact N-O 3.05Å; I1599-Y1612 PolarHBondContact O-N 2.86Å; I1599-F1614 HydrophobicContact CB-CE2 4.04Å; I1599-F1614 HydrophobicContact CD1-CD2 4.31Å; I1599-F1614 HydrophobicContact CD1-CE2 3.91Å; I1599-F1614 HydrophobicContact CG1-CD2 4.21Å; I1599-F1614 HydrophobicContact CG1-CE2 3.98Å
1600	R	82.6	Confident	75.1	Confident	31 Å²	31	42.6 Å²	42.6	12%	0.117	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.9	-173.6	-177	-174.2	-162.3	-152	1.3	111.1	S1369 Y1512 Q1513 F1609 V1610 T1611 D1641	S1369-R1600 PolarHBondContact OG-NH1 2.82Å; Y1512-R1600 CarbonylContact C-O 3.57Å; Y1512-R1600 WeakPolarHBondContact CA-O 3.25Å; Q1513-R1600 HydrophobicContact CB-CB 4.23Å; Q1513-R1600 PolarHBondContact N-O 2.85Å; Q1513-R1600 PolarHBondContact O-N 3.26Å; Q1513-R1600 VanDerWaalsContact OE1-NH1 3.16Å; R1600-F1609 HydrophobicContact CG-CB 4.1Å; R1600-F1609 HydrophobicContact CG-CD1 4.47Å; R1600-F1609 VanDerWaalsContact NE-CB 3.3Å; R1600-F1609 VanDerWaalsContact NH2-CG 3.34Å; R1600-V1610 VanDerWaalsContact CA-O 3.22Å; R1600-V1610 WeakPolarHBondContact CA-O 3.31Å; R1600-T1611 HydrophobicContact CB-CG2 4.19Å; R1600-T1611 WeakPolarHBondContact CB-OG1 3.46Å; R1600-T1611 WeakPolarHBondContact CD-OG1 3.18Å; R1600-T1611 WeakPolarHBondContact CG-OG1 3.43Å; R1600-D1641 IonicContact CZ-OD1 3.74Å; R1600-D1641 IonicContact CZ-OD2 3.37Å; R1600-D1641 IonicContact NE-OD2 2.74Å; R1600-D1641 PolarHBondContact NE-OD2 2.87Å; R1600-D1641 IonicContact NH2-OD1 3.68Å; R1600-D1641 PolarHBondContact NH2-OD1 3.14Å; R1600-D1641 IonicContact NH2-OD2 3.08Å; R1600-D1641 PolarHBondContact NH2-OD2 3.31Å
1601	K	77.4	Confident	75.1	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.035	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	138.6	178.8	-169.5	177	-179.5	179	0	110.6	T1510 Y1512 E1571 E1574 V1610	T1510-K1601 HydrophobicContact CG2-CD 4.32Å; T1510-K1601 HydrophobicContact CG2-CG 3.76Å; Y1512-K1601 HydrophobicContact CD1-CB 4Å; Y1512-K1601 HydrophobicContact CD1-CG 4.13Å; Y1512-K1601 HydrophobicContact CE1-CB 3.82Å; Y1512-K1601 HydrophobicContact CE1-CD 3.97Å; Y1512-K1601 HydrophobicContact CE1-CG 3.63Å; E1571-K1601 VanDerWaalsContact OE1-CE 3.26Å; E1571-K1601 WeakPolarHBondContact OE1-CE 3.4Å; E1571-K1601 IonicContact OE1-NZ 3.06Å; E1571-K1601 PolarHBondContact OE1-NZ 2.86Å; E1574-K1601 HydrophobicContact CG-CD 4.16Å; E1574-K1601 WeakPolarHBondContact OE1-CD 3.21Å; E1574-K1601 WeakPolarHBondContact OE2-CD 3.34Å; E1574-K1601 IonicContact OE2-NZ 3Å; E1574-K1601 PolarHBondContact OE2-NZ 2.96Å; K1601-V1610 PolarHBondContact N-O 3.46Å
1602	I	67.8	Low	75.3	Confident	8 Å²	8	40.5 Å²	40.5	4%	0.041	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	106.2	-172.8	-55.5	-179.5	0	0	0	109.4	I1372 L1373 N1511 Q1513 Y1566	I1372-I1602 HydrophobicContact CG2-CD1 4.46Å; L1373-I1602 HydrophobicContact CD2-CG2 3.34Å; L1373-I1602 HydrophobicContact CG-CG2 3.57Å; N1511-I1602 HydrophobicContact CB-CB 4.09Å; N1511-I1602 HydrophobicContact CB-CD1 4.18Å; N1511-I1602 VanDerWaalsContact O-CB 3.31Å; N1511-I1602 WeakPolarHBondContact O-CB 2.85Å; N1511-I1602 PolarHBondContact O-N 2.93Å; Q1513-I1602 HydrophobicContact CB-CD1 4.12Å; Y1566-I1602 HydrophobicContact CD1-CD1 3.91Å; Y1566-I1602 HydrophobicContact CE1-CD1 4.15Å
1603	K	58	Low	75.3	Confident	85 Å²	85	41.5 Å²	41.5	37%	0.37	20%	0.204	S	C	.	.			trans	-105.4	115.4	-177.4	-72	177.7	179.8	161.8	0	111.4	L1373 E1574 N1605 Q1606	L1373-K1603 VanDerWaalsContact CD2-C 3.47Å; L1373-K1603 WeakPolarHBondContact CD2-O 3.47Å; E1574-K1603 IonicContact OE2-NZ 2.97Å; E1574-K1603 PolarHBondContact OE2-NZ 2.81Å; K1603-N1605 PolarHBondContact O-N 2.86Å; K1603-Q1606 PolarHBondContact O-N 2.84Å
1604	T	53.1	Low	75.2	Confident	81 Å²	81	40.8 Å²	40.8	50%	0.497	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-20.1	-165.6	57.7	0	0	0	0	117
1605	N	50.2	Low	75.1	Confident	147 Å²	147	43.5 Å²	43.5	79%	0.786	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.8	4.3	-169.6	-66.7	25.8	0	0	0	114.1	K1603	K1603-N1605 PolarHBondContact O-N 2.86Å
1606	Q	51.2	Low	75	Confident	133 Å²	133	41.7 Å²	41.7	62%	0.621	21%	0.21	S	C	*	.			trans	-144.7	125.8	-176.1	-67.9	-179.3	-24.6	0	0	111.1	K1603 V1608	K1603-Q1606 PolarHBondContact O-N 2.84Å; Q1606-V1608 PolarHBondContact O-N 2.85Å
1607	Y	55	Low	74.8	Confident	101 Å²	101	44 Å²	44	40%	0.396	23%	0.226	S	C	.	.	S	Bend	trans	-73.4	27.1	175.8	-64.3	-80.6	0	0	0	114.1	Q1642 N1643	Y1607-Q1642 WeakPolarHBondContact O-CA 3.49Å; Y1607-Q1642 WeakPolarHBondContact O-CG 3.39Å; Y1607-N1643 VanDerWaalsContact CB-OD1 3.25Å; Y1607-N1643 WeakPolarHBondContact CB-OD1 3.32Å; Y1607-N1643 PolarHBondContact O-N 3.12Å
1608	V	51.4	Low	74.5	Confident	42 Å²	42	47.2 Å²	47.2	26%	0.255	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117	178.8	-179.5	0	0	0	0	107.7	Q1606 Q1640 Q1642	Q1606-V1608 PolarHBondContact O-N 2.85Å; V1608-Q1640 HydrophobicContact CG1-CG 4.01Å; V1608-Q1642 HydrophobicContact CG2-CB 4.44Å; V1608-Q1642 HydrophobicContact CG2-CG 3.93Å
1609	F	63.9	Low	74.2	Confident	8 Å²	8	47.4 Å²	47.4	4%	0.035	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	147.5	-175.8	-53.9	-102.4	0	0	0	110.3	L1373 R1600 Q1640 D1641	L1373-F1609 HydrophobicContact CD1-CE1 3.59Å; L1373-F1609 HydrophobicContact CD1-CZ 3.52Å; R1600-F1609 HydrophobicContact CG-CB 4.1Å; R1600-F1609 HydrophobicContact CG-CD1 4.47Å; R1600-F1609 VanDerWaalsContact NE-CB 3.3Å; R1600-F1609 VanDerWaalsContact NH2-CG 3.34Å; F1609-Q1640 WeakPolarHBondContact O-CA 3.49Å; F1609-D1641 WeakPolarHBondContact CB-OD2 3.46Å; F1609-D1641 VanDerWaalsContact CD2-OD1 3.3Å; F1609-D1641 WeakPolarHBondContact CD2-OD1 3.49Å; F1609-D1641 PolarHBondContact N-O 2.74Å; F1609-D1641 PolarHBondContact O-N 2.77Å
1610	V	73.8	Confident	74.1	Confident	24 Å²	24	47.4 Å²	47.4	15%	0.145	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125	174.4	-175	0	0	0	0	108.6	R1600 K1601 Y1612 M1638 L1639 Q1640	R1600-V1610 VanDerWaalsContact CA-O 3.22Å; R1600-V1610 WeakPolarHBondContact CA-O 3.31Å; K1601-V1610 PolarHBondContact N-O 3.46Å; V1610-Y1612 HydrophobicContact CB-CE2 4.4Å; V1610-Y1612 HydrophobicContact CG1-CD2 4.28Å; V1610-Y1612 HydrophobicContact CG1-CE2 3.58Å; V1610-M1638 HydrophobicContact CG1-CE 4.47Å; V1610-M1638 HydrophobicContact CG1-CG 3.4Å; V1610-M1638 HydrophobicContact CG1-SD 3.8Å; V1610-L1639 CarbonylContact C-O 3.46Å; V1610-L1639 WeakPolarHBondContact CA-O 3.25Å; V1610-Q1640 HydrophobicContact CG2-CG 4.3Å
1611	T	83.5	Confident	74	Confident	13 Å²	13	46 Å²	46	8%	0.08	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.4	-176.2	-54.6	0	0	0	0	110.3	E1598 I1599 R1600 M1638 L1639	E1598-T1611 HydrophobicContact CB-CG2 4.02Å; I1599-T1611 CarbonylContact O-C 3.6Å; I1599-T1611 WeakPolarHBondContact O-CA 3.29Å; R1600-T1611 HydrophobicContact CB-CG2 4.19Å; R1600-T1611 WeakPolarHBondContact CB-OG1 3.46Å; R1600-T1611 WeakPolarHBondContact CD-OG1 3.18Å; R1600-T1611 WeakPolarHBondContact CG-OG1 3.43Å; T1611-M1638 CarbonylContact O-C 3.53Å; T1611-M1638 WeakPolarHBondContact O-CA 3.2Å; T1611-L1639 PolarHBondContact N-O 2.87Å; T1611-L1639 PolarHBondContact O-N 2.83Å
1612	Y	88.3	Confident	73.8	Confident	9 Å²	9	53.1 Å²	53.1	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.1	179.6	-66.9	-89.3	0	0	0	111	P1575 F1576 E1598 I1599 V1610 P1635 H1637 M1638 L1652	P1575-Y1612 WeakPolarHBondContact CA-OH 3.26Å; P1575-Y1612 HydrophobicContact CB-CE1 3.49Å; P1575-Y1612 VanDerWaalsContact CB-CE1 3.49Å; F1576-Y1612 AromaticContact CD2-CD2 3.55Å; F1576-Y1612 HydrophobicContact CD2-CD2 3.55Å; F1576-Y1612 AromaticContact CD2-CE2 3.99Å; F1576-Y1612 HydrophobicContact CD2-CE2 3.99Å; F1576-Y1612 AromaticContact CD2-CG 3.83Å; F1576-Y1612 HydrophobicContact CD2-CG 3.83Å; F1576-Y1612 AromaticContact CE2-CD2 3.29Å; F1576-Y1612 HydrophobicContact CE2-CD2 3.29Å; F1576-Y1612 AromaticContact CE2-CE2 3.58Å; F1576-Y1612 HydrophobicContact CE2-CE2 3.58Å; F1576-Y1612 HydrophobicContact CE2-CG 4.06Å; F1576-Y1612 HydrophobicContact CZ-CD2 4.26Å; F1576-Y1612 HydrophobicContact CZ-CE2 4.14Å; E1598-Y1612 CarbonylContact C-O 3.57Å; E1598-Y1612 WeakPolarHBondContact CA-O 3.23Å; I1599-Y1612 PolarHBondContact N-O 3.05Å; I1599-Y1612 PolarHBondContact O-N 2.86Å; V1610-Y1612 HydrophobicContact CB-CE2 4.4Å; V1610-Y1612 HydrophobicContact CG1-CD2 4.28Å; V1610-Y1612 HydrophobicContact CG1-CE2 3.58Å; Y1612-P1635 HydrophobicContact CD1-CB 4.43Å; Y1612-H1637 WeakPolarHBondContact CA-O 3.33Å; Y1612-M1638 HydrophobicContact CD1-CB 3.98Å; Y1612-M1638 HydrophobicContact CD1-CG 3.96Å; Y1612-M1638 HydrophobicContact CE1-CB 3.83Å; Y1612-M1638 HydrophobicContact CE1-CG 3.47Å; Y1612-M1638 VanDerWaalsContact CE1-CG 3.47Å; Y1612-M1638 HydrophobicContact CE1-SD 3.81Å; Y1612-M1638 HydrophobicContact CE2-CG 4.47Å; Y1612-L1652 HydrophobicContact CD1-CD1 4.04Å; Y1612-L1652 HydrophobicContact CE1-CD1 4.33Å
1613	I	89	Confident	74.1	Confident	22 Å²	22	58.1 Å²	58.1	11%	0.113	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	114.2	-177.2	-46.1	-175	0	0	0	111.2	K1596 E1598 P1615 P1635 S1636 H1637 L1639	K1596-I1613 HydrophobicContact CD-CG2 3.89Å; E1598-I1613 HydrophobicContact CG-CG1 4.39Å; E1598-I1613 HydrophobicContact CG-CG2 4.38Å; I1613-P1615 VanDerWaalsContact O-CD 3.29Å; I1613-P1615 WeakPolarHBondContact O-CD 3.21Å; I1613-P1635 CarbonylContact O-C 3.51Å; I1613-P1635 WeakPolarHBondContact O-CA 3.22Å; I1613-S1636 PolarHBondContact O-N 2.98Å; I1613-S1636 PolarHBondContact O-OG 3.4Å; I1613-H1637 HydrophobicContact CB-CB 4.2Å; I1613-H1637 HydrophobicContact CD1-CB 3.99Å; I1613-H1637 HydrophobicContact CG1-CB 4.11Å; I1613-H1637 PolarHBondContact N-O 2.68Å; I1613-L1639 HydrophobicContact CD1-CD1 3.97Å; I1613-L1639 HydrophobicContact CD1-CD2 4.22Å; I1613-L1639 HydrophobicContact CD1-CG 4.03Å; I1613-L1639 HydrophobicContact CG1-CG 4.4Å
1614	F	90.6	Very high	74.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	95.7	178.4	-63	-99.7	0	0	0	110.2	L1534 F1576 L1579 K1596 V1597 I1599 L1633 P1635	L1534-F1614 HydrophobicContact CD1-CZ 4.02Å; F1576-F1614 HydrophobicContact CB-CZ 4.05Å; F1576-F1614 HydrophobicContact CD2-CZ 4.26Å; L1579-F1614 HydrophobicContact CB-CD1 3.5Å; L1579-F1614 HydrophobicContact CB-CE1 3.46Å; L1579-F1614 VanDerWaalsContact CB-CE1 3.46Å; L1579-F1614 HydrophobicContact CB-CG 4.12Å; L1579-F1614 HydrophobicContact CB-CZ 4.07Å; L1579-F1614 HydrophobicContact CD2-CB 4.07Å; L1579-F1614 HydrophobicContact CD2-CD1 4.08Å; L1579-F1614 HydrophobicContact CD2-CD2 4.01Å; L1579-F1614 HydrophobicContact CD2-CE1 4.49Å; L1579-F1614 HydrophobicContact CD2-CE2 4.44Å; L1579-F1614 HydrophobicContact CD2-CG 3.82Å; L1579-F1614 HydrophobicContact CG-CD1 4.46Å; K1596-F1614 CarbonylContact C-O 3.54Å; K1596-F1614 VanDerWaalsContact CA-O 3.3Å; K1596-F1614 WeakPolarHBondContact CA-O 3.35Å; K1596-F1614 WeakPolarHBondContact CB-O 3.17Å; V1597-F1614 HydrophobicContact CB-CB 4.32Å; V1597-F1614 PolarHBondContact N-O 3.06Å; V1597-F1614 PolarHBondContact O-N 2.91Å; I1599-F1614 HydrophobicContact CB-CE2 4.04Å; I1599-F1614 HydrophobicContact CD1-CD2 4.31Å; I1599-F1614 HydrophobicContact CD1-CE2 3.91Å; I1599-F1614 HydrophobicContact CG1-CD2 4.21Å; I1599-F1614 HydrophobicContact CG1-CE2 3.98Å; F1614-L1633 HydrophobicContact CB-CB 3.86Å; F1614-L1633 HydrophobicContact CB-CD1 4.18Å; F1614-L1633 HydrophobicContact CD1-CB 4.16Å; F1614-L1633 HydrophobicContact CG-CB 4.49Å; F1614-P1635 HydrophobicContact CD1-CB 3.96Å; F1614-P1635 HydrophobicContact CD1-CG 4.38Å; F1614-P1635 HydrophobicContact CD2-CB 4.43Å; F1614-P1635 HydrophobicContact CE1-CB 3.7Å; F1614-P1635 HydrophobicContact CE1-CG 3.8Å; F1614-P1635 HydrophobicContact CE2-CB 4.18Å; F1614-P1635 HydrophobicContact CG-CB 4.33Å; F1614-P1635 HydrophobicContact CZ-CB 3.83Å; F1614-P1635 HydrophobicContact CZ-CG 4.1Å
1615	P	87	Confident	74.5	Confident	58 Å²	58	57.5 Å²	57.5	38%	0.377	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	149.9	174.7	29	-35.5	0	0	0	111.1	I1613 S1636	I1613-P1615 VanDerWaalsContact O-CD 3.29Å; I1613-P1615 WeakPolarHBondContact O-CD 3.21Å; P1615-S1636 VanDerWaalsContact CD-OG 3.3Å; P1615-S1636 WeakPolarHBondContact CD-OG 3.06Å
1616	C	87.1	Confident	74.9	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.135	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	-60.8	178.4	-179.4	0	0	0	0	111.2	L1594 N1595 K1618 L1633	L1594-C1616 HydrophobicContact CB-CB 4.3Å; L1594-C1616 HydrophobicContact CD2-CB 4.07Å; L1594-C1616 HydrophobicContact CG-CB 3.94Å; L1594-C1616 WeakPolarHBondContact O-CB 3.44Å; N1595-C1616 WeakPolarHBondContact O-CA 3.37Å; N1595-C1616 PolarHBondContact O-N 3.2Å; C1616-K1618 PolarHBondContact O-N 3.23Å; C1616-L1633 HydrophobicContact CB-CD1 3.89Å; C1616-L1633 HydrophobicContact CB-CD2 3.62Å; C1616-L1633 HydrophobicContact CB-CG 4.44Å
1617	N	87.8	Confident	75.6	Confident	108 Å²	108	52.3 Å²	52.3	58%	0.578	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	42.4	46	-176.5	-66.6	-10.4	0	0	0	113.8	H1593 L1594 N1595	H1593-N1617 VanDerWaalsContact CE1-C 3.43Å; L1594-N1617 WeakPolarHBondContact O-CA 3.48Å; L1594-N1617 PolarHBondContact O-N 2.93Å; N1595-N1617 VanDerWaalsContact CA-OD1 3.32Å; N1595-N1617 WeakPolarHBondContact CA-OD1 3.46Å; N1595-N1617 PolarHBondContact O-N 2.95Å; N1595-N1617 PolarHBondContact O-OD1 2.77Å
1618	K	85.3	Confident	76.1	Confident	68 Å²	68	48.8 Å²	48.8	30%	0.296	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.9	177.8	-74.5	-165.4	173.1	-166.5	0	111.1	H1593 L1594 C1616 E1716	H1593-K1618 PolarHBondContact CE1-N 2.78Å; L1594-K1618 PolarHBondContact N-O 2.82Å; L1594-K1618 VanDerWaalsContact N-O 3.15Å; L1594-K1618 PolarHBondContact O-N 2.91Å; C1616-K1618 PolarHBondContact O-N 3.23Å; K1618-E1716 IonicContact NZ-OE2 2.64Å
1619	W	85.3	Confident	77.4	Confident	30 Å²	30	49.1 Å²	49.1	11%	0.114	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	149.8	168.5	-62.8	85	0	0	0	111.5	I1521 A1524 D1591 W1592 H1593 M1624 D1625 R1631	I1521-W1619 HydrophobicContact CG2-CH2 4.01Å; I1521-W1619 HydrophobicContact CG2-CZ2 3.67Å; A1524-W1619 HydrophobicContact CB-CH2 4.34Å; A1524-W1619 HydrophobicContact CB-CZ3 4.3Å; D1591-W1619 HydrophobicContact CB-CE3 4.44Å; D1591-W1619 HydrophobicContact CB-CZ3 4.26Å; D1591-W1619 WeakPolarHBondContact O-CZ3 3.23Å; W1592-W1619 CarbonylContact O-C 3.57Å; W1592-W1619 VanDerWaalsContact O-CA 3.23Å; W1592-W1619 WeakPolarHBondContact O-CA 3.38Å; W1592-W1619 VanDerWaalsContact O-CE3 3.31Å; H1593-W1619 HydrophobicContact CB-CD2 4Å; H1593-W1619 HydrophobicContact CB-CE3 3.94Å; H1593-W1619 HydrophobicContact CB-CG 4.45Å; H1593-W1619 HydrophobicContact CB-CZ3 4.25Å; H1593-W1619 AromaticContact CD2-CD1 3.48Å; H1593-W1619 VanDerWaalsContact CD2-CD1 3.48Å; H1593-W1619 AromaticContact CD2-CD2 3.77Å; H1593-W1619 AromaticContact CD2-CE2 3.74Å; H1593-W1619 AromaticContact CD2-CG 3.61Å; H1593-W1619 PolarHBondContact CD2-N 2.91Å; H1593-W1619 AromaticContact CD2-NE1 3.57Å; W1619-M1624 HydrophobicContact CB-CB 3.96Å; W1619-M1624 HydrophobicContact CD2-CB 3.72Å; W1619-M1624 HydrophobicContact CD2-CE 4.38Å; W1619-M1624 HydrophobicContact CD2-CG 3.95Å; W1619-M1624 HydrophobicContact CE3-CB 4.16Å; W1619-M1624 HydrophobicContact CE3-CG 4.02Å; W1619-M1624 HydrophobicContact CG-CB 3.61Å; W1619-M1624 HydrophobicContact CG-CG 4.38Å; W1619-M1624 HydrophobicContact CH2-CE 3.89Å; W1619-M1624 HydrophobicContact CZ2-CE 3.5Å; W1619-M1624 VanDerWaalsContact CZ2-CE 3.5Å; W1619-M1624 HydrophobicContact CZ3-CE 4.44Å; W1619-M1624 HydrophobicContact CZ3-CG 4.41Å; W1619-D1625 HydrophobicContact CB-CB 4.01Å; W1619-D1625 VanDerWaalsContact CD1-CB 3.47Å; W1619-D1625 HydrophobicContact CG-CB 4.04Å; W1619-R1631 VanDerWaalsContact O-CZ 3.29Å; W1619-R1631 PolarHBondContact O-NE 3.16Å; W1619-R1631 PolarHBondContact O-NH2 2.92Å
1620	L	87.5	Confident	78.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	103.8	157	-62.8	89.9	0	0	0	106	I1581 H1583 W1592 L1594 A1628 R1631	I1581-L1620 HydrophobicContact CG2-CD2 4.44Å; H1583-L1620 VanDerWaalsContact NE2-C 3.35Å; H1583-L1620 PolarHBondContact NE2-O 2.91Å; W1592-L1620 HydrophobicContact CB-CB 4.29Å; W1592-L1620 HydrophobicContact CD2-CD1 4.43Å; W1592-L1620 HydrophobicContact CE3-CB 4.12Å; W1592-L1620 HydrophobicContact CE3-CD1 3.9Å; W1592-L1620 HydrophobicContact CE3-CD2 4.12Å; W1592-L1620 HydrophobicContact CE3-CG 4.26Å; W1592-L1620 HydrophobicContact CZ3-CD1 4.33Å; W1592-L1620 HydrophobicContact CZ3-CD2 4.2Å; W1592-L1620 PolarHBondContact N-O 3.09Å; W1592-L1620 PolarHBondContact O-N 2.98Å; L1594-L1620 HydrophobicContact CB-CD1 3.64Å; L1594-L1620 HydrophobicContact CD2-CD1 4.08Å; L1620-A1628 WeakPolarHBondContact CA-O 3.35Å; L1620-R1631 HydrophobicContact CD1-CG 4.18Å; L1620-R1631 HydrophobicContact CD2-CB 4.41Å; L1620-R1631 HydrophobicContact CD2-CG 4.01Å; L1620-R1631 HydrophobicContact CG-CG 3.78Å
1621	S	81.4	Confident	78.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.			trans	-164.4	151.9	-164.5	167.7	0	0	0	0	110.5	D1591 N1623 M1624 A1627 A1628	D1591-S1621 VanDerWaalsContact OD1-CB 3.31Å; D1591-S1621 WeakPolarHBondContact OD1-CB 3.41Å; D1591-S1621 PolarHBondContact OD1-OG 2.96Å; S1621-N1623 PolarHBondContact OG-N 3.46Å; S1621-M1624 PolarHBondContact OG-N 3.48Å; S1621-A1627 CarbonylContact O-C 3.53Å; S1621-A1627 WeakPolarHBondContact O-CA 3.39Å; S1621-A1628 PolarHBondContact N-O 3.19Å; S1621-A1628 VanDerWaalsContact N-O 3.1Å; S1621-A1628 CarbonylContact O-C 3.53Å; S1621-A1628 PolarHBondContact O-N 2.73Å; S1621-A1628 VanDerWaalsContact O-N 3.08Å
1622	R	73.3	Confident	78.6	Confident	158 Å²	158	50.3 Å²	50.3	60%	0.596	26%	0.259	S	S	*	.	S	Bend	trans	-82.6	-26.3	168.4	-165	-174.2	-67.7	-150	2.8	112.4	D1585 A1627 L1629	D1585-R1622 IonicContact OD2-CZ 2.87Å; D1585-R1622 IonicContact OD2-NE 2.69Å; D1585-R1622 PolarHBondContact OD2-NE 3.27Å; D1585-R1622 IonicContact OD2-NH2 2.77Å; D1585-R1622 PolarHBondContact OD2-NH2 3.41Å; R1622-A1627 VanDerWaalsContact O-CB 3.25Å; R1622-A1627 WeakPolarHBondContact O-CB 3.31Å; R1622-L1629 HydrophobicContact CB-CD2 4.23Å
1623	N	74.5	Confident	78.5	Confident	114 Å²	114	50.3 Å²	50.3	61%	0.61	26%	0.26	S	S	*	.	S	Bend	trans	-97.4	-31.9	-170.3	-55.2	-37.5	0	0	0	112.5	D1591 S1621	D1591-N1623 PolarHBondContact OD1-ND2 2.83Å; D1591-N1623 PolarHBondContact OD2-ND2 2.63Å; S1621-N1623 PolarHBondContact OG-N 3.46Å
1624	M	65.2	Low	78.1	Confident	77 Å²	77	51 Å²	51	38%	0.379	26%	0.263	S	S	.	.	S	Bend	trans	-105.7	151.3	-172.6	-55.2	-67.2	-100.4	0	0	112.1	W1619 S1621 A1627	W1619-M1624 HydrophobicContact CB-CB 3.96Å; W1619-M1624 HydrophobicContact CD2-CB 3.72Å; W1619-M1624 HydrophobicContact CD2-CE 4.38Å; W1619-M1624 HydrophobicContact CD2-CG 3.95Å; W1619-M1624 HydrophobicContact CE3-CB 4.16Å; W1619-M1624 HydrophobicContact CE3-CG 4.02Å; W1619-M1624 HydrophobicContact CG-CB 3.61Å; W1619-M1624 HydrophobicContact CG-CG 4.38Å; W1619-M1624 HydrophobicContact CH2-CE 3.89Å; W1619-M1624 HydrophobicContact CZ2-CE 3.5Å; W1619-M1624 VanDerWaalsContact CZ2-CE 3.5Å; W1619-M1624 HydrophobicContact CZ3-CE 4.44Å; W1619-M1624 HydrophobicContact CZ3-CG 4.41Å; S1621-M1624 PolarHBondContact OG-N 3.48Å; M1624-A1627 PolarHBondContact O-N 2.8Å
1625	D	52.7	Low	77.9	Confident	75 Å²	75	51.4 Å²	51.4	40%	0.401	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	41.3	84.1	158.7	-166.5	30.5	0	0	0	116.8	W1619 A1627 R1631	W1619-D1625 HydrophobicContact CB-CB 4.01Å; W1619-D1625 VanDerWaalsContact CD1-CB 3.47Å; W1619-D1625 HydrophobicContact CG-CB 4.04Å; D1625-A1627 PolarHBondContact O-N 2.83Å; D1625-R1631 PolarHBondContact O-NH2 3.3Å; D1625-R1631 IonicContact OD2-NH2 2.7Å
1626	Q	58.5	Low	77.5	Confident	112 Å²	112	50.1 Å²	50.1	52%	0.523	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	65.4	0.4	-174	-55.4	174.2	-36.3	0	0	115.7	A1628 R1631 E1716	Q1626-A1628 PolarHBondContact O-N 2.76Å; Q1626-R1631 VanDerWaalsContact OE1-NH1 3.09Å; Q1626-E1716 PolarHBondContact NE2-OE2 2.59Å
1627	A	65.6	Low	77.2	Confident	60 Å²	60	51.5 Å²	51.5	50%	0.496	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	56.4	44.4	177.3	0	0	0	0	0	113.6	S1621 R1622 M1624 D1625	S1621-A1627 CarbonylContact O-C 3.53Å; S1621-A1627 WeakPolarHBondContact O-CA 3.39Å; R1622-A1627 VanDerWaalsContact O-CB 3.25Å; R1622-A1627 WeakPolarHBondContact O-CB 3.31Å; M1624-A1627 PolarHBondContact O-N 2.8Å; D1625-A1627 PolarHBondContact O-N 2.83Å
1628	A	65.7	Low	77	Confident	27 Å²	27	47.4 Å²	47.4	22%	0.223	24%	0.24	C	C	.	.			trans	-113	122.5	-177.6	0	0	0	0	0	112	L1620 S1621 Q1626 E1630	L1620-A1628 WeakPolarHBondContact CA-O 3.35Å; S1621-A1628 PolarHBondContact N-O 3.19Å; S1621-A1628 VanDerWaalsContact N-O 3.1Å; S1621-A1628 CarbonylContact O-C 3.53Å; S1621-A1628 PolarHBondContact O-N 2.73Å; S1621-A1628 VanDerWaalsContact O-N 3.08Å; Q1626-A1628 PolarHBondContact O-N 2.76Å; A1628-E1630 VanDerWaalsContact C-N 3.34Å
1629	L	80.5	Confident	76.9	Confident	49 Å²	49	45.6 Å²	45.6	26%	0.257	23%	0.234	S	C	.	.	S	Bend	trans	-86.2	-6.1	177.2	-57.2	165.5	0	0	0	113.1	W1582 H1583 D1585 R1622	W1582-L1629 WeakPolarHBondContact CA-O 3.42Å; W1582-L1629 VanDerWaalsContact CB-O 3.24Å; W1582-L1629 WeakPolarHBondContact CB-O 3.4Å; H1583-L1629 PolarHBondContact CD2-O 2.78Å; H1583-L1629 VanDerWaalsContact CD2-O 3.29Å; H1583-L1629 WeakPolarHBondContact CE1-CD2 3.32Å; H1583-L1629 PolarHBondContact N-O 2.84Å; H1583-L1629 VanDerWaalsContact NE2-CD2 3.3Å; H1583-L1629 WeakPolarHBondContact NE2-CD2 3.17Å; D1585-L1629 HydrophobicContact CB-CD1 3.81Å; D1585-L1629 HydrophobicContact CB-CD2 3.93Å; D1585-L1629 HydrophobicContact CB-CG 4.5Å; R1622-L1629 HydrophobicContact CB-CD2 4.23Å
1630	E	82.5	Confident	76.3	Confident	33 Å²	33	47 Å²	47	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.5	-176.2	-179.2	-161.8	118.4	0	0	109.2	R1580 I1581 W1582 A1628 R1693	R1580-E1630 HydrophobicContact CG-CG 3.84Å; R1580-E1630 IonicContact NE-OE1 2.67Å; I1581-E1630 WeakPolarHBondContact O-CA 3.4Å; W1582-E1630 HydrophobicContact CB-CB 3.7Å; W1582-E1630 HydrophobicContact CB-CG 3.91Å; A1628-E1630 VanDerWaalsContact C-N 3.34Å; E1630-R1693 IonicContact OE1-CZ 2.72Å; E1630-R1693 IonicContact OE1-NH1 2.96Å; E1630-R1693 PolarHBondContact OE1-NH1 3.18Å; E1630-R1693 IonicContact OE1-NH2 3.5Å; E1630-R1693 PolarHBondContact OE1-NH2 3.06Å; E1630-R1693 IonicContact OE2-NH1 3.4Å; E1630-R1693 PolarHBondContact OE2-NH1 3.33Å
1631	R	83.1	Confident	75.3	Confident	22 Å²	22	47.7 Å²	47.7	8%	0.083	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.1	170.5	-59.8	-67.3	-178.1	-175.5	1.4	110.5	I1581 W1619 L1620 D1625 Q1626 L1633	I1581-R1631 PolarHBondContact N-O 3.06Å; I1581-R1631 PolarHBondContact O-N 3.09Å; W1619-R1631 VanDerWaalsContact O-CZ 3.29Å; W1619-R1631 PolarHBondContact O-NE 3.16Å; W1619-R1631 PolarHBondContact O-NH2 2.92Å; L1620-R1631 HydrophobicContact CD1-CG 4.18Å; L1620-R1631 HydrophobicContact CD2-CB 4.41Å; L1620-R1631 HydrophobicContact CD2-CG 4.01Å; L1620-R1631 HydrophobicContact CG-CG 3.78Å; D1625-R1631 PolarHBondContact O-NH2 3.3Å; D1625-R1631 IonicContact OD2-NH2 2.7Å; Q1626-R1631 VanDerWaalsContact OE1-NH1 3.09Å; R1631-L1633 HydrophobicContact CB-CD2 3.94Å
1632	E	80.2	Confident	74.3	Confident	15 Å²	15	51.1 Å²	51.1	7%	0.07	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.6	166.7	-60.2	-148.2	129.2	0	0	109.6	K1578 L1579 R1580 M1658 V1718	K1578-E1632 VanDerWaalsContact CE-OE1 3.29Å; K1578-E1632 WeakPolarHBondContact CE-OE1 3.09Å; K1578-E1632 IonicContact NZ-OE1 3.69Å; K1578-E1632 PolarHBondContact NZ-OE1 2.91Å; K1578-E1632 IonicContact NZ-OE2 2.76Å; K1578-E1632 PolarHBondContact NZ-OE2 2.97Å; L1579-E1632 CarbonylContact O-C 3.58Å; L1579-E1632 WeakPolarHBondContact O-CA 3.12Å; R1580-E1632 IonicContact CZ-OE1 2.89Å; R1580-E1632 VanDerWaalsContact CZ-OE1 3.25Å; R1580-E1632 IonicContact NE-OE1 3.58Å; R1580-E1632 PolarHBondContact NE-OE1 2.9Å; R1580-E1632 IonicContact NH2-OE1 2.76Å; R1580-E1632 PolarHBondContact NH2-OE1 3.02Å; E1632-M1658 WeakPolarHBondContact O-CE 3.12Å; E1632-V1718 HydrophobicContact CB-CG2 4.21Å
1633	L	84.9	Confident	73.5	Confident	9 Å²	9	49 Å²	49	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	146.6	-175.5	-44.8	-177.6	0	0	0	109.9	K1578 L1579 I1581 L1594 V1597 F1614 C1616 R1631	K1578-L1633 CarbonylContact C-O 3.54Å; K1578-L1633 WeakPolarHBondContact CA-O 3.5Å; L1579-L1633 HydrophobicContact CB-CB 4.38Å; L1579-L1633 HydrophobicContact CD2-CD1 4.37Å; L1579-L1633 PolarHBondContact N-O 3.22Å; L1579-L1633 PolarHBondContact O-N 2.75Å; I1581-L1633 HydrophobicContact CG2-CD1 3.99Å; I1581-L1633 HydrophobicContact CG2-CG 4.31Å; L1594-L1633 HydrophobicContact CD2-CD1 4.33Å; V1597-L1633 HydrophobicContact CG2-CD1 3.8Å; F1614-L1633 HydrophobicContact CB-CB 3.86Å; F1614-L1633 HydrophobicContact CB-CD1 4.18Å; F1614-L1633 HydrophobicContact CD1-CB 4.16Å; F1614-L1633 HydrophobicContact CG-CB 4.49Å; C1616-L1633 HydrophobicContact CB-CD1 3.89Å; C1616-L1633 HydrophobicContact CB-CD2 3.62Å; C1616-L1633 HydrophobicContact CB-CG 4.44Å; R1631-L1633 HydrophobicContact CB-CD2 3.94Å
1634	I	81.5	Confident	72.5	Confident	35 Å²	35	46.6 Å²	46.6	18%	0.179	26%	0.264	C	S	.	.			trans	-116	136.5	-177.9	-57.6	168.9	0	0	0	107.6	S1636 W1656 M1658 V1718	I1634-S1636 PolarHBondContact O-N 2.74Å; I1634-W1656 HydrophobicContact CD1-CB 4.22Å; I1634-M1658 HydrophobicContact CD1-CE 4.4Å; I1634-V1718 HydrophobicContact CD1-CG1 4.03Å; I1634-V1718 HydrophobicContact CD1-CG2 4.11Å; I1634-V1718 HydrophobicContact CG1-CG2 4.3Å
1635	P	85.5	Confident	72.3	Confident	10 Å²	10	47.7 Å²	47.7	7%	0.065	27%	0.274	C	S	.	.			trans	-75	124.6	-176.8	28.7	-29.2	0	0	0	110.5	F1576 S1577 Y1612 I1613 F1614 L1652	F1576-P1635 VanDerWaalsContact O-CG 3.31Å; F1576-P1635 WeakPolarHBondContact O-CG 3.47Å; S1577-P1635 WeakPolarHBondContact O-CD 3.36Å; Y1612-P1635 HydrophobicContact CD1-CB 4.43Å; I1613-P1635 CarbonylContact O-C 3.51Å; I1613-P1635 WeakPolarHBondContact O-CA 3.22Å; F1614-P1635 HydrophobicContact CD1-CB 3.96Å; F1614-P1635 HydrophobicContact CD1-CG 4.38Å; F1614-P1635 HydrophobicContact CD2-CB 4.43Å; F1614-P1635 HydrophobicContact CE1-CB 3.7Å; F1614-P1635 HydrophobicContact CE1-CG 3.8Å; F1614-P1635 HydrophobicContact CE2-CB 4.18Å; F1614-P1635 HydrophobicContact CG-CB 4.33Å; F1614-P1635 HydrophobicContact CZ-CB 3.83Å; F1614-P1635 HydrophobicContact CZ-CG 4.1Å; P1635-L1652 HydrophobicContact CB-CD1 3.9Å; P1635-L1652 HydrophobicContact CG-CD1 4.15Å
1636	S	79.8	Confident	72.9	Confident	30 Å²	30	48.5 Å²	48.5	21%	0.21	28%	0.278	C	S	.	.			trans	-93.6	-31.6	-176.2	62.9	0	0	0	0	113.6	I1613 P1615 I1634 L1652	I1613-S1636 PolarHBondContact O-N 2.98Å; I1613-S1636 PolarHBondContact O-OG 3.4Å; P1615-S1636 VanDerWaalsContact CD-OG 3.3Å; P1615-S1636 WeakPolarHBondContact CD-OG 3.06Å; I1634-S1636 PolarHBondContact O-N 2.74Å; S1636-L1652 PolarHBondContact O-N 3.18Å
1637	H	80.4	Confident	73.1	Confident	50 Å²	50	48.5 Å²	48.5	23%	0.231	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.4	-177.1	-60.3	78.3	0	0	0	109.5	Y1612 I1613 E1649 R1650	Y1612-H1637 WeakPolarHBondContact CA-O 3.33Å; I1613-H1637 HydrophobicContact CB-CB 4.2Å; I1613-H1637 HydrophobicContact CD1-CB 3.99Å; I1613-H1637 HydrophobicContact CG1-CB 4.11Å; I1613-H1637 PolarHBondContact N-O 2.68Å; H1637-E1649 IonicContact CD2-OE1 2.81Å; H1637-E1649 PolarHBondContact CD2-OE1 2.64Å; H1637-E1649 VanDerWaalsContact CD2-OE1 3.22Å; H1637-E1649 IonicContact CG-OE1 2.75Å; H1637-R1650 CarbonylContact C-O 2.99Å; H1637-R1650 WeakPolarHBondContact CA-O 3.29Å
1638	M	83.7	Confident	73.3	Confident	22 Å²	22	50.5 Å²	50.5	11%	0.108	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	109.4	170.9	-178.6	-164.2	88.9	0	0	107.7	V1610 T1611 Y1612 F1648 R1650 L1652	V1610-M1638 HydrophobicContact CG1-CE 4.47Å; V1610-M1638 HydrophobicContact CG1-CG 3.4Å; V1610-M1638 HydrophobicContact CG1-SD 3.8Å; T1611-M1638 CarbonylContact O-C 3.53Å; T1611-M1638 WeakPolarHBondContact O-CA 3.2Å; Y1612-M1638 HydrophobicContact CD1-CB 3.98Å; Y1612-M1638 HydrophobicContact CD1-CG 3.96Å; Y1612-M1638 HydrophobicContact CE1-CB 3.83Å; Y1612-M1638 HydrophobicContact CE1-CG 3.47Å; Y1612-M1638 VanDerWaalsContact CE1-CG 3.47Å; Y1612-M1638 HydrophobicContact CE1-SD 3.81Å; Y1612-M1638 HydrophobicContact CE2-CG 4.47Å; M1638-F1648 HydrophobicContact CE-CD1 4.42Å; M1638-F1648 HydrophobicContact CE-CE1 4.34Å; M1638-R1650 HydrophobicContact CB-CB 4.41Å; M1638-R1650 HydrophobicContact CE-CB 4.26Å; M1638-R1650 PolarHBondContact N-O 2.96Å; M1638-R1650 PolarHBondContact O-N 2.75Å; M1638-L1652 HydrophobicContact CB-CD1 4.19Å; M1638-L1652 HydrophobicContact CB-CD2 4.15Å; M1638-L1652 HydrophobicContact CB-CG 4.23Å
1639	L	82.4	Confident	73.9	Confident	30 Å²	30	54.1 Å²	54.1	16%	0.157	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.8	172.9	-45.7	-175.7	0	0	0	109	V1610 T1611 I1613 L1646 F1648 E1649	V1610-L1639 CarbonylContact C-O 3.46Å; V1610-L1639 WeakPolarHBondContact CA-O 3.25Å; T1611-L1639 PolarHBondContact N-O 2.87Å; T1611-L1639 PolarHBondContact O-N 2.83Å; I1613-L1639 HydrophobicContact CD1-CD1 3.97Å; I1613-L1639 HydrophobicContact CD1-CD2 4.22Å; I1613-L1639 HydrophobicContact CD1-CG 4.03Å; I1613-L1639 HydrophobicContact CG1-CG 4.4Å; L1639-L1646 HydrophobicContact CB-CD1 4.05Å; L1639-L1646 HydrophobicContact CD1-CD1 3.87Å; L1639-L1646 HydrophobicContact CD2-CD1 4.2Å; L1639-L1646 HydrophobicContact CG-CD1 4.26Å; L1639-F1648 CarbonylContact C-O 3.57Å; L1639-E1649 HydrophobicContact CD2-CB 3.82Å; L1639-E1649 VanDerWaalsContact CD2-CD 3.43Å; L1639-E1649 HydrophobicContact CD2-CG 3.55Å; L1639-E1649 WeakPolarHBondContact CD2-OE1 3.45Å
1640	Q	73.2	Confident	73.6	Confident	58 Å²	58	58.5 Å²	58.5	27%	0.271	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120	170.1	-176.9	174.4	-26.7	0	0	109	V1608 F1609 V1610 Q1647 F1648	V1608-Q1640 HydrophobicContact CG1-CG 4.01Å; F1609-Q1640 WeakPolarHBondContact O-CA 3.49Å; V1610-Q1640 HydrophobicContact CG2-CG 4.3Å; Q1640-Q1647 PolarHBondContact O-N 3.38Å; Q1640-F1648 HydrophobicContact CB-CB 4.37Å; Q1640-F1648 PolarHBondContact N-O 3.34Å; Q1640-F1648 PolarHBondContact O-N 2.95Å
1641	D	67	Low	73.2	Confident	16 Å²	16	64.1 Å²	64.1	9%	0.086	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	146.1	179.4	79.8	82.9	0	0	0	111.3	R1600 F1609 V1645	R1600-D1641 IonicContact CZ-OD1 3.74Å; R1600-D1641 IonicContact CZ-OD2 3.37Å; R1600-D1641 IonicContact NE-OD2 2.74Å; R1600-D1641 PolarHBondContact NE-OD2 2.87Å; R1600-D1641 IonicContact NH2-OD1 3.68Å; R1600-D1641 PolarHBondContact NH2-OD1 3.14Å; R1600-D1641 IonicContact NH2-OD2 3.08Å; R1600-D1641 PolarHBondContact NH2-OD2 3.31Å; F1609-D1641 WeakPolarHBondContact CB-OD2 3.46Å; F1609-D1641 VanDerWaalsContact CD2-OD1 3.3Å; F1609-D1641 WeakPolarHBondContact CD2-OD1 3.49Å; F1609-D1641 PolarHBondContact N-O 2.74Å; F1609-D1641 PolarHBondContact O-N 2.77Å; D1641-V1645 WeakPolarHBondContact CA-O 3.49Å
1642	Q	60	Low	72.5	Confident	71 Å²	71	64.8 Å²	64.8	33%	0.332	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.4	172.4	-169.5	176.1	20.2	0	0	108.5	Y1607 V1608 G1644 V1645 Q1647	Y1607-Q1642 WeakPolarHBondContact O-CA 3.49Å; Y1607-Q1642 WeakPolarHBondContact O-CG 3.39Å; V1608-Q1642 HydrophobicContact CG2-CB 4.44Å; V1608-Q1642 HydrophobicContact CG2-CG 3.93Å; Q1642-G1644 PolarHBondContact O-N 3.1Å; Q1642-G1644 VanDerWaalsContact O-N 3.13Å; Q1642-V1645 PolarHBondContact N-O 3.18Å; Q1642-V1645 PolarHBondContact O-N 3.21Å; Q1642-Q1647 HydrophobicContact CB-CG 4.24Å
1643	N	57	Low	71.3	Confident	113 Å²	113	69 Å²	69	60%	0.604	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	28.9	-174.3	-59.5	-17.8	0	0	0	114.2	Y1607 V1645	Y1607-N1643 VanDerWaalsContact CB-OD1 3.25Å; Y1607-N1643 WeakPolarHBondContact CB-OD1 3.32Å; Y1607-N1643 PolarHBondContact O-N 3.12Å; N1643-V1645 VanDerWaalsContact C-N 3.29Å; N1643-V1645 PolarHBondContact O-N 3.18Å
1644	G	54.1	Low	69.7	Low	64 Å²	64	73 Å²	73	66%	0.66	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-1.1	-176.9	0	0	0	0	0	115.3	Q1642	Q1642-G1644 PolarHBondContact O-N 3.1Å; Q1642-G1644 VanDerWaalsContact O-N 3.13Å
1645	V	59.1	Low	68.1	Low	100 Å²	100	77.1 Å²	77.1	61%	0.606	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.1	168.5	-177.5	0	0	0	0	108.6	D1641 Q1642 N1643 Q1647	D1641-V1645 WeakPolarHBondContact CA-O 3.49Å; Q1642-V1645 PolarHBondContact N-O 3.18Å; Q1642-V1645 PolarHBondContact O-N 3.21Å; N1643-V1645 VanDerWaalsContact C-N 3.29Å; N1643-V1645 PolarHBondContact O-N 3.18Å; V1645-Q1647 PolarHBondContact O-N 2.79Å
1646	L	65.7	Low	66.6	Low	92 Å²	92	78.6 Å²	78.6	48%	0.482	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	115.9	175.5	-171.3	140.4	0	0	0	109.5	L1639 E1649	L1639-L1646 HydrophobicContact CB-CD1 4.05Å; L1639-L1646 HydrophobicContact CD1-CD1 3.87Å; L1639-L1646 HydrophobicContact CD2-CD1 4.2Å; L1639-L1646 HydrophobicContact CG-CD1 4.26Å; L1646-E1649 HydrophobicContact CD2-CB 4.38Å
1647	Q	64.2	Low	65.6	Low	113 Å²	113	81.8 Å²	81.8	53%	0.528	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-31.6	-177.9	-72.3	-166.5	-14	0	0	112.9	Q1640 Q1642 V1645	Q1640-Q1647 PolarHBondContact O-N 3.38Å; Q1642-Q1647 HydrophobicContact CB-CG 4.24Å; V1645-Q1647 PolarHBondContact O-N 2.79Å
1648	F	68.5	Low	64.7	Low	101 Å²	101	84.1 Å²	84.1	44%	0.443	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	132.7	-175.3	179.4	-129.5	0	0	0	110.6	M1638 L1639 Q1640 R1650	M1638-F1648 HydrophobicContact CE-CD1 4.42Å; M1638-F1648 HydrophobicContact CE-CE1 4.34Å; L1639-F1648 CarbonylContact C-O 3.57Å; Q1640-F1648 HydrophobicContact CB-CB 4.37Å; Q1640-F1648 PolarHBondContact N-O 3.34Å; Q1640-F1648 PolarHBondContact O-N 2.95Å; F1648-R1650 HydrophobicContact CD1-CB 4.4Å; F1648-R1650 HydrophobicContact CE1-CB 3.7Å; F1648-R1650 HydrophobicContact CE1-CG 4.31Å; F1648-R1650 HydrophobicContact CZ-CB 3.79Å; F1648-R1650 HydrophobicContact CZ-CG 4.18Å
1649	E	78.4	Confident	64.1	Low	103 Å²	103	83.8 Å²	83.8	48%	0.481	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.1	166.1	170.7	158.1	-149.9	0	0	108.8	H1637 L1639 L1646	H1637-E1649 IonicContact CD2-OE1 2.81Å; H1637-E1649 PolarHBondContact CD2-OE1 2.64Å; H1637-E1649 VanDerWaalsContact CD2-OE1 3.22Å; H1637-E1649 IonicContact CG-OE1 2.75Å; L1639-E1649 HydrophobicContact CD2-CB 3.82Å; L1639-E1649 VanDerWaalsContact CD2-CD 3.43Å; L1639-E1649 HydrophobicContact CD2-CG 3.55Å; L1639-E1649 WeakPolarHBondContact CD2-OE1 3.45Å; L1646-E1649 HydrophobicContact CD2-CB 4.38Å
1650	R	74.8	Confident	63.9	Low	141 Å²	141	84.2 Å²	84.2	53%	0.532	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	108.6	176.4	-174.5	178.2	-173.4	161	7.2	109.8	H1637 M1638 F1648 L1652	H1637-R1650 CarbonylContact C-O 2.99Å; H1637-R1650 WeakPolarHBondContact CA-O 3.29Å; M1638-R1650 HydrophobicContact CB-CB 4.41Å; M1638-R1650 HydrophobicContact CE-CB 4.26Å; M1638-R1650 PolarHBondContact N-O 2.96Å; M1638-R1650 PolarHBondContact O-N 2.75Å; F1648-R1650 HydrophobicContact CD1-CB 4.4Å; F1648-R1650 HydrophobicContact CE1-CB 3.7Å; F1648-R1650 HydrophobicContact CE1-CG 4.31Å; F1648-R1650 HydrophobicContact CZ-CB 3.79Å; F1648-R1650 HydrophobicContact CZ-CG 4.18Å; R1650-L1652 HydrophobicContact CG-CD2 4.46Å; R1650-L1652 PolarHBondContact O-N 2.94Å
1651	Q	74.6	Confident	64.4	Low	152 Å²	152	81.5 Å²	81.5	71%	0.71	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	127.7	162.1	-164.7	177.2	39.8	0	0	108.9
1652	L	66.7	Low	65.5	Low	36 Å²	36	82 Å²	82	19%	0.188	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-91.9	123.6	178.3	-63.6	174.3	0	0	0	108.1	Y1612 P1635 S1636 M1638 R1650	Y1612-L1652 HydrophobicContact CD1-CD1 4.04Å; Y1612-L1652 HydrophobicContact CE1-CD1 4.33Å; P1635-L1652 HydrophobicContact CB-CD1 3.9Å; P1635-L1652 HydrophobicContact CG-CD1 4.15Å; S1636-L1652 PolarHBondContact O-N 3.18Å; M1638-L1652 HydrophobicContact CB-CD1 4.19Å; M1638-L1652 HydrophobicContact CB-CD2 4.15Å; M1638-L1652 HydrophobicContact CB-CG 4.23Å; R1650-L1652 HydrophobicContact CG-CD2 4.46Å; R1650-L1652 PolarHBondContact O-N 2.94Å
1653	S	55.6	Low	66.9	Low	104 Å²	104	78.7 Å²	78.7	73%	0.727	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-66.4	141.8	176	51.6	0	0	0	0	110.4	K1655	S1653-K1655 PolarHBondContact O-N 3.27Å
1654	P	51.3	Low	68.6	Low	92 Å²	92	77.6 Å²	77.6	60%	0.597	40%	0.401	S	S	*	.			trans	-71.5	80.2	-179	29.6	-35.2	0	0	0	110.4	W1656 L1657	P1654-W1656 PolarHBondContact O-N 2.91Å; P1654-L1657 HydrophobicContact CB-CD1 4.43Å; P1654-L1657 WeakPolarHBondContact O-CD1 3.3Å
1655	K	49.2	Very low	70.5	Confident	121 Å²	121	74.5 Å²	74.5	53%	0.526	37%	0.37	S	S	.	.	S	Bend	trans	-63	-22.9	171.2	-161.1	-169.4	176	-152.6	0	111.3	S1653	S1653-K1655 PolarHBondContact O-N 3.27Å
1656	W	52.9	Low	72.1	Confident	42 Å²	42	71 Å²	71	16%	0.159	35%	0.348	C	S	.	.	S	Bend	trans	-118.1	121.2	174.6	-38	112.1	0	0	0	107.6	I1634 P1654 N1687 V1718	I1634-W1656 HydrophobicContact CD1-CB 4.22Å; P1654-W1656 PolarHBondContact O-N 2.91Å; W1656-N1687 HydrophobicContact CE3-CB 4.25Å; W1656-N1687 HydrophobicContact CZ3-CB 3.8Å; W1656-N1687 VanDerWaalsContact CZ3-CG 3.49Å; W1656-V1718 HydrophobicContact CB-CG1 3.83Å
1657	L	58.1	Low	73.4	Confident	96 Å²	96	66.6 Å²	66.6	50%	0.503	33%	0.326	S	S	.	.			trans	-97.6	158.9	170.1	-87.6	77.3	0	0	0	109.5	P1654 D1719	P1654-L1657 HydrophobicContact CB-CD1 4.43Å; P1654-L1657 WeakPolarHBondContact O-CD1 3.3Å; L1657-D1719 WeakPolarHBondContact O-CB 3.3Å; L1657-D1719 PolarHBondContact O-N 2.93Å
1658	M	62.7	Low	74.4	Confident	100 Å²	100	61.5 Å²	61.5	49%	0.493	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132.2	157.8	-71.8	-67.6	-177.6	0	0	108.6	E1632 I1634 I1717 V1718	E1632-M1658 WeakPolarHBondContact O-CE 3.12Å; I1634-M1658 HydrophobicContact CD1-CE 4.4Å; M1658-I1717 VanDerWaalsContact SD-C 3.54Å; M1658-V1718 HydrophobicContact CE-CG2 3.86Å; M1658-V1718 HydrophobicContact SD-CG2 3.91Å; M1658-V1718 PolarHBondContact SD-N 2.94Å
1659	N	69.8	Low	75.3	Confident	14 Å²	14	62.2 Å²	62.2	8%	0.075	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.3	179.4	-85.7	-13.3	0	0	0	109.5	Y1661 I1717 D1719 N1748 S1750	N1659-Y1661 HydrophobicContact CB-CD2 4.13Å; N1659-Y1661 HydrophobicContact CB-CE2 3.58Å; N1659-I1717 PolarHBondContact N-O 3.12Å; N1659-I1717 PolarHBondContact O-N 2.88Å; N1659-D1719 WeakPolarHBondContact ND2-CB 3.31Å; N1659-D1719 PolarHBondContact ND2-OD1 2.92Å; N1659-N1748 PolarHBondContact ND2-ND2 2.75Å; N1659-S1750 VanDerWaalsContact CA-OG 3.25Å; N1659-S1750 WeakPolarHBondContact CA-OG 3.49Å; N1659-S1750 VanDerWaalsContact CB-OG 3.23Å; N1659-S1750 WeakPolarHBondContact CB-OG 3.46Å; N1659-S1750 PolarHBondContact OD1-OG 2.93Å
1660	T	79	Confident	75.5	Confident	39 Å²	39	61.8 Å²	61.8	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.4	172.6	-47.4	0	0	0	0	108.6	Q1714 L1715 I1749 S1750	T1660-Q1714 HydrophobicContact CG2-CB 4.27Å; T1660-Q1714 HydrophobicContact CG2-CG 4.43Å; T1660-L1715 WeakPolarHBondContact CA-O 3.28Å; T1660-I1749 HydrophobicContact CG2-CD1 3.94Å; T1660-I1749 HydrophobicContact CG2-CG1 4.06Å; T1660-I1749 VanDerWaalsContact O-CG1 3.23Å; T1660-I1749 WeakPolarHBondContact O-CG1 3.3Å; T1660-I1749 PolarHBondContact O-N 2.88Å; T1660-S1750 PolarHBondContact N-OG 2.9Å; T1660-S1750 PolarHBondContact O-N 3.03Å; T1660-S1750 PolarHBondContact O-OG 3.31Å
1661	Y	83.4	Confident	75.7	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	175.3	-71.1	-98.3	0	0	0	109.9	N1659 Q1714 L1715 I1717 L1720 I1723 V1746 F1747 N1748	N1659-Y1661 HydrophobicContact CB-CD2 4.13Å; N1659-Y1661 HydrophobicContact CB-CE2 3.58Å; Y1661-Q1714 CarbonylContact O-C 3.18Å; Y1661-Q1714 WeakPolarHBondContact O-CA 3.43Å; Y1661-L1715 PolarHBondContact N-O 3.08Å; Y1661-L1715 PolarHBondContact O-N 3Å; Y1661-I1717 HydrophobicContact CD2-CD1 3.73Å; Y1661-I1717 HydrophobicContact CD2-CG1 3.45Å; Y1661-I1717 VanDerWaalsContact CD2-CG1 3.45Å; Y1661-I1717 HydrophobicContact CE2-CD1 4Å; Y1661-I1717 HydrophobicContact CE2-CG1 3.75Å; Y1661-I1717 HydrophobicContact CG-CD1 4.35Å; Y1661-I1717 HydrophobicContact CG-CG1 4.43Å; Y1661-L1720 PolarHBondContact OH-N 2.86Å; Y1661-I1723 HydrophobicContact CE1-CD1 3.77Å; Y1661-I1723 HydrophobicContact CE1-CG1 4.13Å; Y1661-V1746 HydrophobicContact CD1-CG1 3.83Å; Y1661-F1747 CarbonylContact C-O 3.57Å; Y1661-F1747 VanDerWaalsContact CA-O 3.26Å; Y1661-F1747 WeakPolarHBondContact CA-O 3.4Å; Y1661-N1748 HydrophobicContact CD1-CB 4.05Å; Y1661-N1748 HydrophobicContact CE1-CB 3.82Å; Y1661-N1748 PolarHBondContact OH-ND2 2.91Å
1662	E	89.9	Confident	76.1	Confident	28 Å²	28	59.2 Å²	59.2	13%	0.131	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.7	166.5	-173.2	-178.7	113.1	0	0	108.8	R1664 V1712 F1713 V1746 F1747 I1749	E1662-R1664 IonicContact OE1-CZ 2.74Å; E1662-R1664 IonicContact OE1-NE 3.38Å; E1662-R1664 PolarHBondContact OE1-NE 2.87Å; E1662-R1664 IonicContact OE1-NH2 3.39Å; E1662-R1664 PolarHBondContact OE1-NH2 3.47Å; E1662-V1712 HydrophobicContact CG-CG1 3.52Å; E1662-F1713 CarbonylContact C-O 3.56Å; E1662-F1713 WeakPolarHBondContact CA-O 3.31Å; E1662-V1746 CarbonylContact O-C 3.56Å; E1662-V1746 WeakPolarHBondContact O-CA 2.97Å; E1662-F1747 HydrophobicContact CB-CB 4.34Å; E1662-F1747 PolarHBondContact N-O 3.28Å; E1662-F1747 PolarHBondContact O-N 2.96Å; E1662-I1749 HydrophobicContact CB-CD1 4.43Å; E1662-I1749 HydrophobicContact CB-CG2 3.99Å
1663	V	90.4	Very high	77	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	117.2	180	-179	0	0	0	0	108.5	I1665 I1681 L1683 V1712 F1713 L1715 I1744 E1745 V1746	V1663-I1665 HydrophobicContact CG1-CD1 4.31Å; V1663-I1665 HydrophobicContact CG1-CG1 4.04Å; V1663-I1681 HydrophobicContact CG1-CD1 3.75Å; V1663-L1683 HydrophobicContact CG2-CD1 4.3Å; V1663-V1712 CarbonylContact O-C 3.55Å; V1663-V1712 WeakPolarHBondContact O-CA 3.3Å; V1663-F1713 PolarHBondContact N-O 3.4Å; V1663-F1713 PolarHBondContact O-N 3.41Å; V1663-L1715 HydrophobicContact CG2-CD1 3.73Å; V1663-L1715 HydrophobicContact CG2-CG 4.18Å; V1663-I1744 HydrophobicContact CG1-CG2 3.85Å; V1663-E1745 CarbonylContact C-O 3.56Å; V1663-E1745 WeakPolarHBondContact CA-O 3.4Å; V1663-V1746 HydrophobicContact CG1-CG2 4.34Å; V1663-V1746 HydrophobicContact CG2-CG1 4.47Å; V1663-V1746 HydrophobicContact CG2-CG2 4.24Å
1664	R	92.6	Very high	78.6	Confident	90 Å²	90	53.3 Å²	53.3	34%	0.34	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.3	173.6	-45.8	-169.7	175.8	-174.8	-5.7	109.2	E1662 T1710 D1711 V1712 I1744 E1745 F1747	E1662-R1664 IonicContact OE1-CZ 2.74Å; E1662-R1664 IonicContact OE1-NE 3.38Å; E1662-R1664 PolarHBondContact OE1-NE 2.87Å; E1662-R1664 IonicContact OE1-NH2 3.39Å; E1662-R1664 PolarHBondContact OE1-NH2 3.47Å; R1664-T1710 HydrophobicContact CB-CG2 4.05Å; R1664-D1711 CarbonylContact C-O 3.47Å; R1664-D1711 VanDerWaalsContact CA-O 3.31Å; R1664-D1711 WeakPolarHBondContact CA-O 3.3Å; R1664-V1712 HydrophobicContact CB-CG2 4.33Å; R1664-V1712 HydrophobicContact CG-CG1 4.21Å; R1664-V1712 HydrophobicContact CG-CG2 3.92Å; R1664-I1744 CarbonylContact O-C 3.48Å; R1664-I1744 VanDerWaalsContact O-CA 3.29Å; R1664-I1744 WeakPolarHBondContact O-CA 3.49Å; R1664-E1745 HydrophobicContact CB-CB 4.08Å; R1664-E1745 HydrophobicContact CB-CG 4.38Å; R1664-E1745 HydrophobicContact CG-CB 4.45Å; R1664-E1745 PolarHBondContact N-O 2.72Å; R1664-E1745 PolarHBondContact O-N 2.79Å; R1664-F1747 HydrophobicContact CG-CD2 4.45Å; R1664-F1747 HydrophobicContact CG-CE2 3.91Å
1665	I	93.2	Very high	80.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.1	-178	-60.9	-166.4	0	0	0	108.4	V1663 L1695 F1705 T1710 D1711 F1713 I1728 W1739 L1741 I1744	V1663-I1665 HydrophobicContact CG1-CD1 4.31Å; V1663-I1665 HydrophobicContact CG1-CG1 4.04Å; I1665-L1695 HydrophobicContact CD1-CD1 3.25Å; I1665-F1705 HydrophobicContact CB-CE1 4.32Å; I1665-F1705 HydrophobicContact CD1-CE1 4.3Å; I1665-F1705 HydrophobicContact CG2-CD1 4.19Å; I1665-F1705 HydrophobicContact CG2-CE1 4.09Å; I1665-T1710 CarbonylContact O-C 3.35Å; I1665-T1710 VanDerWaalsContact O-CA 3.32Å; I1665-T1710 WeakPolarHBondContact O-CA 3.14Å; I1665-D1711 PolarHBondContact N-O 2.8Å; I1665-D1711 PolarHBondContact O-N 2.94Å; I1665-F1713 HydrophobicContact CD1-CE2 4.48Å; I1665-I1728 HydrophobicContact CD1-CD1 3.81Å; I1665-W1739 HydrophobicContact CG2-CH2 3.76Å; I1665-W1739 HydrophobicContact CG2-CZ2 3.61Å; I1665-L1741 HydrophobicContact CG2-CD1 3.59Å; I1665-I1744 HydrophobicContact CG1-CG1 4.3Å; I1665-I1744 HydrophobicContact CG1-CG2 4.28Å
1666	T	93.1	Very high	82.2	Confident	26 Å²	26	47.2 Å²	47.2	16%	0.16	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	112.4	179.7	-52.4	0	0	0	0	110	Q1709 T1710 S1742 T1743	T1666-Q1709 WeakPolarHBondContact CA-O 3.06Å; T1666-T1710 PolarHBondContact OG1-OG1 3.22Å; T1666-S1742 WeakPolarHBondContact O-CA 3.32Å; T1666-S1742 VanDerWaalsContact O-CB 3.24Å; T1666-S1742 WeakPolarHBondContact O-CB 3.35Å; T1666-S1742 PolarHBondContact O-N 2.91Å; T1666-T1743 WeakPolarHBondContact CB-OG1 3.23Å; T1666-T1743 PolarHBondContact N-O 3.38Å; T1666-T1743 PolarHBondContact O-N 2.83Å; T1666-T1743 PolarHBondContact OG1-OG1 3.48Å
1667	T	92.3	Very high	83.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	136.6	163.8	-61.1	0	0	0	0	108.5	A1673 F1705 E1706 G1708 Q1709 W1739	T1667-A1673 HydrophobicContact CG2-CB 3.97Å; T1667-A1673 WeakPolarHBondContact CG2-O 3.47Å; T1667-F1705 VanDerWaalsContact OG1-C 3.26Å; T1667-F1705 WeakPolarHBondContact OG1-CA 3.1Å; T1667-F1705 PolarHBondContact OG1-O 2.73Å; T1667-E1706 WeakPolarHBondContact CB-O 3.19Å; T1667-E1706 WeakPolarHBondContact CG2-O 3.41Å; T1667-E1706 PolarHBondContact OG1-O 3.03Å; T1667-G1708 CarbonylContact O-C 3.55Å; T1667-G1708 WeakPolarHBondContact O-CA 3.42Å; T1667-G1708 PolarHBondContact O-N 2.9Å; T1667-Q1709 PolarHBondContact N-O 2.7Å; T1667-W1739 PolarHBondContact OG1-NE1 3.23Å
1668	G	85.6	Confident	85.3	Confident	5 Å²	5	42.2 Å²	42.2	5%	0.052	22%	0.218	C	C	.	.			trans	-76.2	166.6	179.9	0	0	0	0	0	113.8	K1670 A1673 G1708 Y1740	G1668-K1670 VanDerWaalsContact C-N 3.28Å; G1668-K1670 PolarHBondContact O-N 3.31Å; G1668-A1673 WeakPolarHBondContact O-CB 3.35Å; G1668-G1708 PolarHBondContact O-N 2.82Å; G1668-G1708 VanDerWaalsContact O-N 3.15Å; G1668-Y1740 PolarHBondContact N-O 3.06Å
1669	D	87.4	Confident	86.6	Confident	117 Å²	117	37.5 Å²	37.5	63%	0.626	20%	0.195	S	C	*	.	S	Bend	trans	-89.4	35.2	-177.6	-171	30.3	0	0	0	113.8	R1707	D1669-R1707 PolarHBondContact O-NH2 2.82Å; D1669-R1707 IonicContact OD1-CZ 2.75Å; D1669-R1707 IonicContact OD1-NE 3.35Å; D1669-R1707 PolarHBondContact OD1-NE 2.77Å; D1669-R1707 IonicContact OD1-NH2 2.86Å; D1669-R1707 PolarHBondContact OD1-NH2 3.47Å; D1669-R1707 IonicContact OD2-NH2 3.84Å
1670	K	83.1	Confident	87.5	Confident	93 Å²	93	38.9 Å²	38.9	40%	0.404	20%	0.199	S	C	.	.	S	Bend	trans	-82.7	153	173	-74.2	-178.2	177.1	171.3	0	110.6	G1668 Y1672 A1673 R1707 Y1740 W1778	G1668-K1670 VanDerWaalsContact C-N 3.28Å; G1668-K1670 PolarHBondContact O-N 3.31Å; K1670-Y1672 PolarHBondContact O-N 3.07Å; K1670-A1673 HydrophobicContact CB-CB 4.15Å; K1670-A1673 WeakPolarHBondContact O-CB 3.18Å; K1670-A1673 PolarHBondContact O-N 2.95Å; K1670-A1673 VanDerWaalsContact O-N 3.16Å; K1670-R1707 VanDerWaalsContact O-CD 3.22Å; K1670-R1707 WeakPolarHBondContact O-CD 3Å; K1670-R1707 PolarHBondContact O-NE 3.13Å; K1670-Y1740 HydrophobicContact CB-CD1 4.49Å; K1670-Y1740 HydrophobicContact CD-CD1 3.96Å; K1670-Y1740 HydrophobicContact CD-CD2 3.87Å; K1670-Y1740 HydrophobicContact CD-CE1 3.86Å; K1670-Y1740 HydrophobicContact CD-CE2 3.75Å; K1670-Y1740 HydrophobicContact CD-CG 3.96Å; K1670-Y1740 HydrophobicContact CG-CD1 4.28Å; K1670-Y1740 HydrophobicContact CG-CE1 4.35Å; K1670-Y1740 PolarHBondContact NZ-OH 3.02Å; K1670-W1778 HydrophobicContact CB-CZ2 4.38Å; K1670-W1778 HydrophobicContact CD-CZ2 4.38Å
1671	A	78.2	Confident	88.1	Confident	57 Å²	57	37 Å²	37	47%	0.471	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	135.4	169.7	0	0	0	0	0	109.7	A1673	A1671-A1673 PolarHBondContact O-N 2.95Å
1672	Y	83.8	Confident	88.3	Confident	182 Å²	182	37.3 Å²	37.3	71%	0.714	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	28.1	-175.6	-44.6	-75.8	0	0	0	115	K1670 W1778	K1670-Y1672 PolarHBondContact O-N 3.07Å; Y1672-W1778 WeakPolarHBondContact O-CZ3 3.03Å
1673	A	86.5	Confident	88.1	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.			trans	-75.3	-22.2	179.3	0	0	0	0	0	115.5	T1667 G1668 K1670 A1671 R1707 W1739 Y1740	T1667-A1673 HydrophobicContact CG2-CB 3.97Å; T1667-A1673 WeakPolarHBondContact CG2-O 3.47Å; G1668-A1673 WeakPolarHBondContact O-CB 3.35Å; K1670-A1673 HydrophobicContact CB-CB 4.15Å; K1670-A1673 WeakPolarHBondContact O-CB 3.18Å; K1670-A1673 PolarHBondContact O-N 2.95Å; K1670-A1673 VanDerWaalsContact O-N 3.16Å; A1671-A1673 PolarHBondContact O-N 2.95Å; A1673-R1707 HydrophobicContact CB-CB 4.49Å; A1673-R1707 HydrophobicContact CB-CG 4.29Å; A1673-W1739 WeakPolarHBondContact O-CA 3.4Å; A1673-Y1740 PolarHBondContact O-N 3.48Å
1674	G	88	Confident	87.7	Confident	16 Å²	16	37.9 Å²	37.9	17%	0.165	19%	0.192	C	C	.	.			trans	-83.5	148.8	-176.8	0	0	0	0	0	113.1	F1705 S1738	G1674-F1705 VanDerWaalsContact CA-O 3.26Å; G1674-F1705 WeakPolarHBondContact CA-O 3.5Å; G1674-S1738 VanDerWaalsContact O-O 3.08Å
1675	T	90.6	Very high	87	Confident	6 Å²	6	34.1 Å²	34.1	4%	0.037	18%	0.18	C	C	.	.			trans	-129.3	137.1	-173.5	-168	0	0	0	0	114.1	A1677 V1679 F1705 N1736 P1737 S1738 W1739	T1675-A1677 VanDerWaalsContact C-N 3.3Å; T1675-A1677 VanDerWaalsContact OG1-CB 3.3Å; T1675-A1677 WeakPolarHBondContact OG1-CB 3.37Å; T1675-A1677 PolarHBondContact OG1-N 3.11Å; T1675-A1677 VanDerWaalsContact OG1-N 3.13Å; T1675-V1679 HydrophobicContact CG2-CG2 4.32Å; T1675-F1705 HydrophobicContact CG2-CB 3.86Å; T1675-F1705 HydrophobicContact CG2-CD2 4.49Å; T1675-F1705 HydrophobicContact CG2-CG 4.45Å; T1675-F1705 PolarHBondContact N-O 3.46Å; T1675-N1736 WeakPolarHBondContact CA-O 3.11Å; T1675-N1736 PolarHBondContact OG1-O 3.18Å; T1675-P1737 PolarHBondContact OG1-O 3.48Å; T1675-S1738 WeakPolarHBondContact CB-O 3.29Å; T1675-W1739 HydrophobicContact CG2-CB 3.77Å; T1675-W1739 HydrophobicContact CG2-CD2 3.86Å; T1675-W1739 HydrophobicContact CG2-CG 3.42Å; T1675-W1739 VanDerWaalsContact CG2-CG 3.42Å
1676	D	86.6	Confident	85.6	Confident	80 Å²	80	37.9 Å²	37.9	43%	0.428	20%	0.198	S	C	.	.			trans	-79.7	-12.6	167.9	-68.8	-49.6	0	0	0	112.7	V1735 N1736	D1676-V1735 WeakPolarHBondContact OD2-CA 3.22Å; D1676-V1735 WeakPolarHBondContact OD2-CB 3.07Å; D1676-V1735 PolarHBondContact OD2-N 2.77Å; D1676-N1736 PolarHBondContact N-O 3.28Å; D1676-N1736 PolarHBondContact OD2-N 3.27Å
1677	A	87.9	Confident	84.1	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.033	20%	0.199	C	C	.	.	S	Bend	trans	-71.4	155.3	-167.1	0	0	0	0	0	113.2	T1675 V1679 H1730 S1733	T1675-A1677 VanDerWaalsContact C-N 3.3Å; T1675-A1677 VanDerWaalsContact OG1-CB 3.3Å; T1675-A1677 WeakPolarHBondContact OG1-CB 3.37Å; T1675-A1677 PolarHBondContact OG1-N 3.11Å; T1675-A1677 VanDerWaalsContact OG1-N 3.13Å; A1677-V1679 PolarHBondContact O-N 3.2Å; A1677-V1679 VanDerWaalsContact O-N 3.17Å; A1677-H1730 HydrophobicContact CB-CB 3.88Å; A1677-H1730 WeakPolarHBondContact CB-ND1 3.36Å; A1677-S1733 VanDerWaalsContact CA-O 3.22Å; A1677-S1733 WeakPolarHBondContact CA-O 3.49Å; A1677-S1733 VanDerWaalsContact CB-O 3.31Å; A1677-S1733 WeakPolarHBondContact CB-O 3.48Å; A1677-S1733 PolarHBondContact N-O 3.34Å
1678	S	87.2	Confident	82.9	Confident	29 Å²	29	39.2 Å²	39.2	20%	0.203	21%	0.208	C	C	.	.			trans	-75	111.4	176.1	-64.4	0	0	0	0	111.2	Y1680 K1694 H1730 D1731 S1733	S1678-Y1680 WeakPolarHBondContact O-CD2 3.37Å; S1678-Y1680 WeakPolarHBondContact O-CE2 3.36Å; S1678-K1694 VanDerWaalsContact CB-CE 3.46Å; S1678-K1694 WeakPolarHBondContact OG-CE 3.28Å; S1678-K1694 PolarHBondContact OG-NZ 3.01Å; S1678-H1730 VanDerWaalsContact O-CA 3.24Å; S1678-H1730 WeakPolarHBondContact O-CA 3.13Å; S1678-D1731 WeakPolarHBondContact CB-OD1 3.31Å; S1678-D1731 VanDerWaalsContact CB-OD2 3.23Å; S1678-D1731 WeakPolarHBondContact CB-OD2 3.47Å; S1678-D1731 PolarHBondContact N-OD1 3.17Å; S1678-D1731 PolarHBondContact O-N 3.45Å; S1678-D1731 PolarHBondContact OG-OD2 2.8Å; S1678-S1733 PolarHBondContact N-OG 2.91Å
1679	V	89.9	Confident	82.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.213	C	C	.	.			trans	-84.7	140.5	177.6	-176.6	0	0	0	0	112.1	T1675 A1677 L1695 F1705 I1728 R1729 H1730 W1739	T1675-V1679 HydrophobicContact CG2-CG2 4.32Å; A1677-V1679 PolarHBondContact O-N 3.2Å; A1677-V1679 VanDerWaalsContact O-N 3.17Å; V1679-L1695 HydrophobicContact CG1-CD1 4.04Å; V1679-L1695 PolarHBondContact O-N 3.03Å; V1679-F1705 HydrophobicContact CB-CD2 4.36Å; V1679-F1705 HydrophobicContact CB-CE1 4.48Å; V1679-F1705 HydrophobicContact CB-CE2 3.67Å; V1679-F1705 HydrophobicContact CB-CZ 3.73Å; V1679-F1705 HydrophobicContact CG1-CZ 4.2Å; V1679-F1705 HydrophobicContact CG2-CD2 3.64Å; V1679-F1705 HydrophobicContact CG2-CE1 4.37Å; V1679-F1705 HydrophobicContact CG2-CE2 3.46Å; V1679-F1705 VanDerWaalsContact CG2-CE2 3.46Å; V1679-F1705 HydrophobicContact CG2-CG 4.18Å; V1679-F1705 HydrophobicContact CG2-CZ 3.86Å; V1679-I1728 HydrophobicContact CG1-CD1 3.8Å; V1679-I1728 HydrophobicContact CG1-CG1 3.82Å; V1679-R1729 WeakPolarHBondContact CA-O 3.44Å; V1679-H1730 HydrophobicContact CG2-CB 4.49Å; V1679-W1739 HydrophobicContact CG1-CH2 3.73Å; V1679-W1739 HydrophobicContact CG1-CZ3 3.71Å; V1679-W1739 HydrophobicContact CG2-CE3 4.24Å; V1679-W1739 HydrophobicContact CG2-CH2 4.03Å; V1679-W1739 HydrophobicContact CG2-CZ2 4.45Å; V1679-W1739 HydrophobicContact CG2-CZ3 3.92Å
1680	Y	89.9	Confident	82	Confident	43 Å²	43	34.6 Å²	34.6	17%	0.169	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.9	-179.9	-62.7	-105.2	0	0	0	110.6	S1678 E1692 R1693 K1694 I1728 R1729 D1731	S1678-Y1680 WeakPolarHBondContact O-CD2 3.37Å; S1678-Y1680 WeakPolarHBondContact O-CE2 3.36Å; Y1680-E1692 HydrophobicContact CD1-CG 4.24Å; Y1680-R1693 CarbonylContact C-O 3.58Å; Y1680-R1693 WeakPolarHBondContact CA-O 3.42Å; Y1680-K1694 HydrophobicContact CD1-CB 3.86Å; Y1680-K1694 HydrophobicContact CD1-CG 4.23Å; Y1680-K1694 HydrophobicContact CE1-CB 3.76Å; Y1680-K1694 HydrophobicContact CE1-CD 3.93Å; Y1680-K1694 HydrophobicContact CE1-CG 3.89Å; Y1680-K1694 HydrophobicContact CE2-CG 4.47Å; Y1680-K1694 PolarHBondContact OH-NZ 3.35Å; Y1680-I1728 WeakPolarHBondContact O-CA 3.32Å; Y1680-I1728 WeakPolarHBondContact O-CG1 3.36Å; Y1680-R1729 PolarHBondContact N-O 2.82Å; Y1680-R1729 PolarHBondContact O-N 2.79Å; Y1680-D1731 HydrophobicContact CE2-CB 4.35Å
1681	I	90.5	Very high	81.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	-178.3	-163	174.5	0	0	0	112.4	V1663 L1683 R1693 L1695 L1715 V1726 R1727 I1744	V1663-I1681 HydrophobicContact CG1-CD1 3.75Å; I1681-L1683 HydrophobicContact CD1-CD2 4.02Å; I1681-L1683 HydrophobicContact CG1-CD2 4.43Å; I1681-R1693 HydrophobicContact CG2-CB 4.13Å; I1681-R1693 PolarHBondContact N-O 2.79Å; I1681-R1693 PolarHBondContact O-N 3.5Å; I1681-L1695 HydrophobicContact CB-CD1 4.34Å; I1681-L1695 HydrophobicContact CG2-CD1 4.27Å; I1681-L1695 HydrophobicContact CG2-CD2 3.82Å; I1681-L1695 HydrophobicContact CG2-CG 4.16Å; I1681-L1715 HydrophobicContact CG2-CD1 4.04Å; I1681-V1726 HydrophobicContact CD1-CG2 3.74Å; I1681-V1726 HydrophobicContact CG1-CG2 3.49Å; I1681-V1726 VanDerWaalsContact CG1-CG2 3.49Å; I1681-R1727 CarbonylContact C-O 3.53Å; I1681-R1727 WeakPolarHBondContact CA-O 3.11Å; I1681-I1744 HydrophobicContact CD1-CG2 4.42Å
1682	T	87	Confident	81.2	Confident	6 Å²	6	30.5 Å²	30.5	4%	0.037	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	120	163	-60.6	0	0	0	0	109.6	F1684 D1689 S1690 G1691 E1692 V1726 R1727	T1682-F1684 HydrophobicContact CG2-CD2 4.12Å; T1682-F1684 HydrophobicContact CG2-CE1 4.22Å; T1682-F1684 HydrophobicContact CG2-CE2 3.54Å; T1682-F1684 HydrophobicContact CG2-CZ 3.59Å; T1682-F1684 WeakPolarHBondContact O-CD2 3.5Å; T1682-F1684 WeakPolarHBondContact O-CE2 3.4Å; T1682-D1689 HydrophobicContact CG2-CB 4.09Å; T1682-S1690 WeakPolarHBondContact CA-OG 3.25Å; T1682-G1691 WeakPolarHBondContact CA-O 2.95Å; T1682-G1691 WeakPolarHBondContact CB-O 3.45Å; T1682-G1691 VanDerWaalsContact CG2-O 3.31Å; T1682-G1691 WeakPolarHBondContact CG2-O 3.09Å; T1682-G1691 PolarHBondContact OG1-O 3.08Å; T1682-E1692 WeakPolarHBondContact OG1-CA 2.98Å; T1682-V1726 CarbonylContact O-C 3.54Å; T1682-V1726 WeakPolarHBondContact O-CA 3.42Å; T1682-R1727 PolarHBondContact N-O 3.22Å; T1682-R1727 PolarHBondContact O-N 3.31Å
1683	L	86.9	Confident	81	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	145.4	170.6	-58	178.2	0	0	0	109.8	V1663 I1681 D1689 S1690 L1715 I1717 L1720 I1723 V1726 V1746	V1663-L1683 HydrophobicContact CG2-CD1 4.3Å; I1681-L1683 HydrophobicContact CD1-CD2 4.02Å; I1681-L1683 HydrophobicContact CG1-CD2 4.43Å; L1683-D1689 CarbonylContact O-C 3.51Å; L1683-D1689 VanDerWaalsContact O-CA 3.28Å; L1683-D1689 WeakPolarHBondContact O-CA 3.3Å; L1683-S1690 PolarHBondContact N-OG 3.01Å; L1683-S1690 PolarHBondContact O-N 2.9Å; L1683-S1690 PolarHBondContact O-OG 3.27Å; L1683-L1715 HydrophobicContact CD1-CD1 4.36Å; L1683-I1717 HydrophobicContact CD1-CD1 4.02Å; L1683-L1720 HydrophobicContact CB-CD1 3.74Å; L1683-I1723 HydrophobicContact CB-CG2 4.33Å; L1683-I1723 HydrophobicContact CD2-CG2 4.48Å; L1683-V1726 HydrophobicContact CD2-CB 4.37Å; L1683-V1726 HydrophobicContact CD2-CG2 3.96Å; L1683-V1746 HydrophobicContact CD1-CG1 4.07Å; L1683-V1746 HydrophobicContact CD2-CG2 3.87Å
1684	F	81	Confident	81	Confident	41 Å²	41	28.3 Å²	28.3	18%	0.18	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.4	175.2	-59	-103.4	0	0	0	109.3	T1682 D1689 I1723 N1724 K1725 R1727 F1791	T1682-F1684 HydrophobicContact CG2-CD2 4.12Å; T1682-F1684 HydrophobicContact CG2-CE1 4.22Å; T1682-F1684 HydrophobicContact CG2-CE2 3.54Å; T1682-F1684 HydrophobicContact CG2-CZ 3.59Å; T1682-F1684 WeakPolarHBondContact O-CD2 3.5Å; T1682-F1684 WeakPolarHBondContact O-CE2 3.4Å; F1684-D1689 HydrophobicContact CD1-CB 3.53Å; F1684-D1689 HydrophobicContact CE1-CB 3.7Å; F1684-D1689 HydrophobicContact CG-CB 4.21Å; F1684-I1723 CarbonylContact O-C 3.44Å; F1684-I1723 WeakPolarHBondContact O-CA 3.33Å; F1684-I1723 VanDerWaalsContact O-CG2 3.24Å; F1684-I1723 WeakPolarHBondContact O-CG2 3.43Å; F1684-N1724 PolarHBondContact O-N 3.05Å; F1684-N1724 PolarHBondContact O-OD1 2.74Å; F1684-K1725 HydrophobicContact CB-CB 4.08Å; F1684-K1725 WeakPolarHBondContact CB-O 3.25Å; F1684-K1725 HydrophobicContact CD2-CB 4.34Å; F1684-K1725 HydrophobicContact CD2-CD 4.42Å; F1684-K1725 HydrophobicContact CD2-CG 4.3Å; F1684-K1725 HydrophobicContact CG-CB 4.45Å; F1684-K1725 PolarHBondContact N-O 3.47Å; F1684-K1725 PolarHBondContact O-N 3.23Å; F1684-R1727 HydrophobicContact CE2-CB 3.84Å; F1684-R1727 HydrophobicContact CZ-CB 4.46Å; F1684-F1791 HydrophobicContact CE2-CD1 4.27Å; F1684-F1791 AromaticContact CE2-CE1 3.99Å; F1684-F1791 HydrophobicContact CE2-CE1 3.99Å; F1684-F1791 AromaticContact CZ-CE1 3.86Å; F1684-F1791 HydrophobicContact CZ-CE1 3.86Å
1685	G	77.7	Confident	81	Confident	10 Å²	10	27.8 Å²	27.8	10%	0.103	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	-170.9	175.1	0	0	0	0	0	113.1	N1687 G1688 L1720 K1722	G1685-N1687 PolarHBondContact O-N 2.73Å; G1685-G1688 PolarHBondContact N-O 2.87Å; G1685-G1688 PolarHBondContact O-N 3.17Å; G1685-L1720 CarbonylContact C-O 3.52Å; G1685-L1720 WeakPolarHBondContact CA-O 3.09Å; G1685-K1722 CarbonylContact C-O 3.6Å; G1685-K1722 WeakPolarHBondContact CA-O 3.42Å
1686	E	64.7	Low	80.5	Confident	79 Å²	79	31.4 Å²	31.4	37%	0.369	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.5	178.7	-69.8	163.9	155.7	0	0	113.4	L1720 K1722	E1686-L1720 PolarHBondContact N-O 2.83Å; E1686-K1722 HydrophobicContact CG-CB 3.92Å; E1686-K1722 PolarHBondContact N-O 2.99Å; E1686-K1722 WeakPolarHBondContact OE1-CB 3.05Å; E1686-K1722 WeakPolarHBondContact OE1-CD 3.48Å; E1686-K1722 WeakPolarHBondContact OE2-CB 3.3Å; E1686-K1722 PolarHBondContact OE2-N 3.18Å
1687	N	62.5	Low	80.2	Confident	35 Å²	35	36 Å²	36	19%	0.187	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	23.2	-176.1	-48.9	-30.4	0	0	0	112.8	W1656 G1685 D1719 L1720 G1721	W1656-N1687 HydrophobicContact CE3-CB 4.25Å; W1656-N1687 HydrophobicContact CZ3-CB 3.8Å; W1656-N1687 VanDerWaalsContact CZ3-CG 3.49Å; G1685-N1687 PolarHBondContact O-N 2.73Å; N1687-D1719 VanDerWaalsContact CB-O 3.32Å; N1687-D1719 WeakPolarHBondContact CB-O 3.07Å; N1687-D1719 PolarHBondContact ND2-O 2.82Å; N1687-L1720 PolarHBondContact N-O 3.1Å; N1687-G1721 PolarHBondContact ND2-N 2.84Å
1688	G	65.5	Low	80	Confident	19 Å²	19	36.8 Å²	36.8	20%	0.196	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.2	-160.1	177.3	0	0	0	0	0	114.6	G1685	G1685-G1688 PolarHBondContact N-O 2.87Å; G1685-G1688 PolarHBondContact O-N 3.17Å
1689	D	76.3	Confident	79.9	Confident	26 Å²	26	40.6 Å²	40.6	14%	0.139	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	154.2	-176.4	74.4	110	0	0	0	113.1	Y1535 K1578 R1580 T1682 L1683 F1684 G1691	Y1535-D1689 PolarHBondContact OH-OD2 3.08Å; Y1535-D1689 VanDerWaalsContact OH-OD2 3.06Å; K1578-D1689 PolarHBondContact NZ-O 3.05Å; R1580-D1689 IonicContact CZ-OD1 2.67Å; R1580-D1689 VanDerWaalsContact CZ-OD1 3.31Å; R1580-D1689 IonicContact CZ-OD2 2.76Å; R1580-D1689 IonicContact NH1-OD1 2.68Å; R1580-D1689 PolarHBondContact NH1-OD1 2.87Å; R1580-D1689 IonicContact NH1-OD2 2.8Å; R1580-D1689 PolarHBondContact NH2-O 3.5Å; R1580-D1689 IonicContact NH2-OD1 2.87Å; R1580-D1689 PolarHBondContact NH2-OD1 3.06Å; R1580-D1689 IonicContact NH2-OD2 2.7Å; R1580-D1689 PolarHBondContact NH2-OD2 3.02Å; R1580-D1689 VanDerWaalsContact NH2-OD2 3.09Å; T1682-D1689 HydrophobicContact CG2-CB 4.09Å; L1683-D1689 CarbonylContact O-C 3.51Å; L1683-D1689 VanDerWaalsContact O-CA 3.28Å; L1683-D1689 WeakPolarHBondContact O-CA 3.3Å; F1684-D1689 HydrophobicContact CD1-CB 3.53Å; F1684-D1689 HydrophobicContact CE1-CB 3.7Å; F1684-D1689 HydrophobicContact CG-CB 4.21Å; D1689-G1691 VanDerWaalsContact C-N 3.27Å; D1689-G1691 PolarHBondContact O-N 3.38Å; D1689-G1691 PolarHBondContact OD1-N 3.37Å
1690	S	78.6	Confident	79.6	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.			trans	-74.3	-7.5	-178.1	64.5	0	0	0	0	115.6	T1682 L1683 R1693	T1682-S1690 WeakPolarHBondContact CA-OG 3.25Å; L1683-S1690 PolarHBondContact N-OG 3.01Å; L1683-S1690 PolarHBondContact O-N 2.9Å; L1683-S1690 PolarHBondContact O-OG 3.27Å; S1690-R1693 PolarHBondContact O-NE 3.18Å; S1690-R1693 PolarHBondContact O-NH2 3.08Å
1691	G	65.8	Low	79.2	Confident	2 Å²	2	45.5 Å²	45.5	2%	0.021	23%	0.233	C	C	.	.			trans	69.5	-179	-157.1	0	0	0	0	0	112.1	R1580 T1682 D1689	R1580-G1691 VanDerWaalsContact NH2-N 3.15Å; T1682-G1691 WeakPolarHBondContact CA-O 2.95Å; T1682-G1691 WeakPolarHBondContact CB-O 3.45Å; T1682-G1691 VanDerWaalsContact CG2-O 3.31Å; T1682-G1691 WeakPolarHBondContact CG2-O 3.09Å; T1682-G1691 PolarHBondContact OG1-O 3.08Å; D1689-G1691 VanDerWaalsContact C-N 3.27Å; D1689-G1691 PolarHBondContact O-N 3.38Å; D1689-G1691 PolarHBondContact OD1-N 3.37Å
1692	E	78.2	Confident	78.7	Confident	61 Å²	61	57.7 Å²	57.7	29%	0.285	28%	0.279	S	S	.	.			trans	-90.9	129.5	-179.9	-160.7	177.1	88.4	0	0	110.8	Y1680 T1682 R1727 R1729	Y1680-E1692 HydrophobicContact CD1-CG 4.24Å; T1682-E1692 WeakPolarHBondContact OG1-CA 2.98Å; E1692-R1727 IonicContact OE2-CZ 3.45Å; E1692-R1727 IonicContact OE2-NH1 3.16Å; E1692-R1727 PolarHBondContact OE2-NH1 3.04Å; E1692-R1727 IonicContact OE2-NH2 2.84Å; E1692-R1729 VanDerWaalsContact CD-NE 3.28Å; E1692-R1729 IonicContact OE1-CZ 2.74Å; E1692-R1729 IonicContact OE1-NE 3.95Å; E1692-R1729 PolarHBondContact OE1-NE 2.79Å; E1692-R1729 IonicContact OE1-NH2 3.01Å; E1692-R1729 PolarHBondContact OE1-NH2 2.99Å; E1692-R1729 IonicContact OE2-CZ 2.66Å; E1692-R1729 IonicContact OE2-NE 2.98Å; E1692-R1729 PolarHBondContact OE2-NE 2.74Å; E1692-R1729 IonicContact OE2-NH2 2.75Å
1693	R	80.7	Confident	78.4	Confident	47 Å²	47	61.9 Å²	61.9	18%	0.177	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.4	-173.3	-59.1	-65	171.5	-102.4	5.3	110.2	E1630 Y1680 I1681 S1690 L1715	E1630-R1693 IonicContact OE1-CZ 2.72Å; E1630-R1693 IonicContact OE1-NH1 2.96Å; E1630-R1693 PolarHBondContact OE1-NH1 3.18Å; E1630-R1693 IonicContact OE1-NH2 3.5Å; E1630-R1693 PolarHBondContact OE1-NH2 3.06Å; E1630-R1693 IonicContact OE2-NH1 3.4Å; E1630-R1693 PolarHBondContact OE2-NH1 3.33Å; Y1680-R1693 CarbonylContact C-O 3.58Å; Y1680-R1693 WeakPolarHBondContact CA-O 3.42Å; I1681-R1693 HydrophobicContact CG2-CB 4.13Å; I1681-R1693 PolarHBondContact N-O 2.79Å; I1681-R1693 PolarHBondContact O-N 3.5Å; S1690-R1693 PolarHBondContact O-NE 3.18Å; S1690-R1693 PolarHBondContact O-NH2 3.08Å; R1693-L1715 HydrophobicContact CB-CD2 4.17Å
1694	K	85.3	Confident	78.4	Confident	90 Å²	90	64.9 Å²	64.9	39%	0.391	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.7	178	-171.6	173.6	-178.8	136.2	0	110.2	S1678 Y1680 T1696	S1678-K1694 VanDerWaalsContact CB-CE 3.46Å; S1678-K1694 WeakPolarHBondContact OG-CE 3.28Å; S1678-K1694 PolarHBondContact OG-NZ 3.01Å; Y1680-K1694 HydrophobicContact CD1-CB 3.86Å; Y1680-K1694 HydrophobicContact CD1-CG 4.23Å; Y1680-K1694 HydrophobicContact CE1-CB 3.76Å; Y1680-K1694 HydrophobicContact CE1-CD 3.93Å; Y1680-K1694 HydrophobicContact CE1-CG 3.89Å; Y1680-K1694 HydrophobicContact CE2-CG 4.47Å; Y1680-K1694 PolarHBondContact OH-NZ 3.35Å; K1694-T1696 HydrophobicContact CB-CG2 4.36Å; K1694-T1696 HydrophobicContact CD-CG2 4.3Å; K1694-T1696 HydrophobicContact CG-CG2 4.03Å; K1694-T1696 PolarHBondContact O-N 2.82Å
1695	L	87.5	Confident	78.9	Confident	5 Å²	5	63 Å²	63	3%	0.026	31%	0.306	C	S	.	.			trans	-91.4	86.2	-174.6	-63.3	-176.8	0	0	0	111	I1665 V1679 I1681 K1704 F1705 F1713 L1715	I1665-L1695 HydrophobicContact CD1-CD1 3.25Å; V1679-L1695 HydrophobicContact CG1-CD1 4.04Å; V1679-L1695 PolarHBondContact O-N 3.03Å; I1681-L1695 HydrophobicContact CB-CD1 4.34Å; I1681-L1695 HydrophobicContact CG2-CD1 4.27Å; I1681-L1695 HydrophobicContact CG2-CD2 3.82Å; I1681-L1695 HydrophobicContact CG2-CG 4.16Å; L1695-K1704 WeakPolarHBondContact O-CE 3.35Å; L1695-F1705 HydrophobicContact CB-CZ 3.91Å; L1695-F1705 HydrophobicContact CD1-CZ 4.19Å; L1695-F1713 HydrophobicContact CB-CD1 3.97Å; L1695-F1713 HydrophobicContact CB-CE1 3.73Å; L1695-F1713 HydrophobicContact CB-CE2 4.37Å; L1695-F1713 HydrophobicContact CB-CG 4.4Å; L1695-F1713 HydrophobicContact CB-CZ 3.96Å; L1695-F1713 HydrophobicContact CD1-CD2 4.21Å; L1695-F1713 HydrophobicContact CD1-CE2 4.21Å; L1695-F1713 HydrophobicContact CD2-CB 4.13Å; L1695-F1713 HydrophobicContact CD2-CD1 4.11Å; L1695-F1713 HydrophobicContact CD2-CD2 4.33Å; L1695-F1713 HydrophobicContact CD2-CG 3.93Å; L1695-L1715 HydrophobicContact CD2-CD2 4.32Å
1696	T	80.1	Confident	79.6	Confident	82 Å²	82	66 Å²	66	50%	0.503	32%	0.317	S	S	.	.			trans	-88.6	-49	-167.5	54.1	0	0	0	0	113.9	K1694 K1704	K1694-T1696 HydrophobicContact CB-CG2 4.36Å; K1694-T1696 HydrophobicContact CD-CG2 4.3Å; K1694-T1696 HydrophobicContact CG-CG2 4.03Å; K1694-T1696 PolarHBondContact O-N 2.82Å; T1696-K1704 WeakPolarHBondContact O-CE 3.39Å; T1696-K1704 PolarHBondContact O-NZ 2.8Å
1697	K	80.6	Confident	80.8	Confident	175 Å²	175	68.1 Å²	68.1	76%	0.761	32%	0.322	S	S	*	.			trans	-118.7	111.7	-175.1	-63.5	-179.5	-179.4	179.4	0	110.8	F1713	K1697-F1713 WeakPolarHBondContact O-CD1 3.46Å
1698	S	85.1	Confident	81.9	Confident	22 Å²	22	68.4 Å²	68.4	15%	0.154	33%	0.333	C	S	.	.			trans	-79.8	145.4	167.3	173.3	0	0	0	0	109.7	T1700 H1701 D1711 V1712	S1698-T1700 PolarHBondContact OG-N 3.06Å; S1698-T1700 PolarHBondContact OG-OG1 2.95Å; S1698-H1701 WeakPolarHBondContact CB-O 3.39Å; S1698-H1701 PolarHBondContact OG-N 2.81Å; S1698-D1711 WeakPolarHBondContact CB-OD1 3.39Å; S1698-D1711 PolarHBondContact OG-OD1 3.24Å; S1698-V1712 CarbonylContact C-O 3.5Å; S1698-V1712 WeakPolarHBondContact CA-O 3.37Å; S1698-V1712 PolarHBondContact OG-N 2.8Å
1699	L	84	Confident	83.1	Confident	108 Å²	108	69.5 Å²	69.5	57%	0.565	33%	0.333	S	S	*	.	S	Bend	trans	-87.9	-18.7	176.7	-63.5	175.8	0	0	0	112.1	V1712 Q1714	L1699-V1712 HydrophobicContact CB-CB 4.42Å; L1699-V1712 WeakPolarHBondContact CB-O 3.12Å; L1699-V1712 HydrophobicContact CD1-CG1 4.43Å; L1699-V1712 PolarHBondContact N-O 2.92Å; L1699-Q1714 HydrophobicContact CD1-CB 4.45Å; L1699-Q1714 HydrophobicContact CD1-CG 3.75Å
1700	T	82.9	Confident	83.9	Confident	72 Å²	72	70.8 Å²	70.8	44%	0.442	34%	0.342	S	S	.	.	S	Bend	trans	-97.7	-37.8	-179.9	41.6	0	0	0	0	113.1	S1698 T1710 V1712	S1698-T1700 PolarHBondContact OG-N 3.06Å; S1698-T1700 PolarHBondContact OG-OG1 2.95Å; T1700-T1710 PolarHBondContact OG1-O 2.86Å; T1700-T1710 VanDerWaalsContact OG1-O 3.05Å; T1700-V1712 HydrophobicContact CG2-CB 4.04Å; T1700-V1712 HydrophobicContact CG2-CG2 3.58Å; T1700-V1712 PolarHBondContact OG1-N 3.18Å
1701	H	82.4	Confident	84.6	Confident	75 Å²	75	70.8 Å²	70.8	35%	0.347	34%	0.342	S	S	.	.			trans	-137	146.9	-173.4	-47.4	104.5	0	0	0	113.2	S1698 N1703 Q1709 T1710 D1711	S1698-H1701 WeakPolarHBondContact CB-O 3.39Å; S1698-H1701 PolarHBondContact OG-N 2.81Å; H1701-N1703 WeakPolarHBondContact CB-O 3.44Å; H1701-Q1709 WeakPolarHBondContact CE1-CG 3.29Å; H1701-Q1709 VanDerWaalsContact CG-CD 3.43Å; H1701-Q1709 VanDerWaalsContact ND1-CD 3.32Å; H1701-Q1709 VanDerWaalsContact ND1-CG 3.33Å; H1701-Q1709 WeakPolarHBondContact ND1-CG 3.2Å; H1701-Q1709 PolarHBondContact ND1-NE2 2.98Å; H1701-T1710 PolarHBondContact CE1-O 2.77Å; H1701-T1710 PolarHBondContact ND1-O 2.87Å; H1701-D1711 WeakPolarHBondContact CB-OD1 3.1Å; H1701-D1711 IonicContact CG-OD1 3.73Å; H1701-D1711 IonicContact ND1-OD1 2.77Å; H1701-D1711 PolarHBondContact ND1-OD1 2.88Å
1702	R	79.3	Confident	85.7	Confident	256 Å²	256	71.3 Å²	71.3	97%	0.966	35%	0.345	S	S	*	.	S	Bend	trans	-76	-47.7	175.5	-80.7	-174.5	172.6	-175.8	-1.2	112
1703	N	82.4	Confident	86.3	Confident	94 Å²	94	68.6 Å²	68.6	50%	0.503	33%	0.332	S	S	.	.	S	Bend	trans	-88.6	136.7	166.2	-168.1	19.5	0	0	0	108	H1701 E1706 Q1709	H1701-N1703 WeakPolarHBondContact CB-O 3.44Å; N1703-E1706 PolarHBondContact ND2-OE1 3.4Å; N1703-Q1709 PolarHBondContact O-NE2 2.82Å
1704	K	86.7	Confident	86.7	Confident	64 Å²	64	71.2 Å²	71.2	28%	0.278	35%	0.346	S	S	.	.			trans	-132.1	150	-162.2	56.4	171.8	177.5	-75.5	0	111.8	L1695 T1696 E1706 D1711 F1713	L1695-K1704 WeakPolarHBondContact O-CE 3.35Å; T1696-K1704 WeakPolarHBondContact O-CE 3.39Å; T1696-K1704 PolarHBondContact O-NZ 2.8Å; K1704-E1706 VanDerWaalsContact C-N 3.28Å; K1704-D1711 WeakPolarHBondContact CA-OD2 3.37Å; K1704-F1713 HydrophobicContact CD-CE1 4.33Å; K1704-F1713 HydrophobicContact CD-CZ 4.25Å
1705	F	91.3	Very high	86.5	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.009	33%	0.332	C	S	.	.	S	Bend	trans	67.2	19.8	-175.7	-46	-59.9	0	0	0	115.3	I1665 T1667 G1674 T1675 V1679 L1695 D1711 F1713 W1739	I1665-F1705 HydrophobicContact CB-CE1 4.32Å; I1665-F1705 HydrophobicContact CD1-CE1 4.3Å; I1665-F1705 HydrophobicContact CG2-CD1 4.19Å; I1665-F1705 HydrophobicContact CG2-CE1 4.09Å; T1667-F1705 VanDerWaalsContact OG1-C 3.26Å; T1667-F1705 WeakPolarHBondContact OG1-CA 3.1Å; T1667-F1705 PolarHBondContact OG1-O 2.73Å; G1674-F1705 VanDerWaalsContact CA-O 3.26Å; G1674-F1705 WeakPolarHBondContact CA-O 3.5Å; T1675-F1705 HydrophobicContact CG2-CB 3.86Å; T1675-F1705 HydrophobicContact CG2-CD2 4.49Å; T1675-F1705 HydrophobicContact CG2-CG 4.45Å; T1675-F1705 PolarHBondContact N-O 3.46Å; V1679-F1705 HydrophobicContact CB-CD2 4.36Å; V1679-F1705 HydrophobicContact CB-CE1 4.48Å; V1679-F1705 HydrophobicContact CB-CE2 3.67Å; V1679-F1705 HydrophobicContact CB-CZ 3.73Å; V1679-F1705 HydrophobicContact CG1-CZ 4.2Å; V1679-F1705 HydrophobicContact CG2-CD2 3.64Å; V1679-F1705 HydrophobicContact CG2-CE1 4.37Å; V1679-F1705 HydrophobicContact CG2-CE2 3.46Å; V1679-F1705 VanDerWaalsContact CG2-CE2 3.46Å; V1679-F1705 HydrophobicContact CG2-CG 4.18Å; V1679-F1705 HydrophobicContact CG2-CZ 3.86Å; L1695-F1705 HydrophobicContact CB-CZ 3.91Å; L1695-F1705 HydrophobicContact CD1-CZ 4.19Å; F1705-D1711 HydrophobicContact CE1-CB 4.44Å; F1705-D1711 PolarHBondContact N-OD2 3.19Å; F1705-F1713 AromaticContact CE1-CE2 3.68Å; F1705-F1713 HydrophobicContact CE1-CE2 3.68Å; F1705-F1713 AromaticContact CE1-CZ 3.69Å; F1705-F1713 HydrophobicContact CE1-CZ 3.69Å; F1705-F1713 HydrophobicContact CE2-CZ 4.33Å; F1705-F1713 HydrophobicContact CZ-CE1 4.36Å; F1705-F1713 AromaticContact CZ-CE2 3.84Å; F1705-F1713 HydrophobicContact CZ-CE2 3.84Å; F1705-F1713 AromaticContact CZ-CZ 3.42Å; F1705-F1713 HydrophobicContact CZ-CZ 3.42Å; F1705-F1713 VanDerWaalsContact CZ-CZ 3.42Å; F1705-W1739 HydrophobicContact CB-CZ2 4.36Å; F1705-W1739 HydrophobicContact CD1-CH2 4.37Å; F1705-W1739 AromaticContact CD1-CZ2 3.7Å; F1705-W1739 HydrophobicContact CD1-CZ2 3.7Å; F1705-W1739 HydrophobicContact CE1-CZ2 4.27Å; F1705-W1739 HydrophobicContact CG-CZ2 4.17Å
1706	E	91.5	Very high	86.1	Confident	72 Å²	72	72.7 Å²	72.7	34%	0.336	36%	0.355	S	S	.	.			trans	-59.9	156.9	175.4	-77.3	-61.6	164.1	0	0	113.8	T1667 N1703 K1704 G1708 Q1709	T1667-E1706 WeakPolarHBondContact CB-O 3.19Å; T1667-E1706 WeakPolarHBondContact CG2-O 3.41Å; T1667-E1706 PolarHBondContact OG1-O 3.03Å; N1703-E1706 PolarHBondContact ND2-OE1 3.4Å; K1704-E1706 VanDerWaalsContact C-N 3.28Å; E1706-G1708 PolarHBondContact O-N 3.45Å; E1706-Q1709 HydrophobicContact CB-CB 3.92Å; E1706-Q1709 WeakPolarHBondContact O-CB 2.9Å; E1706-Q1709 PolarHBondContact O-N 2.73Å
1707	R	89.9	Confident	86.1	Confident	124 Å²	124	69 Å²	69	47%	0.468	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	125	179.7	174.2	-177.8	165.7	178.2	-3.8	111.1	D1669 K1670 A1673 Q1709	D1669-R1707 PolarHBondContact O-NH2 2.82Å; D1669-R1707 IonicContact OD1-CZ 2.75Å; D1669-R1707 IonicContact OD1-NE 3.35Å; D1669-R1707 PolarHBondContact OD1-NE 2.77Å; D1669-R1707 IonicContact OD1-NH2 2.86Å; D1669-R1707 PolarHBondContact OD1-NH2 3.47Å; D1669-R1707 IonicContact OD2-NH2 3.84Å; K1670-R1707 VanDerWaalsContact O-CD 3.22Å; K1670-R1707 WeakPolarHBondContact O-CD 3Å; K1670-R1707 PolarHBondContact O-NE 3.13Å; A1673-R1707 HydrophobicContact CB-CB 4.49Å; A1673-R1707 HydrophobicContact CB-CG 4.29Å; R1707-Q1709 PolarHBondContact O-N 2.59Å
1708	G	84.9	Confident	85.6	Confident	41 Å²	41	61 Å²	61	42%	0.423	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	2.1	-179.4	0	0	0	0	0	115.9	T1667 G1668 E1706	T1667-G1708 CarbonylContact O-C 3.55Å; T1667-G1708 WeakPolarHBondContact O-CA 3.42Å; T1667-G1708 PolarHBondContact O-N 2.9Å; G1668-G1708 PolarHBondContact O-N 2.82Å; G1668-G1708 VanDerWaalsContact O-N 3.15Å; E1706-G1708 PolarHBondContact O-N 3.45Å
1709	Q	91.1	Very high	85.2	Confident	41 Å²	41	60.6 Å²	60.6	19%	0.192	29%	0.294	C	S	.	.			trans	-87.6	144.6	-174.3	-166.6	174.2	-90.8	0	0	112.4	T1666 T1667 H1701 N1703 E1706 R1707 D1711	T1666-Q1709 WeakPolarHBondContact CA-O 3.06Å; T1667-Q1709 PolarHBondContact N-O 2.7Å; H1701-Q1709 WeakPolarHBondContact CE1-CG 3.29Å; H1701-Q1709 VanDerWaalsContact CG-CD 3.43Å; H1701-Q1709 VanDerWaalsContact ND1-CD 3.32Å; H1701-Q1709 VanDerWaalsContact ND1-CG 3.33Å; H1701-Q1709 WeakPolarHBondContact ND1-CG 3.2Å; H1701-Q1709 PolarHBondContact ND1-NE2 2.98Å; N1703-Q1709 PolarHBondContact O-NE2 2.82Å; E1706-Q1709 HydrophobicContact CB-CB 3.92Å; E1706-Q1709 WeakPolarHBondContact O-CB 2.9Å; E1706-Q1709 PolarHBondContact O-N 2.73Å; R1707-Q1709 PolarHBondContact O-N 2.59Å; Q1709-D1711 PolarHBondContact NE2-OD1 3.28Å; Q1709-D1711 PolarHBondContact NE2-OD2 2.87Å
1710	T	92.6	Very high	84.7	Confident	54 Å²	54	55.4 Å²	55.4	33%	0.331	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111.8	169.3	-56.4	0	0	0	0	111.7	R1664 I1665 T1666 T1700 H1701	R1664-T1710 HydrophobicContact CB-CG2 4.05Å; I1665-T1710 CarbonylContact O-C 3.35Å; I1665-T1710 VanDerWaalsContact O-CA 3.32Å; I1665-T1710 WeakPolarHBondContact O-CA 3.14Å; T1666-T1710 PolarHBondContact OG1-OG1 3.22Å; T1700-T1710 PolarHBondContact OG1-O 2.86Å; T1700-T1710 VanDerWaalsContact OG1-O 3.05Å; H1701-T1710 PolarHBondContact CE1-O 2.77Å; H1701-T1710 PolarHBondContact ND1-O 2.87Å
1711	D	93.2	Very high	84.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.3	177.6	-80.1	-70.5	0	0	0	112.8	R1664 I1665 S1698 H1701 K1704 F1705 Q1709 F1713	R1664-D1711 CarbonylContact C-O 3.47Å; R1664-D1711 VanDerWaalsContact CA-O 3.31Å; R1664-D1711 WeakPolarHBondContact CA-O 3.3Å; I1665-D1711 PolarHBondContact N-O 2.8Å; I1665-D1711 PolarHBondContact O-N 2.94Å; S1698-D1711 WeakPolarHBondContact CB-OD1 3.39Å; S1698-D1711 PolarHBondContact OG-OD1 3.24Å; H1701-D1711 WeakPolarHBondContact CB-OD1 3.1Å; H1701-D1711 IonicContact CG-OD1 3.73Å; H1701-D1711 IonicContact ND1-OD1 2.77Å; H1701-D1711 PolarHBondContact ND1-OD1 2.88Å; K1704-D1711 WeakPolarHBondContact CA-OD2 3.37Å; F1705-D1711 HydrophobicContact CE1-CB 4.44Å; F1705-D1711 PolarHBondContact N-OD2 3.19Å; Q1709-D1711 PolarHBondContact NE2-OD1 3.28Å; Q1709-D1711 PolarHBondContact NE2-OD2 2.87Å; D1711-F1713 HydrophobicContact CB-CE2 3.61Å; D1711-F1713 HydrophobicContact CB-CZ 3.9Å
1712	V	90.6	Very high	83.9	Confident	13 Å²	13	51.7 Å²	51.7	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.6	-172.5	-175.9	0	0	0	0	110.5	E1662 V1663 R1664 S1698 L1699 T1700	E1662-V1712 HydrophobicContact CG-CG1 3.52Å; V1663-V1712 CarbonylContact O-C 3.55Å; V1663-V1712 WeakPolarHBondContact O-CA 3.3Å; R1664-V1712 HydrophobicContact CB-CG2 4.33Å; R1664-V1712 HydrophobicContact CG-CG1 4.21Å; R1664-V1712 HydrophobicContact CG-CG2 3.92Å; S1698-V1712 CarbonylContact C-O 3.5Å; S1698-V1712 WeakPolarHBondContact CA-O 3.37Å; S1698-V1712 PolarHBondContact OG-N 2.8Å; L1699-V1712 HydrophobicContact CB-CB 4.42Å; L1699-V1712 WeakPolarHBondContact CB-O 3.12Å; L1699-V1712 HydrophobicContact CD1-CG1 4.43Å; L1699-V1712 PolarHBondContact N-O 2.92Å; T1700-V1712 HydrophobicContact CG2-CB 4.04Å; T1700-V1712 HydrophobicContact CG2-CG2 3.58Å; T1700-V1712 PolarHBondContact OG1-N 3.18Å
1713	F	91	Very high	84	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	155.9	-177.7	-56.6	-90.9	0	0	0	110	E1662 V1663 I1665 L1695 K1697 K1704 F1705 D1711	E1662-F1713 CarbonylContact C-O 3.56Å; E1662-F1713 WeakPolarHBondContact CA-O 3.31Å; V1663-F1713 PolarHBondContact N-O 3.4Å; V1663-F1713 PolarHBondContact O-N 3.41Å; I1665-F1713 HydrophobicContact CD1-CE2 4.48Å; L1695-F1713 HydrophobicContact CB-CD1 3.97Å; L1695-F1713 HydrophobicContact CB-CE1 3.73Å; L1695-F1713 HydrophobicContact CB-CE2 4.37Å; L1695-F1713 HydrophobicContact CB-CG 4.4Å; L1695-F1713 HydrophobicContact CB-CZ 3.96Å; L1695-F1713 HydrophobicContact CD1-CD2 4.21Å; L1695-F1713 HydrophobicContact CD1-CE2 4.21Å; L1695-F1713 HydrophobicContact CD2-CB 4.13Å; L1695-F1713 HydrophobicContact CD2-CD1 4.11Å; L1695-F1713 HydrophobicContact CD2-CD2 4.33Å; L1695-F1713 HydrophobicContact CD2-CG 3.93Å; K1697-F1713 WeakPolarHBondContact O-CD1 3.46Å; K1704-F1713 HydrophobicContact CD-CE1 4.33Å; K1704-F1713 HydrophobicContact CD-CZ 4.25Å; F1705-F1713 AromaticContact CE1-CE2 3.68Å; F1705-F1713 HydrophobicContact CE1-CE2 3.68Å; F1705-F1713 AromaticContact CE1-CZ 3.69Å; F1705-F1713 HydrophobicContact CE1-CZ 3.69Å; F1705-F1713 HydrophobicContact CE2-CZ 4.33Å; F1705-F1713 HydrophobicContact CZ-CE1 4.36Å; F1705-F1713 AromaticContact CZ-CE2 3.84Å; F1705-F1713 HydrophobicContact CZ-CE2 3.84Å; F1705-F1713 AromaticContact CZ-CZ 3.42Å; F1705-F1713 HydrophobicContact CZ-CZ 3.42Å; F1705-F1713 VanDerWaalsContact CZ-CZ 3.42Å; D1711-F1713 HydrophobicContact CB-CE2 3.61Å; D1711-F1713 HydrophobicContact CB-CZ 3.9Å
1714	Q	87.5	Confident	84	Confident	101 Å²	101	37.8 Å²	37.8	47%	0.472	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	135.5	169.8	-78.8	173.9	-0.5	0	0	110.4	T1660 Y1661 L1699 I1749	T1660-Q1714 HydrophobicContact CG2-CB 4.27Å; T1660-Q1714 HydrophobicContact CG2-CG 4.43Å; Y1661-Q1714 CarbonylContact O-C 3.18Å; Y1661-Q1714 WeakPolarHBondContact O-CA 3.43Å; L1699-Q1714 HydrophobicContact CD1-CB 4.45Å; L1699-Q1714 HydrophobicContact CD1-CG 3.75Å; Q1714-I1749 HydrophobicContact CG-CD1 4.27Å
1715	L	81.6	Confident	83.8	Confident	18 Å²	18	37.8 Å²	37.8	9%	0.094	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.3	-178.9	-59	-179.8	0	0	0	109.9	T1660 Y1661 V1663 I1681 L1683 R1693 L1695 I1717	T1660-L1715 WeakPolarHBondContact CA-O 3.28Å; Y1661-L1715 PolarHBondContact N-O 3.08Å; Y1661-L1715 PolarHBondContact O-N 3Å; V1663-L1715 HydrophobicContact CG2-CD1 3.73Å; V1663-L1715 HydrophobicContact CG2-CG 4.18Å; I1681-L1715 HydrophobicContact CG2-CD1 4.04Å; L1683-L1715 HydrophobicContact CD1-CD1 4.36Å; R1693-L1715 HydrophobicContact CB-CD2 4.17Å; L1695-L1715 HydrophobicContact CD2-CD2 4.32Å; L1715-I1717 HydrophobicContact CB-CG2 4.5Å
1716	E	80.3	Confident	83.7	Confident	109 Å²	109	37.7 Å²	37.7	51%	0.509	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	110.3	166.7	-63.6	-176.8	148.9	0	0	109.2	K1618 Q1626	K1618-E1716 IonicContact NZ-OE2 2.64Å; Q1626-E1716 PolarHBondContact NE2-OE2 2.59Å
1717	I	79.4	Confident	83.6	Confident	5 Å²	5	37 Å²	37	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	163.1	-179.4	56	171.9	0	0	0	110.8	M1658 N1659 Y1661 L1683 L1715 L1720	M1658-I1717 VanDerWaalsContact SD-C 3.54Å; N1659-I1717 PolarHBondContact N-O 3.12Å; N1659-I1717 PolarHBondContact O-N 2.88Å; Y1661-I1717 HydrophobicContact CD2-CD1 3.73Å; Y1661-I1717 HydrophobicContact CD2-CG1 3.45Å; Y1661-I1717 VanDerWaalsContact CD2-CG1 3.45Å; Y1661-I1717 HydrophobicContact CE2-CD1 4Å; Y1661-I1717 HydrophobicContact CE2-CG1 3.75Å; Y1661-I1717 HydrophobicContact CG-CD1 4.35Å; Y1661-I1717 HydrophobicContact CG-CG1 4.43Å; L1683-I1717 HydrophobicContact CD1-CD1 4.02Å; L1715-I1717 HydrophobicContact CB-CG2 4.5Å; I1717-L1720 HydrophobicContact CD1-CD1 3.85Å; I1717-L1720 HydrophobicContact CD1-CG 4.07Å
1718	V	69.9	Low	83.8	Confident	7 Å²	7	31 Å²	31	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	145.6	175.2	-170.5	0	0	0	0	110	E1632 I1634 W1656 M1658 L1720	E1632-V1718 HydrophobicContact CB-CG2 4.21Å; I1634-V1718 HydrophobicContact CD1-CG1 4.03Å; I1634-V1718 HydrophobicContact CD1-CG2 4.11Å; I1634-V1718 HydrophobicContact CG1-CG2 4.3Å; W1656-V1718 HydrophobicContact CB-CG1 3.83Å; M1658-V1718 HydrophobicContact CE-CG2 3.86Å; M1658-V1718 HydrophobicContact SD-CG2 3.91Å; M1658-V1718 PolarHBondContact SD-N 2.94Å; V1718-L1720 WeakPolarHBondContact O-CD2 3.01Å; V1718-L1720 WeakPolarHBondContact O-CG 3.44Å; V1718-L1720 PolarHBondContact O-N 2.87Å
1719	D	75.8	Confident	84.1	Confident	12 Å²	12	31.4 Å²	31.4	6%	0.064	15%	0.152	C	C	.	.			trans	-54	92.6	175.3	-176	14.2	0	0	0	111.2	L1657 N1659 N1687 G1721 K1826	L1657-D1719 WeakPolarHBondContact O-CB 3.3Å; L1657-D1719 PolarHBondContact O-N 2.93Å; N1659-D1719 WeakPolarHBondContact ND2-CB 3.31Å; N1659-D1719 PolarHBondContact ND2-OD1 2.92Å; N1687-D1719 VanDerWaalsContact CB-O 3.32Å; N1687-D1719 WeakPolarHBondContact CB-O 3.07Å; N1687-D1719 PolarHBondContact ND2-O 2.82Å; D1719-G1721 PolarHBondContact O-N 2.96Å; D1719-G1721 VanDerWaalsContact O-N 3.12Å; D1719-G1721 PolarHBondContact OD1-N 2.93Å; D1719-K1826 IonicContact OD2-NZ 3.29Å; D1719-K1826 PolarHBondContact OD2-NZ 3.46Å
1720	L	74.7	Confident	84	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.			trans	-69.9	-4.4	180	-61	-169	0	0	0	112.8	Y1661 L1683 G1685 E1686 N1687 I1717 V1718 I1723	Y1661-L1720 PolarHBondContact OH-N 2.86Å; L1683-L1720 HydrophobicContact CB-CD1 3.74Å; G1685-L1720 CarbonylContact C-O 3.52Å; G1685-L1720 WeakPolarHBondContact CA-O 3.09Å; E1686-L1720 PolarHBondContact N-O 2.83Å; N1687-L1720 PolarHBondContact N-O 3.1Å; I1717-L1720 HydrophobicContact CD1-CD1 3.85Å; I1717-L1720 HydrophobicContact CD1-CG 4.07Å; V1718-L1720 WeakPolarHBondContact O-CD2 3.01Å; V1718-L1720 WeakPolarHBondContact O-CG 3.44Å; V1718-L1720 PolarHBondContact O-N 2.87Å; L1720-I1723 HydrophobicContact CB-CD1 3.64Å; L1720-I1723 HydrophobicContact CD1-CD1 4.1Å; L1720-I1723 HydrophobicContact CG-CD1 4.42Å
1721	G	73.4	Confident	83.7	Confident	15 Å²	15	30.2 Å²	30.2	16%	0.155	15%	0.145	C	C	.	.			trans	71.2	-139.3	-173.1	0	0	0	0	0	111	N1687 D1719 I1723	N1687-G1721 PolarHBondContact ND2-N 2.84Å; D1719-G1721 PolarHBondContact O-N 2.96Å; D1719-G1721 VanDerWaalsContact O-N 3.12Å; D1719-G1721 PolarHBondContact OD1-N 2.93Å; G1721-I1723 PolarHBondContact O-N 2.94Å
1722	K	74.6	Confident	83.3	Confident	53 Å²	53	32.6 Å²	32.6	23%	0.23	16%	0.158	C	C	.	.	S	Bend	trans	-71.6	118.5	174.5	-170.1	-169.7	179.5	-166.9	0	110.4	G1685 E1686 Y1771 E1865	G1685-K1722 CarbonylContact C-O 3.6Å; G1685-K1722 WeakPolarHBondContact CA-O 3.42Å; E1686-K1722 HydrophobicContact CG-CB 3.92Å; E1686-K1722 PolarHBondContact N-O 2.99Å; E1686-K1722 WeakPolarHBondContact OE1-CB 3.05Å; E1686-K1722 WeakPolarHBondContact OE1-CD 3.48Å; E1686-K1722 WeakPolarHBondContact OE2-CB 3.3Å; E1686-K1722 PolarHBondContact OE2-N 3.18Å; K1722-Y1771 WeakPolarHBondContact CA-OH 3.33Å; K1722-Y1771 HydrophobicContact CG-CE1 3.93Å; K1722-E1865 VanDerWaalsContact CE-OE1 3.32Å; K1722-E1865 WeakPolarHBondContact CE-OE1 3.43Å; K1722-E1865 IonicContact NZ-OE1 2.78Å; K1722-E1865 PolarHBondContact NZ-OE1 2.93Å; K1722-E1865 IonicContact NZ-OE2 2.72Å; K1722-E1865 PolarHBondContact NZ-OE2 2.93Å
1723	I	82.5	Confident	82.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.2	177.1	-41.5	-57.9	0	0	0	108.7	Y1661 L1683 F1684 L1720 G1721 V1746 Y1771 F1773 A1794	Y1661-I1723 HydrophobicContact CE1-CD1 3.77Å; Y1661-I1723 HydrophobicContact CE1-CG1 4.13Å; L1683-I1723 HydrophobicContact CB-CG2 4.33Å; L1683-I1723 HydrophobicContact CD2-CG2 4.48Å; F1684-I1723 CarbonylContact O-C 3.44Å; F1684-I1723 WeakPolarHBondContact O-CA 3.33Å; F1684-I1723 VanDerWaalsContact O-CG2 3.24Å; F1684-I1723 WeakPolarHBondContact O-CG2 3.43Å; L1720-I1723 HydrophobicContact CB-CD1 3.64Å; L1720-I1723 HydrophobicContact CD1-CD1 4.1Å; L1720-I1723 HydrophobicContact CG-CD1 4.42Å; G1721-I1723 PolarHBondContact O-N 2.94Å; I1723-V1746 HydrophobicContact CG1-CG1 4.48Å; I1723-Y1771 HydrophobicContact CB-CD1 4.07Å; I1723-Y1771 HydrophobicContact CB-CD2 4.2Å; I1723-Y1771 HydrophobicContact CB-CE1 4.32Å; I1723-Y1771 HydrophobicContact CB-CE2 4.45Å; I1723-Y1771 HydrophobicContact CB-CG 4.02Å; I1723-Y1771 HydrophobicContact CG1-CD2 3.92Å; I1723-Y1771 HydrophobicContact CG1-CE2 3.93Å; I1723-Y1771 HydrophobicContact CG1-CG 4.27Å; I1723-Y1771 VanDerWaalsContact O-CD1 3.29Å; I1723-Y1771 WeakPolarHBondContact O-CD1 3.48Å; I1723-F1773 HydrophobicContact CG2-CZ 3.75Å; I1723-A1794 WeakPolarHBondContact O-CB 3.35Å
1724	N	80.7	Confident	82.1	Confident	58 Å²	58	36.5 Å²	36.5	31%	0.31	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	-21.1	-174.8	60.3	42.8	0	0	0	113.6	F1684 A1794	F1684-N1724 PolarHBondContact O-N 3.05Å; F1684-N1724 PolarHBondContact O-OD1 2.74Å; N1724-A1794 PolarHBondContact O-N 2.88Å
1725	K	83.2	Confident	81.6	Confident	65 Å²	65	37.8 Å²	37.8	28%	0.283	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	152.7	-178.7	-176.5	-170.5	69.5	173.3	0	110.3	F1684 F1791 F1792	F1684-K1725 HydrophobicContact CB-CB 4.08Å; F1684-K1725 WeakPolarHBondContact CB-O 3.25Å; F1684-K1725 HydrophobicContact CD2-CB 4.34Å; F1684-K1725 HydrophobicContact CD2-CD 4.42Å; F1684-K1725 HydrophobicContact CD2-CG 4.3Å; F1684-K1725 HydrophobicContact CG-CB 4.45Å; F1684-K1725 PolarHBondContact N-O 3.47Å; F1684-K1725 PolarHBondContact O-N 3.23Å; K1725-F1791 HydrophobicContact CD-CD1 3.87Å; K1725-F1791 HydrophobicContact CG-CD1 4.4Å; K1725-F1792 CarbonylContact C-O 3.22Å; K1725-F1792 VanDerWaalsContact CA-O 3.29Å; K1725-F1792 WeakPolarHBondContact CA-O 3.25Å; K1725-F1792 VanDerWaalsContact CG-O 3.29Å; K1725-F1792 WeakPolarHBondContact CG-O 3.12Å
1726	V	90.1	Very high	81.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.4	168	64.8	0	0	0	0	109.2	I1681 T1682 L1683 I1744 F1773 F1791 F1792	I1681-V1726 HydrophobicContact CD1-CG2 3.74Å; I1681-V1726 HydrophobicContact CG1-CG2 3.49Å; I1681-V1726 VanDerWaalsContact CG1-CG2 3.49Å; T1682-V1726 CarbonylContact O-C 3.54Å; T1682-V1726 WeakPolarHBondContact O-CA 3.42Å; L1683-V1726 HydrophobicContact CD2-CB 4.37Å; L1683-V1726 HydrophobicContact CD2-CG2 3.96Å; V1726-I1744 HydrophobicContact CG1-CD1 4.07Å; V1726-I1744 HydrophobicContact CG2-CD1 4.11Å; V1726-F1773 HydrophobicContact CB-CD1 4.03Å; V1726-F1773 HydrophobicContact CB-CE1 3.95Å; V1726-F1773 HydrophobicContact CB-CE2 4.47Å; V1726-F1773 HydrophobicContact CB-CG 4.33Å; V1726-F1773 HydrophobicContact CB-CZ 4.19Å; V1726-F1773 HydrophobicContact CG1-CB 4.01Å; V1726-F1773 HydrophobicContact CG1-CD1 3.39Å; V1726-F1773 HydrophobicContact CG1-CD2 4.14Å; V1726-F1773 HydrophobicContact CG1-CE1 3.84Å; V1726-F1773 HydrophobicContact CG1-CG 3.57Å; V1726-F1773 HydrophobicContact CG1-CZ 4.39Å; V1726-F1791 CarbonylContact O-C 3.56Å; V1726-F1791 VanDerWaalsContact O-CA 3.27Å; V1726-F1791 WeakPolarHBondContact O-CA 3.42Å; V1726-F1792 HydrophobicContact CG1-CB 3.8Å; V1726-F1792 HydrophobicContact CG1-CD2 4.33Å; V1726-F1792 PolarHBondContact N-O 2.84Å; V1726-F1792 PolarHBondContact O-N 2.92Å
1727	R	89.4	Confident	81.6	Confident	56 Å²	56	37 Å²	37	21%	0.211	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.6	159.5	-177	-171.4	175.3	-141.7	1.5	107.4	I1681 T1682 F1684 E1692 D1789 R1790 F1791	I1681-R1727 CarbonylContact C-O 3.53Å; I1681-R1727 WeakPolarHBondContact CA-O 3.11Å; T1682-R1727 PolarHBondContact N-O 3.22Å; T1682-R1727 PolarHBondContact O-N 3.31Å; F1684-R1727 HydrophobicContact CE2-CB 3.84Å; F1684-R1727 HydrophobicContact CZ-CB 4.46Å; E1692-R1727 IonicContact OE2-CZ 3.45Å; E1692-R1727 IonicContact OE2-NH1 3.16Å; E1692-R1727 PolarHBondContact OE2-NH1 3.04Å; E1692-R1727 IonicContact OE2-NH2 2.84Å; R1727-D1789 VanDerWaalsContact CG-OD1 3.31Å; R1727-D1789 WeakPolarHBondContact CG-OD1 3.35Å; R1727-D1789 IonicContact CZ-OD1 3.18Å; R1727-D1789 IonicContact CZ-OD2 2.69Å; R1727-D1789 IonicContact NE-OD1 3.81Å; R1727-D1789 PolarHBondContact NE-OD1 2.79Å; R1727-D1789 IonicContact NE-OD2 2.66Å; R1727-D1789 PolarHBondContact NE-OD2 2.82Å; R1727-D1789 IonicContact NH2-OD1 2.75Å; R1727-D1789 IonicContact NH2-OD2 3.64Å; R1727-D1789 PolarHBondContact NH2-OD2 2.87Å; R1727-R1790 CarbonylContact C-O 3.57Å; R1727-R1790 VanDerWaalsContact CA-O 3.29Å; R1727-R1790 WeakPolarHBondContact CA-O 3.48Å; R1727-F1791 HydrophobicContact CB-CD1 3.66Å; R1727-F1791 HydrophobicContact CB-CE1 3.6Å; R1727-F1791 HydrophobicContact CB-CG 4.3Å; R1727-F1791 HydrophobicContact CB-CZ 4.17Å; R1727-F1791 HydrophobicContact CG-CD1 4.05Å; R1727-F1791 HydrophobicContact CG-CD2 4.35Å; R1727-F1791 HydrophobicContact CG-CE1 3.79Å; R1727-F1791 HydrophobicContact CG-CE2 4.08Å; R1727-F1791 HydrophobicContact CG-CG 4.34Å; R1727-F1791 HydrophobicContact CG-CZ 3.81Å
1728	I	92.8	Very high	81.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	137.1	172.9	-165.9	165.1	0	0	0	109.9	I1665 V1679 Y1680 W1739 L1741 I1744 L1779 R1790 F1792	I1665-I1728 HydrophobicContact CD1-CD1 3.81Å; V1679-I1728 HydrophobicContact CG1-CD1 3.8Å; V1679-I1728 HydrophobicContact CG1-CG1 3.82Å; Y1680-I1728 WeakPolarHBondContact O-CA 3.32Å; Y1680-I1728 WeakPolarHBondContact O-CG1 3.36Å; I1728-W1739 HydrophobicContact CD1-CH2 3.64Å; I1728-W1739 HydrophobicContact CD1-CZ3 3.79Å; I1728-W1739 HydrophobicContact CG1-CH2 4.42Å; I1728-W1739 HydrophobicContact CG1-CZ3 4.09Å; I1728-L1741 HydrophobicContact CD1-CD2 4.11Å; I1728-L1741 HydrophobicContact CG2-CD2 3.58Å; I1728-I1744 HydrophobicContact CB-CD1 4.25Å; I1728-I1744 HydrophobicContact CD1-CD1 3.65Å; I1728-I1744 HydrophobicContact CD1-CG1 4.47Å; I1728-I1744 HydrophobicContact CG2-CD1 4.17Å; I1728-L1779 HydrophobicContact CG2-CD2 4.43Å; I1728-R1790 PolarHBondContact N-O 2.82Å; I1728-R1790 PolarHBondContact O-N 2.82Å; I1728-F1792 HydrophobicContact CG2-CD2 3.98Å; I1728-F1792 HydrophobicContact CG2-CE2 3.63Å
1729	R	91	Very high	82.9	Confident	49 Å²	49	36.8 Å²	36.8	19%	0.185	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	166.2	-178.7	70.4	171.3	-165.2	73.7	5.2	110.9	V1679 Y1680 E1692 L1788 D1789	V1679-R1729 WeakPolarHBondContact CA-O 3.44Å; Y1680-R1729 PolarHBondContact N-O 2.82Å; Y1680-R1729 PolarHBondContact O-N 2.79Å; E1692-R1729 VanDerWaalsContact CD-NE 3.28Å; E1692-R1729 IonicContact OE1-CZ 2.74Å; E1692-R1729 IonicContact OE1-NE 3.95Å; E1692-R1729 PolarHBondContact OE1-NE 2.79Å; E1692-R1729 IonicContact OE1-NH2 3.01Å; E1692-R1729 PolarHBondContact OE1-NH2 2.99Å; E1692-R1729 IonicContact OE2-CZ 2.66Å; E1692-R1729 IonicContact OE2-NE 2.98Å; E1692-R1729 PolarHBondContact OE2-NE 2.74Å; E1692-R1729 IonicContact OE2-NH2 2.75Å; R1729-L1788 WeakPolarHBondContact CA-O 3.45Å; R1729-L1788 VanDerWaalsContact CB-O 3.25Å; R1729-L1788 WeakPolarHBondContact CB-O 3.29Å; R1729-D1789 HydrophobicContact CB-CB 3.75Å
1730	H	89.6	Confident	83.7	Confident	5 Å²	5	37.3 Å²	37.3	2%	0.023	21%	0.21	C	C	.	.			trans	-126.7	179.5	166.8	64.2	138.8	0	0	0	110.3	A1677 S1678 V1679 P1737 L1779 L1788	A1677-H1730 HydrophobicContact CB-CB 3.88Å; A1677-H1730 WeakPolarHBondContact CB-ND1 3.36Å; S1678-H1730 VanDerWaalsContact O-CA 3.24Å; S1678-H1730 WeakPolarHBondContact O-CA 3.13Å; V1679-H1730 HydrophobicContact CG2-CB 4.49Å; H1730-P1737 PolarHBondContact CE1-O 3.21Å; H1730-P1737 PolarHBondContact ND1-O 2.93Å; H1730-P1737 VanDerWaalsContact ND1-O 3.13Å; H1730-L1779 PolarHBondContact CE1-O 2.88Å; H1730-L1779 VanDerWaalsContact NE2-C 3.27Å; H1730-L1779 WeakPolarHBondContact NE2-CB 3.45Å; H1730-L1779 PolarHBondContact NE2-O 3.5Å; H1730-L1788 PolarHBondContact CD2-O 2.82Å; H1730-L1788 PolarHBondContact N-O 3.14Å; H1730-L1788 VanDerWaalsContact N-O 3.14Å; H1730-L1788 WeakPolarHBondContact NE2-CD2 3.29Å
1731	D	86	Confident	84.4	Confident	65 Å²	65	37.3 Å²	37.3	35%	0.348	21%	0.21	S	C	.	.			trans	-110.3	8.7	179.5	65.6	-3	0	0	0	114	S1678 Y1680 S1733	S1678-D1731 WeakPolarHBondContact CB-OD1 3.31Å; S1678-D1731 VanDerWaalsContact CB-OD2 3.23Å; S1678-D1731 WeakPolarHBondContact CB-OD2 3.47Å; S1678-D1731 PolarHBondContact N-OD1 3.17Å; S1678-D1731 PolarHBondContact O-N 3.45Å; S1678-D1731 PolarHBondContact OG-OD2 2.8Å; Y1680-D1731 HydrophobicContact CE2-CB 4.35Å; D1731-S1733 PolarHBondContact O-N 3.04Å; D1731-S1733 WeakPolarHBondContact OD1-CB 3.13Å; D1731-S1733 PolarHBondContact OD1-N 3.48Å; D1731-S1733 PolarHBondContact OD1-OG 3.42Å; D1731-S1733 PolarHBondContact OD2-OG 3.48Å
1732	N	85	Confident	85.1	Confident	50 Å²	50	38 Å²	38	27%	0.267	21%	0.213	S	C	.	.			trans	53.9	30.6	-178.5	-156.7	102.7	0	0	0	113.4	P1737 T1781 L1788	N1732-P1737 HydrophobicContact CB-CB 4.28Å; N1732-T1781 PolarHBondContact OD1-OG1 2.7Å; N1732-L1788 HydrophobicContact CB-CD1 3.98Å; N1732-L1788 HydrophobicContact CB-CD2 4.28Å; N1732-L1788 WeakPolarHBondContact OD1-CD2 3.36Å
1733	S	81.3	Confident	85.9	Confident	46 Å²	46	36.9 Å²	36.9	32%	0.322	21%	0.21	S	C	.	.			trans	-86	167.3	169.9	62.2	0	0	0	0	112.3	A1677 S1678 D1731	A1677-S1733 VanDerWaalsContact CA-O 3.22Å; A1677-S1733 WeakPolarHBondContact CA-O 3.49Å; A1677-S1733 VanDerWaalsContact CB-O 3.31Å; A1677-S1733 WeakPolarHBondContact CB-O 3.48Å; A1677-S1733 PolarHBondContact N-O 3.34Å; S1678-S1733 PolarHBondContact N-OG 2.91Å; D1731-S1733 PolarHBondContact O-N 3.04Å; D1731-S1733 WeakPolarHBondContact OD1-CB 3.13Å; D1731-S1733 PolarHBondContact OD1-N 3.48Å; D1731-S1733 PolarHBondContact OD1-OG 3.42Å; D1731-S1733 PolarHBondContact OD2-OG 3.48Å
1734	G	76.6	Confident	86.4	Confident	53 Å²	53	36.9 Å²	36.9	55%	0.546	21%	0.21	S	C	.	.	S	Bend	trans	95.2	-174.9	178	0	0	0	0	0	114.6
1735	V	75.7	Confident	86.8	Confident	127 Å²	127	35.7 Å²	35.7	77%	0.77	20%	0.203	S	C	*	.	S	Bend	trans	-87.4	-38	-175.9	-176.9	0	0	0	0	110.7	D1676	D1676-V1735 WeakPolarHBondContact OD2-CA 3.22Å; D1676-V1735 WeakPolarHBondContact OD2-CB 3.07Å; D1676-V1735 PolarHBondContact OD2-N 2.77Å
1736	N	78.3	Confident	87.1	Confident	89 Å²	89	32.6 Å²	32.6	48%	0.476	19%	0.189	S	C	.	.			trans	-117.8	92.2	168.8	-62.5	-80.4	0	0	0	109.1	T1675 D1676	T1675-N1736 WeakPolarHBondContact CA-O 3.11Å; T1675-N1736 PolarHBondContact OG1-O 3.18Å; D1676-N1736 PolarHBondContact N-O 3.28Å; D1676-N1736 PolarHBondContact OD2-N 3.27Å
1737	P	84.3	Confident	86.8	Confident	21 Å²	21	33.5 Å²	33.5	14%	0.136	19%	0.193	C	C	.	.			trans	-79.3	-22.9	-178.2	29.5	-34.4	0	0	0	113.3	T1675 H1730 N1732	T1675-P1737 PolarHBondContact OG1-O 3.48Å; H1730-P1737 PolarHBondContact CE1-O 3.21Å; H1730-P1737 PolarHBondContact ND1-O 2.93Å; H1730-P1737 VanDerWaalsContact ND1-O 3.13Å; N1732-P1737 HydrophobicContact CB-CB 4.28Å
1738	S	85.5	Confident	86.3	Confident	9 Å²	9	31.6 Å²	31.6	6%	0.063	19%	0.187	C	C	.	.			trans	-59.5	136.4	178.2	-72.2	0	0	0	0	111.9	G1674 T1675 S1780	G1674-S1738 VanDerWaalsContact O-O 3.08Å; T1675-S1738 WeakPolarHBondContact CB-O 3.29Å; S1738-S1780 WeakPolarHBondContact OG-CB 3.28Å; S1738-S1780 PolarHBondContact OG-OG 2.82Å
1739	W	91.3	Very high	85.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	135.8	-178	-167.4	35.2	0	0	0	111.2	I1665 T1667 A1673 T1675 V1679 F1705 I1728 L1741 W1778 L1779	I1665-W1739 HydrophobicContact CG2-CH2 3.76Å; I1665-W1739 HydrophobicContact CG2-CZ2 3.61Å; T1667-W1739 PolarHBondContact OG1-NE1 3.23Å; A1673-W1739 WeakPolarHBondContact O-CA 3.4Å; T1675-W1739 HydrophobicContact CG2-CB 3.77Å; T1675-W1739 HydrophobicContact CG2-CD2 3.86Å; T1675-W1739 HydrophobicContact CG2-CG 3.42Å; T1675-W1739 VanDerWaalsContact CG2-CG 3.42Å; V1679-W1739 HydrophobicContact CG1-CH2 3.73Å; V1679-W1739 HydrophobicContact CG1-CZ3 3.71Å; V1679-W1739 HydrophobicContact CG2-CE3 4.24Å; V1679-W1739 HydrophobicContact CG2-CH2 4.03Å; V1679-W1739 HydrophobicContact CG2-CZ2 4.45Å; V1679-W1739 HydrophobicContact CG2-CZ3 3.92Å; F1705-W1739 HydrophobicContact CB-CZ2 4.36Å; F1705-W1739 HydrophobicContact CD1-CH2 4.37Å; F1705-W1739 AromaticContact CD1-CZ2 3.7Å; F1705-W1739 HydrophobicContact CD1-CZ2 3.7Å; F1705-W1739 HydrophobicContact CE1-CZ2 4.27Å; F1705-W1739 HydrophobicContact CG-CZ2 4.17Å; I1728-W1739 HydrophobicContact CD1-CH2 3.64Å; I1728-W1739 HydrophobicContact CD1-CZ3 3.79Å; I1728-W1739 HydrophobicContact CG1-CH2 4.42Å; I1728-W1739 HydrophobicContact CG1-CZ3 4.09Å; W1739-L1741 HydrophobicContact CD2-CB 4.43Å; W1739-L1741 HydrophobicContact CE3-CB 4.4Å; W1739-L1741 HydrophobicContact CH2-CB 4.47Å; W1739-L1741 HydrophobicContact CH2-CD1 3.8Å; W1739-L1741 HydrophobicContact CH2-CD2 4.3Å; W1739-L1741 HydrophobicContact CH2-CG 4.41Å; W1739-L1741 HydrophobicContact CZ2-CB 4.48Å; W1739-L1741 HydrophobicContact CZ2-CD1 3.81Å; W1739-L1741 HydrophobicContact CZ3-CB 4.43Å; W1739-L1741 HydrophobicContact CZ3-CD1 4.49Å; W1739-L1741 HydrophobicContact CZ3-CD2 4.27Å; W1739-W1778 CarbonylContact O-C 3.52Å; W1739-W1778 WeakPolarHBondContact O-CA 3.36Å; W1739-W1778 VanDerWaalsContact O-CE3 3.31Å; W1739-L1779 HydrophobicContact CE3-CB 4.49Å; W1739-L1779 HydrophobicContact CE3-CD1 4.12Å; W1739-L1779 HydrophobicContact CE3-CD2 4.44Å; W1739-L1779 PolarHBondContact N-O 2.81Å; W1739-L1779 PolarHBondContact O-N 3.18Å
1740	Y	91.1	Very high	84.3	Confident	23 Å²	23	32.5 Å²	32.5	9%	0.09	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	103.7	168.9	-173.4	-94.1	0	0	0	110.4	G1668 K1670 A1673 E1776 W1778	G1668-Y1740 PolarHBondContact N-O 3.06Å; K1670-Y1740 HydrophobicContact CB-CD1 4.49Å; K1670-Y1740 HydrophobicContact CD-CD1 3.96Å; K1670-Y1740 HydrophobicContact CD-CD2 3.87Å; K1670-Y1740 HydrophobicContact CD-CE1 3.86Å; K1670-Y1740 HydrophobicContact CD-CE2 3.75Å; K1670-Y1740 HydrophobicContact CD-CG 3.96Å; K1670-Y1740 HydrophobicContact CG-CD1 4.28Å; K1670-Y1740 HydrophobicContact CG-CE1 4.35Å; K1670-Y1740 PolarHBondContact NZ-OH 3.02Å; A1673-Y1740 PolarHBondContact O-N 3.48Å; Y1740-E1776 PolarHBondContact OH-O 2.96Å; Y1740-E1776 VanDerWaalsContact OH-O 3.11Å; Y1740-W1778 AromaticContact CD2-CD1 3.95Å; Y1740-W1778 AromaticContact CD2-CD2 3.72Å; Y1740-W1778 HydrophobicContact CD2-CD2 3.72Å; Y1740-W1778 AromaticContact CD2-CE2 3.76Å; Y1740-W1778 HydrophobicContact CD2-CE3 4.3Å; Y1740-W1778 AromaticContact CD2-CG 3.83Å; Y1740-W1778 HydrophobicContact CD2-CG 3.83Å; Y1740-W1778 HydrophobicContact CD2-CZ2 4.35Å; Y1740-W1778 AromaticContact CD2-NE1 3.91Å; Y1740-W1778 HydrophobicContact CG-CD2 4.36Å
1741	L	90.3	Very high	82.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.6	-177.8	175.4	62.4	0	0	0	110.2	I1665 I1728 W1739 I1744 C1775 E1776 A1777 L1779 F1792	I1665-L1741 HydrophobicContact CG2-CD1 3.59Å; I1728-L1741 HydrophobicContact CD1-CD2 4.11Å; I1728-L1741 HydrophobicContact CG2-CD2 3.58Å; W1739-L1741 HydrophobicContact CD2-CB 4.43Å; W1739-L1741 HydrophobicContact CE3-CB 4.4Å; W1739-L1741 HydrophobicContact CH2-CB 4.47Å; W1739-L1741 HydrophobicContact CH2-CD1 3.8Å; W1739-L1741 HydrophobicContact CH2-CD2 4.3Å; W1739-L1741 HydrophobicContact CH2-CG 4.41Å; W1739-L1741 HydrophobicContact CZ2-CB 4.48Å; W1739-L1741 HydrophobicContact CZ2-CD1 3.81Å; W1739-L1741 HydrophobicContact CZ3-CB 4.43Å; W1739-L1741 HydrophobicContact CZ3-CD1 4.49Å; W1739-L1741 HydrophobicContact CZ3-CD2 4.27Å; L1741-I1744 HydrophobicContact CD1-CG1 4.18Å; L1741-I1744 HydrophobicContact CD2-CD1 4.12Å; L1741-I1744 HydrophobicContact CD2-CG1 4.27Å; L1741-C1775 HydrophobicContact CB-CB 4.34Å; L1741-C1775 HydrophobicContact CD2-CB 3.82Å; L1741-C1775 HydrophobicContact CG-CB 3.64Å; L1741-E1776 WeakPolarHBondContact O-CA 3.19Å; L1741-E1776 PolarHBondContact O-N 3.35Å; L1741-A1777 PolarHBondContact N-O 3.07Å; L1741-A1777 PolarHBondContact O-N 2.92Å; L1741-A1777 VanDerWaalsContact O-N 3.13Å; L1741-L1779 HydrophobicContact CB-CD1 3.84Å; L1741-L1779 HydrophobicContact CD2-CD1 4.27Å; L1741-F1792 HydrophobicContact CD2-CE2 3.93Å
1742	S	88.5	Confident	80.7	Confident	30 Å²	30	40.6 Å²	40.6	21%	0.21	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-61.8	179.1	-158.8	0	0	0	0	111.4	T1666 C1775 E1776	T1666-S1742 WeakPolarHBondContact O-CA 3.32Å; T1666-S1742 VanDerWaalsContact O-CB 3.24Å; T1666-S1742 WeakPolarHBondContact O-CB 3.35Å; T1666-S1742 PolarHBondContact O-N 2.91Å; S1742-C1775 WeakPolarHBondContact O-CB 3.26Å; S1742-C1775 PolarHBondContact O-N 2.93Å; S1742-E1776 PolarHBondContact O-N 3.09Å; S1742-E1776 VanDerWaalsContact O-N 3.12Å
1743	T	91.2	Very high	78.6	Confident	28 Å²	28	46.7 Å²	46.7	17%	0.172	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	154.4	-176.5	59.4	0	0	0	0	112.3	T1666 F1773	T1666-T1743 WeakPolarHBondContact CB-OG1 3.23Å; T1666-T1743 PolarHBondContact N-O 3.38Å; T1666-T1743 PolarHBondContact O-N 2.83Å; T1666-T1743 PolarHBondContact OG1-OG1 3.48Å; T1743-F1773 WeakPolarHBondContact CA-O 3.25Å
1744	I	92.8	Very high	76.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.2	162.8	-55.4	170.7	0	0	0	107.8	V1663 R1664 I1665 I1681 V1726 I1728 L1741 V1746 F1773	V1663-I1744 HydrophobicContact CG1-CG2 3.85Å; R1664-I1744 CarbonylContact O-C 3.48Å; R1664-I1744 VanDerWaalsContact O-CA 3.29Å; R1664-I1744 WeakPolarHBondContact O-CA 3.49Å; I1665-I1744 HydrophobicContact CG1-CG1 4.3Å; I1665-I1744 HydrophobicContact CG1-CG2 4.28Å; I1681-I1744 HydrophobicContact CD1-CG2 4.42Å; V1726-I1744 HydrophobicContact CG1-CD1 4.07Å; V1726-I1744 HydrophobicContact CG2-CD1 4.11Å; I1728-I1744 HydrophobicContact CB-CD1 4.25Å; I1728-I1744 HydrophobicContact CD1-CD1 3.65Å; I1728-I1744 HydrophobicContact CD1-CG1 4.47Å; I1728-I1744 HydrophobicContact CG2-CD1 4.17Å; L1741-I1744 HydrophobicContact CD1-CG1 4.18Å; L1741-I1744 HydrophobicContact CD2-CD1 4.12Å; L1741-I1744 HydrophobicContact CD2-CG1 4.27Å; I1744-V1746 HydrophobicContact CG2-CG2 4.12Å; I1744-F1773 HydrophobicContact CB-CB 4.16Å; I1744-F1773 HydrophobicContact CB-CD2 4.12Å; I1744-F1773 HydrophobicContact CG2-CD2 4.21Å; I1744-F1773 PolarHBondContact N-O 2.97Å; I1744-F1773 PolarHBondContact O-N 3.4Å
1745	E	89.8	Confident	74.5	Confident	34 Å²	34	52.6 Å²	52.6	16%	0.159	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.7	170.9	-42	-166.7	141.9	0	0	109.7	V1663 R1664 F1747 K1770 Y1771	V1663-E1745 CarbonylContact C-O 3.56Å; V1663-E1745 WeakPolarHBondContact CA-O 3.4Å; R1664-E1745 HydrophobicContact CB-CB 4.08Å; R1664-E1745 HydrophobicContact CB-CG 4.38Å; R1664-E1745 HydrophobicContact CG-CB 4.45Å; R1664-E1745 PolarHBondContact N-O 2.72Å; R1664-E1745 PolarHBondContact O-N 2.79Å; E1745-F1747 HydrophobicContact CB-CE2 3.76Å; E1745-F1747 HydrophobicContact CB-CZ 4.3Å; E1745-K1770 WeakPolarHBondContact OE1-CE 3.45Å; E1745-K1770 IonicContact OE1-NZ 2.71Å; E1745-K1770 PolarHBondContact OE1-NZ 2.95Å; E1745-K1770 WeakPolarHBondContact OE2-CE 3.11Å; E1745-K1770 IonicContact OE2-NZ 2.72Å; E1745-K1770 PolarHBondContact OE2-NZ 3.03Å; E1745-Y1771 CarbonylContact C-O 3.01Å; E1745-Y1771 WeakPolarHBondContact CA-O 3.45Å
1746	V	89.3	Confident	72.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.1	179.5	-178.3	0	0	0	0	110.3	Y1661 E1662 V1663 L1683 I1723 I1744 Y1771 F1773	Y1661-V1746 HydrophobicContact CD1-CG1 3.83Å; E1662-V1746 CarbonylContact O-C 3.56Å; E1662-V1746 WeakPolarHBondContact O-CA 2.97Å; V1663-V1746 HydrophobicContact CG1-CG2 4.34Å; V1663-V1746 HydrophobicContact CG2-CG1 4.47Å; V1663-V1746 HydrophobicContact CG2-CG2 4.24Å; L1683-V1746 HydrophobicContact CD1-CG1 4.07Å; L1683-V1746 HydrophobicContact CD2-CG2 3.87Å; I1723-V1746 HydrophobicContact CG1-CG1 4.48Å; I1744-V1746 HydrophobicContact CG2-CG2 4.12Å; V1746-Y1771 PolarHBondContact N-O 3.16Å; V1746-Y1771 WeakPolarHBondContact O-CD2 3.37Å; V1746-Y1771 PolarHBondContact O-N 3.33Å; V1746-F1773 HydrophobicContact CB-CE2 4.39Å; V1746-F1773 HydrophobicContact CG2-CD2 4.37Å; V1746-F1773 HydrophobicContact CG2-CE2 3.77Å
1747	F	83.9	Confident	70.1	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.083	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	134.1	180	-53	-103.4	0	0	0	109.3	Y1661 E1662 R1664 E1745 I1749 L1768 K1770	Y1661-F1747 CarbonylContact C-O 3.57Å; Y1661-F1747 VanDerWaalsContact CA-O 3.26Å; Y1661-F1747 WeakPolarHBondContact CA-O 3.4Å; E1662-F1747 HydrophobicContact CB-CB 4.34Å; E1662-F1747 PolarHBondContact N-O 3.28Å; E1662-F1747 PolarHBondContact O-N 2.96Å; R1664-F1747 HydrophobicContact CG-CD2 4.45Å; R1664-F1747 HydrophobicContact CG-CE2 3.91Å; E1745-F1747 HydrophobicContact CB-CE2 3.76Å; E1745-F1747 HydrophobicContact CB-CZ 4.3Å; F1747-I1749 HydrophobicContact CB-CG2 4.21Å; F1747-I1749 PolarHBondContact O-N 2.9Å; F1747-L1768 HydrophobicContact CD1-CB 4.38Å; F1747-K1770 HydrophobicContact CD1-CB 4.04Å; F1747-K1770 HydrophobicContact CD1-CG 4.19Å; F1747-K1770 HydrophobicContact CE1-CB 3.76Å; F1747-K1770 HydrophobicContact CE1-CD 3.71Å; F1747-K1770 HydrophobicContact CE1-CG 3.58Å; F1747-K1770 HydrophobicContact CE2-CG 4.48Å; F1747-K1770 HydrophobicContact CZ-CB 4.44Å; F1747-K1770 HydrophobicContact CZ-CD 3.73Å; F1747-K1770 HydrophobicContact CZ-CG 3.75Å
1748	N	78.6	Confident	67.6	Low	16 Å²	16	62.7 Å²	62.7	9%	0.086	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	105	168.2	-177.8	-42.3	0	0	0	108.4	N1659 Y1661 S1750	N1659-N1748 PolarHBondContact ND2-ND2 2.75Å; Y1661-N1748 HydrophobicContact CD1-CB 4.05Å; Y1661-N1748 HydrophobicContact CE1-CB 3.82Å; Y1661-N1748 PolarHBondContact OH-ND2 2.91Å; N1748-S1750 PolarHBondContact OD1-N 3.05Å; N1748-S1750 PolarHBondContact OD1-OG 2.78Å
1749	I	75.7	Confident	64.8	Low	33 Å²	33	71 Å²	71	17%	0.169	39%	0.387	C	S	.	.			trans	-91.4	-21.2	-174.4	59.1	167.4	0	0	0	112.8	T1660 E1662 Q1714 F1747 K1751 S1752	T1660-I1749 HydrophobicContact CG2-CD1 3.94Å; T1660-I1749 HydrophobicContact CG2-CG1 4.06Å; T1660-I1749 VanDerWaalsContact O-CG1 3.23Å; T1660-I1749 WeakPolarHBondContact O-CG1 3.3Å; T1660-I1749 PolarHBondContact O-N 2.88Å; E1662-I1749 HydrophobicContact CB-CD1 4.43Å; E1662-I1749 HydrophobicContact CB-CG2 3.99Å; Q1714-I1749 HydrophobicContact CG-CD1 4.27Å; F1747-I1749 HydrophobicContact CB-CG2 4.21Å; F1747-I1749 PolarHBondContact O-N 2.9Å; I1749-K1751 PolarHBondContact O-N 2.79Å; I1749-S1752 PolarHBondContact O-N 3.22Å; I1749-S1752 VanDerWaalsContact O-N 3.13Å; I1749-S1752 PolarHBondContact O-OG 2.93Å
1750	S	65.4	Low	61.9	Low	35 Å²	35	78 Å²	78	25%	0.245	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.4	177.1	24.2	0	0	0	0	115.5	N1659 T1660 N1748	N1659-S1750 VanDerWaalsContact CA-OG 3.25Å; N1659-S1750 WeakPolarHBondContact CA-OG 3.49Å; N1659-S1750 VanDerWaalsContact CB-OG 3.23Å; N1659-S1750 WeakPolarHBondContact CB-OG 3.46Å; N1659-S1750 PolarHBondContact OD1-OG 2.93Å; T1660-S1750 PolarHBondContact N-OG 2.9Å; T1660-S1750 PolarHBondContact O-N 3.03Å; T1660-S1750 PolarHBondContact O-OG 3.31Å; N1748-S1750 PolarHBondContact OD1-N 3.05Å; N1748-S1750 PolarHBondContact OD1-OG 2.78Å
1751	K	53.8	Low	59	Low	153 Å²	153	86 Å²	86	67%	0.665	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-3.8	176.9	-70.6	-172.1	177.7	-176.2	0	115.2	I1749	I1749-K1751 PolarHBondContact O-N 2.79Å
1752	S	45.8	Very low	56.3	Low	87 Å²	87	91.2 Å²	91.2	61%	0.608	50%	0.496	S	S	*	.	S	Bend	trans	-96.9	-9.7	-176.1	67	0	0	0	0	115.7	I1749	I1749-S1752 PolarHBondContact O-N 3.22Å; I1749-S1752 VanDerWaalsContact O-N 3.13Å; I1749-S1752 PolarHBondContact O-OG 2.93Å
1753	Q	41.1	Very low	53.4	Low	177 Å²	177	97.3 Å²	97.3	83%	0.827	53%	0.526	S	S	*	.	S	Bend	trans	-102	6.7	-166.6	-70.2	-172.3	-29.8	0	0	115.9
1754	S	39.3	Very low	50.5	Low	105 Å²	105	105.2 Å²	105.2	73%	0.734	56%	0.561	S	S	*	*			trans	-104.9	35.8	-171.6	70.3	0	0	0	0	115.6
1755	V	32.4	Very low	47.7	Very low	119 Å²	119	110.5 Å²	110.5	72%	0.721	59%	0.594	S	S	*	*			trans	-138.8	104.4	166.9	-172.8	0	0	0	0	110.9
1756	H	32.6	Very low	45.1	Very low	207 Å²	207	118.1 Å²	118.1	96%	0.958	63%	0.629	S	S	*	*			trans	-139.7	89.6	163	-105.6	39.7	0	0	0	108
1757	G	30.4	Very low	42.9	Very low	65 Å²	65	124.7 Å²	124.7	67%	0.67	66%	0.66	S	S	*	*	S	Bend	trans	152.8	63	-178.5	0	0	0	0	0	115.5
1758	L	30.1	Very low	41.5	Very low	176 Å²	176	128.4 Å²	128.4	92%	0.921	68%	0.68	S	S	*	*			trans	172.4	158.1	141.2	-92.5	161	0	0	0	109.1
1759	K	28.2	Very low	40.6	Very low	185 Å²	185	131.5 Å²	131.5	80%	0.804	70%	0.699	S	S	*	*			trans	-107.6	171.8	-177.5	-76.2	-173	173.9	-177.4	0	112
1760	D	30.2	Very low	40.5	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	71%	0.706	S	S	*	*			trans	74.6	72.4	159.3	-51.2	-29.4	0	0	0	118.3
1761	Q	29.6	Very low	41.3	Very low	192 Å²	192	132.9 Å²	132.9	90%	0.897	70%	0.699	S	S	*	*				-166.7	147.5	114.3	-102.7	170.4	50.1	0	0	111.9
1762	P	32.9	Very low	42.8	Very low	110 Å²	110	126.5 Å²	126.5	71%	0.714	67%	0.672	S	S	*	*			trans	-92.2	161.3	-179.7	36.1	-34.3	0	0	0	113.7
1763	N	29.1	Very low	44.8	Very low	157 Å²	157	122.4 Å²	122.4	84%	0.84	64%	0.643	S	S	*	*			trans	78.4	76	171.2	-55.8	-21.1	0	0	0	118.4
1764	E	29.9	Very low	46.8	Very low	194 Å²	194	117.4 Å²	117.4	91%	0.907	62%	0.622	S	S	*	*			trans	-152.6	146.4	133.9	-120.4	174.2	-146.5	0	0	110.1
1765	T	34	Very low	49	Very low	112 Å²	112	113 Å²	113	69%	0.687	59%	0.591	S	S	*	*			trans	-106.2	113.7	-174.3	48.5	0	0	0	0	111.6	H1767	T1765-H1767 PolarHBondContact O-CE1 3.32Å; T1765-H1767 VanDerWaalsContact O-CE1 3.22Å; T1765-H1767 PolarHBondContact O-N 2.96Å; T1765-H1767 PolarHBondContact O-ND1 2.67Å
1766	H	35	Very low	51.5	Low	193 Å²	193	113.9 Å²	113.9	89%	0.894	59%	0.587	S	S	*	*			trans	-67.3	114.7	-179.5	-72.4	-70.2	0	0	0	112.2
1767	H	44	Very low	54	Low	139 Å²	139	104.8 Å²	104.8	64%	0.644	55%	0.548	S	S	*	.			trans	-83.8	122.9	-177.6	-54.9	-43	0	0	0	112.7	T1765	T1765-H1767 PolarHBondContact O-CE1 3.32Å; T1765-H1767 VanDerWaalsContact O-CE1 3.22Å; T1765-H1767 PolarHBondContact O-N 2.96Å; T1765-H1767 PolarHBondContact O-ND1 2.67Å
1768	L	54	Low	56.6	Low	97 Å²	97	103.2 Å²	103.2	51%	0.508	52%	0.522	S	S	.	.			trans	-68.1	132.7	170.4	-73.5	165.8	0	0	0	111	F1747 K1770	F1747-L1768 HydrophobicContact CD1-CB 4.38Å; L1768-K1770 PolarHBondContact O-N 2.79Å
1769	V	60.2	Low	59.3	Low	81 Å²	81	94.8 Å²	94.8	49%	0.491	48%	0.478	S	S	.	.			trans	-78.3	106.5	174.4	-177.1	0	0	0	0	109.4	Y1771	V1769-Y1771 HydrophobicContact CG1-CE1 4.31Å; V1769-Y1771 HydrophobicContact CG1-CE2 3.92Å
1770	K	73.3	Confident	62	Low	74 Å²	74	86 Å²	86	32%	0.322	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	129.2	177.5	-176.1	178.6	-175.4	176.8	0	110.8	E1745 F1747 L1768 I1772	E1745-K1770 WeakPolarHBondContact OE1-CE 3.45Å; E1745-K1770 IonicContact OE1-NZ 2.71Å; E1745-K1770 PolarHBondContact OE1-NZ 2.95Å; E1745-K1770 WeakPolarHBondContact OE2-CE 3.11Å; E1745-K1770 IonicContact OE2-NZ 2.72Å; E1745-K1770 PolarHBondContact OE2-NZ 3.03Å; F1747-K1770 HydrophobicContact CD1-CB 4.04Å; F1747-K1770 HydrophobicContact CD1-CG 4.19Å; F1747-K1770 HydrophobicContact CE1-CB 3.76Å; F1747-K1770 HydrophobicContact CE1-CD 3.71Å; F1747-K1770 HydrophobicContact CE1-CG 3.58Å; F1747-K1770 HydrophobicContact CE2-CG 4.48Å; F1747-K1770 HydrophobicContact CZ-CB 4.44Å; F1747-K1770 HydrophobicContact CZ-CD 3.73Å; F1747-K1770 HydrophobicContact CZ-CG 3.75Å; L1768-K1770 PolarHBondContact O-N 2.79Å; K1770-I1772 HydrophobicContact CD-CD1 4.09Å; K1770-I1772 HydrophobicContact CD-CG1 4.16Å; K1770-I1772 HydrophobicContact CG-CD1 4.48Å; K1770-I1772 HydrophobicContact CG-CG1 4.03Å
1771	Y	82.5	Confident	64.5	Low	22 Å²	22	81.9 Å²	81.9	9%	0.086	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.5	167.7	-53.3	-89.6	0	0	0	108.4	K1722 I1723 E1745 V1746 V1769	K1722-Y1771 WeakPolarHBondContact CA-OH 3.33Å; K1722-Y1771 HydrophobicContact CG-CE1 3.93Å; I1723-Y1771 HydrophobicContact CB-CD1 4.07Å; I1723-Y1771 HydrophobicContact CB-CD2 4.2Å; I1723-Y1771 HydrophobicContact CB-CE1 4.32Å; I1723-Y1771 HydrophobicContact CB-CE2 4.45Å; I1723-Y1771 HydrophobicContact CB-CG 4.02Å; I1723-Y1771 HydrophobicContact CG1-CD2 3.92Å; I1723-Y1771 HydrophobicContact CG1-CE2 3.93Å; I1723-Y1771 HydrophobicContact CG1-CG 4.27Å; I1723-Y1771 VanDerWaalsContact O-CD1 3.29Å; I1723-Y1771 WeakPolarHBondContact O-CD1 3.48Å; E1745-Y1771 CarbonylContact C-O 3.01Å; E1745-Y1771 WeakPolarHBondContact CA-O 3.45Å; V1746-Y1771 PolarHBondContact N-O 3.16Å; V1746-Y1771 WeakPolarHBondContact O-CD2 3.37Å; V1746-Y1771 PolarHBondContact O-N 3.33Å; V1769-Y1771 HydrophobicContact CG1-CE1 4.31Å; V1769-Y1771 HydrophobicContact CG1-CE2 3.92Å
1772	I	83.8	Confident	66.9	Low	20 Å²	20	79.7 Å²	79.7	10%	0.103	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	138	179.3	-55.3	-176.7	0	0	0	109.3	K1770 A1794 E1795 I1797	K1770-I1772 HydrophobicContact CD-CD1 4.09Å; K1770-I1772 HydrophobicContact CD-CG1 4.16Å; K1770-I1772 HydrophobicContact CG-CD1 4.48Å; K1770-I1772 HydrophobicContact CG-CG1 4.03Å; I1772-A1794 CarbonylContact O-C 3.4Å; I1772-A1794 WeakPolarHBondContact O-CA 3.47Å; I1772-E1795 PolarHBondContact N-O 2.8Å; I1772-E1795 PolarHBondContact O-N 2.88Å; I1772-I1797 HydrophobicContact CD1-CD1 3.74Å
1773	F	87.3	Confident	69.2	Low	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	104.9	173	-54.3	-92.9	0	0	0	107.9	I1723 V1726 T1743 I1744 V1746 C1775 F1792 S1793 A1794	I1723-F1773 HydrophobicContact CG2-CZ 3.75Å; V1726-F1773 HydrophobicContact CB-CD1 4.03Å; V1726-F1773 HydrophobicContact CB-CE1 3.95Å; V1726-F1773 HydrophobicContact CB-CE2 4.47Å; V1726-F1773 HydrophobicContact CB-CG 4.33Å; V1726-F1773 HydrophobicContact CB-CZ 4.19Å; V1726-F1773 HydrophobicContact CG1-CB 4.01Å; V1726-F1773 HydrophobicContact CG1-CD1 3.39Å; V1726-F1773 HydrophobicContact CG1-CD2 4.14Å; V1726-F1773 HydrophobicContact CG1-CE1 3.84Å; V1726-F1773 HydrophobicContact CG1-CG 3.57Å; V1726-F1773 HydrophobicContact CG1-CZ 4.39Å; T1743-F1773 WeakPolarHBondContact CA-O 3.25Å; I1744-F1773 HydrophobicContact CB-CB 4.16Å; I1744-F1773 HydrophobicContact CB-CD2 4.12Å; I1744-F1773 HydrophobicContact CG2-CD2 4.21Å; I1744-F1773 PolarHBondContact N-O 2.97Å; I1744-F1773 PolarHBondContact O-N 3.4Å; V1746-F1773 HydrophobicContact CB-CE2 4.39Å; V1746-F1773 HydrophobicContact CG2-CD2 4.37Å; V1746-F1773 HydrophobicContact CG2-CE2 3.77Å; F1773-C1775 PolarHBondContact O-N 2.99Å; F1773-C1775 PolarHBondContact O-SG 3.11Å; F1773-F1792 HydrophobicContact CB-CB 4.22Å; F1773-F1792 HydrophobicContact CD1-CB 4.43Å; F1773-S1793 WeakPolarHBondContact CD1-O 3.46Å; F1773-A1794 HydrophobicContact CD1-CB 4.05Å; F1773-A1794 HydrophobicContact CE1-CB 3.38Å; F1773-A1794 HydrophobicContact CE2-CB 4.44Å; F1773-A1794 HydrophobicContact CZ-CB 3.61Å
1774	N	83.7	Confident	70.4	Confident	72 Å²	72	75.9 Å²	75.9	39%	0.385	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.4	171.4	-63.2	-33.1	0	0	0	107.9	E1795	N1774-E1795 PolarHBondContact ND2-OE1 3.37Å; N1774-E1795 PolarHBondContact ND2-OE2 3.13Å
1775	C	85.7	Confident	72	Confident	12 Å²	12	73.4 Å²	73.4	8%	0.081	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-49.6	-169.6	-61.3	0	0	0	0	112	L1741 S1742 F1773 A1777 F1792	L1741-C1775 HydrophobicContact CB-CB 4.34Å; L1741-C1775 HydrophobicContact CD2-CB 3.82Å; L1741-C1775 HydrophobicContact CG-CB 3.64Å; S1742-C1775 WeakPolarHBondContact O-CB 3.26Å; S1742-C1775 PolarHBondContact O-N 2.93Å; F1773-C1775 PolarHBondContact O-N 2.99Å; F1773-C1775 PolarHBondContact O-SG 3.11Å; C1775-A1777 VanDerWaalsContact O-CB 3.28Å; C1775-A1777 WeakPolarHBondContact O-CB 3.36Å; C1775-A1777 PolarHBondContact O-N 2.87Å; C1775-F1792 VanDerWaalsContact CA-CE1 3.5Å; C1775-F1792 HydrophobicContact CB-CD1 4.08Å; C1775-F1792 HydrophobicContact CB-CD2 4.27Å; C1775-F1792 HydrophobicContact CB-CE1 3.75Å; C1775-F1792 HydrophobicContact CB-CE2 3.94Å; C1775-F1792 HydrophobicContact CB-CG 4.32Å; C1775-F1792 HydrophobicContact CB-CZ 3.66Å; C1775-F1792 WeakPolarHBondContact O-CE1 3.33Å; C1775-F1792 VanDerWaalsContact SG-CD2 3.56Å
1776	E	85.5	Confident	74.1	Confident	139 Å²	139	75 Å²	75	65%	0.65	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	40.3	38.1	176.2	-56.9	-160.1	145.5	0	0	116.1	Y1740 L1741 S1742	Y1740-E1776 PolarHBondContact OH-O 2.96Å; Y1740-E1776 VanDerWaalsContact OH-O 3.11Å; L1741-E1776 WeakPolarHBondContact O-CA 3.19Å; L1741-E1776 PolarHBondContact O-N 3.35Å; S1742-E1776 PolarHBondContact O-N 3.09Å; S1742-E1776 VanDerWaalsContact O-N 3.12Å
1777	A	83.9	Confident	76	Confident	15 Å²	15	68.1 Å²	68.1	12%	0.124	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	147.6	-168.1	0	0	0	0	0	113.7	L1741 C1775 F1792	L1741-A1777 PolarHBondContact N-O 3.07Å; L1741-A1777 PolarHBondContact O-N 2.92Å; L1741-A1777 VanDerWaalsContact O-N 3.13Å; C1775-A1777 VanDerWaalsContact O-CB 3.28Å; C1775-A1777 WeakPolarHBondContact O-CB 3.36Å; C1775-A1777 PolarHBondContact O-N 2.87Å; A1777-F1792 HydrophobicContact CB-CE1 4.37Å; A1777-F1792 HydrophobicContact CB-CZ 4.25Å
1778	W	87	Confident	78	Confident	32 Å²	32	64 Å²	64	12%	0.121	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.7	168.4	-73.4	111	0	0	0	111	K1670 Y1672 W1739 Y1740 H1783 R1790	K1670-W1778 HydrophobicContact CB-CZ2 4.38Å; K1670-W1778 HydrophobicContact CD-CZ2 4.38Å; Y1672-W1778 WeakPolarHBondContact O-CZ3 3.03Å; W1739-W1778 CarbonylContact O-C 3.52Å; W1739-W1778 WeakPolarHBondContact O-CA 3.36Å; W1739-W1778 VanDerWaalsContact O-CE3 3.31Å; Y1740-W1778 AromaticContact CD2-CD1 3.95Å; Y1740-W1778 AromaticContact CD2-CD2 3.72Å; Y1740-W1778 HydrophobicContact CD2-CD2 3.72Å; Y1740-W1778 AromaticContact CD2-CE2 3.76Å; Y1740-W1778 HydrophobicContact CD2-CE3 4.3Å; Y1740-W1778 AromaticContact CD2-CG 3.83Å; Y1740-W1778 HydrophobicContact CD2-CG 3.83Å; Y1740-W1778 HydrophobicContact CD2-CZ2 4.35Å; Y1740-W1778 AromaticContact CD2-NE1 3.91Å; Y1740-W1778 HydrophobicContact CG-CD2 4.36Å; W1778-H1783 HydrophobicContact CB-CB 3.93Å; W1778-H1783 HydrophobicContact CD2-CB 3.76Å; W1778-H1783 AromaticContact CD2-CD2 3.61Å; W1778-H1783 AromaticContact CD2-CG 3.64Å; W1778-H1783 AromaticContact CE2-CD2 3.84Å; W1778-H1783 AromaticContact CE2-CG 3.72Å; W1778-H1783 AromaticContact CE2-ND1 3.96Å; W1778-H1783 HydrophobicContact CE3-CB 4.27Å; W1778-H1783 AromaticContact CE3-CD2 3.38Å; W1778-H1783 AromaticContact CE3-CG 3.92Å; W1778-H1783 HydrophobicContact CG-CB 3.58Å; W1778-H1783 AromaticContact CH2-CD2 3.72Å; W1778-H1783 AromaticContact CH2-NE2 3.49Å; W1778-H1783 WeakPolarHBondContact CH2-NE2 3.48Å; W1778-H1783 AromaticContact CZ2-CD2 3.92Å; W1778-H1783 AromaticContact CZ2-CE1 3.88Å; W1778-H1783 AromaticContact CZ2-NE2 3.78Å; W1778-H1783 AromaticContact CZ3-CD2 3.44Å; W1778-H1783 VanDerWaalsContact CZ3-CD2 3.44Å; W1778-H1783 WeakPolarHBondContact CZ3-CD2 3.41Å; W1778-H1783 AromaticContact CZ3-NE2 3.64Å; W1778-R1790 VanDerWaalsContact O-CZ 3.22Å; W1778-R1790 PolarHBondContact O-NE 3.45Å; W1778-R1790 PolarHBondContact O-NH2 2.83Å
1779	L	86.8	Confident	79.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	105.6	157.1	-63.5	87.3	0	0	0	106.8	I1728 H1730 W1739 L1741 V1787 R1790	I1728-L1779 HydrophobicContact CG2-CD2 4.43Å; H1730-L1779 PolarHBondContact CE1-O 2.88Å; H1730-L1779 VanDerWaalsContact NE2-C 3.27Å; H1730-L1779 WeakPolarHBondContact NE2-CB 3.45Å; H1730-L1779 PolarHBondContact NE2-O 3.5Å; W1739-L1779 HydrophobicContact CE3-CB 4.49Å; W1739-L1779 HydrophobicContact CE3-CD1 4.12Å; W1739-L1779 HydrophobicContact CE3-CD2 4.44Å; W1739-L1779 PolarHBondContact N-O 2.81Å; W1739-L1779 PolarHBondContact O-N 3.18Å; L1741-L1779 HydrophobicContact CB-CD1 3.84Å; L1741-L1779 HydrophobicContact CD2-CD1 4.27Å; L1779-V1787 VanDerWaalsContact CA-O 3.26Å; L1779-V1787 WeakPolarHBondContact CA-O 3.05Å; L1779-R1790 HydrophobicContact CD2-CG 4.38Å; L1779-R1790 HydrophobicContact CG-CG 4.24Å
1780	S	84.2	Confident	80.5	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.007	30%	0.295	C	S	.	.			trans	-167.5	156	-169	174.4	0	0	0	0	110.6	S1738 E1782 H1783 K1786 V1787	S1738-S1780 WeakPolarHBondContact OG-CB 3.28Å; S1738-S1780 PolarHBondContact OG-OG 2.82Å; S1780-E1782 PolarHBondContact OG-N 2.87Å; S1780-H1783 PolarHBondContact OG-N 2.74Å; S1780-H1783 VanDerWaalsContact OG-N 3.17Å; S1780-K1786 CarbonylContact O-C 3.54Å; S1780-K1786 VanDerWaalsContact O-CA 3.26Å; S1780-K1786 WeakPolarHBondContact O-CA 3.5Å; S1780-V1787 PolarHBondContact N-O 2.91Å; S1780-V1787 PolarHBondContact O-N 2.62Å
1781	T	82.3	Confident	81.1	Confident	58 Å²	58	61.9 Å²	61.9	36%	0.356	30%	0.303	S	S	.	.	S	Bend	trans	-89.2	-11.6	167.5	40.2	0	0	0	0	113.5	N1732 K1786 L1788	N1732-T1781 PolarHBondContact OD1-OG1 2.7Å; T1781-K1786 VanDerWaalsContact O-CD 3.28Å; T1781-K1786 WeakPolarHBondContact O-CD 3.44Å; T1781-K1786 WeakPolarHBondContact O-CE 3.47Å; T1781-K1786 WeakPolarHBondContact O-CG 3.42Å; T1781-K1786 PolarHBondContact O-NZ 2.81Å; T1781-L1788 HydrophobicContact CG2-CD1 4.04Å; T1781-L1788 HydrophobicContact CG2-CD2 4.02Å; T1781-L1788 HydrophobicContact CG2-CG 4.29Å
1782	E	79.4	Confident	81.1	Confident	145 Å²	145	62 Å²	62	68%	0.678	30%	0.304	S	S	*	.	S	Bend	trans	-110.7	-37.1	-168.2	-59.3	-174.5	146.9	0	0	112.5	S1780	S1780-E1782 PolarHBondContact OG-N 2.87Å
1783	H	81.5	Confident	80.8	Confident	58 Å²	58	64.6 Å²	64.6	27%	0.269	32%	0.324	S	S	.	.	S	Bend	trans	-81.1	174.2	173.7	-69.3	-66.1	0	0	0	113.2	W1778 S1780 K1786	W1778-H1783 HydrophobicContact CB-CB 3.93Å; W1778-H1783 HydrophobicContact CD2-CB 3.76Å; W1778-H1783 AromaticContact CD2-CD2 3.61Å; W1778-H1783 AromaticContact CD2-CG 3.64Å; W1778-H1783 AromaticContact CE2-CD2 3.84Å; W1778-H1783 AromaticContact CE2-CG 3.72Å; W1778-H1783 AromaticContact CE2-ND1 3.96Å; W1778-H1783 HydrophobicContact CE3-CB 4.27Å; W1778-H1783 AromaticContact CE3-CD2 3.38Å; W1778-H1783 AromaticContact CE3-CG 3.92Å; W1778-H1783 HydrophobicContact CG-CB 3.58Å; W1778-H1783 AromaticContact CH2-CD2 3.72Å; W1778-H1783 AromaticContact CH2-NE2 3.49Å; W1778-H1783 WeakPolarHBondContact CH2-NE2 3.48Å; W1778-H1783 AromaticContact CZ2-CD2 3.92Å; W1778-H1783 AromaticContact CZ2-CE1 3.88Å; W1778-H1783 AromaticContact CZ2-NE2 3.78Å; W1778-H1783 AromaticContact CZ3-CD2 3.44Å; W1778-H1783 VanDerWaalsContact CZ3-CD2 3.44Å; W1778-H1783 WeakPolarHBondContact CZ3-CD2 3.41Å; W1778-H1783 AromaticContact CZ3-NE2 3.64Å; S1780-H1783 PolarHBondContact OG-N 2.74Å; S1780-H1783 VanDerWaalsContact OG-N 3.17Å; H1783-K1786 WeakPolarHBondContact O-CG 3.32Å; H1783-K1786 PolarHBondContact O-N 2.9Å
1784	D	53.8	Low	80.1	Confident	129 Å²	129	65.7 Å²	65.7	69%	0.69	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-53.4	148.9	-173.3	-57.9	-60.9	0	0	0	113.8	K1786	D1784-K1786 PolarHBondContact O-N 2.97Å
1785	E	65	Low	79.2	Confident	143 Å²	143	67.2 Å²	67.2	67%	0.668	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	66.3	-25	-170.1	-51.2	-174.6	150.8	0	0	116.2	V1787 R1790	E1785-V1787 VanDerWaalsContact C-N 3.34Å; E1785-V1787 HydrophobicContact CB-CG2 4.12Å; E1785-V1787 WeakPolarHBondContact O-CG2 3.28Å; E1785-V1787 PolarHBondContact O-N 3.03Å; E1785-R1790 IonicContact OE2-CZ 3.27Å; E1785-R1790 IonicContact OE2-NH1 3.74Å; E1785-R1790 PolarHBondContact OE2-NH1 3.04Å; E1785-R1790 IonicContact OE2-NH2 3.6Å; E1785-R1790 PolarHBondContact OE2-NH2 2.76Å
1786	K	78.4	Confident	77.7	Confident	144 Å²	144	70.2 Å²	70.2	63%	0.626	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	56.4	38.6	178.8	-58	-165.7	169.7	-145.6	0	115	S1780 T1781 H1783 D1784	S1780-K1786 CarbonylContact O-C 3.54Å; S1780-K1786 VanDerWaalsContact O-CA 3.26Å; S1780-K1786 WeakPolarHBondContact O-CA 3.5Å; T1781-K1786 VanDerWaalsContact O-CD 3.28Å; T1781-K1786 WeakPolarHBondContact O-CD 3.44Å; T1781-K1786 WeakPolarHBondContact O-CE 3.47Å; T1781-K1786 WeakPolarHBondContact O-CG 3.42Å; T1781-K1786 PolarHBondContact O-NZ 2.81Å; H1783-K1786 WeakPolarHBondContact O-CG 3.32Å; H1783-K1786 PolarHBondContact O-N 2.9Å; D1784-K1786 PolarHBondContact O-N 2.97Å
1787	V	74	Confident	75.7	Confident	50 Å²	50	69.2 Å²	69.2	30%	0.303	35%	0.35	S	S	.	.			trans	-106.5	133	-175.9	176.3	0	0	0	0	111.1	L1779 S1780 E1785 D1789 R1790	L1779-V1787 VanDerWaalsContact CA-O 3.26Å; L1779-V1787 WeakPolarHBondContact CA-O 3.05Å; S1780-V1787 PolarHBondContact N-O 2.91Å; S1780-V1787 PolarHBondContact O-N 2.62Å; E1785-V1787 VanDerWaalsContact C-N 3.34Å; E1785-V1787 HydrophobicContact CB-CG2 4.12Å; E1785-V1787 WeakPolarHBondContact O-CG2 3.28Å; E1785-V1787 PolarHBondContact O-N 3.03Å; V1787-D1789 WeakPolarHBondContact CG1-O 3.31Å; V1787-R1790 HydrophobicContact CG1-CG 3.95Å
1788	L	84.8	Confident	73.4	Confident	51 Å²	51	74 Å²	74	27%	0.267	37%	0.368	S	S	.	.	S	Bend	trans	-104.8	-2.3	178.2	-54.8	174.4	0	0	0	114.1	R1729 H1730 N1732 T1781	R1729-L1788 WeakPolarHBondContact CA-O 3.45Å; R1729-L1788 VanDerWaalsContact CB-O 3.25Å; R1729-L1788 WeakPolarHBondContact CB-O 3.29Å; H1730-L1788 PolarHBondContact CD2-O 2.82Å; H1730-L1788 PolarHBondContact N-O 3.14Å; H1730-L1788 VanDerWaalsContact N-O 3.14Å; H1730-L1788 WeakPolarHBondContact NE2-CD2 3.29Å; N1732-L1788 HydrophobicContact CB-CD1 3.98Å; N1732-L1788 HydrophobicContact CB-CD2 4.28Å; N1732-L1788 WeakPolarHBondContact OD1-CD2 3.36Å; T1781-L1788 HydrophobicContact CG2-CD1 4.04Å; T1781-L1788 HydrophobicContact CG2-CD2 4.02Å; T1781-L1788 HydrophobicContact CG2-CG 4.29Å
1789	D	86.6	Confident	70.8	Confident	59 Å²	59	77.1 Å²	77.1	32%	0.316	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	115.8	-172.1	178.9	13.4	0	0	0	110	R1727 R1729 V1787	R1727-D1789 VanDerWaalsContact CG-OD1 3.31Å; R1727-D1789 WeakPolarHBondContact CG-OD1 3.35Å; R1727-D1789 IonicContact CZ-OD1 3.18Å; R1727-D1789 IonicContact CZ-OD2 2.69Å; R1727-D1789 IonicContact NE-OD1 3.81Å; R1727-D1789 PolarHBondContact NE-OD1 2.79Å; R1727-D1789 IonicContact NE-OD2 2.66Å; R1727-D1789 PolarHBondContact NE-OD2 2.82Å; R1727-D1789 IonicContact NH2-OD1 2.75Å; R1727-D1789 IonicContact NH2-OD2 3.64Å; R1727-D1789 PolarHBondContact NH2-OD2 2.87Å; R1729-D1789 HydrophobicContact CB-CB 3.75Å; V1787-D1789 WeakPolarHBondContact CG1-O 3.31Å
1790	R	81.9	Confident	68.3	Low	38 Å²	38	85.7 Å²	85.7	14%	0.143	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	152	-173	-67.4	-174.7	178.6	-87.9	0.1	112.1	R1727 I1728 W1778 L1779 E1785 V1787 F1792	R1727-R1790 CarbonylContact C-O 3.57Å; R1727-R1790 VanDerWaalsContact CA-O 3.29Å; R1727-R1790 WeakPolarHBondContact CA-O 3.48Å; I1728-R1790 PolarHBondContact N-O 2.82Å; I1728-R1790 PolarHBondContact O-N 2.82Å; W1778-R1790 VanDerWaalsContact O-CZ 3.22Å; W1778-R1790 PolarHBondContact O-NE 3.45Å; W1778-R1790 PolarHBondContact O-NH2 2.83Å; L1779-R1790 HydrophobicContact CD2-CG 4.38Å; L1779-R1790 HydrophobicContact CG-CG 4.24Å; E1785-R1790 IonicContact OE2-CZ 3.27Å; E1785-R1790 IonicContact OE2-NH1 3.74Å; E1785-R1790 PolarHBondContact OE2-NH1 3.04Å; E1785-R1790 IonicContact OE2-NH2 3.6Å; E1785-R1790 PolarHBondContact OE2-NH2 2.76Å; V1787-R1790 HydrophobicContact CG1-CG 3.95Å; R1790-F1792 HydrophobicContact CB-CD2 4.42Å; R1790-F1792 HydrophobicContact CB-CE2 3.62Å; R1790-F1792 HydrophobicContact CB-CZ 3.69Å; R1790-F1792 HydrophobicContact CG-CZ 4.29Å
1791	F	85.4	Confident	66	Low	111 Å²	111	93.4 Å²	93.4	49%	0.487	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.6	170.1	-68.4	-98	0	0	0	110.2	F1684 K1725 V1726 R1727	F1684-F1791 HydrophobicContact CE2-CD1 4.27Å; F1684-F1791 AromaticContact CE2-CE1 3.99Å; F1684-F1791 HydrophobicContact CE2-CE1 3.99Å; F1684-F1791 AromaticContact CZ-CE1 3.86Å; F1684-F1791 HydrophobicContact CZ-CE1 3.86Å; K1725-F1791 HydrophobicContact CD-CD1 3.87Å; K1725-F1791 HydrophobicContact CG-CD1 4.4Å; V1726-F1791 CarbonylContact O-C 3.56Å; V1726-F1791 VanDerWaalsContact O-CA 3.27Å; V1726-F1791 WeakPolarHBondContact O-CA 3.42Å; R1727-F1791 HydrophobicContact CB-CD1 3.66Å; R1727-F1791 HydrophobicContact CB-CE1 3.6Å; R1727-F1791 HydrophobicContact CB-CG 4.3Å; R1727-F1791 HydrophobicContact CB-CZ 4.17Å; R1727-F1791 HydrophobicContact CG-CD1 4.05Å; R1727-F1791 HydrophobicContact CG-CD2 4.35Å; R1727-F1791 HydrophobicContact CG-CE1 3.79Å; R1727-F1791 HydrophobicContact CG-CE2 4.08Å; R1727-F1791 HydrophobicContact CG-CG 4.34Å; R1727-F1791 HydrophobicContact CG-CZ 3.81Å
1792	F	82	Confident	63.3	Low	25 Å²	25	98.7 Å²	98.7	11%	0.11	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	150.7	177.2	-55.5	-78.5	0	0	0	110.4	K1725 V1726 I1728 L1741 F1773 C1775 A1777 R1790	K1725-F1792 CarbonylContact C-O 3.22Å; K1725-F1792 VanDerWaalsContact CA-O 3.29Å; K1725-F1792 WeakPolarHBondContact CA-O 3.25Å; K1725-F1792 VanDerWaalsContact CG-O 3.29Å; K1725-F1792 WeakPolarHBondContact CG-O 3.12Å; V1726-F1792 HydrophobicContact CG1-CB 3.8Å; V1726-F1792 HydrophobicContact CG1-CD2 4.33Å; V1726-F1792 PolarHBondContact N-O 2.84Å; V1726-F1792 PolarHBondContact O-N 2.92Å; I1728-F1792 HydrophobicContact CG2-CD2 3.98Å; I1728-F1792 HydrophobicContact CG2-CE2 3.63Å; L1741-F1792 HydrophobicContact CD2-CE2 3.93Å; F1773-F1792 HydrophobicContact CB-CB 4.22Å; F1773-F1792 HydrophobicContact CD1-CB 4.43Å; C1775-F1792 VanDerWaalsContact CA-CE1 3.5Å; C1775-F1792 HydrophobicContact CB-CD1 4.08Å; C1775-F1792 HydrophobicContact CB-CD2 4.27Å; C1775-F1792 HydrophobicContact CB-CE1 3.75Å; C1775-F1792 HydrophobicContact CB-CE2 3.94Å; C1775-F1792 HydrophobicContact CB-CG 4.32Å; C1775-F1792 HydrophobicContact CB-CZ 3.66Å; C1775-F1792 WeakPolarHBondContact O-CE1 3.33Å; C1775-F1792 VanDerWaalsContact SG-CD2 3.56Å; A1777-F1792 HydrophobicContact CB-CE1 4.37Å; A1777-F1792 HydrophobicContact CB-CZ 4.25Å; R1790-F1792 HydrophobicContact CB-CD2 4.42Å; R1790-F1792 HydrophobicContact CB-CE2 3.62Å; R1790-F1792 HydrophobicContact CB-CZ 3.69Å; R1790-F1792 HydrophobicContact CG-CZ 4.29Å
1793	S	78.4	Confident	61.1	Low	75 Å²	75	97.9 Å²	97.9	52%	0.524	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.8	-179.8	-72.6	0	0	0	0	111.8	F1773	F1773-S1793 WeakPolarHBondContact CD1-O 3.46Å
1794	A	72.6	Confident	58.6	Low	23 Å²	23	98.5 Å²	98.5	19%	0.19	53%	0.528	C	S	.	.			trans	-83	132.2	-175.5	0	0	0	0	0	112.3	I1723 N1724 I1772 F1773	I1723-A1794 WeakPolarHBondContact O-CB 3.35Å; N1724-A1794 PolarHBondContact O-N 2.88Å; I1772-A1794 CarbonylContact O-C 3.4Å; I1772-A1794 WeakPolarHBondContact O-CA 3.47Å; F1773-A1794 HydrophobicContact CD1-CB 4.05Å; F1773-A1794 HydrophobicContact CE1-CB 3.38Å; F1773-A1794 HydrophobicContact CE2-CB 4.44Å; F1773-A1794 HydrophobicContact CZ-CB 3.61Å
1795	E	63.6	Low	57.3	Low	103 Å²	103	100 Å²	100	48%	0.481	53%	0.534	S	S	.	.	B	Isolated β-bridge	trans	-91.1	141.8	161.6	-70.8	179.7	-153.5	0	0	110.2	I1772 N1774	I1772-E1795 PolarHBondContact N-O 2.8Å; I1772-E1795 PolarHBondContact O-N 2.88Å; N1774-E1795 PolarHBondContact ND2-OE1 3.37Å; N1774-E1795 PolarHBondContact ND2-OE2 3.13Å
1796	I	53.9	Low	55.3	Low	76 Å²	76	99.7 Å²	99.7	39%	0.39	54%	0.542	S	S	.	.			trans	-120.4	98.3	-172.4	-55.2	166.9	0	0	0	109
1797	I	43.3	Very low	53.4	Low	118 Å²	118	98 Å²	98	61%	0.605	55%	0.546	S	S	*	.			trans	-82.6	132.9	175.7	-56.5	-177.1	0	0	0	109.5	I1772	I1772-I1797 HydrophobicContact CD1-CD1 3.74Å
1798	K	35.9	Very low	51	Low	114 Å²	114	104.9 Å²	104.9	50%	0.496	57%	0.572	S	S	.	*			trans	-98.7	135.3	165.2	-60.4	-175.4	-168.6	176.8	0	109.1	Q1800	K1798-Q1800 PolarHBondContact O-N 2.97Å
1799	P	33.1	Very low	48.1	Very low	98 Å²	98	108.8 Å²	108.8	64%	0.636	60%	0.598	S	S	*	*	S	Bend	trans	-85	83.6	177.2	33.4	-33.5	0	0	0	111.4
1800	Q	33.7	Very low	45.4	Very low	180 Å²	180	111.6 Å²	111.6	84%	0.841	62%	0.622	S	S	*	*			trans	-157.9	0.6	171	-125.6	164.3	28.5	0	0	119.5	K1798	K1798-Q1800 PolarHBondContact O-N 2.97Å
1801	D	35.6	Very low	42.7	Very low	164 Å²	164	119.3 Å²	119.3	88%	0.877	66%	0.657	S	S	*	*			trans	-104.5	95.9	-176.2	-72.5	-62.8	0	0	0	113.7
1802	L	27.5	Very low	39.9	Very low	169 Å²	169	121.4 Å²	121.4	89%	0.885	67%	0.673	S	S	*	*			trans	-132.8	139	157.7	-93.6	168.4	0	0	0	108.4
1803	P	32.5	Very low	37.4	Very low	128 Å²	128	127.1 Å²	127.1	83%	0.831	70%	0.703	S	S	*	*			trans	-93	145.6	-153.3	34.3	-36.9	0	0	0	116.2
1804	G	28	Very low	34.9	Very low	70 Å²	70	128.7 Å²	128.7	72%	0.722	71%	0.709	S	S	*	*			trans	-161.9	87	177	0	0	0	0	0	117.3
1805	I	26.4	Very low	32.9	Very low	161 Å²	161	132.5 Å²	132.5	83%	0.826	73%	0.732	S	S	*	*			trans	63.3	112.2	140.7	-61.8	179.9	0	0	0	120.9
1806	V	24.5	Very low	31.1	Very low	136 Å²	136	134.8 Å²	134.8	82%	0.824	74%	0.743	S	S	*	*			trans	80.9	142.3	147.2	167.1	0	0	0	0	119.9
1807	P	37.3	Very low	30.2	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	75%	0.75	S	S	*	*			trans	-124.6	166.6	-149.5	41.7	-27.3	0	0	0	116.9
1808	K	23.8	Very low	29.9	Very low	194 Å²	194	136.7 Å²	136.7	84%	0.843	75%	0.748	S	S	*	*			trans	-160.3	126.9	155.4	-112.5	156.9	-171.1	170.8	0	114.6
1809	T	24.5	Very low	29.7	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	75%	0.754	S	S	*	*			trans	44.5	119.2	150.7	53.6	0	0	0	0	121.1
1810	S	30.2	Very low	29.7	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	76%	0.762	S	S	*	*			trans	-42.8	135	174.7	53.8	0	0	0	0	118.5
1811	K	25.3	Very low	29.7	Very low	200 Å²	200	138.5 Å²	138.5	87%	0.87	76%	0.757	S	S	*	*			trans	-140.8	164.1	146.8	-86.5	-171.5	176.8	177.4	0	109.8
1812	D	26	Very low	29.5	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	75%	0.752	S	S	*	*			trans	-65.4	140.4	-164.2	-54.6	-90.8	0	0	0	115.2	V1814	D1812-V1814 PolarHBondContact O-N 3.43Å
1813	I	28.9	Very low	29.6	Very low	145 Å²	145	134.5 Å²	134.5	74%	0.744	74%	0.744	S	S	*	*			trans	-82	98.5	-178.5	-58	174.2	0	0	0	109.9
1814	V	27	Very low	29.5	Very low	108 Å²	108	136.4 Å²	136.4	66%	0.655	74%	0.741	S	S	*	*			trans	-94	131.6	159.6	-178.7	0	0	0	0	108.2	D1812 H1816	D1812-V1814 PolarHBondContact O-N 3.43Å; V1814-H1816 PolarHBondContact O-N 2.79Å
1815	P	29.3	Very low	29.5	Very low	103 Å²	103	137.6 Å²	137.6	67%	0.669	75%	0.753	S	S	*	*			trans	-60.3	107.7	178.3	-25.5	35.5	0	0	0	112.2	K1817	P1815-K1817 PolarHBondContact O-N 2.91Å
1816	H	27.1	Very low	29.9	Very low	152 Å²	152	137.2 Å²	137.2	70%	0.704	75%	0.746	S	S	*	*	S	Bend	trans	-77.8	51.9	-167.2	-131.4	-88.1	0	0	0	113.7	V1814	V1814-H1816 PolarHBondContact O-N 2.79Å
1817	K	34.3	Very low	30.5	Very low	124 Å²	124	140.5 Å²	140.5	54%	0.539	75%	0.749	S	S	.	*	S	Bend	trans	-132.4	25.3	-178.2	-142.4	-158.4	-173.9	-171.8	0	114.8	P1815	P1815-K1817 PolarHBondContact O-N 2.91Å
1818	L	36.8	Very low	30.6	Very low	110 Å²	110	140 Å²	140	58%	0.576	75%	0.753	S	S	*	*	S	Bend	trans	-129.3	7	-179.5	-145.3	79.2	0	0	0	114.4
1819	I	31.8	Very low	31.7	Very low	118 Å²	118	135.2 Å²	135.2	61%	0.605	74%	0.737	S	S	*	*	S	Bend	trans	-104.6	-19.1	-171.7	-66.3	177.1	0	0	0	112.9
1820	Q	32.6	Very low	33.3	Very low	176 Å²	176	134 Å²	134	82%	0.822	72%	0.722	S	S	*	*	S	Bend	trans	-92.7	-24.8	-179.3	-77.3	174.4	-52.9	0	0	114.6	L1822	Q1820-L1822 PolarHBondContact O-N 2.82Å
1821	D	34.5	Very low	34.9	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-78.9	3.6	-178	-65.7	-41.6	0	0	0	114.2	S1823	D1821-S1823 PolarHBondContact O-N 2.65Å; D1821-S1823 VanDerWaalsContact O-N 3.15Å
1822	L	31.3	Very low	37.1	Very low	150 Å²	150	122.3 Å²	122.3	79%	0.785	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-73.8	2.9	-177.6	-85.1	164.1	0	0	0	114.8	Q1820	Q1820-L1822 PolarHBondContact O-N 2.82Å
1823	S	28.9	Very low	39.4	Very low	100 Å²	100	115.6 Å²	115.6	70%	0.699	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-102.3	-9.9	-173.8	57.6	0	0	0	0	115.4	D1821	D1821-S1823 PolarHBondContact O-N 2.65Å; D1821-S1823 VanDerWaalsContact O-N 3.15Å
1824	Q	30.4	Very low	42.1	Very low	168 Å²	168	108.7 Å²	108.7	79%	0.785	59%	0.591	S	S	*	*	S	Bend	trans	-136.5	80.7	-172.4	-66.2	-166.8	2	0	0	116	K1826	Q1824-K1826 VanDerWaalsContact C-N 3.34Å; Q1824-K1826 PolarHBondContact O-N 2.8Å
1825	G	28.8	Very low	44.5	Very low	94 Å²	94	106.1 Å²	106.1	97%	0.969	57%	0.574	S	S	*	*			trans	68.7	-19.2	134	0	0	0	0	0	122.2
1826	K	34	Very low	47.2	Very low	154 Å²	154	101.2 Å²	101.2	67%	0.67	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-89.6	140.7	177.3	-80.7	-168.2	175.4	-169.7	0	111.8	D1719 Q1824 A1828	D1719-K1826 IonicContact OD2-NZ 3.29Å; D1719-K1826 PolarHBondContact OD2-NZ 3.46Å; Q1824-K1826 VanDerWaalsContact C-N 3.34Å; Q1824-K1826 PolarHBondContact O-N 2.8Å; K1826-A1828 PolarHBondContact O-N 2.83Å
1827	K	37	Very low	49.7	Very low	205 Å²	205	94.9 Å²	94.9	89%	0.891	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-59.9	117.9	173.1	-88.7	-171.1	172	-175.1	0	110
1828	A	40.5	Very low	52.1	Low	98 Å²	98	89 Å²	89	81%	0.81	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-59.8	136	175.9	0	0	0	0	0	111.6	K1826	K1826-A1828 PolarHBondContact O-N 2.83Å
1829	L	47.1	Very low	54.3	Low	95 Å²	95	84.1 Å²	84.1	50%	0.497	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-69.8	132.4	161.3	-78.3	167.8	0	0	0	108.2	T1831	L1829-T1831 PolarHBondContact O-N 2.78Å
1830	E	58.6	Low	56.8	Low	107 Å²	107	78.6 Å²	78.6	50%	0.5	44%	0.435	S	S	.	.			trans	-68.8	103.3	-177.9	-165.8	-174	147.4	0	0	109.5	I1832 K1892	E1830-I1832 HydrophobicContact CG-CG2 4.5Å; E1830-K1892 HydrophobicContact CB-CB 4.3Å; E1830-K1892 HydrophobicContact CB-CD 4.11Å; E1830-K1892 HydrophobicContact CG-CD 4.01Å; E1830-K1892 WeakPolarHBondContact O-CB 3.16Å; E1830-K1892 PolarHBondContact O-N 3.38Å; E1830-K1892 VanDerWaalsContact OE1-CD 3.31Å; E1830-K1892 WeakPolarHBondContact OE1-CD 3.32Å; E1830-K1892 IonicContact OE1-NZ 3.33Å; E1830-K1892 PolarHBondContact OE1-NZ 3.32Å; E1830-K1892 VanDerWaalsContact OE2-CD 3.28Å; E1830-K1892 WeakPolarHBondContact OE2-CD 3.33Å; E1830-K1892 IonicContact OE2-NZ 2.79Å; E1830-K1892 PolarHBondContact OE2-NZ 2.56Å
1831	T	63.7	Low	58.9	Low	70 Å²	70	70.3 Å²	70.3	43%	0.429	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	134.5	174	53.8	0	0	0	0	110.6	L1829 G1890	L1829-T1831 PolarHBondContact O-N 2.78Å; T1831-G1890 CarbonylContact C-O 3.52Å; T1831-G1890 VanDerWaalsContact CA-O 3.28Å; T1831-G1890 WeakPolarHBondContact CA-O 3.32Å
1832	I	71.2	Confident	61.1	Low	3 Å²	3	68.6 Å²	68.6	2%	0.015	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	156.3	-178.2	60	167.6	0	0	0	111.6	E1830 Y1834 A1889 G1890 K1892 F1922 T1924 I1925	E1830-I1832 HydrophobicContact CG-CG2 4.5Å; I1832-Y1834 HydrophobicContact CD1-CE2 4.42Å; I1832-Y1834 HydrophobicContact CG1-CD2 4.4Å; I1832-Y1834 HydrophobicContact CG1-CE2 3.94Å; I1832-Y1834 WeakPolarHBondContact O-CD2 3.41Å; I1832-A1889 WeakPolarHBondContact O-CA 3.27Å; I1832-G1890 PolarHBondContact N-O 3.23Å; I1832-G1890 PolarHBondContact O-N 3.39Å; I1832-K1892 HydrophobicContact CD1-CB 4.05Å; I1832-K1892 HydrophobicContact CD1-CG 4.13Å; I1832-K1892 HydrophobicContact CG1-CB 4.12Å; I1832-K1892 HydrophobicContact CG2-CB 3.96Å; I1832-K1892 HydrophobicContact CG2-CD 4.18Å; I1832-K1892 HydrophobicContact CG2-CG 4.27Å; I1832-F1922 HydrophobicContact CD1-CD1 3.78Å; I1832-F1922 HydrophobicContact CD1-CE1 4.42Å; I1832-T1924 HydrophobicContact CB-CG2 4.28Å; I1832-T1924 VanDerWaalsContact CB-OG1 3.24Å; I1832-T1924 WeakPolarHBondContact CB-OG1 3.41Å; I1832-T1924 HydrophobicContact CG2-CG2 4.04Å; I1832-T1924 WeakPolarHBondContact CG2-OG1 3.27Å; I1832-I1925 HydrophobicContact CD1-CD1 3.65Å; I1832-I1925 HydrophobicContact CD1-CG1 3.96Å
1833	P	74.3	Confident	63.2	Low	12 Å²	12	65 Å²	65	8%	0.078	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	136.1	172.2	27.9	-35.4	0	0	0	112	F1888 P1923 T1924	P1833-F1888 CarbonylContact C-O 3.54Å; P1833-F1888 WeakPolarHBondContact CA-O 3.06Å; P1833-P1923 HydrophobicContact CB-CG 4.43Å; P1833-P1923 HydrophobicContact CG-CB 4.13Å; P1833-P1923 HydrophobicContact CG-CG 3.99Å; P1833-P1923 WeakPolarHBondContact O-CD 3.44Å; P1833-T1924 HydrophobicContact CG-CG2 4.23Å
1834	Y	84.3	Confident	65.3	Low	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.9	167.2	-76.6	-114.7	0	0	0	108	I1832 C1856 F1867 R1887 F1888 V1891 L1893 L1920 F1922	I1832-Y1834 HydrophobicContact CD1-CE2 4.42Å; I1832-Y1834 HydrophobicContact CG1-CD2 4.4Å; I1832-Y1834 HydrophobicContact CG1-CE2 3.94Å; I1832-Y1834 WeakPolarHBondContact O-CD2 3.41Å; Y1834-C1856 HydrophobicContact CE1-CB 4.2Å; Y1834-F1867 HydrophobicContact CD1-CD2 4.48Å; Y1834-F1867 AromaticContact CD1-CE2 3.42Å; Y1834-F1867 HydrophobicContact CD1-CE2 3.42Å; Y1834-F1867 VanDerWaalsContact CD1-CE2 3.42Å; Y1834-F1867 AromaticContact CD1-CZ 3.86Å; Y1834-F1867 HydrophobicContact CD1-CZ 3.86Å; Y1834-F1867 HydrophobicContact CD2-CE2 4.38Å; Y1834-F1867 AromaticContact CD2-CZ 3.97Å; Y1834-F1867 HydrophobicContact CD2-CZ 3.97Å; Y1834-F1867 AromaticContact CE1-CE2 3.78Å; Y1834-F1867 HydrophobicContact CE1-CE2 3.78Å; Y1834-F1867 HydrophobicContact CE1-CZ 4.11Å; Y1834-F1867 HydrophobicContact CE2-CZ 4.26Å; Y1834-F1867 AromaticContact CG-CE2 3.76Å; Y1834-F1867 HydrophobicContact CG-CE2 3.76Å; Y1834-F1867 AromaticContact CG-CZ 3.78Å; Y1834-F1867 HydrophobicContact CG-CZ 3.78Å; Y1834-R1887 WeakPolarHBondContact O-CA 3.37Å; Y1834-F1888 PolarHBondContact N-O 3.26Å; Y1834-F1888 PolarHBondContact O-N 2.86Å; Y1834-V1891 WeakPolarHBondContact CE2-O 3.49Å; Y1834-V1891 PolarHBondContact OH-O 2.72Å; Y1834-L1893 VanDerWaalsContact OH-CD1 3.29Å; Y1834-L1893 WeakPolarHBondContact OH-CD1 3.17Å; Y1834-L1893 VanDerWaalsContact OH-CG 3.26Å; Y1834-L1893 WeakPolarHBondContact OH-CG 3.37Å; Y1834-L1920 HydrophobicContact CD1-CD1 4.35Å; Y1834-F1922 AromaticContact CD1-CE1 3.81Å; Y1834-F1922 HydrophobicContact CD1-CE1 3.81Å; Y1834-F1922 AromaticContact CD1-CZ 3.89Å; Y1834-F1922 HydrophobicContact CD1-CZ 3.89Å; Y1834-F1922 HydrophobicContact CE1-CD1 4.37Å; Y1834-F1922 AromaticContact CE1-CE1 3.31Å; Y1834-F1922 HydrophobicContact CE1-CE1 3.31Å; Y1834-F1922 AromaticContact CE1-CZ 3.5Å; Y1834-F1922 HydrophobicContact CE1-CZ 3.5Å; Y1834-F1922 HydrophobicContact CE2-CE1 4.23Å; Y1834-F1922 HydrophobicContact CG-CE1 4.47Å; Y1834-F1922 AromaticContact CZ-CE1 3.54Å
1835	L	78.9	Confident	67.6	Low	54 Å²	54	66.5 Å²	66.5	28%	0.283	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	112.8	177.7	-100.3	160.9	0	0	0	109.9	R1887 S1921 P1923	L1835-R1887 HydrophobicContact CD2-CB 4.3Å; L1835-S1921 PolarHBondContact N-O 3.33Å; L1835-S1921 PolarHBondContact O-N 2.9Å; L1835-P1923 HydrophobicContact CD1-CG 3.9Å
1836	I	84.3	Confident	70	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.4	-173.8	-42.2	-165	0	0	0	109.3	V1838 I1854 F1867 L1869 Y1885 F1886 F1888 L1918 L1920	I1836-V1838 HydrophobicContact CG2-CG2 4.04Å; I1836-I1854 HydrophobicContact CD1-CB 4.25Å; I1836-I1854 HydrophobicContact CD1-CG2 4.09Å; I1836-I1854 HydrophobicContact CG2-CD1 3.64Å; I1836-F1867 HydrophobicContact CD1-CB 4.23Å; I1836-F1867 HydrophobicContact CD1-CD2 3.9Å; I1836-F1867 HydrophobicContact CD1-CG 4.38Å; I1836-L1869 HydrophobicContact CD1-CD2 4.25Å; I1836-L1869 HydrophobicContact CG2-CD2 4.44Å; I1836-Y1885 WeakPolarHBondContact O-CA 3.04Å; I1836-F1886 HydrophobicContact CB-CB 4.29Å; I1836-F1886 HydrophobicContact CB-CD2 4.44Å; I1836-F1886 PolarHBondContact N-O 2.73Å; I1836-F1886 PolarHBondContact O-N 3.41Å; I1836-F1888 HydrophobicContact CD1-CD2 3.79Å; I1836-F1888 HydrophobicContact CD1-CE2 3.71Å; I1836-F1888 HydrophobicContact CG1-CD2 4.12Å; I1836-F1888 HydrophobicContact CG1-CE2 4.16Å; I1836-L1918 HydrophobicContact CG2-CD1 3.89Å; I1836-L1920 HydrophobicContact CD1-CD1 4.13Å; I1836-L1920 HydrophobicContact CG1-CD1 3.75Å
1837	T	80	Confident	72.1	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.117	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.7	175.2	-48	0	0	0	0	109.5	T1883 R1884 Y1885 Y1919	T1837-T1883 HydrophobicContact CG2-CG2 3.79Å; T1837-R1884 WeakPolarHBondContact CA-O 3.33Å; T1837-Y1885 HydrophobicContact CG2-CD1 3.78Å; T1837-Y1885 HydrophobicContact CG2-CE1 3.6Å; T1837-Y1885 VanDerWaalsContact OG1-CD1 3.29Å; T1837-Y1885 WeakPolarHBondContact OG1-CD1 3.06Å; T1837-Y1885 VanDerWaalsContact OG1-CE1 3.27Å; T1837-Y1885 WeakPolarHBondContact OG1-CE1 3.46Å; T1837-Y1919 HydrophobicContact CG2-CD2 4.02Å; T1837-Y1919 PolarHBondContact N-O 2.99Å; T1837-Y1919 PolarHBondContact O-N 2.82Å
1838	V	84.8	Confident	74.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.9	-177.1	-165.4	0	0	0	0	111	I1836 I1854 L1869 T1883 R1884 F1886 W1913 I1915 L1918	I1836-V1838 HydrophobicContact CG2-CG2 4.04Å; V1838-I1854 HydrophobicContact CG2-CD1 4.13Å; V1838-L1869 HydrophobicContact CG2-CD1 4.03Å; V1838-T1883 CarbonylContact O-C 3.48Å; V1838-T1883 VanDerWaalsContact O-CA 3.32Å; V1838-T1883 WeakPolarHBondContact O-CA 3.41Å; V1838-R1884 PolarHBondContact N-O 2.9Å; V1838-R1884 PolarHBondContact O-N 2.81Å; V1838-F1886 HydrophobicContact CB-CE2 4.39Å; V1838-F1886 HydrophobicContact CG2-CD2 4.31Å; V1838-F1886 HydrophobicContact CG2-CE2 3.95Å; V1838-W1913 HydrophobicContact CG1-CH2 4.29Å; V1838-W1913 HydrophobicContact CG1-CZ2 3.73Å; V1838-I1915 HydrophobicContact CG1-CD1 3.67Å; V1838-I1915 HydrophobicContact CG1-CG1 3.61Å; V1838-L1918 HydrophobicContact CG2-CD1 3.85Å
1839	I	83	Confident	75.8	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.041	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.8	178.1	-53.1	-174.5	0	0	0	109.2	T1883 Q1916 S1917 Y1919 Y2511	I1839-T1883 HydrophobicContact CG1-CG2 3.92Å; I1839-Q1916 HydrophobicContact CB-CB 4.38Å; I1839-Q1916 HydrophobicContact CG2-CB 4.1Å; I1839-Q1916 HydrophobicContact CG2-CG 4.49Å; I1839-Q1916 WeakPolarHBondContact O-CB 3.46Å; I1839-Q1916 PolarHBondContact O-N 2.98Å; I1839-S1917 PolarHBondContact N-O 3.1Å; I1839-Y1919 HydrophobicContact CD1-CE2 4.05Å; I1839-Y2511 HydrophobicContact CD1-CD2 3.73Å; I1839-Y2511 HydrophobicContact CD1-CE2 4.42Å
1840	T	84.2	Confident	77	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.3	179.9	-43.6	0	0	0	0	110.5	A1846 K1879 G1881 T1882	T1840-A1846 VanDerWaalsContact CG2-O 3.27Å; T1840-A1846 WeakPolarHBondContact CG2-O 3.48Å; T1840-K1879 WeakPolarHBondContact CB-O 3.26Å; T1840-G1881 VanDerWaalsContact O-CA 3.27Å; T1840-G1881 WeakPolarHBondContact O-CA 3.37Å; T1840-G1881 PolarHBondContact O-N 3.42Å; T1840-G1881 VanDerWaalsContact O-N 3.08Å; T1840-T1882 WeakPolarHBondContact CB-O 3.37Å; T1840-T1882 PolarHBondContact N-O 2.81Å; T1840-T1882 PolarHBondContact OG1-O 2.84Å; T1840-T1882 VanDerWaalsContact OG1-O 3.13Å
1841	G	78.1	Confident	78	Confident	2 Å²	2	37 Å²	37	2%	0.021	20%	0.201	C	C	.	.			trans	-58.6	157.8	-177.3	0	0	0	0	0	114.7	A1846 R1880 G1881 Y1914	G1841-A1846 VanDerWaalsContact O-CB 3.25Å; G1841-A1846 WeakPolarHBondContact O-CB 3.47Å; G1841-R1880 CarbonylContact O-C 3.5Å; G1841-R1880 WeakPolarHBondContact O-CA 3.35Å; G1841-R1880 WeakPolarHBondContact O-CB 3.49Å; G1841-G1881 PolarHBondContact O-N 2.69Å; G1841-Y1914 PolarHBondContact N-O 2.93Å
1842	S	79.2	Confident	79	Confident	99 Å²	99	33.7 Å²	33.7	69%	0.692	18%	0.18	S	C	*	.			trans	-85.3	-10.5	-173.7	50.4	0	0	0	0	115.6
1843	D	77.3	Confident	79.9	Confident	74 Å²	74	34.4 Å²	34.4	40%	0.396	18%	0.183	S	C	.	.	S	Bend	trans	-54.2	146	178.5	176.7	-79	0	0	0	112.3	K1845 A1846 R1880 W1936 R1941	D1843-K1845 PolarHBondContact O-N 3.34Å; D1843-K1845 PolarHBondContact OD1-N 3.02Å; D1843-A1846 HydrophobicContact CB-CB 3.97Å; D1843-A1846 WeakPolarHBondContact O-CB 3.44Å; D1843-A1846 PolarHBondContact O-N 3Å; D1843-R1880 WeakPolarHBondContact O-CB 3.37Å; D1843-R1880 WeakPolarHBondContact O-CD 3.31Å; D1843-W1936 HydrophobicContact CB-CH2 4.14Å; D1843-W1936 HydrophobicContact CB-CZ2 4.17Å; D1843-R1941 IonicContact OD1-NH1 3.57Å; D1843-R1941 PolarHBondContact OD1-NH1 2.78Å
1844	R	72.3	Confident	80.6	Confident	215 Å²	215	33.9 Å²	33.9	81%	0.811	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-29.2	-177.5	-111.4	-177.4	177.8	-169	-0.6	113.5	R1880	R1844-R1880 PolarHBondContact O-NH1 3.41Å
1845	K	77.6	Confident	80.8	Confident	84 Å²	84	34 Å²	34	37%	0.365	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	5.8	-176.8	-71.1	179.3	158.6	-165.9	0	114.8	D1843 G1847 S1910 G1912 W1936	D1843-K1845 PolarHBondContact O-N 3.34Å; D1843-K1845 PolarHBondContact OD1-N 3.02Å; K1845-G1847 VanDerWaalsContact C-N 3.32Å; K1845-G1847 PolarHBondContact O-N 3.1Å; K1845-S1910 WeakPolarHBondContact CD-O 3.3Å; K1845-S1910 WeakPolarHBondContact CE-O 3.27Å; K1845-S1910 VanDerWaalsContact CG-O 3.3Å; K1845-S1910 WeakPolarHBondContact CG-O 3.25Å; K1845-S1910 PolarHBondContact NZ-O 3.31Å; K1845-G1912 PolarHBondContact O-N 3.04Å; K1845-W1936 HydrophobicContact CB-CH2 4.5Å
1846	A	81	Confident	81.2	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.			trans	-73.2	-5.7	-173	0	0	0	0	0	117.5	T1840 G1841 D1843 R1880 G1912 Y1914 W1936	T1840-A1846 VanDerWaalsContact CG2-O 3.27Å; T1840-A1846 WeakPolarHBondContact CG2-O 3.48Å; G1841-A1846 VanDerWaalsContact O-CB 3.25Å; G1841-A1846 WeakPolarHBondContact O-CB 3.47Å; D1843-A1846 HydrophobicContact CB-CB 3.97Å; D1843-A1846 WeakPolarHBondContact O-CB 3.44Å; D1843-A1846 PolarHBondContact O-N 3Å; A1846-R1880 HydrophobicContact CB-CB 4.18Å; A1846-G1912 CarbonylContact C-O 3.51Å; A1846-G1912 VanDerWaalsContact C-O 3.32Å; A1846-G1912 WeakPolarHBondContact CA-O 3.15Å; A1846-Y1914 PolarHBondContact O-N 3.32Å; A1846-W1936 HydrophobicContact CB-CH2 4.06Å; A1846-W1936 HydrophobicContact CB-CZ3 4.41Å
1847	G	77.2	Confident	81.1	Confident	14 Å²	14	32.4 Å²	32.4	14%	0.144	17%	0.172	C	C	.	.			trans	-87.6	155.1	179.1	0	0	0	0	0	112.7	K1845 L1878	K1845-G1847 VanDerWaalsContact C-N 3.32Å; K1845-G1847 PolarHBondContact O-N 3.1Å; G1847-L1878 CarbonylContact C-O 3.57Å; G1847-L1878 WeakPolarHBondContact CA-O 3.4Å
1848	T	82	Confident	81.2	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.025	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-105.6	137.9	171.1	-171.2	0	0	0	0	111.5	G1850 V1852 M1877 L1878 N1903 A1905 W1913	T1848-G1850 PolarHBondContact OG1-N 2.82Å; T1848-V1852 HydrophobicContact CG2-CG1 3.84Å; T1848-V1852 HydrophobicContact CG2-CG2 4Å; T1848-M1877 WeakPolarHBondContact O-CA 3.16Å; T1848-M1877 WeakPolarHBondContact O-CG 3.35Å; T1848-L1878 HydrophobicContact CG2-CB 4.01Å; T1848-L1878 HydrophobicContact CG2-CG 4.2Å; T1848-L1878 PolarHBondContact N-O 2.89Å; T1848-L1878 PolarHBondContact O-N 3.06Å; T1848-L1878 VanDerWaalsContact O-N 3.15Å; T1848-N1903 PolarHBondContact OG1-OD1 3.48Å; T1848-A1905 WeakPolarHBondContact OG1-CB 3.38Å; T1848-W1913 HydrophobicContact CG2-CG 4.33Å
1849	P	74.1	Confident	80.6	Confident	66 Å²	66	35.3 Å²	35.3	43%	0.429	18%	0.184	S	C	.	.	S	Bend	trans	-84.1	-15.6	173	34.1	-34.7	0	0	0	113.7	A1905 M1911	P1849-A1905 HydrophobicContact CG-CB 4.42Å; P1849-M1911 HydrophobicContact CB-SD 4.46Å; P1849-M1911 HydrophobicContact CG-SD 4.1Å
1850	G	72.1	Confident	80	Confident	5 Å²	5	35.9 Å²	35.9	5%	0.052	19%	0.187	C	C	.	.	S	Bend	trans	-127.3	-173.2	-167.3	0	0	0	0	0	115	T1848	T1848-G1850 PolarHBondContact OG1-N 2.82Å
1851	P	79.6	Confident	79.5	Confident	46 Å²	46	43.7 Å²	43.7	30%	0.299	22%	0.22	S	C	.	.			trans	-59.4	135	-176.2	22.7	-32.3	0	0	0	113.4	T1876 D1904 A1905	P1851-T1876 HydrophobicContact CB-CG2 4.14Å; P1851-D1904 HydrophobicContact CG-CB 4.1Å; P1851-D1904 WeakPolarHBondContact O-CA 3.34Å; P1851-D1904 PolarHBondContact O-N 3.32Å; P1851-A1905 PolarHBondContact O-N 2.67Å
1852	V	84.2	Confident	79	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.8	172.9	-87	0	0	0	0	108.3	T1848 L1869 L1878 G1902 N1903 W1913	T1848-V1852 HydrophobicContact CG2-CG1 3.84Å; T1848-V1852 HydrophobicContact CG2-CG2 4Å; V1852-L1869 HydrophobicContact CG2-CB 4.24Å; V1852-L1869 HydrophobicContact CG2-CD1 4.41Å; V1852-L1869 WeakPolarHBondContact O-CB 3.43Å; V1852-L1869 WeakPolarHBondContact O-CG 3.44Å; V1852-L1869 PolarHBondContact O-N 3.15Å; V1852-L1878 HydrophobicContact CG2-CD1 3.67Å; V1852-L1878 HydrophobicContact CG2-CG 3.88Å; V1852-G1902 VanDerWaalsContact CA-O 3.27Å; V1852-G1902 WeakPolarHBondContact CA-O 3.46Å; V1852-G1902 WeakPolarHBondContact CG1-O 3.19Å; V1852-N1903 HydrophobicContact CG1-CB 3.9Å; V1852-N1903 WeakPolarHBondContact CG1-OD1 2.99Å; V1852-W1913 HydrophobicContact CB-CE3 4.22Å; V1852-W1913 HydrophobicContact CB-CH2 3.82Å; V1852-W1913 HydrophobicContact CB-CZ2 4.37Å; V1852-W1913 HydrophobicContact CB-CZ3 3.74Å; V1852-W1913 HydrophobicContact CG1-CD2 3.8Å; V1852-W1913 HydrophobicContact CG1-CE3 3.35Å; V1852-W1913 HydrophobicContact CG1-CH2 3.86Å; V1852-W1913 HydrophobicContact CG1-CZ2 4.28Å; V1852-W1913 HydrophobicContact CG1-CZ3 3.37Å; V1852-W1913 HydrophobicContact CG2-CH2 4.28Å; V1852-W1913 HydrophobicContact CG2-CZ2 4.4Å
1853	W	89.6	Confident	78.8	Confident	17 Å²	17	45 Å²	45	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	157	-171.5	57.1	-95.1	0	0	0	112.8	K1866 F1867 I1868 Q1900 V1901 G1902 D1904 T1947	W1853-K1866 HydrophobicContact CB-CB 4.36Å; W1853-K1866 HydrophobicContact CB-CD 4.38Å; W1853-K1866 HydrophobicContact CD2-CD 3.65Å; W1853-K1866 HydrophobicContact CD2-CG 3.9Å; W1853-K1866 VanDerWaalsContact CE2-NZ 3.26Å; W1853-K1866 HydrophobicContact CE3-CD 3.99Å; W1853-K1866 HydrophobicContact CE3-CG 3.72Å; W1853-K1866 HydrophobicContact CG-CD 3.8Å; W1853-K1866 HydrophobicContact CG-CG 4.25Å; W1853-K1866 VanDerWaalsContact CZ2-CE 3.49Å; W1853-K1866 HydrophobicContact CZ3-CG 4.25Å; W1853-K1866 VanDerWaalsContact NE1-NZ 3.14Å; W1853-F1867 CarbonylContact C-O 2.93Å; W1853-F1867 WeakPolarHBondContact CA-O 3.16Å; W1853-I1868 HydrophobicContact CB-CG1 4.46Å; W1853-Q1900 HydrophobicContact CH2-CB 4.44Å; W1853-Q1900 HydrophobicContact CZ3-CB 4.02Å; W1853-V1901 WeakPolarHBondContact O-CA 3.48Å; W1853-G1902 PolarHBondContact N-O 3.35Å; W1853-G1902 PolarHBondContact O-N 3.17Å; W1853-D1904 VanDerWaalsContact CD1-CG 3.44Å; W1853-D1904 PolarHBondContact NE1-OD1 3.1Å; W1853-D1904 PolarHBondContact NE1-OD2 2.77Å; W1853-T1947 HydrophobicContact CH2-CG2 4.06Å; W1853-T1947 HydrophobicContact CZ2-CG2 3.72Å
1854	I	89.4	Confident	78.7	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.4	173.9	-74.5	172.9	0	0	0	110.1	I1836 V1838 F1867 L1869 I1899 Q1900 V1901 L1918	I1836-I1854 HydrophobicContact CD1-CB 4.25Å; I1836-I1854 HydrophobicContact CD1-CG2 4.09Å; I1836-I1854 HydrophobicContact CG2-CD1 3.64Å; V1838-I1854 HydrophobicContact CG2-CD1 4.13Å; I1854-F1867 PolarHBondContact N-O 3.04Å; I1854-F1867 PolarHBondContact O-N 3.22Å; I1854-L1869 HydrophobicContact CD1-CD1 3.9Å; I1854-L1869 HydrophobicContact CD1-CD2 4.39Å; I1854-L1869 HydrophobicContact CG1-CD1 4.15Å; I1854-I1899 HydrophobicContact CG2-CG2 3.87Å; I1854-Q1900 CarbonylContact C-O 3.39Å; I1854-Q1900 WeakPolarHBondContact CA-O 3.33Å; I1854-V1901 HydrophobicContact CD1-CG1 4.4Å; I1854-V1901 HydrophobicContact CG1-CB 4.38Å; I1854-V1901 HydrophobicContact CG1-CG1 3.93Å; I1854-V1901 HydrophobicContact CG1-CG2 4.17Å; I1854-L1918 HydrophobicContact CD1-CD1 3.48Å; I1854-L1918 VanDerWaalsContact CD1-CD1 3.48Å; I1854-L1918 HydrophobicContact CD1-CD2 3.95Å; I1854-L1918 HydrophobicContact CD1-CG 4.4Å
1855	S	87.9	Confident	78.7	Confident	4 Å²	4	35 Å²	35	3%	0.028	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138.8	176.1	167.9	0	0	0	0	109.2	N1863 I1899 Q1900	S1855-N1863 VanDerWaalsContact OG-CG 3.23Å; S1855-N1863 PolarHBondContact OG-ND2 2.65Å; S1855-N1863 PolarHBondContact OG-OD1 3.08Å; S1855-I1899 CarbonylContact O-C 3.44Å; S1855-I1899 WeakPolarHBondContact O-CA 3.28Å; S1855-Q1900 PolarHBondContact N-O 2.99Å; S1855-Q1900 PolarHBondContact O-N 2.9Å
1856	C	86.7	Confident	78.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.7	-174	-38.7	0	0	0	0	109.3	Y1834 N1863 S1864 L1893 L1896 L1920	Y1834-C1856 HydrophobicContact CE1-CB 4.2Å; C1856-N1863 WeakPolarHBondContact O-CA 3.29Å; C1856-S1864 PolarHBondContact N-OG 2.86Å; C1856-S1864 PolarHBondContact O-N 3.49Å; C1856-S1864 PolarHBondContact SG-OG 3.11Å; C1856-L1893 HydrophobicContact CB-CD1 3.92Å; C1856-L1893 WeakPolarHBondContact O-CD1 3.29Å; C1856-L1896 HydrophobicContact CB-CD1 4.18Å; C1856-L1896 HydrophobicContact CB-CD2 3.93Å; C1856-L1920 HydrophobicContact CB-CD2 4.21Å; C1856-L1920 WeakPolarHBondContact SG-CD2 3.29Å
1857	V	83.9	Confident	79.1	Confident	19 Å²	19	36.6 Å²	36.6	12%	0.115	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.9	-176.2	-174	0	0	0	0	110.9	M1862 T1897 E1898	V1857-M1862 WeakPolarHBondContact CA-O 3.26Å; V1857-T1897 PolarHBondContact O-N 2.88Å; V1857-E1898 HydrophobicContact CB-CB 4.33Å; V1857-E1898 PolarHBondContact N-O 3.21Å; V1857-E1898 PolarHBondContact O-N 2.84Å; V1857-E1898 VanDerWaalsContact O-N 3.12Å
1858	D	81	Confident	79.4	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.011	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	177.1	-179.6	71.3	13.7	0	0	0	115.8	D1860 K1861 M1862 L1893 N1894 D1895 L1896 T1897	D1858-D1860 PolarHBondContact O-N 3.23Å; D1858-D1860 VanDerWaalsContact O-N 3.09Å; D1858-D1860 VanDerWaalsContact OD1-CA 3.29Å; D1858-D1860 WeakPolarHBondContact OD1-CA 3.29Å; D1858-D1860 PolarHBondContact OD1-N 2.96Å; D1858-K1861 WeakPolarHBondContact O-CA 3.46Å; D1858-K1861 PolarHBondContact O-N 2.6Å; D1858-K1861 PolarHBondContact OD1-N 2.86Å; D1858-M1862 PolarHBondContact N-O 3.23Å; D1858-M1862 PolarHBondContact OD1-N 3.28Å; D1858-L1893 HydrophobicContact CB-CB 4.14Å; D1858-L1893 WeakPolarHBondContact OD2-CA 3.4Å; D1858-N1894 PolarHBondContact OD2-N 3.12Å; D1858-D1895 CarbonylContact C-O 3.58Å; D1858-D1895 WeakPolarHBondContact CA-O 3.5Å; D1858-D1895 WeakPolarHBondContact CB-O 3.44Å; D1858-L1896 HydrophobicContact CB-CD2 4.26Å; D1858-T1897 PolarHBondContact O-OG1 2.92Å
1859	K	72.6	Confident	79.4	Confident	80 Å²	80	39.9 Å²	39.9	35%	0.348	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-15	175.2	58.7	157.3	-165.9	-144.9	0	113.9	K1507 N1894 D1895 T1897	K1507-K1859 PolarHBondContact NZ-O 2.87Å; K1859-N1894 HydrophobicContact CG-CB 4.39Å; K1859-D1895 HydrophobicContact CD-CB 4.04Å; K1859-D1895 WeakPolarHBondContact CE-OD2 3.32Å; K1859-D1895 HydrophobicContact CG-CB 4.04Å; K1859-D1895 PolarHBondContact N-O 2.7Å; K1859-D1895 IonicContact NZ-OD2 2.75Å; K1859-D1895 PolarHBondContact NZ-OD2 2.81Å; K1859-T1897 HydrophobicContact CB-CG2 3.87Å
1860	D	69.8	Low	79.4	Confident	19 Å²	19	38.6 Å²	38.6	10%	0.102	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	10.1	-179.5	-48.2	-38.6	0	0	0	110.6	D1538 L1540 D1858 M1862 N1894	D1538-D1860 HydrophobicContact CB-CB 4.4Å; L1540-D1860 HydrophobicContact CD1-CB 4.11Å; L1540-D1860 VanDerWaalsContact CD2-O 3.23Å; L1540-D1860 WeakPolarHBondContact CD2-O 3.29Å; L1540-D1860 HydrophobicContact CG-CB 4.02Å; L1540-D1860 WeakPolarHBondContact CG-O 3.25Å; D1858-D1860 PolarHBondContact O-N 3.23Å; D1858-D1860 VanDerWaalsContact O-N 3.09Å; D1858-D1860 VanDerWaalsContact OD1-CA 3.29Å; D1858-D1860 WeakPolarHBondContact OD1-CA 3.29Å; D1858-D1860 PolarHBondContact OD1-N 2.96Å; D1860-M1862 PolarHBondContact O-N 3.08Å; D1860-M1862 VanDerWaalsContact O-N 3.12Å; D1860-N1894 PolarHBondContact OD2-ND2 2.96Å
1861	K	74.2	Confident	78.8	Confident	166 Å²	166	39 Å²	39	72%	0.722	19%	0.192	S	C	*	.			trans	57.6	13.9	178.6	-64.1	-171.7	176	-177.7	0	115.2	L1540 D1858	L1540-K1861 HydrophobicContact CD2-CB 4.25Å; L1540-K1861 HydrophobicContact CD2-CG 4.24Å; D1858-K1861 WeakPolarHBondContact O-CA 3.46Å; D1858-K1861 PolarHBondContact O-N 2.6Å; D1858-K1861 PolarHBondContact OD1-N 2.86Å
1862	M	67.5	Low	77.3	Confident	60 Å²	60	41.8 Å²	41.8	30%	0.296	21%	0.211	S	C	.	.			trans	-70.8	143.6	174.3	-157.8	-179.4	-146.3	0	0	109	V1857 D1858 D1860 V1891 L1893	V1857-M1862 WeakPolarHBondContact CA-O 3.26Å; D1858-M1862 PolarHBondContact N-O 3.23Å; D1858-M1862 PolarHBondContact OD1-N 3.28Å; D1860-M1862 PolarHBondContact O-N 3.08Å; D1860-M1862 VanDerWaalsContact O-N 3.12Å; M1862-V1891 HydrophobicContact CE-CG1 4.32Å; M1862-V1891 HydrophobicContact SD-CG1 3.96Å; M1862-L1893 VanDerWaalsContact C-CD2 3.44Å; M1862-L1893 HydrophobicContact CB-CD2 3.57Å; M1862-L1893 HydrophobicContact CG-CD2 3.87Å; M1862-L1893 VanDerWaalsContact O-CD2 3.29Å; M1862-L1893 WeakPolarHBondContact O-CD2 3.38Å; M1862-L1893 HydrophobicContact SD-CD2 4.35Å
1863	N	75.7	Confident	75.9	Confident	68 Å²	68	49.8 Å²	49.8	36%	0.364	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-117.5	140.2	-169.4	-168.4	-59.5	0	0	0	111.3	S1855 C1856 E1865	S1855-N1863 VanDerWaalsContact OG-CG 3.23Å; S1855-N1863 PolarHBondContact OG-ND2 2.65Å; S1855-N1863 PolarHBondContact OG-OD1 3.08Å; C1856-N1863 WeakPolarHBondContact O-CA 3.29Å; N1863-E1865 PolarHBondContact O-N 3.23Å; N1863-E1865 WeakPolarHBondContact OD1-CA 3.41Å; N1863-E1865 PolarHBondContact OD1-N 3Å
1864	S	73.6	Confident	74.3	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.035	27%	0.273	C	S	.	.			trans	-73.4	-1.1	178.7	69.5	0	0	0	0	115.8	C1856 F1867	C1856-S1864 PolarHBondContact N-OG 2.86Å; C1856-S1864 PolarHBondContact O-N 3.49Å; C1856-S1864 PolarHBondContact SG-OG 3.11Å; S1864-F1867 VanDerWaalsContact CB-CE2 3.49Å; S1864-F1867 WeakPolarHBondContact O-CZ 3.49Å; S1864-F1867 VanDerWaalsContact OG-CE2 3.27Å; S1864-F1867 WeakPolarHBondContact OG-CE2 3.2Å
1865	E	72.7	Confident	72.9	Confident	76 Å²	76	61.4 Å²	61.4	36%	0.355	30%	0.296	S	S	.	.			trans	63.9	170.3	-155.9	-56.2	-166.9	137.5	0	0	114	K1722 N1863 F1867	K1722-E1865 VanDerWaalsContact CE-OE1 3.32Å; K1722-E1865 WeakPolarHBondContact CE-OE1 3.43Å; K1722-E1865 IonicContact NZ-OE1 2.78Å; K1722-E1865 PolarHBondContact NZ-OE1 2.93Å; K1722-E1865 IonicContact NZ-OE2 2.72Å; K1722-E1865 PolarHBondContact NZ-OE2 2.93Å; N1863-E1865 PolarHBondContact O-N 3.23Å; N1863-E1865 WeakPolarHBondContact OD1-CA 3.41Å; N1863-E1865 PolarHBondContact OD1-N 3Å; E1865-F1867 PolarHBondContact O-N 2.99Å
1866	K	82.1	Confident	72	Confident	99 Å²	99	63 Å²	63	43%	0.43	31%	0.306	S	S	.	.			trans	-76	104.9	173.7	-80.4	-166.9	174.2	-167.8	0	110.1	W1853 I1868 D1904	W1853-K1866 HydrophobicContact CB-CB 4.36Å; W1853-K1866 HydrophobicContact CB-CD 4.38Å; W1853-K1866 HydrophobicContact CD2-CD 3.65Å; W1853-K1866 HydrophobicContact CD2-CG 3.9Å; W1853-K1866 VanDerWaalsContact CE2-NZ 3.26Å; W1853-K1866 HydrophobicContact CE3-CD 3.99Å; W1853-K1866 HydrophobicContact CE3-CG 3.72Å; W1853-K1866 HydrophobicContact CG-CD 3.8Å; W1853-K1866 HydrophobicContact CG-CG 4.25Å; W1853-K1866 VanDerWaalsContact CZ2-CE 3.49Å; W1853-K1866 HydrophobicContact CZ3-CG 4.25Å; W1853-K1866 VanDerWaalsContact NE1-NZ 3.14Å; K1866-I1868 PolarHBondContact O-N 3.16Å; K1866-D1904 IonicContact NZ-OD2 2.76Å; K1866-D1904 PolarHBondContact NZ-OD2 2.87Å
1867	F	84.5	Confident	71.3	Confident	17 Å²	17	67.1 Å²	67.1	8%	0.075	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	107.6	167	-59	-55.4	0	0	0	110.5	Y1834 I1836 W1853 I1854 S1864 E1865 F1888	Y1834-F1867 HydrophobicContact CD1-CD2 4.48Å; Y1834-F1867 AromaticContact CD1-CE2 3.42Å; Y1834-F1867 HydrophobicContact CD1-CE2 3.42Å; Y1834-F1867 VanDerWaalsContact CD1-CE2 3.42Å; Y1834-F1867 AromaticContact CD1-CZ 3.86Å; Y1834-F1867 HydrophobicContact CD1-CZ 3.86Å; Y1834-F1867 HydrophobicContact CD2-CE2 4.38Å; Y1834-F1867 AromaticContact CD2-CZ 3.97Å; Y1834-F1867 HydrophobicContact CD2-CZ 3.97Å; Y1834-F1867 AromaticContact CE1-CE2 3.78Å; Y1834-F1867 HydrophobicContact CE1-CE2 3.78Å; Y1834-F1867 HydrophobicContact CE1-CZ 4.11Å; Y1834-F1867 HydrophobicContact CE2-CZ 4.26Å; Y1834-F1867 AromaticContact CG-CE2 3.76Å; Y1834-F1867 HydrophobicContact CG-CE2 3.76Å; Y1834-F1867 AromaticContact CG-CZ 3.78Å; Y1834-F1867 HydrophobicContact CG-CZ 3.78Å; I1836-F1867 HydrophobicContact CD1-CB 4.23Å; I1836-F1867 HydrophobicContact CD1-CD2 3.9Å; I1836-F1867 HydrophobicContact CD1-CG 4.38Å; W1853-F1867 CarbonylContact C-O 2.93Å; W1853-F1867 WeakPolarHBondContact CA-O 3.16Å; I1854-F1867 PolarHBondContact N-O 3.04Å; I1854-F1867 PolarHBondContact O-N 3.22Å; S1864-F1867 VanDerWaalsContact CB-CE2 3.49Å; S1864-F1867 WeakPolarHBondContact O-CZ 3.49Å; S1864-F1867 VanDerWaalsContact OG-CE2 3.27Å; S1864-F1867 WeakPolarHBondContact OG-CE2 3.2Å; E1865-F1867 PolarHBondContact O-N 2.99Å; F1867-F1888 HydrophobicContact CB-CD1 4.13Å; F1867-F1888 HydrophobicContact CB-CD2 3.72Å; F1867-F1888 HydrophobicContact CB-CE1 4.03Å; F1867-F1888 HydrophobicContact CB-CE2 3.61Å; F1867-F1888 HydrophobicContact CB-CG 3.99Å; F1867-F1888 HydrophobicContact CB-CZ 3.78Å; F1867-F1888 HydrophobicContact CD1-CB 3.5Å; F1867-F1888 AromaticContact CD1-CD1 3.7Å; F1867-F1888 HydrophobicContact CD1-CD1 3.7Å; F1867-F1888 AromaticContact CD1-CD2 3.88Å; F1867-F1888 HydrophobicContact CD1-CD2 3.88Å; F1867-F1888 HydrophobicContact CD1-CE1 4.41Å; F1867-F1888 AromaticContact CD1-CG 3.4Å; F1867-F1888 HydrophobicContact CD1-CG 3.4Å; F1867-F1888 HydrophobicContact CD2-CD2 4.23Å; F1867-F1888 HydrophobicContact CE1-CB 3.48Å; F1867-F1888 VanDerWaalsContact CE1-CB 3.48Å; F1867-F1888 HydrophobicContact CE1-CD1 4.48Å; F1867-F1888 AromaticContact CE1-CG 3.95Å; F1867-F1888 HydrophobicContact CE1-CG 3.95Å; F1867-F1888 HydrophobicContact CG-CB 4.15Å; F1867-F1888 HydrophobicContact CG-CD1 4.19Å; F1867-F1888 AromaticContact CG-CD2 3.69Å; F1867-F1888 HydrophobicContact CG-CD2 3.69Å; F1867-F1888 HydrophobicContact CG-CE2 4.12Å; F1867-F1888 AromaticContact CG-CG 3.73Å; F1867-F1888 HydrophobicContact CG-CG 3.73Å; F1867-F1888 HydrophobicContact CZ-CB 4.09Å
1868	I	84.8	Confident	70.9	Confident	88 Å²	88	66.3 Å²	66.3	45%	0.451	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	127.3	172.9	-62	178.4	0	0	0	109.5	W1853 K1866 C1870 T1876 F1888	W1853-I1868 HydrophobicContact CB-CG1 4.46Å; K1866-I1868 PolarHBondContact O-N 3.16Å; I1868-C1870 PolarHBondContact O-N 2.79Å; I1868-C1870 VanDerWaalsContact O-N 3.12Å; I1868-T1876 HydrophobicContact CG2-CG2 4.03Å; I1868-F1888 WeakPolarHBondContact O-CE1 3.39Å; I1868-F1888 VanDerWaalsContact O-CZ 3.31Å; I1868-F1888 WeakPolarHBondContact O-CZ 3.45Å
1869	L	82.2	Confident	70.5	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	35%	0.348	C	S	.	.			trans	-88.3	74.1	-171.6	-53.2	179.4	0	0	0	111.5	I1836 V1838 V1852 I1854 F1886 F1888 W1913	I1836-L1869 HydrophobicContact CD1-CD2 4.25Å; I1836-L1869 HydrophobicContact CG2-CD2 4.44Å; V1838-L1869 HydrophobicContact CG2-CD1 4.03Å; V1852-L1869 HydrophobicContact CG2-CB 4.24Å; V1852-L1869 HydrophobicContact CG2-CD1 4.41Å; V1852-L1869 WeakPolarHBondContact O-CB 3.43Å; V1852-L1869 WeakPolarHBondContact O-CG 3.44Å; V1852-L1869 PolarHBondContact O-N 3.15Å; I1854-L1869 HydrophobicContact CD1-CD1 3.9Å; I1854-L1869 HydrophobicContact CD1-CD2 4.39Å; I1854-L1869 HydrophobicContact CG1-CD1 4.15Å; L1869-F1886 HydrophobicContact CB-CD1 3.95Å; L1869-F1886 HydrophobicContact CB-CD2 4.23Å; L1869-F1886 HydrophobicContact CB-CE1 3.68Å; L1869-F1886 HydrophobicContact CB-CE2 3.98Å; L1869-F1886 HydrophobicContact CB-CG 4.21Å; L1869-F1886 HydrophobicContact CB-CZ 3.69Å; L1869-F1886 HydrophobicContact CD1-CE2 4.28Å; L1869-F1886 HydrophobicContact CD2-CB 4.23Å; L1869-F1886 HydrophobicContact CD2-CD1 4.39Å; L1869-F1886 HydrophobicContact CD2-CD2 3.79Å; L1869-F1886 HydrophobicContact CD2-CE2 4.27Å; L1869-F1886 HydrophobicContact CD2-CG 3.86Å; L1869-F1886 HydrophobicContact CG-CD2 4.41Å; L1869-F1886 HydrophobicContact CG-CE2 4.41Å; L1869-F1886 WeakPolarHBondContact O-CE1 3.48Å; L1869-F1888 HydrophobicContact CD2-CE2 4.08Å; L1869-F1888 HydrophobicContact CD2-CZ 4.21Å; L1869-W1913 HydrophobicContact CD1-CH2 4.21Å
1870	C	72.4	Confident	70.9	Confident	39 Å²	39	75.2 Å²	75.2	26%	0.264	36%	0.356	S	S	.	.			trans	-94.3	148.6	173.8	55	0	0	0	0	112.9	I1868 R1875 T1876 F1886	I1868-C1870 PolarHBondContact O-N 2.79Å; I1868-C1870 VanDerWaalsContact O-N 3.12Å; C1870-R1875 WeakPolarHBondContact CA-O 3.29Å; C1870-T1876 HydrophobicContact CB-CG2 4.38Å; C1870-F1886 VanDerWaalsContact O-CD1 3.28Å; C1870-F1886 WeakPolarHBondContact O-CD1 3.4Å; C1870-F1886 WeakPolarHBondContact O-CE1 3.4Å
1871	D	61.1	Low	70.9	Confident	12 Å²	12	75.5 Å²	75.5	6%	0.064	36%	0.364	C	S	.	.			trans	-76.4	174.1	171.4	84.4	-5.9	0	0	0	112.4	Y1873 N1874 R1875 R1884	D1871-Y1873 PolarHBondContact O-N 2.81Å; D1871-Y1873 WeakPolarHBondContact OD1-CA 3.17Å; D1871-Y1873 WeakPolarHBondContact OD1-CB 3.37Å; D1871-Y1873 PolarHBondContact OD1-N 3.45Å; D1871-N1874 WeakPolarHBondContact O-CA 3.29Å; D1871-N1874 PolarHBondContact O-N 3.3Å; D1871-R1875 PolarHBondContact N-O 3.48Å; D1871-R1875 WeakPolarHBondContact OD1-CB 3.26Å; D1871-R1875 IonicContact OD1-CZ 2.66Å; D1871-R1875 PolarHBondContact OD1-N 3.31Å; D1871-R1875 VanDerWaalsContact OD1-N 3.15Å; D1871-R1875 IonicContact OD1-NE 2.61Å; D1871-R1875 PolarHBondContact OD1-NE 3.04Å; D1871-R1875 IonicContact OD1-NH2 3.59Å; D1871-R1875 IonicContact OD2-CZ 2.73Å; D1871-R1875 IonicContact OD2-NE 3.1Å; D1871-R1875 PolarHBondContact OD2-NE 3.48Å; D1871-R1875 IonicContact OD2-NH2 3.82Å; D1871-R1875 PolarHBondContact OD2-NH2 3.17Å; D1871-R1884 IonicContact OD2-CZ 3.38Å; D1871-R1884 IonicContact OD2-NH1 2.67Å; D1871-R1884 IonicContact OD2-NH2 2.64Å; D1871-R1884 PolarHBondContact OD2-NH2 3.37Å
1872	C	48.1	Very low	70.8	Confident	105 Å²	105	69.5 Å²	69.5	71%	0.709	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	1	-179.5	52.1	0	0	0	0	115.5
1873	Y	53.6	Low	71	Confident	169 Å²	169	68 Å²	68	66%	0.663	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	21.5	170.3	-54.8	-94.5	0	0	0	111.4	D1871 R1875	D1871-Y1873 PolarHBondContact O-N 2.81Å; D1871-Y1873 WeakPolarHBondContact OD1-CA 3.17Å; D1871-Y1873 WeakPolarHBondContact OD1-CB 3.37Å; D1871-Y1873 PolarHBondContact OD1-N 3.45Å; Y1873-R1875 PolarHBondContact O-N 2.79Å
1874	N	57.2	Low	70.9	Confident	131 Å²	131	68.8 Å²	68.8	70%	0.701	33%	0.333	S	S	*	.	S	Bend	trans	57.3	19.2	-173.7	-87	-9.6	0	0	0	115.8	D1871	D1871-N1874 WeakPolarHBondContact O-CA 3.29Å; D1871-N1874 PolarHBondContact O-N 3.3Å
1875	R	59.1	Low	70.7	Confident	130 Å²	130	73.1 Å²	73.1	49%	0.491	35%	0.35	S	S	.	.			trans	-88.6	127.4	-179.8	-58.6	172.7	-61	-148.4	-0.8	111.3	C1870 D1871 Y1873	C1870-R1875 WeakPolarHBondContact CA-O 3.29Å; D1871-R1875 PolarHBondContact N-O 3.48Å; D1871-R1875 WeakPolarHBondContact OD1-CB 3.26Å; D1871-R1875 IonicContact OD1-CZ 2.66Å; D1871-R1875 PolarHBondContact OD1-N 3.31Å; D1871-R1875 VanDerWaalsContact OD1-N 3.15Å; D1871-R1875 IonicContact OD1-NE 2.61Å; D1871-R1875 PolarHBondContact OD1-NE 3.04Å; D1871-R1875 IonicContact OD1-NH2 3.59Å; D1871-R1875 IonicContact OD2-CZ 2.73Å; D1871-R1875 IonicContact OD2-NE 3.1Å; D1871-R1875 PolarHBondContact OD2-NE 3.48Å; D1871-R1875 IonicContact OD2-NH2 3.82Å; D1871-R1875 PolarHBondContact OD2-NH2 3.17Å; Y1873-R1875 PolarHBondContact O-N 2.79Å
1876	T	68.1	Low	71	Confident	38 Å²	38	69.9 Å²	69.9	23%	0.233	33%	0.334	C	S	.	.			trans	-82.2	-17.3	-179	45.4	0	0	0	0	114.8	P1851 I1868 C1870 L1878	P1851-T1876 HydrophobicContact CB-CG2 4.14Å; I1868-T1876 HydrophobicContact CG2-CG2 4.03Å; C1870-T1876 HydrophobicContact CB-CG2 4.38Å; T1876-L1878 PolarHBondContact O-N 3.29Å
1877	M	72.2	Confident	70.7	Confident	86 Å²	86	71.7 Å²	71.7	42%	0.424	34%	0.339	S	S	.	.			trans	-62.1	116.7	-177.4	-178.4	-158	-51.8	0	0	113	T1848 K1879	T1848-M1877 WeakPolarHBondContact O-CA 3.16Å; T1848-M1877 WeakPolarHBondContact O-CG 3.35Å; M1877-K1879 HydrophobicContact CG-CG 4.34Å; M1877-K1879 HydrophobicContact SD-CD 4.32Å; M1877-K1879 WeakPolarHBondContact SD-CE 3.5Å; M1877-K1879 HydrophobicContact SD-CG 3.97Å
1878	L	77.3	Confident	70.4	Confident	2 Å²	2	73 Å²	73	1%	0.01	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-103.6	114.7	170.8	-47.7	-172.1	0	0	0	110.4	G1847 T1848 V1852 T1876 R1884 F1886 W1913	G1847-L1878 CarbonylContact C-O 3.57Å; G1847-L1878 WeakPolarHBondContact CA-O 3.4Å; T1848-L1878 HydrophobicContact CG2-CB 4.01Å; T1848-L1878 HydrophobicContact CG2-CG 4.2Å; T1848-L1878 PolarHBondContact N-O 2.89Å; T1848-L1878 PolarHBondContact O-N 3.06Å; T1848-L1878 VanDerWaalsContact O-N 3.15Å; V1852-L1878 HydrophobicContact CG2-CD1 3.67Å; V1852-L1878 HydrophobicContact CG2-CG 3.88Å; T1876-L1878 PolarHBondContact O-N 3.29Å; L1878-R1884 HydrophobicContact CD2-CB 4.49Å; L1878-R1884 HydrophobicContact CD2-CG 4.14Å; L1878-F1886 HydrophobicContact CD1-CZ 4.48Å; L1878-F1886 HydrophobicContact CD2-CE1 4.46Å; L1878-F1886 HydrophobicContact CD2-CZ 3.83Å; L1878-W1913 HydrophobicContact CD1-CH2 4.4Å; L1878-W1913 HydrophobicContact CD1-CZ2 3.51Å
1879	K	72.4	Confident	69.7	Low	133 Å²	133	72.3 Å²	72.3	58%	0.578	35%	0.352	S	S	*	.			trans	-81.8	147.6	-176	-62.7	-178	179.4	-178.2	0	111.2	T1840 M1877 T1882	T1840-K1879 WeakPolarHBondContact CB-O 3.26Å; M1877-K1879 HydrophobicContact CG-CG 4.34Å; M1877-K1879 HydrophobicContact SD-CD 4.32Å; M1877-K1879 WeakPolarHBondContact SD-CE 3.5Å; M1877-K1879 HydrophobicContact SD-CG 3.97Å; K1879-T1882 HydrophobicContact CB-CG2 3.96Å; K1879-T1882 WeakPolarHBondContact O-CB 3.01Å; K1879-T1882 WeakPolarHBondContact O-CG2 3.04Å; K1879-T1882 PolarHBondContact O-N 3.15Å; K1879-T1882 PolarHBondContact O-OG1 3.19Å
1880	R	79.2	Confident	69.3	Low	136 Å²	136	72.8 Å²	72.8	51%	0.513	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	141.3	173.8	66.9	175.2	-175	-115.8	-5.9	111.9	G1841 D1843 R1844 A1846 T1882	G1841-R1880 CarbonylContact O-C 3.5Å; G1841-R1880 WeakPolarHBondContact O-CA 3.35Å; G1841-R1880 WeakPolarHBondContact O-CB 3.49Å; D1843-R1880 WeakPolarHBondContact O-CB 3.37Å; D1843-R1880 WeakPolarHBondContact O-CD 3.31Å; R1844-R1880 PolarHBondContact O-NH1 3.41Å; A1846-R1880 HydrophobicContact CB-CB 4.18Å; R1880-T1882 VanDerWaalsContact C-N 3.26Å; R1880-T1882 PolarHBondContact O-N 3.49Å
1881	G	71	Confident	69.4	Low	26 Å²	26	72.5 Å²	72.5	27%	0.268	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	65	24.9	177.9	0	0	0	0	0	114.7	T1840 G1841 K2421	T1840-G1881 VanDerWaalsContact O-CA 3.27Å; T1840-G1881 WeakPolarHBondContact O-CA 3.37Å; T1840-G1881 PolarHBondContact O-N 3.42Å; T1840-G1881 VanDerWaalsContact O-N 3.08Å; G1841-G1881 PolarHBondContact O-N 2.69Å; G1881-K2421 PolarHBondContact O-NZ 2.77Å
1882	T	72.4	Confident	70.2	Confident	39 Å²	39	75.7 Å²	75.7	24%	0.239	37%	0.367	C	S	.	.			trans	-115.3	137.8	176.1	70.1	0	0	0	0	112.3	T1840 K1879 R1880	T1840-T1882 WeakPolarHBondContact CB-O 3.37Å; T1840-T1882 PolarHBondContact N-O 2.81Å; T1840-T1882 PolarHBondContact OG1-O 2.84Å; T1840-T1882 VanDerWaalsContact OG1-O 3.13Å; K1879-T1882 HydrophobicContact CB-CG2 3.96Å; K1879-T1882 WeakPolarHBondContact O-CB 3.01Å; K1879-T1882 WeakPolarHBondContact O-CG2 3.04Å; K1879-T1882 PolarHBondContact O-N 3.15Å; K1879-T1882 PolarHBondContact O-OG1 3.19Å; R1880-T1882 VanDerWaalsContact C-N 3.26Å; R1880-T1882 PolarHBondContact O-N 3.49Å
1883	T	72	Confident	71.6	Confident	29 Å²	29	70.8 Å²	70.8	18%	0.178	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.2	165.4	-50.6	0	0	0	0	108	T1837 V1838 I1839 Y2511 Q2512	T1837-T1883 HydrophobicContact CG2-CG2 3.79Å; V1838-T1883 CarbonylContact O-C 3.48Å; V1838-T1883 VanDerWaalsContact O-CA 3.32Å; V1838-T1883 WeakPolarHBondContact O-CA 3.41Å; I1839-T1883 HydrophobicContact CG1-CG2 3.92Å; T1883-Y2511 PolarHBondContact OG1-O 3.42Å; T1883-Q2512 HydrophobicContact CG2-CG 4.26Å
1884	R	71.9	Confident	72.6	Confident	84 Å²	84	66.2 Å²	66.2	32%	0.317	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	146.5	178.1	-71.2	-69	-141.7	164.5	14.5	111	T1837 V1838 D1871 L1878 F1886	T1837-R1884 WeakPolarHBondContact CA-O 3.33Å; V1838-R1884 PolarHBondContact N-O 2.9Å; V1838-R1884 PolarHBondContact O-N 2.81Å; D1871-R1884 IonicContact OD2-CZ 3.38Å; D1871-R1884 IonicContact OD2-NH1 2.67Å; D1871-R1884 IonicContact OD2-NH2 2.64Å; D1871-R1884 PolarHBondContact OD2-NH2 3.37Å; L1878-R1884 HydrophobicContact CD2-CB 4.49Å; L1878-R1884 HydrophobicContact CD2-CG 4.14Å; R1884-F1886 HydrophobicContact CB-CE1 4.37Å; R1884-F1886 HydrophobicContact CB-CE2 3.65Å; R1884-F1886 HydrophobicContact CB-CZ 3.44Å; R1884-F1886 VanDerWaalsContact CB-CZ 3.44Å; R1884-F1886 HydrophobicContact CG-CZ 4.35Å
1885	Y	70.9	Confident	73.3	Confident	96 Å²	96	63.4 Å²	63.4	38%	0.376	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.8	177.6	-70.7	-67.4	0	0	0	110.5	I1836 T1837 Q2512	I1836-Y1885 WeakPolarHBondContact O-CA 3.04Å; T1837-Y1885 HydrophobicContact CG2-CD1 3.78Å; T1837-Y1885 HydrophobicContact CG2-CE1 3.6Å; T1837-Y1885 VanDerWaalsContact OG1-CD1 3.29Å; T1837-Y1885 WeakPolarHBondContact OG1-CD1 3.06Å; T1837-Y1885 VanDerWaalsContact OG1-CE1 3.27Å; T1837-Y1885 WeakPolarHBondContact OG1-CE1 3.46Å; Y1885-Q2512 PolarHBondContact OH-NE2 2.75Å; Y1885-Q2512 PolarHBondContact OH-OE1 3.1Å; Y1885-Q2512 VanDerWaalsContact OH-OE1 3.07Å
1886	F	77.8	Confident	74.4	Confident	9 Å²	9	57.6 Å²	57.6	4%	0.039	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.2	175.9	-45.2	-87.3	0	0	0	108.7	I1836 V1838 L1869 C1870 L1878 R1884 F1888	I1836-F1886 HydrophobicContact CB-CB 4.29Å; I1836-F1886 HydrophobicContact CB-CD2 4.44Å; I1836-F1886 PolarHBondContact N-O 2.73Å; I1836-F1886 PolarHBondContact O-N 3.41Å; V1838-F1886 HydrophobicContact CB-CE2 4.39Å; V1838-F1886 HydrophobicContact CG2-CD2 4.31Å; V1838-F1886 HydrophobicContact CG2-CE2 3.95Å; L1869-F1886 HydrophobicContact CB-CD1 3.95Å; L1869-F1886 HydrophobicContact CB-CD2 4.23Å; L1869-F1886 HydrophobicContact CB-CE1 3.68Å; L1869-F1886 HydrophobicContact CB-CE2 3.98Å; L1869-F1886 HydrophobicContact CB-CG 4.21Å; L1869-F1886 HydrophobicContact CB-CZ 3.69Å; L1869-F1886 HydrophobicContact CD1-CE2 4.28Å; L1869-F1886 HydrophobicContact CD2-CB 4.23Å; L1869-F1886 HydrophobicContact CD2-CD1 4.39Å; L1869-F1886 HydrophobicContact CD2-CD2 3.79Å; L1869-F1886 HydrophobicContact CD2-CE2 4.27Å; L1869-F1886 HydrophobicContact CD2-CG 3.86Å; L1869-F1886 HydrophobicContact CG-CD2 4.41Å; L1869-F1886 HydrophobicContact CG-CE2 4.41Å; L1869-F1886 WeakPolarHBondContact O-CE1 3.48Å; C1870-F1886 VanDerWaalsContact O-CD1 3.28Å; C1870-F1886 WeakPolarHBondContact O-CD1 3.4Å; C1870-F1886 WeakPolarHBondContact O-CE1 3.4Å; L1878-F1886 HydrophobicContact CD1-CZ 4.48Å; L1878-F1886 HydrophobicContact CD2-CE1 4.46Å; L1878-F1886 HydrophobicContact CD2-CZ 3.83Å; R1884-F1886 HydrophobicContact CB-CE1 4.37Å; R1884-F1886 HydrophobicContact CB-CE2 3.65Å; R1884-F1886 HydrophobicContact CB-CZ 3.44Å; R1884-F1886 VanDerWaalsContact CB-CZ 3.44Å; R1884-F1886 HydrophobicContact CG-CZ 4.35Å; F1886-F1888 HydrophobicContact CB-CD2 4.36Å; F1886-F1888 HydrophobicContact CB-CE2 3.4Å; F1886-F1888 HydrophobicContact CB-CZ 3.77Å; F1886-F1888 HydrophobicContact CG-CE2 4.44Å
1887	R	75.5	Confident	75	Confident	137 Å²	137	58.9 Å²	58.9	52%	0.517	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	124.2	178.9	179.8	175	167.1	125.2	7.7	108.8	Y1834 L1835 E2018	Y1834-R1887 WeakPolarHBondContact O-CA 3.37Å; L1835-R1887 HydrophobicContact CD2-CB 4.3Å; R1887-E2018 IonicContact CZ-OE1 2.71Å; R1887-E2018 IonicContact CZ-OE2 3.94Å; R1887-E2018 VanDerWaalsContact CZ-OE2 3.29Å; R1887-E2018 IonicContact NH1-OE2 2.71Å; R1887-E2018 PolarHBondContact NH1-OE2 3.27Å; R1887-E2018 IonicContact NH2-OE1 2.79Å; R1887-E2018 PolarHBondContact NH2-OE1 2.69Å; R1887-E2018 IonicContact NH2-OE2 3.19Å; R1887-E2018 PolarHBondContact NH2-OE2 3.04Å
1888	F	78.3	Confident	75.7	Confident	45 Å²	45	56.7 Å²	56.7	20%	0.197	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	161.8	178.9	-54.4	-83.9	0	0	0	109.9	P1833 Y1834 I1836 F1867 I1868 L1869 F1886	P1833-F1888 CarbonylContact C-O 3.54Å; P1833-F1888 WeakPolarHBondContact CA-O 3.06Å; Y1834-F1888 PolarHBondContact N-O 3.26Å; Y1834-F1888 PolarHBondContact O-N 2.86Å; I1836-F1888 HydrophobicContact CD1-CD2 3.79Å; I1836-F1888 HydrophobicContact CD1-CE2 3.71Å; I1836-F1888 HydrophobicContact CG1-CD2 4.12Å; I1836-F1888 HydrophobicContact CG1-CE2 4.16Å; F1867-F1888 HydrophobicContact CB-CD1 4.13Å; F1867-F1888 HydrophobicContact CB-CD2 3.72Å; F1867-F1888 HydrophobicContact CB-CE1 4.03Å; F1867-F1888 HydrophobicContact CB-CE2 3.61Å; F1867-F1888 HydrophobicContact CB-CG 3.99Å; F1867-F1888 HydrophobicContact CB-CZ 3.78Å; F1867-F1888 HydrophobicContact CD1-CB 3.5Å; F1867-F1888 AromaticContact CD1-CD1 3.7Å; F1867-F1888 HydrophobicContact CD1-CD1 3.7Å; F1867-F1888 AromaticContact CD1-CD2 3.88Å; F1867-F1888 HydrophobicContact CD1-CD2 3.88Å; F1867-F1888 HydrophobicContact CD1-CE1 4.41Å; F1867-F1888 AromaticContact CD1-CG 3.4Å; F1867-F1888 HydrophobicContact CD1-CG 3.4Å; F1867-F1888 HydrophobicContact CD2-CD2 4.23Å; F1867-F1888 HydrophobicContact CE1-CB 3.48Å; F1867-F1888 VanDerWaalsContact CE1-CB 3.48Å; F1867-F1888 HydrophobicContact CE1-CD1 4.48Å; F1867-F1888 AromaticContact CE1-CG 3.95Å; F1867-F1888 HydrophobicContact CE1-CG 3.95Å; F1867-F1888 HydrophobicContact CG-CB 4.15Å; F1867-F1888 HydrophobicContact CG-CD1 4.19Å; F1867-F1888 AromaticContact CG-CD2 3.69Å; F1867-F1888 HydrophobicContact CG-CD2 3.69Å; F1867-F1888 HydrophobicContact CG-CE2 4.12Å; F1867-F1888 AromaticContact CG-CG 3.73Å; F1867-F1888 HydrophobicContact CG-CG 3.73Å; F1867-F1888 HydrophobicContact CZ-CB 4.09Å; I1868-F1888 WeakPolarHBondContact O-CE1 3.39Å; I1868-F1888 VanDerWaalsContact O-CZ 3.31Å; I1868-F1888 WeakPolarHBondContact O-CZ 3.45Å; L1869-F1888 HydrophobicContact CD2-CE2 4.08Å; L1869-F1888 HydrophobicContact CD2-CZ 4.21Å; F1886-F1888 HydrophobicContact CB-CD2 4.36Å; F1886-F1888 HydrophobicContact CB-CE2 3.4Å; F1886-F1888 HydrophobicContact CB-CZ 3.77Å; F1886-F1888 HydrophobicContact CG-CE2 4.44Å
1889	A	71	Confident	76.2	Confident	73 Å²	73	56.6 Å²	56.6	60%	0.603	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.2	161.3	0	0	0	0	0	107.4	I1832	I1832-A1889 WeakPolarHBondContact O-CA 3.27Å
1890	G	73	Confident	77	Confident	9 Å²	9	53 Å²	53	9%	0.093	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	173.7	-179.3	0	0	0	0	0	111.3	T1831 I1832	T1831-G1890 CarbonylContact C-O 3.52Å; T1831-G1890 VanDerWaalsContact CA-O 3.28Å; T1831-G1890 WeakPolarHBondContact CA-O 3.32Å; I1832-G1890 PolarHBondContact N-O 3.23Å; I1832-G1890 PolarHBondContact O-N 3.39Å
1891	V	75.8	Confident	77.5	Confident	34 Å²	34	46.6 Å²	46.6	21%	0.206	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	142.3	179.4	177.2	0	0	0	0	110.9	Y1834 M1862 L1893	Y1834-V1891 WeakPolarHBondContact CE2-O 3.49Å; Y1834-V1891 PolarHBondContact OH-O 2.72Å; M1862-V1891 HydrophobicContact CE-CG1 4.32Å; M1862-V1891 HydrophobicContact SD-CG1 3.96Å; V1891-L1893 PolarHBondContact O-N 2.88Å
1892	K	78.4	Confident	78.3	Confident	79 Å²	79	45.4 Å²	45.4	34%	0.343	23%	0.229	S	C	.	.			trans	-67.9	98.8	171	-180	172	178.8	177.6	0	111.3	E1830 I1832 I1925	E1830-K1892 HydrophobicContact CB-CB 4.3Å; E1830-K1892 HydrophobicContact CB-CD 4.11Å; E1830-K1892 HydrophobicContact CG-CD 4.01Å; E1830-K1892 WeakPolarHBondContact O-CB 3.16Å; E1830-K1892 PolarHBondContact O-N 3.38Å; E1830-K1892 VanDerWaalsContact OE1-CD 3.31Å; E1830-K1892 WeakPolarHBondContact OE1-CD 3.32Å; E1830-K1892 IonicContact OE1-NZ 3.33Å; E1830-K1892 PolarHBondContact OE1-NZ 3.32Å; E1830-K1892 VanDerWaalsContact OE2-CD 3.28Å; E1830-K1892 WeakPolarHBondContact OE2-CD 3.33Å; E1830-K1892 IonicContact OE2-NZ 2.79Å; E1830-K1892 PolarHBondContact OE2-NZ 2.56Å; I1832-K1892 HydrophobicContact CD1-CB 4.05Å; I1832-K1892 HydrophobicContact CD1-CG 4.13Å; I1832-K1892 HydrophobicContact CG1-CB 4.12Å; I1832-K1892 HydrophobicContact CG2-CB 3.96Å; I1832-K1892 HydrophobicContact CG2-CD 4.18Å; I1832-K1892 HydrophobicContact CG2-CG 4.27Å; K1892-I1925 HydrophobicContact CG-CD1 4.4Å
1893	L	76.8	Confident	79	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.219	C	C	.	.			trans	-76.5	156.7	169.6	-64.7	179.1	0	0	0	111.3	Y1834 C1856 D1858 M1862 V1891 L1896 I1925	Y1834-L1893 VanDerWaalsContact OH-CD1 3.29Å; Y1834-L1893 WeakPolarHBondContact OH-CD1 3.17Å; Y1834-L1893 VanDerWaalsContact OH-CG 3.26Å; Y1834-L1893 WeakPolarHBondContact OH-CG 3.37Å; C1856-L1893 HydrophobicContact CB-CD1 3.92Å; C1856-L1893 WeakPolarHBondContact O-CD1 3.29Å; D1858-L1893 HydrophobicContact CB-CB 4.14Å; D1858-L1893 WeakPolarHBondContact OD2-CA 3.4Å; M1862-L1893 VanDerWaalsContact C-CD2 3.44Å; M1862-L1893 HydrophobicContact CB-CD2 3.57Å; M1862-L1893 HydrophobicContact CG-CD2 3.87Å; M1862-L1893 VanDerWaalsContact O-CD2 3.29Å; M1862-L1893 WeakPolarHBondContact O-CD2 3.38Å; M1862-L1893 HydrophobicContact SD-CD2 4.35Å; V1891-L1893 PolarHBondContact O-N 2.88Å; L1893-L1896 HydrophobicContact CB-CD2 4.14Å; L1893-L1896 HydrophobicContact CD1-CD2 3.68Å; L1893-I1925 VanDerWaalsContact O-CD1 3.23Å; L1893-I1925 WeakPolarHBondContact O-CD1 3.32Å
1894	N	74.1	Confident	79.4	Confident	74 Å²	74	46 Å²	46	40%	0.396	23%	0.229	S	C	.	.			trans	-83.3	-126.7	179.7	-74.2	-36.7	0	0	0	112	D1858 K1859 D1860 L1896	D1858-N1894 PolarHBondContact OD2-N 3.12Å; K1859-N1894 HydrophobicContact CG-CB 4.39Å; D1860-N1894 PolarHBondContact OD2-ND2 2.96Å; N1894-L1896 PolarHBondContact O-N 3.1Å
1895	D	73	Confident	79.5	Confident	72 Å²	72	42.2 Å²	42.2	39%	0.385	22%	0.216	S	C	.	.	S	Bend	trans	-81.7	110.2	175.7	-56.9	-72.6	0	0	0	108.7	D1858 K1859 K1927	D1858-D1895 CarbonylContact C-O 3.58Å; D1858-D1895 WeakPolarHBondContact CA-O 3.5Å; D1858-D1895 WeakPolarHBondContact CB-O 3.44Å; K1859-D1895 HydrophobicContact CD-CB 4.04Å; K1859-D1895 WeakPolarHBondContact CE-OD2 3.32Å; K1859-D1895 HydrophobicContact CG-CB 4.04Å; K1859-D1895 PolarHBondContact N-O 2.7Å; K1859-D1895 IonicContact NZ-OD2 2.75Å; K1859-D1895 PolarHBondContact NZ-OD2 2.81Å; D1895-K1927 IonicContact OD1-NZ 3.51Å; D1895-K1927 PolarHBondContact OD1-NZ 2.8Å
1896	L	81.6	Confident	79.2	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	141.2	179.4	-72.1	-167.6	0	0	0	111.4	C1856 D1858 L1893 N1894 I1899 L1920 F1922 Y1929 I1952	C1856-L1896 HydrophobicContact CB-CD1 4.18Å; C1856-L1896 HydrophobicContact CB-CD2 3.93Å; D1858-L1896 HydrophobicContact CB-CD2 4.26Å; L1893-L1896 HydrophobicContact CB-CD2 4.14Å; L1893-L1896 HydrophobicContact CD1-CD2 3.68Å; N1894-L1896 PolarHBondContact O-N 3.1Å; L1896-I1899 HydrophobicContact CD1-CD1 4.42Å; L1896-I1899 HydrophobicContact CD1-CG1 4.21Å; L1896-L1920 HydrophobicContact CD1-CD2 3.69Å; L1896-F1922 HydrophobicContact CD1-CE2 3.54Å; L1896-F1922 HydrophobicContact CD1-CZ 3.61Å; L1896-F1922 HydrophobicContact CD2-CZ 4.22Å; L1896-F1922 HydrophobicContact CG-CE2 4.18Å; L1896-F1922 HydrophobicContact CG-CZ 4.01Å; L1896-Y1929 HydrophobicContact CB-CE1 3.89Å; L1896-Y1929 HydrophobicContact CB-CE2 4.24Å; L1896-Y1929 HydrophobicContact CD1-CD2 3.89Å; L1896-Y1929 HydrophobicContact CD1-CE2 3.69Å; L1896-Y1929 HydrophobicContact CD1-CG 4.39Å; L1896-Y1929 HydrophobicContact CG-CE2 3.99Å; L1896-Y1929 PolarHBondContact N-OH 2.9Å; L1896-I1952 HydrophobicContact CB-CD1 3.24Å; L1896-I1952 HydrophobicContact CD1-CD1 4.05Å; L1896-I1952 HydrophobicContact CG-CD1 4.34Å
1897	T	80.9	Confident	78.1	Confident	64 Å²	64	48.9 Å²	48.9	39%	0.393	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-27.7	173.8	57.5	0	0	0	0	113.4	V1857 D1858 K1859 I1952	V1857-T1897 PolarHBondContact O-N 2.88Å; D1858-T1897 PolarHBondContact O-OG1 2.92Å; K1859-T1897 HydrophobicContact CB-CG2 3.87Å; T1897-I1952 PolarHBondContact O-N 2.9Å
1898	E	85.6	Confident	77.3	Confident	41 Å²	41	44.5 Å²	44.5	19%	0.192	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.3	-178.6	-169.2	175	128.4	0	0	111.4	V1857 Q1900 N1949 L1950	V1857-E1898 HydrophobicContact CB-CB 4.33Å; V1857-E1898 PolarHBondContact N-O 3.21Å; V1857-E1898 PolarHBondContact O-N 2.84Å; V1857-E1898 VanDerWaalsContact O-N 3.12Å; E1898-Q1900 HydrophobicContact CG-CG 4.43Å; E1898-Q1900 WeakPolarHBondContact OE1-CG 3.17Å; E1898-Q1900 PolarHBondContact OE1-NE2 3.44Å; E1898-N1949 HydrophobicContact CG-CB 4.36Å; E1898-N1949 PolarHBondContact OE1-ND2 3.5Å; E1898-L1950 WeakPolarHBondContact CA-O 3.32Å
1899	I	88.1	Confident	76.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.7	167.3	-55.5	172.2	0	0	0	108	I1854 S1855 L1896 V1901 L1918 L1920 F1931 L1950 I1952	I1854-I1899 HydrophobicContact CG2-CG2 3.87Å; S1855-I1899 CarbonylContact O-C 3.44Å; S1855-I1899 WeakPolarHBondContact O-CA 3.28Å; L1896-I1899 HydrophobicContact CD1-CD1 4.42Å; L1896-I1899 HydrophobicContact CD1-CG1 4.21Å; I1899-V1901 HydrophobicContact CG2-CG2 4.39Å; I1899-L1918 HydrophobicContact CG2-CD2 4.24Å; I1899-L1920 HydrophobicContact CD1-CB 4.07Å; I1899-L1920 HydrophobicContact CD1-CD2 3.5Å; I1899-L1920 HydrophobicContact CD1-CG 4.44Å; I1899-L1920 HydrophobicContact CG1-CD2 4.01Å; I1899-F1931 HydrophobicContact CD1-CD2 4.16Å; I1899-F1931 HydrophobicContact CD1-CE2 3.65Å; I1899-L1950 HydrophobicContact CB-CB 4.34Å; I1899-L1950 PolarHBondContact N-O 3.43Å; I1899-L1950 PolarHBondContact O-N 3.37Å; I1899-I1952 HydrophobicContact CD1-CD1 4.49Å; I1899-I1952 HydrophobicContact CG1-CD1 4.24Å
1900	Q	89.4	Confident	75.4	Confident	58 Å²	58	46.9 Å²	46.9	27%	0.271	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.6	175.3	-61.8	-172.5	-2.4	0	0	110.2	W1853 I1854 S1855 E1898 C1948 N1949	W1853-Q1900 HydrophobicContact CH2-CB 4.44Å; W1853-Q1900 HydrophobicContact CZ3-CB 4.02Å; I1854-Q1900 CarbonylContact C-O 3.39Å; I1854-Q1900 WeakPolarHBondContact CA-O 3.33Å; S1855-Q1900 PolarHBondContact N-O 2.99Å; S1855-Q1900 PolarHBondContact O-N 2.9Å; E1898-Q1900 HydrophobicContact CG-CG 4.43Å; E1898-Q1900 WeakPolarHBondContact OE1-CG 3.17Å; E1898-Q1900 PolarHBondContact OE1-NE2 3.44Å; Q1900-C1948 WeakPolarHBondContact CA-O 3.33Å; Q1900-N1949 PolarHBondContact NE2-ND2 3.01Å
1901	V	90.4	Very high	74.8	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.5	-177.2	-168.7	0	0	0	0	108.3	W1853 I1854 I1899 W1913 I1915 L1918 L1937 T1947 C1948 L1950	W1853-V1901 WeakPolarHBondContact O-CA 3.48Å; I1854-V1901 HydrophobicContact CD1-CG1 4.4Å; I1854-V1901 HydrophobicContact CG1-CB 4.38Å; I1854-V1901 HydrophobicContact CG1-CG1 3.93Å; I1854-V1901 HydrophobicContact CG1-CG2 4.17Å; I1899-V1901 HydrophobicContact CG2-CG2 4.39Å; V1901-W1913 HydrophobicContact CG1-CH2 4.04Å; V1901-W1913 HydrophobicContact CG1-CZ3 3.75Å; V1901-I1915 HydrophobicContact CG1-CD1 3.74Å; V1901-L1918 HydrophobicContact CG2-CD2 3.72Å; V1901-L1937 HydrophobicContact CG1-CD1 3.99Å; V1901-T1947 CarbonylContact O-C 3.58Å; V1901-T1947 WeakPolarHBondContact O-CA 3.38Å; V1901-C1948 PolarHBondContact N-O 3.5Å; V1901-C1948 PolarHBondContact O-N 3.17Å; V1901-L1950 HydrophobicContact CG2-CD1 3.88Å
1902	G	86.8	Confident	74.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	156.3	-178.1	0	0	0	0	0	115.6	V1852 W1853 R1946	V1852-G1902 VanDerWaalsContact CA-O 3.27Å; V1852-G1902 WeakPolarHBondContact CA-O 3.46Å; V1852-G1902 WeakPolarHBondContact CG1-O 3.19Å; W1853-G1902 PolarHBondContact N-O 3.35Å; W1853-G1902 PolarHBondContact O-N 3.17Å; G1902-R1946 WeakPolarHBondContact CA-O 3.49Å
1903	N	87.2	Confident	74.7	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	101.9	179.9	-176.1	21.1	0	0	0	110.8	T1848 V1852 A1905 W1913 L1937 R1946	T1848-N1903 PolarHBondContact OG1-OD1 3.48Å; V1852-N1903 HydrophobicContact CG1-CB 3.9Å; V1852-N1903 WeakPolarHBondContact CG1-OD1 2.99Å; N1903-A1905 VanDerWaalsContact C-N 3.33Å; N1903-A1905 WeakPolarHBondContact OD1-CB 3.15Å; N1903-A1905 PolarHBondContact OD1-N 3.48Å; N1903-W1913 HydrophobicContact CB-CE3 4.17Å; N1903-L1937 HydrophobicContact CB-CB 4.13Å; N1903-L1937 PolarHBondContact ND2-O 3.03Å; N1903-R1946 PolarHBondContact N-O 3.32Å; N1903-R1946 PolarHBondContact O-NH1 2.92Å
1904	D	81.7	Confident	75.2	Confident	74 Å²	74	48.5 Å²	48.5	40%	0.396	27%	0.269	S	S	.	.			trans	-96.5	16	-175.6	-62.6	-1.1	0	0	0	111	P1851 W1853 K1866	P1851-D1904 HydrophobicContact CG-CB 4.1Å; P1851-D1904 WeakPolarHBondContact O-CA 3.34Å; P1851-D1904 PolarHBondContact O-N 3.32Å; W1853-D1904 VanDerWaalsContact CD1-CG 3.44Å; W1853-D1904 PolarHBondContact NE1-OD1 3.1Å; W1853-D1904 PolarHBondContact NE1-OD2 2.77Å; K1866-D1904 IonicContact NZ-OD2 2.76Å; K1866-D1904 PolarHBondContact NZ-OD2 2.87Å
1905	A	73.1	Confident	75.8	Confident	5 Å²	5	45.1 Å²	45.1	4%	0.041	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-66.2	141.2	177.5	0	0	0	0	0	112.8	T1848 P1849 P1851 N1903 R1946	T1848-A1905 WeakPolarHBondContact OG1-CB 3.38Å; P1849-A1905 HydrophobicContact CG-CB 4.42Å; P1851-A1905 PolarHBondContact O-N 2.67Å; N1903-A1905 VanDerWaalsContact C-N 3.33Å; N1903-A1905 WeakPolarHBondContact OD1-CB 3.15Å; N1903-A1905 PolarHBondContact OD1-N 3.48Å; A1905-R1946 PolarHBondContact O-NH1 3.17Å; A1905-R1946 PolarHBondContact O-NH2 3.08Å
1906	P	64.7	Low	76.3	Confident	105 Å²	105	44.1 Å²	44.1	68%	0.682	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-64.9	156.1	179.8	26.8	-34.7	0	0	0	112.5
1907	E	55	Low	76.4	Confident	139 Å²	139	43.8 Å²	43.8	65%	0.65	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-71.7	133.6	-166.1	-60.3	-113.4	114.1	0	0	113.2	T1939 R1946	E1907-T1939 PolarHBondContact OE1-OG1 2.89Å; E1907-R1946 IonicContact OE1-CZ 3.54Å; E1907-R1946 IonicContact OE1-NE 2.77Å; E1907-R1946 IonicContact OE1-NH2 3.46Å; E1907-R1946 PolarHBondContact OE1-NH2 2.8Å
1908	S	58.1	Low	76.7	Confident	45 Å²	45	40.8 Å²	40.8	32%	0.315	22%	0.224	S	C	.	.			trans	-141.8	133.9	164.4	-179.9	0	0	0	0	108.9	S1910 M1911 N1940	S1908-S1910 PolarHBondContact O-N 2.8Å; S1908-S1910 PolarHBondContact OG-N 3.22Å; S1908-S1910 PolarHBondContact OG-OG 2.64Å; S1908-M1911 PolarHBondContact O-N 3.24Å; S1908-N1940 PolarHBondContact O-ND2 2.84Å
1909	P	55	Low	76.6	Confident	124 Å²	124	40.1 Å²	40.1	81%	0.805	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-3.4	173.6	26.5	-34.5	0	0	0	113.3	N1940	P1909-N1940 WeakPolarHBondContact CA-ND2 2.96Å
1910	S	55.6	Low	76.6	Confident	45 Å²	45	40.1 Å²	40.1	32%	0.315	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-15.3	-173.7	75.9	0	0	0	0	116.2	K1845 S1908	K1845-S1910 WeakPolarHBondContact CD-O 3.3Å; K1845-S1910 WeakPolarHBondContact CE-O 3.27Å; K1845-S1910 VanDerWaalsContact CG-O 3.3Å; K1845-S1910 WeakPolarHBondContact CG-O 3.25Å; K1845-S1910 PolarHBondContact NZ-O 3.31Å; S1908-S1910 PolarHBondContact O-N 2.8Å; S1908-S1910 PolarHBondContact OG-N 3.22Å; S1908-S1910 PolarHBondContact OG-OG 2.64Å
1911	M	58.4	Low	76.1	Confident	96 Å²	96	38.2 Å²	38.2	47%	0.473	21%	0.213	S	C	.	.			trans	-131.1	157.3	-171.1	-61.6	-165.4	-173.5	0	0	113.5	P1849 S1908	P1849-M1911 HydrophobicContact CB-SD 4.46Å; P1849-M1911 HydrophobicContact CG-SD 4.1Å; S1908-M1911 PolarHBondContact O-N 3.24Å
1912	G	69	Low	75.8	Confident	4 Å²	4	38.3 Å²	38.3	4%	0.041	21%	0.214	C	C	.	.			trans	-170.4	149.6	174	0	0	0	0	0	110.2	K1845 A1846 W1936	K1845-G1912 PolarHBondContact O-N 3.04Å; A1846-G1912 CarbonylContact C-O 3.51Å; A1846-G1912 VanDerWaalsContact C-O 3.32Å; A1846-G1912 WeakPolarHBondContact CA-O 3.15Å; G1912-W1936 WeakPolarHBondContact O-CZ3 3.43Å
1913	W	85.1	Confident	74.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.5	-178	-169.1	31.3	0	0	0	110	V1838 T1848 V1852 L1869 L1878 V1901 N1903 I1915 W1936 L1937	V1838-W1913 HydrophobicContact CG1-CH2 4.29Å; V1838-W1913 HydrophobicContact CG1-CZ2 3.73Å; T1848-W1913 HydrophobicContact CG2-CG 4.33Å; V1852-W1913 HydrophobicContact CB-CE3 4.22Å; V1852-W1913 HydrophobicContact CB-CH2 3.82Å; V1852-W1913 HydrophobicContact CB-CZ2 4.37Å; V1852-W1913 HydrophobicContact CB-CZ3 3.74Å; V1852-W1913 HydrophobicContact CG1-CD2 3.8Å; V1852-W1913 HydrophobicContact CG1-CE3 3.35Å; V1852-W1913 HydrophobicContact CG1-CH2 3.86Å; V1852-W1913 HydrophobicContact CG1-CZ2 4.28Å; V1852-W1913 HydrophobicContact CG1-CZ3 3.37Å; V1852-W1913 HydrophobicContact CG2-CH2 4.28Å; V1852-W1913 HydrophobicContact CG2-CZ2 4.4Å; L1869-W1913 HydrophobicContact CD1-CH2 4.21Å; L1878-W1913 HydrophobicContact CD1-CH2 4.4Å; L1878-W1913 HydrophobicContact CD1-CZ2 3.51Å; V1901-W1913 HydrophobicContact CG1-CH2 4.04Å; V1901-W1913 HydrophobicContact CG1-CZ3 3.75Å; N1903-W1913 HydrophobicContact CB-CE3 4.17Å; W1913-I1915 HydrophobicContact CH2-CD1 3.51Å; W1913-I1915 HydrophobicContact CH2-CG1 4.24Å; W1913-I1915 HydrophobicContact CZ2-CD1 3.76Å; W1913-I1915 HydrophobicContact CZ2-CG1 3.98Å; W1913-I1915 HydrophobicContact CZ3-CD1 3.92Å; W1913-W1936 CarbonylContact O-C 3.5Å; W1913-W1936 WeakPolarHBondContact O-CA 3.39Å; W1913-L1937 HydrophobicContact CB-CB 4.32Å; W1913-L1937 HydrophobicContact CD2-CD1 4.45Å; W1913-L1937 HydrophobicContact CE3-CB 4.17Å; W1913-L1937 HydrophobicContact CE3-CD1 3.46Å; W1913-L1937 VanDerWaalsContact CE3-CD1 3.46Å; W1913-L1937 HydrophobicContact CE3-CG 4.44Å; W1913-L1937 HydrophobicContact CZ3-CD1 3.7Å; W1913-L1937 PolarHBondContact N-O 3.13Å; W1913-L1937 PolarHBondContact O-N 3.07Å
1914	Y	86.7	Confident	74.2	Confident	56 Å²	56	39.9 Å²	39.9	22%	0.22	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.7	166.2	-175	-88.2	0	0	0	109.2	G1841 A1846 Q1916 K1934 E1935 W1936	G1841-Y1914 PolarHBondContact N-O 2.93Å; A1846-Y1914 PolarHBondContact O-N 3.32Å; Y1914-Q1916 HydrophobicContact CD1-CB 4.3Å; Y1914-Q1916 HydrophobicContact CE1-CB 4.09Å; Y1914-Q1916 HydrophobicContact CE1-CG 4.49Å; Y1914-K1934 WeakPolarHBondContact CE2-O 3.32Å; Y1914-K1934 WeakPolarHBondContact OH-CA 3.4Å; Y1914-K1934 PolarHBondContact OH-O 2.97Å; Y1914-E1935 WeakPolarHBondContact CA-O 3.3Å; Y1914-E1935 WeakPolarHBondContact CD2-O 3.09Å; Y1914-W1936 AromaticContact CD2-CD1 3.56Å; Y1914-W1936 AromaticContact CD2-CD2 3.82Å; Y1914-W1936 HydrophobicContact CD2-CD2 3.82Å; Y1914-W1936 AromaticContact CD2-CE2 3.59Å; Y1914-W1936 AromaticContact CD2-CG 3.79Å; Y1914-W1936 HydrophobicContact CD2-CG 3.79Å; Y1914-W1936 HydrophobicContact CD2-CZ2 4.19Å; Y1914-W1936 AromaticContact CD2-NE1 3.43Å; Y1914-W1936 AromaticContact CE2-CD1 3.97Å; Y1914-W1936 AromaticContact CE2-NE1 3.84Å; Y1914-W1936 HydrophobicContact CG-CD2 4.45Å
1915	I	86.8	Confident	73.9	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	108.8	178.5	-148.1	176	0	0	0	107.5	V1838 V1901 W1913 C1933 K1934 E1935 L1937	V1838-I1915 HydrophobicContact CG1-CD1 3.67Å; V1838-I1915 HydrophobicContact CG1-CG1 3.61Å; V1901-I1915 HydrophobicContact CG1-CD1 3.74Å; W1913-I1915 HydrophobicContact CH2-CD1 3.51Å; W1913-I1915 HydrophobicContact CH2-CG1 4.24Å; W1913-I1915 HydrophobicContact CZ2-CD1 3.76Å; W1913-I1915 HydrophobicContact CZ2-CG1 3.98Å; W1913-I1915 HydrophobicContact CZ3-CD1 3.92Å; I1915-C1933 HydrophobicContact CG2-CB 3.64Å; I1915-K1934 PolarHBondContact O-N 2.93Å; I1915-K1934 VanDerWaalsContact O-N 3.14Å; I1915-E1935 PolarHBondContact N-O 3.08Å; I1915-E1935 PolarHBondContact O-N 2.79Å; I1915-L1937 HydrophobicContact CB-CD1 4.44Å; I1915-L1937 HydrophobicContact CG2-CD1 4.17Å
1916	Q	82.7	Confident	73.9	Confident	52 Å²	52	38.2 Å²	38.2	24%	0.243	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-52.7	-176.4	-176.9	177.4	-36.1	0	0	109.8	I1839 Y1914 D1932 C1933 K1934	I1839-Q1916 HydrophobicContact CB-CB 4.38Å; I1839-Q1916 HydrophobicContact CG2-CB 4.1Å; I1839-Q1916 HydrophobicContact CG2-CG 4.49Å; I1839-Q1916 WeakPolarHBondContact O-CB 3.46Å; I1839-Q1916 PolarHBondContact O-N 2.98Å; Y1914-Q1916 HydrophobicContact CD1-CB 4.3Å; Y1914-Q1916 HydrophobicContact CE1-CB 4.09Å; Y1914-Q1916 HydrophobicContact CE1-CG 4.49Å; Q1916-D1932 CarbonylContact O-C 3.48Å; Q1916-C1933 PolarHBondContact O-N 3.29Å; Q1916-K1934 PolarHBondContact O-N 3.11Å
1917	S	83.5	Confident	74.5	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.007	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	150.6	179.8	-36.9	0	0	0	0	110.7	I1839 F1931 D1932	I1839-S1917 PolarHBondContact N-O 3.1Å; S1917-F1931 CarbonylContact C-O 3.5Å; S1917-F1931 VanDerWaalsContact CA-O 3.25Å; S1917-F1931 WeakPolarHBondContact CA-O 3.48Å; S1917-D1932 PolarHBondContact OG-OD1 2.8Å
1918	L	87.3	Confident	75.6	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.9	178.5	170.3	63.4	0	0	0	110.1	I1836 V1838 I1854 I1899 V1901 F1931 L1950	I1836-L1918 HydrophobicContact CG2-CD1 3.89Å; V1838-L1918 HydrophobicContact CG2-CD1 3.85Å; I1854-L1918 HydrophobicContact CD1-CD1 3.48Å; I1854-L1918 VanDerWaalsContact CD1-CD1 3.48Å; I1854-L1918 HydrophobicContact CD1-CD2 3.95Å; I1854-L1918 HydrophobicContact CD1-CG 4.4Å; I1899-L1918 HydrophobicContact CG2-CD2 4.24Å; V1901-L1918 HydrophobicContact CG2-CD2 3.72Å; L1918-F1931 HydrophobicContact CB-CB 4.46Å; L1918-F1931 PolarHBondContact N-O 2.61Å; L1918-F1931 PolarHBondContact O-N 3.37Å; L1918-L1950 HydrophobicContact CD2-CD1 3.67Å
1919	Y	84.8	Confident	76.9	Confident	27 Å²	27	26.9 Å²	26.9	11%	0.106	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.3	171	-39.1	-47	0	0	0	110.3	T1837 I1839 Y1929 L1930 Q2509	T1837-Y1919 HydrophobicContact CG2-CD2 4.02Å; T1837-Y1919 PolarHBondContact N-O 2.99Å; T1837-Y1919 PolarHBondContact O-N 2.82Å; I1839-Y1919 HydrophobicContact CD1-CE2 4.05Å; Y1919-Y1929 WeakPolarHBondContact CA-O 3.32Å; Y1919-L1930 HydrophobicContact CD1-CB 4.15Å; Y1919-L1930 HydrophobicContact CD1-CD2 3.84Å; Y1919-L1930 HydrophobicContact CD1-CG 3.98Å; Y1919-L1930 HydrophobicContact CE1-CD2 3.9Å; Y1919-L1930 HydrophobicContact CE1-CG 4.48Å; Y1919-Q2509 PolarHBondContact OH-OE1 3.24Å; Y1919-Q2509 VanDerWaalsContact OH-OE1 3.07Å
1920	L	86.6	Confident	78	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.9	179.3	179.4	68.8	0	0	0	110.3	Y1834 I1836 C1856 L1896 I1899 F1922 M1928 Y1929	Y1834-L1920 HydrophobicContact CD1-CD1 4.35Å; I1836-L1920 HydrophobicContact CD1-CD1 4.13Å; I1836-L1920 HydrophobicContact CG1-CD1 3.75Å; C1856-L1920 HydrophobicContact CB-CD2 4.21Å; C1856-L1920 WeakPolarHBondContact SG-CD2 3.29Å; L1896-L1920 HydrophobicContact CD1-CD2 3.69Å; I1899-L1920 HydrophobicContact CD1-CB 4.07Å; I1899-L1920 HydrophobicContact CD1-CD2 3.5Å; I1899-L1920 HydrophobicContact CD1-CG 4.44Å; I1899-L1920 HydrophobicContact CG1-CD2 4.01Å; L1920-F1922 HydrophobicContact CD1-CE2 4.49Å; L1920-F1922 HydrophobicContact CD2-CE2 3.6Å; L1920-F1922 HydrophobicContact CD2-CZ 3.93Å; L1920-F1922 HydrophobicContact CG-CD2 4.45Å; L1920-F1922 HydrophobicContact CG-CE2 3.66Å; L1920-F1922 HydrophobicContact CG-CZ 4.28Å; L1920-M1928 CarbonylContact O-C 3.44Å; L1920-M1928 VanDerWaalsContact O-CA 3.26Å; L1920-M1928 WeakPolarHBondContact O-CA 3.43Å; L1920-M1928 VanDerWaalsContact O-CG 3.27Å; L1920-M1928 WeakPolarHBondContact O-CG 3.41Å; L1920-Y1929 PolarHBondContact N-O 2.77Å; L1920-Y1929 PolarHBondContact O-N 3.33Å
1921	S	80.2	Confident	79.3	Confident	18 Å²	18	20.5 Å²	20.5	13%	0.126	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.3	-174	-173.2	0	0	0	0	112.9	L1835 P1923	L1835-S1921 PolarHBondContact N-O 3.33Å; L1835-S1921 PolarHBondContact O-N 2.9Å; S1921-P1923 WeakPolarHBondContact O-CD 3.33Å
1922	F	82.9	Confident	80.3	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.009	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	86.8	179.4	-67.6	-101.3	0	0	0	109.3	I1832 Y1834 L1896 L1920 T1924 I1925 G1926 K1927 Y1929	I1832-F1922 HydrophobicContact CD1-CD1 3.78Å; I1832-F1922 HydrophobicContact CD1-CE1 4.42Å; Y1834-F1922 AromaticContact CD1-CE1 3.81Å; Y1834-F1922 HydrophobicContact CD1-CE1 3.81Å; Y1834-F1922 AromaticContact CD1-CZ 3.89Å; Y1834-F1922 HydrophobicContact CD1-CZ 3.89Å; Y1834-F1922 HydrophobicContact CE1-CD1 4.37Å; Y1834-F1922 AromaticContact CE1-CE1 3.31Å; Y1834-F1922 HydrophobicContact CE1-CE1 3.31Å; Y1834-F1922 AromaticContact CE1-CZ 3.5Å; Y1834-F1922 HydrophobicContact CE1-CZ 3.5Å; Y1834-F1922 HydrophobicContact CE2-CE1 4.23Å; Y1834-F1922 HydrophobicContact CG-CE1 4.47Å; Y1834-F1922 AromaticContact CZ-CE1 3.54Å; L1896-F1922 HydrophobicContact CD1-CE2 3.54Å; L1896-F1922 HydrophobicContact CD1-CZ 3.61Å; L1896-F1922 HydrophobicContact CD2-CZ 4.22Å; L1896-F1922 HydrophobicContact CG-CE2 4.18Å; L1896-F1922 HydrophobicContact CG-CZ 4.01Å; L1920-F1922 HydrophobicContact CD1-CE2 4.49Å; L1920-F1922 HydrophobicContact CD2-CE2 3.6Å; L1920-F1922 HydrophobicContact CD2-CZ 3.93Å; L1920-F1922 HydrophobicContact CG-CD2 4.45Å; L1920-F1922 HydrophobicContact CG-CE2 3.66Å; L1920-F1922 HydrophobicContact CG-CZ 4.28Å; F1922-T1924 VanDerWaalsContact C-N 3.32Å; F1922-T1924 PolarHBondContact O-N 3.39Å; F1922-I1925 HydrophobicContact CB-CB 3.94Å; F1922-I1925 HydrophobicContact CB-CD1 4.19Å; F1922-I1925 HydrophobicContact CB-CG1 4.15Å; F1922-I1925 HydrophobicContact CD1-CD1 3.83Å; F1922-I1925 HydrophobicContact CG-CD1 4.29Å; F1922-I1925 PolarHBondContact O-N 2.86Å; F1922-I1925 VanDerWaalsContact O-N 3.13Å; F1922-G1926 PolarHBondContact O-N 2.81Å; F1922-K1927 PolarHBondContact N-O 3.15Å; F1922-Y1929 AromaticContact CD2-CD2 3.96Å; F1922-Y1929 HydrophobicContact CD2-CD2 3.96Å; F1922-Y1929 AromaticContact CD2-CE2 3.58Å; F1922-Y1929 HydrophobicContact CD2-CE2 3.58Å; F1922-Y1929 AromaticContact CE2-CD2 3.81Å; F1922-Y1929 HydrophobicContact CE2-CD2 3.81Å; F1922-Y1929 AromaticContact CE2-CE2 3.55Å; F1922-Y1929 HydrophobicContact CE2-CE2 3.55Å
1923	P	68.7	Low	81	Confident	8 Å²	8	20.6 Å²	20.6	5%	0.052	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-46.4	-176.2	-29.1	35.8	0	0	0	113.5	P1833 L1835 S1921 I1925 G1926 P1962 K1963	P1833-P1923 HydrophobicContact CB-CG 4.43Å; P1833-P1923 HydrophobicContact CG-CB 4.13Å; P1833-P1923 HydrophobicContact CG-CG 3.99Å; P1833-P1923 WeakPolarHBondContact O-CD 3.44Å; L1835-P1923 HydrophobicContact CD1-CG 3.9Å; S1921-P1923 WeakPolarHBondContact O-CD 3.33Å; P1923-I1925 VanDerWaalsContact C-N 3.32Å; P1923-I1925 PolarHBondContact O-N 2.8Å; P1923-G1926 PolarHBondContact O-N 2.55Å; P1923-P1962 CarbonylContact O-C 3.46Å; P1923-P1962 VanDerWaalsContact O-CA 3.26Å; P1923-P1962 WeakPolarHBondContact O-CA 3.23Å; P1923-K1963 HydrophobicContact CB-CB 4.22Å; P1923-K1963 PolarHBondContact O-N 2.91Å
1924	T	72.6	Confident	81.1	Confident	33 Å²	33	26.2 Å²	26.2	20%	0.202	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-17	-177.1	53	0	0	0	0	114.9	I1832 P1833 F1922 P1962 K1963	I1832-T1924 HydrophobicContact CB-CG2 4.28Å; I1832-T1924 VanDerWaalsContact CB-OG1 3.24Å; I1832-T1924 WeakPolarHBondContact CB-OG1 3.41Å; I1832-T1924 HydrophobicContact CG2-CG2 4.04Å; I1832-T1924 WeakPolarHBondContact CG2-OG1 3.27Å; P1833-T1924 HydrophobicContact CG-CG2 4.23Å; F1922-T1924 VanDerWaalsContact C-N 3.32Å; F1922-T1924 PolarHBondContact O-N 3.39Å; T1924-P1962 WeakPolarHBondContact O-CB 3.45Å; T1924-K1963 VanDerWaalsContact CA-O 3.3Å; T1924-K1963 WeakPolarHBondContact CA-O 3.4Å; T1924-K1963 WeakPolarHBondContact CG2-O 3.31Å
1925	I	76.1	Confident	80.9	Confident	40 Å²	40	27.1 Å²	27.1	21%	0.205	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-21.6	178.3	-53.6	-178	0	0	0	110.8	I1832 K1892 L1893 F1922 P1923 K1927	I1832-I1925 HydrophobicContact CD1-CD1 3.65Å; I1832-I1925 HydrophobicContact CD1-CG1 3.96Å; K1892-I1925 HydrophobicContact CG-CD1 4.4Å; L1893-I1925 VanDerWaalsContact O-CD1 3.23Å; L1893-I1925 WeakPolarHBondContact O-CD1 3.32Å; F1922-I1925 HydrophobicContact CB-CB 3.94Å; F1922-I1925 HydrophobicContact CB-CD1 4.19Å; F1922-I1925 HydrophobicContact CB-CG1 4.15Å; F1922-I1925 HydrophobicContact CD1-CD1 3.83Å; F1922-I1925 HydrophobicContact CG-CD1 4.29Å; F1922-I1925 PolarHBondContact O-N 2.86Å; F1922-I1925 VanDerWaalsContact O-N 3.13Å; P1923-I1925 VanDerWaalsContact C-N 3.32Å; P1923-I1925 PolarHBondContact O-N 2.8Å; I1925-K1927 HydrophobicContact CG2-CB 4.49Å; I1925-K1927 HydrophobicContact CG2-CD 3.81Å; I1925-K1927 HydrophobicContact CG2-CG 4.02Å
1926	G	72.7	Confident	80.9	Confident	3 Å²	3	29 Å²	29	3%	0.031	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	38.6	-175.4	0	0	0	0	0	112.6	F1922 P1923 K1959 F1960	F1922-G1926 PolarHBondContact O-N 2.81Å; P1923-G1926 PolarHBondContact O-N 2.55Å; G1926-K1959 CarbonylContact O-C 3.48Å; G1926-K1959 VanDerWaalsContact O-CA 3.32Å; G1926-K1959 WeakPolarHBondContact O-CA 3.08Å; G1926-F1960 CarbonylContact C-O 3.42Å; G1926-F1960 WeakPolarHBondContact CA-O 3.38Å; G1926-F1960 PolarHBondContact O-N 3.14Å; G1926-F1960 VanDerWaalsContact O-O 3.11Å
1927	K	76	Confident	81.1	Confident	31 Å²	31	26.6 Å²	26.6	14%	0.135	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.8	179.3	-66	178.7	-171.6	169.3	0	111.7	D1895 F1922 I1925 Y1929 V1958 F1960	D1895-K1927 IonicContact OD1-NZ 3.51Å; D1895-K1927 PolarHBondContact OD1-NZ 2.8Å; F1922-K1927 PolarHBondContact N-O 3.15Å; I1925-K1927 HydrophobicContact CG2-CB 4.49Å; I1925-K1927 HydrophobicContact CG2-CD 3.81Å; I1925-K1927 HydrophobicContact CG2-CG 4.02Å; K1927-Y1929 HydrophobicContact CB-CE2 4.07Å; K1927-Y1929 WeakPolarHBondContact CD-OH 3.16Å; K1927-V1958 CarbonylContact C-O 3.54Å; K1927-V1958 WeakPolarHBondContact CA-O 3.49Å; K1927-F1960 WeakPolarHBondContact O-CE1 3.27Å
1928	M	79.3	Confident	80.8	Confident	17 Å²	17	26.7 Å²	26.7	8%	0.084	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.9	166.1	-168.6	-179.7	72.8	0	0	109.6	L1920 L1930 V1958 F1960 L2528	L1920-M1928 CarbonylContact O-C 3.44Å; L1920-M1928 VanDerWaalsContact O-CA 3.26Å; L1920-M1928 WeakPolarHBondContact O-CA 3.43Å; L1920-M1928 VanDerWaalsContact O-CG 3.27Å; L1920-M1928 WeakPolarHBondContact O-CG 3.41Å; M1928-L1930 HydrophobicContact CE-CD1 3.58Å; M1928-L1930 HydrophobicContact CE-CD2 3.95Å; M1928-L1930 HydrophobicContact CE-CG 3.69Å; M1928-V1958 PolarHBondContact N-O 3.15Å; M1928-V1958 PolarHBondContact O-N 3.24Å; M1928-F1960 HydrophobicContact CB-CE1 4.08Å; M1928-L2528 HydrophobicContact CB-CD1 4.13Å; M1928-L2528 HydrophobicContact CE-CB 3.44Å; M1928-L2528 VanDerWaalsContact CE-CB 3.44Å; M1928-L2528 HydrophobicContact CE-CD1 3.78Å; M1928-L2528 HydrophobicContact CE-CG 4.23Å; M1928-L2528 HydrophobicContact CG-CD1 4.44Å; M1928-L2528 HydrophobicContact SD-CB 4.3Å; M1928-L2528 HydrophobicContact SD-CD1 3.51Å; M1928-L2528 VanDerWaalsContact SD-CD1 3.51Å
1929	Y	84.8	Confident	80.3	Confident	3 Å²	3	29.5 Å²	29.5	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.6	179.4	-54.1	-95	0	0	0	109.1	L1896 Y1919 L1920 F1922 K1927 I1952 N1956 I1957	L1896-Y1929 HydrophobicContact CB-CE1 3.89Å; L1896-Y1929 HydrophobicContact CB-CE2 4.24Å; L1896-Y1929 HydrophobicContact CD1-CD2 3.89Å; L1896-Y1929 HydrophobicContact CD1-CE2 3.69Å; L1896-Y1929 HydrophobicContact CD1-CG 4.39Å; L1896-Y1929 HydrophobicContact CG-CE2 3.99Å; L1896-Y1929 PolarHBondContact N-OH 2.9Å; Y1919-Y1929 WeakPolarHBondContact CA-O 3.32Å; L1920-Y1929 PolarHBondContact N-O 2.77Å; L1920-Y1929 PolarHBondContact O-N 3.33Å; F1922-Y1929 AromaticContact CD2-CD2 3.96Å; F1922-Y1929 HydrophobicContact CD2-CD2 3.96Å; F1922-Y1929 AromaticContact CD2-CE2 3.58Å; F1922-Y1929 HydrophobicContact CD2-CE2 3.58Å; F1922-Y1929 AromaticContact CE2-CD2 3.81Å; F1922-Y1929 HydrophobicContact CE2-CD2 3.81Å; F1922-Y1929 AromaticContact CE2-CE2 3.55Å; F1922-Y1929 HydrophobicContact CE2-CE2 3.55Å; K1927-Y1929 HydrophobicContact CB-CE2 4.07Å; K1927-Y1929 WeakPolarHBondContact CD-OH 3.16Å; Y1929-I1952 HydrophobicContact CD1-CD1 3.62Å; Y1929-I1952 HydrophobicContact CD1-CG1 3.99Å; Y1929-I1952 HydrophobicContact CD1-CG2 3.9Å; Y1929-I1952 HydrophobicContact CE1-CD1 3.86Å; Y1929-I1952 HydrophobicContact CE1-CG2 4.01Å; Y1929-I1952 HydrophobicContact CG-CD1 4.26Å; Y1929-N1956 CarbonylContact C-O 3.48Å; Y1929-N1956 VanDerWaalsContact CA-O 3.26Å; Y1929-N1956 WeakPolarHBondContact CA-O 3.41Å; Y1929-I1957 HydrophobicContact CD1-CG1 3.86Å; Y1929-I1957 HydrophobicContact CE1-CD1 4.13Å; Y1929-I1957 HydrophobicContact CE1-CG1 3.79Å; Y1929-I1957 HydrophobicContact CE1-CG2 4.26Å
1930	L	78.2	Confident	79.9	Confident	22 Å²	22	31.6 Å²	31.6	12%	0.115	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.3	179.1	-60.7	97.8	0	0	0	112.2	Y1919 M1928 N1956 V1958	Y1919-L1930 HydrophobicContact CD1-CB 4.15Å; Y1919-L1930 HydrophobicContact CD1-CD2 3.84Å; Y1919-L1930 HydrophobicContact CD1-CG 3.98Å; Y1919-L1930 HydrophobicContact CE1-CD2 3.9Å; Y1919-L1930 HydrophobicContact CE1-CG 4.48Å; M1928-L1930 HydrophobicContact CE-CD1 3.58Å; M1928-L1930 HydrophobicContact CE-CD2 3.95Å; M1928-L1930 HydrophobicContact CE-CG 3.69Å; L1930-N1956 PolarHBondContact N-O 3.23Å; L1930-N1956 PolarHBondContact O-ND2 2.69Å; L1930-V1958 HydrophobicContact CD1-CB 4.28Å; L1930-V1958 HydrophobicContact CD1-CG2 3.42Å; L1930-V1958 VanDerWaalsContact CD1-CG2 3.42Å
1931	F	82.5	Confident	79.3	Confident	14 Å²	14	35.2 Å²	35.2	6%	0.061	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	120.6	174.7	-68.9	-81	0	0	0	111.1	I1899 S1917 L1918 C1933 L1950 K1951 I1952 N1956	I1899-F1931 HydrophobicContact CD1-CD2 4.16Å; I1899-F1931 HydrophobicContact CD1-CE2 3.65Å; S1917-F1931 CarbonylContact C-O 3.5Å; S1917-F1931 VanDerWaalsContact CA-O 3.25Å; S1917-F1931 WeakPolarHBondContact CA-O 3.48Å; L1918-F1931 HydrophobicContact CB-CB 4.46Å; L1918-F1931 PolarHBondContact N-O 2.61Å; L1918-F1931 PolarHBondContact O-N 3.37Å; F1931-C1933 VanDerWaalsContact C-N 3.33Å; F1931-C1933 PolarHBondContact O-N 3.31Å; F1931-L1950 HydrophobicContact CB-CD1 3.96Å; F1931-L1950 HydrophobicContact CB-CD2 4.26Å; F1931-L1950 HydrophobicContact CD1-CB 3.84Å; F1931-L1950 HydrophobicContact CD1-CD1 4.3Å; F1931-L1950 HydrophobicContact CD1-CD2 3.87Å; F1931-L1950 HydrophobicContact CD1-CG 4.21Å; F1931-L1950 HydrophobicContact CD2-CB 4.33Å; F1931-L1950 HydrophobicContact CD2-CD1 4.11Å; F1931-L1950 HydrophobicContact CE1-CB 3.76Å; F1931-L1950 HydrophobicContact CE2-CB 4.27Å; F1931-L1950 HydrophobicContact CG-CB 4.11Å; F1931-L1950 HydrophobicContact CG-CD1 3.84Å; F1931-L1950 HydrophobicContact CG-CD2 4.16Å; F1931-L1950 HydrophobicContact CG-CG 4.26Å; F1931-L1950 HydrophobicContact CZ-CB 3.98Å; F1931-K1951 WeakPolarHBondContact CE1-O 3.38Å; F1931-I1952 HydrophobicContact CE2-CG1 4.09Å; F1931-I1952 HydrophobicContact CZ-CB 4.5Å; F1931-I1952 HydrophobicContact CZ-CG1 3.59Å; F1931-N1956 HydrophobicContact CE1-CB 4.23Å; F1931-N1956 VanDerWaalsContact CE1-ND2 3.29Å; F1931-N1956 WeakPolarHBondContact CE1-ND2 3.41Å; F1931-N1956 HydrophobicContact CE2-CB 4.48Å; F1931-N1956 HydrophobicContact CZ-CB 3.99Å
1932	D	79.6	Confident	78.9	Confident	78 Å²	78	37.1 Å²	37.1	42%	0.417	20%	0.198	S	C	.	.			trans	-95.1	66.3	175.4	-165.1	23.6	0	0	0	109.8	Q1916 S1917 K1934	Q1916-D1932 CarbonylContact O-C 3.48Å; S1917-D1932 PolarHBondContact OG-OD1 2.8Å; D1932-K1934 VanDerWaalsContact CG-CE 3.46Å; D1932-K1934 PolarHBondContact O-N 3.13Å; D1932-K1934 WeakPolarHBondContact OD2-CE 3.27Å; D1932-K1934 IonicContact OD2-NZ 3.36Å; D1932-K1934 PolarHBondContact OD2-NZ 2.87Å
1933	C	84.6	Confident	78.7	Confident	23 Å²	23	40.1 Å²	40.1	16%	0.155	21%	0.214	C	C	.	.			trans	-58.1	-43.3	-160.6	-52.9	0	0	0	0	115.4	I1915 Q1916 F1931 E1935	I1915-C1933 HydrophobicContact CG2-CB 3.64Å; Q1916-C1933 PolarHBondContact O-N 3.29Å; F1931-C1933 VanDerWaalsContact C-N 3.33Å; F1931-C1933 PolarHBondContact O-N 3.31Å; C1933-E1935 PolarHBondContact O-N 3.35Å; C1933-E1935 VanDerWaalsContact O-N 3.09Å
1934	K	86	Confident	79.2	Confident	119 Å²	119	47 Å²	47	52%	0.517	24%	0.243	S	C	.	.			trans	48.3	34.4	178.5	-66.1	167.1	178.6	156.8	0	115.9	Y1914 I1915 Q1916 D1932	Y1914-K1934 WeakPolarHBondContact CE2-O 3.32Å; Y1914-K1934 WeakPolarHBondContact OH-CA 3.4Å; Y1914-K1934 PolarHBondContact OH-O 2.97Å; I1915-K1934 PolarHBondContact O-N 2.93Å; I1915-K1934 VanDerWaalsContact O-N 3.14Å; Q1916-K1934 PolarHBondContact O-N 3.11Å; D1932-K1934 VanDerWaalsContact CG-CE 3.46Å; D1932-K1934 PolarHBondContact O-N 3.13Å; D1932-K1934 WeakPolarHBondContact OD2-CE 3.27Å; D1932-K1934 IonicContact OD2-NZ 3.36Å; D1932-K1934 PolarHBondContact OD2-NZ 2.87Å
1935	E	83.7	Confident	79.4	Confident	75 Å²	75	51.5 Å²	51.5	35%	0.35	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	157.2	-177.2	-81.2	-152.6	148.7	0	0	114.4	Y1914 I1915 C1933 N1943	Y1914-E1935 WeakPolarHBondContact CA-O 3.3Å; Y1914-E1935 WeakPolarHBondContact CD2-O 3.09Å; I1915-E1935 PolarHBondContact N-O 3.08Å; I1915-E1935 PolarHBondContact O-N 2.79Å; C1933-E1935 PolarHBondContact O-N 3.35Å; C1933-E1935 VanDerWaalsContact O-N 3.09Å; E1935-N1943 PolarHBondContact OE1-ND2 3.05Å; E1935-N1943 PolarHBondContact OE2-ND2 2.8Å
1936	W	86	Confident	79.7	Confident	43 Å²	43	52.9 Å²	52.9	16%	0.163	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.6	170.7	-71.8	91.1	0	0	0	111	D1843 K1845 A1846 G1912 W1913 Y1914 R1941	D1843-W1936 HydrophobicContact CB-CH2 4.14Å; D1843-W1936 HydrophobicContact CB-CZ2 4.17Å; K1845-W1936 HydrophobicContact CB-CH2 4.5Å; A1846-W1936 HydrophobicContact CB-CH2 4.06Å; A1846-W1936 HydrophobicContact CB-CZ3 4.41Å; G1912-W1936 WeakPolarHBondContact O-CZ3 3.43Å; W1913-W1936 CarbonylContact O-C 3.5Å; W1913-W1936 WeakPolarHBondContact O-CA 3.39Å; Y1914-W1936 AromaticContact CD2-CD1 3.56Å; Y1914-W1936 AromaticContact CD2-CD2 3.82Å; Y1914-W1936 HydrophobicContact CD2-CD2 3.82Å; Y1914-W1936 AromaticContact CD2-CE2 3.59Å; Y1914-W1936 AromaticContact CD2-CG 3.79Å; Y1914-W1936 HydrophobicContact CD2-CG 3.79Å; Y1914-W1936 HydrophobicContact CD2-CZ2 4.19Å; Y1914-W1936 AromaticContact CD2-NE1 3.43Å; Y1914-W1936 AromaticContact CE2-CD1 3.97Å; Y1914-W1936 AromaticContact CE2-NE1 3.84Å; Y1914-W1936 HydrophobicContact CG-CD2 4.45Å; W1936-R1941 HydrophobicContact CB-CB 4.04Å; W1936-R1941 HydrophobicContact CD2-CB 3.94Å; W1936-R1941 HydrophobicContact CE3-CB 4.06Å; W1936-R1941 HydrophobicContact CE3-CG 4.43Å; W1936-R1941 HydrophobicContact CG-CB 3.93Å; W1936-R1941 VanDerWaalsContact CZ2-NH1 3.3Å
1937	L	86.2	Confident	80.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	91.3	169.8	-70.4	168.2	0	0	0	109.6	V1901 N1903 W1913 I1915 K1945 T1947 C1948	V1901-L1937 HydrophobicContact CG1-CD1 3.99Å; N1903-L1937 HydrophobicContact CB-CB 4.13Å; N1903-L1937 PolarHBondContact ND2-O 3.03Å; W1913-L1937 HydrophobicContact CB-CB 4.32Å; W1913-L1937 HydrophobicContact CD2-CD1 4.45Å; W1913-L1937 HydrophobicContact CE3-CB 4.17Å; W1913-L1937 HydrophobicContact CE3-CD1 3.46Å; W1913-L1937 VanDerWaalsContact CE3-CD1 3.46Å; W1913-L1937 HydrophobicContact CE3-CG 4.44Å; W1913-L1937 HydrophobicContact CZ3-CD1 3.7Å; W1913-L1937 PolarHBondContact N-O 3.13Å; W1913-L1937 PolarHBondContact O-N 3.07Å; I1915-L1937 HydrophobicContact CB-CD1 4.44Å; I1915-L1937 HydrophobicContact CG2-CD1 4.17Å; L1937-K1945 CarbonylContact C-O 3.58Å; L1937-K1945 VanDerWaalsContact CA-O 3.31Å; L1937-K1945 WeakPolarHBondContact CA-O 3.35Å; L1937-T1947 VanDerWaalsContact CD2-C 3.46Å; L1937-C1948 HydrophobicContact CD2-CB 3.75Å
1938	S	79	Confident	80.6	Confident	3 Å²	3	55 Å²	55	2%	0.021	28%	0.278	C	S	.	.	S	Bend	trans	-167.1	142	-163.2	162	0	0	0	0	110.8	N1940 R1941 K1944 K1945	S1938-N1940 VanDerWaalsContact C-N 3.27Å; S1938-N1940 PolarHBondContact O-N 2.82Å; S1938-N1940 PolarHBondContact OG-N 3.45Å; S1938-N1940 PolarHBondContact OG-OD1 2.83Å; S1938-R1941 WeakPolarHBondContact OG-CB 3.37Å; S1938-R1941 PolarHBondContact OG-N 2.84Å; S1938-K1944 CarbonylContact O-C 3.54Å; S1938-K1944 WeakPolarHBondContact O-CA 3.27Å; S1938-K1945 PolarHBondContact N-O 2.82Å; S1938-K1945 PolarHBondContact O-N 3.17Å
1939	T	76.1	Confident	81	Confident	58 Å²	58	58.1 Å²	58.1	36%	0.356	30%	0.296	S	S	.	.	S	Bend	trans	-72.1	-19.5	173.1	30.1	0	0	0	0	113.3	E1907 R1946	E1907-T1939 PolarHBondContact OE1-OG1 2.89Å; T1939-R1946 HydrophobicContact CG2-CG 4.09Å
1940	N	76.1	Confident	81	Confident	72 Å²	72	58.9 Å²	58.9	39%	0.385	30%	0.3	S	S	.	.	S	Bend	trans	-125.5	8.4	-167.3	52.7	-8.1	0	0	0	114.3	S1908 P1909 S1938	S1908-N1940 PolarHBondContact O-ND2 2.84Å; P1909-N1940 WeakPolarHBondContact CA-ND2 2.96Å; S1938-N1940 VanDerWaalsContact C-N 3.27Å; S1938-N1940 PolarHBondContact O-N 2.82Å; S1938-N1940 PolarHBondContact OG-N 3.45Å; S1938-N1940 PolarHBondContact OG-OD1 2.83Å
1941	R	73.3	Confident	81.2	Confident	77 Å²	77	65.5 Å²	65.5	29%	0.291	33%	0.328	S	S	.	.	S	Bend	trans	-141.3	158.6	175.2	-66.1	-171.2	153.3	-143.3	-15.9	111.9	D1843 W1936 S1938 N1943 K1944	D1843-R1941 IonicContact OD1-NH1 3.57Å; D1843-R1941 PolarHBondContact OD1-NH1 2.78Å; W1936-R1941 HydrophobicContact CB-CB 4.04Å; W1936-R1941 HydrophobicContact CD2-CB 3.94Å; W1936-R1941 HydrophobicContact CE3-CB 4.06Å; W1936-R1941 HydrophobicContact CE3-CG 4.43Å; W1936-R1941 HydrophobicContact CG-CB 3.93Å; W1936-R1941 VanDerWaalsContact CZ2-NH1 3.3Å; S1938-R1941 WeakPolarHBondContact OG-CB 3.37Å; S1938-R1941 PolarHBondContact OG-N 2.84Å; R1941-N1943 PolarHBondContact O-N 2.77Å; R1941-K1944 PolarHBondContact O-N 3.31Å; R1941-K1944 VanDerWaalsContact O-N 3.14Å
1942	G	73.5	Confident	81.1	Confident	58 Å²	58	66.2 Å²	66.2	60%	0.598	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	-133.6	178.8	0	0	0	0	0	112.8	K1944	G1942-K1944 PolarHBondContact O-N 2.95Å
1943	N	78.4	Confident	80.8	Confident	64 Å²	64	65 Å²	65	34%	0.342	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	8.3	179	65	20.7	0	0	0	114.1	E1935 R1941 K1945	E1935-N1943 PolarHBondContact OE1-ND2 3.05Å; E1935-N1943 PolarHBondContact OE2-ND2 2.8Å; R1941-N1943 PolarHBondContact O-N 2.77Å; N1943-K1945 VanDerWaalsContact C-N 3.26Å; N1943-K1945 PolarHBondContact O-N 3.29Å; N1943-K1945 WeakPolarHBondContact OD1-CB 3.47Å; N1943-K1945 PolarHBondContact OD1-N 3.08Å
1944	K	77.8	Confident	79.9	Confident	153 Å²	153	71 Å²	71	67%	0.665	36%	0.36	S	S	*	.	S	Bend	trans	61.5	19.7	179.6	-58.2	-173.3	-178.8	-179.6	0	115.7	S1938 R1941 G1942	S1938-K1944 CarbonylContact O-C 3.54Å; S1938-K1944 WeakPolarHBondContact O-CA 3.27Å; R1941-K1944 PolarHBondContact O-N 3.31Å; R1941-K1944 VanDerWaalsContact O-N 3.14Å; G1942-K1944 PolarHBondContact O-N 2.95Å
1945	K	76.6	Confident	78.7	Confident	128 Å²	128	70 Å²	70	56%	0.557	36%	0.363	S	S	*	.			trans	-100.4	141	178.5	-64.1	179.1	-179.9	178	0	111.7	L1937 S1938 N1943	L1937-K1945 CarbonylContact C-O 3.58Å; L1937-K1945 VanDerWaalsContact CA-O 3.31Å; L1937-K1945 WeakPolarHBondContact CA-O 3.35Å; S1938-K1945 PolarHBondContact N-O 2.82Å; S1938-K1945 PolarHBondContact O-N 3.17Å; N1943-K1945 VanDerWaalsContact C-N 3.26Å; N1943-K1945 PolarHBondContact O-N 3.29Å; N1943-K1945 WeakPolarHBondContact OD1-CB 3.47Å; N1943-K1945 PolarHBondContact OD1-N 3.08Å
1946	R	82.7	Confident	78.4	Confident	68 Å²	68	67.7 Å²	67.7	26%	0.257	35%	0.354	S	S	.	.	S	Bend	trans	-84.1	-10.7	170	-78.9	172.7	166.2	-93.7	5.1	113.6	G1902 N1903 A1905 E1907 T1939	G1902-R1946 WeakPolarHBondContact CA-O 3.49Å; N1903-R1946 PolarHBondContact N-O 3.32Å; N1903-R1946 PolarHBondContact O-NH1 2.92Å; A1905-R1946 PolarHBondContact O-NH1 3.17Å; A1905-R1946 PolarHBondContact O-NH2 3.08Å; E1907-R1946 IonicContact OE1-CZ 3.54Å; E1907-R1946 IonicContact OE1-NE 2.77Å; E1907-R1946 IonicContact OE1-NH2 3.46Å; E1907-R1946 PolarHBondContact OE1-NH2 2.8Å; T1939-R1946 HydrophobicContact CG2-CG 4.09Å
1947	T	84.4	Confident	77.8	Confident	60 Å²	60	67.9 Å²	67.9	37%	0.368	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.5	-177.5	46.3	0	0	0	0	112.1	W1853 V1901 L1937	W1853-T1947 HydrophobicContact CH2-CG2 4.06Å; W1853-T1947 HydrophobicContact CZ2-CG2 3.72Å; V1901-T1947 CarbonylContact O-C 3.58Å; V1901-T1947 WeakPolarHBondContact O-CA 3.38Å; L1937-T1947 VanDerWaalsContact CD2-C 3.46Å
1948	C	84.1	Confident	76.8	Confident	18 Å²	18	68.1 Å²	68.1	12%	0.122	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.7	176.3	167.2	0	0	0	0	109.8	Q1900 V1901 L1937 L1950	Q1900-C1948 WeakPolarHBondContact CA-O 3.33Å; V1901-C1948 PolarHBondContact N-O 3.5Å; V1901-C1948 PolarHBondContact O-N 3.17Å; L1937-C1948 HydrophobicContact CD2-CB 3.75Å; C1948-L1950 VanDerWaalsContact SG-CD2 3.57Å
1949	N	87	Confident	76	Confident	84 Å²	84	74.2 Å²	74.2	45%	0.449	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	106.5	179.4	-65.1	38.3	0	0	0	109	E1898 Q1900	E1898-N1949 HydrophobicContact CG-CB 4.36Å; E1898-N1949 PolarHBondContact OE1-ND2 3.5Å; Q1900-N1949 PolarHBondContact NE2-ND2 3.01Å
1950	L	85.5	Confident	75.6	Confident	19 Å²	19	72.7 Å²	72.7	10%	0.099	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	103.8	-175.8	-62.8	166.9	0	0	0	109.3	E1898 I1899 V1901 L1918 F1931 C1948	E1898-L1950 WeakPolarHBondContact CA-O 3.32Å; I1899-L1950 HydrophobicContact CB-CB 4.34Å; I1899-L1950 PolarHBondContact N-O 3.43Å; I1899-L1950 PolarHBondContact O-N 3.37Å; V1901-L1950 HydrophobicContact CG2-CD1 3.88Å; L1918-L1950 HydrophobicContact CD2-CD1 3.67Å; F1931-L1950 HydrophobicContact CB-CD1 3.96Å; F1931-L1950 HydrophobicContact CB-CD2 4.26Å; F1931-L1950 HydrophobicContact CD1-CB 3.84Å; F1931-L1950 HydrophobicContact CD1-CD1 4.3Å; F1931-L1950 HydrophobicContact CD1-CD2 3.87Å; F1931-L1950 HydrophobicContact CD1-CG 4.21Å; F1931-L1950 HydrophobicContact CD2-CB 4.33Å; F1931-L1950 HydrophobicContact CD2-CD1 4.11Å; F1931-L1950 HydrophobicContact CE1-CB 3.76Å; F1931-L1950 HydrophobicContact CE2-CB 4.27Å; F1931-L1950 HydrophobicContact CG-CB 4.11Å; F1931-L1950 HydrophobicContact CG-CD1 3.84Å; F1931-L1950 HydrophobicContact CG-CD2 4.16Å; F1931-L1950 HydrophobicContact CG-CG 4.26Å; F1931-L1950 HydrophobicContact CZ-CB 3.98Å; C1948-L1950 VanDerWaalsContact SG-CD2 3.57Å
1951	K	81.4	Confident	75.1	Confident	161 Å²	161	71.8 Å²	71.8	70%	0.7	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.2	174.5	-72.3	-175.1	175.9	-179.8	0	110.8	F1931	F1931-K1951 WeakPolarHBondContact CE1-O 3.38Å
1952	I	80.8	Confident	75.1	Confident	29 Å²	29	70.4 Å²	70.4	15%	0.149	37%	0.367	C	S	.	.			trans	-86.3	128.5	-179.3	-70.1	160.6	0	0	0	110.4	L1896 T1897 I1899 Y1929 F1931 I1957	L1896-I1952 HydrophobicContact CB-CD1 3.24Å; L1896-I1952 HydrophobicContact CD1-CD1 4.05Å; L1896-I1952 HydrophobicContact CG-CD1 4.34Å; T1897-I1952 PolarHBondContact O-N 2.9Å; I1899-I1952 HydrophobicContact CD1-CD1 4.49Å; I1899-I1952 HydrophobicContact CG1-CD1 4.24Å; Y1929-I1952 HydrophobicContact CD1-CD1 3.62Å; Y1929-I1952 HydrophobicContact CD1-CG1 3.99Å; Y1929-I1952 HydrophobicContact CD1-CG2 3.9Å; Y1929-I1952 HydrophobicContact CE1-CD1 3.86Å; Y1929-I1952 HydrophobicContact CE1-CG2 4.01Å; Y1929-I1952 HydrophobicContact CG-CD1 4.26Å; F1931-I1952 HydrophobicContact CE2-CG1 4.09Å; F1931-I1952 HydrophobicContact CZ-CB 4.5Å; F1931-I1952 HydrophobicContact CZ-CG1 3.59Å; I1952-I1957 HydrophobicContact CG2-CD1 3.74Å; I1952-I1957 HydrophobicContact CG2-CG1 3.68Å
1953	S	73.9	Confident	75.2	Confident	52 Å²	52	68.9 Å²	68.9	36%	0.364	34%	0.344	S	S	.	.			trans	-115.8	170.4	167.4	78.3	0	0	0	0	110.7	T1955 N1956	S1953-T1955 PolarHBondContact O-N 3.13Å; S1953-T1955 VanDerWaalsContact O-N 3.14Å; S1953-T1955 PolarHBondContact OG-N 2.9Å; S1953-T1955 PolarHBondContact OG-OG1 3Å; S1953-T1955 VanDerWaalsContact OG-OG1 3.05Å; S1953-N1956 WeakPolarHBondContact CB-OD1 3.49Å; S1953-N1956 PolarHBondContact N-OD1 3.21Å; S1953-N1956 WeakPolarHBondContact O-CB 3.42Å; S1953-N1956 PolarHBondContact O-N 2.9Å; S1953-N1956 PolarHBondContact OG-OD1 2.69Å
1954	N	66.1	Low	75.4	Confident	149 Å²	149	66.9 Å²	66.9	80%	0.797	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-58.8	-25.4	177.5	-76.3	-22.3	0	0	0	113.6	N1956	N1954-N1956 VanDerWaalsContact C-N 3.31Å
1955	T	60	Low	75.6	Confident	97 Å²	97	61.8 Å²	61.8	60%	0.595	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-83.9	-1.7	175.8	57.4	0	0	0	0	113.6	S1953 N2531	S1953-T1955 PolarHBondContact O-N 3.13Å; S1953-T1955 VanDerWaalsContact O-N 3.14Å; S1953-T1955 PolarHBondContact OG-N 2.9Å; S1953-T1955 PolarHBondContact OG-OG1 3Å; S1953-T1955 VanDerWaalsContact OG-OG1 3.05Å; T1955-N2531 PolarHBondContact O-ND2 3Å
1956	N	77.1	Confident	76.1	Confident	27 Å²	27	55.7 Å²	55.7	14%	0.144	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-92.6	-16.7	170.2	-58.8	102.2	0	0	0	112.8	Y1929 L1930 F1931 S1953 N1954	Y1929-N1956 CarbonylContact C-O 3.48Å; Y1929-N1956 VanDerWaalsContact CA-O 3.26Å; Y1929-N1956 WeakPolarHBondContact CA-O 3.41Å; L1930-N1956 PolarHBondContact N-O 3.23Å; L1930-N1956 PolarHBondContact O-ND2 2.69Å; F1931-N1956 HydrophobicContact CE1-CB 4.23Å; F1931-N1956 VanDerWaalsContact CE1-ND2 3.29Å; F1931-N1956 WeakPolarHBondContact CE1-ND2 3.41Å; F1931-N1956 HydrophobicContact CE2-CB 4.48Å; F1931-N1956 HydrophobicContact CZ-CB 3.99Å; S1953-N1956 WeakPolarHBondContact CB-OD1 3.49Å; S1953-N1956 PolarHBondContact N-OD1 3.21Å; S1953-N1956 WeakPolarHBondContact O-CB 3.42Å; S1953-N1956 PolarHBondContact O-N 2.9Å; S1953-N1956 PolarHBondContact OG-OD1 2.69Å; N1954-N1956 VanDerWaalsContact C-N 3.31Å
1957	I	73.1	Confident	76.3	Confident	48 Å²	48	56.2 Å²	56.2	25%	0.246	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121	-168.2	-49.5	176.3	0	0	0	111.5	Y1929 I1952	Y1929-I1957 HydrophobicContact CD1-CG1 3.86Å; Y1929-I1957 HydrophobicContact CE1-CD1 4.13Å; Y1929-I1957 HydrophobicContact CE1-CG1 3.79Å; Y1929-I1957 HydrophobicContact CE1-CG2 4.26Å; I1952-I1957 HydrophobicContact CG2-CD1 3.74Å; I1952-I1957 HydrophobicContact CG2-CG1 3.68Å
1958	V	65.1	Low	76.7	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.2	166.9	179.7	0	0	0	0	109.1	K1927 M1928 L1930 L2528 V2529	K1927-V1958 CarbonylContact C-O 3.54Å; K1927-V1958 WeakPolarHBondContact CA-O 3.49Å; M1928-V1958 PolarHBondContact N-O 3.15Å; M1928-V1958 PolarHBondContact O-N 3.24Å; L1930-V1958 HydrophobicContact CD1-CB 4.28Å; L1930-V1958 HydrophobicContact CD1-CG2 3.42Å; L1930-V1958 VanDerWaalsContact CD1-CG2 3.42Å; V1958-L2528 HydrophobicContact CG1-CB 4.38Å; V1958-L2528 HydrophobicContact CG1-CD2 3.78Å; V1958-V2529 HydrophobicContact CG1-CG1 4.15Å; V1958-V2529 HydrophobicContact CG2-CG1 4.09Å; V1958-V2529 VanDerWaalsContact CG2-O 3.25Å; V1958-V2529 WeakPolarHBondContact CG2-O 3.08Å
1959	K	63.2	Low	77.1	Confident	131 Å²	131	57 Å²	57	57%	0.57	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	152.2	174.2	-61.4	174.5	-174.8	173.6	0	109.6	G1926 Q2475	G1926-K1959 CarbonylContact O-C 3.48Å; G1926-K1959 VanDerWaalsContact O-CA 3.32Å; G1926-K1959 WeakPolarHBondContact O-CA 3.08Å; K1959-Q2475 PolarHBondContact O-NE2 2.97Å; K1959-Q2475 PolarHBondContact O-OE1 2.78Å; K1959-Q2475 VanDerWaalsContact O-OE1 3.08Å
1960	F	66.8	Low	77.4	Confident	25 Å²	25	53 Å²	53	11%	0.11	27%	0.269	C	S	.	.			trans	-153.5	178.7	171.4	61.2	-90.8	0	0	0	108.9	G1926 K1927 M1928 L2528	G1926-F1960 CarbonylContact C-O 3.42Å; G1926-F1960 WeakPolarHBondContact CA-O 3.38Å; G1926-F1960 PolarHBondContact O-N 3.14Å; G1926-F1960 VanDerWaalsContact O-O 3.11Å; K1927-F1960 WeakPolarHBondContact O-CE1 3.27Å; M1928-F1960 HydrophobicContact CB-CE1 4.08Å; F1960-L2528 HydrophobicContact CB-CD2 4.1Å; F1960-L2528 HydrophobicContact CD1-CD1 4.2Å; F1960-L2528 HydrophobicContact CD1-CD2 4.01Å; F1960-L2528 HydrophobicContact CE1-CD1 4.32Å; F1960-L2528 HydrophobicContact CG-CD2 4.31Å
1961	K	65.8	Low	77.7	Confident	53 Å²	53	53.4 Å²	53.4	23%	0.23	27%	0.272	C	S	.	.			trans	-69.7	133.1	178.1	-73.2	-164.1	178.7	-172.5	0	111.7	N1992 E2020	K1961-N1992 PolarHBondContact NZ-O 2.85Å; K1961-E2020 HydrophobicContact CB-CB 4.38Å; K1961-E2020 HydrophobicContact CB-CG 4.07Å
1962	P	73.7	Confident	78.3	Confident	48 Å²	48	45.8 Å²	45.8	31%	0.312	24%	0.239	S	C	.	.			trans	-59.9	146.1	171.8	26.9	-34.1	0	0	0	110.6	P1923 T1924 D2021	P1923-P1962 CarbonylContact O-C 3.46Å; P1923-P1962 VanDerWaalsContact O-CA 3.26Å; P1923-P1962 WeakPolarHBondContact O-CA 3.23Å; T1924-P1962 WeakPolarHBondContact O-CB 3.45Å; P1962-D2021 HydrophobicContact CG-CB 4.38Å; P1962-D2021 PolarHBondContact O-N 3Å
1963	K	76.8	Confident	78.7	Confident	26 Å²	26	45.1 Å²	45.1	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136	176.9	-58.8	-171.5	-177	-179.9	0	110	P1923 T1924 M2019 E2020 E2526	P1923-K1963 HydrophobicContact CB-CB 4.22Å; P1923-K1963 PolarHBondContact O-N 2.91Å; T1924-K1963 VanDerWaalsContact CA-O 3.3Å; T1924-K1963 WeakPolarHBondContact CA-O 3.4Å; T1924-K1963 WeakPolarHBondContact CG2-O 3.31Å; K1963-M2019 CarbonylContact C-O 3.58Å; K1963-M2019 WeakPolarHBondContact CA-O 3.32Å; K1963-M2019 WeakPolarHBondContact CB-O 3.21Å; K1963-E2020 HydrophobicContact CG-CG 4.44Å; K1963-E2526 IonicContact NZ-OE1 2.66Å; K1963-E2526 IonicContact NZ-OE2 3.53Å; K1963-E2526 PolarHBondContact NZ-OE2 3.22Å
1964	I	81.4	Confident	79.4	Confident	23 Å²	23	48.8 Å²	48.8	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	162.3	178.4	62.2	175.3	0	0	0	110.9	Y1966 E2018 M2019 D2021 V2050 N2052	I1964-Y1966 HydrophobicContact CD1-CE2 4.2Å; I1964-Y1966 HydrophobicContact CG1-CD2 4.31Å; I1964-Y1966 HydrophobicContact CG1-CE2 3.58Å; I1964-Y1966 WeakPolarHBondContact O-CD2 3.38Å; I1964-E2018 WeakPolarHBondContact O-CA 3.17Å; I1964-M2019 PolarHBondContact N-O 2.95Å; I1964-M2019 PolarHBondContact O-N 2.85Å; I1964-D2021 HydrophobicContact CD1-CB 4.06Å; I1964-D2021 HydrophobicContact CG1-CB 4.13Å; I1964-D2021 HydrophobicContact CG2-CB 4.26Å; I1964-V2050 HydrophobicContact CD1-CG1 3.59Å; I1964-N2052 WeakPolarHBondContact CD1-ND2 3.13Å
1965	T	82.8	Confident	80.3	Confident	46 Å²	46	45.1 Å²	45.1	28%	0.282	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	125.5	179	-50.2	0	0	0	0	111.3	L2017 A2051	T1965-L2017 WeakPolarHBondContact CA-O 3.23Å; T1965-A2051 WeakPolarHBondContact O-CB 3.29Å; T1965-A2051 PolarHBondContact O-N 2.99Å
1966	Y	85.8	Confident	81.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.4	167	-65.7	-89.4	0	0	0	108.5	I1964 I1988 S2016 L2017 M2019 E2020 V2022 L2025 V2048 V2050	I1964-Y1966 HydrophobicContact CD1-CE2 4.2Å; I1964-Y1966 HydrophobicContact CG1-CD2 4.31Å; I1964-Y1966 HydrophobicContact CG1-CE2 3.58Å; I1964-Y1966 WeakPolarHBondContact O-CD2 3.38Å; Y1966-I1988 HydrophobicContact CG-CD1 4.48Å; Y1966-S2016 WeakPolarHBondContact O-CA 3.42Å; Y1966-L2017 PolarHBondContact N-O 3.24Å; Y1966-L2017 PolarHBondContact O-N 2.85Å; Y1966-M2019 HydrophobicContact CD2-CB 3.8Å; Y1966-M2019 HydrophobicContact CD2-CG 4.18Å; Y1966-M2019 HydrophobicContact CD2-SD 4.24Å; Y1966-M2019 HydrophobicContact CE2-CB 3.96Å; Y1966-E2020 PolarHBondContact OH-O 2.9Å; Y1966-V2022 WeakPolarHBondContact OH-CG2 3.46Å; Y1966-V2022 PolarHBondContact OH-N 3.21Å; Y1966-L2025 HydrophobicContact CE1-CD2 4.04Å; Y1966-V2048 HydrophobicContact CD1-CG1 3.91Å; Y1966-V2050 HydrophobicContact CD1-CB 4.39Å; Y1966-V2050 HydrophobicContact CD1-CG1 4.08Å; Y1966-V2050 HydrophobicContact CD1-CG2 3.97Å; Y1966-V2050 HydrophobicContact CE1-CB 4.26Å; Y1966-V2050 HydrophobicContact CE1-CG1 3.65Å; Y1966-V2050 HydrophobicContact CE1-CG2 3.78Å
1967	H	88.1	Confident	81.4	Confident	79 Å²	79	57.4 Å²	57.4	37%	0.366	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	117	173.3	-59.2	-73.1	0	0	0	108.8	S2016 V2048 T2049	H1967-S2016 PolarHBondContact ND1-OG 3.3Å; H1967-V2048 CarbonylContact O-C 3.51Å; H1967-V2048 WeakPolarHBondContact O-CA 3.44Å; H1967-T2049 PolarHBondContact N-O 2.93Å; H1967-T2049 PolarHBondContact O-N 3.49Å
1968	L	92.2	Very high	82	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.8	-177.7	-58.6	97.3	0	0	0	111.3	L1986 N2014 I2015 L2017 V2046 E2047 V2048	L1968-L1986 HydrophobicContact CD2-CD1 4.3Å; L1968-L1986 HydrophobicContact CD2-CD2 3.67Å; L1968-N2014 CarbonylContact O-C 3.57Å; L1968-N2014 WeakPolarHBondContact O-CA 3.42Å; L1968-I2015 PolarHBondContact N-O 2.79Å; L1968-I2015 PolarHBondContact O-N 2.81Å; L1968-L2017 HydrophobicContact CD1-CB 4.34Å; L1968-L2017 HydrophobicContact CD1-CD1 3.78Å; L1968-L2017 HydrophobicContact CD1-CG 3.96Å; L1968-V2046 HydrophobicContact CD2-CG1 4.26Å; L1968-E2047 CarbonylContact C-O 3.41Å; L1968-E2047 VanDerWaalsContact CA-O 3.29Å; L1968-E2047 WeakPolarHBondContact CA-O 3.21Å; L1968-V2048 HydrophobicContact CD2-CG2 3.93Å; L1968-V2048 HydrophobicContact CG-CG1 4.47Å; L1968-V2048 HydrophobicContact CG-CG2 4.08Å
1969	K	91.7	Very high	83	Confident	89 Å²	89	55.3 Å²	55.3	39%	0.387	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120	161.1	-82.9	175	174.9	178.2	0	108.5	T2012 D2013 N2014 V2046 E2047	K1969-T2012 HydrophobicContact CB-CG2 3.95Å; K1969-T2012 HydrophobicContact CD-CG2 4.42Å; K1969-T2012 HydrophobicContact CG-CG2 4.11Å; K1969-D2013 CarbonylContact C-O 3.55Å; K1969-D2013 VanDerWaalsContact CA-O 3.31Å; K1969-D2013 WeakPolarHBondContact CA-O 3.37Å; K1969-N2014 WeakPolarHBondContact CE-OD1 3.39Å; K1969-N2014 VanDerWaalsContact CG-OD1 3.28Å; K1969-N2014 WeakPolarHBondContact CG-OD1 3.02Å; K1969-V2046 CarbonylContact O-C 2.99Å; K1969-V2046 WeakPolarHBondContact O-CA 3.38Å; K1969-V2046 WeakPolarHBondContact O-CG1 3.33Å; K1969-E2047 HydrophobicContact CB-CB 4.2Å; K1969-E2047 PolarHBondContact N-O 3.33Å; K1969-E2047 PolarHBondContact O-N 3.24Å
1970	I	93.7	Very high	84.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.2	179.1	-59.4	179	0	0	0	108.6	L2000 F2007 T2012 D2013 I2015 W2041 L2043 V2046	I1970-L2000 HydrophobicContact CD1-CD1 3.92Å; I1970-F2007 HydrophobicContact CD1-CE1 4.23Å; I1970-F2007 HydrophobicContact CG2-CD1 4.43Å; I1970-F2007 HydrophobicContact CG2-CE1 4.39Å; I1970-T2012 CarbonylContact O-C 3.58Å; I1970-T2012 WeakPolarHBondContact O-CA 3.39Å; I1970-D2013 PolarHBondContact N-O 2.79Å; I1970-D2013 PolarHBondContact O-N 3.27Å; I1970-I2015 HydrophobicContact CD1-CD1 4.07Å; I1970-W2041 HydrophobicContact CG2-CH2 4.03Å; I1970-W2041 HydrophobicContact CG2-CZ2 3.75Å; I1970-L2043 HydrophobicContact CG2-CD1 3.9Å; I1970-V2046 HydrophobicContact CB-CG2 4.47Å; I1970-V2046 HydrophobicContact CG1-CG1 4.03Å; I1970-V2046 HydrophobicContact CG1-CG2 4.1Å; I1970-V2046 HydrophobicContact CG2-CG2 4.26Å
1971	T	92.9	Very high	85	Confident	29 Å²	29	49.5 Å²	49.5	18%	0.178	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.1	-176.4	-55.5	0	0	0	0	111.1	T2012 S2044 C2045	T1971-T2012 PolarHBondContact OG1-OG1 3.41Å; T1971-S2044 PolarHBondContact O-N 2.84Å; T1971-C2045 PolarHBondContact N-O 2.9Å
1972	T	92.6	Very high	85.9	Confident	1 Å²	1	47 Å²	47	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	130.5	170.9	-59.2	0	0	0	0	109.2	A1978 A2008 G2010 I2011 W2041	T1972-A1978 HydrophobicContact CG2-CB 4.06Å; T1972-A2008 VanDerWaalsContact CB-O 3.25Å; T1972-A2008 WeakPolarHBondContact CB-O 3.21Å; T1972-A2008 WeakPolarHBondContact CG2-O 3.29Å; T1972-G2010 VanDerWaalsContact O-CA 3.27Å; T1972-G2010 WeakPolarHBondContact O-CA 3.49Å; T1972-G2010 PolarHBondContact O-N 2.6Å; T1972-G2010 VanDerWaalsContact O-N 3.14Å; T1972-I2011 PolarHBondContact N-O 3.31Å; T1972-W2041 PolarHBondContact OG1-NE1 2.98Å
1973	A	89.5	Confident	86.3	Confident	14 Å²	14	45.5 Å²	45.5	12%	0.116	22%	0.223	C	C	.	.			trans	-63.2	154.8	-173.3	0	0	0	0	0	113.1	V1975 A1978 G2010 N2042	A1973-V1975 VanDerWaalsContact C-N 3.27Å; A1973-V1975 HydrophobicContact CB-CG2 3.87Å; A1973-V1975 PolarHBondContact O-N 2.92Å; A1973-A1978 WeakPolarHBondContact O-CB 3.18Å; A1973-G2010 PolarHBondContact O-N 3.34Å; A1973-N2042 HydrophobicContact CB-CB 4.29Å; A1973-N2042 WeakPolarHBondContact CB-OD1 3.41Å; A1973-N2042 PolarHBondContact N-O 2.88Å
1974	N	89.3	Confident	86.7	Confident	130 Å²	130	44.3 Å²	44.3	70%	0.695	22%	0.217	S	C	*	.	S	Bend	trans	-90.3	44.3	177.6	-164.5	12.5	0	0	0	113.2	Q2009	N1974-Q2009 PolarHBondContact OD1-NE2 2.78Å
1975	V	85	Confident	86.9	Confident	71 Å²	71	45.8 Å²	45.8	43%	0.43	23%	0.226	S	C	.	.	S	Bend	trans	-104.5	146.4	171.9	-90	0	0	0	0	111.3	A1973 R1977 A1978 Q2009 N2042	A1973-V1975 VanDerWaalsContact C-N 3.27Å; A1973-V1975 HydrophobicContact CB-CG2 3.87Å; A1973-V1975 PolarHBondContact O-N 2.92Å; V1975-R1977 PolarHBondContact O-N 2.86Å; V1975-A1978 HydrophobicContact CG2-CB 4.2Å; V1975-A1978 WeakPolarHBondContact O-CB 3.2Å; V1975-A1978 PolarHBondContact O-N 2.66Å; V1975-Q2009 WeakPolarHBondContact O-CG 3.15Å; V1975-Q2009 PolarHBondContact O-OE1 3.22Å; V1975-Q2009 VanDerWaalsContact O-OE1 3.1Å; V1975-N2042 HydrophobicContact CG2-CB 4.28Å
1976	K	79.4	Confident	87.2	Confident	186 Å²	186	43.7 Å²	43.7	81%	0.809	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	119.9	-170.2	-162	171.8	-172.9	173.3	0	111.3
1977	R	81.6	Confident	87.3	Confident	196 Å²	196	45.4 Å²	45.4	74%	0.74	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.3	20.4	-174	-51.9	177.5	172.7	166.6	-2.6	116	V1975 G1979 W2064	V1975-R1977 PolarHBondContact O-N 2.86Å; R1977-G1979 VanDerWaalsContact C-N 3.29Å; R1977-G1979 PolarHBondContact O-N 2.98Å; R1977-W2064 WeakPolarHBondContact O-CZ3 3.38Å
1978	A	85.3	Confident	87.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.203	C	C	.	.			trans	-64.8	-23	178.4	0	0	0	0	0	115.8	T1972 A1973 V1975 Q2009 W2041 N2042	T1972-A1978 HydrophobicContact CG2-CB 4.06Å; A1973-A1978 WeakPolarHBondContact O-CB 3.18Å; V1975-A1978 HydrophobicContact CG2-CB 4.2Å; V1975-A1978 WeakPolarHBondContact O-CB 3.2Å; V1975-A1978 PolarHBondContact O-N 2.66Å; A1978-Q2009 HydrophobicContact CB-CB 4.26Å; A1978-Q2009 HydrophobicContact CB-CG 4.15Å; A1978-W2041 CarbonylContact O-C 3.57Å; A1978-W2041 WeakPolarHBondContact O-CA 3.32Å; A1978-N2042 HydrophobicContact CB-CB 3.82Å; A1978-N2042 PolarHBondContact O-N 3.28Å
1979	G	85.7	Confident	87	Confident	11 Å²	11	41.6 Å²	41.6	11%	0.113	20%	0.203	C	C	.	.			trans	-88.8	136.3	-171.6	0	0	0	0	0	114.7	R1977 F2007	R1977-G1979 VanDerWaalsContact C-N 3.29Å; R1977-G1979 PolarHBondContact O-N 2.98Å; G1979-F2007 CarbonylContact C-O 3.52Å; G1979-F2007 WeakPolarHBondContact CA-O 3.5Å
1980	T	87.3	Confident	86.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.185	C	C	.	.			trans	-105.3	159.5	-178	-170.9	0	0	0	0	113.2	C1982 I1984 K2002 F2007 N2038 W2041	T1980-C1982 WeakPolarHBondContact OG1-CB 3.11Å; T1980-C1982 PolarHBondContact OG1-N 2.87Å; T1980-C1982 VanDerWaalsContact OG1-N 3.11Å; T1980-I1984 HydrophobicContact CG2-CD1 3.87Å; T1980-K2002 WeakPolarHBondContact O-CE 3.47Å; T1980-K2002 PolarHBondContact O-NZ 3.34Å; T1980-F2007 HydrophobicContact CG2-CB 4.32Å; T1980-F2007 PolarHBondContact N-O 2.73Å; T1980-F2007 VanDerWaalsContact N-O 3.17Å; T1980-N2038 WeakPolarHBondContact CB-O 3.19Å; T1980-N2038 PolarHBondContact OG1-O 3.24Å; T1980-W2041 HydrophobicContact CG2-CB 3.86Å; T1980-W2041 HydrophobicContact CG2-CD2 4.12Å; T1980-W2041 HydrophobicContact CG2-CG 3.65Å
1981	D	84.7	Confident	85.4	Confident	34 Å²	34	39.2 Å²	39.2	18%	0.182	20%	0.196	C	C	.	.			trans	-112	2.9	168.5	65.5	-15	0	0	0	112.9	R2036 K2037 N2038	D1981-R2036 HydrophobicContact CB-CB 4.25Å; D1981-R2036 WeakPolarHBondContact O-CD 3.23Å; D1981-R2036 WeakPolarHBondContact O-CG 3.49Å; D1981-R2036 WeakPolarHBondContact OD1-CB 3.45Å; D1981-R2036 WeakPolarHBondContact OD2-CB 3.23Å; D1981-K2037 PolarHBondContact OD1-N 3.32Å; D1981-K2037 VanDerWaalsContact OD1-N 3.1Å; D1981-K2037 WeakPolarHBondContact OD2-CB 3.21Å; D1981-K2037 PolarHBondContact OD2-N 2.98Å; D1981-N2038 WeakPolarHBondContact OD1-CA 3.24Å; D1981-N2038 WeakPolarHBondContact OD1-CB 3.45Å; D1981-N2038 PolarHBondContact OD1-N 3.48Å; D1981-N2038 PolarHBondContact OD2-N 3.32Å
1982	C	84	Confident	84.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-72.6	157.4	174	-64.3	0	0	0	0	111.6	T1980 H2032 D2033	T1980-C1982 WeakPolarHBondContact OG1-CB 3.11Å; T1980-C1982 PolarHBondContact OG1-N 2.87Å; T1980-C1982 VanDerWaalsContact OG1-N 3.11Å; C1982-H2032 HydrophobicContact CB-CB 3.95Å; C1982-H2032 WeakPolarHBondContact CB-ND1 3.21Å; C1982-D2033 WeakPolarHBondContact CB-OD1 3.43Å
1983	S	82.1	Confident	83	Confident	17 Å²	17	40.8 Å²	40.8	12%	0.119	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-77.3	137.7	172.9	-35.3	0	0	0	0	109.8	H2032 D2033	S1983-H2032 VanDerWaalsContact O-CA 3.23Å; S1983-H2032 WeakPolarHBondContact O-CA 3.44Å; S1983-H2032 WeakPolarHBondContact O-CB 3.46Å; S1983-D2033 WeakPolarHBondContact CB-OD2 3.32Å; S1983-D2033 VanDerWaalsContact N-CG 3.34Å; S1983-D2033 PolarHBondContact N-OD1 3.26Å; S1983-D2033 PolarHBondContact N-OD2 3.44Å; S1983-D2033 PolarHBondContact O-N 3.12Å; S1983-D2033 PolarHBondContact OG-OD2 3.36Å
1984	I	86.8	Confident	82.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.9	-178.2	-52.9	-53.5	0	0	0	110	T1980 I1999 L2000 F2007 I2030 G2031 H2032 W2041	T1980-I1984 HydrophobicContact CG2-CD1 3.87Å; I1984-I1999 CarbonylContact O-C 3.55Å; I1984-I1999 WeakPolarHBondContact O-CA 3.19Å; I1984-L2000 HydrophobicContact CB-CB 4.23Å; I1984-L2000 HydrophobicContact CG2-CD1 4.48Å; I1984-L2000 PolarHBondContact N-O 2.98Å; I1984-L2000 VanDerWaalsContact N-O 3.13Å; I1984-L2000 PolarHBondContact O-N 2.8Å; I1984-F2007 HydrophobicContact CB-CE2 4.26Å; I1984-F2007 HydrophobicContact CB-CZ 4.3Å; I1984-F2007 HydrophobicContact CD1-CD2 4.46Å; I1984-F2007 HydrophobicContact CG1-CD1 4.41Å; I1984-F2007 HydrophobicContact CG1-CD2 3.67Å; I1984-F2007 HydrophobicContact CG1-CE1 4.26Å; I1984-F2007 HydrophobicContact CG1-CE2 3.49Å; I1984-F2007 VanDerWaalsContact CG1-CE2 3.49Å; I1984-F2007 HydrophobicContact CG1-CG 4.13Å; I1984-F2007 HydrophobicContact CG1-CZ 3.81Å; I1984-I2030 HydrophobicContact CG2-CD1 4.16Å; I1984-I2030 HydrophobicContact CG2-CG1 3.85Å; I1984-G2031 CarbonylContact C-O 3.53Å; I1984-G2031 WeakPolarHBondContact CA-O 3.4Å; I1984-G2031 WeakPolarHBondContact CG2-O 3.38Å; I1984-H2032 HydrophobicContact CD1-CB 3.73Å; I1984-W2041 HydrophobicContact CD1-CD2 4.07Å; I1984-W2041 HydrophobicContact CD1-CE3 3.67Å; I1984-W2041 HydrophobicContact CD1-CH2 3.99Å; I1984-W2041 HydrophobicContact CD1-CZ2 4.34Å; I1984-W2041 HydrophobicContact CD1-CZ3 3.64Å; I1984-W2041 HydrophobicContact CG1-CH2 4.16Å; I1984-W2041 HydrophobicContact CG1-CZ3 4.23Å; I1984-W2041 HydrophobicContact CG2-CH2 3.87Å; I1984-W2041 HydrophobicContact CG2-CZ3 3.85Å
1985	N	85.1	Confident	81.6	Confident	55 Å²	55	35.5 Å²	35.5	29%	0.294	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.8	176	-61.8	-23.5	0	0	0	109.6	I2030 G2031	N1985-I2030 WeakPolarHBondContact O-CA 3.33Å; N1985-G2031 PolarHBondContact N-O 2.91Å; N1985-G2031 PolarHBondContact O-N 3.45Å
1986	L	89.3	Confident	80.9	Confident	1 Å²	1	33 Å²	33	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.9	-173.1	-179.2	74.8	0	0	0	111.5	L1968 C1997 Y1998 L2000 L2017 M2019 M2028 I2030	L1968-L1986 HydrophobicContact CD2-CD1 4.3Å; L1968-L1986 HydrophobicContact CD2-CD2 3.67Å; L1986-C1997 CarbonylContact O-C 3.57Å; L1986-C1997 WeakPolarHBondContact O-CA 3.49Å; L1986-Y1998 PolarHBondContact N-O 3.26Å; L1986-Y1998 PolarHBondContact O-N 2.97Å; L1986-L2000 HydrophobicContact CD2-CD1 4.49Å; L1986-L2017 HydrophobicContact CD2-CD1 3.53Å; L1986-M2019 HydrophobicContact CD2-CE 4.3Å; L1986-M2028 HydrophobicContact CD1-CG 3.83Å; L1986-M2028 HydrophobicContact CD1-SD 3.61Å; L1986-I2030 HydrophobicContact CD1-CD1 4.2Å; L1986-I2030 HydrophobicContact CD1-CG1 4.36Å
1987	Q	86.8	Confident	80.6	Confident	37 Å²	37	27.7 Å²	27.7	17%	0.173	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138.6	172	-156.6	172.5	13.6	0	0	110.7	V1994 T1995 M2028 R2029	Q1987-V1994 HydrophobicContact CG-CG2 3.77Å; Q1987-T1995 WeakPolarHBondContact CG-O 3.49Å; Q1987-T1995 PolarHBondContact NE2-O 3.48Å; Q1987-M2028 CarbonylContact O-C 3.53Å; Q1987-M2028 WeakPolarHBondContact O-CA 3.4Å; Q1987-R2029 HydrophobicContact CB-CB 4.21Å; Q1987-R2029 PolarHBondContact N-O 3.18Å; Q1987-R2029 PolarHBondContact O-N 2.91Å
1988	I	88.1	Confident	80.3	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.9	-173.5	-53.6	178.9	0	0	0	110.1	Y1966 V1994 T1995 M2019 V2022 L2025 M2028	Y1966-I1988 HydrophobicContact CG-CD1 4.48Å; I1988-V1994 CarbonylContact O-C 3.52Å; I1988-V1994 WeakPolarHBondContact O-CA 3.12Å; I1988-V1994 WeakPolarHBondContact O-CG2 3.45Å; I1988-T1995 HydrophobicContact CB-CG2 3.99Å; I1988-T1995 PolarHBondContact N-OG1 3.45Å; I1988-T1995 PolarHBondContact O-N 2.77Å; I1988-M2019 HydrophobicContact CD1-CE 3.77Å; I1988-M2019 HydrophobicContact CD1-SD 3.71Å; I1988-M2019 HydrophobicContact CG1-CE 3.86Å; I1988-M2019 HydrophobicContact CG1-SD 4.46Å; I1988-V2022 HydrophobicContact CG2-CG2 4.07Å; I1988-L2025 HydrophobicContact CG2-CD1 4.23Å; I1988-L2025 HydrophobicContact CG2-CD2 3.6Å; I1988-L2025 HydrophobicContact CG2-CG 4.45Å; I1988-M2028 HydrophobicContact CG1-CG 4.36Å
1989	F	86	Confident	80.1	Confident	1 Å²	1	25.8 Å²	25.8	0%	0.004	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.3	178.1	-59.3	-103.5	0	0	0	110.2	V1994 L2026 K2027 R2029 D2122	F1989-V1994 HydrophobicContact CD1-CB 3.69Å; F1989-V1994 HydrophobicContact CD1-CG2 3.46Å; F1989-V1994 VanDerWaalsContact CD1-CG2 3.46Å; F1989-V1994 HydrophobicContact CD2-CG2 4.15Å; F1989-V1994 HydrophobicContact CE1-CB 3.84Å; F1989-V1994 HydrophobicContact CE1-CG2 3.32Å; F1989-V1994 HydrophobicContact CE2-CG2 4.03Å; F1989-V1994 HydrophobicContact CG-CB 4.34Å; F1989-V1994 HydrophobicContact CG-CG2 3.88Å; F1989-V1994 HydrophobicContact CZ-CG2 3.63Å; F1989-L2026 PolarHBondContact O-N 2.91Å; F1989-K2027 HydrophobicContact CB-CG 3.66Å; F1989-K2027 WeakPolarHBondContact CB-O 3.32Å; F1989-K2027 HydrophobicContact CD2-CD 4.27Å; F1989-K2027 HydrophobicContact CD2-CG 3.73Å; F1989-K2027 HydrophobicContact CG-CD 4.4Å; F1989-K2027 HydrophobicContact CG-CG 3.79Å; F1989-K2027 PolarHBondContact N-O 2.99Å; F1989-K2027 PolarHBondContact O-N 2.92Å; F1989-R2029 HydrophobicContact CE2-CB 4.05Å; F1989-D2122 VanDerWaalsContact CE1-OD2 3.25Å; F1989-D2122 WeakPolarHBondContact CE1-OD2 3.29Å; F1989-D2122 VanDerWaalsContact CZ-OD2 3.29Å; F1989-D2122 WeakPolarHBondContact CZ-OD2 3.32Å
1990	G	82.2	Confident	80	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.01	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-179.2	175.4	0	0	0	0	0	112.2	N1992 G1993 V2022 K2024 Y2397	G1990-N1992 PolarHBondContact O-N 3.34Å; G1990-G1993 PolarHBondContact N-O 3.2Å; G1990-G1993 PolarHBondContact O-N 2.99Å; G1990-G1993 VanDerWaalsContact O-N 3.15Å; G1990-V2022 CarbonylContact C-O 3.48Å; G1990-V2022 WeakPolarHBondContact CA-O 3.34Å; G1990-K2024 CarbonylContact C-O 3.51Å; G1990-K2024 WeakPolarHBondContact CA-O 3.41Å; G1990-Y2397 WeakPolarHBondContact O-CE2 3.39Å
1991	T	69.4	Low	79.3	Confident	39 Å²	39	32.1 Å²	32.1	24%	0.239	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-10.3	-173.8	59.8	0	0	0	0	116.2	V2022 K2024 L2026 P2396 Y2397	T1991-V2022 PolarHBondContact N-O 3.24Å; T1991-K2024 HydrophobicContact CG2-CB 3.86Å; T1991-K2024 PolarHBondContact N-O 2.87Å; T1991-K2024 PolarHBondContact OG1-N 2.83Å; T1991-K2024 VanDerWaalsContact OG1-N 3.1Å; T1991-L2026 HydrophobicContact CG2-CD1 4.26Å; T1991-L2026 HydrophobicContact CG2-CD2 4.26Å; T1991-L2026 HydrophobicContact CG2-CG 4.34Å; T1991-P2396 VanDerWaalsContact O-CG 3.3Å; T1991-P2396 WeakPolarHBondContact O-CG 3.27Å; T1991-Y2397 VanDerWaalsContact O-CD2 3.31Å; T1991-Y2397 WeakPolarHBondContact O-CD2 3.29Å
1992	N	65.8	Low	78.5	Confident	61 Å²	61	33.6 Å²	33.6	33%	0.326	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-5.5	177.7	-55.7	-10.7	0	0	0	112.9	K1961 G1990 V2022 G2023	K1961-N1992 PolarHBondContact NZ-O 2.85Å; G1990-N1992 PolarHBondContact O-N 3.34Å; N1992-V2022 PolarHBondContact N-O 3.23Å; N1992-G2023 WeakPolarHBondContact ND2-CA 3.39Å
1993	G	68.8	Low	77.7	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.1	-169.2	176.3	0	0	0	0	0	116.4	G1990 V2022 Y2397	G1990-G1993 PolarHBondContact N-O 3.2Å; G1990-G1993 PolarHBondContact O-N 2.99Å; G1990-G1993 VanDerWaalsContact O-N 3.15Å; G1993-V2022 VanDerWaalsContact C-CG1 3.43Å; G1993-V2022 WeakPolarHBondContact O-CB 3.4Å; G1993-V2022 WeakPolarHBondContact O-CG1 3.44Å; G1993-Y2397 WeakPolarHBondContact CA-OH 3.44Å; G1993-Y2397 PolarHBondContact O-OH 2.86Å
1994	V	75.9	Confident	77.1	Confident	33 Å²	33	41 Å²	41	20%	0.2	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.4	159.5	64.3	0	0	0	0	107.9	Q1987 I1988 F1989	Q1987-V1994 HydrophobicContact CG-CG2 3.77Å; I1988-V1994 CarbonylContact O-C 3.52Å; I1988-V1994 WeakPolarHBondContact O-CA 3.12Å; I1988-V1994 WeakPolarHBondContact O-CG2 3.45Å; F1989-V1994 HydrophobicContact CD1-CB 3.69Å; F1989-V1994 HydrophobicContact CD1-CG2 3.46Å; F1989-V1994 VanDerWaalsContact CD1-CG2 3.46Å; F1989-V1994 HydrophobicContact CD2-CG2 4.15Å; F1989-V1994 HydrophobicContact CE1-CB 3.84Å; F1989-V1994 HydrophobicContact CE1-CG2 3.32Å; F1989-V1994 HydrophobicContact CE2-CG2 4.03Å; F1989-V1994 HydrophobicContact CG-CB 4.34Å; F1989-V1994 HydrophobicContact CG-CG2 3.88Å; F1989-V1994 HydrophobicContact CZ-CG2 3.63Å
1995	T	74.7	Confident	76.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-76.2	166.6	172.9	66.6	0	0	0	0	111.3	Q1987 I1988 M2019 E2020 V2022	Q1987-T1995 WeakPolarHBondContact CG-O 3.49Å; Q1987-T1995 PolarHBondContact NE2-O 3.48Å; I1988-T1995 HydrophobicContact CB-CG2 3.99Å; I1988-T1995 PolarHBondContact N-OG1 3.45Å; I1988-T1995 PolarHBondContact O-N 2.77Å; T1995-M2019 HydrophobicContact CG2-CB 3.83Å; T1995-M2019 HydrophobicContact CG2-CE 3.91Å; T1995-M2019 WeakPolarHBondContact OG1-CE 3.34Å; T1995-E2020 WeakPolarHBondContact CA-OE2 3.48Å; T1995-V2022 HydrophobicContact CG2-CG1 3.71Å; T1995-V2022 HydrophobicContact CG2-CG2 4.47Å
1996	N	70.1	Confident	76.2	Confident	18 Å²	18	47 Å²	47	10%	0.096	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-58.8	161.1	157.8	-70.9	-17.1	0	0	0	110.8	Y1998 E2020 R2476	N1996-Y1998 HydrophobicContact CB-CE2 3.91Å; N1996-Y1998 VanDerWaalsContact O-CD2 3.23Å; N1996-Y1998 WeakPolarHBondContact O-CD2 3.37Å; N1996-E2020 VanDerWaalsContact CG-OE1 3.3Å; N1996-E2020 PolarHBondContact N-OE2 2.81Å; N1996-E2020 PolarHBondContact ND2-OE1 2.92Å; N1996-E2020 PolarHBondContact OD1-OE1 2.88Å; N1996-R2476 PolarHBondContact OD1-NH2 2.84Å
1997	C	72.5	Confident	76.1	Confident	74 Å²	74	46.9 Å²	46.9	50%	0.5	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-80	126.8	170.5	-171.9	0	0	0	0	109.7	L1986	L1986-C1997 CarbonylContact O-C 3.57Å; L1986-C1997 WeakPolarHBondContact O-CA 3.49Å
1998	Y	76.2	Confident	76	Confident	50 Å²	50	46.5 Å²	46.5	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.6	179.5	-73.9	-103	0	0	0	110.2	L1986 N1996 E2018 M2019	L1986-Y1998 PolarHBondContact N-O 3.26Å; L1986-Y1998 PolarHBondContact O-N 2.97Å; N1996-Y1998 HydrophobicContact CB-CE2 3.91Å; N1996-Y1998 VanDerWaalsContact O-CD2 3.23Å; N1996-Y1998 WeakPolarHBondContact O-CD2 3.37Å; Y1998-E2018 PolarHBondContact OH-O 3.42Å; Y1998-M2019 HydrophobicContact CD2-CE 3.56Å; Y1998-M2019 HydrophobicContact CD2-CG 4.21Å; Y1998-M2019 HydrophobicContact CE2-CB 4.18Å; Y1998-M2019 HydrophobicContact CE2-CE 3.94Å; Y1998-M2019 HydrophobicContact CE2-CG 3.89Å; Y1998-M2019 HydrophobicContact CG-CE 4.31Å
1999	I	79.4	Confident	76	Confident	107 Å²	107	50.1 Å²	50.1	55%	0.549	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130	176.6	-51.2	-177.8	0	0	0	108.9	I1984	I1984-I1999 CarbonylContact O-C 3.55Å; I1984-I1999 WeakPolarHBondContact O-CA 3.19Å
2000	L	84.5	Confident	75.9	Confident	9 Å²	9	51.9 Å²	51.9	5%	0.047	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	108	178.8	-57.1	172.7	0	0	0	109.1	I1970 I1984 L1986 F2007 I2015 L2017	I1970-L2000 HydrophobicContact CD1-CD1 3.92Å; I1984-L2000 HydrophobicContact CB-CB 4.23Å; I1984-L2000 HydrophobicContact CG2-CD1 4.48Å; I1984-L2000 PolarHBondContact N-O 2.98Å; I1984-L2000 VanDerWaalsContact N-O 3.13Å; I1984-L2000 PolarHBondContact O-N 2.8Å; L1986-L2000 HydrophobicContact CD2-CD1 4.49Å; L2000-F2007 HydrophobicContact CB-CE2 4.37Å; L2000-F2007 HydrophobicContact CB-CZ 3.98Å; L2000-F2007 HydrophobicContact CD1-CZ 4.33Å; L2000-I2015 HydrophobicContact CD1-CD1 3.91Å; L2000-I2015 HydrophobicContact CD2-CD1 4.35Å; L2000-I2015 HydrophobicContact CD2-CG2 4.05Å; L2000-L2017 HydrophobicContact CD2-CD1 4.23Å; L2000-L2017 HydrophobicContact CD2-CD2 4.02Å
2001	E	72.4	Confident	76.3	Confident	135 Å²	135	54.7 Å²	54.7	63%	0.631	30%	0.304	S	S	*	.			trans	-75.7	146.7	-179.1	-62.8	-162.7	159.2	0	0	113.3	T2003 R2006	E2001-T2003 PolarHBondContact O-N 2.79Å; E2001-R2006 PolarHBondContact O-NH1 2.99Å
2002	K	68.7	Low	77.2	Confident	65 Å²	65	55.8 Å²	55.8	28%	0.283	31%	0.311	S	S	.	.			trans	-71.1	107.1	176	177.4	70.3	175	-167.6	0	110.7	T1980 S2004 R2006	T1980-K2002 WeakPolarHBondContact O-CE 3.47Å; T1980-K2002 PolarHBondContact O-NZ 3.34Å; K2002-S2004 WeakPolarHBondContact CE-O 3.31Å; K2002-R2006 WeakPolarHBondContact CD-O 3.32Å; K2002-R2006 VanDerWaalsContact CE-O 3.32Å; K2002-R2006 WeakPolarHBondContact CE-O 3.5Å; K2002-R2006 PolarHBondContact NZ-O 3.17Å
2003	T	67.5	Low	78.4	Confident	67 Å²	67	53.7 Å²	53.7	41%	0.411	30%	0.3	S	S	.	.			trans	-109.6	116.4	170.4	64.1	0	0	0	0	110.7	E2001 N2005 R2006	E2001-T2003 PolarHBondContact O-N 2.79Å; T2003-N2005 PolarHBondContact O-N 2.8Å; T2003-R2006 VanDerWaalsContact CG2-NH2 3.29Å; T2003-R2006 WeakPolarHBondContact O-CB 3.27Å; T2003-R2006 PolarHBondContact O-N 2.75Å; T2003-R2006 PolarHBondContact OG1-NE 3.4Å; T2003-R2006 PolarHBondContact OG1-NH2 2.93Å
2004	S	69.4	Low	79.4	Confident	105 Å²	105	59.3 Å²	59.3	73%	0.734	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.9	-101.5	-177.9	58	0	0	0	0	113.9	K2002	K2002-S2004 WeakPolarHBondContact CE-O 3.31Å
2005	N	72.7	Confident	79.8	Confident	115 Å²	115	58.7 Å²	58.7	62%	0.615	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-5.3	-171.1	-64.9	7.3	0	0	0	114.3	T2003 F2007 A2008 I2011	T2003-N2005 PolarHBondContact O-N 2.8Å; N2005-F2007 PolarHBondContact O-N 2.68Å; N2005-A2008 VanDerWaalsContact O-CB 3.24Å; N2005-A2008 WeakPolarHBondContact O-CB 3.42Å; N2005-A2008 PolarHBondContact O-N 2.8Å; N2005-I2011 HydrophobicContact CB-CD1 4.44Å
2006	R	79.6	Confident	80.3	Confident	65 Å²	65	62.2 Å²	62.2	25%	0.245	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	134.1	-176.9	-154.6	-171.4	-61.5	-165.9	1.2	111.2	E2001 K2002 T2003 A2008 D2013	E2001-R2006 PolarHBondContact O-NH1 2.99Å; K2002-R2006 WeakPolarHBondContact CD-O 3.32Å; K2002-R2006 VanDerWaalsContact CE-O 3.32Å; K2002-R2006 WeakPolarHBondContact CE-O 3.5Å; K2002-R2006 PolarHBondContact NZ-O 3.17Å; T2003-R2006 VanDerWaalsContact CG2-NH2 3.29Å; T2003-R2006 WeakPolarHBondContact O-CB 3.27Å; T2003-R2006 PolarHBondContact O-N 2.75Å; T2003-R2006 PolarHBondContact OG1-NE 3.4Å; T2003-R2006 PolarHBondContact OG1-NH2 2.93Å; R2006-A2008 PolarHBondContact O-N 3.16Å; R2006-D2013 VanDerWaalsContact CA-OD1 3.29Å; R2006-D2013 WeakPolarHBondContact CA-OD1 3.29Å; R2006-D2013 HydrophobicContact CG-CB 4.14Å; R2006-D2013 WeakPolarHBondContact CG-OD1 3.46Å
2007	F	87.3	Confident	80.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	31.3	-177.9	-37.6	-54.5	0	0	0	115.2	I1970 G1979 T1980 I1984 L2000 N2005 D2013 I2015 W2041	I1970-F2007 HydrophobicContact CD1-CE1 4.23Å; I1970-F2007 HydrophobicContact CG2-CD1 4.43Å; I1970-F2007 HydrophobicContact CG2-CE1 4.39Å; G1979-F2007 CarbonylContact C-O 3.52Å; G1979-F2007 WeakPolarHBondContact CA-O 3.5Å; T1980-F2007 HydrophobicContact CG2-CB 4.32Å; T1980-F2007 PolarHBondContact N-O 2.73Å; T1980-F2007 VanDerWaalsContact N-O 3.17Å; I1984-F2007 HydrophobicContact CB-CE2 4.26Å; I1984-F2007 HydrophobicContact CB-CZ 4.3Å; I1984-F2007 HydrophobicContact CD1-CD2 4.46Å; I1984-F2007 HydrophobicContact CG1-CD1 4.41Å; I1984-F2007 HydrophobicContact CG1-CD2 3.67Å; I1984-F2007 HydrophobicContact CG1-CE1 4.26Å; I1984-F2007 HydrophobicContact CG1-CE2 3.49Å; I1984-F2007 VanDerWaalsContact CG1-CE2 3.49Å; I1984-F2007 HydrophobicContact CG1-CG 4.13Å; I1984-F2007 HydrophobicContact CG1-CZ 3.81Å; L2000-F2007 HydrophobicContact CB-CE2 4.37Å; L2000-F2007 HydrophobicContact CB-CZ 3.98Å; L2000-F2007 HydrophobicContact CD1-CZ 4.33Å; N2005-F2007 PolarHBondContact O-N 2.68Å; F2007-D2013 WeakPolarHBondContact CA-OD2 3.36Å; F2007-D2013 HydrophobicContact CD1-CB 4.44Å; F2007-D2013 VanDerWaalsContact CD1-OD2 3.28Å; F2007-D2013 WeakPolarHBondContact CD1-OD2 3.24Å; F2007-D2013 HydrophobicContact CE1-CB 4.29Å; F2007-D2013 PolarHBondContact N-OD2 2.8Å; F2007-I2015 HydrophobicContact CE1-CD1 4.09Å; F2007-I2015 HydrophobicContact CZ-CD1 4.07Å; F2007-W2041 HydrophobicContact CD1-CZ2 4.37Å
2008	A	84.8	Confident	81	Confident	29 Å²	29	61.8 Å²	61.8	24%	0.24	34%	0.34	C	S	.	.			trans	-81.5	159.1	170.9	0	0	0	0	0	112.4	T1972 N2005 R2006 G2010 I2011	T1972-A2008 VanDerWaalsContact CB-O 3.25Å; T1972-A2008 WeakPolarHBondContact CB-O 3.21Å; T1972-A2008 WeakPolarHBondContact CG2-O 3.29Å; N2005-A2008 VanDerWaalsContact O-CB 3.24Å; N2005-A2008 WeakPolarHBondContact O-CB 3.42Å; N2005-A2008 PolarHBondContact O-N 2.8Å; R2006-A2008 PolarHBondContact O-N 3.16Å; A2008-G2010 PolarHBondContact O-N 3.13Å; A2008-I2011 HydrophobicContact CB-CD1 3.99Å; A2008-I2011 HydrophobicContact CB-CG1 4.23Å; A2008-I2011 PolarHBondContact O-N 3.32Å; A2008-I2011 VanDerWaalsContact O-N 3.15Å
2009	Q	87.8	Confident	81.1	Confident	76 Å²	76	59.4 Å²	59.4	36%	0.355	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	128	177.7	174.6	-176.4	-31.6	0	0	111.2	N1974 V1975 A1978 I2011	N1974-Q2009 PolarHBondContact OD1-NE2 2.78Å; V1975-Q2009 WeakPolarHBondContact O-CG 3.15Å; V1975-Q2009 PolarHBondContact O-OE1 3.22Å; V1975-Q2009 VanDerWaalsContact O-OE1 3.1Å; A1978-Q2009 HydrophobicContact CB-CB 4.26Å; A1978-Q2009 HydrophobicContact CB-CG 4.15Å; Q2009-I2011 VanDerWaalsContact C-N 3.28Å; Q2009-I2011 PolarHBondContact O-N 3.27Å
2010	G	84.3	Confident	81	Confident	38 Å²	38	54.4 Å²	54.4	39%	0.392	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	73	7.4	177.3	0	0	0	0	0	116.1	T1972 A1973 A2008	T1972-G2010 VanDerWaalsContact O-CA 3.27Å; T1972-G2010 WeakPolarHBondContact O-CA 3.49Å; T1972-G2010 PolarHBondContact O-N 2.6Å; T1972-G2010 VanDerWaalsContact O-N 3.14Å; A1973-G2010 PolarHBondContact O-N 3.34Å; A2008-G2010 PolarHBondContact O-N 3.13Å
2011	I	89.8	Confident	80.7	Confident	61 Å²	61	56 Å²	56	31%	0.313	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-98.4	141.6	179.9	-63.4	-162.8	0	0	0	111.7	T1972 N2005 A2008 Q2009	T1972-I2011 PolarHBondContact N-O 3.31Å; N2005-I2011 HydrophobicContact CB-CD1 4.44Å; A2008-I2011 HydrophobicContact CB-CD1 3.99Å; A2008-I2011 HydrophobicContact CB-CG1 4.23Å; A2008-I2011 PolarHBondContact O-N 3.32Å; A2008-I2011 VanDerWaalsContact O-N 3.15Å; Q2009-I2011 VanDerWaalsContact C-N 3.28Å; Q2009-I2011 PolarHBondContact O-N 3.27Å
2012	T	89.9	Confident	80.9	Confident	61 Å²	61	49.5 Å²	49.5	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.8	167.3	-54.9	0	0	0	0	110.3	K1969 I1970 T1971	K1969-T2012 HydrophobicContact CB-CG2 3.95Å; K1969-T2012 HydrophobicContact CD-CG2 4.42Å; K1969-T2012 HydrophobicContact CG-CG2 4.11Å; I1970-T2012 CarbonylContact O-C 3.58Å; I1970-T2012 WeakPolarHBondContact O-CA 3.39Å; T1971-T2012 PolarHBondContact OG1-OG1 3.41Å
2013	D	89.8	Confident	81.4	Confident	18 Å²	18	47.3 Å²	47.3	10%	0.096	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.5	179.5	-67.4	-70.8	0	0	0	111.6	K1969 I1970 R2006 F2007 I2015	K1969-D2013 CarbonylContact C-O 3.55Å; K1969-D2013 VanDerWaalsContact CA-O 3.31Å; K1969-D2013 WeakPolarHBondContact CA-O 3.37Å; I1970-D2013 PolarHBondContact N-O 2.79Å; I1970-D2013 PolarHBondContact O-N 3.27Å; R2006-D2013 VanDerWaalsContact CA-OD1 3.29Å; R2006-D2013 WeakPolarHBondContact CA-OD1 3.29Å; R2006-D2013 HydrophobicContact CG-CB 4.14Å; R2006-D2013 WeakPolarHBondContact CG-OD1 3.46Å; F2007-D2013 WeakPolarHBondContact CA-OD2 3.36Å; F2007-D2013 HydrophobicContact CD1-CB 4.44Å; F2007-D2013 VanDerWaalsContact CD1-OD2 3.28Å; F2007-D2013 WeakPolarHBondContact CD1-OD2 3.24Å; F2007-D2013 HydrophobicContact CE1-CB 4.29Å; F2007-D2013 PolarHBondContact N-OD2 2.8Å; D2013-I2015 HydrophobicContact CB-CD1 4.48Å; D2013-I2015 HydrophobicContact CB-CG1 4.46Å
2014	N	89.1	Confident	82.1	Confident	119 Å²	119	48.3 Å²	48.3	64%	0.636	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.9	174.8	-61.2	-92.7	0	0	0	109.3	L1968 K1969	L1968-N2014 CarbonylContact O-C 3.57Å; L1968-N2014 WeakPolarHBondContact O-CA 3.42Å; K1969-N2014 WeakPolarHBondContact CE-OD1 3.39Å; K1969-N2014 VanDerWaalsContact CG-OD1 3.28Å; K1969-N2014 WeakPolarHBondContact CG-OD1 3.02Å
2015	I	85.9	Confident	83	Confident	19 Å²	19	43.3 Å²	43.3	10%	0.097	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.3	-174.1	-54.3	-179.2	0	0	0	108.8	L1968 I1970 L2000 F2007 D2013 L2017	L1968-I2015 PolarHBondContact N-O 2.79Å; L1968-I2015 PolarHBondContact O-N 2.81Å; I1970-I2015 HydrophobicContact CD1-CD1 4.07Å; L2000-I2015 HydrophobicContact CD1-CD1 3.91Å; L2000-I2015 HydrophobicContact CD2-CD1 4.35Å; L2000-I2015 HydrophobicContact CD2-CG2 4.05Å; F2007-I2015 HydrophobicContact CE1-CD1 4.09Å; F2007-I2015 HydrophobicContact CZ-CD1 4.07Å; D2013-I2015 HydrophobicContact CB-CD1 4.48Å; D2013-I2015 HydrophobicContact CB-CG1 4.46Å; I2015-L2017 HydrophobicContact CG2-CD2 4.01Å; I2015-L2017 HydrophobicContact CG2-CG 4.1Å
2016	S	84	Confident	83.7	Confident	76 Å²	76	38.6 Å²	38.6	53%	0.531	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.8	174.5	-57.2	0	0	0	0	110.2	Y1966 H1967	Y1966-S2016 WeakPolarHBondContact O-CA 3.42Å; H1967-S2016 PolarHBondContact ND1-OG 3.3Å
2017	L	80.3	Confident	84.2	Confident	26 Å²	26	35.6 Å²	35.6	14%	0.136	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.9	-175.7	-59.8	176.7	0	0	0	111.2	T1965 Y1966 L1968 L1986 L2000 I2015 M2019	T1965-L2017 WeakPolarHBondContact CA-O 3.23Å; Y1966-L2017 PolarHBondContact N-O 3.24Å; Y1966-L2017 PolarHBondContact O-N 2.85Å; L1968-L2017 HydrophobicContact CD1-CB 4.34Å; L1968-L2017 HydrophobicContact CD1-CD1 3.78Å; L1968-L2017 HydrophobicContact CD1-CG 3.96Å; L1986-L2017 HydrophobicContact CD2-CD1 3.53Å; L2000-L2017 HydrophobicContact CD2-CD1 4.23Å; L2000-L2017 HydrophobicContact CD2-CD2 4.02Å; I2015-L2017 HydrophobicContact CG2-CD2 4.01Å; I2015-L2017 HydrophobicContact CG2-CG 4.1Å; L2017-M2019 HydrophobicContact CB-CG 3.7Å; L2017-M2019 HydrophobicContact CB-SD 3.73Å; L2017-M2019 HydrophobicContact CD1-SD 3.68Å; L2017-M2019 HydrophobicContact CG-SD 4.37Å
2018	E	77	Confident	84.4	Confident	57 Å²	57	35.6 Å²	35.6	27%	0.266	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	110.2	164.4	-72	175.5	166.9	0	0	109.1	R1887 I1964 Y1998	R1887-E2018 IonicContact CZ-OE1 2.71Å; R1887-E2018 IonicContact CZ-OE2 3.94Å; R1887-E2018 VanDerWaalsContact CZ-OE2 3.29Å; R1887-E2018 IonicContact NH1-OE2 2.71Å; R1887-E2018 PolarHBondContact NH1-OE2 3.27Å; R1887-E2018 IonicContact NH2-OE1 2.79Å; R1887-E2018 PolarHBondContact NH2-OE1 2.69Å; R1887-E2018 IonicContact NH2-OE2 3.19Å; R1887-E2018 PolarHBondContact NH2-OE2 3.04Å; I1964-E2018 WeakPolarHBondContact O-CA 3.17Å; Y1998-E2018 PolarHBondContact OH-O 3.42Å
2019	M	78.3	Confident	84.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	161.4	-176.5	-49.8	172.3	71.1	0	0	109.5	K1963 I1964 Y1966 L1986 I1988 T1995 Y1998 L2017 D2021	K1963-M2019 CarbonylContact C-O 3.58Å; K1963-M2019 WeakPolarHBondContact CA-O 3.32Å; K1963-M2019 WeakPolarHBondContact CB-O 3.21Å; I1964-M2019 PolarHBondContact N-O 2.95Å; I1964-M2019 PolarHBondContact O-N 2.85Å; Y1966-M2019 HydrophobicContact CD2-CB 3.8Å; Y1966-M2019 HydrophobicContact CD2-CG 4.18Å; Y1966-M2019 HydrophobicContact CD2-SD 4.24Å; Y1966-M2019 HydrophobicContact CE2-CB 3.96Å; L1986-M2019 HydrophobicContact CD2-CE 4.3Å; I1988-M2019 HydrophobicContact CD1-CE 3.77Å; I1988-M2019 HydrophobicContact CD1-SD 3.71Å; I1988-M2019 HydrophobicContact CG1-CE 3.86Å; I1988-M2019 HydrophobicContact CG1-SD 4.46Å; T1995-M2019 HydrophobicContact CG2-CB 3.83Å; T1995-M2019 HydrophobicContact CG2-CE 3.91Å; T1995-M2019 WeakPolarHBondContact OG1-CE 3.34Å; Y1998-M2019 HydrophobicContact CD2-CE 3.56Å; Y1998-M2019 HydrophobicContact CD2-CG 4.21Å; Y1998-M2019 HydrophobicContact CE2-CB 4.18Å; Y1998-M2019 HydrophobicContact CE2-CE 3.94Å; Y1998-M2019 HydrophobicContact CE2-CG 3.89Å; Y1998-M2019 HydrophobicContact CG-CE 4.31Å; L2017-M2019 HydrophobicContact CB-CG 3.7Å; L2017-M2019 HydrophobicContact CB-SD 3.73Å; L2017-M2019 HydrophobicContact CD1-SD 3.68Å; L2017-M2019 HydrophobicContact CG-SD 4.37Å; M2019-D2021 PolarHBondContact O-N 2.76Å
2020	E	77.2	Confident	85	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.6	138.8	176.1	-68.3	93	160.7	0	0	112.5	K1961 K1963 Y1966 T1995 N1996 V2022 R2476	K1961-E2020 HydrophobicContact CB-CB 4.38Å; K1961-E2020 HydrophobicContact CB-CG 4.07Å; K1963-E2020 HydrophobicContact CG-CG 4.44Å; Y1966-E2020 PolarHBondContact OH-O 2.9Å; T1995-E2020 WeakPolarHBondContact CA-OE2 3.48Å; N1996-E2020 VanDerWaalsContact CG-OE1 3.3Å; N1996-E2020 PolarHBondContact N-OE2 2.81Å; N1996-E2020 PolarHBondContact ND2-OE1 2.92Å; N1996-E2020 PolarHBondContact OD1-OE1 2.88Å; E2020-V2022 PolarHBondContact O-N 2.82Å; E2020-R2476 IonicContact OE1-CZ 2.96Å; E2020-R2476 VanDerWaalsContact OE1-CZ 3.31Å; E2020-R2476 IonicContact OE1-NH1 2.88Å; E2020-R2476 PolarHBondContact OE1-NH1 2.81Å; E2020-R2476 IonicContact OE1-NH2 2.72Å; E2020-R2476 PolarHBondContact OE1-NH2 2.88Å
2021	D	79.5	Confident	85.2	Confident	42 Å²	42	30.4 Å²	30.4	23%	0.225	17%	0.166	C	C	.	.			trans	-66.1	103.4	172	-177.8	-2.2	0	0	0	109.6	P1962 I1964 M2019 G2023	P1962-D2021 HydrophobicContact CG-CB 4.38Å; P1962-D2021 PolarHBondContact O-N 3Å; I1964-D2021 HydrophobicContact CD1-CB 4.06Å; I1964-D2021 HydrophobicContact CG1-CB 4.13Å; I1964-D2021 HydrophobicContact CG2-CB 4.26Å; M2019-D2021 PolarHBondContact O-N 2.76Å; D2021-G2023 PolarHBondContact OD1-N 3.14Å
2022	V	76.8	Confident	85.1	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.			trans	-96	9.4	176	-62.8	0	0	0	0	113	Y1966 I1988 G1990 T1991 N1992 G1993 T1995 E2020 L2025	Y1966-V2022 WeakPolarHBondContact OH-CG2 3.46Å; Y1966-V2022 PolarHBondContact OH-N 3.21Å; I1988-V2022 HydrophobicContact CG2-CG2 4.07Å; G1990-V2022 CarbonylContact C-O 3.48Å; G1990-V2022 WeakPolarHBondContact CA-O 3.34Å; T1991-V2022 PolarHBondContact N-O 3.24Å; N1992-V2022 PolarHBondContact N-O 3.23Å; G1993-V2022 VanDerWaalsContact C-CG1 3.43Å; G1993-V2022 WeakPolarHBondContact O-CB 3.4Å; G1993-V2022 WeakPolarHBondContact O-CG1 3.44Å; T1995-V2022 HydrophobicContact CG2-CG1 3.71Å; T1995-V2022 HydrophobicContact CG2-CG2 4.47Å; E2020-V2022 PolarHBondContact O-N 2.82Å; V2022-L2025 HydrophobicContact CG2-CD2 3.61Å
2023	G	79.2	Confident	84.7	Confident	19 Å²	19	27.2 Å²	27.2	20%	0.196	15%	0.148	C	C	.	.			trans	67.2	-140.3	178.8	0	0	0	0	0	113.2	N1992 D2021 L2025	N1992-G2023 WeakPolarHBondContact ND2-CA 3.39Å; D2021-G2023 PolarHBondContact OD1-N 3.14Å; G2023-L2025 PolarHBondContact O-N 2.74Å
2024	K	80.7	Confident	84.3	Confident	88 Å²	88	28.2 Å²	28.2	38%	0.383	15%	0.153	S	C	.	.	S	Bend	trans	-70.4	125.3	-178.6	-162.2	-163.7	-170.8	-167.8	0	109.6	G1990 T1991 Y2057 I2083	G1990-K2024 CarbonylContact C-O 3.51Å; G1990-K2024 WeakPolarHBondContact CA-O 3.41Å; T1991-K2024 HydrophobicContact CG2-CB 3.86Å; T1991-K2024 PolarHBondContact N-O 2.87Å; T1991-K2024 PolarHBondContact OG1-N 2.83Å; T1991-K2024 VanDerWaalsContact OG1-N 3.1Å; K2024-Y2057 HydrophobicContact CG-CE1 4.34Å; K2024-Y2057 WeakPolarHBondContact CG-OH 3.31Å; K2024-I2083 VanDerWaalsContact CE-CD1 3.48Å
2025	L	89.5	Confident	83.8	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	139.3	-175.3	-52.7	-171.3	0	0	0	111.8	Y1966 I1988 V2022 G2023 V2048 V2050 Y2057 F2059 A2081	Y1966-L2025 HydrophobicContact CE1-CD2 4.04Å; I1988-L2025 HydrophobicContact CG2-CD1 4.23Å; I1988-L2025 HydrophobicContact CG2-CD2 3.6Å; I1988-L2025 HydrophobicContact CG2-CG 4.45Å; V2022-L2025 HydrophobicContact CG2-CD2 3.61Å; G2023-L2025 PolarHBondContact O-N 2.74Å; L2025-V2048 HydrophobicContact CD1-CB 4.27Å; L2025-V2048 HydrophobicContact CD1-CG1 3.98Å; L2025-V2050 HydrophobicContact CD1-CG2 4.29Å; L2025-V2050 HydrophobicContact CG-CG2 4.44Å; L2025-Y2057 HydrophobicContact CB-CD1 3.7Å; L2025-Y2057 HydrophobicContact CB-CD2 4.43Å; L2025-Y2057 HydrophobicContact CB-CE1 3.69Å; L2025-Y2057 HydrophobicContact CB-CE2 4.49Å; L2025-Y2057 HydrophobicContact CB-CG 4.07Å; L2025-Y2057 HydrophobicContact CD1-CD1 4.41Å; L2025-Y2057 HydrophobicContact CD1-CD2 3.87Å; L2025-Y2057 HydrophobicContact CD1-CE2 4.39Å; L2025-Y2057 HydrophobicContact CD1-CG 3.9Å; L2025-Y2057 HydrophobicContact CG-CD1 4.25Å; L2025-Y2057 HydrophobicContact CG-CD2 4.07Å; L2025-Y2057 HydrophobicContact CG-CE1 4.21Å; L2025-Y2057 HydrophobicContact CG-CE2 4.12Å; L2025-Y2057 HydrophobicContact CG-CG 4.16Å; L2025-F2059 HydrophobicContact CB-CZ 4.4Å; L2025-F2059 HydrophobicContact CD1-CE2 4.39Å; L2025-F2059 HydrophobicContact CD1-CZ 4.18Å; L2025-A2081 HydrophobicContact CB-CB 4.24Å; L2025-A2081 WeakPolarHBondContact O-CB 3.27Å
2026	L	86.7	Confident	83.5	Confident	16 Å²	16	36.2 Å²	36.2	8%	0.084	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-47.5	-177.4	-64.5	175.6	0	0	0	111.7	F1989 T1991 A2081 Q2088 L2089 Y2120	F1989-L2026 PolarHBondContact O-N 2.91Å; T1991-L2026 HydrophobicContact CG2-CD1 4.26Å; T1991-L2026 HydrophobicContact CG2-CD2 4.26Å; T1991-L2026 HydrophobicContact CG2-CG 4.34Å; L2026-A2081 WeakPolarHBondContact O-CB 3.48Å; L2026-A2081 PolarHBondContact O-N 2.81Å; L2026-Q2088 HydrophobicContact CD2-CB 4.48Å; L2026-L2089 HydrophobicContact CB-CD1 3.94Å; L2026-L2089 HydrophobicContact CB-CG 4.27Å; L2026-Y2120 HydrophobicContact CD1-CD1 4.03Å; L2026-Y2120 HydrophobicContact CD1-CG 4.46Å
2027	K	90.6	Very high	83.1	Confident	1 Å²	1	41.6 Å²	41.6	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	166.1	175	64.4	171.7	-173.8	169.4	0	112.2	F1989 D2078 L2079 L2089 D2122 L2152	F1989-K2027 HydrophobicContact CB-CG 3.66Å; F1989-K2027 WeakPolarHBondContact CB-O 3.32Å; F1989-K2027 HydrophobicContact CD2-CD 4.27Å; F1989-K2027 HydrophobicContact CD2-CG 3.73Å; F1989-K2027 HydrophobicContact CG-CD 4.4Å; F1989-K2027 HydrophobicContact CG-CG 3.79Å; F1989-K2027 PolarHBondContact N-O 2.99Å; F1989-K2027 PolarHBondContact O-N 2.92Å; K2027-D2078 IonicContact NZ-OD2 2.64Å; K2027-D2078 PolarHBondContact NZ-OD2 2.75Å; K2027-L2079 CarbonylContact C-O 3.56Å; K2027-L2079 WeakPolarHBondContact CA-O 3.5Å; K2027-L2079 VanDerWaalsContact CB-O 3.28Å; K2027-L2079 WeakPolarHBondContact CB-O 3.32Å; K2027-L2089 HydrophobicContact CB-CD1 4.21Å; K2027-L2089 HydrophobicContact CD-CD1 4.38Å; K2027-L2089 HydrophobicContact CG-CD1 4.27Å; K2027-D2122 PolarHBondContact NZ-O 3.49Å; K2027-L2152 HydrophobicContact CB-CD1 3.77Å; K2027-L2152 HydrophobicContact CD-CB 4.46Å; K2027-L2152 HydrophobicContact CD-CD1 4.01Å
2028	M	91.6	Very high	83.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.7	176	178.1	-169.7	77.2	0	0	109.7	L1986 Q1987 I1988 I2030 V2046 F2059 D2078 L2079	L1986-M2028 HydrophobicContact CD1-CG 3.83Å; L1986-M2028 HydrophobicContact CD1-SD 3.61Å; Q1987-M2028 CarbonylContact O-C 3.53Å; Q1987-M2028 WeakPolarHBondContact O-CA 3.4Å; I1988-M2028 HydrophobicContact CG1-CG 4.36Å; M2028-I2030 HydrophobicContact CE-CB 4.1Å; M2028-I2030 HydrophobicContact CE-CD1 4.18Å; M2028-I2030 HydrophobicContact CE-CG2 4.03Å; M2028-V2046 HydrophobicContact CE-CB 3.82Å; M2028-V2046 HydrophobicContact CE-CG1 4.16Å; M2028-V2046 HydrophobicContact CE-CG2 3.71Å; M2028-V2046 HydrophobicContact SD-CB 4.33Å; M2028-V2046 HydrophobicContact SD-CG1 4.02Å; M2028-F2059 HydrophobicContact CB-CD1 3.77Å; M2028-F2059 HydrophobicContact CB-CE1 3.54Å; M2028-F2059 HydrophobicContact CB-CG 4.36Å; M2028-F2059 HydrophobicContact CB-CZ 3.97Å; M2028-F2059 HydrophobicContact CE-CB 4.19Å; M2028-F2059 HydrophobicContact CE-CG 4.25Å; M2028-F2059 HydrophobicContact SD-CD2 4.41Å; M2028-D2078 CarbonylContact O-C 3.51Å; M2028-D2078 WeakPolarHBondContact O-CA 3.31Å; M2028-L2079 HydrophobicContact CE-CD1 3.87Å; M2028-L2079 PolarHBondContact N-O 3.41Å; M2028-L2079 PolarHBondContact O-N 3.17Å
2029	R	91.3	Very high	83.5	Confident	30 Å²	30	45.9 Å²	45.9	11%	0.113	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.6	170.7	179.6	169.3	-64.3	146.7	10.8	109.5	Q1987 F1989 W2076 A2077 D2078 D2122 G2124	Q1987-R2029 HydrophobicContact CB-CB 4.21Å; Q1987-R2029 PolarHBondContact N-O 3.18Å; Q1987-R2029 PolarHBondContact O-N 2.91Å; F1989-R2029 HydrophobicContact CE2-CB 4.05Å; R2029-W2076 HydrophobicContact CG-CE3 4.13Å; R2029-A2077 WeakPolarHBondContact CA-O 3.35Å; R2029-D2078 WeakPolarHBondContact CB-OD1 3.28Å; R2029-D2078 WeakPolarHBondContact CG-OD1 3.18Å; R2029-D2078 IonicContact CZ-OD1 3.85Å; R2029-D2078 IonicContact CZ-OD2 2.75Å; R2029-D2078 IonicContact NE-OD1 2.7Å; R2029-D2078 PolarHBondContact NE-OD1 3.06Å; R2029-D2078 IonicContact NE-OD2 3.87Å; R2029-D2078 IonicContact NH2-OD1 3.92Å; R2029-D2078 PolarHBondContact NH2-OD1 3.29Å; R2029-D2078 VanDerWaalsContact NH2-OD1 3.14Å; R2029-D2078 IonicContact NH2-OD2 3.53Å; R2029-D2078 PolarHBondContact NH2-OD2 3.17Å; R2029-D2122 IonicContact CZ-OD1 2.88Å; R2029-D2122 IonicContact NH1-OD1 2.83Å; R2029-D2122 PolarHBondContact NH1-OD1 3.04Å; R2029-D2122 IonicContact NH1-OD2 3.28Å; R2029-D2122 PolarHBondContact NH1-OD2 3.06Å; R2029-D2122 PolarHBondContact NH2-O 3.23Å; R2029-D2122 IonicContact NH2-OD1 3.93Å; R2029-D2122 PolarHBondContact NH2-OD1 2.87Å; R2029-G2124 VanDerWaalsContact NH2-N 3.12Å
2030	I	92.6	Very high	83.9	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	142.9	178.7	-163.6	166.9	0	0	0	111.1	I1984 N1985 L1986 M2028 W2041 L2043 V2046 W2076 A2077 L2079	I1984-I2030 HydrophobicContact CG2-CD1 4.16Å; I1984-I2030 HydrophobicContact CG2-CG1 3.85Å; N1985-I2030 WeakPolarHBondContact O-CA 3.33Å; L1986-I2030 HydrophobicContact CD1-CD1 4.2Å; L1986-I2030 HydrophobicContact CD1-CG1 4.36Å; M2028-I2030 HydrophobicContact CE-CB 4.1Å; M2028-I2030 HydrophobicContact CE-CD1 4.18Å; M2028-I2030 HydrophobicContact CE-CG2 4.03Å; I2030-W2041 HydrophobicContact CD1-CH2 3.89Å; I2030-W2041 HydrophobicContact CD1-CZ3 4.24Å; I2030-W2041 HydrophobicContact CG1-CH2 4.32Å; I2030-W2041 HydrophobicContact CG1-CZ3 4.18Å; I2030-L2043 HydrophobicContact CD1-CD2 4.1Å; I2030-L2043 HydrophobicContact CG2-CD2 3.62Å; I2030-V2046 HydrophobicContact CD1-CG2 4.08Å; I2030-W2076 CarbonylContact O-C 3.53Å; I2030-W2076 WeakPolarHBondContact O-CA 3.45Å; I2030-A2077 PolarHBondContact N-O 3.27Å; I2030-A2077 PolarHBondContact O-N 2.64Å; I2030-L2079 HydrophobicContact CG2-CD1 4.11Å; I2030-L2079 HydrophobicContact CG2-CG 4.44Å
2031	G	89.9	Confident	84.6	Confident	3 Å²	3	48.3 Å²	48.3	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	-172.6	-178.8	0	0	0	0	0	113.1	I1984 N1985 L2075	I1984-G2031 CarbonylContact C-O 3.53Å; I1984-G2031 WeakPolarHBondContact CA-O 3.4Å; I1984-G2031 WeakPolarHBondContact CG2-O 3.38Å; N1985-G2031 PolarHBondContact N-O 2.91Å; N1985-G2031 PolarHBondContact O-N 3.45Å; G2031-L2075 CarbonylContact C-O 3.51Å; G2031-L2075 WeakPolarHBondContact CA-O 3.1Å
2032	H	87.8	Confident	85.2	Confident	9 Å²	9	46.8 Å²	46.8	4%	0.042	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	159.3	179.7	72	106	0	0	0	114.9	C1982 S1983 I1984 N2034 L2065 L2075	C1982-H2032 HydrophobicContact CB-CB 3.95Å; C1982-H2032 WeakPolarHBondContact CB-ND1 3.21Å; S1983-H2032 VanDerWaalsContact O-CA 3.23Å; S1983-H2032 WeakPolarHBondContact O-CA 3.44Å; S1983-H2032 WeakPolarHBondContact O-CB 3.46Å; I1984-H2032 HydrophobicContact CD1-CB 3.73Å; H2032-N2034 VanDerWaalsContact C-N 3.33Å; H2032-N2034 PolarHBondContact O-N 2.96Å; H2032-L2065 PolarHBondContact NE2-O 2.92Å; H2032-L2075 PolarHBondContact N-O 3.13Å; H2032-L2075 WeakPolarHBondContact NE2-CD2 3.21Å
2033	D	80.2	Confident	85.9	Confident	47 Å²	47	46.8 Å²	46.8	25%	0.251	22%	0.217	S	C	.	.			trans	-72.1	-14.7	-171.5	70.1	15.8	0	0	0	116.2	C1982 S1983 Q2035	C1982-D2033 WeakPolarHBondContact CB-OD1 3.43Å; S1983-D2033 WeakPolarHBondContact CB-OD2 3.32Å; S1983-D2033 VanDerWaalsContact N-CG 3.34Å; S1983-D2033 PolarHBondContact N-OD1 3.26Å; S1983-D2033 PolarHBondContact N-OD2 3.44Å; S1983-D2033 PolarHBondContact O-N 3.12Å; S1983-D2033 PolarHBondContact OG-OD2 3.36Å; D2033-Q2035 HydrophobicContact CB-CG 3.94Å; D2033-Q2035 PolarHBondContact O-N 3.4Å; D2033-Q2035 VanDerWaalsContact O-N 3.08Å; D2033-Q2035 WeakPolarHBondContact OD1-CB 3.23Å; D2033-Q2035 PolarHBondContact OD1-N 3.02Å
2034	N	82.4	Confident	86.5	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.203	22%	0.217	C	C	.	.			trans	56.6	16.5	-177	-164.8	28.9	0	0	0	115.4	H2032 K2039 L2075	H2032-N2034 VanDerWaalsContact C-N 3.33Å; H2032-N2034 PolarHBondContact O-N 2.96Å; N2034-K2039 VanDerWaalsContact O-CE 3.3Å; N2034-K2039 WeakPolarHBondContact O-CE 3.48Å; N2034-K2039 PolarHBondContact O-NZ 2.89Å; N2034-K2039 WeakPolarHBondContact OD1-CB 3.41Å; N2034-K2039 WeakPolarHBondContact OD1-CD 3.24Å; N2034-K2039 WeakPolarHBondContact OD1-CG 3.44Å; N2034-L2075 HydrophobicContact CB-CD1 3.73Å; N2034-L2075 HydrophobicContact CB-CD2 3.87Å; N2034-L2075 HydrophobicContact CB-CG 4.45Å
2035	Q	78.1	Confident	87.1	Confident	156 Å²	156	44 Å²	44	73%	0.729	21%	0.206	S	C	*	.			trans	-82.5	-27.6	-173.2	-69.3	-89.5	-28.5	0	0	113.1	D2033	D2033-Q2035 HydrophobicContact CB-CG 3.94Å; D2033-Q2035 PolarHBondContact O-N 3.4Å; D2033-Q2035 VanDerWaalsContact O-N 3.08Å; D2033-Q2035 WeakPolarHBondContact OD1-CB 3.23Å; D2033-Q2035 PolarHBondContact OD1-N 3.02Å
2036	R	80.6	Confident	87.3	Confident	150 Å²	150	44 Å²	44	57%	0.566	21%	0.206	S	C	*	.	S	Bend	trans	-99.3	-164.7	-167.8	-60	-126.5	-169.5	-149.4	3.6	113.7	D1981 K2039	D1981-R2036 HydrophobicContact CB-CB 4.25Å; D1981-R2036 WeakPolarHBondContact O-CD 3.23Å; D1981-R2036 WeakPolarHBondContact O-CG 3.49Å; D1981-R2036 WeakPolarHBondContact OD1-CB 3.45Å; D1981-R2036 WeakPolarHBondContact OD2-CB 3.23Å; R2036-K2039 WeakPolarHBondContact O-CE 3.41Å; R2036-K2039 WeakPolarHBondContact O-CG 3.25Å
2037	K	75.7	Confident	87.6	Confident	189 Å²	189	44.6 Å²	44.6	82%	0.822	21%	0.208	S	C	*	.	S	Bend	trans	-88.5	-37.4	-165.8	-141.2	176.8	-173	-179.3	0	112.9	D1981 K2039	D1981-K2037 PolarHBondContact OD1-N 3.32Å; D1981-K2037 VanDerWaalsContact OD1-N 3.1Å; D1981-K2037 WeakPolarHBondContact OD2-CB 3.21Å; D1981-K2037 PolarHBondContact OD2-N 2.98Å; K2037-K2039 PolarHBondContact O-N 2.87Å
2038	N	82.2	Confident	87.7	Confident	91 Å²	91	44.6 Å²	44.6	49%	0.487	21%	0.208	S	C	.	.			trans	-91.6	75.6	174.2	-71.6	-7.2	0	0	0	110.1	T1980 D1981 H2040	T1980-N2038 WeakPolarHBondContact CB-O 3.19Å; T1980-N2038 PolarHBondContact OG1-O 3.24Å; D1981-N2038 WeakPolarHBondContact OD1-CA 3.24Å; D1981-N2038 WeakPolarHBondContact OD1-CB 3.45Å; D1981-N2038 PolarHBondContact OD1-N 3.48Å; D1981-N2038 PolarHBondContact OD2-N 3.32Å; N2038-H2040 PolarHBondContact O-N 2.88Å
2039	K	83	Confident	87.6	Confident	83 Å²	83	46.6 Å²	46.6	36%	0.361	22%	0.22	S	C	.	.			trans	-73.4	18.1	-176.5	-63.4	-173.8	173.2	-136.6	0	115.5	N2034 R2036 K2037	N2034-K2039 VanDerWaalsContact O-CE 3.3Å; N2034-K2039 WeakPolarHBondContact O-CE 3.48Å; N2034-K2039 PolarHBondContact O-NZ 2.89Å; N2034-K2039 WeakPolarHBondContact OD1-CB 3.41Å; N2034-K2039 WeakPolarHBondContact OD1-CD 3.24Å; N2034-K2039 WeakPolarHBondContact OD1-CG 3.44Å; R2036-K2039 WeakPolarHBondContact O-CE 3.41Å; R2036-K2039 WeakPolarHBondContact O-CG 3.25Å; K2037-K2039 PolarHBondContact O-N 2.87Å
2040	H	87.3	Confident	87.3	Confident	51 Å²	51	45.3 Å²	45.3	24%	0.236	22%	0.216	C	C	.	.			trans	-132.2	128.4	-177.1	-42.9	-78.2	0	0	0	107.8	N2038 W2064 S2066 Y2069	N2038-H2040 PolarHBondContact O-N 2.88Å; H2040-W2064 HydrophobicContact CB-CE3 4Å; H2040-W2064 HydrophobicContact CB-CZ3 3.9Å; H2040-S2066 PolarHBondContact ND1-OG 2.92Å; H2040-Y2069 HydrophobicContact CB-CD2 4.1Å; H2040-Y2069 HydrophobicContact CB-CE2 4.41Å; H2040-Y2069 AromaticContact CE1-CD2 3.97Å; H2040-Y2069 AromaticContact CE1-CE2 3.64Å; H2040-Y2069 AromaticContact CG-CD2 3.74Å; H2040-Y2069 AromaticContact CG-CE2 3.72Å; H2040-Y2069 AromaticContact ND1-CD2 3.36Å; H2040-Y2069 WeakPolarHBondContact ND1-CD2 3.39Å; H2040-Y2069 AromaticContact ND1-CE2 3.45Å; H2040-Y2069 WeakPolarHBondContact ND1-CE2 3.13Å; H2040-Y2069 AromaticContact NE2-CE2 3.99Å
2041	W	91.4	Very high	86.6	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.2	174.5	-170.1	32.8	0	0	0	108.8	I1970 T1972 A1978 T1980 I1984 F2007 I2030 L2043 W2064 L2065	I1970-W2041 HydrophobicContact CG2-CH2 4.03Å; I1970-W2041 HydrophobicContact CG2-CZ2 3.75Å; T1972-W2041 PolarHBondContact OG1-NE1 2.98Å; A1978-W2041 CarbonylContact O-C 3.57Å; A1978-W2041 WeakPolarHBondContact O-CA 3.32Å; T1980-W2041 HydrophobicContact CG2-CB 3.86Å; T1980-W2041 HydrophobicContact CG2-CD2 4.12Å; T1980-W2041 HydrophobicContact CG2-CG 3.65Å; I1984-W2041 HydrophobicContact CD1-CD2 4.07Å; I1984-W2041 HydrophobicContact CD1-CE3 3.67Å; I1984-W2041 HydrophobicContact CD1-CH2 3.99Å; I1984-W2041 HydrophobicContact CD1-CZ2 4.34Å; I1984-W2041 HydrophobicContact CD1-CZ3 3.64Å; I1984-W2041 HydrophobicContact CG1-CH2 4.16Å; I1984-W2041 HydrophobicContact CG1-CZ3 4.23Å; I1984-W2041 HydrophobicContact CG2-CH2 3.87Å; I1984-W2041 HydrophobicContact CG2-CZ3 3.85Å; F2007-W2041 HydrophobicContact CD1-CZ2 4.37Å; I2030-W2041 HydrophobicContact CD1-CH2 3.89Å; I2030-W2041 HydrophobicContact CD1-CZ3 4.24Å; I2030-W2041 HydrophobicContact CG1-CH2 4.32Å; I2030-W2041 HydrophobicContact CG1-CZ3 4.18Å; W2041-L2043 HydrophobicContact CD2-CB 4.43Å; W2041-L2043 HydrophobicContact CE3-CB 4.49Å; W2041-L2043 HydrophobicContact CH2-CB 4.44Å; W2041-L2043 HydrophobicContact CH2-CD1 3.93Å; W2041-L2043 HydrophobicContact CH2-CD2 4.19Å; W2041-L2043 HydrophobicContact CH2-CG 4.42Å; W2041-L2043 HydrophobicContact CZ2-CB 4.39Å; W2041-L2043 HydrophobicContact CZ2-CD1 3.85Å; W2041-L2043 HydrophobicContact CZ3-CB 4.48Å; W2041-L2043 HydrophobicContact CZ3-CD2 4.28Å; W2041-W2064 CarbonylContact O-C 3.6Å; W2041-W2064 VanDerWaalsContact O-CA 3.29Å; W2041-W2064 WeakPolarHBondContact O-CA 3.19Å; W2041-L2065 HydrophobicContact CE3-CB 4.47Å; W2041-L2065 HydrophobicContact CE3-CD1 3.6Å; W2041-L2065 HydrophobicContact CZ3-CD1 3.76Å; W2041-L2065 PolarHBondContact N-O 2.79Å; W2041-L2065 VanDerWaalsContact N-O 3.08Å; W2041-L2065 PolarHBondContact O-N 3.32Å
2042	N	92.3	Very high	85.8	Confident	10 Å²	10	51.4 Å²	51.4	5%	0.053	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	108.3	168.2	-170.6	-68.9	0	0	0	108.6	A1973 V1975 A1978 W2064	A1973-N2042 HydrophobicContact CB-CB 4.29Å; A1973-N2042 WeakPolarHBondContact CB-OD1 3.41Å; A1973-N2042 PolarHBondContact N-O 2.88Å; V1975-N2042 HydrophobicContact CG2-CB 4.28Å; A1978-N2042 HydrophobicContact CB-CB 3.82Å; A1978-N2042 PolarHBondContact O-N 3.28Å; N2042-W2064 HydrophobicContact CB-CD2 3.82Å; N2042-W2064 HydrophobicContact CB-CE3 3.88Å; N2042-W2064 HydrophobicContact CB-CG 4.31Å; N2042-W2064 HydrophobicContact CB-CH2 4.37Å; N2042-W2064 HydrophobicContact CB-CZ2 4.31Å; N2042-W2064 HydrophobicContact CB-CZ3 4.16Å; N2042-W2064 PolarHBondContact ND2-NE1 2.84Å
2043	L	92	Very high	85.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.5	-177.3	171.3	63.7	0	0	0	108.2	I1970 I2030 W2041 V2046 Y2061 D2062 D2063 L2065 L2079	I1970-L2043 HydrophobicContact CG2-CD1 3.9Å; I2030-L2043 HydrophobicContact CD1-CD2 4.1Å; I2030-L2043 HydrophobicContact CG2-CD2 3.62Å; W2041-L2043 HydrophobicContact CD2-CB 4.43Å; W2041-L2043 HydrophobicContact CE3-CB 4.49Å; W2041-L2043 HydrophobicContact CH2-CB 4.44Å; W2041-L2043 HydrophobicContact CH2-CD1 3.93Å; W2041-L2043 HydrophobicContact CH2-CD2 4.19Å; W2041-L2043 HydrophobicContact CH2-CG 4.42Å; W2041-L2043 HydrophobicContact CZ2-CB 4.39Å; W2041-L2043 HydrophobicContact CZ2-CD1 3.85Å; W2041-L2043 HydrophobicContact CZ3-CB 4.48Å; W2041-L2043 HydrophobicContact CZ3-CD2 4.28Å; L2043-V2046 HydrophobicContact CD1-CG2 4Å; L2043-V2046 HydrophobicContact CD2-CG2 4.42Å; L2043-Y2061 HydrophobicContact CB-CD1 4.25Å; L2043-D2062 WeakPolarHBondContact O-CA 3.36Å; L2043-D2062 PolarHBondContact O-N 3.33Å; L2043-D2063 PolarHBondContact N-O 2.66Å; L2043-L2065 HydrophobicContact CB-CD1 4.36Å; L2043-L2065 HydrophobicContact CD2-CD1 4.18Å; L2043-L2079 HydrophobicContact CD2-CD1 4.31Å
2044	S	90.7	Very high	85.2	Confident	26 Å²	26	58.8 Å²	58.8	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-67.1	176.8	176.8	0	0	0	0	110.3	T1971 Y2061 D2062	T1971-S2044 PolarHBondContact O-N 2.84Å; S2044-Y2061 PolarHBondContact O-N 3.37Å; S2044-D2062 WeakPolarHBondContact CA-OD1 3.49Å; S2044-D2062 WeakPolarHBondContact CB-OD1 3.44Å; S2044-D2062 PolarHBondContact O-N 3.2Å; S2044-D2062 VanDerWaalsContact O-N 3.12Å; S2044-D2062 PolarHBondContact OG-OD1 2.65Å
2045	C	92.7	Very high	85.2	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.149	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	163.1	-178.2	68.9	0	0	0	0	112.8	T1971 F2059 V2060	T1971-C2045 PolarHBondContact N-O 2.9Å; C2045-F2059 CarbonylContact C-O 3.59Å; C2045-F2059 VanDerWaalsContact CA-O 3.25Å; C2045-F2059 WeakPolarHBondContact CA-O 3.48Å; C2045-F2059 WeakPolarHBondContact CB-O 3.44Å; C2045-V2060 HydrophobicContact CB-CG2 4.25Å
2046	V	93.5	Very high	85.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.9	166.3	-177.3	0	0	0	0	108.8	L1968 K1969 I1970 M2028 I2030 L2043 V2048 F2059	L1968-V2046 HydrophobicContact CD2-CG1 4.26Å; K1969-V2046 CarbonylContact O-C 2.99Å; K1969-V2046 WeakPolarHBondContact O-CA 3.38Å; K1969-V2046 WeakPolarHBondContact O-CG1 3.33Å; I1970-V2046 HydrophobicContact CB-CG2 4.47Å; I1970-V2046 HydrophobicContact CG1-CG1 4.03Å; I1970-V2046 HydrophobicContact CG1-CG2 4.1Å; I1970-V2046 HydrophobicContact CG2-CG2 4.26Å; M2028-V2046 HydrophobicContact CE-CB 3.82Å; M2028-V2046 HydrophobicContact CE-CG1 4.16Å; M2028-V2046 HydrophobicContact CE-CG2 3.71Å; M2028-V2046 HydrophobicContact SD-CB 4.33Å; M2028-V2046 HydrophobicContact SD-CG1 4.02Å; I2030-V2046 HydrophobicContact CD1-CG2 4.08Å; L2043-V2046 HydrophobicContact CD1-CG2 4Å; L2043-V2046 HydrophobicContact CD2-CG2 4.42Å; V2046-V2048 HydrophobicContact CG1-CG2 4.02Å; V2046-F2059 HydrophobicContact CB-CB 4.38Å; V2046-F2059 PolarHBondContact N-O 2.84Å; V2046-F2059 PolarHBondContact O-N 3.12Å
2047	E	93.5	Very high	86.3	Confident	30 Å²	30	50.5 Å²	50.5	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.6	169.4	-46.7	-170.5	121.9	0	0	109.2	L1968 K1969 L2056 Y2057 R2058	L1968-E2047 CarbonylContact C-O 3.41Å; L1968-E2047 VanDerWaalsContact CA-O 3.29Å; L1968-E2047 WeakPolarHBondContact CA-O 3.21Å; K1969-E2047 HydrophobicContact CB-CB 4.2Å; K1969-E2047 PolarHBondContact N-O 3.33Å; K1969-E2047 PolarHBondContact O-N 3.24Å; E2047-L2056 HydrophobicContact CB-CD1 4.13Å; E2047-Y2057 CarbonylContact C-O 3.53Å; E2047-Y2057 WeakPolarHBondContact CA-O 3.33Å; E2047-R2058 HydrophobicContact CG-CG 4.42Å; E2047-R2058 IonicContact OE1-CZ 2.92Å; E2047-R2058 VanDerWaalsContact OE1-CZ 3.23Å; E2047-R2058 IonicContact OE1-NE 2.98Å; E2047-R2058 PolarHBondContact OE1-NE 3.06Å; E2047-R2058 IonicContact OE1-NH2 3.77Å; E2047-R2058 PolarHBondContact OE1-NH2 2.88Å
2048	V	92.9	Very high	87	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.8	-179.1	-175.4	0	0	0	0	109.8	Y1966 H1967 L1968 L2025 V2046 Y2057 F2059	Y1966-V2048 HydrophobicContact CD1-CG1 3.91Å; H1967-V2048 CarbonylContact O-C 3.51Å; H1967-V2048 WeakPolarHBondContact O-CA 3.44Å; L1968-V2048 HydrophobicContact CD2-CG2 3.93Å; L1968-V2048 HydrophobicContact CG-CG1 4.47Å; L1968-V2048 HydrophobicContact CG-CG2 4.08Å; L2025-V2048 HydrophobicContact CD1-CB 4.27Å; L2025-V2048 HydrophobicContact CD1-CG1 3.98Å; V2046-V2048 HydrophobicContact CG1-CG2 4.02Å; V2048-Y2057 PolarHBondContact N-O 3.19Å; V2048-Y2057 PolarHBondContact O-N 2.79Å; V2048-F2059 HydrophobicContact CB-CE2 4.15Å; V2048-F2059 HydrophobicContact CG2-CD2 4.07Å; V2048-F2059 HydrophobicContact CG2-CE2 3.7Å
2049	T	90.3	Very high	87.5	Confident	41 Å²	41	43 Å²	43	25%	0.252	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.7	170.1	-50.6	0	0	0	0	109.3	H1967 L2056	H1967-T2049 PolarHBondContact N-O 2.93Å; H1967-T2049 PolarHBondContact O-N 3.49Å; T2049-L2056 WeakPolarHBondContact OG1-CD1 3.24Å
2050	V	85.3	Confident	87.8	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.024	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	116.1	177.3	-164.8	0	0	0	0	109.5	I1964 Y1966 L2025 N2052 T2053 N2054 Q2055 Y2057	I1964-V2050 HydrophobicContact CD1-CG1 3.59Å; Y1966-V2050 HydrophobicContact CD1-CB 4.39Å; Y1966-V2050 HydrophobicContact CD1-CG1 4.08Å; Y1966-V2050 HydrophobicContact CD1-CG2 3.97Å; Y1966-V2050 HydrophobicContact CE1-CB 4.26Å; Y1966-V2050 HydrophobicContact CE1-CG1 3.65Å; Y1966-V2050 HydrophobicContact CE1-CG2 3.78Å; L2025-V2050 HydrophobicContact CD1-CG2 4.29Å; L2025-V2050 HydrophobicContact CG-CG2 4.44Å; V2050-N2052 VanDerWaalsContact C-N 3.28Å; V2050-N2052 VanDerWaalsContact CG1-OD1 3.3Å; V2050-N2052 WeakPolarHBondContact CG1-OD1 3.39Å; V2050-N2052 PolarHBondContact O-N 3.46Å; V2050-N2052 VanDerWaalsContact O-N 3.15Å; V2050-T2053 PolarHBondContact O-N 2.94Å; V2050-T2053 VanDerWaalsContact O-N 3.17Å; V2050-T2053 PolarHBondContact O-OG1 3.05Å; V2050-N2054 WeakPolarHBondContact O-CA 2.87Å; V2050-N2054 PolarHBondContact O-N 3.11Å; V2050-Q2055 PolarHBondContact N-O 2.97Å; V2050-Y2057 HydrophobicContact CG2-CD2 4.08Å; V2050-Y2057 HydrophobicContact CG2-CE2 3.9Å
2051	A	77.4	Confident	87.9	Confident	35 Å²	35	41.2 Å²	41.2	29%	0.289	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.5	-164	0	0	0	0	0	115.6	T1965	T1965-A2051 WeakPolarHBondContact O-CB 3.29Å; T1965-A2051 PolarHBondContact O-N 2.99Å
2052	N	72	Confident	87.8	Confident	97 Å²	97	45.9 Å²	45.9	52%	0.519	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-15.1	179	66.3	-10.7	0	0	0	114	I1964 V2050	I1964-N2052 WeakPolarHBondContact CD1-ND2 3.13Å; V2050-N2052 VanDerWaalsContact C-N 3.28Å; V2050-N2052 VanDerWaalsContact CG1-OD1 3.3Å; V2050-N2052 WeakPolarHBondContact CG1-OD1 3.39Å; V2050-N2052 PolarHBondContact O-N 3.46Å; V2050-N2052 VanDerWaalsContact O-N 3.15Å
2053	T	77.3	Confident	87.7	Confident	82 Å²	82	46.8 Å²	46.8	50%	0.503	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-10.8	178.3	56.2	0	0	0	0	113.2	V2050 Q2055	V2050-T2053 PolarHBondContact O-N 2.94Å; V2050-T2053 VanDerWaalsContact O-N 3.17Å; V2050-T2053 PolarHBondContact O-OG1 3.05Å; T2053-Q2055 PolarHBondContact O-N 2.89Å; T2053-Q2055 WeakPolarHBondContact OG1-CB 3.49Å; T2053-Q2055 PolarHBondContact OG1-N 3.16Å
2054	N	78.9	Confident	87.6	Confident	128 Å²	128	49.1 Å²	49.1	68%	0.684	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	19.3	-167.5	-71.6	-32.6	0	0	0	114.2	V2050	V2050-N2054 WeakPolarHBondContact O-CA 2.87Å; V2050-N2054 PolarHBondContact O-N 3.11Å
2055	Q	82	Confident	87.6	Confident	83 Å²	83	47.9 Å²	47.9	39%	0.388	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.2	-175.4	-161.8	164.4	54.2	0	0	110	V2050 T2053 Y2057	V2050-Q2055 PolarHBondContact N-O 2.97Å; T2053-Q2055 PolarHBondContact O-N 2.89Å; T2053-Q2055 WeakPolarHBondContact OG1-CB 3.49Å; T2053-Q2055 PolarHBondContact OG1-N 3.16Å; Q2055-Y2057 HydrophobicContact CB-CE2 4.04Å; Q2055-Y2057 HydrophobicContact CG-CE2 3.95Å; Q2055-Y2057 WeakPolarHBondContact O-CD2 3.43Å; Q2055-Y2057 PolarHBondContact OE1-OH 2.85Å
2056	L	88.9	Confident	87.3	Confident	84 Å²	84	46.9 Å²	46.9	44%	0.44	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.8	-178.6	-177.8	65.9	0	0	0	110.8	E2047 T2049	E2047-L2056 HydrophobicContact CB-CD1 4.13Å; T2049-L2056 WeakPolarHBondContact OG1-CD1 3.24Å
2057	Y	92.3	Very high	86.8	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	137.4	173.2	-65.5	-100.3	0	0	0	109.5	K2024 L2025 E2047 V2048 V2050 Q2055 A2081 M2082 I2083	K2024-Y2057 HydrophobicContact CG-CE1 4.34Å; K2024-Y2057 WeakPolarHBondContact CG-OH 3.31Å; L2025-Y2057 HydrophobicContact CB-CD1 3.7Å; L2025-Y2057 HydrophobicContact CB-CD2 4.43Å; L2025-Y2057 HydrophobicContact CB-CE1 3.69Å; L2025-Y2057 HydrophobicContact CB-CE2 4.49Å; L2025-Y2057 HydrophobicContact CB-CG 4.07Å; L2025-Y2057 HydrophobicContact CD1-CD1 4.41Å; L2025-Y2057 HydrophobicContact CD1-CD2 3.87Å; L2025-Y2057 HydrophobicContact CD1-CE2 4.39Å; L2025-Y2057 HydrophobicContact CD1-CG 3.9Å; L2025-Y2057 HydrophobicContact CG-CD1 4.25Å; L2025-Y2057 HydrophobicContact CG-CD2 4.07Å; L2025-Y2057 HydrophobicContact CG-CE1 4.21Å; L2025-Y2057 HydrophobicContact CG-CE2 4.12Å; L2025-Y2057 HydrophobicContact CG-CG 4.16Å; E2047-Y2057 CarbonylContact C-O 3.53Å; E2047-Y2057 WeakPolarHBondContact CA-O 3.33Å; V2048-Y2057 PolarHBondContact N-O 3.19Å; V2048-Y2057 PolarHBondContact O-N 2.79Å; V2050-Y2057 HydrophobicContact CG2-CD2 4.08Å; V2050-Y2057 HydrophobicContact CG2-CE2 3.9Å; Q2055-Y2057 HydrophobicContact CB-CE2 4.04Å; Q2055-Y2057 HydrophobicContact CG-CE2 3.95Å; Q2055-Y2057 WeakPolarHBondContact O-CD2 3.43Å; Q2055-Y2057 PolarHBondContact OE1-OH 2.85Å; Y2057-A2081 HydrophobicContact CD1-CB 4.09Å; Y2057-M2082 WeakPolarHBondContact CA-O 3.13Å; Y2057-I2083 HydrophobicContact CD1-CD1 4.16Å; Y2057-I2083 HydrophobicContact CD1-CG1 3.64Å; Y2057-I2083 HydrophobicContact CE1-CD1 3.5Å; Y2057-I2083 VanDerWaalsContact CE1-CD1 3.5Å; Y2057-I2083 HydrophobicContact CE1-CG1 3.53Å; Y2057-I2083 HydrophobicContact CG-CG1 4.47Å
2058	R	90.3	Very high	86.3	Confident	123 Å²	123	54.1 Å²	54.1	46%	0.464	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.2	175.8	-171.8	177	-78	166.2	-5.8	110.5	E2047 V2060 M2082	E2047-R2058 HydrophobicContact CG-CG 4.42Å; E2047-R2058 IonicContact OE1-CZ 2.92Å; E2047-R2058 VanDerWaalsContact OE1-CZ 3.23Å; E2047-R2058 IonicContact OE1-NE 2.98Å; E2047-R2058 PolarHBondContact OE1-NE 3.06Å; E2047-R2058 IonicContact OE1-NH2 3.77Å; E2047-R2058 PolarHBondContact OE1-NH2 2.88Å; R2058-V2060 HydrophobicContact CG-CG2 4.1Å; R2058-M2082 HydrophobicContact CB-CE 4.22Å; R2058-M2082 HydrophobicContact CG-CE 4.14Å; R2058-M2082 PolarHBondContact N-O 3.32Å; R2058-M2082 WeakPolarHBondContact O-CB 3.26Å; R2058-M2082 PolarHBondContact O-N 3.41Å
2059	F	93.4	Very high	85.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.6	176.5	-57.6	-96.3	0	0	0	107.4	L2025 M2028 C2045 V2046 V2048 L2079 P2080 A2081	L2025-F2059 HydrophobicContact CB-CZ 4.4Å; L2025-F2059 HydrophobicContact CD1-CE2 4.39Å; L2025-F2059 HydrophobicContact CD1-CZ 4.18Å; M2028-F2059 HydrophobicContact CB-CD1 3.77Å; M2028-F2059 HydrophobicContact CB-CE1 3.54Å; M2028-F2059 HydrophobicContact CB-CG 4.36Å; M2028-F2059 HydrophobicContact CB-CZ 3.97Å; M2028-F2059 HydrophobicContact CE-CB 4.19Å; M2028-F2059 HydrophobicContact CE-CG 4.25Å; M2028-F2059 HydrophobicContact SD-CD2 4.41Å; C2045-F2059 CarbonylContact C-O 3.59Å; C2045-F2059 VanDerWaalsContact CA-O 3.25Å; C2045-F2059 WeakPolarHBondContact CA-O 3.48Å; C2045-F2059 WeakPolarHBondContact CB-O 3.44Å; V2046-F2059 HydrophobicContact CB-CB 4.38Å; V2046-F2059 PolarHBondContact N-O 2.84Å; V2046-F2059 PolarHBondContact O-N 3.12Å; V2048-F2059 HydrophobicContact CB-CE2 4.15Å; V2048-F2059 HydrophobicContact CG2-CD2 4.07Å; V2048-F2059 HydrophobicContact CG2-CE2 3.7Å; F2059-L2079 HydrophobicContact CB-CB 4.09Å; F2059-L2079 HydrophobicContact CB-CD1 4.15Å; F2059-L2079 HydrophobicContact CD1-CB 4.1Å; F2059-P2080 VanDerWaalsContact CD1-O 3.26Å; F2059-P2080 WeakPolarHBondContact CD1-O 3.4Å; F2059-A2081 HydrophobicContact CD1-CB 4.41Å; F2059-A2081 VanDerWaalsContact CE1-CA 3.42Å; F2059-A2081 HydrophobicContact CE1-CB 3.58Å; F2059-A2081 HydrophobicContact CZ-CB 3.76Å
2060	V	89.7	Confident	85	Confident	59 Å²	59	58 Å²	58	36%	0.358	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146	-175.8	178.5	0	0	0	0	109.6	C2045 R2058 D2062 M2082	C2045-V2060 HydrophobicContact CB-CG2 4.25Å; R2058-V2060 HydrophobicContact CG-CG2 4.1Å; V2060-D2062 VanDerWaalsContact CG1-OD2 3.25Å; V2060-D2062 WeakPolarHBondContact CG1-OD2 3.43Å; V2060-M2082 HydrophobicContact CB-CE 4.46Å; V2060-M2082 HydrophobicContact CG2-CE 3.67Å
2061	Y	89.6	Confident	84.5	Confident	38 Å²	38	67.1 Å²	67.1	15%	0.149	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	-50.1	179.7	-172.9	-117.6	0	0	0	113.3	L2043 S2044 D2063 L2065 A2077 L2079	L2043-Y2061 HydrophobicContact CB-CD1 4.25Å; S2044-Y2061 PolarHBondContact O-N 3.37Å; Y2061-D2063 HydrophobicContact CD1-CB 4.22Å; Y2061-D2063 VanDerWaalsContact CD1-O 3.31Å; Y2061-D2063 WeakPolarHBondContact CD1-O 3.47Å; Y2061-D2063 HydrophobicContact CE1-CB 3.85Å; Y2061-D2063 VanDerWaalsContact CE1-O 3.24Å; Y2061-D2063 WeakPolarHBondContact CE1-O 3.34Å; Y2061-D2063 PolarHBondContact O-N 3.39Å; Y2061-D2063 VanDerWaalsContact O-N 3.11Å; Y2061-L2065 HydrophobicContact CE1-CD2 3.87Å; Y2061-L2065 HydrophobicContact CE1-CG 3.85Å; Y2061-A2077 HydrophobicContact CD2-CB 4.28Å; Y2061-A2077 HydrophobicContact CE2-CB 3.7Å; Y2061-L2079 HydrophobicContact CD2-CD2 3.41Å; Y2061-L2079 VanDerWaalsContact CD2-CD2 3.41Å; Y2061-L2079 HydrophobicContact CE2-CD2 4.24Å; Y2061-L2079 HydrophobicContact CG-CD2 3.92Å
2062	D	88.6	Confident	84.3	Confident	97 Å²	97	71.4 Å²	71.4	52%	0.519	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.9	34	178.1	-66.1	-50.9	0	0	0	115.7	L2043 S2044 V2060	L2043-D2062 WeakPolarHBondContact O-CA 3.36Å; L2043-D2062 PolarHBondContact O-N 3.33Å; S2044-D2062 WeakPolarHBondContact CA-OD1 3.49Å; S2044-D2062 WeakPolarHBondContact CB-OD1 3.44Å; S2044-D2062 PolarHBondContact O-N 3.2Å; S2044-D2062 VanDerWaalsContact O-N 3.12Å; S2044-D2062 PolarHBondContact OG-OD1 2.65Å; V2060-D2062 VanDerWaalsContact CG1-OD2 3.25Å; V2060-D2062 WeakPolarHBondContact CG1-OD2 3.43Å
2063	D	89.9	Confident	84.7	Confident	30 Å²	30	73 Å²	73	16%	0.16	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	175.2	174.7	-160.3	6.1	0	0	0	111.7	L2043 Y2061 G2070 K2071	L2043-D2063 PolarHBondContact N-O 2.66Å; Y2061-D2063 HydrophobicContact CD1-CB 4.22Å; Y2061-D2063 VanDerWaalsContact CD1-O 3.31Å; Y2061-D2063 WeakPolarHBondContact CD1-O 3.47Å; Y2061-D2063 HydrophobicContact CE1-CB 3.85Å; Y2061-D2063 VanDerWaalsContact CE1-O 3.24Å; Y2061-D2063 WeakPolarHBondContact CE1-O 3.34Å; Y2061-D2063 PolarHBondContact O-N 3.39Å; Y2061-D2063 VanDerWaalsContact O-N 3.11Å; D2063-G2070 WeakPolarHBondContact OD1-CA 3.5Å; D2063-K2071 WeakPolarHBondContact OD2-CB 3.49Å; D2063-K2071 PolarHBondContact OD2-N 3.3Å
2064	W	90.9	Very high	85	Confident	48 Å²	48	70.4 Å²	70.4	18%	0.182	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129	-179.8	-61.9	80.7	0	0	0	112.3	R1977 H2040 W2041 N2042 Y2069	R1977-W2064 WeakPolarHBondContact O-CZ3 3.38Å; H2040-W2064 HydrophobicContact CB-CE3 4Å; H2040-W2064 HydrophobicContact CB-CZ3 3.9Å; W2041-W2064 CarbonylContact O-C 3.6Å; W2041-W2064 VanDerWaalsContact O-CA 3.29Å; W2041-W2064 WeakPolarHBondContact O-CA 3.19Å; N2042-W2064 HydrophobicContact CB-CD2 3.82Å; N2042-W2064 HydrophobicContact CB-CE3 3.88Å; N2042-W2064 HydrophobicContact CB-CG 4.31Å; N2042-W2064 HydrophobicContact CB-CH2 4.37Å; N2042-W2064 HydrophobicContact CB-CZ2 4.31Å; N2042-W2064 HydrophobicContact CB-CZ3 4.16Å; N2042-W2064 PolarHBondContact ND2-NE1 2.84Å; W2064-Y2069 HydrophobicContact CE3-CD2 4.33Å
2065	L	89.7	Confident	85.3	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	99.7	156.5	-66.3	172.4	0	0	0	106.9	H2032 W2041 L2043 Y2061 S2074 A2077	H2032-L2065 PolarHBondContact NE2-O 2.92Å; W2041-L2065 HydrophobicContact CE3-CB 4.47Å; W2041-L2065 HydrophobicContact CE3-CD1 3.6Å; W2041-L2065 HydrophobicContact CZ3-CD1 3.76Å; W2041-L2065 PolarHBondContact N-O 2.79Å; W2041-L2065 VanDerWaalsContact N-O 3.08Å; W2041-L2065 PolarHBondContact O-N 3.32Å; L2043-L2065 HydrophobicContact CB-CD1 4.36Å; L2043-L2065 HydrophobicContact CD2-CD1 4.18Å; Y2061-L2065 HydrophobicContact CE1-CD2 3.87Å; Y2061-L2065 HydrophobicContact CE1-CG 3.85Å; L2065-S2074 CarbonylContact C-O 3.52Å; L2065-S2074 WeakPolarHBondContact CA-O 3.27Å; L2065-A2077 HydrophobicContact CD2-CB 4.01Å
2066	S	87.4	Confident	85.7	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.007	31%	0.313	C	S	.	.	S	Bend	trans	-168.1	151.6	-177.8	-169.4	0	0	0	0	111	H2040 T2068 K2073 S2074	H2040-S2066 PolarHBondContact ND1-OG 2.92Å; S2066-T2068 VanDerWaalsContact C-N 3.25Å; S2066-T2068 PolarHBondContact O-N 2.79Å; S2066-T2068 PolarHBondContact OG-N 2.68Å; S2066-K2073 CarbonylContact O-C 3.56Å; S2066-K2073 WeakPolarHBondContact O-CA 3.5Å; S2066-S2074 PolarHBondContact N-O 3.44Å; S2066-S2074 PolarHBondContact O-N 2.81Å; S2066-S2074 VanDerWaalsContact O-N 3.16Å
2067	L	82.6	Confident	85.6	Confident	98 Å²	98	62.7 Å²	62.7	51%	0.513	30%	0.295	S	S	.	.	S	Bend	trans	-74.6	-14.1	168.5	-62.2	175.1	0	0	0	113.3	L2075	L2067-L2075 HydrophobicContact CD1-CD1 4.24Å; L2067-L2075 HydrophobicContact CD1-CG 4.49Å; L2067-L2075 HydrophobicContact CD2-CD1 4.22Å; L2067-L2075 HydrophobicContact CD2-CG 3.92Å; L2067-L2075 HydrophobicContact CG-CD1 4.18Å; L2067-L2075 HydrophobicContact CG-CD2 3.97Å; L2067-L2075 HydrophobicContact CG-CG 3.9Å
2068	T	82	Confident	85.5	Confident	84 Å²	84	63.7 Å²	63.7	52%	0.515	30%	0.3	S	S	.	.	S	Bend	trans	-110.5	-34.9	-169.7	-37	0	0	0	0	113.2	S2066	S2066-T2068 VanDerWaalsContact C-N 3.25Å; S2066-T2068 PolarHBondContact O-N 2.79Å; S2066-T2068 PolarHBondContact OG-N 2.68Å
2069	Y	78.3	Confident	85.6	Confident	100 Å²	100	58 Å²	58	39%	0.392	28%	0.279	S	S	.	.	S	Bend	trans	-118	164	-175.7	-56.9	-58	0	0	0	111.3	H2040 W2064	H2040-Y2069 HydrophobicContact CB-CD2 4.1Å; H2040-Y2069 HydrophobicContact CB-CE2 4.41Å; H2040-Y2069 AromaticContact CE1-CD2 3.97Å; H2040-Y2069 AromaticContact CE1-CE2 3.64Å; H2040-Y2069 AromaticContact CG-CD2 3.74Å; H2040-Y2069 AromaticContact CG-CE2 3.72Å; H2040-Y2069 AromaticContact ND1-CD2 3.36Å; H2040-Y2069 WeakPolarHBondContact ND1-CD2 3.39Å; H2040-Y2069 AromaticContact ND1-CE2 3.45Å; H2040-Y2069 WeakPolarHBondContact ND1-CE2 3.13Å; H2040-Y2069 AromaticContact NE2-CE2 3.99Å; W2064-Y2069 HydrophobicContact CE3-CD2 4.33Å
2070	G	78.7	Confident	85.4	Confident	25 Å²	25	59.7 Å²	59.7	26%	0.258	29%	0.29	S	S	.	.	S	Bend	trans	80.4	169.2	-179.8	0	0	0	0	0	114.6	D2063	D2063-G2070 WeakPolarHBondContact OD1-CA 3.5Å
2071	K	74.8	Confident	85.5	Confident	195 Å²	195	56.9 Å²	56.9	85%	0.848	27%	0.273	S	S	*	.	S	Bend	trans	-72.9	-41.9	-172	-67.2	174.5	-178.4	169.8	0	112.9	D2063	D2063-K2071 WeakPolarHBondContact OD2-CB 3.49Å; D2063-K2071 PolarHBondContact OD2-N 3.3Å
2072	R	73	Confident	85.4	Confident	124 Å²	124	57.1 Å²	57.1	47%	0.468	28%	0.276	S	S	.	.	S	Bend	trans	-84.7	-14.1	-176.6	-64.4	-166.6	-170.9	-142.3	2.7	114.5	S2074 E2091 S2150	R2072-S2074 PolarHBondContact O-N 2.88Å; R2072-S2074 VanDerWaalsContact O-N 3.16Å; R2072-E2091 IonicContact CZ-OE1 3.94Å; R2072-E2091 IonicContact NH2-OE1 3.85Å; R2072-E2091 PolarHBondContact NH2-OE1 2.79Å; R2072-S2150 PolarHBondContact NH1-O 2.89Å; R2072-S2150 PolarHBondContact NH2-O 2.95Å
2073	K	81.5	Confident	85.2	Confident	130 Å²	130	54.6 Å²	54.6	57%	0.565	26%	0.262	S	S	*	.			trans	45.5	40.8	-174.6	-64.6	-174.7	178.8	178.2	0	114.1	S2066	S2066-K2073 CarbonylContact O-C 3.56Å; S2066-K2073 WeakPolarHBondContact O-CA 3.5Å
2074	S	82.9	Confident	84.6	Confident	28 Å²	28	56.1 Å²	56.1	20%	0.196	29%	0.285	C	S	.	.			trans	-113.6	152.1	-176.6	-178	0	0	0	0	111.6	L2065 S2066 R2072 W2076	L2065-S2074 CarbonylContact C-O 3.52Å; L2065-S2074 WeakPolarHBondContact CA-O 3.27Å; S2066-S2074 PolarHBondContact N-O 3.44Å; S2066-S2074 PolarHBondContact O-N 2.81Å; S2066-S2074 VanDerWaalsContact O-N 3.16Å; R2072-S2074 PolarHBondContact O-N 2.88Å; R2072-S2074 VanDerWaalsContact O-N 3.16Å; S2074-W2076 VanDerWaalsContact C-N 3.33Å; S2074-W2076 WeakPolarHBondContact CB-O 3.35Å; S2074-W2076 PolarHBondContact OG-N 2.81Å; S2074-W2076 VanDerWaalsContact OG-N 3.15Å; S2074-W2076 PolarHBondContact OG-O 3.29Å
2075	L	85.7	Confident	83.8	Confident	37 Å²	37	61.8 Å²	61.8	19%	0.194	32%	0.319	C	S	.	.	S	Bend	trans	-83.7	-8.9	171.9	-63.8	169.9	0	0	0	113.1	G2031 H2032 N2034 L2067	G2031-L2075 CarbonylContact C-O 3.51Å; G2031-L2075 WeakPolarHBondContact CA-O 3.1Å; H2032-L2075 PolarHBondContact N-O 3.13Å; H2032-L2075 WeakPolarHBondContact NE2-CD2 3.21Å; N2034-L2075 HydrophobicContact CB-CD1 3.73Å; N2034-L2075 HydrophobicContact CB-CD2 3.87Å; N2034-L2075 HydrophobicContact CB-CG 4.45Å; L2067-L2075 HydrophobicContact CD1-CD1 4.24Å; L2067-L2075 HydrophobicContact CD1-CG 4.49Å; L2067-L2075 HydrophobicContact CD2-CD1 4.22Å; L2067-L2075 HydrophobicContact CD2-CG 3.92Å; L2067-L2075 HydrophobicContact CG-CD1 4.18Å; L2067-L2075 HydrophobicContact CG-CD2 3.97Å; L2067-L2075 HydrophobicContact CG-CG 3.9Å
2076	W	88.7	Confident	83	Confident	90 Å²	90	66.3 Å²	66.3	34%	0.341	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	158.5	-179.2	68.8	-89	0	0	0	112.6	R2029 I2030 S2074 D2078	R2029-W2076 HydrophobicContact CG-CE3 4.13Å; I2030-W2076 CarbonylContact O-C 3.53Å; I2030-W2076 WeakPolarHBondContact O-CA 3.45Å; S2074-W2076 VanDerWaalsContact C-N 3.33Å; S2074-W2076 WeakPolarHBondContact CB-O 3.35Å; S2074-W2076 PolarHBondContact OG-N 2.81Å; S2074-W2076 VanDerWaalsContact OG-N 3.15Å; S2074-W2076 PolarHBondContact OG-O 3.29Å; W2076-D2078 WeakPolarHBondContact CZ3-OD1 3.46Å
2077	A	88.3	Confident	82.7	Confident	6 Å²	6	69.8 Å²	69.8	5%	0.05	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	153.7	175	0	0	0	0	0	112.1	R2029 I2030 Y2061 L2065 L2079	R2029-A2077 WeakPolarHBondContact CA-O 3.35Å; I2030-A2077 PolarHBondContact N-O 3.27Å; I2030-A2077 PolarHBondContact O-N 2.64Å; Y2061-A2077 HydrophobicContact CD2-CB 4.28Å; Y2061-A2077 HydrophobicContact CE2-CB 3.7Å; L2065-A2077 HydrophobicContact CD2-CB 4.01Å; A2077-L2079 HydrophobicContact CB-CD2 4.1Å
2078	D	89.2	Confident	82.8	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.128	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122	165.8	-84.9	20	0	0	0	109	K2027 M2028 R2029 W2076 L2152	K2027-D2078 IonicContact NZ-OD2 2.64Å; K2027-D2078 PolarHBondContact NZ-OD2 2.75Å; M2028-D2078 CarbonylContact O-C 3.51Å; M2028-D2078 WeakPolarHBondContact O-CA 3.31Å; R2029-D2078 WeakPolarHBondContact CB-OD1 3.28Å; R2029-D2078 WeakPolarHBondContact CG-OD1 3.18Å; R2029-D2078 IonicContact CZ-OD1 3.85Å; R2029-D2078 IonicContact CZ-OD2 2.75Å; R2029-D2078 IonicContact NE-OD1 2.7Å; R2029-D2078 PolarHBondContact NE-OD1 3.06Å; R2029-D2078 IonicContact NE-OD2 3.87Å; R2029-D2078 IonicContact NH2-OD1 3.92Å; R2029-D2078 PolarHBondContact NH2-OD1 3.29Å; R2029-D2078 VanDerWaalsContact NH2-OD1 3.14Å; R2029-D2078 IonicContact NH2-OD2 3.53Å; R2029-D2078 PolarHBondContact NH2-OD2 3.17Å; W2076-D2078 WeakPolarHBondContact CZ3-OD1 3.46Å; D2078-L2152 HydrophobicContact CB-CD1 4.13Å
2079	L	91.8	Very high	82.8	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.5	-178.2	-51.6	-174	0	0	0	110.7	K2027 M2028 I2030 L2043 F2059 Y2061 A2077	K2027-L2079 CarbonylContact C-O 3.56Å; K2027-L2079 WeakPolarHBondContact CA-O 3.5Å; K2027-L2079 VanDerWaalsContact CB-O 3.28Å; K2027-L2079 WeakPolarHBondContact CB-O 3.32Å; M2028-L2079 HydrophobicContact CE-CD1 3.87Å; M2028-L2079 PolarHBondContact N-O 3.41Å; M2028-L2079 PolarHBondContact O-N 3.17Å; I2030-L2079 HydrophobicContact CG2-CD1 4.11Å; I2030-L2079 HydrophobicContact CG2-CG 4.44Å; L2043-L2079 HydrophobicContact CD2-CD1 4.31Å; F2059-L2079 HydrophobicContact CB-CB 4.09Å; F2059-L2079 HydrophobicContact CB-CD1 4.15Å; F2059-L2079 HydrophobicContact CD1-CB 4.1Å; Y2061-L2079 HydrophobicContact CD2-CD2 3.41Å; Y2061-L2079 VanDerWaalsContact CD2-CD2 3.41Å; Y2061-L2079 HydrophobicContact CE2-CD2 4.24Å; Y2061-L2079 HydrophobicContact CG-CD2 3.92Å; A2077-L2079 HydrophobicContact CB-CD2 4.1Å
2080	P	90.4	Very high	82.9	Confident	34 Å²	34	65.5 Å²	65.5	22%	0.221	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	145.2	177.4	31.4	-33.3	0	0	0	111.2	F2059 V2087 L2089 L2152	F2059-P2080 VanDerWaalsContact CD1-O 3.26Å; F2059-P2080 WeakPolarHBondContact CD1-O 3.4Å; P2080-V2087 HydrophobicContact CB-CG1 3.83Å; P2080-V2087 HydrophobicContact CG-CG1 4.1Å; P2080-L2089 WeakPolarHBondContact CB-O 3.49Å; P2080-L2152 HydrophobicContact CB-CD1 4.06Å; P2080-L2152 HydrophobicContact CB-CD2 3.89Å; P2080-L2152 HydrophobicContact CG-CD2 4.11Å
2081	A	91.3	Very high	83.1	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.348	C	S	.	.			trans	-73.7	142.3	172.2	0	0	0	0	0	111.1	L2025 L2026 Y2057 F2059 Q2088	L2025-A2081 HydrophobicContact CB-CB 4.24Å; L2025-A2081 WeakPolarHBondContact O-CB 3.27Å; L2026-A2081 WeakPolarHBondContact O-CB 3.48Å; L2026-A2081 PolarHBondContact O-N 2.81Å; Y2057-A2081 HydrophobicContact CD1-CB 4.09Å; F2059-A2081 HydrophobicContact CD1-CB 4.41Å; F2059-A2081 VanDerWaalsContact CE1-CA 3.42Å; F2059-A2081 HydrophobicContact CE1-CB 3.58Å; F2059-A2081 HydrophobicContact CZ-CB 3.76Å; A2081-Q2088 HydrophobicContact CB-CB 4.23Å; A2081-Q2088 HydrophobicContact CB-CG 4.02Å; A2081-Q2088 WeakPolarHBondContact O-CB 3.24Å; A2081-Q2088 WeakPolarHBondContact O-CG 3.4Å; A2081-Q2088 PolarHBondContact O-N 3.31Å
2082	M	87.1	Confident	83.4	Confident	43 Å²	43	59.7 Å²	59.7	21%	0.212	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.3	170.2	-50.5	-171.1	-58.8	0	0	110.6	Y2057 R2058 V2060 T2086 V2087	Y2057-M2082 WeakPolarHBondContact CA-O 3.13Å; R2058-M2082 HydrophobicContact CB-CE 4.22Å; R2058-M2082 HydrophobicContact CG-CE 4.14Å; R2058-M2082 PolarHBondContact N-O 3.32Å; R2058-M2082 WeakPolarHBondContact O-CB 3.26Å; R2058-M2082 PolarHBondContact O-N 3.41Å; V2060-M2082 HydrophobicContact CB-CE 4.46Å; V2060-M2082 HydrophobicContact CG2-CE 3.67Å; M2082-T2086 WeakPolarHBondContact CA-O 3.32Å; M2082-V2087 HydrophobicContact CG-CG1 4.5Å; M2082-V2087 HydrophobicContact CG-CG2 4.12Å; M2082-V2087 HydrophobicContact SD-CG2 4.06Å
2083	I	84	Confident	84	Confident	44 Å²	44	56.2 Å²	56.2	23%	0.226	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.8	167.9	-59.1	176.3	0	0	0	106.8	K2024 Y2057 D2085 T2086	K2024-I2083 VanDerWaalsContact CE-CD1 3.48Å; Y2057-I2083 HydrophobicContact CD1-CD1 4.16Å; Y2057-I2083 HydrophobicContact CD1-CG1 3.64Å; Y2057-I2083 HydrophobicContact CE1-CD1 3.5Å; Y2057-I2083 VanDerWaalsContact CE1-CD1 3.5Å; Y2057-I2083 HydrophobicContact CE1-CG1 3.53Å; Y2057-I2083 HydrophobicContact CG-CG1 4.47Å; I2083-D2085 PolarHBondContact O-N 2.83Å; I2083-T2086 PolarHBondContact N-O 2.89Å; I2083-T2086 WeakPolarHBondContact O-CB 3.27Å; I2083-T2086 PolarHBondContact O-N 2.88Å
2084	G	77.8	Confident	84.3	Confident	62 Å²	62	50.4 Å²	50.4	64%	0.639	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	-133.6	-162.9	0	0	0	0	0	109.8	T2086	G2084-T2086 VanDerWaalsContact C-N 3.25Å; G2084-T2086 PolarHBondContact O-N 2.56Å
2085	D	73.8	Confident	84.7	Confident	168 Å²	168	50.2 Å²	50.2	90%	0.898	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	2.9	177.5	-47.6	-58.1	0	0	0	113.6	I2083	I2083-D2085 PolarHBondContact O-N 2.83Å
2086	T	73.4	Confident	85	Confident	94 Å²	94	48.4 Å²	48.4	58%	0.577	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	103.8	-174.2	-51.2	0	0	0	0	112.2	M2082 I2083 G2084 Q2088	M2082-T2086 WeakPolarHBondContact CA-O 3.32Å; I2083-T2086 PolarHBondContact N-O 2.89Å; I2083-T2086 WeakPolarHBondContact O-CB 3.27Å; I2083-T2086 PolarHBondContact O-N 2.88Å; G2084-T2086 VanDerWaalsContact C-N 3.25Å; G2084-T2086 PolarHBondContact O-N 2.56Å; T2086-Q2088 PolarHBondContact O-NE2 2.65Å
2087	V	81.2	Confident	85.2	Confident	74 Å²	74	45.7 Å²	45.7	45%	0.448	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	131.2	173.1	-167.8	0	0	0	0	110.8	P2080 M2082 L2089	P2080-V2087 HydrophobicContact CB-CG1 3.83Å; P2080-V2087 HydrophobicContact CG-CG1 4.1Å; M2082-V2087 HydrophobicContact CG-CG1 4.5Å; M2082-V2087 HydrophobicContact CG-CG2 4.12Å; M2082-V2087 HydrophobicContact SD-CG2 4.06Å; V2087-L2089 WeakPolarHBondContact CG1-O 3.43Å
2088	Q	84.1	Confident	85.5	Confident	43 Å²	43	45.4 Å²	45.4	20%	0.201	26%	0.256	C	S	.	.	S	Bend	trans	-84.7	-28.8	-175.1	-58.1	-54.8	-74.4	0	0	114.1	L2026 A2081 T2086	L2026-Q2088 HydrophobicContact CD2-CB 4.48Å; A2081-Q2088 HydrophobicContact CB-CB 4.23Å; A2081-Q2088 HydrophobicContact CB-CG 4.02Å; A2081-Q2088 WeakPolarHBondContact O-CB 3.24Å; A2081-Q2088 WeakPolarHBondContact O-CG 3.4Å; A2081-Q2088 PolarHBondContact O-N 3.31Å; T2086-Q2088 PolarHBondContact O-NE2 2.65Å
2089	L	82.6	Confident	85.7	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.079	25%	0.254	C	S	.	.	S	Bend	trans	-133.7	132	174.9	-71.1	-179.7	0	0	0	110.8	L2026 K2027 P2080 V2087 Y2120	L2026-L2089 HydrophobicContact CB-CD1 3.94Å; L2026-L2089 HydrophobicContact CB-CG 4.27Å; K2027-L2089 HydrophobicContact CB-CD1 4.21Å; K2027-L2089 HydrophobicContact CD-CD1 4.38Å; K2027-L2089 HydrophobicContact CG-CD1 4.27Å; P2080-L2089 WeakPolarHBondContact CB-O 3.49Å; V2087-L2089 WeakPolarHBondContact CG1-O 3.43Å; L2089-Y2120 HydrophobicContact CD2-CD2 3.85Å; L2089-Y2120 HydrophobicContact CD2-CE2 4.46Å; L2089-Y2120 HydrophobicContact CD2-CG 4.17Å
2090	K	81	Confident	85.6	Confident	135 Å²	135	45 Å²	45	59%	0.587	25%	0.253	S	S	*	.			trans	-82.6	157.3	171.5	-62.8	-168.7	-176.8	-170.7	0	111.5	K2153 E2188	K2090-K2153 PolarHBondContact O-N 2.65Å; K2090-E2188 IonicContact NZ-OE1 3.51Å; K2090-E2188 PolarHBondContact NZ-OE1 3.48Å
2091	E	81.8	Confident	85.4	Confident	85 Å²	85	43.5 Å²	43.5	40%	0.397	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	154.3	160.1	-67.8	-160.8	149.9	0	0	111.6	R2072 S2150 I2151 L2152	R2072-E2091 IonicContact CZ-OE1 3.94Å; R2072-E2091 IonicContact NH2-OE1 3.85Å; R2072-E2091 PolarHBondContact NH2-OE1 2.79Å; E2091-S2150 VanDerWaalsContact CD-CB 3.49Å; E2091-S2150 WeakPolarHBondContact OE1-CB 3.45Å; E2091-S2150 WeakPolarHBondContact OE2-CA 3.48Å; E2091-S2150 WeakPolarHBondContact OE2-CB 3.35Å; E2091-S2150 PolarHBondContact OE2-OG 2.96Å; E2091-I2151 CarbonylContact C-O 3.58Å; E2091-I2151 WeakPolarHBondContact CA-O 3.46Å; E2091-L2152 HydrophobicContact CG-CD2 4.05Å
2092	T	82.7	Confident	85.2	Confident	13 Å²	13	48.8 Å²	48.8	8%	0.08	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	174.6	172.9	-167	0	0	0	0	109.3	S2150 I2151 K2153 E2182	T2092-S2150 PolarHBondContact O-N 3.12Å; T2092-I2151 HydrophobicContact CG2-CG2 4.01Å; T2092-I2151 PolarHBondContact N-O 3.35Å; T2092-I2151 PolarHBondContact O-N 2.99Å; T2092-I2151 VanDerWaalsContact O-N 3.1Å; T2092-K2153 HydrophobicContact CG2-CB 4.23Å; T2092-K2153 HydrophobicContact CG2-CG 4.47Å; T2092-E2182 WeakPolarHBondContact OG1-CG 3.29Å; T2092-E2182 PolarHBondContact OG1-OE1 2.98Å
2093	C	84.2	Confident	84.8	Confident	50 Å²	50	50 Å²	50	34%	0.338	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.6	173.5	-72.9	0	0	0	0	110	V2183	C2093-V2183 HydrophobicContact CB-CB 3.98Å; C2093-V2183 HydrophobicContact CB-CG2 4.33Å; C2093-V2183 PolarHBondContact O-N 2.69Å
2094	L	89.2	Confident	84.3	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	135.7	176	-58.3	177.5	0	0	0	111.3	L2116 I2148 I2151 V2180 K2181 E2182 W2195	L2094-L2116 HydrophobicContact CD1-CD1 3.99Å; L2094-I2148 HydrophobicContact CB-CB 4.35Å; L2094-I2148 PolarHBondContact N-O 2.86Å; L2094-I2148 PolarHBondContact O-N 2.87Å; L2094-I2151 HydrophobicContact CD1-CD1 4.26Å; L2094-I2151 HydrophobicContact CD1-CG2 3.95Å; L2094-I2151 HydrophobicContact CG-CG2 3.86Å; L2094-V2180 HydrophobicContact CB-CG1 4.27Å; L2094-V2180 HydrophobicContact CD1-CG1 4.08Å; L2094-V2180 HydrophobicContact CD2-CG1 4.18Å; L2094-V2180 HydrophobicContact CG-CG1 4.41Å; L2094-K2181 CarbonylContact C-O 3.46Å; L2094-K2181 VanDerWaalsContact CA-O 3.28Å; L2094-K2181 WeakPolarHBondContact CA-O 3.49Å; L2094-E2182 HydrophobicContact CD2-CB 4.22Å; L2094-W2195 HydrophobicContact CD2-CZ3 4.37Å
2095	D	89.7	Confident	84.4	Confident	24 Å²	24	53.8 Å²	53.8	13%	0.128	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.5	161.5	-74.6	-48.6	0	0	0	108.8	F2097 H2145 K2147 V2180 K2181 V2183	D2095-F2097 HydrophobicContact CB-CE2 3.61Å; D2095-F2097 HydrophobicContact CB-CZ 4.05Å; D2095-H2145 VanDerWaalsContact CG-NE2 3.28Å; D2095-H2145 IonicContact OD1-CD2 2.91Å; D2095-H2145 IonicContact OD1-CE1 2.7Å; D2095-H2145 IonicContact OD1-NE2 3.23Å; D2095-H2145 PolarHBondContact OD1-NE2 2.63Å; D2095-K2147 WeakPolarHBondContact OD1-CE 3.38Å; D2095-K2147 WeakPolarHBondContact OD1-CG 3.43Å; D2095-V2180 CarbonylContact O-C 3.6Å; D2095-V2180 WeakPolarHBondContact O-CA 3.23Å; D2095-K2181 HydrophobicContact CB-CB 4.28Å; D2095-K2181 PolarHBondContact N-O 3.36Å; D2095-K2181 PolarHBondContact O-N 2.83Å; D2095-V2183 HydrophobicContact CB-CG2 4.48Å; D2095-V2183 WeakPolarHBondContact OD2-CG2 3.34Å
2096	I	93.1	Very high	84.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.9	176.3	-57.7	-177	0	0	0	109.1	V2098 V2114 L2116 H2145 F2146 I2148 L2178 E2179 V2180	I2096-V2098 HydrophobicContact CG2-CG2 4.25Å; I2096-V2114 HydrophobicContact CD1-CG1 4.17Å; I2096-L2116 HydrophobicContact CD1-CD1 4.14Å; I2096-H2145 CarbonylContact O-C 3.57Å; I2096-H2145 WeakPolarHBondContact O-CA 3.42Å; I2096-F2146 PolarHBondContact N-O 2.82Å; I2096-F2146 PolarHBondContact O-N 3.26Å; I2096-I2148 HydrophobicContact CD1-CD1 4.46Å; I2096-I2148 HydrophobicContact CD1-CG1 3.69Å; I2096-I2148 HydrophobicContact CG1-CG1 4.11Å; I2096-L2178 HydrophobicContact CG2-CD1 4.04Å; I2096-L2178 HydrophobicContact CG2-CD2 4.08Å; I2096-L2178 HydrophobicContact CG2-CG 4.05Å; I2096-E2179 CarbonylContact C-O 3.56Å; I2096-E2179 WeakPolarHBondContact CA-O 3.29Å; I2096-V2180 HydrophobicContact CG1-CG1 4.4Å; I2096-V2180 HydrophobicContact CG1-CG2 4.31Å
2097	F	93.5	Very high	85.4	Confident	33 Å²	33	43.4 Å²	43.4	15%	0.145	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127	177.3	-57.3	-97.2	0	0	0	109.3	D2095 D2144 H2145 W2177 L2178 E2179 K2181	D2095-F2097 HydrophobicContact CB-CE2 3.61Å; D2095-F2097 HydrophobicContact CB-CZ 4.05Å; F2097-D2144 CarbonylContact C-O 3.52Å; F2097-D2144 VanDerWaalsContact CA-O 3.31Å; F2097-D2144 WeakPolarHBondContact CA-O 3.22Å; F2097-H2145 HydrophobicContact CD1-CB 3.82Å; F2097-H2145 AromaticContact CD1-CG 3.93Å; F2097-H2145 HydrophobicContact CE1-CB 3.75Å; F2097-H2145 AromaticContact CE1-CD2 3.52Å; F2097-H2145 AromaticContact CE1-CG 3.4Å; F2097-H2145 AromaticContact CE1-ND1 3.8Å; F2097-H2145 AromaticContact CZ-CD2 3.52Å; F2097-H2145 AromaticContact CZ-CE1 3.98Å; F2097-H2145 AromaticContact CZ-CG 3.85Å; F2097-H2145 AromaticContact CZ-NE2 3.64Å; F2097-W2177 HydrophobicContact CB-CZ3 4.39Å; F2097-L2178 CarbonylContact O-C 3.57Å; F2097-L2178 WeakPolarHBondContact O-CA 3.33Å; F2097-E2179 HydrophobicContact CB-CB 4.35Å; F2097-E2179 PolarHBondContact N-O 3.12Å; F2097-E2179 PolarHBondContact O-N 2.89Å; F2097-K2181 HydrophobicContact CD2-CD 4.32Å; F2097-K2181 HydrophobicContact CD2-CG 4.46Å; F2097-K2181 HydrophobicContact CE2-CD 3.6Å; F2097-K2181 HydrophobicContact CE2-CG 4.04Å; F2097-K2181 HydrophobicContact CZ-CD 4.34Å
2098	V	93.6	Very high	85.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.8	179.2	-169.7	0	0	0	0	109.5	I2096 L2128 F2138 I2143 D2144 F2146 I2162 W2173 L2178	I2096-V2098 HydrophobicContact CG2-CG2 4.25Å; V2098-L2128 HydrophobicContact CG2-CD1 3.86Å; V2098-F2138 HydrophobicContact CB-CE1 4.21Å; V2098-F2138 HydrophobicContact CG1-CE1 4.15Å; V2098-F2138 HydrophobicContact CG2-CE1 4.4Å; V2098-I2143 WeakPolarHBondContact O-CA 3.42Å; V2098-D2144 PolarHBondContact N-O 2.81Å; V2098-D2144 PolarHBondContact O-N 3.5Å; V2098-F2146 HydrophobicContact CB-CE2 4.47Å; V2098-F2146 HydrophobicContact CG2-CD2 4.22Å; V2098-F2146 HydrophobicContact CG2-CE2 3.96Å; V2098-I2162 HydrophobicContact CG1-CD1 4.36Å; V2098-W2173 HydrophobicContact CG1-CH2 3.8Å; V2098-W2173 HydrophobicContact CG1-CZ2 3.69Å; V2098-L2178 HydrophobicContact CG2-CD1 3.9Å; V2098-L2178 HydrophobicContact CG2-CG 4.29Å
2099	K	93.5	Very high	85.9	Confident	20 Å²	20	42 Å²	42	9%	0.087	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.7	176.1	175.3	70.7	-169.7	173.5	0	110.8	N2141 S2142 I2143 E2176 W2177	K2099-N2141 PolarHBondContact NZ-O 3.01Å; K2099-N2141 PolarHBondContact NZ-OD1 3.23Å; K2099-S2142 WeakPolarHBondContact CD-O 3.29Å; K2099-I2143 HydrophobicContact CD-CD1 4.19Å; K2099-I2143 HydrophobicContact CD-CG1 3.53Å; K2099-E2176 HydrophobicContact CB-CB 4.15Å; K2099-E2176 WeakPolarHBondContact CE-OE2 3.25Å; K2099-E2176 HydrophobicContact CG-CB 3.59Å; K2099-E2176 HydrophobicContact CG-CG 4.16Å; K2099-E2176 WeakPolarHBondContact CG-OE2 3.26Å; K2099-E2176 PolarHBondContact O-N 2.76Å; K2099-W2177 HydrophobicContact CB-CD2 3.58Å; K2099-W2177 HydrophobicContact CB-CE3 4Å; K2099-W2177 HydrophobicContact CB-CG 4.08Å; K2099-W2177 HydrophobicContact CB-CH2 4.07Å; K2099-W2177 HydrophobicContact CB-CZ2 3.66Å; K2099-W2177 HydrophobicContact CB-CZ3 4.23Å; K2099-W2177 HydrophobicContact CD-CZ2 4.25Å; K2099-W2177 HydrophobicContact CG-CD2 4.32Å; K2099-W2177 HydrophobicContact CG-CZ2 3.99Å; K2099-W2177 PolarHBondContact N-O 2.86Å
2100	T	90.4	Very high	86.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.8	166.8	-49	0	0	0	0	108.9	S2106 Q2139 N2141 S2142 W2173	T2100-S2106 VanDerWaalsContact CG2-O 3.27Å; T2100-S2106 WeakPolarHBondContact CG2-O 3.28Å; T2100-Q2139 WeakPolarHBondContact CB-O 3.44Å; T2100-Q2139 VanDerWaalsContact CG2-O 3.29Å; T2100-Q2139 WeakPolarHBondContact CG2-O 3.29Å; T2100-Q2139 PolarHBondContact OG1-O 3.33Å; T2100-N2141 CarbonylContact O-C 3.14Å; T2100-N2141 VanDerWaalsContact O-CA 3.29Å; T2100-N2141 WeakPolarHBondContact O-CA 3.49Å; T2100-S2142 PolarHBondContact N-O 3.21Å; T2100-S2142 PolarHBondContact OG1-OG 2.75Å; T2100-W2173 PolarHBondContact OG1-NE1 3.49Å
2101	G	85.3	Confident	86.5	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.021	22%	0.219	C	C	.	.			trans	-72.1	163.3	-179.2	0	0	0	0	0	113.8	M2103 S2106 N2140 N2141 Y2174	G2101-M2103 PolarHBondContact O-N 3.13Å; G2101-S2106 VanDerWaalsContact O-CB 3.29Å; G2101-S2106 WeakPolarHBondContact O-CB 3.5Å; G2101-S2106 PolarHBondContact O-OG 2.99Å; G2101-N2140 PolarHBondContact O-OD1 3.42Å; G2101-N2141 PolarHBondContact O-N 2.8Å; G2101-Y2174 PolarHBondContact N-O 3.02Å
2102	N	86.2	Confident	86.9	Confident	112 Å²	112	33.4 Å²	33.4	60%	0.599	20%	0.2	S	C	*	.	S	Bend	trans	-93	42.2	-175.5	-167.9	46.3	0	0	0	113.7	N2140 N2141	N2102-N2140 WeakPolarHBondContact CA-OD1 3.48Å; N2102-N2141 HydrophobicContact CB-CB 4.02Å; N2102-N2141 WeakPolarHBondContact OD1-CB 3.31Å; N2102-N2141 PolarHBondContact OD1-ND2 3.29Å
2103	M	79.2	Confident	87.3	Confident	67 Å²	67	35.3 Å²	35.3	33%	0.33	21%	0.206	S	C	.	.	S	Bend	trans	-105.4	155.6	-179.5	-72.2	-159.7	-67.8	0	0	112	G2101 A2105 S2106 N2140 Y2174 W2202	G2101-M2103 PolarHBondContact O-N 3.13Å; M2103-A2105 PolarHBondContact O-N 3.42Å; M2103-S2106 VanDerWaalsContact O-CB 3.24Å; M2103-S2106 WeakPolarHBondContact O-CB 3.45Å; M2103-S2106 PolarHBondContact O-N 2.86Å; M2103-S2106 VanDerWaalsContact O-N 3.14Å; M2103-S2106 PolarHBondContact O-OG 2.81Å; M2103-N2140 PolarHBondContact O-ND2 2.85Å; M2103-N2140 PolarHBondContact O-OD1 2.83Å; M2103-Y2174 HydrophobicContact CE-CD1 4.05Å; M2103-Y2174 HydrophobicContact CE-CD2 3.21Å; M2103-Y2174 HydrophobicContact CE-CE1 4.09Å; M2103-Y2174 HydrophobicContact CE-CE2 3.27Å; M2103-Y2174 HydrophobicContact CE-CG 3.62Å; M2103-W2202 HydrophobicContact CB-CZ2 4.34Å; M2103-W2202 HydrophobicContact CE-CZ2 3.78Å
2104	P	74.9	Confident	87.6	Confident	118 Å²	118	32.9 Å²	32.9	77%	0.766	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	135.6	173.1	-23.7	34.5	0	0	0	111	S2106 W2202	P2104-S2106 PolarHBondContact O-N 3.41Å; P2104-W2202 WeakPolarHBondContact O-CH2 3.11Å
2105	A	78.1	Confident	87.6	Confident	68 Å²	68	34 Å²	34	56%	0.562	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	22.5	-176.2	0	0	0	0	0	116.3	M2103 S2107 W2202	M2103-A2105 PolarHBondContact O-N 3.42Å; A2105-S2107 PolarHBondContact O-N 3.32Å; A2105-W2202 WeakPolarHBondContact O-CZ3 3.43Å
2106	S	82.5	Confident	87.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.			trans	-70.8	-10.1	176.5	65.3	0	0	0	0	115.3	T2100 G2101 M2103 P2104 N2140 W2173 Y2174	T2100-S2106 VanDerWaalsContact CG2-O 3.27Å; T2100-S2106 WeakPolarHBondContact CG2-O 3.28Å; G2101-S2106 VanDerWaalsContact O-CB 3.29Å; G2101-S2106 WeakPolarHBondContact O-CB 3.5Å; G2101-S2106 PolarHBondContact O-OG 2.99Å; M2103-S2106 VanDerWaalsContact O-CB 3.24Å; M2103-S2106 WeakPolarHBondContact O-CB 3.45Å; M2103-S2106 PolarHBondContact O-N 2.86Å; M2103-S2106 VanDerWaalsContact O-N 3.14Å; M2103-S2106 PolarHBondContact O-OG 2.81Å; P2104-S2106 PolarHBondContact O-N 3.41Å; S2106-N2140 PolarHBondContact OG-ND2 2.79Å; S2106-N2140 PolarHBondContact OG-OD1 2.92Å; S2106-W2173 WeakPolarHBondContact O-CA 3.1Å; S2106-Y2174 PolarHBondContact O-N 3.14Å
2107	S	86.7	Confident	87.1	Confident	45 Å²	45	34.1 Å²	34.1	32%	0.315	19%	0.194	S	C	.	.			trans	-95.7	135	-172.3	56.8	0	0	0	0	112.4	A2105 F2138 N2172	A2105-S2107 PolarHBondContact O-N 3.32Å; S2107-F2138 VanDerWaalsContact CA-O 3.26Å; S2107-F2138 WeakPolarHBondContact CA-O 3.29Å; S2107-F2138 WeakPolarHBondContact CB-O 3.4Å; S2107-N2172 CarbonylContact C-O 3.6Å
2108	T	87.7	Confident	86.4	Confident	12 Å²	12	33.1 Å²	33.1	7%	0.074	19%	0.193	C	C	.	.			trans	-114.3	146.1	-176.7	-169.1	0	0	0	0	113.7	A2110 V2112 F2138 S2170 P2171 N2172 W2173	T2108-A2110 WeakPolarHBondContact OG1-CB 3.41Å; T2108-A2110 PolarHBondContact OG1-N 2.8Å; T2108-A2110 VanDerWaalsContact OG1-N 3.1Å; T2108-V2112 HydrophobicContact CG2-CG2 3.92Å; T2108-F2138 HydrophobicContact CG2-CB 3.8Å; T2108-F2138 HydrophobicContact CG2-CD2 4.48Å; T2108-F2138 HydrophobicContact CG2-CG 4.31Å; T2108-F2138 PolarHBondContact N-O 2.94Å; T2108-S2170 WeakPolarHBondContact CA-O 3.24Å; T2108-P2171 WeakPolarHBondContact CB-O 3.3Å; T2108-P2171 VanDerWaalsContact OG1-C 3.24Å; T2108-P2171 WeakPolarHBondContact OG1-CA 3.14Å; T2108-P2171 PolarHBondContact OG1-O 2.8Å; T2108-N2172 WeakPolarHBondContact CB-O 3.4Å; T2108-W2173 HydrophobicContact CG2-CB 3.94Å; T2108-W2173 VanDerWaalsContact CG2-CD1 3.5Å; T2108-W2173 HydrophobicContact CG2-CD2 4.12Å; T2108-W2173 HydrophobicContact CG2-CG 3.6Å
2109	D	87.4	Confident	85.2	Confident	76 Å²	76	34.3 Å²	34.3	41%	0.406	20%	0.199	S	C	.	.			trans	-102.3	3.5	165.4	69.3	-16.8	0	0	0	114	G2168 S2169 S2170	D2109-G2168 VanDerWaalsContact OD1-CA 3.29Å; D2109-G2168 WeakPolarHBondContact OD1-CA 3.1Å; D2109-S2169 PolarHBondContact OD1-N 2.86Å; D2109-S2169 PolarHBondContact OD2-N 3.14Å; D2109-S2169 PolarHBondContact OD2-OG 3.17Å; D2109-S2170 PolarHBondContact N-O 3.19Å; D2109-S2170 WeakPolarHBondContact OD1-CA 3.28Å; D2109-S2170 PolarHBondContact OD1-N 2.76Å; D2109-S2170 VanDerWaalsContact OD1-O 3.11Å; D2109-S2170 PolarHBondContact OD2-N 3.01Å
2110	A	88	Confident	84.2	Confident	6 Å²	6	37 Å²	37	5%	0.05	21%	0.209	C	C	.	.	S	Bend	trans	-75.4	159.8	177.8	0	0	0	0	0	113.3	T2108 V2112 H2164 K2167 P2171	T2108-A2110 WeakPolarHBondContact OG1-CB 3.41Å; T2108-A2110 PolarHBondContact OG1-N 2.8Å; T2108-A2110 VanDerWaalsContact OG1-N 3.1Å; A2110-V2112 PolarHBondContact O-N 2.81Å; A2110-H2164 HydrophobicContact CB-CB 4.05Å; A2110-K2167 WeakPolarHBondContact CA-O 3.27Å; A2110-P2171 HydrophobicContact CB-CB 4.12Å
2111	N	88.1	Confident	83.5	Confident	47 Å²	47	37.3 Å²	37.3	25%	0.251	21%	0.213	S	C	.	.			trans	-74.6	115.4	175.8	-61.9	-81.2	0	0	0	109.3	Y2113 L2127 H2164 D2165	N2111-Y2113 HydrophobicContact CB-CE2 3.74Å; N2111-Y2113 WeakPolarHBondContact O-CD2 3.49Å; N2111-Y2113 WeakPolarHBondContact O-CE2 3.34Å; N2111-L2127 HydrophobicContact CB-CD1 3.93Å; N2111-H2164 WeakPolarHBondContact O-CA 3.37Å; N2111-H2164 WeakPolarHBondContact O-CB 3.47Å; N2111-D2165 PolarHBondContact N-OD1 2.84Å; N2111-D2165 PolarHBondContact ND2-OD2 2.82Å; N2111-D2165 PolarHBondContact O-N 2.83Å; N2111-D2165 VanDerWaalsContact O-N 3.17Å
2112	V	90.1	Very high	83.5	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	136.1	178.7	-179.3	0	0	0	0	111.1	T2108 A2110 L2128 F2138 I2162 W2163 H2164 W2173	T2108-V2112 HydrophobicContact CG2-CG2 3.92Å; A2110-V2112 PolarHBondContact O-N 2.81Å; V2112-L2128 HydrophobicContact CG1-CD1 4.49Å; V2112-L2128 PolarHBondContact O-N 3.12Å; V2112-F2138 HydrophobicContact CB-CD2 4.22Å; V2112-F2138 HydrophobicContact CB-CE1 4.28Å; V2112-F2138 HydrophobicContact CB-CE2 3.59Å; V2112-F2138 HydrophobicContact CB-CZ 3.62Å; V2112-F2138 HydrophobicContact CG1-CE1 4.24Å; V2112-F2138 HydrophobicContact CG1-CE2 4.42Å; V2112-F2138 HydrophobicContact CG1-CZ 3.96Å; V2112-F2138 HydrophobicContact CG2-CD1 4.38Å; V2112-F2138 HydrophobicContact CG2-CD2 3.64Å; V2112-F2138 HydrophobicContact CG2-CE1 4.3Å; V2112-F2138 HydrophobicContact CG2-CE2 3.56Å; V2112-F2138 HydrophobicContact CG2-CG 4.07Å; V2112-F2138 HydrophobicContact CG2-CZ 3.9Å; V2112-I2162 HydrophobicContact CG1-CG1 4.25Å; V2112-W2163 WeakPolarHBondContact CA-O 3.26Å; V2112-H2164 HydrophobicContact CG2-CB 4.34Å; V2112-W2173 HydrophobicContact CG1-CH2 3.75Å; V2112-W2173 HydrophobicContact CG1-CZ3 3.78Å; V2112-W2173 HydrophobicContact CG2-CE3 4.46Å; V2112-W2173 HydrophobicContact CG2-CZ3 4.39Å
2113	Y	91.5	Very high	83.5	Confident	52 Å²	52	32.6 Å²	32.6	20%	0.204	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.8	-178.1	-61.4	-100.4	0	0	0	110.8	N2111 I2126 L2127 I2162 W2163 D2165	N2111-Y2113 HydrophobicContact CB-CE2 3.74Å; N2111-Y2113 WeakPolarHBondContact O-CD2 3.49Å; N2111-Y2113 WeakPolarHBondContact O-CE2 3.34Å; Y2113-I2126 CarbonylContact C-O 3.52Å; Y2113-I2126 VanDerWaalsContact CA-O 3.32Å; Y2113-I2126 WeakPolarHBondContact CA-O 3.28Å; Y2113-L2127 HydrophobicContact CD1-CB 4.12Å; Y2113-L2127 HydrophobicContact CD1-CD1 4.28Å; Y2113-L2127 HydrophobicContact CE1-CB 4.02Å; Y2113-L2127 HydrophobicContact CE1-CD1 3.92Å; Y2113-L2127 HydrophobicContact CE1-CG 4.42Å; Y2113-L2127 HydrophobicContact CE2-CD1 4.29Å; Y2113-I2162 WeakPolarHBondContact O-CA 3.32Å; Y2113-I2162 WeakPolarHBondContact O-CG1 3.12Å; Y2113-W2163 VanDerWaalsContact CB-CZ2 3.45Å; Y2113-W2163 HydrophobicContact CD1-CZ2 4.34Å; Y2113-W2163 AromaticContact CD2-NE1 3.85Å; Y2113-W2163 AromaticContact CG-CE2 3.9Å; Y2113-W2163 HydrophobicContact CG-CZ2 4.03Å; Y2113-W2163 AromaticContact CG-NE1 3.85Å; Y2113-W2163 PolarHBondContact N-O 3.26Å; Y2113-W2163 PolarHBondContact O-N 2.67Å; Y2113-W2163 VanDerWaalsContact O-N 3.07Å; Y2113-D2165 HydrophobicContact CE2-CB 4.17Å
2114	V	91.7	Very high	83.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	147.1	174.9	71.5	0	0	0	0	111.4	I2096 L2116 I2126 L2128 C2160 R2161 I2162 L2178	I2096-V2114 HydrophobicContact CD1-CG1 4.17Å; V2114-L2116 HydrophobicContact CG2-CD2 4.03Å; V2114-I2126 HydrophobicContact CG1-CB 3.85Å; V2114-I2126 HydrophobicContact CG1-CG2 4.23Å; V2114-I2126 PolarHBondContact N-O 3.4Å; V2114-I2126 PolarHBondContact O-N 3.49Å; V2114-L2128 HydrophobicContact CB-CD1 4.11Å; V2114-L2128 HydrophobicContact CG1-CD1 3.9Å; V2114-L2128 HydrophobicContact CG1-CD2 3.93Å; V2114-L2128 HydrophobicContact CG1-CG 3.97Å; V2114-C2160 VanDerWaalsContact CG2-SG 3.51Å; V2114-R2161 CarbonylContact C-O 3.49Å; V2114-R2161 VanDerWaalsContact CA-O 3.31Å; V2114-R2161 WeakPolarHBondContact CA-O 3.4Å; V2114-R2161 VanDerWaalsContact CG2-O 3.31Å; V2114-R2161 WeakPolarHBondContact CG2-O 3.36Å; V2114-I2162 HydrophobicContact CB-CG1 4.49Å; V2114-L2178 HydrophobicContact CB-CD1 4.48Å; V2114-L2178 HydrophobicContact CG2-CD1 3.7Å
2115	Q	89.6	Confident	83.9	Confident	30 Å²	30	29.5 Å²	29.5	14%	0.14	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	126.7	169	-175.4	178.9	25.7	0	0	109.6	F2117 D2122 R2161 W2163	Q2115-F2117 HydrophobicContact CB-CE2 4.12Å; Q2115-F2117 HydrophobicContact CB-CZ 4.41Å; Q2115-F2117 HydrophobicContact CG-CD2 4.45Å; Q2115-F2117 HydrophobicContact CG-CE1 4.36Å; Q2115-F2117 HydrophobicContact CG-CE2 3.76Å; Q2115-F2117 HydrophobicContact CG-CZ 3.71Å; Q2115-F2117 VanDerWaalsContact OE1-CZ 3.29Å; Q2115-D2122 HydrophobicContact CG-CB 4.44Å; Q2115-D2122 PolarHBondContact NE2-OD1 3.17Å; Q2115-R2161 HydrophobicContact CB-CB 4.29Å; Q2115-R2161 PolarHBondContact N-O 2.78Å; Q2115-R2161 PolarHBondContact O-N 3.41Å; Q2115-W2163 HydrophobicContact CB-CH2 4.21Å; Q2115-W2163 HydrophobicContact CB-CZ3 3.96Å
2116	L	89.3	Confident	84.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.1	-178.2	-54.4	178.4	0	0	0	109.3	L2094 I2096 V2114 D2122 S2123 L2154 L2157 C2160 V2180	L2094-L2116 HydrophobicContact CD1-CD1 3.99Å; I2096-L2116 HydrophobicContact CD1-CD1 4.14Å; V2114-L2116 HydrophobicContact CG2-CD2 4.03Å; L2116-D2122 CarbonylContact O-C 3.45Å; L2116-D2122 WeakPolarHBondContact O-CA 3.42Å; L2116-D2122 WeakPolarHBondContact O-CB 3.43Å; L2116-S2123 PolarHBondContact N-OG 3.34Å; L2116-S2123 PolarHBondContact O-N 2.91Å; L2116-L2154 HydrophobicContact CB-CD1 4.27Å; L2116-L2157 HydrophobicContact CB-CD1 4.2Å; L2116-L2157 HydrophobicContact CB-CD2 4.17Å; L2116-L2157 HydrophobicContact CD1-CD1 4.06Å; L2116-L2157 HydrophobicContact CD2-CD1 4.49Å; L2116-L2157 HydrophobicContact CG-CD1 4.49Å; L2116-C2160 HydrophobicContact CD2-CB 4.32Å; L2116-V2180 HydrophobicContact CD1-CG1 4.01Å; L2116-V2180 HydrophobicContact CD1-CG2 3.89Å; L2116-V2180 HydrophobicContact CD2-CG2 3.8Å
2117	F	82	Confident	84.7	Confident	27 Å²	27	30.9 Å²	30.9	12%	0.118	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.1	-178.6	-60.2	-100	0	0	0	110.4	Q2115 D2122 L2157 A2158 R2159 R2161	Q2115-F2117 HydrophobicContact CB-CE2 4.12Å; Q2115-F2117 HydrophobicContact CB-CZ 4.41Å; Q2115-F2117 HydrophobicContact CG-CD2 4.45Å; Q2115-F2117 HydrophobicContact CG-CE1 4.36Å; Q2115-F2117 HydrophobicContact CG-CE2 3.76Å; Q2115-F2117 HydrophobicContact CG-CZ 3.71Å; Q2115-F2117 VanDerWaalsContact OE1-CZ 3.29Å; F2117-D2122 HydrophobicContact CD1-CB 3.52Å; F2117-D2122 HydrophobicContact CE1-CB 3.85Å; F2117-D2122 HydrophobicContact CG-CB 4.1Å; F2117-L2157 CarbonylContact O-C 3.5Å; F2117-L2157 VanDerWaalsContact O-CA 3.29Å; F2117-L2157 WeakPolarHBondContact O-CA 3.33Å; F2117-A2158 PolarHBondContact O-N 2.99Å; F2117-R2159 HydrophobicContact CB-CG 3.66Å; F2117-R2159 HydrophobicContact CD2-CG 3.7Å; F2117-R2159 VanDerWaalsContact CE1-NH2 3.27Å; F2117-R2159 HydrophobicContact CG-CG 3.85Å; F2117-R2159 PolarHBondContact N-O 2.93Å; F2117-R2159 PolarHBondContact O-N 3.1Å; F2117-R2161 HydrophobicContact CE2-CB 3.87Å
2118	G	77.8	Confident	84.8	Confident	12 Å²	12	28.9 Å²	28.9	12%	0.124	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	-176.1	179.6	0	0	0	0	0	115.7	Y2120 G2121 L2154 N2156	G2118-Y2120 PolarHBondContact O-N 2.93Å; G2118-Y2120 VanDerWaalsContact O-N 3.11Å; G2118-G2121 PolarHBondContact N-O 2.91Å; G2118-G2121 PolarHBondContact O-N 3.29Å; G2118-L2154 CarbonylContact C-O 3.55Å; G2118-N2156 CarbonylContact C-O 3.49Å; G2118-N2156 WeakPolarHBondContact CA-O 3.31Å
2119	E	69.1	Low	84.5	Confident	25 Å²	25	34.8 Å²	34.8	12%	0.117	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-25.4	-176.4	-167.9	174	-165.6	0	0	114.7	L2154 N2156 Y2397	E2119-L2154 PolarHBondContact N-O 3.12Å; E2119-L2154 VanDerWaalsContact N-O 3.14Å; E2119-N2156 PolarHBondContact N-O 2.85Å; E2119-N2156 PolarHBondContact OE2-N 3.36Å; E2119-N2156 VanDerWaalsContact OE2-N 3.12Å; E2119-N2156 PolarHBondContact OE2-ND2 3.32Å; E2119-Y2397 WeakPolarHBondContact O-CD1 3.47Å
2120	Y	73.1	Confident	84.1	Confident	76 Å²	76	39.5 Å²	39.5	30%	0.298	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	22.5	175.9	-49.2	-43	0	0	0	113.5	L2026 L2089 G2118 L2154 G2155	L2026-Y2120 HydrophobicContact CD1-CD1 4.03Å; L2026-Y2120 HydrophobicContact CD1-CG 4.46Å; L2089-Y2120 HydrophobicContact CD2-CD2 3.85Å; L2089-Y2120 HydrophobicContact CD2-CE2 4.46Å; L2089-Y2120 HydrophobicContact CD2-CG 4.17Å; G2118-Y2120 PolarHBondContact O-N 2.93Å; G2118-Y2120 VanDerWaalsContact O-N 3.11Å; Y2120-L2154 PolarHBondContact N-O 3.37Å; Y2120-G2155 VanDerWaalsContact CD2-N 3.34Å
2121	G	75.7	Confident	83.6	Confident	8 Å²	8	40.5 Å²	40.5	8%	0.082	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	109.3	-167.4	178.1	0	0	0	0	0	114.3	G2118	G2118-G2121 PolarHBondContact N-O 2.91Å; G2118-G2121 PolarHBondContact O-N 3.29Å
2122	D	84.1	Confident	83.2	Confident	11 Å²	11	42.9 Å²	42.9	6%	0.059	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	162.2	-175.9	76.6	89.5	0	0	0	113.5	F1989 K2027 R2029 Q2115 L2116 F2117 G2124	F1989-D2122 VanDerWaalsContact CE1-OD2 3.25Å; F1989-D2122 WeakPolarHBondContact CE1-OD2 3.29Å; F1989-D2122 VanDerWaalsContact CZ-OD2 3.29Å; F1989-D2122 WeakPolarHBondContact CZ-OD2 3.32Å; K2027-D2122 PolarHBondContact NZ-O 3.49Å; R2029-D2122 IonicContact CZ-OD1 2.88Å; R2029-D2122 IonicContact NH1-OD1 2.83Å; R2029-D2122 PolarHBondContact NH1-OD1 3.04Å; R2029-D2122 IonicContact NH1-OD2 3.28Å; R2029-D2122 PolarHBondContact NH1-OD2 3.06Å; R2029-D2122 PolarHBondContact NH2-O 3.23Å; R2029-D2122 IonicContact NH2-OD1 3.93Å; R2029-D2122 PolarHBondContact NH2-OD1 2.87Å; Q2115-D2122 HydrophobicContact CG-CB 4.44Å; Q2115-D2122 PolarHBondContact NE2-OD1 3.17Å; L2116-D2122 CarbonylContact O-C 3.45Å; L2116-D2122 WeakPolarHBondContact O-CA 3.42Å; L2116-D2122 WeakPolarHBondContact O-CB 3.43Å; F2117-D2122 HydrophobicContact CD1-CB 3.52Å; F2117-D2122 HydrophobicContact CE1-CB 3.85Å; F2117-D2122 HydrophobicContact CG-CB 4.1Å; D2122-G2124 PolarHBondContact O-N 2.66Å; D2122-G2124 WeakPolarHBondContact OD1-CA 3.33Å; D2122-G2124 PolarHBondContact OD1-N 2.9Å
2123	S	86.4	Confident	82.7	Confident	4 Å²	4	45.7 Å²	45.7	3%	0.028	23%	0.231	C	C	.	.			trans	-73.7	-16	-177.1	60.7	0	0	0	0	116.1	L2116	L2116-S2123 PolarHBondContact N-OG 3.34Å; L2116-S2123 PolarHBondContact O-N 2.91Å
2124	G	79.6	Confident	81.9	Confident	3 Å²	3	46.3 Å²	46.3	3%	0.031	24%	0.238	C	C	.	.			trans	70.7	-179.7	-156.3	0	0	0	0	0	111.9	R2029 D2122 I2126	R2029-G2124 VanDerWaalsContact NH2-N 3.12Å; D2122-G2124 PolarHBondContact O-N 2.66Å; D2122-G2124 WeakPolarHBondContact OD1-CA 3.33Å; D2122-G2124 PolarHBondContact OD1-N 2.9Å; G2124-I2126 PolarHBondContact O-N 3.39Å
2125	E	82.9	Confident	81	Confident	116 Å²	116	56.1 Å²	56.1	54%	0.542	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-78.2	116.1	-178	-49.6	-170.2	159	0	0	110.8	W2163	E2125-W2163 HydrophobicContact CB-CH2 3.91Å; E2125-W2163 HydrophobicContact CB-CZ2 4.03Å; E2125-W2163 HydrophobicContact CG-CH2 3.76Å; E2125-W2163 HydrophobicContact CG-CZ2 3.85Å
2126	I	88.6	Confident	80.6	Confident	20 Å²	20	61.6 Å²	61.6	10%	0.103	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118	178.1	-60.5	172.3	0	0	0	109	Y2113 V2114 G2124 L2128 I2148 I2151	Y2113-I2126 CarbonylContact C-O 3.52Å; Y2113-I2126 VanDerWaalsContact CA-O 3.32Å; Y2113-I2126 WeakPolarHBondContact CA-O 3.28Å; V2114-I2126 HydrophobicContact CG1-CB 3.85Å; V2114-I2126 HydrophobicContact CG1-CG2 4.23Å; V2114-I2126 PolarHBondContact N-O 3.4Å; V2114-I2126 PolarHBondContact O-N 3.49Å; G2124-I2126 PolarHBondContact O-N 3.39Å; I2126-L2128 HydrophobicContact CG2-CD2 3.95Å; I2126-I2148 HydrophobicContact CD1-CG2 4.22Å; I2126-I2148 HydrophobicContact CG2-CD1 3.54Å; I2126-I2148 HydrophobicContact CG2-CG1 4.3Å; I2126-I2151 HydrophobicContact CD1-CD1 4.42Å
2127	L	88.6	Confident	80.4	Confident	77 Å²	77	63.4 Å²	63.4	40%	0.403	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	117.2	173.5	171.6	60.5	0	0	0	110.8	N2111 Y2113 K2129	N2111-L2127 HydrophobicContact CB-CD1 3.93Å; Y2113-L2127 HydrophobicContact CD1-CB 4.12Å; Y2113-L2127 HydrophobicContact CD1-CD1 4.28Å; Y2113-L2127 HydrophobicContact CE1-CB 4.02Å; Y2113-L2127 HydrophobicContact CE1-CD1 3.92Å; Y2113-L2127 HydrophobicContact CE1-CG 4.42Å; Y2113-L2127 HydrophobicContact CE2-CD1 4.29Å; L2127-K2129 HydrophobicContact CD2-CB 4.45Å; L2127-K2129 HydrophobicContact CD2-CD 4.36Å; L2127-K2129 HydrophobicContact CG-CB 4.09Å; L2127-K2129 PolarHBondContact O-N 2.87Å
2128	L	90.4	Very high	80.8	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.016	32%	0.315	C	S	.	.			trans	-90.3	74.8	-176.4	-62.3	-178.3	0	0	0	111.4	V2098 V2112 V2114 I2126 F2138 F2146 I2148	V2098-L2128 HydrophobicContact CG2-CD1 3.86Å; V2112-L2128 HydrophobicContact CG1-CD1 4.49Å; V2112-L2128 PolarHBondContact O-N 3.12Å; V2114-L2128 HydrophobicContact CB-CD1 4.11Å; V2114-L2128 HydrophobicContact CG1-CD1 3.9Å; V2114-L2128 HydrophobicContact CG1-CD2 3.93Å; V2114-L2128 HydrophobicContact CG1-CG 3.97Å; I2126-L2128 HydrophobicContact CG2-CD2 3.95Å; L2128-F2138 HydrophobicContact CB-CZ 3.86Å; L2128-F2138 WeakPolarHBondContact O-CE2 3.33Å; L2128-F2146 VanDerWaalsContact C-CE1 3.49Å; L2128-F2146 HydrophobicContact CB-CD1 3.99Å; L2128-F2146 HydrophobicContact CB-CD2 4.33Å; L2128-F2146 HydrophobicContact CB-CE1 3.83Å; L2128-F2146 HydrophobicContact CB-CE2 4.17Å; L2128-F2146 HydrophobicContact CB-CG 4.26Å; L2128-F2146 HydrophobicContact CB-CZ 3.93Å; L2128-F2146 HydrophobicContact CD1-CD2 4.33Å; L2128-F2146 HydrophobicContact CD1-CE2 4.33Å; L2128-F2146 HydrophobicContact CD2-CB 4.03Å; L2128-F2146 HydrophobicContact CD2-CD1 4.29Å; L2128-F2146 HydrophobicContact CD2-CD2 4.14Å; L2128-F2146 HydrophobicContact CD2-CG 3.89Å; L2128-F2146 WeakPolarHBondContact O-CE1 3.32Å; L2128-I2148 HydrophobicContact CD2-CD1 4.5Å
2129	K	81.7	Confident	81.2	Confident	137 Å²	137	66.8 Å²	66.8	60%	0.596	33%	0.332	S	S	*	.			trans	-104.2	-33.1	-172.1	-169.2	163.2	-171.7	159.9	0	116.4	L2127	L2127-K2129 HydrophobicContact CD2-CB 4.45Å; L2127-K2129 HydrophobicContact CD2-CD 4.36Å; L2127-K2129 HydrophobicContact CG-CB 4.09Å; L2127-K2129 PolarHBondContact O-N 2.87Å
2130	Q	77.4	Confident	82	Confident	175 Å²	175	68.7 Å²	68.7	82%	0.818	34%	0.343	S	S	*	.			trans	-112.3	104	-179.8	-75.6	-177.5	-35.1	0	0	110.2	F2146	Q2130-F2146 VanDerWaalsContact O-CD1 3.32Å; Q2130-F2146 WeakPolarHBondContact O-CD1 3.37Å
2131	T	78.8	Confident	82.7	Confident	27 Å²	27	68.7 Å²	68.7	17%	0.166	35%	0.348	C	S	.	.			trans	-87.8	146.8	174.8	167.7	0	0	0	0	110.2	S2133 N2134 P2137 D2144 H2145	T2131-S2133 PolarHBondContact OG1-N 2.72Å; T2131-S2133 PolarHBondContact OG1-OG 2.91Å; T2131-S2133 VanDerWaalsContact OG1-OG 3.09Å; T2131-N2134 WeakPolarHBondContact CG2-O 3.41Å; T2131-P2137 HydrophobicContact CG2-CB 3.73Å; T2131-P2137 HydrophobicContact CG2-CG 4.19Å; T2131-D2144 PolarHBondContact OG1-OD1 3Å; T2131-H2145 CarbonylContact C-O 3.51Å; T2131-H2145 VanDerWaalsContact CA-O 3.29Å; T2131-H2145 WeakPolarHBondContact CA-O 3.37Å; T2131-H2145 PolarHBondContact OG1-O 3.14Å
2132	V	79.9	Confident	83.4	Confident	97 Å²	97	69 Å²	69	59%	0.588	35%	0.349	S	S	*	.	S	Bend	trans	-89.7	-17.6	177.8	-168.5	0	0	0	0	110.9	H2145	V2132-H2145 PolarHBondContact N-O 3.04Å
2133	S	77.9	Confident	83.7	Confident	60 Å²	60	72.3 Å²	72.3	42%	0.42	37%	0.366	S	S	.	.	S	Bend	trans	-101.2	-34.1	-170.6	55.8	0	0	0	0	115.3	T2131 I2143 H2145	T2131-S2133 PolarHBondContact OG1-N 2.72Å; T2131-S2133 PolarHBondContact OG1-OG 2.91Å; T2131-S2133 VanDerWaalsContact OG1-OG 3.09Å; S2133-I2143 PolarHBondContact OG-O 2.83Å; S2133-H2145 PolarHBondContact OG-N 2.83Å; S2133-H2145 VanDerWaalsContact OG-N 3.14Å
2134	N	75.4	Confident	84	Confident	65 Å²	65	72.1 Å²	72.1	35%	0.348	36%	0.364	S	S	.	.			trans	-131.3	147.9	-170.5	-56.1	-58.4	0	0	0	111.9	T2131 K2136 I2143 D2144	T2131-N2134 WeakPolarHBondContact CG2-O 3.41Å; N2134-K2136 VanDerWaalsContact C-N 3.29Å; N2134-K2136 PolarHBondContact O-N 3.15Å; N2134-I2143 PolarHBondContact ND2-O 3.07Å; N2134-D2144 PolarHBondContact ND2-OD1 3.03Å
2135	Q	73.7	Confident	84.6	Confident	206 Å²	206	73.6 Å²	73.6	96%	0.963	37%	0.37	S	S	*	.	S	Bend	trans	-71	-23	175.8	-72.7	-171.1	-6.9	0	0	113.8
2136	K	81.1	Confident	85.1	Confident	144 Å²	144	68.3 Å²	68.3	63%	0.626	35%	0.345	S	S	*	.	S	Bend	trans	-132.2	120.3	172	-70.6	-176.3	176.9	-177.1	0	107.9	N2134 Q2139	N2134-K2136 VanDerWaalsContact C-N 3.29Å; N2134-K2136 PolarHBondContact O-N 3.15Å; K2136-Q2139 HydrophobicContact CB-CG 4.24Å
2137	P	83.9	Confident	85.1	Confident	39 Å²	39	73.5 Å²	73.5	25%	0.253	37%	0.367	S	S	.	.	S	Bend	trans	-74.2	166	178	30	-33.8	0	0	0	112.5	T2131 Q2139 D2144 F2146	T2131-P2137 HydrophobicContact CG2-CB 3.73Å; T2131-P2137 HydrophobicContact CG2-CG 4.19Å; P2137-Q2139 PolarHBondContact O-N 3.26Å; P2137-D2144 WeakPolarHBondContact CA-OD1 3.45Å; P2137-F2146 HydrophobicContact CB-CZ 4.12Å
2138	F	90.5	Very high	85.1	Confident	7 Å²	7	71.2 Å²	71.2	3%	0.031	36%	0.355	C	S	.	.	S	Bend	trans	58.5	28.2	171.4	-45.2	-61.1	0	0	0	115.4	V2098 S2107 T2108 V2112 L2128 D2144 F2146 W2173	V2098-F2138 HydrophobicContact CB-CE1 4.21Å; V2098-F2138 HydrophobicContact CG1-CE1 4.15Å; V2098-F2138 HydrophobicContact CG2-CE1 4.4Å; S2107-F2138 VanDerWaalsContact CA-O 3.26Å; S2107-F2138 WeakPolarHBondContact CA-O 3.29Å; S2107-F2138 WeakPolarHBondContact CB-O 3.4Å; T2108-F2138 HydrophobicContact CG2-CB 3.8Å; T2108-F2138 HydrophobicContact CG2-CD2 4.48Å; T2108-F2138 HydrophobicContact CG2-CG 4.31Å; T2108-F2138 PolarHBondContact N-O 2.94Å; V2112-F2138 HydrophobicContact CB-CD2 4.22Å; V2112-F2138 HydrophobicContact CB-CE1 4.28Å; V2112-F2138 HydrophobicContact CB-CE2 3.59Å; V2112-F2138 HydrophobicContact CB-CZ 3.62Å; V2112-F2138 HydrophobicContact CG1-CE1 4.24Å; V2112-F2138 HydrophobicContact CG1-CE2 4.42Å; V2112-F2138 HydrophobicContact CG1-CZ 3.96Å; V2112-F2138 HydrophobicContact CG2-CD1 4.38Å; V2112-F2138 HydrophobicContact CG2-CD2 3.64Å; V2112-F2138 HydrophobicContact CG2-CE1 4.3Å; V2112-F2138 HydrophobicContact CG2-CE2 3.56Å; V2112-F2138 HydrophobicContact CG2-CG 4.07Å; V2112-F2138 HydrophobicContact CG2-CZ 3.9Å; L2128-F2138 HydrophobicContact CB-CZ 3.86Å; L2128-F2138 WeakPolarHBondContact O-CE2 3.33Å; F2138-D2144 PolarHBondContact N-OD2 3.15Å; F2138-F2146 AromaticContact CE1-CE2 3.93Å; F2138-F2146 HydrophobicContact CE1-CE2 3.93Å; F2138-F2146 AromaticContact CE1-CZ 3.79Å; F2138-F2146 HydrophobicContact CE1-CZ 3.79Å; F2138-F2146 HydrophobicContact CE2-CZ 4.11Å; F2138-F2146 HydrophobicContact CZ-CE1 4.27Å; F2138-F2146 AromaticContact CZ-CE2 3.89Å; F2138-F2146 HydrophobicContact CZ-CE2 3.89Å; F2138-F2146 AromaticContact CZ-CZ 3.37Å; F2138-F2146 HydrophobicContact CZ-CZ 3.37Å; F2138-W2173 AromaticContact CD1-CZ2 3.73Å; F2138-W2173 HydrophobicContact CD1-CZ2 3.73Å; F2138-W2173 HydrophobicContact CE1-CZ2 4.16Å; F2138-W2173 HydrophobicContact CG-CZ2 4.49Å
2139	Q	87.4	Confident	84.7	Confident	103 Å²	103	75.3 Å²	75.3	48%	0.481	38%	0.382	S	S	.	.			trans	-71	162.5	171.6	-67.6	-161	-28.6	0	0	112.2	T2100 K2136 P2137 N2141 S2142	T2100-Q2139 WeakPolarHBondContact CB-O 3.44Å; T2100-Q2139 VanDerWaalsContact CG2-O 3.29Å; T2100-Q2139 WeakPolarHBondContact CG2-O 3.29Å; T2100-Q2139 PolarHBondContact OG1-O 3.33Å; K2136-Q2139 HydrophobicContact CB-CG 4.24Å; P2137-Q2139 PolarHBondContact O-N 3.26Å; Q2139-N2141 PolarHBondContact O-N 2.92Å; Q2139-S2142 PolarHBondContact N-OG 2.67Å; Q2139-S2142 WeakPolarHBondContact O-CB 3.24Å; Q2139-S2142 PolarHBondContact O-N 2.89Å; Q2139-S2142 PolarHBondContact O-OG 2.83Å
2140	N	85.3	Confident	84.6	Confident	65 Å²	65	71 Å²	71	35%	0.348	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	131.7	-177.6	-164	-25.2	0	0	0	109.8	G2101 N2102 M2103 S2106 S2142	G2101-N2140 PolarHBondContact O-OD1 3.42Å; N2102-N2140 WeakPolarHBondContact CA-OD1 3.48Å; M2103-N2140 PolarHBondContact O-ND2 2.85Å; M2103-N2140 PolarHBondContact O-OD1 2.83Å; S2106-N2140 PolarHBondContact OG-ND2 2.79Å; S2106-N2140 PolarHBondContact OG-OD1 2.92Å; N2140-S2142 PolarHBondContact O-N 2.92Å; N2140-S2142 VanDerWaalsContact O-N 3.11Å
2141	N	88.1	Confident	85	Confident	76 Å²	76	63.5 Å²	63.5	41%	0.406	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	6.7	-175.8	-153.4	8.7	0	0	0	115.6	K2099 T2100 G2101 N2102 Q2139	K2099-N2141 PolarHBondContact NZ-O 3.01Å; K2099-N2141 PolarHBondContact NZ-OD1 3.23Å; T2100-N2141 CarbonylContact O-C 3.14Å; T2100-N2141 VanDerWaalsContact O-CA 3.29Å; T2100-N2141 WeakPolarHBondContact O-CA 3.49Å; G2101-N2141 PolarHBondContact O-N 2.8Å; N2102-N2141 HydrophobicContact CB-CB 4.02Å; N2102-N2141 WeakPolarHBondContact OD1-CB 3.31Å; N2102-N2141 PolarHBondContact OD1-ND2 3.29Å; Q2139-N2141 PolarHBondContact O-N 2.92Å
2142	S	89.2	Confident	85.5	Confident	15 Å²	15	62.5 Å²	62.5	11%	0.105	33%	0.328	C	S	.	.			trans	-66.2	152.8	-177.8	75.2	0	0	0	0	113.3	K2099 T2100 Q2139 N2140 D2144	K2099-S2142 WeakPolarHBondContact CD-O 3.29Å; T2100-S2142 PolarHBondContact N-O 3.21Å; T2100-S2142 PolarHBondContact OG1-OG 2.75Å; Q2139-S2142 PolarHBondContact N-OG 2.67Å; Q2139-S2142 WeakPolarHBondContact O-CB 3.24Å; Q2139-S2142 PolarHBondContact O-N 2.89Å; Q2139-S2142 PolarHBondContact O-OG 2.83Å; N2140-S2142 PolarHBondContact O-N 2.92Å; N2140-S2142 VanDerWaalsContact O-N 3.11Å; S2142-D2144 WeakPolarHBondContact CB-OD2 3.04Å; S2142-D2144 PolarHBondContact OG-OD2 3.03Å
2143	I	91.5	Very high	85.6	Confident	80 Å²	80	61.4 Å²	61.4	41%	0.41	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123	154.9	-63.9	173.6	0	0	0	106.7	V2098 K2099 S2133 N2134 W2177	V2098-I2143 WeakPolarHBondContact O-CA 3.42Å; K2099-I2143 HydrophobicContact CD-CD1 4.19Å; K2099-I2143 HydrophobicContact CD-CG1 3.53Å; S2133-I2143 PolarHBondContact OG-O 2.83Å; N2134-I2143 PolarHBondContact ND2-O 3.07Å; I2143-W2177 HydrophobicContact CD1-CH2 4.19Å; I2143-W2177 HydrophobicContact CD1-CZ2 4.23Å
2144	D	92.4	Very high	85.7	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.2	-177.7	-78.6	-70.7	0	0	0	111.5	F2097 V2098 T2131 N2134 P2137 F2138 S2142 F2146	F2097-D2144 CarbonylContact C-O 3.52Å; F2097-D2144 VanDerWaalsContact CA-O 3.31Å; F2097-D2144 WeakPolarHBondContact CA-O 3.22Å; V2098-D2144 PolarHBondContact N-O 2.81Å; V2098-D2144 PolarHBondContact O-N 3.5Å; T2131-D2144 PolarHBondContact OG1-OD1 3Å; N2134-D2144 PolarHBondContact ND2-OD1 3.03Å; P2137-D2144 WeakPolarHBondContact CA-OD1 3.45Å; F2138-D2144 PolarHBondContact N-OD2 3.15Å; S2142-D2144 WeakPolarHBondContact CB-OD2 3.04Å; S2142-D2144 PolarHBondContact OG-OD2 3.03Å; D2144-F2146 HydrophobicContact CB-CD2 4.47Å; D2144-F2146 HydrophobicContact CB-CE2 3.51Å; D2144-F2146 HydrophobicContact CB-CZ 3.78Å
2145	H	92.8	Very high	85.8	Confident	34 Å²	34	56.4 Å²	56.4	16%	0.157	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.9	-177.6	175.1	-157.4	0	0	0	110.6	D2095 I2096 F2097 T2131 V2132 S2133	D2095-H2145 VanDerWaalsContact CG-NE2 3.28Å; D2095-H2145 IonicContact OD1-CD2 2.91Å; D2095-H2145 IonicContact OD1-CE1 2.7Å; D2095-H2145 IonicContact OD1-NE2 3.23Å; D2095-H2145 PolarHBondContact OD1-NE2 2.63Å; I2096-H2145 CarbonylContact O-C 3.57Å; I2096-H2145 WeakPolarHBondContact O-CA 3.42Å; F2097-H2145 HydrophobicContact CD1-CB 3.82Å; F2097-H2145 AromaticContact CD1-CG 3.93Å; F2097-H2145 HydrophobicContact CE1-CB 3.75Å; F2097-H2145 AromaticContact CE1-CD2 3.52Å; F2097-H2145 AromaticContact CE1-CG 3.4Å; F2097-H2145 AromaticContact CE1-ND1 3.8Å; F2097-H2145 AromaticContact CZ-CD2 3.52Å; F2097-H2145 AromaticContact CZ-CE1 3.98Å; F2097-H2145 AromaticContact CZ-CG 3.85Å; F2097-H2145 AromaticContact CZ-NE2 3.64Å; T2131-H2145 CarbonylContact C-O 3.51Å; T2131-H2145 VanDerWaalsContact CA-O 3.29Å; T2131-H2145 WeakPolarHBondContact CA-O 3.37Å; T2131-H2145 PolarHBondContact OG1-O 3.14Å; V2132-H2145 PolarHBondContact N-O 3.04Å; S2133-H2145 PolarHBondContact OG-N 2.83Å; S2133-H2145 VanDerWaalsContact OG-N 3.14Å
2146	F	92.4	Very high	85.8	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.2	178.7	-55.4	-90.7	0	0	0	110.3	I2096 V2098 L2128 Q2130 P2137 F2138 D2144	I2096-F2146 PolarHBondContact N-O 2.82Å; I2096-F2146 PolarHBondContact O-N 3.26Å; V2098-F2146 HydrophobicContact CB-CE2 4.47Å; V2098-F2146 HydrophobicContact CG2-CD2 4.22Å; V2098-F2146 HydrophobicContact CG2-CE2 3.96Å; L2128-F2146 VanDerWaalsContact C-CE1 3.49Å; L2128-F2146 HydrophobicContact CB-CD1 3.99Å; L2128-F2146 HydrophobicContact CB-CD2 4.33Å; L2128-F2146 HydrophobicContact CB-CE1 3.83Å; L2128-F2146 HydrophobicContact CB-CE2 4.17Å; L2128-F2146 HydrophobicContact CB-CG 4.26Å; L2128-F2146 HydrophobicContact CB-CZ 3.93Å; L2128-F2146 HydrophobicContact CD1-CD2 4.33Å; L2128-F2146 HydrophobicContact CD1-CE2 4.33Å; L2128-F2146 HydrophobicContact CD2-CB 4.03Å; L2128-F2146 HydrophobicContact CD2-CD1 4.29Å; L2128-F2146 HydrophobicContact CD2-CD2 4.14Å; L2128-F2146 HydrophobicContact CD2-CG 3.89Å; L2128-F2146 WeakPolarHBondContact O-CE1 3.32Å; Q2130-F2146 VanDerWaalsContact O-CD1 3.32Å; Q2130-F2146 WeakPolarHBondContact O-CD1 3.37Å; P2137-F2146 HydrophobicContact CB-CZ 4.12Å; F2138-F2146 AromaticContact CE1-CE2 3.93Å; F2138-F2146 HydrophobicContact CE1-CE2 3.93Å; F2138-F2146 AromaticContact CE1-CZ 3.79Å; F2138-F2146 HydrophobicContact CE1-CZ 3.79Å; F2138-F2146 HydrophobicContact CE2-CZ 4.11Å; F2138-F2146 HydrophobicContact CZ-CE1 4.27Å; F2138-F2146 AromaticContact CZ-CE2 3.89Å; F2138-F2146 HydrophobicContact CZ-CE2 3.89Å; F2138-F2146 AromaticContact CZ-CZ 3.37Å; F2138-F2146 HydrophobicContact CZ-CZ 3.37Å; D2144-F2146 HydrophobicContact CB-CD2 4.47Å; D2144-F2146 HydrophobicContact CB-CE2 3.51Å; D2144-F2146 HydrophobicContact CB-CZ 3.78Å
2147	K	88.2	Confident	85.9	Confident	129 Å²	129	41 Å²	41	56%	0.561	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	125.8	173.6	-97.1	-174.5	173.5	-177.4	0	111.7	D2095 P2149	D2095-K2147 WeakPolarHBondContact OD1-CE 3.38Å; D2095-K2147 WeakPolarHBondContact OD1-CG 3.43Å; K2147-P2149 WeakPolarHBondContact O-CD 3.38Å
2148	I	88.4	Confident	85.4	Confident	29 Å²	29	39.3 Å²	39.3	15%	0.149	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	94.9	178.3	-49.1	-55.5	0	0	0	108.8	L2094 I2096 I2126 L2128 I2151	L2094-I2148 HydrophobicContact CB-CB 4.35Å; L2094-I2148 PolarHBondContact N-O 2.86Å; L2094-I2148 PolarHBondContact O-N 2.87Å; I2096-I2148 HydrophobicContact CD1-CD1 4.46Å; I2096-I2148 HydrophobicContact CD1-CG1 3.69Å; I2096-I2148 HydrophobicContact CG1-CG1 4.11Å; I2126-I2148 HydrophobicContact CD1-CG2 4.22Å; I2126-I2148 HydrophobicContact CG2-CD1 3.54Å; I2126-I2148 HydrophobicContact CG2-CG1 4.3Å; L2128-I2148 HydrophobicContact CD2-CD1 4.5Å; I2148-I2151 HydrophobicContact CG2-CB 4.48Å
2149	P	82.6	Confident	85	Confident	89 Å²	89	39.3 Å²	39.3	58%	0.578	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	156.9	178.3	33.4	-35.3	0	0	0	112.4	K2147 I2151	K2147-P2149 WeakPolarHBondContact O-CD 3.38Å; P2149-I2151 PolarHBondContact O-N 2.89Å
2150	S	80.2	Confident	85	Confident	46 Å²	46	34.4 Å²	34.4	32%	0.322	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.6	48.5	168.5	-76.8	0	0	0	0	114.7	R2072 E2091 T2092	R2072-S2150 PolarHBondContact NH1-O 2.89Å; R2072-S2150 PolarHBondContact NH2-O 2.95Å; E2091-S2150 VanDerWaalsContact CD-CB 3.49Å; E2091-S2150 WeakPolarHBondContact OE1-CB 3.45Å; E2091-S2150 WeakPolarHBondContact OE2-CA 3.48Å; E2091-S2150 WeakPolarHBondContact OE2-CB 3.35Å; E2091-S2150 PolarHBondContact OE2-OG 2.96Å; T2092-S2150 PolarHBondContact O-N 3.12Å
2151	I	85.7	Confident	85	Confident	19 Å²	19	31.7 Å²	31.7	10%	0.097	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	140.9	169.5	-170	170.4	0	0	0	109.5	E2091 T2092 L2094 I2126 I2148 P2149 L2154	E2091-I2151 CarbonylContact C-O 3.58Å; E2091-I2151 WeakPolarHBondContact CA-O 3.46Å; T2092-I2151 HydrophobicContact CG2-CG2 4.01Å; T2092-I2151 PolarHBondContact N-O 3.35Å; T2092-I2151 PolarHBondContact O-N 2.99Å; T2092-I2151 VanDerWaalsContact O-N 3.1Å; L2094-I2151 HydrophobicContact CD1-CD1 4.26Å; L2094-I2151 HydrophobicContact CD1-CG2 3.95Å; L2094-I2151 HydrophobicContact CG-CG2 3.86Å; I2126-I2151 HydrophobicContact CD1-CD1 4.42Å; I2148-I2151 HydrophobicContact CG2-CB 4.48Å; P2149-I2151 PolarHBondContact O-N 2.89Å; I2151-L2154 HydrophobicContact CD1-CD1 4.22Å
2152	L	87.9	Confident	85.1	Confident	6 Å²	6	28 Å²	28	3%	0.031	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	137.6	174.5	-65.4	178.8	0	0	0	110.6	K2027 D2078 P2080 E2091 L2154	K2027-L2152 HydrophobicContact CB-CD1 3.77Å; K2027-L2152 HydrophobicContact CD-CB 4.46Å; K2027-L2152 HydrophobicContact CD-CD1 4.01Å; D2078-L2152 HydrophobicContact CB-CD1 4.13Å; P2080-L2152 HydrophobicContact CB-CD1 4.06Å; P2080-L2152 HydrophobicContact CB-CD2 3.89Å; P2080-L2152 HydrophobicContact CG-CD2 4.11Å; E2091-L2152 HydrophobicContact CG-CD2 4.05Å; L2152-L2154 PolarHBondContact O-N 3.19Å; L2152-L2154 VanDerWaalsContact O-N 3.12Å
2153	K	82.9	Confident	85.1	Confident	73 Å²	73	29.2 Å²	29.2	32%	0.317	15%	0.151	S	C	.	.			trans	-59.1	115.5	-176	-168.1	171.9	-177.6	108.8	0	111.1	K2090 T2092 G2155 E2182	K2090-K2153 PolarHBondContact O-N 2.65Å; T2092-K2153 HydrophobicContact CG2-CB 4.23Å; T2092-K2153 HydrophobicContact CG2-CG 4.47Å; K2153-G2155 VanDerWaalsContact C-N 3.33Å; K2153-G2155 PolarHBondContact O-N 3.11Å; K2153-E2182 IonicContact NZ-OE1 2.71Å; K2153-E2182 PolarHBondContact NZ-OE1 2.87Å; K2153-E2182 IonicContact NZ-OE2 3.26Å; K2153-E2182 PolarHBondContact NZ-OE2 3.03Å
2154	L	80.7	Confident	85	Confident	10 Å²	10	25.6 Å²	25.6	5%	0.052	13%	0.133	C	C	.	.			trans	-84.4	-0.9	-174.8	-58.6	179.3	0	0	0	114.4	L2116 G2118 E2119 Y2120 I2151 L2152 L2157	L2116-L2154 HydrophobicContact CB-CD1 4.27Å; G2118-L2154 CarbonylContact C-O 3.55Å; E2119-L2154 PolarHBondContact N-O 3.12Å; E2119-L2154 VanDerWaalsContact N-O 3.14Å; Y2120-L2154 PolarHBondContact N-O 3.37Å; I2151-L2154 HydrophobicContact CD1-CD1 4.22Å; L2152-L2154 PolarHBondContact O-N 3.19Å; L2152-L2154 VanDerWaalsContact O-N 3.12Å; L2154-L2157 HydrophobicContact CB-CD2 3.91Å; L2154-L2157 HydrophobicContact CD1-CD2 4.01Å
2155	G	77	Confident	84.5	Confident	10 Å²	10	27.4 Å²	27.4	10%	0.103	14%	0.143	C	C	.	.			trans	68.9	-152.7	-171.5	0	0	0	0	0	111.6	Y2120 K2153 L2157 W2195	Y2120-G2155 VanDerWaalsContact CD2-N 3.34Å; K2153-G2155 VanDerWaalsContact C-N 3.33Å; K2153-G2155 PolarHBondContact O-N 3.11Å; G2155-L2157 PolarHBondContact O-N 3.34Å; G2155-W2195 WeakPolarHBondContact O-CZ2 3.42Å
2156	N	74.1	Confident	84.1	Confident	23 Å²	23	28.3 Å²	28.3	12%	0.123	15%	0.148	C	C	.	.	S	Bend	trans	-72.8	126.5	177.1	-70.5	-74.9	0	0	0	111.8	G2118 E2119 F2401	G2118-N2156 CarbonylContact C-O 3.49Å; G2118-N2156 WeakPolarHBondContact CA-O 3.31Å; E2119-N2156 PolarHBondContact N-O 2.85Å; E2119-N2156 PolarHBondContact OE2-N 3.36Å; E2119-N2156 VanDerWaalsContact OE2-N 3.12Å; E2119-N2156 PolarHBondContact OE2-ND2 3.32Å; N2156-F2401 HydrophobicContact CB-CD2 4.04Å; N2156-F2401 HydrophobicContact CB-CE1 4.39Å; N2156-F2401 HydrophobicContact CB-CE2 3.42Å; N2156-F2401 VanDerWaalsContact CB-CE2 3.42Å; N2156-F2401 HydrophobicContact CB-CZ 3.63Å
2157	L	82.7	Confident	83.4	Confident	3 Å²	3	35 Å²	35	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	128.2	175.8	-51.9	179.8	0	0	0	111.3	L2116 F2117 L2154 G2155 V2180 W2195 F2197	L2116-L2157 HydrophobicContact CB-CD1 4.2Å; L2116-L2157 HydrophobicContact CB-CD2 4.17Å; L2116-L2157 HydrophobicContact CD1-CD1 4.06Å; L2116-L2157 HydrophobicContact CD2-CD1 4.49Å; L2116-L2157 HydrophobicContact CG-CD1 4.49Å; F2117-L2157 CarbonylContact O-C 3.5Å; F2117-L2157 VanDerWaalsContact O-CA 3.29Å; F2117-L2157 WeakPolarHBondContact O-CA 3.33Å; L2154-L2157 HydrophobicContact CB-CD2 3.91Å; L2154-L2157 HydrophobicContact CD1-CD2 4.01Å; G2155-L2157 PolarHBondContact O-N 3.34Å; L2157-V2180 HydrophobicContact CD1-CB 4.18Å; L2157-V2180 HydrophobicContact CD1-CG1 4.06Å; L2157-V2180 HydrophobicContact CD1-CG2 4.32Å; L2157-W2195 HydrophobicContact CB-CB 4.23Å; L2157-W2195 HydrophobicContact CB-CD2 4Å; L2157-W2195 HydrophobicContact CB-CG 3.7Å; L2157-W2195 HydrophobicContact CD1-CB 4.17Å; L2157-W2195 HydrophobicContact CD1-CD2 3.7Å; L2157-W2195 HydrophobicContact CD1-CE3 3.65Å; L2157-W2195 HydrophobicContact CD1-CG 3.94Å; L2157-W2195 HydrophobicContact CD1-CZ3 4.21Å; L2157-W2195 HydrophobicContact CG-CD2 3.68Å; L2157-W2195 HydrophobicContact CG-CE3 4.02Å; L2157-W2195 HydrophobicContact CG-CG 3.93Å; L2157-W2195 HydrophobicContact CG-CH2 4.49Å; L2157-W2195 HydrophobicContact CG-CZ2 4.22Å; L2157-W2195 HydrophobicContact CG-CZ3 4.41Å; L2157-F2197 HydrophobicContact CB-CZ 3.98Å; L2157-F2197 HydrophobicContact CD1-CZ 4.3Å
2158	A	74.2	Confident	82.8	Confident	5 Å²	5	31.2 Å²	31.2	4%	0.041	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-32.8	-178.9	0	0	0	0	0	113.1	F2117 C2218 F2401 L2404	F2117-A2158 PolarHBondContact O-N 2.99Å; A2158-C2218 WeakPolarHBondContact O-CB 3.32Å; A2158-C2218 PolarHBondContact O-N 3.3Å; A2158-F2401 HydrophobicContact CB-CD2 3.88Å; A2158-F2401 HydrophobicContact CB-CE2 4.14Å; A2158-L2404 HydrophobicContact CB-CB 4.14Å; A2158-L2404 HydrophobicContact CB-CD1 4.14Å; A2158-L2404 HydrophobicContact CB-CD2 4.46Å; A2158-L2404 HydrophobicContact CB-CG 4.49Å
2159	R	80.9	Confident	82.5	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	161	178.5	67.4	170.6	-172	139.9	-12.5	112.4	F2117 D2215 A2216 N2442 I2469	F2117-R2159 HydrophobicContact CB-CG 3.66Å; F2117-R2159 HydrophobicContact CD2-CG 3.7Å; F2117-R2159 VanDerWaalsContact CE1-NH2 3.27Å; F2117-R2159 HydrophobicContact CG-CG 3.85Å; F2117-R2159 PolarHBondContact N-O 2.93Å; F2117-R2159 PolarHBondContact O-N 3.1Å; R2159-D2215 IonicContact NH1-OD1 2.95Å; R2159-D2215 PolarHBondContact NH1-OD1 3.05Å; R2159-D2215 VanDerWaalsContact NH1-OD1 3.1Å; R2159-D2215 IonicContact NH1-OD2 2.89Å; R2159-D2215 PolarHBondContact NH1-OD2 3.11Å; R2159-A2216 WeakPolarHBondContact CA-O 3.45Å; R2159-A2216 WeakPolarHBondContact CB-O 3.4Å; R2159-N2442 PolarHBondContact NH2-O 2.97Å; R2159-I2469 HydrophobicContact CB-CD1 3.56Å; R2159-I2469 HydrophobicContact CG-CD1 4.2Å
2160	C	86.9	Confident	82.5	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.4	173.7	-179.7	0	0	0	0	109.9	V2114 L2116 F2197 F2199 D2215 A2216	V2114-C2160 VanDerWaalsContact CG2-SG 3.51Å; L2116-C2160 HydrophobicContact CD2-CB 4.32Å; C2160-F2197 HydrophobicContact CB-CB 3.93Å; C2160-F2197 HydrophobicContact CB-CD1 3.34Å; C2160-F2197 HydrophobicContact CB-CD2 3.61Å; C2160-F2197 HydrophobicContact CB-CE1 3.68Å; C2160-F2197 HydrophobicContact CB-CE2 3.92Å; C2160-F2197 HydrophobicContact CB-CG 3.32Å; C2160-F2197 HydrophobicContact CB-CZ 3.96Å; C2160-F2199 HydrophobicContact CB-CZ 4.32Å; C2160-D2215 WeakPolarHBondContact O-CA 3.35Å; C2160-A2216 PolarHBondContact N-O 2.94Å; C2160-A2216 PolarHBondContact O-N 3.14Å
2161	R	86.9	Confident	82.6	Confident	7 Å²	7	32.9 Å²	32.9	3%	0.026	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.2	171.3	171.8	168.6	-65.8	-156	-4.4	109.5	V2114 Q2115 F2117 W2163 L2213 R2214 D2215 S2443	V2114-R2161 CarbonylContact C-O 3.49Å; V2114-R2161 VanDerWaalsContact CA-O 3.31Å; V2114-R2161 WeakPolarHBondContact CA-O 3.4Å; V2114-R2161 VanDerWaalsContact CG2-O 3.31Å; V2114-R2161 WeakPolarHBondContact CG2-O 3.36Å; Q2115-R2161 HydrophobicContact CB-CB 4.29Å; Q2115-R2161 PolarHBondContact N-O 2.78Å; Q2115-R2161 PolarHBondContact O-N 3.41Å; F2117-R2161 HydrophobicContact CE2-CB 3.87Å; R2161-W2163 HydrophobicContact CG-CE3 3.74Å; R2161-W2163 HydrophobicContact CG-CZ3 3.83Å; R2161-L2213 HydrophobicContact CG-CG 4.48Å; R2161-R2214 WeakPolarHBondContact CA-O 3.2Å; R2161-D2215 IonicContact CZ-OD1 3.52Å; R2161-D2215 VanDerWaalsContact CZ-OD1 3.26Å; R2161-D2215 IonicContact CZ-OD2 2.68Å; R2161-D2215 IonicContact NE-OD1 3.56Å; R2161-D2215 PolarHBondContact NE-OD1 2.9Å; R2161-D2215 IonicContact NH2-OD1 3.7Å; R2161-D2215 PolarHBondContact NH2-OD1 3.16Å; R2161-D2215 IonicContact NH2-OD2 2.97Å; R2161-D2215 PolarHBondContact NH2-OD2 2.89Å; R2161-S2443 VanDerWaalsContact CZ-O 3.3Å; R2161-S2443 PolarHBondContact NH1-O 2.78Å; R2161-S2443 VanDerWaalsContact NH1-O 3.09Å; R2161-S2443 VanDerWaalsContact NH2-C 3.34Å; R2161-S2443 PolarHBondContact NH2-O 2.89Å
2162	I	90.6	Very high	82.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	139.4	179.4	-150.7	170	0	0	0	110.7	V2098 V2112 Y2113 V2114 W2173 L2178 F2199 L2203 L2213 R2214	V2098-I2162 HydrophobicContact CG1-CD1 4.36Å; V2112-I2162 HydrophobicContact CG1-CG1 4.25Å; Y2113-I2162 WeakPolarHBondContact O-CA 3.32Å; Y2113-I2162 WeakPolarHBondContact O-CG1 3.12Å; V2114-I2162 HydrophobicContact CB-CG1 4.49Å; I2162-W2173 HydrophobicContact CD1-CH2 3.56Å; I2162-W2173 HydrophobicContact CD1-CZ3 3.86Å; I2162-W2173 HydrophobicContact CG1-CH2 4.22Å; I2162-W2173 HydrophobicContact CG1-CZ3 4.05Å; I2162-L2178 HydrophobicContact CD1-CD1 3.69Å; I2162-F2199 HydrophobicContact CB-CE1 4.43Å; I2162-F2199 HydrophobicContact CB-CE2 4.25Å; I2162-F2199 HydrophobicContact CB-CZ 3.91Å; I2162-F2199 HydrophobicContact CD1-CE2 4.48Å; I2162-F2199 HydrophobicContact CG2-CD1 4.07Å; I2162-F2199 HydrophobicContact CG2-CD2 4.23Å; I2162-F2199 HydrophobicContact CG2-CE1 3.65Å; I2162-F2199 HydrophobicContact CG2-CE2 3.83Å; I2162-F2199 HydrophobicContact CG2-CG 4.35Å; I2162-F2199 HydrophobicContact CG2-CZ 3.52Å; I2162-L2203 HydrophobicContact CG2-CD2 4.02Å; I2162-L2213 WeakPolarHBondContact O-CA 3.16Å; I2162-R2214 HydrophobicContact CG2-CB 4.47Å; I2162-R2214 PolarHBondContact N-O 2.98Å; I2162-R2214 PolarHBondContact O-N 3.27Å
2163	W	88.8	Confident	82.7	Confident	39 Å²	39	33.3 Å²	33.3	15%	0.148	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	173.3	-179.5	72.6	101.5	0	0	0	111.8	V2112 Y2113 Q2115 E2125 R2161 L2212 L2213	V2112-W2163 WeakPolarHBondContact CA-O 3.26Å; Y2113-W2163 VanDerWaalsContact CB-CZ2 3.45Å; Y2113-W2163 HydrophobicContact CD1-CZ2 4.34Å; Y2113-W2163 AromaticContact CD2-NE1 3.85Å; Y2113-W2163 AromaticContact CG-CE2 3.9Å; Y2113-W2163 HydrophobicContact CG-CZ2 4.03Å; Y2113-W2163 AromaticContact CG-NE1 3.85Å; Y2113-W2163 PolarHBondContact N-O 3.26Å; Y2113-W2163 PolarHBondContact O-N 2.67Å; Y2113-W2163 VanDerWaalsContact O-N 3.07Å; Q2115-W2163 HydrophobicContact CB-CH2 4.21Å; Q2115-W2163 HydrophobicContact CB-CZ3 3.96Å; E2125-W2163 HydrophobicContact CB-CH2 3.91Å; E2125-W2163 HydrophobicContact CB-CZ2 4.03Å; E2125-W2163 HydrophobicContact CG-CH2 3.76Å; E2125-W2163 HydrophobicContact CG-CZ2 3.85Å; R2161-W2163 HydrophobicContact CG-CE3 3.74Å; R2161-W2163 HydrophobicContact CG-CZ3 3.83Å; W2163-L2212 VanDerWaalsContact CA-O 3.22Å; W2163-L2212 WeakPolarHBondContact CA-O 3.32Å; W2163-L2212 VanDerWaalsContact CB-O 3.22Å; W2163-L2212 WeakPolarHBondContact CB-O 3.31Å; W2163-L2213 HydrophobicContact CB-CB 3.76Å; W2163-L2213 HydrophobicContact CB-CD1 4.13Å; W2163-L2213 HydrophobicContact CB-CG 3.99Å; W2163-L2213 HydrophobicContact CG-CD1 4.37Å
2164	H	88.6	Confident	83.1	Confident	5 Å²	5	31.9 Å²	31.9	2%	0.023	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	161.8	174.2	62.6	128.4	0	0	0	111.6	A2110 N2111 V2112 N2166 P2171 L2203 L2212	A2110-H2164 HydrophobicContact CB-CB 4.05Å; N2111-H2164 WeakPolarHBondContact O-CA 3.37Å; N2111-H2164 WeakPolarHBondContact O-CB 3.47Å; V2112-H2164 HydrophobicContact CG2-CB 4.34Å; H2164-N2166 VanDerWaalsContact C-N 3.33Å; H2164-N2166 PolarHBondContact O-N 2.79Å; H2164-P2171 PolarHBondContact CE1-O 2.88Å; H2164-P2171 PolarHBondContact ND1-O 3.34Å; H2164-P2171 VanDerWaalsContact ND1-O 3.14Å; H2164-L2203 VanDerWaalsContact NE2-C 3.35Å; H2164-L2203 WeakPolarHBondContact NE2-CB 3.32Å; H2164-L2203 PolarHBondContact NE2-O 2.87Å; H2164-L2212 PolarHBondContact CD2-O 2.85Å; H2164-L2212 VanDerWaalsContact CE1-CD2 3.43Å; H2164-L2212 WeakPolarHBondContact CE1-CD2 3.31Å; H2164-L2212 PolarHBondContact N-O 2.8Å; H2164-L2212 WeakPolarHBondContact NE2-CD2 3.34Å
2165	D	82.4	Confident	83.5	Confident	38 Å²	38	31.4 Å²	31.4	20%	0.203	18%	0.183	C	C	.	.			trans	-85	0.4	-175.9	73.1	-17.7	0	0	0	115.1	N2111 Y2113 K2167	N2111-D2165 PolarHBondContact N-OD1 2.84Å; N2111-D2165 PolarHBondContact ND2-OD2 2.82Å; N2111-D2165 PolarHBondContact O-N 2.83Å; N2111-D2165 VanDerWaalsContact O-N 3.17Å; Y2113-D2165 HydrophobicContact CE2-CB 4.17Å; D2165-K2167 PolarHBondContact O-N 2.95Å; D2165-K2167 PolarHBondContact OD1-N 2.84Å; D2165-K2167 WeakPolarHBondContact OD2-CD 3.44Å; D2165-K2167 IonicContact OD2-NZ 3.2Å
2166	N	83.6	Confident	84.1	Confident	52 Å²	52	33.7 Å²	33.7	28%	0.278	19%	0.191	S	C	.	.			trans	55.8	24.7	-175.8	-156.5	58.3	0	0	0	114.6	H2164 P2171 L2212	H2164-N2166 VanDerWaalsContact C-N 3.33Å; H2164-N2166 PolarHBondContact O-N 2.79Å; N2166-P2171 WeakPolarHBondContact OD1-CB 3.5Å; N2166-P2171 WeakPolarHBondContact OD1-CG 3.35Å; N2166-L2212 HydrophobicContact CB-CD1 3.81Å; N2166-L2212 HydrophobicContact CB-CD2 4.1Å
2167	K	77.6	Confident	85	Confident	146 Å²	146	34.5 Å²	34.5	64%	0.635	19%	0.193	S	C	*	.			trans	-104.9	108	179.1	-63.7	-178.1	-162.8	154.3	0	111.5	A2110 D2165	A2110-K2167 WeakPolarHBondContact CA-O 3.27Å; D2165-K2167 PolarHBondContact O-N 2.95Å; D2165-K2167 PolarHBondContact OD1-N 2.84Å; D2165-K2167 WeakPolarHBondContact OD2-CD 3.44Å; D2165-K2167 IonicContact OD2-NZ 3.2Å
2168	G	77.3	Confident	85.6	Confident	48 Å²	48	34.4 Å²	34.4	50%	0.495	19%	0.192	S	C	.	.	S	Bend	trans	172.3	-174.5	175.8	0	0	0	0	0	111.6	D2109	D2109-G2168 VanDerWaalsContact OD1-CA 3.29Å; D2109-G2168 WeakPolarHBondContact OD1-CA 3.1Å
2169	S	81.1	Confident	86.5	Confident	105 Å²	105	35.1 Å²	35.1	73%	0.734	20%	0.195	S	C	*	.	S	Bend	trans	-89.2	-13.7	174	63	0	0	0	0	113.1	D2109	D2109-S2169 PolarHBondContact OD1-N 2.86Å; D2109-S2169 PolarHBondContact OD2-N 3.14Å; D2109-S2169 PolarHBondContact OD2-OG 3.17Å
2170	S	83	Confident	87	Confident	71 Å²	71	34.8 Å²	34.8	50%	0.497	19%	0.193	S	C	.	.	S	Bend	trans	-151.9	71.9	175.9	-69.7	0	0	0	0	109.5	T2108 D2109 N2172	T2108-S2170 WeakPolarHBondContact CA-O 3.24Å; D2109-S2170 PolarHBondContact N-O 3.19Å; D2109-S2170 WeakPolarHBondContact OD1-CA 3.28Å; D2109-S2170 PolarHBondContact OD1-N 2.76Å; D2109-S2170 VanDerWaalsContact OD1-O 3.11Å; D2109-S2170 PolarHBondContact OD2-N 3.01Å; S2170-N2172 PolarHBondContact O-N 3.39Å
2171	P	82.5	Confident	87.1	Confident	23 Å²	23	37.2 Å²	37.2	15%	0.149	20%	0.204	C	C	.	.			trans	-77.1	-16.9	-170.4	31.2	-36.8	0	0	0	114.3	T2108 A2110 H2164 N2166	T2108-P2171 WeakPolarHBondContact CB-O 3.3Å; T2108-P2171 VanDerWaalsContact OG1-C 3.24Å; T2108-P2171 WeakPolarHBondContact OG1-CA 3.14Å; T2108-P2171 PolarHBondContact OG1-O 2.8Å; A2110-P2171 HydrophobicContact CB-CB 4.12Å; H2164-P2171 PolarHBondContact CE1-O 2.88Å; H2164-P2171 PolarHBondContact ND1-O 3.34Å; H2164-P2171 VanDerWaalsContact ND1-O 3.14Å; N2166-P2171 WeakPolarHBondContact OD1-CB 3.5Å; N2166-P2171 WeakPolarHBondContact OD1-CG 3.35Å
2172	N	85.3	Confident	87	Confident	35 Å²	35	37.6 Å²	37.6	19%	0.187	21%	0.206	C	C	.	.			trans	-61.2	141	-178.1	-64.5	4.6	0	0	0	111.6	S2107 T2108 S2170 W2202 S2204 S2206 D2207	S2107-N2172 CarbonylContact C-O 3.6Å; T2108-N2172 WeakPolarHBondContact CB-O 3.4Å; S2170-N2172 PolarHBondContact O-N 3.39Å; N2172-W2202 HydrophobicContact CB-CZ3 4.46Å; N2172-S2204 VanDerWaalsContact CG-OG 3.26Å; N2172-S2204 PolarHBondContact ND2-OG 2.97Å; N2172-S2204 PolarHBondContact OD1-OG 2.76Å; N2172-S2206 PolarHBondContact ND2-OG 3Å; N2172-D2207 PolarHBondContact ND2-OD2 2.78Å
2173	W	90.4	Very high	86.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.9	-174.7	-166	40.1	0	0	0	111.9	V2098 T2100 S2106 T2108 V2112 F2138 I2162 C2175 W2202 L2203	V2098-W2173 HydrophobicContact CG1-CH2 3.8Å; V2098-W2173 HydrophobicContact CG1-CZ2 3.69Å; T2100-W2173 PolarHBondContact OG1-NE1 3.49Å; S2106-W2173 WeakPolarHBondContact O-CA 3.1Å; T2108-W2173 HydrophobicContact CG2-CB 3.94Å; T2108-W2173 VanDerWaalsContact CG2-CD1 3.5Å; T2108-W2173 HydrophobicContact CG2-CD2 4.12Å; T2108-W2173 HydrophobicContact CG2-CG 3.6Å; V2112-W2173 HydrophobicContact CG1-CH2 3.75Å; V2112-W2173 HydrophobicContact CG1-CZ3 3.78Å; V2112-W2173 HydrophobicContact CG2-CE3 4.46Å; V2112-W2173 HydrophobicContact CG2-CZ3 4.39Å; F2138-W2173 AromaticContact CD1-CZ2 3.73Å; F2138-W2173 HydrophobicContact CD1-CZ2 3.73Å; F2138-W2173 HydrophobicContact CE1-CZ2 4.16Å; F2138-W2173 HydrophobicContact CG-CZ2 4.49Å; I2162-W2173 HydrophobicContact CD1-CH2 3.56Å; I2162-W2173 HydrophobicContact CD1-CZ3 3.86Å; I2162-W2173 HydrophobicContact CG1-CH2 4.22Å; I2162-W2173 HydrophobicContact CG1-CZ3 4.05Å; W2173-C2175 HydrophobicContact CD2-CB 4.46Å; W2173-C2175 HydrophobicContact CE3-CB 4.25Å; W2173-C2175 HydrophobicContact CH2-CB 3.91Å; W2173-C2175 HydrophobicContact CZ2-CB 4.13Å; W2173-C2175 HydrophobicContact CZ3-CB 3.98Å; W2173-W2202 CarbonylContact O-C 3.59Å; W2173-W2202 WeakPolarHBondContact O-CA 3.36Å; W2173-L2203 HydrophobicContact CB-CB 4.44Å; W2173-L2203 HydrophobicContact CE3-CB 4.32Å; W2173-L2203 HydrophobicContact CE3-CD1 3.87Å; W2173-L2203 HydrophobicContact CE3-CD2 4.19Å; W2173-L2203 HydrophobicContact CE3-CG 4.35Å; W2173-L2203 HydrophobicContact CZ3-CD1 4.27Å; W2173-L2203 HydrophobicContact CZ3-CD2 4.34Å; W2173-L2203 PolarHBondContact N-O 2.93Å; W2173-L2203 PolarHBondContact O-N 2.91Å
2174	Y	90.7	Very high	85.5	Confident	42 Å²	42	39.8 Å²	39.8	17%	0.165	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	114.2	166.1	-175.8	-83.5	0	0	0	110.7	G2101 M2103 S2106 N2200 W2202	G2101-Y2174 PolarHBondContact N-O 3.02Å; M2103-Y2174 HydrophobicContact CE-CD1 4.05Å; M2103-Y2174 HydrophobicContact CE-CD2 3.21Å; M2103-Y2174 HydrophobicContact CE-CE1 4.09Å; M2103-Y2174 HydrophobicContact CE-CE2 3.27Å; M2103-Y2174 HydrophobicContact CE-CG 3.62Å; S2106-Y2174 PolarHBondContact O-N 3.14Å; Y2174-N2200 VanDerWaalsContact CZ-C 3.48Å; Y2174-N2200 VanDerWaalsContact OH-C 3.23Å; Y2174-N2200 PolarHBondContact OH-O 2.84Å; Y2174-W2202 HydrophobicContact CD2-CB 4.46Å; Y2174-W2202 AromaticContact CD2-CD1 3.73Å; Y2174-W2202 AromaticContact CD2-CD2 3.92Å; Y2174-W2202 HydrophobicContact CD2-CD2 3.92Å; Y2174-W2202 AromaticContact CD2-CE2 3.88Å; Y2174-W2202 AromaticContact CD2-CG 3.8Å; Y2174-W2202 HydrophobicContact CD2-CG 3.8Å; Y2174-W2202 AromaticContact CD2-NE1 3.76Å; Y2174-W2202 HydrophobicContact CG-CD2 4.49Å
2175	C	89.9	Confident	84.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.3	178.9	-170.4	0	0	0	0	110.2	W2173 F2199 N2200 K2201 L2203	W2173-C2175 HydrophobicContact CD2-CB 4.46Å; W2173-C2175 HydrophobicContact CE3-CB 4.25Å; W2173-C2175 HydrophobicContact CH2-CB 3.91Å; W2173-C2175 HydrophobicContact CZ2-CB 4.13Å; W2173-C2175 HydrophobicContact CZ3-CB 3.98Å; C2175-F2199 HydrophobicContact CB-CB 4.28Å; C2175-N2200 WeakPolarHBondContact O-CA 3.32Å; C2175-N2200 PolarHBondContact O-N 3.05Å; C2175-K2201 PolarHBondContact N-O 3.03Å; C2175-K2201 VanDerWaalsContact N-O 3.12Å; C2175-K2201 PolarHBondContact O-N 2.81Å; C2175-L2203 HydrophobicContact CB-CD1 3.82Å
2176	E	88.9	Confident	82.9	Confident	58 Å²	58	48.4 Å²	48.4	27%	0.271	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-58.2	177.8	-161.8	-168.6	117.2	0	0	109.7	K2099 F2199 N2200	K2099-E2176 HydrophobicContact CB-CB 4.15Å; K2099-E2176 WeakPolarHBondContact CE-OE2 3.25Å; K2099-E2176 HydrophobicContact CG-CB 3.59Å; K2099-E2176 HydrophobicContact CG-CG 4.16Å; K2099-E2176 WeakPolarHBondContact CG-OE2 3.26Å; K2099-E2176 PolarHBondContact O-N 2.76Å; E2176-F2199 PolarHBondContact O-N 3.19Å; E2176-N2200 WeakPolarHBondContact CG-OD1 3.41Å; E2176-N2200 PolarHBondContact O-N 3.5Å; E2176-N2200 PolarHBondContact O-OD1 2.86Å
2177	W	93.4	Very high	81.3	Confident	41 Å²	41	49.8 Å²	49.8	16%	0.155	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	164.9	177.7	51.4	-98.8	0	0	0	112.6	F2097 K2099 I2143 E2179 K2196 F2197	F2097-W2177 HydrophobicContact CB-CZ3 4.39Å; K2099-W2177 HydrophobicContact CB-CD2 3.58Å; K2099-W2177 HydrophobicContact CB-CE3 4Å; K2099-W2177 HydrophobicContact CB-CG 4.08Å; K2099-W2177 HydrophobicContact CB-CH2 4.07Å; K2099-W2177 HydrophobicContact CB-CZ2 3.66Å; K2099-W2177 HydrophobicContact CB-CZ3 4.23Å; K2099-W2177 HydrophobicContact CD-CZ2 4.25Å; K2099-W2177 HydrophobicContact CG-CD2 4.32Å; K2099-W2177 HydrophobicContact CG-CZ2 3.99Å; K2099-W2177 PolarHBondContact N-O 2.86Å; I2143-W2177 HydrophobicContact CD1-CH2 4.19Å; I2143-W2177 HydrophobicContact CD1-CZ2 4.23Å; W2177-E2179 HydrophobicContact CE3-CB 4.22Å; W2177-E2179 HydrophobicContact CZ3-CB 4.02Å; W2177-K2196 VanDerWaalsContact CG-CE 3.45Å; W2177-F2197 CarbonylContact C-O 3.56Å; W2177-F2197 VanDerWaalsContact CA-O 3.25Å; W2177-F2197 WeakPolarHBondContact CA-O 3.09Å; W2177-F2197 VanDerWaalsContact CB-O 3.23Å; W2177-F2197 WeakPolarHBondContact CB-O 2.8Å
2178	L	94.2	Very high	80.1	Confident	0 Å²	0	46 Å²	46	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	140	171.5	-176	150.8	0	0	0	109.9	I2096 F2097 V2098 V2114 I2162 V2180 F2197 F2199	I2096-L2178 HydrophobicContact CG2-CD1 4.04Å; I2096-L2178 HydrophobicContact CG2-CD2 4.08Å; I2096-L2178 HydrophobicContact CG2-CG 4.05Å; F2097-L2178 CarbonylContact O-C 3.57Å; F2097-L2178 WeakPolarHBondContact O-CA 3.33Å; V2098-L2178 HydrophobicContact CG2-CD1 3.9Å; V2098-L2178 HydrophobicContact CG2-CG 4.29Å; V2114-L2178 HydrophobicContact CB-CD1 4.48Å; V2114-L2178 HydrophobicContact CG2-CD1 3.7Å; I2162-L2178 HydrophobicContact CD1-CD1 3.69Å; L2178-V2180 HydrophobicContact CD2-CG2 3.54Å; L2178-F2197 HydrophobicContact CD2-CD2 3.88Å; L2178-F2197 HydrophobicContact CD2-CE2 4.39Å; L2178-F2197 PolarHBondContact N-O 3.34Å; L2178-F2197 PolarHBondContact O-N 3.03Å; L2178-F2199 HydrophobicContact CB-CE2 4.09Å
2179	E	93.1	Very high	78.8	Confident	20 Å²	20	53.8 Å²	53.8	9%	0.093	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137	176.9	-175.3	179.6	148.3	0	0	110.1	I2096 F2097 W2177 K2181 W2195 K2196 Y2222	I2096-E2179 CarbonylContact C-O 3.56Å; I2096-E2179 WeakPolarHBondContact CA-O 3.29Å; F2097-E2179 HydrophobicContact CB-CB 4.35Å; F2097-E2179 PolarHBondContact N-O 3.12Å; F2097-E2179 PolarHBondContact O-N 2.89Å; W2177-E2179 HydrophobicContact CE3-CB 4.22Å; W2177-E2179 HydrophobicContact CZ3-CB 4.02Å; E2179-K2181 WeakPolarHBondContact OE1-CE 3.49Å; E2179-K2181 IonicContact OE1-NZ 3.47Å; E2179-W2195 CarbonylContact C-O 3.56Å; E2179-W2195 WeakPolarHBondContact CA-O 3.03Å; E2179-K2196 HydrophobicContact CB-CG 4.35Å; E2179-K2196 IonicContact OE2-NZ 3.02Å; E2179-Y2222 PolarHBondContact OE1-OH 2.7Å; E2179-Y2222 PolarHBondContact OE2-OH 2.67Å
2180	V	92.5	Very high	77.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.6	178.4	-176.2	0	0	0	0	108.8	L2094 D2095 I2096 L2116 L2157 L2178 N2194 W2195 F2197	L2094-V2180 HydrophobicContact CB-CG1 4.27Å; L2094-V2180 HydrophobicContact CD1-CG1 4.08Å; L2094-V2180 HydrophobicContact CD2-CG1 4.18Å; L2094-V2180 HydrophobicContact CG-CG1 4.41Å; D2095-V2180 CarbonylContact O-C 3.6Å; D2095-V2180 WeakPolarHBondContact O-CA 3.23Å; I2096-V2180 HydrophobicContact CG1-CG1 4.4Å; I2096-V2180 HydrophobicContact CG1-CG2 4.31Å; L2116-V2180 HydrophobicContact CD1-CG1 4.01Å; L2116-V2180 HydrophobicContact CD1-CG2 3.89Å; L2116-V2180 HydrophobicContact CD2-CG2 3.8Å; L2157-V2180 HydrophobicContact CD1-CB 4.18Å; L2157-V2180 HydrophobicContact CD1-CG1 4.06Å; L2157-V2180 HydrophobicContact CD1-CG2 4.32Å; L2178-V2180 HydrophobicContact CD2-CG2 3.54Å; V2180-N2194 CarbonylContact O-C 3.57Å; V2180-N2194 WeakPolarHBondContact O-CA 3.32Å; V2180-W2195 HydrophobicContact CB-CE3 4.17Å; V2180-W2195 HydrophobicContact CG1-CE3 4.05Å; V2180-W2195 HydrophobicContact CG1-CZ3 4.34Å; V2180-W2195 PolarHBondContact N-O 2.7Å; V2180-W2195 PolarHBondContact O-N 2.94Å; V2180-F2197 HydrophobicContact CG2-CE2 4.05Å
2181	K	88.1	Confident	76.2	Confident	51 Å²	51	52.6 Å²	52.6	22%	0.222	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.9	177.3	-54.3	-177.7	-173.4	146.8	0	110	L2094 D2095 F2097 E2179 N2194	L2094-K2181 CarbonylContact C-O 3.46Å; L2094-K2181 VanDerWaalsContact CA-O 3.28Å; L2094-K2181 WeakPolarHBondContact CA-O 3.49Å; D2095-K2181 HydrophobicContact CB-CB 4.28Å; D2095-K2181 PolarHBondContact N-O 3.36Å; D2095-K2181 PolarHBondContact O-N 2.83Å; F2097-K2181 HydrophobicContact CD2-CD 4.32Å; F2097-K2181 HydrophobicContact CD2-CG 4.46Å; F2097-K2181 HydrophobicContact CE2-CD 3.6Å; F2097-K2181 HydrophobicContact CE2-CG 4.04Å; F2097-K2181 HydrophobicContact CZ-CD 4.34Å; E2179-K2181 WeakPolarHBondContact OE1-CE 3.49Å; E2179-K2181 IonicContact OE1-NZ 3.47Å; K2181-N2194 WeakPolarHBondContact CA-OD1 3.31Å; K2181-N2194 WeakPolarHBondContact CB-OD1 3.21Å; K2181-N2194 HydrophobicContact CG-CB 4.31Å; K2181-N2194 VanDerWaalsContact CG-OD1 3.26Å; K2181-N2194 WeakPolarHBondContact CG-OD1 3.13Å
2182	E	85.9	Confident	75.5	Confident	15 Å²	15	51.7 Å²	51.7	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	136.8	166.7	-174.6	166.4	-141.4	0	0	110.5	T2092 L2094 K2153 A2192 C2193 W2195	T2092-E2182 WeakPolarHBondContact OG1-CG 3.29Å; T2092-E2182 PolarHBondContact OG1-OE1 2.98Å; L2094-E2182 HydrophobicContact CD2-CB 4.22Å; K2153-E2182 IonicContact NZ-OE1 2.71Å; K2153-E2182 PolarHBondContact NZ-OE1 2.87Å; K2153-E2182 IonicContact NZ-OE2 3.26Å; K2153-E2182 PolarHBondContact NZ-OE2 3.03Å; E2182-A2192 HydrophobicContact CB-CB 4.07Å; E2182-A2192 HydrophobicContact CG-CB 4.44Å; E2182-A2192 WeakPolarHBondContact O-CB 3.2Å; E2182-C2193 WeakPolarHBondContact CB-O 3.3Å; E2182-C2193 PolarHBondContact N-O 3.1Å; E2182-C2193 PolarHBondContact OE2-N 2.81Å; E2182-W2195 HydrophobicContact CB-CH2 4.37Å; E2182-W2195 HydrophobicContact CB-CZ3 4.26Å
2183	V	79	Confident	74.9	Confident	48 Å²	48	50.8 Å²	50.8	29%	0.291	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116	179.4	-176.2	0	0	0	0	109	C2093 D2095 I2185	C2093-V2183 HydrophobicContact CB-CB 3.98Å; C2093-V2183 HydrophobicContact CB-CG2 4.33Å; C2093-V2183 PolarHBondContact O-N 2.69Å; D2095-V2183 HydrophobicContact CB-CG2 4.48Å; D2095-V2183 WeakPolarHBondContact OD2-CG2 3.34Å; V2183-I2185 PolarHBondContact O-N 2.75Å
2184	L	67.8	Low	74.6	Confident	38 Å²	38	50.8 Å²	50.8	20%	0.199	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-66.2	133	178.5	-81.1	165.2	0	0	0	111.9	N2190 A2192	L2184-N2190 WeakPolarHBondContact CD1-O 3.5Å; L2184-N2190 HydrophobicContact CD2-CB 4.2Å; L2184-N2190 VanDerWaalsContact CD2-O 3.27Å; L2184-N2190 WeakPolarHBondContact CD2-O 3.44Å; L2184-A2192 HydrophobicContact CD1-CB 3.97Å; L2184-A2192 HydrophobicContact CD2-CB 4.35Å; L2184-A2192 HydrophobicContact CG-CB 3.64Å
2185	I	64.6	Low	74.5	Confident	91 Å²	91	49.1 Å²	49.1	47%	0.467	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-74.2	127.3	170.7	-58.1	173.3	0	0	0	108.1	V2183 G2187 E2188	V2183-I2185 PolarHBondContact O-N 2.75Å; I2185-G2187 PolarHBondContact O-N 3.26Å; I2185-G2187 VanDerWaalsContact O-N 3.12Å; I2185-E2188 PolarHBondContact O-N 3.27Å
2186	P	52.3	Low	74.4	Confident	132 Å²	132	51 Å²	51	86%	0.857	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	118.7	179	-27	35.4	0	0	0	112.2
2187	G	50.4	Low	74.4	Confident	81 Å²	81	48.3 Å²	48.3	84%	0.835	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.1	-23.3	177.7	0	0	0	0	0	115.4	I2185 K2189	I2185-G2187 PolarHBondContact O-N 3.26Å; I2185-G2187 VanDerWaalsContact O-N 3.12Å; G2187-K2189 PolarHBondContact O-N 2.88Å
2188	E	51.9	Low	74.1	Confident	67 Å²	67	48.6 Å²	48.6	31%	0.313	28%	0.276	S	S	.	.			trans	-75.3	127.2	171.8	-74.5	-152.6	162.4	0	0	111.1	K2090 I2185 N2190	K2090-E2188 IonicContact NZ-OE1 3.51Å; K2090-E2188 PolarHBondContact NZ-OE1 3.48Å; I2185-E2188 PolarHBondContact O-N 3.27Å; E2188-N2190 HydrophobicContact CB-CB 4.47Å; E2188-N2190 PolarHBondContact O-N 3.09Å; E2188-N2190 PolarHBondContact OE2-ND2 2.66Å
2189	K	49.2	Very low	73.7	Confident	212 Å²	212	49.4 Å²	49.4	92%	0.922	28%	0.28	S	S	*	.			trans	-73.4	20.7	176.1	-63.8	-177.1	179	176.8	0	113.9	G2187	G2187-K2189 PolarHBondContact O-N 2.88Å
2190	N	51.9	Low	73.5	Confident	90 Å²	90	52.6 Å²	52.6	48%	0.481	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-87.1	164.8	-176.6	-73.3	-40	0	0	0	111.6	L2184 E2188	L2184-N2190 WeakPolarHBondContact CD1-O 3.5Å; L2184-N2190 HydrophobicContact CD2-CB 4.2Å; L2184-N2190 VanDerWaalsContact CD2-O 3.27Å; L2184-N2190 WeakPolarHBondContact CD2-O 3.44Å; E2188-N2190 HydrophobicContact CB-CB 4.47Å; E2188-N2190 PolarHBondContact O-N 3.09Å; E2188-N2190 PolarHBondContact OE2-ND2 2.66Å
2191	L	58.4	Low	73.1	Confident	61 Å²	61	55.6 Å²	55.6	32%	0.319	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-99.3	138.9	171.7	-69.9	169.6	0	0	0	109.8	M2223 D2225	L2191-M2223 HydrophobicContact CB-CB 4.14Å; L2191-M2223 HydrophobicContact CB-CG 4.36Å; L2191-M2223 HydrophobicContact CB-SD 3.57Å; L2191-M2223 VanDerWaalsContact CB-SD 3.57Å; L2191-M2223 HydrophobicContact CD1-SD 3.77Å; L2191-M2223 HydrophobicContact CG-SD 4.32Å; L2191-D2225 HydrophobicContact CD2-CB 4.41Å
2192	A	67.3	Low	73.1	Confident	3 Å²	3	55.2 Å²	55.2	3%	0.025	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.3	176.8	0	0	0	0	0	110.2	E2182 L2184 N2194 M2223 N2224	E2182-A2192 HydrophobicContact CB-CB 4.07Å; E2182-A2192 HydrophobicContact CG-CB 4.44Å; E2182-A2192 WeakPolarHBondContact O-CB 3.2Å; L2184-A2192 HydrophobicContact CD1-CB 3.97Å; L2184-A2192 HydrophobicContact CD2-CB 4.35Å; L2184-A2192 HydrophobicContact CG-CB 3.64Å; A2192-N2194 PolarHBondContact O-ND2 2.98Å; A2192-N2194 VanDerWaalsContact O-ND2 3.07Å; A2192-M2223 CarbonylContact O-C 3.26Å; A2192-M2223 WeakPolarHBondContact O-CA 3.16Å; A2192-N2224 PolarHBondContact N-O 2.89Å; A2192-N2224 PolarHBondContact O-N 2.82Å
2193	C	73.6	Confident	73.1	Confident	16 Å²	16	54.5 Å²	54.5	11%	0.108	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	152.4	175.5	-63.7	0	0	0	0	112.1	E2182 W2195 Y2222	E2182-C2193 WeakPolarHBondContact CB-O 3.3Å; E2182-C2193 PolarHBondContact N-O 3.1Å; E2182-C2193 PolarHBondContact OE2-N 2.81Å; C2193-W2195 HydrophobicContact CB-CH2 3.39Å; C2193-W2195 HydrophobicContact CB-CZ2 3.19Å; C2193-W2195 HydrophobicContact CB-CZ3 4.17Å; C2193-W2195 WeakPolarHBondContact O-CZ3 3.19Å; C2193-Y2222 CarbonylContact C-O 3.59Å
2194	N	82.9	Confident	73.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	141.3	-175.7	-45.5	-103.4	0	0	0	108.6	V2180 K2181 A2192 V2221 Y2222 N2224	V2180-N2194 CarbonylContact O-C 3.57Å; V2180-N2194 WeakPolarHBondContact O-CA 3.32Å; K2181-N2194 WeakPolarHBondContact CA-OD1 3.31Å; K2181-N2194 WeakPolarHBondContact CB-OD1 3.21Å; K2181-N2194 HydrophobicContact CG-CB 4.31Å; K2181-N2194 VanDerWaalsContact CG-OD1 3.26Å; K2181-N2194 WeakPolarHBondContact CG-OD1 3.13Å; A2192-N2194 PolarHBondContact O-ND2 2.98Å; A2192-N2194 VanDerWaalsContact O-ND2 3.07Å; N2194-V2221 CarbonylContact O-C 3.6Å; N2194-V2221 VanDerWaalsContact O-CA 3.24Å; N2194-V2221 WeakPolarHBondContact O-CA 3.16Å; N2194-V2221 WeakPolarHBondContact O-CG1 3.19Å; N2194-Y2222 WeakPolarHBondContact CA-O 3.23Å; N2194-Y2222 HydrophobicContact CB-CD2 3.66Å; N2194-Y2222 HydrophobicContact CB-CE2 3.55Å; N2194-Y2222 HydrophobicContact CB-CG 4.21Å; N2194-Y2222 WeakPolarHBondContact CB-O 3.39Å; N2194-Y2222 PolarHBondContact N-O 3.12Å; N2194-Y2222 PolarHBondContact ND2-O 2.71Å; N2194-Y2222 PolarHBondContact O-N 2.83Å; N2194-N2224 PolarHBondContact ND2-N 2.89Å; N2194-N2224 PolarHBondContact ND2-ND2 3.12Å; N2194-N2224 PolarHBondContact OD1-ND2 2.99Å
2195	W	89	Confident	73.5	Confident	8 Å²	8	52.2 Å²	52.2	3%	0.03	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.2	-168.4	-54.8	-96.9	0	0	0	109.9	L2094 G2155 L2157 E2179 V2180 E2182 C2193 F2197 E2220 V2221	L2094-W2195 HydrophobicContact CD2-CZ3 4.37Å; G2155-W2195 WeakPolarHBondContact O-CZ2 3.42Å; L2157-W2195 HydrophobicContact CB-CB 4.23Å; L2157-W2195 HydrophobicContact CB-CD2 4Å; L2157-W2195 HydrophobicContact CB-CG 3.7Å; L2157-W2195 HydrophobicContact CD1-CB 4.17Å; L2157-W2195 HydrophobicContact CD1-CD2 3.7Å; L2157-W2195 HydrophobicContact CD1-CE3 3.65Å; L2157-W2195 HydrophobicContact CD1-CG 3.94Å; L2157-W2195 HydrophobicContact CD1-CZ3 4.21Å; L2157-W2195 HydrophobicContact CG-CD2 3.68Å; L2157-W2195 HydrophobicContact CG-CE3 4.02Å; L2157-W2195 HydrophobicContact CG-CG 3.93Å; L2157-W2195 HydrophobicContact CG-CH2 4.49Å; L2157-W2195 HydrophobicContact CG-CZ2 4.22Å; L2157-W2195 HydrophobicContact CG-CZ3 4.41Å; E2179-W2195 CarbonylContact C-O 3.56Å; E2179-W2195 WeakPolarHBondContact CA-O 3.03Å; V2180-W2195 HydrophobicContact CB-CE3 4.17Å; V2180-W2195 HydrophobicContact CG1-CE3 4.05Å; V2180-W2195 HydrophobicContact CG1-CZ3 4.34Å; V2180-W2195 PolarHBondContact N-O 2.7Å; V2180-W2195 PolarHBondContact O-N 2.94Å; E2182-W2195 HydrophobicContact CB-CH2 4.37Å; E2182-W2195 HydrophobicContact CB-CZ3 4.26Å; C2193-W2195 HydrophobicContact CB-CH2 3.39Å; C2193-W2195 HydrophobicContact CB-CZ2 3.19Å; C2193-W2195 HydrophobicContact CB-CZ3 4.17Å; C2193-W2195 WeakPolarHBondContact O-CZ3 3.19Å; W2195-F2197 HydrophobicContact CB-CE2 3.84Å; W2195-F2197 HydrophobicContact CB-CZ 3.86Å; W2195-E2220 CarbonylContact C-O 3.4Å; W2195-E2220 WeakPolarHBondContact CA-O 3.35Å; W2195-V2221 HydrophobicContact CG-CG1 4.23Å; W2195-V2221 HydrophobicContact CG-CG2 4.23Å
2196	K	87.1	Confident	74	Confident	40 Å²	40	51.4 Å²	51.4	17%	0.174	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	146	176	-168	163.8	-177	157.2	0	111.5	W2177 E2179 C2218 S2219 E2220	W2177-K2196 VanDerWaalsContact CG-CE 3.45Å; E2179-K2196 HydrophobicContact CB-CG 4.35Å; E2179-K2196 IonicContact OE2-NZ 3.02Å; K2196-C2218 CarbonylContact O-C 3.56Å; K2196-C2218 PolarHBondContact O-SG 2.94Å; K2196-C2218 VanDerWaalsContact O-SG 3.33Å; K2196-S2219 PolarHBondContact O-N 2.95Å; K2196-S2219 PolarHBondContact O-OG 3.47Å; K2196-S2219 VanDerWaalsContact O-OG 3.06Å; K2196-E2220 HydrophobicContact CB-CB 4.15Å; K2196-E2220 PolarHBondContact N-O 2.8Å; K2196-E2220 PolarHBondContact O-N 3.17Å
2197	F	90.2	Very high	75	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.1	-177	-51.5	-87.2	0	0	0	108.5	L2157 C2160 W2177 L2178 V2180 W2195 F2199 A2216 C2218	L2157-F2197 HydrophobicContact CB-CZ 3.98Å; L2157-F2197 HydrophobicContact CD1-CZ 4.3Å; C2160-F2197 HydrophobicContact CB-CB 3.93Å; C2160-F2197 HydrophobicContact CB-CD1 3.34Å; C2160-F2197 HydrophobicContact CB-CD2 3.61Å; C2160-F2197 HydrophobicContact CB-CE1 3.68Å; C2160-F2197 HydrophobicContact CB-CE2 3.92Å; C2160-F2197 HydrophobicContact CB-CG 3.32Å; C2160-F2197 HydrophobicContact CB-CZ 3.96Å; W2177-F2197 CarbonylContact C-O 3.56Å; W2177-F2197 VanDerWaalsContact CA-O 3.25Å; W2177-F2197 WeakPolarHBondContact CA-O 3.09Å; W2177-F2197 VanDerWaalsContact CB-O 3.23Å; W2177-F2197 WeakPolarHBondContact CB-O 2.8Å; L2178-F2197 HydrophobicContact CD2-CD2 3.88Å; L2178-F2197 HydrophobicContact CD2-CE2 4.39Å; L2178-F2197 PolarHBondContact N-O 3.34Å; L2178-F2197 PolarHBondContact O-N 3.03Å; V2180-F2197 HydrophobicContact CG2-CE2 4.05Å; W2195-F2197 HydrophobicContact CB-CE2 3.84Å; W2195-F2197 HydrophobicContact CB-CZ 3.86Å; F2197-F2199 HydrophobicContact CB-CE2 4.27Å; F2197-A2216 HydrophobicContact CB-CB 4.2Å; F2197-C2218 HydrophobicContact CD1-CB 4.08Å; F2197-C2218 HydrophobicContact CE1-CB 3.53Å; F2197-C2218 HydrophobicContact CZ-CB 4.23Å
2198	A	86.1	Confident	76	Confident	48 Å²	48	48.6 Å²	48.6	40%	0.397	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.7	177.3	0	0	0	0	0	110.1	A2216	A2198-A2216 WeakPolarHBondContact O-CB 3.32Å
2199	F	86.8	Confident	76.8	Confident	17 Å²	17	47.7 Å²	47.7	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-54.5	179.5	-74.6	-75.9	0	0	0	111.2	C2160 I2162 C2175 E2176 L2178 F2197 K2201 R2214 A2216	C2160-F2199 HydrophobicContact CB-CZ 4.32Å; I2162-F2199 HydrophobicContact CB-CE1 4.43Å; I2162-F2199 HydrophobicContact CB-CE2 4.25Å; I2162-F2199 HydrophobicContact CB-CZ 3.91Å; I2162-F2199 HydrophobicContact CD1-CE2 4.48Å; I2162-F2199 HydrophobicContact CG2-CD1 4.07Å; I2162-F2199 HydrophobicContact CG2-CD2 4.23Å; I2162-F2199 HydrophobicContact CG2-CE1 3.65Å; I2162-F2199 HydrophobicContact CG2-CE2 3.83Å; I2162-F2199 HydrophobicContact CG2-CG 4.35Å; I2162-F2199 HydrophobicContact CG2-CZ 3.52Å; C2175-F2199 HydrophobicContact CB-CB 4.28Å; E2176-F2199 PolarHBondContact O-N 3.19Å; L2178-F2199 HydrophobicContact CB-CE2 4.09Å; F2197-F2199 HydrophobicContact CB-CE2 4.27Å; F2199-K2201 VanDerWaalsContact C-N 3.25Å; F2199-K2201 PolarHBondContact O-N 2.71Å; F2199-R2214 HydrophobicContact CD1-CB 3.63Å; F2199-R2214 HydrophobicContact CD1-CG 4.46Å; F2199-R2214 HydrophobicContact CE1-CB 3.75Å; F2199-A2216 HydrophobicContact CD1-CB 3.75Å; F2199-A2216 HydrophobicContact CE1-CB 3.44Å; F2199-A2216 VanDerWaalsContact CE1-CB 3.44Å; F2199-A2216 HydrophobicContact CE2-CB 4.29Å; F2199-A2216 HydrophobicContact CG-CB 4.3Å; F2199-A2216 HydrophobicContact CZ-CB 3.74Å
2200	N	88.3	Confident	77.7	Confident	87 Å²	87	42.5 Å²	42.5	47%	0.465	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	46.6	43.6	-179.5	-63.4	-48.4	0	0	0	114.1	Y2174 C2175 E2176	Y2174-N2200 VanDerWaalsContact CZ-C 3.48Å; Y2174-N2200 VanDerWaalsContact OH-C 3.23Å; Y2174-N2200 PolarHBondContact OH-O 2.84Å; C2175-N2200 WeakPolarHBondContact O-CA 3.32Å; C2175-N2200 PolarHBondContact O-N 3.05Å; E2176-N2200 WeakPolarHBondContact CG-OD1 3.41Å; E2176-N2200 PolarHBondContact O-N 3.5Å; E2176-N2200 PolarHBondContact O-OD1 2.86Å
2201	K	85.5	Confident	78.6	Confident	63 Å²	63	40 Å²	40	27%	0.274	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	158.9	-178.6	-71.7	-163	-173.4	-170.4	0	113.1	C2175 F2199 R2214 E2467	C2175-K2201 PolarHBondContact N-O 3.03Å; C2175-K2201 VanDerWaalsContact N-O 3.12Å; C2175-K2201 PolarHBondContact O-N 2.81Å; F2199-K2201 VanDerWaalsContact C-N 3.25Å; F2199-K2201 PolarHBondContact O-N 2.71Å; K2201-R2214 VanDerWaalsContact CD-NH1 3.26Å; K2201-E2467 IonicContact NZ-OE1 3.54Å; K2201-E2467 PolarHBondContact NZ-OE1 2.75Å; K2201-E2467 IonicContact NZ-OE2 2.67Å; K2201-E2467 PolarHBondContact NZ-OE2 2.9Å
2202	W	86.1	Confident	79.5	Confident	42 Å²	42	39.3 Å²	39.3	16%	0.159	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	145.7	168.4	-72.8	97.7	0	0	0	111.3	M2103 P2104 A2105 N2172 W2173 Y2174 D2207 D2208 R2214	M2103-W2202 HydrophobicContact CB-CZ2 4.34Å; M2103-W2202 HydrophobicContact CE-CZ2 3.78Å; P2104-W2202 WeakPolarHBondContact O-CH2 3.11Å; A2105-W2202 WeakPolarHBondContact O-CZ3 3.43Å; N2172-W2202 HydrophobicContact CB-CZ3 4.46Å; W2173-W2202 CarbonylContact O-C 3.59Å; W2173-W2202 WeakPolarHBondContact O-CA 3.36Å; Y2174-W2202 HydrophobicContact CD2-CB 4.46Å; Y2174-W2202 AromaticContact CD2-CD1 3.73Å; Y2174-W2202 AromaticContact CD2-CD2 3.92Å; Y2174-W2202 HydrophobicContact CD2-CD2 3.92Å; Y2174-W2202 AromaticContact CD2-CE2 3.88Å; Y2174-W2202 AromaticContact CD2-CG 3.8Å; Y2174-W2202 HydrophobicContact CD2-CG 3.8Å; Y2174-W2202 AromaticContact CD2-NE1 3.76Å; Y2174-W2202 HydrophobicContact CG-CD2 4.49Å; W2202-D2207 HydrophobicContact CB-CB 4.26Å; W2202-D2207 HydrophobicContact CD2-CB 4.1Å; W2202-D2207 HydrophobicContact CE3-CB 4.47Å; W2202-D2207 HydrophobicContact CG-CB 3.97Å; W2202-D2208 HydrophobicContact CB-CB 3.96Å; W2202-D2208 HydrophobicContact CG-CB 4.44Å; W2202-R2214 PolarHBondContact O-NE 3.43Å; W2202-R2214 VanDerWaalsContact O-NE 3.13Å; W2202-R2214 PolarHBondContact O-NH2 2.98Å
2203	L	87.8	Confident	80.3	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	103.4	158.7	-63.1	87	0	0	0	104.9	I2162 H2164 W2173 C2175 Q2211 R2214	I2162-L2203 HydrophobicContact CG2-CD2 4.02Å; H2164-L2203 VanDerWaalsContact NE2-C 3.35Å; H2164-L2203 WeakPolarHBondContact NE2-CB 3.32Å; H2164-L2203 PolarHBondContact NE2-O 2.87Å; W2173-L2203 HydrophobicContact CB-CB 4.44Å; W2173-L2203 HydrophobicContact CE3-CB 4.32Å; W2173-L2203 HydrophobicContact CE3-CD1 3.87Å; W2173-L2203 HydrophobicContact CE3-CD2 4.19Å; W2173-L2203 HydrophobicContact CE3-CG 4.35Å; W2173-L2203 HydrophobicContact CZ3-CD1 4.27Å; W2173-L2203 HydrophobicContact CZ3-CD2 4.34Å; W2173-L2203 PolarHBondContact N-O 2.93Å; W2173-L2203 PolarHBondContact O-N 2.91Å; C2175-L2203 HydrophobicContact CB-CD1 3.82Å; L2203-Q2211 WeakPolarHBondContact CA-O 3.37Å; L2203-R2214 HydrophobicContact CD1-CG 4.2Å; L2203-R2214 HydrophobicContact CD2-CG 4.2Å; L2203-R2214 HydrophobicContact CG-CG 4.01Å
2204	S	81.9	Confident	80.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.			trans	-161.4	152	-165.6	176.6	0	0	0	0	109.8	N2172 S2206 D2207 K2210 Q2211	N2172-S2204 VanDerWaalsContact CG-OG 3.26Å; N2172-S2204 PolarHBondContact ND2-OG 2.97Å; N2172-S2204 PolarHBondContact OD1-OG 2.76Å; S2204-S2206 PolarHBondContact OG-N 2.7Å; S2204-S2206 PolarHBondContact OG-OG 3.46Å; S2204-D2207 PolarHBondContact OG-N 3.35Å; S2204-D2207 VanDerWaalsContact OG-N 3.11Å; S2204-D2207 PolarHBondContact OG-OD2 3.46Å; S2204-K2210 CarbonylContact O-C 3.55Å; S2204-K2210 VanDerWaalsContact O-CA 3.28Å; S2204-K2210 WeakPolarHBondContact O-CA 3.42Å; S2204-Q2211 PolarHBondContact N-O 2.71Å; S2204-Q2211 VanDerWaalsContact N-O 3.14Å; S2204-Q2211 CarbonylContact O-C 3.27Å; S2204-Q2211 PolarHBondContact O-N 2.82Å
2205	V	73.4	Confident	80.7	Confident	39 Å²	39	40.7 Å²	40.7	24%	0.236	22%	0.215	C	C	.	.	S	Bend	trans	-85.8	-25.4	166.1	-85.7	0	0	0	0	112.7	K2210 L2212	V2205-K2210 VanDerWaalsContact O-CB 3.29Å; V2205-K2210 WeakPolarHBondContact O-CB 3.21Å; V2205-K2210 WeakPolarHBondContact O-CD 3.32Å; V2205-K2210 WeakPolarHBondContact O-CG 3.23Å; V2205-L2212 HydrophobicContact CG1-CD1 4.12Å; V2205-L2212 HydrophobicContact CG1-CD2 4.13Å; V2205-L2212 HydrophobicContact CG1-CG 4.24Å
2206	S	73.1	Confident	80.3	Confident	73 Å²	73	40.4 Å²	40.4	51%	0.51	21%	0.214	S	C	.	.	S	Bend	trans	-92.9	-23.4	-178.6	45.2	0	0	0	0	114.6	N2172 S2204	N2172-S2206 PolarHBondContact ND2-OG 3Å; S2204-S2206 PolarHBondContact OG-N 2.7Å; S2204-S2206 PolarHBondContact OG-OG 3.46Å
2207	D	73.7	Confident	80	Confident	56 Å²	56	39.7 Å²	39.7	30%	0.299	21%	0.214	S	C	.	.	S	Bend	trans	-120.4	160.6	-163.7	-51.2	-87.3	0	0	0	113.9	N2172 W2202 S2204 N2209 K2210	N2172-D2207 PolarHBondContact ND2-OD2 2.78Å; W2202-D2207 HydrophobicContact CB-CB 4.26Å; W2202-D2207 HydrophobicContact CD2-CB 4.1Å; W2202-D2207 HydrophobicContact CE3-CB 4.47Å; W2202-D2207 HydrophobicContact CG-CB 3.97Å; S2204-D2207 PolarHBondContact OG-N 3.35Å; S2204-D2207 VanDerWaalsContact OG-N 3.11Å; S2204-D2207 PolarHBondContact OG-OD2 3.46Å; D2207-N2209 PolarHBondContact O-N 2.94Å; D2207-K2210 PolarHBondContact O-N 2.68Å
2208	D	72.9	Confident	79.5	Confident	99 Å²	99	40 Å²	40	53%	0.529	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-114.8	-174	-173.8	47.3	0	0	0	112.3	W2202 R2214	W2202-D2208 HydrophobicContact CB-CB 3.96Å; W2202-D2208 HydrophobicContact CG-CB 4.44Å; D2208-R2214 IonicContact OD2-CZ 3.11Å; D2208-R2214 IonicContact OD2-NH1 2.69Å; D2208-R2214 PolarHBondContact OD2-NH1 2.83Å; D2208-R2214 IonicContact OD2-NH2 3.67Å; D2208-R2214 PolarHBondContact OD2-NH2 3.15Å
2209	N	67.3	Low	79	Confident	48 Å²	48	40.4 Å²	40.4	26%	0.257	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	15.8	179.8	74.8	-15.2	0	0	0	113.7	D2207 Q2211 R2214	D2207-N2209 PolarHBondContact O-N 2.94Å; N2209-Q2211 VanDerWaalsContact C-N 3.28Å; N2209-Q2211 PolarHBondContact ND2-OE1 3.04Å; N2209-Q2211 PolarHBondContact O-N 2.97Å; N2209-Q2211 WeakPolarHBondContact OD1-CB 3.39Å; N2209-Q2211 WeakPolarHBondContact OD1-CG 3.2Å; N2209-Q2211 PolarHBondContact OD1-N 3.46Å; N2209-R2214 PolarHBondContact ND2-NH1 3.29Å; N2209-R2214 VanDerWaalsContact ND2-NH1 3.16Å; N2209-R2214 VanDerWaalsContact OD1-CZ 3.26Å; N2209-R2214 PolarHBondContact OD1-NH1 2.81Å; N2209-R2214 PolarHBondContact OD1-NH2 3Å
2210	K	69.2	Low	78.4	Confident	102 Å²	102	41.9 Å²	41.9	44%	0.443	22%	0.223	S	C	.	.	S	Bend	trans	59.4	30.5	-179.8	-49.6	-172	-173.3	177.1	0	114.2	E528 S2204 V2205 D2207	E528-K2210 IonicContact OE1-NZ 2.74Å; E528-K2210 PolarHBondContact OE1-NZ 3.19Å; S2204-K2210 CarbonylContact O-C 3.55Å; S2204-K2210 VanDerWaalsContact O-CA 3.28Å; S2204-K2210 WeakPolarHBondContact O-CA 3.42Å; V2205-K2210 VanDerWaalsContact O-CB 3.29Å; V2205-K2210 WeakPolarHBondContact O-CB 3.21Å; V2205-K2210 WeakPolarHBondContact O-CD 3.32Å; V2205-K2210 WeakPolarHBondContact O-CG 3.23Å; D2207-K2210 PolarHBondContact O-N 2.68Å
2211	Q	70.2	Confident	77.6	Confident	37 Å²	37	38 Å²	38	17%	0.173	20%	0.202	C	C	.	.			trans	-106.3	139.1	177.8	-63.7	-167.5	-38.4	0	0	113.5	L2203 S2204 N2209 Y2465	L2203-Q2211 WeakPolarHBondContact CA-O 3.37Å; S2204-Q2211 PolarHBondContact N-O 2.71Å; S2204-Q2211 VanDerWaalsContact N-O 3.14Å; S2204-Q2211 CarbonylContact O-C 3.27Å; S2204-Q2211 PolarHBondContact O-N 2.82Å; N2209-Q2211 VanDerWaalsContact C-N 3.28Å; N2209-Q2211 PolarHBondContact ND2-OE1 3.04Å; N2209-Q2211 PolarHBondContact O-N 2.97Å; N2209-Q2211 WeakPolarHBondContact OD1-CB 3.39Å; N2209-Q2211 WeakPolarHBondContact OD1-CG 3.2Å; N2209-Q2211 PolarHBondContact OD1-N 3.46Å; Q2211-Y2465 PolarHBondContact NE2-O 3.42Å
2212	L	77.6	Confident	76.8	Confident	48 Å²	48	35.1 Å²	35.1	25%	0.251	19%	0.19	S	C	.	.	S	Bend	trans	-96.5	6	-179.9	-59	167.2	0	0	0	113.5	W2163 H2164 N2166 V2205	W2163-L2212 VanDerWaalsContact CA-O 3.22Å; W2163-L2212 WeakPolarHBondContact CA-O 3.32Å; W2163-L2212 VanDerWaalsContact CB-O 3.22Å; W2163-L2212 WeakPolarHBondContact CB-O 3.31Å; H2164-L2212 PolarHBondContact CD2-O 2.85Å; H2164-L2212 VanDerWaalsContact CE1-CD2 3.43Å; H2164-L2212 WeakPolarHBondContact CE1-CD2 3.31Å; H2164-L2212 PolarHBondContact N-O 2.8Å; H2164-L2212 WeakPolarHBondContact NE2-CD2 3.34Å; N2166-L2212 HydrophobicContact CB-CD1 3.81Å; N2166-L2212 HydrophobicContact CB-CD2 4.1Å; V2205-L2212 HydrophobicContact CG1-CD1 4.12Å; V2205-L2212 HydrophobicContact CG1-CD2 4.13Å; V2205-L2212 HydrophobicContact CG1-CG 4.24Å
2213	L	84.5	Confident	75.7	Confident	39 Å²	39	34.4 Å²	34.4	20%	0.204	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	140.7	-173.4	176.9	151.6	0	0	0	110.1	R2161 I2162 W2163	R2161-L2213 HydrophobicContact CG-CG 4.48Å; I2162-L2213 WeakPolarHBondContact O-CA 3.16Å; W2163-L2213 HydrophobicContact CB-CB 3.76Å; W2163-L2213 HydrophobicContact CB-CD1 4.13Å; W2163-L2213 HydrophobicContact CB-CG 3.99Å; W2163-L2213 HydrophobicContact CG-CD1 4.37Å
2214	R	82.4	Confident	74.5	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.015	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146	172.6	-57.5	-66.4	179.1	166.3	1.4	111.8	R2161 I2162 F2199 K2201 W2202 L2203 D2208 N2209 E2467	R2161-R2214 WeakPolarHBondContact CA-O 3.2Å; I2162-R2214 HydrophobicContact CG2-CB 4.47Å; I2162-R2214 PolarHBondContact N-O 2.98Å; I2162-R2214 PolarHBondContact O-N 3.27Å; F2199-R2214 HydrophobicContact CD1-CB 3.63Å; F2199-R2214 HydrophobicContact CD1-CG 4.46Å; F2199-R2214 HydrophobicContact CE1-CB 3.75Å; K2201-R2214 VanDerWaalsContact CD-NH1 3.26Å; W2202-R2214 PolarHBondContact O-NE 3.43Å; W2202-R2214 VanDerWaalsContact O-NE 3.13Å; W2202-R2214 PolarHBondContact O-NH2 2.98Å; L2203-R2214 HydrophobicContact CD1-CG 4.2Å; L2203-R2214 HydrophobicContact CD2-CG 4.2Å; L2203-R2214 HydrophobicContact CG-CG 4.01Å; D2208-R2214 IonicContact OD2-CZ 3.11Å; D2208-R2214 IonicContact OD2-NH1 2.69Å; D2208-R2214 PolarHBondContact OD2-NH1 2.83Å; D2208-R2214 IonicContact OD2-NH2 3.67Å; D2208-R2214 PolarHBondContact OD2-NH2 3.15Å; N2209-R2214 PolarHBondContact ND2-NH1 3.29Å; N2209-R2214 VanDerWaalsContact ND2-NH1 3.16Å; N2209-R2214 VanDerWaalsContact OD1-CZ 3.26Å; N2209-R2214 PolarHBondContact OD1-NH1 2.81Å; N2209-R2214 PolarHBondContact OD1-NH2 3Å; R2214-E2467 IonicContact CZ-OE2 3.92Å; R2214-E2467 IonicContact NH1-OE2 3.74Å; R2214-E2467 PolarHBondContact NH1-OE2 3.23Å
2215	D	81.6	Confident	73.3	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.027	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.8	161.1	-78.5	-33.2	0	0	0	109.7	R2159 C2160 R2161 S2468 I2469	R2159-D2215 IonicContact NH1-OD1 2.95Å; R2159-D2215 PolarHBondContact NH1-OD1 3.05Å; R2159-D2215 VanDerWaalsContact NH1-OD1 3.1Å; R2159-D2215 IonicContact NH1-OD2 2.89Å; R2159-D2215 PolarHBondContact NH1-OD2 3.11Å; C2160-D2215 WeakPolarHBondContact O-CA 3.35Å; R2161-D2215 IonicContact CZ-OD1 3.52Å; R2161-D2215 VanDerWaalsContact CZ-OD1 3.26Å; R2161-D2215 IonicContact CZ-OD2 2.68Å; R2161-D2215 IonicContact NE-OD1 3.56Å; R2161-D2215 PolarHBondContact NE-OD1 2.9Å; R2161-D2215 IonicContact NH2-OD1 3.7Å; R2161-D2215 PolarHBondContact NH2-OD1 3.16Å; R2161-D2215 IonicContact NH2-OD2 2.97Å; R2161-D2215 PolarHBondContact NH2-OD2 2.89Å; D2215-S2468 PolarHBondContact OD2-OG 2.76Å; D2215-I2469 HydrophobicContact CB-CD1 4.49Å; D2215-I2469 HydrophobicContact CB-CG1 4.14Å
2216	A	80.8	Confident	72.1	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.7	167.8	0	0	0	0	0	111.2	R2159 C2160 F2197 A2198 F2199	R2159-A2216 WeakPolarHBondContact CA-O 3.45Å; R2159-A2216 WeakPolarHBondContact CB-O 3.4Å; C2160-A2216 PolarHBondContact N-O 2.94Å; C2160-A2216 PolarHBondContact O-N 3.14Å; F2197-A2216 HydrophobicContact CB-CB 4.2Å; A2198-A2216 WeakPolarHBondContact O-CB 3.32Å; F2199-A2216 HydrophobicContact CD1-CB 3.75Å; F2199-A2216 HydrophobicContact CE1-CB 3.44Å; F2199-A2216 VanDerWaalsContact CE1-CB 3.44Å; F2199-A2216 HydrophobicContact CE2-CB 4.29Å; F2199-A2216 HydrophobicContact CG-CB 4.3Å; F2199-A2216 HydrophobicContact CZ-CB 3.74Å
2217	P	80.2	Confident	71.3	Confident	26 Å²	26	44.9 Å²	44.9	17%	0.169	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	160.2	167.9	31.6	-35.9	0	0	0	110.4	S2219 K2407 I2469	P2217-S2219 PolarHBondContact O-N 2.89Å; P2217-S2219 VanDerWaalsContact O-N 3.16Å; P2217-K2407 WeakPolarHBondContact CG-O 3.48Å; P2217-I2469 HydrophobicContact CB-CD1 4.19Å
2218	C	80.7	Confident	70	Confident	7 Å²	7	45 Å²	45	5%	0.047	25%	0.252	C	S	.	.			trans	-72.7	108.3	177	-162.9	0	0	0	0	111.3	A2158 K2196 F2197 E2220 V2221	A2158-C2218 WeakPolarHBondContact O-CB 3.32Å; A2158-C2218 PolarHBondContact O-N 3.3Å; K2196-C2218 CarbonylContact O-C 3.56Å; K2196-C2218 PolarHBondContact O-SG 2.94Å; K2196-C2218 VanDerWaalsContact O-SG 3.33Å; F2197-C2218 HydrophobicContact CD1-CB 4.08Å; F2197-C2218 HydrophobicContact CE1-CB 3.53Å; F2197-C2218 HydrophobicContact CZ-CB 4.23Å; C2218-E2220 PolarHBondContact SG-O 2.79Å; C2218-V2221 HydrophobicContact CB-CG2 4.43Å; C2218-V2221 WeakPolarHBondContact SG-CG2 3.29Å
2219	S	74.5	Confident	68.9	Low	55 Å²	55	46.1 Å²	46.1	39%	0.385	25%	0.254	S	S	.	.			trans	-78.1	-25	-177.6	58.1	0	0	0	0	113.6	K2196 P2217	K2196-S2219 PolarHBondContact O-N 2.95Å; K2196-S2219 PolarHBondContact O-OG 3.47Å; K2196-S2219 VanDerWaalsContact O-OG 3.06Å; P2217-S2219 PolarHBondContact O-N 2.89Å; P2217-S2219 VanDerWaalsContact O-N 3.16Å
2220	E	74.1	Confident	67.6	Low	49 Å²	49	50.6 Å²	50.6	23%	0.229	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	142	174.6	-57.2	-165.1	119.8	0	0	111.5	K140 W2195 K2196 C2218 R2230	K140-E2220 WeakPolarHBondContact CE-OE1 3.43Å; K140-E2220 IonicContact NZ-OE1 2.78Å; K140-E2220 PolarHBondContact NZ-OE1 3.49Å; K140-E2220 IonicContact NZ-OE2 3.81Å; K140-E2220 PolarHBondContact NZ-OE2 2.62Å; W2195-E2220 CarbonylContact C-O 3.4Å; W2195-E2220 WeakPolarHBondContact CA-O 3.35Å; K2196-E2220 HydrophobicContact CB-CB 4.15Å; K2196-E2220 PolarHBondContact N-O 2.8Å; K2196-E2220 PolarHBondContact O-N 3.17Å; C2218-E2220 PolarHBondContact SG-O 2.79Å; E2220-R2230 IonicContact OE2-NH2 2.88Å
2221	V	72.1	Confident	66.4	Low	4 Å²	4	46.9 Å²	46.9	2%	0.024	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.4	167.1	-176.3	0	0	0	0	110.7	K140 Y171 N2194 W2195 C2218	K140-V2221 WeakPolarHBondContact CD-O 3.49Å; Y171-V2221 HydrophobicContact CE1-CB 3.57Å; Y171-V2221 HydrophobicContact CE1-CG2 4.03Å; Y171-V2221 WeakPolarHBondContact CE1-O 3.35Å; Y171-V2221 WeakPolarHBondContact OH-CB 3.16Å; Y171-V2221 PolarHBondContact OH-O 3.1Å; N2194-V2221 CarbonylContact O-C 3.6Å; N2194-V2221 VanDerWaalsContact O-CA 3.24Å; N2194-V2221 WeakPolarHBondContact O-CA 3.16Å; N2194-V2221 WeakPolarHBondContact O-CG1 3.19Å; W2195-V2221 HydrophobicContact CG-CG1 4.23Å; W2195-V2221 HydrophobicContact CG-CG2 4.23Å; C2218-V2221 HydrophobicContact CB-CG2 4.43Å; C2218-V2221 WeakPolarHBondContact SG-CG2 3.29Å
2222	Y	69.3	Low	65.1	Low	4 Å²	4	47.7 Å²	47.7	2%	0.016	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.5	177.3	47.3	-82.8	0	0	0	113.2	E2179 C2193 N2194 R2230	E2179-Y2222 PolarHBondContact OE1-OH 2.7Å; E2179-Y2222 PolarHBondContact OE2-OH 2.67Å; C2193-Y2222 CarbonylContact C-O 3.59Å; N2194-Y2222 WeakPolarHBondContact CA-O 3.23Å; N2194-Y2222 HydrophobicContact CB-CD2 3.66Å; N2194-Y2222 HydrophobicContact CB-CE2 3.55Å; N2194-Y2222 HydrophobicContact CB-CG 4.21Å; N2194-Y2222 WeakPolarHBondContact CB-O 3.39Å; N2194-Y2222 PolarHBondContact N-O 3.12Å; N2194-Y2222 PolarHBondContact ND2-O 2.71Å; N2194-Y2222 PolarHBondContact O-N 2.83Å; Y2222-R2230 HydrophobicContact CD2-CG 3.71Å; Y2222-R2230 VanDerWaalsContact CE1-NH2 3.29Å; Y2222-R2230 HydrophobicContact CE2-CG 3.92Å; Y2222-R2230 VanDerWaalsContact CE2-NE 3.32Å; Y2222-R2230 HydrophobicContact CG-CG 4.49Å; Y2222-R2230 PolarHBondContact OH-NH2 3.33Å
2223	M	63.1	Low	63.4	Low	26 Å²	26	45.5 Å²	45.5	13%	0.128	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	149.9	173.1	-62.3	-171.1	-162.1	0	0	110.6	L2191 A2192 T2231	L2191-M2223 HydrophobicContact CB-CB 4.14Å; L2191-M2223 HydrophobicContact CB-CG 4.36Å; L2191-M2223 HydrophobicContact CB-SD 3.57Å; L2191-M2223 VanDerWaalsContact CB-SD 3.57Å; L2191-M2223 HydrophobicContact CD1-SD 3.77Å; L2191-M2223 HydrophobicContact CG-SD 4.32Å; A2192-M2223 CarbonylContact O-C 3.26Å; A2192-M2223 WeakPolarHBondContact O-CA 3.16Å; M2223-T2231 CarbonylContact O-C 3.6Å; M2223-T2231 PolarHBondContact O-N 2.64Å
2224	N	60.9	Low	61.2	Low	21 Å²	21	45.3 Å²	45.3	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.7	168.9	-69.5	-20.4	0	0	0	108.7	A2192 N2194 H2229 R2230	A2192-N2224 PolarHBondContact N-O 2.89Å; A2192-N2224 PolarHBondContact O-N 2.82Å; N2194-N2224 PolarHBondContact ND2-N 2.89Å; N2194-N2224 PolarHBondContact ND2-ND2 3.12Å; N2194-N2224 PolarHBondContact OD1-ND2 2.99Å; N2224-H2229 VanDerWaalsContact CA-O 3.32Å; N2224-H2229 WeakPolarHBondContact CA-O 3.43Å; N2224-H2229 PolarHBondContact OD1-O 3.41Å; N2224-R2230 WeakPolarHBondContact OD1-CA 3.43Å
2225	D	57.1	Low	59.1	Low	45 Å²	45	45.1 Å²	45.1	24%	0.241	24%	0.244	C	C	.	.			trans	-85.6	177.7	172.7	71	-3.5	0	0	0	110.7	L2191 K2227 G2228 H2229 T2231	L2191-D2225 HydrophobicContact CD2-CB 4.41Å; D2225-K2227 PolarHBondContact O-N 3.27Å; D2225-K2227 VanDerWaalsContact OD1-CA 3.31Å; D2225-K2227 WeakPolarHBondContact OD1-CA 3.45Å; D2225-K2227 WeakPolarHBondContact OD1-CB 3.4Å; D2225-K2227 PolarHBondContact OD1-N 3.49Å; D2225-G2228 PolarHBondContact O-N 3.07Å; D2225-G2228 PolarHBondContact OD1-N 2.79Å; D2225-H2229 PolarHBondContact N-O 3.49Å; D2225-H2229 PolarHBondContact OD1-N 3Å; D2225-T2231 HydrophobicContact CB-CG2 4.1Å; D2225-T2231 PolarHBondContact N-OG1 2.74Å
2226	S	48.8	Very low	57	Low	101 Å²	101	44.9 Å²	44.9	71%	0.706	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	6.6	175	63.7	0	0	0	0	114.1
2227	K	55.3	Low	55	Low	166 Å²	166	46.9 Å²	46.9	72%	0.722	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	15	173.7	-62.4	-173.6	177.3	-175.9	0	112.1	D2225 H2229	D2225-K2227 PolarHBondContact O-N 3.27Å; D2225-K2227 VanDerWaalsContact OD1-CA 3.31Å; D2225-K2227 WeakPolarHBondContact OD1-CA 3.45Å; D2225-K2227 WeakPolarHBondContact OD1-CB 3.4Å; D2225-K2227 PolarHBondContact OD1-N 3.49Å; K2227-H2229 PolarHBondContact O-N 2.81Å; K2227-H2229 VanDerWaalsContact O-N 3.12Å; K2227-H2229 PolarHBondContact O-ND1 3.1Å; K2227-H2229 VanDerWaalsContact O-ND1 3.08Å
2228	G	47.5	Very low	52.9	Low	58 Å²	58	49.3 Å²	49.3	60%	0.598	26%	0.262	S	S	*	.			trans	66.3	10.4	176.1	0	0	0	0	0	115	D2225	D2225-G2228 PolarHBondContact O-N 3.07Å; D2225-G2228 PolarHBondContact OD1-N 2.79Å
2229	H	48.8	Very low	50.8	Low	123 Å²	123	49 Å²	49	57%	0.569	26%	0.26	S	S	*	.			trans	-75.2	134.5	176.1	-77.4	58.5	0	0	0	109.1	N2224 D2225 K2227 T2231	N2224-H2229 VanDerWaalsContact CA-O 3.32Å; N2224-H2229 WeakPolarHBondContact CA-O 3.43Å; N2224-H2229 PolarHBondContact OD1-O 3.41Å; D2225-H2229 PolarHBondContact N-O 3.49Å; D2225-H2229 PolarHBondContact OD1-N 3Å; K2227-H2229 PolarHBondContact O-N 2.81Å; K2227-H2229 VanDerWaalsContact O-N 3.12Å; K2227-H2229 PolarHBondContact O-ND1 3.1Å; K2227-H2229 VanDerWaalsContact O-ND1 3.08Å; H2229-T2231 VanDerWaalsContact C-N 3.26Å; H2229-T2231 HydrophobicContact CB-CG2 3.83Å; H2229-T2231 WeakPolarHBondContact O-CG2 3.44Å; H2229-T2231 PolarHBondContact O-N 2.78Å; H2229-T2231 PolarHBondContact O-OG1 3.01Å; H2229-T2231 VanDerWaalsContact O-OG1 3.1Å
2230	R	41.9	Very low	48.9	Very low	141 Å²	141	48.9 Å²	48.9	53%	0.532	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	94.8	168.5	-110.3	-177.1	178.5	-174.9	-1.2	107.4	E2220 Y2222 N2224	E2220-R2230 IonicContact OE2-NH2 2.88Å; Y2222-R2230 HydrophobicContact CD2-CG 3.71Å; Y2222-R2230 VanDerWaalsContact CE1-NH2 3.29Å; Y2222-R2230 HydrophobicContact CE2-CG 3.92Å; Y2222-R2230 VanDerWaalsContact CE2-NE 3.32Å; Y2222-R2230 HydrophobicContact CG-CG 4.49Å; Y2222-R2230 PolarHBondContact OH-NH2 3.33Å; N2224-R2230 WeakPolarHBondContact OD1-CA 3.43Å
2231	T	43.5	Very low	47	Very low	25 Å²	25	48.9 Å²	48.9	15%	0.153	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	-158.5	-174.8	51.8	0	0	0	0	107	M2223 D2225 H2229 D2233	M2223-T2231 CarbonylContact O-C 3.6Å; M2223-T2231 PolarHBondContact O-N 2.64Å; D2225-T2231 HydrophobicContact CB-CG2 4.1Å; D2225-T2231 PolarHBondContact N-OG1 2.74Å; H2229-T2231 VanDerWaalsContact C-N 3.26Å; H2229-T2231 HydrophobicContact CB-CG2 3.83Å; H2229-T2231 WeakPolarHBondContact O-CG2 3.44Å; H2229-T2231 PolarHBondContact O-N 2.78Å; H2229-T2231 PolarHBondContact O-OG1 3.01Å; H2229-T2231 VanDerWaalsContact O-OG1 3.1Å; T2231-D2233 WeakPolarHBondContact O-CB 3.43Å; T2231-D2233 PolarHBondContact O-N 3.08Å; T2231-D2233 VanDerWaalsContact O-OD1 3.07Å
2232	I	42.4	Very low	45.3	Very low	53 Å²	53	50.9 Å²	50.9	27%	0.272	27%	0.268	S	S	.	.			trans	-102.1	58.8	-130	-24.4	-174.7	0	0	0	108.3	R139 D142	R139-I2232 VanDerWaalsContact CB-C 3.47Å; R139-I2232 HydrophobicContact CB-CB 4.06Å; R139-I2232 HydrophobicContact CB-CG2 3.41Å; R139-I2232 VanDerWaalsContact CB-CG2 3.41Å; R139-I2232 VanDerWaalsContact CB-O 3.25Å; R139-I2232 WeakPolarHBondContact CB-O 3.39Å; R139-I2232 VanDerWaalsContact CD-CG2 3.45Å; R139-I2232 WeakPolarHBondContact CD-O 3.26Å; R139-I2232 HydrophobicContact CG-CB 4.3Å; R139-I2232 HydrophobicContact CG-CG2 3.98Å; R139-I2232 WeakPolarHBondContact CG-O 3.48Å; R139-I2232 PolarHBondContact NH1-O 2.99Å; D142-I2232 HydrophobicContact CB-CG2 3.95Å; D142-I2232 VanDerWaalsContact OD2-CG2 3.3Å; D142-I2232 WeakPolarHBondContact OD2-CG2 3.39Å
2233	D	41.3	Very low	43.7	Very low	2 Å²	2	51.2 Å²	51.2	1%	0.011	27%	0.27	C	S	.	.			trans	22.2	-148.6	132	41.3	-159.9	0	0	0	124.1	R139 K140 S141 T2231	R139-D2233 WeakPolarHBondContact CA-O 3.29Å; K140-D2233 VanDerWaalsContact C-CG 3.49Å; K140-D2233 VanDerWaalsContact C-OD1 3.28Å; K140-D2233 WeakPolarHBondContact CA-OD1 3.41Å; K140-D2233 WeakPolarHBondContact CA-OD2 3.41Å; K140-D2233 HydrophobicContact CB-CB 3.45Å; K140-D2233 VanDerWaalsContact CB-CB 3.45Å; K140-D2233 VanDerWaalsContact CB-OD1 3.27Å; K140-D2233 WeakPolarHBondContact CB-OD1 3.3Å; K140-D2233 VanDerWaalsContact N-CB 3.3Å; K140-D2233 PolarHBondContact N-OD2 3Å; S141-D2233 WeakPolarHBondContact CB-OD1 3.48Å; S141-D2233 PolarHBondContact N-OD1 2.72Å; S141-D2233 PolarHBondContact N-OD2 3.28Å; S141-D2233 PolarHBondContact OG-OD1 3.12Å; S141-D2233 PolarHBondContact OG-OD2 2.9Å; T2231-D2233 WeakPolarHBondContact O-CB 3.43Å; T2231-D2233 PolarHBondContact O-N 3.08Å; T2231-D2233 VanDerWaalsContact O-OD1 3.07Å
2234	Q	38.4	Very low	42.3	Very low	36 Å²	36	52 Å²	52	17%	0.168	28%	0.281	C	S	.	.	S	Bend	trans	-127.1	12.4	178.9	-125.2	-169.6	-0.6	0	0	126.3	L138 Y171	L138-Q2234 CarbonylContact C-O 3.54Å; L138-Q2234 VanDerWaalsContact CA-C 3.48Å; L138-Q2234 WeakPolarHBondContact CA-O 3.43Å; L138-Q2234 HydrophobicContact CB-CG 4.35Å; L138-Q2234 WeakPolarHBondContact CB-O 3.4Å; L138-Q2234 CarbonylContact O-C 3.5Å; L138-Q2234 WeakPolarHBondContact O-CA 3.31Å; Y171-Q2234 HydrophobicContact CE2-CB 3.64Å; Y171-Q2234 WeakPolarHBondContact OH-CB 3.46Å; Y171-Q2234 PolarHBondContact OH-OE1 3.11Å
2235	E	38.8	Very low	40.9	Very low	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-101	84	154.8	-136.3	-116.2	-62.4	0	0	125.6	H135 S137 L138 R139 S143 S169 L170 I177	H135-E2235 IonicContact CE1-OE2 3.31Å; H135-E2235 PolarHBondContact CE1-OE2 3.27Å; H135-E2235 IonicContact ND1-OE2 3.26Å; H135-E2235 PolarHBondContact ND1-OE2 3.04Å; S137-E2235 VanDerWaalsContact C-CG 3.47Å; S137-E2235 WeakPolarHBondContact CB-OE2 3.47Å; S137-E2235 WeakPolarHBondContact O-CG 3.41Å; L138-E2235 VanDerWaalsContact C-C 3.45Å; L138-E2235 VanDerWaalsContact C-CA 3.44Å; L138-E2235 HydrophobicContact CD2-CG 4.19Å; R139-E2235 CarbonylContact C-O 3.54Å; R139-E2235 VanDerWaalsContact CA-C 3.42Å; R139-E2235 PolarHBondContact N-O 2.9Å; R139-E2235 CarbonylContact O-C 3.59Å; S143-E2235 PolarHBondContact OG-O 3.23Å; S143-E2235 VanDerWaalsContact OG-O 3.06Å; S169-E2235 WeakPolarHBondContact CA-OE1 3.46Å; S169-E2235 PolarHBondContact N-OE1 3.15Å; L170-E2235 HydrophobicContact CB-CB 3.83Å; L170-E2235 HydrophobicContact CB-CG 4.32Å; L170-E2235 HydrophobicContact CD1-CB 4.48Å; L170-E2235 HydrophobicContact CD1-CG 4.43Å; L170-E2235 HydrophobicContact CG-CB 3.8Å; L170-E2235 HydrophobicContact CG-CG 3.75Å; L170-E2235 PolarHBondContact N-OE1 2.93Å; I177-E2235 WeakPolarHBondContact CA-OE1 3.21Å; I177-E2235 WeakPolarHBondContact CA-OE2 3.47Å; I177-E2235 HydrophobicContact CG1-CG 4.3Å; I177-E2235 VanDerWaalsContact CG2-CD 3.43Å; I177-E2235 HydrophobicContact CG2-CG 4.1Å; I177-E2235 WeakPolarHBondContact CG2-OE2 3.35Å
2236	S	38.5	Very low	39.7	Very low	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	107.2	27.4	-137	70	0	0	0	0	130.6	S137 L138 R139 D142 T2239	S137-S2236 VanDerWaalsContact CA-CA 3.42Å; S137-S2236 VanDerWaalsContact CA-N 3.32Å; S137-S2236 WeakPolarHBondContact OG-CA 3.29Å; S137-S2236 WeakPolarHBondContact OG-CB 3.47Å; S137-S2236 PolarHBondContact OG-N 2.95Å; L138-S2236 VanDerWaalsContact C-CA 3.42Å; R139-S2236 WeakPolarHBondContact CA-OG 3.3Å; R139-S2236 WeakPolarHBondContact CB-OG 3.21Å; R139-S2236 WeakPolarHBondContact CD-O 3.25Å; R139-S2236 VanDerWaalsContact CG-C 3.45Å; R139-S2236 WeakPolarHBondContact CG-O 3.29Å; R139-S2236 PolarHBondContact N-OG 3.32Å; R139-S2236 PolarHBondContact O-OG 3.49Å; D142-S2236 WeakPolarHBondContact CB-OG 3.38Å; S2236-T2239 WeakPolarHBondContact CA-OG1 3.48Å; S2236-T2239 WeakPolarHBondContact O-CB 3.45Å
2237	I	36.9	Very low	38.7	Very low	43 Å²	43	57.5 Å²	57.5	22%	0.221	30%	0.302	C	S	.	.	S	Bend	trans	-100.5	-51.3	169.6	-96.4	170.3	0	0	0	109.1	L138 R139 T2239 L2240 L2241	L138-I2237 HydrophobicContact CB-CB 3.78Å; L138-I2237 HydrophobicContact CB-CG2 4.41Å; L138-I2237 WeakPolarHBondContact O-CB 3.42Å; L138-I2237 WeakPolarHBondContact O-CG1 3.38Å; L138-I2237 PolarHBondContact O-N 3.38Å; R139-I2237 HydrophobicContact CG-CB 4.1Å; R139-I2237 HydrophobicContact CG-CD1 4.36Å; R139-I2237 HydrophobicContact CG-CG1 3.51Å; I2237-T2239 CarbonylContact O-C 3.57Å; I2237-T2239 PolarHBondContact O-N 3.21Å; I2237-L2240 WeakPolarHBondContact O-CA 3.22Å; I2237-L2240 PolarHBondContact O-N 2.86Å; I2237-L2241 HydrophobicContact CG2-CD1 3.48Å; I2237-L2241 VanDerWaalsContact CG2-CD1 3.48Å; I2237-L2241 HydrophobicContact CG2-CG 4.4Å; I2237-L2241 WeakPolarHBondContact O-CG 3.21Å; I2237-L2241 PolarHBondContact O-N 2.85Å
2238	E	37.3	Very low	37.7	Very low	77 Å²	77	55.9 Å²	55.9	36%	0.36	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-15.7	175.1	-76.1	171.9	179.4	0	0	109.6	D136 L138 L2241 T2242	D136-E2238 CarbonylContact O-C 3.5Å; L138-E2238 HydrophobicContact CB-CB 4.39Å; L138-E2238 HydrophobicContact CB-CG 4.39Å; L138-E2238 HydrophobicContact CD1-CB 4.37Å; L138-E2238 HydrophobicContact CD1-CG 3.64Å; L138-E2238 VanDerWaalsContact CD1-OE1 3.31Å; L138-E2238 WeakPolarHBondContact CD1-OE1 3.42Å; L138-E2238 WeakPolarHBondContact CD1-OE2 3.35Å; L138-E2238 HydrophobicContact CG-CB 3.96Å; L138-E2238 HydrophobicContact CG-CG 3.81Å; E2238-L2241 HydrophobicContact CG-CD1 4.3Å; E2238-L2241 PolarHBondContact O-N 2.9Å; E2238-T2242 WeakPolarHBondContact O-CB 3.43Å; E2238-T2242 WeakPolarHBondContact O-CG2 3.36Å; E2238-T2242 PolarHBondContact O-N 3.47Å; E2238-T2242 PolarHBondContact O-OG1 2.66Å
2239	T	36.5	Very low	36.8	Very low	1 Å²	1	60.6 Å²	60.6	1%	0.006	31%	0.311	C	S	.	.	H	α-helix	trans	-49.5	-66.8	159.7	-78.6	0	0	0	0	109.8	A78 D136 S137 S2236 I2237 L2241 T2242 T2243	A78-T2239 HydrophobicContact CB-CG2 4.34Å; D136-T2239 PolarHBondContact N-OG1 2.95Å; D136-T2239 WeakPolarHBondContact O-CA 3.3Å; D136-T2239 PolarHBondContact O-N 3.13Å; D136-T2239 WeakPolarHBondContact OD1-CB 3.22Å; D136-T2239 VanDerWaalsContact OD1-CG2 3.29Å; D136-T2239 WeakPolarHBondContact OD1-CG2 3.5Å; D136-T2239 PolarHBondContact OD1-OG1 2.99Å; D136-T2239 WeakPolarHBondContact OD2-CA 3.45Å; D136-T2239 VanDerWaalsContact OD2-CB 3.3Å; D136-T2239 WeakPolarHBondContact OD2-CB 3.22Å; D136-T2239 WeakPolarHBondContact OD2-CG2 3.4Å; D136-T2239 PolarHBondContact OD2-OG1 2.81Å; S137-T2239 VanDerWaalsContact CA-OG1 3.25Å; S137-T2239 WeakPolarHBondContact CA-OG1 3.26Å; S137-T2239 PolarHBondContact OG-OG1 2.87Å; S2236-T2239 WeakPolarHBondContact CA-OG1 3.48Å; S2236-T2239 WeakPolarHBondContact O-CB 3.45Å; I2237-T2239 CarbonylContact O-C 3.57Å; I2237-T2239 PolarHBondContact O-N 3.21Å; T2239-L2241 PolarHBondContact O-N 2.9Å; T2239-T2242 CarbonylContact O-C 3.56Å; T2239-T2242 PolarHBondContact O-N 3.26Å; T2239-T2242 VanDerWaalsContact O-N 3.12Å; T2239-T2243 WeakPolarHBondContact O-CB 3.48Å; T2239-T2243 PolarHBondContact O-N 3.48Å; T2239-T2243 PolarHBondContact O-OG1 2.97Å
2240	L	35.2	Very low	35.9	Very low	51 Å²	51	58.2 Å²	58.2	27%	0.267	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-4.2	-170.1	-64.5	168.7	0	0	0	112.8	R107 I2237	R107-L2240 VanDerWaalsContact NH1-CD2 3.34Å; I2237-L2240 WeakPolarHBondContact O-CA 3.22Å; I2237-L2240 PolarHBondContact O-N 2.86Å
2241	L	33.6	Very low	35.4	Very low	49 Å²	49	57.8 Å²	57.8	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-107.1	-37.3	177.8	-59.5	163.3	0	0	0	111.3	I2237 E2238 T2239 V2360	I2237-L2241 HydrophobicContact CG2-CD1 3.48Å; I2237-L2241 VanDerWaalsContact CG2-CD1 3.48Å; I2237-L2241 HydrophobicContact CG2-CG 4.4Å; I2237-L2241 WeakPolarHBondContact O-CG 3.21Å; I2237-L2241 PolarHBondContact O-N 2.85Å; E2238-L2241 HydrophobicContact CG-CD1 4.3Å; E2238-L2241 PolarHBondContact O-N 2.9Å; T2239-L2241 PolarHBondContact O-N 2.9Å; L2241-V2360 HydrophobicContact CB-CG1 4.02Å; L2241-V2360 HydrophobicContact CD1-CG1 3.38Å; L2241-V2360 HydrophobicContact CD2-CB 4.41Å; L2241-V2360 HydrophobicContact CD2-CG1 3.56Å; L2241-V2360 HydrophobicContact CD2-CG2 3.93Å; L2241-V2360 HydrophobicContact CG-CG1 3.81Å
2242	T	35.3	Very low	35	Very low	47 Å²	47	61.2 Å²	61.2	29%	0.288	33%	0.334	S	S	.	.	H	α-helix	trans	-88.4	-0.6	173.8	63	0	0	0	0	114.1	Y81 D136 E2238 T2239	Y81-T2242 PolarHBondContact OH-O 2.98Å; D136-T2242 PolarHBondContact O-OG1 3.06Å; E2238-T2242 WeakPolarHBondContact O-CB 3.43Å; E2238-T2242 WeakPolarHBondContact O-CG2 3.36Å; E2238-T2242 PolarHBondContact O-N 3.47Å; E2238-T2242 PolarHBondContact O-OG1 2.66Å; T2239-T2242 CarbonylContact O-C 3.56Å; T2239-T2242 PolarHBondContact O-N 3.26Å; T2239-T2242 VanDerWaalsContact O-N 3.12Å
2243	T	35.7	Very low	34.4	Very low	11 Å²	11	67.7 Å²	67.7	7%	0.067	36%	0.36	C	S	.	.	S	Bend	trans	-104.3	-2.4	174	41.7	0	0	0	0	116.3	Q79 Y81 K95 D136 T2239 D2245 S2246	Q79-T2243 HydrophobicContact CB-CG2 3.85Å; Y81-T2243 HydrophobicContact CE2-CG2 3.55Å; Y81-T2243 WeakPolarHBondContact OH-CG2 3.37Å; K95-T2243 HydrophobicContact CD-CG2 4.16Å; K95-T2243 VanDerWaalsContact NZ-CB 3.25Å; K95-T2243 PolarHBondContact NZ-O 3.38Å; D136-T2243 WeakPolarHBondContact OD2-CG2 3.49Å; T2239-T2243 WeakPolarHBondContact O-CB 3.48Å; T2239-T2243 PolarHBondContact O-N 3.48Å; T2239-T2243 PolarHBondContact O-OG1 2.97Å; T2243-D2245 PolarHBondContact O-N 3.32Å; T2243-S2246 PolarHBondContact O-OG 3.34Å
2244	A	33.6	Very low	33.9	Very low	43 Å²	43	75.1 Å²	75.1	36%	0.355	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-55.9	-32.9	173.1	0	0	0	0	0	112.1	S2246 P2319	A2244-S2246 PolarHBondContact O-N 3.11Å; A2244-P2319 HydrophobicContact CB-CB 4.38Å; A2244-P2319 HydrophobicContact CB-CG 3.82Å
2245	D	32.5	Very low	33.6	Very low	83 Å²	83	79.5 Å²	79.5	44%	0.444	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-72.5	24.5	-171.5	-35.4	-43.1	0	0	0	114.2	T2243 H2288	T2243-D2245 PolarHBondContact O-N 3.32Å; D2245-H2288 IonicContact OD1-CE1 2.62Å; D2245-H2288 IonicContact OD1-CG 3.42Å; D2245-H2288 IonicContact OD1-ND1 2.68Å; D2245-H2288 PolarHBondContact OD1-ND1 2.88Å; D2245-H2288 IonicContact OD2-CE1 3.5Å; D2245-H2288 PolarHBondContact OD2-CE1 3.14Å; D2245-H2288 IonicContact OD2-CG 2.74Å; D2245-H2288 IonicContact OD2-ND1 3.39Å; D2245-H2288 PolarHBondContact OD2-ND1 3Å; D2245-H2288 IonicContact OD2-NE2 3.84Å
2246	S	31	Very low	33.2	Very low	37 Å²	37	84.9 Å²	84.9	26%	0.259	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-148.9	21.6	-172	69.6	0	0	0	0	114.4	K95 R97 T2243 A2244	K95-S2246 PolarHBondContact NZ-OG 2.77Å; R97-S2246 PolarHBondContact NH2-O 3.31Å; R97-S2246 PolarHBondContact NH2-OG 2.88Å; T2243-S2246 PolarHBondContact O-OG 3.34Å; A2244-S2246 PolarHBondContact O-N 3.11Å
2247	M	29.5	Very low	33.5	Very low	162 Å²	162	93.4 Å²	93.4	80%	0.798	50%	0.499	S	S	*	.			trans	-97.7	140.5	160.9	-90.2	-177.9	157.3	0	0	110.6
2248	N	32.7	Very low	33.8	Very low	131 Å²	131	93.8 Å²	93.8	70%	0.701	51%	0.513	S	S	*	.			trans	-85.6	150.4	178.5	-144.6	-7.6	0	0	0	109.7	S2250	N2248-S2250 PolarHBondContact O-N 3.48Å
2249	I	28.6	Very low	34.4	Very low	157 Å²	157	95.3 Å²	95.3	81%	0.805	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-1.1	-169.2	-73.2	171.3	0	0	0	113.7
2250	S	30.6	Very low	35.7	Very low	74 Å²	74	97.6 Å²	97.6	52%	0.517	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-34	179.7	48.8	0	0	0	0	115.3	N2248	N2248-S2250 PolarHBondContact O-N 3.48Å
2251	D	31.9	Very low	37.6	Very low	131 Å²	131	98.2 Å²	98.2	70%	0.701	54%	0.536	S	S	*	.	S	Bend	trans	-97.8	2.5	-157.8	-63.5	10.7	0	0	0	113.8	K2253	D2251-K2253 VanDerWaalsContact C-N 3.35Å; D2251-K2253 PolarHBondContact O-N 2.95Å
2252	L	34.6	Very low	39.9	Very low	98 Å²	98	96 Å²	96	51%	0.513	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-87.4	10.8	-177	-91.4	167.6	0	0	0	114.8	F2318	L2252-F2318 HydrophobicContact CD1-CE1 3.9Å; L2252-F2318 HydrophobicContact CD1-CZ 4.05Å
2253	K	30.7	Very low	42.3	Very low	189 Å²	189	96.7 Å²	96.7	82%	0.822	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-76.9	-21.5	-173.8	-78.6	-171.4	170.7	-175.8	0	115.7	D2251	D2251-K2253 VanDerWaalsContact C-N 3.35Å; D2251-K2253 PolarHBondContact O-N 2.95Å
2254	D	30.3	Very low	44.8	Very low	157 Å²	157	96.2 Å²	96.2	84%	0.84	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-118.2	22.6	-167.6	-63.3	-34.8	0	0	0	115.3
2255	N	31.5	Very low	47.4	Very low	129 Å²	129	95.6 Å²	95.6	69%	0.69	51%	0.513	S	S	*	.			trans	-155.5	126.8	170.6	-153.5	-12	0	0	0	114
2256	P	31.4	Very low	50.1	Low	113 Å²	113	91.7 Å²	91.7	73%	0.734	49%	0.492	S	S	*	.	S	Bend	trans	-84.6	-25.6	-162	-16.2	33.2	0	0	0	118.5	G2258	P2256-G2258 PolarHBondContact O-N 2.79Å
2257	E	43.3	Very low	52.9	Low	179 Å²	179	91.7 Å²	91.7	84%	0.836	49%	0.488	S	S	*	.			trans	-100.5	26.8	-159.5	-60.2	-164.8	139.9	0	0	115.9	K2259	E2257-K2259 VanDerWaalsContact C-N 3.29Å; E2257-K2259 PolarHBondContact O-N 3.41Å; E2257-K2259 VanDerWaalsContact O-N 3.12Å
2258	G	43.7	Very low	55.6	Low	50 Å²	50	84.1 Å²	84.1	52%	0.515	45%	0.451	S	S	.	.			trans	-78.8	21.3	-174.1	0	0	0	0	0	117.7	P2256	P2256-G2258 PolarHBondContact O-N 2.79Å
2259	K	50.9	Low	57.9	Low	110 Å²	110	77.9 Å²	77.9	48%	0.478	42%	0.418	S	S	.	.			trans	-110.5	132.1	-169.9	-61.3	-178.4	-175.2	178.4	0	113	E2257 P2316 S2317	E2257-K2259 VanDerWaalsContact C-N 3.29Å; E2257-K2259 PolarHBondContact O-N 3.41Å; E2257-K2259 VanDerWaalsContact O-N 3.12Å; K2259-P2316 HydrophobicContact CB-CB 3.88Å; K2259-P2316 HydrophobicContact CD-CB 3.66Å; K2259-P2316 HydrophobicContact CG-CB 4.41Å; K2259-S2317 CarbonylContact C-O 3.5Å; K2259-S2317 WeakPolarHBondContact CA-O 3.41Å
2260	L	63	Low	60.3	Low	49 Å²	49	75.3 Å²	75.3	26%	0.257	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	142.8	165	-72.1	172.2	0	0	0	110	Y2262 P2316 S2317 P2319 P2359 V2360	L2260-Y2262 HydrophobicContact CB-CE2 4.28Å; L2260-P2316 CarbonylContact O-C 2.97Å; L2260-P2316 WeakPolarHBondContact O-CA 3.43Å; L2260-S2317 PolarHBondContact N-O 2.93Å; L2260-S2317 PolarHBondContact O-N 2.85Å; L2260-S2317 VanDerWaalsContact O-O 3.05Å; L2260-P2319 HydrophobicContact CD1-CB 3.83Å; L2260-P2319 HydrophobicContact CD1-CG 3.63Å; L2260-P2319 HydrophobicContact CG-CG 4.49Å; L2260-P2359 HydrophobicContact CB-CG 4.24Å; L2260-P2359 HydrophobicContact CD2-CG 4.4Å; L2260-V2360 HydrophobicContact CD1-CG2 3.4Å; L2260-V2360 HydrophobicContact CD2-CG2 4.07Å; L2260-V2360 HydrophobicContact CG-CG2 4.38Å
2261	V	76.1	Confident	62.4	Low	64 Å²	64	75.7 Å²	75.7	39%	0.388	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	108.8	-179.2	-162	0	0	0	0	109.8	Q2314 P2359	V2261-Q2314 HydrophobicContact CG1-CB 3.64Å; V2261-Q2314 HydrophobicContact CG1-CG 4.31Å; V2261-P2359 WeakPolarHBondContact O-CG 3.48Å
2262	Y	81.8	Confident	64.3	Low	2 Å²	2	77.4 Å²	77.4	1%	0.008	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.7	174.4	-71.9	-95.1	0	0	0	109.7	L2260 V2264 L2284 L2315 L2320 I2356 D2358	L2260-Y2262 HydrophobicContact CB-CE2 4.28Å; Y2262-V2264 PolarHBondContact O-N 3.29Å; Y2262-L2284 HydrophobicContact CG-CD1 4.27Å; Y2262-L2315 PolarHBondContact N-O 3.45Å; Y2262-L2315 PolarHBondContact O-N 2.82Å; Y2262-L2320 HydrophobicContact CE2-CD1 4.19Å; Y2262-L2320 HydrophobicContact CE2-CG 4.22Å; Y2262-L2320 PolarHBondContact OH-N 2.88Å; Y2262-L2320 VanDerWaalsContact OH-N 3.08Å; Y2262-I2356 HydrophobicContact CD1-CG2 4.13Å; Y2262-D2358 HydrophobicContact CD1-CB 4.38Å; Y2262-D2358 HydrophobicContact CE1-CB 3.95Å; Y2262-D2358 WeakPolarHBondContact CE1-OD1 3.04Å
2263	E	85.9	Confident	66.2	Low	62 Å²	62	77.8 Å²	77.8	29%	0.29	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	110.3	176.5	-178.1	-172.1	148.4	0	0	107.9	T2312 I2356 K2357	E2263-T2312 HydrophobicContact CG-CG2 4.02Å; E2263-I2356 WeakPolarHBondContact O-CA 3.48Å; E2263-K2357 HydrophobicContact CB-CB 4.28Å; E2263-K2357 HydrophobicContact CB-CD 4.44Å; E2263-K2357 PolarHBondContact N-O 3.23Å; E2263-K2357 PolarHBondContact O-N 2.91Å; E2263-K2357 IonicContact OE1-NZ 2.73Å; E2263-K2357 VanDerWaalsContact OE2-CD 3.23Å; E2263-K2357 WeakPolarHBondContact OE2-CD 3.3Å; E2263-K2357 IonicContact OE2-NZ 2.61Å; E2263-K2357 PolarHBondContact OE2-NZ 2.92Å
2264	V	88.3	Confident	68.6	Low	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.9	-173.9	-179.6	0	0	0	0	109.1	Y2262 I2266 I2282 L2284 F2313 L2315 V2354 I2356	Y2262-V2264 PolarHBondContact O-N 3.29Å; V2264-I2266 HydrophobicContact CG1-CD1 4.33Å; V2264-I2266 HydrophobicContact CG1-CG1 4.01Å; V2264-I2282 HydrophobicContact CG1-CD1 4.23Å; V2264-L2284 HydrophobicContact CG2-CD1 4.47Å; V2264-F2313 PolarHBondContact N-O 2.99Å; V2264-F2313 PolarHBondContact O-N 2.82Å; V2264-L2315 HydrophobicContact CG2-CB 4.05Å; V2264-L2315 HydrophobicContact CG2-CD2 4.39Å; V2264-V2354 HydrophobicContact CG1-CG1 3.88Å; V2264-I2356 HydrophobicContact CG1-CG1 4.39Å; V2264-I2356 HydrophobicContact CG2-CD1 4.44Å; V2264-I2356 HydrophobicContact CG2-CG1 4.36Å; V2264-I2356 HydrophobicContact CG2-CG2 4.26Å
2265	V	87.5	Confident	71.1	Confident	30 Å²	30	62.2 Å²	62.2	18%	0.182	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.7	176.7	-172.8	0	0	0	0	109.1	M2310 T2312 V2354 S2355	V2265-M2310 HydrophobicContact CG1-SD 4.37Å; V2265-T2312 HydrophobicContact CG2-CG2 4.09Å; V2265-V2354 CarbonylContact O-C 3.53Å; V2265-V2354 WeakPolarHBondContact O-CA 3.11Å; V2265-S2355 PolarHBondContact N-O 3.09Å; V2265-S2355 PolarHBondContact O-N 3.33Å
2266	I	89	Confident	73.5	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	130	-179.6	-55.2	-172.4	0	0	0	108.9	V2264 L2296 L2305 M2310 N2311 F2313 W2349 V2354	V2264-I2266 HydrophobicContact CG1-CD1 4.33Å; V2264-I2266 HydrophobicContact CG1-CG1 4.01Å; I2266-L2296 HydrophobicContact CD1-CD1 3.54Å; I2266-L2296 HydrophobicContact CD1-CD2 4.32Å; I2266-L2305 HydrophobicContact CG2-CD2 4.1Å; I2266-M2310 CarbonylContact O-C 3.59Å; I2266-M2310 VanDerWaalsContact O-CA 3.31Å; I2266-M2310 WeakPolarHBondContact O-CA 3.38Å; I2266-N2311 PolarHBondContact N-O 3.12Å; I2266-N2311 PolarHBondContact O-N 3Å; I2266-F2313 HydrophobicContact CB-CE2 4.2Å; I2266-F2313 HydrophobicContact CD1-CD2 3.81Å; I2266-F2313 HydrophobicContact CD1-CE2 3.77Å; I2266-F2313 HydrophobicContact CG1-CD2 3.99Å; I2266-F2313 HydrophobicContact CG1-CE2 4.05Å; I2266-W2349 HydrophobicContact CG2-CH2 3.76Å; I2266-W2349 HydrophobicContact CG2-CZ2 3.56Å; I2266-V2354 HydrophobicContact CG1-CG1 4.45Å; I2266-V2354 HydrophobicContact CG1-CG2 4.17Å; I2266-V2354 HydrophobicContact CG2-CG2 4.29Å
2267	E	89	Confident	75.8	Confident	38 Å²	38	55.1 Å²	55.1	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	113.8	179.7	-169.6	171.8	-108.8	0	0	108.6	M2310 E2352 K2353	E2267-M2310 HydrophobicContact CB-CG 4.05Å; E2267-M2310 HydrophobicContact CG-CG 3.86Å; E2267-E2352 HydrophobicContact CG-CB 4.41Å; E2267-E2352 PolarHBondContact O-N 3.18Å; E2267-K2353 HydrophobicContact CB-CB 4.08Å; E2267-K2353 WeakPolarHBondContact CB-O 3.41Å; E2267-K2353 PolarHBondContact N-O 3.42Å; E2267-K2353 PolarHBondContact O-N 3.05Å; E2267-K2353 IonicContact OE1-NZ 3.78Å; E2267-K2353 PolarHBondContact OE1-NZ 3.2Å; E2267-K2353 WeakPolarHBondContact OE2-CB 3.29Å; E2267-K2353 VanDerWaalsContact OE2-CE 3.26Å; E2267-K2353 WeakPolarHBondContact OE2-CE 3.13Å; E2267-K2353 IonicContact OE2-NZ 3.81Å; E2267-K2353 PolarHBondContact OE2-NZ 3.21Å
2268	T	87.1	Confident	77.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.1	173.7	-60.5	0	0	0	0	108.7	Q2306 N2308 Q2309 W2349	T2268-Q2306 WeakPolarHBondContact CB-O 3.17Å; T2268-Q2306 WeakPolarHBondContact CG2-O 3.27Å; T2268-N2308 VanDerWaalsContact O-CA 3.32Å; T2268-N2308 WeakPolarHBondContact O-CA 3.21Å; T2268-N2308 PolarHBondContact O-N 2.87Å; T2268-Q2309 PolarHBondContact N-O 3.39Å; T2268-W2349 PolarHBondContact OG1-NE1 3.04Å
2269	G	80.8	Confident	79.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.242	C	C	.	.			trans	-68.2	169.8	-169.9	0	0	0	0	0	114.3	S2274 N2308 F2350 E2352	G2269-S2274 WeakPolarHBondContact O-CB 3.46Å; G2269-S2274 PolarHBondContact O-OG 3.2Å; G2269-N2308 PolarHBondContact O-N 3.15Å; G2269-F2350 PolarHBondContact N-O 2.87Å; G2269-E2352 WeakPolarHBondContact CA-OE2 3.31Å
2270	N	80	Confident	81.1	Confident	103 Å²	103	41.1 Å²	41.1	55%	0.551	22%	0.22	S	C	*	.	S	Bend	trans	-95.7	9	-174.2	65.9	16.1	0	0	0	115.1	N2308	N2270-N2308 HydrophobicContact CB-CB 3.94Å; N2270-N2308 WeakPolarHBondContact CB-OD1 2.98Å
2271	L	74.5	Confident	82.3	Confident	82 Å²	82	39.7 Å²	39.7	43%	0.429	21%	0.212	S	C	.	.	S	Bend	trans	-69.5	154.1	174.9	-54.7	174.6	0	0	0	110.2	D2273 S2274 I2307 F2350	L2271-D2273 PolarHBondContact O-N 3.42Å; L2271-S2274 VanDerWaalsContact C-OG 3.28Å; L2271-S2274 WeakPolarHBondContact CA-OG 3.49Å; L2271-S2274 WeakPolarHBondContact CB-OG 3.23Å; L2271-S2274 PolarHBondContact N-OG 2.76Å; L2271-S2274 VanDerWaalsContact N-OG 3.11Å; L2271-S2274 WeakPolarHBondContact O-CB 3.36Å; L2271-S2274 PolarHBondContact O-N 3.36Å; L2271-S2274 PolarHBondContact O-OG 2.68Å; L2271-I2307 WeakPolarHBondContact O-CG2 3.45Å; L2271-F2350 HydrophobicContact CD1-CD1 4.35Å; L2271-F2350 HydrophobicContact CD1-CD2 4.46Å; L2271-F2350 HydrophobicContact CD1-CE1 4.19Å; L2271-F2350 HydrophobicContact CD1-CE2 4.3Å; L2271-F2350 HydrophobicContact CD1-CG 4.48Å; L2271-F2350 HydrophobicContact CD1-CZ 4.16Å
2272	K	70.6	Confident	83	Confident	168 Å²	168	36.8 Å²	36.8	73%	0.73	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	138.8	170.8	-158.5	-167.3	170.5	-170.1	0	109.5	S2274	K2272-S2274 PolarHBondContact O-N 2.77Å; K2272-S2274 VanDerWaalsContact O-N 3.13Å
2273	D	76	Confident	83.5	Confident	106 Å²	106	37.4 Å²	37.4	57%	0.567	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	16.1	178.1	-42.8	-46	0	0	0	114.9	L2271 G2275 W2372	L2271-D2273 PolarHBondContact O-N 3.42Å; D2273-G2275 PolarHBondContact O-N 2.83Å; D2273-W2372 VanDerWaalsContact O-CH2 3.31Å; D2273-W2372 WeakPolarHBondContact O-CH2 3.17Å; D2273-W2372 WeakPolarHBondContact O-CZ3 3.34Å
2274	S	81	Confident	83.7	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.183	C	C	.	.			trans	-60.2	-25.8	178.5	-63.8	0	0	0	0	114.6	G2269 L2271 K2272 F2350	G2269-S2274 WeakPolarHBondContact O-CB 3.46Å; G2269-S2274 PolarHBondContact O-OG 3.2Å; L2271-S2274 VanDerWaalsContact C-OG 3.28Å; L2271-S2274 WeakPolarHBondContact CA-OG 3.49Å; L2271-S2274 WeakPolarHBondContact CB-OG 3.23Å; L2271-S2274 PolarHBondContact N-OG 2.76Å; L2271-S2274 VanDerWaalsContact N-OG 3.11Å; L2271-S2274 WeakPolarHBondContact O-CB 3.36Å; L2271-S2274 PolarHBondContact O-N 3.36Å; L2271-S2274 PolarHBondContact O-OG 2.68Å; K2272-S2274 PolarHBondContact O-N 2.77Å; K2272-S2274 VanDerWaalsContact O-N 3.13Å; S2274-F2350 PolarHBondContact O-N 2.94Å
2275	G	81.5	Confident	83.6	Confident	19 Å²	19	35.9 Å²	35.9	20%	0.196	19%	0.19	C	C	.	.			trans	-81	159.8	-175.6	0	0	0	0	0	113	D2273 L2305	D2273-G2275 PolarHBondContact O-N 2.83Å; G2275-L2305 CarbonylContact C-O 3.52Å; G2275-L2305 WeakPolarHBondContact CA-O 3.3Å
2276	T	82.2	Confident	83.3	Confident	3 Å²	3	35 Å²	35	2%	0.018	19%	0.187	C	C	.	.			trans	-127.7	152.5	-179.9	-165.9	0	0	0	0	113.1	C2278 N2298 L2305 Q2306 K2348 W2349	T2276-C2278 PolarHBondContact OG1-N 2.87Å; T2276-N2298 PolarHBondContact O-ND2 2.97Å; T2276-L2305 HydrophobicContact CG2-CB 4.13Å; T2276-L2305 HydrophobicContact CG2-CD1 4.38Å; T2276-L2305 PolarHBondContact N-O 3.01Å; T2276-L2305 VanDerWaalsContact N-O 3.09Å; T2276-Q2306 PolarHBondContact O-NE2 3.03Å; T2276-K2348 VanDerWaalsContact CB-O 3.32Å; T2276-K2348 WeakPolarHBondContact CB-O 3.49Å; T2276-K2348 PolarHBondContact OG1-O 2.96Å; T2276-W2349 HydrophobicContact CG2-CB 3.86Å; T2276-W2349 HydrophobicContact CG2-CG 3.91Å
2277	T	79.6	Confident	82.5	Confident	90 Å²	90	40.3 Å²	40.3	55%	0.552	21%	0.21	S	C	*	.	S	Bend	trans	-100.4	-11.2	170.4	45.2	0	0	0	0	113.3	Q2347	T2277-Q2347 PolarHBondContact OG1-NE2 2.77Å; T2277-Q2347 PolarHBondContact OG1-OE1 2.97Å
2278	C	78.6	Confident	81.1	Confident	15 Å²	15	42.5 Å²	42.5	10%	0.101	22%	0.22	C	C	.	.	S	Bend	trans	-76.5	163.9	176.2	-69.1	0	0	0	0	111.9	T2276 N2298 I2330 Q2347 V2375	T2276-C2278 PolarHBondContact OG1-N 2.87Å; C2278-N2298 PolarHBondContact O-ND2 3.48Å; C2278-I2330 HydrophobicContact CB-CG2 3.33Å; C2278-Q2347 PolarHBondContact SG-OE1 3.05Å; C2278-Q2347 VanDerWaalsContact SG-OE1 3.38Å; C2278-V2375 HydrophobicContact CB-CG2 4.39Å
2279	D	83.9	Confident	80.6	Confident	27 Å²	27	44 Å²	44	14%	0.144	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	128.5	171.9	-62	-48.8	0	0	0	108.7	V2297 N2298 Q2331 R2333	D2279-V2297 VanDerWaalsContact OD1-CA 3.3Å; D2279-V2297 WeakPolarHBondContact OD1-CA 3.36Å; D2279-V2297 WeakPolarHBondContact OD1-CG1 3.11Å; D2279-N2298 PolarHBondContact OD1-N 3.26Å; D2279-Q2331 PolarHBondContact O-N 3.3Å; D2279-R2333 IonicContact OD1-CZ 3.14Å; D2279-R2333 IonicContact OD1-NE 2.72Å; D2279-R2333 IonicContact OD1-NH2 3.37Å; D2279-R2333 PolarHBondContact OD1-NH2 3.27Å; D2279-R2333 IonicContact OD2-CZ 3.95Å; D2279-R2333 IonicContact OD2-NE 3.98Å; D2279-R2333 PolarHBondContact OD2-NE 2.82Å; D2279-R2333 IonicContact OD2-NH2 2.92Å; D2279-R2333 PolarHBondContact OD2-NH2 2.81Å
2280	A	86.9	Confident	80.7	Confident	2 Å²	2	49.4 Å²	49.4	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	173.9	-179.9	0	0	0	0	0	111.6	L2296 L2305 G2329 W2349	A2280-L2296 HydrophobicContact CB-CB 4.14Å; A2280-L2296 HydrophobicContact CB-CD1 4.13Å; A2280-L2296 PolarHBondContact N-O 2.9Å; A2280-L2296 VanDerWaalsContact N-O 3.11Å; A2280-L2296 WeakPolarHBondContact O-CB 3.25Å; A2280-L2296 PolarHBondContact O-N 2.78Å; A2280-L2305 HydrophobicContact CB-CD1 3.55Å; A2280-G2329 WeakPolarHBondContact CA-O 3.27Å; A2280-W2349 HydrophobicContact CB-CE3 4.2Å; A2280-W2349 HydrophobicContact CB-CZ3 4.23Å
2281	W	88.7	Confident	81.1	Confident	20 Å²	20	44.9 Å²	44.9	8%	0.076	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	155.8	175	60.1	-93.3	0	0	0	113.5	I2283 K2293 L2294 R2327 L2328 G2329 D2384	W2281-I2283 HydrophobicContact CE3-CD1 4.05Å; W2281-I2283 HydrophobicContact CE3-CG1 4.09Å; W2281-I2283 HydrophobicContact CZ3-CD1 3.72Å; W2281-I2283 HydrophobicContact CZ3-CG1 4.07Å; W2281-K2293 HydrophobicContact CB-CD 4.21Å; W2281-K2293 HydrophobicContact CB-CG 3.84Å; W2281-K2293 HydrophobicContact CD2-CG 4.4Å; W2281-K2293 HydrophobicContact CE3-CG 4.35Å; W2281-K2293 HydrophobicContact CG-CD 4.31Å; W2281-K2293 HydrophobicContact CG-CG 4.22Å; W2281-L2294 CarbonylContact C-O 3.57Å; W2281-L2294 WeakPolarHBondContact CA-O 3.49Å; W2281-L2294 WeakPolarHBondContact CB-O 3.29Å; W2281-R2327 HydrophobicContact CZ3-CB 4.1Å; W2281-L2328 VanDerWaalsContact O-CA 3.27Å; W2281-L2328 WeakPolarHBondContact O-CA 3.44Å; W2281-L2328 WeakPolarHBondContact O-CB 3.12Å; W2281-G2329 PolarHBondContact N-O 3.42Å; W2281-G2329 PolarHBondContact O-N 3.15Å; W2281-G2329 VanDerWaalsContact O-N 3.17Å; W2281-D2384 HydrophobicContact CH2-CB 3.63Å; W2281-D2384 HydrophobicContact CZ2-CB 4.11Å
2282	I	90.7	Very high	81.4	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	144.7	174.3	-171.7	173.4	0	0	0	111.3	V2264 L2284 L2294 L2296 I2326 R2327 V2354	V2264-I2282 HydrophobicContact CG1-CD1 4.23Å; I2282-L2284 HydrophobicContact CD1-CD2 4.02Å; I2282-L2284 HydrophobicContact CG1-CD2 4.05Å; I2282-L2294 HydrophobicContact CG2-CB 3.86Å; I2282-L2294 HydrophobicContact CG2-CD2 3.8Å; I2282-L2294 HydrophobicContact CG2-CG 4.23Å; I2282-L2294 PolarHBondContact N-O 3.43Å; I2282-L2294 PolarHBondContact O-N 2.88Å; I2282-L2296 HydrophobicContact CG2-CD1 4.5Å; I2282-I2326 HydrophobicContact CD1-CB 4.46Å; I2282-I2326 HydrophobicContact CD1-CD1 4.12Å; I2282-R2327 CarbonylContact C-O 3.5Å; I2282-R2327 WeakPolarHBondContact CA-O 3.26Å; I2282-R2327 WeakPolarHBondContact CG1-O 3.34Å; I2282-V2354 HydrophobicContact CD1-CG1 3.83Å; I2282-V2354 HydrophobicContact CD1-CG2 4.38Å
2283	I	90.9	Very high	82.2	Confident	15 Å²	15	39.3 Å²	39.3	8%	0.077	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.9	171.6	-63.5	164.2	0	0	0	108.5	W2281 R2290 S2291 K2293 I2326 R2327	W2281-I2283 HydrophobicContact CE3-CD1 4.05Å; W2281-I2283 HydrophobicContact CE3-CG1 4.09Å; W2281-I2283 HydrophobicContact CZ3-CD1 3.72Å; W2281-I2283 HydrophobicContact CZ3-CG1 4.07Å; I2283-R2290 HydrophobicContact CG2-CG 3.38Å; I2283-S2291 WeakPolarHBondContact CG2-O 3.31Å; I2283-K2293 HydrophobicContact CD1-CB 4.15Å; I2283-K2293 HydrophobicContact CD1-CG 4.44Å; I2283-K2293 HydrophobicContact CG1-CB 4.02Å; I2283-K2293 HydrophobicContact CG1-CG 4.35Å; I2283-I2326 CarbonylContact O-C 3.51Å; I2283-I2326 WeakPolarHBondContact O-CA 3.45Å; I2283-R2327 HydrophobicContact CB-CB 4.43Å; I2283-R2327 PolarHBondContact N-O 3.01Å; I2283-R2327 PolarHBondContact O-N 2.88Å
2284	L	91.2	Very high	82.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	144.1	178.5	-41.1	-170.7	0	0	0	110	Y2262 V2264 I2282 R2290 S2291 L2315 L2320 L2323 I2326 I2356	Y2262-L2284 HydrophobicContact CG-CD1 4.27Å; V2264-L2284 HydrophobicContact CG2-CD1 4.47Å; I2282-L2284 HydrophobicContact CD1-CD2 4.02Å; I2282-L2284 HydrophobicContact CG1-CD2 4.05Å; L2284-R2290 CarbonylContact O-C 3.44Å; L2284-R2290 VanDerWaalsContact O-CA 3.31Å; L2284-R2290 WeakPolarHBondContact O-CA 3.49Å; L2284-S2291 PolarHBondContact N-OG 2.97Å; L2284-S2291 PolarHBondContact O-N 3.28Å; L2284-L2315 HydrophobicContact CD1-CD2 3.86Å; L2284-L2315 HydrophobicContact CD2-CD2 4.12Å; L2284-L2315 HydrophobicContact CG-CD2 3.66Å; L2284-L2320 HydrophobicContact CB-CD1 3.64Å; L2284-L2320 HydrophobicContact CD1-CD1 4.11Å; L2284-L2320 HydrophobicContact CG-CD1 4.41Å; L2284-L2323 HydrophobicContact CB-CD2 4.45Å; L2284-I2326 HydrophobicContact CD2-CG2 3.79Å; L2284-I2356 HydrophobicContact CD1-CD1 3.9Å; L2284-I2356 HydrophobicContact CD1-CG2 4.01Å; L2284-I2356 HydrophobicContact CD2-CD1 3.29Å; L2284-I2356 HydrophobicContact CG-CD1 4.18Å
2285	E	86.7	Confident	83	Confident	29 Å²	29	40.6 Å²	40.6	14%	0.136	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	176.1	-78.3	176.7	161	0	0	108.7	R2290 E2324 T2325 R2327 L2386	E2285-R2290 HydrophobicContact CG-CB 4.01Å; E2285-R2290 HydrophobicContact CG-CG 3.69Å; E2285-R2290 VanDerWaalsContact OE1-CD 3.3Å; E2285-R2290 WeakPolarHBondContact OE1-CD 3.31Å; E2285-R2290 IonicContact OE1-CZ 3.1Å; E2285-R2290 IonicContact OE1-NE 2.9Å; E2285-R2290 IonicContact OE1-NH1 2.71Å; E2285-R2290 PolarHBondContact OE1-NH1 2.89Å; E2285-E2324 PolarHBondContact O-N 2.73Å; E2285-T2325 CarbonylContact C-O 3.35Å; E2285-T2325 WeakPolarHBondContact CB-OG1 3.16Å; E2285-T2325 PolarHBondContact N-O 2.78Å; E2285-T2325 PolarHBondContact O-N 2.89Å; E2285-T2325 PolarHBondContact OE2-OG1 2.89Å; E2285-T2325 VanDerWaalsContact OE2-OG1 3.1Å; E2285-R2327 IonicContact OE1-CZ 3.45Å; E2285-R2327 IonicContact OE1-NE 3.69Å; E2285-R2327 PolarHBondContact OE1-NE 3.13Å; E2285-R2327 IonicContact OE1-NH2 3.48Å; E2285-R2327 PolarHBondContact OE1-NH2 3.19Å; E2285-R2327 IonicContact OE2-CZ 2.72Å; E2285-R2327 IonicContact OE2-NE 3.93Å; E2285-R2327 PolarHBondContact OE2-NE 2.97Å; E2285-R2327 IonicContact OE2-NH2 2.76Å; E2285-L2386 WeakPolarHBondContact OE2-CD1 3.45Å
2286	G	80.6	Confident	83.3	Confident	11 Å²	11	39.8 Å²	39.8	11%	0.113	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	175.3	175.4	0	0	0	0	0	110.6	H2288 G2289 L2320 D2322	G2286-H2288 PolarHBondContact O-N 2.66Å; G2286-G2289 PolarHBondContact N-O 2.68Å; G2286-G2289 PolarHBondContact O-N 3.29Å; G2286-G2289 VanDerWaalsContact O-O 3.07Å; G2286-L2320 CarbonylContact C-O 3.55Å; G2286-L2320 VanDerWaalsContact CA-O 3.31Å; G2286-L2320 WeakPolarHBondContact CA-O 3.37Å; G2286-D2322 CarbonylContact C-O 3.6Å; G2286-D2322 WeakPolarHBondContact CA-O 3.41Å
2287	K	72.2	Confident	83.2	Confident	114 Å²	114	42.7 Å²	42.7	50%	0.496	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-29	-174.8	-70	177.3	-176.2	167.5	0	114.6	L2320 D2322 E2324	K2287-L2320 PolarHBondContact N-O 3.36Å; K2287-D2322 HydrophobicContact CD-CB 4.02Å; K2287-D2322 HydrophobicContact CG-CB 4.49Å; K2287-D2322 PolarHBondContact N-O 3.43Å; K2287-D2322 IonicContact NZ-OD2 3.5Å; K2287-D2322 PolarHBondContact NZ-OD2 3.23Å; K2287-E2324 WeakPolarHBondContact CE-OE1 3.2Å; K2287-E2324 HydrophobicContact CG-CG 4.06Å; K2287-E2324 WeakPolarHBondContact CG-OE1 3.18Å
2288	H	60.1	Low	83.1	Confident	83 Å²	83	38.7 Å²	38.7	38%	0.384	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-4.2	-173.5	-53.7	-165.5	0	0	0	112.8	D2245 G2286 L2320	D2245-H2288 IonicContact OD1-CE1 2.62Å; D2245-H2288 IonicContact OD1-CG 3.42Å; D2245-H2288 IonicContact OD1-ND1 2.68Å; D2245-H2288 PolarHBondContact OD1-ND1 2.88Å; D2245-H2288 IonicContact OD2-CE1 3.5Å; D2245-H2288 PolarHBondContact OD2-CE1 3.14Å; D2245-H2288 IonicContact OD2-CG 2.74Å; D2245-H2288 IonicContact OD2-ND1 3.39Å; D2245-H2288 PolarHBondContact OD2-ND1 3Å; D2245-H2288 IonicContact OD2-NE2 3.84Å; G2286-H2288 PolarHBondContact O-N 2.66Å; H2288-L2320 PolarHBondContact N-O 2.81Å
2289	G	75.6	Confident	82.6	Confident	35 Å²	35	44.2 Å²	44.2	36%	0.361	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	150.4	-161.8	174.7	0	0	0	0	0	115.4	G2286	G2286-G2289 PolarHBondContact N-O 2.68Å; G2286-G2289 PolarHBondContact O-N 3.29Å; G2286-G2289 VanDerWaalsContact O-O 3.07Å
2290	R	82.7	Confident	81.4	Confident	112 Å²	112	49.8 Å²	49.8	42%	0.423	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137	-173.5	-177.2	172.5	175.7	156.1	-10	110.8	I2283 L2284 E2285 R2327	I2283-R2290 HydrophobicContact CG2-CG 3.38Å; L2284-R2290 CarbonylContact O-C 3.44Å; L2284-R2290 VanDerWaalsContact O-CA 3.31Å; L2284-R2290 WeakPolarHBondContact O-CA 3.49Å; E2285-R2290 HydrophobicContact CG-CB 4.01Å; E2285-R2290 HydrophobicContact CG-CG 3.69Å; E2285-R2290 VanDerWaalsContact OE1-CD 3.3Å; E2285-R2290 WeakPolarHBondContact OE1-CD 3.31Å; E2285-R2290 IonicContact OE1-CZ 3.1Å; E2285-R2290 IonicContact OE1-NE 2.9Å; E2285-R2290 IonicContact OE1-NH1 2.71Å; E2285-R2290 PolarHBondContact OE1-NH1 2.89Å; R2290-R2327 VanDerWaalsContact CZ-CD 3.46Å; R2290-R2327 VanDerWaalsContact NH1-CZ 3.25Å; R2290-R2327 VanDerWaalsContact NH2-CD 3.34Å
2291	S	88.3	Confident	80.3	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.063	30%	0.296	C	S	.	.			trans	-71.3	164.4	178.6	80.8	0	0	0	0	112.3	I2283 L2284	I2283-S2291 WeakPolarHBondContact CG2-O 3.31Å; L2284-S2291 PolarHBondContact N-OG 2.97Å; L2284-S2291 PolarHBondContact O-N 3.28Å
2292	P	82.1	Confident	79.4	Confident	55 Å²	55	58 Å²	58	36%	0.357	32%	0.321	S	S	.	.			trans	-55.8	157.5	157.6	-21.2	33.9	0	0	0	111.6	L2294	P2292-L2294 PolarHBondContact O-N 2.71Å
2293	K	86.1	Confident	78.6	Confident	77 Å²	77	61 Å²	61	34%	0.335	34%	0.341	S	S	.	.			trans	-65.7	114.9	166.4	-173.7	-169	-178.2	-163.5	0	108.9	W2281 I2283 E2295	W2281-K2293 HydrophobicContact CB-CD 4.21Å; W2281-K2293 HydrophobicContact CB-CG 3.84Å; W2281-K2293 HydrophobicContact CD2-CG 4.4Å; W2281-K2293 HydrophobicContact CE3-CG 4.35Å; W2281-K2293 HydrophobicContact CG-CD 4.31Å; W2281-K2293 HydrophobicContact CG-CG 4.22Å; I2283-K2293 HydrophobicContact CD1-CB 4.15Å; I2283-K2293 HydrophobicContact CD1-CG 4.44Å; I2283-K2293 HydrophobicContact CG1-CB 4.02Å; I2283-K2293 HydrophobicContact CG1-CG 4.35Å; K2293-E2295 HydrophobicContact CD-CG 3.91Å; K2293-E2295 WeakPolarHBondContact CD-OE1 3.37Å; K2293-E2295 VanDerWaalsContact CE-OE1 3.27Å; K2293-E2295 WeakPolarHBondContact CE-OE1 3.33Å; K2293-E2295 HydrophobicContact CG-CG 4.09Å; K2293-E2295 IonicContact NZ-OE1 3.26Å; K2293-E2295 PolarHBondContact NZ-OE1 3.43Å
2294	L	88.7	Confident	78.2	Confident	26 Å²	26	61.4 Å²	61.4	14%	0.136	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.1	163.6	178.3	65.4	0	0	0	107.7	W2281 I2282 P2292 L2296 F2313 L2315	W2281-L2294 CarbonylContact C-O 3.57Å; W2281-L2294 WeakPolarHBondContact CA-O 3.49Å; W2281-L2294 WeakPolarHBondContact CB-O 3.29Å; I2282-L2294 HydrophobicContact CG2-CB 3.86Å; I2282-L2294 HydrophobicContact CG2-CD2 3.8Å; I2282-L2294 HydrophobicContact CG2-CG 4.23Å; I2282-L2294 PolarHBondContact N-O 3.43Å; I2282-L2294 PolarHBondContact O-N 2.88Å; P2292-L2294 PolarHBondContact O-N 2.71Å; L2294-L2296 HydrophobicContact CD2-CD2 3.78Å; L2294-L2296 HydrophobicContact CG-CD2 3.87Å; L2294-F2313 HydrophobicContact CD2-CB 3.82Å; L2294-F2313 HydrophobicContact CD2-CG 4.44Å; L2294-L2315 HydrophobicContact CB-CD1 4.01Å; L2294-L2315 HydrophobicContact CB-CD2 4.02Å; L2294-L2315 HydrophobicContact CD2-CB 4.29Å; L2294-L2315 HydrophobicContact CD2-CD2 4.38Å
2295	E	85.5	Confident	77.9	Confident	108 Å²	108	61.4 Å²	61.4	51%	0.505	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	130.3	174	-61.2	-168.8	150.6	0	0	110	K2293 V2297	K2293-E2295 HydrophobicContact CD-CG 3.91Å; K2293-E2295 WeakPolarHBondContact CD-OE1 3.37Å; K2293-E2295 VanDerWaalsContact CE-OE1 3.27Å; K2293-E2295 WeakPolarHBondContact CE-OE1 3.33Å; K2293-E2295 HydrophobicContact CG-CG 4.09Å; K2293-E2295 IonicContact NZ-OE1 3.26Å; K2293-E2295 PolarHBondContact NZ-OE1 3.43Å; E2295-V2297 HydrophobicContact CB-CG2 4.22Å
2296	L	87.2	Confident	77.8	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	78.6	-175.6	-52.2	175	0	0	0	106.8	I2266 A2280 I2282 L2294 I2304 L2305 F2313	I2266-L2296 HydrophobicContact CD1-CD1 3.54Å; I2266-L2296 HydrophobicContact CD1-CD2 4.32Å; A2280-L2296 HydrophobicContact CB-CB 4.14Å; A2280-L2296 HydrophobicContact CB-CD1 4.13Å; A2280-L2296 PolarHBondContact N-O 2.9Å; A2280-L2296 VanDerWaalsContact N-O 3.11Å; A2280-L2296 WeakPolarHBondContact O-CB 3.25Å; A2280-L2296 PolarHBondContact O-N 2.78Å; I2282-L2296 HydrophobicContact CG2-CD1 4.5Å; L2294-L2296 HydrophobicContact CD2-CD2 3.78Å; L2294-L2296 HydrophobicContact CG-CD2 3.87Å; L2296-I2304 HydrophobicContact CB-CD1 4.2Å; L2296-L2305 HydrophobicContact CB-CD1 4.16Å; L2296-L2305 HydrophobicContact CD1-CD1 4.23Å; L2296-F2313 HydrophobicContact CD2-CD1 3.76Å; L2296-F2313 HydrophobicContact CD2-CD2 3.84Å; L2296-F2313 HydrophobicContact CD2-CE1 3.81Å; L2296-F2313 HydrophobicContact CD2-CE2 3.88Å; L2296-F2313 HydrophobicContact CD2-CG 3.78Å; L2296-F2313 HydrophobicContact CD2-CZ 3.86Å
2297	V	81.4	Confident	77.9	Confident	64 Å²	64	66 Å²	66	39%	0.388	36%	0.363	S	S	.	.			trans	-79.4	124	-170.1	-178.2	0	0	0	0	111.2	D2279 E2295 Q2299 I2304	D2279-V2297 VanDerWaalsContact OD1-CA 3.3Å; D2279-V2297 WeakPolarHBondContact OD1-CA 3.36Å; D2279-V2297 WeakPolarHBondContact OD1-CG1 3.11Å; E2295-V2297 HydrophobicContact CB-CG2 4.22Å; V2297-Q2299 HydrophobicContact CG1-CG 4.45Å; V2297-Q2299 PolarHBondContact O-N 3.41Å; V2297-I2304 WeakPolarHBondContact O-CD1 3.31Å
2298	N	77.5	Confident	78.3	Confident	7 Å²	7	66 Å²	66	4%	0.037	37%	0.369	C	S	.	.			trans	-88.3	82.5	-171.8	-132	-33.2	0	0	0	110.8	T2276 C2278 D2279 P2303 I2304 R2333	T2276-N2298 PolarHBondContact O-ND2 2.97Å; C2278-N2298 PolarHBondContact O-ND2 3.48Å; D2279-N2298 PolarHBondContact OD1-N 3.26Å; N2298-P2303 WeakPolarHBondContact OD1-CA 3.36Å; N2298-I2304 HydrophobicContact CB-CG1 4.48Å; N2298-I2304 PolarHBondContact ND2-O 3.32Å; N2298-I2304 PolarHBondContact OD1-N 2.99Å; N2298-I2304 PolarHBondContact OD1-O 3.11Å; N2298-R2333 VanDerWaalsContact O-CZ 3.28Å; N2298-R2333 PolarHBondContact O-NH1 2.84Å; N2298-R2333 PolarHBondContact O-NH2 3.07Å
2299	Q	66.6	Low	79.3	Confident	131 Å²	131	64.5 Å²	64.5	61%	0.612	36%	0.362	S	S	*	.			trans	-69.1	135.3	-169	-65.4	-172.6	-0.2	0	0	112.8	V2297 G2301 N2302	V2297-Q2299 HydrophobicContact CG1-CG 4.45Å; V2297-Q2299 PolarHBondContact O-N 3.41Å; Q2299-G2301 PolarHBondContact O-N 2.98Å; Q2299-G2301 VanDerWaalsContact O-N 3.15Å; Q2299-N2302 CarbonylContact O-C 3.59Å; Q2299-N2302 PolarHBondContact O-N 3.44Å; Q2299-N2302 VanDerWaalsContact O-N 3.12Å
2300	V	60.3	Low	79.5	Confident	143 Å²	143	68.4 Å²	68.4	87%	0.867	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	114.9	177.4	-178.1	0	0	0	0	109
2301	G	63.5	Low	79.7	Confident	80 Å²	80	64 Å²	64	83%	0.825	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.8	-16.9	-177.1	0	0	0	0	0	115	Q2299	Q2299-G2301 PolarHBondContact O-N 2.98Å; Q2299-G2301 VanDerWaalsContact O-N 3.15Å
2302	N	69.5	Low	79.5	Confident	115 Å²	115	67.5 Å²	67.5	62%	0.615	38%	0.378	S	S	*	.	S	Bend	trans	-145.3	76.7	172.3	-171.8	17.2	0	0	0	110.6	Q2299	Q2299-N2302 CarbonylContact O-C 3.59Å; Q2299-N2302 PolarHBondContact O-N 3.44Å; Q2299-N2302 VanDerWaalsContact O-N 3.12Å
2303	P	74.5	Confident	79.7	Confident	66 Å²	66	66.6 Å²	66.6	43%	0.429	37%	0.369	S	S	.	.			trans	-68.4	136.8	-175.7	28.6	-34.7	0	0	0	112	N2298 Q2306 Q2309	N2298-P2303 WeakPolarHBondContact OD1-CA 3.36Å; P2303-Q2306 HydrophobicContact CB-CG 4.02Å; P2303-Q2306 HydrophobicContact CG-CG 4.28Å; P2303-Q2309 PolarHBondContact O-NE2 3.17Å
2304	I	82.2	Confident	79.7	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.118	38%	0.376	C	S	.	.			trans	-106.7	170.4	174.2	55	166	0	0	0	109.6	L2296 V2297 N2298 Q2306 Q2309 F2313	L2296-I2304 HydrophobicContact CB-CD1 4.2Å; V2297-I2304 WeakPolarHBondContact O-CD1 3.31Å; N2298-I2304 HydrophobicContact CB-CG1 4.48Å; N2298-I2304 PolarHBondContact ND2-O 3.32Å; N2298-I2304 PolarHBondContact OD1-N 2.99Å; N2298-I2304 PolarHBondContact OD1-O 3.11Å; I2304-Q2306 VanDerWaalsContact C-N 3.27Å; I2304-Q2306 PolarHBondContact O-N 3.31Å; I2304-Q2306 PolarHBondContact O-NE2 3.01Å; I2304-Q2309 VanDerWaalsContact C-OE1 3.29Å; I2304-F2313 HydrophobicContact CD1-CE1 3.96Å; I2304-F2313 HydrophobicContact CD1-CZ 3.93Å
2305	L	84.5	Confident	79.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	57.7	40.5	177.6	-48	-179.4	0	0	0	112.5	I2266 G2275 T2276 A2280 L2296 N2311 F2313 W2349	I2266-L2305 HydrophobicContact CG2-CD2 4.1Å; G2275-L2305 CarbonylContact C-O 3.52Å; G2275-L2305 WeakPolarHBondContact CA-O 3.3Å; T2276-L2305 HydrophobicContact CG2-CB 4.13Å; T2276-L2305 HydrophobicContact CG2-CD1 4.38Å; T2276-L2305 PolarHBondContact N-O 3.01Å; T2276-L2305 VanDerWaalsContact N-O 3.09Å; A2280-L2305 HydrophobicContact CB-CD1 3.55Å; L2296-L2305 HydrophobicContact CB-CD1 4.16Å; L2296-L2305 HydrophobicContact CD1-CD1 4.23Å; L2305-N2311 PolarHBondContact N-OD1 3.22Å; L2305-F2313 HydrophobicContact CD2-CE2 4.35Å; L2305-F2313 HydrophobicContact CD2-CZ 4.33Å; L2305-W2349 HydrophobicContact CD1-CD2 4.41Å; L2305-W2349 HydrophobicContact CD1-CH2 4.43Å; L2305-W2349 HydrophobicContact CD1-CZ2 4.21Å; L2305-W2349 HydrophobicContact CD2-CH2 4.4Å; L2305-W2349 HydrophobicContact CD2-CZ2 3.81Å; L2305-W2349 HydrophobicContact CG-CZ2 4.41Å
2306	Q	85.5	Confident	79.3	Confident	59 Å²	59	64.3 Å²	64.3	28%	0.276	36%	0.363	S	S	.	.			trans	-91.8	166	177.1	-58.1	-54	-61	0	0	112	T2268 T2276 P2303 I2304 N2308 Q2309	T2268-Q2306 WeakPolarHBondContact CB-O 3.17Å; T2268-Q2306 WeakPolarHBondContact CG2-O 3.27Å; T2276-Q2306 PolarHBondContact O-NE2 3.03Å; P2303-Q2306 HydrophobicContact CB-CG 4.02Å; P2303-Q2306 HydrophobicContact CG-CG 4.28Å; I2304-Q2306 VanDerWaalsContact C-N 3.27Å; I2304-Q2306 PolarHBondContact O-N 3.31Å; I2304-Q2306 PolarHBondContact O-NE2 3.01Å; Q2306-N2308 PolarHBondContact O-N 2.79Å; Q2306-Q2309 HydrophobicContact CB-CB 4.28Å; Q2306-Q2309 WeakPolarHBondContact O-CB 3.48Å; Q2306-Q2309 PolarHBondContact O-N 2.9Å
2307	I	82.7	Confident	78.9	Confident	78 Å²	78	64.3 Å²	64.3	40%	0.4	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	129.5	-177.6	-55.3	175.7	0	0	0	110.8	L2271 Q2309	L2271-I2307 WeakPolarHBondContact O-CG2 3.45Å; I2307-Q2309 PolarHBondContact O-N 2.89Å
2308	N	79.6	Confident	78.3	Confident	113 Å²	113	65.8 Å²	65.8	60%	0.604	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	23.2	-179.9	-164.4	78	0	0	0	114.2	T2268 G2269 N2270 Q2306	T2268-N2308 VanDerWaalsContact O-CA 3.32Å; T2268-N2308 WeakPolarHBondContact O-CA 3.21Å; T2268-N2308 PolarHBondContact O-N 2.87Å; G2269-N2308 PolarHBondContact O-N 3.15Å; N2270-N2308 HydrophobicContact CB-CB 3.94Å; N2270-N2308 WeakPolarHBondContact CB-OD1 2.98Å; Q2306-N2308 PolarHBondContact O-N 2.79Å
2309	Q	81	Confident	77.9	Confident	52 Å²	52	67.1 Å²	67.1	24%	0.243	37%	0.374	C	S	.	.			trans	-94.8	129.4	178.4	-161.6	-177.1	22.7	0	0	110.8	T2268 P2303 I2304 Q2306 I2307 N2311	T2268-Q2309 PolarHBondContact N-O 3.39Å; P2303-Q2309 PolarHBondContact O-NE2 3.17Å; I2304-Q2309 VanDerWaalsContact C-OE1 3.29Å; Q2306-Q2309 HydrophobicContact CB-CB 4.28Å; Q2306-Q2309 WeakPolarHBondContact O-CB 3.48Å; Q2306-Q2309 PolarHBondContact O-N 2.9Å; I2307-Q2309 PolarHBondContact O-N 2.89Å; Q2309-N2311 VanDerWaalsContact CD-ND2 3.28Å; Q2309-N2311 PolarHBondContact NE2-ND2 2.61Å; Q2309-N2311 PolarHBondContact OE1-OD1 3.01Å
2310	M	80.7	Confident	78.3	Confident	118 Å²	118	61 Å²	61	58%	0.581	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	128.4	159.8	-80	-167.7	-70.2	0	0	109.7	V2265 I2266 E2267	V2265-M2310 HydrophobicContact CG1-SD 4.37Å; I2266-M2310 CarbonylContact O-C 3.59Å; I2266-M2310 VanDerWaalsContact O-CA 3.31Å; I2266-M2310 WeakPolarHBondContact O-CA 3.38Å; E2267-M2310 HydrophobicContact CB-CG 4.05Å; E2267-M2310 HydrophobicContact CG-CG 3.86Å
2311	N	86.7	Confident	78.7	Confident	18 Å²	18	55.1 Å²	55.1	10%	0.096	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126.8	174.4	-61.9	112.8	0	0	0	109.7	I2266 L2305 Q2309 F2313	I2266-N2311 PolarHBondContact N-O 3.12Å; I2266-N2311 PolarHBondContact O-N 3Å; L2305-N2311 PolarHBondContact N-OD1 3.22Å; Q2309-N2311 VanDerWaalsContact CD-ND2 3.28Å; Q2309-N2311 PolarHBondContact NE2-ND2 2.61Å; Q2309-N2311 PolarHBondContact OE1-OD1 3.01Å; N2311-F2313 HydrophobicContact CB-CD2 4.37Å; N2311-F2313 HydrophobicContact CB-CE2 3.42Å; N2311-F2313 VanDerWaalsContact CB-CE2 3.42Å; N2311-F2313 HydrophobicContact CB-CZ 3.51Å
2312	T	83.6	Confident	79.3	Confident	84 Å²	84	53.6 Å²	53.6	52%	0.515	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.9	175.6	-57.7	0	0	0	0	110.2	E2263 V2265	E2263-T2312 HydrophobicContact CG-CG2 4.02Å; V2265-T2312 HydrophobicContact CG2-CG2 4.09Å
2313	F	87	Confident	79.8	Confident	36 Å²	36	48.1 Å²	48.1	16%	0.158	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	160	177.3	-54	-85.6	0	0	0	110.8	V2264 I2266 L2294 L2296 I2304 L2305 N2311	V2264-F2313 PolarHBondContact N-O 2.99Å; V2264-F2313 PolarHBondContact O-N 2.82Å; I2266-F2313 HydrophobicContact CB-CE2 4.2Å; I2266-F2313 HydrophobicContact CD1-CD2 3.81Å; I2266-F2313 HydrophobicContact CD1-CE2 3.77Å; I2266-F2313 HydrophobicContact CG1-CD2 3.99Å; I2266-F2313 HydrophobicContact CG1-CE2 4.05Å; L2294-F2313 HydrophobicContact CD2-CB 3.82Å; L2294-F2313 HydrophobicContact CD2-CG 4.44Å; L2296-F2313 HydrophobicContact CD2-CD1 3.76Å; L2296-F2313 HydrophobicContact CD2-CD2 3.84Å; L2296-F2313 HydrophobicContact CD2-CE1 3.81Å; L2296-F2313 HydrophobicContact CD2-CE2 3.88Å; L2296-F2313 HydrophobicContact CD2-CG 3.78Å; L2296-F2313 HydrophobicContact CD2-CZ 3.86Å; I2304-F2313 HydrophobicContact CD1-CE1 3.96Å; I2304-F2313 HydrophobicContact CD1-CZ 3.93Å; L2305-F2313 HydrophobicContact CD2-CE2 4.35Å; L2305-F2313 HydrophobicContact CD2-CZ 4.33Å; N2311-F2313 HydrophobicContact CB-CD2 4.37Å; N2311-F2313 HydrophobicContact CB-CE2 3.42Å; N2311-F2313 VanDerWaalsContact CB-CE2 3.42Å; N2311-F2313 HydrophobicContact CB-CZ 3.51Å
2314	Q	86.2	Confident	80.1	Confident	104 Å²	104	49.1 Å²	49.1	49%	0.486	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.5	177.9	-67.6	-63.7	-22.3	0	0	107.9	V2261 P2316	V2261-Q2314 HydrophobicContact CG1-CB 3.64Å; V2261-Q2314 HydrophobicContact CG1-CG 4.31Å; Q2314-P2316 WeakPolarHBondContact O-CD 3.47Å
2315	L	84.8	Confident	80.2	Confident	4 Å²	4	49 Å²	49	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	97.9	-176	177.8	37.4	0	0	0	111.5	Y2262 V2264 L2284 L2294 S2317	Y2262-L2315 PolarHBondContact N-O 3.45Å; Y2262-L2315 PolarHBondContact O-N 2.82Å; V2264-L2315 HydrophobicContact CG2-CB 4.05Å; V2264-L2315 HydrophobicContact CG2-CD2 4.39Å; L2284-L2315 HydrophobicContact CD1-CD2 3.86Å; L2284-L2315 HydrophobicContact CD2-CD2 4.12Å; L2284-L2315 HydrophobicContact CG-CD2 3.66Å; L2294-L2315 HydrophobicContact CB-CD1 4.01Å; L2294-L2315 HydrophobicContact CB-CD2 4.02Å; L2294-L2315 HydrophobicContact CD2-CB 4.29Å; L2294-L2315 HydrophobicContact CD2-CD2 4.38Å; L2315-S2317 PolarHBondContact O-N 3.01Å; L2315-S2317 VanDerWaalsContact O-N 3.17Å
2316	P	79.5	Confident	80.6	Confident	55 Å²	55	49 Å²	49	36%	0.357	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	106.4	172.8	-19.1	33.4	0	0	0	111.4	K2259 L2260 Q2314	K2259-P2316 HydrophobicContact CB-CB 3.88Å; K2259-P2316 HydrophobicContact CD-CB 3.66Å; K2259-P2316 HydrophobicContact CG-CB 4.41Å; L2260-P2316 CarbonylContact O-C 2.97Å; L2260-P2316 WeakPolarHBondContact O-CA 3.43Å; Q2314-P2316 WeakPolarHBondContact O-CD 3.47Å
2317	S	79.6	Confident	80.7	Confident	1 Å²	1	49 Å²	49	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	163.9	179.2	-174.8	0	0	0	0	111	K2259 L2260 L2315	K2259-S2317 CarbonylContact C-O 3.5Å; K2259-S2317 WeakPolarHBondContact CA-O 3.41Å; L2260-S2317 PolarHBondContact N-O 2.93Å; L2260-S2317 PolarHBondContact O-N 2.85Å; L2260-S2317 VanDerWaalsContact O-O 3.05Å; L2315-S2317 PolarHBondContact O-N 3.01Å; L2315-S2317 VanDerWaalsContact O-N 3.17Å
2318	F	69.8	Low	80.9	Confident	94 Å²	94	45.4 Å²	45.4	41%	0.412	24%	0.235	S	C	.	.			trans	-70	162.3	159.7	-56.2	-71.6	0	0	0	109.7	L2252 L2320	L2252-F2318 HydrophobicContact CD1-CE1 3.9Å; L2252-F2318 HydrophobicContact CD1-CZ 4.05Å; F2318-L2320 WeakPolarHBondContact O-CG 3.44Å; F2318-L2320 PolarHBondContact O-N 2.85Å
2319	P	68.2	Low	81.1	Confident	36 Å²	36	40.3 Å²	40.3	23%	0.234	21%	0.21	C	C	.	.			trans	-58.2	128.9	176.8	-16.2	27.3	0	0	0	111	A2244 L2260	A2244-P2319 HydrophobicContact CB-CB 4.38Å; A2244-P2319 HydrophobicContact CB-CG 3.82Å; L2260-P2319 HydrophobicContact CD1-CB 3.83Å; L2260-P2319 HydrophobicContact CD1-CG 3.63Å; L2260-P2319 HydrophobicContact CG-CG 4.49Å
2320	L	75.5	Confident	81.3	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.198	C	C	.	.			trans	-101.3	-4	-174.6	-59.4	175.1	0	0	0	113.9	Y2262 L2284 G2286 K2287 H2288 F2318 L2323	Y2262-L2320 HydrophobicContact CE2-CD1 4.19Å; Y2262-L2320 HydrophobicContact CE2-CG 4.22Å; Y2262-L2320 PolarHBondContact OH-N 2.88Å; Y2262-L2320 VanDerWaalsContact OH-N 3.08Å; L2284-L2320 HydrophobicContact CB-CD1 3.64Å; L2284-L2320 HydrophobicContact CD1-CD1 4.11Å; L2284-L2320 HydrophobicContact CG-CD1 4.41Å; G2286-L2320 CarbonylContact C-O 3.55Å; G2286-L2320 VanDerWaalsContact CA-O 3.31Å; G2286-L2320 WeakPolarHBondContact CA-O 3.37Å; K2287-L2320 PolarHBondContact N-O 3.36Å; H2288-L2320 PolarHBondContact N-O 2.81Å; F2318-L2320 WeakPolarHBondContact O-CG 3.44Å; F2318-L2320 PolarHBondContact O-N 2.85Å; L2320-L2323 HydrophobicContact CB-CD2 3.69Å; L2320-L2323 HydrophobicContact CD1-CD2 3.72Å; L2320-L2323 HydrophobicContact CG-CD2 4.36Å
2321	G	69	Low	81	Confident	18 Å²	18	35.1 Å²	35.1	19%	0.186	18%	0.184	C	C	.	.			trans	74.3	-156.4	-169.5	0	0	0	0	0	112.2	L2323	G2321-L2323 PolarHBondContact O-N 2.89Å
2322	D	74.3	Confident	80.1	Confident	49 Å²	49	38.6 Å²	38.6	26%	0.262	20%	0.2	S	C	.	.	S	Bend	trans	-61.3	130.4	164.5	-62.8	-53.7	0	0	0	108.7	G2286 K2287 R2363 Y2365	G2286-D2322 CarbonylContact C-O 3.6Å; G2286-D2322 WeakPolarHBondContact CA-O 3.41Å; K2287-D2322 HydrophobicContact CD-CB 4.02Å; K2287-D2322 HydrophobicContact CG-CB 4.49Å; K2287-D2322 PolarHBondContact N-O 3.43Å; K2287-D2322 IonicContact NZ-OD2 3.5Å; K2287-D2322 PolarHBondContact NZ-OD2 3.23Å; D2322-R2363 IonicContact OD1-NH1 3.25Å; D2322-R2363 PolarHBondContact OD1-NH1 3.39Å; D2322-Y2365 PolarHBondContact OD1-OH 3.45Å
2323	L	80.1	Confident	79.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134	177.1	-60.2	178.3	0	0	0	109.8	L2284 L2320 G2321 I2356 Y2365 F2367 Y2389	L2284-L2323 HydrophobicContact CB-CD2 4.45Å; L2320-L2323 HydrophobicContact CB-CD2 3.69Å; L2320-L2323 HydrophobicContact CD1-CD2 3.72Å; L2320-L2323 HydrophobicContact CG-CD2 4.36Å; G2321-L2323 PolarHBondContact O-N 2.89Å; L2323-I2356 HydrophobicContact CD1-CB 4.01Å; L2323-I2356 HydrophobicContact CD1-CD1 4.48Å; L2323-I2356 HydrophobicContact CD1-CG2 3.58Å; L2323-Y2365 HydrophobicContact CB-CD1 3.96Å; L2323-Y2365 HydrophobicContact CB-CD2 4.26Å; L2323-Y2365 HydrophobicContact CB-CE1 4.21Å; L2323-Y2365 HydrophobicContact CB-CE2 4.49Å; L2323-Y2365 HydrophobicContact CB-CG 4.01Å; L2323-Y2365 HydrophobicContact CD1-CD2 3.84Å; L2323-Y2365 HydrophobicContact CD1-CE2 4.37Å; L2323-Y2365 HydrophobicContact CD1-CG 4.15Å; L2323-Y2365 HydrophobicContact CG-CD2 4.18Å; L2323-Y2365 HydrophobicContact CG-CE2 4.3Å; L2323-Y2365 HydrophobicContact CG-CG 4.41Å; L2323-F2367 HydrophobicContact CB-CZ 4.19Å; L2323-Y2389 WeakPolarHBondContact O-CD1 3.2Å; L2323-Y2389 VanDerWaalsContact O-CE1 3.32Å; L2323-Y2389 WeakPolarHBondContact O-CE1 3.2Å
2324	E	81	Confident	77.4	Confident	86 Å²	86	44.9 Å²	44.9	40%	0.402	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-48.5	-176.8	-59.6	-165.1	147.1	0	0	110.8	E2285 K2287 N2388 Y2389	E2285-E2324 PolarHBondContact O-N 2.73Å; K2287-E2324 WeakPolarHBondContact CE-OE1 3.2Å; K2287-E2324 HydrophobicContact CG-CG 4.06Å; K2287-E2324 WeakPolarHBondContact CG-OE1 3.18Å; E2324-N2388 WeakPolarHBondContact O-CA 3.46Å; E2324-Y2389 PolarHBondContact O-N 3.29Å
2325	T	85.9	Confident	75.5	Confident	21 Å²	21	46.2 Å²	46.2	13%	0.129	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	159.6	-179.3	38	0	0	0	0	113.6	E2285 L2386 V2387 N2388	E2285-T2325 CarbonylContact C-O 3.35Å; E2285-T2325 WeakPolarHBondContact CB-OG1 3.16Å; E2285-T2325 PolarHBondContact N-O 2.78Å; E2285-T2325 PolarHBondContact O-N 2.89Å; E2285-T2325 PolarHBondContact OE2-OG1 2.89Å; E2285-T2325 VanDerWaalsContact OE2-OG1 3.1Å; T2325-L2386 HydrophobicContact CG2-CD1 3.86Å; T2325-L2386 HydrophobicContact CG2-CD2 4.4Å; T2325-L2386 HydrophobicContact CG2-CG 4Å; T2325-V2387 CarbonylContact C-O 3.55Å; T2325-V2387 VanDerWaalsContact CA-O 3.3Å; T2325-V2387 WeakPolarHBondContact CA-O 3.4Å; T2325-N2388 WeakPolarHBondContact CG2-OD1 3.38Å
2326	I	91	Very high	73.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.7	159.1	61.4	174	0	0	0	110.3	I2282 I2283 L2284 L2328 V2354 I2356 F2367 I2369 L2386 V2387	I2282-I2326 HydrophobicContact CD1-CB 4.46Å; I2282-I2326 HydrophobicContact CD1-CD1 4.12Å; I2283-I2326 CarbonylContact O-C 3.51Å; I2283-I2326 WeakPolarHBondContact O-CA 3.45Å; L2284-I2326 HydrophobicContact CD2-CG2 3.79Å; I2326-L2328 HydrophobicContact CD1-CD2 4.13Å; I2326-L2328 HydrophobicContact CG1-CD2 4.21Å; I2326-V2354 HydrophobicContact CD1-CB 3.93Å; I2326-V2354 HydrophobicContact CD1-CG1 4.19Å; I2326-V2354 HydrophobicContact CD1-CG2 4.22Å; I2326-I2356 HydrophobicContact CG2-CD1 3.73Å; I2326-F2367 HydrophobicContact CB-CD1 4.37Å; I2326-F2367 HydrophobicContact CB-CE1 4.46Å; I2326-F2367 HydrophobicContact CD1-CB 3.55Å; I2326-F2367 HydrophobicContact CD1-CD1 4.01Å; I2326-F2367 HydrophobicContact CD1-CD2 4.22Å; I2326-F2367 HydrophobicContact CD1-CG 3.67Å; I2326-F2367 HydrophobicContact CG1-CB 4.18Å; I2326-F2367 HydrophobicContact CG1-CD1 3.73Å; I2326-F2367 HydrophobicContact CG1-CE1 4.29Å; I2326-F2367 HydrophobicContact CG1-CG 3.94Å; I2326-F2367 HydrophobicContact CG2-CD1 3.96Å; I2326-F2367 HydrophobicContact CG2-CD2 4.09Å; I2326-F2367 HydrophobicContact CG2-CE1 3.75Å; I2326-F2367 HydrophobicContact CG2-CE2 3.91Å; I2326-F2367 HydrophobicContact CG2-CG 4.14Å; I2326-F2367 HydrophobicContact CG2-CZ 3.74Å; I2326-I2369 HydrophobicContact CD1-CD1 3.97Å; I2326-L2386 CarbonylContact O-C 3.54Å; I2326-L2386 WeakPolarHBondContact O-CA 3.2Å; I2326-V2387 HydrophobicContact CD1-CB 4.49Å; I2326-V2387 HydrophobicContact CG1-CB 3.91Å; I2326-V2387 PolarHBondContact N-O 2.94Å; I2326-V2387 PolarHBondContact O-N 3.22Å
2327	R	87.8	Confident	71.2	Confident	59 Å²	59	60.7 Å²	60.7	22%	0.223	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.2	169	-67	168.9	-175.5	-108.5	4.3	109.8	W2281 I2282 I2283 E2285 R2290 D2384 V2385 L2386	W2281-R2327 HydrophobicContact CZ3-CB 4.1Å; I2282-R2327 CarbonylContact C-O 3.5Å; I2282-R2327 WeakPolarHBondContact CA-O 3.26Å; I2282-R2327 WeakPolarHBondContact CG1-O 3.34Å; I2283-R2327 HydrophobicContact CB-CB 4.43Å; I2283-R2327 PolarHBondContact N-O 3.01Å; I2283-R2327 PolarHBondContact O-N 2.88Å; E2285-R2327 IonicContact OE1-CZ 3.45Å; E2285-R2327 IonicContact OE1-NE 3.69Å; E2285-R2327 PolarHBondContact OE1-NE 3.13Å; E2285-R2327 IonicContact OE1-NH2 3.48Å; E2285-R2327 PolarHBondContact OE1-NH2 3.19Å; E2285-R2327 IonicContact OE2-CZ 2.72Å; E2285-R2327 IonicContact OE2-NE 3.93Å; E2285-R2327 PolarHBondContact OE2-NE 2.97Å; E2285-R2327 IonicContact OE2-NH2 2.76Å; R2290-R2327 VanDerWaalsContact CZ-CD 3.46Å; R2290-R2327 VanDerWaalsContact NH1-CZ 3.25Å; R2290-R2327 VanDerWaalsContact NH2-CD 3.34Å; R2327-D2384 VanDerWaalsContact CD-OD2 3.28Å; R2327-D2384 WeakPolarHBondContact CD-OD2 3.15Å; R2327-D2384 IonicContact CZ-OD2 3.37Å; R2327-D2384 IonicContact NE-OD2 3.46Å; R2327-D2384 IonicContact NH1-OD2 2.68Å; R2327-D2384 PolarHBondContact NH1-OD2 3.02Å; R2327-V2385 VanDerWaalsContact CA-O 3.31Å; R2327-V2385 WeakPolarHBondContact CA-O 3.47Å; R2327-L2386 HydrophobicContact CG-CD1 3.51Å
2328	L	88.3	Confident	69.2	Low	2 Å²	2	69.7 Å²	69.7	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.6	177.9	59.9	154.1	0	0	0	112.1	W2281 I2326 W2349 C2351 I2369 L2373 V2385 V2387	W2281-L2328 VanDerWaalsContact O-CA 3.27Å; W2281-L2328 WeakPolarHBondContact O-CA 3.44Å; W2281-L2328 WeakPolarHBondContact O-CB 3.12Å; I2326-L2328 HydrophobicContact CD1-CD2 4.13Å; I2326-L2328 HydrophobicContact CG1-CD2 4.21Å; L2328-W2349 HydrophobicContact CD1-CH2 4.49Å; L2328-W2349 HydrophobicContact CD1-CZ3 4.1Å; L2328-C2351 HydrophobicContact CD1-CB 4.47Å; L2328-I2369 HydrophobicContact CD1-CD1 3.55Å; L2328-I2369 HydrophobicContact CD1-CG2 4.41Å; L2328-I2369 HydrophobicContact CD2-CD1 3.73Å; L2328-I2369 HydrophobicContact CG-CD1 4.34Å; L2328-L2373 HydrophobicContact CD1-CD1 3.6Å; L2328-L2373 HydrophobicContact CD1-CD2 3.79Å; L2328-L2373 HydrophobicContact CD1-CG 4.35Å; L2328-L2373 HydrophobicContact CG-CD2 3.82Å; L2328-V2385 HydrophobicContact CD2-CB 4.43Å; L2328-V2385 HydrophobicContact CD2-CG1 4.48Å; L2328-V2385 WeakPolarHBondContact CD2-O 3.44Å; L2328-V2385 HydrophobicContact CG-CB 4.44Å; L2328-V2385 PolarHBondContact N-O 3.33Å; L2328-V2385 VanDerWaalsContact N-O 3.13Å; L2328-V2385 PolarHBondContact O-N 2.88Å; L2328-V2387 HydrophobicContact CD2-CG2 3.97Å
2329	G	83.9	Confident	67.8	Low	6 Å²	6	70.9 Å²	70.9	6%	0.062	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	177.7	-179.4	0	0	0	0	0	113.2	A2280 W2281	A2280-G2329 WeakPolarHBondContact CA-O 3.27Å; W2281-G2329 PolarHBondContact N-O 3.42Å; W2281-G2329 PolarHBondContact O-N 3.15Å; W2281-G2329 VanDerWaalsContact O-N 3.17Å
2330	I	84.2	Confident	66.7	Low	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	140.5	179.7	-41.3	176.4	0	0	0	109.2	C2278 W2349 L2373 V2375 T2376	C2278-I2330 HydrophobicContact CB-CG2 3.33Å; I2330-W2349 HydrophobicContact CD1-CB 3.56Å; I2330-W2349 HydrophobicContact CG1-CB 4.35Å; I2330-L2373 HydrophobicContact CD1-CB 3.81Å; I2330-L2373 HydrophobicContact CG1-CB 3.89Å; I2330-V2375 HydrophobicContact CB-CG2 4.29Å; I2330-V2375 HydrophobicContact CG2-CG2 3.9Å; I2330-T2376 PolarHBondContact O-N 2.93Å; I2330-T2376 PolarHBondContact O-OG1 2.86Å
2331	Q	75.7	Confident	65.2	Low	61 Å²	61	78.7 Å²	78.7	29%	0.285	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.2	-179.9	-169.6	175.9	-36.9	0	0	111.5	D2279	D2279-Q2331 PolarHBondContact O-N 3.3Å
2332	E	67.3	Low	64.2	Low	92 Å²	92	84.5 Å²	84.5	43%	0.43	43%	0.428	S	S	.	.			trans	-72.2	143.3	173.8	-172.6	169.1	-152.2	0	0	111.4	V2375	E2332-V2375 HydrophobicContact CB-CG1 4.03Å
2333	R	62.8	Low	63.1	Low	79 Å²	79	87.7 Å²	87.7	30%	0.298	45%	0.445	S	S	.	.			trans	-89.1	126.2	178.3	179.6	173.9	-87.3	179.3	-8.6	109.2	D2279 N2298 I2335	D2279-R2333 IonicContact OD1-CZ 3.14Å; D2279-R2333 IonicContact OD1-NE 2.72Å; D2279-R2333 IonicContact OD1-NH2 3.37Å; D2279-R2333 PolarHBondContact OD1-NH2 3.27Å; D2279-R2333 IonicContact OD2-CZ 3.95Å; D2279-R2333 IonicContact OD2-NE 3.98Å; D2279-R2333 PolarHBondContact OD2-NE 2.82Å; D2279-R2333 IonicContact OD2-NH2 2.92Å; D2279-R2333 PolarHBondContact OD2-NH2 2.81Å; N2298-R2333 VanDerWaalsContact O-CZ 3.28Å; N2298-R2333 PolarHBondContact O-NH1 2.84Å; N2298-R2333 PolarHBondContact O-NH2 3.07Å; R2333-I2335 HydrophobicContact CG-CG1 4.32Å; R2333-I2335 PolarHBondContact O-N 3.06Å
2334	N	50.3	Low	61.5	Low	173 Å²	173	91.2 Å²	91.2	93%	0.925	46%	0.463	S	S	*	.			trans	-63.5	94.9	178.1	-83.1	-24.6	0	0	0	111.2
2335	I	47.3	Very low	59.9	Low	132 Å²	132	95.9 Å²	95.9	68%	0.677	49%	0.485	S	S	*	.			trans	-105.3	142	172.7	-64	173.4	0	0	0	108.2	R2333	R2333-I2335 HydrophobicContact CG-CG1 4.32Å; R2333-I2335 PolarHBondContact O-N 3.06Å
2336	N	38.6	Very low	58.4	Low	155 Å²	155	98.9 Å²	98.9	83%	0.829	51%	0.507	S	S	*	.			trans	-64.7	151.4	-174.9	-78.6	-43.8	0	0	0	113	Q2338	N2336-Q2338 PolarHBondContact O-N 3.42Å
2337	K	35.6	Very low	57.4	Low	207 Å²	207	102.1 Å²	102.1	90%	0.9	52%	0.522	S	S	*	.	S	Bend	trans	-46	93	-176.2	-57.8	172.2	-178.5	176.7	0	114.5
2338	Q	37.1	Very low	56.9	Low	191 Å²	191	104.1 Å²	104.1	89%	0.893	53%	0.532	S	S	*	.			trans	-179.1	73.5	152.8	-105.5	168.2	10.8	0	0	112	N2336	N2336-Q2338 PolarHBondContact O-N 3.42Å
2339	T	40.3	Very low	56.8	Low	118 Å²	118	104.1 Å²	104.1	72%	0.724	53%	0.532	S	S	*	.			trans	-145.8	151.9	170.6	25.4	0	0	0	0	110.8
2340	N	44.8	Very low	57	Low	111 Å²	111	105 Å²	105	59%	0.594	53%	0.534	S	S	*	.			trans	-85.6	133.2	-170.3	-142	4.5	0	0	0	110	N2342 D2343	N2340-N2342 PolarHBondContact O-N 2.98Å; N2340-D2343 PolarHBondContact O-N 2.8Å
2341	P	44.3	Very low	57.1	Low	93 Å²	93	105 Å²	105	60%	0.604	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.9	-169.2	25.1	-34.6	0	0	0	115.9
2342	N	47.2	Very low	57.4	Low	140 Å²	140	104.8 Å²	104.8	75%	0.749	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-25.3	178.5	-72.5	-8.4	0	0	0	114	N2340 I2344	N2340-N2342 PolarHBondContact O-N 2.98Å; N2342-I2344 PolarHBondContact O-N 3.47Å
2343	D	51.1	Low	58.4	Low	115 Å²	115	103 Å²	103	62%	0.615	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-76.4	-22.6	-176	-72.4	-53.7	0	0	0	113.6	N2340 Q2345 S2346	N2340-D2343 PolarHBondContact O-N 2.8Å; D2343-Q2345 VanDerWaalsContact C-N 3.27Å; D2343-Q2345 PolarHBondContact O-N 2.66Å; D2343-S2346 PolarHBondContact O-N 2.8Å; D2343-S2346 PolarHBondContact O-OG 2.75Å
2344	I	47.1	Very low	59.7	Low	75 Å²	75	99.3 Å²	99.3	39%	0.385	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-69.9	-19.4	-168.7	-59.4	173.5	0	0	0	112.7	N2342 S2346	N2342-I2344 PolarHBondContact O-N 3.47Å; I2344-S2346 VanDerWaalsContact C-N 3.32Å; I2344-S2346 PolarHBondContact O-N 2.94Å
2345	Q	47.8	Very low	61.4	Low	183 Å²	183	91.8 Å²	91.8	86%	0.855	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-80.9	-2.2	-177	-63.4	-166	4	0	0	115.3	D2343	D2343-Q2345 VanDerWaalsContact C-N 3.27Å; D2343-Q2345 PolarHBondContact O-N 2.66Å
2346	S	54.6	Low	63.4	Low	84 Å²	84	85.5 Å²	85.5	59%	0.587	44%	0.439	S	S	*	.			trans	-95.8	-25.6	-168.5	62.8	0	0	0	0	116	D2343 I2344	D2343-S2346 PolarHBondContact O-N 2.8Å; D2343-S2346 PolarHBondContact O-OG 2.75Å; I2344-S2346 VanDerWaalsContact C-N 3.32Å; I2344-S2346 PolarHBondContact O-N 2.94Å
2347	Q	68.7	Low	65.3	Low	69 Å²	69	82.2 Å²	82.2	32%	0.322	42%	0.417	S	S	.	.			trans	-71.2	127.1	-169.5	-73.1	-88.6	-17.6	0	0	113.6	T2277 C2278 V2375	T2277-Q2347 PolarHBondContact OG1-NE2 2.77Å; T2277-Q2347 PolarHBondContact OG1-OE1 2.97Å; C2278-Q2347 PolarHBondContact SG-OE1 3.05Å; C2278-Q2347 VanDerWaalsContact SG-OE1 3.38Å; Q2347-V2375 HydrophobicContact CB-CG2 3.66Å
2348	K	77.4	Confident	67.1	Low	100 Å²	100	72.7 Å²	72.7	44%	0.435	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	169.5	-177.7	-61.7	-177.5	-177.8	168.7	0	111.8	T2276 W2372 L2373	T2276-K2348 VanDerWaalsContact CB-O 3.32Å; T2276-K2348 WeakPolarHBondContact CB-O 3.49Å; T2276-K2348 PolarHBondContact OG1-O 2.96Å; K2348-W2372 HydrophobicContact CB-CE3 3.78Å; K2348-W2372 HydrophobicContact CB-CZ3 4.17Å; K2348-L2373 WeakPolarHBondContact CA-O 3.48Å; K2348-L2373 VanDerWaalsContact CB-O 3.27Å; K2348-L2373 WeakPolarHBondContact CB-O 3.45Å
2349	W	87.5	Confident	68.2	Low	3 Å²	3	65.4 Å²	65.4	1%	0.011	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	135.7	175	174.9	41.6	0	0	0	109.8	I2266 T2268 T2276 A2280 L2305 L2328 I2330 C2351 W2372 L2373	I2266-W2349 HydrophobicContact CG2-CH2 3.76Å; I2266-W2349 HydrophobicContact CG2-CZ2 3.56Å; T2268-W2349 PolarHBondContact OG1-NE1 3.04Å; T2276-W2349 HydrophobicContact CG2-CB 3.86Å; T2276-W2349 HydrophobicContact CG2-CG 3.91Å; A2280-W2349 HydrophobicContact CB-CE3 4.2Å; A2280-W2349 HydrophobicContact CB-CZ3 4.23Å; L2305-W2349 HydrophobicContact CD1-CD2 4.41Å; L2305-W2349 HydrophobicContact CD1-CH2 4.43Å; L2305-W2349 HydrophobicContact CD1-CZ2 4.21Å; L2305-W2349 HydrophobicContact CD2-CH2 4.4Å; L2305-W2349 HydrophobicContact CD2-CZ2 3.81Å; L2305-W2349 HydrophobicContact CG-CZ2 4.41Å; L2328-W2349 HydrophobicContact CD1-CH2 4.49Å; L2328-W2349 HydrophobicContact CD1-CZ3 4.1Å; I2330-W2349 HydrophobicContact CD1-CB 3.56Å; I2330-W2349 HydrophobicContact CG1-CB 4.35Å; W2349-C2351 HydrophobicContact CD2-CB 4.43Å; W2349-C2351 HydrophobicContact CH2-CB 3.73Å; W2349-C2351 HydrophobicContact CZ2-CB 3.59Å; W2349-C2351 HydrophobicContact CZ3-CB 4.22Å; W2349-W2372 CarbonylContact O-C 3.43Å; W2349-W2372 WeakPolarHBondContact O-CA 3.32Å; W2349-L2373 HydrophobicContact CD2-CD1 4.2Å; W2349-L2373 HydrophobicContact CE3-CD1 3.54Å; W2349-L2373 HydrophobicContact CZ3-CD1 3.84Å; W2349-L2373 PolarHBondContact N-O 3.02Å; W2349-L2373 VanDerWaalsContact N-O 3.12Å; W2349-L2373 PolarHBondContact O-N 2.94Å
2350	F	87.3	Confident	69.1	Low	24 Å²	24	61.7 Å²	61.7	11%	0.105	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	101.8	175.9	-172.8	-94.5	0	0	0	111.6	G2269 L2271 S2274 H2370 W2372	G2269-F2350 PolarHBondContact N-O 2.87Å; L2271-F2350 HydrophobicContact CD1-CD1 4.35Å; L2271-F2350 HydrophobicContact CD1-CD2 4.46Å; L2271-F2350 HydrophobicContact CD1-CE1 4.19Å; L2271-F2350 HydrophobicContact CD1-CE2 4.3Å; L2271-F2350 HydrophobicContact CD1-CG 4.48Å; L2271-F2350 HydrophobicContact CD1-CZ 4.16Å; S2274-F2350 PolarHBondContact O-N 2.94Å; F2350-H2370 VanDerWaalsContact CE2-C 3.41Å; F2350-H2370 WeakPolarHBondContact CE2-O 3.41Å; F2350-H2370 VanDerWaalsContact CZ-C 3.46Å; F2350-H2370 HydrophobicContact CZ-CB 4.41Å; F2350-W2372 HydrophobicContact CB-CD2 3.82Å; F2350-W2372 HydrophobicContact CB-CE3 3.76Å; F2350-W2372 HydrophobicContact CB-CG 4.47Å; F2350-W2372 HydrophobicContact CB-CH2 4.17Å; F2350-W2372 HydrophobicContact CB-CZ2 4.17Å; F2350-W2372 HydrophobicContact CB-CZ3 3.96Å; F2350-W2372 AromaticContact CD2-CD1 3.59Å; F2350-W2372 AromaticContact CD2-CD2 3.87Å; F2350-W2372 HydrophobicContact CD2-CD2 3.87Å; F2350-W2372 AromaticContact CD2-CE2 3.81Å; F2350-W2372 AromaticContact CD2-CG 3.76Å; F2350-W2372 HydrophobicContact CD2-CG 3.76Å; F2350-W2372 AromaticContact CD2-NE1 3.59Å; F2350-W2372 HydrophobicContact CG-CD2 4.3Å
2351	C	86.7	Confident	69.8	Low	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.8	174.2	-169.9	0	0	0	0	110.4	L2328 W2349 I2369 H2370 Q2371 L2373	L2328-C2351 HydrophobicContact CD1-CB 4.47Å; W2349-C2351 HydrophobicContact CD2-CB 4.43Å; W2349-C2351 HydrophobicContact CH2-CB 3.73Å; W2349-C2351 HydrophobicContact CZ2-CB 3.59Å; W2349-C2351 HydrophobicContact CZ3-CB 4.22Å; C2351-I2369 HydrophobicContact CB-CB 4.4Å; C2351-I2369 HydrophobicContact CB-CD1 4.39Å; C2351-I2369 HydrophobicContact CB-CG2 4.23Å; C2351-H2370 WeakPolarHBondContact O-CA 3.35Å; C2351-H2370 PolarHBondContact O-N 2.77Å; C2351-Q2371 PolarHBondContact N-O 2.53Å; C2351-Q2371 PolarHBondContact O-N 3.32Å; C2351-L2373 HydrophobicContact CB-CD1 3.98Å
2352	E	82.6	Confident	70.7	Confident	56 Å²	56	58.6 Å²	58.6	26%	0.262	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-52.8	178.6	-169.2	168.2	157.2	0	0	110.5	E2267 G2269 I2369 H2370	E2267-E2352 HydrophobicContact CG-CB 4.41Å; E2267-E2352 PolarHBondContact O-N 3.18Å; G2269-E2352 WeakPolarHBondContact CA-OE2 3.31Å; E2352-I2369 PolarHBondContact O-N 3.33Å; E2352-H2370 VanDerWaalsContact CG-CE1 3.43Å; E2352-H2370 WeakPolarHBondContact CG-CE1 3.38Å; E2352-H2370 PolarHBondContact O-N 2.94Å; E2352-H2370 VanDerWaalsContact O-N 3.11Å; E2352-H2370 PolarHBondContact O-ND1 2.93Å
2353	K	87.4	Confident	71.6	Confident	55 Å²	55	55.3 Å²	55.3	24%	0.239	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	144.1	-173.3	-170	-176.2	71.3	-132	0	111.1	E2267 S2355 I2366 F2367	E2267-K2353 HydrophobicContact CB-CB 4.08Å; E2267-K2353 WeakPolarHBondContact CB-O 3.41Å; E2267-K2353 PolarHBondContact N-O 3.42Å; E2267-K2353 PolarHBondContact O-N 3.05Å; E2267-K2353 IonicContact OE1-NZ 3.78Å; E2267-K2353 PolarHBondContact OE1-NZ 3.2Å; E2267-K2353 WeakPolarHBondContact OE2-CB 3.29Å; E2267-K2353 VanDerWaalsContact OE2-CE 3.26Å; E2267-K2353 WeakPolarHBondContact OE2-CE 3.13Å; E2267-K2353 IonicContact OE2-NZ 3.81Å; E2267-K2353 PolarHBondContact OE2-NZ 3.21Å; K2353-S2355 VanDerWaalsContact CE-OG 3.31Å; K2353-S2355 WeakPolarHBondContact CE-OG 3.47Å; K2353-I2366 HydrophobicContact CD-CG2 3.88Å; K2353-I2366 HydrophobicContact CG-CG2 3.86Å; K2353-F2367 WeakPolarHBondContact CA-O 3.49Å
2354	V	89.3	Confident	72.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.7	162.5	177.5	0	0	0	0	108.4	V2264 V2265 I2266 I2282 I2326 I2356 F2367 I2369	V2264-V2354 HydrophobicContact CG1-CG1 3.88Å; V2265-V2354 CarbonylContact O-C 3.53Å; V2265-V2354 WeakPolarHBondContact O-CA 3.11Å; I2266-V2354 HydrophobicContact CG1-CG1 4.45Å; I2266-V2354 HydrophobicContact CG1-CG2 4.17Å; I2266-V2354 HydrophobicContact CG2-CG2 4.29Å; I2282-V2354 HydrophobicContact CD1-CG1 3.83Å; I2282-V2354 HydrophobicContact CD1-CG2 4.38Å; I2326-V2354 HydrophobicContact CD1-CB 3.93Å; I2326-V2354 HydrophobicContact CD1-CG1 4.19Å; I2326-V2354 HydrophobicContact CD1-CG2 4.22Å; V2354-I2356 HydrophobicContact CG1-CD1 4.11Å; V2354-I2356 HydrophobicContact CG1-CG1 3.85Å; V2354-F2367 HydrophobicContact CB-CB 4.37Å; V2354-F2367 PolarHBondContact N-O 3.01Å; V2354-F2367 PolarHBondContact O-N 2.72Å; V2354-I2369 HydrophobicContact CB-CD1 4.32Å; V2354-I2369 HydrophobicContact CG2-CD1 3.61Å
2355	S	86.5	Confident	74.5	Confident	15 Å²	15	48.1 Å²	48.1	11%	0.105	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.4	176.7	-54.6	0	0	0	0	109.2	V2265 K2353 Y2365	V2265-S2355 PolarHBondContact N-O 3.09Å; V2265-S2355 PolarHBondContact O-N 3.33Å; K2353-S2355 VanDerWaalsContact CE-OG 3.31Å; K2353-S2355 WeakPolarHBondContact CE-OG 3.47Å; S2355-Y2365 WeakPolarHBondContact CA-O 3.41Å
2356	I	89.4	Confident	76.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118	-173.9	-51	-172.2	0	0	0	108.9	Y2262 E2263 V2264 L2284 L2323 I2326 V2354 T2364 Y2365 F2367	Y2262-I2356 HydrophobicContact CD1-CG2 4.13Å; E2263-I2356 WeakPolarHBondContact O-CA 3.48Å; V2264-I2356 HydrophobicContact CG1-CG1 4.39Å; V2264-I2356 HydrophobicContact CG2-CD1 4.44Å; V2264-I2356 HydrophobicContact CG2-CG1 4.36Å; V2264-I2356 HydrophobicContact CG2-CG2 4.26Å; L2284-I2356 HydrophobicContact CD1-CD1 3.9Å; L2284-I2356 HydrophobicContact CD1-CG2 4.01Å; L2284-I2356 HydrophobicContact CD2-CD1 3.29Å; L2284-I2356 HydrophobicContact CG-CD1 4.18Å; L2323-I2356 HydrophobicContact CD1-CB 4.01Å; L2323-I2356 HydrophobicContact CD1-CD1 4.48Å; L2323-I2356 HydrophobicContact CD1-CG2 3.58Å; I2326-I2356 HydrophobicContact CG2-CD1 3.73Å; V2354-I2356 HydrophobicContact CG1-CD1 4.11Å; V2354-I2356 HydrophobicContact CG1-CG1 3.85Å; I2356-T2364 CarbonylContact O-C 3.58Å; I2356-T2364 WeakPolarHBondContact O-CA 3.46Å; I2356-Y2365 PolarHBondContact N-O 2.92Å; I2356-Y2365 PolarHBondContact O-N 2.87Å; I2356-F2367 HydrophobicContact CB-CE2 4.29Å; I2356-F2367 HydrophobicContact CD1-CD2 4.12Å; I2356-F2367 HydrophobicContact CD1-CE2 3.77Å; I2356-F2367 HydrophobicContact CG1-CD2 4.14Å; I2356-F2367 HydrophobicContact CG1-CE2 3.96Å
2357	K	78	Confident	77.8	Confident	86 Å²	86	36.7 Å²	36.7	37%	0.374	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.2	178.1	179.4	-166.2	-178.3	-172.8	0	108.3	E2263 P2359	E2263-K2357 HydrophobicContact CB-CB 4.28Å; E2263-K2357 HydrophobicContact CB-CD 4.44Å; E2263-K2357 PolarHBondContact N-O 3.23Å; E2263-K2357 PolarHBondContact O-N 2.91Å; E2263-K2357 IonicContact OE1-NZ 2.73Å; E2263-K2357 VanDerWaalsContact OE2-CD 3.23Å; E2263-K2357 WeakPolarHBondContact OE2-CD 3.3Å; E2263-K2357 IonicContact OE2-NZ 2.61Å; E2263-K2357 PolarHBondContact OE2-NZ 2.92Å; K2357-P2359 WeakPolarHBondContact O-CD 3.5Å
2358	D	73.7	Confident	78.6	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	18%	0.18	C	C	.	.			trans	-71.5	120	174.8	169	26.5	0	0	0	109.4	Y2262 V2360 S2361 K2362 R2363 Y2365	Y2262-D2358 HydrophobicContact CD1-CB 4.38Å; Y2262-D2358 HydrophobicContact CE1-CB 3.95Å; Y2262-D2358 WeakPolarHBondContact CE1-OD1 3.04Å; D2358-V2360 PolarHBondContact O-N 2.83Å; D2358-V2360 VanDerWaalsContact O-N 3.13Å; D2358-V2360 VanDerWaalsContact OD1-CB 3.29Å; D2358-V2360 WeakPolarHBondContact OD1-CB 3.47Å; D2358-V2360 PolarHBondContact OD1-N 3.18Å; D2358-S2361 WeakPolarHBondContact OD2-CB 3.36Å; D2358-S2361 PolarHBondContact OD2-N 3.4Å; D2358-S2361 PolarHBondContact OD2-OG 3.01Å; D2358-K2362 WeakPolarHBondContact O-CA 3.34Å; D2358-K2362 PolarHBondContact O-N 3.18Å; D2358-R2363 PolarHBondContact N-O 2.95Å; D2358-Y2365 HydrophobicContact CB-CE2 3.99Å
2359	P	61	Low	79	Confident	38 Å²	38	32.5 Å²	32.5	25%	0.247	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.3	178	29.1	-38.2	0	0	0	112.6	L2260 V2261 K2357 K2362	L2260-P2359 HydrophobicContact CB-CG 4.24Å; L2260-P2359 HydrophobicContact CD2-CG 4.4Å; V2261-P2359 WeakPolarHBondContact O-CG 3.48Å; K2357-P2359 WeakPolarHBondContact O-CD 3.5Å; P2359-K2362 WeakPolarHBondContact O-CE 3.43Å; P2359-K2362 PolarHBondContact O-NZ 2.89Å
2360	V	59.1	Low	78.8	Confident	40 Å²	40	37.7 Å²	37.7	24%	0.242	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-73.8	-176.6	179.6	0	0	0	0	111.9	L2241 L2260 D2358 K2362	L2241-V2360 HydrophobicContact CB-CG1 4.02Å; L2241-V2360 HydrophobicContact CD1-CG1 3.38Å; L2241-V2360 HydrophobicContact CD2-CB 4.41Å; L2241-V2360 HydrophobicContact CD2-CG1 3.56Å; L2241-V2360 HydrophobicContact CD2-CG2 3.93Å; L2241-V2360 HydrophobicContact CG-CG1 3.81Å; L2260-V2360 HydrophobicContact CD1-CG2 3.4Å; L2260-V2360 HydrophobicContact CD2-CG2 4.07Å; L2260-V2360 HydrophobicContact CG-CG2 4.38Å; D2358-V2360 PolarHBondContact O-N 2.83Å; D2358-V2360 VanDerWaalsContact O-N 3.13Å; D2358-V2360 VanDerWaalsContact OD1-CB 3.29Å; D2358-V2360 WeakPolarHBondContact OD1-CB 3.47Å; D2358-V2360 PolarHBondContact OD1-N 3.18Å; V2360-K2362 PolarHBondContact O-N 2.75Å
2361	S	59.8	Low	78.5	Confident	25 Å²	25	41 Å²	41	18%	0.175	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-21	-176.2	62.2	0	0	0	0	113	D2358 R2363 K2398	D2358-S2361 WeakPolarHBondContact OD2-CB 3.36Å; D2358-S2361 PolarHBondContact OD2-N 3.4Å; D2358-S2361 PolarHBondContact OD2-OG 3.01Å; S2361-R2363 PolarHBondContact O-N 2.96Å; S2361-R2363 WeakPolarHBondContact OG-CB 3.3Å; S2361-R2363 PolarHBondContact OG-N 2.75Å; S2361-R2363 VanDerWaalsContact OG-N 3.14Å; S2361-K2398 PolarHBondContact O-NZ 3.01Å
2362	K	62.9	Low	78.3	Confident	115 Å²	115	45.9 Å²	45.9	50%	0.5	22%	0.222	S	C	.	.			trans	65.8	9.3	-165.1	-50.8	-54.6	-172.4	-166.8	0	114.2	D2358 P2359 V2360	D2358-K2362 WeakPolarHBondContact O-CA 3.34Å; D2358-K2362 PolarHBondContact O-N 3.18Å; P2359-K2362 WeakPolarHBondContact O-CE 3.43Å; P2359-K2362 PolarHBondContact O-NZ 2.89Å; V2360-K2362 PolarHBondContact O-N 2.75Å
2363	R	65.1	Low	78.3	Confident	71 Å²	71	43.5 Å²	43.5	27%	0.268	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-69.1	138.2	171.6	-68.9	175.3	170.2	155.2	2	110.3	D2322 D2358 S2361 Y2365 I2392 I2393 E2394	D2322-R2363 IonicContact OD1-NH1 3.25Å; D2322-R2363 PolarHBondContact OD1-NH1 3.39Å; D2358-R2363 PolarHBondContact N-O 2.95Å; S2361-R2363 PolarHBondContact O-N 2.96Å; S2361-R2363 WeakPolarHBondContact OG-CB 3.3Å; S2361-R2363 PolarHBondContact OG-N 2.75Å; S2361-R2363 VanDerWaalsContact OG-N 3.14Å; R2363-Y2365 HydrophobicContact CB-CD2 4.3Å; R2363-Y2365 HydrophobicContact CB-CE2 3.63Å; R2363-Y2365 WeakPolarHBondContact CD-OH 3.45Å; R2363-I2392 HydrophobicContact CB-CG2 4.04Å; R2363-I2392 HydrophobicContact CG-CG2 3.99Å; R2363-I2393 WeakPolarHBondContact CA-O 3.32Å; R2363-E2394 HydrophobicContact CG-CG 4.29Å; R2363-E2394 IonicContact CZ-OE1 3.69Å; R2363-E2394 VanDerWaalsContact CZ-OE1 3.25Å; R2363-E2394 IonicContact NE-OE1 3.51Å; R2363-E2394 PolarHBondContact NE-OE1 2.79Å; R2363-E2394 IonicContact NH2-OE1 2.75Å; R2363-E2394 PolarHBondContact NH2-OE1 2.79Å
2364	T	76.9	Confident	77.7	Confident	39 Å²	39	43.7 Å²	43.7	24%	0.239	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.3	166.7	-57.1	0	0	0	0	109	I2356 I2366 I2393	I2356-T2364 CarbonylContact O-C 3.58Å; I2356-T2364 WeakPolarHBondContact O-CA 3.46Å; T2364-I2366 HydrophobicContact CG2-CG1 4.37Å; T2364-I2393 PolarHBondContact N-O 3.19Å; T2364-I2393 PolarHBondContact O-N 3.27Å
2365	Y	82.7	Confident	76.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124.3	176.4	-60.1	-97	0	0	0	108.6	D2322 L2323 S2355 I2356 D2358 R2363 Y2389 I2392	D2322-Y2365 PolarHBondContact OD1-OH 3.45Å; L2323-Y2365 HydrophobicContact CB-CD1 3.96Å; L2323-Y2365 HydrophobicContact CB-CD2 4.26Å; L2323-Y2365 HydrophobicContact CB-CE1 4.21Å; L2323-Y2365 HydrophobicContact CB-CE2 4.49Å; L2323-Y2365 HydrophobicContact CB-CG 4.01Å; L2323-Y2365 HydrophobicContact CD1-CD2 3.84Å; L2323-Y2365 HydrophobicContact CD1-CE2 4.37Å; L2323-Y2365 HydrophobicContact CD1-CG 4.15Å; L2323-Y2365 HydrophobicContact CG-CD2 4.18Å; L2323-Y2365 HydrophobicContact CG-CE2 4.3Å; L2323-Y2365 HydrophobicContact CG-CG 4.41Å; S2355-Y2365 WeakPolarHBondContact CA-O 3.41Å; I2356-Y2365 PolarHBondContact N-O 2.92Å; I2356-Y2365 PolarHBondContact O-N 2.87Å; D2358-Y2365 HydrophobicContact CB-CE2 3.99Å; R2363-Y2365 HydrophobicContact CB-CD2 4.3Å; R2363-Y2365 HydrophobicContact CB-CE2 3.63Å; R2363-Y2365 WeakPolarHBondContact CD-OH 3.45Å; Y2365-Y2389 HydrophobicContact CD1-CG 4.46Å; Y2365-I2392 HydrophobicContact CD1-CD1 4.12Å; Y2365-I2392 HydrophobicContact CD1-CG1 3.83Å; Y2365-I2392 HydrophobicContact CE1-CD1 3.74Å; Y2365-I2392 HydrophobicContact CE1-CG1 3.94Å
2366	I	83.1	Confident	75.7	Confident	27 Å²	27	45.9 Å²	45.9	14%	0.138	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.6	-178.7	-60.5	177	0	0	0	109.2	K2353 T2364 S2390 K2391 I2393	K2353-I2366 HydrophobicContact CD-CG2 3.88Å; K2353-I2366 HydrophobicContact CG-CG2 3.86Å; T2364-I2366 HydrophobicContact CG2-CG1 4.37Å; I2366-S2390 PolarHBondContact O-N 3.44Å; I2366-S2390 PolarHBondContact O-OG 2.95Å; I2366-K2391 HydrophobicContact CB-CB 4.35Å; I2366-K2391 PolarHBondContact N-O 3.07Å; I2366-K2391 PolarHBondContact O-N 2.62Å; I2366-I2393 HydrophobicContact CD1-CD1 3.7Å; I2366-I2393 HydrophobicContact CD1-CG1 4.32Å
2367	F	87.7	Confident	74	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.2	176.2	-57.9	-95.4	0	0	0	108	L2323 I2326 K2353 V2354 I2356 V2387 Y2389	L2323-F2367 HydrophobicContact CB-CZ 4.19Å; I2326-F2367 HydrophobicContact CB-CD1 4.37Å; I2326-F2367 HydrophobicContact CB-CE1 4.46Å; I2326-F2367 HydrophobicContact CD1-CB 3.55Å; I2326-F2367 HydrophobicContact CD1-CD1 4.01Å; I2326-F2367 HydrophobicContact CD1-CD2 4.22Å; I2326-F2367 HydrophobicContact CD1-CG 3.67Å; I2326-F2367 HydrophobicContact CG1-CB 4.18Å; I2326-F2367 HydrophobicContact CG1-CD1 3.73Å; I2326-F2367 HydrophobicContact CG1-CE1 4.29Å; I2326-F2367 HydrophobicContact CG1-CG 3.94Å; I2326-F2367 HydrophobicContact CG2-CD1 3.96Å; I2326-F2367 HydrophobicContact CG2-CD2 4.09Å; I2326-F2367 HydrophobicContact CG2-CE1 3.75Å; I2326-F2367 HydrophobicContact CG2-CE2 3.91Å; I2326-F2367 HydrophobicContact CG2-CG 4.14Å; I2326-F2367 HydrophobicContact CG2-CZ 3.74Å; K2353-F2367 WeakPolarHBondContact CA-O 3.49Å; V2354-F2367 HydrophobicContact CB-CB 4.37Å; V2354-F2367 PolarHBondContact N-O 3.01Å; V2354-F2367 PolarHBondContact O-N 2.72Å; I2356-F2367 HydrophobicContact CB-CE2 4.29Å; I2356-F2367 HydrophobicContact CD1-CD2 4.12Å; I2356-F2367 HydrophobicContact CD1-CE2 3.77Å; I2356-F2367 HydrophobicContact CG1-CD2 4.14Å; I2356-F2367 HydrophobicContact CG1-CE2 3.96Å; F2367-V2387 HydrophobicContact CB-CG1 4.32Å; F2367-V2387 WeakPolarHBondContact CD1-O 3.16Å; F2367-Y2389 VanDerWaalsContact CE1-N 3.32Å
2368	T	86	Confident	72.6	Confident	64 Å²	64	52.3 Å²	52.3	39%	0.393	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.6	178.3	-58	0	0	0	0	108.1	S2390	T2368-S2390 PolarHBondContact OG1-OG 2.72Å
2369	I	85.1	Confident	71.3	Confident	17 Å²	17	57 Å²	57	9%	0.087	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-58.1	-171	-52.4	-164.8	0	0	0	110.2	I2326 L2328 C2351 E2352 V2354 Q2371 V2387	I2326-I2369 HydrophobicContact CD1-CD1 3.97Å; L2328-I2369 HydrophobicContact CD1-CD1 3.55Å; L2328-I2369 HydrophobicContact CD1-CG2 4.41Å; L2328-I2369 HydrophobicContact CD2-CD1 3.73Å; L2328-I2369 HydrophobicContact CG-CD1 4.34Å; C2351-I2369 HydrophobicContact CB-CB 4.4Å; C2351-I2369 HydrophobicContact CB-CD1 4.39Å; C2351-I2369 HydrophobicContact CB-CG2 4.23Å; E2352-I2369 PolarHBondContact O-N 3.33Å; V2354-I2369 HydrophobicContact CB-CD1 4.32Å; V2354-I2369 HydrophobicContact CG2-CD1 3.61Å; I2369-Q2371 HydrophobicContact CG2-CB 4.11Å; I2369-Q2371 PolarHBondContact O-N 3.29Å; I2369-Q2371 VanDerWaalsContact O-N 3.13Å; I2369-V2387 HydrophobicContact CD1-CG2 4.47Å; I2369-V2387 HydrophobicContact CG1-CG1 4.44Å; I2369-V2387 HydrophobicContact CG1-CG2 4.32Å
2370	H	84.5	Confident	70.6	Confident	112 Å²	112	60.1 Å²	60.1	52%	0.519	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.3	35	176.7	-71.8	31	0	0	0	113.7	F2350 C2351 E2352	F2350-H2370 VanDerWaalsContact CE2-C 3.41Å; F2350-H2370 WeakPolarHBondContact CE2-O 3.41Å; F2350-H2370 VanDerWaalsContact CZ-C 3.46Å; F2350-H2370 HydrophobicContact CZ-CB 4.41Å; C2351-H2370 WeakPolarHBondContact O-CA 3.35Å; C2351-H2370 PolarHBondContact O-N 2.77Å; E2352-H2370 VanDerWaalsContact CG-CE1 3.43Å; E2352-H2370 WeakPolarHBondContact CG-CE1 3.38Å; E2352-H2370 PolarHBondContact O-N 2.94Å; E2352-H2370 VanDerWaalsContact O-N 3.11Å; E2352-H2370 PolarHBondContact O-ND1 2.93Å
2371	Q	80.4	Confident	70.1	Confident	94 Å²	94	65.5 Å²	65.5	44%	0.439	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.9	-170.9	-166.2	178.3	13.5	0	0	112.6	C2351 I2369	C2351-Q2371 PolarHBondContact N-O 2.53Å; C2351-Q2371 PolarHBondContact O-N 3.32Å; I2369-Q2371 HydrophobicContact CG2-CB 4.11Å; I2369-Q2371 PolarHBondContact O-N 3.29Å; I2369-Q2371 VanDerWaalsContact O-N 3.13Å
2372	W	82.1	Confident	69.6	Low	102 Å²	102	73 Å²	73	39%	0.386	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	119.4	166.6	-71.2	99.3	0	0	0	111	D2273 K2348 W2349 F2350	D2273-W2372 VanDerWaalsContact O-CH2 3.31Å; D2273-W2372 WeakPolarHBondContact O-CH2 3.17Å; D2273-W2372 WeakPolarHBondContact O-CZ3 3.34Å; K2348-W2372 HydrophobicContact CB-CE3 3.78Å; K2348-W2372 HydrophobicContact CB-CZ3 4.17Å; W2349-W2372 CarbonylContact O-C 3.43Å; W2349-W2372 WeakPolarHBondContact O-CA 3.32Å; F2350-W2372 HydrophobicContact CB-CD2 3.82Å; F2350-W2372 HydrophobicContact CB-CE3 3.76Å; F2350-W2372 HydrophobicContact CB-CG 4.47Å; F2350-W2372 HydrophobicContact CB-CH2 4.17Å; F2350-W2372 HydrophobicContact CB-CZ2 4.17Å; F2350-W2372 HydrophobicContact CB-CZ3 3.96Å; F2350-W2372 AromaticContact CD2-CD1 3.59Å; F2350-W2372 AromaticContact CD2-CD2 3.87Å; F2350-W2372 HydrophobicContact CD2-CD2 3.87Å; F2350-W2372 AromaticContact CD2-CE2 3.81Å; F2350-W2372 AromaticContact CD2-CG 3.76Å; F2350-W2372 HydrophobicContact CD2-CG 3.76Å; F2350-W2372 AromaticContact CD2-NE1 3.59Å; F2350-W2372 HydrophobicContact CG-CD2 4.3Å
2373	L	82.9	Confident	69.2	Low	6 Å²	6	75.2 Å²	75.2	3%	0.031	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	158.3	168.8	-60.9	125.8	0	0	0	109.2	L2328 I2330 K2348 W2349 C2351 V2385	L2328-L2373 HydrophobicContact CD1-CD1 3.6Å; L2328-L2373 HydrophobicContact CD1-CD2 3.79Å; L2328-L2373 HydrophobicContact CD1-CG 4.35Å; L2328-L2373 HydrophobicContact CG-CD2 3.82Å; I2330-L2373 HydrophobicContact CD1-CB 3.81Å; I2330-L2373 HydrophobicContact CG1-CB 3.89Å; K2348-L2373 WeakPolarHBondContact CA-O 3.48Å; K2348-L2373 VanDerWaalsContact CB-O 3.27Å; K2348-L2373 WeakPolarHBondContact CB-O 3.45Å; W2349-L2373 HydrophobicContact CD2-CD1 4.2Å; W2349-L2373 HydrophobicContact CE3-CD1 3.54Å; W2349-L2373 HydrophobicContact CZ3-CD1 3.84Å; W2349-L2373 PolarHBondContact N-O 3.02Å; W2349-L2373 VanDerWaalsContact N-O 3.12Å; W2349-L2373 PolarHBondContact O-N 2.94Å; C2351-L2373 HydrophobicContact CB-CD1 3.98Å; L2373-V2385 HydrophobicContact CD2-CB 3.87Å; L2373-V2385 HydrophobicContact CD2-CG2 3.57Å; L2373-V2385 HydrophobicContact CG-CG2 4.5Å
2374	S	76.4	Confident	69.3	Low	58 Å²	58	73.7 Å²	73.7	41%	0.406	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	154.1	-178.5	-57.8	0	0	0	0	110.6
2375	V	72.4	Confident	68.8	Low	32 Å²	32	73.2 Å²	73.2	19%	0.194	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-62.6	137.3	-178.9	179	0	0	0	0	111.7	C2278 I2330 E2332 Q2347	C2278-V2375 HydrophobicContact CB-CG2 4.39Å; I2330-V2375 HydrophobicContact CB-CG2 4.29Å; I2330-V2375 HydrophobicContact CG2-CG2 3.9Å; E2332-V2375 HydrophobicContact CB-CG1 4.03Å; Q2347-V2375 HydrophobicContact CB-CG2 3.66Å
2376	T	60.2	Low	68.7	Low	30 Å²	30	77.7 Å²	77.7	18%	0.184	41%	0.411	C	S	.	.			trans	-116.4	126.8	177.3	54.4	0	0	0	0	111.9	I2330 K2383	I2330-T2376 PolarHBondContact O-N 2.93Å; I2330-T2376 PolarHBondContact O-OG1 2.86Å; T2376-K2383 HydrophobicContact CG2-CB 3.56Å; T2376-K2383 HydrophobicContact CG2-CD 4.21Å
2377	P	53.9	Low	68.5	Low	95 Å²	95	77.3 Å²	77.3	62%	0.617	41%	0.41	S	S	*	.			trans	-58.9	145	170.9	-24.8	34.9	0	0	0	112.4	S2379 N2380	P2377-S2379 PolarHBondContact O-N 3.32Å; P2377-N2380 PolarHBondContact O-N 3.39Å
2378	T	49.2	Very low	68.2	Low	127 Å²	127	82.8 Å²	82.8	78%	0.779	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	2.9	-162.7	-10.3	0	0	0	0	116.6
2379	S	45.4	Very low	67.7	Low	104 Å²	104	84.4 Å²	84.4	73%	0.727	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-2.1	-172.6	58.6	0	0	0	0	115.5	P2377	P2377-S2379 PolarHBondContact O-N 3.32Å
2380	N	46.1	Very low	66.7	Low	105 Å²	105	87 Å²	87	56%	0.561	46%	0.458	S	S	*	.			trans	-134.8	95.8	-176.1	-100.3	-67.5	0	0	0	114.4	P2377 K2382	P2377-N2380 PolarHBondContact O-N 3.39Å; N2380-K2382 PolarHBondContact O-N 2.82Å
2381	L	49.2	Very low	65.6	Low	152 Å²	152	87.5 Å²	87.5	80%	0.796	46%	0.459	S	S	*	.			trans	-72.6	43	170.7	-77.9	163.3	0	0	0	113.4
2382	K	50.1	Low	65	Low	182 Å²	182	85.7 Å²	85.7	79%	0.791	45%	0.452	S	S	*	.	S	Bend	trans	-120.2	14.8	-179	-76.8	-171.8	173.5	-177.7	0	113.7	N2380	N2380-K2382 PolarHBondContact O-N 2.82Å
2383	K	53.8	Low	63.6	Low	163 Å²	163	84.3 Å²	84.3	71%	0.709	45%	0.451	S	S	*	.			trans	-137	17.7	-175	-80	-168.3	173.3	-173	0	113.7	T2376	T2376-K2383 HydrophobicContact CG2-CB 3.56Å; T2376-K2383 HydrophobicContact CG2-CD 4.21Å
2384	D	66.4	Low	62.2	Low	38 Å²	38	89.1 Å²	89.1	20%	0.203	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-76	139.3	170	57.4	-41.3	0	0	0	111.3	W2281 R2327	W2281-D2384 HydrophobicContact CH2-CB 3.63Å; W2281-D2384 HydrophobicContact CZ2-CB 4.11Å; R2327-D2384 VanDerWaalsContact CD-OD2 3.28Å; R2327-D2384 WeakPolarHBondContact CD-OD2 3.15Å; R2327-D2384 IonicContact CZ-OD2 3.37Å; R2327-D2384 IonicContact NE-OD2 3.46Å; R2327-D2384 IonicContact NH1-OD2 2.68Å; R2327-D2384 PolarHBondContact NH1-OD2 3.02Å
2385	V	68.1	Low	60.9	Low	29 Å²	29	88.9 Å²	88.9	18%	0.176	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	117.2	178.8	176.1	0	0	0	0	108.7	R2327 L2328 L2373 V2387	R2327-V2385 VanDerWaalsContact CA-O 3.31Å; R2327-V2385 WeakPolarHBondContact CA-O 3.47Å; L2328-V2385 HydrophobicContact CD2-CB 4.43Å; L2328-V2385 HydrophobicContact CD2-CG1 4.48Å; L2328-V2385 WeakPolarHBondContact CD2-O 3.44Å; L2328-V2385 HydrophobicContact CG-CB 4.44Å; L2328-V2385 PolarHBondContact N-O 3.33Å; L2328-V2385 VanDerWaalsContact N-O 3.13Å; L2328-V2385 PolarHBondContact O-N 2.88Å; L2373-V2385 HydrophobicContact CD2-CB 3.87Å; L2373-V2385 HydrophobicContact CD2-CG2 3.57Å; L2373-V2385 HydrophobicContact CG-CG2 4.5Å; V2385-V2387 HydrophobicContact CG1-CG2 3.79Å
2386	L	79.8	Confident	59.4	Low	94 Å²	94	89.8 Å²	89.8	49%	0.492	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.2	177.6	-174.7	73.4	0	0	0	110	E2285 T2325 I2326 R2327	E2285-L2386 WeakPolarHBondContact OE2-CD1 3.45Å; T2325-L2386 HydrophobicContact CG2-CD1 3.86Å; T2325-L2386 HydrophobicContact CG2-CD2 4.4Å; T2325-L2386 HydrophobicContact CG2-CG 4Å; I2326-L2386 CarbonylContact O-C 3.54Å; I2326-L2386 WeakPolarHBondContact O-CA 3.2Å; R2327-L2386 HydrophobicContact CG-CD1 3.51Å
2387	V	79	Confident	58.7	Low	19 Å²	19	89.5 Å²	89.5	12%	0.115	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.5	-175.4	-170.2	0	0	0	0	110.5	T2325 I2326 L2328 F2367 I2369 V2385	T2325-V2387 CarbonylContact C-O 3.55Å; T2325-V2387 VanDerWaalsContact CA-O 3.3Å; T2325-V2387 WeakPolarHBondContact CA-O 3.4Å; I2326-V2387 HydrophobicContact CD1-CB 4.49Å; I2326-V2387 HydrophobicContact CG1-CB 3.91Å; I2326-V2387 PolarHBondContact N-O 2.94Å; I2326-V2387 PolarHBondContact O-N 3.22Å; L2328-V2387 HydrophobicContact CD2-CG2 3.97Å; F2367-V2387 HydrophobicContact CB-CG1 4.32Å; F2367-V2387 WeakPolarHBondContact CD1-O 3.16Å; I2369-V2387 HydrophobicContact CD1-CG2 4.47Å; I2369-V2387 HydrophobicContact CG1-CG1 4.44Å; I2369-V2387 HydrophobicContact CG1-CG2 4.32Å; V2385-V2387 HydrophobicContact CG1-CG2 3.79Å
2388	N	80.4	Confident	58.6	Low	116 Å²	116	88 Å²	88	62%	0.62	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	154.4	170.7	-64.6	-40	0	0	0	110.8	E2324 T2325	E2324-N2388 WeakPolarHBondContact O-CA 3.46Å; T2325-N2388 WeakPolarHBondContact CG2-OD1 3.38Å
2389	Y	76.2	Confident	58.7	Low	97 Å²	97	88 Å²	88	38%	0.38	44%	0.443	S	S	.	.			trans	-65.1	143	170.2	70.9	-92.1	0	0	0	111.2	L2323 E2324 Y2365 F2367 I2392	L2323-Y2389 WeakPolarHBondContact O-CD1 3.2Å; L2323-Y2389 VanDerWaalsContact O-CE1 3.32Å; L2323-Y2389 WeakPolarHBondContact O-CE1 3.2Å; E2324-Y2389 PolarHBondContact O-N 3.29Å; Y2365-Y2389 HydrophobicContact CD1-CG 4.46Å; F2367-Y2389 VanDerWaalsContact CE1-N 3.32Å; Y2389-I2392 HydrophobicContact CD2-CD1 4.27Å; Y2389-I2392 HydrophobicContact CD2-CG1 3.79Å; Y2389-I2392 HydrophobicContact CE2-CD1 3.68Å; Y2389-I2392 HydrophobicContact CE2-CG1 3.64Å
2390	S	64.2	Low	58.7	Low	71 Å²	71	83.2 Å²	83.2	50%	0.497	41%	0.41	S	S	.	.			trans	-97.2	-28.1	178.1	67.9	0	0	0	0	112.9	I2366 T2368	I2366-S2390 PolarHBondContact O-N 3.44Å; I2366-S2390 PolarHBondContact O-OG 2.95Å; T2368-S2390 PolarHBondContact OG1-OG 2.72Å
2391	K	61.3	Low	58.8	Low	123 Å²	123	78.7 Å²	78.7	54%	0.535	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	138.8	-176.6	-174	176.1	-178	-177.8	0	111.2	I2366 I2393	I2366-K2391 HydrophobicContact CB-CB 4.35Å; I2366-K2391 PolarHBondContact N-O 3.07Å; I2366-K2391 PolarHBondContact O-N 2.62Å; K2391-I2393 HydrophobicContact CD-CG1 4.32Å; K2391-I2393 HydrophobicContact CG-CG1 4.31Å
2392	I	68	Low	59.1	Low	56 Å²	56	75.7 Å²	75.7	29%	0.287	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	138	165.2	-59.8	178	0	0	0	107.7	R2363 Y2365 Y2389 E2394	R2363-I2392 HydrophobicContact CB-CG2 4.04Å; R2363-I2392 HydrophobicContact CG-CG2 3.99Å; Y2365-I2392 HydrophobicContact CD1-CD1 4.12Å; Y2365-I2392 HydrophobicContact CD1-CG1 3.83Å; Y2365-I2392 HydrophobicContact CE1-CD1 3.74Å; Y2365-I2392 HydrophobicContact CE1-CG1 3.94Å; Y2389-I2392 HydrophobicContact CD2-CD1 4.27Å; Y2389-I2392 HydrophobicContact CD2-CG1 3.79Å; Y2389-I2392 HydrophobicContact CE2-CD1 3.68Å; Y2389-I2392 HydrophobicContact CE2-CG1 3.64Å; I2392-E2394 HydrophobicContact CG2-CG 4.44Å
2393	I	53.8	Low	59.3	Low	73 Å²	73	70.3 Å²	70.3	37%	0.374	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.1	169.8	-57.5	-178.1	0	0	0	108.3	R2363 T2364 I2366 K2391	R2363-I2393 WeakPolarHBondContact CA-O 3.32Å; T2364-I2393 PolarHBondContact N-O 3.19Å; T2364-I2393 PolarHBondContact O-N 3.27Å; I2366-I2393 HydrophobicContact CD1-CD1 3.7Å; I2366-I2393 HydrophobicContact CD1-CG1 4.32Å; K2391-I2393 HydrophobicContact CD-CG1 4.32Å; K2391-I2393 HydrophobicContact CG-CG1 4.31Å
2394	E	51.7	Low	59.4	Low	107 Å²	107	63.5 Å²	63.5	50%	0.5	32%	0.319	S	S	.	.			trans	-96.3	155.2	170.5	-53.6	-160.5	125.9	0	0	110.6	R2363 I2392	R2363-E2394 HydrophobicContact CG-CG 4.29Å; R2363-E2394 IonicContact CZ-OE1 3.69Å; R2363-E2394 VanDerWaalsContact CZ-OE1 3.25Å; R2363-E2394 IonicContact NE-OE1 3.51Å; R2363-E2394 PolarHBondContact NE-OE1 2.79Å; R2363-E2394 IonicContact NH2-OE1 2.75Å; R2363-E2394 PolarHBondContact NH2-OE1 2.79Å; I2392-E2394 HydrophobicContact CG2-CG 4.44Å
2395	D	49.5	Very low	58.8	Low	53 Å²	53	62.8 Å²	62.8	28%	0.283	31%	0.314	S	S	.	.			trans	-75	120.4	176.7	-171.1	-57.5	0	0	0	110.8	Y2397 K2398 K2399	D2395-Y2397 VanDerWaalsContact C-N 3.35Å; D2395-Y2397 PolarHBondContact O-N 3.22Å; D2395-Y2397 WeakPolarHBondContact OD1-CB 3.41Å; D2395-Y2397 PolarHBondContact OD1-N 3.22Å; D2395-K2398 HydrophobicContact CB-CB 3.95Å; D2395-K2398 PolarHBondContact O-N 3.18Å; D2395-K2398 PolarHBondContact OD1-N 3.17Å; D2395-K2398 VanDerWaalsContact OD1-N 3.17Å; D2395-K2399 PolarHBondContact O-N 3.5Å
2396	P	41	Very low	58.4	Low	51 Å²	51	66.7 Å²	66.7	33%	0.331	33%	0.334	S	S	.	.	H	α-helix	trans	-73.8	-21.6	-174.6	30.8	-35.1	0	0	0	113.6	T1991 A2400	T1991-P2396 VanDerWaalsContact O-CG 3.3Å; T1991-P2396 WeakPolarHBondContact O-CG 3.27Å; P2396-A2400 WeakPolarHBondContact O-CB 3.33Å; P2396-A2400 PolarHBondContact O-N 3.27Å
2397	Y	45.4	Very low	57.7	Low	25 Å²	25	63.3 Å²	63.3	10%	0.098	32%	0.315	C	S	.	.	H	α-helix	trans	-74.3	-39.9	170.2	-92.7	-87.8	0	0	0	111.5	G1990 T1991 G1993 E2119 D2395 K2399 A2400 F2401	G1990-Y2397 WeakPolarHBondContact O-CE2 3.39Å; T1991-Y2397 VanDerWaalsContact O-CD2 3.31Å; T1991-Y2397 WeakPolarHBondContact O-CD2 3.29Å; G1993-Y2397 WeakPolarHBondContact CA-OH 3.44Å; G1993-Y2397 PolarHBondContact O-OH 2.86Å; E2119-Y2397 WeakPolarHBondContact O-CD1 3.47Å; D2395-Y2397 VanDerWaalsContact C-N 3.35Å; D2395-Y2397 PolarHBondContact O-N 3.22Å; D2395-Y2397 WeakPolarHBondContact OD1-CB 3.41Å; D2395-Y2397 PolarHBondContact OD1-N 3.22Å; Y2397-K2399 PolarHBondContact O-N 3.2Å; Y2397-A2400 PolarHBondContact O-N 2.98Å; Y2397-F2401 VanDerWaalsContact O-CB 3.24Å; Y2397-F2401 WeakPolarHBondContact O-CB 3.36Å; Y2397-F2401 PolarHBondContact O-N 3.43Å
2398	K	51.5	Low	57.3	Low	64 Å²	64	69.9 Å²	69.9	28%	0.278	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-35.9	175.7	-168.2	179.6	175.4	-170.6	0	111.4	S2361 D2395 N2402	S2361-K2398 PolarHBondContact O-NZ 3.01Å; D2395-K2398 HydrophobicContact CB-CB 3.95Å; D2395-K2398 PolarHBondContact O-N 3.18Å; D2395-K2398 PolarHBondContact OD1-N 3.17Å; D2395-K2398 VanDerWaalsContact OD1-N 3.17Å; K2398-N2402 PolarHBondContact O-N 2.8Å
2399	K	50.9	Low	57	Low	126 Å²	126	66.7 Å²	66.7	55%	0.548	33%	0.329	S	S	.	.	H	α-helix	trans	-66.9	-53.5	170.5	-179.9	169.4	174.9	172.5	0	112.4	D2395 Y2397 F2401 N2402 E2403	D2395-K2399 PolarHBondContact O-N 3.5Å; Y2397-K2399 PolarHBondContact O-N 3.2Å; K2399-F2401 VanDerWaalsContact C-N 3.26Å; K2399-F2401 PolarHBondContact O-N 2.97Å; K2399-N2402 PolarHBondContact O-N 3.21Å; K2399-E2403 WeakPolarHBondContact CE-OE1 3.39Å; K2399-E2403 IonicContact NZ-OE1 2.63Å; K2399-E2403 PolarHBondContact O-N 3.1Å; K2399-E2403 VanDerWaalsContact O-N 3.15Å
2400	A	45.5	Very low	57.3	Low	3 Å²	3	62.6 Å²	62.6	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-34.7	-179.1	0	0	0	0	0	112.8	P2396 Y2397 E2403 L2404 T2438 P2439	P2396-A2400 WeakPolarHBondContact O-CB 3.33Å; P2396-A2400 PolarHBondContact O-N 3.27Å; Y2397-A2400 PolarHBondContact O-N 2.98Å; A2400-E2403 PolarHBondContact O-N 2.85Å; A2400-L2404 WeakPolarHBondContact O-CB 3.19Å; A2400-L2404 PolarHBondContact O-N 3.26Å; A2400-T2438 HydrophobicContact CB-CG2 3.96Å; A2400-P2439 WeakPolarHBondContact CB-O 3.36Å
2401	F	49.1	Very low	58.2	Low	11 Å²	11	62.2 Å²	62.2	5%	0.048	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-47.7	174.7	174	-93	0	0	0	112.2	N2156 A2158 Y2397 K2399 E2403 L2404 K2405	N2156-F2401 HydrophobicContact CB-CD2 4.04Å; N2156-F2401 HydrophobicContact CB-CE1 4.39Å; N2156-F2401 HydrophobicContact CB-CE2 3.42Å; N2156-F2401 VanDerWaalsContact CB-CE2 3.42Å; N2156-F2401 HydrophobicContact CB-CZ 3.63Å; A2158-F2401 HydrophobicContact CB-CD2 3.88Å; A2158-F2401 HydrophobicContact CB-CE2 4.14Å; Y2397-F2401 VanDerWaalsContact O-CB 3.24Å; Y2397-F2401 WeakPolarHBondContact O-CB 3.36Å; Y2397-F2401 PolarHBondContact O-N 3.43Å; K2399-F2401 VanDerWaalsContact C-N 3.26Å; K2399-F2401 PolarHBondContact O-N 2.97Å; F2401-E2403 VanDerWaalsContact C-N 3.35Å; F2401-E2403 PolarHBondContact O-N 2.94Å; F2401-L2404 PolarHBondContact O-N 3.2Å; F2401-K2405 HydrophobicContact CE1-CD 4.34Å; F2401-K2405 HydrophobicContact CZ-CD 4.49Å; F2401-K2405 WeakPolarHBondContact O-CB 3.36Å; F2401-K2405 PolarHBondContact O-N 3.37Å
2402	N	55.6	Low	59.5	Low	89 Å²	89	56.3 Å²	56.3	48%	0.476	28%	0.28	S	S	.	.	H	α-helix	trans	-65.2	-37.6	178.1	-76.6	-12	0	0	0	112	K2398 K2399	K2398-N2402 PolarHBondContact O-N 2.8Å; K2399-N2402 PolarHBondContact O-N 3.21Å
2403	E	54	Low	60.5	Low	69 Å²	69	55.6 Å²	55.6	32%	0.322	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-37.4	173.1	-70.4	173.5	-168.6	0	0	112.2	K2399 A2400 F2401 K2407 T2438	K2399-E2403 WeakPolarHBondContact CE-OE1 3.39Å; K2399-E2403 IonicContact NZ-OE1 2.63Å; K2399-E2403 PolarHBondContact O-N 3.1Å; K2399-E2403 VanDerWaalsContact O-N 3.15Å; A2400-E2403 PolarHBondContact O-N 2.85Å; F2401-E2403 VanDerWaalsContact C-N 3.35Å; F2401-E2403 PolarHBondContact O-N 2.94Å; E2403-K2407 WeakPolarHBondContact O-CE 3.41Å; E2403-K2407 WeakPolarHBondContact O-CG 3.42Å; E2403-T2438 WeakPolarHBondContact OE2-CG2 3.46Å; E2403-T2438 PolarHBondContact OE2-OG1 3.12Å; E2403-T2438 VanDerWaalsContact OE2-OG1 3.11Å
2404	L	55.4	Low	62.3	Low	19 Å²	19	52.1 Å²	52.1	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-70.8	-42.4	-179.3	-115.5	156.1	0	0	0	113.7	A2158 A2400 F2401 N2406 K2407 L2441	A2158-L2404 HydrophobicContact CB-CB 4.14Å; A2158-L2404 HydrophobicContact CB-CD1 4.14Å; A2158-L2404 HydrophobicContact CB-CD2 4.46Å; A2158-L2404 HydrophobicContact CB-CG 4.49Å; A2400-L2404 WeakPolarHBondContact O-CB 3.19Å; A2400-L2404 PolarHBondContact O-N 3.26Å; F2401-L2404 PolarHBondContact O-N 3.2Å; L2404-N2406 PolarHBondContact O-N 2.9Å; L2404-K2407 WeakPolarHBondContact O-CB 3.36Å; L2404-K2407 WeakPolarHBondContact O-CG 3.32Å; L2404-K2407 PolarHBondContact O-N 3.35Å; L2404-K2407 VanDerWaalsContact O-N 3.16Å; L2404-L2441 HydrophobicContact CD1-CD1 4.45Å; L2404-L2441 HydrophobicContact CD2-CD1 3.83Å; L2404-L2441 HydrophobicContact CG-CD1 4.06Å
2405	K	54.8	Low	64.2	Low	23 Å²	23	47.3 Å²	47.3	10%	0.1	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-31.7	-170.1	-179.3	-177.7	166.1	-167.9	0	113.4	L170 F2401	L170-K2405 WeakPolarHBondContact O-CE 3.44Å; L170-K2405 PolarHBondContact O-NZ 2.93Å; F2401-K2405 HydrophobicContact CE1-CD 4.34Å; F2401-K2405 HydrophobicContact CZ-CD 4.49Å; F2401-K2405 WeakPolarHBondContact O-CB 3.36Å; F2401-K2405 PolarHBondContact O-N 3.37Å
2406	N	59.3	Low	66.2	Low	112 Å²	112	44.8 Å²	44.8	60%	0.599	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	6.1	-176.4	-64.2	0.8	0	0	0	113.2	L2404	L2404-N2406 PolarHBondContact O-N 2.9Å
2407	K	64.7	Low	68.6	Low	23 Å²	23	46.5 Å²	46.5	10%	0.1	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-76.9	143	179.7	-64.5	-58.9	-170.1	111.8	0	112.4	P2217 E2403 L2404 I2469 D2470 E2472	P2217-K2407 WeakPolarHBondContact CG-O 3.48Å; E2403-K2407 WeakPolarHBondContact O-CE 3.41Å; E2403-K2407 WeakPolarHBondContact O-CG 3.42Å; L2404-K2407 WeakPolarHBondContact O-CB 3.36Å; L2404-K2407 WeakPolarHBondContact O-CG 3.32Å; L2404-K2407 PolarHBondContact O-N 3.35Å; L2404-K2407 VanDerWaalsContact O-N 3.16Å; K2407-I2469 HydrophobicContact CB-CG2 3.33Å; K2407-I2469 HydrophobicContact CG-CG2 4.02Å; K2407-D2470 PolarHBondContact NZ-O 2.78Å; K2407-E2472 VanDerWaalsContact CE-OE1 3.24Å; K2407-E2472 WeakPolarHBondContact CE-OE1 3.41Å; K2407-E2472 IonicContact NZ-OE1 2.66Å; K2407-E2472 PolarHBondContact NZ-OE1 3.32Å
2408	Q	70.9	Confident	70.7	Confident	156 Å²	156	45.4 Å²	45.4	73%	0.729	22%	0.218	S	C	*	.	P	Polyproline II helix	trans	-91.4	157.1	169.2	-61.9	-176.5	5.8	0	0	111	D2470	Q2408-D2470 PolarHBondContact O-N 2.96Å
2409	T	74.8	Confident	72.1	Confident	50 Å²	50	42.4 Å²	42.4	31%	0.307	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	135.1	170	-28.5	0	0	0	0	109.7	E2467 S2468	T2409-E2467 HydrophobicContact CG2-CG 3.5Å; T2409-S2468 WeakPolarHBondContact CG2-O 3.21Å
2410	V	81.4	Confident	73.5	Confident	11 Å²	11	40 Å²	40	7%	0.067	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	157.5	-175.9	-63.1	0	0	0	0	111.4	Y2412 E2467 S2468 D2470 T2501	V2410-Y2412 HydrophobicContact CG2-CD2 4.31Å; V2410-Y2412 HydrophobicContact CG2-CE2 3.56Å; V2410-E2467 WeakPolarHBondContact O-CA 3.03Å; V2410-S2468 PolarHBondContact N-O 2.88Å; V2410-S2468 PolarHBondContact O-N 3.43Å; V2410-D2470 HydrophobicContact CG1-CB 4.15Å; V2410-D2470 HydrophobicContact CG2-CB 3.86Å; V2410-T2501 WeakPolarHBondContact CG1-OG1 3.36Å
2411	M	84.1	Confident	74.9	Confident	62 Å²	62	43.6 Å²	43.6	31%	0.305	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127	177.1	-85.8	-93.4	-79.3	0	0	111	Y2465 E2467 Q2500	M2411-Y2465 HydrophobicContact CE-CD1 3.89Å; M2411-Y2465 HydrophobicContact CE-CG 4Å; M2411-E2467 HydrophobicContact SD-CB 4.43Å; M2411-Q2500 HydrophobicContact CB-CB 4.12Å; M2411-Q2500 HydrophobicContact CB-CG 4.1Å; M2411-Q2500 VanDerWaalsContact O-CB 3.31Å; M2411-Q2500 WeakPolarHBondContact O-CB 3.35Å; M2411-Q2500 WeakPolarHBondContact O-CG 3.17Å; M2411-Q2500 PolarHBondContact O-N 3.11Å
2412	Y	87.5	Confident	76	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.4	169.2	-67.4	-82.8	0	0	0	110	V2410 M2434 Y2465 V2466 D2470 L2471 I2474 I2497 T2498 N2499	V2410-Y2412 HydrophobicContact CG2-CD2 4.31Å; V2410-Y2412 HydrophobicContact CG2-CE2 3.56Å; Y2412-M2434 HydrophobicContact CD2-CE 4.07Å; Y2412-M2434 HydrophobicContact CG-CE 4.26Å; Y2412-M2434 HydrophobicContact CG-SD 4.48Å; Y2412-Y2465 CarbonylContact O-C 3.51Å; Y2412-Y2465 WeakPolarHBondContact O-CA 3.29Å; Y2412-V2466 PolarHBondContact N-O 2.86Å; Y2412-V2466 PolarHBondContact O-N 2.91Å; Y2412-D2470 PolarHBondContact OH-OD1 2.86Å; Y2412-L2471 HydrophobicContact CE2-CG 4.4Å; Y2412-L2471 PolarHBondContact OH-N 3.24Å; Y2412-I2474 HydrophobicContact CD1-CD1 4.11Å; Y2412-I2474 HydrophobicContact CE1-CD1 3.84Å; Y2412-I2497 HydrophobicContact CD1-CG2 3.92Å; Y2412-I2497 HydrophobicContact CG-CG2 4.42Å; Y2412-T2498 CarbonylContact C-O 3.59Å; Y2412-T2498 WeakPolarHBondContact CA-O 3.29Å; Y2412-N2499 HydrophobicContact CD1-CB 4.04Å; Y2412-N2499 HydrophobicContact CE1-CB 3.7Å
2413	K	89.6	Confident	77	Confident	41 Å²	41	44.8 Å²	44.8	18%	0.178	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	119.9	166.7	-172.4	-179	-174.1	-170.8	0	109	E2463 Y2465 I2497 T2498 Q2500	K2413-E2463 WeakPolarHBondContact CE-OE1 3.23Å; K2413-E2463 WeakPolarHBondContact CE-OE2 3.41Å; K2413-E2463 IonicContact NZ-OE1 2.77Å; K2413-E2463 PolarHBondContact NZ-OE1 2.81Å; K2413-E2463 IonicContact NZ-OE2 3.43Å; K2413-E2463 PolarHBondContact NZ-OE2 3.02Å; K2413-Y2465 HydrophobicContact CB-CD1 3.96Å; K2413-Y2465 HydrophobicContact CB-CE1 3.75Å; K2413-Y2465 HydrophobicContact CD-CE1 3.74Å; K2413-Y2465 WeakPolarHBondContact CE-OH 3.42Å; K2413-Y2465 HydrophobicContact CG-CD1 4.04Å; K2413-Y2465 HydrophobicContact CG-CE1 3.57Å; K2413-I2497 CarbonylContact O-C 3.56Å; K2413-I2497 WeakPolarHBondContact O-CA 3.28Å; K2413-T2498 PolarHBondContact N-O 2.91Å; K2413-T2498 PolarHBondContact O-N 2.7Å; K2413-Q2500 HydrophobicContact CB-CG 4.36Å
2414	V	91.2	Very high	78.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	111.9	179.3	-179.2	0	0	0	0	108.6	I2416 I2432 L2448 F2464 V2466 V2495 L2496 I2497	V2414-I2416 HydrophobicContact CG1-CD1 4.47Å; V2414-I2416 HydrophobicContact CG1-CG1 4.32Å; V2414-I2432 HydrophobicContact CG1-CD1 3.89Å; V2414-L2448 HydrophobicContact CG1-CD1 4.41Å; V2414-F2464 PolarHBondContact N-O 2.75Å; V2414-F2464 PolarHBondContact O-N 3.18Å; V2414-V2466 HydrophobicContact CG2-CB 4.49Å; V2414-V2466 HydrophobicContact CG2-CG2 4Å; V2414-V2495 HydrophobicContact CG1-CG1 3.89Å; V2414-L2496 CarbonylContact C-O 3.05Å; V2414-L2496 WeakPolarHBondContact CA-O 3.2Å; V2414-I2497 HydrophobicContact CG1-CG1 4.46Å; V2414-I2497 HydrophobicContact CG2-CD1 4.5Å; V2414-I2497 HydrophobicContact CG2-CG1 4.32Å; V2414-I2497 HydrophobicContact CG2-CG2 4.36Å
2415	S	91.7	Very high	79.7	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.035	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.9	-179.2	-48.2	0	0	0	0	110.4	D2462 E2463 V2495 L2496	S2415-D2462 CarbonylContact C-O 3.49Å; S2415-D2462 WeakPolarHBondContact CA-O 3.28Å; S2415-E2463 WeakPolarHBondContact CB-OE1 3.2Å; S2415-E2463 PolarHBondContact OG-OE1 3.18Å; S2415-V2495 CarbonylContact O-C 2.98Å; S2415-V2495 WeakPolarHBondContact O-CA 3.28Å; S2415-L2496 PolarHBondContact N-O 3.2Å; S2415-L2496 PolarHBondContact O-N 2.84Å
2416	I	92	Very high	81.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.2	-172.8	-73.6	176.8	0	0	0	110	V2414 L2448 F2456 L2461 D2462 F2464 I2479 W2490 L2492 V2495	V2414-I2416 HydrophobicContact CG1-CD1 4.47Å; V2414-I2416 HydrophobicContact CG1-CG1 4.32Å; I2416-L2448 HydrophobicContact CD1-CD1 3.36Å; I2416-F2456 HydrophobicContact CD1-CE1 4.1Å; I2416-F2456 HydrophobicContact CG2-CD1 4.08Å; I2416-F2456 HydrophobicContact CG2-CE1 4.12Å; I2416-L2461 WeakPolarHBondContact O-CA 3.2Å; I2416-L2461 WeakPolarHBondContact O-CD1 3.34Å; I2416-D2462 PolarHBondContact N-O 2.93Å; I2416-D2462 PolarHBondContact O-N 3.01Å; I2416-F2464 HydrophobicContact CD1-CD2 4.44Å; I2416-F2464 HydrophobicContact CD1-CE2 4.21Å; I2416-I2479 HydrophobicContact CD1-CD1 3.88Å; I2416-W2490 HydrophobicContact CG2-CH2 4.05Å; I2416-W2490 HydrophobicContact CG2-CZ2 3.62Å; I2416-L2492 HydrophobicContact CG2-CD1 3.9Å; I2416-V2495 HydrophobicContact CG1-CG1 4.02Å; I2416-V2495 HydrophobicContact CG1-CG2 4.26Å
2417	Y	91.6	Very high	82.2	Confident	88 Å²	88	41 Å²	41	35%	0.345	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.4	175.4	-79.6	-101.4	0	0	0	110.9	L2461 D2493 K2494	Y2417-L2461 HydrophobicContact CD2-CD1 3.7Å; Y2417-L2461 HydrophobicContact CE1-CB 4.45Å; Y2417-L2461 HydrophobicContact CE1-CD1 4.31Å; Y2417-L2461 HydrophobicContact CE2-CD1 3.41Å; Y2417-L2461 VanDerWaalsContact CE2-CD1 3.41Å; Y2417-L2461 HydrophobicContact CE2-CD2 4.39Å; Y2417-L2461 HydrophobicContact CE2-CG 4.43Å; Y2417-L2461 HydrophobicContact CG-CD1 4.26Å; Y2417-D2493 PolarHBondContact O-N 2.81Å; Y2417-K2494 HydrophobicContact CD2-CD 4.19Å; Y2417-K2494 HydrophobicContact CD2-CG 3.82Å; Y2417-K2494 HydrophobicContact CG-CD 4.39Å; Y2417-K2494 HydrophobicContact CG-CG 3.92Å; Y2417-K2494 PolarHBondContact N-O 2.82Å
2418	T	89.7	Confident	83.1	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	129.2	172.7	-62.3	0	0	0	0	110.3	A2424 D2457 K2459 Q2460 W2490	T2418-A2424 WeakPolarHBondContact CG2-O 2.96Å; T2418-D2457 VanDerWaalsContact CB-O 3.27Å; T2418-D2457 WeakPolarHBondContact CB-O 3.36Å; T2418-D2457 VanDerWaalsContact CG2-O 3.32Å; T2418-D2457 WeakPolarHBondContact CG2-O 3.44Å; T2418-K2459 VanDerWaalsContact O-CA 3.3Å; T2418-K2459 WeakPolarHBondContact O-CA 3.45Å; T2418-K2459 PolarHBondContact O-N 2.69Å; T2418-Q2460 PolarHBondContact N-O 2.79Å; T2418-W2490 PolarHBondContact OG1-NE1 3.15Å
2419	G	81.2	Confident	83.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.			trans	-74.7	178.3	-166.3	0	0	0	0	0	115.7	K2459 Y2491 D2493	G2419-K2459 PolarHBondContact O-N 3.2Å; G2419-Y2491 PolarHBondContact N-O 2.85Å; G2419-D2493 VanDerWaalsContact CA-CG 3.43Å; G2419-D2493 WeakPolarHBondContact CA-OD2 3.4Å
2420	T	80.2	Confident	84	Confident	77 Å²	77	32.8 Å²	32.8	47%	0.472	18%	0.184	S	C	.	.	S	Bend	trans	-98.2	-3.1	-162.3	70.5	0	0	0	0	115.3	R2458 K2459	T2420-R2458 PolarHBondContact O-NE 3.26Å; T2420-R2458 PolarHBondContact O-NH2 3.21Å; T2420-K2459 HydrophobicContact CG2-CG 3.98Å
2421	K	73.3	Confident	84.1	Confident	77 Å²	77	33.4 Å²	33.4	34%	0.335	19%	0.186	S	C	.	.	S	Bend	trans	-72	161	-177.7	-65.5	-169.8	179.1	169	0	112.1	G1881 A2424 R2458 Y2491 W2513	G1881-K2421 PolarHBondContact O-NZ 2.77Å; K2421-A2424 WeakPolarHBondContact O-CB 2.87Å; K2421-A2424 PolarHBondContact O-N 2.88Å; K2421-R2458 VanDerWaalsContact O-CD 3.24Å; K2421-R2458 WeakPolarHBondContact O-CD 3.41Å; K2421-R2458 PolarHBondContact O-NE 2.75Å; K2421-Y2491 HydrophobicContact CD-CD2 4.21Å; K2421-Y2491 HydrophobicContact CD-CE1 4.42Å; K2421-Y2491 HydrophobicContact CD-CE2 3.64Å; K2421-Y2491 WeakPolarHBondContact CE-OH 3.46Å; K2421-Y2491 HydrophobicContact CG-CE2 4.49Å; K2421-Y2491 PolarHBondContact NZ-OH 2.89Å; K2421-W2513 HydrophobicContact CB-CZ2 4.42Å
2422	G	72.3	Confident	84.2	Confident	46 Å²	46	30.5 Å²	30.5	47%	0.474	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	136.7	-179.4	0	0	0	0	0	111.6	A2424 W2513	G2422-A2424 VanDerWaalsContact C-N 3.3Å; G2422-A2424 PolarHBondContact O-N 2.71Å; G2422-W2513 WeakPolarHBondContact O-CH2 3.16Å
2423	C	77.2	Confident	83.9	Confident	79 Å²	79	31.2 Å²	31.2	53%	0.534	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	45.4	-174.3	-49.6	0	0	0	0	112.9	W2513	C2423-W2513 WeakPolarHBondContact O-CH2 3.33Å; C2423-W2513 WeakPolarHBondContact O-CZ3 3.49Å
2424	A	81.1	Confident	83.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.167	C	C	.	.			trans	-88.4	-7.8	177.9	0	0	0	0	0	114	T2418 K2421 G2422 R2458 Y2491 W2513	T2418-A2424 WeakPolarHBondContact CG2-O 2.96Å; K2421-A2424 WeakPolarHBondContact O-CB 2.87Å; K2421-A2424 PolarHBondContact O-N 2.88Å; G2422-A2424 VanDerWaalsContact C-N 3.3Å; G2422-A2424 PolarHBondContact O-N 2.71Å; A2424-R2458 HydrophobicContact CB-CG 4.32Å; A2424-Y2491 PolarHBondContact O-N 2.71Å; A2424-W2513 HydrophobicContact CB-CH2 4.49Å
2425	N	84.1	Confident	82.9	Confident	55 Å²	55	30.7 Å²	30.7	29%	0.294	17%	0.173	S	C	.	.			trans	-83.2	149.9	178.8	56.4	-39.6	0	0	0	111.7	F2456 D2457	N2425-F2456 VanDerWaalsContact CA-O 3.29Å; N2425-F2456 WeakPolarHBondContact CA-O 3.4Å; N2425-D2457 HydrophobicContact CB-CB 4.49Å; N2425-D2457 WeakPolarHBondContact CB-OD1 3.09Å; N2425-D2457 PolarHBondContact ND2-OD1 2.95Å
2426	T	85.8	Confident	82	Confident	12 Å²	12	31 Å²	31	7%	0.074	18%	0.176	C	C	.	.			trans	-135.6	145.3	-174.8	-169.6	0	0	0	0	112.2	A2428 I2430 F2456 P2488 W2490	T2426-A2428 PolarHBondContact OG1-N 3.14Å; T2426-I2430 HydrophobicContact CG2-CD1 4.05Å; T2426-F2456 HydrophobicContact CG2-CB 3.9Å; T2426-F2456 HydrophobicContact CG2-CG 4.45Å; T2426-P2488 WeakPolarHBondContact OG1-CA 3.4Å; T2426-P2488 PolarHBondContact OG1-O 2.72Å; T2426-W2490 HydrophobicContact CG2-CB 3.72Å; T2426-W2490 VanDerWaalsContact CG2-CD1 3.45Å; T2426-W2490 HydrophobicContact CG2-CD2 4.05Å; T2426-W2490 HydrophobicContact CG2-CG 3.49Å; T2426-W2490 VanDerWaalsContact CG2-CG 3.49Å
2427	D	82.4	Confident	80.6	Confident	76 Å²	76	33.7 Å²	33.7	41%	0.406	19%	0.192	S	C	.	.			trans	-109.2	10.7	175	53.4	-0.4	0	0	0	113	G2485 V2486 S2487	D2427-G2485 WeakPolarHBondContact OD1-CA 3.33Å; D2427-V2486 PolarHBondContact OD1-N 2.79Å; D2427-V2486 WeakPolarHBondContact OD2-CA 3.39Å; D2427-V2486 PolarHBondContact OD2-N 2.75Å; D2427-S2487 WeakPolarHBondContact OD1-CA 3.29Å; D2427-S2487 PolarHBondContact OD1-N 3.36Å; D2427-S2487 PolarHBondContact OD2-N 3.43Å
2428	A	82	Confident	79.1	Confident	6 Å²	6	30 Å²	30	5%	0.05	18%	0.179	C	C	.	.	S	Bend	trans	-81.7	151.9	175	0	0	0	0	0	112.6	T2426 I2430 H2481 T2484 P2488	T2426-A2428 PolarHBondContact OG1-N 3.14Å; A2428-I2430 PolarHBondContact O-N 3.09Å; A2428-H2481 HydrophobicContact CB-CB 3.89Å; A2428-H2481 VanDerWaalsContact CB-ND1 3.32Å; A2428-H2481 WeakPolarHBondContact CB-ND1 3.42Å; A2428-T2484 VanDerWaalsContact CA-O 3.3Å; A2428-T2484 WeakPolarHBondContact CA-O 3.3Å; A2428-T2484 WeakPolarHBondContact CB-O 2.95Å; A2428-P2488 HydrophobicContact CB-CB 4.14Å
2429	N	79.4	Confident	77.3	Confident	50 Å²	50	32.6 Å²	32.6	27%	0.267	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-70	127	173.4	-61.3	-92	0	0	0	110	F2431 K2449 H2481 D2482 T2484	N2429-F2431 HydrophobicContact CB-CE2 3.71Å; N2429-F2431 HydrophobicContact CB-CZ 3.86Å; N2429-F2431 WeakPolarHBondContact O-CD2 3.47Å; N2429-F2431 WeakPolarHBondContact O-CE2 3.36Å; N2429-K2449 WeakPolarHBondContact OD1-CE 3.29Å; N2429-K2449 PolarHBondContact OD1-NZ 3.23Å; N2429-H2481 VanDerWaalsContact O-CA 3.25Å; N2429-H2481 WeakPolarHBondContact O-CA 3.33Å; N2429-D2482 WeakPolarHBondContact CB-OD2 3.36Å; N2429-D2482 PolarHBondContact N-OD1 3.12Å; N2429-D2482 VanDerWaalsContact N-OD1 3.07Å; N2429-D2482 PolarHBondContact ND2-OD2 2.86Å; N2429-D2482 PolarHBondContact O-N 3.14Å; N2429-T2484 PolarHBondContact ND2-OG1 3.08Å
2430	I	86.5	Confident	76	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141.1	176.8	-52.5	-53.1	0	0	0	110.9	T2426 A2428 L2448 F2456 I2479 E2480 H2481 W2490	T2426-I2430 HydrophobicContact CG2-CD1 4.05Å; A2428-I2430 PolarHBondContact O-N 3.09Å; I2430-L2448 HydrophobicContact CG2-CD1 4.27Å; I2430-L2448 PolarHBondContact O-N 3.12Å; I2430-F2456 HydrophobicContact CB-CE1 4.41Å; I2430-F2456 HydrophobicContact CB-CE2 3.97Å; I2430-F2456 HydrophobicContact CB-CZ 3.76Å; I2430-F2456 HydrophobicContact CG1-CD1 4.31Å; I2430-F2456 HydrophobicContact CG1-CD2 3.69Å; I2430-F2456 HydrophobicContact CG1-CE1 4Å; I2430-F2456 HydrophobicContact CG1-CE2 3.35Å; I2430-F2456 HydrophobicContact CG1-CG 4.17Å; I2430-F2456 HydrophobicContact CG1-CZ 3.5Å; I2430-F2456 HydrophobicContact CG2-CZ 4.37Å; I2430-I2479 HydrophobicContact CG2-CD1 4.29Å; I2430-I2479 HydrophobicContact CG2-CG1 4.1Å; I2430-E2480 WeakPolarHBondContact CA-O 3.43Å; I2430-H2481 HydrophobicContact CD1-CB 3.58Å; I2430-W2490 HydrophobicContact CD1-CD2 4.22Å; I2430-W2490 HydrophobicContact CD1-CE3 3.77Å; I2430-W2490 HydrophobicContact CD1-CH2 4.26Å; I2430-W2490 HydrophobicContact CD1-CZ3 3.8Å; I2430-W2490 HydrophobicContact CG1-CH2 4.34Å; I2430-W2490 HydrophobicContact CG1-CZ3 4.34Å; I2430-W2490 HydrophobicContact CG2-CH2 3.92Å; I2430-W2490 HydrophobicContact CG2-CZ3 3.96Å
2431	F	82.6	Confident	75.3	Confident	25 Å²	25	30.8 Å²	30.8	11%	0.11	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	150.4	175.5	-49.5	-103.4	0	0	0	111	N2429 R2445 I2446 A2447 I2479 E2480 D2482	N2429-F2431 HydrophobicContact CB-CE2 3.71Å; N2429-F2431 HydrophobicContact CB-CZ 3.86Å; N2429-F2431 WeakPolarHBondContact O-CD2 3.47Å; N2429-F2431 WeakPolarHBondContact O-CE2 3.36Å; F2431-R2445 HydrophobicContact CB-CG 4.21Å; F2431-R2445 HydrophobicContact CD1-CG 4.28Å; F2431-R2445 VanDerWaalsContact CE1-NH1 3.27Å; F2431-I2446 CarbonylContact C-O 3.56Å; F2431-I2446 WeakPolarHBondContact CA-O 3.45Å; F2431-A2447 HydrophobicContact CD1-CB 3.68Å; F2431-A2447 HydrophobicContact CE1-CB 3.72Å; F2431-I2479 WeakPolarHBondContact O-CA 3.22Å; F2431-E2480 HydrophobicContact CB-CG 3.82Å; F2431-E2480 HydrophobicContact CD2-CG 4.4Å; F2431-E2480 PolarHBondContact N-O 2.99Å; F2431-E2480 PolarHBondContact O-N 3.15Å; F2431-D2482 HydrophobicContact CE2-CB 4.09Å
2432	I	87.4	Confident	75.2	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.6	177.1	-166.3	169.4	0	0	0	111.3	V2414 I2446 L2448 I2477 I2478 V2495 I2497	V2414-I2432 HydrophobicContact CG1-CD1 3.89Å; I2432-I2446 HydrophobicContact CG2-CB 4.32Å; I2432-I2446 PolarHBondContact N-O 3.49Å; I2432-I2446 PolarHBondContact O-N 2.64Å; I2432-L2448 HydrophobicContact CB-CD1 4.18Å; I2432-L2448 HydrophobicContact CG2-CD1 4.01Å; I2432-L2448 HydrophobicContact CG2-CD2 3.85Å; I2432-L2448 HydrophobicContact CG2-CG 4.03Å; I2432-I2477 HydrophobicContact CD1-CD1 4.06Å; I2432-I2477 HydrophobicContact CG1-CB 4.44Å; I2432-I2478 CarbonylContact C-O 3.56Å; I2432-I2478 WeakPolarHBondContact CA-O 3.25Å; I2432-V2495 HydrophobicContact CD1-CG1 4.36Å; I2432-I2497 HydrophobicContact CD1-CD1 3.95Å
2433	T	80.3	Confident	75.3	Confident	16 Å²	16	26.1 Å²	26.1	10%	0.098	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.9	167.8	-57.2	0	0	0	0	109.3	F2435 G2444 R2445 I2477 I2478	T2433-F2435 HydrophobicContact CG2-CD2 4.11Å; T2433-F2435 HydrophobicContact CG2-CE1 4.38Å; T2433-F2435 HydrophobicContact CG2-CE2 3.47Å; T2433-F2435 VanDerWaalsContact CG2-CE2 3.47Å; T2433-F2435 HydrophobicContact CG2-CZ 3.63Å; T2433-G2444 VanDerWaalsContact CA-O 3.31Å; T2433-G2444 WeakPolarHBondContact CA-O 3.33Å; T2433-G2444 WeakPolarHBondContact CG2-O 3.1Å; T2433-G2444 PolarHBondContact OG1-O 2.86Å; T2433-R2445 WeakPolarHBondContact OG1-CA 3.36Å; T2433-I2477 CarbonylContact O-C 3.54Å; T2433-I2477 WeakPolarHBondContact O-CA 3.21Å; T2433-I2477 WeakPolarHBondContact O-CB 3.35Å; T2433-I2478 PolarHBondContact N-O 2.63Å; T2433-I2478 PolarHBondContact O-N 3.31Å
2434	M	85.5	Confident	74.8	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.9	-179.9	-55.6	177.5	-71.4	0	0	110.7	Y2412 N2442 S2443 V2466 L2471 I2474 I2477 I2497	Y2412-M2434 HydrophobicContact CD2-CE 4.07Å; Y2412-M2434 HydrophobicContact CG-CE 4.26Å; Y2412-M2434 HydrophobicContact CG-SD 4.48Å; M2434-N2442 CarbonylContact O-C 3.56Å; M2434-N2442 WeakPolarHBondContact O-CA 3.29Å; M2434-N2442 VanDerWaalsContact O-CB 3.29Å; M2434-N2442 WeakPolarHBondContact O-CB 3.4Å; M2434-S2443 PolarHBondContact N-OG 3.17Å; M2434-S2443 PolarHBondContact O-N 3.2Å; M2434-V2466 HydrophobicContact CE-CG1 4.09Å; M2434-L2471 HydrophobicContact CB-CD1 3.58Å; M2434-L2471 HydrophobicContact CE-CD1 4.37Å; M2434-I2474 HydrophobicContact CB-CD1 4.41Å; M2434-I2474 HydrophobicContact CB-CG2 4.07Å; M2434-I2474 HydrophobicContact SD-CD1 4.02Å; M2434-I2477 HydrophobicContact CB-CG2 4.35Å; M2434-I2477 HydrophobicContact CG-CG2 4.04Å; M2434-I2497 HydrophobicContact CG-CD1 3.97Å; M2434-I2497 HydrophobicContact SD-CD1 3.77Å; M2434-I2497 HydrophobicContact SD-CG2 3.91Å
2435	F	74.8	Confident	74.1	Confident	29 Å²	29	28.7 Å²	28.7	13%	0.127	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.5	-177.9	-62.1	-102.3	0	0	0	111.9	T2433 N2442 I2474 Q2475 R2476 I2478	T2433-F2435 HydrophobicContact CG2-CD2 4.11Å; T2433-F2435 HydrophobicContact CG2-CE1 4.38Å; T2433-F2435 HydrophobicContact CG2-CE2 3.47Å; T2433-F2435 VanDerWaalsContact CG2-CE2 3.47Å; T2433-F2435 HydrophobicContact CG2-CZ 3.63Å; F2435-N2442 HydrophobicContact CD1-CB 3.74Å; F2435-N2442 HydrophobicContact CE1-CB 4.19Å; F2435-N2442 HydrophobicContact CG-CB 4.19Å; F2435-I2474 CarbonylContact O-C 3.5Å; F2435-I2474 WeakPolarHBondContact O-CA 3.5Å; F2435-Q2475 PolarHBondContact O-N 3.3Å; F2435-R2476 HydrophobicContact CB-CG 3.64Å; F2435-R2476 HydrophobicContact CD2-CG 3.65Å; F2435-R2476 HydrophobicContact CE2-CG 4.47Å; F2435-R2476 HydrophobicContact CG-CG 3.8Å; F2435-R2476 PolarHBondContact N-O 2.91Å; F2435-I2478 HydrophobicContact CE2-CB 4.43Å; F2435-I2478 HydrophobicContact CE2-CD1 3.78Å; F2435-I2478 HydrophobicContact CE2-CG1 3.86Å; F2435-I2478 HydrophobicContact CZ-CD1 3.85Å; F2435-I2478 HydrophobicContact CZ-CG1 4.44Å
2436	S	72.6	Confident	73.8	Confident	12 Å²	12	26.8 Å²	26.8	8%	0.084	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	165.1	176.8	-177.8	0	0	0	0	112.8	T2438 L2441 L2471 S2473	S2436-T2438 VanDerWaalsContact C-N 3.26Å; S2436-T2438 PolarHBondContact OG-N 2.88Å; S2436-T2438 VanDerWaalsContact OG-N 3.08Å; S2436-L2441 VanDerWaalsContact CB-O 3.29Å; S2436-L2441 WeakPolarHBondContact CB-O 3.5Å; S2436-L2441 PolarHBondContact N-O 2.88Å; S2436-L2471 VanDerWaalsContact CB-O 3.25Å; S2436-L2471 WeakPolarHBondContact CB-O 3.41Å; S2436-L2471 PolarHBondContact OG-O 2.85Å; S2436-S2473 WeakPolarHBondContact CA-O 3.31Å
2437	T	62.5	Low	73.3	Confident	56 Å²	56	28.4 Å²	28.4	34%	0.344	17%	0.165	S	C	.	.	S	Bend	trans	-53.4	-36.1	156.8	37.6	0	0	0	0	114.1	S2473 Q2475	T2437-S2473 PolarHBondContact N-O 2.83Å; T2437-S2473 VanDerWaalsContact N-O 3.1Å; T2437-Q2475 HydrophobicContact CG2-CG 3.83Å
2438	T	61	Low	73.5	Confident	11 Å²	11	25 Å²	25	7%	0.067	15%	0.147	C	C	.	.	S	Bend	trans	-76.7	126.6	-174.5	-67.1	0	0	0	0	111.1	A2400 E2403 S2436 G2440 L2441	A2400-T2438 HydrophobicContact CB-CG2 3.96Å; E2403-T2438 WeakPolarHBondContact OE2-CG2 3.46Å; E2403-T2438 PolarHBondContact OE2-OG1 3.12Å; E2403-T2438 VanDerWaalsContact OE2-OG1 3.11Å; S2436-T2438 VanDerWaalsContact C-N 3.26Å; S2436-T2438 PolarHBondContact OG-N 2.88Å; S2436-T2438 VanDerWaalsContact OG-N 3.08Å; T2438-G2440 PolarHBondContact O-N 2.85Å; T2438-G2440 VanDerWaalsContact O-N 3.11Å; T2438-L2441 HydrophobicContact CG2-CB 4.29Å; T2438-L2441 WeakPolarHBondContact O-CB 3.26Å; T2438-L2441 PolarHBondContact O-N 2.75Å
2439	P	51.6	Low	72.9	Confident	57 Å²	57	31 Å²	31	37%	0.37	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	117.1	-177.1	-29.6	36.7	0	0	0	113.8	A2400	A2400-P2439 WeakPolarHBondContact CB-O 3.36Å
2440	G	53.9	Low	72.3	Confident	33 Å²	33	35.6 Å²	35.6	34%	0.34	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	-17.4	178.3	0	0	0	0	0	114.8	T2438 N2442	T2438-G2440 PolarHBondContact O-N 2.85Å; T2438-G2440 VanDerWaalsContact O-N 3.11Å; G2440-N2442 PolarHBondContact O-N 2.84Å; G2440-N2442 PolarHBondContact O-ND2 2.97Å
2441	L	64.9	Low	70.7	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.031	21%	0.21	C	C	.	.			trans	-77	114.9	-179.9	179.3	56.8	0	0	0	111.2	L2404 S2436 T2438 L2471	L2404-L2441 HydrophobicContact CD1-CD1 4.45Å; L2404-L2441 HydrophobicContact CD2-CD1 3.83Å; L2404-L2441 HydrophobicContact CG-CD1 4.06Å; S2436-L2441 VanDerWaalsContact CB-O 3.29Å; S2436-L2441 WeakPolarHBondContact CB-O 3.5Å; S2436-L2441 PolarHBondContact N-O 2.88Å; T2438-L2441 HydrophobicContact CG2-CB 4.29Å; T2438-L2441 WeakPolarHBondContact O-CB 3.26Å; T2438-L2441 PolarHBondContact O-N 2.75Å; L2441-L2471 HydrophobicContact CD1-CD2 3.83Å; L2441-L2471 HydrophobicContact CG-CD2 3.8Å
2442	N	71.9	Confident	69	Low	25 Å²	25	47.6 Å²	47.6	13%	0.134	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-156	155	-178	72.2	90	0	0	0	112	R2159 M2434 F2435 G2440 G2444	R2159-N2442 PolarHBondContact NH2-O 2.97Å; M2434-N2442 CarbonylContact O-C 3.56Å; M2434-N2442 WeakPolarHBondContact O-CA 3.29Å; M2434-N2442 VanDerWaalsContact O-CB 3.29Å; M2434-N2442 WeakPolarHBondContact O-CB 3.4Å; F2435-N2442 HydrophobicContact CD1-CB 3.74Å; F2435-N2442 HydrophobicContact CE1-CB 4.19Å; F2435-N2442 HydrophobicContact CG-CB 4.19Å; G2440-N2442 PolarHBondContact O-N 2.84Å; G2440-N2442 PolarHBondContact O-ND2 2.97Å; N2442-G2444 PolarHBondContact O-N 2.86Å; N2442-G2444 WeakPolarHBondContact OD1-CA 3.38Å; N2442-G2444 PolarHBondContact OD1-N 3.5Å
2443	S	74.2	Confident	67.3	Low	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.			trans	-76.2	-0.4	179.2	77.4	0	0	0	0	114.4	R2161 M2434 I2446	R2161-S2443 VanDerWaalsContact CZ-O 3.3Å; R2161-S2443 PolarHBondContact NH1-O 2.78Å; R2161-S2443 VanDerWaalsContact NH1-O 3.09Å; R2161-S2443 VanDerWaalsContact NH2-C 3.34Å; R2161-S2443 PolarHBondContact NH2-O 2.89Å; M2434-S2443 PolarHBondContact N-OG 3.17Å; M2434-S2443 PolarHBondContact O-N 3.2Å; S2443-I2446 WeakPolarHBondContact O-CD1 3.39Å
2444	G	65.7	Low	66.5	Low	10 Å²	10	57.9 Å²	57.9	10%	0.103	30%	0.301	C	S	.	.			trans	52.2	-171.2	-167.1	0	0	0	0	0	113.7	T2433 N2442	T2433-G2444 VanDerWaalsContact CA-O 3.31Å; T2433-G2444 WeakPolarHBondContact CA-O 3.33Å; T2433-G2444 WeakPolarHBondContact CG2-O 3.1Å; T2433-G2444 PolarHBondContact OG1-O 2.86Å; N2442-G2444 PolarHBondContact O-N 2.86Å; N2442-G2444 WeakPolarHBondContact OD1-CA 3.38Å; N2442-G2444 PolarHBondContact OD1-N 3.5Å
2445	R	67.8	Low	66	Low	123 Å²	123	59.5 Å²	59.5	46%	0.464	31%	0.31	S	S	.	.			trans	-74	123	178.9	-167.2	-176.8	-161.7	-106.7	-14.1	110.9	F2431 T2433 E2480	F2431-R2445 HydrophobicContact CB-CG 4.21Å; F2431-R2445 HydrophobicContact CD1-CG 4.28Å; F2431-R2445 VanDerWaalsContact CE1-NH1 3.27Å; T2433-R2445 WeakPolarHBondContact OG1-CA 3.36Å; R2445-E2480 IonicContact CZ-OE1 2.78Å; R2445-E2480 IonicContact NE-OE1 3.84Å; R2445-E2480 PolarHBondContact NE-OE1 3.38Å; R2445-E2480 IonicContact NH2-OE1 3.35Å; R2445-E2480 PolarHBondContact NH2-OE1 3.04Å
2446	I	76.9	Confident	66.6	Low	14 Å²	14	58.5 Å²	58.5	7%	0.072	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.2	-179.1	-60.7	-179.6	0	0	0	108.9	F2431 I2432 S2443 V2466	F2431-I2446 CarbonylContact C-O 3.56Å; F2431-I2446 WeakPolarHBondContact CA-O 3.45Å; I2432-I2446 HydrophobicContact CG2-CB 4.32Å; I2432-I2446 PolarHBondContact N-O 3.49Å; I2432-I2446 PolarHBondContact O-N 2.64Å; S2443-I2446 WeakPolarHBondContact O-CD1 3.39Å; I2446-V2466 HydrophobicContact CD1-CG1 3.46Å; I2446-V2466 VanDerWaalsContact CD1-CG1 3.46Å; I2446-V2466 HydrophobicContact CG2-CG1 4.09Å; I2446-V2466 HydrophobicContact CG2-CG2 4.41Å
2447	A	76.5	Confident	67.1	Low	47 Å²	47	60.3 Å²	60.3	39%	0.388	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	138.8	176.9	0	0	0	0	0	111.3	F2431 K2449	F2431-A2447 HydrophobicContact CD1-CB 3.68Å; F2431-A2447 HydrophobicContact CE1-CB 3.72Å; A2447-K2449 HydrophobicContact CB-CG 4.43Å
2448	L	84.9	Confident	68.1	Low	5 Å²	5	63.9 Å²	63.9	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	106.5	178.3	-60.1	-177.9	0	0	0	109.4	V2414 I2416 I2430 I2432 F2456 F2464 V2466	V2414-L2448 HydrophobicContact CG1-CD1 4.41Å; I2416-L2448 HydrophobicContact CD1-CD1 3.36Å; I2430-L2448 HydrophobicContact CG2-CD1 4.27Å; I2430-L2448 PolarHBondContact O-N 3.12Å; I2432-L2448 HydrophobicContact CB-CD1 4.18Å; I2432-L2448 HydrophobicContact CG2-CD1 4.01Å; I2432-L2448 HydrophobicContact CG2-CD2 3.85Å; I2432-L2448 HydrophobicContact CG2-CG 4.03Å; L2448-F2456 HydrophobicContact CB-CZ 4.44Å; L2448-F2464 HydrophobicContact CB-CD1 4Å; L2448-F2464 HydrophobicContact CB-CD2 4.13Å; L2448-F2464 HydrophobicContact CB-CE1 3.99Å; L2448-F2464 HydrophobicContact CB-CE2 4.13Å; L2448-F2464 HydrophobicContact CB-CG 4.08Å; L2448-F2464 HydrophobicContact CB-CZ 4.07Å; L2448-F2464 HydrophobicContact CD1-CD2 4.16Å; L2448-F2464 HydrophobicContact CD1-CE2 4.43Å; L2448-F2464 HydrophobicContact CD2-CB 4Å; L2448-F2464 HydrophobicContact CD2-CD2 4.34Å; L2448-F2464 HydrophobicContact CD2-CG 4.03Å; L2448-F2464 HydrophobicContact CG-CD2 4.45Å; L2448-F2464 HydrophobicContact CG-CG 4.48Å; L2448-V2466 HydrophobicContact CD2-CG2 4.12Å
2449	K	71	Confident	69	Low	131 Å²	131	71 Å²	71	57%	0.57	35%	0.351	S	S	*	.			trans	-137.7	153.7	-173.9	-59.7	-164	177.7	-153.5	0	111.5	N2429 A2447	N2429-K2449 WeakPolarHBondContact OD1-CE 3.29Å; N2429-K2449 PolarHBondContact OD1-NZ 3.23Å; A2447-K2449 HydrophobicContact CB-CG 4.43Å
2450	R	66.8	Low	70.6	Confident	146 Å²	146	70.7 Å²	70.7	55%	0.551	35%	0.345	S	S	*	.			trans	-154.8	143	175.9	-145	172.8	-178.9	175.1	-1.9	107.4	L2455 E2463 F2464	R2450-L2455 HydrophobicContact CB-CD1 3.86Å; R2450-L2455 HydrophobicContact CB-CD2 3.95Å; R2450-L2455 HydrophobicContact CB-CG 4.46Å; R2450-E2463 PolarHBondContact NH1-O 3.28Å; R2450-F2464 HydrophobicContact CB-CE1 4.43Å
2451	E	51.3	Low	72.2	Confident	113 Å²	113	72.5 Å²	72.5	53%	0.528	35%	0.346	S	S	.	.	S	Bend	trans	-81.3	152.9	-176.7	-63	-175.1	143	0	0	112.4	N2453	E2451-N2453 VanDerWaalsContact C-N 3.34Å; E2451-N2453 PolarHBondContact O-N 3.49Å; E2451-N2453 VanDerWaalsContact O-N 3.15Å; E2451-N2453 PolarHBondContact O-ND2 3.15Å
2452	N	47.6	Very low	73.3	Confident	166 Å²	166	72.3 Å²	72.3	89%	0.888	35%	0.345	S	S	*	.	S	Bend	trans	51.5	35.6	166.8	-60.4	-15.4	0	0	0	117.3
2453	N	52.6	Low	74.1	Confident	111 Å²	111	73.9 Å²	73.9	59%	0.594	35%	0.352	S	S	*	.	S	Bend	trans	-138.1	149.1	173.4	-73	-93.3	0	0	0	111	E2451 L2455	E2451-N2453 VanDerWaalsContact C-N 3.34Å; E2451-N2453 PolarHBondContact O-N 3.49Å; E2451-N2453 VanDerWaalsContact O-N 3.15Å; E2451-N2453 PolarHBondContact O-ND2 3.15Å; N2453-L2455 PolarHBondContact O-N 3.39Å
2454	N	63.2	Low	74.6	Confident	120 Å²	120	74.4 Å²	74.4	64%	0.642	35%	0.354	S	S	*	.			trans	-61.6	122.4	155.4	-79.3	19.9	0	0	0	107.4	D2457 Q2460	N2454-D2457 WeakPolarHBondContact CB-OD2 3.49Å; N2454-D2457 PolarHBondContact ND2-OD2 2.93Å; N2454-Q2460 PolarHBondContact O-NE2 2.86Å; N2454-Q2460 PolarHBondContact O-OE1 3.22Å
2455	L	74.4	Confident	75.5	Confident	34 Å²	34	79 Å²	79	18%	0.178	37%	0.369	C	S	.	.			trans	-109.8	146.7	173.7	-65.5	171.5	0	0	0	108.2	R2450 N2453 D2457 D2462 F2464	R2450-L2455 HydrophobicContact CB-CD1 3.86Å; R2450-L2455 HydrophobicContact CB-CD2 3.95Å; R2450-L2455 HydrophobicContact CB-CG 4.46Å; N2453-L2455 PolarHBondContact O-N 3.39Å; L2455-D2457 VanDerWaalsContact C-N 3.32Å; L2455-D2457 PolarHBondContact O-N 2.75Å; L2455-D2462 WeakPolarHBondContact CD2-OD1 3.43Å; L2455-F2464 HydrophobicContact CD1-CE1 4.43Å; L2455-F2464 HydrophobicContact CD2-CZ 4.39Å
2456	F	87	Confident	76	Confident	9 Å²	9	73.2 Å²	73.2	4%	0.039	35%	0.348	C	S	.	.	S	Bend	trans	61.6	33.5	176.5	-39.9	-70.5	0	0	0	114.3	I2416 N2425 T2426 I2430 L2448 D2462 F2464 W2490	I2416-F2456 HydrophobicContact CD1-CE1 4.1Å; I2416-F2456 HydrophobicContact CG2-CD1 4.08Å; I2416-F2456 HydrophobicContact CG2-CE1 4.12Å; N2425-F2456 VanDerWaalsContact CA-O 3.29Å; N2425-F2456 WeakPolarHBondContact CA-O 3.4Å; T2426-F2456 HydrophobicContact CG2-CB 3.9Å; T2426-F2456 HydrophobicContact CG2-CG 4.45Å; I2430-F2456 HydrophobicContact CB-CE1 4.41Å; I2430-F2456 HydrophobicContact CB-CE2 3.97Å; I2430-F2456 HydrophobicContact CB-CZ 3.76Å; I2430-F2456 HydrophobicContact CG1-CD1 4.31Å; I2430-F2456 HydrophobicContact CG1-CD2 3.69Å; I2430-F2456 HydrophobicContact CG1-CE1 4Å; I2430-F2456 HydrophobicContact CG1-CE2 3.35Å; I2430-F2456 HydrophobicContact CG1-CG 4.17Å; I2430-F2456 HydrophobicContact CG1-CZ 3.5Å; I2430-F2456 HydrophobicContact CG2-CZ 4.37Å; L2448-F2456 HydrophobicContact CB-CZ 4.44Å; F2456-D2462 WeakPolarHBondContact CA-OD2 3.47Å; F2456-D2462 HydrophobicContact CD1-CB 4.23Å; F2456-D2462 HydrophobicContact CE1-CB 4.13Å; F2456-D2462 PolarHBondContact N-OD2 3.22Å; F2456-F2464 AromaticContact CE1-CE2 3.74Å; F2456-F2464 HydrophobicContact CE1-CE2 3.74Å; F2456-F2464 AromaticContact CE1-CZ 3.74Å; F2456-F2464 HydrophobicContact CE1-CZ 3.74Å; F2456-F2464 HydrophobicContact CE2-CZ 4.35Å; F2456-F2464 HydrophobicContact CZ-CE1 4.42Å; F2456-F2464 AromaticContact CZ-CE2 3.84Å; F2456-F2464 HydrophobicContact CZ-CE2 3.84Å; F2456-F2464 AromaticContact CZ-CZ 3.42Å; F2456-F2464 HydrophobicContact CZ-CZ 3.42Å; F2456-F2464 VanDerWaalsContact CZ-CZ 3.42Å; F2456-W2490 AromaticContact CD1-CZ2 3.89Å; F2456-W2490 HydrophobicContact CD1-CZ2 3.89Å; F2456-W2490 HydrophobicContact CE1-CZ2 4.41Å; F2456-W2490 HydrophobicContact CG-CZ2 4.48Å
2457	D	84	Confident	76.1	Confident	49 Å²	49	73.5 Å²	73.5	26%	0.262	35%	0.349	S	S	.	.			trans	-71.8	162	169.4	-105.2	-35.6	0	0	0	112.3	T2418 N2425 N2454 L2455 K2459 Q2460	T2418-D2457 VanDerWaalsContact CB-O 3.27Å; T2418-D2457 WeakPolarHBondContact CB-O 3.36Å; T2418-D2457 VanDerWaalsContact CG2-O 3.32Å; T2418-D2457 WeakPolarHBondContact CG2-O 3.44Å; N2425-D2457 HydrophobicContact CB-CB 4.49Å; N2425-D2457 WeakPolarHBondContact CB-OD1 3.09Å; N2425-D2457 PolarHBondContact ND2-OD1 2.95Å; N2454-D2457 WeakPolarHBondContact CB-OD2 3.49Å; N2454-D2457 PolarHBondContact ND2-OD2 2.93Å; L2455-D2457 VanDerWaalsContact C-N 3.32Å; L2455-D2457 PolarHBondContact O-N 2.75Å; D2457-K2459 PolarHBondContact O-N 2.89Å; D2457-Q2460 HydrophobicContact CB-CB 4.41Å; D2457-Q2460 VanDerWaalsContact CB-OE1 3.25Å; D2457-Q2460 WeakPolarHBondContact O-CB 3.08Å; D2457-Q2460 PolarHBondContact O-N 2.77Å
2458	R	82.8	Confident	76.2	Confident	132 Å²	132	71.3 Å²	71.3	50%	0.498	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	125	-176	177.8	-173.4	179	-161.2	1.9	111	T2420 K2421 A2424 Q2460	T2420-R2458 PolarHBondContact O-NE 3.26Å; T2420-R2458 PolarHBondContact O-NH2 3.21Å; K2421-R2458 VanDerWaalsContact O-CD 3.24Å; K2421-R2458 WeakPolarHBondContact O-CD 3.41Å; K2421-R2458 PolarHBondContact O-NE 2.75Å; A2424-R2458 HydrophobicContact CB-CG 4.32Å; R2458-Q2460 VanDerWaalsContact C-N 3.31Å
2459	K	81.1	Confident	75.8	Confident	160 Å²	160	71.1 Å²	71.1	70%	0.696	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	5.6	-169	-58.9	177.1	165.9	-174.7	0	115.8	T2418 G2419 T2420 D2457	T2418-K2459 VanDerWaalsContact O-CA 3.3Å; T2418-K2459 WeakPolarHBondContact O-CA 3.45Å; T2418-K2459 PolarHBondContact O-N 2.69Å; G2419-K2459 PolarHBondContact O-N 3.2Å; T2420-K2459 HydrophobicContact CG2-CG 3.98Å; D2457-K2459 PolarHBondContact O-N 2.89Å
2460	Q	83.3	Confident	76.3	Confident	50 Å²	50	66.6 Å²	66.6	23%	0.234	31%	0.311	C	S	.	.			trans	-74.9	148.7	-179.6	-169.5	166.6	-11.7	0	0	112.6	T2418 N2454 D2457 R2458 D2462	T2418-Q2460 PolarHBondContact N-O 2.79Å; N2454-Q2460 PolarHBondContact O-NE2 2.86Å; N2454-Q2460 PolarHBondContact O-OE1 3.22Å; D2457-Q2460 HydrophobicContact CB-CB 4.41Å; D2457-Q2460 VanDerWaalsContact CB-OE1 3.25Å; D2457-Q2460 WeakPolarHBondContact O-CB 3.08Å; D2457-Q2460 PolarHBondContact O-N 2.77Å; R2458-Q2460 VanDerWaalsContact C-N 3.31Å; Q2460-D2462 VanDerWaalsContact CD-OD1 3.3Å; Q2460-D2462 WeakPolarHBondContact CG-OD2 3.45Å; Q2460-D2462 PolarHBondContact NE2-OD1 2.8Å
2461	L	87.9	Confident	76.8	Confident	71 Å²	71	59.7 Å²	59.7	37%	0.372	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.5	163.4	170.7	57.1	0	0	0	108.5	I2416 Y2417 E2463	I2416-L2461 WeakPolarHBondContact O-CA 3.2Å; I2416-L2461 WeakPolarHBondContact O-CD1 3.34Å; Y2417-L2461 HydrophobicContact CD2-CD1 3.7Å; Y2417-L2461 HydrophobicContact CE1-CB 4.45Å; Y2417-L2461 HydrophobicContact CE1-CD1 4.31Å; Y2417-L2461 HydrophobicContact CE2-CD1 3.41Å; Y2417-L2461 VanDerWaalsContact CE2-CD1 3.41Å; Y2417-L2461 HydrophobicContact CE2-CD2 4.39Å; Y2417-L2461 HydrophobicContact CE2-CG 4.43Å; Y2417-L2461 HydrophobicContact CG-CD1 4.26Å; L2461-E2463 HydrophobicContact CD1-CG 4.2Å; L2461-E2463 HydrophobicContact CG-CG 4.09Å
2462	D	88.5	Confident	78	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.1	178.9	-68.5	-68.5	0	0	0	110.6	S2415 I2416 L2455 F2456 Q2460 F2464	S2415-D2462 CarbonylContact C-O 3.49Å; S2415-D2462 WeakPolarHBondContact CA-O 3.28Å; I2416-D2462 PolarHBondContact N-O 2.93Å; I2416-D2462 PolarHBondContact O-N 3.01Å; L2455-D2462 WeakPolarHBondContact CD2-OD1 3.43Å; F2456-D2462 WeakPolarHBondContact CA-OD2 3.47Å; F2456-D2462 HydrophobicContact CD1-CB 4.23Å; F2456-D2462 HydrophobicContact CE1-CB 4.13Å; F2456-D2462 PolarHBondContact N-OD2 3.22Å; Q2460-D2462 VanDerWaalsContact CD-OD1 3.3Å; Q2460-D2462 WeakPolarHBondContact CG-OD2 3.45Å; Q2460-D2462 PolarHBondContact NE2-OD1 2.8Å; D2462-F2464 HydrophobicContact CB-CE2 3.64Å; D2462-F2464 HydrophobicContact CB-CZ 3.93Å
2463	E	88	Confident	79.4	Confident	57 Å²	57	52.3 Å²	52.3	27%	0.266	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.8	-176.9	-54.9	-157.3	114.6	0	0	111.8	K2413 S2415 R2450 L2461	K2413-E2463 WeakPolarHBondContact CE-OE1 3.23Å; K2413-E2463 WeakPolarHBondContact CE-OE2 3.41Å; K2413-E2463 IonicContact NZ-OE1 2.77Å; K2413-E2463 PolarHBondContact NZ-OE1 2.81Å; K2413-E2463 IonicContact NZ-OE2 3.43Å; K2413-E2463 PolarHBondContact NZ-OE2 3.02Å; S2415-E2463 WeakPolarHBondContact CB-OE1 3.2Å; S2415-E2463 PolarHBondContact OG-OE1 3.18Å; R2450-E2463 PolarHBondContact NH1-O 3.28Å; L2461-E2463 HydrophobicContact CD1-CG 4.2Å; L2461-E2463 HydrophobicContact CG-CG 4.09Å
2464	F	86.1	Confident	80.8	Confident	11 Å²	11	47 Å²	47	5%	0.048	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150	-179.1	-52.9	-88.2	0	0	0	109.6	V2414 I2416 L2448 R2450 L2455 F2456 D2462	V2414-F2464 PolarHBondContact N-O 2.75Å; V2414-F2464 PolarHBondContact O-N 3.18Å; I2416-F2464 HydrophobicContact CD1-CD2 4.44Å; I2416-F2464 HydrophobicContact CD1-CE2 4.21Å; L2448-F2464 HydrophobicContact CB-CD1 4Å; L2448-F2464 HydrophobicContact CB-CD2 4.13Å; L2448-F2464 HydrophobicContact CB-CE1 3.99Å; L2448-F2464 HydrophobicContact CB-CE2 4.13Å; L2448-F2464 HydrophobicContact CB-CG 4.08Å; L2448-F2464 HydrophobicContact CB-CZ 4.07Å; L2448-F2464 HydrophobicContact CD1-CD2 4.16Å; L2448-F2464 HydrophobicContact CD1-CE2 4.43Å; L2448-F2464 HydrophobicContact CD2-CB 4Å; L2448-F2464 HydrophobicContact CD2-CD2 4.34Å; L2448-F2464 HydrophobicContact CD2-CG 4.03Å; L2448-F2464 HydrophobicContact CG-CD2 4.45Å; L2448-F2464 HydrophobicContact CG-CG 4.48Å; R2450-F2464 HydrophobicContact CB-CE1 4.43Å; L2455-F2464 HydrophobicContact CD1-CE1 4.43Å; L2455-F2464 HydrophobicContact CD2-CZ 4.39Å; F2456-F2464 AromaticContact CE1-CE2 3.74Å; F2456-F2464 HydrophobicContact CE1-CE2 3.74Å; F2456-F2464 AromaticContact CE1-CZ 3.74Å; F2456-F2464 HydrophobicContact CE1-CZ 3.74Å; F2456-F2464 HydrophobicContact CE2-CZ 4.35Å; F2456-F2464 HydrophobicContact CZ-CE1 4.42Å; F2456-F2464 AromaticContact CZ-CE2 3.84Å; F2456-F2464 HydrophobicContact CZ-CE2 3.84Å; F2456-F2464 AromaticContact CZ-CZ 3.42Å; F2456-F2464 HydrophobicContact CZ-CZ 3.42Å; F2456-F2464 VanDerWaalsContact CZ-CZ 3.42Å; D2462-F2464 HydrophobicContact CB-CE2 3.64Å; D2462-F2464 HydrophobicContact CB-CZ 3.93Å
2465	Y	84.1	Confident	81.4	Confident	106 Å²	106	43.3 Å²	43.3	42%	0.416	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.5	169.9	-65.4	-84.4	0	0	0	109.2	Q2211 M2411 Y2412 K2413	Q2211-Y2465 PolarHBondContact NE2-O 3.42Å; M2411-Y2465 HydrophobicContact CE-CD1 3.89Å; M2411-Y2465 HydrophobicContact CE-CG 4Å; Y2412-Y2465 CarbonylContact O-C 3.51Å; Y2412-Y2465 WeakPolarHBondContact O-CA 3.29Å; K2413-Y2465 HydrophobicContact CB-CD1 3.96Å; K2413-Y2465 HydrophobicContact CB-CE1 3.75Å; K2413-Y2465 HydrophobicContact CD-CE1 3.74Å; K2413-Y2465 WeakPolarHBondContact CE-OH 3.42Å; K2413-Y2465 HydrophobicContact CG-CD1 4.04Å; K2413-Y2465 HydrophobicContact CG-CE1 3.57Å
2466	V	78.7	Confident	81.5	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	114.8	-170.4	177.3	0	0	0	0	109.1	Y2412 V2414 M2434 I2446 L2448	Y2412-V2466 PolarHBondContact N-O 2.86Å; Y2412-V2466 PolarHBondContact O-N 2.91Å; V2414-V2466 HydrophobicContact CG2-CB 4.49Å; V2414-V2466 HydrophobicContact CG2-CG2 4Å; M2434-V2466 HydrophobicContact CE-CG1 4.09Å; I2446-V2466 HydrophobicContact CD1-CG1 3.46Å; I2446-V2466 VanDerWaalsContact CD1-CG1 3.46Å; I2446-V2466 HydrophobicContact CG2-CG1 4.09Å; I2446-V2466 HydrophobicContact CG2-CG2 4.41Å; L2448-V2466 HydrophobicContact CD2-CG2 4.12Å
2467	E	78.1	Confident	81.6	Confident	20 Å²	20	42.3 Å²	42.3	9%	0.093	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.8	172.6	-179.1	164	-131.8	0	0	110.5	K2201 R2214 T2409 V2410 M2411	K2201-E2467 IonicContact NZ-OE1 3.54Å; K2201-E2467 PolarHBondContact NZ-OE1 2.75Å; K2201-E2467 IonicContact NZ-OE2 2.67Å; K2201-E2467 PolarHBondContact NZ-OE2 2.9Å; R2214-E2467 IonicContact CZ-OE2 3.92Å; R2214-E2467 IonicContact NH1-OE2 3.74Å; R2214-E2467 PolarHBondContact NH1-OE2 3.23Å; T2409-E2467 HydrophobicContact CG2-CG 3.5Å; V2410-E2467 WeakPolarHBondContact O-CA 3.03Å; M2411-E2467 HydrophobicContact SD-CB 4.43Å
2468	S	78.8	Confident	81.5	Confident	1 Å²	1	41 Å²	41	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	173.6	171.2	-163.2	0	0	0	0	110.5	D2215 T2409 V2410	D2215-S2468 PolarHBondContact OD2-OG 2.76Å; T2409-S2468 WeakPolarHBondContact CG2-O 3.21Å; V2410-S2468 PolarHBondContact N-O 2.88Å; V2410-S2468 PolarHBondContact O-N 3.43Å
2469	I	76.9	Confident	81.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	143.2	178.9	-57.8	178.3	0	0	0	109.5	R2159 D2215 P2217 K2407 L2471	R2159-I2469 HydrophobicContact CB-CD1 3.56Å; R2159-I2469 HydrophobicContact CG-CD1 4.2Å; D2215-I2469 HydrophobicContact CB-CD1 4.49Å; D2215-I2469 HydrophobicContact CB-CG1 4.14Å; P2217-I2469 HydrophobicContact CB-CD1 4.19Å; K2407-I2469 HydrophobicContact CB-CG2 3.33Å; K2407-I2469 HydrophobicContact CG-CG2 4.02Å; I2469-L2471 WeakPolarHBondContact O-CD2 3.36Å; I2469-L2471 WeakPolarHBondContact O-CG 3.28Å; I2469-L2471 PolarHBondContact O-N 2.85Å
2470	D	81.4	Confident	82	Confident	35 Å²	35	29.1 Å²	29.1	19%	0.187	14%	0.14	C	C	.	.			trans	-59	110.2	-176.4	-174.3	14.7	0	0	0	112.9	K2407 Q2408 V2410 Y2412 E2472 N2499	K2407-D2470 PolarHBondContact NZ-O 2.78Å; Q2408-D2470 PolarHBondContact O-N 2.96Å; V2410-D2470 HydrophobicContact CG1-CB 4.15Å; V2410-D2470 HydrophobicContact CG2-CB 3.86Å; Y2412-D2470 PolarHBondContact OH-OD1 2.86Å; D2470-E2472 VanDerWaalsContact C-N 3.28Å; D2470-E2472 PolarHBondContact O-N 2.82Å; D2470-E2472 PolarHBondContact OD1-N 2.79Å; D2470-N2499 PolarHBondContact OD1-ND2 2.68Å
2471	L	77.7	Confident	82	Confident	1 Å²	1	27 Å²	27	1%	0.005	13%	0.13	C	C	.	.			trans	-80.1	-3.3	179.6	-55.2	-178.8	0	0	0	113.2	Y2412 M2434 S2436 L2441 I2469 S2473 I2474	Y2412-L2471 HydrophobicContact CE2-CG 4.4Å; Y2412-L2471 PolarHBondContact OH-N 3.24Å; M2434-L2471 HydrophobicContact CB-CD1 3.58Å; M2434-L2471 HydrophobicContact CE-CD1 4.37Å; S2436-L2471 VanDerWaalsContact CB-O 3.25Å; S2436-L2471 WeakPolarHBondContact CB-O 3.41Å; S2436-L2471 PolarHBondContact OG-O 2.85Å; L2441-L2471 HydrophobicContact CD1-CD2 3.83Å; L2441-L2471 HydrophobicContact CG-CD2 3.8Å; I2469-L2471 WeakPolarHBondContact O-CD2 3.36Å; I2469-L2471 WeakPolarHBondContact O-CG 3.28Å; I2469-L2471 PolarHBondContact O-N 2.85Å; L2471-S2473 PolarHBondContact O-N 3.1Å; L2471-I2474 HydrophobicContact CB-CG1 4.16Å; L2471-I2474 HydrophobicContact CD1-CD1 4.25Å; L2471-I2474 HydrophobicContact CD1-CG1 4.16Å
2472	E	76.9	Confident	81.5	Confident	83 Å²	83	26.4 Å²	26.4	39%	0.388	13%	0.127	S	C	.	.	S	Bend	trans	52.6	-100.7	-167.3	-74.1	160.8	-132.2	0	0	112	K2407 D2470	K2407-E2472 VanDerWaalsContact CE-OE1 3.24Å; K2407-E2472 WeakPolarHBondContact CE-OE1 3.41Å; K2407-E2472 IonicContact NZ-OE1 2.66Å; K2407-E2472 PolarHBondContact NZ-OE1 3.32Å; D2470-E2472 VanDerWaalsContact C-N 3.28Å; D2470-E2472 PolarHBondContact O-N 2.82Å; D2470-E2472 PolarHBondContact OD1-N 2.79Å
2473	S	76.4	Confident	81.1	Confident	42 Å²	42	28.4 Å²	28.4	29%	0.294	14%	0.138	S	C	.	.	S	Bend	trans	-102.4	113.8	-176.6	-173	0	0	0	0	110.3	S2436 T2437 L2471 Q2475	S2436-S2473 WeakPolarHBondContact CA-O 3.31Å; T2437-S2473 PolarHBondContact N-O 2.83Å; T2437-S2473 VanDerWaalsContact N-O 3.1Å; L2471-S2473 PolarHBondContact O-N 3.1Å; S2473-Q2475 PolarHBondContact O-N 2.95Å
2474	I	82.4	Confident	80.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	103.5	-178.9	-52.7	175.5	0	0	0	108.7	Y2412 M2434 F2435 L2471 I2477 I2497 H2506 F2508	Y2412-I2474 HydrophobicContact CD1-CD1 4.11Å; Y2412-I2474 HydrophobicContact CE1-CD1 3.84Å; M2434-I2474 HydrophobicContact CB-CD1 4.41Å; M2434-I2474 HydrophobicContact CB-CG2 4.07Å; M2434-I2474 HydrophobicContact SD-CD1 4.02Å; F2435-I2474 CarbonylContact O-C 3.5Å; F2435-I2474 WeakPolarHBondContact O-CA 3.5Å; L2471-I2474 HydrophobicContact CB-CG1 4.16Å; L2471-I2474 HydrophobicContact CD1-CD1 4.25Å; L2471-I2474 HydrophobicContact CD1-CG1 4.16Å; I2474-I2477 HydrophobicContact CG2-CG2 4.07Å; I2474-I2497 HydrophobicContact CD1-CG2 3.8Å; I2474-H2506 PolarHBondContact N-CD2 2.84Å; I2474-H2506 PolarHBondContact N-NE2 2.89Å; I2474-H2506 PolarHBondContact O-CD2 2.95Å; I2474-F2508 HydrophobicContact CB-CZ 4.26Å; I2474-F2508 HydrophobicContact CG2-CZ 3.78Å
2475	Q	75	Confident	79.7	Confident	42 Å²	42	30.6 Å²	30.6	20%	0.196	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-37.2	-178.2	-84.3	-176.5	-26.5	0	0	113.6	K1959 F2435 T2437 S2473 V2529	K1959-Q2475 PolarHBondContact O-NE2 2.97Å; K1959-Q2475 PolarHBondContact O-OE1 2.78Å; K1959-Q2475 VanDerWaalsContact O-OE1 3.08Å; F2435-Q2475 PolarHBondContact O-N 3.3Å; T2437-Q2475 HydrophobicContact CG2-CG 3.83Å; S2473-Q2475 PolarHBondContact O-N 2.95Å; Q2475-V2529 PolarHBondContact O-N 2.91Å
2476	R	77.5	Confident	79.3	Confident	22 Å²	22	32.3 Å²	32.3	8%	0.083	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.9	177.8	71.5	170.2	-170.9	-166.9	-2.9	111.8	N1996 E2020 F2435 E2526 L2527 L2528	N1996-R2476 PolarHBondContact OD1-NH2 2.84Å; E2020-R2476 IonicContact OE1-CZ 2.96Å; E2020-R2476 VanDerWaalsContact OE1-CZ 3.31Å; E2020-R2476 IonicContact OE1-NH1 2.88Å; E2020-R2476 PolarHBondContact OE1-NH1 2.81Å; E2020-R2476 IonicContact OE1-NH2 2.72Å; E2020-R2476 PolarHBondContact OE1-NH2 2.88Å; F2435-R2476 HydrophobicContact CB-CG 3.64Å; F2435-R2476 HydrophobicContact CD2-CG 3.65Å; F2435-R2476 HydrophobicContact CE2-CG 4.47Å; F2435-R2476 HydrophobicContact CG-CG 3.8Å; F2435-R2476 PolarHBondContact N-O 2.91Å; R2476-E2526 WeakPolarHBondContact CD-OE1 3.4Å; R2476-E2526 IonicContact CZ-OE1 2.75Å; R2476-E2526 IonicContact NE-OE1 2.75Å; R2476-E2526 IonicContact NH1-OE1 3.43Å; R2476-E2526 PolarHBondContact NH1-OE1 2.98Å; R2476-L2527 CarbonylContact C-O 3.49Å; R2476-L2527 VanDerWaalsContact CA-O 3.29Å; R2476-L2527 WeakPolarHBondContact CA-O 3.04Å; R2476-L2528 HydrophobicContact CB-CD2 3.82Å; R2476-L2528 HydrophobicContact CB-CG 4.24Å
2477	I	87.6	Confident	79.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	156.4	162.5	65.8	176.4	0	0	0	110.5	I2432 T2433 M2434 I2474 V2495 I2497 F2508 E2526 L2527	I2432-I2477 HydrophobicContact CD1-CD1 4.06Å; I2432-I2477 HydrophobicContact CG1-CB 4.44Å; T2433-I2477 CarbonylContact O-C 3.54Å; T2433-I2477 WeakPolarHBondContact O-CA 3.21Å; T2433-I2477 WeakPolarHBondContact O-CB 3.35Å; M2434-I2477 HydrophobicContact CB-CG2 4.35Å; M2434-I2477 HydrophobicContact CG-CG2 4.04Å; I2474-I2477 HydrophobicContact CG2-CG2 4.07Å; I2477-V2495 HydrophobicContact CD1-CB 4.02Å; I2477-V2495 HydrophobicContact CD1-CG1 4.14Å; I2477-V2495 HydrophobicContact CD1-CG2 4.1Å; I2477-I2497 HydrophobicContact CD1-CD1 4.46Å; I2477-I2497 HydrophobicContact CG2-CD1 3.7Å; I2477-F2508 HydrophobicContact CD1-CB 3.86Å; I2477-F2508 HydrophobicContact CD1-CD1 4.17Å; I2477-F2508 HydrophobicContact CD1-CD2 3.9Å; I2477-F2508 HydrophobicContact CD1-CG 3.7Å; I2477-F2508 HydrophobicContact CG1-CB 4.3Å; I2477-F2508 HydrophobicContact CG1-CD1 3.84Å; I2477-F2508 HydrophobicContact CG1-CD2 4.38Å; I2477-F2508 HydrophobicContact CG1-CE1 4.3Å; I2477-F2508 HydrophobicContact CG1-CG 3.91Å; I2477-F2508 HydrophobicContact CG2-CD1 4.3Å; I2477-F2508 HydrophobicContact CG2-CD2 4.3Å; I2477-F2508 HydrophobicContact CG2-CE1 3.94Å; I2477-F2508 HydrophobicContact CG2-CE2 3.94Å; I2477-F2508 HydrophobicContact CG2-CG 4.49Å; I2477-F2508 HydrophobicContact CG2-CZ 3.77Å; I2477-E2526 WeakPolarHBondContact O-CA 3.1Å; I2477-L2527 HydrophobicContact CD1-CB 4.46Å; I2477-L2527 HydrophobicContact CD1-CD1 4.23Å; I2477-L2527 HydrophobicContact CG1-CB 3.85Å; I2477-L2527 HydrophobicContact CG1-CD1 4.41Å; I2477-L2527 HydrophobicContact CG1-CG 4.49Å; I2477-L2527 PolarHBondContact N-O 3.1Å; I2477-L2527 PolarHBondContact O-N 3.22Å
2478	I	82.6	Confident	79.7	Confident	21 Å²	21	34.4 Å²	34.4	11%	0.108	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.4	157.3	-65.3	169.6	0	0	0	106.8	I2432 T2433 F2435 W2524 K2525 E2526	I2432-I2478 CarbonylContact C-O 3.56Å; I2432-I2478 WeakPolarHBondContact CA-O 3.25Å; T2433-I2478 PolarHBondContact N-O 2.63Å; T2433-I2478 PolarHBondContact O-N 3.31Å; F2435-I2478 HydrophobicContact CE2-CB 4.43Å; F2435-I2478 HydrophobicContact CE2-CD1 3.78Å; F2435-I2478 HydrophobicContact CE2-CG1 3.86Å; F2435-I2478 HydrophobicContact CZ-CD1 3.85Å; F2435-I2478 HydrophobicContact CZ-CG1 4.44Å; I2478-W2524 HydrophobicContact CG2-CE3 4.39Å; I2478-K2525 WeakPolarHBondContact CA-O 3.11Å; I2478-E2526 HydrophobicContact CG1-CB 4.33Å
2479	I	89.3	Confident	79.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.6	172	-165	165.4	0	0	0	109.4	I2416 I2430 F2431 W2490 L2492 V2495 I2514 W2524 K2525 L2527	I2416-I2479 HydrophobicContact CD1-CD1 3.88Å; I2430-I2479 HydrophobicContact CG2-CD1 4.29Å; I2430-I2479 HydrophobicContact CG2-CG1 4.1Å; F2431-I2479 WeakPolarHBondContact O-CA 3.22Å; I2479-W2490 HydrophobicContact CD1-CH2 3.82Å; I2479-W2490 HydrophobicContact CD1-CZ3 4.11Å; I2479-W2490 HydrophobicContact CG1-CH2 4.38Å; I2479-W2490 HydrophobicContact CG1-CZ3 4.19Å; I2479-L2492 HydrophobicContact CD1-CD2 4.05Å; I2479-L2492 HydrophobicContact CG2-CD2 3.7Å; I2479-V2495 HydrophobicContact CD1-CG2 3.83Å; I2479-I2514 HydrophobicContact CG2-CD1 4.16Å; I2479-W2524 CarbonylContact O-C 3.56Å; I2479-W2524 VanDerWaalsContact O-CA 3.31Å; I2479-W2524 WeakPolarHBondContact O-CA 3.27Å; I2479-K2525 HydrophobicContact CG2-CB 4.31Å; I2479-K2525 PolarHBondContact N-O 3.05Å; I2479-K2525 PolarHBondContact O-N 3.14Å; I2479-L2527 HydrophobicContact CG2-CD1 3.8Å; I2479-L2527 HydrophobicContact CG2-CG 4.38Å
2480	E	85.4	Confident	80.6	Confident	43 Å²	43	35.1 Å²	35.1	20%	0.201	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	163.3	-168	64.4	178.2	-171.6	0	0	112.5	I2430 F2431 R2445 L2523 W2524	I2430-E2480 WeakPolarHBondContact CA-O 3.43Å; F2431-E2480 HydrophobicContact CB-CG 3.82Å; F2431-E2480 HydrophobicContact CD2-CG 4.4Å; F2431-E2480 PolarHBondContact N-O 2.99Å; F2431-E2480 PolarHBondContact O-N 3.15Å; R2445-E2480 IonicContact CZ-OE1 2.78Å; R2445-E2480 IonicContact NE-OE1 3.84Å; R2445-E2480 PolarHBondContact NE-OE1 3.38Å; R2445-E2480 IonicContact NH2-OE1 3.35Å; R2445-E2480 PolarHBondContact NH2-OE1 3.04Å; E2480-L2523 VanDerWaalsContact CA-O 3.29Å; E2480-L2523 WeakPolarHBondContact CA-O 3.39Å; E2480-L2523 WeakPolarHBondContact CB-O 3.25Å; E2480-W2524 HydrophobicContact CB-CB 3.49Å; E2480-W2524 VanDerWaalsContact CB-CB 3.49Å
2481	H	84	Confident	80.8	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.028	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	153.4	172.4	76.2	128.7	0	0	0	111.8	A2428 N2429 I2430 N2483 P2488 I2514 L2523	A2428-H2481 HydrophobicContact CB-CB 3.89Å; A2428-H2481 VanDerWaalsContact CB-ND1 3.32Å; A2428-H2481 WeakPolarHBondContact CB-ND1 3.42Å; N2429-H2481 VanDerWaalsContact O-CA 3.25Å; N2429-H2481 WeakPolarHBondContact O-CA 3.33Å; I2430-H2481 HydrophobicContact CD1-CB 3.58Å; H2481-N2483 VanDerWaalsContact C-N 3.3Å; H2481-N2483 PolarHBondContact O-N 2.91Å; H2481-P2488 PolarHBondContact CE1-O 3.29Å; H2481-P2488 PolarHBondContact ND1-O 3.05Å; H2481-I2514 PolarHBondContact NE2-O 3.28Å; H2481-L2523 PolarHBondContact CD2-O 3.38Å; H2481-L2523 VanDerWaalsContact CD2-O 3.29Å; H2481-L2523 PolarHBondContact N-O 3.36Å; H2481-L2523 WeakPolarHBondContact NE2-CD2 3.21Å
2482	D	77.3	Confident	81.3	Confident	57 Å²	57	34.1 Å²	34.1	31%	0.305	20%	0.201	S	C	.	.			trans	-81.7	-2.9	-177.4	63.8	6.5	0	0	0	114.9	N2429 F2431 T2484	N2429-D2482 WeakPolarHBondContact CB-OD2 3.36Å; N2429-D2482 PolarHBondContact N-OD1 3.12Å; N2429-D2482 VanDerWaalsContact N-OD1 3.07Å; N2429-D2482 PolarHBondContact ND2-OD2 2.86Å; N2429-D2482 PolarHBondContact O-N 3.14Å; F2431-D2482 HydrophobicContact CE2-CB 4.09Å; D2482-T2484 HydrophobicContact CB-CG2 4.38Å; D2482-T2484 PolarHBondContact O-N 3.37Å; D2482-T2484 WeakPolarHBondContact OD1-CB 3.15Å; D2482-T2484 PolarHBondContact OD1-N 2.6Å; D2482-T2484 PolarHBondContact OD1-OG1 3.06Å; D2482-T2484 WeakPolarHBondContact OD2-CG2 3.38Å; D2482-T2484 PolarHBondContact OD2-OG1 2.87Å
2483	N	79.5	Confident	81.6	Confident	46 Å²	46	31.7 Å²	31.7	25%	0.246	19%	0.191	C	C	.	.			trans	55.5	30.2	-173.9	-161.6	105.5	0	0	0	112.9	H2481 P2488 L2523	H2481-N2483 VanDerWaalsContact C-N 3.3Å; H2481-N2483 PolarHBondContact O-N 2.91Å; N2483-P2488 HydrophobicContact CB-CB 4.45Å; N2483-L2523 HydrophobicContact CB-CD1 3.82Å; N2483-L2523 HydrophobicContact CB-CD2 3.93Å; N2483-L2523 WeakPolarHBondContact OD1-CD2 3.5Å
2484	T	72.1	Confident	82.1	Confident	62 Å²	62	32.9 Å²	32.9	38%	0.38	19%	0.191	S	C	.	.			trans	-78.1	167.3	162.7	60.1	0	0	0	0	110.7	A2428 N2429 D2482	A2428-T2484 VanDerWaalsContact CA-O 3.3Å; A2428-T2484 WeakPolarHBondContact CA-O 3.3Å; A2428-T2484 WeakPolarHBondContact CB-O 2.95Å; N2429-T2484 PolarHBondContact ND2-OG1 3.08Å; D2482-T2484 HydrophobicContact CB-CG2 4.38Å; D2482-T2484 PolarHBondContact O-N 3.37Å; D2482-T2484 WeakPolarHBondContact OD1-CB 3.15Å; D2482-T2484 PolarHBondContact OD1-N 2.6Å; D2482-T2484 PolarHBondContact OD1-OG1 3.06Å; D2482-T2484 WeakPolarHBondContact OD2-CG2 3.38Å; D2482-T2484 PolarHBondContact OD2-OG1 2.87Å
2485	G	72.9	Confident	82.5	Confident	51 Å²	51	32.9 Å²	32.9	53%	0.526	19%	0.191	S	C	.	.	S	Bend	trans	95.1	178.5	-176.9	0	0	0	0	0	114.8	D2427	D2427-G2485 WeakPolarHBondContact OD1-CA 3.33Å
2486	V	75.9	Confident	83.3	Confident	143 Å²	143	33.2 Å²	33.2	87%	0.867	19%	0.194	S	C	*	.	S	Bend	trans	-90.2	-34.1	-179.4	-175.8	0	0	0	0	111	D2427 P2488	D2427-V2486 PolarHBondContact OD1-N 2.79Å; D2427-V2486 WeakPolarHBondContact OD2-CA 3.39Å; D2427-V2486 PolarHBondContact OD2-N 2.75Å; V2486-P2488 VanDerWaalsContact C-CD 3.41Å
2487	S	81.3	Confident	84	Confident	49 Å²	49	32.2 Å²	32.2	34%	0.343	19%	0.19	S	C	.	.			trans	-127.6	59.7	-178.6	-175.4	0	0	0	0	112.5	D2427 D2489	D2427-S2487 WeakPolarHBondContact OD1-CA 3.29Å; D2427-S2487 PolarHBondContact OD1-N 3.36Å; D2427-S2487 PolarHBondContact OD2-N 3.43Å; S2487-D2489 PolarHBondContact O-N 3.13Å
2488	P	82.5	Confident	84.1	Confident	17 Å²	17	32.3 Å²	32.3	11%	0.11	19%	0.191	C	C	.	.			trans	-66.7	-3.1	-173.3	25.2	-35.7	0	0	0	115.7	T2426 A2428 H2481 N2483 V2486 W2490	T2426-P2488 WeakPolarHBondContact OG1-CA 3.4Å; T2426-P2488 PolarHBondContact OG1-O 2.72Å; A2428-P2488 HydrophobicContact CB-CB 4.14Å; H2481-P2488 PolarHBondContact CE1-O 3.29Å; H2481-P2488 PolarHBondContact ND1-O 3.05Å; N2483-P2488 HydrophobicContact CB-CB 4.45Å; V2486-P2488 VanDerWaalsContact C-CD 3.41Å; P2488-W2490 PolarHBondContact O-N 3Å; P2488-W2490 VanDerWaalsContact O-N 3.12Å
2489	D	84.3	Confident	84.3	Confident	18 Å²	18	31.3 Å²	31.3	10%	0.096	19%	0.186	C	C	.	.			trans	-72.8	98.8	-174.1	-74.7	-21.7	0	0	0	112.7	S2487 W2513 S2515 K2518	S2487-D2489 PolarHBondContact O-N 3.13Å; D2489-W2513 HydrophobicContact CB-CE3 4.39Å; D2489-W2513 HydrophobicContact CB-CZ3 4.14Å; D2489-S2515 WeakPolarHBondContact OD1-CB 3.16Å; D2489-S2515 PolarHBondContact OD1-OG 2.81Å; D2489-K2518 HydrophobicContact CB-CD 4.02Å; D2489-K2518 VanDerWaalsContact CB-NZ 3.27Å; D2489-K2518 WeakPolarHBondContact OD2-CD 3.46Å; D2489-K2518 WeakPolarHBondContact OD2-CE 3.45Å; D2489-K2518 IonicContact OD2-NZ 2.67Å; D2489-K2518 PolarHBondContact OD2-NZ 3.31Å
2490	W	89.9	Confident	84.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	145.2	-177.3	-166	32	0	0	0	112.9	I2416 T2418 T2426 I2430 F2456 I2479 P2488 L2492 W2513 I2514	I2416-W2490 HydrophobicContact CG2-CH2 4.05Å; I2416-W2490 HydrophobicContact CG2-CZ2 3.62Å; T2418-W2490 PolarHBondContact OG1-NE1 3.15Å; T2426-W2490 HydrophobicContact CG2-CB 3.72Å; T2426-W2490 VanDerWaalsContact CG2-CD1 3.45Å; T2426-W2490 HydrophobicContact CG2-CD2 4.05Å; T2426-W2490 HydrophobicContact CG2-CG 3.49Å; T2426-W2490 VanDerWaalsContact CG2-CG 3.49Å; I2430-W2490 HydrophobicContact CD1-CD2 4.22Å; I2430-W2490 HydrophobicContact CD1-CE3 3.77Å; I2430-W2490 HydrophobicContact CD1-CH2 4.26Å; I2430-W2490 HydrophobicContact CD1-CZ3 3.8Å; I2430-W2490 HydrophobicContact CG1-CH2 4.34Å; I2430-W2490 HydrophobicContact CG1-CZ3 4.34Å; I2430-W2490 HydrophobicContact CG2-CH2 3.92Å; I2430-W2490 HydrophobicContact CG2-CZ3 3.96Å; F2456-W2490 AromaticContact CD1-CZ2 3.89Å; F2456-W2490 HydrophobicContact CD1-CZ2 3.89Å; F2456-W2490 HydrophobicContact CE1-CZ2 4.41Å; F2456-W2490 HydrophobicContact CG-CZ2 4.48Å; I2479-W2490 HydrophobicContact CD1-CH2 3.82Å; I2479-W2490 HydrophobicContact CD1-CZ3 4.11Å; I2479-W2490 HydrophobicContact CG1-CH2 4.38Å; I2479-W2490 HydrophobicContact CG1-CZ3 4.19Å; P2488-W2490 PolarHBondContact O-N 3Å; P2488-W2490 VanDerWaalsContact O-N 3.12Å; W2490-L2492 HydrophobicContact CD2-CB 4.42Å; W2490-L2492 HydrophobicContact CE3-CB 4.44Å; W2490-L2492 HydrophobicContact CH2-CB 4.4Å; W2490-L2492 HydrophobicContact CH2-CD1 3.87Å; W2490-L2492 HydrophobicContact CH2-CD2 4.15Å; W2490-L2492 HydrophobicContact CH2-CG 4.37Å; W2490-L2492 HydrophobicContact CZ2-CB 4.36Å; W2490-L2492 HydrophobicContact CZ2-CD1 3.8Å; W2490-L2492 HydrophobicContact CZ3-CB 4.43Å; W2490-L2492 HydrophobicContact CZ3-CD2 4.23Å; W2490-W2513 CarbonylContact O-C 3.59Å; W2490-W2513 VanDerWaalsContact O-CA 3.23Å; W2490-W2513 WeakPolarHBondContact O-CA 3.32Å; W2490-W2513 VanDerWaalsContact O-CE3 3.24Å; W2490-I2514 HydrophobicContact CE3-CB 4.36Å; W2490-I2514 HydrophobicContact CE3-CD1 3.92Å; W2490-I2514 HydrophobicContact CE3-CG1 4.36Å; W2490-I2514 HydrophobicContact CZ3-CD1 4.04Å; W2490-I2514 PolarHBondContact N-O 3.34Å; W2490-I2514 PolarHBondContact O-N 3Å
2491	Y	87.2	Confident	83.6	Confident	14 Å²	14	37.5 Å²	37.5	6%	0.055	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	111.4	164.2	-163.5	-80.7	0	0	0	110.4	G2419 K2421 A2424 D2493 Y2511 Q2512 W2513	G2419-Y2491 PolarHBondContact N-O 2.85Å; K2421-Y2491 HydrophobicContact CD-CD2 4.21Å; K2421-Y2491 HydrophobicContact CD-CE1 4.42Å; K2421-Y2491 HydrophobicContact CD-CE2 3.64Å; K2421-Y2491 WeakPolarHBondContact CE-OH 3.46Å; K2421-Y2491 HydrophobicContact CG-CE2 4.49Å; K2421-Y2491 PolarHBondContact NZ-OH 2.89Å; A2424-Y2491 PolarHBondContact O-N 2.71Å; Y2491-D2493 WeakPolarHBondContact CE1-OD1 3.45Å; Y2491-Y2511 VanDerWaalsContact CZ-O 3.26Å; Y2491-Y2511 PolarHBondContact OH-O 2.84Å; Y2491-Q2512 CarbonylContact C-O 3.58Å; Y2491-Q2512 WeakPolarHBondContact CA-O 3.39Å; Y2491-W2513 HydrophobicContact CD2-CB 4.43Å; Y2491-W2513 AromaticContact CD2-CD1 3.73Å; Y2491-W2513 AromaticContact CD2-CD2 3.62Å; Y2491-W2513 HydrophobicContact CD2-CD2 3.62Å; Y2491-W2513 AromaticContact CD2-CE2 3.57Å; Y2491-W2513 HydrophobicContact CD2-CE3 4.24Å; Y2491-W2513 AromaticContact CD2-CG 3.7Å; Y2491-W2513 HydrophobicContact CD2-CG 3.7Å; Y2491-W2513 HydrophobicContact CD2-CZ2 4.11Å; Y2491-W2513 AromaticContact CD2-NE1 3.67Å; Y2491-W2513 AromaticContact CE2-CD1 3.88Å; Y2491-W2513 HydrophobicContact CE2-CD2 4.49Å; Y2491-W2513 HydrophobicContact CE2-CG 4.26Å; Y2491-W2513 AromaticContact CE2-NE1 3.87Å; Y2491-W2513 HydrophobicContact CG-CD2 4.47Å
2492	L	88.2	Confident	83.4	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.6	-178.7	175.7	63	0	0	0	110.3	I2416 I2479 W2490 V2495 C2510 Y2511 Q2512 I2514 L2527	I2416-L2492 HydrophobicContact CG2-CD1 3.9Å; I2479-L2492 HydrophobicContact CD1-CD2 4.05Å; I2479-L2492 HydrophobicContact CG2-CD2 3.7Å; W2490-L2492 HydrophobicContact CD2-CB 4.42Å; W2490-L2492 HydrophobicContact CE3-CB 4.44Å; W2490-L2492 HydrophobicContact CH2-CB 4.4Å; W2490-L2492 HydrophobicContact CH2-CD1 3.87Å; W2490-L2492 HydrophobicContact CH2-CD2 4.15Å; W2490-L2492 HydrophobicContact CH2-CG 4.37Å; W2490-L2492 HydrophobicContact CZ2-CB 4.36Å; W2490-L2492 HydrophobicContact CZ2-CD1 3.8Å; W2490-L2492 HydrophobicContact CZ3-CB 4.43Å; W2490-L2492 HydrophobicContact CZ3-CD2 4.23Å; L2492-V2495 HydrophobicContact CD1-CG2 4.15Å; L2492-V2495 HydrophobicContact CD2-CG2 4.04Å; L2492-C2510 HydrophobicContact CB-CB 4.31Å; L2492-C2510 HydrophobicContact CD2-CB 3.94Å; L2492-C2510 HydrophobicContact CG-CB 3.87Å; L2492-Y2511 CarbonylContact O-C 3.43Å; L2492-Y2511 WeakPolarHBondContact O-CA 3.38Å; L2492-Y2511 PolarHBondContact O-N 3.11Å; L2492-Q2512 PolarHBondContact N-O 2.87Å; L2492-Q2512 PolarHBondContact O-N 2.89Å; L2492-I2514 HydrophobicContact CB-CD1 4.31Å; L2492-I2514 HydrophobicContact CD2-CD1 4.07Å; L2492-L2527 HydrophobicContact CD2-CD1 4.2Å
2493	D	83.2	Confident	83.3	Confident	33 Å²	33	39.5 Å²	39.5	18%	0.176	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-57.3	173.1	-82	-7.3	0	0	0	110.8	Y2417 G2419 Y2491 C2510 Y2511	Y2417-D2493 PolarHBondContact O-N 2.81Å; G2419-D2493 VanDerWaalsContact CA-CG 3.43Å; G2419-D2493 WeakPolarHBondContact CA-OD2 3.4Å; Y2491-D2493 WeakPolarHBondContact CE1-OD1 3.45Å; D2493-C2510 PolarHBondContact O-N 2.59Å; D2493-Y2511 HydrophobicContact CB-CD1 3.85Å; D2493-Y2511 HydrophobicContact CB-CE1 3.91Å; D2493-Y2511 PolarHBondContact O-N 3.04Å
2494	K	85.8	Confident	83.2	Confident	66 Å²	66	40.8 Å²	40.8	29%	0.287	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	160.1	-176.7	60.6	-179.7	179.2	-179	0	113.4	Y2417 L2507 F2508	Y2417-K2494 HydrophobicContact CD2-CD 4.19Å; Y2417-K2494 HydrophobicContact CD2-CG 3.82Å; Y2417-K2494 HydrophobicContact CG-CD 4.39Å; Y2417-K2494 HydrophobicContact CG-CG 3.92Å; Y2417-K2494 PolarHBondContact N-O 2.82Å; K2494-L2507 HydrophobicContact CB-CD1 4.37Å; K2494-L2507 HydrophobicContact CD-CD1 4.16Å; K2494-F2508 CarbonylContact C-O 3.39Å; K2494-F2508 VanDerWaalsContact CA-O 3.29Å; K2494-F2508 WeakPolarHBondContact CA-O 3.37Å; K2494-F2508 WeakPolarHBondContact CB-O 3.38Å
2495	V	91.3	Very high	83.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139	170.2	-170	0	0	0	0	108.8	V2414 S2415 I2416 I2432 I2477 I2479 L2492 I2497 F2508 L2527	V2414-V2495 HydrophobicContact CG1-CG1 3.89Å; S2415-V2495 CarbonylContact O-C 2.98Å; S2415-V2495 WeakPolarHBondContact O-CA 3.28Å; I2416-V2495 HydrophobicContact CG1-CG1 4.02Å; I2416-V2495 HydrophobicContact CG1-CG2 4.26Å; I2432-V2495 HydrophobicContact CD1-CG1 4.36Å; I2477-V2495 HydrophobicContact CD1-CB 4.02Å; I2477-V2495 HydrophobicContact CD1-CG1 4.14Å; I2477-V2495 HydrophobicContact CD1-CG2 4.1Å; I2479-V2495 HydrophobicContact CD1-CG2 3.83Å; L2492-V2495 HydrophobicContact CD1-CG2 4.15Å; L2492-V2495 HydrophobicContact CD2-CG2 4.04Å; V2495-I2497 HydrophobicContact CG1-CD1 4.5Å; V2495-I2497 HydrophobicContact CG1-CG1 4.15Å; V2495-F2508 HydrophobicContact CB-CB 4.31Å; V2495-F2508 PolarHBondContact N-O 2.89Å; V2495-F2508 PolarHBondContact O-N 3.3Å; V2495-L2527 HydrophobicContact CG2-CD1 4.48Å
2496	L	91.2	Very high	84.4	Confident	50 Å²	50	39.5 Å²	39.5	26%	0.262	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133.1	173.3	-165.8	81.7	0	0	0	109.1	V2414 S2415 I2505 L2507	V2414-L2496 CarbonylContact C-O 3.05Å; V2414-L2496 WeakPolarHBondContact CA-O 3.2Å; S2415-L2496 PolarHBondContact N-O 3.2Å; S2415-L2496 PolarHBondContact O-N 2.84Å; L2496-I2505 HydrophobicContact CD1-CG2 3.64Å; L2496-I2505 HydrophobicContact CD2-CG2 4.11Å; L2496-I2505 HydrophobicContact CG-CG2 3.83Å; L2496-L2507 HydrophobicContact CD1-CB 4Å; L2496-L2507 HydrophobicContact CD1-CD1 3.74Å; L2496-L2507 HydrophobicContact CD1-CG 4.46Å
2497	I	92.7	Very high	84.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.2	-180	-52.9	-173.7	0	0	0	109.3	Y2412 K2413 V2414 I2432 M2434 I2474 I2477 V2495 I2505 H2506 F2508	Y2412-I2497 HydrophobicContact CD1-CG2 3.92Å; Y2412-I2497 HydrophobicContact CG-CG2 4.42Å; K2413-I2497 CarbonylContact O-C 3.56Å; K2413-I2497 WeakPolarHBondContact O-CA 3.28Å; V2414-I2497 HydrophobicContact CG1-CG1 4.46Å; V2414-I2497 HydrophobicContact CG2-CD1 4.5Å; V2414-I2497 HydrophobicContact CG2-CG1 4.32Å; V2414-I2497 HydrophobicContact CG2-CG2 4.36Å; I2432-I2497 HydrophobicContact CD1-CD1 3.95Å; M2434-I2497 HydrophobicContact CG-CD1 3.97Å; M2434-I2497 HydrophobicContact SD-CD1 3.77Å; M2434-I2497 HydrophobicContact SD-CG2 3.91Å; I2474-I2497 HydrophobicContact CD1-CG2 3.8Å; I2477-I2497 HydrophobicContact CD1-CD1 4.46Å; I2477-I2497 HydrophobicContact CG2-CD1 3.7Å; V2495-I2497 HydrophobicContact CG1-CD1 4.5Å; V2495-I2497 HydrophobicContact CG1-CG1 4.15Å; I2497-I2505 CarbonylContact O-C 3.51Å; I2497-I2505 WeakPolarHBondContact O-CA 3.14Å; I2497-H2506 HydrophobicContact CB-CB 4.48Å; I2497-H2506 PolarHBondContact N-O 3.16Å; I2497-H2506 PolarHBondContact O-N 2.7Å; I2497-F2508 HydrophobicContact CB-CE2 4.34Å; I2497-F2508 HydrophobicContact CD1-CD2 4.19Å; I2497-F2508 HydrophobicContact CD1-CE2 3.81Å; I2497-F2508 HydrophobicContact CG1-CD2 4.23Å; I2497-F2508 HydrophobicContact CG1-CE2 4Å
2498	T	88.5	Confident	85.1	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.7	178.4	-56.9	0	0	0	0	110.3	K497 Y2412 K2413 Q2500 Q2504	K497-T2498 PolarHBondContact NZ-OG1 3.03Å; Y2412-T2498 CarbonylContact C-O 3.59Å; Y2412-T2498 WeakPolarHBondContact CA-O 3.29Å; K2413-T2498 PolarHBondContact N-O 2.91Å; K2413-T2498 PolarHBondContact O-N 2.7Å; T2498-Q2500 PolarHBondContact O-N 2.85Å; T2498-Q2504 WeakPolarHBondContact CA-O 3.34Å
2499	N	88.1	Confident	84.9	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	119	164.6	177.2	-25.3	0	0	0	108.2	Y2412 D2470 T2501 N2502 N2503 Q2504	Y2412-N2499 HydrophobicContact CD1-CB 4.04Å; Y2412-N2499 HydrophobicContact CE1-CB 3.7Å; D2470-N2499 PolarHBondContact OD1-ND2 2.68Å; N2499-T2501 VanDerWaalsContact C-N 3.29Å; N2499-T2501 PolarHBondContact O-N 2.95Å; N2499-T2501 WeakPolarHBondContact OD1-CB 3.35Å; N2499-T2501 PolarHBondContact OD1-N 3.47Å; N2499-N2502 VanDerWaalsContact CB-OD1 3.23Å; N2499-N2502 WeakPolarHBondContact CB-OD1 3.24Å; N2499-N2502 PolarHBondContact ND2-OD1 3.43Å; N2499-N2502 PolarHBondContact OD1-N 2.69Å; N2499-N2503 WeakPolarHBondContact O-CA 3.31Å; N2499-N2503 PolarHBondContact O-N 3.03Å; N2499-Q2504 PolarHBondContact N-O 3.16Å
2500	Q	84.3	Confident	84.8	Confident	73 Å²	73	32.7 Å²	32.7	34%	0.341	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-19.3	-175.4	-64	-73.4	-105	0	0	113.4	M2411 K2413 T2498	M2411-Q2500 HydrophobicContact CB-CB 4.12Å; M2411-Q2500 HydrophobicContact CB-CG 4.1Å; M2411-Q2500 VanDerWaalsContact O-CB 3.31Å; M2411-Q2500 WeakPolarHBondContact O-CB 3.35Å; M2411-Q2500 WeakPolarHBondContact O-CG 3.17Å; M2411-Q2500 PolarHBondContact O-N 3.11Å; K2413-Q2500 HydrophobicContact CB-CG 4.36Å; T2498-Q2500 PolarHBondContact O-N 2.85Å
2501	T	76.2	Confident	84.4	Confident	99 Å²	99	35.2 Å²	35.2	61%	0.607	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-34.8	-176.9	-43.1	0	0	0	0	112.2	V2410 N2499	V2410-T2501 WeakPolarHBondContact CG1-OG1 3.36Å; N2499-T2501 VanDerWaalsContact C-N 3.29Å; N2499-T2501 PolarHBondContact O-N 2.95Å; N2499-T2501 WeakPolarHBondContact OD1-CB 3.35Å; N2499-T2501 PolarHBondContact OD1-N 3.47Å
2502	N	79	Confident	84	Confident	79 Å²	79	35.5 Å²	35.5	42%	0.422	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-1.3	-179.5	76.8	-2.2	0	0	0	114.5	N2499 Q2504	N2499-N2502 VanDerWaalsContact CB-OD1 3.23Å; N2499-N2502 WeakPolarHBondContact CB-OD1 3.24Å; N2499-N2502 PolarHBondContact ND2-OD1 3.43Å; N2499-N2502 PolarHBondContact OD1-N 2.69Å; N2502-Q2504 PolarHBondContact ND2-OE1 2.71Å; N2502-Q2504 PolarHBondContact O-N 2.84Å; N2502-Q2504 VanDerWaalsContact O-N 3.17Å; N2502-Q2504 WeakPolarHBondContact OD1-CB 3.19Å; N2502-Q2504 PolarHBondContact OD1-N 3.48Å
2503	N	75	Confident	83.6	Confident	26 Å²	26	37.6 Å²	37.6	14%	0.139	19%	0.187	C	C	.	.			trans	59.5	14.1	-177.8	-73	-77.5	0	0	0	117.2	I495 S496 N2499 I2505	I495-N2503 PolarHBondContact O-ND2 3.08Å; I495-N2503 PolarHBondContact O-OD1 2.78Å; S496-N2503 WeakPolarHBondContact OG-CB 3.14Å; N2499-N2503 WeakPolarHBondContact O-CA 3.31Å; N2499-N2503 PolarHBondContact O-N 3.03Å; N2503-I2505 VanDerWaalsContact O-CG1 3.3Å; N2503-I2505 WeakPolarHBondContact O-CG1 3.48Å; N2503-I2505 PolarHBondContact O-N 3.22Å
2504	Q	77.4	Confident	83.7	Confident	74 Å²	74	36 Å²	36	35%	0.346	18%	0.179	S	C	.	.			trans	-63.3	126.3	175.1	-167.5	175.2	-4.9	0	0	110.9	T2498 N2499 N2502	T2498-Q2504 WeakPolarHBondContact CA-O 3.34Å; N2499-Q2504 PolarHBondContact N-O 3.16Å; N2502-Q2504 PolarHBondContact ND2-OE1 2.71Å; N2502-Q2504 PolarHBondContact O-N 2.84Å; N2502-Q2504 VanDerWaalsContact O-N 3.17Å; N2502-Q2504 WeakPolarHBondContact OD1-CB 3.19Å; N2502-Q2504 PolarHBondContact OD1-N 3.48Å
2505	I	84.1	Confident	83.5	Confident	77 Å²	77	32.9 Å²	32.9	40%	0.395	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.8	-172.8	-36.3	178.4	0	0	0	109.9	K497 L2496 I2497 N2503	K497-I2505 HydrophobicContact CD-CD1 3.87Å; K497-I2505 VanDerWaalsContact CE-CD1 3.43Å; K497-I2505 HydrophobicContact CG-CD1 4.09Å; L2496-I2505 HydrophobicContact CD1-CG2 3.64Å; L2496-I2505 HydrophobicContact CD2-CG2 4.11Å; L2496-I2505 HydrophobicContact CG-CG2 3.83Å; I2497-I2505 CarbonylContact O-C 3.51Å; I2497-I2505 WeakPolarHBondContact O-CA 3.14Å; N2503-I2505 VanDerWaalsContact O-CG1 3.3Å; N2503-I2505 WeakPolarHBondContact O-CG1 3.48Å; N2503-I2505 PolarHBondContact O-N 3.22Å
2506	H	86.4	Confident	82.6	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.1	175.4	-55.2	80.8	0	0	0	108.2	I2474 I2497 F2508 V2529	I2474-H2506 PolarHBondContact N-CD2 2.84Å; I2474-H2506 PolarHBondContact N-NE2 2.89Å; I2474-H2506 PolarHBondContact O-CD2 2.95Å; I2497-H2506 HydrophobicContact CB-CB 4.48Å; I2497-H2506 PolarHBondContact N-O 3.16Å; I2497-H2506 PolarHBondContact O-N 2.7Å; H2506-F2508 HydrophobicContact CB-CE2 3.59Å; H2506-F2508 HydrophobicContact CB-CZ 3.91Å; H2506-V2529 HydrophobicContact CB-CG2 4.01Å
2507	L	85.5	Confident	81.6	Confident	44 Å²	44	44.7 Å²	44.7	23%	0.23	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	142	177.2	176.9	68.4	0	0	0	109.6	K2494 L2496 Q2509 V2529 S2530	K2494-L2507 HydrophobicContact CB-CD1 4.37Å; K2494-L2507 HydrophobicContact CD-CD1 4.16Å; L2496-L2507 HydrophobicContact CD1-CB 4Å; L2496-L2507 HydrophobicContact CD1-CD1 3.74Å; L2496-L2507 HydrophobicContact CD1-CG 4.46Å; L2507-Q2509 HydrophobicContact CD2-CG 4.36Å; L2507-Q2509 HydrophobicContact CG-CG 4.34Å; L2507-V2529 CarbonylContact O-C 3.51Å; L2507-V2529 WeakPolarHBondContact O-CA 3.45Å; L2507-V2529 WeakPolarHBondContact O-CG2 3.25Å; L2507-S2530 WeakPolarHBondContact CD2-OG 3.48Å; L2507-S2530 VanDerWaalsContact CG-OG 3.28Å; L2507-S2530 WeakPolarHBondContact CG-OG 3.37Å; L2507-S2530 PolarHBondContact O-N 2.97Å; L2507-S2530 PolarHBondContact O-OG 3.06Å
2508	F	86.7	Confident	80.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.8	176.8	-58.5	-90.1	0	0	0	108.9	I2474 I2477 K2494 V2495 I2497 H2506 L2527 V2529	I2474-F2508 HydrophobicContact CB-CZ 4.26Å; I2474-F2508 HydrophobicContact CG2-CZ 3.78Å; I2477-F2508 HydrophobicContact CD1-CB 3.86Å; I2477-F2508 HydrophobicContact CD1-CD1 4.17Å; I2477-F2508 HydrophobicContact CD1-CD2 3.9Å; I2477-F2508 HydrophobicContact CD1-CG 3.7Å; I2477-F2508 HydrophobicContact CG1-CB 4.3Å; I2477-F2508 HydrophobicContact CG1-CD1 3.84Å; I2477-F2508 HydrophobicContact CG1-CD2 4.38Å; I2477-F2508 HydrophobicContact CG1-CE1 4.3Å; I2477-F2508 HydrophobicContact CG1-CG 3.91Å; I2477-F2508 HydrophobicContact CG2-CD1 4.3Å; I2477-F2508 HydrophobicContact CG2-CD2 4.3Å; I2477-F2508 HydrophobicContact CG2-CE1 3.94Å; I2477-F2508 HydrophobicContact CG2-CE2 3.94Å; I2477-F2508 HydrophobicContact CG2-CG 4.49Å; I2477-F2508 HydrophobicContact CG2-CZ 3.77Å; K2494-F2508 CarbonylContact C-O 3.39Å; K2494-F2508 VanDerWaalsContact CA-O 3.29Å; K2494-F2508 WeakPolarHBondContact CA-O 3.37Å; K2494-F2508 WeakPolarHBondContact CB-O 3.38Å; V2495-F2508 HydrophobicContact CB-CB 4.31Å; V2495-F2508 PolarHBondContact N-O 2.89Å; V2495-F2508 PolarHBondContact O-N 3.3Å; I2497-F2508 HydrophobicContact CB-CE2 4.34Å; I2497-F2508 HydrophobicContact CD1-CD2 4.19Å; I2497-F2508 HydrophobicContact CD1-CE2 3.81Å; I2497-F2508 HydrophobicContact CG1-CD2 4.23Å; I2497-F2508 HydrophobicContact CG1-CE2 4Å; H2506-F2508 HydrophobicContact CB-CE2 3.59Å; H2506-F2508 HydrophobicContact CB-CZ 3.91Å; F2508-L2527 HydrophobicContact CB-CB 4.14Å; F2508-L2527 HydrophobicContact CB-CD1 4.37Å; F2508-L2527 HydrophobicContact CD1-CB 4.38Å; F2508-V2529 HydrophobicContact CD1-CB 4.29Å; F2508-V2529 VanDerWaalsContact CE1-CA 3.49Å; F2508-V2529 HydrophobicContact CE1-CB 3.64Å; F2508-V2529 HydrophobicContact CE1-CG2 4.22Å; F2508-V2529 HydrophobicContact CZ-CB 3.98Å; F2508-V2529 HydrophobicContact CZ-CG2 4.13Å
2509	Q	78.3	Confident	79.4	Confident	33 Å²	33	50.2 Å²	50.2	15%	0.154	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.1	-177.3	-62.1	-179.3	27.5	0	0	110.9	Y1919 L2507 Y2511 S2530	Y1919-Q2509 PolarHBondContact OH-OE1 3.24Å; Y1919-Q2509 VanDerWaalsContact OH-OE1 3.07Å; L2507-Q2509 HydrophobicContact CD2-CG 4.36Å; L2507-Q2509 HydrophobicContact CG-CG 4.34Å; Q2509-Y2511 HydrophobicContact CB-CD2 4.3Å; Q2509-Y2511 HydrophobicContact CB-CE2 3.86Å; Q2509-Y2511 HydrophobicContact CG-CE2 4.17Å; Q2509-S2530 PolarHBondContact NE2-OG 2.82Å
2510	C	82	Confident	78.2	Confident	7 Å²	7	52.6 Å²	52.6	5%	0.047	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	-57	-177.2	-174	0	0	0	0	112.5	L2492 D2493 Q2512 L2527	L2492-C2510 HydrophobicContact CB-CB 4.31Å; L2492-C2510 HydrophobicContact CD2-CB 3.94Å; L2492-C2510 HydrophobicContact CG-CB 3.87Å; D2493-C2510 PolarHBondContact O-N 2.59Å; C2510-Q2512 VanDerWaalsContact C-N 3.32Å; C2510-Q2512 WeakPolarHBondContact O-CG 3.47Å; C2510-Q2512 PolarHBondContact O-N 3.12Å; C2510-L2527 HydrophobicContact CB-CD1 3.96Å; C2510-L2527 HydrophobicContact CB-CD2 3.92Å
2511	Y	80.9	Confident	77.3	Confident	54 Å²	54	52.6 Å²	52.6	21%	0.212	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	48.1	42.8	-177.5	-55.8	-67	0	0	0	115.1	I1839 T1883 Y2491 L2492 D2493 Q2509	I1839-Y2511 HydrophobicContact CD1-CD2 3.73Å; I1839-Y2511 HydrophobicContact CD1-CE2 4.42Å; T1883-Y2511 PolarHBondContact OG1-O 3.42Å; Y2491-Y2511 VanDerWaalsContact CZ-O 3.26Å; Y2491-Y2511 PolarHBondContact OH-O 2.84Å; L2492-Y2511 CarbonylContact O-C 3.43Å; L2492-Y2511 WeakPolarHBondContact O-CA 3.38Å; L2492-Y2511 PolarHBondContact O-N 3.11Å; D2493-Y2511 HydrophobicContact CB-CD1 3.85Å; D2493-Y2511 HydrophobicContact CB-CE1 3.91Å; D2493-Y2511 PolarHBondContact O-N 3.04Å; Q2509-Y2511 HydrophobicContact CB-CD2 4.3Å; Q2509-Y2511 HydrophobicContact CB-CE2 3.86Å; Q2509-Y2511 HydrophobicContact CG-CE2 4.17Å
2512	Q	78.5	Confident	76.9	Confident	19 Å²	19	54.1 Å²	54.1	9%	0.089	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	160.8	-171	-77.1	-179.1	44.6	0	0	115.2	T1883 Y1885 Y2491 L2492 C2510	T1883-Q2512 HydrophobicContact CG2-CG 4.26Å; Y1885-Q2512 PolarHBondContact OH-NE2 2.75Å; Y1885-Q2512 PolarHBondContact OH-OE1 3.1Å; Y1885-Q2512 VanDerWaalsContact OH-OE1 3.07Å; Y2491-Q2512 CarbonylContact C-O 3.58Å; Y2491-Q2512 WeakPolarHBondContact CA-O 3.39Å; L2492-Q2512 PolarHBondContact N-O 2.87Å; L2492-Q2512 PolarHBondContact O-N 2.89Å; C2510-Q2512 VanDerWaalsContact C-N 3.32Å; C2510-Q2512 WeakPolarHBondContact O-CG 3.47Å; C2510-Q2512 PolarHBondContact O-N 3.12Å
2513	W	80.1	Confident	76.8	Confident	44 Å²	44	52.1 Å²	52.1	17%	0.167	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.9	166.1	-67.9	104.1	0	0	0	111.2	K2421 G2422 C2423 A2424 D2489 W2490 Y2491 K2518	K2421-W2513 HydrophobicContact CB-CZ2 4.42Å; G2422-W2513 WeakPolarHBondContact O-CH2 3.16Å; C2423-W2513 WeakPolarHBondContact O-CH2 3.33Å; C2423-W2513 WeakPolarHBondContact O-CZ3 3.49Å; A2424-W2513 HydrophobicContact CB-CH2 4.49Å; D2489-W2513 HydrophobicContact CB-CE3 4.39Å; D2489-W2513 HydrophobicContact CB-CZ3 4.14Å; W2490-W2513 CarbonylContact O-C 3.59Å; W2490-W2513 VanDerWaalsContact O-CA 3.23Å; W2490-W2513 WeakPolarHBondContact O-CA 3.32Å; W2490-W2513 VanDerWaalsContact O-CE3 3.24Å; Y2491-W2513 HydrophobicContact CD2-CB 4.43Å; Y2491-W2513 AromaticContact CD2-CD1 3.73Å; Y2491-W2513 AromaticContact CD2-CD2 3.62Å; Y2491-W2513 HydrophobicContact CD2-CD2 3.62Å; Y2491-W2513 AromaticContact CD2-CE2 3.57Å; Y2491-W2513 HydrophobicContact CD2-CE3 4.24Å; Y2491-W2513 AromaticContact CD2-CG 3.7Å; Y2491-W2513 HydrophobicContact CD2-CG 3.7Å; Y2491-W2513 HydrophobicContact CD2-CZ2 4.11Å; Y2491-W2513 AromaticContact CD2-NE1 3.67Å; Y2491-W2513 AromaticContact CE2-CD1 3.88Å; Y2491-W2513 HydrophobicContact CE2-CD2 4.49Å; Y2491-W2513 HydrophobicContact CE2-CG 4.26Å; Y2491-W2513 AromaticContact CE2-NE1 3.87Å; Y2491-W2513 HydrophobicContact CG-CD2 4.47Å; W2513-K2518 HydrophobicContact CB-CB 3.95Å; W2513-K2518 HydrophobicContact CD2-CB 3.69Å; W2513-K2518 HydrophobicContact CD2-CD 3.63Å; W2513-K2518 HydrophobicContact CD2-CG 4.29Å; W2513-K2518 HydrophobicContact CE3-CB 4.13Å; W2513-K2518 HydrophobicContact CE3-CD 3.5Å; W2513-K2518 VanDerWaalsContact CE3-CD 3.5Å; W2513-K2518 HydrophobicContact CE3-CG 4.48Å; W2513-K2518 HydrophobicContact CG-CB 3.58Å; W2513-K2518 HydrophobicContact CG-CD 4.44Å; W2513-K2518 HydrophobicContact CH2-CD 3.79Å; W2513-K2518 HydrophobicContact CZ2-CD 3.87Å; W2513-K2518 HydrophobicContact CZ3-CD 3.59Å
2514	I	85.7	Confident	77	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	108.2	160.3	-43.9	-170.8	0	0	0	105	I2479 H2481 W2490 L2492 R2522 L2523 K2525	I2479-I2514 HydrophobicContact CG2-CD1 4.16Å; H2481-I2514 PolarHBondContact NE2-O 3.28Å; W2490-I2514 HydrophobicContact CE3-CB 4.36Å; W2490-I2514 HydrophobicContact CE3-CD1 3.92Å; W2490-I2514 HydrophobicContact CE3-CG1 4.36Å; W2490-I2514 HydrophobicContact CZ3-CD1 4.04Å; W2490-I2514 PolarHBondContact N-O 3.34Å; W2490-I2514 PolarHBondContact O-N 3Å; L2492-I2514 HydrophobicContact CB-CD1 4.31Å; L2492-I2514 HydrophobicContact CD2-CD1 4.07Å; I2514-R2522 CarbonylContact C-O 3.5Å; I2514-R2522 WeakPolarHBondContact CG2-O 3.43Å; I2514-L2523 WeakPolarHBondContact CG2-O 3.39Å; I2514-K2525 HydrophobicContact CD1-CB 4.33Å; I2514-K2525 HydrophobicContact CD1-CG 3.75Å; I2514-K2525 HydrophobicContact CG1-CG 3.96Å
2515	S	81	Confident	76.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-171.8	149.1	-161.6	163.7	0	0	0	0	110.5	D2489 K2517 K2518 C2521 R2522	D2489-S2515 WeakPolarHBondContact OD1-CB 3.16Å; D2489-S2515 PolarHBondContact OD1-OG 2.81Å; S2515-K2517 VanDerWaalsContact C-N 3.31Å; S2515-K2517 PolarHBondContact OG-N 3.21Å; S2515-K2518 PolarHBondContact OG-N 3.15Å; S2515-C2521 CarbonylContact O-C 3.51Å; S2515-C2521 WeakPolarHBondContact O-CA 3.24Å; S2515-R2522 PolarHBondContact N-O 2.75Å; S2515-R2522 PolarHBondContact O-N 3.01Å
2516	K	71.8	Confident	76.6	Confident	125 Å²	125	51.1 Å²	51.1	54%	0.543	25%	0.247	S	C	.	.	S	Bend	trans	-81	-5.6	170.9	-126.2	167.9	-174.4	167.5	0	114.6	L2523	K2516-L2523 HydrophobicContact CB-CD2 3.89Å; K2516-L2523 HydrophobicContact CD-CD1 4.21Å; K2516-L2523 HydrophobicContact CD-CD2 4.32Å; K2516-L2523 HydrophobicContact CG-CD2 3.94Å; K2516-L2523 HydrophobicContact CG-CG 4.4Å
2517	K	71.3	Confident	76.2	Confident	174 Å²	174	51.2 Å²	51.2	76%	0.757	25%	0.248	S	C	*	.	S	Bend	trans	-127.9	-18.6	-171	-63.5	177.6	-177.2	172	0	114.1	S2515	S2515-K2517 VanDerWaalsContact C-N 3.31Å; S2515-K2517 PolarHBondContact OG-N 3.21Å
2518	K	67.9	Low	75.6	Confident	58 Å²	58	50.3 Å²	50.3	25%	0.252	24%	0.243	S	C	.	.	S	Bend	trans	-128.7	157.6	-174.3	-60.6	169.1	179.4	152.2	0	110.3	D2489 W2513 S2515 C2521	D2489-K2518 HydrophobicContact CB-CD 4.02Å; D2489-K2518 VanDerWaalsContact CB-NZ 3.27Å; D2489-K2518 WeakPolarHBondContact OD2-CD 3.46Å; D2489-K2518 WeakPolarHBondContact OD2-CE 3.45Å; D2489-K2518 IonicContact OD2-NZ 2.67Å; D2489-K2518 PolarHBondContact OD2-NZ 3.31Å; W2513-K2518 HydrophobicContact CB-CB 3.95Å; W2513-K2518 HydrophobicContact CD2-CB 3.69Å; W2513-K2518 HydrophobicContact CD2-CD 3.63Å; W2513-K2518 HydrophobicContact CD2-CG 4.29Å; W2513-K2518 HydrophobicContact CE3-CB 4.13Å; W2513-K2518 HydrophobicContact CE3-CD 3.5Å; W2513-K2518 VanDerWaalsContact CE3-CD 3.5Å; W2513-K2518 HydrophobicContact CE3-CG 4.48Å; W2513-K2518 HydrophobicContact CG-CB 3.58Å; W2513-K2518 HydrophobicContact CG-CD 4.44Å; W2513-K2518 HydrophobicContact CH2-CD 3.79Å; W2513-K2518 HydrophobicContact CZ2-CD 3.87Å; W2513-K2518 HydrophobicContact CZ3-CD 3.59Å; S2515-K2518 PolarHBondContact OG-N 3.15Å; K2518-C2521 PolarHBondContact O-N 3.25Å
2519	G	67.2	Low	75.2	Confident	59 Å²	59	51 Å²	51	61%	0.608	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.5	-128.6	179.1	0	0	0	0	0	112.9	C2521	G2519-C2521 VanDerWaalsContact C-N 3.34Å
2520	D	61.8	Low	74.5	Confident	51 Å²	51	49.9 Å²	49.9	27%	0.273	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	15.9	171.8	62.9	-28.3	0	0	0	112.7	R2522 K2525	D2520-R2522 PolarHBondContact O-N 3.17Å; D2520-R2522 WeakPolarHBondContact OD2-CD 3.36Å; D2520-R2522 IonicContact OD2-NE 3.94Å; D2520-K2525 IonicContact OD1-NZ 3.73Å; D2520-K2525 PolarHBondContact OD1-NZ 3.31Å; D2520-K2525 IonicContact OD2-NZ 2.77Å; D2520-K2525 PolarHBondContact OD2-NZ 2.93Å
2521	C	67.2	Low	73	Confident	74 Å²	74	56.9 Å²	56.9	50%	0.5	28%	0.28	S	S	.	.	S	Bend	trans	59.7	23.7	177.9	-59.6	0	0	0	0	115	S2515 K2518 G2519	S2515-C2521 CarbonylContact O-C 3.51Å; S2515-C2521 WeakPolarHBondContact O-CA 3.24Å; K2518-C2521 PolarHBondContact O-N 3.25Å; G2519-C2521 VanDerWaalsContact C-N 3.34Å
2522	R	66.4	Low	72.6	Confident	130 Å²	130	57 Å²	57	49%	0.491	28%	0.284	S	S	.	.			trans	-100.6	144.1	178.5	-65.1	-173.3	-179.1	-176.4	-0.3	112.5	I2514 S2515 D2520 W2524	I2514-R2522 CarbonylContact C-O 3.5Å; I2514-R2522 WeakPolarHBondContact CG2-O 3.43Å; S2515-R2522 PolarHBondContact N-O 2.75Å; S2515-R2522 PolarHBondContact O-N 3.01Å; D2520-R2522 PolarHBondContact O-N 3.17Å; D2520-R2522 WeakPolarHBondContact OD2-CD 3.36Å; D2520-R2522 IonicContact OD2-NE 3.94Å; R2522-W2524 VanDerWaalsContact C-N 3.32Å
2523	L	76.7	Confident	72.3	Confident	37 Å²	37	59 Å²	59	19%	0.194	29%	0.294	C	S	.	.	S	Bend	trans	-89.6	6.2	175	-52	-178.5	0	0	0	113.2	E2480 H2481 N2483 I2514 K2516	E2480-L2523 VanDerWaalsContact CA-O 3.29Å; E2480-L2523 WeakPolarHBondContact CA-O 3.39Å; E2480-L2523 WeakPolarHBondContact CB-O 3.25Å; H2481-L2523 PolarHBondContact CD2-O 3.38Å; H2481-L2523 VanDerWaalsContact CD2-O 3.29Å; H2481-L2523 PolarHBondContact N-O 3.36Å; H2481-L2523 WeakPolarHBondContact NE2-CD2 3.21Å; N2483-L2523 HydrophobicContact CB-CD1 3.82Å; N2483-L2523 HydrophobicContact CB-CD2 3.93Å; N2483-L2523 WeakPolarHBondContact OD1-CD2 3.5Å; I2514-L2523 WeakPolarHBondContact CG2-O 3.39Å; K2516-L2523 HydrophobicContact CB-CD2 3.89Å; K2516-L2523 HydrophobicContact CD-CD1 4.21Å; K2516-L2523 HydrophobicContact CD-CD2 4.32Å; K2516-L2523 HydrophobicContact CG-CD2 3.94Å; K2516-L2523 HydrophobicContact CG-CG 4.4Å
2524	W	79.3	Confident	71.8	Confident	94 Å²	94	59.8 Å²	59.8	36%	0.356	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	158.1	-178.7	65.9	-93.3	0	0	0	112.6	I2478 I2479 E2480 R2522 E2526	I2478-W2524 HydrophobicContact CG2-CE3 4.39Å; I2479-W2524 CarbonylContact O-C 3.56Å; I2479-W2524 VanDerWaalsContact O-CA 3.31Å; I2479-W2524 WeakPolarHBondContact O-CA 3.27Å; E2480-W2524 HydrophobicContact CB-CB 3.49Å; E2480-W2524 VanDerWaalsContact CB-CB 3.49Å; R2522-W2524 VanDerWaalsContact C-N 3.32Å; W2524-E2526 HydrophobicContact CZ3-CB 3.92Å
2525	K	76.8	Confident	71	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.039	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	127.9	173.4	-65.5	-69.6	174.5	175.3	0	111.3	I2478 I2479 I2514 D2520 L2527	I2478-K2525 WeakPolarHBondContact CA-O 3.11Å; I2479-K2525 HydrophobicContact CG2-CB 4.31Å; I2479-K2525 PolarHBondContact N-O 3.05Å; I2479-K2525 PolarHBondContact O-N 3.14Å; I2514-K2525 HydrophobicContact CD1-CB 4.33Å; I2514-K2525 HydrophobicContact CD1-CG 3.75Å; I2514-K2525 HydrophobicContact CG1-CG 3.96Å; D2520-K2525 IonicContact OD1-NZ 3.73Å; D2520-K2525 PolarHBondContact OD1-NZ 3.31Å; D2520-K2525 IonicContact OD2-NZ 2.77Å; D2520-K2525 PolarHBondContact OD2-NZ 2.93Å; K2525-L2527 HydrophobicContact CB-CD2 3.8Å; K2525-L2527 HydrophobicContact CB-CG 4.09Å
2526	E	77.1	Confident	70.4	Confident	53 Å²	53	67.3 Å²	67.3	25%	0.248	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	115.5	159.7	173.9	170.7	-151.4	0	0	107.3	K1963 R2476 I2477 I2478 W2524	K1963-E2526 IonicContact NZ-OE1 2.66Å; K1963-E2526 IonicContact NZ-OE2 3.53Å; K1963-E2526 PolarHBondContact NZ-OE2 3.22Å; R2476-E2526 WeakPolarHBondContact CD-OE1 3.4Å; R2476-E2526 IonicContact CZ-OE1 2.75Å; R2476-E2526 IonicContact NE-OE1 2.75Å; R2476-E2526 IonicContact NH1-OE1 3.43Å; R2476-E2526 PolarHBondContact NH1-OE1 2.98Å; I2477-E2526 WeakPolarHBondContact O-CA 3.1Å; I2478-E2526 HydrophobicContact CG1-CB 4.33Å; W2524-E2526 HydrophobicContact CZ3-CB 3.92Å
2527	L	78	Confident	70.3	Confident	11 Å²	11	63.5 Å²	63.5	6%	0.058	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.8	179.6	-53.9	177.9	0	0	0	108.9	R2476 I2477 I2479 L2492 V2495 F2508 C2510 K2525	R2476-L2527 CarbonylContact C-O 3.49Å; R2476-L2527 VanDerWaalsContact CA-O 3.29Å; R2476-L2527 WeakPolarHBondContact CA-O 3.04Å; I2477-L2527 HydrophobicContact CD1-CB 4.46Å; I2477-L2527 HydrophobicContact CD1-CD1 4.23Å; I2477-L2527 HydrophobicContact CG1-CB 3.85Å; I2477-L2527 HydrophobicContact CG1-CD1 4.41Å; I2477-L2527 HydrophobicContact CG1-CG 4.49Å; I2477-L2527 PolarHBondContact N-O 3.1Å; I2477-L2527 PolarHBondContact O-N 3.22Å; I2479-L2527 HydrophobicContact CG2-CD1 3.8Å; I2479-L2527 HydrophobicContact CG2-CG 4.38Å; L2492-L2527 HydrophobicContact CD2-CD1 4.2Å; V2495-L2527 HydrophobicContact CG2-CD1 4.48Å; F2508-L2527 HydrophobicContact CB-CB 4.14Å; F2508-L2527 HydrophobicContact CB-CD1 4.37Å; F2508-L2527 HydrophobicContact CD1-CB 4.38Å; C2510-L2527 HydrophobicContact CB-CD1 3.96Å; C2510-L2527 HydrophobicContact CB-CD2 3.92Å; K2525-L2527 HydrophobicContact CB-CD2 3.8Å; K2525-L2527 HydrophobicContact CB-CG 4.09Å
2528	L	73.1	Confident	70.2	Confident	24 Å²	24	55.6 Å²	55.6	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	152.1	177.2	-77.2	149.2	0	0	0	110	M1928 V1958 F1960 R2476 S2530	M1928-L2528 HydrophobicContact CB-CD1 4.13Å; M1928-L2528 HydrophobicContact CE-CB 3.44Å; M1928-L2528 VanDerWaalsContact CE-CB 3.44Å; M1928-L2528 HydrophobicContact CE-CD1 3.78Å; M1928-L2528 HydrophobicContact CE-CG 4.23Å; M1928-L2528 HydrophobicContact CG-CD1 4.44Å; M1928-L2528 HydrophobicContact SD-CB 4.3Å; M1928-L2528 HydrophobicContact SD-CD1 3.51Å; M1928-L2528 VanDerWaalsContact SD-CD1 3.51Å; V1958-L2528 HydrophobicContact CG1-CB 4.38Å; V1958-L2528 HydrophobicContact CG1-CD2 3.78Å; F1960-L2528 HydrophobicContact CB-CD2 4.1Å; F1960-L2528 HydrophobicContact CD1-CD1 4.2Å; F1960-L2528 HydrophobicContact CD1-CD2 4.01Å; F1960-L2528 HydrophobicContact CE1-CD1 4.32Å; F1960-L2528 HydrophobicContact CG-CD2 4.31Å; R2476-L2528 HydrophobicContact CB-CD2 3.82Å; R2476-L2528 HydrophobicContact CB-CG 4.24Å; L2528-S2530 PolarHBondContact O-N 3.19Å
2529	V	77.3	Confident	70.4	Confident	16 Å²	16	55.4 Å²	55.4	10%	0.097	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	131.9	-176.3	68.4	0	0	0	0	110.9	V1958 Q2475 H2506 L2507 F2508	V1958-V2529 HydrophobicContact CG1-CG1 4.15Å; V1958-V2529 HydrophobicContact CG2-CG1 4.09Å; V1958-V2529 VanDerWaalsContact CG2-O 3.25Å; V1958-V2529 WeakPolarHBondContact CG2-O 3.08Å; Q2475-V2529 PolarHBondContact O-N 2.91Å; H2506-V2529 HydrophobicContact CB-CG2 4.01Å; L2507-V2529 CarbonylContact O-C 3.51Å; L2507-V2529 WeakPolarHBondContact O-CA 3.45Å; L2507-V2529 WeakPolarHBondContact O-CG2 3.25Å; F2508-V2529 HydrophobicContact CD1-CB 4.29Å; F2508-V2529 VanDerWaalsContact CE1-CA 3.49Å; F2508-V2529 HydrophobicContact CE1-CB 3.64Å; F2508-V2529 HydrophobicContact CE1-CG2 4.22Å; F2508-V2529 HydrophobicContact CZ-CB 3.98Å; F2508-V2529 HydrophobicContact CZ-CG2 4.13Å
2530	S	64	Low	70.7	Confident	8 Å²	8	55.1 Å²	55.1	6%	0.056	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.6	167.8	58.7	0	0	0	0	109.1	L2507 Q2509 L2528	L2507-S2530 WeakPolarHBondContact CD2-OG 3.48Å; L2507-S2530 VanDerWaalsContact CG-OG 3.28Å; L2507-S2530 WeakPolarHBondContact CG-OG 3.37Å; L2507-S2530 PolarHBondContact O-N 2.97Å; L2507-S2530 PolarHBondContact O-OG 3.06Å; Q2509-S2530 PolarHBondContact NE2-OG 2.82Å; L2528-S2530 PolarHBondContact O-N 3.19Å
2531	N	50.3	Low	71.5	Confident	154 Å²	154	55.5 Å²	55.5	82%	0.824	27%	0.272	S	S	*	.			trans	-70.8	0	169.4	-66.9	-31	0	0	0	112	T1955	T1955-N2531 PolarHBondContact O-ND2 3Å

Retrieved 2,531 of 2,531 residues in 4328.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).