A0A3Q0KM21_SCHMA Loading...

Axon guidance protein

AlphaFold DB , UniProt , Accession A0A3Q0KM21, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,936 aa.

						>A0A3Q0KM21_SCHMA|A0A3Q0KM21
MQFFLWNIPIEMLLIIWFLLSLYTNRQIFPIHVYTTGLILTNDIVEDNAASISLPNYHPNITVSNNNNEKDEFISYKSKNRIWAALPKHIDLLHFPQVNMNDKVSKQGINLHQMVTDQSKPKFRRESSRQKFSFKRRSNPQIRSRFSKAFNYANFTCPNECTCHLNEIECNNAQLESIPLNIPSYTEKLFIIGNNIKTLNNGNLRDLIHLKTLVLSNNKIEHIEENAFSELTNLRRLKLNLNLLQTLPENIFSSLKQLQRLDLQDNKLVCLPGSLFSGLNELRFILLARNNLIWLPGSLISDLKLLRYIDLKENPLQCDCHIQPFLNEFIMTNRLAILQKSGAVCSSLSTDPSLHGYPLSENVYQTLQCPLDSEMVQKPPQQCISLIRSSCDGICDCSIEGVANCQNRGLKSIPNDLPKDIMELNLDHNELISLPLDSFIHYKNLRKIVLDNNRISYIHPQAFNNLHELSSLYMSSNELGLLPSRIFSQLTNLKILYLHRNKISCIHRGSFAGLEHLQILHLSNNRIQTFPRNSFEDLRRLKYLYLVHNPLICDCQLAAWLPVFLIEKEAGGTQWVRCAEPLNVQGHHVRELLPHILDCPSNINYKEENHSCEFHDYQCPDGCRCKDIIIKPRMHANSEAIFRQDEFGSILGGLSVDCSSLELTEIPDNLPINTKELILRNNLIKSITIESGLSKLKSLETLIIDGNEIEHIEPMSFRNNLNIKKLILSNNSLTYLEEKTFNGLKNIEILLLQHNQIKCLNNRTFHQTPVLKILMLNNNKLRCIAKGIFTELNLESLSLSANPFKCDCHLSWLPDWLRNNANQINEGPSPPICISPEDLAGTPVASLSRYHFICKNSASNCLSTNENLHLNEKLNTNENGIVQSVQNVYCDTTGTSCCEEIAAQTTCPLNCLCGTDGVYCSDRNLTEIPVNISPETTQLYLERNQITKIDSNRIAHLKKLQTLVLSYNKLRELPPRVFEKLANLKTIVLSYNNLQCIHPEAFHGLSNLRVLILQGNNISSIPQGTFNDLGQLNNLALGQNPLHCDCTTKWLNGFFRQNFLDNGISLCHSPSNMRLKSIYHSKPTDFICPLKQHDLHNEINTSSLVSRNENLLYFQNAKISDQHNHQDQISNSKSIQEVLNREKESLIIAAKCMPCLLNPCQNGGTCLALTQLDYKCSCKPPYYGKNCEQRDHICSTNPCQNGGLCKITAYPSSYKCICPTGFHGPTCTKQMETCRQNLCENGGTCEVVDNDYRCHCTALFHGKNCQHEYIYCEELNPCGNGGKCISLPKNNYRCECLTGWIGNDCQINQDDCIYNRCENGATCVDGINEYICKCRPGYAGIYCERPTWKQSTYITRMDRPFNYQLMIGRTSVPGVRQSPIKTRSLTTQNLDTLCAYQQCQNNAKCVENQNDAYTCICQKGFSGQFCENLFAISLPSPHSYVAIVPPSRGALVPSGTISFEIATKSMNGILLNFIDTSLINNSDGIPEHYLLVDLHDGQIHVKFSLNRNYTTHNMNCNININDGNFHQIKLYLEAKILFLYIDNNLCITMGKVNTKLNESISNHGHNNPIHSSSIFTYNMVIKSKHLALTSPLYFGGVPVDQLETARHLTNGLSELGLTGCIRNVQINGRMIDFARLFGAPVDKMIVAEEHDIDSSSPEAKHHGTAIGILPGCRLSNEKSEYMESAVEFQANNNESQKLKSINLNTNQELETRKSESLKIGQLHNTKTSDKATLCDPHGNNSCLNGGICENNEMNQTIKYQCKCPTGFKGERCEIVPVCHRETQRSYIRDPQTNCISSRKLSIRKCSGSCDSTMINLQQQESFNNDNNDITNDNESFKYHKWKAFHKRSTNSDHVWLPQNLDHKQSHIIKMKDSNTPISSPYSIHLNSYKITSSMTKQHCCQAIKIKLRPILFNCPNGAVYERTIKLAKKCTCIQCD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.6	Very low	35.9	Very low	218 Å²	218	164.8 Å²	164.8	100%	1.074	78%	0.784	S	S	*	*				0	68.2	0	-65.3	-52.6	-153.6	0	0	109.7
2	Q	29.7	Very low	36.6	Very low	190 Å²	190	159.3 Å²	159.3	89%	0.888	76%	0.759	S	S	*	*			trans	-134.8	29.9	-168.8	-154.7	171.5	5.4	0	0	111.7
3	F	28.5	Very low	37.4	Very low	201 Å²	201	155.4 Å²	155.4	88%	0.882	75%	0.745	S	S	*	*	S	Bend	trans	-144.3	18.9	-169	-115.3	-76.4	0	0	0	113.6
4	F	29.3	Very low	37.8	Very low	200 Å²	200	152.4 Å²	152.4	88%	0.877	73%	0.734	S	S	*	*	S	Bend	trans	-133.5	21.6	-177.5	-101	-72	0	0	0	113.4
5	L	31.1	Very low	38.5	Very low	145 Å²	145	148.2 Å²	148.2	76%	0.759	72%	0.716	S	S	*	*	S	Bend	trans	-128.2	28.7	-178.6	-71.7	174.3	0	0	0	112.9
6	W	32.9	Very low	38.8	Very low	248 Å²	248	144.3 Å²	144.3	94%	0.939	70%	0.698	S	S	*	*	S	Bend	trans	-126.3	24.5	178.7	-104.8	57.9	0	0	0	112.8
7	N	35.7	Very low	38.6	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	70%	0.702	S	S	*	*			trans	-147.8	56.1	175.4	-95.1	-21.7	0	0	0	110.8
8	I	43.2	Very low	38.7	Very low	98 Å²	98	147.3 Å²	147.3	50%	0.503	70%	0.698	S	S	.	*			trans	-125.2	117.5	164.3	-62.1	179.9	0	0	0	106.7	M12	I8-M12 HydrophobicContact CG2-CB 4.03Å
9	P	47.6	Very low	38.6	Very low	77 Å²	77	145.1 Å²	145.1	50%	0.5	69%	0.69	S	S	.	*			trans	-59.1	147.1	177.4	-26.2	35.7	0	0	0	112.7	E11 M12	P9-E11 PolarHBondContact O-N 3.39Å; P9-E11 VanDerWaalsContact O-N 3.16Å; P9-M12 PolarHBondContact O-N 3.48Å; P9-M12 VanDerWaalsContact O-N 3.07Å
10	I	46.5	Very low	38.3	Very low	133 Å²	133	144.2 Å²	144.2	68%	0.682	69%	0.689	S	S	*	*	H	α-helix	trans	-58.8	-31	-176.5	-66.8	174.7	0	0	0	111.7	M12 L13 L14	I10-M12 VanDerWaalsContact C-N 3.3Å; I10-M12 PolarHBondContact O-N 3.42Å; I10-L13 PolarHBondContact O-N 2.82Å; I10-L13 VanDerWaalsContact O-N 3.13Å; I10-L14 PolarHBondContact O-N 2.81Å
11	E	44.4	Very low	38	Very low	142 Å²	142	140.8 Å²	140.8	66%	0.664	68%	0.68	S	S	*	*	H	α-helix	trans	-58.1	-37.9	177	-64.2	140.7	162.6	0	0	112.6	P9 L14 I15	P9-E11 PolarHBondContact O-N 3.39Å; P9-E11 VanDerWaalsContact O-N 3.16Å; E11-L14 PolarHBondContact O-N 3.4Å; E11-I15 WeakPolarHBondContact O-CG1 3.23Å; E11-I15 PolarHBondContact O-N 2.79Å
12	M	44.6	Very low	38.2	Very low	98 Å²	98	136 Å²	136	48%	0.483	66%	0.658	S	S	.	*	H	α-helix	trans	-75.3	-27.1	178	-78	-70.9	-83.3	0	0	113	I8 P9 I10 I15 I16	I8-M12 HydrophobicContact CG2-CB 4.03Å; P9-M12 PolarHBondContact O-N 3.48Å; P9-M12 VanDerWaalsContact O-N 3.07Å; I10-M12 VanDerWaalsContact C-N 3.3Å; I10-M12 PolarHBondContact O-N 3.42Å; M12-I15 PolarHBondContact O-N 3.47Å; M12-I15 HydrophobicContact SD-CD1 3.93Å; M12-I16 WeakPolarHBondContact O-CG1 3.28Å; M12-I16 PolarHBondContact O-N 3.23Å
13	L	47.2	Very low	38.1	Very low	109 Å²	109	137 Å²	137	57%	0.571	66%	0.655	S	S	*	*	H	α-helix	trans	-69.5	-36	172.3	-80.9	166.4	0	0	0	111.6	I10 I16 W17	I10-L13 PolarHBondContact O-N 2.82Å; I10-L13 VanDerWaalsContact O-N 3.13Å; L13-I16 PolarHBondContact O-N 3.04Å; L13-W17 WeakPolarHBondContact O-CB 3.3Å; L13-W17 PolarHBondContact O-N 2.94Å
14	L	43.3	Very low	38.1	Very low	113 Å²	113	132.6 Å²	132.6	59%	0.592	65%	0.645	S	S	*	*	H	α-helix	trans	-63.4	-43.7	171.9	-74.6	165.1	0	0	0	111.6	I10 E11 I16 W17 F18	I10-L14 PolarHBondContact O-N 2.81Å; E11-L14 PolarHBondContact O-N 3.4Å; L14-I16 PolarHBondContact O-N 2.97Å; L14-W17 PolarHBondContact O-N 3.03Å; L14-F18 WeakPolarHBondContact O-CB 3.33Å; L14-F18 PolarHBondContact O-N 2.74Å
15	I	47.6	Very low	38.1	Very low	90 Å²	90	131.1 Å²	131.1	46%	0.462	65%	0.647	S	S	.	*	H	α-helix	trans	-61.6	-43.8	176.3	-67.5	166	0	0	0	111.3	E11 M12 W17 F18 L19	E11-I15 WeakPolarHBondContact O-CG1 3.23Å; E11-I15 PolarHBondContact O-N 2.79Å; M12-I15 PolarHBondContact O-N 3.47Å; M12-I15 HydrophobicContact SD-CD1 3.93Å; I15-W17 PolarHBondContact O-N 3.15Å; I15-F18 PolarHBondContact O-N 3.34Å; I15-L19 HydrophobicContact CG2-CD1 3.88Å; I15-L19 HydrophobicContact CG2-CG 4.4Å; I15-L19 WeakPolarHBondContact O-CB 3Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3Å; I15-L19 PolarHBondContact O-N 3.39Å
16	I	43	Very low	37.7	Very low	86 Å²	86	135 Å²	135	44%	0.441	65%	0.651	S	S	.	*	H	α-helix	trans	-65.6	-38.1	177.6	-69.4	167.6	0	0	0	111.8	M12 L13 L14 L19 L20	M12-I16 WeakPolarHBondContact O-CG1 3.28Å; M12-I16 PolarHBondContact O-N 3.23Å; L13-I16 PolarHBondContact O-N 3.04Å; L14-I16 PolarHBondContact O-N 2.97Å; I16-L19 PolarHBondContact O-N 3.04Å; I16-L20 HydrophobicContact CG2-CD1 4.05Å; I16-L20 WeakPolarHBondContact O-CB 3.35Å; I16-L20 PolarHBondContact O-N 3.39Å
17	W	36.5	Very low	37.5	Very low	202 Å²	202	132.4 Å²	132.4	77%	0.765	65%	0.649	S	S	*	*	H	α-helix	trans	-67.8	-39.1	176.2	-157.6	67.1	0	0	0	111.9	L13 L14 I15 L20 S21	L13-W17 WeakPolarHBondContact O-CB 3.3Å; L13-W17 PolarHBondContact O-N 2.94Å; L14-W17 PolarHBondContact O-N 3.03Å; I15-W17 PolarHBondContact O-N 3.15Å; W17-L20 PolarHBondContact O-N 2.98Å; W17-S21 PolarHBondContact O-N 2.91Å; W17-S21 VanDerWaalsContact O-N 3.09Å
18	F	38.9	Very low	36.9	Very low	141 Å²	141	131 Å²	131	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-62.4	-47.5	173.7	-162	-95.5	0	0	0	111.5	L14 I15 L20 S21 L22	L14-F18 WeakPolarHBondContact O-CB 3.33Å; L14-F18 PolarHBondContact O-N 2.74Å; I15-F18 PolarHBondContact O-N 3.34Å; F18-L20 PolarHBondContact O-N 3.3Å; F18-S21 WeakPolarHBondContact O-CB 3.32Å; F18-S21 PolarHBondContact O-N 3.47Å; F18-S21 PolarHBondContact O-OG 2.04Å; F18-L22 HydrophobicContact CD1-CD1 4.37Å; F18-L22 HydrophobicContact CE1-CD1 4.39Å
19	L	37.3	Very low	36	Very low	105 Å²	105	135.8 Å²	135.8	55%	0.55	66%	0.658	S	S	.	*	H	α-helix	trans	-63.7	-35.8	177.9	-72	171.2	0	0	0	113.1	I15 I16 L22	I15-L19 HydrophobicContact CG2-CD1 3.88Å; I15-L19 HydrophobicContact CG2-CG 4.4Å; I15-L19 WeakPolarHBondContact O-CB 3Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3Å; I15-L19 PolarHBondContact O-N 3.39Å; I16-L19 PolarHBondContact O-N 3.04Å; L19-L22 HydrophobicContact CD2-CD1 4.47Å; L19-L22 PolarHBondContact O-N 3.2Å
20	L	32.8	Very low	35.1	Very low	127 Å²	127	136.7 Å²	136.7	67%	0.665	66%	0.664	S	S	*	*	H	α-helix	trans	-72.8	-26.5	174.9	-81.7	165.5	0	0	0	113.4	I16 W17 F18 L22	I16-L20 HydrophobicContact CG2-CD1 4.05Å; I16-L20 WeakPolarHBondContact O-CB 3.35Å; I16-L20 PolarHBondContact O-N 3.39Å; W17-L20 PolarHBondContact O-N 2.98Å; F18-L20 PolarHBondContact O-N 3.3Å; L20-L22 PolarHBondContact O-N 2.03Å
21	S	31.9	Very low	33.9	Very low	73 Å²	73	137 Å²	137	51%	0.51	67%	0.665	S	S	.	*	H	α-helix	trans	-67.4	-22.4	174.2	78.9	0	0	0	0	113.5	W17 F18 Y23	W17-S21 PolarHBondContact O-N 2.91Å; W17-S21 VanDerWaalsContact O-N 3.09Å; F18-S21 WeakPolarHBondContact O-CB 3.32Å; F18-S21 PolarHBondContact O-N 3.47Å; F18-S21 PolarHBondContact O-OG 2.04Å; S21-Y23 VanDerWaalsContact C-N 3.32Å; S21-Y23 PolarHBondContact O-N 3.1Å
22	L	30.4	Very low	32.8	Very low	117 Å²	117	139.2 Å²	139.2	61%	0.613	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-3.8	-174.6	-74	168.4	0	0	0	114.8	F18 L19 L20	F18-L22 HydrophobicContact CD1-CD1 4.37Å; F18-L22 HydrophobicContact CE1-CD1 4.39Å; L19-L22 HydrophobicContact CD2-CD1 4.47Å; L19-L22 PolarHBondContact O-N 3.2Å; L20-L22 PolarHBondContact O-N 2.03Å
23	Y	26.8	Very low	31.7	Very low	210 Å²	210	138.9 Å²	138.9	82%	0.824	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	1.5	-173.9	-126.4	-92.6	0	0	0	116.1	S21	S21-Y23 VanDerWaalsContact C-N 3.32Å; S21-Y23 PolarHBondContact O-N 3.1Å
24	T	29.1	Very low	30.5	Very low	109 Å²	109	144 Å²	144	67%	0.669	69%	0.692	S	S	*	*	S	Bend	trans	-139.1	72	179.9	58.1	0	0	0	0	114.4
25	N	28.4	Very low	29.5	Very low	170 Å²	170	144.4 Å²	144.4	91%	0.909	70%	0.699	S	S	*	*				-179.9	141.7	120	-92.8	-34.6	0	0	0	113.5
26	R	23.8	Very low	28.5	Very low	227 Å²	227	146.4 Å²	146.4	86%	0.857	72%	0.716	S	S	*	*			trans	-121.5	101.6	172.7	-82.5	179.7	165.5	-175.6	-4.2	110.7	I28	R26-I28 HydrophobicContact CB-CD1 4.45Å
27	Q	29.1	Very low	27.5	Very low	193 Å²	193	145.8 Å²	145.8	90%	0.902	73%	0.73	S	S	*	*			trans	-148.5	117.9	156.1	-67.1	-170	-19.6	0	0	105.1
28	I	22.2	Very low	26.8	Very low	132 Å²	132	143.6 Å²	143.6	68%	0.677	73%	0.733	S	S	*	*			cis	73.3	79.5	30.8	-39.7	173.7	0	0	0	112.9	R26	R26-I28 HydrophobicContact CB-CD1 4.45Å
29	F	24.9	Very low	25.9	Very low	198 Å²	198	144.2 Å²	144.2	87%	0.868	74%	0.741	S	S	*	*				-165.6	166.2	113.4	-111.7	-105	0	0	0	107.6
30	P	28.5	Very low	25.3	Very low	95 Å²	95	146.8 Å²	146.8	62%	0.617	76%	0.755	S	S	*	*			trans	-129.2	168.9	-132.3	43.9	-32.6	0	0	0	117.6
31	I	21	Very low	24.7	Very low	140 Å²	140	146 Å²	146	72%	0.718	76%	0.755	S	S	*	*			trans	28.7	112.4	137.1	-51.4	167.4	0	0	0	116.9	V33	I31-V33 HydrophobicContact CG2-CG2 4.05Å
32	H	22.3	Very low	24.3	Very low	188 Å²	188	149 Å²	149	87%	0.87	77%	0.766	S	S	*	*				-133.1	132.3	129.2	-116.1	-86	0	0	0	109.5
33	V	21.2	Very low	23.8	Very low	92 Å²	92	151.7 Å²	151.7	56%	0.558	78%	0.78	S	S	*	*			trans	-100.9	134.8	-177.8	175.6	0	0	0	0	109.4	I31 T35	I31-V33 HydrophobicContact CG2-CG2 4.05Å; V33-T35 HydrophobicContact CG1-CG2 3.91Å
34	Y	22.4	Very low	23.6	Very low	217 Å²	217	148.8 Å²	148.8	85%	0.851	78%	0.778	S	S	*	*			trans	-135.7	121.8	147.9	-100.7	-79.8	0	0	0	109.1
35	T	21	Very low	23.4	Very low	121 Å²	121	150.3 Å²	150.3	74%	0.742	79%	0.787	S	S	*	*			trans	-131.2	77.5	-178.1	47.8	0	0	0	0	110.4	V33	V33-T35 HydrophobicContact CG1-CG2 3.91Å
36	T	26.3	Very low	23.1	Very low	132 Å²	132	150.7 Å²	150.7	81%	0.81	78%	0.783	S	S	*	*			trans	-150.3	145.7	157.3	37.7	0	0	0	0	106.8
37	G	22.5	Very low	23	Very low	72 Å²	72	146.9 Å²	146.9	74%	0.742	78%	0.779	S	S	*	*			cis	112	60.5	10.9	0	0	0	0	0	110.8
38	L	22.6	Very low	22.8	Very low	157 Å²	157	145.8 Å²	145.8	82%	0.822	78%	0.78	S	S	*	*			trans	-142.7	123.2	174.4	-113.5	166.7	0	0	0	109.4
39	I	20.5	Very low	22.7	Very low	154 Å²	154	144.4 Å²	144.4	79%	0.79	79%	0.788	S	S	*	*			trans	-95.6	124.4	170.2	-63.5	168.3	0	0	0	106.2
40	L	23.9	Very low	22.6	Very low	159 Å²	159	140 Å²	140	83%	0.832	79%	0.788	S	S	*	*			trans	-129.7	115.7	163.1	-78.7	172.9	0	0	0	108.3
41	T	20.9	Very low	22.1	Very low	110 Å²	110	141 Å²	141	68%	0.675	80%	0.797	S	S	*	*			trans	-79.1	137.8	165	49.8	0	0	0	0	109
42	N	22.1	Very low	22.2	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	81%	0.806	S	S	*	*				174.5	121.6	122.4	-85.8	-0.9	0	0	0	109	I44	N42-I44 PolarHBondContact O-N 3.18Å
43	D	21.2	Very low	22.1	Very low	173 Å²	173	138.7 Å²	138.7	93%	0.925	80%	0.799	S	S	*	*			trans	-72.3	121.1	169.3	-60.2	-76.3	0	0	0	109.6
44	I	21.5	Very low	22.1	Very low	149 Å²	149	142.5 Å²	142.5	76%	0.764	82%	0.815	S	S	*	*			trans	-143.4	104	164.1	-54.6	178.4	0	0	0	107.9	N42	N42-I44 PolarHBondContact O-N 3.18Å
45	V	25.1	Very low	22.1	Very low	141 Å²	141	136.7 Å²	136.7	86%	0.855	80%	0.804	S	S	*	*				-162.3	106.3	124.4	172.4	0	0	0	0	105.6
46	E	21.8	Very low	22	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	81%	0.806	S	S	*	*			trans	-88.1	153	157.8	-75.3	-175.4	142.6	0	0	110
47	D	22.4	Very low	21.8	Very low	147 Å²	147	142.5 Å²	142.5	79%	0.786	81%	0.81	S	S	*	*			trans	5.6	134.9	158.1	-62.6	-20.4	0	0	0	120.4
48	N	24.6	Very low	22	Very low	171 Å²	171	147.3 Å²	147.3	91%	0.914	81%	0.813	S	S	*	*			trans	-141.1	114.4	135	-101.4	-88.7	0	0	0	109.1
49	A	20.3	Very low	22.3	Very low	102 Å²	102	144 Å²	144	84%	0.843	80%	0.801	S	S	*	*			trans	-89.7	137.4	177.1	0	0	0	0	0	111.1
50	A	22.5	Very low	22.2	Very low	105 Å²	105	143.5 Å²	143.5	87%	0.868	80%	0.8	S	S	*	*			trans	-136.6	126.8	172.7	0	0	0	0	0	110.9
51	S	18.4	Very low	22.1	Very low	117 Å²	117	143.3 Å²	143.3	82%	0.818	80%	0.798	S	S	*	*			trans	-73.5	154.7	-177.7	50.7	0	0	0	0	113.7
52	I	23.1	Very low	22.3	Very low	176 Å²	176	144.8 Å²	144.8	90%	0.903	81%	0.807	S	S	*	*			trans	-150.2	145	141	-98.2	144.6	0	0	0	107.3
53	S	20.1	Very low	22.2	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	81%	0.807	S	S	*	*			trans	-120.6	158.6	-171.9	54	0	0	0	0	111.8
54	L	21.1	Very low	22.2	Very low	171 Å²	171	140.4 Å²	140.4	90%	0.895	80%	0.795	S	S	*	*			trans	-179.8	128.1	147.6	-103.3	160	0	0	0	112.1
55	P	22	Very low	22.2	Very low	95 Å²	95	139 Å²	139	62%	0.617	79%	0.79	S	S	*	*			trans	-109.7	163.9	170.5	38.8	-31.7	0	0	0	113.7
56	N	19.7	Very low	22.1	Very low	144 Å²	144	137.3 Å²	137.3	77%	0.77	78%	0.776	S	S	*	*			trans	64.7	122.1	160.9	-55.2	-25.9	0	0	0	119
57	Y	20.7	Very low	22.2	Very low	232 Å²	232	132.3 Å²	132.3	91%	0.91	76%	0.755	S	S	*	*				-164.4	156.9	103.8	-122.3	-98	0	0	0	113.1
58	H	28.1	Very low	22.2	Very low	172 Å²	172	128 Å²	128	80%	0.796	73%	0.731	S	S	*	*			trans	-105.2	-172.9	177.8	-111.3	-69.5	0	0	0	109
59	P	27.6	Very low	22.2	Very low	89 Å²	89	123.4 Å²	123.4	58%	0.578	71%	0.705	S	S	*	*			cis	-136.9	-167.9	-20.2	37	-16.7	0	0	0	113.9
60	N	19.7	Very low	22.3	Very low	142 Å²	142	125 Å²	125	76%	0.759	69%	0.693	S	S	*	*			trans	55.2	131	144.8	-64	-13.1	0	0	0	122.5
61	I	20.3	Very low	22.3	Very low	155 Å²	155	125.1 Å²	125.1	80%	0.795	68%	0.679	S	S	*	*				-173.2	132	107.2	-92.3	153.7	0	0	0	109.7
62	T	25.2	Very low	22.4	Very low	142 Å²	142	127.9 Å²	127.9	87%	0.871	68%	0.679	S	S	*	*			trans	-142.6	110.5	171.2	36.3	0	0	0	0	110.1
63	V	20.9	Very low	22.2	Very low	118 Å²	118	129 Å²	129	72%	0.715	68%	0.677	S	S	*	*			trans	-144.1	99.3	-177.3	-177.5	0	0	0	0	112.6
64	S	20.3	Very low	22.3	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	68%	0.679	S	S	*	*			trans	66.1	170.8	151.3	83.5	0	0	0	0	118.1
65	N	21.4	Very low	22.2	Very low	120 Å²	120	127.4 Å²	127.4	64%	0.642	67%	0.667	S	S	*	*			cis	-158.5	148.8	13.9	-140.8	-14.8	0	0	0	115.2
66	N	23.6	Very low	22	Very low	106 Å²	106	132.7 Å²	132.7	57%	0.567	68%	0.677	S	S	*	*			trans	62	171.5	150.8	-71.4	-34.7	0	0	0	121.7
67	N	23.8	Very low	22	Very low	71 Å²	71	133.3 Å²	133.3	38%	0.38	67%	0.672	S	S	.	*			trans	171.9	-11.9	153.2	-52.8	-13.6	0	0	0	125.1	R124 R125 E126	N67-R124 WeakPolarHBondContact OD1-CA 3.02Å; N67-R124 PolarHBondContact OD1-N 2.94Å; N67-R125 VanDerWaalsContact CG-N 3.33Å; N67-R125 PolarHBondContact ND2-O 2.92Å; N67-R125 WeakPolarHBondContact OD1-CA 3.46Å; N67-R125 PolarHBondContact OD1-N 3.39Å; N67-E126 PolarHBondContact ND2-N 3.1Å
68	N	23.7	Very low	22.1	Very low	56 Å²	56	127.1 Å²	127.1	30%	0.299	66%	0.663	S	S	.	*			trans	-12.1	157.8	-173.2	-94.5	16.1	0	0	0	125.5	F123 R124 R125	N68-F123 VanDerWaalsContact CG-O 3.23Å; N68-F123 PolarHBondContact N-O 2.98Å; N68-F123 PolarHBondContact OD1-O 2.84Å; N68-R124 HydrophobicContact CB-CB 4.21Å; N68-R124 HydrophobicContact CB-CG 3.7Å; N68-R125 WeakPolarHBondContact O-CA 3.5Å; N68-R125 WeakPolarHBondContact O-CG 3.47Å
69	E	24.6	Very low	21.7	Very low	75 Å²	75	127.6 Å²	127.6	35%	0.35	66%	0.662	S	S	.	*			trans	72	139.6	140.4	-76.9	169.8	-171.1	0	0	120.8	R124 R125	E69-R124 WeakPolarHBondContact OE2-CD 3.39Å; E69-R124 WeakPolarHBondContact OE2-CG 3.02Å; E69-R124 IonicContact OE2-NE 3.6Å; E69-R124 PolarHBondContact OE2-NE 3.26Å; E69-R125 HydrophobicContact CB-CG 4.18Å
70	K	22.5	Very low	21.4	Very low	136 Å²	136	129.3 Å²	129.3	59%	0.591	67%	0.667	S	S	*	*			cis	-172.8	166.9	-1.4	-128.5	177.9	155	-75	0	110.9
71	D	22.1	Very low	21.5	Very low	107 Å²	107	132.7 Å²	132.7	57%	0.572	67%	0.669	S	S	*	*			trans	54	110.8	151.8	-49	-25.7	0	0	0	122.3
72	E	20.7	Very low	21.5	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	67%	0.667	S	S	*	*				48.9	118	124.5	-58	-173.6	146.7	0	0	122.9
73	F	18.7	Very low	21.3	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.873	67%	0.671	S	S	*	*				-163.7	146.8	115.3	-123.4	-85.9	0	0	0	114.5
74	I	20.9	Very low	21.4	Very low	148 Å²	148	135.6 Å²	135.6	76%	0.759	67%	0.668	S	S	*	*			trans	-62.6	134	-165.1	-70.8	161.8	0	0	0	117.6
75	S	19.3	Very low	21.6	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	67%	0.674	S	S	*	*			trans	42.1	127.2	142.2	-165.6	0	0	0	0	122.7
76	Y	19	Very low	21.6	Very low	206 Å²	206	138.2 Å²	138.2	81%	0.808	69%	0.687	S	S	*	*				-153.4	113.2	126.5	-120.8	-83.3	0	0	0	114
77	K	19.7	Very low	21.6	Very low	157 Å²	157	138.8 Å²	138.8	68%	0.683	70%	0.697	S	S	*	*			trans	40.8	97.8	152.7	-63	-176.4	-177.1	177.9	0	121.3
78	S	21.5	Very low	21.5	Very low	101 Å²	101	145.6 Å²	145.6	71%	0.706	72%	0.723	S	S	*	*				49.4	125.4	123.7	68.1	0	0	0	0	121.9
79	K	20.6	Very low	21.5	Very low	182 Å²	182	151.3 Å²	151.3	79%	0.791	75%	0.747	S	S	*	*				-174.8	136.2	102.7	-102.8	172	-179.4	175.4	0	115.8
80	N	21.9	Very low	21.4	Very low	126 Å²	126	154.7 Å²	154.7	67%	0.674	77%	0.766	S	S	*	*			trans	73	117.5	143.1	-66.4	-2.9	0	0	0	122.9
81	R	19.8	Very low	21.5	Very low	212 Å²	212	155.5 Å²	155.5	80%	0.8	78%	0.777	S	S	*	*			trans	75.8	110.1	139.9	-63.2	174.8	179	-171.8	-4.7	116.4
82	I	21.7	Very low	21.5	Very low	147 Å²	147	157.4 Å²	157.4	75%	0.754	79%	0.787	S	S	*	*				63.7	114.9	56.5	-48.7	157.6	0	0	0	108.3
83	W	19.8	Very low	21.6	Very low	250 Å²	250	156.1 Å²	156.1	95%	0.947	78%	0.784	S	S	*	*				-126.3	157	71.4	-83.7	22.9	0	0	0	117
84	A	24.6	Very low	21.9	Very low	80 Å²	80	155.7 Å²	155.7	66%	0.661	79%	0.785	S	S	*	*			trans	-78.3	145.5	161.6	0	0	0	0	0	109.7
85	A	23.9	Very low	21.9	Very low	98 Å²	98	157.9 Å²	157.9	81%	0.81	79%	0.789	S	S	*	*				66.1	122.5	63.9	0	0	0	0	0	114
86	L	20.8	Very low	22.2	Very low	175 Å²	175	159.1 Å²	159.1	92%	0.916	80%	0.795	S	S	*	*			trans	-157.8	100.3	176	-149.4	160.1	0	0	0	110.1
87	P	24.5	Very low	22.3	Very low	119 Å²	119	158.1 Å²	158.1	77%	0.773	80%	0.797	S	S	*	*			trans	-109.5	144.8	179.1	33.5	-22.1	0	0	0	114.2
88	K	21.4	Very low	22.5	Very low	213 Å²	213	156.9 Å²	156.9	93%	0.926	80%	0.803	S	S	*	*			trans	0.7	149.8	164.6	-68.8	-175.1	171.4	-173	0	122.7
89	H	23.5	Very low	22.5	Very low	177 Å²	177	159 Å²	159	82%	0.819	81%	0.806	S	S	*	*			trans	-99.2	176.7	176.5	-121.8	-99.9	0	0	0	112.3
90	I	22.9	Very low	22.6	Very low	145 Å²	145	158.7 Å²	158.7	74%	0.744	81%	0.81	S	S	*	*			trans	79.2	118.5	165.5	-59.1	143.1	0	0	0	115.9
91	D	24.2	Very low	22.5	Very low	154 Å²	154	160 Å²	160	82%	0.824	82%	0.817	S	S	*	*			trans	-146.5	169.9	136.5	-129.4	-38.3	0	0	0	110.2
92	L	23.1	Very low	22.6	Very low	147 Å²	147	155.6 Å²	155.6	77%	0.77	81%	0.809	S	S	*	*			trans	-92	163.6	-152.4	-79.6	151.7	0	0	0	118.2
93	L	22.9	Very low	22.5	Very low	149 Å²	149	156.7 Å²	156.7	78%	0.78	81%	0.808	S	S	*	*			trans	-65.9	146.4	170.8	-58.7	95.1	0	0	0	112.1
94	H	23.6	Very low	22.7	Very low	189 Å²	189	151.3 Å²	151.3	88%	0.875	80%	0.803	S	S	*	*			trans	-139.7	145	160.3	-100.8	36.4	0	0	0	111
95	F	20.5	Very low	22.4	Very low	194 Å²	194	152.6 Å²	152.6	85%	0.851	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-88.4	143.3	-176.1	-78.1	-102.5	0	0	0	112.4
96	P	27.1	Very low	22.4	Very low	120 Å²	120	158 Å²	158	78%	0.779	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-80.4	128.1	169.5	32.2	-32	0	0	0	111.4
97	Q	20.6	Very low	22.3	Very low	185 Å²	185	159 Å²	159	86%	0.864	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87.7	149.8	172	-84.8	-73.8	-24	0	0	111.6
98	V	23.4	Very low	22.3	Very low	132 Å²	132	156.7 Å²	156.7	80%	0.8	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.5	137.3	-176.9	177.7	0	0	0	0	110.7
99	N	21	Very low	22.2	Very low	144 Å²	144	154 Å²	154	77%	0.77	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85.6	129.9	-174.2	-162.7	12.2	0	0	0	111.8
100	M	22.9	Very low	22.2	Very low	177 Å²	177	152.4 Å²	152.4	87%	0.872	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-99.5	128.4	177.1	-74.4	-168.6	178.7	0	0	111.7
101	N	21.6	Very low	22	Very low	152 Å²	152	151.9 Å²	151.9	81%	0.813	80%	0.8	S	S	*	*			trans	-108.3	107.4	168.4	-77.4	-23.6	0	0	0	110.4
102	D	21.4	Very low	21.9	Very low	121 Å²	121	150.9 Å²	150.9	65%	0.647	79%	0.79	S	S	*	*				-174.5	149.5	126.4	-124.6	-21.6	0	0	0	113.2
103	K	19.4	Very low	21.7	Very low	169 Å²	169	151.2 Å²	151.2	74%	0.735	79%	0.788	S	S	*	*			trans	37.9	126	152	-62.2	147.3	-170.4	153.8	0	118.2
104	V	23	Very low	21.6	Very low	138 Å²	138	151.8 Å²	151.8	84%	0.836	79%	0.788	S	S	*	*				-160	150.2	55.4	165.2	0	0	0	0	110.5
105	S	19.3	Very low	21.4	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	79%	0.786	S	S	*	*			trans	-77.5	141.7	175.3	51.8	0	0	0	0	114.7
106	K	22.6	Very low	21.5	Very low	212 Å²	212	146.8 Å²	146.8	92%	0.922	79%	0.787	S	S	*	*			trans	-152.4	147.6	153.7	-117.3	172.2	-175.2	177.4	0	111.4
107	Q	20.5	Very low	21.2	Very low	194 Å²	194	148.1 Å²	148.1	91%	0.907	79%	0.787	S	S	*	*			trans	-107.4	155.2	-173.9	-66.1	169.9	-42.9	0	0	111.8
108	G	23.2	Very low	21.2	Very low	71 Å²	71	147.4 Å²	147.4	73%	0.732	78%	0.784	S	S	*	*			trans	154.1	89.3	178.3	0	0	0	0	0	108.7
109	I	20.3	Very low	21.1	Very low	157 Å²	157	146.2 Å²	146.2	81%	0.805	78%	0.782	S	S	*	*				68.1	76.3	63.3	-49.8	-179.4	0	0	0	112.9
110	N	22.8	Very low	21.4	Very low	143 Å²	143	148.9 Å²	148.9	77%	0.765	79%	0.786	S	S	*	*				75	143.6	119	-154.1	10.8	0	0	0	121.5
111	L	18.7	Very low	21.5	Very low	134 Å²	134	146.2 Å²	146.2	70%	0.702	78%	0.782	S	S	*	*			trans	105.1	148.4	145.2	-142.2	68.4	0	0	0	119.6
112	H	21.6	Very low	21.5	Very low	134 Å²	134	147 Å²	147	62%	0.62	78%	0.778	S	S	*	*			trans	85	104.2	168.2	-84.1	-89.7	0	0	0	122
113	Q	20.2	Very low	21.5	Very low	153 Å²	153	148 Å²	148	72%	0.715	78%	0.777	S	S	*	*			trans	70	153.4	137	-74.4	163.9	-33.4	0	0	118.9
114	M	20.2	Very low	21.5	Very low	162 Å²	162	145.6 Å²	145.6	80%	0.798	76%	0.764	S	S	*	*			cis	-142.4	155.8	8.3	-140.4	164.5	-162.9	0	0	111.8
115	V	20.3	Very low	21.4	Very low	136 Å²	136	145.4 Å²	145.4	82%	0.824	75%	0.748	S	S	*	*			trans	-127.7	132.6	175	173.3	0	0	0	0	109.5
116	T	22.1	Very low	21.4	Very low	141 Å²	141	147.7 Å²	147.7	87%	0.865	75%	0.747	S	S	*	*			trans	-142.7	142.4	165.2	45.5	0	0	0	0	110.1
117	D	20.8	Very low	21.3	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	74%	0.736	S	S	*	*			trans	-113	168.2	-170.4	-174.5	10.9	0	0	0	111.2
118	Q	20.6	Very low	21.4	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	73%	0.73	S	S	*	*			trans	153.8	115.6	138.2	-82.9	-177.7	26.7	0	0	117.5
119	S	21.1	Very low	21.1	Very low	108 Å²	108	146.7 Å²	146.7	76%	0.755	74%	0.739	S	S	*	*				82.2	163.2	129.8	82.3	0	0	0	0	124.4
120	K	27.7	Very low	21.3	Very low	199 Å²	199	149 Å²	149	87%	0.865	75%	0.747	S	S	*	*			trans	-146.4	157.7	-175.7	-56.6	174.1	178.4	174.2	0	109.2
121	P	25.2	Very low	21	Very low	122 Å²	122	151.5 Å²	151.5	79%	0.792	75%	0.751	S	S	*	*				-170	167	87.9	43.5	-20.7	0	0	0	122.5
122	K	21	Very low	21.1	Very low	167 Å²	167	155.5 Å²	155.5	73%	0.726	76%	0.763	S	S	*	*			trans	22.2	151.5	144.7	-56.8	-179.2	177.1	-174.1	0	127
123	F	20.8	Very low	20.9	Very low	143 Å²	143	153.9 Å²	153.9	63%	0.627	77%	0.766	S	S	*	*				176.8	157.6	128.9	-118.6	-114.1	0	0	0	116.2	N68	N68-F123 VanDerWaalsContact CG-O 3.23Å; N68-F123 PolarHBondContact N-O 2.98Å; N68-F123 PolarHBondContact OD1-O 2.84Å
124	R	19.6	Very low	20.9	Very low	118 Å²	118	154.7 Å²	154.7	45%	0.445	77%	0.768	S	S	.	*			cis	-176.9	14.6	12.5	-84.8	-167.7	128.9	-81.6	14.2	121.3	N67 N68 E69	N67-R124 WeakPolarHBondContact OD1-CA 3.02Å; N67-R124 PolarHBondContact OD1-N 2.94Å; N68-R124 HydrophobicContact CB-CB 4.21Å; N68-R124 HydrophobicContact CB-CG 3.7Å; E69-R124 WeakPolarHBondContact OE2-CD 3.39Å; E69-R124 WeakPolarHBondContact OE2-CG 3.02Å; E69-R124 IonicContact OE2-NE 3.6Å; E69-R124 PolarHBondContact OE2-NE 3.26Å
125	R	20.5	Very low	20.9	Very low	134 Å²	134	154.1 Å²	154.1	51%	0.506	76%	0.761	S	S	.	*			trans	64.8	130	179.6	-82.1	-172.1	168.2	-168.2	1.2	122.7	N67 N68 E69	N67-R125 VanDerWaalsContact CG-N 3.33Å; N67-R125 PolarHBondContact ND2-O 2.92Å; N67-R125 WeakPolarHBondContact OD1-CA 3.46Å; N67-R125 PolarHBondContact OD1-N 3.39Å; N68-R125 WeakPolarHBondContact O-CA 3.5Å; N68-R125 WeakPolarHBondContact O-CG 3.47Å; E69-R125 HydrophobicContact CB-CG 4.18Å
126	E	20.4	Very low	20.8	Very low	156 Å²	156	157.4 Å²	157.4	73%	0.729	76%	0.759	S	S	*	*			trans	176.5	179.7	140.4	-106.4	-63.5	-161.9	0	0	116.7	N67	N67-E126 PolarHBondContact ND2-N 3.1Å
127	S	20.5	Very low	20.7	Very low	98 Å²	98	161.1 Å²	161.1	69%	0.685	76%	0.757	S	S	*	*			trans	-161.5	165.3	-164.8	65.4	0	0	0	0	118.7
128	S	22.1	Very low	20.7	Very low	114 Å²	114	158.8 Å²	158.8	80%	0.797	75%	0.752	S	S	*	*			trans	-168.6	127.8	164.1	-84.1	0	0	0	0	112.7
129	R	17.3	Very low	20.9	Very low	243 Å²	243	158.6 Å²	158.6	92%	0.917	76%	0.756	S	S	*	*				69.2	105.3	64.7	-80.2	-169.4	177.2	-176.9	3.6	117
130	Q	23.7	Very low	21.2	Very low	205 Å²	205	158.8 Å²	158.8	96%	0.958	76%	0.755	S	S	*	*			trans	-151	145.6	134.2	-110	179.9	29.7	0	0	111.3
131	K	16.9	Very low	21	Very low	196 Å²	196	158.1 Å²	158.1	85%	0.852	76%	0.755	S	S	*	*			trans	-115.5	144.7	172.8	-65.2	173.7	177.4	175.7	0	108
132	F	21	Very low	21	Very low	219 Å²	219	160.3 Å²	160.3	96%	0.961	76%	0.758	S	S	*	*			trans	-158.8	151.8	135.5	-106.9	-68.4	0	0	0	111.1
133	S	18	Very low	21	Very low	99 Å²	99	163.3 Å²	163.3	69%	0.692	77%	0.765	S	S	*	*			trans	-142.6	133.7	-178	63.2	0	0	0	0	112.1
134	F	20.3	Very low	21.1	Very low	171 Å²	171	161 Å²	161	75%	0.75	77%	0.767	S	S	*	*			trans	-144.7	124.3	151.3	-105.2	-104.6	0	0	0	105.1
135	K	19.6	Very low	21.1	Very low	150 Å²	150	166 Å²	166	65%	0.652	79%	0.786	S	S	*	*				52.4	137.9	84.5	-62.8	-176.5	-154.8	152.5	0	112.6
136	R	17.4	Very low	21.4	Very low	205 Å²	205	169.7 Å²	169.7	77%	0.774	81%	0.806	S	S	*	*			cis	-174.7	165	-6.8	-117.3	-179.6	-177.8	-178.8	0.1	106.7
137	R	19.5	Very low	21.4	Very low	219 Å²	219	167.6 Å²	167.6	83%	0.826	81%	0.809	S	S	*	*			trans	66.7	165.2	159.1	-73.2	170.4	175.6	170.9	-5.3	117
138	S	21.7	Very low	21.5	Very low	98 Å²	98	171.8 Å²	171.8	69%	0.685	81%	0.814	S	S	*	*			cis	-173.5	136	-47.9	50.5	0	0	0	0	111.4
139	N	23.7	Very low	21.7	Very low	166 Å²	166	170.7 Å²	170.7	89%	0.888	81%	0.812	S	S	*	*			trans	68.4	153.4	167.4	-89.7	5.3	0	0	0	119.7
140	P	28.2	Very low	22	Very low	113 Å²	113	167.9 Å²	167.9	73%	0.734	81%	0.807	S	S	*	*			trans	-113.8	157	-170.1	40.9	-30.5	0	0	0	114.4
141	Q	23.3	Very low	22	Very low	185 Å²	185	165.5 Å²	165.5	86%	0.864	80%	0.801	S	S	*	*			trans	-149.6	164.9	155.6	-85	-148.2	2.8	0	0	112.1
142	I	25.4	Very low	22.5	Very low	167 Å²	167	166.1 Å²	166.1	86%	0.856	80%	0.799	S	S	*	*			trans	76.9	131.4	171.9	-61.5	164.3	0	0	0	116.4
143	R	20.4	Very low	22.9	Very low	230 Å²	230	159.3 Å²	159.3	87%	0.868	78%	0.783	S	S	*	*			trans	-96.7	135	-167.1	-103.6	174.4	169.4	161.8	-5.8	111.8
144	S	23.5	Very low	23.8	Very low	95 Å²	95	162.2 Å²	162.2	66%	0.664	79%	0.791	S	S	*	*				47.2	147	130	75.2	0	0	0	0	122.9
145	R	20.2	Very low	25.2	Very low	223 Å²	223	160.7 Å²	160.7	84%	0.842	79%	0.785	S	S	*	*			trans	82.9	83.6	162.9	-57.8	-177.8	174.7	-173.4	-2.3	116.7
146	F	25.7	Very low	27.2	Very low	212 Å²	212	158.5 Å²	158.5	93%	0.93	78%	0.784	S	S	*	*	S	Bend		-127.3	175.2	109.6	-94.1	-77.8	0	0	0	109.4
147	S	22.1	Very low	30.2	Very low	112 Å²	112	150.8 Å²	150.8	78%	0.783	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-72.9	151	-160.4	35.5	0	0	0	0	115	A149	S147-A149 PolarHBondContact O-N 3.4Å
148	K	21.5	Very low	33.2	Very low	186 Å²	186	141 Å²	141	81%	0.809	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-65.2	117.3	163.6	-67.5	177.2	175	-177.8	0	109.1
149	A	26.4	Very low	36.1	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-66.9	138	150.5	0	0	0	0	0	108.2	S147	S147-A149 PolarHBondContact O-N 3.4Å
150	F	22.9	Very low	38.9	Very low	183 Å²	183	141 Å²	141	80%	0.803	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-84.3	131.6	173.5	-98.5	-104.4	0	0	0	109.5	Y152	F150-Y152 PolarHBondContact O-N 3.26Å
151	N	25	Very low	41.8	Very low	156 Å²	156	136.4 Å²	136.4	83%	0.834	69%	0.685	S	S	*	*			trans	-71.2	109	176	-72.3	-10.4	0	0	0	110
152	Y	26.7	Very low	44.8	Very low	208 Å²	208	131.2 Å²	131.2	82%	0.816	67%	0.666	S	S	*	*			trans	-79.8	118.9	153.7	-84.8	-95.9	0	0	0	108	F150	F150-Y152 PolarHBondContact O-N 3.26Å
153	A	30.1	Very low	47.7	Very low	76 Å²	76	125.5 Å²	125.5	63%	0.628	64%	0.641	S	S	*	*			trans	-145.7	144.2	174.3	0	0	0	0	0	109.3
154	N	35.9	Very low	50.6	Low	160 Å²	160	119.8 Å²	119.8	86%	0.856	62%	0.624	S	S	*	*			trans	62.5	61.3	177.8	-59.6	3.7	0	0	0	116.1
155	F	49.7	Very low	53.3	Low	140 Å²	140	122.8 Å²	122.8	61%	0.614	63%	0.631	S	S	*	*			trans	-117.8	132.9	145.8	-81.2	-83	0	0	0	108.9	Y185	F155-Y185 HydrophobicContact CB-CE1 4.2Å; F155-Y185 HydrophobicContact CD1-CE1 4.14Å; F155-Y185 HydrophobicContact CD2-CE1 4.24Å; F155-Y185 AromaticContact CG-CE1 3.92Å; F155-Y185 HydrophobicContact CG-CE1 3.92Å
156	T	62.1	Low	56.4	Low	103 Å²	103	115.4 Å²	115.4	63%	0.632	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-90.3	120.5	-174.7	46.7	0	0	0	0	110.9
157	C	80.3	Confident	59.6	Low	44 Å²	44	107.8 Å²	107.8	30%	0.297	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-70.3	141.8	160.6	-164.4	0	0	0	0	108.8	C161 C163	C157-C161 PolarHBondContact SG-O 2.95Å; C157-C161 VanDerWaalsContact SG-O 3.34Å; C157-C163 HydrophobicContact CB-CB 3.82Å; C157-C163 WeakPolarHBondContact CB-SG 3.37Å; C157-C163 WeakPolarHBondContact SG-CB 3.25Å; C157-C163 PolarHBondContact SG-N 2.97Å; C157-C163 CovalentContact SG-SG 2.03Å; C157-C163 PolarHBondContact SG-SG 2.77Å
158	P	82.2	Confident	62.9	Low	14 Å²	14	102.6 Å²	102.6	9%	0.091	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-60.3	140.2	167.8	-19.9	32	0	0	0	110.4	E160 C161 P179 I182	P158-E160 PolarHBondContact O-N 2.98Å; P158-E160 VanDerWaalsContact O-N 3.17Å; P158-C161 HydrophobicContact CB-CB 4.4Å; P158-C161 PolarHBondContact O-N 2.69Å; P158-P179 HydrophobicContact CB-CB 4.2Å; P158-P179 HydrophobicContact CG-CB 4.4Å; P158-I182 HydrophobicContact CG-CG1 4.17Å
159	N	82.9	Confident	66.3	Low	165 Å²	165	96.8 Å²	96.8	88%	0.882	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.8	-174.9	-67.8	-26.1	0	0	0	113.3	C161	N159-C161 VanDerWaalsContact C-N 3.27Å
160	E	82.1	Confident	69.4	Low	98 Å²	98	92.5 Å²	92.5	46%	0.458	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.6	175.7	-55.5	110	-115	0	0	114	P158 A173 L175	P158-E160 PolarHBondContact O-N 2.98Å; P158-E160 VanDerWaalsContact O-N 3.17Å; E160-A173 HydrophobicContact CB-CB 4.13Å; E160-L175 HydrophobicContact CB-CD2 3.95Å; E160-L175 HydrophobicContact CG-CD2 3.87Å; E160-L175 WeakPolarHBondContact OE2-CD2 3.22Å
161	C	89.3	Confident	72.5	Confident	16 Å²	16	86.2 Å²	86.2	11%	0.108	45%	0.454	C	S	.	.	S	Bend	trans	-127.6	154.4	-170.4	-50.4	0	0	0	0	113	C157 P158 N159 I168 E169 C170	C157-C161 PolarHBondContact SG-O 2.95Å; C157-C161 VanDerWaalsContact SG-O 3.34Å; P158-C161 HydrophobicContact CB-CB 4.4Å; P158-C161 PolarHBondContact O-N 2.69Å; N159-C161 VanDerWaalsContact C-N 3.27Å; C161-I168 HydrophobicContact CB-CG2 3.98Å; C161-E169 CarbonylContact C-O 3.36Å; C161-E169 WeakPolarHBondContact CA-O 3.48Å; C161-E169 WeakPolarHBondContact CB-O 3.49Å; C161-C170 HydrophobicContact CB-CB 4.04Å; C161-C170 WeakPolarHBondContact CB-SG 3.37Å; C161-C170 WeakPolarHBondContact SG-CB 3.29Å; C161-C170 CovalentContact SG-SG 2.04Å; C161-C170 PolarHBondContact SG-SG 2.8Å
162	T	87.4	Confident	75.5	Confident	76 Å²	76	84 Å²	84	47%	0.466	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.2	166.3	46.6	0	0	0	0	110.4	I168 E169	T162-I168 WeakPolarHBondContact O-CA 3.31Å; T162-E169 PolarHBondContact N-O 3.03Å; T162-E169 PolarHBondContact O-N 3.15Å; T162-E169 PolarHBondContact OG1-O 2.91Å
163	C	85.4	Confident	78.3	Confident	48 Å²	48	76 Å²	76	32%	0.324	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116	-178.3	-65	0	0	0	0	111.8	C157 I168	C157-C163 HydrophobicContact CB-CB 3.82Å; C157-C163 WeakPolarHBondContact CB-SG 3.37Å; C157-C163 WeakPolarHBondContact SG-CB 3.25Å; C157-C163 PolarHBondContact SG-N 2.97Å; C157-C163 CovalentContact SG-SG 2.03Å; C157-C163 PolarHBondContact SG-SG 2.77Å; C163-I168 HydrophobicContact CB-CG1 4.2Å
164	H	81.3	Confident	81	Confident	110 Å²	110	78 Å²	78	51%	0.509	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	89.3	179.4	-63	-68.8	0	0	0	110.5	N166 E167	H164-N166 PolarHBondContact O-N 2.78Å; H164-E167 WeakPolarHBondContact CA-O 3.44Å; H164-E167 HydrophobicContact CB-CB 4.46Å; H164-E167 PolarHBondContact N-O 2.9Å; H164-E167 WeakPolarHBondContact O-CB 3.27Å; H164-E167 PolarHBondContact O-N 2.67Å
165	L	80.1	Confident	83.5	Confident	158 Å²	158	71.1 Å²	71.1	83%	0.827	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	-98.7	-174	-62	166.6	0	0	0	112.1	Y185	L165-Y185 WeakPolarHBondContact O-CE2 3.32Å
166	N	86.1	Confident	85.3	Confident	67 Å²	67	72 Å²	72	36%	0.358	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	12	-178.9	-56.5	11.9	0	0	0	112.1	H164 E187 K188	H164-N166 PolarHBondContact O-N 2.78Å; N166-E187 HydrophobicContact CB-CB 4.15Å; N166-E187 HydrophobicContact CB-CG 4Å; N166-E187 PolarHBondContact O-N 3.35Å; N166-K188 PolarHBondContact O-N 3.45Å; N166-K188 VanDerWaalsContact O-N 3.13Å
167	E	91.8	Very high	86.4	Confident	53 Å²	53	70.5 Å²	70.5	25%	0.248	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.9	-176.7	178.1	154.2	-143.1	0	0	108.5	H164 K188 F190	H164-E167 WeakPolarHBondContact CA-O 3.44Å; H164-E167 HydrophobicContact CB-CB 4.46Å; H164-E167 PolarHBondContact N-O 2.9Å; H164-E167 WeakPolarHBondContact O-CB 3.27Å; H164-E167 PolarHBondContact O-N 2.67Å; E167-K188 WeakPolarHBondContact CA-O 3.49Å; E167-K188 HydrophobicContact CB-CB 4.33Å; E167-K188 HydrophobicContact CB-CD 4.12Å; E167-K188 HydrophobicContact CG-CB 4.18Å; E167-K188 HydrophobicContact CG-CD 3.82Å; E167-K188 WeakPolarHBondContact OE1-CD 3.28Å; E167-K188 WeakPolarHBondContact OE1-CE 3.46Å; E167-K188 IonicContact OE1-NZ 2.81Å; E167-K188 PolarHBondContact OE1-NZ 3.47Å; E167-K188 IonicContact OE2-NZ 2.67Å; E167-K188 PolarHBondContact OE2-NZ 2.04Å; E167-F190 HydrophobicContact CG-CE2 3.96Å; E167-F190 WeakPolarHBondContact OE1-CE2 3.4Å
168	I	91.3	Very high	86.8	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.9	-173.2	-59.5	-173.9	0	0	0	109.9	C161 T162 C163 I182 P183 T186 K188 L189 F190	C161-I168 HydrophobicContact CB-CG2 3.98Å; T162-I168 WeakPolarHBondContact O-CA 3.31Å; C163-I168 HydrophobicContact CB-CG1 4.2Å; I168-I182 HydrophobicContact CD1-CG2 4.11Å; I168-P183 HydrophobicContact CD1-CG 4.12Å; I168-T186 HydrophobicContact CB-CG2 4.27Å; I168-T186 HydrophobicContact CD1-CG2 4.05Å; I168-T186 WeakPolarHBondContact CD1-OG1 3.46Å; I168-T186 HydrophobicContact CG1-CG2 4Å; I168-K188 PolarHBondContact N-O 3.18Å; I168-L189 HydrophobicContact CB-CD1 4.12Å; I168-L189 HydrophobicContact CG2-CD1 4.06Å; I168-L189 WeakPolarHBondContact O-CA 3.04Å; I168-F190 PolarHBondContact O-N 2.86Å
169	E	93.3	Very high	86.8	Confident	65 Å²	65	68.5 Å²	68.5	30%	0.304	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.2	-176.5	-66.2	-177.3	-135.1	0	0	110.5	C161 T162 N171 F190	C161-E169 CarbonylContact C-O 3.36Å; C161-E169 WeakPolarHBondContact CA-O 3.48Å; C161-E169 WeakPolarHBondContact CB-O 3.49Å; T162-E169 PolarHBondContact N-O 3.03Å; T162-E169 PolarHBondContact O-N 3.15Å; T162-E169 PolarHBondContact OG1-O 2.91Å; E169-N171 PolarHBondContact OE2-ND2 3.13Å; E169-F190 HydrophobicContact CG-CB 4.13Å; E169-F190 HydrophobicContact CG-CD2 3.9Å; E169-F190 HydrophobicContact CG-CG 4.29Å
170	C	90.8	Very high	86.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.358	C	S	.	.			trans	-120	59.3	-179.2	-53.2	0	0	0	0	108.6	C161 L175 F190 I191 N194	C161-C170 HydrophobicContact CB-CB 4.04Å; C161-C170 WeakPolarHBondContact CB-SG 3.37Å; C161-C170 WeakPolarHBondContact SG-CB 3.29Å; C161-C170 CovalentContact SG-SG 2.04Å; C161-C170 PolarHBondContact SG-SG 2.8Å; C170-L175 HydrophobicContact CB-CD1 3.92Å; C170-F190 PolarHBondContact N-O 2.98Å; C170-I191 HydrophobicContact CB-CG1 4.2Å; C170-N194 PolarHBondContact O-ND2 3.25Å
171	N	88.7	Confident	86.4	Confident	51 Å²	51	68.9 Å²	68.9	27%	0.273	37%	0.369	S	S	.	.			trans	-98.6	137.2	-165	-61.8	-30	0	0	0	112.1	E169 A173 I192	E169-N171 PolarHBondContact OE2-ND2 3.13Å; N171-A173 PolarHBondContact O-N 3.31Å; N171-I192 CarbonylContact C-O 3.58Å; N171-I192 VanDerWaalsContact CA-O 3.23Å; N171-I192 WeakPolarHBondContact CA-O 3.4Å; N171-I192 HydrophobicContact CB-CB 4.48Å; N171-I192 WeakPolarHBondContact OD1-CB 3.43Å; N171-I192 PolarHBondContact OD1-N 2.98Å
172	N	88	Confident	86.2	Confident	109 Å²	109	69.1 Å²	69.1	58%	0.583	37%	0.369	S	S	*	.	S	Bend	trans	58.2	8.1	178.2	-59.2	-43.9	0	0	0	116.9	Q174 I192 G193	N172-Q174 PolarHBondContact O-N 3.28Å; N172-Q174 PolarHBondContact O-NE2 3.35Å; N172-I192 PolarHBondContact N-O 2.72Å; N172-G193 WeakPolarHBondContact CA-O 3.22Å
173	A	86.1	Confident	86.1	Confident	41 Å²	41	65.9 Å²	65.9	34%	0.339	35%	0.35	S	S	.	.	S	Bend	trans	-73.2	15.6	-177.8	0	0	0	0	0	114.9	E160 N171 L175 N194	E160-A173 HydrophobicContact CB-CB 4.13Å; N171-A173 PolarHBondContact O-N 3.31Å; A173-L175 HydrophobicContact CB-CD1 4.29Å; A173-L175 HydrophobicContact CB-CD2 4.09Å; A173-L175 HydrophobicContact CB-CG 3.91Å; A173-L175 PolarHBondContact O-N 2.74Å; A173-L175 VanDerWaalsContact O-N 3.1Å; A173-N194 WeakPolarHBondContact CA-OD1 3.47Å; A173-N194 PolarHBondContact N-OD1 3.18Å
174	Q	86.8	Confident	86	Confident	117 Å²	117	66.4 Å²	66.4	55%	0.547	35%	0.354	S	S	.	.			trans	60.1	14.9	177.8	-58.4	-54.7	-60.9	0	0	115.8	N172 E176 N194 N195	N172-Q174 PolarHBondContact O-N 3.28Å; N172-Q174 PolarHBondContact O-NE2 3.35Å; Q174-E176 PolarHBondContact O-N 2.83Å; Q174-N194 PolarHBondContact N-OD1 3.12Å; Q174-N194 VanDerWaalsContact N-OD1 3.09Å; Q174-N195 WeakPolarHBondContact CA-ND2 3.43Å; Q174-N195 PolarHBondContact O-ND2 2.85Å; Q174-N195 PolarHBondContact OE1-ND2 2.85Å
175	L	87.3	Confident	86.2	Confident	16 Å²	16	64.8 Å²	64.8	8%	0.084	34%	0.344	C	S	.	.			trans	-55.3	127.1	-172.1	-53.6	169.9	0	0	0	113.1	E160 C170 A173 P179 I191 N194 N195 I196	E160-L175 HydrophobicContact CB-CD2 3.95Å; E160-L175 HydrophobicContact CG-CD2 3.87Å; E160-L175 WeakPolarHBondContact OE2-CD2 3.22Å; C170-L175 HydrophobicContact CB-CD1 3.92Å; A173-L175 HydrophobicContact CB-CD1 4.29Å; A173-L175 HydrophobicContact CB-CD2 4.09Å; A173-L175 HydrophobicContact CB-CG 3.91Å; A173-L175 PolarHBondContact O-N 2.74Å; A173-L175 VanDerWaalsContact O-N 3.1Å; L175-P179 HydrophobicContact CD1-CG 3.65Å; L175-P179 HydrophobicContact CD2-CG 4.2Å; L175-I191 HydrophobicContact CD1-CG2 4.3Å; L175-N194 HydrophobicContact CB-CB 3.84Å; L175-N194 HydrophobicContact CG-CB 4.43Å; L175-N194 WeakPolarHBondContact CG-OD1 3.39Å; L175-N194 PolarHBondContact N-OD1 3.12Å; L175-N194 WeakPolarHBondContact O-CB 3.47Å; L175-N195 CarbonylContact O-C 3.26Å; L175-N195 WeakPolarHBondContact O-CA 3.35Å; L175-N195 PolarHBondContact O-N 3.31Å; L175-I196 WeakPolarHBondContact O-CG1 3.09Å; L175-I196 PolarHBondContact O-N 3.46Å; L175-I196 VanDerWaalsContact O-N 3.12Å
176	E	87	Confident	86.7	Confident	160 Å²	160	57.2 Å²	57.2	75%	0.748	30%	0.304	S	S	*	.	S	Bend	trans	-87.2	-15.6	175.3	-58.8	-168.2	148.8	0	0	112.8	Q174 N195 I196	Q174-E176 PolarHBondContact O-N 2.83Å; E176-N195 HydrophobicContact CG-CB 4.3Å; E176-I196 WeakPolarHBondContact O-CA 3.37Å
177	S	87.1	Confident	87	Confident	71 Å²	71	57.3 Å²	57.3	50%	0.497	30%	0.303	S	S	.	.	S	Bend	trans	-146.1	166.6	175.1	63.9	0	0	0	0	110.7
178	I	87.3	Confident	87.2	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.021	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-66	131.5	174.4	-64.2	-173.6	0	0	0	109.5	I182 I191 I196 L199 N203 L204 L215	I178-I182 HydrophobicContact CG2-CD1 3.71Å; I178-I191 HydrophobicContact CB-CD1 4.32Å; I178-I191 HydrophobicContact CD1-CD1 4.18Å; I178-I191 HydrophobicContact CG1-CD1 3.92Å; I178-I191 HydrophobicContact CG2-CD1 3.84Å; I178-I196 HydrophobicContact CG1-CD1 3.95Å; I178-L199 HydrophobicContact CD1-CD1 3.48Å; I178-L199 VanDerWaalsContact CD1-CD1 3.48Å; I178-L199 HydrophobicContact CG1-CD1 4.35Å; I178-N203 HydrophobicContact CB-CB 4.24Å; I178-N203 HydrophobicContact CD1-CB 4.23Å; I178-L204 HydrophobicContact CD1-CD1 4.35Å; I178-L204 HydrophobicContact CD1-CD2 3.78Å; I178-L204 HydrophobicContact CD1-CG 4Å; I178-L215 HydrophobicContact CD1-CD2 3.91Å; I178-L215 HydrophobicContact CG1-CD2 4.35Å
179	P	83.4	Confident	87.4	Confident	12 Å²	12	58.3 Å²	58.3	8%	0.078	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-59.9	146.2	-178.1	-26.7	35.8	0	0	0	113.9	P158 L175 I182	P158-P179 HydrophobicContact CB-CB 4.2Å; P158-P179 HydrophobicContact CG-CB 4.4Å; L175-P179 HydrophobicContact CD1-CG 3.65Å; L175-P179 HydrophobicContact CD2-CG 4.2Å; P179-I182 WeakPolarHBondContact O-CD1 3.45Å; P179-I182 WeakPolarHBondContact O-CG1 3.49Å
180	L	79.5	Confident	87.5	Confident	142 Å²	142	57.2 Å²	57.2	74%	0.743	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	157.6	172.8	-64	175.4	0	0	0	111.4	I182	L180-I182 PolarHBondContact O-N 3.34Å
181	N	76.9	Confident	87.6	Confident	129 Å²	129	57.2 Å²	57.2	69%	0.69	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	27.5	178.4	-45.3	-69.9	0	0	0	115.5	P183	N181-P183 WeakPolarHBondContact O-CD 3.23Å
182	I	85.4	Confident	87.8	Confident	20 Å²	20	57.5 Å²	57.5	10%	0.103	30%	0.301	C	S	.	.			trans	-61.6	124	166.3	-61.2	172.1	0	0	0	108.6	P158 I168 I178 P179 L180 S184 L189 L207	P158-I182 HydrophobicContact CG-CG1 4.17Å; I168-I182 HydrophobicContact CD1-CG2 4.11Å; I178-I182 HydrophobicContact CG2-CD1 3.71Å; P179-I182 WeakPolarHBondContact O-CD1 3.45Å; P179-I182 WeakPolarHBondContact O-CG1 3.49Å; L180-I182 PolarHBondContact O-N 3.34Å; I182-S184 PolarHBondContact O-N 3.01Å; I182-L189 HydrophobicContact CD1-CD1 4.12Å; I182-L189 HydrophobicContact CD1-CD2 3.84Å; I182-L189 HydrophobicContact CG2-CD1 4.39Å; I182-L189 HydrophobicContact CG2-CD2 4.43Å; I182-L207 HydrophobicContact CB-CD2 4.16Å; I182-L207 HydrophobicContact CG2-CD1 4.15Å; I182-L207 HydrophobicContact CG2-CD2 3.78Å
183	P	85.2	Confident	88	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.058	28%	0.278	C	S	.	.			trans	-56.9	130.6	-178.6	-27.3	33.5	0	0	0	114	I168 N181 Y185 T186	I168-P183 HydrophobicContact CD1-CG 4.12Å; N181-P183 WeakPolarHBondContact O-CD 3.23Å; P183-Y185 HydrophobicContact CB-CD1 3.98Å; P183-Y185 HydrophobicContact CB-CE1 3.52Å; P183-Y185 HydrophobicContact CB-CE2 4.08Å; P183-Y185 HydrophobicContact CB-CG 4.45Å; P183-Y185 HydrophobicContact CG-CE1 4.46Å; P183-Y185 PolarHBondContact O-N 3.17Å; P183-Y185 VanDerWaalsContact O-N 3.14Å; P183-T186 VanDerWaalsContact O-CB 3.27Å; P183-T186 WeakPolarHBondContact O-CB 3.43Å; P183-T186 PolarHBondContact O-N 2.75Å; P183-T186 VanDerWaalsContact O-N 3.08Å; P183-T186 PolarHBondContact O-OG1 2.8Å
184	S	83.3	Confident	88.3	Confident	59 Å²	59	51 Å²	51	41%	0.413	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.8	-175.2	55	0	0	0	0	115.1	I182 T186 D206 H209	I182-S184 PolarHBondContact O-N 3.01Å; S184-T186 PolarHBondContact O-N 2.76Å; S184-D206 VanDerWaalsContact CB-O 3.32Å; S184-D206 WeakPolarHBondContact CB-O 3.33Å; S184-H209 PolarHBondContact O-CD2 3.09Å
185	Y	84.8	Confident	88.6	Confident	75 Å²	75	46.9 Å²	46.9	29%	0.294	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	2.4	174.8	61.6	-103.8	0	0	0	114.3	F155 L165 P183 E187	F155-Y185 HydrophobicContact CB-CE1 4.2Å; F155-Y185 HydrophobicContact CD1-CE1 4.14Å; F155-Y185 HydrophobicContact CD2-CE1 4.24Å; F155-Y185 AromaticContact CG-CE1 3.92Å; F155-Y185 HydrophobicContact CG-CE1 3.92Å; L165-Y185 WeakPolarHBondContact O-CE2 3.32Å; P183-Y185 HydrophobicContact CB-CD1 3.98Å; P183-Y185 HydrophobicContact CB-CE1 3.52Å; P183-Y185 HydrophobicContact CB-CE2 4.08Å; P183-Y185 HydrophobicContact CB-CG 4.45Å; P183-Y185 HydrophobicContact CG-CE1 4.46Å; P183-Y185 PolarHBondContact O-N 3.17Å; P183-Y185 VanDerWaalsContact O-N 3.14Å; Y185-E187 PolarHBondContact O-N 3.31Å
186	T	89.9	Confident	88.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.			trans	-62.8	124.1	179.9	-59.9	0	0	0	0	111.3	I168 P183 S184 K188 L189 H209 L210	I168-T186 HydrophobicContact CB-CG2 4.27Å; I168-T186 HydrophobicContact CD1-CG2 4.05Å; I168-T186 WeakPolarHBondContact CD1-OG1 3.46Å; I168-T186 HydrophobicContact CG1-CG2 4Å; P183-T186 VanDerWaalsContact O-CB 3.27Å; P183-T186 WeakPolarHBondContact O-CB 3.43Å; P183-T186 PolarHBondContact O-N 2.75Å; P183-T186 VanDerWaalsContact O-N 3.08Å; P183-T186 PolarHBondContact O-OG1 2.8Å; S184-T186 PolarHBondContact O-N 2.76Å; T186-K188 WeakPolarHBondContact CG2-O 3.45Å; T186-L189 HydrophobicContact CG2-CB 4.25Å; T186-H209 CarbonylContact O-C 3.08Å; T186-L210 HydrophobicContact CG2-CD1 3.98Å; T186-L210 WeakPolarHBondContact O-CA 3.48Å; T186-L210 PolarHBondContact O-N 3.1Å
187	E	93.4	Very high	88.9	Confident	69 Å²	69	44.5 Å²	44.5	32%	0.322	23%	0.231	S	C	.	.	S	Bend	trans	-95.6	-23.2	175.9	-65.1	-161	172.6	0	0	112.9	N166 Y185 K211 T212	N166-E187 HydrophobicContact CB-CB 4.15Å; N166-E187 HydrophobicContact CB-CG 4Å; N166-E187 PolarHBondContact O-N 3.35Å; Y185-E187 PolarHBondContact O-N 3.31Å; E187-K211 HydrophobicContact CB-CD 4.38Å; E187-K211 VanDerWaalsContact CD-CE 3.43Å; E187-K211 HydrophobicContact CG-CD 4.41Å; E187-K211 WeakPolarHBondContact O-CA 3.02Å; E187-K211 PolarHBondContact O-N 3.14Å; E187-K211 WeakPolarHBondContact OE1-CE 3.33Å; E187-K211 IonicContact OE1-NZ 3.66Å; E187-K211 PolarHBondContact OE1-NZ 3.26Å; E187-K211 WeakPolarHBondContact OE2-CD 3.03Å; E187-K211 WeakPolarHBondContact OE2-CE 3.45Å; E187-K211 IonicContact OE2-NZ 2.86Å; E187-K211 PolarHBondContact OE2-NZ 3.03Å; E187-T212 PolarHBondContact O-N 2.87Å
188	K	95.6	Very high	88.8	Confident	76 Å²	76	44.5 Å²	44.5	33%	0.33	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.9	176.3	-53.6	169.9	177.3	175.5	0	110.5	N166 E167 I168 T186 F190 T212	N166-K188 PolarHBondContact O-N 3.45Å; N166-K188 VanDerWaalsContact O-N 3.13Å; E167-K188 WeakPolarHBondContact CA-O 3.49Å; E167-K188 HydrophobicContact CB-CB 4.33Å; E167-K188 HydrophobicContact CB-CD 4.12Å; E167-K188 HydrophobicContact CG-CB 4.18Å; E167-K188 HydrophobicContact CG-CD 3.82Å; E167-K188 WeakPolarHBondContact OE1-CD 3.28Å; E167-K188 WeakPolarHBondContact OE1-CE 3.46Å; E167-K188 IonicContact OE1-NZ 2.81Å; E167-K188 PolarHBondContact OE1-NZ 3.47Å; E167-K188 IonicContact OE2-NZ 2.67Å; E167-K188 PolarHBondContact OE2-NZ 2.04Å; I168-K188 PolarHBondContact N-O 3.18Å; T186-K188 WeakPolarHBondContact CG2-O 3.45Å; K188-F190 HydrophobicContact CB-CE2 3.81Å; K188-F190 HydrophobicContact CB-CZ 4.48Å; K188-F190 HydrophobicContact CD-CE2 4.23Å; K188-F190 HydrophobicContact CD-CZ 4.49Å; K188-T212 WeakPolarHBondContact CA-O 3.02Å
189	L	94.9	Very high	88.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	123.9	177.5	178.2	58.9	0	0	0	109.7	I168 I182 T186 I191 L204 L207 L210 T212 L213 V214	I168-L189 HydrophobicContact CB-CD1 4.12Å; I168-L189 HydrophobicContact CG2-CD1 4.06Å; I168-L189 WeakPolarHBondContact O-CA 3.04Å; I182-L189 HydrophobicContact CD1-CD1 4.12Å; I182-L189 HydrophobicContact CD1-CD2 3.84Å; I182-L189 HydrophobicContact CG2-CD1 4.39Å; I182-L189 HydrophobicContact CG2-CD2 4.43Å; T186-L189 HydrophobicContact CG2-CB 4.25Å; L189-I191 HydrophobicContact CD1-CD1 4.24Å; L189-I191 HydrophobicContact CD1-CG1 4.04Å; L189-I191 HydrophobicContact CD2-CD1 4.06Å; L189-I191 HydrophobicContact CG-CD1 4.07Å; L189-I191 HydrophobicContact CG-CG1 4.03Å; L189-L204 HydrophobicContact CD2-CD2 4.41Å; L189-L207 HydrophobicContact CD2-CD1 3.64Å; L189-L210 HydrophobicContact CB-CD1 3.7Å; L189-L210 HydrophobicContact CB-CD2 4.38Å; L189-T212 PolarHBondContact N-O 2.98Å; L189-L213 HydrophobicContact CB-CD1 4.14Å; L189-L213 HydrophobicContact CD2-CD1 4.01Å; L189-L213 HydrophobicContact CG-CD1 4.11Å; L189-V214 PolarHBondContact O-N 2.87Å
190	F	95.3	Very high	88.8	Confident	42 Å²	42	46.5 Å²	46.5	18%	0.184	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127	176.9	-56.5	-97.6	0	0	0	109.3	E167 I168 E169 C170 K188 I192 V214	E167-F190 HydrophobicContact CG-CE2 3.96Å; E167-F190 WeakPolarHBondContact OE1-CE2 3.4Å; I168-F190 PolarHBondContact O-N 2.86Å; E169-F190 HydrophobicContact CG-CB 4.13Å; E169-F190 HydrophobicContact CG-CD2 3.9Å; E169-F190 HydrophobicContact CG-CG 4.29Å; C170-F190 PolarHBondContact N-O 2.98Å; K188-F190 HydrophobicContact CB-CE2 3.81Å; K188-F190 HydrophobicContact CB-CZ 4.48Å; K188-F190 HydrophobicContact CD-CE2 4.23Å; K188-F190 HydrophobicContact CD-CZ 4.49Å; F190-I192 HydrophobicContact CB-CD1 4.35Å; F190-I192 HydrophobicContact CB-CG1 4.44Å; F190-I192 HydrophobicContact CD1-CD1 4.23Å; F190-V214 HydrophobicContact CB-CB 4.5Å; F190-V214 HydrophobicContact CD1-CB 3.68Å; F190-V214 HydrophobicContact CD1-CG1 4.12Å; F190-V214 HydrophobicContact CD1-CG2 3.59Å; F190-V214 HydrophobicContact CE1-CB 4.32Å; F190-V214 HydrophobicContact CE1-CG2 3.72Å; F190-V214 HydrophobicContact CG-CB 4.35Å
191	I	93.1	Very high	88.5	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.			trans	-135.4	74.5	179.2	-53.6	-178	0	0	0	106.2	C170 L175 I178 L189 N194 I196 V214 L215 N218	C170-I191 HydrophobicContact CB-CG1 4.2Å; L175-I191 HydrophobicContact CD1-CG2 4.3Å; I178-I191 HydrophobicContact CB-CD1 4.32Å; I178-I191 HydrophobicContact CD1-CD1 4.18Å; I178-I191 HydrophobicContact CG1-CD1 3.92Å; I178-I191 HydrophobicContact CG2-CD1 3.84Å; L189-I191 HydrophobicContact CD1-CD1 4.24Å; L189-I191 HydrophobicContact CD1-CG1 4.04Å; L189-I191 HydrophobicContact CD2-CD1 4.06Å; L189-I191 HydrophobicContact CG-CD1 4.07Å; L189-I191 HydrophobicContact CG-CG1 4.03Å; I191-N194 WeakPolarHBondContact CG2-ND2 3.38Å; I191-I196 HydrophobicContact CG2-CD1 3.64Å; I191-V214 PolarHBondContact N-O 3.28Å; I191-L215 HydrophobicContact CB-CD2 4.12Å; I191-L215 HydrophobicContact CD1-CD2 4.16Å; I191-L215 HydrophobicContact CG2-CD2 4.49Å; I191-N218 PolarHBondContact O-ND2 2.97Å
192	I	93.1	Very high	88.1	Confident	56 Å²	56	39.4 Å²	39.4	29%	0.287	22%	0.215	S	C	.	.			trans	-103.6	133	-170.5	-55.3	171.5	0	0	0	110.7	N171 N172 F190 N194 V214 S216 N217	N171-I192 CarbonylContact C-O 3.58Å; N171-I192 VanDerWaalsContact CA-O 3.23Å; N171-I192 WeakPolarHBondContact CA-O 3.4Å; N171-I192 HydrophobicContact CB-CB 4.48Å; N171-I192 WeakPolarHBondContact OD1-CB 3.43Å; N171-I192 PolarHBondContact OD1-N 2.98Å; N172-I192 PolarHBondContact N-O 2.72Å; F190-I192 HydrophobicContact CB-CD1 4.35Å; F190-I192 HydrophobicContact CB-CG1 4.44Å; F190-I192 HydrophobicContact CD1-CD1 4.23Å; I192-N194 PolarHBondContact O-ND2 3.42Å; I192-V214 HydrophobicContact CD1-CG1 3.91Å; I192-V214 HydrophobicContact CG1-CG1 3.8Å; I192-S216 VanDerWaalsContact CA-O 3.26Å; I192-S216 WeakPolarHBondContact CA-O 3.31Å; I192-N217 HydrophobicContact CG2-CB 4.27Å
193	G	91.7	Very high	87.3	Confident	10 Å²	10	40.9 Å²	40.9	10%	0.103	22%	0.223	C	C	.	.	S	Bend	trans	81	31.7	170.4	0	0	0	0	0	115.2	N172 S216 N217	N172-G193 WeakPolarHBondContact CA-O 3.22Å; G193-S216 PolarHBondContact N-O 3.22Å; G193-N217 CarbonylContact C-O 3.29Å; G193-N217 WeakPolarHBondContact CA-O 3.46Å; G193-N217 PolarHBondContact N-O 2.97Å
194	N	94.3	Very high	87.2	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.221	C	C	.	.			trans	-110.6	-173	-179.7	-57.1	-77.2	0	0	0	112.4	C170 A173 Q174 L175 I191 I192 I196 N217 N218	C170-N194 PolarHBondContact O-ND2 3.25Å; A173-N194 WeakPolarHBondContact CA-OD1 3.47Å; A173-N194 PolarHBondContact N-OD1 3.18Å; Q174-N194 PolarHBondContact N-OD1 3.12Å; Q174-N194 VanDerWaalsContact N-OD1 3.09Å; L175-N194 HydrophobicContact CB-CB 3.84Å; L175-N194 HydrophobicContact CG-CB 4.43Å; L175-N194 WeakPolarHBondContact CG-OD1 3.39Å; L175-N194 PolarHBondContact N-OD1 3.12Å; L175-N194 WeakPolarHBondContact O-CB 3.47Å; I191-N194 WeakPolarHBondContact CG2-ND2 3.38Å; I192-N194 PolarHBondContact O-ND2 3.42Å; N194-I196 HydrophobicContact CB-CG1 4.39Å; N194-N217 PolarHBondContact N-O 3.08Å; N194-N218 WeakPolarHBondContact CA-OD1 3.2Å; N194-N218 VanDerWaalsContact CB-OD1 3.23Å; N194-N218 WeakPolarHBondContact CB-OD1 3.48Å; N194-N218 PolarHBondContact N-OD1 3.32Å; N194-N218 WeakPolarHBondContact O-CA 3.24Å; N194-N218 PolarHBondContact O-OD1 3.31Å
195	N	92.3	Very high	86.9	Confident	30 Å²	30	45.1 Å²	45.1	16%	0.16	23%	0.229	C	C	.	.			trans	-103.1	10.9	-171.9	-68.4	-57.5	0	0	0	113.9	Q174 L175 E176 K197 K219	Q174-N195 WeakPolarHBondContact CA-ND2 3.43Å; Q174-N195 PolarHBondContact O-ND2 2.85Å; Q174-N195 PolarHBondContact OE1-ND2 2.85Å; L175-N195 CarbonylContact O-C 3.26Å; L175-N195 WeakPolarHBondContact O-CA 3.35Å; L175-N195 PolarHBondContact O-N 3.31Å; E176-N195 HydrophobicContact CG-CB 4.3Å; N195-K197 PolarHBondContact O-N 2.03Å; N195-K219 WeakPolarHBondContact OD1-CE 3Å; N195-K219 PolarHBondContact OD1-NZ 3.34Å
196	I	91.8	Very high	86.5	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.247	C	C	.	.			trans	-60.5	125.3	-173.2	-52	178.2	0	0	0	110.7	L175 E176 I178 I191 N194 T198 N218 K219 I220	L175-I196 WeakPolarHBondContact O-CG1 3.09Å; L175-I196 PolarHBondContact O-N 3.46Å; L175-I196 VanDerWaalsContact O-N 3.12Å; E176-I196 WeakPolarHBondContact O-CA 3.37Å; I178-I196 HydrophobicContact CG1-CD1 3.95Å; I191-I196 HydrophobicContact CG2-CD1 3.64Å; N194-I196 HydrophobicContact CB-CG1 4.39Å; I196-T198 WeakPolarHBondContact CG2-O 3.39Å; I196-N218 HydrophobicContact CB-CB 4.42Å; I196-K219 CarbonylContact O-C 3.52Å; I196-K219 VanDerWaalsContact O-CA 3.31Å; I196-K219 WeakPolarHBondContact O-CA 3.04Å; I196-K219 PolarHBondContact O-N 3.07Å; I196-I220 HydrophobicContact CB-CG1 4.44Å; I196-I220 HydrophobicContact CG2-CG1 4.28Å; I196-I220 WeakPolarHBondContact O-CG1 3.43Å; I196-I220 PolarHBondContact O-N 2.85Å; I196-I220 VanDerWaalsContact O-N 3.08Å
197	K	88.4	Confident	86.4	Confident	125 Å²	125	47.8 Å²	47.8	54%	0.543	25%	0.249	S	C	.	.			trans	-104.9	-32.8	-176.5	-66.3	-175.6	-179.2	178.6	0	115.8	N195 K219 I220 E221	N195-K197 PolarHBondContact O-N 2.03Å; K197-K219 WeakPolarHBondContact CA-O 3.08Å; K197-K219 HydrophobicContact CG-CB 4.22Å; K197-I220 WeakPolarHBondContact O-CA 3.25Å; K197-E221 PolarHBondContact O-N 3.21Å
198	T	85.4	Confident	86	Confident	71 Å²	71	48.4 Å²	48.4	44%	0.436	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.5	178.7	63.5	0	0	0	0	110.2	I196 N200 H222	I196-T198 WeakPolarHBondContact CG2-O 3.39Å; T198-N200 WeakPolarHBondContact CB-OD1 3.49Å; T198-N200 PolarHBondContact OG1-OD1 3.17Å; T198-H222 WeakPolarHBondContact CA-O 3.08Å; T198-H222 HydrophobicContact CG2-CB 4.46Å
199	L	88	Confident	85.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	110.6	171	-171.9	70.2	0	0	0	109.9	I178 N203 L204 L215 H222 I223 E224 A227 F228	I178-L199 HydrophobicContact CD1-CD1 3.48Å; I178-L199 VanDerWaalsContact CD1-CD1 3.48Å; I178-L199 HydrophobicContact CG1-CD1 4.35Å; L199-N203 HydrophobicContact CD1-CB 4.31Å; L199-L204 HydrophobicContact CD1-CD1 4.1Å; L199-L204 HydrophobicContact CD2-CD1 4.14Å; L199-L215 HydrophobicContact CD2-CD1 4.15Å; L199-H222 PolarHBondContact N-O 3.07Å; L199-H222 VanDerWaalsContact N-O 3.09Å; L199-I223 HydrophobicContact CB-CG1 4.19Å; L199-I223 HydrophobicContact CB-CG2 4.33Å; L199-I223 HydrophobicContact CD2-CG2 4.28Å; L199-E224 PolarHBondContact O-N 3.43Å; L199-A227 HydrophobicContact CD2-CB 4.08Å; L199-A227 HydrophobicContact CG-CB 4.08Å; L199-F228 HydrophobicContact CD2-CD1 4.34Å; L199-F228 HydrophobicContact CD2-CE1 3.39Å; L199-F228 HydrophobicContact CD2-CE2 4.34Å; L199-F228 HydrophobicContact CD2-CZ 3.39Å
200	N	82.2	Confident	85.7	Confident	57 Å²	57	49.3 Å²	49.3	31%	0.305	26%	0.258	S	S	.	.			trans	-103.1	158.6	-172.2	-55.3	55.4	0	0	0	111.4	T198 G202 N203 E224	T198-N200 WeakPolarHBondContact CB-OD1 3.49Å; T198-N200 PolarHBondContact OG1-OD1 3.17Å; N200-G202 PolarHBondContact O-N 3.29Å; N200-N203 WeakPolarHBondContact CB-OD1 3.18Å; N200-N203 PolarHBondContact O-N 2.98Å; N200-N203 VanDerWaalsContact O-N 3.15Å; N200-N203 PolarHBondContact O-OD1 2.97Å; N200-E224 WeakPolarHBondContact CA-OE2 3Å; N200-E224 HydrophobicContact CB-CG 4.43Å; N200-E224 PolarHBondContact ND2-OE1 2.73Å
201	N	73.1	Confident	85.7	Confident	64 Å²	64	50.6 Å²	50.6	34%	0.342	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.7	-172.4	-66.7	-36.9	0	0	0	115	E224 N226 A227	N201-E224 WeakPolarHBondContact CB-OE2 3.21Å; N201-E224 PolarHBondContact N-OE2 2.04Å; N201-E224 PolarHBondContact ND2-OE2 3.21Å; N201-E224 WeakPolarHBondContact OD1-CB 3.41Å; N201-N226 WeakPolarHBondContact OD1-CA 3.44Å; N201-N226 VanDerWaalsContact OD1-CB 3.28Å; N201-N226 WeakPolarHBondContact OD1-CB 3.26Å; N201-N226 PolarHBondContact OD1-N 2.85Å; N201-A227 PolarHBondContact OD1-N 2.02Å
202	G	68.1	Low	85.9	Confident	58 Å²	58	51.2 Å²	51.2	60%	0.598	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-28.1	179.4	0	0	0	0	0	115.3	N200 L204	N200-G202 PolarHBondContact O-N 3.29Å; G202-L204 VanDerWaalsContact C-N 3.29Å; G202-L204 PolarHBondContact O-N 2.76Å; G202-L204 VanDerWaalsContact O-N 3.12Å
203	N	69.5	Low	86.1	Confident	52 Å²	52	48.6 Å²	48.6	28%	0.278	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.6	-159.8	-71.9	87	0	0	0	116.1	I178 L199 N200	I178-N203 HydrophobicContact CB-CB 4.24Å; I178-N203 HydrophobicContact CD1-CB 4.23Å; L199-N203 HydrophobicContact CD1-CB 4.31Å; N200-N203 WeakPolarHBondContact CB-OD1 3.18Å; N200-N203 PolarHBondContact O-N 2.98Å; N200-N203 VanDerWaalsContact O-N 3.15Å; N200-N203 PolarHBondContact O-OD1 2.97Å
204	L	83	Confident	86.3	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	2.9	-172.9	-68.3	169.5	0	0	0	113.5	I178 L189 L199 G202 D206 L207 L213 F228 L231	I178-L204 HydrophobicContact CD1-CD1 4.35Å; I178-L204 HydrophobicContact CD1-CD2 3.78Å; I178-L204 HydrophobicContact CD1-CG 4Å; L189-L204 HydrophobicContact CD2-CD2 4.41Å; L199-L204 HydrophobicContact CD1-CD1 4.1Å; L199-L204 HydrophobicContact CD2-CD1 4.14Å; G202-L204 VanDerWaalsContact C-N 3.29Å; G202-L204 PolarHBondContact O-N 2.76Å; G202-L204 VanDerWaalsContact O-N 3.12Å; L204-D206 VanDerWaalsContact C-N 3.34Å; L204-D206 PolarHBondContact O-N 3.1Å; L204-L207 HydrophobicContact CD2-CD1 3.95Å; L204-L207 PolarHBondContact O-N 3.45Å; L204-L213 HydrophobicContact CD1-CD2 3.7Å; L204-L213 HydrophobicContact CD2-CD1 4.46Å; L204-L213 HydrophobicContact CD2-CD2 4.22Å; L204-F228 HydrophobicContact CD1-CD1 4Å; L204-F228 HydrophobicContact CD1-CE1 3.98Å; L204-L231 HydrophobicContact CB-CD1 4.23Å; L204-L231 HydrophobicContact CD1-CD1 4.16Å
205	R	77.1	Confident	86.4	Confident	153 Å²	153	48.2 Å²	48.2	58%	0.577	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-40	-162.2	-159.9	-178.1	-174.2	172.7	4.3	114.5	L207 E230	R205-L207 PolarHBondContact O-N 2.79Å; R205-E230 HydrophobicContact CG-CG 3.68Å; R205-E230 IonicContact CZ-OE1 2.77Å; R205-E230 IonicContact NE-OE1 3.83Å; R205-E230 PolarHBondContact NE-OE1 2.04Å; R205-E230 IonicContact NH2-OE1 3.94Å; R205-E230 PolarHBondContact NH2-OE1 3.2Å
206	D	77.3	Confident	86.5	Confident	124 Å²	124	47.2 Å²	47.2	66%	0.663	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.3	-172.7	-58.4	-39.8	0	0	0	114	S184 L204 I208	S184-D206 VanDerWaalsContact CB-O 3.32Å; S184-D206 WeakPolarHBondContact CB-O 3.33Å; L204-D206 VanDerWaalsContact C-N 3.34Å; L204-D206 PolarHBondContact O-N 3.1Å; D206-I208 PolarHBondContact O-N 3.44Å; D206-I208 VanDerWaalsContact O-N 3.08Å
207	L	87.2	Confident	86.7	Confident	7 Å²	7	51 Å²	51	4%	0.037	27%	0.266	C	S	.	.			trans	-88	44.4	-173.8	-56.6	-175.9	0	0	0	113	I182 L189 L204 R205 H209 L210 L231	I182-L207 HydrophobicContact CB-CD2 4.16Å; I182-L207 HydrophobicContact CG2-CD1 4.15Å; I182-L207 HydrophobicContact CG2-CD2 3.78Å; L189-L207 HydrophobicContact CD2-CD1 3.64Å; L204-L207 HydrophobicContact CD2-CD1 3.95Å; L204-L207 PolarHBondContact O-N 3.45Å; R205-L207 PolarHBondContact O-N 2.79Å; L207-H209 PolarHBondContact O-N 3.29Å; L207-L210 HydrophobicContact CB-CB 4.26Å; L207-L210 HydrophobicContact CB-CD2 4.39Å; L207-L210 HydrophobicContact CD1-CD2 4.38Å; L207-L210 WeakPolarHBondContact O-CB 3.37Å; L207-L210 PolarHBondContact O-N 3.32Å; L207-L231 HydrophobicContact CB-CD2 4.15Å; L207-L231 WeakPolarHBondContact O-CD2 3.46Å
208	I	85.4	Confident	86.9	Confident	81 Å²	81	45.6 Å²	45.6	42%	0.415	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-18.5	-173.4	60.4	167.8	0	0	0	115.1	D206 N233	D206-I208 PolarHBondContact O-N 3.44Å; D206-I208 VanDerWaalsContact O-N 3.08Å; I208-N233 PolarHBondContact O-ND2 3.48Å
209	H	89.4	Confident	87.2	Confident	95 Å²	95	46.5 Å²	46.5	44%	0.44	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-2.3	178.5	-65.9	-54.6	0	0	0	114.1	S184 T186 L207 K211	S184-H209 PolarHBondContact O-CD2 3.09Å; T186-H209 CarbonylContact O-C 3.08Å; L207-H209 PolarHBondContact O-N 3.29Å; H209-K211 PolarHBondContact O-N 2.96Å
210	L	93.9	Very high	87.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.241	C	C	.	.			trans	-67.9	125	-173.5	-163.3	67.6	0	0	0	112	T186 L189 L207 T212 L213 L231 N233 L234	T186-L210 HydrophobicContact CG2-CD1 3.98Å; T186-L210 WeakPolarHBondContact O-CA 3.48Å; T186-L210 PolarHBondContact O-N 3.1Å; L189-L210 HydrophobicContact CB-CD1 3.7Å; L189-L210 HydrophobicContact CB-CD2 4.38Å; L207-L210 HydrophobicContact CB-CB 4.26Å; L207-L210 HydrophobicContact CB-CD2 4.39Å; L207-L210 HydrophobicContact CD1-CD2 4.38Å; L207-L210 WeakPolarHBondContact O-CB 3.37Å; L207-L210 PolarHBondContact O-N 3.32Å; L210-T212 WeakPolarHBondContact CD1-O 3.01Å; L210-L213 HydrophobicContact CD2-CB 3.87Å; L210-L213 HydrophobicContact CD2-CD1 4.17Å; L210-L213 HydrophobicContact CD2-CD2 4.36Å; L210-L213 HydrophobicContact CD2-CG 4.35Å; L210-L231 HydrophobicContact CB-CD2 4.47Å; L210-L231 HydrophobicContact CD2-CD2 4.49Å; L210-N233 CarbonylContact O-C 3.04Å; L210-N233 VanDerWaalsContact O-C 3.31Å; L210-L234 HydrophobicContact CB-CD1 4.33Å; L210-L234 HydrophobicContact CD2-CD1 4.12Å; L210-L234 HydrophobicContact CG-CD1 3.92Å; L210-L234 VanDerWaalsContact O-CA 3.31Å; L210-L234 WeakPolarHBondContact O-CA 3.13Å; L210-L234 PolarHBondContact O-N 3.14Å
211	K	95.6	Very high	87.8	Confident	68 Å²	68	47.7 Å²	47.7	30%	0.296	24%	0.244	S	C	.	.	S	Bend	trans	-108.5	-24.3	179.5	-60.7	172.7	-165	168.2	0	112.1	E187 H209 R235 R236	E187-K211 HydrophobicContact CB-CD 4.38Å; E187-K211 VanDerWaalsContact CD-CE 3.43Å; E187-K211 HydrophobicContact CG-CD 4.41Å; E187-K211 WeakPolarHBondContact O-CA 3.02Å; E187-K211 PolarHBondContact O-N 3.14Å; E187-K211 WeakPolarHBondContact OE1-CE 3.33Å; E187-K211 IonicContact OE1-NZ 3.66Å; E187-K211 PolarHBondContact OE1-NZ 3.26Å; E187-K211 WeakPolarHBondContact OE2-CD 3.03Å; E187-K211 WeakPolarHBondContact OE2-CE 3.45Å; E187-K211 IonicContact OE2-NZ 2.86Å; E187-K211 PolarHBondContact OE2-NZ 3.03Å; H209-K211 PolarHBondContact O-N 2.96Å; K211-R235 WeakPolarHBondContact O-CA 3.26Å; K211-R235 PolarHBondContact O-N 2.87Å; K211-R236 PolarHBondContact O-N 3.28Å
212	T	97.5	Very high	88.2	Confident	14 Å²	14	50.7 Å²	50.7	9%	0.086	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.9	177.1	-57.7	0	0	0	0	110	E187 K188 L189 L210 V214 R236	E187-T212 PolarHBondContact O-N 2.87Å; K188-T212 WeakPolarHBondContact CA-O 3.02Å; L189-T212 PolarHBondContact N-O 2.98Å; L210-T212 WeakPolarHBondContact CD1-O 3.01Å; T212-V214 HydrophobicContact CG2-CG2 4.06Å; T212-R236 WeakPolarHBondContact CA-O 3.06Å; T212-R236 HydrophobicContact CG2-CB 4.09Å
213	L	96.5	Very high	89.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.9	173	178	56.5	0	0	0	109.1	L189 L204 L210 L215 F228 L231 L234 R236 L237 K238	L189-L213 HydrophobicContact CB-CD1 4.14Å; L189-L213 HydrophobicContact CD2-CD1 4.01Å; L189-L213 HydrophobicContact CG-CD1 4.11Å; L204-L213 HydrophobicContact CD1-CD2 3.7Å; L204-L213 HydrophobicContact CD2-CD1 4.46Å; L204-L213 HydrophobicContact CD2-CD2 4.22Å; L210-L213 HydrophobicContact CD2-CB 3.87Å; L210-L213 HydrophobicContact CD2-CD1 4.17Å; L210-L213 HydrophobicContact CD2-CD2 4.36Å; L210-L213 HydrophobicContact CD2-CG 4.35Å; L213-L215 HydrophobicContact CD1-CD1 4.4Å; L213-L215 HydrophobicContact CD1-CG 4.15Å; L213-L215 HydrophobicContact CD2-CD1 4.01Å; L213-L215 HydrophobicContact CG-CD1 4.16Å; L213-L215 HydrophobicContact CG-CG 4.25Å; L213-F228 HydrophobicContact CD2-CE1 4.23Å; L213-L231 HydrophobicContact CD2-CD1 4.24Å; L213-L234 HydrophobicContact CB-CD1 3.85Å; L213-L234 HydrophobicContact CB-CD2 4.31Å; L213-R236 PolarHBondContact N-O 2.91Å; L213-L237 HydrophobicContact CB-CD1 4Å; L213-L237 HydrophobicContact CD2-CD1 3.88Å; L213-L237 HydrophobicContact CG-CD1 3.95Å; L213-L237 WeakPolarHBondContact O-CA 3.48Å; L213-K238 PolarHBondContact O-N 3.03Å
214	V	97	Very high	89.8	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	108	179.3	-178.6	0	0	0	0	109.6	L189 F190 I191 I192 T212 S216 K238	L189-V214 PolarHBondContact O-N 2.87Å; F190-V214 HydrophobicContact CB-CB 4.5Å; F190-V214 HydrophobicContact CD1-CB 3.68Å; F190-V214 HydrophobicContact CD1-CG1 4.12Å; F190-V214 HydrophobicContact CD1-CG2 3.59Å; F190-V214 HydrophobicContact CE1-CB 4.32Å; F190-V214 HydrophobicContact CE1-CG2 3.72Å; F190-V214 HydrophobicContact CG-CB 4.35Å; I191-V214 PolarHBondContact N-O 3.28Å; I192-V214 HydrophobicContact CD1-CG1 3.91Å; I192-V214 HydrophobicContact CG1-CG1 3.8Å; T212-V214 HydrophobicContact CG2-CG2 4.06Å; V214-S216 WeakPolarHBondContact CG1-OG 3.1Å; V214-K238 HydrophobicContact CB-CB 4.36Å; V214-K238 HydrophobicContact CB-CD 4.46Å; V214-K238 HydrophobicContact CG1-CB 4.06Å; V214-K238 HydrophobicContact CG1-CD 3.9Å; V214-K238 HydrophobicContact CG2-CB 4.23Å; V214-K238 HydrophobicContact CG2-CD 3.84Å; V214-K238 HydrophobicContact CG2-CG 4.25Å
215	L	95.4	Very high	89.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.			trans	-109.7	32.1	176.2	-71	161.6	0	0	0	110.6	I178 I191 L199 L213 N218 I220 K238 L239 N242	I178-L215 HydrophobicContact CD1-CD2 3.91Å; I178-L215 HydrophobicContact CG1-CD2 4.35Å; I191-L215 HydrophobicContact CB-CD2 4.12Å; I191-L215 HydrophobicContact CD1-CD2 4.16Å; I191-L215 HydrophobicContact CG2-CD2 4.49Å; L199-L215 HydrophobicContact CD2-CD1 4.15Å; L213-L215 HydrophobicContact CD1-CD1 4.4Å; L213-L215 HydrophobicContact CD1-CG 4.15Å; L213-L215 HydrophobicContact CD2-CD1 4.01Å; L213-L215 HydrophobicContact CG-CD1 4.16Å; L213-L215 HydrophobicContact CG-CG 4.25Å; L215-N218 PolarHBondContact O-ND2 3.1Å; L215-I220 HydrophobicContact CB-CD1 4.12Å; L215-K238 PolarHBondContact N-O 3.02Å; L215-L239 HydrophobicContact CB-CD2 3.98Å; L215-L239 HydrophobicContact CD1-CD2 3.9Å; L215-N242 PolarHBondContact O-ND2 3.01Å
216	S	95.2	Very high	89.4	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.063	25%	0.252	C	S	.	.			trans	-72.7	149.6	-173.1	-57.8	0	0	0	0	113.2	I192 G193 V214 N218 N240	I192-S216 VanDerWaalsContact CA-O 3.26Å; I192-S216 WeakPolarHBondContact CA-O 3.31Å; G193-S216 PolarHBondContact N-O 3.22Å; V214-S216 WeakPolarHBondContact CG1-OG 3.1Å; S216-N218 PolarHBondContact O-ND2 2.04Å; S216-N240 CarbonylContact C-O 3.13Å; S216-N240 WeakPolarHBondContact CA-O 3.24Å; S216-N240 WeakPolarHBondContact CB-O 3.23Å; S216-N240 PolarHBondContact OG-OD1 3.31Å
217	N	94.7	Very high	89.7	Confident	81 Å²	81	45.9 Å²	45.9	43%	0.433	22%	0.223	S	C	.	.	S	Bend	trans	56.6	56.2	178.5	-164.9	37.8	0	0	0	112	I192 G193 N194 N240 L241	I192-N217 HydrophobicContact CG2-CB 4.27Å; G193-N217 CarbonylContact C-O 3.29Å; G193-N217 WeakPolarHBondContact CA-O 3.46Å; G193-N217 PolarHBondContact N-O 2.97Å; N194-N217 PolarHBondContact N-O 3.08Å; N217-N240 PolarHBondContact N-O 2.8Å; N217-L241 CarbonylContact C-O 3.6Å; N217-L241 WeakPolarHBondContact CA-O 3.42Å; N217-L241 HydrophobicContact CB-CB 4.09Å; N217-L241 HydrophobicContact CB-CD1 4.29Å; N217-L241 PolarHBondContact N-O 3.21Å
218	N	93.4	Very high	89.9	Confident	10 Å²	10	45.6 Å²	45.6	5%	0.053	22%	0.221	C	C	.	.	S	Bend	trans	-121.4	-165.3	171.4	-71.8	-82.8	0	0	0	109.1	I191 N194 I196 L215 S216 I220 L241 N242	I191-N218 PolarHBondContact O-ND2 2.97Å; N194-N218 WeakPolarHBondContact CA-OD1 3.2Å; N194-N218 VanDerWaalsContact CB-OD1 3.23Å; N194-N218 WeakPolarHBondContact CB-OD1 3.48Å; N194-N218 PolarHBondContact N-OD1 3.32Å; N194-N218 WeakPolarHBondContact O-CA 3.24Å; N194-N218 PolarHBondContact O-OD1 3.31Å; I196-N218 HydrophobicContact CB-CB 4.42Å; L215-N218 PolarHBondContact O-ND2 3.1Å; S216-N218 PolarHBondContact O-ND2 2.04Å; N218-I220 HydrophobicContact CB-CD1 4.27Å; N218-I220 HydrophobicContact CB-CG1 3.98Å; N218-L241 PolarHBondContact N-O 3.38Å; N218-L241 VanDerWaalsContact N-O 3.08Å; N218-N242 WeakPolarHBondContact CA-OD1 3.35Å; N218-N242 WeakPolarHBondContact CB-OD1 3.29Å; N218-N242 PolarHBondContact N-OD1 3.02Å; N218-N242 PolarHBondContact O-OD1 3.08Å
219	K	92.7	Very high	89.6	Confident	91 Å²	91	43.9 Å²	43.9	40%	0.396	22%	0.216	S	C	.	.			trans	-116.2	28.5	-179.1	-64.8	175.2	179.4	166.5	0	111.1	N195 I196 K197 E221 N242 L243	N195-K219 WeakPolarHBondContact OD1-CE 3Å; N195-K219 PolarHBondContact OD1-NZ 3.34Å; I196-K219 CarbonylContact O-C 3.52Å; I196-K219 VanDerWaalsContact O-CA 3.31Å; I196-K219 WeakPolarHBondContact O-CA 3.04Å; I196-K219 PolarHBondContact O-N 3.07Å; K197-K219 WeakPolarHBondContact CA-O 3.08Å; K197-K219 HydrophobicContact CG-CB 4.22Å; K219-E221 PolarHBondContact O-N 2.86Å; K219-E221 VanDerWaalsContact O-N 3.17Å; K219-N242 PolarHBondContact N-OD1 2.84Å; K219-L243 HydrophobicContact CB-CD1 4.16Å
220	I	94.3	Very high	89.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.213	C	C	.	.			trans	-69.8	115.5	-169.4	-54.8	172	0	0	0	109.2	I196 K197 L215 N218 I223 L239 N242 L243 L244	I196-I220 HydrophobicContact CB-CG1 4.44Å; I196-I220 HydrophobicContact CG2-CG1 4.28Å; I196-I220 WeakPolarHBondContact O-CG1 3.43Å; I196-I220 PolarHBondContact O-N 2.85Å; I196-I220 VanDerWaalsContact O-N 3.08Å; K197-I220 WeakPolarHBondContact O-CA 3.25Å; L215-I220 HydrophobicContact CB-CD1 4.12Å; N218-I220 HydrophobicContact CB-CD1 4.27Å; N218-I220 HydrophobicContact CB-CG1 3.98Å; I220-I223 HydrophobicContact CG2-CG1 4Å; I220-L239 HydrophobicContact CD1-CD2 4.21Å; I220-N242 HydrophobicContact CB-CB 4.35Å; I220-N242 WeakPolarHBondContact CB-OD1 3.44Å; I220-N242 VanDerWaalsContact CG1-OD1 3.3Å; I220-N242 WeakPolarHBondContact CG1-OD1 3.38Å; I220-N242 PolarHBondContact N-OD1 3.29Å; I220-L243 CarbonylContact O-C 3.1Å; I220-L243 VanDerWaalsContact O-C 3.26Å; I220-L243 WeakPolarHBondContact O-CA 3.41Å; I220-L243 PolarHBondContact O-N 3.39Å; I220-L244 HydrophobicContact CB-CD2 4.45Å; I220-L244 HydrophobicContact CG2-CD2 3.81Å; I220-L244 PolarHBondContact O-N 2.88Å; I220-L244 VanDerWaalsContact O-N 3.09Å
221	E	87.6	Confident	88.9	Confident	83 Å²	83	43.2 Å²	43.2	39%	0.388	21%	0.213	S	C	.	.			trans	-101.4	-37.9	179.5	-71.4	164.8	-160.7	0	0	111	K197 K219 L243	K197-E221 PolarHBondContact O-N 3.21Å; K219-E221 PolarHBondContact O-N 2.86Å; K219-E221 VanDerWaalsContact O-N 3.17Å; E221-L243 HydrophobicContact CG-CB 3.63Å; E221-L243 HydrophobicContact CG-CD1 4.04Å; E221-L243 HydrophobicContact CG-CG 4.48Å
222	H	81.8	Confident	88.4	Confident	126 Å²	126	43.4 Å²	43.4	58%	0.583	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.8	-178.4	-76.8	-82.7	0	0	0	113.3	T198 L199	T198-H222 WeakPolarHBondContact CA-O 3.08Å; T198-H222 HydrophobicContact CG2-CB 4.46Å; L199-H222 PolarHBondContact N-O 3.07Å; L199-H222 VanDerWaalsContact N-O 3.09Å
223	I	89.1	Confident	88.1	Confident	15 Å²	15	45.3 Å²	45.3	8%	0.077	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.6	175.4	-59.3	178.4	0	0	0	108.1	L199 I220 A227 F228 L239 L244 L247 P248 I251	L199-I223 HydrophobicContact CB-CG1 4.19Å; L199-I223 HydrophobicContact CB-CG2 4.33Å; L199-I223 HydrophobicContact CD2-CG2 4.28Å; I220-I223 HydrophobicContact CG2-CG1 4Å; I223-A227 HydrophobicContact CG2-CB 3.77Å; I223-F228 HydrophobicContact CD1-CE2 4.44Å; I223-F228 HydrophobicContact CD1-CZ 4.42Å; I223-F228 HydrophobicContact CG2-CE2 4.04Å; I223-F228 HydrophobicContact CG2-CZ 4.44Å; I223-L239 HydrophobicContact CD1-CD1 4.12Å; I223-L239 HydrophobicContact CD1-CD2 4.29Å; I223-L244 HydrophobicContact CD1-CD1 4.14Å; I223-L244 HydrophobicContact CD1-CD2 3.86Å; I223-L244 HydrophobicContact CG1-CD2 3.88Å; I223-L247 HydrophobicContact CD1-CD2 4.15Å; I223-P248 WeakPolarHBondContact O-CG 3.4Å; I223-I251 HydrophobicContact CG2-CD1 3.87Å; I223-I251 HydrophobicContact CG2-CG1 4.2Å
224	E	82.3	Confident	88	Confident	73 Å²	73	45.3 Å²	45.3	34%	0.341	23%	0.23	S	C	.	.			trans	-73.3	145.3	174.6	-69.4	179.6	-177.4	0	0	111.8	L199 N200 N201 N226 A227 I251	L199-E224 PolarHBondContact O-N 3.43Å; N200-E224 WeakPolarHBondContact CA-OE2 3Å; N200-E224 HydrophobicContact CB-CG 4.43Å; N200-E224 PolarHBondContact ND2-OE1 2.73Å; N201-E224 WeakPolarHBondContact CB-OE2 3.21Å; N201-E224 PolarHBondContact N-OE2 2.04Å; N201-E224 PolarHBondContact ND2-OE2 3.21Å; N201-E224 WeakPolarHBondContact OD1-CB 3.41Å; E224-N226 PolarHBondContact O-N 3.18Å; E224-A227 VanDerWaalsContact O-CB 3.24Å; E224-A227 WeakPolarHBondContact O-CB 3.02Å; E224-A227 PolarHBondContact O-N 3.09Å; E224-I251 VanDerWaalsContact O-CD1 3.23Å; E224-I251 WeakPolarHBondContact O-CD1 3.44Å
225	E	73.4	Confident	88	Confident	114 Å²	114	49.8 Å²	49.8	53%	0.533	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-28.1	-169.6	-165.5	-174.3	-175.5	0	0	115.3	P248 I251	E225-P248 HydrophobicContact CB-CB 4.5Å; E225-P248 HydrophobicContact CG-CB 4.36Å; E225-I251 VanDerWaalsContact O-CD1 3.23Å; E225-I251 WeakPolarHBondContact O-CD1 3.49Å
226	N	78.6	Confident	88.1	Confident	84 Å²	84	56.1 Å²	56.1	45%	0.449	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	11.9	-176.8	-69.7	-82.5	0	0	0	113.5	N201 E224 F228 S229	N201-N226 WeakPolarHBondContact OD1-CA 3.44Å; N201-N226 VanDerWaalsContact OD1-CB 3.28Å; N201-N226 WeakPolarHBondContact OD1-CB 3.26Å; N201-N226 PolarHBondContact OD1-N 2.85Å; E224-N226 PolarHBondContact O-N 3.18Å; N226-F228 PolarHBondContact O-N 3.09Å; N226-S229 VanDerWaalsContact O-CB 3.25Å; N226-S229 WeakPolarHBondContact O-CB 3.32Å; N226-S229 PolarHBondContact O-N 3.21Å; N226-S229 PolarHBondContact O-OG 3.17Å
227	A	83.8	Confident	88.3	Confident	5 Å²	5	55.7 Å²	55.7	4%	0.041	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20	-174.1	0	0	0	0	0	115.5	L199 N201 I223 E224	L199-A227 HydrophobicContact CD2-CB 4.08Å; L199-A227 HydrophobicContact CG-CB 4.08Å; N201-A227 PolarHBondContact OD1-N 2.02Å; I223-A227 HydrophobicContact CG2-CB 3.77Å; E224-A227 VanDerWaalsContact O-CB 3.24Å; E224-A227 WeakPolarHBondContact O-CB 3.02Å; E224-A227 PolarHBondContact O-N 3.09Å
228	F	90.8	Very high	88.4	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	12.6	177.2	-49.1	-65.5	0	0	0	113.7	L199 L204 L213 I223 N226 E230 L231 L237 L239 I251 F252 S254 L255	L199-F228 HydrophobicContact CD2-CD1 4.34Å; L199-F228 HydrophobicContact CD2-CE1 3.39Å; L199-F228 HydrophobicContact CD2-CE2 4.34Å; L199-F228 HydrophobicContact CD2-CZ 3.39Å; L204-F228 HydrophobicContact CD1-CD1 4Å; L204-F228 HydrophobicContact CD1-CE1 3.98Å; L213-F228 HydrophobicContact CD2-CE1 4.23Å; I223-F228 HydrophobicContact CD1-CE2 4.44Å; I223-F228 HydrophobicContact CD1-CZ 4.42Å; I223-F228 HydrophobicContact CG2-CE2 4.04Å; I223-F228 HydrophobicContact CG2-CZ 4.44Å; N226-F228 PolarHBondContact O-N 3.09Å; F228-E230 PolarHBondContact O-N 2.85Å; F228-L231 HydrophobicContact CB-CD1 4.49Å; F228-L231 HydrophobicContact CD1-CD1 4.06Å; F228-L231 PolarHBondContact O-N 2.78Å; F228-L237 HydrophobicContact CE1-CD1 4.32Å; F228-L237 HydrophobicContact CE1-CD2 4.33Å; F228-L237 HydrophobicContact CE2-CD2 4.32Å; F228-L237 HydrophobicContact CZ-CD2 4.14Å; F228-L239 HydrophobicContact CZ-CD1 4.17Å; F228-I251 HydrophobicContact CD2-CD1 3.86Å; F228-I251 HydrophobicContact CD2-CG1 3.89Å; F228-I251 HydrophobicContact CE2-CD1 4.22Å; F228-I251 HydrophobicContact CE2-CG1 4.02Å; F228-F252 HydrophobicContact CD2-CD1 4.15Å; F228-F252 HydrophobicContact CD2-CE1 4.13Å; F228-F252 HydrophobicContact CE2-CD1 4.34Å; F228-F252 AromaticContact CE2-CE1 3.85Å; F228-F252 HydrophobicContact CE2-CE1 3.85Å; F228-S254 PolarHBondContact O-OG 2.99Å; F228-L255 HydrophobicContact CB-CD1 4.18Å; F228-L255 HydrophobicContact CB-CD2 4.08Å; F228-L255 HydrophobicContact CB-CG 4.39Å; F228-L255 WeakPolarHBondContact O-CD2 3.39Å
229	S	79.5	Confident	88.6	Confident	45 Å²	45	54.7 Å²	54.7	32%	0.315	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-42.7	-171.3	50	0	0	0	0	114.5	N226 S254	N226-S229 VanDerWaalsContact O-CB 3.25Å; N226-S229 WeakPolarHBondContact O-CB 3.32Å; N226-S229 PolarHBondContact O-N 3.21Å; N226-S229 PolarHBondContact O-OG 3.17Å; S229-S254 WeakPolarHBondContact O-CB 3.36Å
230	E	79	Confident	88.8	Confident	78 Å²	78	51.1 Å²	51.1	36%	0.364	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-13.2	-177	-51.7	-71.4	-170.5	0	0	114.1	R205 F228 T232	R205-E230 HydrophobicContact CG-CG 3.68Å; R205-E230 IonicContact CZ-OE1 2.77Å; R205-E230 IonicContact NE-OE1 3.83Å; R205-E230 PolarHBondContact NE-OE1 2.04Å; R205-E230 IonicContact NH2-OE1 3.94Å; R205-E230 PolarHBondContact NH2-OE1 3.2Å; F228-E230 PolarHBondContact O-N 2.85Å; E230-T232 PolarHBondContact O-N 3.22Å
231	L	88.8	Confident	88.8	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	26%	0.263	C	S	.	.			trans	-78.8	42.5	-169.4	-61.1	-176.9	0	0	0	114.3	L204 L207 L210 L213 F228 N233 L234 L255	L204-L231 HydrophobicContact CB-CD1 4.23Å; L204-L231 HydrophobicContact CD1-CD1 4.16Å; L207-L231 HydrophobicContact CB-CD2 4.15Å; L207-L231 WeakPolarHBondContact O-CD2 3.46Å; L210-L231 HydrophobicContact CB-CD2 4.47Å; L210-L231 HydrophobicContact CD2-CD2 4.49Å; L213-L231 HydrophobicContact CD2-CD1 4.24Å; F228-L231 HydrophobicContact CB-CD1 4.49Å; F228-L231 HydrophobicContact CD1-CD1 4.06Å; F228-L231 PolarHBondContact O-N 2.78Å; L231-N233 PolarHBondContact O-N 2.86Å; L231-L234 HydrophobicContact CB-CB 4.28Å; L231-L234 HydrophobicContact CD1-CD2 4.4Å; L231-L234 VanDerWaalsContact O-CB 3.23Å; L231-L234 WeakPolarHBondContact O-CB 3.43Å; L231-L234 PolarHBondContact O-N 2.97Å; L231-L255 HydrophobicContact CB-CD2 3.78Å; L231-L255 VanDerWaalsContact O-CD2 3.3Å; L231-L255 WeakPolarHBondContact O-CD2 3.21Å
232	T	85.4	Confident	89.3	Confident	72 Å²	72	51.1 Å²	51.1	44%	0.442	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-17	-173.7	57.3	0	0	0	0	115.9	E230 Q257	E230-T232 PolarHBondContact O-N 3.22Å; T232-Q257 PolarHBondContact O-NE2 2.93Å
233	N	90.4	Very high	89.9	Confident	54 Å²	54	48.1 Å²	48.1	29%	0.289	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-2.8	176.3	-72.7	-61	0	0	0	114.6	I208 L210 L231 R235 Q257	I208-N233 PolarHBondContact O-ND2 3.48Å; L210-N233 CarbonylContact O-C 3.04Å; L210-N233 VanDerWaalsContact O-C 3.31Å; L231-N233 PolarHBondContact O-N 2.86Å; N233-R235 WeakPolarHBondContact O-CG 3.44Å; N233-R235 PolarHBondContact O-N 2.04Å; N233-Q257 PolarHBondContact OD1-NE2 3.45Å
234	L	95.7	Very high	90.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.231	C	C	.	.			trans	-68.7	127.6	-173.7	-161.6	72.3	0	0	0	111.5	L210 L213 L231 L237 L255 Q257 L258	L210-L234 HydrophobicContact CB-CD1 4.33Å; L210-L234 HydrophobicContact CD2-CD1 4.12Å; L210-L234 HydrophobicContact CG-CD1 3.92Å; L210-L234 VanDerWaalsContact O-CA 3.31Å; L210-L234 WeakPolarHBondContact O-CA 3.13Å; L210-L234 PolarHBondContact O-N 3.14Å; L213-L234 HydrophobicContact CB-CD1 3.85Å; L213-L234 HydrophobicContact CB-CD2 4.31Å; L231-L234 HydrophobicContact CB-CB 4.28Å; L231-L234 HydrophobicContact CD1-CD2 4.4Å; L231-L234 VanDerWaalsContact O-CB 3.23Å; L231-L234 WeakPolarHBondContact O-CB 3.43Å; L231-L234 PolarHBondContact O-N 2.97Å; L234-L237 HydrophobicContact CD2-CB 3.98Å; L234-L237 HydrophobicContact CD2-CD1 4.28Å; L234-L237 HydrophobicContact CD2-CG 4.49Å; L234-L255 HydrophobicContact CB-CD2 4.23Å; L234-L255 HydrophobicContact CD2-CD1 4.28Å; L234-L255 HydrophobicContact CD2-CD2 4.4Å; L234-Q257 CarbonylContact O-C 3.53Å; L234-L258 VanDerWaalsContact O-CA 3.31Å; L234-L258 WeakPolarHBondContact O-CA 3.22Å; L234-L258 PolarHBondContact O-N 3.23Å; L234-L258 VanDerWaalsContact O-N 3.15Å
235	R	96.8	Very high	90.2	Very high	101 Å²	101	49.6 Å²	49.6	38%	0.381	24%	0.241	S	C	.	.			trans	-111.3	-23	-178.5	-57.4	-171.8	178.9	176.2	-2.3	113.2	K211 N233 Q257 Q259 R260	K211-R235 WeakPolarHBondContact O-CA 3.26Å; K211-R235 PolarHBondContact O-N 2.87Å; N233-R235 WeakPolarHBondContact O-CG 3.44Å; N233-R235 PolarHBondContact O-N 2.04Å; R235-Q257 WeakPolarHBondContact CA-O 3.27Å; R235-Q257 HydrophobicContact CG-CB 4.26Å; R235-Q257 VanDerWaalsContact NE-OE1 3.13Å; R235-Q259 PolarHBondContact O-N 2.98Å; R235-R260 PolarHBondContact O-N 3.31Å; R235-R260 VanDerWaalsContact O-N 3.12Å
236	R	98.2	Very high	90.5	Very high	133 Å²	133	46.7 Å²	46.7	50%	0.502	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	126.7	177.3	-58.5	-172.5	-176.2	91.8	-0.3	110.1	K211 T212 L213 R260	K211-R236 PolarHBondContact O-N 3.28Å; T212-R236 WeakPolarHBondContact CA-O 3.06Å; T212-R236 HydrophobicContact CG2-CB 4.09Å; L213-R236 PolarHBondContact N-O 2.91Å; R236-R260 WeakPolarHBondContact CA-O 3.18Å; R236-R260 HydrophobicContact CG-CB 4.38Å
237	L	97.8	Very high	90.9	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.9	171.9	179.2	56.5	0	0	0	108.8	L213 F228 L234 L239 F252 L255 L258 R260 L261 D262	L213-L237 HydrophobicContact CB-CD1 4Å; L213-L237 HydrophobicContact CD2-CD1 3.88Å; L213-L237 HydrophobicContact CG-CD1 3.95Å; L213-L237 WeakPolarHBondContact O-CA 3.48Å; F228-L237 HydrophobicContact CE1-CD1 4.32Å; F228-L237 HydrophobicContact CE1-CD2 4.33Å; F228-L237 HydrophobicContact CE2-CD2 4.32Å; F228-L237 HydrophobicContact CZ-CD2 4.14Å; L234-L237 HydrophobicContact CD2-CB 3.98Å; L234-L237 HydrophobicContact CD2-CD1 4.28Å; L234-L237 HydrophobicContact CD2-CG 4.49Å; L237-L239 HydrophobicContact CD1-CD1 4.5Å; L237-L239 HydrophobicContact CD1-CG 4.33Å; L237-L239 HydrophobicContact CD2-CD1 4.06Å; L237-L239 HydrophobicContact CG-CD1 4.21Å; L237-L239 HydrophobicContact CG-CG 4.37Å; L237-F252 HydrophobicContact CD2-CD1 4.1Å; L237-F252 HydrophobicContact CD2-CE1 3.74Å; L237-L255 HydrophobicContact CD2-CD1 4.26Å; L237-L258 HydrophobicContact CB-CD1 3.95Å; L237-R260 PolarHBondContact N-O 3.33Å; L237-L261 HydrophobicContact CB-CD1 3.99Å; L237-L261 HydrophobicContact CD2-CD1 3.93Å; L237-L261 HydrophobicContact CG-CD1 4Å; L237-L261 WeakPolarHBondContact O-CA 3.1Å; L237-D262 PolarHBondContact O-N 3.42Å
238	K	97.8	Very high	90.7	Very high	70 Å²	70	44.8 Å²	44.8	30%	0.304	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.7	168.8	-67.2	179	139	-76.5	0	110.3	L213 V214 L215 N240 D262	L213-K238 PolarHBondContact O-N 3.03Å; V214-K238 HydrophobicContact CB-CB 4.36Å; V214-K238 HydrophobicContact CB-CD 4.46Å; V214-K238 HydrophobicContact CG1-CB 4.06Å; V214-K238 HydrophobicContact CG1-CD 3.9Å; V214-K238 HydrophobicContact CG2-CB 4.23Å; V214-K238 HydrophobicContact CG2-CD 3.84Å; V214-K238 HydrophobicContact CG2-CG 4.25Å; L215-K238 PolarHBondContact N-O 3.02Å; K238-N240 PolarHBondContact NZ-OD1 2.99Å; K238-N240 VanDerWaalsContact NZ-OD1 3.1Å; K238-D262 HydrophobicContact CB-CB 4.2Å; K238-D262 WeakPolarHBondContact CE-OD2 3.34Å; K238-D262 HydrophobicContact CG-CB 3.78Å; K238-D262 IonicContact NZ-OD2 3.77Å; K238-D262 PolarHBondContact NZ-OD2 2.84Å
239	L	96.5	Very high	89.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.			trans	-126.3	13.6	173.3	-75.4	161.7	0	0	0	110.7	L215 I220 I223 F228 L237 N242 L244 F252 D262 L263 N266	L215-L239 HydrophobicContact CB-CD2 3.98Å; L215-L239 HydrophobicContact CD1-CD2 3.9Å; I220-L239 HydrophobicContact CD1-CD2 4.21Å; I223-L239 HydrophobicContact CD1-CD1 4.12Å; I223-L239 HydrophobicContact CD1-CD2 4.29Å; F228-L239 HydrophobicContact CZ-CD1 4.17Å; L237-L239 HydrophobicContact CD1-CD1 4.5Å; L237-L239 HydrophobicContact CD1-CG 4.33Å; L237-L239 HydrophobicContact CD2-CD1 4.06Å; L237-L239 HydrophobicContact CG-CD1 4.21Å; L237-L239 HydrophobicContact CG-CG 4.37Å; L239-N242 WeakPolarHBondContact O-CB 3.36Å; L239-N242 PolarHBondContact O-ND2 3.12Å; L239-L244 HydrophobicContact CB-CD1 4.4Å; L239-F252 HydrophobicContact CD1-CE1 4.48Å; L239-D262 PolarHBondContact N-O 3.18Å; L239-L263 HydrophobicContact CB-CD2 3.89Å; L239-L263 HydrophobicContact CD1-CD2 4Å; L239-N266 PolarHBondContact O-ND2 3.47Å
240	N	96.9	Very high	89.6	Confident	15 Å²	15	48.6 Å²	48.6	8%	0.08	24%	0.236	C	C	.	.			trans	-69.2	153.6	-176	76.5	-84.5	0	0	0	113.2	S216 N217 K238 D262 Q264	S216-N240 CarbonylContact C-O 3.13Å; S216-N240 WeakPolarHBondContact CA-O 3.24Å; S216-N240 WeakPolarHBondContact CB-O 3.23Å; S216-N240 PolarHBondContact OG-OD1 3.31Å; N217-N240 PolarHBondContact N-O 2.8Å; K238-N240 PolarHBondContact NZ-OD1 2.99Å; K238-N240 VanDerWaalsContact NZ-OD1 3.1Å; N240-D262 PolarHBondContact N-O 3.06Å; N240-Q264 CarbonylContact C-O 3.49Å; N240-Q264 WeakPolarHBondContact CA-O 3.46Å; N240-Q264 HydrophobicContact CB-CB 4.11Å; N240-Q264 VanDerWaalsContact CB-O 3.29Å; N240-Q264 WeakPolarHBondContact CB-O 3.43Å
241	L	95.5	Very high	89.9	Confident	77 Å²	77	45 Å²	45	40%	0.403	22%	0.219	S	C	.	.	S	Bend	trans	59.3	68	-170.9	-63.6	158.6	0	0	0	110.5	N217 N218 Q264 D265	N217-L241 CarbonylContact C-O 3.6Å; N217-L241 WeakPolarHBondContact CA-O 3.42Å; N217-L241 HydrophobicContact CB-CB 4.09Å; N217-L241 HydrophobicContact CB-CD1 4.29Å; N217-L241 PolarHBondContact N-O 3.21Å; N218-L241 PolarHBondContact N-O 3.38Å; N218-L241 VanDerWaalsContact N-O 3.08Å; L241-Q264 PolarHBondContact N-O 2.94Å; L241-Q264 VanDerWaalsContact N-O 3.16Å; L241-D265 WeakPolarHBondContact CA-O 3.46Å; L241-D265 HydrophobicContact CB-CB 4.43Å; L241-D265 HydrophobicContact CD2-CB 3.63Å; L241-D265 HydrophobicContact CG-CB 3.83Å; L241-D265 PolarHBondContact N-O 2.78Å
242	N	96.8	Very high	90	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.032	22%	0.219	C	C	.	.	S	Bend	trans	-145.8	-171.6	177.3	-87.1	-69.3	0	0	0	110	L215 N218 K219 I220 L239 L244 D265 N266	L215-N242 PolarHBondContact O-ND2 3.01Å; N218-N242 WeakPolarHBondContact CA-OD1 3.35Å; N218-N242 WeakPolarHBondContact CB-OD1 3.29Å; N218-N242 PolarHBondContact N-OD1 3.02Å; N218-N242 PolarHBondContact O-OD1 3.08Å; K219-N242 PolarHBondContact N-OD1 2.84Å; I220-N242 HydrophobicContact CB-CB 4.35Å; I220-N242 WeakPolarHBondContact CB-OD1 3.44Å; I220-N242 VanDerWaalsContact CG1-OD1 3.3Å; I220-N242 WeakPolarHBondContact CG1-OD1 3.38Å; I220-N242 PolarHBondContact N-OD1 3.29Å; L239-N242 WeakPolarHBondContact O-CB 3.36Å; L239-N242 PolarHBondContact O-ND2 3.12Å; N242-L244 HydrophobicContact CB-CG 4.5Å; N242-D265 PolarHBondContact N-O 2.86Å; N242-D265 VanDerWaalsContact N-O 3.12Å; N242-N266 WeakPolarHBondContact CA-OD1 3.34Å; N242-N266 WeakPolarHBondContact CB-OD1 3.05Å; N242-N266 PolarHBondContact O-OD1 2.86Å
243	L	94.6	Very high	89.8	Confident	64 Å²	64	44 Å²	44	34%	0.335	22%	0.215	S	C	.	.			trans	-115.1	16	-172.8	-60.1	178.5	0	0	0	113.2	K219 I220 E221 Q245	K219-L243 HydrophobicContact CB-CD1 4.16Å; I220-L243 CarbonylContact O-C 3.1Å; I220-L243 VanDerWaalsContact O-C 3.26Å; I220-L243 WeakPolarHBondContact O-CA 3.41Å; I220-L243 PolarHBondContact O-N 3.39Å; E221-L243 HydrophobicContact CG-CB 3.63Å; E221-L243 HydrophobicContact CG-CD1 4.04Å; E221-L243 HydrophobicContact CG-CG 4.48Å; L243-Q245 PolarHBondContact O-N 2.83Å
244	L	93.5	Very high	89.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.209	C	C	.	.			trans	-61.5	122.2	-175.4	-60.2	169.5	0	0	0	111	I220 I223 L239 N242 L247 L263 N266 K267 L268	I220-L244 HydrophobicContact CB-CD2 4.45Å; I220-L244 HydrophobicContact CG2-CD2 3.81Å; I220-L244 PolarHBondContact O-N 2.88Å; I220-L244 VanDerWaalsContact O-N 3.09Å; I223-L244 HydrophobicContact CD1-CD1 4.14Å; I223-L244 HydrophobicContact CD1-CD2 3.86Å; I223-L244 HydrophobicContact CG1-CD2 3.88Å; L239-L244 HydrophobicContact CB-CD1 4.4Å; N242-L244 HydrophobicContact CB-CG 4.5Å; L244-L247 HydrophobicContact CD1-CD2 4.27Å; L244-L263 HydrophobicContact CD1-CD2 4.21Å; L244-N266 HydrophobicContact CB-CB 4.46Å; L244-N266 VanDerWaalsContact CB-OD1 3.29Å; L244-N266 WeakPolarHBondContact CB-OD1 3.44Å; L244-N266 WeakPolarHBondContact CG-OD1 3.07Å; L244-N266 PolarHBondContact N-OD1 3.26Å; L244-N266 VanDerWaalsContact N-OD1 3.15Å; L244-K267 CarbonylContact O-C 3.5Å; L244-K267 VanDerWaalsContact O-CA 3.27Å; L244-K267 WeakPolarHBondContact O-CA 3.47Å; L244-K267 WeakPolarHBondContact O-CB 3.38Å; L244-K267 PolarHBondContact O-N 2.87Å; L244-L268 HydrophobicContact CB-CD2 3.9Å; L244-L268 HydrophobicContact CB-CG 4.42Å; L244-L268 PolarHBondContact O-N 3.32Å
245	Q	84	Confident	89.2	Confident	118 Å²	118	42.5 Å²	42.5	55%	0.551	21%	0.209	S	C	*	.			trans	-98.3	-32.6	178	-59.5	-178.3	31.6	0	0	112.5	L243 K267 L268 V269	L243-Q245 PolarHBondContact O-N 2.83Å; Q245-K267 HydrophobicContact CG-CB 4.07Å; Q245-L268 WeakPolarHBondContact O-CA 3.31Å; Q245-V269 PolarHBondContact O-N 3.12Å
246	T	79.6	Confident	88.8	Confident	52 Å²	52	44.6 Å²	44.6	32%	0.319	22%	0.221	S	C	.	.			trans	-138.8	170.8	175.7	58.9	0	0	0	0	109.9	L386	T246-L386 HydrophobicContact CG2-CB 4.26Å; T246-L386 HydrophobicContact CG2-CD2 4.27Å
247	L	86.9	Confident	88.5	Confident	13 Å²	13	40.9 Å²	40.9	7%	0.068	21%	0.209	C	C	.	.			trans	-133.6	143	171.2	-75.8	171.2	0	0	0	109	I223 L244 F252 L263 L268 L271 L275	I223-L247 HydrophobicContact CD1-CD2 4.15Å; L244-L247 HydrophobicContact CD1-CD2 4.27Å; L247-F252 HydrophobicContact CD1-CE2 4.13Å; L247-F252 HydrophobicContact CD1-CZ 4.23Å; L247-L263 HydrophobicContact CD1-CD1 3.94Å; L247-L263 HydrophobicContact CD1-CD2 4.22Å; L247-L268 HydrophobicContact CD1-CD1 4.46Å; L247-L268 HydrophobicContact CD1-CD2 4.3Å; L247-L268 HydrophobicContact CG-CD2 4Å; L247-L271 HydrophobicContact CD1-CD2 4.3Å; L247-L275 HydrophobicContact CB-CD1 4.08Å; L247-L275 HydrophobicContact CD1-CD1 4.32Å; L247-L275 HydrophobicContact CD1-CD2 4.09Å
248	P	80.1	Confident	88.4	Confident	36 Å²	36	40.9 Å²	40.9	23%	0.234	21%	0.209	C	C	.	.			trans	-61.4	151.8	173.4	-17.7	29.5	0	0	0	111.6	I223 E225 I251	I223-P248 WeakPolarHBondContact O-CG 3.4Å; E225-P248 HydrophobicContact CB-CB 4.5Å; E225-P248 HydrophobicContact CG-CB 4.36Å; P248-I251 HydrophobicContact CB-CB 4.25Å; P248-I251 HydrophobicContact CG-CB 4.43Å; P248-I251 VanDerWaalsContact O-CG2 3.27Å; P248-I251 WeakPolarHBondContact O-CG2 3.37Å
249	E	72.8	Confident	88.3	Confident	81 Å²	81	40 Å²	40	38%	0.379	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	146.1	166.8	-68.9	-119.7	162.7	0	0	110.8	I251 P272 S274	E249-I251 PolarHBondContact O-N 2.84Å; E249-P272 HydrophobicContact CG-CB 4.03Å; E249-P272 HydrophobicContact CG-CG 4.28Å; E249-P272 WeakPolarHBondContact OE1-CB 3.27Å; E249-S274 WeakPolarHBondContact OE2-CB 3.33Å; E249-S274 PolarHBondContact OE2-OG 3.44Å
250	N	75.3	Confident	88.4	Confident	45 Å²	45	44.4 Å²	44.4	24%	0.241	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	7	173	-52.8	-78.2	0	0	0	117.3	F252 S253	N250-F252 PolarHBondContact O-N 3.11Å; N250-S253 WeakPolarHBondContact O-CB 3.32Å; N250-S253 PolarHBondContact O-N 3.21Å; N250-S253 PolarHBondContact O-OG 2.81Å
251	I	84.6	Confident	88.4	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-24.2	-177	-177.2	55.7	0	0	0	114.7	I223 E224 E225 F228 P248 E249 L275	I223-I251 HydrophobicContact CG2-CD1 3.87Å; I223-I251 HydrophobicContact CG2-CG1 4.2Å; E224-I251 VanDerWaalsContact O-CD1 3.23Å; E224-I251 WeakPolarHBondContact O-CD1 3.44Å; E225-I251 VanDerWaalsContact O-CD1 3.23Å; E225-I251 WeakPolarHBondContact O-CD1 3.49Å; F228-I251 HydrophobicContact CD2-CD1 3.86Å; F228-I251 HydrophobicContact CD2-CG1 3.89Å; F228-I251 HydrophobicContact CE2-CD1 4.22Å; F228-I251 HydrophobicContact CE2-CG1 4.02Å; P248-I251 HydrophobicContact CB-CB 4.25Å; P248-I251 HydrophobicContact CG-CB 4.43Å; P248-I251 VanDerWaalsContact O-CG2 3.27Å; P248-I251 WeakPolarHBondContact O-CG2 3.37Å; E249-I251 PolarHBondContact O-N 2.84Å; I251-L275 HydrophobicContact CG2-CD1 3.62Å
252	F	90.8	Very high	88.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-2.8	177.5	-53.9	-52.2	0	0	0	114.3	F228 L237 L239 L247 N250 S254 L255 L261 L263 L275 F276 L279	F228-F252 HydrophobicContact CD2-CD1 4.15Å; F228-F252 HydrophobicContact CD2-CE1 4.13Å; F228-F252 HydrophobicContact CE2-CD1 4.34Å; F228-F252 AromaticContact CE2-CE1 3.85Å; F228-F252 HydrophobicContact CE2-CE1 3.85Å; L237-F252 HydrophobicContact CD2-CD1 4.1Å; L237-F252 HydrophobicContact CD2-CE1 3.74Å; L239-F252 HydrophobicContact CD1-CE1 4.48Å; L247-F252 HydrophobicContact CD1-CE2 4.13Å; L247-F252 HydrophobicContact CD1-CZ 4.23Å; N250-F252 PolarHBondContact O-N 3.11Å; F252-S254 PolarHBondContact O-N 3.07Å; F252-S254 VanDerWaalsContact O-N 3.08Å; F252-L255 HydrophobicContact CB-CD1 4.24Å; F252-L255 HydrophobicContact CD1-CD1 3.96Å; F252-L255 VanDerWaalsContact O-CB 3.28Å; F252-L255 WeakPolarHBondContact O-CB 3.43Å; F252-L255 WeakPolarHBondContact O-CG 3.24Å; F252-L255 PolarHBondContact O-N 3.47Å; F252-L261 HydrophobicContact CD2-CD2 4.04Å; F252-L261 HydrophobicContact CE1-CD1 4.4Å; F252-L261 HydrophobicContact CE2-CD2 3.79Å; F252-L261 HydrophobicContact CZ-CD1 4.25Å; F252-L261 HydrophobicContact CZ-CD2 4.22Å; F252-L263 HydrophobicContact CE2-CD1 4.37Å; F252-L263 HydrophobicContact CZ-CD1 4.45Å; F252-L275 HydrophobicContact CD2-CD1 3.95Å; F252-L275 HydrophobicContact CD2-CG 4.08Å; F252-L275 HydrophobicContact CE2-CD1 3.89Å; F252-L275 HydrophobicContact CE2-CD2 4.46Å; F252-L275 HydrophobicContact CE2-CG 4.13Å; F252-F276 HydrophobicContact CD2-CD1 4.19Å; F252-F276 HydrophobicContact CD2-CE1 4.07Å; F252-F276 HydrophobicContact CE2-CE1 4.23Å; F252-L279 HydrophobicContact CB-CD1 3.93Å; F252-L279 WeakPolarHBondContact O-CD2 3.44Å
253	S	82.4	Confident	88.6	Confident	52 Å²	52	39.9 Å²	39.9	36%	0.364	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.3	-170.2	63.7	0	0	0	0	115.4	N250 L255	N250-S253 WeakPolarHBondContact O-CB 3.32Å; N250-S253 PolarHBondContact O-N 3.21Å; N250-S253 PolarHBondContact O-OG 2.81Å; S253-L255 VanDerWaalsContact C-N 3.35Å
254	S	82	Confident	88.7	Confident	23 Å²	23	38.2 Å²	38.2	16%	0.161	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.8	170.8	56.6	0	0	0	0	113.5	F228 S229 F252 K256	F228-S254 PolarHBondContact O-OG 2.99Å; S229-S254 WeakPolarHBondContact O-CB 3.36Å; F252-S254 PolarHBondContact O-N 3.07Å; F252-S254 VanDerWaalsContact O-N 3.08Å; S254-K256 PolarHBondContact O-N 3.34Å
255	L	91.3	Very high	88.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.199	C	C	.	.			trans	-84	52.5	-163.7	-52.6	-178.9	0	0	0	112.6	F228 L231 L234 L237 F252 S253 Q257 L258 L279	F228-L255 HydrophobicContact CB-CD1 4.18Å; F228-L255 HydrophobicContact CB-CD2 4.08Å; F228-L255 HydrophobicContact CB-CG 4.39Å; F228-L255 WeakPolarHBondContact O-CD2 3.39Å; L231-L255 HydrophobicContact CB-CD2 3.78Å; L231-L255 VanDerWaalsContact O-CD2 3.3Å; L231-L255 WeakPolarHBondContact O-CD2 3.21Å; L234-L255 HydrophobicContact CB-CD2 4.23Å; L234-L255 HydrophobicContact CD2-CD1 4.28Å; L234-L255 HydrophobicContact CD2-CD2 4.4Å; L237-L255 HydrophobicContact CD2-CD1 4.26Å; F252-L255 HydrophobicContact CB-CD1 4.24Å; F252-L255 HydrophobicContact CD1-CD1 3.96Å; F252-L255 VanDerWaalsContact O-CB 3.28Å; F252-L255 WeakPolarHBondContact O-CB 3.43Å; F252-L255 WeakPolarHBondContact O-CG 3.24Å; F252-L255 PolarHBondContact O-N 3.47Å; S253-L255 VanDerWaalsContact C-N 3.35Å; L255-Q257 PolarHBondContact O-N 2.75Å; L255-L258 HydrophobicContact CB-CB 3.99Å; L255-L258 HydrophobicContact CB-CD2 4.38Å; L255-L258 HydrophobicContact CD1-CD2 4.2Å; L255-L258 WeakPolarHBondContact O-CB 3.48Å; L255-L258 PolarHBondContact O-N 3.15Å; L255-L279 HydrophobicContact CB-CD2 4.28Å; L255-L279 VanDerWaalsContact O-CD2 3.28Å; L255-L279 WeakPolarHBondContact O-CD2 3.03Å
256	K	87.1	Confident	89.5	Confident	146 Å²	146	34.4 Å²	34.4	64%	0.635	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.2	-170.6	-64.8	174.1	-176.6	175.5	0	115.2	S254	S254-K256 PolarHBondContact O-N 3.34Å
257	Q	91.3	Very high	90.1	Very high	55 Å²	55	36.3 Å²	36.3	26%	0.257	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	3.2	172.4	-71.8	-173.8	60.6	0	0	114.3	T232 N233 L234 R235 L255 Q259	T232-Q257 PolarHBondContact O-NE2 2.93Å; N233-Q257 PolarHBondContact OD1-NE2 3.45Å; L234-Q257 CarbonylContact O-C 3.53Å; R235-Q257 WeakPolarHBondContact CA-O 3.27Å; R235-Q257 HydrophobicContact CG-CB 4.26Å; R235-Q257 VanDerWaalsContact NE-OE1 3.13Å; L255-Q257 PolarHBondContact O-N 2.75Å; Q257-Q259 PolarHBondContact O-N 2.78Å
258	L	96.2	Very high	90.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.173	C	C	.	.			trans	-67.6	120.6	-173.8	-167.9	69	0	0	0	111	L234 L237 L255 L261 L279 E281 L282	L234-L258 VanDerWaalsContact O-CA 3.31Å; L234-L258 WeakPolarHBondContact O-CA 3.22Å; L234-L258 PolarHBondContact O-N 3.23Å; L234-L258 VanDerWaalsContact O-N 3.15Å; L237-L258 HydrophobicContact CB-CD1 3.95Å; L255-L258 HydrophobicContact CB-CB 3.99Å; L255-L258 HydrophobicContact CB-CD2 4.38Å; L255-L258 HydrophobicContact CD1-CD2 4.2Å; L255-L258 WeakPolarHBondContact O-CB 3.48Å; L255-L258 PolarHBondContact O-N 3.15Å; L258-L261 HydrophobicContact CD2-CB 4.24Å; L258-L279 HydrophobicContact CB-CD2 4.47Å; L258-L279 HydrophobicContact CD2-CD1 4.38Å; L258-E281 CarbonylContact O-C 3.29Å; L258-E281 VanDerWaalsContact O-C 3.26Å; L258-L282 HydrophobicContact CD2-CD1 4.31Å; L258-L282 HydrophobicContact CG-CD1 4.17Å; L258-L282 WeakPolarHBondContact O-CA 3.41Å; L258-L282 PolarHBondContact O-N 3.25Å; L258-L282 VanDerWaalsContact O-N 3.16Å
259	Q	96.8	Very high	90.7	Very high	52 Å²	52	35.5 Å²	35.5	24%	0.243	17%	0.172	C	C	.	.			trans	-109.4	-24.9	-177.4	-72.4	176.7	-11.9	0	0	113	R235 Q257 E281 R283 F284	R235-Q259 PolarHBondContact O-N 2.98Å; Q257-Q259 PolarHBondContact O-N 2.78Å; Q259-E281 HydrophobicContact CG-CB 4.19Å; Q259-E281 WeakPolarHBondContact CG-O 3.44Å; Q259-E281 PolarHBondContact NE2-OE2 3.28Å; Q259-R283 PolarHBondContact O-N 3.5Å; Q259-F284 PolarHBondContact O-N 2.98Å; Q259-F284 VanDerWaalsContact O-N 3.12Å
260	R	98.2	Very high	91.2	Very high	91 Å²	91	31.9 Å²	31.9	34%	0.343	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	127.4	175.8	-176.3	167.3	-172	120.9	-13.9	111.7	R235 R236 L237 F284	R235-R260 PolarHBondContact O-N 3.31Å; R235-R260 VanDerWaalsContact O-N 3.12Å; R236-R260 WeakPolarHBondContact CA-O 3.18Å; R236-R260 HydrophobicContact CG-CB 4.38Å; L237-R260 PolarHBondContact N-O 3.33Å; R260-F284 WeakPolarHBondContact CA-O 3.02Å; R260-F284 HydrophobicContact CB-CB 4.05Å; R260-F284 HydrophobicContact CG-CB 3.75Å; R260-F284 VanDerWaalsContact NH1-CD1 3.33Å
261	L	97.6	Very high	91.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	134.1	173.3	-179.7	59.8	0	0	0	109.3	L237 F252 L258 L263 F276 L282 F284 L286	L237-L261 HydrophobicContact CB-CD1 3.99Å; L237-L261 HydrophobicContact CD2-CD1 3.93Å; L237-L261 HydrophobicContact CG-CD1 4Å; L237-L261 WeakPolarHBondContact O-CA 3.1Å; F252-L261 HydrophobicContact CD2-CD2 4.04Å; F252-L261 HydrophobicContact CE1-CD1 4.4Å; F252-L261 HydrophobicContact CE2-CD2 3.79Å; F252-L261 HydrophobicContact CZ-CD1 4.25Å; F252-L261 HydrophobicContact CZ-CD2 4.22Å; L258-L261 HydrophobicContact CD2-CB 4.24Å; L261-L263 HydrophobicContact CD1-CD1 4.37Å; L261-L263 HydrophobicContact CD1-CG 4.24Å; L261-L263 HydrophobicContact CD2-CD1 3.79Å; L261-L263 HydrophobicContact CD2-CG 4.49Å; L261-L263 HydrophobicContact CG-CD1 3.98Å; L261-L263 HydrophobicContact CG-CG 4.15Å; L261-F276 HydrophobicContact CD2-CD1 4.32Å; L261-F276 HydrophobicContact CD2-CE1 3.52Å; L261-F276 HydrophobicContact CD2-CZ 4.19Å; L261-L282 HydrophobicContact CB-CD1 4.28Å; L261-F284 PolarHBondContact N-O 3.45Å; L261-L286 PolarHBondContact O-N 3.02Å
262	D	97.8	Very high	91.5	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	105.9	-177	-160.1	-17.6	0	0	0	110.2	L237 K238 L239 N240 Q264 L286	L237-D262 PolarHBondContact O-N 3.42Å; K238-D262 HydrophobicContact CB-CB 4.2Å; K238-D262 WeakPolarHBondContact CE-OD2 3.34Å; K238-D262 HydrophobicContact CG-CB 3.78Å; K238-D262 IonicContact NZ-OD2 3.77Å; K238-D262 PolarHBondContact NZ-OD2 2.84Å; L239-D262 PolarHBondContact N-O 3.18Å; N240-D262 PolarHBondContact N-O 3.06Å; D262-Q264 WeakPolarHBondContact OD1-CG 3.11Å; D262-Q264 PolarHBondContact OD1-NE2 3.16Å; D262-L286 HydrophobicContact CB-CD1 4.12Å
263	L	96.9	Very high	90.8	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.			trans	-120.7	15.3	-175.6	-76.8	166.5	0	0	0	111.5	L239 L244 L247 F252 L261 N266 L268 L286 L287 N290	L239-L263 HydrophobicContact CB-CD2 3.89Å; L239-L263 HydrophobicContact CD1-CD2 4Å; L244-L263 HydrophobicContact CD1-CD2 4.21Å; L247-L263 HydrophobicContact CD1-CD1 3.94Å; L247-L263 HydrophobicContact CD1-CD2 4.22Å; F252-L263 HydrophobicContact CE2-CD1 4.37Å; F252-L263 HydrophobicContact CZ-CD1 4.45Å; L261-L263 HydrophobicContact CD1-CD1 4.37Å; L261-L263 HydrophobicContact CD1-CG 4.24Å; L261-L263 HydrophobicContact CD2-CD1 3.79Å; L261-L263 HydrophobicContact CD2-CG 4.49Å; L261-L263 HydrophobicContact CG-CD1 3.98Å; L261-L263 HydrophobicContact CG-CG 4.15Å; L263-N266 PolarHBondContact O-ND2 2.94Å; L263-L268 HydrophobicContact CB-CD1 4.24Å; L263-L268 HydrophobicContact CD2-CD1 4.46Å; L263-L286 CarbonylContact C-O 3.37Å; L263-L286 WeakPolarHBondContact CA-O 3.42Å; L263-L286 PolarHBondContact N-O 2.97Å; L263-L287 HydrophobicContact CB-CD2 3.77Å; L263-L287 HydrophobicContact CD1-CD2 4.04Å; L263-N290 PolarHBondContact O-ND2 3.22Å
264	Q	97	Very high	90.5	Very high	29 Å²	29	29.8 Å²	29.8	14%	0.136	15%	0.148	C	C	.	.			trans	-59.6	163.9	178.6	-63.9	174.7	90.6	0	0	112.4	N240 L241 D262 N266 L286 A288 R289	N240-Q264 CarbonylContact C-O 3.49Å; N240-Q264 WeakPolarHBondContact CA-O 3.46Å; N240-Q264 HydrophobicContact CB-CB 4.11Å; N240-Q264 VanDerWaalsContact CB-O 3.29Å; N240-Q264 WeakPolarHBondContact CB-O 3.43Å; L241-Q264 PolarHBondContact N-O 2.94Å; L241-Q264 VanDerWaalsContact N-O 3.16Å; D262-Q264 WeakPolarHBondContact OD1-CG 3.11Å; D262-Q264 PolarHBondContact OD1-NE2 3.16Å; Q264-N266 VanDerWaalsContact C-N 3.32Å; Q264-N266 PolarHBondContact O-N 2.92Å; Q264-N266 PolarHBondContact O-ND2 3.09Å; Q264-L286 HydrophobicContact CG-CB 3.67Å; Q264-L286 PolarHBondContact N-O 2.94Å; Q264-A288 CarbonylContact C-O 3.52Å; Q264-A288 WeakPolarHBondContact CA-O 3.44Å; Q264-A288 VanDerWaalsContact CB-O 3.32Å; Q264-A288 WeakPolarHBondContact CB-O 3.45Å; Q264-A288 HydrophobicContact CG-CB 4.17Å; Q264-R289 VanDerWaalsContact OE1-NH2 3.15Å
265	D	96.8	Very high	90.6	Very high	39 Å²	39	28.8 Å²	28.8	21%	0.209	14%	0.14	C	C	.	.	S	Bend	trans	54.8	48.1	170.3	-58.3	-82	0	0	0	112.3	L241 N242 A288 R289	L241-D265 WeakPolarHBondContact CA-O 3.46Å; L241-D265 HydrophobicContact CB-CB 4.43Å; L241-D265 HydrophobicContact CD2-CB 3.63Å; L241-D265 HydrophobicContact CG-CB 3.83Å; L241-D265 PolarHBondContact N-O 2.78Å; N242-D265 PolarHBondContact N-O 2.86Å; N242-D265 VanDerWaalsContact N-O 3.12Å; D265-A288 PolarHBondContact N-O 2.8Å; D265-R289 VanDerWaalsContact CA-O 3.28Å; D265-R289 WeakPolarHBondContact CA-O 3.42Å; D265-R289 PolarHBondContact N-O 2.93Å; D265-R289 WeakPolarHBondContact OD1-CD 3.45Å; D265-R289 IonicContact OD1-CZ 3.89Å; D265-R289 IonicContact OD1-NE 3.57Å; D265-R289 PolarHBondContact OD1-NE 2.8Å; D265-R289 IonicContact OD1-NH2 2.86Å; D265-R289 IonicContact OD2-CZ 3.32Å; D265-R289 IonicContact OD2-NE 3.19Å; D265-R289 IonicContact OD2-NH2 3.36Å; D265-R289 PolarHBondContact OD2-NH2 2.9Å
266	N	97.1	Very high	90.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-121.9	-157.2	177.7	-91.3	-89.1	0	0	0	109.3	L239 N242 L244 L263 Q264 L268 R289 N290	L239-N266 PolarHBondContact O-ND2 3.47Å; N242-N266 WeakPolarHBondContact CA-OD1 3.34Å; N242-N266 WeakPolarHBondContact CB-OD1 3.05Å; N242-N266 PolarHBondContact O-OD1 2.86Å; L244-N266 HydrophobicContact CB-CB 4.46Å; L244-N266 VanDerWaalsContact CB-OD1 3.29Å; L244-N266 WeakPolarHBondContact CB-OD1 3.44Å; L244-N266 WeakPolarHBondContact CG-OD1 3.07Å; L244-N266 PolarHBondContact N-OD1 3.26Å; L244-N266 VanDerWaalsContact N-OD1 3.15Å; L263-N266 PolarHBondContact O-ND2 2.94Å; Q264-N266 VanDerWaalsContact C-N 3.32Å; Q264-N266 PolarHBondContact O-N 2.92Å; Q264-N266 PolarHBondContact O-ND2 3.09Å; N266-L268 HydrophobicContact CB-CD1 4.37Å; N266-L268 HydrophobicContact CB-CG 4.21Å; N266-R289 PolarHBondContact N-O 2.69Å; N266-N290 VanDerWaalsContact CA-OD1 3.32Å; N266-N290 WeakPolarHBondContact CA-OD1 3.42Å; N266-N290 WeakPolarHBondContact CB-OD1 3.45Å; N266-N290 PolarHBondContact N-OD1 2.04Å
267	K	93	Very high	90	Very high	91 Å²	91	24.5 Å²	24.5	40%	0.396	13%	0.128	S	C	.	.			trans	-126.1	17.4	179.2	-58	-68.4	153	-114.3	0	112.2	L244 Q245 V269 N290 N291	L244-K267 CarbonylContact O-C 3.5Å; L244-K267 VanDerWaalsContact O-CA 3.27Å; L244-K267 WeakPolarHBondContact O-CA 3.47Å; L244-K267 WeakPolarHBondContact O-CB 3.38Å; L244-K267 PolarHBondContact O-N 2.87Å; Q245-K267 HydrophobicContact CG-CB 4.07Å; K267-V269 WeakPolarHBondContact O-CG2 3.33Å; K267-V269 PolarHBondContact O-N 2.96Å; K267-N290 PolarHBondContact N-OD1 3.27Å; K267-N291 PolarHBondContact O-ND2 3.34Å; K267-N291 VanDerWaalsContact O-ND2 3.09Å
268	L	93.1	Very high	89.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.129	C	C	.	.			trans	-61.6	122.2	-171.4	-62.8	166.7	0	0	0	110.5	L244 Q245 L247 L263 N266 L271 L287 N290 N291 L292	L244-L268 HydrophobicContact CB-CD2 3.9Å; L244-L268 HydrophobicContact CB-CG 4.42Å; L244-L268 PolarHBondContact O-N 3.32Å; Q245-L268 WeakPolarHBondContact O-CA 3.31Å; L247-L268 HydrophobicContact CD1-CD1 4.46Å; L247-L268 HydrophobicContact CD1-CD2 4.3Å; L247-L268 HydrophobicContact CG-CD2 4Å; L263-L268 HydrophobicContact CB-CD1 4.24Å; L263-L268 HydrophobicContact CD2-CD1 4.46Å; N266-L268 HydrophobicContact CB-CD1 4.37Å; N266-L268 HydrophobicContact CB-CG 4.21Å; L268-L271 HydrophobicContact CD1-CD2 4.3Å; L268-L287 HydrophobicContact CD1-CD2 4.39Å; L268-N290 HydrophobicContact CB-CB 4.32Å; L268-N290 WeakPolarHBondContact CB-OD1 3.36Å; L268-N290 WeakPolarHBondContact CG-OD1 3.43Å; L268-N290 PolarHBondContact N-OD1 3.41Å; L268-N291 CarbonylContact O-C 3.56Å; L268-N291 VanDerWaalsContact O-CA 3.29Å; L268-N291 WeakPolarHBondContact O-CA 3.48Å; L268-N291 WeakPolarHBondContact O-CB 3.1Å; L268-N291 PolarHBondContact O-N 3.2Å; L268-L292 HydrophobicContact CB-CD2 4.05Å; L268-L292 WeakPolarHBondContact O-CD2 3.29Å; L268-L292 PolarHBondContact O-N 3.2Å; L268-L292 VanDerWaalsContact O-N 3.15Å
269	V	86.4	Confident	89	Confident	32 Å²	32	23.1 Å²	23.1	19%	0.194	13%	0.129	C	C	.	.			trans	-95.5	-37.8	-178	-171.5	0	0	0	0	111.8	Q245 K267 N291 L292 I293 L386	Q245-V269 PolarHBondContact O-N 3.12Å; K267-V269 WeakPolarHBondContact O-CG2 3.33Å; K267-V269 PolarHBondContact O-N 2.96Å; V269-N291 HydrophobicContact CG2-CB 4.12Å; V269-L292 WeakPolarHBondContact O-CA 3.29Å; V269-I293 HydrophobicContact CG1-CD1 4.41Å; V269-I293 HydrophobicContact CG1-CG1 4.48Å; V269-I293 PolarHBondContact O-N 3.43Å; V269-L386 HydrophobicContact CB-CD1 4.06Å; V269-L386 HydrophobicContact CG1-CD1 4.29Å; V269-L386 HydrophobicContact CG2-CD1 4.48Å
270	C	83.8	Confident	88.5	Confident	6 Å²	6	25.1 Å²	25.1	4%	0.041	14%	0.142	C	C	.	.			trans	-146.6	155.7	-178.1	-50.6	0	0	0	0	109.9	C383 I387	C270-C383 HydrophobicContact CB-CB 3.77Å; C270-C383 WeakPolarHBondContact CB-SG 3.44Å; C270-C383 WeakPolarHBondContact SG-CA 3.5Å; C270-C383 WeakPolarHBondContact SG-CB 3.4Å; C270-C383 CovalentContact SG-SG 2.03Å; C270-C383 PolarHBondContact SG-SG 3.22Å; C270-I387 HydrophobicContact CB-CD1 4.44Å
271	L	87.4	Confident	88.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.139	C	C	.	.			trans	-126	137.1	175.2	-59	178.4	0	0	0	110.4	L247 L268 L275 L287 L292 L295 P296 L299	L247-L271 HydrophobicContact CD1-CD2 4.3Å; L268-L271 HydrophobicContact CD1-CD2 4.3Å; L271-L275 HydrophobicContact CB-CD2 4.11Å; L271-L275 HydrophobicContact CD1-CD2 4.24Å; L271-L275 HydrophobicContact CD2-CD2 3.9Å; L271-L275 HydrophobicContact CG-CD2 4.3Å; L271-L287 HydrophobicContact CD1-CD1 3.9Å; L271-L287 HydrophobicContact CD1-CD2 4.04Å; L271-L292 HydrophobicContact CD1-CD1 4.49Å; L271-L292 HydrophobicContact CD1-CD2 4.32Å; L271-L292 HydrophobicContact CD2-CD2 4.35Å; L271-L292 HydrophobicContact CG-CD2 3.87Å; L271-L295 HydrophobicContact CB-CD2 4.42Å; L271-L295 HydrophobicContact CD1-CD2 3.87Å; L271-L295 HydrophobicContact CG-CD2 4.26Å; L271-P296 WeakPolarHBondContact O-CD 3.34Å; L271-L299 HydrophobicContact CD1-CD2 4.17Å
272	P	79.3	Confident	88	Confident	11 Å²	11	23.8 Å²	23.8	7%	0.071	14%	0.139	C	C	.	.			trans	-71.6	147.5	175.4	27.8	-31.1	0	0	0	111.3	E249 S274 L275	E249-P272 HydrophobicContact CG-CB 4.03Å; E249-P272 HydrophobicContact CG-CG 4.28Å; E249-P272 WeakPolarHBondContact OE1-CB 3.27Å; P272-S274 VanDerWaalsContact C-N 3.26Å; P272-S274 PolarHBondContact O-N 3.32Å; P272-L275 HydrophobicContact CG-CB 4.18Å; P272-L275 HydrophobicContact CG-CD1 4.37Å; P272-L275 VanDerWaalsContact O-CB 3.23Å; P272-L275 WeakPolarHBondContact O-CB 3.02Å; P272-L275 PolarHBondContact O-N 3.4Å
273	G	75.2	Confident	87.9	Confident	20 Å²	20	26.4 Å²	26.4	21%	0.206	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-64	-28.9	-177.5	0	0	0	0	0	114	L275	G273-L275 VanDerWaalsContact C-N 3.27Å; G273-L275 PolarHBondContact O-N 3.46Å
274	S	76.7	Confident	87.9	Confident	26 Å²	26	29.6 Å²	29.6	18%	0.182	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-72.9	-12.1	178.3	63	0	0	0	0	114.5	E249 P272 F276 S277	E249-S274 WeakPolarHBondContact OE2-CB 3.33Å; E249-S274 PolarHBondContact OE2-OG 3.44Å; P272-S274 VanDerWaalsContact C-N 3.26Å; P272-S274 PolarHBondContact O-N 3.32Å; S274-F276 PolarHBondContact O-N 3.25Å; S274-S277 WeakPolarHBondContact O-CB 3.03Å; S274-S277 PolarHBondContact O-N 2.86Å
275	L	84	Confident	87.8	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-54.2	-33.2	-164.7	-172.2	64.7	0	0	0	114.8	L247 I251 F252 L271 P272 G273 L299	L247-L275 HydrophobicContact CB-CD1 4.08Å; L247-L275 HydrophobicContact CD1-CD1 4.32Å; L247-L275 HydrophobicContact CD1-CD2 4.09Å; I251-L275 HydrophobicContact CG2-CD1 3.62Å; F252-L275 HydrophobicContact CD2-CD1 3.95Å; F252-L275 HydrophobicContact CD2-CG 4.08Å; F252-L275 HydrophobicContact CE2-CD1 3.89Å; F252-L275 HydrophobicContact CE2-CD2 4.46Å; F252-L275 HydrophobicContact CE2-CG 4.13Å; L271-L275 HydrophobicContact CB-CD2 4.11Å; L271-L275 HydrophobicContact CD1-CD2 4.24Å; L271-L275 HydrophobicContact CD2-CD2 3.9Å; L271-L275 HydrophobicContact CG-CD2 4.3Å; P272-L275 HydrophobicContact CG-CB 4.18Å; P272-L275 HydrophobicContact CG-CD1 4.37Å; P272-L275 VanDerWaalsContact O-CB 3.23Å; P272-L275 WeakPolarHBondContact O-CB 3.02Å; P272-L275 PolarHBondContact O-N 3.4Å; G273-L275 VanDerWaalsContact C-N 3.27Å; G273-L275 PolarHBondContact O-N 3.46Å; L275-L299 HydrophobicContact CB-CD1 3.94Å
276	F	87.8	Confident	87.8	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.009	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-113.1	11.6	-178.8	-52.6	-39.3	0	0	0	114	F252 L261 S274 G278 L279 L282 I285 L299 L303	F252-F276 HydrophobicContact CD2-CD1 4.19Å; F252-F276 HydrophobicContact CD2-CE1 4.07Å; F252-F276 HydrophobicContact CE2-CE1 4.23Å; L261-F276 HydrophobicContact CD2-CD1 4.32Å; L261-F276 HydrophobicContact CD2-CE1 3.52Å; L261-F276 HydrophobicContact CD2-CZ 4.19Å; S274-F276 PolarHBondContact O-N 3.25Å; F276-G278 PolarHBondContact O-N 3.39Å; F276-L279 HydrophobicContact CB-CD1 4.09Å; F276-L279 HydrophobicContact CD1-CD1 4.06Å; F276-L279 HydrophobicContact CG-CD1 4.5Å; F276-L279 WeakPolarHBondContact O-CB 3.34Å; F276-L279 PolarHBondContact O-N 3.3Å; F276-L279 VanDerWaalsContact O-N 3.15Å; F276-L282 HydrophobicContact CD1-CD2 4.43Å; F276-L282 HydrophobicContact CG-CD2 4.36Å; F276-I285 HydrophobicContact CD2-CD1 3.98Å; F276-I285 HydrophobicContact CE2-CD1 3.84Å; F276-I285 HydrophobicContact CE2-CG2 4.37Å; F276-I285 HydrophobicContact CZ-CD1 4.45Å; F276-I285 HydrophobicContact CZ-CG2 4.29Å; F276-L299 HydrophobicContact CD2-CD1 3.55Å; F276-L299 HydrophobicContact CD2-CG 3.76Å; F276-L299 WeakPolarHBondContact CD2-O 3.22Å; F276-L299 HydrophobicContact CE2-CD1 3.6Å; F276-L299 HydrophobicContact CE2-CD2 4.18Å; F276-L299 HydrophobicContact CE2-CG 3.78Å; F276-L299 HydrophobicContact CG-CD1 4.3Å; F276-L299 HydrophobicContact CZ-CD1 4.39Å; F276-L303 HydrophobicContact CB-CD1 4.05Å; F276-L303 HydrophobicContact CB-CD2 4.18Å; F276-L303 HydrophobicContact CD2-CD1 4.09Å; F276-L303 HydrophobicContact CG-CD1 4.41Å
277	S	78	Confident	87.8	Confident	54 Å²	54	26.7 Å²	26.7	38%	0.378	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	135	-177.7	-170	0	0	0	0	111.7	S274 L279 D302	S274-S277 WeakPolarHBondContact O-CB 3.03Å; S274-S277 PolarHBondContact O-N 2.86Å; S277-L279 VanDerWaalsContact C-N 3.29Å; S277-L279 PolarHBondContact O-N 3.06Å; S277-D302 PolarHBondContact OG-OD2 3.48Å
278	G	78.3	Confident	87.9	Confident	27 Å²	27	22.4 Å²	22.4	28%	0.278	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	-2.6	-177	0	0	0	0	0	116.6	F276 N280	F276-G278 PolarHBondContact O-N 3.39Å; G278-N280 PolarHBondContact O-N 2.03Å; G278-N280 PolarHBondContact O-ND2 3.39Å; G278-N280 VanDerWaalsContact O-ND2 3.1Å
279	L	88.4	Confident	88	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.144	C	C	.	.			trans	-78.2	57	179.6	-65.7	-176.5	0	0	0	113.6	F252 L255 L258 F276 S277 E281 L282 L303	F252-L279 HydrophobicContact CB-CD1 3.93Å; F252-L279 WeakPolarHBondContact O-CD2 3.44Å; L255-L279 HydrophobicContact CB-CD2 4.28Å; L255-L279 VanDerWaalsContact O-CD2 3.28Å; L255-L279 WeakPolarHBondContact O-CD2 3.03Å; L258-L279 HydrophobicContact CB-CD2 4.47Å; L258-L279 HydrophobicContact CD2-CD1 4.38Å; F276-L279 HydrophobicContact CB-CD1 4.09Å; F276-L279 HydrophobicContact CD1-CD1 4.06Å; F276-L279 HydrophobicContact CG-CD1 4.5Å; F276-L279 WeakPolarHBondContact O-CB 3.34Å; F276-L279 PolarHBondContact O-N 3.3Å; F276-L279 VanDerWaalsContact O-N 3.15Å; S277-L279 VanDerWaalsContact C-N 3.29Å; S277-L279 PolarHBondContact O-N 3.06Å; L279-E281 PolarHBondContact O-N 2.83Å; L279-L282 HydrophobicContact CB-CB 4.09Å; L279-L282 HydrophobicContact CB-CD2 4.19Å; L279-L282 HydrophobicContact CD1-CD2 3.9Å; L279-L282 VanDerWaalsContact O-CB 3.25Å; L279-L282 WeakPolarHBondContact O-CB 3.49Å; L279-L282 PolarHBondContact O-N 3.25Å; L279-L303 HydrophobicContact CB-CD2 4.16Å
280	N	84.9	Confident	88.5	Confident	94 Å²	94	24.9 Å²	24.9	50%	0.503	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.9	-173.4	-66.3	-68.5	0	0	0	115.2	G278 L305	G278-N280 PolarHBondContact O-N 2.03Å; G278-N280 PolarHBondContact O-ND2 3.39Å; G278-N280 VanDerWaalsContact O-ND2 3.1Å; N280-L305 WeakPolarHBondContact O-CD1 3.47Å; N280-L305 WeakPolarHBondContact O-CG 3.31Å
281	E	91.9	Very high	89	Confident	61 Å²	61	27.9 Å²	27.9	29%	0.285	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.6	-179.8	-85.7	-67.4	141.8	0	0	114.8	L258 Q259 L279 R283	L258-E281 CarbonylContact O-C 3.29Å; L258-E281 VanDerWaalsContact O-C 3.26Å; Q259-E281 HydrophobicContact CG-CB 4.19Å; Q259-E281 WeakPolarHBondContact CG-O 3.44Å; Q259-E281 PolarHBondContact NE2-OE2 3.28Å; L279-E281 PolarHBondContact O-N 2.83Å; E281-R283 WeakPolarHBondContact O-CG 3.26Å; E281-R283 PolarHBondContact O-N 3.2Å; E281-R283 PolarHBondContact O-NE 2.76Å; E281-R283 IonicContact OE1-NH2 3.59Å; E281-R283 IonicContact OE2-CZ 2.71Å; E281-R283 IonicContact OE2-NE 3.52Å; E281-R283 PolarHBondContact OE2-NE 2.74Å; E281-R283 IonicContact OE2-NH2 3.95Å; E281-R283 PolarHBondContact OE2-NH2 2.77Å
282	L	94.7	Very high	89.2	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	15%	0.151	C	C	.	.			trans	-72.5	121.8	-170	-168.8	60.3	0	0	0	112	L258 L261 F276 L279 I285 L303 L305 L306	L258-L282 HydrophobicContact CD2-CD1 4.31Å; L258-L282 HydrophobicContact CG-CD1 4.17Å; L258-L282 WeakPolarHBondContact O-CA 3.41Å; L258-L282 PolarHBondContact O-N 3.25Å; L258-L282 VanDerWaalsContact O-N 3.16Å; L261-L282 HydrophobicContact CB-CD1 4.28Å; F276-L282 HydrophobicContact CD1-CD2 4.43Å; F276-L282 HydrophobicContact CG-CD2 4.36Å; L279-L282 HydrophobicContact CB-CB 4.09Å; L279-L282 HydrophobicContact CB-CD2 4.19Å; L279-L282 HydrophobicContact CD1-CD2 3.9Å; L279-L282 VanDerWaalsContact O-CB 3.25Å; L279-L282 WeakPolarHBondContact O-CB 3.49Å; L279-L282 PolarHBondContact O-N 3.25Å; L282-I285 HydrophobicContact CD1-CG1 4.45Å; L282-I285 HydrophobicContact CD2-CD1 3.75Å; L282-I285 HydrophobicContact CD2-CG1 3.8Å; L282-I285 HydrophobicContact CG-CD1 4.29Å; L282-I285 HydrophobicContact CG-CG1 3.99Å; L282-L303 HydrophobicContact CB-CD2 4.44Å; L282-L303 HydrophobicContact CD2-CD1 4.21Å; L282-L303 HydrophobicContact CD2-CD2 4.46Å; L282-L305 CarbonylContact O-C 3.57Å; L282-L305 VanDerWaalsContact O-C 3.29Å; L282-L306 PolarHBondContact O-N 3.05Å
283	R	94.8	Very high	89.6	Confident	59 Å²	59	27.7 Å²	27.7	22%	0.223	15%	0.15	C	C	.	.			trans	-117.3	-28.9	-172.8	-65.6	152.3	-163.7	-139.9	-0.2	113.3	Q259 E281 L305 R307 Y308	Q259-R283 PolarHBondContact O-N 3.5Å; E281-R283 WeakPolarHBondContact O-CG 3.26Å; E281-R283 PolarHBondContact O-N 3.2Å; E281-R283 PolarHBondContact O-NE 2.76Å; E281-R283 IonicContact OE1-NH2 3.59Å; E281-R283 IonicContact OE2-CZ 2.71Å; E281-R283 IonicContact OE2-NE 3.52Å; E281-R283 PolarHBondContact OE2-NE 2.74Å; E281-R283 IonicContact OE2-NH2 3.95Å; E281-R283 PolarHBondContact OE2-NH2 2.77Å; R283-L305 WeakPolarHBondContact CA-O 3.42Å; R283-L305 HydrophobicContact CG-CB 4.22Å; R283-L305 WeakPolarHBondContact CG-O 3.34Å; R283-R307 HydrophobicContact CB-CG 4.3Å; R283-R307 WeakPolarHBondContact O-CA 3.46Å; R283-R307 WeakPolarHBondContact O-CB 3.44Å; R283-R307 PolarHBondContact O-N 2.83Å; R283-Y308 PolarHBondContact O-N 3.46Å; R283-Y308 VanDerWaalsContact O-N 3.08Å
284	F	96.5	Very high	90.2	Very high	68 Å²	68	27.9 Å²	27.9	30%	0.298	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	121.4	-175.3	-64.2	-90.7	0	0	0	110.4	Q259 R260 L261 Y308	Q259-F284 PolarHBondContact O-N 2.98Å; Q259-F284 VanDerWaalsContact O-N 3.12Å; R260-F284 WeakPolarHBondContact CA-O 3.02Å; R260-F284 HydrophobicContact CB-CB 4.05Å; R260-F284 HydrophobicContact CG-CB 3.75Å; R260-F284 VanDerWaalsContact NH1-CD1 3.33Å; L261-F284 PolarHBondContact N-O 3.45Å; F284-Y308 WeakPolarHBondContact CA-O 3.39Å; F284-Y308 HydrophobicContact CD1-CD1 4.28Å; F284-Y308 HydrophobicContact CD1-CG 4.39Å
285	I	95.6	Very high	90.7	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	131.3	174.3	-61	171.8	0	0	0	107.4	F276 L282 L287 L303 L306 Y308 I309 D310	F276-I285 HydrophobicContact CD2-CD1 3.98Å; F276-I285 HydrophobicContact CE2-CD1 3.84Å; F276-I285 HydrophobicContact CE2-CG2 4.37Å; F276-I285 HydrophobicContact CZ-CD1 4.45Å; F276-I285 HydrophobicContact CZ-CG2 4.29Å; L282-I285 HydrophobicContact CD1-CG1 4.45Å; L282-I285 HydrophobicContact CD2-CD1 3.75Å; L282-I285 HydrophobicContact CD2-CG1 3.8Å; L282-I285 HydrophobicContact CG-CD1 4.29Å; L282-I285 HydrophobicContact CG-CG1 3.99Å; I285-L287 HydrophobicContact CG2-CD1 3.78Å; I285-L287 HydrophobicContact CG2-CG 3.97Å; I285-L303 HydrophobicContact CD1-CD1 3.75Å; I285-L306 HydrophobicContact CD1-CD1 3.91Å; I285-L306 HydrophobicContact CG1-CD1 4.15Å; I285-Y308 PolarHBondContact N-O 2.91Å; I285-I309 HydrophobicContact CB-CG1 4.09Å; I285-I309 HydrophobicContact CG2-CD1 4.46Å; I285-I309 HydrophobicContact CG2-CG1 4.15Å; I285-I309 CarbonylContact O-C 3.52Å; I285-I309 VanDerWaalsContact O-CA 3.23Å; I285-I309 WeakPolarHBondContact O-CA 3.45Å; I285-D310 PolarHBondContact O-N 3.44Å
286	L	97.3	Very high	90.8	Very high	6 Å²	6	27.1 Å²	27.1	3%	0.031	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	116.3	-179.3	-48.9	167.7	0	0	0	109.1	L261 D262 L263 Q264 Y308 D310	L261-L286 PolarHBondContact O-N 3.02Å; D262-L286 HydrophobicContact CB-CD1 4.12Å; L263-L286 CarbonylContact C-O 3.37Å; L263-L286 WeakPolarHBondContact CA-O 3.42Å; L263-L286 PolarHBondContact N-O 2.97Å; Q264-L286 HydrophobicContact CG-CB 3.67Å; Q264-L286 PolarHBondContact N-O 2.94Å; L286-Y308 HydrophobicContact CD2-CD1 3.86Å; L286-Y308 HydrophobicContact CD2-CE1 3.78Å; L286-D310 HydrophobicContact CD2-CB 3.74Å
287	L	96	Very high	90.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.			trans	-129	4.6	-173.7	-73.1	164.9	0	0	0	112.5	L263 L268 L271 I285 N290 L292 D310 L311 N314	L263-L287 HydrophobicContact CB-CD2 3.77Å; L263-L287 HydrophobicContact CD1-CD2 4.04Å; L268-L287 HydrophobicContact CD1-CD2 4.39Å; L271-L287 HydrophobicContact CD1-CD1 3.9Å; L271-L287 HydrophobicContact CD1-CD2 4.04Å; I285-L287 HydrophobicContact CG2-CD1 3.78Å; I285-L287 HydrophobicContact CG2-CG 3.97Å; L287-N290 PolarHBondContact O-ND2 3.42Å; L287-L292 HydrophobicContact CB-CD1 4Å; L287-L292 HydrophobicContact CD1-CD1 4.33Å; L287-L292 HydrophobicContact CD2-CD1 4.3Å; L287-L292 HydrophobicContact CG-CD1 4.45Å; L287-D310 CarbonylContact C-O 3.18Å; L287-D310 WeakPolarHBondContact CA-O 3.35Å; L287-D310 PolarHBondContact N-O 2.77Å; L287-L311 HydrophobicContact CB-CD2 4.06Å; L287-L311 HydrophobicContact CD1-CD2 4.17Å; L287-N314 PolarHBondContact O-ND2 3.03Å
288	A	96.2	Very high	90.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.			trans	-56.2	150.6	179.1	0	0	0	0	0	113.7	Q264 D265 D310 K312	Q264-A288 CarbonylContact C-O 3.52Å; Q264-A288 WeakPolarHBondContact CA-O 3.44Å; Q264-A288 VanDerWaalsContact CB-O 3.32Å; Q264-A288 WeakPolarHBondContact CB-O 3.45Å; Q264-A288 HydrophobicContact CG-CB 4.17Å; D265-A288 PolarHBondContact N-O 2.8Å; A288-D310 HydrophobicContact CB-CB 4.49Å; A288-D310 PolarHBondContact N-O 2.78Å; A288-K312 CarbonylContact C-O 3.57Å; A288-K312 WeakPolarHBondContact CA-O 3.45Å; A288-K312 HydrophobicContact CB-CB 4.05Å; A288-K312 WeakPolarHBondContact CB-O 3.41Å
289	R	95.9	Very high	90.6	Very high	81 Å²	81	27.2 Å²	27.2	31%	0.306	14%	0.136	S	C	.	.	S	Bend	trans	54.4	57.7	-174.5	-66.7	174.5	-58	-64.3	-15.7	112.5	Q264 D265 N266 K312 E313	Q264-R289 VanDerWaalsContact OE1-NH2 3.15Å; D265-R289 VanDerWaalsContact CA-O 3.28Å; D265-R289 WeakPolarHBondContact CA-O 3.42Å; D265-R289 PolarHBondContact N-O 2.93Å; D265-R289 WeakPolarHBondContact OD1-CD 3.45Å; D265-R289 IonicContact OD1-CZ 3.89Å; D265-R289 IonicContact OD1-NE 3.57Å; D265-R289 PolarHBondContact OD1-NE 2.8Å; D265-R289 IonicContact OD1-NH2 2.86Å; D265-R289 IonicContact OD2-CZ 3.32Å; D265-R289 IonicContact OD2-NE 3.19Å; D265-R289 IonicContact OD2-NH2 3.36Å; D265-R289 PolarHBondContact OD2-NH2 2.9Å; N266-R289 PolarHBondContact N-O 2.69Å; R289-K312 PolarHBondContact N-O 2.02Å; R289-E313 WeakPolarHBondContact CA-O 3.42Å; R289-E313 HydrophobicContact CB-CB 4.49Å; R289-E313 WeakPolarHBondContact CD-OE1 3.21Å; R289-E313 VanDerWaalsContact CD-OE2 3.26Å; R289-E313 WeakPolarHBondContact CD-OE2 3.43Å; R289-E313 HydrophobicContact CG-CB 3.6Å; R289-E313 HydrophobicContact CG-CG 4.07Å; R289-E313 VanDerWaalsContact CG-OE1 3.26Å; R289-E313 WeakPolarHBondContact CG-OE1 3.41Å; R289-E313 VanDerWaalsContact CG-OE2 3.26Å; R289-E313 WeakPolarHBondContact CG-OE2 3.2Å; R289-E313 IonicContact CZ-OE1 2.77Å; R289-E313 IonicContact NE-OE1 2.74Å; R289-E313 IonicContact NH1-OE1 2.8Å; R289-E313 PolarHBondContact NH1-OE1 3.22Å
290	N	96.6	Very high	90.5	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	14%	0.136	C	C	.	.	S	Bend	trans	-127.2	179.8	167.9	-85.6	-78.7	0	0	0	109.6	L263 N266 K267 L268 L287 L292 N314 P315	L263-N290 PolarHBondContact O-ND2 3.22Å; N266-N290 VanDerWaalsContact CA-OD1 3.32Å; N266-N290 WeakPolarHBondContact CA-OD1 3.42Å; N266-N290 WeakPolarHBondContact CB-OD1 3.45Å; N266-N290 PolarHBondContact N-OD1 2.04Å; K267-N290 PolarHBondContact N-OD1 3.27Å; L268-N290 HydrophobicContact CB-CB 4.32Å; L268-N290 WeakPolarHBondContact CB-OD1 3.36Å; L268-N290 WeakPolarHBondContact CG-OD1 3.43Å; L268-N290 PolarHBondContact N-OD1 3.41Å; L287-N290 PolarHBondContact O-ND2 3.42Å; N290-L292 VanDerWaalsContact C-N 3.34Å; N290-L292 HydrophobicContact CB-CD1 4.3Å; N290-L292 HydrophobicContact CB-CG 4.03Å; N290-N314 WeakPolarHBondContact CA-OD1 3.25Å; N290-N314 WeakPolarHBondContact CB-OD1 2.99Å; N290-N314 PolarHBondContact N-OD1 2.84Å; N290-N314 PolarHBondContact O-OD1 3.15Å; N290-N314 VanDerWaalsContact O-OD1 3.11Å; N290-P315 WeakPolarHBondContact O-CD 2.99Å
291	N	93.5	Very high	90.2	Very high	69 Å²	69	24.9 Å²	24.9	37%	0.369	13%	0.128	S	C	.	.			trans	-97.3	23.6	-179.9	-60.4	-33.6	0	0	0	111.9	K267 L268 V269 I293	K267-N291 PolarHBondContact O-ND2 3.34Å; K267-N291 VanDerWaalsContact O-ND2 3.09Å; L268-N291 CarbonylContact O-C 3.56Å; L268-N291 VanDerWaalsContact O-CA 3.29Å; L268-N291 WeakPolarHBondContact O-CA 3.48Å; L268-N291 WeakPolarHBondContact O-CB 3.1Å; L268-N291 PolarHBondContact O-N 3.2Å; V269-N291 HydrophobicContact CG2-CB 4.12Å; N291-I293 PolarHBondContact O-N 2.03Å
292	L	92.3	Very high	89.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.			trans	-66.5	110.7	-170.8	-61.3	167.9	0	0	0	111.1	L268 V269 L271 L287 N290 L295 N314 P315 L316	L268-L292 HydrophobicContact CB-CD2 4.05Å; L268-L292 WeakPolarHBondContact O-CD2 3.29Å; L268-L292 PolarHBondContact O-N 3.2Å; L268-L292 VanDerWaalsContact O-N 3.15Å; V269-L292 WeakPolarHBondContact O-CA 3.29Å; L271-L292 HydrophobicContact CD1-CD1 4.49Å; L271-L292 HydrophobicContact CD1-CD2 4.32Å; L271-L292 HydrophobicContact CD2-CD2 4.35Å; L271-L292 HydrophobicContact CG-CD2 3.87Å; L287-L292 HydrophobicContact CB-CD1 4Å; L287-L292 HydrophobicContact CD1-CD1 4.33Å; L287-L292 HydrophobicContact CD2-CD1 4.3Å; L287-L292 HydrophobicContact CG-CD1 4.45Å; N290-L292 VanDerWaalsContact C-N 3.34Å; N290-L292 HydrophobicContact CB-CD1 4.3Å; N290-L292 HydrophobicContact CB-CG 4.03Å; L292-L295 HydrophobicContact CD1-CD2 4.33Å; L292-L295 HydrophobicContact CD2-CD2 4.47Å; L292-N314 HydrophobicContact CB-CB 4.19Å; L292-N314 VanDerWaalsContact CB-OD1 3.22Å; L292-N314 WeakPolarHBondContact CB-OD1 3.46Å; L292-N314 WeakPolarHBondContact CD1-OD1 3.06Å; L292-N314 VanDerWaalsContact CG-OD1 3.31Å; L292-N314 WeakPolarHBondContact CG-OD1 3.49Å; L292-N314 PolarHBondContact N-OD1 3.32Å; L292-N314 VanDerWaalsContact N-OD1 3.16Å; L292-P315 CarbonylContact O-C 3.56Å; L292-L316 HydrophobicContact CB-CD2 4.36Å; L292-L316 WeakPolarHBondContact O-CD2 3.49Å; L292-L316 PolarHBondContact O-N 3.37Å
293	I	87.7	Confident	89.1	Confident	6 Å²	6	25.6 Å²	25.6	3%	0.031	13%	0.133	C	C	.	.			trans	-84.8	-28	175.4	61.9	177.4	0	0	0	112.2	V269 N291 P315 Q317 L348 P380 Q382	V269-I293 HydrophobicContact CG1-CD1 4.41Å; V269-I293 HydrophobicContact CG1-CG1 4.48Å; V269-I293 PolarHBondContact O-N 3.43Å; N291-I293 PolarHBondContact O-N 2.03Å; I293-P315 HydrophobicContact CG2-CG 4.23Å; I293-Q317 PolarHBondContact O-N 2.86Å; I293-L348 HydrophobicContact CG2-CD1 3.79Å; I293-P380 HydrophobicContact CD1-CB 4.08Å; I293-Q382 HydrophobicContact CD1-CB 3.89Å
294	W	87.3	Confident	88.6	Confident	25 Å²	25	31 Å²	31	10%	0.095	16%	0.159	C	C	.	.			trans	-157	155.1	-172.1	174.3	84.1	0	0	0	111.6	P296 H321 P379 P380	W294-P296 HydrophobicContact CH2-CB 3.49Å; W294-P296 VanDerWaalsContact CH2-CB 3.49Å; W294-P296 HydrophobicContact CH2-CG 4.01Å; W294-P296 HydrophobicContact CZ2-CB 4.05Å; W294-P296 HydrophobicContact CZ3-CB 3.98Å; W294-P296 HydrophobicContact CZ3-CG 3.97Å; W294-H321 VanDerWaalsContact NE1-C 3.32Å; W294-H321 PolarHBondContact NE1-O 3.4Å; W294-P379 HydrophobicContact CD2-CB 4.29Å; W294-P379 HydrophobicContact CE3-CB 3.9Å; W294-P379 HydrophobicContact CH2-CB 3.62Å; W294-P379 HydrophobicContact CZ2-CB 4.05Å; W294-P379 HydrophobicContact CZ3-CB 3.56Å; W294-P380 HydrophobicContact CB-CG 3.78Å; W294-P380 HydrophobicContact CG-CG 3.96Å
295	L	88	Confident	88.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.			trans	-137.8	134.6	176.7	-66.2	173.4	0	0	0	110.3	L271 L292 L299 L311 L316 F325	L271-L295 HydrophobicContact CB-CD2 4.42Å; L271-L295 HydrophobicContact CD1-CD2 3.87Å; L271-L295 HydrophobicContact CG-CD2 4.26Å; L292-L295 HydrophobicContact CD1-CD2 4.33Å; L292-L295 HydrophobicContact CD2-CD2 4.47Å; L295-L299 HydrophobicContact CB-CD2 4.49Å; L295-L299 HydrophobicContact CD2-CD2 3.87Å; L295-L311 HydrophobicContact CD1-CD1 4.28Å; L295-L311 HydrophobicContact CD1-CD2 3.8Å; L295-L316 HydrophobicContact CD1-CD2 4.43Å; L295-L316 HydrophobicContact CG-CD2 4.39Å; L295-F325 HydrophobicContact CB-CD1 4.3Å; L295-F325 HydrophobicContact CB-CD2 3.84Å; L295-F325 HydrophobicContact CB-CE1 4.36Å; L295-F325 HydrophobicContact CB-CE2 3.91Å; L295-F325 HydrophobicContact CB-CG 4.04Å; L295-F325 HydrophobicContact CB-CZ 4.17Å; L295-F325 HydrophobicContact CD1-CE1 3.82Å; L295-F325 HydrophobicContact CD1-CE2 3.95Å; L295-F325 HydrophobicContact CD1-CZ 3.47Å; L295-F325 VanDerWaalsContact CD1-CZ 3.47Å; L295-F325 HydrophobicContact CG-CZ 4.47Å; L295-F325 WeakPolarHBondContact O-CB 3.46Å
296	P	84.2	Confident	88.1	Confident	10 Å²	10	31.6 Å²	31.6	7%	0.065	16%	0.164	C	C	.	.			trans	-73.6	146.1	173.7	22.2	-23.9	0	0	0	112	L271 W294 S298 L299	L271-P296 WeakPolarHBondContact O-CD 3.34Å; W294-P296 HydrophobicContact CH2-CB 3.49Å; W294-P296 VanDerWaalsContact CH2-CB 3.49Å; W294-P296 HydrophobicContact CH2-CG 4.01Å; W294-P296 HydrophobicContact CZ2-CB 4.05Å; W294-P296 HydrophobicContact CZ3-CB 3.98Å; W294-P296 HydrophobicContact CZ3-CG 3.97Å; P296-S298 VanDerWaalsContact C-N 3.33Å; P296-S298 PolarHBondContact O-N 3Å; P296-L299 HydrophobicContact CG-CB 4.22Å; P296-L299 WeakPolarHBondContact O-CB 3.46Å; P296-L299 PolarHBondContact O-N 2.93Å
297	G	77.1	Confident	87.8	Confident	10 Å²	10	38.8 Å²	38.8	10%	0.103	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-39.4	174.4	0	0	0	0	0	113.4	L299 I300 S301	G297-L299 PolarHBondContact O-N 3.05Å; G297-I300 PolarHBondContact O-N 2.89Å; G297-S301 PolarHBondContact O-OG 3.25Å
298	S	79.4	Confident	87.7	Confident	72 Å²	72	41.3 Å²	41.3	50%	0.503	20%	0.201	S	C	.	.	H	α-helix	trans	-57.4	-20.6	178.6	47.5	0	0	0	0	114.5	P296 I300	P296-S298 VanDerWaalsContact C-N 3.33Å; P296-S298 PolarHBondContact O-N 3Å; S298-I300 PolarHBondContact O-N 2.84Å; S298-I300 VanDerWaalsContact O-N 3.13Å
299	L	85.3	Confident	87.6	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-28.1	178.4	-170.2	64.7	0	0	0	113.6	L271 L275 F276 L295 P296 G297	L271-L299 HydrophobicContact CD1-CD2 4.17Å; L275-L299 HydrophobicContact CB-CD1 3.94Å; F276-L299 HydrophobicContact CD2-CD1 3.55Å; F276-L299 HydrophobicContact CD2-CG 3.76Å; F276-L299 WeakPolarHBondContact CD2-O 3.22Å; F276-L299 HydrophobicContact CE2-CD1 3.6Å; F276-L299 HydrophobicContact CE2-CD2 4.18Å; F276-L299 HydrophobicContact CE2-CG 3.78Å; F276-L299 HydrophobicContact CG-CD1 4.3Å; F276-L299 HydrophobicContact CZ-CD1 4.39Å; L295-L299 HydrophobicContact CB-CD2 4.49Å; L295-L299 HydrophobicContact CD2-CD2 3.87Å; P296-L299 HydrophobicContact CG-CB 4.22Å; P296-L299 WeakPolarHBondContact O-CB 3.46Å; P296-L299 PolarHBondContact O-N 2.93Å; G297-L299 PolarHBondContact O-N 3.05Å
300	I	85	Confident	87.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-126.3	-1.8	-172.6	60.8	164.1	0	0	0	114.6	G297 S298 D302 L303 L306 F325 E328 F329 R334	G297-I300 PolarHBondContact O-N 2.89Å; S298-I300 PolarHBondContact O-N 2.84Å; S298-I300 VanDerWaalsContact O-N 3.13Å; I300-D302 PolarHBondContact O-N 3.41Å; I300-L303 HydrophobicContact CG2-CD1 4.3Å; I300-L303 PolarHBondContact O-N 3.37Å; I300-L303 VanDerWaalsContact O-N 3.15Å; I300-L306 HydrophobicContact CG2-CD2 4.41Å; I300-F325 HydrophobicContact CD1-CD2 4.32Å; I300-F325 HydrophobicContact CD1-CE2 4.02Å; I300-F325 HydrophobicContact CG1-CE2 4.33Å; I300-F325 HydrophobicContact CG2-CE2 4.38Å; I300-E328 HydrophobicContact CD1-CB 4.4Å; I300-E328 HydrophobicContact CD1-CG 3.83Å; I300-E328 HydrophobicContact CG1-CB 4.44Å; I300-E328 HydrophobicContact CG1-CG 3.56Å; I300-F329 HydrophobicContact CD1-CD1 4.3Å; I300-F329 HydrophobicContact CD1-CD2 3.69Å; I300-F329 HydrophobicContact CD1-CE1 3.99Å; I300-F329 HydrophobicContact CD1-CE2 3.33Å; I300-F329 HydrophobicContact CD1-CG 4.16Å; I300-F329 HydrophobicContact CD1-CZ 3.49Å; I300-F329 VanDerWaalsContact CD1-CZ 3.49Å; I300-R334 PolarHBondContact O-NH1 2.93Å; I300-R334 PolarHBondContact O-NH2 2.96Å
301	S	79	Confident	87.4	Confident	46 Å²	46	37.9 Å²	37.9	32%	0.322	19%	0.189	S	C	.	.	H	α-helix	trans	-58.1	-45.4	-177.7	-52	0	0	0	0	112.7	G297 L303 E328	G297-S301 PolarHBondContact O-OG 3.25Å; S301-L303 VanDerWaalsContact C-N 3.28Å; S301-L303 PolarHBondContact O-N 3.44Å; S301-E328 WeakPolarHBondContact CB-OE2 3.43Å; S301-E328 VanDerWaalsContact OG-CD 3.27Å; S301-E328 PolarHBondContact OG-OE2 2.99Å
302	D	77.8	Confident	87.4	Confident	75 Å²	75	38.3 Å²	38.3	40%	0.401	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.3	179.3	-77.2	-20.5	0	0	0	114	S277 I300 K304	S277-D302 PolarHBondContact OG-OD2 3.48Å; I300-D302 PolarHBondContact O-N 3.41Å; D302-K304 VanDerWaalsContact C-N 3.31Å; D302-K304 PolarHBondContact O-N 3.19Å
303	L	86.5	Confident	87.4	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.216	C	C	.	.			trans	-82.8	66.4	-163.1	-58.2	-173.4	0	0	0	113.9	F276 L279 L282 I285 I300 S301 L305 L306 R334	F276-L303 HydrophobicContact CB-CD1 4.05Å; F276-L303 HydrophobicContact CB-CD2 4.18Å; F276-L303 HydrophobicContact CD2-CD1 4.09Å; F276-L303 HydrophobicContact CG-CD1 4.41Å; L279-L303 HydrophobicContact CB-CD2 4.16Å; L282-L303 HydrophobicContact CB-CD2 4.44Å; L282-L303 HydrophobicContact CD2-CD1 4.21Å; L282-L303 HydrophobicContact CD2-CD2 4.46Å; I285-L303 HydrophobicContact CD1-CD1 3.75Å; I300-L303 HydrophobicContact CG2-CD1 4.3Å; I300-L303 PolarHBondContact O-N 3.37Å; I300-L303 VanDerWaalsContact O-N 3.15Å; S301-L303 VanDerWaalsContact C-N 3.28Å; S301-L303 PolarHBondContact O-N 3.44Å; L303-L305 PolarHBondContact O-N 3.43Å; L303-L306 HydrophobicContact CB-CB 4.16Å; L303-L306 VanDerWaalsContact O-CB 3.32Å; L303-L306 WeakPolarHBondContact O-CB 3.19Å; L303-L306 PolarHBondContact O-N 2.73Å; L303-L306 VanDerWaalsContact O-N 3.13Å; L303-R334 PolarHBondContact O-NH1 3.16Å
304	K	83.2	Confident	87.7	Confident	174 Å²	174	44.6 Å²	44.6	76%	0.757	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.4	-177.2	-68	167.8	-173.5	169.6	0	114.9	D302	D302-K304 VanDerWaalsContact C-N 3.31Å; D302-K304 PolarHBondContact O-N 3.19Å
305	L	90.6	Very high	88	Confident	69 Å²	69	45.4 Å²	45.4	36%	0.361	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	7.4	178.8	-62.9	-170.5	0	0	0	114.5	N280 L282 R283 L303 R307	N280-L305 WeakPolarHBondContact O-CD1 3.47Å; N280-L305 WeakPolarHBondContact O-CG 3.31Å; L282-L305 CarbonylContact O-C 3.57Å; L282-L305 VanDerWaalsContact O-C 3.29Å; R283-L305 WeakPolarHBondContact CA-O 3.42Å; R283-L305 HydrophobicContact CG-CB 4.22Å; R283-L305 WeakPolarHBondContact CG-O 3.34Å; L303-L305 PolarHBondContact O-N 3.43Å; L305-R307 WeakPolarHBondContact O-CG 3.17Å; L305-R307 PolarHBondContact O-N 3.25Å
306	L	91.7	Very high	88.2	Confident	11 Å²	11	45.5 Å²	45.5	6%	0.058	23%	0.226	C	C	.	.			trans	-57.4	130.2	176.6	-173.6	63.7	0	0	0	110.7	L282 I285 I300 L303 I337	L282-L306 PolarHBondContact O-N 3.05Å; I285-L306 HydrophobicContact CD1-CD1 3.91Å; I285-L306 HydrophobicContact CG1-CD1 4.15Å; I300-L306 HydrophobicContact CG2-CD2 4.41Å; L303-L306 HydrophobicContact CB-CB 4.16Å; L303-L306 VanDerWaalsContact O-CB 3.32Å; L303-L306 WeakPolarHBondContact O-CB 3.19Å; L303-L306 PolarHBondContact O-N 2.73Å; L303-L306 VanDerWaalsContact O-N 3.13Å; L306-I337 HydrophobicContact CG-CD1 4.4Å; L306-I337 WeakPolarHBondContact O-CD1 3.46Å
307	R	90.7	Very high	88.4	Confident	158 Å²	158	46.8 Å²	46.8	60%	0.596	23%	0.231	S	C	*	.			trans	-120.4	-28.7	178.5	-60.4	-174.6	178.8	-163.6	-5.7	113	R283 L305	R283-R307 HydrophobicContact CB-CG 4.3Å; R283-R307 WeakPolarHBondContact O-CA 3.46Å; R283-R307 WeakPolarHBondContact O-CB 3.44Å; R283-R307 PolarHBondContact O-N 2.83Å; L305-R307 WeakPolarHBondContact O-CG 3.17Å; L305-R307 PolarHBondContact O-N 3.25Å
308	Y	93.5	Very high	89	Confident	53 Å²	53	46.3 Å²	46.3	21%	0.208	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	133.4	-177.2	-169.7	-116.6	0	0	0	110.7	R283 F284 I285 L286 D310 K312 K340	R283-Y308 PolarHBondContact O-N 3.46Å; R283-Y308 VanDerWaalsContact O-N 3.08Å; F284-Y308 WeakPolarHBondContact CA-O 3.39Å; F284-Y308 HydrophobicContact CD1-CD1 4.28Å; F284-Y308 HydrophobicContact CD1-CG 4.39Å; I285-Y308 PolarHBondContact N-O 2.91Å; L286-Y308 HydrophobicContact CD2-CD1 3.86Å; L286-Y308 HydrophobicContact CD2-CE1 3.78Å; Y308-D310 HydrophobicContact CE1-CB 3.75Å; Y308-D310 PolarHBondContact OH-OD2 2.92Å; Y308-K312 PolarHBondContact OH-NZ 3.36Å; Y308-K340 HydrophobicContact CD2-CB 4.35Å; Y308-K340 HydrophobicContact CE2-CB 4.01Å; Y308-K340 VanDerWaalsContact CE2-O 3.3Å; Y308-K340 WeakPolarHBondContact CE2-O 3.08Å; Y308-K340 PolarHBondContact OH-O 3.4Å
309	I	93.5	Very high	89.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136	163.6	-164.9	169.6	0	0	0	106.9	I285 L311 F329 I337 S341	I285-I309 HydrophobicContact CB-CG1 4.09Å; I285-I309 HydrophobicContact CG2-CD1 4.46Å; I285-I309 HydrophobicContact CG2-CG1 4.15Å; I285-I309 CarbonylContact O-C 3.52Å; I285-I309 VanDerWaalsContact O-CA 3.23Å; I285-I309 WeakPolarHBondContact O-CA 3.45Å; I309-L311 HydrophobicContact CD1-CD1 4.18Å; I309-L311 HydrophobicContact CD1-CD2 4.33Å; I309-L311 HydrophobicContact CD1-CG 4.24Å; I309-L311 HydrophobicContact CG1-CD1 4.41Å; I309-L311 HydrophobicContact CG1-CD2 4.44Å; I309-L311 HydrophobicContact CG1-CG 4.09Å; I309-L311 HydrophobicContact CG2-CD1 4.26Å; I309-F329 HydrophobicContact CG2-CZ 4.2Å; I309-I337 HydrophobicContact CG2-CG2 4.16Å; I309-S341 WeakPolarHBondContact O-CA 3.48Å; I309-S341 WeakPolarHBondContact O-CB 3.4Å
310	D	94.8	Very high	89.2	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.07	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.2	170.2	-156.4	-25.5	0	0	0	109.4	I285 L286 L287 A288 Y308 K312	I285-D310 PolarHBondContact O-N 3.44Å; L286-D310 HydrophobicContact CD2-CB 3.74Å; L287-D310 CarbonylContact C-O 3.18Å; L287-D310 WeakPolarHBondContact CA-O 3.35Å; L287-D310 PolarHBondContact N-O 2.77Å; A288-D310 HydrophobicContact CB-CB 4.49Å; A288-D310 PolarHBondContact N-O 2.78Å; Y308-D310 HydrophobicContact CE1-CB 3.75Å; Y308-D310 PolarHBondContact OH-OD2 2.92Å; D310-K312 WeakPolarHBondContact OD1-CD 3.35Å; D310-K312 WeakPolarHBondContact OD1-CE 3.48Å; D310-K312 VanDerWaalsContact OD1-CG 3.29Å; D310-K312 WeakPolarHBondContact OD1-CG 3.22Å; D310-K312 PolarHBondContact OD1-N 3.43Å; D310-K312 IonicContact OD1-NZ 3.35Å; D310-K312 PolarHBondContact OD1-NZ 2.91Å; D310-K312 IonicContact OD2-NZ 2.79Å; D310-K312 PolarHBondContact OD2-NZ 3.01Å
311	L	95	Very high	89	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.			trans	-132.4	6.1	-172.3	-74	173.3	0	0	0	112.4	L287 L295 I309 N314 F325 S341 A343	L287-L311 HydrophobicContact CB-CD2 4.06Å; L287-L311 HydrophobicContact CD1-CD2 4.17Å; L295-L311 HydrophobicContact CD1-CD1 4.28Å; L295-L311 HydrophobicContact CD1-CD2 3.8Å; I309-L311 HydrophobicContact CD1-CD1 4.18Å; I309-L311 HydrophobicContact CD1-CD2 4.33Å; I309-L311 HydrophobicContact CD1-CG 4.24Å; I309-L311 HydrophobicContact CG1-CD1 4.41Å; I309-L311 HydrophobicContact CG1-CD2 4.44Å; I309-L311 HydrophobicContact CG1-CG 4.09Å; I309-L311 HydrophobicContact CG2-CD1 4.26Å; L311-N314 PolarHBondContact O-ND2 3.12Å; L311-F325 HydrophobicContact CD1-CE1 4.21Å; L311-F325 HydrophobicContact CD1-CZ 4.17Å; L311-S341 PolarHBondContact N-O 2.85Å; L311-A343 HydrophobicContact CB-CB 3.66Å; L311-A343 HydrophobicContact CD1-CB 4.01Å
312	K	93.5	Very high	89.4	Confident	77 Å²	77	43.4 Å²	43.4	34%	0.335	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	150.9	178.4	-65.9	164.6	-159.8	134.4	0	112.1	A288 R289 Y308 D310 N314 S341 G342	A288-K312 CarbonylContact C-O 3.57Å; A288-K312 WeakPolarHBondContact CA-O 3.45Å; A288-K312 HydrophobicContact CB-CB 4.05Å; A288-K312 WeakPolarHBondContact CB-O 3.41Å; R289-K312 PolarHBondContact N-O 2.02Å; Y308-K312 PolarHBondContact OH-NZ 3.36Å; D310-K312 WeakPolarHBondContact OD1-CD 3.35Å; D310-K312 WeakPolarHBondContact OD1-CE 3.48Å; D310-K312 VanDerWaalsContact OD1-CG 3.29Å; D310-K312 WeakPolarHBondContact OD1-CG 3.22Å; D310-K312 PolarHBondContact OD1-N 3.43Å; D310-K312 IonicContact OD1-NZ 3.35Å; D310-K312 PolarHBondContact OD1-NZ 2.91Å; D310-K312 IonicContact OD2-NZ 2.79Å; D310-K312 PolarHBondContact OD2-NZ 3.01Å; K312-N314 PolarHBondContact O-N 3.06Å; K312-N314 PolarHBondContact O-ND2 3.43Å; K312-S341 PolarHBondContact N-O 3.05Å; K312-G342 WeakPolarHBondContact CA-O 3.38Å
313	E	92.4	Very high	89.7	Confident	128 Å²	128	41.6 Å²	41.6	60%	0.598	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	38.9	172.3	-53.3	167.7	-94.5	0	0	112.4	R289	R289-E313 WeakPolarHBondContact CA-O 3.42Å; R289-E313 HydrophobicContact CB-CB 4.49Å; R289-E313 WeakPolarHBondContact CD-OE1 3.21Å; R289-E313 VanDerWaalsContact CD-OE2 3.26Å; R289-E313 WeakPolarHBondContact CD-OE2 3.43Å; R289-E313 HydrophobicContact CG-CB 3.6Å; R289-E313 HydrophobicContact CG-CG 4.07Å; R289-E313 VanDerWaalsContact CG-OE1 3.26Å; R289-E313 WeakPolarHBondContact CG-OE1 3.41Å; R289-E313 VanDerWaalsContact CG-OE2 3.26Å; R289-E313 WeakPolarHBondContact CG-OE2 3.2Å; R289-E313 IonicContact CZ-OE1 2.77Å; R289-E313 IonicContact NE-OE1 2.74Å; R289-E313 IonicContact NH1-OE1 2.8Å; R289-E313 PolarHBondContact NH1-OE1 3.22Å
314	N	93.6	Very high	89.6	Confident	11 Å²	11	43.7 Å²	43.7	6%	0.059	21%	0.205	C	C	.	.			trans	-114.2	139.5	167	-79.4	-85.6	0	0	0	109.6	L287 N290 L292 L311 K312 L316	L287-N314 PolarHBondContact O-ND2 3.03Å; N290-N314 WeakPolarHBondContact CA-OD1 3.25Å; N290-N314 WeakPolarHBondContact CB-OD1 2.99Å; N290-N314 PolarHBondContact N-OD1 2.84Å; N290-N314 PolarHBondContact O-OD1 3.15Å; N290-N314 VanDerWaalsContact O-OD1 3.11Å; L292-N314 HydrophobicContact CB-CB 4.19Å; L292-N314 VanDerWaalsContact CB-OD1 3.22Å; L292-N314 WeakPolarHBondContact CB-OD1 3.46Å; L292-N314 WeakPolarHBondContact CD1-OD1 3.06Å; L292-N314 VanDerWaalsContact CG-OD1 3.31Å; L292-N314 WeakPolarHBondContact CG-OD1 3.49Å; L292-N314 PolarHBondContact N-OD1 3.32Å; L292-N314 VanDerWaalsContact N-OD1 3.16Å; L311-N314 PolarHBondContact O-ND2 3.12Å; K312-N314 PolarHBondContact O-N 3.06Å; K312-N314 PolarHBondContact O-ND2 3.43Å; N314-L316 HydrophobicContact CB-CD1 4.43Å; N314-L316 HydrophobicContact CB-CG 4.1Å; N314-L316 PolarHBondContact O-N 2.88Å
315	P	92.3	Very high	89.9	Confident	42 Å²	42	35.5 Å²	35.5	27%	0.273	17%	0.169	S	C	.	.			trans	-78.9	52.8	-179.1	35.9	-38.7	0	0	0	112.4	N290 L292 I293 Q317 S346 L348	N290-P315 WeakPolarHBondContact O-CD 2.99Å; L292-P315 CarbonylContact O-C 3.56Å; I293-P315 HydrophobicContact CG2-CG 4.23Å; P315-Q317 PolarHBondContact O-N 2.93Å; P315-S346 VanDerWaalsContact C-CB 3.45Å; P315-S346 PolarHBondContact O-OG 3.11Å; P315-S346 VanDerWaalsContact O-OG 3.13Å; P315-L348 HydrophobicContact CB-CD1 4.22Å
316	L	92.4	Very high	89.8	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	15%	0.152	C	C	.	.			trans	-63	127.3	-175.8	-69.4	165.5	0	0	0	111.1	L292 L295 N314 A343 S346 L359	L292-L316 HydrophobicContact CB-CD2 4.36Å; L292-L316 WeakPolarHBondContact O-CD2 3.49Å; L292-L316 PolarHBondContact O-N 3.37Å; L295-L316 HydrophobicContact CD1-CD2 4.43Å; L295-L316 HydrophobicContact CG-CD2 4.39Å; N314-L316 HydrophobicContact CB-CD1 4.43Å; N314-L316 HydrophobicContact CB-CG 4.1Å; N314-L316 PolarHBondContact O-N 2.88Å; L316-A343 HydrophobicContact CD1-CB 3.94Å; L316-S346 VanDerWaalsContact O-CB 3.27Å; L316-S346 WeakPolarHBondContact O-CB 3.47Å; L316-S346 PolarHBondContact O-N 2.9Å; L316-S346 PolarHBondContact O-OG 2.93Å; L316-L359 HydrophobicContact CB-CD1 4.23Å; L316-L359 HydrophobicContact CD1-CD1 3.63Å
317	Q	89.7	Confident	89.5	Confident	37 Å²	37	34.4 Å²	34.4	17%	0.173	16%	0.164	C	C	.	.			trans	-87.4	108.9	179.6	178.9	167.5	-27.3	0	0	109	I293 P315 D319 L348	I293-Q317 PolarHBondContact O-N 2.86Å; P315-Q317 PolarHBondContact O-N 2.93Å; Q317-D319 PolarHBondContact NE2-OD2 3.41Å; Q317-D319 PolarHBondContact O-N 3.13Å; Q317-L348 HydrophobicContact CB-CB 4.17Å; Q317-L348 HydrophobicContact CG-CB 4.29Å
318	C	88.5	Confident	89.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.			trans	-89.2	84	179.3	-69.3	0	0	0	0	110.8	C345 S349 L354 V363	C318-C345 HydrophobicContact CB-CB 3.62Å; C318-C345 WeakPolarHBondContact CB-SG 3.35Å; C318-C345 WeakPolarHBondContact SG-CA 3.12Å; C318-C345 WeakPolarHBondContact SG-CB 3.31Å; C318-C345 CovalentContact SG-SG 2.02Å; C318-C345 PolarHBondContact SG-SG 2.04Å; C318-S349 WeakPolarHBondContact CB-OG 3.35Å; C318-S349 PolarHBondContact N-OG 3.08Å; C318-L354 HydrophobicContact CB-CD1 4.13Å; C318-V363 HydrophobicContact CB-CG1 4.31Å
319	D	86.3	Confident	88.9	Confident	10 Å²	10	26 Å²	26	5%	0.053	13%	0.134	C	C	.	.	S	Bend	trans	-134.4	-166	169.6	66.3	12.9	0	0	0	109.7	Q317 H321 I322 T350	Q317-D319 PolarHBondContact NE2-OD2 3.41Å; Q317-D319 PolarHBondContact O-N 3.13Å; D319-H321 PolarHBondContact O-N 3.44Å; D319-H321 VanDerWaalsContact O-N 3.13Å; D319-H321 VanDerWaalsContact OD1-CB 3.32Å; D319-H321 WeakPolarHBondContact OD1-CB 3.03Å; D319-H321 IonicContact OD1-CE1 3.2Å; D319-H321 IonicContact OD1-CG 3.18Å; D319-H321 PolarHBondContact OD1-N 3.12Å; D319-H321 IonicContact OD1-ND1 2.76Å; D319-H321 PolarHBondContact OD1-ND1 3.14Å; D319-H321 IonicContact OD2-CE1 3.61Å; D319-H321 PolarHBondContact OD2-CE1 2.98Å; D319-H321 IonicContact OD2-ND1 2.71Å; D319-H321 PolarHBondContact OD2-ND1 2.59Å; D319-I322 WeakPolarHBondContact O-CG2 3.39Å; D319-I322 PolarHBondContact O-N 2.98Å; D319-I322 VanDerWaalsContact O-N 3.12Å; D319-T350 HydrophobicContact CB-CG2 4.49Å
320	C	82.5	Confident	88.4	Confident	26 Å²	26	28.1 Å²	28.1	18%	0.176	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-62.9	-18.3	-177.9	-64.6	0	0	0	0	115.3	I322 Q323 C369 V376	C320-I322 VanDerWaalsContact C-N 3.32Å; C320-I322 PolarHBondContact O-N 2.89Å; C320-Q323 WeakPolarHBondContact O-CB 3.26Å; C320-Q323 PolarHBondContact O-N 3.35Å; C320-C369 WeakPolarHBondContact CA-SG 3.33Å; C320-C369 HydrophobicContact CB-CB 3.85Å; C320-C369 WeakPolarHBondContact CB-SG 3.37Å; C320-C369 WeakPolarHBondContact SG-CA 3.3Å; C320-C369 WeakPolarHBondContact SG-CB 3Å; C320-C369 CovalentContact SG-SG 2.04Å; C320-C369 PolarHBondContact SG-SG 3.26Å; C320-V376 HydrophobicContact CB-CG2 4.35Å
321	H	81.8	Confident	87.7	Confident	25 Å²	25	34.6 Å²	34.6	12%	0.116	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-68.9	-32.1	175.7	-48	105.8	0	0	0	111.2	W294 D319 Q323 P324 M375 K378 P380	W294-H321 VanDerWaalsContact NE1-C 3.32Å; W294-H321 PolarHBondContact NE1-O 3.4Å; D319-H321 PolarHBondContact O-N 3.44Å; D319-H321 VanDerWaalsContact O-N 3.13Å; D319-H321 VanDerWaalsContact OD1-CB 3.32Å; D319-H321 WeakPolarHBondContact OD1-CB 3.03Å; D319-H321 IonicContact OD1-CE1 3.2Å; D319-H321 IonicContact OD1-CG 3.18Å; D319-H321 PolarHBondContact OD1-N 3.12Å; D319-H321 IonicContact OD1-ND1 2.76Å; D319-H321 PolarHBondContact OD1-ND1 3.14Å; D319-H321 IonicContact OD2-CE1 3.61Å; D319-H321 PolarHBondContact OD2-CE1 2.98Å; D319-H321 IonicContact OD2-ND1 2.71Å; D319-H321 PolarHBondContact OD2-ND1 2.59Å; H321-Q323 VanDerWaalsContact C-N 3.29Å; H321-Q323 PolarHBondContact O-N 3.27Å; H321-P324 VanDerWaalsContact O-CD 3.28Å; H321-P324 WeakPolarHBondContact O-CD 3.21Å; H321-M375 PolarHBondContact CD2-O 3.29Å; H321-M375 PolarHBondContact NE2-O 3.1Å; H321-K378 PolarHBondContact CD2-O 3.4Å; H321-P380 HydrophobicContact CB-CG 4.36Å
322	I	87.2	Confident	87	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-78.6	-12.8	-178.8	-146.6	68	0	0	0	113.2	D319 C320 F325 L326 L359 L367	D319-I322 WeakPolarHBondContact O-CG2 3.39Å; D319-I322 PolarHBondContact O-N 2.98Å; D319-I322 VanDerWaalsContact O-N 3.12Å; C320-I322 VanDerWaalsContact C-N 3.32Å; C320-I322 PolarHBondContact O-N 2.89Å; I322-F325 PolarHBondContact O-N 2.96Å; I322-F325 VanDerWaalsContact O-N 3.16Å; I322-L326 HydrophobicContact CG2-CD1 3.93Å; I322-L326 HydrophobicContact CG2-CG 4.45Å; I322-L326 PolarHBondContact O-N 2.95Å; I322-L359 HydrophobicContact CG2-CD2 4.48Å; I322-L367 HydrophobicContact CG2-CD1 3.94Å
323	Q	84.8	Confident	86.4	Confident	36 Å²	36	40.3 Å²	40.3	17%	0.168	21%	0.212	C	C	.	.	H	α-helix	trans	-57.2	-41.9	-173.7	-169.1	-175.9	14.6	0	0	114	C320 H321 F325 L326 N327 Y364	C320-Q323 WeakPolarHBondContact O-CB 3.26Å; C320-Q323 PolarHBondContact O-N 3.35Å; H321-Q323 VanDerWaalsContact C-N 3.29Å; H321-Q323 PolarHBondContact O-N 3.27Å; Q323-F325 VanDerWaalsContact C-N 3.32Å; Q323-F325 PolarHBondContact O-N 2.97Å; Q323-L326 PolarHBondContact O-N 2.77Å; Q323-N327 WeakPolarHBondContact O-CB 3.3Å; Q323-N327 PolarHBondContact O-N 2.86Å; Q323-Y364 HydrophobicContact CG-CD2 3.83Å; Q323-Y364 HydrophobicContact CG-CE2 3.51Å
324	P	83.5	Confident	86	Confident	47 Å²	47	35.6 Å²	35.6	31%	0.305	19%	0.189	S	C	.	.	H	α-helix	trans	-63.9	-33.2	178.1	-23.4	35.8	0	0	0	113.7	H321 N327 E328 V376	H321-P324 VanDerWaalsContact O-CD 3.28Å; H321-P324 WeakPolarHBondContact O-CD 3.21Å; P324-N327 PolarHBondContact O-N 2.57Å; P324-E328 WeakPolarHBondContact O-CB 3.43Å; P324-E328 PolarHBondContact O-N 2.93Å; P324-V376 HydrophobicContact CG-CG1 4.22Å; P324-V376 WeakPolarHBondContact CG-O 3.45Å
325	F	88.9	Confident	85.5	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-71.9	-39.8	177.3	-179.8	-106.2	0	0	0	112	L295 I300 L311 I322 Q323 F329	L295-F325 HydrophobicContact CB-CD1 4.3Å; L295-F325 HydrophobicContact CB-CD2 3.84Å; L295-F325 HydrophobicContact CB-CE1 4.36Å; L295-F325 HydrophobicContact CB-CE2 3.91Å; L295-F325 HydrophobicContact CB-CG 4.04Å; L295-F325 HydrophobicContact CB-CZ 4.17Å; L295-F325 HydrophobicContact CD1-CE1 3.82Å; L295-F325 HydrophobicContact CD1-CE2 3.95Å; L295-F325 HydrophobicContact CD1-CZ 3.47Å; L295-F325 VanDerWaalsContact CD1-CZ 3.47Å; L295-F325 HydrophobicContact CG-CZ 4.47Å; L295-F325 WeakPolarHBondContact O-CB 3.46Å; I300-F325 HydrophobicContact CD1-CD2 4.32Å; I300-F325 HydrophobicContact CD1-CE2 4.02Å; I300-F325 HydrophobicContact CG1-CE2 4.33Å; I300-F325 HydrophobicContact CG2-CE2 4.38Å; L311-F325 HydrophobicContact CD1-CE1 4.21Å; L311-F325 HydrophobicContact CD1-CZ 4.17Å; I322-F325 PolarHBondContact O-N 2.96Å; I322-F325 VanDerWaalsContact O-N 3.16Å; Q323-F325 VanDerWaalsContact C-N 3.32Å; Q323-F325 PolarHBondContact O-N 2.97Å; F325-F329 HydrophobicContact CD1-CE2 4.42Å; F325-F329 AromaticContact CE1-CE2 3.85Å; F325-F329 HydrophobicContact CE1-CE2 3.85Å; F325-F329 HydrophobicContact CE2-CE2 4.05Å; F325-F329 AromaticContact CZ-CE2 3.65Å; F325-F329 HydrophobicContact CZ-CE2 3.65Å; F325-F329 HydrophobicContact CZ-CZ 4.4Å; F325-F329 WeakPolarHBondContact O-CD2 3.48Å
326	L	88.4	Confident	85.1	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-45.3	169.8	-74.4	175.1	0	0	0	111.8	I322 Q323 E328 F329 I330 L338 L359 V363 Y364 L367	I322-L326 HydrophobicContact CG2-CD1 3.93Å; I322-L326 HydrophobicContact CG2-CG 4.45Å; I322-L326 PolarHBondContact O-N 2.95Å; Q323-L326 PolarHBondContact O-N 2.77Å; L326-E328 VanDerWaalsContact C-N 3.3Å; L326-E328 PolarHBondContact O-N 2.87Å; L326-F329 PolarHBondContact O-N 3.29Å; L326-F329 VanDerWaalsContact O-N 3.16Å; L326-I330 WeakPolarHBondContact O-CG1 3.28Å; L326-I330 PolarHBondContact O-N 3Å; L326-I330 VanDerWaalsContact O-N 3.16Å; L326-L338 HydrophobicContact CD2-CD1 4.42Å; L326-L338 HydrophobicContact CD2-CD2 3.56Å; L326-L359 HydrophobicContact CD1-CD2 3.95Å; L326-L359 HydrophobicContact CD2-CD2 3.76Å; L326-L359 HydrophobicContact CG-CD2 4.11Å; L326-V363 HydrophobicContact CD1-CB 4.37Å; L326-V363 HydrophobicContact CD1-CG1 4.13Å; L326-Y364 HydrophobicContact CB-CD2 3.82Å; L326-Y364 HydrophobicContact CB-CG 4.46Å; L326-L367 HydrophobicContact CD1-CD1 4.32Å
327	N	85.6	Confident	85	Confident	56 Å²	56	38.1 Å²	38.1	30%	0.299	21%	0.208	S	C	.	.	H	α-helix	trans	-59.7	-40.6	-179.8	-166.2	25.1	0	0	0	111.9	Q323 P324 F329 I330 M331 Y364	Q323-N327 WeakPolarHBondContact O-CB 3.3Å; Q323-N327 PolarHBondContact O-N 2.86Å; P324-N327 PolarHBondContact O-N 2.57Å; N327-F329 VanDerWaalsContact C-N 3.33Å; N327-F329 PolarHBondContact O-N 2.98Å; N327-I330 PolarHBondContact O-N 2.87Å; N327-M331 WeakPolarHBondContact O-CB 3.24Å; N327-M331 WeakPolarHBondContact O-CG 3.31Å; N327-M331 PolarHBondContact O-N 2.84Å; N327-M331 WeakPolarHBondContact OD1-CG 3.37Å; N327-Y364 HydrophobicContact CB-CE2 3.81Å; N327-Y364 PolarHBondContact OD1-OH 2.98Å
328	E	85.8	Confident	84.9	Confident	36 Å²	36	36.4 Å²	36.4	17%	0.168	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-39	177.2	178.7	57.8	-121.8	0	0	112.2	I300 S301 P324 L326 T332 R334	I300-E328 HydrophobicContact CD1-CB 4.4Å; I300-E328 HydrophobicContact CD1-CG 3.83Å; I300-E328 HydrophobicContact CG1-CB 4.44Å; I300-E328 HydrophobicContact CG1-CG 3.56Å; S301-E328 WeakPolarHBondContact CB-OE2 3.43Å; S301-E328 VanDerWaalsContact OG-CD 3.27Å; S301-E328 PolarHBondContact OG-OE2 2.99Å; P324-E328 WeakPolarHBondContact O-CB 3.43Å; P324-E328 PolarHBondContact O-N 2.93Å; L326-E328 VanDerWaalsContact C-N 3.3Å; L326-E328 PolarHBondContact O-N 2.87Å; E328-T332 WeakPolarHBondContact O-CB 3.48Å; E328-T332 PolarHBondContact O-N 2.84Å; E328-T332 PolarHBondContact O-OG1 2.83Å; E328-T332 WeakPolarHBondContact OE1-CG2 3.33Å; E328-R334 IonicContact OE1-NH2 2.75Å; E328-R334 PolarHBondContact OE1-NH2 3.46Å
329	F	86.6	Confident	84.7	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-34.3	171.7	-81.1	-75.6	0	0	0	113.6	I300 I309 F325 L326 N327 N333 R334 L335 I337 L338	I300-F329 HydrophobicContact CD1-CD1 4.3Å; I300-F329 HydrophobicContact CD1-CD2 3.69Å; I300-F329 HydrophobicContact CD1-CE1 3.99Å; I300-F329 HydrophobicContact CD1-CE2 3.33Å; I300-F329 HydrophobicContact CD1-CG 4.16Å; I300-F329 HydrophobicContact CD1-CZ 3.49Å; I300-F329 VanDerWaalsContact CD1-CZ 3.49Å; I309-F329 HydrophobicContact CG2-CZ 4.2Å; F325-F329 HydrophobicContact CD1-CE2 4.42Å; F325-F329 AromaticContact CE1-CE2 3.85Å; F325-F329 HydrophobicContact CE1-CE2 3.85Å; F325-F329 HydrophobicContact CE2-CE2 4.05Å; F325-F329 AromaticContact CZ-CE2 3.65Å; F325-F329 HydrophobicContact CZ-CE2 3.65Å; F325-F329 HydrophobicContact CZ-CZ 4.4Å; F325-F329 WeakPolarHBondContact O-CD2 3.48Å; L326-F329 PolarHBondContact O-N 3.29Å; L326-F329 VanDerWaalsContact O-N 3.16Å; N327-F329 VanDerWaalsContact C-N 3.33Å; N327-F329 PolarHBondContact O-N 2.98Å; F329-N333 PolarHBondContact O-N 3.5Å; F329-R334 HydrophobicContact CD1-CB 3.72Å; F329-R334 HydrophobicContact CE1-CB 4.37Å; F329-R334 PolarHBondContact O-N 2.91Å; F329-L335 PolarHBondContact O-N 3.25Å; F329-I337 HydrophobicContact CE1-CB 4.13Å; F329-I337 HydrophobicContact CE1-CG2 4.16Å; F329-L338 HydrophobicContact CB-CB 4.41Å; F329-L338 HydrophobicContact CB-CD2 4.37Å; F329-L338 HydrophobicContact CD1-CB 4Å; F329-L338 HydrophobicContact CD2-CB 4.25Å; F329-L338 HydrophobicContact CD2-CD1 4Å; F329-L338 HydrophobicContact CD2-CD2 4.45Å; F329-L338 HydrophobicContact CD2-CG 4.46Å; F329-L338 HydrophobicContact CE1-CB 4.32Å; F329-L338 HydrophobicContact CE2-CD1 4Å; F329-L338 HydrophobicContact CG-CB 3.98Å; F329-L338 HydrophobicContact CG-CD2 4.49Å
330	I	83.6	Confident	84.7	Confident	43 Å²	43	49.2 Å²	49.2	22%	0.221	26%	0.258	C	S	.	.	H	α-helix	trans	-72	-54.5	179.3	-66.2	164.6	0	0	0	110	L326 N327 T332 N333 L335 E361 Y364	L326-I330 WeakPolarHBondContact O-CG1 3.28Å; L326-I330 PolarHBondContact O-N 3Å; L326-I330 VanDerWaalsContact O-N 3.16Å; N327-I330 PolarHBondContact O-N 2.87Å; I330-T332 VanDerWaalsContact C-N 3.25Å; I330-T332 PolarHBondContact O-N 2.88Å; I330-N333 PolarHBondContact O-N 3.48Å; I330-L335 HydrophobicContact CG1-CD1 4.35Å; I330-L335 HydrophobicContact CG1-CD2 4.01Å; I330-L335 HydrophobicContact CG1-CG 4.29Å; I330-E361 HydrophobicContact CD1-CG 4.3Å; I330-Y364 HydrophobicContact CD1-CD1 3.43Å; I330-Y364 VanDerWaalsContact CD1-CD1 3.43Å; I330-Y364 HydrophobicContact CD1-CD2 3.85Å; I330-Y364 HydrophobicContact CD1-CE1 3.9Å; I330-Y364 HydrophobicContact CD1-CE2 4.28Å; I330-Y364 HydrophobicContact CD1-CG 3.4Å
331	M	78.9	Confident	85	Confident	149 Å²	149	48 Å²	48	73%	0.734	25%	0.25	S	C	*	.	H	α-helix	trans	-60.9	-30.4	-177.7	-70.8	-64.9	-69.1	0	0	113.5	N327	N327-M331 WeakPolarHBondContact O-CB 3.24Å; N327-M331 WeakPolarHBondContact O-CG 3.31Å; N327-M331 PolarHBondContact O-N 2.84Å; N327-M331 WeakPolarHBondContact OD1-CG 3.37Å
332	T	80.3	Confident	85.3	Confident	58 Å²	58	48.3 Å²	48.3	36%	0.356	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	4.6	175	56.4	0	0	0	0	114.2	E328 I330 R334	E328-T332 WeakPolarHBondContact O-CB 3.48Å; E328-T332 PolarHBondContact O-N 2.84Å; E328-T332 PolarHBondContact O-OG1 2.83Å; E328-T332 WeakPolarHBondContact OE1-CG2 3.33Å; I330-T332 VanDerWaalsContact C-N 3.25Å; I330-T332 PolarHBondContact O-N 2.88Å; T332-R334 PolarHBondContact O-N 3.07Å; T332-R334 PolarHBondContact OG1-NE 2.87Å; T332-R334 PolarHBondContact OG1-NH2 2.83Å
333	N	80.5	Confident	85.5	Confident	140 Å²	140	48.5 Å²	48.5	75%	0.749	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	36.7	-177.2	-162	8.7	0	0	0	113.1	F329 I330	F329-N333 PolarHBondContact O-N 3.5Å; I330-N333 PolarHBondContact O-N 3.48Å
334	R	85.7	Confident	85.8	Confident	28 Å²	28	49.6 Å²	49.6	11%	0.106	27%	0.269	C	S	.	.			trans	-98.3	13.9	179.4	-71.8	-174.6	-68.4	-173.4	-0.1	112.8	I300 L303 E328 F329 T332 A336 I337 L338	I300-R334 PolarHBondContact O-NH1 2.93Å; I300-R334 PolarHBondContact O-NH2 2.96Å; L303-R334 PolarHBondContact O-NH1 3.16Å; E328-R334 IonicContact OE1-NH2 2.75Å; E328-R334 PolarHBondContact OE1-NH2 3.46Å; F329-R334 HydrophobicContact CD1-CB 3.72Å; F329-R334 HydrophobicContact CE1-CB 4.37Å; F329-R334 PolarHBondContact O-N 2.91Å; T332-R334 PolarHBondContact O-N 3.07Å; T332-R334 PolarHBondContact OG1-NE 2.87Å; T332-R334 PolarHBondContact OG1-NH2 2.83Å; R334-A336 PolarHBondContact O-N 3Å; R334-A336 VanDerWaalsContact O-N 3.11Å; R334-I337 HydrophobicContact CB-CD1 4.12Å; R334-I337 HydrophobicContact CB-CG1 4.49Å; R334-I337 HydrophobicContact CG-CD1 4.15Å; R334-I337 WeakPolarHBondContact O-CA 3.39Å; R334-I337 VanDerWaalsContact O-CB 3.28Å; R334-I337 WeakPolarHBondContact O-CB 3.31Å; R334-I337 PolarHBondContact O-N 3.41Å; R334-L338 PolarHBondContact O-N 2.84Å
335	L	82.9	Confident	86.1	Confident	28 Å²	28	47.4 Å²	47.4	15%	0.147	26%	0.255	C	S	.	.	H	α-helix	trans	-48.3	-37.8	179.9	-83	159.2	0	0	0	114.6	F329 I330 I337 L338 Q339 E361	F329-L335 PolarHBondContact O-N 3.25Å; I330-L335 HydrophobicContact CG1-CD1 4.35Å; I330-L335 HydrophobicContact CG1-CD2 4.01Å; I330-L335 HydrophobicContact CG1-CG 4.29Å; L335-I337 PolarHBondContact O-N 3.37Å; L335-L338 HydrophobicContact CD2-CD2 4.44Å; L335-L338 WeakPolarHBondContact O-CB 3.44Å; L335-L338 PolarHBondContact O-N 3.28Å; L335-L338 VanDerWaalsContact O-N 3.16Å; L335-Q339 WeakPolarHBondContact O-CG 3.25Å; L335-Q339 PolarHBondContact O-N 2.7Å; L335-E361 HydrophobicContact CD2-CB 4.07Å
336	A	84	Confident	86.2	Confident	58 Å²	58	48.1 Å²	48.1	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-68.1	-12.3	177.1	0	0	0	0	0	114.6	R334 K340	R334-A336 PolarHBondContact O-N 3Å; R334-A336 VanDerWaalsContact O-N 3.11Å; A336-K340 WeakPolarHBondContact O-CD 3.2Å; A336-K340 WeakPolarHBondContact O-CG 3.07Å
337	I	88.5	Confident	85.9	Confident	21 Å²	21	52.8 Å²	52.8	11%	0.108	29%	0.293	C	S	.	.	H	α-helix	trans	-85.4	-46.6	169.9	-54.5	-178.6	0	0	0	109.3	L306 I309 F329 R334 L335 Q339 K340 S341	L306-I337 HydrophobicContact CG-CD1 4.4Å; L306-I337 WeakPolarHBondContact O-CD1 3.46Å; I309-I337 HydrophobicContact CG2-CG2 4.16Å; F329-I337 HydrophobicContact CE1-CB 4.13Å; F329-I337 HydrophobicContact CE1-CG2 4.16Å; R334-I337 HydrophobicContact CB-CD1 4.12Å; R334-I337 HydrophobicContact CB-CG1 4.49Å; R334-I337 HydrophobicContact CG-CD1 4.15Å; R334-I337 WeakPolarHBondContact O-CA 3.39Å; R334-I337 VanDerWaalsContact O-CB 3.28Å; R334-I337 WeakPolarHBondContact O-CB 3.31Å; R334-I337 PolarHBondContact O-N 3.41Å; L335-I337 PolarHBondContact O-N 3.37Å; I337-Q339 PolarHBondContact O-N 3.14Å; I337-K340 PolarHBondContact O-N 3.44Å; I337-S341 PolarHBondContact O-N 3.01Å
338	L	88	Confident	85.7	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-56.3	-48.8	176.4	-179.9	66.8	0	0	0	111.5	L326 F329 R334 L335 K340 S341 L359	L326-L338 HydrophobicContact CD2-CD1 4.42Å; L326-L338 HydrophobicContact CD2-CD2 3.56Å; F329-L338 HydrophobicContact CB-CB 4.41Å; F329-L338 HydrophobicContact CB-CD2 4.37Å; F329-L338 HydrophobicContact CD1-CB 4Å; F329-L338 HydrophobicContact CD2-CB 4.25Å; F329-L338 HydrophobicContact CD2-CD1 4Å; F329-L338 HydrophobicContact CD2-CD2 4.45Å; F329-L338 HydrophobicContact CD2-CG 4.46Å; F329-L338 HydrophobicContact CE1-CB 4.32Å; F329-L338 HydrophobicContact CE2-CD1 4Å; F329-L338 HydrophobicContact CG-CB 3.98Å; F329-L338 HydrophobicContact CG-CD2 4.49Å; R334-L338 PolarHBondContact O-N 2.84Å; L335-L338 HydrophobicContact CD2-CD2 4.44Å; L335-L338 WeakPolarHBondContact O-CB 3.44Å; L335-L338 PolarHBondContact O-N 3.28Å; L335-L338 VanDerWaalsContact O-N 3.16Å; L338-K340 PolarHBondContact O-N 3.15Å; L338-K340 VanDerWaalsContact O-N 3.12Å; L338-S341 VanDerWaalsContact O-CB 3.27Å; L338-S341 WeakPolarHBondContact O-CB 3.42Å; L338-S341 PolarHBondContact O-N 2.75Å; L338-S341 PolarHBondContact O-OG 3.45Å; L338-L359 HydrophobicContact CD1-CB 4.34Å
339	Q	84.5	Confident	85.5	Confident	140 Å²	140	52.6 Å²	52.6	65%	0.654	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.8	176.5	-72.5	173.9	-13.4	0	0	113.8	L335 I337	L335-Q339 WeakPolarHBondContact O-CG 3.25Å; L335-Q339 PolarHBondContact O-N 2.7Å; I337-Q339 PolarHBondContact O-N 3.14Å
340	K	86.8	Confident	85	Confident	140 Å²	140	57.9 Å²	57.9	61%	0.609	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7	179.7	-68.6	177.5	-176.3	172.6	0	113.5	Y308 A336 I337 L338 G342	Y308-K340 HydrophobicContact CD2-CB 4.35Å; Y308-K340 HydrophobicContact CE2-CB 4.01Å; Y308-K340 VanDerWaalsContact CE2-O 3.3Å; Y308-K340 WeakPolarHBondContact CE2-O 3.08Å; Y308-K340 PolarHBondContact OH-O 3.4Å; A336-K340 WeakPolarHBondContact O-CD 3.2Å; A336-K340 WeakPolarHBondContact O-CG 3.07Å; I337-K340 PolarHBondContact O-N 3.44Å; L338-K340 PolarHBondContact O-N 3.15Å; L338-K340 VanDerWaalsContact O-N 3.12Å; K340-G342 VanDerWaalsContact C-N 3.26Å; K340-G342 PolarHBondContact O-N 3.39Å
341	S	89.5	Confident	85	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.007	33%	0.33	C	S	.	.	S	Bend	trans	-71.8	-19.4	-176.8	71.7	0	0	0	0	114.4	I309 L311 K312 I337 L338 A343	I309-S341 WeakPolarHBondContact O-CA 3.48Å; I309-S341 WeakPolarHBondContact O-CB 3.4Å; L311-S341 PolarHBondContact N-O 2.85Å; K312-S341 PolarHBondContact N-O 3.05Å; I337-S341 PolarHBondContact O-N 3.01Å; L338-S341 VanDerWaalsContact O-CB 3.27Å; L338-S341 WeakPolarHBondContact O-CB 3.42Å; L338-S341 PolarHBondContact O-N 2.75Å; L338-S341 PolarHBondContact O-OG 3.45Å; S341-A343 PolarHBondContact O-N 3.43Å; S341-A343 VanDerWaalsContact OG-CB 3.31Å; S341-A343 WeakPolarHBondContact OG-CB 3.25Å; S341-A343 PolarHBondContact OG-N 2.82Å
342	G	87.8	Confident	85	Confident	31 Å²	31	56 Å²	56	32%	0.32	33%	0.325	S	S	.	.			trans	61.2	18.5	-173	0	0	0	0	0	113.6	K312 K340	K312-G342 WeakPolarHBondContact CA-O 3.38Å; K340-G342 VanDerWaalsContact C-N 3.26Å; K340-G342 PolarHBondContact O-N 3.39Å
343	A	90.5	Very high	85.1	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	34%	0.335	C	S	.	.			trans	-67.5	131.6	173.3	0	0	0	0	0	110.2	L311 L316 S341 L359	L311-A343 HydrophobicContact CB-CB 3.66Å; L311-A343 HydrophobicContact CD1-CB 4.01Å; L316-A343 HydrophobicContact CD1-CB 3.94Å; S341-A343 PolarHBondContact O-N 3.43Å; S341-A343 VanDerWaalsContact OG-CB 3.31Å; S341-A343 WeakPolarHBondContact OG-CB 3.25Å; S341-A343 PolarHBondContact OG-N 2.82Å; A343-L359 HydrophobicContact CB-CB 4.03Å; A343-L359 HydrophobicContact CB-CD1 3.61Å; A343-L359 HydrophobicContact CB-CG 4.42Å; A343-L359 PolarHBondContact O-N 3.06Å
344	V	91	Very high	85.4	Confident	59 Å²	59	50.8 Å²	50.8	36%	0.358	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-131.5	137.8	-176.5	177.9	0	0	0	0	109	S346 G356	V344-S346 PolarHBondContact O-N 2.75Å; V344-G356 VanDerWaalsContact CG1-CA 3.49Å; V344-G356 WeakPolarHBondContact CG1-O 3.28Å
345	C	91	Very high	85.5	Confident	1 Å²	1	53 Å²	53	1%	0.007	31%	0.312	C	S	.	.			trans	-65.1	124.1	175.5	-67.8	0	0	0	0	110.9	C318 L354 G356 Y357	C318-C345 HydrophobicContact CB-CB 3.62Å; C318-C345 WeakPolarHBondContact CB-SG 3.35Å; C318-C345 WeakPolarHBondContact SG-CA 3.12Å; C318-C345 WeakPolarHBondContact SG-CB 3.31Å; C318-C345 CovalentContact SG-SG 2.02Å; C318-C345 PolarHBondContact SG-SG 2.04Å; C345-L354 HydrophobicContact CB-CB 4.3Å; C345-L354 WeakPolarHBondContact CB-O 3.4Å; C345-G356 PolarHBondContact O-N 2.03Å; C345-Y357 WeakPolarHBondContact CB-O 3.43Å; C345-Y357 PolarHBondContact N-O 2.84Å
346	S	90.7	Very high	85.6	Confident	17 Å²	17	54.4 Å²	54.4	12%	0.119	33%	0.333	C	S	.	.			trans	-85	173.3	-175.2	74.8	0	0	0	0	113	P315 L316 V344 L348 S349 H355	P315-S346 VanDerWaalsContact C-CB 3.45Å; P315-S346 PolarHBondContact O-OG 3.11Å; P315-S346 VanDerWaalsContact O-OG 3.13Å; L316-S346 VanDerWaalsContact O-CB 3.27Å; L316-S346 WeakPolarHBondContact O-CB 3.47Å; L316-S346 PolarHBondContact O-N 2.9Å; L316-S346 PolarHBondContact O-OG 2.93Å; V344-S346 PolarHBondContact O-N 2.75Å; S346-L348 PolarHBondContact O-N 2.77Å; S346-L348 WeakPolarHBondContact OG-CB 3.17Å; S346-L348 PolarHBondContact OG-N 2.99Å; S346-S349 VanDerWaalsContact O-CB 3.3Å; S346-S349 WeakPolarHBondContact O-CB 3.38Å; S346-S349 PolarHBondContact O-N 3.26Å; S346-S349 VanDerWaalsContact O-N 3.13Å; S346-S349 PolarHBondContact O-OG 3.18Å; S346-H355 PolarHBondContact O-CD2 3.36Å
347	S	81.7	Confident	85.8	Confident	98 Å²	98	55.9 Å²	55.9	69%	0.685	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-5.2	172.1	51	0	0	0	0	115	S349 H355	S347-S349 VanDerWaalsContact C-N 3.29Å; S347-H355 PolarHBondContact O-CE1 2.93Å
348	L	80.6	Confident	85.8	Confident	84 Å²	84	58.4 Å²	58.4	44%	0.44	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.8	169.7	-59.4	177.5	0	0	0	112.5	I293 P315 Q317 S346	I293-L348 HydrophobicContact CG2-CD1 3.79Å; P315-L348 HydrophobicContact CB-CD1 4.22Å; Q317-L348 HydrophobicContact CB-CB 4.17Å; Q317-L348 HydrophobicContact CG-CB 4.29Å; S346-L348 PolarHBondContact O-N 2.77Å; S346-L348 WeakPolarHBondContact OG-CB 3.17Å; S346-L348 PolarHBondContact OG-N 2.99Å
349	S	83.2	Confident	85.7	Confident	5 Å²	5	58.5 Å²	58.5	4%	0.035	35%	0.345	C	S	.	.	S	Bend	trans	-62.6	135.3	178.7	-45.5	0	0	0	0	110.6	C318 S346 S347 D351 H355	C318-S349 WeakPolarHBondContact CB-OG 3.35Å; C318-S349 PolarHBondContact N-OG 3.08Å; S346-S349 VanDerWaalsContact O-CB 3.3Å; S346-S349 WeakPolarHBondContact O-CB 3.38Å; S346-S349 PolarHBondContact O-N 3.26Å; S346-S349 VanDerWaalsContact O-N 3.13Å; S346-S349 PolarHBondContact O-OG 3.18Å; S347-S349 VanDerWaalsContact C-N 3.29Å; S349-D351 PolarHBondContact O-N 2.75Å; S349-H355 PolarHBondContact O-NE2 2.82Å
350	T	75.3	Confident	85.7	Confident	111 Å²	111	52.8 Å²	52.8	68%	0.681	32%	0.32	S	S	*	.	S	Bend	trans	-67.9	-22.3	-175.9	52.3	0	0	0	0	113.9	D319	D319-T350 HydrophobicContact CB-CG2 4.49Å
351	D	82.6	Confident	85.3	Confident	57 Å²	57	50 Å²	50	31%	0.305	31%	0.31	S	S	.	.			trans	-97.8	113.3	173.6	-174.4	-18.4	0	0	0	110.4	S349 S353 L354 H355	S349-D351 PolarHBondContact O-N 2.75Å; D351-S353 PolarHBondContact O-N 3.32Å; D351-S353 WeakPolarHBondContact OD1-CA 3.05Å; D351-S353 VanDerWaalsContact OD1-CB 3.26Å; D351-S353 WeakPolarHBondContact OD1-CB 3.11Å; D351-S353 PolarHBondContact OD1-N 3.25Å; D351-S353 PolarHBondContact OD1-OG 3.14Å; D351-S353 PolarHBondContact OD2-OG 3.15Å; D351-S353 VanDerWaalsContact OD2-OG 3.14Å; D351-L354 HydrophobicContact CB-CD1 4.14Å; D351-L354 HydrophobicContact CB-CG 4.15Å; D351-L354 PolarHBondContact O-N 2.79Å; D351-H355 PolarHBondContact O-CD2 3.45Å; D351-H355 VanDerWaalsContact O-CD2 3.27Å
352	P	80.7	Confident	84.9	Confident	96 Å²	96	53.9 Å²	53.9	62%	0.623	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-62.3	-22.5	176.9	-23.4	35.1	0	0	0	114.5	L354 H355	P352-L354 PolarHBondContact O-N 3.48Å; P352-H355 WeakPolarHBondContact O-CB 3.21Å; P352-H355 PolarHBondContact O-N 3.49Å
353	S	82.4	Confident	84.8	Confident	82 Å²	82	52.4 Å²	52.4	57%	0.573	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-71.2	-20.2	178	75.6	0	0	0	0	113	D351	D351-S353 PolarHBondContact O-N 3.32Å; D351-S353 WeakPolarHBondContact OD1-CA 3.05Å; D351-S353 VanDerWaalsContact OD1-CB 3.26Å; D351-S353 WeakPolarHBondContact OD1-CB 3.11Å; D351-S353 PolarHBondContact OD1-N 3.25Å; D351-S353 PolarHBondContact OD1-OG 3.14Å; D351-S353 PolarHBondContact OD2-OG 3.15Å; D351-S353 VanDerWaalsContact OD2-OG 3.14Å
354	L	86.9	Confident	84.4	Confident	5 Å²	5	55 Å²	55	3%	0.026	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-85.2	-10.6	173.1	-62.1	-179.5	0	0	0	112.8	C318 C345 D351 P352 G356 Y357 V363 T366 L367	C318-L354 HydrophobicContact CB-CD1 4.13Å; C345-L354 HydrophobicContact CB-CB 4.3Å; C345-L354 WeakPolarHBondContact CB-O 3.4Å; D351-L354 HydrophobicContact CB-CD1 4.14Å; D351-L354 HydrophobicContact CB-CG 4.15Å; D351-L354 PolarHBondContact O-N 2.79Å; P352-L354 PolarHBondContact O-N 3.48Å; L354-G356 PolarHBondContact O-N 2.73Å; L354-Y357 WeakPolarHBondContact O-CB 3.14Å; L354-Y357 PolarHBondContact O-N 3.37Å; L354-V363 HydrophobicContact CD1-CG1 4.37Å; L354-V363 HydrophobicContact CD2-CG2 4.49Å; L354-T366 HydrophobicContact CD2-CG2 4.12Å; L354-L367 HydrophobicContact CD1-CD2 4.15Å
355	H	87.7	Confident	83.9	Confident	76 Å²	76	58.3 Å²	58.3	35%	0.352	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	119.8	-177.2	-68.4	-169.3	0	0	0	110.6	S346 S347 S349 D351 P352 Y357	S346-H355 PolarHBondContact O-CD2 3.36Å; S347-H355 PolarHBondContact O-CE1 2.93Å; S349-H355 PolarHBondContact O-NE2 2.82Å; D351-H355 PolarHBondContact O-CD2 3.45Å; D351-H355 VanDerWaalsContact O-CD2 3.27Å; P352-H355 WeakPolarHBondContact O-CB 3.21Å; P352-H355 PolarHBondContact O-N 3.49Å; H355-Y357 VanDerWaalsContact C-N 3.32Å
356	G	85	Confident	83.4	Confident	57 Å²	57	61.5 Å²	61.5	59%	0.588	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	1.4	-174.4	0	0	0	0	0	114.9	V344 C345 L354	V344-G356 VanDerWaalsContact CG1-CA 3.49Å; V344-G356 WeakPolarHBondContact CG1-O 3.28Å; C345-G356 PolarHBondContact O-N 2.03Å; L354-G356 PolarHBondContact O-N 2.73Å
357	Y	88.2	Confident	82.9	Confident	89 Å²	89	61.7 Å²	61.7	35%	0.349	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-81.9	135.6	-180	-153.8	-84.2	0	0	0	111.7	C345 L354 H355 N362 V363	C345-Y357 WeakPolarHBondContact CB-O 3.43Å; C345-Y357 PolarHBondContact N-O 2.84Å; L354-Y357 WeakPolarHBondContact O-CB 3.14Å; L354-Y357 PolarHBondContact O-N 3.37Å; H355-Y357 VanDerWaalsContact C-N 3.32Å; Y357-N362 HydrophobicContact CE1-CB 4.13Å; Y357-N362 PolarHBondContact OH-ND2 3.16Å; Y357-N362 VanDerWaalsContact OH-ND2 3.08Å; Y357-V363 HydrophobicContact CD1-CG2 3.63Å; Y357-V363 HydrophobicContact CE1-CG2 4.15Å
358	P	87.3	Confident	82.4	Confident	73 Å²	73	66 Å²	66	47%	0.474	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-71.1	134.1	179.7	28	-35	0	0	0	112.3	S360 V363	P358-S360 WeakPolarHBondContact O-CB 3.38Å; P358-S360 PolarHBondContact O-N 3.28Å; P358-S360 VanDerWaalsContact O-N 3.16Å; P358-S360 PolarHBondContact O-OG 2.93Å; P358-V363 WeakPolarHBondContact O-CG2 3.03Å
359	L	86.9	Confident	82.1	Confident	4 Å²	4	63 Å²	63	2%	0.021	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-60.7	118.4	177.1	-87.7	155.7	0	0	0	110.4	L316 I322 L326 L338 A343 V363	L316-L359 HydrophobicContact CB-CD1 4.23Å; L316-L359 HydrophobicContact CD1-CD1 3.63Å; I322-L359 HydrophobicContact CG2-CD2 4.48Å; L326-L359 HydrophobicContact CD1-CD2 3.95Å; L326-L359 HydrophobicContact CD2-CD2 3.76Å; L326-L359 HydrophobicContact CG-CD2 4.11Å; L338-L359 HydrophobicContact CD1-CB 4.34Å; A343-L359 HydrophobicContact CB-CB 4.03Å; A343-L359 HydrophobicContact CB-CD1 3.61Å; A343-L359 HydrophobicContact CB-CG 4.42Å; A343-L359 PolarHBondContact O-N 3.06Å; L359-V363 HydrophobicContact CD2-CG1 4.29Å
360	S	83.3	Confident	81.2	Confident	19 Å²	19	66.5 Å²	66.5	13%	0.133	37%	0.373	C	S	.	.	S	Bend	trans	-160.9	171.9	-164.7	54.3	0	0	0	0	110.5	P358 N362 V363 Y364	P358-S360 WeakPolarHBondContact O-CB 3.38Å; P358-S360 PolarHBondContact O-N 3.28Å; P358-S360 VanDerWaalsContact O-N 3.16Å; P358-S360 PolarHBondContact O-OG 2.93Å; S360-N362 PolarHBondContact O-N 3.14Å; S360-V363 WeakPolarHBondContact O-CB 3.36Å; S360-V363 PolarHBondContact O-N 2.86Å; S360-Y364 PolarHBondContact O-N 2.7Å
361	E	79.1	Confident	80.3	Confident	82 Å²	82	69.4 Å²	69.4	38%	0.383	38%	0.384	S	S	.	.	H	α-helix	trans	-58.2	-33.4	175.6	-159.1	-176.3	149.8	0	0	112.2	I330 L335 V363 Y364 Q365	I330-E361 HydrophobicContact CD1-CG 4.3Å; L335-E361 HydrophobicContact CD2-CB 4.07Å; E361-V363 VanDerWaalsContact C-N 3.33Å; E361-V363 PolarHBondContact O-N 2.03Å; E361-Y364 WeakPolarHBondContact O-CB 3.32Å; E361-Y364 PolarHBondContact O-N 2.93Å; E361-Y364 VanDerWaalsContact O-N 3.16Å; E361-Q365 WeakPolarHBondContact O-CG 3.01Å; E361-Q365 PolarHBondContact O-N 2.78Å; E361-Q365 PolarHBondContact OE1-NE2 2.61Å
362	N	81.4	Confident	78.7	Confident	82 Å²	82	74.5 Å²	74.5	44%	0.439	41%	0.411	S	S	.	.	H	α-helix	trans	-57.1	-45	173.4	-63.7	6.1	0	0	0	111.5	Y357 S360 Y364 Q365 T366	Y357-N362 HydrophobicContact CE1-CB 4.13Å; Y357-N362 PolarHBondContact OH-ND2 3.16Å; Y357-N362 VanDerWaalsContact OH-ND2 3.08Å; S360-N362 PolarHBondContact O-N 3.14Å; N362-Y364 VanDerWaalsContact C-N 3.32Å; N362-Y364 PolarHBondContact O-N 3.47Å; N362-Q365 PolarHBondContact O-N 3.16Å; N362-Q365 VanDerWaalsContact O-N 3.17Å; N362-T366 WeakPolarHBondContact O-CB 3.15Å; N362-T366 PolarHBondContact O-N 3.27Å; N362-T366 PolarHBondContact O-OG1 2.76Å
363	V	85.2	Confident	77	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-62.6	-41.7	177.8	-178.7	0	0	0	0	110.6	C318 L326 L354 Y357 P358 L359 S360 E361 Q365 T366 L367	C318-V363 HydrophobicContact CB-CG1 4.31Å; L326-V363 HydrophobicContact CD1-CB 4.37Å; L326-V363 HydrophobicContact CD1-CG1 4.13Å; L354-V363 HydrophobicContact CD1-CG1 4.37Å; L354-V363 HydrophobicContact CD2-CG2 4.49Å; Y357-V363 HydrophobicContact CD1-CG2 3.63Å; Y357-V363 HydrophobicContact CE1-CG2 4.15Å; P358-V363 WeakPolarHBondContact O-CG2 3.03Å; L359-V363 HydrophobicContact CD2-CG1 4.29Å; S360-V363 WeakPolarHBondContact O-CB 3.36Å; S360-V363 PolarHBondContact O-N 2.86Å; E361-V363 VanDerWaalsContact C-N 3.33Å; E361-V363 PolarHBondContact O-N 2.03Å; V363-Q365 VanDerWaalsContact C-N 3.31Å; V363-Q365 PolarHBondContact O-N 3.09Å; V363-T366 PolarHBondContact O-N 2.03Å; V363-L367 HydrophobicContact CG1-CD1 4Å; V363-L367 HydrophobicContact CG1-CG 4.34Å; V363-L367 WeakPolarHBondContact O-CB 3.16Å; V363-L367 VanDerWaalsContact O-CG 3.24Å; V363-L367 WeakPolarHBondContact O-CG 3.29Å; V363-L367 PolarHBondContact O-N 2.97Å
364	Y	82.9	Confident	75.3	Confident	59 Å²	59	73.7 Å²	73.7	23%	0.231	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-36.9	175.3	-180	-95.9	0	0	0	112.8	Q323 L326 N327 I330 S360 E361 N362	Q323-Y364 HydrophobicContact CG-CD2 3.83Å; Q323-Y364 HydrophobicContact CG-CE2 3.51Å; L326-Y364 HydrophobicContact CB-CD2 3.82Å; L326-Y364 HydrophobicContact CB-CG 4.46Å; N327-Y364 HydrophobicContact CB-CE2 3.81Å; N327-Y364 PolarHBondContact OD1-OH 2.98Å; I330-Y364 HydrophobicContact CD1-CD1 3.43Å; I330-Y364 VanDerWaalsContact CD1-CD1 3.43Å; I330-Y364 HydrophobicContact CD1-CD2 3.85Å; I330-Y364 HydrophobicContact CD1-CE1 3.9Å; I330-Y364 HydrophobicContact CD1-CE2 4.28Å; I330-Y364 HydrophobicContact CD1-CG 3.4Å; S360-Y364 PolarHBondContact O-N 2.7Å; E361-Y364 WeakPolarHBondContact O-CB 3.32Å; E361-Y364 PolarHBondContact O-N 2.93Å; E361-Y364 VanDerWaalsContact O-N 3.16Å; N362-Y364 VanDerWaalsContact C-N 3.32Å; N362-Y364 PolarHBondContact O-N 3.47Å
365	Q	79.7	Confident	73.6	Confident	127 Å²	127	78.7 Å²	78.7	59%	0.593	42%	0.418	S	S	*	.	H	α-helix	trans	-78.4	-29.6	177.5	-66.6	177.7	16.6	0	0	113.2	E361 N362 V363	E361-Q365 WeakPolarHBondContact O-CG 3.01Å; E361-Q365 PolarHBondContact O-N 2.78Å; E361-Q365 PolarHBondContact OE1-NE2 2.61Å; N362-Q365 PolarHBondContact O-N 3.16Å; N362-Q365 VanDerWaalsContact O-N 3.17Å; V363-Q365 VanDerWaalsContact C-N 3.31Å; V363-Q365 PolarHBondContact O-N 3.09Å
366	T	81.1	Confident	72	Confident	69 Å²	69	76.5 Å²	76.5	42%	0.423	41%	0.41	S	S	.	.	H	α-helix	trans	-76.3	-30.5	177	-61.9	0	0	0	0	112.7	L354 N362 V363 Q368	L354-T366 HydrophobicContact CD2-CG2 4.12Å; N362-T366 WeakPolarHBondContact O-CB 3.15Å; N362-T366 PolarHBondContact O-N 3.27Å; N362-T366 PolarHBondContact O-OG1 2.76Å; V363-T366 PolarHBondContact O-N 2.03Å; T366-Q368 PolarHBondContact O-N 2.84Å
367	L	80	Confident	70.5	Confident	20 Å²	20	80.7 Å²	80.7	11%	0.105	41%	0.414	C	S	.	.			trans	-68.6	91.5	178.4	-76	171.2	0	0	0	111.9	I322 L326 L354 V363 C369	I322-L367 HydrophobicContact CG2-CD1 3.94Å; L326-L367 HydrophobicContact CD1-CD1 4.32Å; L354-L367 HydrophobicContact CD1-CD2 4.15Å; V363-L367 HydrophobicContact CG1-CD1 4Å; V363-L367 HydrophobicContact CG1-CG 4.34Å; V363-L367 WeakPolarHBondContact O-CB 3.16Å; V363-L367 VanDerWaalsContact O-CG 3.24Å; V363-L367 WeakPolarHBondContact O-CG 3.29Å; V363-L367 PolarHBondContact O-N 2.97Å; L367-C369 PolarHBondContact O-N 3.28Å
368	Q	71.7	Confident	68.9	Low	189 Å²	189	78.9 Å²	78.9	88%	0.883	41%	0.408	S	S	*	.			trans	-73.2	71.2	177.1	-67.3	-171.3	-7.5	0	0	112.3	T366	T366-Q368 PolarHBondContact O-N 2.84Å
369	C	73.7	Confident	67.8	Low	20 Å²	20	76.3 Å²	76.3	14%	0.135	39%	0.391	C	S	.	.			trans	-88.9	132.4	-176.9	-61	0	0	0	0	112.2	C320 L367 L371 V376	C320-C369 WeakPolarHBondContact CA-SG 3.33Å; C320-C369 HydrophobicContact CB-CB 3.85Å; C320-C369 WeakPolarHBondContact CB-SG 3.37Å; C320-C369 WeakPolarHBondContact SG-CA 3.3Å; C320-C369 WeakPolarHBondContact SG-CB 3Å; C320-C369 CovalentContact SG-SG 2.04Å; C320-C369 PolarHBondContact SG-SG 3.26Å; L367-C369 PolarHBondContact O-N 3.28Å; C369-L371 PolarHBondContact O-N 3.2Å; C369-V376 HydrophobicContact CB-CG2 4.31Å
370	P	65.1	Low	66.8	Low	80 Å²	80	76.7 Å²	76.7	52%	0.519	39%	0.394	S	S	.	.			trans	-68.8	128.6	176.3	-11.4	25.4	0	0	0	110.3	D372 S373	P370-D372 PolarHBondContact O-N 3.48Å; P370-D372 VanDerWaalsContact O-N 3.1Å; P370-S373 PolarHBondContact O-N 3.19Å; P370-S373 VanDerWaalsContact O-N 3.1Å
371	L	55.3	Low	66	Low	172 Å²	172	83.9 Å²	83.9	90%	0.901	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-30.4	-175.5	-72.2	164.3	0	0	0	113.9	C369	C369-L371 PolarHBondContact O-N 3.2Å
372	D	49.7	Very low	65.3	Low	163 Å²	163	85.9 Å²	85.9	87%	0.872	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	16.9	-176.8	-55.7	-64.4	0	0	0	113.6	P370	P370-D372 PolarHBondContact O-N 3.48Å; P370-D372 VanDerWaalsContact O-N 3.1Å
373	S	45.3	Very low	64.5	Low	35 Å²	35	82 Å²	82	25%	0.245	41%	0.414	C	S	.	.			trans	-84.8	129	180	-176.7	0	0	0	0	112.9	P370 M375 V376	P370-S373 PolarHBondContact O-N 3.19Å; P370-S373 VanDerWaalsContact O-N 3.1Å; S373-M375 PolarHBondContact O-N 2.98Å; S373-M375 WeakPolarHBondContact OG-CB 3.22Å; S373-M375 PolarHBondContact OG-N 3.34Å; S373-V376 PolarHBondContact O-N 2.86Å
374	E	45.1	Very low	63.3	Low	127 Å²	127	84.8 Å²	84.8	59%	0.593	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-53.5	-25.6	171.3	-62.4	-176.6	-165.3	0	0	113.3	V376 Q377 K378	E374-V376 PolarHBondContact O-N 3.27Å; E374-Q377 PolarHBondContact O-N 3.12Å; E374-Q377 VanDerWaalsContact O-N 3.13Å; E374-K378 HydrophobicContact CB-CD 4.35Å; E374-K378 PolarHBondContact O-N 3.01Å; E374-K378 IonicContact OE2-NZ 3.72Å; E374-K378 PolarHBondContact OE2-NZ 2.88Å
375	M	51.6	Low	61.8	Low	110 Å²	110	86.6 Å²	86.6	54%	0.542	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-65	-14.9	177.6	-61.2	-175.5	69.8	0	0	113.8	H321 S373 Q377	H321-M375 PolarHBondContact CD2-O 3.29Å; H321-M375 PolarHBondContact NE2-O 3.1Å; S373-M375 PolarHBondContact O-N 2.98Å; S373-M375 WeakPolarHBondContact OG-CB 3.22Å; S373-M375 PolarHBondContact OG-N 3.34Å; M375-Q377 VanDerWaalsContact C-N 3.34Å
376	V	55.4	Low	60.4	Low	30 Å²	30	84.3 Å²	84.3	18%	0.182	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-79.9	-20.1	175.8	-173.7	0	0	0	0	111.5	C320 P324 C369 S373 E374	C320-V376 HydrophobicContact CB-CG2 4.35Å; P324-V376 HydrophobicContact CG-CG1 4.22Å; P324-V376 WeakPolarHBondContact CG-O 3.45Å; C369-V376 HydrophobicContact CB-CG2 4.31Å; S373-V376 PolarHBondContact O-N 2.86Å; E374-V376 PolarHBondContact O-N 3.27Å
377	Q	51.6	Low	59	Low	144 Å²	144	84.1 Å²	84.1	67%	0.673	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	-35	-172.8	-60.8	-169	18.6	0	0	114.5	E374 M375	E374-Q377 PolarHBondContact O-N 3.12Å; E374-Q377 VanDerWaalsContact O-N 3.13Å; M375-Q377 VanDerWaalsContact C-N 3.34Å
378	K	54.5	Low	57.1	Low	52 Å²	52	93.8 Å²	93.8	23%	0.226	47%	0.472	C	S	.	.	S	Bend	trans	-78.2	128.5	-176.6	-69.6	171.3	-175.7	176.2	0	109.8	H321 E374 I399 E400	H321-K378 PolarHBondContact CD2-O 3.4Å; E374-K378 HydrophobicContact CB-CD 4.35Å; E374-K378 PolarHBondContact O-N 3.01Å; E374-K378 IonicContact OE2-NZ 3.72Å; E374-K378 PolarHBondContact OE2-NZ 2.88Å; K378-I399 HydrophobicContact CG-CG2 4.22Å; K378-E400 WeakPolarHBondContact CE-OE1 3.44Å; K378-E400 IonicContact NZ-OE1 3.55Å; K378-E400 PolarHBondContact NZ-OE1 3.43Å
379	P	64.4	Low	55.9	Low	18 Å²	18	89.7 Å²	89.7	12%	0.117	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-68.2	158.3	177.9	28.9	-32.4	0	0	0	110.6	W294 C383 I384	W294-P379 HydrophobicContact CD2-CB 4.29Å; W294-P379 HydrophobicContact CE3-CB 3.9Å; W294-P379 HydrophobicContact CH2-CB 3.62Å; W294-P379 HydrophobicContact CZ2-CB 4.05Å; W294-P379 HydrophobicContact CZ3-CB 3.56Å; P379-C383 HydrophobicContact CB-CB 4.16Å; P379-I384 HydrophobicContact CG-CG1 3.84Å; P379-I384 VanDerWaalsContact O-CD1 3.3Å; P379-I384 WeakPolarHBondContact O-CD1 3.09Å; P379-I384 WeakPolarHBondContact O-CG1 3.08Å
380	P	67.1	Low	54.8	Low	12 Å²	12	91.9 Å²	91.9	8%	0.078	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-52.8	145.4	178.4	-28.2	36	0	0	0	112.6	I293 W294 H321 Q382 C383 I384	I293-P380 HydrophobicContact CD1-CB 4.08Å; W294-P380 HydrophobicContact CB-CG 3.78Å; W294-P380 HydrophobicContact CG-CG 3.96Å; H321-P380 HydrophobicContact CB-CG 4.36Å; P380-Q382 PolarHBondContact O-N 2.04Å; P380-C383 WeakPolarHBondContact O-CA 3.43Å; P380-C383 WeakPolarHBondContact O-CB 3.49Å; P380-C383 PolarHBondContact O-N 2.82Å; P380-I384 PolarHBondContact O-N 3.25Å
381	Q	65.5	Low	54.2	Low	170 Å²	170	89.8 Å²	89.8	79%	0.794	47%	0.467	S	S	*	.	H	α-helix	trans	-56.8	-30.3	-170.7	-119.8	-179.8	4	0	0	114.3	C383 I384 S385	Q381-C383 VanDerWaalsContact C-N 3.33Å; Q381-C383 PolarHBondContact O-N 3Å; Q381-I384 HydrophobicContact CG-CD1 4.41Å; Q381-I384 PolarHBondContact O-N 3.11Å; Q381-S385 PolarHBondContact O-N 3.33Å
382	Q	64.5	Low	54.1	Low	125 Å²	125	89.3 Å²	89.3	58%	0.584	47%	0.465	S	S	*	.	H	α-helix	trans	-62.7	-35.8	172.7	-74.5	-178.4	-21.6	0	0	112.6	I293 P380 L386	I293-Q382 HydrophobicContact CD1-CB 3.89Å; P380-Q382 PolarHBondContact O-N 2.04Å; Q382-L386 WeakPolarHBondContact O-CD1 3.37Å; Q382-L386 WeakPolarHBondContact O-CG 3.35Å
383	C	65.6	Low	54.5	Low	0 Å²	0	84.1 Å²	84.1	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-72.8	-39.2	173.1	-61.8	0	0	0	0	112.3	C270 P379 P380 Q381 S385 L386 I387	C270-C383 HydrophobicContact CB-CB 3.77Å; C270-C383 WeakPolarHBondContact CB-SG 3.44Å; C270-C383 WeakPolarHBondContact SG-CA 3.5Å; C270-C383 WeakPolarHBondContact SG-CB 3.4Å; C270-C383 CovalentContact SG-SG 2.03Å; C270-C383 PolarHBondContact SG-SG 3.22Å; P379-C383 HydrophobicContact CB-CB 4.16Å; P380-C383 WeakPolarHBondContact O-CA 3.43Å; P380-C383 WeakPolarHBondContact O-CB 3.49Å; P380-C383 PolarHBondContact O-N 2.82Å; Q381-C383 VanDerWaalsContact C-N 3.33Å; Q381-C383 PolarHBondContact O-N 3Å; C383-S385 PolarHBondContact O-N 3.38Å; C383-L386 PolarHBondContact O-N 3.07Å; C383-I387 HydrophobicContact CB-CD1 4.04Å; C383-I387 WeakPolarHBondContact O-CG1 3.42Å; C383-I387 PolarHBondContact O-N 3.38Å; C383-I387 VanDerWaalsContact O-N 3.11Å
384	I	60.5	Low	55.5	Low	58 Å²	58	86.8 Å²	86.8	30%	0.297	46%	0.461	S	S	.	.	H	α-helix	trans	-56.8	-38.8	178.9	-63	174.3	0	0	0	111	P379 P380 Q381 L386 I399	P379-I384 HydrophobicContact CG-CG1 3.84Å; P379-I384 VanDerWaalsContact O-CD1 3.3Å; P379-I384 WeakPolarHBondContact O-CD1 3.09Å; P379-I384 WeakPolarHBondContact O-CG1 3.08Å; P380-I384 PolarHBondContact O-N 3.25Å; Q381-I384 HydrophobicContact CG-CD1 4.41Å; Q381-I384 PolarHBondContact O-N 3.11Å; I384-L386 VanDerWaalsContact C-N 3.3Å; I384-L386 PolarHBondContact O-N 3Å; I384-I399 HydrophobicContact CD1-CD1 3.57Å; I384-I399 HydrophobicContact CG1-CD1 3.85Å; I384-I399 HydrophobicContact CG2-CD1 4.09Å
385	S	50.5	Low	57	Low	97 Å²	97	81 Å²	81	68%	0.678	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.2	178.3	-165.1	0	0	0	0	114.8	Q381 C383	Q381-S385 PolarHBondContact O-N 3.33Å; C383-S385 PolarHBondContact O-N 3.38Å
386	L	50.7	Low	58	Low	80 Å²	80	81.2 Å²	81.2	42%	0.419	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-20.7	-176.2	-71.5	171.7	0	0	0	113.8	T246 V269 Q382 C383 I384	T246-L386 HydrophobicContact CG2-CB 4.26Å; T246-L386 HydrophobicContact CG2-CD2 4.27Å; V269-L386 HydrophobicContact CB-CD1 4.06Å; V269-L386 HydrophobicContact CG1-CD1 4.29Å; V269-L386 HydrophobicContact CG2-CD1 4.48Å; Q382-L386 WeakPolarHBondContact O-CD1 3.37Å; Q382-L386 WeakPolarHBondContact O-CG 3.35Å; C383-L386 PolarHBondContact O-N 3.07Å; I384-L386 VanDerWaalsContact C-N 3.3Å; I384-L386 PolarHBondContact O-N 3Å
387	I	50.9	Low	58.8	Low	65 Å²	65	81.7 Å²	81.7	33%	0.333	44%	0.442	S	S	.	.	S	Bend	trans	-95.5	7.2	-176.2	-60.9	165.9	0	0	0	111.4	C270 C383 S389	C270-I387 HydrophobicContact CB-CD1 4.44Å; C383-I387 HydrophobicContact CB-CD1 4.04Å; C383-I387 WeakPolarHBondContact O-CG1 3.42Å; C383-I387 PolarHBondContact O-N 3.38Å; C383-I387 VanDerWaalsContact O-N 3.11Å; I387-S389 PolarHBondContact O-N 3.15Å
388	R	41.2	Very low	59.4	Low	223 Å²	223	77.2 Å²	77.2	84%	0.842	43%	0.426	S	S	*	.			trans	-84.2	72.5	-164.2	-157.9	179.2	-165	-177.4	4.7	114.2
389	S	46.5	Very low	59.4	Low	102 Å²	102	79 Å²	79	71%	0.713	44%	0.437	S	S	*	.			trans	-148.1	106.3	175.1	57.6	0	0	0	0	114	I387	I387-S389 PolarHBondContact O-N 3.15Å
390	S	49.6	Very low	59	Low	66 Å²	66	82.7 Å²	82.7	46%	0.462	45%	0.453	S	S	.	.	S	Bend	trans	175.8	-46.5	156.7	34.6	0	0	0	0	112.3	D392	S390-D392 VanDerWaalsContact C-N 3.29Å; S390-D392 PolarHBondContact O-N 2.98Å
391	C	52.9	Low	59.1	Low	37 Å²	37	82.7 Å²	82.7	25%	0.25	46%	0.455	C	S	.	.			trans	-78.7	73.5	179.6	-62	0	0	0	0	112.5	G393 C397 P418	C391-G393 PolarHBondContact O-N 3.12Å; C391-C397 HydrophobicContact CB-CB 3.75Å; C391-C397 WeakPolarHBondContact CB-SG 3.39Å; C391-C397 WeakPolarHBondContact SG-CB 3.21Å; C391-C397 CovalentContact SG-SG 2.03Å; C391-C397 PolarHBondContact SG-SG 2.98Å; C391-P418 VanDerWaalsContact SG-CD 3.59Å
392	D	52.7	Low	59.8	Low	161 Å²	161	76.5 Å²	76.5	86%	0.861	43%	0.429	S	S	*	.			trans	-79.4	65	-176.7	-153.7	14.9	0	0	0	112.2	S390 I394	S390-D392 VanDerWaalsContact C-N 3.29Å; S390-D392 PolarHBondContact O-N 2.98Å; D392-I394 PolarHBondContact O-N 3.39Å
393	G	57.6	Low	60.7	Low	54 Å²	54	70.6 Å²	70.6	56%	0.557	40%	0.401	S	S	*	.	S	Bend	trans	88.3	-31	168.1	0	0	0	0	0	117.3	C391 C395 R408	C391-G393 PolarHBondContact O-N 3.12Å; G393-C395 VanDerWaalsContact C-N 3.32Å; G393-C395 PolarHBondContact O-N 2.97Å; G393-R408 PolarHBondContact O-NH1 3.48Å
394	I	66.8	Low	61.6	Low	92 Å²	92	73.3 Å²	73.3	47%	0.472	42%	0.415	S	S	.	.	S	Bend	trans	-64	-35.4	-175.5	-56.1	180	0	0	0	112.3	D392 R408 L410 P414	D392-I394 PolarHBondContact O-N 3.39Å; I394-R408 VanDerWaalsContact O-CZ 3.31Å; I394-R408 PolarHBondContact O-NH1 3.19Å; I394-L410 HydrophobicContact CG2-CD2 3.86Å; I394-P414 HydrophobicContact CG2-CG 4.26Å
395	C	77.3	Confident	62.9	Low	6 Å²	6	70.5 Å²	70.5	4%	0.041	40%	0.401	C	S	.	.	S	Bend	trans	-133.5	156.1	174.9	-52.6	0	0	0	0	110.3	G393 N404 C405 L417	G393-C395 VanDerWaalsContact C-N 3.32Å; G393-C395 PolarHBondContact O-N 2.97Å; C395-N404 WeakPolarHBondContact CA-O 3.44Å; C395-C405 HydrophobicContact CB-CB 4.03Å; C395-C405 WeakPolarHBondContact CB-SG 3.03Å; C395-C405 WeakPolarHBondContact SG-CB 3.23Å; C395-C405 CovalentContact SG-SG 2.03Å; C395-C405 PolarHBondContact SG-SG 3.16Å; C395-L417 HydrophobicContact CB-CD2 3.94Å
396	D	72.9	Confident	64.7	Low	114 Å²	114	69.6 Å²	69.6	61%	0.61	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	139	168.5	-173.4	16.5	0	0	0	109.2	N404	D396-N404 PolarHBondContact N-O 3.03Å; D396-N404 PolarHBondContact O-N 3.24Å
397	C	70.8	Confident	66.3	Low	40 Å²	40	71.9 Å²	71.9	27%	0.27	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	118.6	-165.8	-65.6	0	0	0	0	111.7	C391 V402	C391-C397 HydrophobicContact CB-CB 3.75Å; C391-C397 WeakPolarHBondContact CB-SG 3.39Å; C391-C397 WeakPolarHBondContact SG-CB 3.21Å; C391-C397 CovalentContact SG-SG 2.03Å; C391-C397 PolarHBondContact SG-SG 2.98Å; C397-V402 WeakPolarHBondContact CA-O 3Å
398	S	64.6	Low	67.8	Low	49 Å²	49	74 Å²	74	34%	0.343	40%	0.403	S	S	.	.			trans	-87.2	155.4	178.7	91.3	0	0	0	0	112.5	E400 G401 V402	S398-E400 PolarHBondContact O-N 3.3Å; S398-E400 PolarHBondContact OG-N 3.34Å; S398-G401 PolarHBondContact O-N 2.8Å; S398-G401 VanDerWaalsContact O-N 3.12Å; S398-V402 PolarHBondContact N-O 3.05Å; S398-V402 WeakPolarHBondContact OG-CB 3.32Å; S398-V402 PolarHBondContact OG-N 2.85Å
399	I	55.4	Low	69.9	Low	91 Å²	91	65.5 Å²	65.5	47%	0.467	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.3	173.8	-61.4	170.1	0	0	0	111.6	K378 I384 G401	K378-I399 HydrophobicContact CG-CG2 4.22Å; I384-I399 HydrophobicContact CD1-CD1 3.57Å; I384-I399 HydrophobicContact CG1-CD1 3.85Å; I384-I399 HydrophobicContact CG2-CD1 4.09Å; I399-G401 PolarHBondContact O-N 3.43Å
400	E	55.2	Low	71.6	Confident	95 Å²	95	61.9 Å²	61.9	44%	0.444	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	7.3	175.6	-63.7	146	-144.8	0	0	112.4	K378 S398 V402	K378-E400 WeakPolarHBondContact CE-OE1 3.44Å; K378-E400 IonicContact NZ-OE1 3.55Å; K378-E400 PolarHBondContact NZ-OE1 3.43Å; S398-E400 PolarHBondContact O-N 3.3Å; S398-E400 PolarHBondContact OG-N 3.34Å; E400-V402 HydrophobicContact CB-CG2 4.49Å
401	G	70.3	Confident	73.2	Confident	11 Å²	11	65.9 Å²	65.9	11%	0.113	37%	0.365	C	S	.	.	S	Bend	trans	77	24.9	-179.7	0	0	0	0	0	113.9	S398 I399 I421 M422 E423	S398-G401 PolarHBondContact O-N 2.8Å; S398-G401 VanDerWaalsContact O-N 3.12Å; I399-G401 PolarHBondContact O-N 3.43Å; G401-I421 CarbonylContact O-C 3.26Å; G401-I421 WeakPolarHBondContact O-CA 3.05Å; G401-I421 WeakPolarHBondContact O-CB 3.43Å; G401-M422 PolarHBondContact O-N 2.04Å; G401-E423 PolarHBondContact O-N 3.17Å
402	V	78.6	Confident	74.7	Confident	41 Å²	41	68.1 Å²	68.1	25%	0.248	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	113.2	176.2	-176.4	0	0	0	0	109.7	C397 S398 E400 E423	C397-V402 WeakPolarHBondContact CA-O 3Å; S398-V402 PolarHBondContact N-O 3.05Å; S398-V402 WeakPolarHBondContact OG-CB 3.32Å; S398-V402 PolarHBondContact OG-N 2.85Å; E400-V402 HydrophobicContact CB-CG2 4.49Å; V402-E423 HydrophobicContact CB-CB 4.39Å; V402-E423 HydrophobicContact CG1-CB 4.17Å; V402-E423 HydrophobicContact CG2-CB 4.12Å; V402-E423 HydrophobicContact CG2-CG 4.16Å
403	A	85.4	Confident	76.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.2	170.5	0	0	0	0	0	110.6	L417 I421 E423 L424 N425	A403-L417 HydrophobicContact CB-CD1 4.05Å; A403-I421 HydrophobicContact CB-CD1 4.15Å; A403-I421 HydrophobicContact CB-CG2 4.26Å; A403-E423 PolarHBondContact N-O 3.14Å; A403-L424 HydrophobicContact CB-CD1 3.9Å; A403-L424 WeakPolarHBondContact O-CA 3.37Å; A403-N425 PolarHBondContact O-N 2.74Å
404	N	84.2	Confident	77.4	Confident	57 Å²	57	59.3 Å²	59.3	31%	0.305	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	102.7	179	-168.2	15.5	0	0	0	111.8	C395 D396 Q406 N425	C395-N404 WeakPolarHBondContact CA-O 3.44Å; D396-N404 PolarHBondContact N-O 3.03Å; D396-N404 PolarHBondContact O-N 3.24Å; N404-Q406 VanDerWaalsContact OD1-CB 3.29Å; N404-Q406 WeakPolarHBondContact OD1-CB 3.36Å; N404-Q406 PolarHBondContact OD1-N 3.35Å; N404-N425 PolarHBondContact OD1-ND2 3.12Å
405	C	87.8	Confident	77.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.			trans	-110.4	20.9	179.7	-52.1	0	0	0	0	111.9	C395 R408 L410 N425 L426 N429	C395-C405 HydrophobicContact CB-CB 4.03Å; C395-C405 WeakPolarHBondContact CB-SG 3.03Å; C395-C405 WeakPolarHBondContact SG-CB 3.23Å; C395-C405 CovalentContact SG-SG 2.03Å; C395-C405 PolarHBondContact SG-SG 3.16Å; C405-R408 VanDerWaalsContact O-CG 3.3Å; C405-R408 WeakPolarHBondContact O-CG 3.37Å; C405-L410 HydrophobicContact CB-CD1 3.82Å; C405-N425 CarbonylContact C-O 3.59Å; C405-N425 VanDerWaalsContact C-O 3.31Å; C405-N425 VanDerWaalsContact CA-O 3.25Å; C405-N425 WeakPolarHBondContact CA-O 3.49Å; C405-N425 VanDerWaalsContact CB-O 3.27Å; C405-N425 WeakPolarHBondContact CB-O 3.17Å; C405-N425 PolarHBondContact N-O 2.82Å; C405-L426 HydrophobicContact CB-CD2 3.67Å; C405-L426 HydrophobicContact CB-CG 4.38Å; C405-N429 PolarHBondContact O-ND2 3.03Å
406	Q	87	Confident	77.4	Confident	78 Å²	78	65.3 Å²	65.3	36%	0.364	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	140.3	-176.1	-174.7	-179.7	21.5	0	0	112.7	N404 R408 N425 D427	N404-Q406 VanDerWaalsContact OD1-CB 3.29Å; N404-Q406 WeakPolarHBondContact OD1-CB 3.36Å; N404-Q406 PolarHBondContact OD1-N 3.35Å; Q406-R408 WeakPolarHBondContact O-CG 3.18Å; Q406-R408 PolarHBondContact O-N 3.03Å; Q406-N425 PolarHBondContact N-O 2.6Å; Q406-N425 PolarHBondContact OE1-ND2 3.34Å; Q406-D427 VanDerWaalsContact CA-O 3.28Å; Q406-D427 WeakPolarHBondContact CA-O 3.34Å; Q406-D427 HydrophobicContact CG-CB 4.04Å; Q406-D427 WeakPolarHBondContact CG-O 3.29Å; Q406-D427 PolarHBondContact NE2-OD2 3.37Å
407	N	84.9	Confident	77.6	Confident	127 Å²	127	60.5 Å²	60.5	68%	0.679	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	46.6	175.3	-164	30.1	0	0	0	114.1	D427 H428	N407-D427 PolarHBondContact N-O 2.85Å; N407-H428 VanDerWaalsContact CA-O 3.27Å; N407-H428 WeakPolarHBondContact CA-O 3.05Å; N407-H428 HydrophobicContact CB-CB 4.22Å
408	R	83.5	Confident	77.7	Confident	111 Å²	111	60 Å²	60	42%	0.419	33%	0.326	S	S	.	.	S	Bend	trans	-112.1	1.7	-177.5	-59.5	-55.4	-168.6	103.8	5.1	114.1	G393 I394 C405 Q406 L410 N429	G393-R408 PolarHBondContact O-NH1 3.48Å; I394-R408 VanDerWaalsContact O-CZ 3.31Å; I394-R408 PolarHBondContact O-NH1 3.19Å; C405-R408 VanDerWaalsContact O-CG 3.3Å; C405-R408 WeakPolarHBondContact O-CG 3.37Å; Q406-R408 WeakPolarHBondContact O-CG 3.18Å; Q406-R408 PolarHBondContact O-N 3.03Å; R408-L410 VanDerWaalsContact C-N 3.31Å; R408-L410 HydrophobicContact CB-CD1 4.1Å; R408-L410 HydrophobicContact CB-CD2 4.48Å; R408-L410 HydrophobicContact CB-CG 3.87Å; R408-L410 PolarHBondContact O-N 3.38Å; R408-N429 WeakPolarHBondContact CA-OD1 3.22Å; R408-N429 PolarHBondContact N-OD1 2.93Å
409	G	83.5	Confident	78	Confident	43 Å²	43	64.1 Å²	64.1	44%	0.443	34%	0.337	S	S	.	.			trans	69.4	23.7	-178.9	0	0	0	0	0	114.4	K411 N429	G409-K411 PolarHBondContact O-N 2.99Å; G409-N429 PolarHBondContact N-OD1 3Å
410	L	82.7	Confident	78.7	Confident	26 Å²	26	64.2 Å²	64.2	14%	0.136	34%	0.339	C	S	.	.			trans	-70	128.4	-172.2	-65	169.9	0	0	0	112.1	I394 C405 R408 P414 L426 N429 E430 L431	I394-L410 HydrophobicContact CG2-CD2 3.86Å; C405-L410 HydrophobicContact CB-CD1 3.82Å; R408-L410 VanDerWaalsContact C-N 3.31Å; R408-L410 HydrophobicContact CB-CD1 4.1Å; R408-L410 HydrophobicContact CB-CD2 4.48Å; R408-L410 HydrophobicContact CB-CG 3.87Å; R408-L410 PolarHBondContact O-N 3.38Å; L410-P414 HydrophobicContact CD1-CG 4.06Å; L410-P414 HydrophobicContact CD2-CG 4.49Å; L410-L426 HydrophobicContact CD1-CD2 3.74Å; L410-N429 HydrophobicContact CB-CB 4.14Å; L410-N429 PolarHBondContact N-OD1 3.36Å; L410-E430 CarbonylContact O-C 3.31Å; L410-E430 WeakPolarHBondContact O-CA 3.42Å; L410-E430 PolarHBondContact O-N 2.89Å; L410-L431 PolarHBondContact O-N 3.45Å
411	K	83.5	Confident	80	Confident	150 Å²	150	59.9 Å²	59.9	65%	0.652	32%	0.319	S	S	*	.	S	Bend	trans	-97.5	-13.7	176	-66.7	177.1	179.2	178.6	0	113.2	G409 E430	G409-K411 PolarHBondContact O-N 2.99Å; K411-E430 WeakPolarHBondContact CE-OE2 3.26Å; K411-E430 HydrophobicContact CG-CB 3.93Å; K411-E430 IonicContact NZ-OE2 2.66Å
412	S	84.5	Confident	80.5	Confident	84 Å²	84	62.3 Å²	62.3	59%	0.587	33%	0.328	S	S	*	.	S	Bend	trans	-142	159.9	173.2	59.6	0	0	0	0	109.9
413	I	85.9	Confident	81	Confident	16 Å²	16	63.1 Å²	63.1	8%	0.082	33%	0.329	C	S	.	.			trans	-68.2	135.1	172.1	-63	160.5	0	0	0	108.6	L426 L434 F439	I413-L426 HydrophobicContact CG1-CD1 3.99Å; I413-L426 HydrophobicContact CG2-CD1 4.4Å; I413-L434 HydrophobicContact CD1-CD2 4.01Å; I413-F439 HydrophobicContact CD1-CD1 4.28Å; I413-F439 HydrophobicContact CD1-CE1 3.63Å; I413-F439 HydrophobicContact CD1-CE2 4.11Å; I413-F439 HydrophobicContact CD1-CZ 3.52Å; I413-F439 HydrophobicContact CG1-CE1 4.36Å; I413-F439 HydrophobicContact CG2-CE1 4.48Å
414	P	81.3	Confident	81.4	Confident	15 Å²	15	63.2 Å²	63.2	10%	0.097	33%	0.33	C	S	.	.			trans	-65.3	141.8	171.5	-20.2	33.2	0	0	0	111.2	I394 L410 L417 Y442	I394-P414 HydrophobicContact CG2-CG 4.26Å; L410-P414 HydrophobicContact CD1-CG 4.06Å; L410-P414 HydrophobicContact CD2-CG 4.49Å; P414-L417 HydrophobicContact CB-CD1 4.36Å; P414-L417 HydrophobicContact CB-CG 4.26Å; P414-Y442 PolarHBondContact O-OH 2.03Å
415	N	73.5	Confident	81.8	Confident	97 Å²	97	61.9 Å²	61.9	52%	0.519	32%	0.322	S	S	.	.	S	Bend	trans	-100.6	-11.5	-179.7	-67.9	-41.8	0	0	0	113.7	Y442	N415-Y442 VanDerWaalsContact CA-OH 3.25Å; N415-Y442 WeakPolarHBondContact CA-OH 3.35Å; N415-Y442 PolarHBondContact O-OH 3.07Å
416	D	69.7	Low	82.1	Confident	126 Å²	126	61.9 Å²	61.9	67%	0.674	32%	0.322	S	S	*	.			trans	-101.3	8.4	-165.2	-44.5	-74.5	0	0	0	113.8	Y442	D416-Y442 PolarHBondContact N-OH 3.49Å
417	L	77.1	Confident	82.5	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.068	31%	0.308	C	S	.	.	S	Bend	trans	-69.5	160.9	174.2	-56.3	172.2	0	0	0	111.9	C395 A403 P414 I421 L424 Y442	C395-L417 HydrophobicContact CB-CD2 3.94Å; A403-L417 HydrophobicContact CB-CD1 4.05Å; P414-L417 HydrophobicContact CB-CD1 4.36Å; P414-L417 HydrophobicContact CB-CG 4.26Å; L417-I421 HydrophobicContact CB-CD1 4.3Å; L417-I421 HydrophobicContact CD1-CD1 4.23Å; L417-L424 HydrophobicContact CD1-CD1 3.8Å; L417-Y442 HydrophobicContact CB-CE1 3.81Å; L417-Y442 PolarHBondContact N-OH 3.32Å; L417-Y442 WeakPolarHBondContact O-CE1 3.34Å
418	P	73.5	Confident	82.9	Confident	31 Å²	31	57.3 Å²	57.3	20%	0.201	30%	0.297	C	S	.	.			trans	-55.4	141.1	172.8	-22	30.7	0	0	0	112.3	C391 D420 I421 Y442	C391-P418 VanDerWaalsContact SG-CD 3.59Å; P418-D420 VanDerWaalsContact C-N 3.27Å; P418-D420 WeakPolarHBondContact CB-OD1 3.27Å; P418-D420 PolarHBondContact O-N 2.85Å; P418-I421 HydrophobicContact CB-CG2 4.06Å; P418-I421 HydrophobicContact CG-CG2 4.37Å; P418-I421 WeakPolarHBondContact O-CG1 3.29Å; P418-I421 WeakPolarHBondContact O-CG2 3.38Å; P418-Y442 WeakPolarHBondContact O-CD1 3.41Å
419	K	70.2	Confident	83.3	Confident	134 Å²	134	52.5 Å²	52.5	58%	0.583	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-14.9	-173.4	-68	164.5	-173.6	150.7	0	113.3
420	D	71.5	Confident	83.6	Confident	94 Å²	94	53.5 Å²	53.5	50%	0.503	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-2.8	-176.1	62.1	-35.6	0	0	0	114	P418 M422 N444	P418-D420 VanDerWaalsContact C-N 3.27Å; P418-D420 WeakPolarHBondContact CB-OD1 3.27Å; P418-D420 PolarHBondContact O-N 2.85Å; D420-M422 PolarHBondContact O-N 2.79Å; D420-N444 WeakPolarHBondContact O-CB 3.01Å; D420-N444 PolarHBondContact O-ND2 2.86Å
421	I	81.3	Confident	84	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.267	C	S	.	.			trans	-50.7	135.5	179	59.9	176.6	0	0	0	112.7	G401 A403 L417 P418 L424 Y442 N444 L445	G401-I421 CarbonylContact O-C 3.26Å; G401-I421 WeakPolarHBondContact O-CA 3.05Å; G401-I421 WeakPolarHBondContact O-CB 3.43Å; A403-I421 HydrophobicContact CB-CD1 4.15Å; A403-I421 HydrophobicContact CB-CG2 4.26Å; L417-I421 HydrophobicContact CB-CD1 4.3Å; L417-I421 HydrophobicContact CD1-CD1 4.23Å; P418-I421 HydrophobicContact CB-CG2 4.06Å; P418-I421 HydrophobicContact CG-CG2 4.37Å; P418-I421 WeakPolarHBondContact O-CG1 3.29Å; P418-I421 WeakPolarHBondContact O-CG2 3.38Å; I421-L424 HydrophobicContact CD1-CB 4.4Å; I421-Y442 HydrophobicContact CD1-CD1 3.68Å; I421-Y442 HydrophobicContact CD1-CD2 4.3Å; I421-Y442 HydrophobicContact CD1-CE1 4.16Å; I421-Y442 HydrophobicContact CD1-CG 3.79Å; I421-Y442 HydrophobicContact CG1-CD1 3.83Å; I421-Y442 HydrophobicContact CG1-CG 4.07Å; I421-N444 CarbonylContact O-C 3.57Å; I421-L445 HydrophobicContact CD1-CD2 4.15Å; I421-L445 HydrophobicContact CG1-CD2 3.91Å; I421-L445 HydrophobicContact CG1-CG 4.36Å; I421-L445 PolarHBondContact O-N 2.66Å
422	M	81.6	Confident	84.1	Confident	62 Å²	62	50.1 Å²	50.1	31%	0.305	26%	0.261	S	S	.	.	S	Bend	trans	-102.4	-24	-179.2	-49.4	-156.6	97.6	0	0	112	G401 D420 R446 K447	G401-M422 PolarHBondContact O-N 2.04Å; D420-M422 PolarHBondContact O-N 2.79Å; M422-R446 HydrophobicContact CE-CG 4.48Å; M422-R446 WeakPolarHBondContact O-CA 3.42Å; M422-R446 PolarHBondContact O-N 3.08Å; M422-K447 PolarHBondContact O-N 3.18Å; M422-K447 VanDerWaalsContact O-N 3.1Å
423	E	88.4	Confident	84.1	Confident	58 Å²	58	48.8 Å²	48.8	27%	0.271	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.4	172.2	-50.4	-156.3	142	0	0	112.1	G401 V402 A403 K447	G401-E423 PolarHBondContact O-N 3.17Å; V402-E423 HydrophobicContact CB-CB 4.39Å; V402-E423 HydrophobicContact CG1-CB 4.17Å; V402-E423 HydrophobicContact CG2-CB 4.12Å; V402-E423 HydrophobicContact CG2-CG 4.16Å; A403-E423 PolarHBondContact N-O 3.14Å; E423-K447 VanDerWaalsContact CA-O 3.31Å; E423-K447 WeakPolarHBondContact CA-O 3.05Å; E423-K447 HydrophobicContact CB-CB 4.21Å; E423-K447 HydrophobicContact CG-CB 3.84Å; E423-K447 WeakPolarHBondContact OE1-CB 3.18Å; E423-K447 VanDerWaalsContact OE1-CD 3.3Å; E423-K447 WeakPolarHBondContact OE1-CD 3.42Å; E423-K447 WeakPolarHBondContact OE1-CE 3.26Å; E423-K447 IonicContact OE1-NZ 3.57Å; E423-K447 PolarHBondContact OE1-NZ 3.45Å; E423-K447 WeakPolarHBondContact OE2-CE 3.15Å; E423-K447 IonicContact OE2-NZ 2.78Å; E423-K447 PolarHBondContact OE2-NZ 3.01Å
424	L	93.1	Very high	84.1	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	117.8	175.6	177	57.3	0	0	0	110.1	A403 L417 I421 L426 F439 Y442 L445 K447 I448 V449	A403-L424 HydrophobicContact CB-CD1 3.9Å; A403-L424 WeakPolarHBondContact O-CA 3.37Å; L417-L424 HydrophobicContact CD1-CD1 3.8Å; I421-L424 HydrophobicContact CD1-CB 4.4Å; L424-L426 HydrophobicContact CD1-CD1 4.35Å; L424-L426 HydrophobicContact CD1-CG 4.15Å; L424-L426 HydrophobicContact CD2-CD1 3.85Å; L424-L426 HydrophobicContact CG-CD1 3.88Å; L424-L426 HydrophobicContact CG-CG 4.08Å; L424-F439 HydrophobicContact CD2-CD1 4.04Å; L424-F439 HydrophobicContact CD2-CE1 3.95Å; L424-Y442 HydrophobicContact CD2-CD2 4.48Å; L424-L445 HydrophobicContact CB-CD1 4.33Å; L424-L445 HydrophobicContact CB-CD2 3.72Å; L424-L445 HydrophobicContact CD2-CD1 4.33Å; L424-K447 PolarHBondContact N-O 2.88Å; L424-I448 WeakPolarHBondContact O-CA 3.38Å; L424-V449 PolarHBondContact O-N 3.43Å
425	N	93.8	Very high	84	Confident	29 Å²	29	50.9 Å²	50.9	16%	0.155	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	110.7	178	-176.4	19.7	0	0	0	110.9	A403 N404 C405 Q406 D427	A403-N425 PolarHBondContact O-N 2.74Å; N404-N425 PolarHBondContact OD1-ND2 3.12Å; C405-N425 CarbonylContact C-O 3.59Å; C405-N425 VanDerWaalsContact C-O 3.31Å; C405-N425 VanDerWaalsContact CA-O 3.25Å; C405-N425 WeakPolarHBondContact CA-O 3.49Å; C405-N425 VanDerWaalsContact CB-O 3.27Å; C405-N425 WeakPolarHBondContact CB-O 3.17Å; C405-N425 PolarHBondContact N-O 2.82Å; Q406-N425 PolarHBondContact N-O 2.6Å; Q406-N425 PolarHBondContact OE1-ND2 3.34Å; N425-D427 WeakPolarHBondContact OD1-CB 3.25Å; N425-D427 PolarHBondContact OD1-N 3.49Å
426	L	94.2	Very high	84.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.			trans	-116.4	19.2	178.9	-72.8	159.8	0	0	0	111.8	C405 L410 I413 L424 N429 L431 F439 V449 L450 N453	C405-L426 HydrophobicContact CB-CD2 3.67Å; C405-L426 HydrophobicContact CB-CG 4.38Å; L410-L426 HydrophobicContact CD1-CD2 3.74Å; I413-L426 HydrophobicContact CG1-CD1 3.99Å; I413-L426 HydrophobicContact CG2-CD1 4.4Å; L424-L426 HydrophobicContact CD1-CD1 4.35Å; L424-L426 HydrophobicContact CD1-CG 4.15Å; L424-L426 HydrophobicContact CD2-CD1 3.85Å; L424-L426 HydrophobicContact CG-CD1 3.88Å; L424-L426 HydrophobicContact CG-CG 4.08Å; L426-N429 VanDerWaalsContact C-ND2 3.31Å; L426-N429 PolarHBondContact O-ND2 2.04Å; L426-L431 HydrophobicContact CB-CD1 4.28Å; L426-L431 HydrophobicContact CD1-CD1 4.42Å; L426-F439 HydrophobicContact CD1-CE1 4.37Å; L426-V449 WeakPolarHBondContact CA-O 3.38Å; L426-V449 WeakPolarHBondContact CB-O 3.47Å; L426-V449 PolarHBondContact N-O 2.91Å; L426-L450 HydrophobicContact CB-CD2 3.93Å; L426-L450 HydrophobicContact CD1-CD2 3.82Å; L426-N453 PolarHBondContact O-ND2 2.87Å
427	D	94.1	Very high	84.5	Confident	13 Å²	13	44.3 Å²	44.3	7%	0.07	23%	0.231	C	C	.	.			trans	-58	150.3	178.6	173.9	52.7	0	0	0	113.6	Q406 N407 N425 N429 V449 D451 N452	Q406-D427 VanDerWaalsContact CA-O 3.28Å; Q406-D427 WeakPolarHBondContact CA-O 3.34Å; Q406-D427 HydrophobicContact CG-CB 4.04Å; Q406-D427 WeakPolarHBondContact CG-O 3.29Å; Q406-D427 PolarHBondContact NE2-OD2 3.37Å; N407-D427 PolarHBondContact N-O 2.85Å; N425-D427 WeakPolarHBondContact OD1-CB 3.25Å; N425-D427 PolarHBondContact OD1-N 3.49Å; D427-N429 PolarHBondContact O-ND2 3.47Å; D427-V449 HydrophobicContact CB-CG1 4.03Å; D427-D451 WeakPolarHBondContact CA-O 3.13Å; D427-D451 VanDerWaalsContact OD1-C 3.31Å; D427-D451 WeakPolarHBondContact OD1-CB 3.38Å; D427-N452 PolarHBondContact OD1-ND2 3.22Å
428	H	93.5	Very high	84.7	Confident	96 Å²	96	44.3 Å²	44.3	44%	0.444	23%	0.232	S	C	.	.	S	Bend	trans	53.6	53	-178.2	-72.7	80.1	0	0	0	113.8	N407 D451 N452	N407-H428 VanDerWaalsContact CA-O 3.27Å; N407-H428 WeakPolarHBondContact CA-O 3.05Å; N407-H428 HydrophobicContact CB-CB 4.22Å; H428-D451 PolarHBondContact N-O 3.21Å; H428-N452 WeakPolarHBondContact CA-O 3.2Å; H428-N452 PolarHBondContact CE1-ND2 2.87Å; H428-N452 VanDerWaalsContact CE1-ND2 3.33Å
429	N	91.5	Very high	85.5	Confident	9 Å²	9	42.9 Å²	42.9	5%	0.048	22%	0.223	C	C	.	.	S	Bend	trans	-124.2	-176.5	176.8	-78.9	-65.4	0	0	0	112.1	C405 R408 G409 L410 L426 D427 L431 N453	C405-N429 PolarHBondContact O-ND2 3.03Å; R408-N429 WeakPolarHBondContact CA-OD1 3.22Å; R408-N429 PolarHBondContact N-OD1 2.93Å; G409-N429 PolarHBondContact N-OD1 3Å; L410-N429 HydrophobicContact CB-CB 4.14Å; L410-N429 PolarHBondContact N-OD1 3.36Å; L426-N429 VanDerWaalsContact C-ND2 3.31Å; L426-N429 PolarHBondContact O-ND2 2.04Å; D427-N429 PolarHBondContact O-ND2 3.47Å; N429-L431 HydrophobicContact CB-CG 4.49Å; N429-N453 WeakPolarHBondContact CA-OD1 3.37Å; N429-N453 WeakPolarHBondContact CB-OD1 3.23Å; N429-N453 PolarHBondContact N-ND2 3.08Å; N429-N453 PolarHBondContact O-OD1 2.92Å
430	E	91.4	Very high	86.1	Confident	64 Å²	64	39.3 Å²	39.3	30%	0.299	21%	0.209	S	C	.	.			trans	-104	28.3	-177.4	-59.2	-154.1	135.5	0	0	112.9	L410 K411 I432 R454	L410-E430 CarbonylContact O-C 3.31Å; L410-E430 WeakPolarHBondContact O-CA 3.42Å; L410-E430 PolarHBondContact O-N 2.89Å; K411-E430 WeakPolarHBondContact CE-OE2 3.26Å; K411-E430 HydrophobicContact CG-CB 3.93Å; K411-E430 IonicContact NZ-OE2 2.66Å; E430-I432 PolarHBondContact O-N 2.9Å; E430-R454 IonicContact OE1-CZ 3.93Å; E430-R454 IonicContact OE1-NH2 3.75Å; E430-R454 PolarHBondContact OE1-NH2 3.48Å
431	L	90.4	Very high	86.2	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	21%	0.206	C	C	.	.			trans	-67.1	122.1	179.6	-58	175.6	0	0	0	110.5	L410 L426 N429 L450 N453 R454 I455	L410-L431 PolarHBondContact O-N 3.45Å; L426-L431 HydrophobicContact CB-CD1 4.28Å; L426-L431 HydrophobicContact CD1-CD1 4.42Å; N429-L431 HydrophobicContact CB-CG 4.49Å; L431-L450 HydrophobicContact CD1-CD2 3.63Å; L431-N453 HydrophobicContact CB-CB 4.29Å; L431-N453 VanDerWaalsContact CB-OD1 3.24Å; L431-N453 WeakPolarHBondContact CB-OD1 3.04Å; L431-N453 WeakPolarHBondContact CG-OD1 3.48Å; L431-N453 PolarHBondContact N-OD1 3.12Å; L431-N453 VanDerWaalsContact N-OD1 3.1Å; L431-R454 CarbonylContact O-C 3.44Å; L431-R454 VanDerWaalsContact O-CA 3.3Å; L431-R454 WeakPolarHBondContact O-CA 3.35Å; L431-R454 PolarHBondContact O-N 2.75Å; L431-I455 HydrophobicContact CB-CD1 4.33Å; L431-I455 HydrophobicContact CB-CG1 3.98Å; L431-I455 WeakPolarHBondContact O-CG1 3.45Å; L431-I455 PolarHBondContact O-N 3.27Å
432	I	85	Confident	86.4	Confident	104 Å²	104	39 Å²	39	53%	0.533	21%	0.205	S	C	.	.			trans	-96.3	-28.8	-176.8	-58.7	173.2	0	0	0	112.1	E430 I455 S456	E430-I432 PolarHBondContact O-N 2.9Å; I432-I455 WeakPolarHBondContact O-CA 3.49Å; I432-S456 PolarHBondContact O-N 2.85Å; I432-S456 PolarHBondContact O-OG 3.24Å
433	S	84.3	Confident	86.3	Confident	56 Å²	56	41.6 Å²	41.6	39%	0.392	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	163.8	177.4	64.4	0	0	0	0	112.3	Y457	S433-Y457 CarbonylContact C-O 3.31Å; S433-Y457 WeakPolarHBondContact CA-O 3.15Å; S433-Y457 VanDerWaalsContact CB-O 3.31Å; S433-Y457 WeakPolarHBondContact CB-O 3.42Å
434	L	85.7	Confident	86.1	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	108.7	171.5	-60.1	-178.5	0	0	0	110.3	I413 F439 L450 I455 Y457 I458 H459 A462 F463 M474	I413-L434 HydrophobicContact CD1-CD2 4.01Å; L434-F439 HydrophobicContact CD1-CE2 4.5Å; L434-L450 HydrophobicContact CD1-CD1 3.97Å; L434-L450 HydrophobicContact CD2-CD2 4.43Å; L434-I455 HydrophobicContact CD1-CD1 4.47Å; L434-I455 HydrophobicContact CD2-CD1 4.14Å; L434-I455 HydrophobicContact CG-CD1 4.2Å; L434-I455 HydrophobicContact CG-CG2 4.22Å; L434-Y457 PolarHBondContact N-O 3.36Å; L434-I458 HydrophobicContact CB-CB 4.36Å; L434-I458 HydrophobicContact CB-CG1 4.15Å; L434-I458 HydrophobicContact CB-CG2 4.1Å; L434-I458 HydrophobicContact CD1-CD1 3.98Å; L434-I458 HydrophobicContact CD1-CG1 3.88Å; L434-I458 HydrophobicContact CD1-CG2 4.14Å; L434-I458 HydrophobicContact CG-CG1 4.08Å; L434-H459 PolarHBondContact O-N 3.13Å; L434-A462 HydrophobicContact CB-CB 4.01Å; L434-F463 HydrophobicContact CD1-CE1 4.06Å; L434-F463 HydrophobicContact CD1-CZ 3.76Å; L434-M474 HydrophobicContact CD1-SD 4.45Å
435	P	79.8	Confident	86	Confident	74 Å²	74	42.2 Å²	42.2	48%	0.481	22%	0.219	S	C	.	.			trans	-70.2	173.4	177.7	29	-36	0	0	0	113.5	S438 A462	P435-S438 VanDerWaalsContact CD-OG 3.23Å; P435-S438 WeakPolarHBondContact CD-OG 3.49Å; P435-S438 PolarHBondContact O-N 3.01Å; P435-S438 PolarHBondContact O-OG 3.09Å; P435-A462 WeakPolarHBondContact O-CA 3.03Å; P435-A462 VanDerWaalsContact O-CB 3.27Å; P435-A462 WeakPolarHBondContact O-CB 3.34Å
436	L	75.8	Confident	85.8	Confident	40 Å²	40	46.4 Å²	46.4	21%	0.209	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	140.8	167.8	169.3	64.3	0	0	0	110.9	S438 Q461 I672	L436-S438 PolarHBondContact O-N 2.9Å; L436-S438 VanDerWaalsContact O-N 3.09Å; L436-Q461 HydrophobicContact CD1-CB 3.51Å; L436-I672 HydrophobicContact CB-CD1 3.47Å; L436-I672 VanDerWaalsContact CB-CD1 3.47Å; L436-I672 HydrophobicContact CD2-CD1 3.95Å; L436-I672 HydrophobicContact CD2-CG2 4.21Å; L436-I672 HydrophobicContact CG-CD1 4.35Å
437	D	79	Confident	85.7	Confident	45 Å²	45	49.3 Å²	49.3	24%	0.241	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	22.6	171.5	-67.7	-32.3	0	0	0	114.3	F439 I440 Q461 N464	D437-F439 PolarHBondContact O-N 2.84Å; D437-I440 HydrophobicContact CB-CB 3.96Å; D437-I440 HydrophobicContact CB-CD1 3.97Å; D437-I440 HydrophobicContact CB-CG2 4.15Å; D437-I440 VanDerWaalsContact O-CB 3.31Å; D437-I440 WeakPolarHBondContact O-CB 3.12Å; D437-I440 VanDerWaalsContact O-CG2 3.24Å; D437-I440 WeakPolarHBondContact O-CG2 3.44Å; D437-I440 PolarHBondContact O-N 2.83Å; D437-Q461 PolarHBondContact N-O 3.43Å; D437-N464 WeakPolarHBondContact OD1-CB 3.33Å; D437-N464 PolarHBondContact OD1-ND2 2.83Å
438	S	81	Confident	85.8	Confident	13 Å²	13	48.7 Å²	48.7	9%	0.091	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.4	-28.8	-177	-76.7	0	0	0	0	116.3	P435 L436 A462	P435-S438 VanDerWaalsContact CD-OG 3.23Å; P435-S438 WeakPolarHBondContact CD-OG 3.49Å; P435-S438 PolarHBondContact O-N 3.01Å; P435-S438 PolarHBondContact O-OG 3.09Å; L436-S438 PolarHBondContact O-N 2.9Å; L436-S438 VanDerWaalsContact O-N 3.09Å; S438-A462 PolarHBondContact N-O 3.2Å
439	F	89.7	Confident	86	Confident	1 Å²	1	45 Å²	45	0%	0.004	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124	18.7	-177	-55.3	-83.2	0	0	0	113.1	I413 L424 L426 L434 D437 H441 Y442 L445 I448 L450 F463 L466	I413-F439 HydrophobicContact CD1-CD1 4.28Å; I413-F439 HydrophobicContact CD1-CE1 3.63Å; I413-F439 HydrophobicContact CD1-CE2 4.11Å; I413-F439 HydrophobicContact CD1-CZ 3.52Å; I413-F439 HydrophobicContact CG1-CE1 4.36Å; I413-F439 HydrophobicContact CG2-CE1 4.48Å; L424-F439 HydrophobicContact CD2-CD1 4.04Å; L424-F439 HydrophobicContact CD2-CE1 3.95Å; L426-F439 HydrophobicContact CD1-CE1 4.37Å; L434-F439 HydrophobicContact CD1-CE2 4.5Å; D437-F439 PolarHBondContact O-N 2.84Å; F439-H441 PolarHBondContact O-N 3.29Å; F439-Y442 PolarHBondContact O-N 3.01Å; F439-L445 HydrophobicContact CB-CD1 4.4Å; F439-L445 HydrophobicContact CD1-CD1 4.13Å; F439-I448 HydrophobicContact CD1-CD1 4.05Å; F439-I448 HydrophobicContact CD2-CD1 4.3Å; F439-I448 HydrophobicContact CE1-CD1 4.13Å; F439-I448 HydrophobicContact CE1-CG2 4.36Å; F439-I448 HydrophobicContact CE2-CD1 4.38Å; F439-I448 HydrophobicContact CG-CD1 4.15Å; F439-I448 HydrophobicContact CZ-CD1 4.3Å; F439-I448 HydrophobicContact CZ-CG2 4.24Å; F439-L450 HydrophobicContact CZ-CD1 4.17Å; F439-L450 HydrophobicContact CZ-CD2 4.48Å; F439-F463 AromaticContact CD2-CD1 3.98Å; F439-F463 HydrophobicContact CD2-CD1 3.98Å; F439-F463 HydrophobicContact CD2-CE1 4.31Å; F439-F463 AromaticContact CE2-CD1 3.87Å; F439-F463 HydrophobicContact CE2-CD1 3.87Å; F439-F463 AromaticContact CE2-CE1 3.72Å; F439-F463 HydrophobicContact CE2-CE1 3.72Å; F439-L466 HydrophobicContact CB-CD1 3.92Å; F439-L466 HydrophobicContact CB-CD2 4.1Å; F439-L466 HydrophobicContact CB-CG 4.39Å; F439-L466 HydrophobicContact CD2-CD1 4.14Å; F439-L466 HydrophobicContact CG-CD1 4.19Å
440	I	82.4	Confident	86.2	Confident	59 Å²	59	44.6 Å²	44.6	30%	0.303	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.8	-170.9	-167.7	164.6	0	0	0	114.8	D437 K443	D437-I440 HydrophobicContact CB-CB 3.96Å; D437-I440 HydrophobicContact CB-CD1 3.97Å; D437-I440 HydrophobicContact CB-CG2 4.15Å; D437-I440 VanDerWaalsContact O-CB 3.31Å; D437-I440 WeakPolarHBondContact O-CB 3.12Å; D437-I440 VanDerWaalsContact O-CG2 3.24Å; D437-I440 WeakPolarHBondContact O-CG2 3.44Å; D437-I440 PolarHBondContact O-N 2.83Å; I440-K443 WeakPolarHBondContact O-CE 3.37Å
441	H	73.9	Confident	86.5	Confident	92 Å²	92	42.8 Å²	42.8	43%	0.426	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.2	176.1	-59.2	-61.9	0	0	0	113.3	F439	F439-H441 PolarHBondContact O-N 3.29Å
442	Y	84.8	Confident	86.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.23	C	C	.	.			trans	-119.1	58.5	-165.8	-51.2	-49.4	0	0	0	112.3	P414 N415 D416 L417 P418 I421 L424 F439 N444 L445	P414-Y442 PolarHBondContact O-OH 2.03Å; N415-Y442 VanDerWaalsContact CA-OH 3.25Å; N415-Y442 WeakPolarHBondContact CA-OH 3.35Å; N415-Y442 PolarHBondContact O-OH 3.07Å; D416-Y442 PolarHBondContact N-OH 3.49Å; L417-Y442 HydrophobicContact CB-CE1 3.81Å; L417-Y442 PolarHBondContact N-OH 3.32Å; L417-Y442 WeakPolarHBondContact O-CE1 3.34Å; P418-Y442 WeakPolarHBondContact O-CD1 3.41Å; I421-Y442 HydrophobicContact CD1-CD1 3.68Å; I421-Y442 HydrophobicContact CD1-CD2 4.3Å; I421-Y442 HydrophobicContact CD1-CE1 4.16Å; I421-Y442 HydrophobicContact CD1-CG 3.79Å; I421-Y442 HydrophobicContact CG1-CD1 3.83Å; I421-Y442 HydrophobicContact CG1-CG 4.07Å; L424-Y442 HydrophobicContact CD2-CD2 4.48Å; F439-Y442 PolarHBondContact O-N 3.01Å; Y442-N444 PolarHBondContact O-N 3.05Å; Y442-L445 VanDerWaalsContact CB-CD1 3.44Å; Y442-L445 HydrophobicContact CG-CD1 4.34Å; Y442-L445 WeakPolarHBondContact O-CG 3.46Å; Y442-L445 PolarHBondContact O-N 2.91Å
443	K	80.2	Confident	87.2	Confident	116 Å²	116	40.8 Å²	40.8	50%	0.504	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-18	-169.2	-62.7	-179.7	-178.5	178.7	0	114.5	I440 L445	I440-K443 WeakPolarHBondContact O-CE 3.37Å; K443-L445 VanDerWaalsContact C-N 3.34Å
444	N	83.7	Confident	87.5	Confident	72 Å²	72	44.2 Å²	44.2	39%	0.385	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.8	-179	-67.6	-0.4	0	0	0	113.5	D420 I421 Y442 R446	D420-N444 WeakPolarHBondContact O-CB 3.01Å; D420-N444 PolarHBondContact O-ND2 2.86Å; I421-N444 CarbonylContact O-C 3.57Å; Y442-N444 PolarHBondContact O-N 3.05Å; N444-R446 PolarHBondContact O-N 2.96Å
445	L	91.7	Very high	87.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.			trans	-60.1	119.7	-175.6	-76.8	172.7	0	0	0	112.6	I421 L424 F439 Y442 K443 I448 L466 E468 L469	I421-L445 HydrophobicContact CD1-CD2 4.15Å; I421-L445 HydrophobicContact CG1-CD2 3.91Å; I421-L445 HydrophobicContact CG1-CG 4.36Å; I421-L445 PolarHBondContact O-N 2.66Å; L424-L445 HydrophobicContact CB-CD1 4.33Å; L424-L445 HydrophobicContact CB-CD2 3.72Å; L424-L445 HydrophobicContact CD2-CD1 4.33Å; F439-L445 HydrophobicContact CB-CD1 4.4Å; F439-L445 HydrophobicContact CD1-CD1 4.13Å; Y442-L445 VanDerWaalsContact CB-CD1 3.44Å; Y442-L445 HydrophobicContact CG-CD1 4.34Å; Y442-L445 WeakPolarHBondContact O-CG 3.46Å; Y442-L445 PolarHBondContact O-N 2.91Å; K443-L445 VanDerWaalsContact C-N 3.34Å; L445-I448 HydrophobicContact CB-CD1 4.43Å; L445-I448 HydrophobicContact CB-CG1 4.38Å; L445-I448 HydrophobicContact CD1-CD1 3.87Å; L445-I448 HydrophobicContact CD1-CG1 3.95Å; L445-L466 HydrophobicContact CB-CD2 4.47Å; L445-E468 CarbonylContact O-C 3.49Å; L445-L469 HydrophobicContact CB-CD1 4.28Å; L445-L469 VanDerWaalsContact O-CA 3.3Å; L445-L469 WeakPolarHBondContact O-CA 3.33Å; L445-L469 WeakPolarHBondContact O-CD1 3.21Å; L445-L469 PolarHBondContact O-N 2.96Å
446	R	89.8	Confident	88	Confident	117 Å²	117	42.3 Å²	42.3	44%	0.442	20%	0.2	S	C	.	.	S	Bend	trans	-100.9	-26.1	174.1	-67.4	-174.1	164.8	165.7	-1.8	112.7	M422 N444 E468 S470 S471	M422-R446 HydrophobicContact CE-CG 4.48Å; M422-R446 WeakPolarHBondContact O-CA 3.42Å; M422-R446 PolarHBondContact O-N 3.08Å; N444-R446 PolarHBondContact O-N 2.96Å; R446-E468 HydrophobicContact CG-CB 4.33Å; R446-E468 IonicContact CZ-OE2 2.67Å; R446-E468 IonicContact NE-OE2 2.64Å; R446-E468 PolarHBondContact NE-OE2 2.99Å; R446-E468 IonicContact NH2-OE2 3.58Å; R446-E468 PolarHBondContact NH2-OE2 2.95Å; R446-S470 WeakPolarHBondContact O-CA 3.29Å; R446-S470 PolarHBondContact O-N 3.36Å; R446-S471 PolarHBondContact O-N 2.85Å
447	K	93	Very high	88.3	Confident	62 Å²	62	43.2 Å²	43.2	27%	0.27	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	130.6	175.7	-172	166.5	106.8	-139	0	112.2	M422 E423 L424 V449 S471 Y473	M422-K447 PolarHBondContact O-N 3.18Å; M422-K447 VanDerWaalsContact O-N 3.1Å; E423-K447 VanDerWaalsContact CA-O 3.31Å; E423-K447 WeakPolarHBondContact CA-O 3.05Å; E423-K447 HydrophobicContact CB-CB 4.21Å; E423-K447 HydrophobicContact CG-CB 3.84Å; E423-K447 WeakPolarHBondContact OE1-CB 3.18Å; E423-K447 VanDerWaalsContact OE1-CD 3.3Å; E423-K447 WeakPolarHBondContact OE1-CD 3.42Å; E423-K447 WeakPolarHBondContact OE1-CE 3.26Å; E423-K447 IonicContact OE1-NZ 3.57Å; E423-K447 PolarHBondContact OE1-NZ 3.45Å; E423-K447 WeakPolarHBondContact OE2-CE 3.15Å; E423-K447 IonicContact OE2-NZ 2.78Å; E423-K447 PolarHBondContact OE2-NZ 3.01Å; L424-K447 PolarHBondContact N-O 2.88Å; K447-V449 HydrophobicContact CG-CG2 4.38Å; K447-S471 WeakPolarHBondContact CA-O 3.42Å; K447-Y473 HydrophobicContact CD-CE2 4.1Å; K447-Y473 HydrophobicContact CG-CE2 4.14Å
448	I	96.2	Very high	88.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.3	172.2	-68.5	169.8	0	0	0	108.8	L424 F439 L445 L450 L466 L469 S471 L472 Y473	L424-I448 WeakPolarHBondContact O-CA 3.38Å; F439-I448 HydrophobicContact CD1-CD1 4.05Å; F439-I448 HydrophobicContact CD2-CD1 4.3Å; F439-I448 HydrophobicContact CE1-CD1 4.13Å; F439-I448 HydrophobicContact CE1-CG2 4.36Å; F439-I448 HydrophobicContact CE2-CD1 4.38Å; F439-I448 HydrophobicContact CG-CD1 4.15Å; F439-I448 HydrophobicContact CZ-CD1 4.3Å; F439-I448 HydrophobicContact CZ-CG2 4.24Å; L445-I448 HydrophobicContact CB-CD1 4.43Å; L445-I448 HydrophobicContact CB-CG1 4.38Å; L445-I448 HydrophobicContact CD1-CD1 3.87Å; L445-I448 HydrophobicContact CD1-CG1 3.95Å; I448-L450 HydrophobicContact CG2-CD1 3.62Å; I448-L450 HydrophobicContact CG2-CG 3.74Å; I448-L466 HydrophobicContact CD1-CD1 3.66Å; I448-L469 HydrophobicContact CB-CD1 4.31Å; I448-L469 HydrophobicContact CD1-CD1 3.79Å; I448-L469 HydrophobicContact CD1-CD2 4.2Å; I448-L469 HydrophobicContact CG1-CD1 3.77Å; I448-S471 PolarHBondContact N-O 3.27Å; I448-L472 HydrophobicContact CB-CD1 3.9Å; I448-L472 HydrophobicContact CG2-CD1 3.84Å; I448-Y473 PolarHBondContact O-N 3.5Å
449	V	96.7	Very high	88.3	Confident	19 Å²	19	41.5 Å²	41.5	12%	0.115	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.6	174.4	-171	0	0	0	0	109	L424 L426 D427 K447 D451 Y473	L424-V449 PolarHBondContact O-N 3.43Å; L426-V449 WeakPolarHBondContact CA-O 3.38Å; L426-V449 WeakPolarHBondContact CB-O 3.47Å; L426-V449 PolarHBondContact N-O 2.91Å; D427-V449 HydrophobicContact CB-CG1 4.03Å; K447-V449 HydrophobicContact CG-CG2 4.38Å; V449-D451 HydrophobicContact CG1-CB 4.36Å; V449-D451 WeakPolarHBondContact CG1-OD2 3.45Å; V449-Y473 HydrophobicContact CG2-CD2 4.03Å
450	L	96.8	Very high	87.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.205	C	C	.	.			trans	-129.2	20.7	-179.9	-66.6	156.3	0	0	0	110.6	L426 L431 L434 F439 I448 N453 I455 L472 Y473 M474 N477	L426-L450 HydrophobicContact CB-CD2 3.93Å; L426-L450 HydrophobicContact CD1-CD2 3.82Å; L431-L450 HydrophobicContact CD1-CD2 3.63Å; L434-L450 HydrophobicContact CD1-CD1 3.97Å; L434-L450 HydrophobicContact CD2-CD2 4.43Å; F439-L450 HydrophobicContact CZ-CD1 4.17Å; F439-L450 HydrophobicContact CZ-CD2 4.48Å; I448-L450 HydrophobicContact CG2-CD1 3.62Å; I448-L450 HydrophobicContact CG2-CG 3.74Å; L450-N453 PolarHBondContact O-ND2 2.78Å; L450-I455 HydrophobicContact CB-CD1 4.08Å; L450-I455 HydrophobicContact CD2-CD1 4.25Å; L450-L472 HydrophobicContact CD1-CD1 4.31Å; L450-Y473 WeakPolarHBondContact CA-O 3.43Å; L450-Y473 WeakPolarHBondContact CB-O 3.32Å; L450-Y473 PolarHBondContact N-O 2.81Å; L450-M474 HydrophobicContact CB-CG 4.24Å; L450-M474 HydrophobicContact CD1-CG 4.09Å; L450-M474 HydrophobicContact CD1-SD 4.1Å; L450-N477 PolarHBondContact O-ND2 3.46Å
451	D	96.6	Very high	87	Confident	25 Å²	25	45.2 Å²	45.2	13%	0.134	21%	0.21	C	C	.	.			trans	-59.5	157.7	179.3	-63.7	-46.3	0	0	0	111.2	D427 H428 V449 N453 Y473 M474 S475	D427-D451 WeakPolarHBondContact CA-O 3.13Å; D427-D451 VanDerWaalsContact OD1-C 3.31Å; D427-D451 WeakPolarHBondContact OD1-CB 3.38Å; H428-D451 PolarHBondContact N-O 3.21Å; V449-D451 HydrophobicContact CG1-CB 4.36Å; V449-D451 WeakPolarHBondContact CG1-OD2 3.45Å; D451-N453 VanDerWaalsContact C-N 3.33Å; D451-N453 PolarHBondContact O-N 3.45Å; D451-N453 PolarHBondContact O-ND2 2.89Å; D451-Y473 WeakPolarHBondContact OD2-CB 3.47Å; D451-M474 PolarHBondContact OD1-N 3.07Å; D451-S475 CarbonylContact C-O 3.59Å; D451-S475 VanDerWaalsContact CA-O 3.3Å; D451-S475 WeakPolarHBondContact CA-O 3.31Å; D451-S475 WeakPolarHBondContact OD1-CA 3.06Å; D451-S475 WeakPolarHBondContact OD1-CB 3.32Å; D451-S475 PolarHBondContact OD1-N 2.88Å; D451-S475 PolarHBondContact OD1-OG 3.44Å
452	N	95.9	Very high	87.3	Confident	57 Å²	57	40.9 Å²	40.9	31%	0.305	19%	0.19	S	C	.	.	S	Bend	trans	52.4	45.5	172.6	-47.1	-70.7	0	0	0	113.8	D427 H428 S475 S476	D427-N452 PolarHBondContact OD1-ND2 3.22Å; H428-N452 WeakPolarHBondContact CA-O 3.2Å; H428-N452 PolarHBondContact CE1-ND2 2.87Å; H428-N452 VanDerWaalsContact CE1-ND2 3.33Å; N452-S475 PolarHBondContact N-O 3.31Å; N452-S476 WeakPolarHBondContact CA-O 3.06Å; N452-S476 WeakPolarHBondContact OD1-CB 3.43Å; N452-S476 PolarHBondContact OD1-OG 3.31Å
453	N	93.8	Very high	87.5	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.043	19%	0.192	C	C	.	.	S	Bend	trans	-116.3	-170.6	174.1	-86.6	-99	0	0	0	109.8	L426 N429 L431 L450 D451 I455 N477	L426-N453 PolarHBondContact O-ND2 2.87Å; N429-N453 WeakPolarHBondContact CA-OD1 3.37Å; N429-N453 WeakPolarHBondContact CB-OD1 3.23Å; N429-N453 PolarHBondContact N-ND2 3.08Å; N429-N453 PolarHBondContact O-OD1 2.92Å; L431-N453 HydrophobicContact CB-CB 4.29Å; L431-N453 VanDerWaalsContact CB-OD1 3.24Å; L431-N453 WeakPolarHBondContact CB-OD1 3.04Å; L431-N453 WeakPolarHBondContact CG-OD1 3.48Å; L431-N453 PolarHBondContact N-OD1 3.12Å; L431-N453 VanDerWaalsContact N-OD1 3.1Å; L450-N453 PolarHBondContact O-ND2 2.78Å; D451-N453 VanDerWaalsContact C-N 3.33Å; D451-N453 PolarHBondContact O-N 3.45Å; D451-N453 PolarHBondContact O-ND2 2.89Å; N453-I455 HydrophobicContact CB-CD1 4.26Å; N453-I455 HydrophobicContact CB-CG1 4.08Å; N453-N477 WeakPolarHBondContact CA-OD1 3.39Å; N453-N477 WeakPolarHBondContact CB-OD1 3.47Å; N453-N477 PolarHBondContact O-OD1 3Å
454	R	91.5	Very high	87.6	Confident	128 Å²	128	36.7 Å²	36.7	48%	0.483	17%	0.173	S	C	.	.			trans	-113.1	27.4	179.1	-52.7	-168.6	-159.9	173.6	13.7	112.8	E430 L431 S456 N477	E430-R454 IonicContact OE1-CZ 3.93Å; E430-R454 IonicContact OE1-NH2 3.75Å; E430-R454 PolarHBondContact OE1-NH2 3.48Å; L431-R454 CarbonylContact O-C 3.44Å; L431-R454 VanDerWaalsContact O-CA 3.3Å; L431-R454 WeakPolarHBondContact O-CA 3.35Å; L431-R454 PolarHBondContact O-N 2.75Å; R454-S456 PolarHBondContact O-N 3.19Å; R454-N477 PolarHBondContact N-OD1 3.46Å
455	I	92	Very high	87	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	17%	0.174	C	C	.	.			trans	-66.8	109.7	-171.5	-57.1	170.4	0	0	0	108.9	L431 I432 L434 L450 N453 I458 N477 E478 L479	L431-I455 HydrophobicContact CB-CD1 4.33Å; L431-I455 HydrophobicContact CB-CG1 3.98Å; L431-I455 WeakPolarHBondContact O-CG1 3.45Å; L431-I455 PolarHBondContact O-N 3.27Å; I432-I455 WeakPolarHBondContact O-CA 3.49Å; L434-I455 HydrophobicContact CD1-CD1 4.47Å; L434-I455 HydrophobicContact CD2-CD1 4.14Å; L434-I455 HydrophobicContact CG-CD1 4.2Å; L434-I455 HydrophobicContact CG-CG2 4.22Å; L450-I455 HydrophobicContact CB-CD1 4.08Å; L450-I455 HydrophobicContact CD2-CD1 4.25Å; N453-I455 HydrophobicContact CB-CD1 4.26Å; N453-I455 HydrophobicContact CB-CG1 4.08Å; I455-I458 HydrophobicContact CG2-CD1 4.12Å; I455-I458 HydrophobicContact CG2-CG1 3.65Å; I455-N477 HydrophobicContact CB-CB 4.46Å; I455-N477 WeakPolarHBondContact CB-OD1 3.5Å; I455-N477 VanDerWaalsContact CG1-OD1 3.26Å; I455-N477 WeakPolarHBondContact CG1-OD1 3.24Å; I455-N477 PolarHBondContact N-OD1 3.29Å; I455-E478 CarbonylContact O-C 3.48Å; I455-E478 WeakPolarHBondContact O-CA 3.41Å; I455-E478 PolarHBondContact O-N 3.07Å; I455-L479 HydrophobicContact CG2-CD2 3.99Å; I455-L479 WeakPolarHBondContact O-CD2 3.28Å; I455-L479 PolarHBondContact O-N 3.46Å; I455-L479 VanDerWaalsContact O-N 3.1Å
456	S	84.5	Confident	86.9	Confident	34 Å²	34	36.8 Å²	36.8	24%	0.238	17%	0.174	C	C	.	.			trans	-102	-25.2	178	66.8	0	0	0	0	113	I432 R454 Q618	I432-S456 PolarHBondContact O-N 2.85Å; I432-S456 PolarHBondContact O-OG 3.24Å; R454-S456 PolarHBondContact O-N 3.19Å; S456-Q618 PolarHBondContact OG-NE2 3.49Å
457	Y	81.3	Confident	86.5	Confident	58 Å²	58	35.3 Å²	35.3	23%	0.227	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.4	179	174.6	-96	0	0	0	112.1	S433 L434 H459 Q618	S433-Y457 CarbonylContact C-O 3.31Å; S433-Y457 WeakPolarHBondContact CA-O 3.15Å; S433-Y457 VanDerWaalsContact CB-O 3.31Å; S433-Y457 WeakPolarHBondContact CB-O 3.42Å; L434-Y457 PolarHBondContact N-O 3.36Å; Y457-H459 HydrophobicContact CE1-CB 4.17Å; Y457-Q618 VanDerWaalsContact CB-OE1 3.29Å
458	I	82.6	Confident	86.1	Confident	9 Å²	9	36.4 Å²	36.4	5%	0.046	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	125.5	174.6	-61.6	175.4	0	0	0	107.4	L434 I455 A462 F463 M474 L479 I486	L434-I458 HydrophobicContact CB-CB 4.36Å; L434-I458 HydrophobicContact CB-CG1 4.15Å; L434-I458 HydrophobicContact CB-CG2 4.1Å; L434-I458 HydrophobicContact CD1-CD1 3.98Å; L434-I458 HydrophobicContact CD1-CG1 3.88Å; L434-I458 HydrophobicContact CD1-CG2 4.14Å; L434-I458 HydrophobicContact CG-CG1 4.08Å; I455-I458 HydrophobicContact CG2-CD1 4.12Å; I455-I458 HydrophobicContact CG2-CG1 3.65Å; I458-A462 HydrophobicContact CG2-CB 3.91Å; I458-F463 HydrophobicContact CG2-CE2 3.87Å; I458-F463 HydrophobicContact CG2-CZ 4.27Å; I458-M474 HydrophobicContact CD1-CE 3.63Å; I458-M474 HydrophobicContact CD1-SD 3.67Å; I458-L479 HydrophobicContact CD1-CD1 4.05Å; I458-L479 HydrophobicContact CD1-CD2 3.77Å; I458-L479 HydrophobicContact CG1-CD2 3.89Å; I458-I486 HydrophobicContact CB-CD1 3.91Å; I458-I486 HydrophobicContact CG2-CD1 3.77Å; I458-I486 HydrophobicContact CG2-CG1 4.31Å
459	H	76.9	Confident	86	Confident	13 Å²	13	36.4 Å²	36.4	6%	0.06	18%	0.178	C	C	.	.			trans	-64.7	137.8	175.4	-171.3	-101.8	0	0	0	110.4	L434 Y457 Q461 A462	L434-H459 PolarHBondContact O-N 3.13Å; Y457-H459 HydrophobicContact CE1-CB 4.17Å; H459-Q461 PolarHBondContact ND1-N 2.78Å; H459-Q461 PolarHBondContact O-N 3.24Å; H459-A462 HydrophobicContact CB-CB 4.42Å; H459-A462 WeakPolarHBondContact O-CB 3.49Å; H459-A462 PolarHBondContact O-N 2.95Å
460	P	67.4	Low	85.8	Confident	48 Å²	48	36.6 Å²	36.6	31%	0.312	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-7.7	-178.5	-27.4	36	0	0	0	116.2
461	Q	77.7	Confident	85.9	Confident	90 Å²	90	37.2 Å²	37.2	42%	0.421	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.4	20.3	177.1	-70.7	179.7	-40.7	0	0	112.7	L436 D437 H459 F463 N464	L436-Q461 HydrophobicContact CD1-CB 3.51Å; D437-Q461 PolarHBondContact N-O 3.43Å; H459-Q461 PolarHBondContact ND1-N 2.78Å; H459-Q461 PolarHBondContact O-N 3.24Å; Q461-F463 PolarHBondContact O-N 3.15Å; Q461-N464 WeakPolarHBondContact O-CB 3.33Å; Q461-N464 PolarHBondContact O-N 2.8Å
462	A	80.9	Confident	85.9	Confident	1 Å²	1	36 Å²	36	1%	0.008	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.7	176.2	0	0	0	0	0	112.5	L434 P435 S438 I458 H459	L434-A462 HydrophobicContact CB-CB 4.01Å; P435-A462 WeakPolarHBondContact O-CA 3.03Å; P435-A462 VanDerWaalsContact O-CB 3.27Å; P435-A462 WeakPolarHBondContact O-CB 3.34Å; S438-A462 PolarHBondContact N-O 3.2Å; I458-A462 HydrophobicContact CG2-CB 3.91Å; H459-A462 HydrophobicContact CB-CB 4.42Å; H459-A462 WeakPolarHBondContact O-CB 3.49Å; H459-A462 PolarHBondContact O-N 2.95Å
463	F	89.3	Confident	86	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	24.8	-179.3	-50.2	-68	0	0	0	113.9	L434 F439 I458 Q461 N465 L466 L472 M474 F487 L490	L434-F463 HydrophobicContact CD1-CE1 4.06Å; L434-F463 HydrophobicContact CD1-CZ 3.76Å; F439-F463 AromaticContact CD2-CD1 3.98Å; F439-F463 HydrophobicContact CD2-CD1 3.98Å; F439-F463 HydrophobicContact CD2-CE1 4.31Å; F439-F463 AromaticContact CE2-CD1 3.87Å; F439-F463 HydrophobicContact CE2-CD1 3.87Å; F439-F463 AromaticContact CE2-CE1 3.72Å; F439-F463 HydrophobicContact CE2-CE1 3.72Å; I458-F463 HydrophobicContact CG2-CE2 3.87Å; I458-F463 HydrophobicContact CG2-CZ 4.27Å; Q461-F463 PolarHBondContact O-N 3.15Å; F463-N465 PolarHBondContact O-N 3.4Å; F463-L466 HydrophobicContact CB-CD1 4.12Å; F463-L466 HydrophobicContact CD1-CD1 4.14Å; F463-L466 PolarHBondContact O-N 2.96Å; F463-L472 HydrophobicContact CE1-CD1 4.21Å; F463-L472 HydrophobicContact CE1-CD2 4.15Å; F463-L472 HydrophobicContact CE2-CD2 4.28Å; F463-L472 HydrophobicContact CZ-CD2 3.93Å; F463-M474 HydrophobicContact CZ-CE 4.46Å; F463-M474 HydrophobicContact CZ-SD 3.78Å; F463-F487 HydrophobicContact CE2-CD1 4.37Å; F463-F487 HydrophobicContact CE2-CE1 4.17Å; F463-L490 HydrophobicContact CB-CD1 4.4Å; F463-L490 HydrophobicContact CB-CD2 3.98Å; F463-L490 HydrophobicContact CB-CG 4.44Å; F463-L490 HydrophobicContact CD2-CD1 4.45Å; F463-L490 HydrophobicContact CG-CD1 4.4Å
464	N	80.5	Confident	86.1	Confident	23 Å²	23	35.2 Å²	35.2	12%	0.123	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	133.8	-179.3	-104.7	-1.3	0	0	0	112.4	D437 Q461 L466 Q489	D437-N464 WeakPolarHBondContact OD1-CB 3.33Å; D437-N464 PolarHBondContact OD1-ND2 2.83Å; Q461-N464 WeakPolarHBondContact O-CB 3.33Å; Q461-N464 PolarHBondContact O-N 2.8Å; N464-L466 PolarHBondContact O-N 3.44Å; N464-Q489 PolarHBondContact OD1-NE2 3.22Å; N464-Q489 PolarHBondContact OD1-OE1 2.94Å
465	N	73	Confident	86.3	Confident	73 Å²	73	29.3 Å²	29.3	39%	0.39	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	3.1	179.5	-42	-91.2	0	0	0	116.9	F463 H467	F463-N465 PolarHBondContact O-N 3.4Å; N465-H467 PolarHBondContact O-N 3.19Å
466	L	87.8	Confident	86.5	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.158	C	C	.	.			trans	-78.1	52.9	-179.9	-61.9	-172.9	0	0	0	113.2	F439 L445 I448 F463 N464 E468 L469 L490	F439-L466 HydrophobicContact CB-CD1 3.92Å; F439-L466 HydrophobicContact CB-CD2 4.1Å; F439-L466 HydrophobicContact CB-CG 4.39Å; F439-L466 HydrophobicContact CD2-CD1 4.14Å; F439-L466 HydrophobicContact CG-CD1 4.19Å; L445-L466 HydrophobicContact CB-CD2 4.47Å; I448-L466 HydrophobicContact CD1-CD1 3.66Å; F463-L466 HydrophobicContact CB-CD1 4.12Å; F463-L466 HydrophobicContact CD1-CD1 4.14Å; F463-L466 PolarHBondContact O-N 2.96Å; N464-L466 PolarHBondContact O-N 3.44Å; L466-E468 VanDerWaalsContact C-N 3.28Å; L466-E468 PolarHBondContact O-N 3.46Å; L466-L469 HydrophobicContact CB-CB 4.24Å; L466-L469 HydrophobicContact CD1-CD2 4.38Å; L466-L469 VanDerWaalsContact O-CB 3.31Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 PolarHBondContact O-N 3.43Å; L466-L490 HydrophobicContact CB-CD2 3.85Å; L466-L490 WeakPolarHBondContact O-CD2 3.35Å
467	H	81.9	Confident	87	Confident	86 Å²	86	29.4 Å²	29.4	40%	0.398	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.2	-173.9	-57.8	-50.8	0	0	0	114	N465 L469 Q489 N492	N465-H467 PolarHBondContact O-N 3.19Å; H467-L469 VanDerWaalsContact C-N 3.31Å; H467-Q489 PolarHBondContact ND1-O 2.91Å; H467-N492 WeakPolarHBondContact O-CB 3.46Å; H467-N492 PolarHBondContact O-ND2 2.81Å
468	E	85.4	Confident	87.5	Confident	85 Å²	85	30.2 Å²	30.2	40%	0.397	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.6	175	-72.8	-67.4	113.3	0	0	113.5	L445 R446 L466 S470	L445-E468 CarbonylContact O-C 3.49Å; R446-E468 HydrophobicContact CG-CB 4.33Å; R446-E468 IonicContact CZ-OE2 2.67Å; R446-E468 IonicContact NE-OE2 2.64Å; R446-E468 PolarHBondContact NE-OE2 2.99Å; R446-E468 IonicContact NH2-OE2 3.58Å; R446-E468 PolarHBondContact NH2-OE2 2.95Å; L466-E468 VanDerWaalsContact C-N 3.28Å; L466-E468 PolarHBondContact O-N 3.46Å; E468-S470 PolarHBondContact O-N 3.28Å; E468-S470 VanDerWaalsContact O-N 3.12Å
469	L	94.5	Very high	87.9	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.			trans	-66.5	114.5	-172.5	-164.5	73.2	0	0	0	111.5	L445 I448 L466 H467 L472 L490 N492 L493	L445-L469 HydrophobicContact CB-CD1 4.28Å; L445-L469 VanDerWaalsContact O-CA 3.3Å; L445-L469 WeakPolarHBondContact O-CA 3.33Å; L445-L469 WeakPolarHBondContact O-CD1 3.21Å; L445-L469 PolarHBondContact O-N 2.96Å; I448-L469 HydrophobicContact CB-CD1 4.31Å; I448-L469 HydrophobicContact CD1-CD1 3.79Å; I448-L469 HydrophobicContact CD1-CD2 4.2Å; I448-L469 HydrophobicContact CG1-CD1 3.77Å; L466-L469 HydrophobicContact CB-CB 4.24Å; L466-L469 HydrophobicContact CD1-CD2 4.38Å; L466-L469 VanDerWaalsContact O-CB 3.31Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 PolarHBondContact O-N 3.43Å; H467-L469 VanDerWaalsContact C-N 3.31Å; L469-L472 HydrophobicContact CD2-CB 4.21Å; L469-L490 HydrophobicContact CB-CD2 4.08Å; L469-L490 HydrophobicContact CD2-CD1 4.07Å; L469-L490 HydrophobicContact CD2-CD2 3.79Å; L469-N492 CarbonylContact O-C 3.47Å; L469-L493 HydrophobicContact CD2-CD1 4.2Å; L469-L493 HydrophobicContact CG-CD1 4.14Å; L469-L493 VanDerWaalsContact O-CA 3.24Å; L469-L493 WeakPolarHBondContact O-CA 3.31Å; L469-L493 PolarHBondContact O-N 2.75Å
470	S	92.5	Very high	88.1	Confident	22 Å²	22	30.9 Å²	30.9	15%	0.154	17%	0.166	C	C	.	.			trans	-98.1	-24.4	-177.8	-176.6	0	0	0	0	112.7	R446 E468 K494 I495	R446-S470 WeakPolarHBondContact O-CA 3.29Å; R446-S470 PolarHBondContact O-N 3.36Å; E468-S470 PolarHBondContact O-N 3.28Å; E468-S470 VanDerWaalsContact O-N 3.12Å; S470-K494 WeakPolarHBondContact O-CA 3.23Å; S470-K494 WeakPolarHBondContact O-CB 3.43Å; S470-K494 PolarHBondContact O-N 3.13Å; S470-K494 WeakPolarHBondContact OG-CD 3.28Å; S470-K494 PolarHBondContact OG-NZ 2.95Å; S470-I495 PolarHBondContact O-N 2.98Å
471	S	97.1	Very high	88.9	Confident	14 Å²	14	30.7 Å²	30.7	10%	0.098	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	132.5	-178.3	-59.4	0	0	0	0	112.7	R446 K447 I448	R446-S471 PolarHBondContact O-N 2.85Å; K447-S471 WeakPolarHBondContact CA-O 3.42Å; I448-S471 PolarHBondContact N-O 3.27Å
472	L	97.7	Very high	89.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	123.5	178.5	178.2	59.6	0	0	0	110.5	I448 L450 F463 L469 M474 F487 L490 L493 I495 L496 Y497	I448-L472 HydrophobicContact CB-CD1 3.9Å; I448-L472 HydrophobicContact CG2-CD1 3.84Å; L450-L472 HydrophobicContact CD1-CD1 4.31Å; F463-L472 HydrophobicContact CE1-CD1 4.21Å; F463-L472 HydrophobicContact CE1-CD2 4.15Å; F463-L472 HydrophobicContact CE2-CD2 4.28Å; F463-L472 HydrophobicContact CZ-CD2 3.93Å; L469-L472 HydrophobicContact CD2-CB 4.21Å; L472-M474 HydrophobicContact CD1-CG 3.91Å; L472-M474 HydrophobicContact CD1-SD 4.12Å; L472-M474 HydrophobicContact CD2-CE 4.25Å; L472-M474 HydrophobicContact CD2-SD 4.17Å; L472-M474 HydrophobicContact CG-CG 4.03Å; L472-M474 HydrophobicContact CG-SD 4.25Å; L472-F487 HydrophobicContact CD2-CD1 4.28Å; L472-F487 HydrophobicContact CD2-CE1 4.05Å; L472-L490 HydrophobicContact CD2-CD1 4.09Å; L472-L493 HydrophobicContact CB-CD1 3.93Å; L472-I495 PolarHBondContact N-O 2.8Å; L472-L496 HydrophobicContact CB-CD1 4.27Å; L472-L496 HydrophobicContact CD2-CD1 4.06Å; L472-L496 HydrophobicContact CG-CD1 4.2Å; L472-L496 WeakPolarHBondContact O-CA 3.27Å; L472-Y497 PolarHBondContact O-N 3.12Å
473	Y	98.1	Very high	88.9	Confident	47 Å²	47	27.9 Å²	27.9	18%	0.184	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.9	179.3	-55.4	-101.5	0	0	0	110.2	K447 I448 V449 L450 D451 I495 Y497	K447-Y473 HydrophobicContact CD-CE2 4.1Å; K447-Y473 HydrophobicContact CG-CE2 4.14Å; I448-Y473 PolarHBondContact O-N 3.5Å; V449-Y473 HydrophobicContact CG2-CD2 4.03Å; L450-Y473 WeakPolarHBondContact CA-O 3.43Å; L450-Y473 WeakPolarHBondContact CB-O 3.32Å; L450-Y473 PolarHBondContact N-O 2.81Å; D451-Y473 WeakPolarHBondContact OD2-CB 3.47Å; Y473-I495 HydrophobicContact CE1-CG2 4.16Å; Y473-Y497 AromaticContact CD1-CD1 3.77Å; Y473-Y497 HydrophobicContact CD1-CD1 3.77Å; Y473-Y497 HydrophobicContact CD1-CD2 4.25Å; Y473-Y497 HydrophobicContact CD1-CE1 4.35Å; Y473-Y497 AromaticContact CD1-CG 3.71Å; Y473-Y497 HydrophobicContact CD1-CG 3.71Å; Y473-Y497 HydrophobicContact CE1-CD1 4.05Å; Y473-Y497 HydrophobicContact CE1-CD2 4.21Å; Y473-Y497 HydrophobicContact CE1-CE1 4.19Å; Y473-Y497 HydrophobicContact CE1-CE2 4.34Å; Y473-Y497 HydrophobicContact CE1-CG 4.06Å
474	M	94.9	Very high	88.3	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.166	C	C	.	.			trans	-140.5	41	-178.3	-53.2	-166.4	-57.2	0	0	111.2	L434 L450 D451 I458 F463 L472 L479 F487 Y497 L498 N501	L434-M474 HydrophobicContact CD1-SD 4.45Å; L450-M474 HydrophobicContact CB-CG 4.24Å; L450-M474 HydrophobicContact CD1-CG 4.09Å; L450-M474 HydrophobicContact CD1-SD 4.1Å; D451-M474 PolarHBondContact OD1-N 3.07Å; I458-M474 HydrophobicContact CD1-CE 3.63Å; I458-M474 HydrophobicContact CD1-SD 3.67Å; F463-M474 HydrophobicContact CZ-CE 4.46Å; F463-M474 HydrophobicContact CZ-SD 3.78Å; L472-M474 HydrophobicContact CD1-CG 3.91Å; L472-M474 HydrophobicContact CD1-SD 4.12Å; L472-M474 HydrophobicContact CD2-CE 4.25Å; L472-M474 HydrophobicContact CD2-SD 4.17Å; L472-M474 HydrophobicContact CG-CG 4.03Å; L472-M474 HydrophobicContact CG-SD 4.25Å; M474-L479 HydrophobicContact CE-CD1 4.31Å; M474-F487 HydrophobicContact CE-CE1 3.84Å; M474-F487 HydrophobicContact CE-CZ 3.97Å; M474-Y497 PolarHBondContact N-O 3.09Å; M474-L498 HydrophobicContact CB-CD2 4.36Å; M474-L498 HydrophobicContact CE-CD2 3.55Å; M474-N501 PolarHBondContact O-ND2 2.88Å
475	S	95.6	Very high	88.2	Confident	3 Å²	3	34 Å²	34	2%	0.021	18%	0.18	C	C	.	.			trans	-78.1	163.9	-178.5	-40.2	0	0	0	0	112.2	D451 N452 N477 H499	D451-S475 CarbonylContact C-O 3.59Å; D451-S475 VanDerWaalsContact CA-O 3.3Å; D451-S475 WeakPolarHBondContact CA-O 3.31Å; D451-S475 WeakPolarHBondContact OD1-CA 3.06Å; D451-S475 WeakPolarHBondContact OD1-CB 3.32Å; D451-S475 PolarHBondContact OD1-N 2.88Å; D451-S475 PolarHBondContact OD1-OG 3.44Å; N452-S475 PolarHBondContact N-O 3.31Å; S475-N477 VanDerWaalsContact C-N 3.3Å; S475-N477 PolarHBondContact O-N 3.24Å; S475-N477 PolarHBondContact O-ND2 3.23Å; S475-H499 CarbonylContact C-O 3.39Å; S475-H499 WeakPolarHBondContact CA-O 3.47Å; S475-H499 VanDerWaalsContact CB-CE1 3.44Å; S475-H499 WeakPolarHBondContact CB-CE1 3.35Å; S475-H499 WeakPolarHBondContact CB-ND1 3.44Å; S475-H499 WeakPolarHBondContact CB-O 3.36Å; S475-H499 PolarHBondContact OG-CE1 2.86Å; S475-H499 PolarHBondContact OG-ND1 2.95Å
476	S	96.5	Very high	88.6	Confident	29 Å²	29	31 Å²	31	20%	0.203	16%	0.164	C	C	.	.	S	Bend	trans	52.3	48.1	176	-53.8	0	0	0	0	112.1	N452 H499 R500	N452-S476 WeakPolarHBondContact CA-O 3.06Å; N452-S476 WeakPolarHBondContact OD1-CB 3.43Å; N452-S476 PolarHBondContact OD1-OG 3.31Å; S476-H499 PolarHBondContact N-O 3.49Å; S476-R500 WeakPolarHBondContact CA-O 3.28Å; S476-R500 PolarHBondContact N-O 3.1Å
477	N	95.2	Very high	88.7	Confident	8 Å²	8	31 Å²	31	4%	0.043	16%	0.163	C	C	.	.	S	Bend	trans	-127.1	-174.2	-177.3	-91.3	-86.6	0	0	0	109.9	L450 N453 R454 I455 S475 R500 N501	L450-N477 PolarHBondContact O-ND2 3.46Å; N453-N477 WeakPolarHBondContact CA-OD1 3.39Å; N453-N477 WeakPolarHBondContact CB-OD1 3.47Å; N453-N477 PolarHBondContact O-OD1 3Å; R454-N477 PolarHBondContact N-OD1 3.46Å; I455-N477 HydrophobicContact CB-CB 4.46Å; I455-N477 WeakPolarHBondContact CB-OD1 3.5Å; I455-N477 VanDerWaalsContact CG1-OD1 3.26Å; I455-N477 WeakPolarHBondContact CG1-OD1 3.24Å; I455-N477 PolarHBondContact N-OD1 3.29Å; S475-N477 VanDerWaalsContact C-N 3.3Å; S475-N477 PolarHBondContact O-N 3.24Å; S475-N477 PolarHBondContact O-ND2 3.23Å; N477-R500 PolarHBondContact N-O 2.93Å; N477-N501 WeakPolarHBondContact CA-OD1 3.49Å; N477-N501 WeakPolarHBondContact CB-OD1 3.43Å; N477-N501 WeakPolarHBondContact O-CA 3.29Å; N477-N501 PolarHBondContact O-OD1 3.15Å
478	E	93	Very high	88.7	Confident	76 Å²	76	28.9 Å²	28.9	36%	0.355	16%	0.158	S	C	.	.			trans	-109.1	14.3	-171.5	-62.6	-155.6	-143.2	0	0	114.7	I455 G480 N501 K502	I455-E478 CarbonylContact O-C 3.48Å; I455-E478 WeakPolarHBondContact O-CA 3.41Å; I455-E478 PolarHBondContact O-N 3.07Å; E478-G480 PolarHBondContact O-N 3.22Å; E478-N501 PolarHBondContact N-OD1 2.74Å; E478-K502 HydrophobicContact CB-CD 4.35Å; E478-K502 IonicContact OE2-NZ 3.59Å; E478-K502 PolarHBondContact OE2-NZ 3.02Å
479	L	90	Very high	88.4	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.026	15%	0.152	C	C	.	.			trans	-58.3	119.5	-176.4	-60.8	174.6	0	0	0	111.6	I455 I458 M474 L498 N501 K502 I503	I455-L479 HydrophobicContact CG2-CD2 3.99Å; I455-L479 WeakPolarHBondContact O-CD2 3.28Å; I455-L479 PolarHBondContact O-N 3.46Å; I455-L479 VanDerWaalsContact O-N 3.1Å; I458-L479 HydrophobicContact CD1-CD1 4.05Å; I458-L479 HydrophobicContact CD1-CD2 3.77Å; I458-L479 HydrophobicContact CG1-CD2 3.89Å; M474-L479 HydrophobicContact CE-CD1 4.31Å; L479-L498 HydrophobicContact CD1-CD2 4.12Å; L479-N501 HydrophobicContact CB-CB 4.26Å; L479-N501 WeakPolarHBondContact CB-OD1 3.26Å; L479-N501 WeakPolarHBondContact CG-OD1 3.39Å; L479-N501 PolarHBondContact N-OD1 2.98Å; L479-N501 VanDerWaalsContact N-OD1 3.16Å; L479-K502 CarbonylContact O-C 3.56Å; L479-K502 VanDerWaalsContact O-CA 3.26Å; L479-K502 WeakPolarHBondContact O-CA 3.5Å; L479-K502 WeakPolarHBondContact O-CB 3.38Å; L479-K502 PolarHBondContact O-N 3.12Å; L479-I503 HydrophobicContact CB-CG1 4.07Å; L479-I503 WeakPolarHBondContact O-CA 3.43Å; L479-I503 VanDerWaalsContact O-CG1 3.31Å; L479-I503 WeakPolarHBondContact O-CG1 3.47Å; L479-I503 PolarHBondContact O-N 3.29Å
480	G	80.9	Confident	88.2	Confident	30 Å²	30	27.6 Å²	27.6	31%	0.309	15%	0.152	S	C	.	.			trans	-92.3	-25.7	179.7	0	0	0	0	0	115	E478 I503 S504	E478-G480 PolarHBondContact O-N 3.22Å; G480-I503 WeakPolarHBondContact O-CA 3.47Å; G480-S504 PolarHBondContact O-N 3.14Å; G480-S504 PolarHBondContact O-OG 2.86Å
481	L	83.7	Confident	87.8	Confident	44 Å²	44	29.4 Å²	29.4	23%	0.23	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.3	179.3	67.6	91.2	0	0	0	111.7	P483 C505	L481-P483 HydrophobicContact CD1-CB 4.17Å; L481-P483 HydrophobicContact CD1-CG 4.38Å; L481-C505 VanDerWaalsContact CA-O 3.31Å; L481-C505 WeakPolarHBondContact CA-O 3.48Å; L481-C505 HydrophobicContact CB-CB 3.76Å
482	L	84.9	Confident	87.5	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	112.1	168.5	-62.3	179.3	0	0	0	110	L498 I503 C505 I506 H507 S510 F511 L522	L482-L498 HydrophobicContact CD1-CD1 3.95Å; L482-L498 HydrophobicContact CD2-CD1 4.43Å; L482-L498 HydrophobicContact CD2-CD2 4.48Å; L482-I503 HydrophobicContact CD1-CD1 4.22Å; L482-I503 HydrophobicContact CD1-CG2 4.47Å; L482-I503 HydrophobicContact CD2-CD1 4.05Å; L482-I503 HydrophobicContact CG-CD1 4.07Å; L482-I503 HydrophobicContact CG-CG2 4.09Å; L482-C505 PolarHBondContact N-O 2.86Å; L482-I506 HydrophobicContact CB-CG1 4.31Å; L482-I506 HydrophobicContact CB-CG2 4.39Å; L482-I506 HydrophobicContact CD1-CD1 4.03Å; L482-I506 HydrophobicContact CD1-CG1 4Å; L482-I506 HydrophobicContact CD1-CG2 4.46Å; L482-I506 HydrophobicContact CG-CG1 4.31Å; L482-H507 WeakPolarHBondContact O-CB 3.19Å; L482-H507 PolarHBondContact O-N 2.89Å; L482-S510 PolarHBondContact O-OG 2.95Å; L482-F511 HydrophobicContact CD1-CE1 3.93Å; L482-F511 HydrophobicContact CD1-CZ 3.61Å; L482-L522 HydrophobicContact CD1-CD2 4.42Å
483	P	75.5	Confident	87.4	Confident	29 Å²	29	31.7 Å²	31.7	19%	0.188	17%	0.173	C	C	.	.			trans	-79.5	158.9	179.3	32.7	-31.5	0	0	0	111.7	L481 I486 S510	L481-P483 HydrophobicContact CD1-CB 4.17Å; L481-P483 HydrophobicContact CD1-CG 4.38Å; P483-I486 HydrophobicContact CG-CB 4.18Å; P483-I486 HydrophobicContact CG-CD1 3.85Å; P483-I486 WeakPolarHBondContact O-CG2 3.22Å; P483-S510 WeakPolarHBondContact O-CB 3.49Å; P483-S510 PolarHBondContact O-OG 3.24Å; P483-S510 VanDerWaalsContact O-OG 3.13Å
484	S	75	Confident	87.2	Confident	48 Å²	48	33.6 Å²	33.6	34%	0.336	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	145.3	-177.5	71.3	0	0	0	0	112.2	I486 R508	S484-I486 PolarHBondContact O-N 3.5Å; S484-R508 WeakPolarHBondContact CB-O 3.36Å
485	R	78.2	Confident	87.2	Confident	111 Å²	111	35.2 Å²	35.2	42%	0.419	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	6	176.8	-56.8	179.4	178.3	-119.2	-4.1	117.6	F487 S488 G509	R485-F487 PolarHBondContact O-N 2.96Å; R485-S488 WeakPolarHBondContact O-CB 3.49Å; R485-S488 PolarHBondContact O-N 3.09Å; R485-S488 PolarHBondContact O-OG 2.71Å; R485-G509 PolarHBondContact N-O 3.25Å
486	I	81.5	Confident	87.3	Confident	9 Å²	9	35.1 Å²	35.1	5%	0.046	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-28.5	-177.6	-171.4	165.3	0	0	0	114.9	I458 P483 S484	I458-I486 HydrophobicContact CB-CD1 3.91Å; I458-I486 HydrophobicContact CG2-CD1 3.77Å; I458-I486 HydrophobicContact CG2-CG1 4.31Å; P483-I486 HydrophobicContact CG-CB 4.18Å; P483-I486 HydrophobicContact CG-CD1 3.85Å; P483-I486 WeakPolarHBondContact O-CG2 3.22Å; S484-I486 PolarHBondContact O-N 3.5Å
487	F	90.1	Very high	87.4	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	4.4	176.6	-53.7	-59.7	0	0	0	114.2	F463 L472 M474 R485 Q489 L490 L496 L498 F511 L514	F463-F487 HydrophobicContact CE2-CD1 4.37Å; F463-F487 HydrophobicContact CE2-CE1 4.17Å; L472-F487 HydrophobicContact CD2-CD1 4.28Å; L472-F487 HydrophobicContact CD2-CE1 4.05Å; M474-F487 HydrophobicContact CE-CE1 3.84Å; M474-F487 HydrophobicContact CE-CZ 3.97Å; R485-F487 PolarHBondContact O-N 2.96Å; F487-Q489 PolarHBondContact O-N 2.75Å; F487-L490 HydrophobicContact CB-CD1 4.25Å; F487-L490 HydrophobicContact CD1-CD1 4.02Å; F487-L490 VanDerWaalsContact O-CB 3.32Å; F487-L490 WeakPolarHBondContact O-CB 3.29Å; F487-L490 PolarHBondContact O-N 2.74Å; F487-L496 HydrophobicContact CD2-CD2 3.83Å; F487-L496 HydrophobicContact CE1-CD1 4.18Å; F487-L496 HydrophobicContact CE2-CD2 3.76Å; F487-L496 HydrophobicContact CG-CD2 4.28Å; F487-L496 HydrophobicContact CZ-CD1 4.16Å; F487-L496 HydrophobicContact CZ-CD2 4.13Å; F487-L498 HydrophobicContact CE2-CD1 4.17Å; F487-L498 HydrophobicContact CZ-CD1 4.18Å; F487-L498 HydrophobicContact CZ-CD2 4.28Å; F487-F511 HydrophobicContact CD2-CD1 4.15Å; F487-F511 HydrophobicContact CD2-CE1 4.46Å; F487-F511 HydrophobicContact CE2-CD1 4.35Å; F487-F511 HydrophobicContact CE2-CE1 4.2Å; F487-L514 HydrophobicContact CB-CD1 3.94Å; F487-L514 HydrophobicContact CB-CD2 4Å; F487-L514 HydrophobicContact CB-CG 4.26Å; F487-L514 HydrophobicContact CD2-CD1 4.43Å; F487-L514 HydrophobicContact CG-CD1 4.49Å
488	S	82.7	Confident	87.4	Confident	41 Å²	41	36.2 Å²	36.2	29%	0.287	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-0.9	-162.3	85.5	0	0	0	0	116.4	R485 A512	R485-S488 WeakPolarHBondContact O-CB 3.49Å; R485-S488 PolarHBondContact O-N 3.09Å; R485-S488 PolarHBondContact O-OG 2.71Å; S488-A512 VanDerWaalsContact CA-O 3.26Å; S488-A512 WeakPolarHBondContact CA-O 3.34Å; S488-A512 WeakPolarHBondContact CB-O 3.36Å
489	Q	78.4	Confident	87.5	Confident	58 Å²	58	34 Å²	34	27%	0.271	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-12.9	169.5	-68.2	-175.5	38.9	0	0	112.9	N464 H467 F487 T491	N464-Q489 PolarHBondContact OD1-NE2 3.22Å; N464-Q489 PolarHBondContact OD1-OE1 2.94Å; H467-Q489 PolarHBondContact ND1-O 2.91Å; F487-Q489 PolarHBondContact O-N 2.75Å; Q489-T491 PolarHBondContact O-N 2.95Å
490	L	90.3	Very high	87.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.204	C	C	.	.			trans	-84.9	51.3	-176.8	-53.1	180	0	0	0	110.6	F463 L466 L469 L472 F487 N492 L493 L514	F463-L490 HydrophobicContact CB-CD1 4.4Å; F463-L490 HydrophobicContact CB-CD2 3.98Å; F463-L490 HydrophobicContact CB-CG 4.44Å; F463-L490 HydrophobicContact CD2-CD1 4.45Å; F463-L490 HydrophobicContact CG-CD1 4.4Å; L466-L490 HydrophobicContact CB-CD2 3.85Å; L466-L490 WeakPolarHBondContact O-CD2 3.35Å; L469-L490 HydrophobicContact CB-CD2 4.08Å; L469-L490 HydrophobicContact CD2-CD1 4.07Å; L469-L490 HydrophobicContact CD2-CD2 3.79Å; L472-L490 HydrophobicContact CD2-CD1 4.09Å; F487-L490 HydrophobicContact CB-CD1 4.25Å; F487-L490 HydrophobicContact CD1-CD1 4.02Å; F487-L490 VanDerWaalsContact O-CB 3.32Å; F487-L490 WeakPolarHBondContact O-CB 3.29Å; F487-L490 PolarHBondContact O-N 2.74Å; L490-N492 PolarHBondContact O-N 3.22Å; L490-N492 VanDerWaalsContact O-N 3.11Å; L490-L493 HydrophobicContact CB-CB 4Å; L490-L493 HydrophobicContact CB-CD2 4.32Å; L490-L493 HydrophobicContact CD1-CD2 4.17Å; L490-L493 WeakPolarHBondContact O-CB 3.13Å; L490-L493 PolarHBondContact O-N 3Å; L490-L514 HydrophobicContact CB-CD2 4.19Å; L490-L514 WeakPolarHBondContact O-CD2 3.18Å
491	T	84.5	Confident	88.5	Confident	59 Å²	59	39.7 Å²	39.7	36%	0.362	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.4	-169.3	51	0	0	0	0	114	Q489 H516	Q489-T491 PolarHBondContact O-N 2.95Å; T491-H516 PolarHBondContact O-ND1 2.98Å
492	N	90.1	Very high	88.9	Confident	61 Å²	61	41.8 Å²	41.8	33%	0.326	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	1.6	176.2	-72.9	-46.6	0	0	0	114.6	H467 L469 L490 K494	H467-N492 WeakPolarHBondContact O-CB 3.46Å; H467-N492 PolarHBondContact O-ND2 2.81Å; L469-N492 CarbonylContact O-C 3.47Å; L490-N492 PolarHBondContact O-N 3.22Å; L490-N492 VanDerWaalsContact O-N 3.11Å; N492-K494 WeakPolarHBondContact O-CG 3.34Å; N492-K494 PolarHBondContact O-N 3.16Å
493	L	95.7	Very high	89.3	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.199	C	C	.	.			trans	-63.5	126.5	-174.6	-166.2	73.1	0	0	0	111.4	L469 L472 L490 L496 L514 H516 L517	L469-L493 HydrophobicContact CD2-CD1 4.2Å; L469-L493 HydrophobicContact CG-CD1 4.14Å; L469-L493 VanDerWaalsContact O-CA 3.24Å; L469-L493 WeakPolarHBondContact O-CA 3.31Å; L469-L493 PolarHBondContact O-N 2.75Å; L472-L493 HydrophobicContact CB-CD1 3.93Å; L490-L493 HydrophobicContact CB-CB 4Å; L490-L493 HydrophobicContact CB-CD2 4.32Å; L490-L493 HydrophobicContact CD1-CD2 4.17Å; L490-L493 WeakPolarHBondContact O-CB 3.13Å; L490-L493 PolarHBondContact O-N 3Å; L493-L496 HydrophobicContact CD2-CB 4.04Å; L493-L496 HydrophobicContact CD2-CD1 4.42Å; L493-L496 HydrophobicContact CD2-CD2 4.42Å; L493-L514 HydrophobicContact CB-CD2 4.2Å; L493-L514 HydrophobicContact CD2-CD2 4.19Å; L493-H516 CarbonylContact O-C 3.54Å; L493-L517 HydrophobicContact CB-CD1 4.49Å; L493-L517 HydrophobicContact CD2-CD1 4.11Å; L493-L517 HydrophobicContact CG-CD1 4.09Å; L493-L517 WeakPolarHBondContact O-CA 3.42Å; L493-L517 PolarHBondContact O-N 3.05Å
494	K	93.9	Very high	89.8	Confident	88 Å²	88	43.3 Å²	43.3	38%	0.383	21%	0.211	S	C	.	.			trans	-105.5	-28.2	-179.4	-55.7	177.9	-164.1	127.1	0	112.2	S470 N492 Q518 I519	S470-K494 WeakPolarHBondContact O-CA 3.23Å; S470-K494 WeakPolarHBondContact O-CB 3.43Å; S470-K494 PolarHBondContact O-N 3.13Å; S470-K494 WeakPolarHBondContact OG-CD 3.28Å; S470-K494 PolarHBondContact OG-NZ 2.95Å; N492-K494 WeakPolarHBondContact O-CG 3.34Å; N492-K494 PolarHBondContact O-N 3.16Å; K494-Q518 HydrophobicContact CB-CG 4.5Å; K494-Q518 WeakPolarHBondContact O-CA 3.16Å; K494-Q518 PolarHBondContact O-N 2.03Å; K494-I519 PolarHBondContact O-N 2.86Å
495	I	96.1	Very high	90	Very high	35 Å²	35	41.9 Å²	41.9	18%	0.179	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.2	-175.7	-57.5	-178.3	0	0	0	109.8	S470 L472 Y473 Y497 I519	S470-I495 PolarHBondContact O-N 2.98Å; L472-I495 PolarHBondContact N-O 2.8Å; Y473-I495 HydrophobicContact CE1-CG2 4.16Å; I495-Y497 HydrophobicContact CG2-CD2 3.55Å; I495-Y497 HydrophobicContact CG2-CE2 3.53Å; I495-I519 HydrophobicContact CD1-CD1 4.37Å; I495-I519 HydrophobicContact CG1-CD1 4.28Å
496	L	97.1	Very high	90.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	112.4	173.8	179.5	55.2	0	0	0	110.6	L472 F487 L493 L498 F511 L514 L517 I519 L520 H521	L472-L496 HydrophobicContact CB-CD1 4.27Å; L472-L496 HydrophobicContact CD2-CD1 4.06Å; L472-L496 HydrophobicContact CG-CD1 4.2Å; L472-L496 WeakPolarHBondContact O-CA 3.27Å; F487-L496 HydrophobicContact CD2-CD2 3.83Å; F487-L496 HydrophobicContact CE1-CD1 4.18Å; F487-L496 HydrophobicContact CE2-CD2 3.76Å; F487-L496 HydrophobicContact CG-CD2 4.28Å; F487-L496 HydrophobicContact CZ-CD1 4.16Å; F487-L496 HydrophobicContact CZ-CD2 4.13Å; L493-L496 HydrophobicContact CD2-CB 4.04Å; L493-L496 HydrophobicContact CD2-CD1 4.42Å; L493-L496 HydrophobicContact CD2-CD2 4.42Å; L496-L498 HydrophobicContact CD1-CD1 4.18Å; L496-L498 HydrophobicContact CD1-CD2 4.45Å; L496-L498 HydrophobicContact CD1-CG 4.07Å; L496-L498 HydrophobicContact CD2-CD1 3.98Å; L496-L498 HydrophobicContact CG-CD1 3.9Å; L496-L498 HydrophobicContact CG-CG 4.13Å; L496-F511 HydrophobicContact CD2-CD1 4.23Å; L496-F511 HydrophobicContact CD2-CE1 4.22Å; L496-L514 HydrophobicContact CD2-CD1 4.17Å; L496-L517 HydrophobicContact CB-CD1 3.81Å; L496-L517 HydrophobicContact CB-CD2 4.46Å; L496-I519 PolarHBondContact N-O 2.96Å; L496-L520 HydrophobicContact CB-CD1 4.23Å; L496-L520 HydrophobicContact CD2-CD1 4.01Å; L496-L520 HydrophobicContact CG-CD1 4.08Å; L496-H521 PolarHBondContact O-N 3.11Å
497	Y	97.8	Very high	90.2	Very high	60 Å²	60	38.3 Å²	38.3	24%	0.235	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.5	179.2	-84.7	-141.7	0	0	0	110.4	L472 Y473 M474 I495 I519 H521	L472-Y497 PolarHBondContact O-N 3.12Å; Y473-Y497 AromaticContact CD1-CD1 3.77Å; Y473-Y497 HydrophobicContact CD1-CD1 3.77Å; Y473-Y497 HydrophobicContact CD1-CD2 4.25Å; Y473-Y497 HydrophobicContact CD1-CE1 4.35Å; Y473-Y497 AromaticContact CD1-CG 3.71Å; Y473-Y497 HydrophobicContact CD1-CG 3.71Å; Y473-Y497 HydrophobicContact CE1-CD1 4.05Å; Y473-Y497 HydrophobicContact CE1-CD2 4.21Å; Y473-Y497 HydrophobicContact CE1-CE1 4.19Å; Y473-Y497 HydrophobicContact CE1-CE2 4.34Å; Y473-Y497 HydrophobicContact CE1-CG 4.06Å; M474-Y497 PolarHBondContact N-O 3.09Å; I495-Y497 HydrophobicContact CG2-CD2 3.55Å; I495-Y497 HydrophobicContact CG2-CE2 3.53Å; Y497-I519 HydrophobicContact CE2-CG2 3.8Å; Y497-H521 HydrophobicContact CD1-CB 4.49Å; Y497-H521 HydrophobicContact CD2-CB 3.96Å; Y497-H521 HydrophobicContact CE2-CB 4.25Å; Y497-H521 HydrophobicContact CG-CB 4.1Å
498	L	96.5	Very high	89.4	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.			trans	-130.4	15.9	-176.4	-70.8	166.9	0	0	0	111.8	M474 L479 L482 F487 L496 N501 I503 F511 H521 L522 N525	M474-L498 HydrophobicContact CB-CD2 4.36Å; M474-L498 HydrophobicContact CE-CD2 3.55Å; L479-L498 HydrophobicContact CD1-CD2 4.12Å; L482-L498 HydrophobicContact CD1-CD1 3.95Å; L482-L498 HydrophobicContact CD2-CD1 4.43Å; L482-L498 HydrophobicContact CD2-CD2 4.48Å; F487-L498 HydrophobicContact CE2-CD1 4.17Å; F487-L498 HydrophobicContact CZ-CD1 4.18Å; F487-L498 HydrophobicContact CZ-CD2 4.28Å; L496-L498 HydrophobicContact CD1-CD1 4.18Å; L496-L498 HydrophobicContact CD1-CD2 4.45Å; L496-L498 HydrophobicContact CD1-CG 4.07Å; L496-L498 HydrophobicContact CD2-CD1 3.98Å; L496-L498 HydrophobicContact CG-CD1 3.9Å; L496-L498 HydrophobicContact CG-CG 4.13Å; L498-N501 PolarHBondContact O-ND2 3.15Å; L498-N501 VanDerWaalsContact O-ND2 3.09Å; L498-I503 HydrophobicContact CB-CD1 4.24Å; L498-F511 HydrophobicContact CD1-CE1 4.17Å; L498-H521 CarbonylContact C-O 3.6Å; L498-H521 WeakPolarHBondContact CA-O 3.14Å; L498-H521 PolarHBondContact N-O 2.93Å; L498-L522 HydrophobicContact CB-CD2 3.87Å; L498-L522 HydrophobicContact CD1-CD2 3.89Å; L498-N525 PolarHBondContact O-ND2 2.83Å
499	H	94.9	Very high	89.2	Confident	31 Å²	31	45.1 Å²	45.1	14%	0.144	22%	0.215	C	C	.	.			trans	-76.9	154.4	-170.9	90	-69.3	0	0	0	112.4	S475 S476 N501 H521 S523	S475-H499 CarbonylContact C-O 3.39Å; S475-H499 WeakPolarHBondContact CA-O 3.47Å; S475-H499 VanDerWaalsContact CB-CE1 3.44Å; S475-H499 WeakPolarHBondContact CB-CE1 3.35Å; S475-H499 WeakPolarHBondContact CB-ND1 3.44Å; S475-H499 WeakPolarHBondContact CB-O 3.36Å; S475-H499 PolarHBondContact OG-CE1 2.86Å; S475-H499 PolarHBondContact OG-ND1 2.95Å; S476-H499 PolarHBondContact N-O 3.49Å; H499-N501 PolarHBondContact O-ND2 3.21Å; H499-H521 WeakPolarHBondContact CB-ND1 3.39Å; H499-H521 AromaticContact CD2-CE1 3.96Å; H499-H521 AromaticContact CG-CE1 3.92Å; H499-H521 AromaticContact CG-ND1 3.79Å; H499-H521 PolarHBondContact N-O 3Å; H499-S523 WeakPolarHBondContact CA-O 3.41Å; H499-S523 VanDerWaalsContact CB-O 3.29Å; H499-S523 WeakPolarHBondContact CB-O 3.44Å
500	R	95.9	Very high	89.5	Confident	141 Å²	141	42.4 Å²	42.4	53%	0.532	20%	0.202	S	C	.	.	S	Bend	trans	57.2	47.6	-173.9	-54.6	169.1	-177.3	173.7	1.9	112.6	S476 N477 S523 N524	S476-R500 WeakPolarHBondContact CA-O 3.28Å; S476-R500 PolarHBondContact N-O 3.1Å; N477-R500 PolarHBondContact N-O 2.93Å; R500-S523 PolarHBondContact N-O 2.89Å; R500-S523 VanDerWaalsContact N-O 3.12Å; R500-N524 WeakPolarHBondContact CA-O 3.4Å; R500-N524 HydrophobicContact CG-CB 4.05Å; R500-N524 PolarHBondContact N-O 3.01Å; R500-N524 VanDerWaalsContact N-O 3.14Å
501	N	95.9	Very high	89.5	Confident	13 Å²	13	42.4 Å²	42.4	7%	0.07	20%	0.203	C	C	.	.	S	Bend	trans	-112.9	-169.6	169.9	-85.6	-91.2	0	0	0	109.7	M474 N477 E478 L479 L498 H499 I503 N524 N525	M474-N501 PolarHBondContact O-ND2 2.88Å; N477-N501 WeakPolarHBondContact CA-OD1 3.49Å; N477-N501 WeakPolarHBondContact CB-OD1 3.43Å; N477-N501 WeakPolarHBondContact O-CA 3.29Å; N477-N501 PolarHBondContact O-OD1 3.15Å; E478-N501 PolarHBondContact N-OD1 2.74Å; L479-N501 HydrophobicContact CB-CB 4.26Å; L479-N501 WeakPolarHBondContact CB-OD1 3.26Å; L479-N501 WeakPolarHBondContact CG-OD1 3.39Å; L479-N501 PolarHBondContact N-OD1 2.98Å; L479-N501 VanDerWaalsContact N-OD1 3.16Å; L498-N501 PolarHBondContact O-ND2 3.15Å; L498-N501 VanDerWaalsContact O-ND2 3.09Å; H499-N501 PolarHBondContact O-ND2 3.21Å; N501-I503 HydrophobicContact CB-CD1 4.02Å; N501-I503 HydrophobicContact CB-CG1 3.89Å; N501-N524 PolarHBondContact N-O 2.91Å; N501-N525 VanDerWaalsContact CA-OD1 3.26Å; N501-N525 WeakPolarHBondContact CA-OD1 3.18Å; N501-N525 WeakPolarHBondContact CB-OD1 3.09Å; N501-N525 PolarHBondContact N-OD1 3.37Å; N501-N525 PolarHBondContact O-OD1 3.49Å
502	K	92.6	Very high	89.4	Confident	88 Å²	88	40.7 Å²	40.7	38%	0.383	19%	0.194	S	C	.	.			trans	-103.2	12	178.3	-62.5	177.3	179.4	177.3	0	112.6	E478 L479 S504	E478-K502 HydrophobicContact CB-CD 4.35Å; E478-K502 IonicContact OE2-NZ 3.59Å; E478-K502 PolarHBondContact OE2-NZ 3.02Å; L479-K502 CarbonylContact O-C 3.56Å; L479-K502 VanDerWaalsContact O-CA 3.26Å; L479-K502 WeakPolarHBondContact O-CA 3.5Å; L479-K502 WeakPolarHBondContact O-CB 3.38Å; L479-K502 PolarHBondContact O-N 3.12Å; K502-S504 PolarHBondContact O-N 3.2Å; K502-S504 VanDerWaalsContact O-N 3.13Å
503	I	92.3	Very high	89.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.			trans	-62	113.4	-163.4	-57.9	166.5	0	0	0	110.2	L479 G480 L482 L498 N501 C505 I506 N525 R526 I527	L479-I503 HydrophobicContact CB-CG1 4.07Å; L479-I503 WeakPolarHBondContact O-CA 3.43Å; L479-I503 VanDerWaalsContact O-CG1 3.31Å; L479-I503 WeakPolarHBondContact O-CG1 3.47Å; L479-I503 PolarHBondContact O-N 3.29Å; G480-I503 WeakPolarHBondContact O-CA 3.47Å; L482-I503 HydrophobicContact CD1-CD1 4.22Å; L482-I503 HydrophobicContact CD1-CG2 4.47Å; L482-I503 HydrophobicContact CD2-CD1 4.05Å; L482-I503 HydrophobicContact CG-CD1 4.07Å; L482-I503 HydrophobicContact CG-CG2 4.09Å; L498-I503 HydrophobicContact CB-CD1 4.24Å; N501-I503 HydrophobicContact CB-CD1 4.02Å; N501-I503 HydrophobicContact CB-CG1 3.89Å; I503-C505 WeakPolarHBondContact CG2-O 3.37Å; I503-I506 HydrophobicContact CG2-CD1 4.14Å; I503-I506 HydrophobicContact CG2-CG1 3.72Å; I503-N525 HydrophobicContact CB-CB 4.29Å; I503-N525 WeakPolarHBondContact CB-OD1 3.48Å; I503-N525 WeakPolarHBondContact CG1-OD1 3.48Å; I503-N525 PolarHBondContact N-OD1 3.3Å; I503-R526 CarbonylContact O-C 3.54Å; I503-R526 VanDerWaalsContact O-CA 3.26Å; I503-R526 WeakPolarHBondContact O-CA 3.35Å; I503-R526 PolarHBondContact O-N 2.69Å; I503-I527 HydrophobicContact CG2-CG1 4.2Å; I503-I527 WeakPolarHBondContact O-CG1 3.32Å; I503-I527 PolarHBondContact O-N 2.75Å
504	S	85.3	Confident	88.9	Confident	63 Å²	63	38.8 Å²	38.8	44%	0.441	19%	0.19	S	C	.	.			trans	-106.4	-41.6	172.6	56.9	0	0	0	0	112.5	G480 K502 R526	G480-S504 PolarHBondContact O-N 3.14Å; G480-S504 PolarHBondContact O-OG 2.86Å; K502-S504 PolarHBondContact O-N 3.2Å; K502-S504 VanDerWaalsContact O-N 3.13Å; S504-R526 WeakPolarHBondContact CA-O 3Å
505	C	80.6	Confident	88.6	Confident	18 Å²	18	37.9 Å²	37.9	12%	0.122	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	138	174.6	160.4	0	0	0	0	111.7	L481 L482 I503 H507 C612	L481-C505 VanDerWaalsContact CA-O 3.31Å; L481-C505 WeakPolarHBondContact CA-O 3.48Å; L481-C505 HydrophobicContact CB-CB 3.76Å; L482-C505 PolarHBondContact N-O 2.86Å; I503-C505 WeakPolarHBondContact CG2-O 3.37Å; C505-H507 VanDerWaalsContact SG-CD2 3.56Å; C505-C612 HydrophobicContact CB-CB 3.97Å; C505-C612 WeakPolarHBondContact CB-SG 3.34Å; C505-C612 WeakPolarHBondContact SG-CB 3.39Å; C505-C612 CovalentContact SG-SG 2.03Å; C505-C612 PolarHBondContact SG-SG 2.93Å
506	I	85.8	Confident	88.4	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.015	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	118.3	163.6	-62.2	-179	0	0	0	107.6	L482 I503 F511 L522 I527 F530 P531	L482-I506 HydrophobicContact CB-CG1 4.31Å; L482-I506 HydrophobicContact CB-CG2 4.39Å; L482-I506 HydrophobicContact CD1-CD1 4.03Å; L482-I506 HydrophobicContact CD1-CG1 4Å; L482-I506 HydrophobicContact CD1-CG2 4.46Å; L482-I506 HydrophobicContact CG-CG1 4.31Å; I503-I506 HydrophobicContact CG2-CD1 4.14Å; I503-I506 HydrophobicContact CG2-CG1 3.72Å; I506-F511 HydrophobicContact CD1-CE2 4.42Å; I506-F511 HydrophobicContact CD1-CZ 4.36Å; I506-F511 HydrophobicContact CG2-CE2 3.81Å; I506-F511 HydrophobicContact CG2-CZ 4.32Å; I506-L522 HydrophobicContact CD1-CD2 4.45Å; I506-I527 HydrophobicContact CD1-CD1 3.6Å; I506-I527 HydrophobicContact CD1-CG1 3.99Å; I506-I527 HydrophobicContact CD1-CG2 4.4Å; I506-F530 HydrophobicContact CD1-CD1 4.12Å; I506-F530 HydrophobicContact CD1-CE1 3.57Å; I506-F530 HydrophobicContact CD1-CZ 4.39Å; I506-P531 VanDerWaalsContact O-CD 3.25Å; I506-P531 WeakPolarHBondContact O-CD 3.39Å; I506-P531 WeakPolarHBondContact O-CG 3.47Å
507	H	77.1	Confident	88.2	Confident	42 Å²	42	39.1 Å²	39.1	19%	0.194	19%	0.192	C	C	.	.			trans	-70.1	156	178.6	-88.8	-90.9	0	0	0	113.6	L482 C505 G509 S510 D616	L482-H507 WeakPolarHBondContact O-CB 3.19Å; L482-H507 PolarHBondContact O-N 2.89Å; C505-H507 VanDerWaalsContact SG-CD2 3.56Å; H507-G509 PolarHBondContact O-N 2.95Å; H507-S510 WeakPolarHBondContact CB-OG 3.46Å; H507-S510 PolarHBondContact N-OG 3.25Å; H507-S510 PolarHBondContact O-N 3.41Å; H507-S510 VanDerWaalsContact O-N 3.17Å; H507-S510 PolarHBondContact O-OG 3.25Å; H507-D616 IonicContact CD2-OD1 3.4Å; H507-D616 IonicContact CE1-OD1 3.47Å; H507-D616 IonicContact CE1-OD2 2.65Å; H507-D616 PolarHBondContact CE1-OD2 2.79Å; H507-D616 IonicContact NE2-OD1 2.67Å; H507-D616 PolarHBondContact NE2-OD1 3.04Å; H507-D616 IonicContact NE2-OD2 3.94Å; H507-D616 PolarHBondContact NE2-OD2 3.39Å
508	R	72.9	Confident	87.8	Confident	162 Å²	162	39 Å²	39	61%	0.611	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	120.6	173.4	-170.2	175.7	-178.3	177.2	-0.7	109.4	S484 P531 E607	S484-R508 WeakPolarHBondContact CB-O 3.36Å; R508-P531 HydrophobicContact CB-CB 4.15Å; R508-P531 HydrophobicContact CG-CB 4.48Å; R508-E607 IonicContact NH1-OE1 3.72Å
509	G	80.2	Confident	87.6	Confident	23 Å²	23	40.7 Å²	40.7	24%	0.237	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	20.7	-178.5	0	0	0	0	0	115.4	R485 H507 F511 A512	R485-G509 PolarHBondContact N-O 3.25Å; H507-G509 PolarHBondContact O-N 2.95Å; G509-F511 PolarHBondContact O-N 3.11Å; G509-A512 VanDerWaalsContact O-CB 3.23Å; G509-A512 WeakPolarHBondContact O-CB 3.43Å; G509-A512 PolarHBondContact O-N 2.97Å; G509-A512 VanDerWaalsContact O-N 3.16Å
510	S	83.1	Confident	87.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-32.4	169	-56.5	0	0	0	0	112.7	L482 P483 H507	L482-S510 PolarHBondContact O-OG 2.95Å; P483-S510 WeakPolarHBondContact O-CB 3.49Å; P483-S510 PolarHBondContact O-OG 3.24Å; P483-S510 VanDerWaalsContact O-OG 3.13Å; H507-S510 WeakPolarHBondContact CB-OG 3.46Å; H507-S510 PolarHBondContact N-OG 3.25Å; H507-S510 PolarHBondContact O-N 3.41Å; H507-S510 VanDerWaalsContact O-N 3.17Å; H507-S510 PolarHBondContact O-OG 3.25Å
511	F	90.1	Very high	87.4	Confident	2 Å²	2	34 Å²	34	1%	0.009	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	14.5	176.6	-51.8	-64.8	0	0	0	113.9	L482 F487 L496 L498 I506 G509 L514 L520 L522 F535 L538	L482-F511 HydrophobicContact CD1-CE1 3.93Å; L482-F511 HydrophobicContact CD1-CZ 3.61Å; F487-F511 HydrophobicContact CD2-CD1 4.15Å; F487-F511 HydrophobicContact CD2-CE1 4.46Å; F487-F511 HydrophobicContact CE2-CD1 4.35Å; F487-F511 HydrophobicContact CE2-CE1 4.2Å; L496-F511 HydrophobicContact CD2-CD1 4.23Å; L496-F511 HydrophobicContact CD2-CE1 4.22Å; L498-F511 HydrophobicContact CD1-CE1 4.17Å; I506-F511 HydrophobicContact CD1-CE2 4.42Å; I506-F511 HydrophobicContact CD1-CZ 4.36Å; I506-F511 HydrophobicContact CG2-CE2 3.81Å; I506-F511 HydrophobicContact CG2-CZ 4.32Å; G509-F511 PolarHBondContact O-N 3.11Å; F511-L514 HydrophobicContact CB-CD1 4.17Å; F511-L514 HydrophobicContact CD1-CD1 4.3Å; F511-L514 WeakPolarHBondContact O-CB 3.38Å; F511-L514 WeakPolarHBondContact O-CG 3.1Å; F511-L514 PolarHBondContact O-N 3.38Å; F511-L520 HydrophobicContact CD1-CD2 4.46Å; F511-L520 HydrophobicContact CE1-CD1 4.04Å; F511-L520 HydrophobicContact CE1-CD2 4.29Å; F511-L520 HydrophobicContact CE2-CD2 4.47Å; F511-L520 HydrophobicContact CZ-CD2 4.3Å; F511-L522 HydrophobicContact CE2-CD1 4.46Å; F511-L522 HydrophobicContact CZ-CD1 4Å; F511-L522 HydrophobicContact CZ-CD2 4.33Å; F511-F535 HydrophobicContact CD2-CD1 4.05Å; F511-F535 AromaticContact CD2-CE1 3.94Å; F511-F535 HydrophobicContact CD2-CE1 3.94Å; F511-F535 HydrophobicContact CE2-CD1 4.38Å; F511-F535 AromaticContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE1 3.8Å; F511-L538 HydrophobicContact CB-CD2 4.25Å
512	A	84.3	Confident	87.2	Confident	22 Å²	22	33.3 Å²	33.3	18%	0.182	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	141.3	-176.3	0	0	0	0	0	112.2	S488 G509 L514 D537	S488-A512 VanDerWaalsContact CA-O 3.26Å; S488-A512 WeakPolarHBondContact CA-O 3.34Å; S488-A512 WeakPolarHBondContact CB-O 3.36Å; G509-A512 VanDerWaalsContact O-CB 3.23Å; G509-A512 WeakPolarHBondContact O-CB 3.43Å; G509-A512 PolarHBondContact O-N 2.97Å; G509-A512 VanDerWaalsContact O-N 3.16Å; A512-L514 VanDerWaalsContact C-N 3.33Å; A512-L514 PolarHBondContact O-N 3.1Å; A512-D537 WeakPolarHBondContact CA-OD2 3.47Å
513	G	82.7	Confident	87.2	Confident	23 Å²	23	29.4 Å²	29.4	24%	0.237	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-0.9	-179.3	0	0	0	0	0	116.1	E515 D537	G513-E515 PolarHBondContact O-N 3.49Å; G513-D537 PolarHBondContact N-OD2 2.72Å
514	L	91.2	Very high	87.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.			trans	-81.7	49	-178.3	-63.4	-175.6	0	0	0	113.6	F487 L490 L493 L496 F511 A512 H516 L517 L538	F487-L514 HydrophobicContact CB-CD1 3.94Å; F487-L514 HydrophobicContact CB-CD2 4Å; F487-L514 HydrophobicContact CB-CG 4.26Å; F487-L514 HydrophobicContact CD2-CD1 4.43Å; F487-L514 HydrophobicContact CG-CD1 4.49Å; L490-L514 HydrophobicContact CB-CD2 4.19Å; L490-L514 WeakPolarHBondContact O-CD2 3.18Å; L493-L514 HydrophobicContact CB-CD2 4.2Å; L493-L514 HydrophobicContact CD2-CD2 4.19Å; L496-L514 HydrophobicContact CD2-CD1 4.17Å; F511-L514 HydrophobicContact CB-CD1 4.17Å; F511-L514 HydrophobicContact CD1-CD1 4.3Å; F511-L514 WeakPolarHBondContact O-CB 3.38Å; F511-L514 WeakPolarHBondContact O-CG 3.1Å; F511-L514 PolarHBondContact O-N 3.38Å; A512-L514 VanDerWaalsContact C-N 3.33Å; A512-L514 PolarHBondContact O-N 3.1Å; L514-H516 PolarHBondContact O-N 2.78Å; L514-L517 HydrophobicContact CB-CB 4.21Å; L514-L517 HydrophobicContact CD1-CD2 4.23Å; L514-L517 WeakPolarHBondContact O-CB 3.35Å; L514-L517 PolarHBondContact O-N 3.36Å; L514-L517 VanDerWaalsContact O-N 3.13Å; L514-L538 HydrophobicContact CB-CD2 3.65Å
515	E	87.2	Confident	87.8	Confident	69 Å²	69	30.3 Å²	30.3	32%	0.322	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.5	-174.3	-68.4	-154.6	-156.3	0	0	115.6	G513 D537 R539 R540	G513-E515 PolarHBondContact O-N 3.49Å; E515-D537 WeakPolarHBondContact CA-O 3.37Å; E515-R539 IonicContact OE1-CZ 2.63Å; E515-R539 IonicContact OE1-NH1 3.59Å; E515-R539 PolarHBondContact OE1-NH1 2.96Å; E515-R539 IonicContact OE1-NH2 2.81Å; E515-R539 IonicContact OE2-CZ 3.4Å; E515-R539 IonicContact OE2-NE 2.66Å; E515-R539 IonicContact OE2-NH1 2.69Å; E515-R539 PolarHBondContact OE2-NH1 2.8Å; E515-R540 WeakPolarHBondContact O-CG 3.18Å; E515-R540 PolarHBondContact O-NH1 2.94Å
516	H	91.7	Very high	88.4	Confident	61 Å²	61	37 Å²	37	28%	0.282	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-0.8	-179.9	-66	101.6	0	0	0	114.4	T491 L493 L514 Q518 R540	T491-H516 PolarHBondContact O-ND1 2.98Å; L493-H516 CarbonylContact O-C 3.54Å; L514-H516 PolarHBondContact O-N 2.78Å; H516-Q518 PolarHBondContact O-N 2.94Å; H516-R540 VanDerWaalsContact CD2-CZ 3.42Å; H516-R540 PolarHBondContact CD2-NH1 3.27Å; H516-R540 PolarHBondContact NE2-NH1 2.91Å; H516-R540 VanDerWaalsContact NE2-NH1 3.13Å
517	L	93.8	Very high	88.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.			trans	-66.4	127.9	-175.5	-161.6	73.6	0	0	0	111.3	L493 L496 L514 L520 L538 R540 L541	L493-L517 HydrophobicContact CB-CD1 4.49Å; L493-L517 HydrophobicContact CD2-CD1 4.11Å; L493-L517 HydrophobicContact CG-CD1 4.09Å; L493-L517 WeakPolarHBondContact O-CA 3.42Å; L493-L517 PolarHBondContact O-N 3.05Å; L496-L517 HydrophobicContact CB-CD1 3.81Å; L496-L517 HydrophobicContact CB-CD2 4.46Å; L514-L517 HydrophobicContact CB-CB 4.21Å; L514-L517 HydrophobicContact CD1-CD2 4.23Å; L514-L517 WeakPolarHBondContact O-CB 3.35Å; L514-L517 PolarHBondContact O-N 3.36Å; L514-L517 VanDerWaalsContact O-N 3.13Å; L517-L520 HydrophobicContact CD2-CB 3.95Å; L517-L520 HydrophobicContact CD2-CD1 4.42Å; L517-L520 HydrophobicContact CD2-CD2 4.47Å; L517-L538 HydrophobicContact CB-CD2 4.18Å; L517-L538 HydrophobicContact CD2-CD1 4.33Å; L517-L538 HydrophobicContact CD2-CD2 3.9Å; L517-R540 CarbonylContact O-C 3.56Å; L517-L541 HydrophobicContact CD2-CD1 4.32Å; L517-L541 HydrophobicContact CG-CD1 4.42Å; L517-L541 VanDerWaalsContact O-CA 3.24Å; L517-L541 WeakPolarHBondContact O-CA 3.34Å; L517-L541 PolarHBondContact O-N 2.88Å
518	Q	90	Very high	89.1	Confident	58 Å²	58	40 Å²	40	27%	0.271	19%	0.193	S	C	.	.			trans	-109.4	-31.5	179.6	-58.2	-173.1	39.9	0	0	111.9	K494 H516 K542 Y543	K494-Q518 HydrophobicContact CB-CG 4.5Å; K494-Q518 WeakPolarHBondContact O-CA 3.16Å; K494-Q518 PolarHBondContact O-N 2.03Å; H516-Q518 PolarHBondContact O-N 2.94Å; Q518-K542 HydrophobicContact CB-CD 4.38Å; Q518-K542 PolarHBondContact O-N 3.02Å; Q518-Y543 PolarHBondContact O-N 3.19Å
519	I	91	Very high	89.7	Confident	34 Å²	34	34 Å²	34	17%	0.174	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	124.8	179.6	-49.7	-179.4	0	0	0	110.2	K494 I495 L496 Y497 Y543 Y545	K494-I519 PolarHBondContact O-N 2.86Å; I495-I519 HydrophobicContact CD1-CD1 4.37Å; I495-I519 HydrophobicContact CG1-CD1 4.28Å; L496-I519 PolarHBondContact N-O 2.96Å; Y497-I519 HydrophobicContact CE2-CG2 3.8Å; I519-Y543 HydrophobicContact CG1-CD2 4.1Å; I519-Y545 HydrophobicContact CG2-CD2 4.42Å; I519-Y545 HydrophobicContact CG2-CE2 4.06Å
520	L	93.1	Very high	90	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	117.9	170	179.2	54.7	0	0	0	109.6	L496 F511 L517 L522 F535 L538 L541 Y543 L544 Y545	L496-L520 HydrophobicContact CB-CD1 4.23Å; L496-L520 HydrophobicContact CD2-CD1 4.01Å; L496-L520 HydrophobicContact CG-CD1 4.08Å; F511-L520 HydrophobicContact CD1-CD2 4.46Å; F511-L520 HydrophobicContact CE1-CD1 4.04Å; F511-L520 HydrophobicContact CE1-CD2 4.29Å; F511-L520 HydrophobicContact CE2-CD2 4.47Å; F511-L520 HydrophobicContact CZ-CD2 4.3Å; L517-L520 HydrophobicContact CD2-CB 3.95Å; L517-L520 HydrophobicContact CD2-CD1 4.42Å; L517-L520 HydrophobicContact CD2-CD2 4.47Å; L520-L522 HydrophobicContact CD1-CD1 4.2Å; L520-L522 HydrophobicContact CD1-CG 4.09Å; L520-L522 HydrophobicContact CD2-CD1 3.93Å; L520-L522 HydrophobicContact CG-CD1 3.93Å; L520-L522 HydrophobicContact CG-CG 4.15Å; L520-F535 HydrophobicContact CD2-CD1 4.3Å; L520-F535 HydrophobicContact CD2-CE1 3.92Å; L520-L538 HydrophobicContact CD2-CD1 3.82Å; L520-L541 HydrophobicContact CB-CD1 3.94Å; L520-Y543 PolarHBondContact N-O 3.44Å; L520-L544 HydrophobicContact CB-CD1 4.01Å; L520-L544 HydrophobicContact CD2-CD1 3.94Å; L520-L544 HydrophobicContact CG-CD1 3.96Å; L520-L544 WeakPolarHBondContact O-CA 3.02Å; L520-Y545 PolarHBondContact O-N 2.95Å
521	H	93.3	Very high	89.8	Confident	31 Å²	31	34.8 Å²	34.8	14%	0.144	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	104.1	-177	-156.2	-48.1	0	0	0	111.5	L496 Y497 L498 H499 Y545	L496-H521 PolarHBondContact O-N 3.11Å; Y497-H521 HydrophobicContact CD1-CB 4.49Å; Y497-H521 HydrophobicContact CD2-CB 3.96Å; Y497-H521 HydrophobicContact CE2-CB 4.25Å; Y497-H521 HydrophobicContact CG-CB 4.1Å; L498-H521 CarbonylContact C-O 3.6Å; L498-H521 WeakPolarHBondContact CA-O 3.14Å; L498-H521 PolarHBondContact N-O 2.93Å; H499-H521 WeakPolarHBondContact CB-ND1 3.39Å; H499-H521 AromaticContact CD2-CE1 3.96Å; H499-H521 AromaticContact CG-CE1 3.92Å; H499-H521 AromaticContact CG-ND1 3.79Å; H499-H521 PolarHBondContact N-O 3Å; H521-Y545 HydrophobicContact CB-CD2 4.14Å; H521-Y545 AromaticContact CD2-CD2 3.37Å; H521-Y545 WeakPolarHBondContact CD2-CD2 3.41Å; H521-Y545 AromaticContact CD2-CE2 3.96Å; H521-Y545 AromaticContact CD2-CG 3.69Å; H521-Y545 AromaticContact CG-CD2 3.77Å; H521-Y545 AromaticContact NE2-CD2 3.99Å; H521-Y545 AromaticContact NE2-CG 3.84Å
522	L	93.7	Very high	89	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.			trans	-116.5	2.1	-175.8	-73.2	164.9	0	0	0	113.6	L482 L498 I506 F511 L520 N525 I527 F530 Y545 L546 N549	L482-L522 HydrophobicContact CD1-CD2 4.42Å; L498-L522 HydrophobicContact CB-CD2 3.87Å; L498-L522 HydrophobicContact CD1-CD2 3.89Å; I506-L522 HydrophobicContact CD1-CD2 4.45Å; F511-L522 HydrophobicContact CE2-CD1 4.46Å; F511-L522 HydrophobicContact CZ-CD1 4Å; F511-L522 HydrophobicContact CZ-CD2 4.33Å; L520-L522 HydrophobicContact CD1-CD1 4.2Å; L520-L522 HydrophobicContact CD1-CG 4.09Å; L520-L522 HydrophobicContact CD2-CD1 3.93Å; L520-L522 HydrophobicContact CG-CD1 3.93Å; L520-L522 HydrophobicContact CG-CG 4.15Å; L522-N525 PolarHBondContact O-ND2 3.13Å; L522-I527 HydrophobicContact CB-CD1 4.15Å; L522-I527 HydrophobicContact CD2-CD1 4.32Å; L522-F530 HydrophobicContact CD1-CE1 4.06Å; L522-F530 HydrophobicContact CD1-CZ 4.23Å; L522-Y545 CarbonylContact C-O 3.16Å; L522-Y545 WeakPolarHBondContact CA-O 3.46Å; L522-Y545 PolarHBondContact N-O 2.94Å; L522-L546 HydrophobicContact CB-CD2 4.06Å; L522-L546 HydrophobicContact CD1-CD2 4.12Å; L522-N549 PolarHBondContact O-ND2 2.89Å
523	S	92.2	Very high	88.4	Confident	5 Å²	5	44.2 Å²	44.2	4%	0.035	21%	0.211	C	C	.	.			trans	-54	156	177.9	-54.3	0	0	0	0	114.2	H499 R500 N525 Y545 V547	H499-S523 WeakPolarHBondContact CA-O 3.41Å; H499-S523 VanDerWaalsContact CB-O 3.29Å; H499-S523 WeakPolarHBondContact CB-O 3.44Å; R500-S523 PolarHBondContact N-O 2.89Å; R500-S523 VanDerWaalsContact N-O 3.12Å; S523-N525 PolarHBondContact O-ND2 2.82Å; S523-Y545 PolarHBondContact N-O 2.81Å; S523-Y545 WeakPolarHBondContact OG-CB 3.37Å; S523-Y545 PolarHBondContact OG-O 2.87Å; S523-V547 CarbonylContact C-O 3.49Å; S523-V547 WeakPolarHBondContact CA-O 3.3Å; S523-V547 WeakPolarHBondContact CB-O 3.43Å; S523-V547 PolarHBondContact OG-N 2.85Å
524	N	94.1	Very high	88.2	Confident	71 Å²	71	43.5 Å²	43.5	38%	0.38	20%	0.202	S	C	.	.	S	Bend	trans	56	60.6	-179.7	-64.7	63	0	0	0	111.2	R500 N501 V547 H548	R500-N524 WeakPolarHBondContact CA-O 3.4Å; R500-N524 HydrophobicContact CG-CB 4.05Å; R500-N524 PolarHBondContact N-O 3.01Å; R500-N524 VanDerWaalsContact N-O 3.14Å; N501-N524 PolarHBondContact N-O 2.91Å; N524-V547 PolarHBondContact N-O 2.68Å; N524-H548 VanDerWaalsContact CA-O 3.3Å; N524-H548 WeakPolarHBondContact CA-O 3.4Å; N524-H548 PolarHBondContact N-O 3.36Å; N524-H548 PolarHBondContact OD1-ND1 3.09Å
525	N	95.2	Very high	88	Confident	12 Å²	12	43.6 Å²	43.6	6%	0.064	20%	0.203	C	C	.	.	S	Bend	trans	-135.1	-167.8	175.2	-88.8	-70.5	0	0	0	109.1	L498 N501 I503 L522 S523 I527 H548 N549	L498-N525 PolarHBondContact O-ND2 2.83Å; N501-N525 VanDerWaalsContact CA-OD1 3.26Å; N501-N525 WeakPolarHBondContact CA-OD1 3.18Å; N501-N525 WeakPolarHBondContact CB-OD1 3.09Å; N501-N525 PolarHBondContact N-OD1 3.37Å; N501-N525 PolarHBondContact O-OD1 3.49Å; I503-N525 HydrophobicContact CB-CB 4.29Å; I503-N525 WeakPolarHBondContact CB-OD1 3.48Å; I503-N525 WeakPolarHBondContact CG1-OD1 3.48Å; I503-N525 PolarHBondContact N-OD1 3.3Å; L522-N525 PolarHBondContact O-ND2 3.13Å; S523-N525 PolarHBondContact O-ND2 2.82Å; N525-I527 HydrophobicContact CB-CD1 4.24Å; N525-I527 HydrophobicContact CB-CG1 4.14Å; N525-H548 PolarHBondContact N-O 2.88Å; N525-N549 WeakPolarHBondContact CA-OD1 3.23Å; N525-N549 WeakPolarHBondContact CB-OD1 3.13Å; N525-N549 PolarHBondContact O-OD1 3.01Å
526	R	93.5	Very high	87.8	Confident	159 Å²	159	46.4 Å²	46.4	60%	0.6	22%	0.216	S	C	*	.			trans	-115	20	-178.1	-63.9	-176.9	172.5	-169	-4.2	112.7	I503 S504 Q528 N549	I503-R526 CarbonylContact O-C 3.54Å; I503-R526 VanDerWaalsContact O-CA 3.26Å; I503-R526 WeakPolarHBondContact O-CA 3.35Å; I503-R526 PolarHBondContact O-N 2.69Å; S504-R526 WeakPolarHBondContact CA-O 3Å; R526-Q528 PolarHBondContact O-N 3.2Å; R526-N549 PolarHBondContact N-OD1 3.11Å
527	I	91.4	Very high	87.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.215	C	C	.	.			trans	-66.2	119.5	-172.5	-53.8	163.3	0	0	0	109.2	I503 I506 L522 N525 T529 F530 N549 P550 L551	I503-I527 HydrophobicContact CG2-CG1 4.2Å; I503-I527 WeakPolarHBondContact O-CG1 3.32Å; I503-I527 PolarHBondContact O-N 2.75Å; I506-I527 HydrophobicContact CD1-CD1 3.6Å; I506-I527 HydrophobicContact CD1-CG1 3.99Å; I506-I527 HydrophobicContact CD1-CG2 4.4Å; L522-I527 HydrophobicContact CB-CD1 4.15Å; L522-I527 HydrophobicContact CD2-CD1 4.32Å; N525-I527 HydrophobicContact CB-CD1 4.24Å; N525-I527 HydrophobicContact CB-CG1 4.14Å; I527-T529 VanDerWaalsContact CG2-O 3.31Å; I527-T529 WeakPolarHBondContact CG2-O 3.25Å; I527-F530 HydrophobicContact CD1-CE1 4.21Å; I527-F530 HydrophobicContact CD1-CZ 3.79Å; I527-F530 HydrophobicContact CG2-CD1 4.48Å; I527-F530 HydrophobicContact CG2-CD2 4.1Å; I527-F530 HydrophobicContact CG2-CE1 4.15Å; I527-F530 HydrophobicContact CG2-CE2 3.75Å; I527-F530 HydrophobicContact CG2-CG 4.46Å; I527-F530 HydrophobicContact CG2-CZ 3.78Å; I527-N549 HydrophobicContact CB-CB 4.27Å; I527-N549 WeakPolarHBondContact CB-OD1 2.99Å; I527-N549 WeakPolarHBondContact CG1-OD1 3.5Å; I527-N549 PolarHBondContact N-OD1 2.73Å; I527-P550 CarbonylContact O-C 3.09Å; I527-P550 VanDerWaalsContact O-CD 3.3Å; I527-P550 WeakPolarHBondContact O-CD 3.49Å; I527-L551 HydrophobicContact CG2-CD2 4.3Å; I527-L551 WeakPolarHBondContact O-CD2 3.04Å
528	Q	87.2	Confident	87	Confident	107 Å²	107	46 Å²	46	50%	0.5	22%	0.216	S	C	.	.			trans	-92.2	-38.4	177.5	-73.3	177.2	-12.4	0	0	112.2	R526 P550 L551 I552	R526-Q528 PolarHBondContact O-N 3.2Å; Q528-P550 WeakPolarHBondContact CA-O 3.29Å; Q528-P550 HydrophobicContact CG-CG 4.1Å; Q528-L551 CarbonylContact O-C 3.2Å; Q528-L551 WeakPolarHBondContact O-CA 3.43Å; Q528-I552 HydrophobicContact CB-CD1 4Å; Q528-I552 HydrophobicContact CB-CG1 4.13Å; Q528-I552 HydrophobicContact CG-CD1 4.34Å; Q528-I552 PolarHBondContact O-N 3.07Å
529	T	84.7	Confident	86.8	Confident	35 Å²	35	49.9 Å²	49.9	22%	0.215	23%	0.228	C	C	.	.			trans	-148.9	168.4	176.3	-167.7	0	0	0	0	110.5	I527	I527-T529 VanDerWaalsContact CG2-O 3.31Å; I527-T529 WeakPolarHBondContact CG2-O 3.25Å
530	F	86.1	Confident	86.6	Confident	3 Å²	3	54.2 Å²	54.2	1%	0.013	24%	0.242	C	C	.	.			trans	-122.8	128.3	174.1	-72.7	-88.7	0	0	0	108.7	I506 L522 I527 F535 L546 L551 L557 W560 L561	I506-F530 HydrophobicContact CD1-CD1 4.12Å; I506-F530 HydrophobicContact CD1-CE1 3.57Å; I506-F530 HydrophobicContact CD1-CZ 4.39Å; L522-F530 HydrophobicContact CD1-CE1 4.06Å; L522-F530 HydrophobicContact CD1-CZ 4.23Å; I527-F530 HydrophobicContact CD1-CE1 4.21Å; I527-F530 HydrophobicContact CD1-CZ 3.79Å; I527-F530 HydrophobicContact CG2-CD1 4.48Å; I527-F530 HydrophobicContact CG2-CD2 4.1Å; I527-F530 HydrophobicContact CG2-CE1 4.15Å; I527-F530 HydrophobicContact CG2-CE2 3.75Å; I527-F530 HydrophobicContact CG2-CG 4.46Å; I527-F530 HydrophobicContact CG2-CZ 3.78Å; F530-F535 HydrophobicContact CD1-CE1 4.21Å; F530-F535 HydrophobicContact CD1-CE2 4.43Å; F530-F535 AromaticContact CD1-CZ 3.69Å; F530-F535 HydrophobicContact CD1-CZ 3.69Å; F530-F535 HydrophobicContact CE1-CE1 4.08Å; F530-F535 HydrophobicContact CE1-CE2 4.47Å; F530-F535 AromaticContact CE1-CZ 3.49Å; F530-F535 HydrophobicContact CE1-CZ 3.49Å; F530-F535 VanDerWaalsContact CE1-CZ 3.49Å; F530-F535 HydrophobicContact CG-CZ 4.33Å; F530-F535 AromaticContact CZ-CZ 3.99Å; F530-F535 HydrophobicContact CZ-CZ 3.99Å; F530-L546 HydrophobicContact CE2-CD1 4.34Å; F530-L546 HydrophobicContact CE2-CD2 4.16Å; F530-L546 HydrophobicContact CZ-CD2 3.7Å; F530-L551 HydrophobicContact CD2-CD2 4.21Å; F530-L551 HydrophobicContact CE2-CD2 3.89Å; F530-L557 HydrophobicContact CB-CD1 4.11Å; F530-L557 HydrophobicContact CD2-CD1 4.14Å; F530-W560 HydrophobicContact CB-CH2 4.2Å; F530-W560 HydrophobicContact CB-CZ2 3.66Å; F530-L561 HydrophobicContact CD2-CD2 4.28Å
531	P	78.6	Confident	86.4	Confident	39 Å²	39	54.6 Å²	54.6	25%	0.253	24%	0.244	S	C	.	.			trans	-51.2	143.4	173	-26.6	32.6	0	0	0	111.8	I506 R508 N533 S534 W560	I506-P531 VanDerWaalsContact O-CD 3.25Å; I506-P531 WeakPolarHBondContact O-CD 3.39Å; I506-P531 WeakPolarHBondContact O-CG 3.47Å; R508-P531 HydrophobicContact CB-CB 4.15Å; R508-P531 HydrophobicContact CG-CB 4.48Å; P531-N533 PolarHBondContact O-N 3.22Å; P531-S534 WeakPolarHBondContact CB-OG 3.28Å; P531-S534 VanDerWaalsContact CD-OG 3.32Å; P531-S534 WeakPolarHBondContact CD-OG 3.44Å; P531-S534 VanDerWaalsContact O-CB 3.31Å; P531-S534 WeakPolarHBondContact O-CB 3.4Å; P531-S534 PolarHBondContact O-N 2.91Å; P531-S534 PolarHBondContact O-OG 2.9Å; P531-W560 WeakPolarHBondContact O-CZ2 3.41Å
532	R	73.1	Confident	85.9	Confident	156 Å²	156	58.6 Å²	58.6	59%	0.589	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	135	178.5	-164.1	174.4	-174.2	176	4.4	110.4	S534 W560	R532-S534 VanDerWaalsContact C-N 3.32Å; R532-S534 PolarHBondContact O-N 2.86Å; R532-W560 HydrophobicContact CG-CG 4.45Å
533	N	72.8	Confident	85.5	Confident	66 Å²	66	63.9 Å²	63.9	35%	0.353	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	19.7	-176	-65.9	24.8	0	0	0	115.9	P531 F535 E536	P531-N533 PolarHBondContact O-N 3.22Å; N533-F535 PolarHBondContact O-N 3.41Å; N533-E536 HydrophobicContact CB-CB 3.98Å; N533-E536 VanDerWaalsContact CB-OE2 3.29Å; N533-E536 WeakPolarHBondContact CB-OE2 3.33Å; N533-E536 PolarHBondContact ND2-OE1 2.85Å; N533-E536 PolarHBondContact ND2-OE2 3.09Å; N533-E536 VanDerWaalsContact O-CB 3.31Å; N533-E536 WeakPolarHBondContact O-CB 3.29Å; N533-E536 PolarHBondContact O-N 3.03Å
534	S	78.9	Confident	85.4	Confident	8 Å²	8	64 Å²	64	6%	0.056	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.3	179	-71.6	0	0	0	0	115.7	P531 R532	P531-S534 WeakPolarHBondContact CB-OG 3.28Å; P531-S534 VanDerWaalsContact CD-OG 3.32Å; P531-S534 WeakPolarHBondContact CD-OG 3.44Å; P531-S534 VanDerWaalsContact O-CB 3.31Å; P531-S534 WeakPolarHBondContact O-CB 3.4Å; P531-S534 PolarHBondContact O-N 2.91Å; P531-S534 PolarHBondContact O-OG 2.9Å; R532-S534 VanDerWaalsContact C-N 3.32Å; R532-S534 PolarHBondContact O-N 2.86Å
535	F	86.4	Confident	85.1	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.009	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	13	-179.7	-54.4	-39.1	0	0	0	113.9	F511 L520 F530 N533 D537 L538 L544 W560 L561 F564	F511-F535 HydrophobicContact CD2-CD1 4.05Å; F511-F535 AromaticContact CD2-CE1 3.94Å; F511-F535 HydrophobicContact CD2-CE1 3.94Å; F511-F535 HydrophobicContact CE2-CD1 4.38Å; F511-F535 AromaticContact CE2-CE1 3.8Å; F511-F535 HydrophobicContact CE2-CE1 3.8Å; L520-F535 HydrophobicContact CD2-CD1 4.3Å; L520-F535 HydrophobicContact CD2-CE1 3.92Å; F530-F535 HydrophobicContact CD1-CE1 4.21Å; F530-F535 HydrophobicContact CD1-CE2 4.43Å; F530-F535 AromaticContact CD1-CZ 3.69Å; F530-F535 HydrophobicContact CD1-CZ 3.69Å; F530-F535 HydrophobicContact CE1-CE1 4.08Å; F530-F535 HydrophobicContact CE1-CE2 4.47Å; F530-F535 AromaticContact CE1-CZ 3.49Å; F530-F535 HydrophobicContact CE1-CZ 3.49Å; F530-F535 VanDerWaalsContact CE1-CZ 3.49Å; F530-F535 HydrophobicContact CG-CZ 4.33Å; F530-F535 AromaticContact CZ-CZ 3.99Å; F530-F535 HydrophobicContact CZ-CZ 3.99Å; N533-F535 PolarHBondContact O-N 3.41Å; F535-D537 PolarHBondContact O-N 3.16Å; F535-L538 HydrophobicContact CB-CD1 3.92Å; F535-L538 HydrophobicContact CB-CG 4.28Å; F535-L538 HydrophobicContact CD1-CD1 3.67Å; F535-L538 HydrophobicContact CG-CD1 4.09Å; F535-L538 WeakPolarHBondContact O-CB 3.24Å; F535-L538 PolarHBondContact O-N 3.16Å; F535-L544 HydrophobicContact CD2-CD2 4.05Å; F535-L544 HydrophobicContact CE2-CD2 3.76Å; F535-L544 HydrophobicContact CZ-CD1 4.4Å; F535-L544 HydrophobicContact CZ-CD2 4.32Å; F535-W560 HydrophobicContact CB-CZ3 4.47Å; F535-W560 AromaticContact CD2-CH2 3.63Å; F535-W560 HydrophobicContact CD2-CH2 3.63Å; F535-W560 AromaticContact CD2-CZ3 3.7Å; F535-W560 HydrophobicContact CD2-CZ3 3.7Å; F535-W560 AromaticContact CE2-CH2 3.92Å; F535-W560 HydrophobicContact CE2-CH2 3.92Å; F535-W560 HydrophobicContact CE2-CZ3 4.34Å; F535-W560 HydrophobicContact CG-CH2 4.26Å; F535-W560 HydrophobicContact CG-CZ3 4.37Å; F535-L561 HydrophobicContact CD2-CD1 4.41Å; F535-L561 HydrophobicContact CE2-CD1 4.01Å; F535-F564 HydrophobicContact CB-CD2 4.35Å; F535-F564 HydrophobicContact CB-CE1 4.04Å; F535-F564 HydrophobicContact CB-CE2 3.64Å; F535-F564 HydrophobicContact CB-CZ 3.46Å; F535-F564 VanDerWaalsContact CB-CZ 3.46Å; F535-F564 HydrophobicContact CD2-CD1 4.1Å; F535-F564 AromaticContact CD2-CE1 3.85Å; F535-F564 HydrophobicContact CD2-CE1 3.85Å; F535-F564 HydrophobicContact CD2-CZ 4.17Å; F535-F564 HydrophobicContact CG-CE1 4.3Å; F535-F564 HydrophobicContact CG-CZ 4.19Å
536	E	82.3	Confident	84.9	Confident	127 Å²	127	63.2 Å²	63.2	59%	0.593	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-38.9	-174.1	179.6	165.4	-144	0	0	113.6	N533 L538	N533-E536 HydrophobicContact CB-CB 3.98Å; N533-E536 VanDerWaalsContact CB-OE2 3.29Å; N533-E536 WeakPolarHBondContact CB-OE2 3.33Å; N533-E536 PolarHBondContact ND2-OE1 2.85Å; N533-E536 PolarHBondContact ND2-OE2 3.09Å; N533-E536 VanDerWaalsContact O-CB 3.31Å; N533-E536 WeakPolarHBondContact O-CB 3.29Å; N533-E536 PolarHBondContact O-N 3.03Å; E536-L538 VanDerWaalsContact C-N 3.27Å; E536-L538 PolarHBondContact O-N 2.86Å
537	D	82.6	Confident	84.6	Confident	51 Å²	51	56.7 Å²	56.7	27%	0.273	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-12.6	176.6	-75.4	-14.7	0	0	0	113.8	A512 G513 E515 F535 R539	A512-D537 WeakPolarHBondContact CA-OD2 3.47Å; G513-D537 PolarHBondContact N-OD2 2.72Å; E515-D537 WeakPolarHBondContact CA-O 3.37Å; F535-D537 PolarHBondContact O-N 3.16Å; D537-R539 PolarHBondContact O-N 2.89Å
538	L	87.9	Confident	84.5	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	28%	0.279	C	S	.	.			trans	-80.3	53.2	-172.8	-54.5	-172.3	0	0	0	112.3	F511 L514 L517 L520 F535 E536 R540 L541	F511-L538 HydrophobicContact CB-CD2 4.25Å; L514-L538 HydrophobicContact CB-CD2 3.65Å; L517-L538 HydrophobicContact CB-CD2 4.18Å; L517-L538 HydrophobicContact CD2-CD1 4.33Å; L517-L538 HydrophobicContact CD2-CD2 3.9Å; L520-L538 HydrophobicContact CD2-CD1 3.82Å; F535-L538 HydrophobicContact CB-CD1 3.92Å; F535-L538 HydrophobicContact CB-CG 4.28Å; F535-L538 HydrophobicContact CD1-CD1 3.67Å; F535-L538 HydrophobicContact CG-CD1 4.09Å; F535-L538 WeakPolarHBondContact O-CB 3.24Å; F535-L538 PolarHBondContact O-N 3.16Å; E536-L538 VanDerWaalsContact C-N 3.27Å; E536-L538 PolarHBondContact O-N 2.86Å; L538-R540 VanDerWaalsContact C-N 3.29Å; L538-R540 PolarHBondContact O-N 2.94Å; L538-L541 HydrophobicContact CB-CB 4.11Å; L538-L541 HydrophobicContact CB-CD2 4.27Å; L538-L541 HydrophobicContact CD1-CD2 4.05Å; L538-L541 WeakPolarHBondContact O-CB 3.27Å; L538-L541 PolarHBondContact O-N 2.99Å
539	R	84.5	Confident	84.5	Confident	141 Å²	141	58.2 Å²	58.2	53%	0.532	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-39.8	-170.5	-68	176	-178.6	156.6	6.8	113	E515 D537 K568	E515-R539 IonicContact OE1-CZ 2.63Å; E515-R539 IonicContact OE1-NH1 3.59Å; E515-R539 PolarHBondContact OE1-NH1 2.96Å; E515-R539 IonicContact OE1-NH2 2.81Å; E515-R539 IonicContact OE2-CZ 3.4Å; E515-R539 IonicContact OE2-NE 2.66Å; E515-R539 IonicContact OE2-NH1 2.69Å; E515-R539 PolarHBondContact OE2-NH1 2.8Å; D537-R539 PolarHBondContact O-N 2.89Å; R539-K568 PolarHBondContact O-NZ 2.92Å
540	R	87.6	Confident	84.8	Confident	124 Å²	124	59 Å²	59	47%	0.468	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	11.5	-176.1	-66.3	-172.1	-179.9	85.3	-12.3	115.5	E515 H516 L517 L538 K542	E515-R540 WeakPolarHBondContact O-CG 3.18Å; E515-R540 PolarHBondContact O-NH1 2.94Å; H516-R540 VanDerWaalsContact CD2-CZ 3.42Å; H516-R540 PolarHBondContact CD2-NH1 3.27Å; H516-R540 PolarHBondContact NE2-NH1 2.91Å; H516-R540 VanDerWaalsContact NE2-NH1 3.13Å; L517-R540 CarbonylContact O-C 3.56Å; L538-R540 VanDerWaalsContact C-N 3.29Å; L538-R540 PolarHBondContact O-N 2.94Å; R540-K542 PolarHBondContact O-N 2.87Å
541	L	88.2	Confident	85	Confident	8 Å²	8	58.8 Å²	58.8	4%	0.042	26%	0.263	C	S	.	.			trans	-63	128.5	-177.1	-164.6	67.9	0	0	0	111.4	L517 L520 L538 L544 F564	L517-L541 HydrophobicContact CD2-CD1 4.32Å; L517-L541 HydrophobicContact CG-CD1 4.42Å; L517-L541 VanDerWaalsContact O-CA 3.24Å; L517-L541 WeakPolarHBondContact O-CA 3.34Å; L517-L541 PolarHBondContact O-N 2.88Å; L520-L541 HydrophobicContact CB-CD1 3.94Å; L538-L541 HydrophobicContact CB-CB 4.11Å; L538-L541 HydrophobicContact CB-CD2 4.27Å; L538-L541 HydrophobicContact CD1-CD2 4.05Å; L538-L541 WeakPolarHBondContact O-CB 3.27Å; L538-L541 PolarHBondContact O-N 2.99Å; L541-L544 HydrophobicContact CD2-CB 4.05Å; L541-L544 HydrophobicContact CD2-CD2 4.24Å; L541-L544 HydrophobicContact CD2-CG 4.49Å; L541-F564 HydrophobicContact CD2-CE1 4.06Å; L541-F564 HydrophobicContact CD2-CZ 3.99Å
542	K	82.8	Confident	85.5	Confident	116 Å²	116	58.8 Å²	58.8	50%	0.504	26%	0.261	S	S	.	.			trans	-109.6	-35.2	177.4	-64.8	176.1	178.5	167.6	0	112.5	Q518 R540 A570	Q518-K542 HydrophobicContact CB-CD 4.38Å; Q518-K542 PolarHBondContact O-N 3.02Å; R540-K542 PolarHBondContact O-N 2.87Å; K542-A570 WeakPolarHBondContact O-CA 3.37Å
543	Y	85.9	Confident	86.1	Confident	111 Å²	111	51.4 Å²	51.4	44%	0.435	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.8	-174.8	-59.2	-78.7	0	0	0	110.7	Q518 I519 L520	Q518-Y543 PolarHBondContact O-N 3.19Å; I519-Y543 HydrophobicContact CG1-CD2 4.1Å; L520-Y543 PolarHBondContact N-O 3.44Å
544	L	89.2	Confident	86.5	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	107.5	179.4	178.3	55.3	0	0	0	110.1	L520 F535 L541 L546 F564 L565 A570	L520-L544 HydrophobicContact CB-CD1 4.01Å; L520-L544 HydrophobicContact CD2-CD1 3.94Å; L520-L544 HydrophobicContact CG-CD1 3.96Å; L520-L544 WeakPolarHBondContact O-CA 3.02Å; F535-L544 HydrophobicContact CD2-CD2 4.05Å; F535-L544 HydrophobicContact CE2-CD2 3.76Å; F535-L544 HydrophobicContact CZ-CD1 4.4Å; F535-L544 HydrophobicContact CZ-CD2 4.32Å; L541-L544 HydrophobicContact CD2-CB 4.05Å; L541-L544 HydrophobicContact CD2-CD2 4.24Å; L541-L544 HydrophobicContact CD2-CG 4.49Å; L544-L546 HydrophobicContact CD1-CD2 3.85Å; L544-L546 HydrophobicContact CD1-CG 4.22Å; L544-L546 HydrophobicContact CD2-CD1 4.27Å; L544-L546 HydrophobicContact CG-CD1 4.3Å; L544-L546 HydrophobicContact CG-CD2 4.19Å; L544-L546 HydrophobicContact CG-CG 4Å; L544-F564 HydrophobicContact CD2-CD1 4.28Å; L544-F564 HydrophobicContact CD2-CE1 3.8Å; L544-L565 HydrophobicContact CD2-CD2 4.12Å; L544-A570 HydrophobicContact CB-CB 4.07Å; L544-A570 PolarHBondContact N-O 3.26Å
545	Y	88.7	Confident	86.4	Confident	63 Å²	63	50.5 Å²	50.5	25%	0.247	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.3	-178.1	-56.9	-84.4	0	0	0	110.9	I519 L520 H521 L522 S523	I519-Y545 HydrophobicContact CG2-CD2 4.42Å; I519-Y545 HydrophobicContact CG2-CE2 4.06Å; L520-Y545 PolarHBondContact O-N 2.95Å; H521-Y545 HydrophobicContact CB-CD2 4.14Å; H521-Y545 AromaticContact CD2-CD2 3.37Å; H521-Y545 WeakPolarHBondContact CD2-CD2 3.41Å; H521-Y545 AromaticContact CD2-CE2 3.96Å; H521-Y545 AromaticContact CD2-CG 3.69Å; H521-Y545 AromaticContact CG-CD2 3.77Å; H521-Y545 AromaticContact NE2-CD2 3.99Å; H521-Y545 AromaticContact NE2-CG 3.84Å; L522-Y545 CarbonylContact C-O 3.16Å; L522-Y545 WeakPolarHBondContact CA-O 3.46Å; L522-Y545 PolarHBondContact N-O 2.94Å; S523-Y545 PolarHBondContact N-O 2.81Å; S523-Y545 WeakPolarHBondContact OG-CB 3.37Å; S523-Y545 PolarHBondContact OG-O 2.87Å
546	L	89.8	Confident	85.8	Confident	5 Å²	5	53 Å²	53	3%	0.026	24%	0.24	C	C	.	.			trans	-117.8	0.2	-177.1	-60.3	-178.9	0	0	0	114.3	L522 F530 L544 N549 L561 V576	L522-L546 HydrophobicContact CB-CD2 4.06Å; L522-L546 HydrophobicContact CD1-CD2 4.12Å; F530-L546 HydrophobicContact CE2-CD1 4.34Å; F530-L546 HydrophobicContact CE2-CD2 4.16Å; F530-L546 HydrophobicContact CZ-CD2 3.7Å; L544-L546 HydrophobicContact CD1-CD2 3.85Å; L544-L546 HydrophobicContact CD1-CG 4.22Å; L544-L546 HydrophobicContact CD2-CD1 4.27Å; L544-L546 HydrophobicContact CG-CD1 4.3Å; L544-L546 HydrophobicContact CG-CD2 4.19Å; L544-L546 HydrophobicContact CG-CG 4Å; L546-N549 PolarHBondContact O-ND2 3.21Å; L546-L561 HydrophobicContact CD1-CD1 4.4Å; L546-L561 HydrophobicContact CD1-CD2 4.25Å; L546-V576 HydrophobicContact CB-CB 4Å; L546-V576 HydrophobicContact CB-CG1 4.25Å; L546-V576 HydrophobicContact CB-CG2 3.85Å; L546-V576 HydrophobicContact CD1-CG1 4.42Å; L546-V576 WeakPolarHBondContact O-CG2 3.46Å
547	V	87.8	Confident	85.9	Confident	21 Å²	21	46.9 Å²	46.9	13%	0.127	21%	0.212	C	C	.	.			trans	-59	145.9	-170.1	-166.4	0	0	0	0	111.9	S523 N524 Q574	S523-V547 CarbonylContact C-O 3.49Å; S523-V547 WeakPolarHBondContact CA-O 3.3Å; S523-V547 WeakPolarHBondContact CB-O 3.43Å; S523-V547 PolarHBondContact OG-N 2.85Å; N524-V547 PolarHBondContact N-O 2.68Å; V547-Q574 HydrophobicContact CG2-CB 3.83Å; V547-Q574 VanDerWaalsContact CG2-O 3.29Å; V547-Q574 WeakPolarHBondContact CG2-O 3.32Å
548	H	89	Confident	85.7	Confident	126 Å²	126	44.6 Å²	44.6	58%	0.583	20%	0.2	S	C	*	.	S	Bend	trans	57.4	56.6	-173.7	-42.9	114.7	0	0	0	112.6	N524 N525	N524-H548 VanDerWaalsContact CA-O 3.3Å; N524-H548 WeakPolarHBondContact CA-O 3.4Å; N524-H548 PolarHBondContact N-O 3.36Å; N524-H548 PolarHBondContact OD1-ND1 3.09Å; N525-H548 PolarHBondContact N-O 2.88Å
549	N	88.1	Confident	85.2	Confident	13 Å²	13	47 Å²	47	7%	0.07	22%	0.22	C	C	.	.			trans	-127.8	140.8	162.5	-81.5	-77.7	0	0	0	108.6	L522 N525 R526 I527 L546 L551	L522-N549 PolarHBondContact O-ND2 2.89Å; N525-N549 WeakPolarHBondContact CA-OD1 3.23Å; N525-N549 WeakPolarHBondContact CB-OD1 3.13Å; N525-N549 PolarHBondContact O-OD1 3.01Å; R526-N549 PolarHBondContact N-OD1 3.11Å; I527-N549 HydrophobicContact CB-CB 4.27Å; I527-N549 WeakPolarHBondContact CB-OD1 2.99Å; I527-N549 WeakPolarHBondContact CG1-OD1 3.5Å; I527-N549 PolarHBondContact N-OD1 2.73Å; L546-N549 PolarHBondContact O-ND2 3.21Å; N549-L551 HydrophobicContact CB-CD2 4.31Å; N549-L551 HydrophobicContact CB-CG 4.17Å; N549-L551 PolarHBondContact O-N 3.29Å
550	P	91.2	Very high	85.1	Confident	51 Å²	51	41.4 Å²	41.4	33%	0.331	20%	0.199	S	C	.	.			trans	-78.3	59.5	-177.7	34.9	-38.6	0	0	0	112.2	I527 Q528 I552 A579	I527-P550 CarbonylContact O-C 3.09Å; I527-P550 VanDerWaalsContact O-CD 3.3Å; I527-P550 WeakPolarHBondContact O-CD 3.49Å; Q528-P550 WeakPolarHBondContact CA-O 3.29Å; Q528-P550 HydrophobicContact CG-CG 4.1Å; P550-I552 PolarHBondContact O-N 3.04Å; P550-A579 HydrophobicContact CB-CB 4.27Å
551	L	90.1	Very high	85	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.			trans	-66.7	123.9	-171.9	-65	177.1	0	0	0	112.7	I527 Q528 F530 N549 C553 L557 V576 A579 E580 V589	I527-L551 HydrophobicContact CG2-CD2 4.3Å; I527-L551 WeakPolarHBondContact O-CD2 3.04Å; Q528-L551 CarbonylContact O-C 3.2Å; Q528-L551 WeakPolarHBondContact O-CA 3.43Å; F530-L551 HydrophobicContact CD2-CD2 4.21Å; F530-L551 HydrophobicContact CE2-CD2 3.89Å; N549-L551 HydrophobicContact CB-CD2 4.31Å; N549-L551 HydrophobicContact CB-CG 4.17Å; N549-L551 PolarHBondContact O-N 3.29Å; L551-C553 PolarHBondContact O-N 3.46Å; L551-L557 HydrophobicContact CB-CD2 4.09Å; L551-L557 HydrophobicContact CD2-CD2 4.25Å; L551-V576 HydrophobicContact CD1-CG1 4.17Å; L551-V576 HydrophobicContact CD1-CG2 3.64Å; L551-A579 PolarHBondContact O-N 2.72Å; L551-E580 PolarHBondContact O-N 2.81Å; L551-V589 HydrophobicContact CD1-CG2 4.37Å
552	I	87.8	Confident	84.9	Confident	39 Å²	39	35.3 Å²	35.3	20%	0.2	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-86	102.4	169.4	-51.2	178.6	0	0	0	107	Q528 P550 D554 L557 E580	Q528-I552 HydrophobicContact CB-CD1 4Å; Q528-I552 HydrophobicContact CB-CG1 4.13Å; Q528-I552 HydrophobicContact CG-CD1 4.34Å; Q528-I552 PolarHBondContact O-N 3.07Å; P550-I552 PolarHBondContact O-N 3.04Å; I552-D554 HydrophobicContact CG2-CB 4.25Å; I552-D554 PolarHBondContact O-N 3.08Å; I552-L557 VanDerWaalsContact O-CD2 3.32Å; I552-L557 WeakPolarHBondContact O-CD2 3.48Å; I552-E580 HydrophobicContact CB-CB 4.49Å; I552-E580 HydrophobicContact CG1-CB 4.3Å; I552-E580 HydrophobicContact CG2-CB 4.21Å
553	C	85.5	Confident	84.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.			trans	-81.6	57.9	178.9	-67.7	0	0	0	0	111.4	L551 C578 E580 V584 L592 L597	L551-C553 PolarHBondContact O-N 3.46Å; C553-C578 HydrophobicContact CB-CB 3.73Å; C553-C578 WeakPolarHBondContact CB-SG 3.33Å; C553-C578 VanDerWaalsContact SG-CA 3.51Å; C553-C578 WeakPolarHBondContact SG-CB 3.2Å; C553-C578 CovalentContact SG-SG 2.03Å; C553-C578 PolarHBondContact SG-SG 3.34Å; C553-E580 WeakPolarHBondContact CB-O 3.5Å; C553-E580 PolarHBondContact N-O 3.28Å; C553-V584 HydrophobicContact CB-CG2 3.84Å; C553-L592 HydrophobicContact CB-CD1 3.87Å; C553-L597 WeakPolarHBondContact O-CD1 3.34Å
554	D	82.1	Confident	84.7	Confident	33 Å²	33	28.5 Å²	28.5	18%	0.176	15%	0.154	C	C	.	.			trans	-76.6	-177.6	173.3	84.2	-42.1	0	0	0	111.7	I552 Q556 L557 A558	I552-D554 HydrophobicContact CG2-CB 4.25Å; I552-D554 PolarHBondContact O-N 3.08Å; D554-Q556 VanDerWaalsContact C-N 3.25Å; D554-Q556 PolarHBondContact O-N 3.22Å; D554-Q556 WeakPolarHBondContact OD1-CB 3.17Å; D554-Q556 PolarHBondContact OD1-N 3.37Å; D554-Q556 VanDerWaalsContact OD1-N 3.12Å; D554-Q556 VanDerWaalsContact OD2-CB 3.31Å; D554-Q556 WeakPolarHBondContact OD2-CB 3.29Å; D554-Q556 VanDerWaalsContact OD2-CG 3.29Å; D554-Q556 WeakPolarHBondContact OD2-CG 3.33Å; D554-Q556 PolarHBondContact OD2-N 3.47Å; D554-L557 PolarHBondContact O-N 2.77Å; D554-L557 PolarHBondContact OD1-N 3.02Å; D554-A558 WeakPolarHBondContact O-CB 3.49Å; D554-A558 PolarHBondContact O-N 2.73Å
555	C	76.7	Confident	84.4	Confident	22 Å²	22	28.7 Å²	28.7	15%	0.149	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-18	175.2	-69.7	0	0	0	0	114.5	A559 C599 Y605	C555-A559 WeakPolarHBondContact O-CB 3.35Å; C555-C599 VanDerWaalsContact CA-SG 3.54Å; C555-C599 HydrophobicContact CB-CB 3.86Å; C555-C599 WeakPolarHBondContact CB-SG 3.27Å; C555-C599 WeakPolarHBondContact SG-CA 3.11Å; C555-C599 WeakPolarHBondContact SG-CB 3.24Å; C555-C599 CovalentContact SG-SG 2.04Å; C555-C599 PolarHBondContact SG-SG 2.7Å; C555-Y605 WeakPolarHBondContact CB-OH 3.43Å
556	Q	74.6	Confident	83.9	Confident	54 Å²	54	29.9 Å²	29.9	25%	0.252	16%	0.164	S	C	.	.	H	α-helix	trans	-73.2	-46.3	170.4	-61.8	-49.1	-80.4	0	0	111.6	D554 Y605	D554-Q556 VanDerWaalsContact C-N 3.25Å; D554-Q556 PolarHBondContact O-N 3.22Å; D554-Q556 WeakPolarHBondContact OD1-CB 3.17Å; D554-Q556 PolarHBondContact OD1-N 3.37Å; D554-Q556 VanDerWaalsContact OD1-N 3.12Å; D554-Q556 VanDerWaalsContact OD2-CB 3.31Å; D554-Q556 WeakPolarHBondContact OD2-CB 3.29Å; D554-Q556 VanDerWaalsContact OD2-CG 3.29Å; D554-Q556 WeakPolarHBondContact OD2-CG 3.33Å; D554-Q556 PolarHBondContact OD2-N 3.47Å; Q556-Y605 VanDerWaalsContact NE2-CD2 3.3Å; Q556-Y605 VanDerWaalsContact NE2-CZ 3.31Å
557	L	83.4	Confident	83.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-76.4	-45.5	-177.5	-165.7	64.7	0	0	0	112.1	F530 L551 I552 D554 A559 W560 L561 P562	F530-L557 HydrophobicContact CB-CD1 4.11Å; F530-L557 HydrophobicContact CD2-CD1 4.14Å; L551-L557 HydrophobicContact CB-CD2 4.09Å; L551-L557 HydrophobicContact CD2-CD2 4.25Å; I552-L557 VanDerWaalsContact O-CD2 3.32Å; I552-L557 WeakPolarHBondContact O-CD2 3.48Å; D554-L557 PolarHBondContact O-N 2.77Å; D554-L557 PolarHBondContact OD1-N 3.02Å; L557-A559 VanDerWaalsContact C-N 3.26Å; L557-A559 PolarHBondContact O-N 2.89Å; L557-W560 PolarHBondContact O-N 2.86Å; L557-L561 HydrophobicContact CD1-CB 4.04Å; L557-L561 HydrophobicContact CD1-CD2 3.68Å; L557-L561 HydrophobicContact CD2-CD2 4.31Å; L557-L561 HydrophobicContact CG-CB 4.26Å; L557-L561 HydrophobicContact CG-CD2 4.03Å; L557-L561 WeakPolarHBondContact O-CB 3.23Å; L557-L561 PolarHBondContact O-N 3.29Å; L557-P562 WeakPolarHBondContact O-CD 3.41Å
558	A	79	Confident	82.5	Confident	3 Å²	3	39 Å²	39	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-22.2	-177.4	0	0	0	0	0	113.6	D554 W560 P562 L592 L597	D554-A558 WeakPolarHBondContact O-CB 3.49Å; D554-A558 PolarHBondContact O-N 2.73Å; A558-W560 VanDerWaalsContact C-N 3.26Å; A558-W560 PolarHBondContact O-N 2.93Å; A558-P562 VanDerWaalsContact O-CD 3.31Å; A558-P562 WeakPolarHBondContact O-CD 3.45Å; A558-P562 WeakPolarHBondContact O-CG 3.47Å; A558-L592 HydrophobicContact CB-CD1 4.18Å; A558-L597 HydrophobicContact CB-CD1 3.43Å; A558-L597 VanDerWaalsContact CB-CD1 3.43Å
559	A	76.4	Confident	81.5	Confident	51 Å²	51	40.4 Å²	40.4	42%	0.421	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-9.6	178.9	0	0	0	0	0	114.8	C555 L557	C555-A559 WeakPolarHBondContact O-CB 3.35Å; L557-A559 VanDerWaalsContact C-N 3.26Å; L557-A559 PolarHBondContact O-N 2.89Å
560	W	82.6	Confident	80	Confident	24 Å²	24	39.9 Å²	39.9	9%	0.091	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-147.5	-35.9	179.8	75.8	-87.5	0	0	0	115.6	F530 P531 R532 F535 L557 A558 V563 F564	F530-W560 HydrophobicContact CB-CH2 4.2Å; F530-W560 HydrophobicContact CB-CZ2 3.66Å; P531-W560 WeakPolarHBondContact O-CZ2 3.41Å; R532-W560 HydrophobicContact CG-CG 4.45Å; F535-W560 HydrophobicContact CB-CZ3 4.47Å; F535-W560 AromaticContact CD2-CH2 3.63Å; F535-W560 HydrophobicContact CD2-CH2 3.63Å; F535-W560 AromaticContact CD2-CZ3 3.7Å; F535-W560 HydrophobicContact CD2-CZ3 3.7Å; F535-W560 AromaticContact CE2-CH2 3.92Å; F535-W560 HydrophobicContact CE2-CH2 3.92Å; F535-W560 HydrophobicContact CE2-CZ3 4.34Å; F535-W560 HydrophobicContact CG-CH2 4.26Å; F535-W560 HydrophobicContact CG-CZ3 4.37Å; L557-W560 PolarHBondContact O-N 2.86Å; A558-W560 VanDerWaalsContact C-N 3.26Å; A558-W560 PolarHBondContact O-N 2.93Å; W560-V563 PolarHBondContact O-N 2.76Å; W560-F564 HydrophobicContact CE3-CB 4.21Å; W560-F564 HydrophobicContact CZ3-CB 4.35Å; W560-F564 HydrophobicContact CZ3-CG 4.4Å; W560-F564 PolarHBondContact O-N 2.94Å
561	L	86.9	Confident	78.1	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.3	-39.6	-176.2	-176.3	60.3	0	0	0	113.5	F530 F535 L546 L557 V563 F564 L565 V589	F530-L561 HydrophobicContact CD2-CD2 4.28Å; F535-L561 HydrophobicContact CD2-CD1 4.41Å; F535-L561 HydrophobicContact CE2-CD1 4.01Å; L546-L561 HydrophobicContact CD1-CD1 4.4Å; L546-L561 HydrophobicContact CD1-CD2 4.25Å; L557-L561 HydrophobicContact CD1-CB 4.04Å; L557-L561 HydrophobicContact CD1-CD2 3.68Å; L557-L561 HydrophobicContact CD2-CD2 4.31Å; L557-L561 HydrophobicContact CG-CB 4.26Å; L557-L561 HydrophobicContact CG-CD2 4.03Å; L557-L561 WeakPolarHBondContact O-CB 3.23Å; L557-L561 PolarHBondContact O-N 3.29Å; L561-V563 VanDerWaalsContact C-N 3.33Å; L561-V563 PolarHBondContact O-N 2.93Å; L561-F564 PolarHBondContact O-N 3.02Å; L561-L565 HydrophobicContact CD1-CD1 4.2Å; L561-L565 HydrophobicContact CD1-CG 4.09Å; L561-L565 HydrophobicContact CG-CD1 4.04Å; L561-L565 HydrophobicContact CG-CG 4.4Å; L561-L565 WeakPolarHBondContact O-CB 3.31Å; L561-L565 VanDerWaalsContact O-CG 3.3Å; L561-L565 WeakPolarHBondContact O-CG 3.45Å; L561-L565 PolarHBondContact O-N 3.29Å; L561-V589 HydrophobicContact CD2-CG1 4.15Å; L561-V589 HydrophobicContact CG-CG1 4.11Å
562	P	85.2	Confident	76.1	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-56.7	-46.6	172.2	-26.1	36.1	0	0	0	112	L557 A558 L565 I566 V589 L592	L557-P562 WeakPolarHBondContact O-CD 3.41Å; A558-P562 VanDerWaalsContact O-CD 3.31Å; A558-P562 WeakPolarHBondContact O-CD 3.45Å; A558-P562 WeakPolarHBondContact O-CG 3.47Å; P562-L565 PolarHBondContact O-N 3.48Å; P562-I566 VanDerWaalsContact O-CG1 3.31Å; P562-I566 WeakPolarHBondContact O-CG1 3.34Å; P562-I566 PolarHBondContact O-N 3.06Å; P562-V589 WeakPolarHBondContact CB-O 3.42Å; P562-V589 HydrophobicContact CG-CG1 4.08Å; P562-V589 VanDerWaalsContact CG-O 3.28Å; P562-V589 WeakPolarHBondContact CG-O 3.3Å; P562-L592 HydrophobicContact CB-CB 4.4Å; P562-L592 HydrophobicContact CG-CB 3.9Å; P562-L592 HydrophobicContact CG-CD1 4.2Å
563	V	81.3	Confident	74.2	Confident	64 Å²	64	43.9 Å²	43.9	39%	0.388	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-48.8	179.9	-176.3	0	0	0	0	110.6	W560 L561 L565 I566 E567	W560-V563 PolarHBondContact O-N 2.76Å; L561-V563 VanDerWaalsContact C-N 3.33Å; L561-V563 PolarHBondContact O-N 2.93Å; V563-L565 VanDerWaalsContact C-N 3.33Å; V563-L565 PolarHBondContact O-N 2.78Å; V563-I566 WeakPolarHBondContact O-CA 3.18Å; V563-I566 WeakPolarHBondContact O-CB 3.37Å; V563-I566 PolarHBondContact O-N 3.31Å; V563-E567 HydrophobicContact CG1-CG 4.11Å; V563-E567 WeakPolarHBondContact O-CG 3.47Å; V563-E567 PolarHBondContact O-N 3.21Å
564	F	83.6	Confident	72.7	Confident	20 Å²	20	50.1 Å²	50.1	9%	0.088	27%	0.271	C	S	.	.	H	α-helix	trans	-59	-40.8	177.4	-176.9	-87.3	0	0	0	112.7	F535 L541 L544 W560 L561 I566 K568	F535-F564 HydrophobicContact CB-CD2 4.35Å; F535-F564 HydrophobicContact CB-CE1 4.04Å; F535-F564 HydrophobicContact CB-CE2 3.64Å; F535-F564 HydrophobicContact CB-CZ 3.46Å; F535-F564 VanDerWaalsContact CB-CZ 3.46Å; F535-F564 HydrophobicContact CD2-CD1 4.1Å; F535-F564 AromaticContact CD2-CE1 3.85Å; F535-F564 HydrophobicContact CD2-CE1 3.85Å; F535-F564 HydrophobicContact CD2-CZ 4.17Å; F535-F564 HydrophobicContact CG-CE1 4.3Å; F535-F564 HydrophobicContact CG-CZ 4.19Å; L541-F564 HydrophobicContact CD2-CE1 4.06Å; L541-F564 HydrophobicContact CD2-CZ 3.99Å; L544-F564 HydrophobicContact CD2-CD1 4.28Å; L544-F564 HydrophobicContact CD2-CE1 3.8Å; W560-F564 HydrophobicContact CE3-CB 4.21Å; W560-F564 HydrophobicContact CZ3-CB 4.35Å; W560-F564 HydrophobicContact CZ3-CG 4.4Å; W560-F564 PolarHBondContact O-N 2.94Å; L561-F564 PolarHBondContact O-N 3.02Å; F564-I566 VanDerWaalsContact C-N 3.29Å; F564-I566 PolarHBondContact O-N 2.77Å; F564-K568 HydrophobicContact CD1-CG 4.43Å; F564-K568 HydrophobicContact CD2-CG 4.31Å; F564-K568 HydrophobicContact CE1-CG 4.1Å; F564-K568 HydrophobicContact CE2-CG 4Å; F564-K568 HydrophobicContact CZ-CG 3.88Å; F564-K568 WeakPolarHBondContact O-CB 3.25Å; F564-K568 PolarHBondContact O-N 2.97Å
565	L	82.2	Confident	72	Confident	11 Å²	11	55.2 Å²	55.2	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-70	-23.7	176.5	-69.9	172.1	0	0	0	113.3	L544 L561 P562 V563 V576 V589 R590	L544-L565 HydrophobicContact CD2-CD2 4.12Å; L561-L565 HydrophobicContact CD1-CD1 4.2Å; L561-L565 HydrophobicContact CD1-CG 4.09Å; L561-L565 HydrophobicContact CG-CD1 4.04Å; L561-L565 HydrophobicContact CG-CG 4.4Å; L561-L565 WeakPolarHBondContact O-CB 3.31Å; L561-L565 VanDerWaalsContact O-CG 3.3Å; L561-L565 WeakPolarHBondContact O-CG 3.45Å; L561-L565 PolarHBondContact O-N 3.29Å; P562-L565 PolarHBondContact O-N 3.48Å; V563-L565 VanDerWaalsContact C-N 3.33Å; V563-L565 PolarHBondContact O-N 2.78Å; L565-V576 HydrophobicContact CD1-CG1 4.41Å; L565-V589 HydrophobicContact CD1-CB 4.3Å; L565-V589 HydrophobicContact CD1-CG1 4.06Å; L565-R590 HydrophobicContact CB-CG 4.43Å; L565-R590 PolarHBondContact O-NE 3.17Å
566	I	79.3	Confident	72.3	Confident	87 Å²	87	54.8 Å²	54.8	45%	0.446	29%	0.285	S	S	.	.	H	α-helix	trans	-77.8	-56.6	170.5	-65.8	163.6	0	0	0	109.9	P562 V563 F564 K568 E569 R590	P562-I566 VanDerWaalsContact O-CG1 3.31Å; P562-I566 WeakPolarHBondContact O-CG1 3.34Å; P562-I566 PolarHBondContact O-N 3.06Å; V563-I566 WeakPolarHBondContact O-CA 3.18Å; V563-I566 WeakPolarHBondContact O-CB 3.37Å; V563-I566 PolarHBondContact O-N 3.31Å; F564-I566 VanDerWaalsContact C-N 3.29Å; F564-I566 PolarHBondContact O-N 2.77Å; I566-K568 PolarHBondContact O-N 3.02Å; I566-E569 PolarHBondContact O-N 2.85Å; I566-E569 VanDerWaalsContact O-N 3.17Å; I566-R590 HydrophobicContact CG1-CG 3.65Å
567	E	77.3	Confident	72.9	Confident	146 Å²	146	59 Å²	59	68%	0.682	30%	0.298	S	S	*	.	H	α-helix	trans	-61.4	-35.7	-173.6	-73.1	-177.5	167.1	0	0	114.3	V563	V563-E567 HydrophobicContact CG1-CG 4.11Å; V563-E567 WeakPolarHBondContact O-CG 3.47Å; V563-E567 PolarHBondContact O-N 3.21Å
568	K	71.1	Confident	73.2	Confident	73 Å²	73	59.2 Å²	59.2	32%	0.317	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-7	179.4	-66	-64.5	-173.5	-178.5	0	113.9	R539 F564 I566 A570	R539-K568 PolarHBondContact O-NZ 2.92Å; F564-K568 HydrophobicContact CD1-CG 4.43Å; F564-K568 HydrophobicContact CD2-CG 4.31Å; F564-K568 HydrophobicContact CE1-CG 4.1Å; F564-K568 HydrophobicContact CE2-CG 4Å; F564-K568 HydrophobicContact CZ-CG 3.88Å; F564-K568 WeakPolarHBondContact O-CB 3.25Å; F564-K568 PolarHBondContact O-N 2.97Å; I566-K568 PolarHBondContact O-N 3.02Å; K568-A570 HydrophobicContact CB-CB 3.96Å; K568-A570 PolarHBondContact O-N 2.88Å
569	E	67.1	Low	73.7	Confident	154 Å²	154	60.4 Å²	60.4	72%	0.72	31%	0.31	S	S	*	.			trans	51.9	6.2	-168.5	-55.8	-166.4	125.8	0	0	115.7	I566 G571	I566-E569 PolarHBondContact O-N 2.85Å; I566-E569 VanDerWaalsContact O-N 3.17Å; E569-G571 PolarHBondContact O-N 2.95Å
570	A	57	Low	73.9	Confident	2 Å²	2	63.1 Å²	63.1	2%	0.017	31%	0.314	C	S	.	.			trans	-72.3	7	-156.3	0	0	0	0	0	116.4	K542 L544 K568 G572	K542-A570 WeakPolarHBondContact O-CA 3.37Å; L544-A570 HydrophobicContact CB-CB 4.07Å; L544-A570 PolarHBondContact N-O 3.26Å; K568-A570 HydrophobicContact CB-CB 3.96Å; K568-A570 PolarHBondContact O-N 2.88Å; A570-G572 PolarHBondContact O-N 2.64Å; A570-G572 VanDerWaalsContact O-N 3.13Å
571	G	51.1	Low	73.8	Confident	21 Å²	21	64.2 Å²	64.2	22%	0.216	32%	0.324	C	S	.	.			trans	-82.3	75.8	179.1	0	0	0	0	0	112.8	E569 T573	E569-G571 PolarHBondContact O-N 2.95Å; G571-T573 PolarHBondContact O-N 3.04Å; G571-T573 VanDerWaalsContact O-N 3.08Å
572	G	48.6	Very low	73.4	Confident	18 Å²	18	71.2 Å²	71.2	19%	0.186	36%	0.36	C	S	.	.			trans	-63.9	104.1	179.1	0	0	0	0	0	113.6	A570 Q574	A570-G572 PolarHBondContact O-N 2.64Å; A570-G572 VanDerWaalsContact O-N 3.13Å; G572-Q574 PolarHBondContact O-N 2.89Å
573	T	47.2	Very low	73.2	Confident	136 Å²	136	75.6 Å²	75.6	83%	0.834	38%	0.384	S	S	*	.	S	Bend	trans	52.5	-14.2	166.3	61	0	0	0	0	120.4	G571	G571-T573 PolarHBondContact O-N 3.04Å; G571-T573 VanDerWaalsContact O-N 3.08Å
574	Q	54.4	Low	73.3	Confident	130 Å²	130	72.6 Å²	72.6	61%	0.607	37%	0.365	S	S	*	.	S	Bend	trans	-129	100	173.3	-67.6	-172.1	-7.5	0	0	109.9	V547 G572	V547-Q574 HydrophobicContact CG2-CB 3.83Å; V547-Q574 VanDerWaalsContact CG2-O 3.29Å; V547-Q574 WeakPolarHBondContact CG2-O 3.32Å; G572-Q574 PolarHBondContact O-N 2.89Å
575	W	66.4	Low	73.3	Confident	141 Å²	141	76.6 Å²	76.6	53%	0.534	38%	0.384	S	S	.	.			trans	-74.2	127.2	-175.3	-52	-48.5	0	0	0	111.6	H588	W575-H588 HydrophobicContact CB-CB 4.38Å; W575-H588 VanDerWaalsContact CB-ND1 3.26Å; W575-H588 WeakPolarHBondContact CB-ND1 3.19Å; W575-H588 AromaticContact CE3-CE1 3.95Å; W575-H588 AromaticContact CE3-NE2 3.8Å; W575-H588 PolarHBondContact O-CE1 2.9Å; W575-H588 PolarHBondContact O-ND1 3.34Å; W575-H588 VanDerWaalsContact O-ND1 3.16Å
576	V	83.7	Confident	73.5	Confident	13 Å²	13	77.8 Å²	77.8	8%	0.079	40%	0.4	C	S	.	.			trans	-65.2	148.6	176.1	76.6	0	0	0	0	111.3	L546 L551 L565 H588 V589	L546-V576 HydrophobicContact CB-CB 4Å; L546-V576 HydrophobicContact CB-CG1 4.25Å; L546-V576 HydrophobicContact CB-CG2 3.85Å; L546-V576 HydrophobicContact CD1-CG1 4.42Å; L546-V576 WeakPolarHBondContact O-CG2 3.46Å; L551-V576 HydrophobicContact CD1-CG1 4.17Å; L551-V576 HydrophobicContact CD1-CG2 3.64Å; L565-V576 HydrophobicContact CD1-CG1 4.41Å; V576-H588 WeakPolarHBondContact O-CA 3.44Å; V576-H588 PolarHBondContact O-ND1 3.24Å; V576-V589 HydrophobicContact CG1-CB 3.89Å; V576-V589 HydrophobicContact CG1-CG2 3.73Å; V576-V589 PolarHBondContact O-N 2.91Å; V576-V589 VanDerWaalsContact O-N 3.11Å
577	R	88	Confident	73.8	Confident	142 Å²	142	78.5 Å²	78.5	54%	0.536	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-120.8	153	-177.9	-72.1	179.2	166.8	169.6	4.2	111.4	G586 H587 H588	R577-G586 WeakPolarHBondContact CD-O 3.46Å; R577-G586 WeakPolarHBondContact CG-O 3.2Å; R577-G586 PolarHBondContact NE-O 3.48Å; R577-H587 CarbonylContact C-O 3.52Å; R577-H587 WeakPolarHBondContact CA-O 3.26Å; R577-H588 VanDerWaalsContact CG-CE1 3.49Å; R577-H588 WeakPolarHBondContact CG-CE1 3.38Å; R577-H588 VanDerWaalsContact CG-ND1 3.33Å; R577-H588 WeakPolarHBondContact CG-ND1 3.48Å; R577-H588 PolarHBondContact NE-CE1 3.29Å; R577-H588 PolarHBondContact NE-NE2 3.15Å; R577-H588 VanDerWaalsContact NE-NE2 3.13Å; R577-H588 PolarHBondContact NH2-NE2 2.82Å
578	C	88.9	Confident	74.2	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.034	37%	0.374	C	S	.	.			trans	-71	138.5	170.2	-56.5	0	0	0	0	111	C553 V584 G586 H587	C553-C578 HydrophobicContact CB-CB 3.73Å; C553-C578 WeakPolarHBondContact CB-SG 3.33Å; C553-C578 VanDerWaalsContact SG-CA 3.51Å; C553-C578 WeakPolarHBondContact SG-CB 3.2Å; C553-C578 CovalentContact SG-SG 2.03Å; C553-C578 PolarHBondContact SG-SG 3.34Å; C578-V584 HydrophobicContact CB-CG2 4.23Å; C578-V584 WeakPolarHBondContact CB-O 3.44Å; C578-G586 PolarHBondContact O-N 2.81Å; C578-H587 PolarHBondContact N-O 3.31Å
579	A	89	Confident	74.8	Confident	28 Å²	28	69.2 Å²	69.2	23%	0.231	36%	0.359	C	S	.	.			trans	-90.3	-35.1	166.2	0	0	0	0	0	111.3	P550 L551 Q585	P550-A579 HydrophobicContact CB-CB 4.27Å; L551-A579 PolarHBondContact O-N 2.72Å; A579-Q585 VanDerWaalsContact O-CG 3.25Å; A579-Q585 WeakPolarHBondContact O-CG 3.46Å; A579-Q585 PolarHBondContact O-NE2 2.03Å
580	E	81.7	Confident	75.5	Confident	108 Å²	108	66.2 Å²	66.2	51%	0.505	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-144.5	168.4	-179.6	-73.1	-175.6	-162.8	0	0	109.9	L551 I552 C553	L551-E580 PolarHBondContact O-N 2.81Å; I552-E580 HydrophobicContact CB-CB 4.49Å; I552-E580 HydrophobicContact CG1-CB 4.3Å; I552-E580 HydrophobicContact CG2-CB 4.21Å; C553-E580 WeakPolarHBondContact CB-O 3.5Å; C553-E580 PolarHBondContact N-O 3.28Å
581	P	79.6	Confident	76.7	Confident	46 Å²	46	71.8 Å²	71.8	30%	0.299	37%	0.366	S	S	.	.	S	Bend	cis	-66	168.2	-17.6	21.9	-28.3	0	0	0	113.3	N583 V584 Q585 L597	P581-N583 WeakPolarHBondContact CB-OD1 3.47Å; P581-N583 VanDerWaalsContact CG-OD1 3.31Å; P581-N583 WeakPolarHBondContact CG-OD1 3.37Å; P581-N583 PolarHBondContact O-N 3.19Å; P581-N583 VanDerWaalsContact O-N 3.09Å; P581-V584 HydrophobicContact CG-CG2 3.98Å; P581-V584 CarbonylContact O-C 3.02Å; P581-V584 WeakPolarHBondContact O-CG2 3.44Å; P581-V584 PolarHBondContact O-N 3.05Å; P581-Q585 PolarHBondContact O-N 3.17Å; P581-L597 HydrophobicContact CG-CD2 4.36Å
582	L	77.8	Confident	78	Confident	147 Å²	147	71.4 Å²	71.4	77%	0.77	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.2	-167.8	-151.5	89.3	0	0	0	114.6
583	N	81.4	Confident	78.9	Confident	95 Å²	95	75.7 Å²	75.7	51%	0.508	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-27.8	176.5	61.2	-37	0	0	0	113.6	P581	P581-N583 WeakPolarHBondContact CB-OD1 3.47Å; P581-N583 VanDerWaalsContact CG-OD1 3.31Å; P581-N583 WeakPolarHBondContact CG-OD1 3.37Å; P581-N583 PolarHBondContact O-N 3.19Å; P581-N583 VanDerWaalsContact O-N 3.09Å
584	V	82.9	Confident	79.4	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-3.6	178.1	-63.9	0	0	0	0	113	C553 C578 P581 G586 H587 L592 I596 L597	C553-V584 HydrophobicContact CB-CG2 3.84Å; C578-V584 HydrophobicContact CB-CG2 4.23Å; C578-V584 WeakPolarHBondContact CB-O 3.44Å; P581-V584 HydrophobicContact CG-CG2 3.98Å; P581-V584 CarbonylContact O-C 3.02Å; P581-V584 WeakPolarHBondContact O-CG2 3.44Å; P581-V584 PolarHBondContact O-N 3.05Å; V584-G586 PolarHBondContact O-N 3.2Å; V584-H587 WeakPolarHBondContact O-CB 3.35Å; V584-H587 PolarHBondContact O-N 3.29Å; V584-H587 PolarHBondContact O-ND1 3.11Å; V584-H587 VanDerWaalsContact O-ND1 3.09Å; V584-L592 HydrophobicContact CB-CD2 4.16Å; V584-L592 HydrophobicContact CG1-CD2 3.98Å; V584-I596 HydrophobicContact CG1-CG2 4.16Å; V584-L597 HydrophobicContact CG1-CD2 4.02Å; V584-L597 HydrophobicContact CG1-CG 4.45Å; V584-L597 HydrophobicContact CG2-CD2 4.47Å
585	Q	85.2	Confident	79.7	Confident	104 Å²	104	73.8 Å²	73.8	49%	0.486	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	132.4	174.8	-179.2	169.7	64.1	0	0	111.3	A579 P581 H587	A579-Q585 VanDerWaalsContact O-CG 3.25Å; A579-Q585 WeakPolarHBondContact O-CG 3.46Å; A579-Q585 PolarHBondContact O-NE2 2.03Å; P581-Q585 PolarHBondContact O-N 3.17Å; Q585-H587 PolarHBondContact O-N 2.76Å; Q585-H587 PolarHBondContact O-ND1 2.04Å
586	G	85	Confident	79.3	Confident	37 Å²	37	71.6 Å²	71.6	38%	0.381	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-13.8	-176.6	0	0	0	0	0	116.3	R577 C578 V584	R577-G586 WeakPolarHBondContact CD-O 3.46Å; R577-G586 WeakPolarHBondContact CG-O 3.2Å; R577-G586 PolarHBondContact NE-O 3.48Å; C578-G586 PolarHBondContact O-N 2.81Å; V584-G586 PolarHBondContact O-N 3.2Å
587	H	85.5	Confident	78.3	Confident	102 Å²	102	72.2 Å²	72.2	47%	0.472	37%	0.365	S	S	.	.			trans	-71.6	150.7	176.4	-65.4	67.3	0	0	0	111.1	R577 C578 V584 Q585	R577-H587 CarbonylContact C-O 3.52Å; R577-H587 WeakPolarHBondContact CA-O 3.26Å; C578-H587 PolarHBondContact N-O 3.31Å; V584-H587 WeakPolarHBondContact O-CB 3.35Å; V584-H587 PolarHBondContact O-N 3.29Å; V584-H587 PolarHBondContact O-ND1 3.11Å; V584-H587 VanDerWaalsContact O-ND1 3.09Å; Q585-H587 PolarHBondContact O-N 2.76Å; Q585-H587 PolarHBondContact O-ND1 2.04Å
588	H	85.9	Confident	76.9	Confident	23 Å²	23	72.6 Å²	72.6	11%	0.106	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-79	131.5	178.1	-71	-65.6	0	0	0	111.2	W575 V576 R577 R590 E591	W575-H588 HydrophobicContact CB-CB 4.38Å; W575-H588 VanDerWaalsContact CB-ND1 3.26Å; W575-H588 WeakPolarHBondContact CB-ND1 3.19Å; W575-H588 AromaticContact CE3-CE1 3.95Å; W575-H588 AromaticContact CE3-NE2 3.8Å; W575-H588 PolarHBondContact O-CE1 2.9Å; W575-H588 PolarHBondContact O-ND1 3.34Å; W575-H588 VanDerWaalsContact O-ND1 3.16Å; V576-H588 WeakPolarHBondContact O-CA 3.44Å; V576-H588 PolarHBondContact O-ND1 3.24Å; R577-H588 VanDerWaalsContact CG-CE1 3.49Å; R577-H588 WeakPolarHBondContact CG-CE1 3.38Å; R577-H588 VanDerWaalsContact CG-ND1 3.33Å; R577-H588 WeakPolarHBondContact CG-ND1 3.48Å; R577-H588 PolarHBondContact NE-CE1 3.29Å; R577-H588 PolarHBondContact NE-NE2 3.15Å; R577-H588 VanDerWaalsContact NE-NE2 3.13Å; R577-H588 PolarHBondContact NH2-NE2 2.82Å; H588-R590 PolarHBondContact O-N 3.26Å; H588-R590 VanDerWaalsContact O-N 3.13Å; H588-E591 HydrophobicContact CB-CG 4.2Å; H588-E591 IonicContact CD2-OE2 2.69Å; H588-E591 WeakPolarHBondContact O-CB 3.41Å; H588-E591 PolarHBondContact O-N 3.12Å
589	V	85	Confident	75.6	Confident	1 Å²	1	74 Å²	74	1%	0.006	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-60	-31.5	-174.1	178.2	0	0	0	0	112.1	L551 L561 P562 L565 V576 E591 L592	L551-V589 HydrophobicContact CD1-CG2 4.37Å; L561-V589 HydrophobicContact CD2-CG1 4.15Å; L561-V589 HydrophobicContact CG-CG1 4.11Å; P562-V589 WeakPolarHBondContact CB-O 3.42Å; P562-V589 HydrophobicContact CG-CG1 4.08Å; P562-V589 VanDerWaalsContact CG-O 3.28Å; P562-V589 WeakPolarHBondContact CG-O 3.3Å; L565-V589 HydrophobicContact CD1-CB 4.3Å; L565-V589 HydrophobicContact CD1-CG1 4.06Å; V576-V589 HydrophobicContact CG1-CB 3.89Å; V576-V589 HydrophobicContact CG1-CG2 3.73Å; V576-V589 PolarHBondContact O-N 2.91Å; V576-V589 VanDerWaalsContact O-N 3.11Å; V589-E591 PolarHBondContact O-N 3.35Å; V589-L592 HydrophobicContact CG1-CD1 4.29Å; V589-L592 PolarHBondContact O-N 2.85Å
590	R	80.9	Confident	73.9	Confident	90 Å²	90	76 Å²	76	34%	0.34	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-65.6	-20.7	176.2	-161.2	-177.8	-174	177.7	4.4	113.6	L565 I566 H588	L565-R590 HydrophobicContact CB-CG 4.43Å; L565-R590 PolarHBondContact O-NE 3.17Å; I566-R590 HydrophobicContact CG1-CG 3.65Å; H588-R590 PolarHBondContact O-N 3.26Å; H588-R590 VanDerWaalsContact O-N 3.13Å
591	E	81.6	Confident	72.6	Confident	119 Å²	119	77.1 Å²	77.1	56%	0.556	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-98.2	-2.4	-175.4	-62.7	169.3	174.9	0	0	112.4	H588 V589 L593	H588-E591 HydrophobicContact CB-CG 4.2Å; H588-E591 IonicContact CD2-OE2 2.69Å; H588-E591 WeakPolarHBondContact O-CB 3.41Å; H588-E591 PolarHBondContact O-N 3.12Å; V589-E591 PolarHBondContact O-N 3.35Å; E591-L593 PolarHBondContact O-N 2.59Å; E591-L593 VanDerWaalsContact O-N 3.1Å
592	L	78.4	Confident	70.9	Confident	13 Å²	13	82.6 Å²	82.6	7%	0.068	44%	0.444	C	S	.	.			trans	-69.8	104.8	177.3	-65.5	176.1	0	0	0	111.4	C553 A558 P562 V584 V589	C553-L592 HydrophobicContact CB-CD1 3.87Å; A558-L592 HydrophobicContact CB-CD1 4.18Å; P562-L592 HydrophobicContact CB-CB 4.4Å; P562-L592 HydrophobicContact CG-CB 3.9Å; P562-L592 HydrophobicContact CG-CD1 4.2Å; V584-L592 HydrophobicContact CB-CD2 4.16Å; V584-L592 HydrophobicContact CG1-CD2 3.98Å; V589-L592 HydrophobicContact CG1-CD1 4.29Å; V589-L592 PolarHBondContact O-N 2.85Å
593	L	68.8	Low	69	Low	108 Å²	108	79.9 Å²	79.9	57%	0.565	43%	0.429	S	S	*	.			trans	-74.3	131.2	163.9	-72.2	160.3	0	0	0	109.4	E591 H595 I596	E591-L593 PolarHBondContact O-N 2.59Å; E591-L593 VanDerWaalsContact O-N 3.1Å; L593-H595 PolarHBondContact O-N 3.23Å; L593-I596 HydrophobicContact CB-CD1 3.94Å; L593-I596 HydrophobicContact CB-CG1 4.12Å; L593-I596 HydrophobicContact CD1-CD1 4.42Å; L593-I596 WeakPolarHBondContact O-CB 3.49Å; L593-I596 PolarHBondContact O-N 2.89Å
594	P	57.6	Low	67	Low	65 Å²	65	83 Å²	83	42%	0.422	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-54.9	-25.8	-179.9	-29.3	36.1	0	0	0	114.8	I596	P594-I596 VanDerWaalsContact C-N 3.29Å; P594-I596 PolarHBondContact O-N 3.35Å
595	H	59.5	Low	65.2	Low	162 Å²	162	87.6 Å²	87.6	75%	0.75	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-69.7	-18	177.3	-54.1	-63.5	0	0	0	114.4	L593 L597	L593-H595 PolarHBondContact O-N 3.23Å; H595-L597 VanDerWaalsContact C-N 3.26Å; H595-L597 PolarHBondContact O-N 3.36Å
596	I	59.1	Low	62.9	Low	94 Å²	94	90.2 Å²	90.2	48%	0.482	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-74	-18.8	-178.4	-68.6	173	0	0	0	112.2	V584 L593 P594	V584-I596 HydrophobicContact CG1-CG2 4.16Å; L593-I596 HydrophobicContact CB-CD1 3.94Å; L593-I596 HydrophobicContact CB-CG1 4.12Å; L593-I596 HydrophobicContact CD1-CD1 4.42Å; L593-I596 WeakPolarHBondContact O-CB 3.49Å; L593-I596 PolarHBondContact O-N 2.89Å; P594-I596 VanDerWaalsContact C-N 3.29Å; P594-I596 PolarHBondContact O-N 3.35Å
597	L	61.9	Low	60.9	Low	27 Å²	27	96 Å²	96	14%	0.141	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-110.4	9	-174.5	-72.8	162.3	0	0	0	113.6	C553 A558 P581 V584 H595 C599	C553-L597 WeakPolarHBondContact O-CD1 3.34Å; A558-L597 HydrophobicContact CB-CD1 3.43Å; A558-L597 VanDerWaalsContact CB-CD1 3.43Å; P581-L597 HydrophobicContact CG-CD2 4.36Å; V584-L597 HydrophobicContact CG1-CD2 4.02Å; V584-L597 HydrophobicContact CG1-CG 4.45Å; V584-L597 HydrophobicContact CG2-CD2 4.47Å; H595-L597 VanDerWaalsContact C-N 3.26Å; H595-L597 PolarHBondContact O-N 3.36Å; L597-C599 VanDerWaalsContact CB-SG 3.53Å; L597-C599 PolarHBondContact O-N 2.84Å
598	D	58.9	Low	58.6	Low	149 Å²	149	97 Å²	97	80%	0.797	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	29.7	-178.5	-91.6	-33	0	0	0	114.6	P600	D598-P600 WeakPolarHBondContact O-CD 2.99Å; D598-P600 VanDerWaalsContact O-N 3.13Å
599	C	61.2	Low	56.2	Low	36 Å²	36	102.8 Å²	102.8	24%	0.243	53%	0.528	C	S	.	.			trans	-61.8	111.8	-173.3	-61.4	0	0	0	0	112.3	C555 L597 S601	C555-C599 VanDerWaalsContact CA-SG 3.54Å; C555-C599 HydrophobicContact CB-CB 3.86Å; C555-C599 WeakPolarHBondContact CB-SG 3.27Å; C555-C599 WeakPolarHBondContact SG-CA 3.11Å; C555-C599 WeakPolarHBondContact SG-CB 3.24Å; C555-C599 CovalentContact SG-SG 2.04Å; C555-C599 PolarHBondContact SG-SG 2.7Å; L597-C599 VanDerWaalsContact CB-SG 3.53Å; L597-C599 PolarHBondContact O-N 2.84Å; C599-S601 PolarHBondContact O-N 3.21Å
600	P	54.5	Low	54.1	Low	70 Å²	70	108.8 Å²	108.8	46%	0.455	56%	0.555	S	S	.	*			trans	-73.6	126.4	-172.8	-20.1	35.1	0	0	0	111.8	D598 N602 I603	D598-P600 WeakPolarHBondContact O-CD 2.99Å; D598-P600 VanDerWaalsContact O-N 3.13Å; P600-N602 PolarHBondContact O-N 2.97Å; P600-I603 HydrophobicContact CB-CD1 3.89Å; P600-I603 HydrophobicContact CB-CG1 4.1Å; P600-I603 HydrophobicContact CG-CD1 3.73Å; P600-I603 HydrophobicContact CG-CG1 4.49Å; P600-I603 PolarHBondContact O-N 3.28Å
601	S	53.3	Low	52.3	Low	131 Å²	131	107.4 Å²	107.4	92%	0.916	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-2.1	-168.9	-37.4	0	0	0	0	116.8	C599	C599-S601 PolarHBondContact O-N 3.21Å
602	N	43.6	Very low	50.7	Low	160 Å²	160	103.3 Å²	103.3	86%	0.856	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144	14.9	-166.2	-121.5	-6.4	0	0	0	114.5	P600 N604	P600-N602 PolarHBondContact O-N 2.97Å; N602-N604 PolarHBondContact O-N 2.95Å
603	I	39.1	Very low	48.8	Very low	90 Å²	90	108.1 Å²	108.1	46%	0.462	57%	0.566	S	S	.	*			trans	-77.2	116.8	172.5	-72.2	176.4	0	0	0	109.4	P600 Y605	P600-I603 HydrophobicContact CB-CD1 3.89Å; P600-I603 HydrophobicContact CB-CG1 4.1Å; P600-I603 HydrophobicContact CG-CD1 3.73Å; P600-I603 HydrophobicContact CG-CG1 4.49Å; P600-I603 PolarHBondContact O-N 3.28Å; I603-Y605 VanDerWaalsContact C-N 3.28Å; I603-Y605 HydrophobicContact CB-CE2 4.2Å; I603-Y605 HydrophobicContact CG2-CD1 4.07Å; I603-Y605 HydrophobicContact CG2-CD2 4.15Å; I603-Y605 HydrophobicContact CG2-CE1 4.12Å; I603-Y605 HydrophobicContact CG2-CE2 4.2Å; I603-Y605 HydrophobicContact CG2-CG 4.09Å; I603-Y605 VanDerWaalsContact O-CD2 3.23Å; I603-Y605 WeakPolarHBondContact O-CD2 3.29Å; I603-Y605 PolarHBondContact O-N 2.95Å
604	N	39.8	Very low	47.2	Very low	160 Å²	160	111.7 Å²	111.7	86%	0.856	58%	0.577	S	S	*	*			trans	-65.1	92.5	157.6	-93.5	-18.5	0	0	0	108	N602 K606	N602-N604 PolarHBondContact O-N 2.95Å; N604-K606 PolarHBondContact O-N 2.87Å
605	Y	44.4	Very low	45.9	Very low	99 Å²	99	116.4 Å²	116.4	39%	0.388	59%	0.593	S	S	.	*			trans	-62.1	108.3	169.8	-67.8	-84.6	0	0	0	108.2	C555 Q556 I603 E607	C555-Y605 WeakPolarHBondContact CB-OH 3.43Å; Q556-Y605 VanDerWaalsContact NE2-CD2 3.3Å; Q556-Y605 VanDerWaalsContact NE2-CZ 3.31Å; I603-Y605 VanDerWaalsContact C-N 3.28Å; I603-Y605 HydrophobicContact CB-CE2 4.2Å; I603-Y605 HydrophobicContact CG2-CD1 4.07Å; I603-Y605 HydrophobicContact CG2-CD2 4.15Å; I603-Y605 HydrophobicContact CG2-CE1 4.12Å; I603-Y605 HydrophobicContact CG2-CE2 4.2Å; I603-Y605 HydrophobicContact CG2-CG 4.09Å; I603-Y605 VanDerWaalsContact O-CD2 3.23Å; I603-Y605 WeakPolarHBondContact O-CD2 3.29Å; I603-Y605 PolarHBondContact O-N 2.95Å; Y605-E607 PolarHBondContact O-N 3.01Å
606	K	37.3	Very low	44.9	Very low	158 Å²	158	111.4 Å²	111.4	69%	0.687	57%	0.572	S	S	*	*			trans	-57.9	129.5	168	-69.8	170.6	136.3	-126.7	0	107.8	N604 E608	N604-K606 PolarHBondContact O-N 2.87Å; K606-E608 HydrophobicContact CB-CG 4.27Å; K606-E608 WeakPolarHBondContact CD-OE2 3.01Å; K606-E608 IonicContact NZ-OE2 3.88Å; K606-E608 PolarHBondContact NZ-OE2 3.3Å; K606-E608 PolarHBondContact O-N 3.09Å
607	E	43.2	Very low	44.3	Very low	160 Å²	160	109.5 Å²	109.5	75%	0.748	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	3.4	-177.4	-61.6	-179	123	0	0	113.5	R508 Y605 N609	R508-E607 IonicContact NH1-OE1 3.72Å; Y605-E607 PolarHBondContact O-N 3.01Å; E607-N609 PolarHBondContact O-N 2.87Å
608	E	36.8	Very low	43.7	Very low	121 Å²	121	113.4 Å²	113.4	57%	0.565	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-6.7	-164	-59.3	177.8	130.4	0	0	115.9	K606	K606-E608 HydrophobicContact CB-CG 4.27Å; K606-E608 WeakPolarHBondContact CD-OE2 3.01Å; K606-E608 IonicContact NZ-OE2 3.88Å; K606-E608 PolarHBondContact NZ-OE2 3.3Å; K606-E608 PolarHBondContact O-N 3.09Å
609	N	35	Very low	43.8	Very low	146 Å²	146	107.6 Å²	107.6	78%	0.781	55%	0.547	S	S	*	.	S	Bend	trans	-117.8	-22.4	-168	-107.6	37.2	0	0	0	117	E607	E607-N609 PolarHBondContact O-N 2.87Å
610	H	40.5	Very low	44.2	Very low	127 Å²	127	106.2 Å²	106.2	59%	0.588	54%	0.538	S	S	*	.	S	Bend	trans	-129.5	31.1	178.2	-70.4	-15.3	0	0	0	112.1
611	S	43.4	Very low	44.8	Very low	60 Å²	60	110.5 Å²	110.5	42%	0.42	56%	0.557	S	S	.	*	S	Bend	trans	-64.4	157	161.6	143	0	0	0	0	110.3	E613	S611-E613 WeakPolarHBondContact CB-OE1 3.39Å; S611-E613 PolarHBondContact O-N 3.02Å; S611-E613 PolarHBondContact OG-OE1 3.02Å
612	C	48.1	Very low	45.5	Very low	34 Å²	34	107.2 Å²	107.2	23%	0.23	54%	0.544	C	S	.	.			trans	-74.8	55.1	173.8	-80.7	0	0	0	0	111.8	C505	C505-C612 HydrophobicContact CB-CB 3.97Å; C505-C612 WeakPolarHBondContact CB-SG 3.34Å; C505-C612 WeakPolarHBondContact SG-CB 3.39Å; C505-C612 CovalentContact SG-SG 2.03Å; C505-C612 PolarHBondContact SG-SG 2.93Å
613	E	38.1	Very low	47.2	Very low	113 Å²	113	100.4 Å²	100.4	53%	0.528	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	140.1	-165.9	-127.7	152.9	-86	0	0	112.5	S611	S611-E613 WeakPolarHBondContact CB-OE1 3.39Å; S611-E613 PolarHBondContact O-N 3.02Å; S611-E613 PolarHBondContact OG-OE1 3.02Å
614	F	35.4	Very low	48.9	Very low	183 Å²	183	105.2 Å²	105.2	80%	0.803	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	1.8	169.7	-64.1	-80.6	0	0	0	122.5
615	H	30.3	Very low	50.5	Low	164 Å²	164	99.3 Å²	99.3	76%	0.759	49%	0.491	S	S	*	.			trans	-133.7	18.7	177.8	-77.4	-62.1	0	0	0	117.2	Y617	H615-Y617 PolarHBondContact O-N 2.84Å; H615-Y617 VanDerWaalsContact O-N 3.12Å
616	D	38.2	Very low	51.6	Low	57 Å²	57	101.6 Å²	101.6	31%	0.305	50%	0.503	S	S	.	.			trans	-74.9	-8.6	-154.8	-122.7	8.5	0	0	0	118.5	H507	H507-D616 IonicContact CD2-OD1 3.4Å; H507-D616 IonicContact CE1-OD1 3.47Å; H507-D616 IonicContact CE1-OD2 2.65Å; H507-D616 PolarHBondContact CE1-OD2 2.79Å; H507-D616 IonicContact NE2-OD1 2.67Å; H507-D616 PolarHBondContact NE2-OD1 3.04Å; H507-D616 IonicContact NE2-OD2 3.94Å; H507-D616 PolarHBondContact NE2-OD2 3.39Å
617	Y	47.6	Very low	52.5	Low	55 Å²	55	97.4 Å²	97.4	22%	0.216	49%	0.488	C	S	.	.	S	Bend	trans	-140.8	133.2	170.4	-61.1	-87.3	0	0	0	110.2	H615 C619 L654 N673	H615-Y617 PolarHBondContact O-N 2.84Å; H615-Y617 VanDerWaalsContact O-N 3.12Å; Y617-C619 VanDerWaalsContact C-N 3.29Å; Y617-C619 PolarHBondContact O-N 2.87Å; Y617-L654 HydrophobicContact CD1-CD1 3.72Å; Y617-L654 HydrophobicContact CD2-CD1 3.87Å; Y617-L654 HydrophobicContact CD2-CD2 3.7Å; Y617-L654 HydrophobicContact CD2-CG 4.27Å; Y617-L654 HydrophobicContact CE1-CD1 3.88Å; Y617-L654 HydrophobicContact CE2-CD1 4.02Å; Y617-L654 HydrophobicContact CE2-CD2 3.8Å; Y617-L654 HydrophobicContact CE2-CG 4.16Å; Y617-L654 HydrophobicContact CG-CD1 3.7Å; Y617-L654 HydrophobicContact CG-CD2 4.33Å; Y617-N673 PolarHBondContact OH-ND2 2.84Å
618	Q	48.1	Very low	52.7	Low	109 Å²	109	92.8 Å²	92.8	51%	0.509	47%	0.468	S	S	.	.			trans	-66.3	94.1	160.8	-80.8	-175.9	-12.3	0	0	108	S456 Y457	S456-Q618 PolarHBondContact OG-NE2 3.49Å; Y457-Q618 VanDerWaalsContact CB-OE1 3.29Å
619	C	62.9	Low	53	Low	26 Å²	26	93.5 Å²	93.5	18%	0.176	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-64.7	152.1	160	-125.3	0	0	0	0	108.8	Y617 C623 C625	Y617-C619 VanDerWaalsContact C-N 3.29Å; Y617-C619 PolarHBondContact O-N 2.87Å; C619-C623 HydrophobicContact CB-CB 4.14Å; C619-C623 WeakPolarHBondContact CB-O 3.43Å; C619-C625 WeakPolarHBondContact CA-SG 3.26Å; C619-C625 HydrophobicContact CB-CB 3.91Å; C619-C625 WeakPolarHBondContact CB-SG 3.36Å; C619-C625 VanDerWaalsContact SG-CA 3.52Å; C619-C625 WeakPolarHBondContact SG-CB 3.23Å; C619-C625 PolarHBondContact SG-N 2.88Å; C619-C625 CovalentContact SG-SG 2.04Å; C619-C625 PolarHBondContact SG-SG 2.9Å
620	P	68.8	Low	53	Low	7 Å²	7	91.4 Å²	91.4	5%	0.045	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-55.2	150.6	167.3	-20.2	31	0	0	0	110.7	G622 C623 P667 N669 L670	P620-G622 PolarHBondContact O-N 3.1Å; P620-C623 HydrophobicContact CB-CB 4.37Å; P620-C623 HydrophobicContact CG-CB 4.49Å; P620-C623 VanDerWaalsContact O-CB 3.25Å; P620-C623 WeakPolarHBondContact O-CB 3.48Å; P620-C623 PolarHBondContact O-N 3.12Å; P620-P667 HydrophobicContact CB-CB 4.09Å; P620-P667 HydrophobicContact CG-CB 4.05Å; P620-N669 WeakPolarHBondContact CB-OD1 3.48Å; P620-N669 VanDerWaalsContact CG-OD1 3.32Å; P620-N669 WeakPolarHBondContact CG-OD1 3.48Å; P620-L670 HydrophobicContact CG-CD2 3.87Å; P620-L670 HydrophobicContact CG-CG 4.36Å
621	D	67.4	Low	52.5	Low	161 Å²	161	92.1 Å²	92.1	86%	0.861	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	132.5	-176.7	-69.7	-61.5	0	0	0	111.8	C623	D621-C623 VanDerWaalsContact C-N 3.25Å; D621-C623 PolarHBondContact O-N 3Å
622	G	67.4	Low	51.9	Low	62 Å²	62	94.1 Å²	94.1	64%	0.639	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	-25.7	-172.2	0	0	0	0	0	115.3	P620 L661	P620-G622 PolarHBondContact O-N 3.1Å; G622-L661 VanDerWaalsContact C-CD1 3.48Å
623	C	79.2	Confident	51	Low	17 Å²	17	103.2 Å²	103.2	12%	0.115	51%	0.505	C	S	.	.			trans	-75.3	151.9	-180	-58.9	0	0	0	0	113.1	C619 P620 D621 V656 D657 C658	C619-C623 HydrophobicContact CB-CB 4.14Å; C619-C623 WeakPolarHBondContact CB-O 3.43Å; P620-C623 HydrophobicContact CB-CB 4.37Å; P620-C623 HydrophobicContact CG-CB 4.49Å; P620-C623 VanDerWaalsContact O-CB 3.25Å; P620-C623 WeakPolarHBondContact O-CB 3.48Å; P620-C623 PolarHBondContact O-N 3.12Å; D621-C623 VanDerWaalsContact C-N 3.25Å; D621-C623 PolarHBondContact O-N 3Å; C623-V656 HydrophobicContact CB-CG1 4.42Å; C623-D657 CarbonylContact C-O 3.18Å; C623-D657 WeakPolarHBondContact CA-O 3.34Å; C623-C658 HydrophobicContact CB-CB 4.1Å; C623-C658 WeakPolarHBondContact CB-SG 3.19Å; C623-C658 WeakPolarHBondContact SG-CB 3.29Å; C623-C658 CovalentContact SG-SG 2.03Å; C623-C658 PolarHBondContact SG-SG 3.18Å
624	R	75.3	Confident	50.4	Low	191 Å²	191	106.6 Å²	106.6	72%	0.721	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.6	177.8	-171.5	-177.7	-172.8	-178.4	7.1	111.5	D657	R624-D657 PolarHBondContact N-O 3.01Å; R624-D657 PolarHBondContact O-N 2.84Å
625	C	73.2	Confident	50	Low	35 Å²	35	104.8 Å²	104.8	24%	0.236	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.8	179.2	-78.4	0	0	0	0	111.1	C619 L654	C619-C625 WeakPolarHBondContact CA-SG 3.26Å; C619-C625 HydrophobicContact CB-CB 3.91Å; C619-C625 WeakPolarHBondContact CB-SG 3.36Å; C619-C625 VanDerWaalsContact SG-CA 3.52Å; C619-C625 WeakPolarHBondContact SG-CB 3.23Å; C619-C625 PolarHBondContact SG-N 2.88Å; C619-C625 CovalentContact SG-SG 2.04Å; C619-C625 PolarHBondContact SG-SG 2.9Å; C625-L654 HydrophobicContact CB-CD2 4.2Å
626	K	67.4	Low	49.9	Very low	147 Å²	147	101.1 Å²	101.1	64%	0.639	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.9	131.9	178.3	-174.9	179.6	-179	179.4	0	112.5	S655	K626-S655 PolarHBondContact N-O 2.87Å; K626-S655 PolarHBondContact O-N 2.98Å
627	D	55.9	Low	49.4	Very low	70 Å²	70	106.2 Å²	106.2	37%	0.374	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.9	176.4	-79.5	-10.1	0	0	0	113.2	I629 L654	D627-I629 PolarHBondContact O-N 2.89Å; D627-I629 VanDerWaalsContact O-N 3.14Å; D627-L654 WeakPolarHBondContact OD1-CD2 3.27Å
628	I	48.5	Very low	48.6	Very low	64 Å²	64	107.8 Å²	107.8	33%	0.328	56%	0.561	S	S	.	*			trans	-80.6	90.8	168.3	-58.7	170	0	0	0	107.9	I630 G653 K675 E676	I628-I630 PolarHBondContact O-N 2.91Å; I628-G653 VanDerWaalsContact CB-O 3.23Å; I628-G653 WeakPolarHBondContact CB-O 3.29Å; I628-G653 WeakPolarHBondContact CD1-O 3.07Å; I628-G653 WeakPolarHBondContact CG1-O 3.24Å; I628-G653 PolarHBondContact N-O 2.77Å; I628-K675 HydrophobicContact CD1-CB 3.82Å; I628-E676 HydrophobicContact CD1-CB 4.28Å
629	I	41.9	Very low	47.7	Very low	135 Å²	135	112.2 Å²	112.2	69%	0.692	58%	0.582	S	S	*	*			trans	-60.3	102.1	-176	-55.6	173.9	0	0	0	111.6	D627 K631	D627-I629 PolarHBondContact O-N 2.89Å; D627-I629 VanDerWaalsContact O-N 3.14Å; I629-K631 HydrophobicContact CG2-CG 4.01Å; I629-K631 PolarHBondContact O-N 2.9Å
630	I	36.6	Very low	45.9	Very low	103 Å²	103	114.5 Å²	114.5	53%	0.528	60%	0.602	S	S	.	*			trans	-84.1	85.8	169.3	-52.5	178.5	0	0	0	108.2	I628 P632	I628-I630 PolarHBondContact O-N 2.91Å; I630-P632 WeakPolarHBondContact O-CD 3.24Å; I630-P632 VanDerWaalsContact O-N 3.14Å
631	K	29.7	Very low	44	Very low	142 Å²	142	121.5 Å²	121.5	62%	0.617	64%	0.638	S	S	*	*			trans	-56.9	117.2	174.7	-76	-169	175.6	-178.4	0	109.9	I629	I629-K631 HydrophobicContact CG2-CG 4.01Å; I629-K631 PolarHBondContact O-N 2.9Å
632	P	30.9	Very low	42	Very low	101 Å²	101	122.5 Å²	122.5	66%	0.656	64%	0.635	S	S	*	*			trans	-61.1	146.4	179.9	-24.4	35.4	0	0	0	112	I630 M634	I630-P632 WeakPolarHBondContact O-CD 3.24Å; I630-P632 VanDerWaalsContact O-N 3.14Å; P632-M634 PolarHBondContact O-N 2.77Å
633	R	27.8	Very low	40.2	Very low	225 Å²	225	129.3 Å²	129.3	85%	0.849	64%	0.641	S	S	*	*			trans	-75.6	90.1	169	-82.1	-172.2	170.4	126.1	-4.6	109.5	H635	R633-H635 VanDerWaalsContact C-N 3.33Å; R633-H635 PolarHBondContact O-N 2.86Å
634	M	26.8	Very low	37.9	Very low	184 Å²	184	136.9 Å²	136.9	91%	0.906	68%	0.675	S	S	*	*			trans	-65	95.6	163.8	-68.9	-169.4	77.4	0	0	109.6	P632 A636	P632-M634 PolarHBondContact O-N 2.77Å; M634-A636 PolarHBondContact O-N 3.33Å
635	H	27	Very low	35.7	Very low	146 Å²	146	134.8 Å²	134.8	68%	0.676	68%	0.678	S	S	*	*			trans	-78.9	107.7	157.6	-77.3	-90.8	0	0	0	107.3	R633	R633-H635 VanDerWaalsContact C-N 3.33Å; R633-H635 PolarHBondContact O-N 2.86Å
636	A	27	Very low	33.5	Very low	87 Å²	87	140.7 Å²	140.7	72%	0.719	70%	0.702	S	S	*	*	S	Bend	trans	-61.8	147.6	166.3	0	0	0	0	0	109.7	M634	M634-A636 PolarHBondContact O-N 3.33Å
637	N	27.8	Very low	31.6	Very low	164 Å²	164	138 Å²	138	88%	0.877	69%	0.69	S	S	*	*	S	Bend	trans	73.8	50.6	174.8	-51	-6.5	0	0	0	116.7
638	S	31.1	Very low	30.3	Very low	87 Å²	87	138.3 Å²	138.3	61%	0.608	71%	0.71	S	S	*	*			trans	-152.9	119.6	146.2	54.2	0	0	0	0	112.6	A640	S638-A640 PolarHBondContact O-N 2.97Å
639	E	28.4	Very low	29.6	Very low	203 Å²	203	139 Å²	139	95%	0.949	72%	0.72	S	S	*	*			trans	-78	48.9	171.5	-62.9	-179.4	133.5	0	0	111	I641	E639-I641 PolarHBondContact O-N 2.9Å
640	A	26.7	Very low	29.2	Very low	74 Å²	74	137.5 Å²	137.5	61%	0.612	71%	0.713	S	S	*	*			trans	-80.1	81.3	-173.1	0	0	0	0	0	111.3	S638 F642	S638-A640 PolarHBondContact O-N 2.97Å; A640-F642 PolarHBondContact O-N 2.84Å
641	I	28.1	Very low	29.4	Very low	154 Å²	154	137.9 Å²	137.9	79%	0.79	72%	0.715	S	S	*	*			trans	5.2	99.6	160.2	-55.2	170	0	0	0	113.5	E639 R643	E639-I641 PolarHBondContact O-N 2.9Å; I641-R643 PolarHBondContact O-N 3Å; I641-R643 VanDerWaalsContact O-N 3.14Å
642	F	26.7	Very low	30.2	Very low	181 Å²	181	131.6 Å²	131.6	79%	0.794	69%	0.691	S	S	*	*			trans	-57.3	116.7	176	-79.2	-93.5	0	0	0	110.8	A640	A640-F642 PolarHBondContact O-N 2.84Å
643	R	28.6	Very low	31.8	Very low	206 Å²	206	126.9 Å²	126.9	78%	0.777	66%	0.661	S	S	*	*			trans	-75.9	133.7	167.3	-66.3	-173.9	177.5	-163.7	-1.9	108.7	I641 D645	I641-R643 PolarHBondContact O-N 3Å; I641-R643 VanDerWaalsContact O-N 3.14Å; R643-D645 PolarHBondContact O-N 3.09Å; R643-D645 VanDerWaalsContact O-N 3.15Å
644	Q	29.8	Very low	33.9	Very low	175 Å²	175	116.2 Å²	116.2	82%	0.818	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-68.7	-17.2	-166.4	-68.2	169.7	-68.8	0	0	113.7
645	D	29.4	Very low	36.5	Very low	147 Å²	147	108.5 Å²	108.5	79%	0.786	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-78.3	-26	-169.8	-48	-52.5	0	0	0	114.8	R643 F647	R643-D645 PolarHBondContact O-N 3.09Å; R643-D645 VanDerWaalsContact O-N 3.15Å; D645-F647 VanDerWaalsContact C-N 3.31Å; D645-F647 PolarHBondContact O-N 2.98Å
646	E	28.1	Very low	39.3	Very low	159 Å²	159	101.5 Å²	101.5	74%	0.743	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-81.9	-4	-173.6	-69.1	-164.2	146.6	0	0	114.5	G648 S649	E646-G648 PolarHBondContact O-N 3.47Å; E646-G648 VanDerWaalsContact O-N 3.08Å; E646-S649 WeakPolarHBondContact O-CB 3.43Å; E646-S649 PolarHBondContact O-N 2.79Å; E646-S649 VanDerWaalsContact O-N 3.12Å; E646-S649 PolarHBondContact O-OG 2.88Å
647	F	27.3	Very low	42.1	Very low	91 Å²	91	100.3 Å²	100.3	40%	0.399	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-62.6	-17.4	-178.4	-109.1	-75	0	0	0	114.7	D645 S649 I650	D645-F647 VanDerWaalsContact C-N 3.31Å; D645-F647 PolarHBondContact O-N 2.98Å; F647-S649 PolarHBondContact O-N 2.93Å; F647-S649 VanDerWaalsContact O-N 3.14Å; F647-I650 HydrophobicContact CD1-CD1 3.93Å; F647-I650 HydrophobicContact CE1-CD1 3.93Å
648	G	28.6	Very low	44.9	Very low	76 Å²	76	92.5 Å²	92.5	78%	0.784	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-66	-5.6	172.9	0	0	0	0	0	114.9	E646	E646-G648 PolarHBondContact O-N 3.47Å; E646-G648 VanDerWaalsContact O-N 3.08Å
649	S	32.5	Very low	47.5	Very low	78 Å²	78	89.7 Å²	89.7	55%	0.545	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-98.4	-7.1	-177.6	65.5	0	0	0	0	115.6	E646 F647	E646-S649 WeakPolarHBondContact O-CB 3.43Å; E646-S649 PolarHBondContact O-N 2.79Å; E646-S649 VanDerWaalsContact O-N 3.12Å; E646-S649 PolarHBondContact O-OG 2.88Å; F647-S649 PolarHBondContact O-N 2.93Å; F647-S649 VanDerWaalsContact O-N 3.14Å
650	I	34.9	Very low	50.2	Low	105 Å²	105	83.7 Å²	83.7	54%	0.538	45%	0.453	S	S	.	.			trans	-93.2	-16.8	-170.6	-58.8	179	0	0	0	112.8	F647 G652	F647-I650 HydrophobicContact CD1-CD1 3.93Å; F647-I650 HydrophobicContact CE1-CD1 3.93Å; I650-G652 PolarHBondContact O-N 2.86Å
651	L	40.4	Very low	53	Low	110 Å²	110	83 Å²	83	58%	0.576	44%	0.439	S	S	*	.	S	Bend	trans	-65.3	102	163.2	-82.9	164.9	0	0	0	109	G653	L651-G653 PolarHBondContact O-N 3.38Å
652	G	47.4	Very low	55.8	Low	10 Å²	10	83 Å²	83	10%	0.103	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-54.5	132.2	163.9	0	0	0	0	0	108.6	I650	I650-G652 PolarHBondContact O-N 2.86Å
653	G	62.8	Low	58.5	Low	3 Å²	3	76.5 Å²	76.5	3%	0.031	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-71.7	154	173.7	0	0	0	0	0	110.4	I628 L651 N673	I628-G653 VanDerWaalsContact CB-O 3.23Å; I628-G653 WeakPolarHBondContact CB-O 3.29Å; I628-G653 WeakPolarHBondContact CD1-O 3.07Å; I628-G653 WeakPolarHBondContact CG1-O 3.24Å; I628-G653 PolarHBondContact N-O 2.77Å; L651-G653 PolarHBondContact O-N 3.38Å; G653-N673 CarbonylContact C-O 3.27Å; G653-N673 WeakPolarHBondContact CA-O 3.46Å
654	L	72.7	Confident	61.2	Low	1 Å²	1	71.3 Å²	71.3	1%	0.005	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.9	-179.1	-76.5	160.6	0	0	0	111.6	Y617 C625 D627 V656 P671 N673 K675 E676	Y617-L654 HydrophobicContact CD1-CD1 3.72Å; Y617-L654 HydrophobicContact CD2-CD1 3.87Å; Y617-L654 HydrophobicContact CD2-CD2 3.7Å; Y617-L654 HydrophobicContact CD2-CG 4.27Å; Y617-L654 HydrophobicContact CE1-CD1 3.88Å; Y617-L654 HydrophobicContact CE2-CD1 4.02Å; Y617-L654 HydrophobicContact CE2-CD2 3.8Å; Y617-L654 HydrophobicContact CE2-CG 4.16Å; Y617-L654 HydrophobicContact CG-CD1 3.7Å; Y617-L654 HydrophobicContact CG-CD2 4.33Å; C625-L654 HydrophobicContact CB-CD2 4.2Å; D627-L654 WeakPolarHBondContact OD1-CD2 3.27Å; L654-V656 HydrophobicContact CB-CG2 3.88Å; L654-P671 HydrophobicContact CD1-CB 3.65Å; L654-P671 HydrophobicContact CD1-CG 3.93Å; L654-N673 PolarHBondContact N-O 3.38Å; L654-K675 PolarHBondContact O-N 3.18Å; L654-E676 PolarHBondContact O-N 3.33Å
655	S	81.3	Confident	63.7	Low	21 Å²	21	70 Å²	70	15%	0.147	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.5	153.7	-171	0	0	0	0	106.9	K626 E676	K626-S655 PolarHBondContact N-O 2.87Å; K626-S655 PolarHBondContact O-N 2.98Å; S655-E676 CarbonylContact C-O 3.54Å; S655-E676 WeakPolarHBondContact CA-O 3.38Å; S655-E676 PolarHBondContact OG-OE2 3.43Å
656	V	85.7	Confident	66.4	Low	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.9	-175.9	179.7	0	0	0	0	108.4	C623 L654 L670 T674 E676 L677 I678	C623-V656 HydrophobicContact CB-CG1 4.42Å; L654-V656 HydrophobicContact CB-CG2 3.88Å; V656-L670 HydrophobicContact CG1-CD2 3.71Å; V656-T674 HydrophobicContact CB-CG2 4.12Å; V656-T674 HydrophobicContact CG2-CG2 3.82Å; V656-T674 WeakPolarHBondContact CG2-OG1 3.34Å; V656-E676 PolarHBondContact N-O 3.04Å; V656-L677 HydrophobicContact CB-CD1 4.18Å; V656-L677 HydrophobicContact CG1-CD1 4.18Å; V656-L677 WeakPolarHBondContact O-CA 3.23Å; V656-I678 PolarHBondContact O-N 3.36Å
657	D	85.9	Confident	68.9	Low	61 Å²	61	56.9 Å²	56.9	33%	0.326	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	111.3	-177.2	-165.4	-6.5	0	0	0	111	C623 R624 S659 I678	C623-D657 CarbonylContact C-O 3.18Å; C623-D657 WeakPolarHBondContact CA-O 3.34Å; R624-D657 PolarHBondContact N-O 3.01Å; R624-D657 PolarHBondContact O-N 2.84Å; D657-S659 WeakPolarHBondContact OD1-CB 3.47Å; D657-S659 PolarHBondContact OD1-N 3.12Å; D657-S659 VanDerWaalsContact OD1-N 3.1Å; D657-S659 PolarHBondContact OD1-OG 3.37Å; D657-I678 HydrophobicContact CB-CB 4.22Å; D657-I678 HydrophobicContact CB-CD1 4.35Å
658	C	86.3	Confident	70.9	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.335	C	S	.	.			trans	-115.6	29.2	178.9	-59.9	0	0	0	0	110.5	C623 L661 L663 I678 L679 N682	C623-C658 HydrophobicContact CB-CB 4.1Å; C623-C658 WeakPolarHBondContact CB-SG 3.19Å; C623-C658 WeakPolarHBondContact SG-CB 3.29Å; C623-C658 CovalentContact SG-SG 2.03Å; C623-C658 PolarHBondContact SG-SG 3.18Å; C658-L661 HydrophobicContact CB-CD1 4.04Å; C658-L663 HydrophobicContact CB-CD1 4.01Å; C658-I678 PolarHBondContact N-O 2.91Å; C658-L679 HydrophobicContact CB-CD2 3.85Å; C658-N682 PolarHBondContact O-ND2 3.47Å
659	S	85.1	Confident	73	Confident	28 Å²	28	58.3 Å²	58.3	20%	0.196	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	145.2	-176.9	-56.1	0	0	0	0	112.9	D657 I678 R680	D657-S659 WeakPolarHBondContact OD1-CB 3.47Å; D657-S659 PolarHBondContact OD1-N 3.12Å; D657-S659 VanDerWaalsContact OD1-N 3.1Å; D657-S659 PolarHBondContact OD1-OG 3.37Å; S659-I678 WeakPolarHBondContact OG-CG2 3.35Å; S659-R680 CarbonylContact C-O 3.45Å; S659-R680 WeakPolarHBondContact CA-O 3.25Å; S659-R680 WeakPolarHBondContact CB-O 3.39Å; S659-R680 PolarHBondContact OG-N 3.42Å; S659-R680 VanDerWaalsContact OG-N 3.1Å
660	S	86	Confident	75.2	Confident	77 Å²	77	55.2 Å²	55.2	54%	0.538	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	43.6	175.9	-49.8	0	0	0	0	114.1	R680 N681	S660-R680 PolarHBondContact N-O 2.87Å; S660-N681 WeakPolarHBondContact CA-O 3.17Å
661	L	85.2	Confident	77.1	Confident	61 Å²	61	50.6 Å²	50.6	32%	0.319	28%	0.277	S	S	.	.	S	Bend	trans	-114.6	14	179.4	-64.5	178.1	0	0	0	112.7	G622 C658 L663 N682	G622-L661 VanDerWaalsContact C-CD1 3.48Å; C658-L661 HydrophobicContact CB-CD1 4.04Å; L661-L663 HydrophobicContact CB-CD1 4.12Å; L661-L663 HydrophobicContact CB-CD2 4.49Å; L661-L663 HydrophobicContact CB-CG 3.86Å; L661-L663 HydrophobicContact CD1-CD1 4.37Å; L661-L663 PolarHBondContact O-N 2.68Å; L661-N682 WeakPolarHBondContact CA-OD1 3.49Å; L661-N682 PolarHBondContact N-OD1 3.38Å
662	E	86.8	Confident	78.5	Confident	154 Å²	154	47.2 Å²	47.2	72%	0.72	26%	0.259	S	S	*	.			trans	56.2	20.2	-178.8	-59	-177.5	-178.5	0	0	114.6	T664 N682 L683	E662-T664 PolarHBondContact O-N 2.82Å; E662-N682 PolarHBondContact N-OD1 2.84Å; E662-N682 VanDerWaalsContact N-OD1 3.1Å; E662-L683 HydrophobicContact CB-CD1 4.19Å
663	L	83.4	Confident	79.6	Confident	43 Å²	43	48.3 Å²	48.3	23%	0.225	26%	0.263	C	S	.	.			trans	-62.3	126	-173.9	-64.6	168.5	0	0	0	111.9	C658 L661 P667 L679 N682 L683 I684	C658-L663 HydrophobicContact CB-CD1 4.01Å; L661-L663 HydrophobicContact CB-CD1 4.12Å; L661-L663 HydrophobicContact CB-CD2 4.49Å; L661-L663 HydrophobicContact CB-CG 3.86Å; L661-L663 HydrophobicContact CD1-CD1 4.37Å; L661-L663 PolarHBondContact O-N 2.68Å; L663-P667 HydrophobicContact CD1-CG 3.84Å; L663-P667 HydrophobicContact CD2-CG 4.43Å; L663-L679 HydrophobicContact CD1-CD2 4.33Å; L663-N682 HydrophobicContact CB-CB 4.1Å; L663-N682 PolarHBondContact N-OD1 3.23Å; L663-N682 VanDerWaalsContact N-OD1 3.14Å; L663-L683 CarbonylContact O-C 3.54Å; L663-L683 VanDerWaalsContact O-C 3.32Å; L663-L683 WeakPolarHBondContact O-CA 3.43Å; L663-L683 PolarHBondContact O-N 3.47Å; L663-I684 VanDerWaalsContact O-CG1 3.25Å; L663-I684 WeakPolarHBondContact O-CG1 3.34Å; L663-I684 PolarHBondContact O-N 2.89Å
664	T	84.7	Confident	80.5	Confident	97 Å²	97	48.1 Å²	48.1	60%	0.595	26%	0.262	S	S	*	.	S	Bend	trans	-84.2	-16	174.5	50.6	0	0	0	0	113.6	E662 L683	E662-T664 PolarHBondContact O-N 2.82Å; T664-L683 HydrophobicContact CG2-CB 4.16Å
665	E	84.1	Confident	80.9	Confident	148 Å²	148	51 Å²	51	69%	0.692	27%	0.274	S	S	*	.	S	Bend	trans	-144.5	169.3	-177.7	64	-173.1	177.8	0	0	111.6
666	I	85.7	Confident	81.3	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.062	28%	0.278	C	S	.	.			trans	-84.4	123.3	-178.7	-60.3	179	0	0	0	109.3	D668 L670 L679 I684 L693 I704	I666-D668 PolarHBondContact O-N 2.93Å; I666-L670 HydrophobicContact CG2-CD1 4.02Å; I666-L679 HydrophobicContact CD1-CD1 4.35Å; I666-L679 HydrophobicContact CG1-CD1 4.14Å; I666-L679 HydrophobicContact CG2-CD1 4.14Å; I666-I684 HydrophobicContact CG1-CD1 4Å; I666-L693 HydrophobicContact CD1-CD1 3.59Å; I666-L693 HydrophobicContact CD1-CD2 4.29Å; I666-L693 HydrophobicContact CD1-CG 3.68Å; I666-L693 HydrophobicContact CG2-CG 4.43Å; I666-I704 HydrophobicContact CD1-CD1 4.2Å; I666-I704 HydrophobicContact CG1-CD1 4.5Å
667	P	79.8	Confident	81.6	Confident	18 Å²	18	52.4 Å²	52.4	12%	0.117	28%	0.278	C	S	.	.			trans	-55.2	131.2	-175.5	-28.4	35.3	0	0	0	113.7	P620 L663 N669 L670	P620-P667 HydrophobicContact CB-CB 4.09Å; P620-P667 HydrophobicContact CG-CB 4.05Å; L663-P667 HydrophobicContact CD1-CG 3.84Å; L663-P667 HydrophobicContact CD2-CG 4.43Å; P667-N669 VanDerWaalsContact C-N 3.34Å; P667-N669 PolarHBondContact O-N 3.04Å; P667-L670 HydrophobicContact CB-CG 4.23Å; P667-L670 VanDerWaalsContact O-CD1 3.23Å; P667-L670 WeakPolarHBondContact O-CD1 3.44Å; P667-L670 VanDerWaalsContact O-CG 3.29Å; P667-L670 WeakPolarHBondContact O-CG 3.4Å
668	D	70.2	Confident	81.9	Confident	95 Å²	95	50.2 Å²	50.2	51%	0.508	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.2	-165	-146.1	28.5	0	0	0	114	I666 G692 K695	I666-D668 PolarHBondContact O-N 2.93Å; D668-G692 VanDerWaalsContact OD1-CA 3.29Å; D668-G692 WeakPolarHBondContact OD1-CA 3.47Å; D668-K695 PolarHBondContact O-NZ 3.3Å; D668-K695 IonicContact OD1-NZ 2.69Å; D668-K695 PolarHBondContact OD1-NZ 3.03Å; D668-K695 IonicContact OD2-NZ 3.59Å; D668-K695 PolarHBondContact OD2-NZ 3.28Å
669	N	73.1	Confident	82.2	Confident	102 Å²	102	50.2 Å²	50.2	55%	0.545	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	22.6	-178.1	59.2	-20.5	0	0	0	113.6	P620 P667	P620-N669 WeakPolarHBondContact CB-OD1 3.48Å; P620-N669 VanDerWaalsContact CG-OD1 3.32Å; P620-N669 WeakPolarHBondContact CG-OD1 3.48Å; P667-N669 VanDerWaalsContact C-N 3.34Å; P667-N669 PolarHBondContact O-N 3.04Å
670	L	78.7	Confident	82.5	Confident	13 Å²	13	52.4 Å²	52.4	7%	0.068	27%	0.27	C	S	.	.			trans	-66.6	139.3	179.2	-74	165.5	0	0	0	113	P620 V656 I666 P667 I672 L677 L696	P620-L670 HydrophobicContact CG-CD2 3.87Å; P620-L670 HydrophobicContact CG-CG 4.36Å; V656-L670 HydrophobicContact CG1-CD2 3.71Å; I666-L670 HydrophobicContact CG2-CD1 4.02Å; P667-L670 HydrophobicContact CB-CG 4.23Å; P667-L670 VanDerWaalsContact O-CD1 3.23Å; P667-L670 WeakPolarHBondContact O-CD1 3.44Å; P667-L670 VanDerWaalsContact O-CG 3.29Å; P667-L670 WeakPolarHBondContact O-CG 3.4Å; L670-I672 PolarHBondContact O-N 2.78Å; L670-L677 HydrophobicContact CD1-CD1 3.84Å; L670-L677 HydrophobicContact CD1-CD2 3.62Å; L670-L677 HydrophobicContact CD1-CG 4.41Å; L670-L677 HydrophobicContact CD2-CD1 3.78Å; L670-L677 HydrophobicContact CG-CD1 4.49Å; L670-L696 HydrophobicContact CB-CD1 4.2Å; L670-L696 HydrophobicContact CB-CD2 4.12Å; L670-L696 HydrophobicContact CD1-CD1 4.01Å
671	P	74.4	Confident	82.8	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.052	27%	0.27	C	S	.	.			trans	-59.2	133.1	179	-25.6	34.3	0	0	0	113.5	L654 N673 T674 L696	L654-P671 HydrophobicContact CD1-CB 3.65Å; L654-P671 HydrophobicContact CD1-CG 3.93Å; P671-N673 WeakPolarHBondContact CB-OD1 3.48Å; P671-N673 PolarHBondContact O-N 3.33Å; P671-T674 WeakPolarHBondContact O-CB 3.37Å; P671-T674 PolarHBondContact O-N 3.1Å; P671-T674 PolarHBondContact O-OG1 3.05Å; P671-L696 WeakPolarHBondContact O-CD2 3.43Å
672	I	69.3	Low	83.1	Confident	39 Å²	39	50.9 Å²	50.9	20%	0.2	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.3	-172.9	-65.1	165.1	0	0	0	112.7	L436 L670 T674 S698	L436-I672 HydrophobicContact CB-CD1 3.47Å; L436-I672 VanDerWaalsContact CB-CD1 3.47Å; L436-I672 HydrophobicContact CD2-CD1 3.95Å; L436-I672 HydrophobicContact CD2-CG2 4.21Å; L436-I672 HydrophobicContact CG-CD1 4.35Å; L670-I672 PolarHBondContact O-N 2.78Å; I672-T674 VanDerWaalsContact C-N 3.29Å; I672-S698 VanDerWaalsContact O-CB 3.22Å; I672-S698 WeakPolarHBondContact O-CB 3.48Å; I672-S698 PolarHBondContact O-OG 2.61Å
673	N	70.9	Confident	83.3	Confident	33 Å²	33	46.8 Å²	46.8	18%	0.176	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	8.3	169	62.7	-37.6	0	0	0	114	Y617 G653 L654 P671 K675	Y617-N673 PolarHBondContact OH-ND2 2.84Å; G653-N673 CarbonylContact C-O 3.27Å; G653-N673 WeakPolarHBondContact CA-O 3.46Å; L654-N673 PolarHBondContact N-O 3.38Å; P671-N673 WeakPolarHBondContact CB-OD1 3.48Å; P671-N673 PolarHBondContact O-N 3.33Å; N673-K675 PolarHBondContact O-N 3.09Å
674	T	80.8	Confident	83.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	122.4	171.9	-59.3	0	0	0	0	110.8	V656 P671 I672 E676 L677 S698 L699	V656-T674 HydrophobicContact CB-CG2 4.12Å; V656-T674 HydrophobicContact CG2-CG2 3.82Å; V656-T674 WeakPolarHBondContact CG2-OG1 3.34Å; P671-T674 WeakPolarHBondContact O-CB 3.37Å; P671-T674 PolarHBondContact O-N 3.1Å; P671-T674 PolarHBondContact O-OG1 3.05Å; I672-T674 VanDerWaalsContact C-N 3.29Å; T674-E676 VanDerWaalsContact CG2-O 3.25Å; T674-E676 WeakPolarHBondContact CG2-O 3.47Å; T674-L677 HydrophobicContact CG2-CB 4.13Å; T674-S698 CarbonylContact O-C 3.47Å; T674-S698 WeakPolarHBondContact O-CB 3.41Å; T674-L699 HydrophobicContact CG2-CD1 3.99Å; T674-L699 WeakPolarHBondContact O-CA 3.44Å; T674-L699 PolarHBondContact O-N 2.98Å
675	K	82.3	Confident	83.8	Confident	62 Å²	62	45.5 Å²	45.5	27%	0.27	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-26.4	175	-82.6	-172.2	179.1	-139.1	0	112.9	I628 L654 N673 E700 T701	I628-K675 HydrophobicContact CD1-CB 3.82Å; L654-K675 PolarHBondContact O-N 3.18Å; N673-K675 PolarHBondContact O-N 3.09Å; K675-E700 WeakPolarHBondContact CD-OE1 3.35Å; K675-E700 WeakPolarHBondContact CE-OE1 3.39Å; K675-E700 HydrophobicContact CG-CG 4.33Å; K675-E700 IonicContact NZ-OE1 2.7Å; K675-E700 PolarHBondContact NZ-OE1 3.11Å; K675-E700 CarbonylContact O-C 3.54Å; K675-E700 WeakPolarHBondContact O-CA 3.43Å; K675-E700 PolarHBondContact O-N 2.02Å; K675-T701 PolarHBondContact O-N 3.2Å
676	E	89	Confident	83.9	Confident	49 Å²	49	41.4 Å²	41.4	23%	0.229	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.2	174.3	177.1	169.8	-123.8	0	0	108.9	I628 L654 S655 V656 T674 I678 T701	I628-E676 HydrophobicContact CD1-CB 4.28Å; L654-E676 PolarHBondContact O-N 3.33Å; S655-E676 CarbonylContact C-O 3.54Å; S655-E676 WeakPolarHBondContact CA-O 3.38Å; S655-E676 PolarHBondContact OG-OE2 3.43Å; V656-E676 PolarHBondContact N-O 3.04Å; T674-E676 VanDerWaalsContact CG2-O 3.25Å; T674-E676 WeakPolarHBondContact CG2-O 3.47Å; E676-I678 HydrophobicContact CG-CD1 4.3Å; E676-I678 HydrophobicContact CG-CG1 4.05Å; E676-T701 WeakPolarHBondContact CA-O 3.39Å; E676-T701 HydrophobicContact CG-CG2 3.91Å
677	L	92.4	Very high	84	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.1	177.1	179.8	60.7	0	0	0	109.2	V656 L670 T674 L679 L693 L696 L699 T701 L702 I703	V656-L677 HydrophobicContact CB-CD1 4.18Å; V656-L677 HydrophobicContact CG1-CD1 4.18Å; V656-L677 WeakPolarHBondContact O-CA 3.23Å; L670-L677 HydrophobicContact CD1-CD1 3.84Å; L670-L677 HydrophobicContact CD1-CD2 3.62Å; L670-L677 HydrophobicContact CD1-CG 4.41Å; L670-L677 HydrophobicContact CD2-CD1 3.78Å; L670-L677 HydrophobicContact CG-CD1 4.49Å; T674-L677 HydrophobicContact CG2-CB 4.13Å; L677-L679 HydrophobicContact CD1-CG 4.31Å; L677-L679 HydrophobicContact CD2-CD1 3.84Å; L677-L679 HydrophobicContact CD2-CG 4.49Å; L677-L679 HydrophobicContact CG-CD1 3.93Å; L677-L679 HydrophobicContact CG-CG 4.09Å; L677-L693 HydrophobicContact CD2-CD2 3.98Å; L677-L696 HydrophobicContact CD2-CD1 3.89Å; L677-L699 HydrophobicContact CB-CD1 3.76Å; L677-T701 PolarHBondContact N-O 3.4Å; L677-L702 HydrophobicContact CB-CD1 4.02Å; L677-L702 HydrophobicContact CD2-CD1 3.9Å; L677-L702 HydrophobicContact CG-CD1 4.05Å; L677-I703 PolarHBondContact O-N 2.92Å
678	I	92.5	Very high	84.1	Confident	16 Å²	16	42.6 Å²	42.6	8%	0.082	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.1	-176.3	-40.9	-176.9	0	0	0	108.5	V656 D657 C658 S659 E676 R680 I703	V656-I678 PolarHBondContact O-N 3.36Å; D657-I678 HydrophobicContact CB-CB 4.22Å; D657-I678 HydrophobicContact CB-CD1 4.35Å; C658-I678 PolarHBondContact N-O 2.91Å; S659-I678 WeakPolarHBondContact OG-CG2 3.35Å; E676-I678 HydrophobicContact CG-CD1 4.3Å; E676-I678 HydrophobicContact CG-CG1 4.05Å; I678-R680 HydrophobicContact CG2-CG 4.14Å; I678-I703 CarbonylContact C-O 3.58Å; I678-I703 WeakPolarHBondContact CA-O 3.36Å; I678-I703 HydrophobicContact CB-CB 4.46Å; I678-I703 HydrophobicContact CG1-CD1 4.34Å; I678-I703 HydrophobicContact CG2-CB 4.13Å; I678-I703 HydrophobicContact CG2-CG2 3.84Å
679	L	92.9	Very high	84.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.			trans	-135	34.5	-171	-71.3	161.9	0	0	0	110.6	C658 L663 I666 L677 N682 I684 L702 I703 I704 N707	C658-L679 HydrophobicContact CB-CD2 3.85Å; L663-L679 HydrophobicContact CD1-CD2 4.33Å; I666-L679 HydrophobicContact CD1-CD1 4.35Å; I666-L679 HydrophobicContact CG1-CD1 4.14Å; I666-L679 HydrophobicContact CG2-CD1 4.14Å; L677-L679 HydrophobicContact CD1-CG 4.31Å; L677-L679 HydrophobicContact CD2-CD1 3.84Å; L677-L679 HydrophobicContact CD2-CG 4.49Å; L677-L679 HydrophobicContact CG-CD1 3.93Å; L677-L679 HydrophobicContact CG-CG 4.09Å; L679-N682 VanDerWaalsContact C-ND2 3.32Å; L679-N682 PolarHBondContact O-ND2 2.97Å; L679-N682 VanDerWaalsContact O-ND2 3.12Å; L679-I684 HydrophobicContact CB-CD1 4.5Å; L679-I684 HydrophobicContact CD2-CD1 4.47Å; L679-L702 HydrophobicContact CD1-CD1 4.26Å; L679-I703 PolarHBondContact N-O 3.47Å; L679-I704 HydrophobicContact CB-CB 4.29Å; L679-I704 HydrophobicContact CB-CD1 4.32Å; L679-I704 HydrophobicContact CB-CG1 3.95Å; L679-I704 HydrophobicContact CD1-CD1 3.98Å; L679-I704 HydrophobicContact CD1-CG1 4.45Å; L679-N707 PolarHBondContact O-ND2 3.18Å
680	R	91.2	Very high	83.8	Confident	74 Å²	74	45 Å²	45	28%	0.279	23%	0.225	S	C	.	.			trans	-68.4	154.1	-172.5	-68.6	-172.7	170.4	97.8	2.7	112.9	S659 S660 I678 N682 I703 D705	S659-R680 CarbonylContact C-O 3.45Å; S659-R680 WeakPolarHBondContact CA-O 3.25Å; S659-R680 WeakPolarHBondContact CB-O 3.39Å; S659-R680 PolarHBondContact OG-N 3.42Å; S659-R680 VanDerWaalsContact OG-N 3.1Å; S660-R680 PolarHBondContact N-O 2.87Å; I678-R680 HydrophobicContact CG2-CG 4.14Å; R680-N682 VanDerWaalsContact C-N 3.28Å; R680-N682 PolarHBondContact O-N 3.3Å; R680-N682 PolarHBondContact O-ND2 3.05Å; R680-I703 HydrophobicContact CG-CG2 4.01Å; R680-D705 WeakPolarHBondContact CA-O 3.49Å; R680-D705 IonicContact CZ-OD1 3.8Å; R680-D705 IonicContact CZ-OD2 3.96Å; R680-D705 VanDerWaalsContact NE-CG 3.33Å; R680-D705 IonicContact NE-OD1 3.37Å; R680-D705 PolarHBondContact NE-OD1 3.42Å; R680-D705 IonicContact NE-OD2 2.57Å; R680-D705 PolarHBondContact NE-OD2 2.96Å; R680-D705 IonicContact NH2-OD1 3.8Å; R680-D705 IonicContact NH2-OD2 2.96Å
681	N	91.1	Very high	83.1	Confident	101 Å²	101	45.3 Å²	45.3	54%	0.54	23%	0.228	S	C	.	.	S	Bend	trans	53.6	45.6	168	-56.4	-9.2	0	0	0	112.5	S660 D705 G706	S660-N681 WeakPolarHBondContact CA-O 3.17Å; N681-D705 PolarHBondContact N-O 2.96Å; N681-G706 WeakPolarHBondContact CA-O 3.29Å; N681-G706 PolarHBondContact N-O 2.92Å
682	N	91.5	Very high	82.7	Confident	4 Å²	4	45 Å²	45	2%	0.021	23%	0.227	C	C	.	.			trans	-116.6	177.8	175.5	-74.7	-58	0	0	0	109.5	C658 L661 E662 L663 L679 R680 I684 N707	C658-N682 PolarHBondContact O-ND2 3.47Å; L661-N682 WeakPolarHBondContact CA-OD1 3.49Å; L661-N682 PolarHBondContact N-OD1 3.38Å; E662-N682 PolarHBondContact N-OD1 2.84Å; E662-N682 VanDerWaalsContact N-OD1 3.1Å; L663-N682 HydrophobicContact CB-CB 4.1Å; L663-N682 PolarHBondContact N-OD1 3.23Å; L663-N682 VanDerWaalsContact N-OD1 3.14Å; L679-N682 VanDerWaalsContact C-ND2 3.32Å; L679-N682 PolarHBondContact O-ND2 2.97Å; L679-N682 VanDerWaalsContact O-ND2 3.12Å; R680-N682 VanDerWaalsContact C-N 3.28Å; R680-N682 PolarHBondContact O-N 3.3Å; R680-N682 PolarHBondContact O-ND2 3.05Å; N682-I684 HydrophobicContact CB-CD1 4.41Å; N682-I684 HydrophobicContact CB-CG1 4.22Å; N682-N707 WeakPolarHBondContact CA-OD1 3.47Å; N682-N707 VanDerWaalsContact CB-OD1 3.25Å; N682-N707 WeakPolarHBondContact CB-OD1 3.06Å; N682-N707 WeakPolarHBondContact O-CA 3.31Å; N682-N707 PolarHBondContact O-OD1 3.22Å; N682-N707 VanDerWaalsContact O-OD1 3.12Å
683	L	91.2	Very high	83.1	Confident	68 Å²	68	43.2 Å²	43.2	36%	0.356	22%	0.218	S	C	.	.			trans	-100.9	27.5	-173.3	-58.3	178.9	0	0	0	112.7	E662 L663 T664 K685	E662-L683 HydrophobicContact CB-CD1 4.19Å; L663-L683 CarbonylContact O-C 3.54Å; L663-L683 VanDerWaalsContact O-C 3.32Å; L663-L683 WeakPolarHBondContact O-CA 3.43Å; L663-L683 PolarHBondContact O-N 3.47Å; T664-L683 HydrophobicContact CG2-CB 4.16Å; L683-K685 PolarHBondContact O-N 3.16Å
684	I	91.5	Very high	83.1	Confident	2 Å²	2	43 Å²	43	1%	0.01	22%	0.219	C	C	.	.			trans	-74.5	121	-174.5	-53.6	175.1	0	0	0	109.8	L663 I666 L679 N682 I704 N707 E708 I709	L663-I684 VanDerWaalsContact O-CG1 3.25Å; L663-I684 WeakPolarHBondContact O-CG1 3.34Å; L663-I684 PolarHBondContact O-N 2.89Å; I666-I684 HydrophobicContact CG1-CD1 4Å; L679-I684 HydrophobicContact CB-CD1 4.5Å; L679-I684 HydrophobicContact CD2-CD1 4.47Å; N682-I684 HydrophobicContact CB-CD1 4.41Å; N682-I684 HydrophobicContact CB-CG1 4.22Å; I684-I704 HydrophobicContact CD1-CD1 3.89Å; I684-I704 HydrophobicContact CD1-CG1 4.44Å; I684-I704 HydrophobicContact CG2-CD1 4.47Å; I684-N707 HydrophobicContact CB-CB 4.43Å; I684-N707 WeakPolarHBondContact CB-OD1 3.21Å; I684-N707 WeakPolarHBondContact CG1-OD1 3.42Å; I684-N707 PolarHBondContact N-OD1 2.79Å; I684-E708 CarbonylContact O-C 3.53Å; I684-E708 VanDerWaalsContact O-C 3.28Å; I684-E708 PolarHBondContact O-N 2.88Å; I684-E708 VanDerWaalsContact O-N 3.11Å; I684-I709 HydrophobicContact CG2-CG1 4.43Å; I684-I709 WeakPolarHBondContact O-CG1 3.42Å; I684-I709 PolarHBondContact O-N 2.92Å; I684-I709 VanDerWaalsContact O-N 3.15Å
685	K	87.5	Confident	82.6	Confident	111 Å²	111	47 Å²	47	48%	0.483	24%	0.236	S	C	.	.			trans	-100.2	-18.9	-173.4	-64.8	175.7	-172.6	-81	0	115	L683 E708 I709 E710	L683-K685 PolarHBondContact O-N 3.16Å; K685-E708 HydrophobicContact CG-CB 4.04Å; K685-E708 IonicContact NZ-OE2 3.51Å; K685-E708 PolarHBondContact NZ-OE2 3.41Å; K685-I709 WeakPolarHBondContact O-CA 3.48Å; K685-E710 PolarHBondContact O-N 2.75Å
686	S	86.4	Confident	82.6	Confident	62 Å²	62	44.1 Å²	44.1	43%	0.434	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	156	-179.4	57.9	0	0	0	0	112.2	H711	S686-H711 WeakPolarHBondContact CA-O 3.35Å
687	I	87.5	Confident	82	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.6	169.2	-57.3	177.7	0	0	0	109	L693 I704 I709 H711 I712 E713 S716 F717 L728	I687-L693 HydrophobicContact CG2-CD1 3.84Å; I687-I704 HydrophobicContact CD1-CD1 4.37Å; I687-I709 HydrophobicContact CD1-CD1 3.98Å; I687-I709 HydrophobicContact CG1-CD1 4.12Å; I687-H711 PolarHBondContact N-O 2.93Å; I687-I712 HydrophobicContact CB-CG1 4.33Å; I687-I712 HydrophobicContact CB-CG2 4.17Å; I687-I712 HydrophobicContact CD1-CD1 4.48Å; I687-I712 HydrophobicContact CD1-CG1 4.37Å; I687-E713 PolarHBondContact O-N 3.5Å; I687-S716 PolarHBondContact O-OG 3.04Å; I687-S716 VanDerWaalsContact O-OG 3.05Å; I687-F717 HydrophobicContact CD1-CZ 4.19Å; I687-F717 HydrophobicContact CG2-CZ 4.5Å; I687-L728 HydrophobicContact CD1-CD2 4.07Å
688	T	82.6	Confident	81.4	Confident	55 Å²	55	49.7 Å²	49.7	34%	0.337	25%	0.253	S	S	.	.			trans	-102.1	165.4	-179.6	59	0	0	0	0	112.5	E690 S691 E713 S716	T688-E690 VanDerWaalsContact C-N 3.25Å; T688-E690 PolarHBondContact O-N 2.85Å; T688-S691 WeakPolarHBondContact O-CB 3.35Å; T688-S691 PolarHBondContact O-N 2.97Å; T688-S691 PolarHBondContact O-OG 3.11Å; T688-E713 VanDerWaalsContact CA-OE2 3.25Å; T688-E713 WeakPolarHBondContact CA-OE2 3.28Å; T688-E713 WeakPolarHBondContact CB-OE2 3.02Å; T688-S716 VanDerWaalsContact C-OG 3.29Å
689	I	71.5	Confident	81.2	Confident	72 Å²	72	49 Å²	49	37%	0.369	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-33.9	174.5	-64.5	168.6	0	0	0	111.6	S691 E713 S716	I689-S691 VanDerWaalsContact C-N 3.31Å; I689-S691 PolarHBondContact O-N 2.67Å; I689-E713 HydrophobicContact CD1-CG 4.16Å; I689-E713 WeakPolarHBondContact CD1-OE1 3.14Å; I689-E713 HydrophobicContact CG1-CG 4.14Å; I689-E713 WeakPolarHBondContact CG1-OE2 3.45Å; I689-E713 PolarHBondContact N-OE2 3.12Å; I689-S716 PolarHBondContact N-OG 2.69Å
690	E	64.6	Low	81	Confident	175 Å²	175	51.2 Å²	51.2	82%	0.818	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.4	-178	-60.3	-170.7	150.6	0	0	113.6	T688	T688-E690 VanDerWaalsContact C-N 3.25Å; T688-E690 PolarHBondContact O-N 2.85Å
691	S	63.6	Low	81	Confident	19 Å²	19	48.8 Å²	48.8	13%	0.133	25%	0.253	C	S	.	.	S	Bend	trans	-57	151.6	-179.5	67.6	0	0	0	0	113.5	T688 I689 L693 S694	T688-S691 WeakPolarHBondContact O-CB 3.35Å; T688-S691 PolarHBondContact O-N 2.97Å; T688-S691 PolarHBondContact O-OG 3.11Å; I689-S691 VanDerWaalsContact C-N 3.31Å; I689-S691 PolarHBondContact O-N 2.67Å; S691-L693 PolarHBondContact O-N 3.18Å; S691-S694 WeakPolarHBondContact O-CB 3.23Å; S691-S694 PolarHBondContact O-N 3.32Å; S691-S694 PolarHBondContact O-OG 3.31Å
692	G	66.1	Low	81.2	Confident	3 Å²	3	44 Å²	44	3%	0.031	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-54.9	-18.5	-177.2	0	0	0	0	0	115.5	D668 S694 K695	D668-G692 VanDerWaalsContact OD1-CA 3.29Å; D668-G692 WeakPolarHBondContact OD1-CA 3.47Å; G692-S694 PolarHBondContact O-N 3.09Å; G692-K695 WeakPolarHBondContact O-CB 3.46Å; G692-K695 PolarHBondContact O-N 3.42Å
693	L	77.2	Confident	81.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-51.6	-36.9	169	-68.5	177.6	0	0	0	112.8	I666 L677 I687 S691 K695 L696 L699 L702 F717 N720	I666-L693 HydrophobicContact CD1-CD1 3.59Å; I666-L693 HydrophobicContact CD1-CD2 4.29Å; I666-L693 HydrophobicContact CD1-CG 3.68Å; I666-L693 HydrophobicContact CG2-CG 4.43Å; L677-L693 HydrophobicContact CD2-CD2 3.98Å; I687-L693 HydrophobicContact CG2-CD1 3.84Å; S691-L693 PolarHBondContact O-N 3.18Å; L693-K695 PolarHBondContact O-N 3.42Å; L693-L696 PolarHBondContact O-N 2.75Å; L693-L699 HydrophobicContact CD2-CD2 4.14Å; L693-L702 HydrophobicContact CD1-CD2 3.95Å; L693-L702 HydrophobicContact CD2-CD1 4.02Å; L693-L702 HydrophobicContact CD2-CD2 3.78Å; L693-F717 HydrophobicContact CD1-CE1 4.07Å; L693-N720 PolarHBondContact O-ND2 3Å
694	S	70.8	Confident	81.4	Confident	28 Å²	28	40.8 Å²	40.8	20%	0.196	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-56.1	-25.2	-177.6	62.8	0	0	0	0	113.9	S691 G692 N719	S691-S694 WeakPolarHBondContact O-CB 3.23Å; S691-S694 PolarHBondContact O-N 3.32Å; S691-S694 PolarHBondContact O-OG 3.31Å; G692-S694 PolarHBondContact O-N 3.09Å; S694-N719 WeakPolarHBondContact O-CB 3.25Å; S694-N719 PolarHBondContact O-ND2 2.88Å
695	K	71.2	Confident	81.3	Confident	85 Å²	85	41.7 Å²	41.7	37%	0.37	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-82.5	-28.8	177.8	-59.5	160.1	-179.6	164.4	0	112.6	D668 G692 L693 K697	D668-K695 PolarHBondContact O-NZ 3.3Å; D668-K695 IonicContact OD1-NZ 2.69Å; D668-K695 PolarHBondContact OD1-NZ 3.03Å; D668-K695 IonicContact OD2-NZ 3.59Å; D668-K695 PolarHBondContact OD2-NZ 3.28Å; G692-K695 WeakPolarHBondContact O-CB 3.46Å; G692-K695 PolarHBondContact O-N 3.42Å; L693-K695 PolarHBondContact O-N 3.42Å; K695-K697 PolarHBondContact O-N 2.82Å
696	L	82	Confident	81.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.203	C	C	.	.			trans	-83.7	67.4	-167.8	-58.1	-178.1	0	0	0	113.6	L670 P671 L677 L693 S698 L699 N720	L670-L696 HydrophobicContact CB-CD1 4.2Å; L670-L696 HydrophobicContact CB-CD2 4.12Å; L670-L696 HydrophobicContact CD1-CD1 4.01Å; P671-L696 WeakPolarHBondContact O-CD2 3.43Å; L677-L696 HydrophobicContact CD2-CD1 3.89Å; L693-L696 PolarHBondContact O-N 2.75Å; L696-S698 PolarHBondContact O-N 2.8Å; L696-L699 HydrophobicContact CB-CB 4.18Å; L696-L699 HydrophobicContact CB-CD2 4.38Å; L696-L699 HydrophobicContact CD1-CD2 4.36Å; L696-L699 WeakPolarHBondContact O-CB 3.05Å; L696-L699 PolarHBondContact O-N 2.87Å; L696-N720 PolarHBondContact O-ND2 3.1Å
697	K	77.1	Confident	81.8	Confident	125 Å²	125	34.9 Å²	34.9	54%	0.543	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.7	177.5	-65.1	168.9	-174.1	165.6	0	113.5	K695 L699 N722	K695-K697 PolarHBondContact O-N 2.82Å; K697-L699 VanDerWaalsContact C-N 3.34Å; K697-N722 PolarHBondContact O-ND2 3.49Å
698	S	80.4	Confident	81.9	Confident	42 Å²	42	38.4 Å²	38.4	29%	0.294	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-10	-178.6	-50.5	0	0	0	0	114.4	I672 T674 L696 E700	I672-S698 VanDerWaalsContact O-CB 3.22Å; I672-S698 WeakPolarHBondContact O-CB 3.48Å; I672-S698 PolarHBondContact O-OG 2.61Å; T674-S698 CarbonylContact O-C 3.47Å; T674-S698 WeakPolarHBondContact O-CB 3.41Å; L696-S698 PolarHBondContact O-N 2.8Å; S698-E700 PolarHBondContact O-N 2.99Å
699	L	87.2	Confident	82.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.			trans	-67.8	121.6	-166.8	-164.7	61.5	0	0	0	112	T674 L677 L693 L696 K697 T701 L702 N722 I723	T674-L699 HydrophobicContact CG2-CD1 3.99Å; T674-L699 WeakPolarHBondContact O-CA 3.44Å; T674-L699 PolarHBondContact O-N 2.98Å; L677-L699 HydrophobicContact CB-CD1 3.76Å; L693-L699 HydrophobicContact CD2-CD2 4.14Å; L696-L699 HydrophobicContact CB-CB 4.18Å; L696-L699 HydrophobicContact CB-CD2 4.38Å; L696-L699 HydrophobicContact CD1-CD2 4.36Å; L696-L699 WeakPolarHBondContact O-CB 3.05Å; L696-L699 PolarHBondContact O-N 2.87Å; K697-L699 VanDerWaalsContact C-N 3.34Å; L699-T701 WeakPolarHBondContact CD1-O 3.3Å; L699-L702 HydrophobicContact CD2-CB 4.15Å; L699-L702 HydrophobicContact CD2-CD1 4.4Å; L699-N722 CarbonylContact O-C 3.59Å; L699-I723 HydrophobicContact CB-CG1 4.24Å; L699-I723 HydrophobicContact CD2-CD1 4.07Å; L699-I723 HydrophobicContact CD2-CG1 4.4Å; L699-I723 HydrophobicContact CG-CD1 4.42Å; L699-I723 HydrophobicContact CG-CG1 4.2Å; L699-I723 WeakPolarHBondContact O-CA 3.46Å; L699-I723 WeakPolarHBondContact O-CG1 3.46Å; L699-I723 PolarHBondContact O-N 3.49Å; L699-I723 VanDerWaalsContact O-N 3.09Å
700	E	89.3	Confident	83.3	Confident	48 Å²	48	38.1 Å²	38.1	22%	0.224	19%	0.194	C	C	.	.	S	Bend	trans	-103.6	-27.9	177.3	-62.7	-167.6	-140.4	0	0	112.4	K675 S698 K724 K725	K675-E700 WeakPolarHBondContact CD-OE1 3.35Å; K675-E700 WeakPolarHBondContact CE-OE1 3.39Å; K675-E700 HydrophobicContact CG-CG 4.33Å; K675-E700 IonicContact NZ-OE1 2.7Å; K675-E700 PolarHBondContact NZ-OE1 3.11Å; K675-E700 CarbonylContact O-C 3.54Å; K675-E700 WeakPolarHBondContact O-CA 3.43Å; K675-E700 PolarHBondContact O-N 2.02Å; S698-E700 PolarHBondContact O-N 2.99Å; E700-K724 PolarHBondContact O-N 2.94Å; E700-K724 WeakPolarHBondContact OE2-CE 3.41Å; E700-K724 IonicContact OE2-NZ 3.37Å; E700-K724 PolarHBondContact OE2-NZ 2.84Å; E700-K725 PolarHBondContact O-N 2.75Å
701	T	91.6	Very high	84.2	Confident	23 Å²	23	32.6 Å²	32.6	14%	0.141	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.3	179.5	-66.6	0	0	0	0	110.5	K675 E676 L677 L699 I703 K725	K675-T701 PolarHBondContact O-N 3.2Å; E676-T701 WeakPolarHBondContact CA-O 3.39Å; E676-T701 HydrophobicContact CG-CG2 3.91Å; L677-T701 PolarHBondContact N-O 3.4Å; L699-T701 WeakPolarHBondContact CD1-O 3.3Å; T701-I703 HydrophobicContact CG2-CD1 3.78Å; T701-I703 HydrophobicContact CG2-CG1 3.69Å; T701-K725 WeakPolarHBondContact CA-O 3.44Å; T701-K725 HydrophobicContact CG2-CB 4.22Å; T701-K725 HydrophobicContact CG2-CD 3.84Å; T701-K725 HydrophobicContact CG2-CG 4.21Å
702	L	94.2	Very high	85.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.7	171.1	178.6	58.1	0	0	0	109.9	L677 L679 L693 L699 F717 I723 K725 L726 I727	L677-L702 HydrophobicContact CB-CD1 4.02Å; L677-L702 HydrophobicContact CD2-CD1 3.9Å; L677-L702 HydrophobicContact CG-CD1 4.05Å; L679-L702 HydrophobicContact CD1-CD1 4.26Å; L693-L702 HydrophobicContact CD1-CD2 3.95Å; L693-L702 HydrophobicContact CD2-CD1 4.02Å; L693-L702 HydrophobicContact CD2-CD2 3.78Å; L699-L702 HydrophobicContact CD2-CB 4.15Å; L699-L702 HydrophobicContact CD2-CD1 4.4Å; L702-F717 HydrophobicContact CD2-CE1 3.98Å; L702-I723 HydrophobicContact CB-CD1 4.33Å; L702-K725 PolarHBondContact N-O 2.85Å; L702-L726 HydrophobicContact CB-CD1 3.88Å; L702-L726 HydrophobicContact CD2-CD1 3.76Å; L702-L726 HydrophobicContact CG-CD1 3.84Å; L702-L726 WeakPolarHBondContact O-CA 3.16Å; L702-I727 PolarHBondContact O-N 2.03Å
703	I	94.5	Very high	86.4	Confident	4 Å²	4	35 Å²	35	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	111.1	-174.2	-62.5	-178.1	0	0	0	108	L677 I678 L679 R680 T701 D705 I727	L677-I703 PolarHBondContact O-N 2.92Å; I678-I703 CarbonylContact C-O 3.58Å; I678-I703 WeakPolarHBondContact CA-O 3.36Å; I678-I703 HydrophobicContact CB-CB 4.46Å; I678-I703 HydrophobicContact CG1-CD1 4.34Å; I678-I703 HydrophobicContact CG2-CB 4.13Å; I678-I703 HydrophobicContact CG2-CG2 3.84Å; L679-I703 PolarHBondContact N-O 3.47Å; R680-I703 HydrophobicContact CG-CG2 4.01Å; T701-I703 HydrophobicContact CG2-CD1 3.78Å; T701-I703 HydrophobicContact CG2-CG1 3.69Å; I703-D705 WeakPolarHBondContact CG2-OD1 3.48Å; I703-I727 HydrophobicContact CD1-CD1 4.25Å; I703-I727 HydrophobicContact CG1-CD1 3.98Å; I703-I727 HydrophobicContact CG1-CG1 4.14Å; I703-I727 HydrophobicContact CG2-CD1 4.25Å
704	I	93.5	Very high	86.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.			trans	-138.2	31.9	-176.1	-164.9	165.2	0	0	0	111	I666 L679 I684 I687 N707 I709 I727 L728 N731	I666-I704 HydrophobicContact CD1-CD1 4.2Å; I666-I704 HydrophobicContact CG1-CD1 4.5Å; L679-I704 HydrophobicContact CB-CB 4.29Å; L679-I704 HydrophobicContact CB-CD1 4.32Å; L679-I704 HydrophobicContact CB-CG1 3.95Å; L679-I704 HydrophobicContact CD1-CD1 3.98Å; L679-I704 HydrophobicContact CD1-CG1 4.45Å; I684-I704 HydrophobicContact CD1-CD1 3.89Å; I684-I704 HydrophobicContact CD1-CG1 4.44Å; I684-I704 HydrophobicContact CG2-CD1 4.47Å; I687-I704 HydrophobicContact CD1-CD1 4.37Å; I704-N707 HydrophobicContact CG1-CB 4.48Å; I704-N707 PolarHBondContact O-ND2 3.37Å; I704-I709 HydrophobicContact CD1-CD1 3.85Å; I704-I709 HydrophobicContact CG1-CD1 3.94Å; I704-I709 HydrophobicContact CG2-CD1 4.17Å; I704-I727 VanDerWaalsContact CG2-O 3.31Å; I704-I727 WeakPolarHBondContact CG2-O 3.48Å; I704-I727 PolarHBondContact N-O 2.86Å; I704-L728 HydrophobicContact CG2-CD2 3.58Å; I704-L728 HydrophobicContact CG2-CG 4.18Å; I704-N731 PolarHBondContact O-ND2 3.49Å; I704-N731 VanDerWaalsContact O-ND2 3.1Å
705	D	89.7	Confident	86.9	Confident	21 Å²	21	37.9 Å²	37.9	11%	0.112	19%	0.19	C	C	.	.			trans	-69.5	146.5	175.4	45.4	-61.6	0	0	0	113.6	R680 N681 I703 I727 S729	R680-D705 WeakPolarHBondContact CA-O 3.49Å; R680-D705 IonicContact CZ-OD1 3.8Å; R680-D705 IonicContact CZ-OD2 3.96Å; R680-D705 VanDerWaalsContact NE-CG 3.33Å; R680-D705 IonicContact NE-OD1 3.37Å; R680-D705 PolarHBondContact NE-OD1 3.42Å; R680-D705 IonicContact NE-OD2 2.57Å; R680-D705 PolarHBondContact NE-OD2 2.96Å; R680-D705 IonicContact NH2-OD1 3.8Å; R680-D705 IonicContact NH2-OD2 2.96Å; N681-D705 PolarHBondContact N-O 2.96Å; I703-D705 WeakPolarHBondContact CG2-OD1 3.48Å; D705-I727 HydrophobicContact CB-CG2 3.81Å; D705-I727 WeakPolarHBondContact OD1-CG2 3.47Å; D705-S729 WeakPolarHBondContact CA-O 3.48Å; D705-S729 VanDerWaalsContact CB-O 3.26Å; D705-S729 WeakPolarHBondContact CB-O 3.17Å
706	G	89.9	Confident	87.5	Confident	22 Å²	22	34.1 Å²	34.1	23%	0.227	17%	0.174	C	C	.	.	S	Bend	trans	78.4	32.6	-178.6	0	0	0	0	0	113.9	N681 S729 N730	N681-G706 WeakPolarHBondContact CA-O 3.29Å; N681-G706 PolarHBondContact N-O 2.92Å; G706-S729 PolarHBondContact N-O 3.37Å; G706-N730 WeakPolarHBondContact CA-O 3.48Å; G706-N730 PolarHBondContact N-O 2.93Å; G706-N730 VanDerWaalsContact N-O 3.08Å
707	N	92.6	Very high	87.7	Confident	8 Å²	8	34 Å²	34	4%	0.043	17%	0.174	C	C	.	.	S	Bend	trans	-110.3	176.9	176.1	-79.2	-98.3	0	0	0	110.6	L679 N682 I684 I704 I709 N730 N731	L679-N707 PolarHBondContact O-ND2 3.18Å; N682-N707 WeakPolarHBondContact CA-OD1 3.47Å; N682-N707 VanDerWaalsContact CB-OD1 3.25Å; N682-N707 WeakPolarHBondContact CB-OD1 3.06Å; N682-N707 WeakPolarHBondContact O-CA 3.31Å; N682-N707 PolarHBondContact O-OD1 3.22Å; N682-N707 VanDerWaalsContact O-OD1 3.12Å; I684-N707 HydrophobicContact CB-CB 4.43Å; I684-N707 WeakPolarHBondContact CB-OD1 3.21Å; I684-N707 WeakPolarHBondContact CG1-OD1 3.42Å; I684-N707 PolarHBondContact N-OD1 2.79Å; I704-N707 HydrophobicContact CG1-CB 4.48Å; I704-N707 PolarHBondContact O-ND2 3.37Å; N707-I709 HydrophobicContact CB-CD1 4.22Å; N707-I709 HydrophobicContact CB-CG1 3.98Å; N707-N730 PolarHBondContact N-O 3Å; N707-N731 VanDerWaalsContact CB-OD1 3.27Å; N707-N731 WeakPolarHBondContact CB-OD1 3.31Å; N707-N731 WeakPolarHBondContact O-CA 3.39Å; N707-N731 PolarHBondContact O-OD1 2.94Å
708	E	91.3	Very high	87.7	Confident	76 Å²	76	35.7 Å²	35.7	36%	0.355	18%	0.177	S	C	.	.			trans	-94.8	24.3	179.5	-63.2	-168.1	175.9	0	0	113.2	I684 K685 E710	I684-E708 CarbonylContact O-C 3.53Å; I684-E708 VanDerWaalsContact O-C 3.28Å; I684-E708 PolarHBondContact O-N 2.88Å; I684-E708 VanDerWaalsContact O-N 3.11Å; K685-E708 HydrophobicContact CG-CB 4.04Å; K685-E708 IonicContact NZ-OE2 3.51Å; K685-E708 PolarHBondContact NZ-OE2 3.41Å; E708-E710 PolarHBondContact O-N 3.45Å
709	I	93.8	Very high	87.3	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.			trans	-66.5	113.5	-167.3	-55.4	168.3	0	0	0	111.1	I684 K685 I687 I704 N707 H711 I712 L728 N731 S732 L733	I684-I709 HydrophobicContact CG2-CG1 4.43Å; I684-I709 WeakPolarHBondContact O-CG1 3.42Å; I684-I709 PolarHBondContact O-N 2.92Å; I684-I709 VanDerWaalsContact O-N 3.15Å; K685-I709 WeakPolarHBondContact O-CA 3.48Å; I687-I709 HydrophobicContact CD1-CD1 3.98Å; I687-I709 HydrophobicContact CG1-CD1 4.12Å; I704-I709 HydrophobicContact CD1-CD1 3.85Å; I704-I709 HydrophobicContact CG1-CD1 3.94Å; I704-I709 HydrophobicContact CG2-CD1 4.17Å; N707-I709 HydrophobicContact CB-CD1 4.22Å; N707-I709 HydrophobicContact CB-CG1 3.98Å; I709-H711 WeakPolarHBondContact CG2-O 3.48Å; I709-I712 HydrophobicContact CG2-CG1 4.08Å; I709-L728 HydrophobicContact CD1-CD2 3.97Å; I709-N731 HydrophobicContact CB-CB 4.49Å; I709-N731 WeakPolarHBondContact CB-OD1 3.45Å; I709-N731 WeakPolarHBondContact CD1-OD1 3.38Å; I709-N731 WeakPolarHBondContact CG1-OD1 3.43Å; I709-N731 PolarHBondContact N-OD1 3.09Å; I709-S732 CarbonylContact O-C 3.33Å; I709-S732 VanDerWaalsContact O-CA 3.32Å; I709-S732 WeakPolarHBondContact O-CA 3.3Å; I709-S732 WeakPolarHBondContact O-CB 3.35Å; I709-S732 PolarHBondContact O-N 3.38Å; I709-L733 HydrophobicContact CB-CD2 4.42Å; I709-L733 HydrophobicContact CG2-CD2 3.74Å; I709-L733 PolarHBondContact O-N 3.03Å
710	E	89.5	Confident	86.8	Confident	120 Å²	120	37.3 Å²	37.3	56%	0.561	18%	0.182	S	C	*	.			trans	-92.3	-32.4	177.2	-65.4	-171.7	-173.5	0	0	112.7	K685 E708	K685-E710 PolarHBondContact O-N 2.75Å; E708-E710 PolarHBondContact O-N 3.45Å
711	H	83.7	Confident	85.9	Confident	59 Å²	59	38.8 Å²	38.8	27%	0.273	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.9	-174.6	-173.2	-102.2	0	0	0	112.9	S686 I687 I709 Y735 E737	S686-H711 WeakPolarHBondContact CA-O 3.35Å; I687-H711 PolarHBondContact N-O 2.93Å; I709-H711 WeakPolarHBondContact CG2-O 3.48Å; H711-Y735 AromaticContact CD2-CE2 3.99Å; H711-Y735 AromaticContact CD2-CZ 3.62Å; H711-Y735 PolarHBondContact CD2-OH 2.87Å; H711-Y735 AromaticContact NE2-CZ 3.96Å; H711-Y735 PolarHBondContact NE2-OH 2.96Å; H711-E737 IonicContact CD2-OE1 2.73Å; H711-E737 IonicContact CE1-OE1 3.56Å; H711-E737 IonicContact NE2-OE1 2.67Å; H711-E737 PolarHBondContact NE2-OE1 3.43Å
712	I	89.7	Confident	85.4	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.2	171.8	-58.7	171	0	0	0	107.1	I687 I709 F717 L728 L733 T740	I687-I712 HydrophobicContact CB-CG1 4.33Å; I687-I712 HydrophobicContact CB-CG2 4.17Å; I687-I712 HydrophobicContact CD1-CD1 4.48Å; I687-I712 HydrophobicContact CD1-CG1 4.37Å; I709-I712 HydrophobicContact CG2-CG1 4.08Å; I712-F717 HydrophobicContact CG2-CE2 3.93Å; I712-F717 HydrophobicContact CG2-CZ 4.41Å; I712-L728 HydrophobicContact CD1-CD1 3.7Å; I712-L728 HydrophobicContact CD1-CD2 3.95Å; I712-L728 HydrophobicContact CD1-CG 4.5Å; I712-L733 HydrophobicContact CD1-CD1 4.11Å; I712-L733 HydrophobicContact CD1-CD2 3.99Å; I712-L733 HydrophobicContact CG1-CD2 3.89Å; I712-T740 HydrophobicContact CB-CG2 3.79Å; I712-T740 HydrophobicContact CD1-CG2 4.42Å; I712-T740 HydrophobicContact CG2-CG2 3.59Å
713	E	85.3	Confident	85.2	Confident	68 Å²	68	41.1 Å²	41.1	32%	0.318	20%	0.203	S	C	.	.			trans	-63.2	139.8	-177.5	-168.1	-177.6	-176.7	0	0	111.5	I687 T688 I689 M715 S716	I687-E713 PolarHBondContact O-N 3.5Å; T688-E713 VanDerWaalsContact CA-OE2 3.25Å; T688-E713 WeakPolarHBondContact CA-OE2 3.28Å; T688-E713 WeakPolarHBondContact CB-OE2 3.02Å; I689-E713 HydrophobicContact CD1-CG 4.16Å; I689-E713 WeakPolarHBondContact CD1-OE1 3.14Å; I689-E713 HydrophobicContact CG1-CG 4.14Å; I689-E713 WeakPolarHBondContact CG1-OE2 3.45Å; I689-E713 PolarHBondContact N-OE2 3.12Å; E713-M715 PolarHBondContact O-N 3.41Å; E713-S716 WeakPolarHBondContact CB-OG 3.37Å; E713-S716 PolarHBondContact O-N 2.74Å; E713-S716 PolarHBondContact O-OG 3.1Å
714	P	79	Confident	85	Confident	28 Å²	28	45.2 Å²	45.2	18%	0.182	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	129.9	174.7	-25.4	34.1	0	0	0	111.5	E737	P714-E737 HydrophobicContact CG-CB 4.13Å; P714-E737 HydrophobicContact CG-CG 4.43Å; P714-E737 WeakPolarHBondContact CG-OE2 3.44Å
715	M	80.4	Confident	85	Confident	61 Å²	61	48.1 Å²	48.1	30%	0.3	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	11.2	-179.9	-43.5	-172.9	-79	0	0	117.1	E713 F717 R718 K739 N742	E713-M715 PolarHBondContact O-N 3.41Å; M715-F717 PolarHBondContact O-N 3.22Å; M715-F717 VanDerWaalsContact O-N 3.14Å; M715-R718 HydrophobicContact CB-CB 4.23Å; M715-R718 WeakPolarHBondContact O-CB 3.02Å; M715-R718 PolarHBondContact O-N 2.87Å; M715-K739 HydrophobicContact CG-CB 4.37Å; M715-K739 PolarHBondContact N-O 2.75Å; M715-N742 HydrophobicContact CG-CB 4.26Å
716	S	82.4	Confident	85.3	Confident	5 Å²	5	47.1 Å²	47.1	4%	0.035	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-36.6	173.5	-56.5	0	0	0	0	113.5	I687 T688 I689 E713 R718	I687-S716 PolarHBondContact O-OG 3.04Å; I687-S716 VanDerWaalsContact O-OG 3.05Å; T688-S716 VanDerWaalsContact C-OG 3.29Å; I689-S716 PolarHBondContact N-OG 2.69Å; E713-S716 WeakPolarHBondContact CB-OG 3.37Å; E713-S716 PolarHBondContact O-N 2.74Å; E713-S716 PolarHBondContact O-OG 3.1Å; S716-R718 VanDerWaalsContact C-N 3.31Å; S716-R718 PolarHBondContact O-N 3.44Å
717	F	86.6	Confident	85.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	10.9	179.9	-55.5	-65.8	0	0	0	115	I687 L693 L702 I712 M715 N719 N720 L726 F741 N742 L744	I687-F717 HydrophobicContact CD1-CZ 4.19Å; I687-F717 HydrophobicContact CG2-CZ 4.5Å; L693-F717 HydrophobicContact CD1-CE1 4.07Å; L702-F717 HydrophobicContact CD2-CE1 3.98Å; I712-F717 HydrophobicContact CG2-CE2 3.93Å; I712-F717 HydrophobicContact CG2-CZ 4.41Å; M715-F717 PolarHBondContact O-N 3.22Å; M715-F717 VanDerWaalsContact O-N 3.14Å; F717-N719 PolarHBondContact O-N 2.96Å; F717-N719 VanDerWaalsContact O-N 3.1Å; F717-N720 PolarHBondContact O-N 2.8Å; F717-L726 HydrophobicContact CE1-CD2 4.46Å; F717-L726 HydrophobicContact CE2-CD2 4.19Å; F717-L726 HydrophobicContact CZ-CD2 4.01Å; F717-F741 HydrophobicContact CD2-CD1 4.39Å; F717-F741 HydrophobicContact CE2-CD1 4.24Å; F717-F741 HydrophobicContact CE2-CE1 4.46Å; F717-N742 CarbonylContact C-O 3.43Å; F717-L744 HydrophobicContact CB-CD1 4.11Å; F717-L744 HydrophobicContact CB-CD2 3.78Å; F717-L744 HydrophobicContact CB-CG 3.76Å; F717-L744 HydrophobicContact CD2-CD1 3.88Å; F717-L744 HydrophobicContact CD2-CG 4.47Å; F717-L744 HydrophobicContact CG-CD1 4Å; F717-L744 HydrophobicContact CG-CD2 4.19Å; F717-L744 HydrophobicContact CG-CG 4.2Å
718	R	77.7	Confident	85.6	Confident	159 Å²	159	46.3 Å²	46.3	60%	0.6	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.5	-171	177.6	173.1	177.1	171.9	-3.4	114.4	M715 S716 N742	M715-R718 HydrophobicContact CB-CB 4.23Å; M715-R718 WeakPolarHBondContact O-CB 3.02Å; M715-R718 PolarHBondContact O-N 2.87Å; S716-R718 VanDerWaalsContact C-N 3.31Å; S716-R718 PolarHBondContact O-N 3.44Å; R718-N742 WeakPolarHBondContact CA-O 3.42Å; R718-N742 PolarHBondContact N-O 3.26Å
719	N	72.3	Confident	85.6	Confident	76 Å²	76	42.8 Å²	42.8	41%	0.406	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-18.6	-179.9	-68.6	-9.8	0	0	0	113.4	S694 F717 L721	S694-N719 WeakPolarHBondContact O-CB 3.25Å; S694-N719 PolarHBondContact O-ND2 2.88Å; F717-N719 PolarHBondContact O-N 2.96Å; F717-N719 VanDerWaalsContact O-N 3.1Å; N719-L721 PolarHBondContact O-N 3.01Å
720	N	75	Confident	85.6	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.			trans	-88.8	51	-170.2	-51.8	96.5	0	0	0	112.4	L693 L696 F717 N722 I723	L693-N720 PolarHBondContact O-ND2 3Å; L696-N720 PolarHBondContact O-ND2 3.1Å; F717-N720 PolarHBondContact O-N 2.8Å; N720-N722 PolarHBondContact O-N 3.31Å; N720-I723 HydrophobicContact CB-CD1 3.52Å; N720-I723 HydrophobicContact CB-CG1 3.95Å; N720-I723 PolarHBondContact O-N 2.87Å
721	L	70.4	Confident	85.8	Confident	79 Å²	79	40.7 Å²	40.7	41%	0.414	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-21.2	-174.2	-64.9	168.8	0	0	0	114.4	N719 K745 N746	N719-L721 PolarHBondContact O-N 3.01Å; L721-K745 HydrophobicContact CD2-CD 4.49Å; L721-N746 PolarHBondContact O-ND2 3.11Å
722	N	82.8	Confident	86.2	Confident	73 Å²	73	40 Å²	40	39%	0.39	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-5.2	-172.6	-68.5	-46.6	0	0	0	115.1	K697 L699 N720 K724	K697-N722 PolarHBondContact O-ND2 3.49Å; L699-N722 CarbonylContact O-C 3.59Å; N720-N722 PolarHBondContact O-N 3.31Å; N722-K724 PolarHBondContact O-N 2.92Å
723	I	89.5	Confident	86.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.			trans	-63.6	121.5	-179.2	-68.2	176.5	0	0	0	110	L699 L702 N720 L726 L744 N746 I747	L699-I723 HydrophobicContact CB-CG1 4.24Å; L699-I723 HydrophobicContact CD2-CD1 4.07Å; L699-I723 HydrophobicContact CD2-CG1 4.4Å; L699-I723 HydrophobicContact CG-CD1 4.42Å; L699-I723 HydrophobicContact CG-CG1 4.2Å; L699-I723 WeakPolarHBondContact O-CA 3.46Å; L699-I723 WeakPolarHBondContact O-CG1 3.46Å; L699-I723 PolarHBondContact O-N 3.49Å; L699-I723 VanDerWaalsContact O-N 3.09Å; L702-I723 HydrophobicContact CB-CD1 4.33Å; N720-I723 HydrophobicContact CB-CD1 3.52Å; N720-I723 HydrophobicContact CB-CG1 3.95Å; N720-I723 PolarHBondContact O-N 2.87Å; I723-L726 HydrophobicContact CG2-CB 4.37Å; I723-L744 HydrophobicContact CB-CD2 3.79Å; I723-L744 HydrophobicContact CD1-CD2 3.98Å; I723-L744 HydrophobicContact CG1-CD2 4.37Å; I723-L744 HydrophobicContact CG2-CD2 4.11Å; I723-N746 CarbonylContact O-C 3.56Å; I723-N746 VanDerWaalsContact O-C 3.28Å; I723-I747 VanDerWaalsContact O-CA 3.26Å; I723-I747 WeakPolarHBondContact O-CA 3.43Å; I723-I747 PolarHBondContact O-N 3.49Å; I723-I747 VanDerWaalsContact O-N 3.16Å
724	K	89.7	Confident	86.5	Confident	89 Å²	89	38.7 Å²	38.7	39%	0.387	19%	0.193	S	C	.	.			trans	-100.5	-25.7	175	-67	164.4	-170.4	169.5	0	112.1	E700 N722 E748 I749	E700-K724 PolarHBondContact O-N 2.94Å; E700-K724 WeakPolarHBondContact OE2-CE 3.41Å; E700-K724 IonicContact OE2-NZ 3.37Å; E700-K724 PolarHBondContact OE2-NZ 2.84Å; N722-K724 PolarHBondContact O-N 2.92Å; K724-E748 PolarHBondContact O-N 2.94Å; K724-I749 PolarHBondContact O-N 3.41Å
725	K	93.8	Very high	86.6	Confident	61 Å²	61	42.5 Å²	42.5	27%	0.265	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	122	-174.5	-179.7	-177.1	171.8	-147.6	0	110.5	E700 T701 L702 I749	E700-K725 PolarHBondContact O-N 2.75Å; T701-K725 WeakPolarHBondContact CA-O 3.44Å; T701-K725 HydrophobicContact CG2-CB 4.22Å; T701-K725 HydrophobicContact CG2-CD 3.84Å; T701-K725 HydrophobicContact CG2-CG 4.21Å; L702-K725 PolarHBondContact N-O 2.85Å; K725-I749 WeakPolarHBondContact CA-O 3.44Å; K725-I749 HydrophobicContact CB-CB 4.37Å; K725-I749 HydrophobicContact CG-CB 4.18Å; K725-I749 HydrophobicContact CG-CG2 4.28Å
726	L	95.1	Very high	86.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.7	175.7	-179.1	55.6	0	0	0	109.8	L702 F717 I723 L728 F741 L744 I747 I749 L750 L751	L702-L726 HydrophobicContact CB-CD1 3.88Å; L702-L726 HydrophobicContact CD2-CD1 3.76Å; L702-L726 HydrophobicContact CG-CD1 3.84Å; L702-L726 WeakPolarHBondContact O-CA 3.16Å; F717-L726 HydrophobicContact CE1-CD2 4.46Å; F717-L726 HydrophobicContact CE2-CD2 4.19Å; F717-L726 HydrophobicContact CZ-CD2 4.01Å; I723-L726 HydrophobicContact CG2-CB 4.37Å; L726-L728 HydrophobicContact CD1-CD1 4.25Å; L726-L728 HydrophobicContact CD1-CG 4.2Å; L726-L728 HydrophobicContact CD2-CD1 3.77Å; L726-L728 HydrophobicContact CG-CD1 3.89Å; L726-L728 HydrophobicContact CG-CG 4.18Å; L726-F741 HydrophobicContact CD2-CD1 4.34Å; L726-F741 HydrophobicContact CD2-CE1 4.2Å; L726-L744 HydrophobicContact CD2-CD1 3.92Å; L726-I747 HydrophobicContact CB-CD1 3.71Å; L726-I747 HydrophobicContact CD2-CD1 4.44Å; L726-I749 PolarHBondContact N-O 3.16Å; L726-L750 HydrophobicContact CB-CD1 4.04Å; L726-L750 HydrophobicContact CD2-CD1 3.92Å; L726-L750 HydrophobicContact CG-CD1 4.01Å; L726-L750 WeakPolarHBondContact O-CA 3.36Å; L726-L751 PolarHBondContact O-N 2.04Å
727	I	95.3	Very high	86.7	Confident	13 Å²	13	43.3 Å²	43.3	7%	0.067	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	113.6	173.2	-45.8	-172.4	0	0	0	109.3	L702 I703 I704 D705 S729 L751	L702-I727 PolarHBondContact O-N 2.03Å; I703-I727 HydrophobicContact CD1-CD1 4.25Å; I703-I727 HydrophobicContact CG1-CD1 3.98Å; I703-I727 HydrophobicContact CG1-CG1 4.14Å; I703-I727 HydrophobicContact CG2-CD1 4.25Å; I704-I727 VanDerWaalsContact CG2-O 3.31Å; I704-I727 WeakPolarHBondContact CG2-O 3.48Å; I704-I727 PolarHBondContact N-O 2.86Å; D705-I727 HydrophobicContact CB-CG2 3.81Å; D705-I727 WeakPolarHBondContact OD1-CG2 3.47Å; I727-S729 WeakPolarHBondContact CG2-OG 3.2Å; I727-L751 HydrophobicContact CD1-CD1 4.12Å; I727-L751 HydrophobicContact CG1-CD1 4.02Å; I727-L751 HydrophobicContact CG2-CB 4.07Å; I727-L751 HydrophobicContact CG2-CD1 4.27Å
728	L	94.6	Very high	86.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.222	C	C	.	.			trans	-121.4	26.8	176.9	-82.1	162.4	0	0	0	110.5	I687 I704 I709 I712 L726 F741 L751 L752 N755	I687-L728 HydrophobicContact CD1-CD2 4.07Å; I704-L728 HydrophobicContact CG2-CD2 3.58Å; I704-L728 HydrophobicContact CG2-CG 4.18Å; I709-L728 HydrophobicContact CD1-CD2 3.97Å; I712-L728 HydrophobicContact CD1-CD1 3.7Å; I712-L728 HydrophobicContact CD1-CD2 3.95Å; I712-L728 HydrophobicContact CD1-CG 4.5Å; L726-L728 HydrophobicContact CD1-CD1 4.25Å; L726-L728 HydrophobicContact CD1-CG 4.2Å; L726-L728 HydrophobicContact CD2-CD1 3.77Å; L726-L728 HydrophobicContact CG-CD1 3.89Å; L726-L728 HydrophobicContact CG-CG 4.18Å; L728-F741 HydrophobicContact CD1-CE1 4.15Å; L728-L751 CarbonylContact C-O 3.11Å; L728-L751 WeakPolarHBondContact CA-O 3.5Å; L728-L751 PolarHBondContact N-O 3.24Å; L728-L752 HydrophobicContact CB-CD2 3.73Å; L728-L752 HydrophobicContact CD1-CD2 4.1Å; L728-N755 PolarHBondContact O-ND2 2.87Å
729	S	91.8	Very high	86.2	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.021	22%	0.219	C	C	.	.			trans	-76.5	160.9	-175.9	-45.7	0	0	0	0	111.6	D705 G706 I727 N731 L751 Q753	D705-S729 WeakPolarHBondContact CA-O 3.48Å; D705-S729 VanDerWaalsContact CB-O 3.26Å; D705-S729 WeakPolarHBondContact CB-O 3.17Å; G706-S729 PolarHBondContact N-O 3.37Å; I727-S729 WeakPolarHBondContact CG2-OG 3.2Å; S729-N731 PolarHBondContact O-ND2 3.1Å; S729-L751 PolarHBondContact N-O 2.04Å; S729-L751 WeakPolarHBondContact OG-CB 3.37Å; S729-L751 PolarHBondContact OG-O 3.09Å; S729-Q753 CarbonylContact C-O 3.56Å; S729-Q753 WeakPolarHBondContact CA-O 3.5Å; S729-Q753 WeakPolarHBondContact CB-O 3.34Å; S729-Q753 PolarHBondContact OG-NE2 2.96Å; S729-Q753 PolarHBondContact OG-OE1 3.31Å
730	N	92.2	Very high	86.8	Confident	66 Å²	66	41.1 Å²	41.1	35%	0.353	20%	0.2	S	C	.	.	S	Bend	trans	52.3	62.8	178.4	-54.3	4.2	0	0	0	111.2	G706 N707 Q753 H754	G706-N730 WeakPolarHBondContact CA-O 3.48Å; G706-N730 PolarHBondContact N-O 2.93Å; G706-N730 VanDerWaalsContact N-O 3.08Å; N707-N730 PolarHBondContact N-O 3Å; N730-Q753 PolarHBondContact N-O 2.88Å; N730-H754 VanDerWaalsContact CA-O 3.25Å; N730-H754 WeakPolarHBondContact CA-O 3.45Å; N730-H754 PolarHBondContact N-O 2.87Å; N730-H754 WeakPolarHBondContact OD1-CB 3.26Å; N730-H754 PolarHBondContact OD1-ND1 2.93Å
731	N	93.9	Very high	87.5	Confident	9 Å²	9	41.3 Å²	41.3	5%	0.048	20%	0.201	C	C	.	.	S	Bend	trans	-145	178.7	-175.1	-92.5	-89.9	0	0	0	110.3	I704 N707 I709 S729 H754 N755	I704-N731 PolarHBondContact O-ND2 3.49Å; I704-N731 VanDerWaalsContact O-ND2 3.1Å; N707-N731 VanDerWaalsContact CB-OD1 3.27Å; N707-N731 WeakPolarHBondContact CB-OD1 3.31Å; N707-N731 WeakPolarHBondContact O-CA 3.39Å; N707-N731 PolarHBondContact O-OD1 2.94Å; I709-N731 HydrophobicContact CB-CB 4.49Å; I709-N731 WeakPolarHBondContact CB-OD1 3.45Å; I709-N731 WeakPolarHBondContact CD1-OD1 3.38Å; I709-N731 WeakPolarHBondContact CG1-OD1 3.43Å; I709-N731 PolarHBondContact N-OD1 3.09Å; S729-N731 PolarHBondContact O-ND2 3.1Å; N731-H754 PolarHBondContact N-O 2.83Å; N731-N755 WeakPolarHBondContact CA-OD1 3.35Å; N731-N755 WeakPolarHBondContact CB-OD1 3.43Å; N731-N755 WeakPolarHBondContact O-CA 3.48Å; N731-N755 PolarHBondContact O-OD1 2.81Å
732	S	93.1	Very high	88	Confident	45 Å²	45	38.9 Å²	38.9	32%	0.315	19%	0.188	S	C	.	.			trans	-98.2	6	-172.6	-67	0	0	0	0	115.2	I709 T734	I709-S732 CarbonylContact O-C 3.33Å; I709-S732 VanDerWaalsContact O-CA 3.32Å; I709-S732 WeakPolarHBondContact O-CA 3.3Å; I709-S732 WeakPolarHBondContact O-CB 3.35Å; I709-S732 PolarHBondContact O-N 3.38Å; S732-T734 WeakPolarHBondContact O-CG2 3.48Å; S732-T734 PolarHBondContact O-N 2.85Å; S732-T734 VanDerWaalsContact O-N 3.15Å
733	L	94	Very high	87.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.172	C	C	.	.			trans	-55	117.9	-169.1	-62.5	170.8	0	0	0	112.2	I709 I712 L752 N755 Q756 I757	I709-L733 HydrophobicContact CB-CD2 4.42Å; I709-L733 HydrophobicContact CG2-CD2 3.74Å; I709-L733 PolarHBondContact O-N 3.03Å; I712-L733 HydrophobicContact CD1-CD1 4.11Å; I712-L733 HydrophobicContact CD1-CD2 3.99Å; I712-L733 HydrophobicContact CG1-CD2 3.89Å; L733-L752 HydrophobicContact CD1-CD2 4Å; L733-N755 HydrophobicContact CB-CB 4.2Å; L733-N755 VanDerWaalsContact CB-OD1 3.28Å; L733-N755 WeakPolarHBondContact CB-OD1 3.45Å; L733-N755 WeakPolarHBondContact CG-OD1 3.36Å; L733-N755 PolarHBondContact N-OD1 3.5Å; L733-N755 VanDerWaalsContact N-OD1 3.14Å; L733-Q756 CarbonylContact O-C 3.14Å; L733-Q756 VanDerWaalsContact O-CA 3.25Å; L733-Q756 WeakPolarHBondContact O-CA 3.13Å; L733-Q756 PolarHBondContact O-N 3.38Å; L733-I757 HydrophobicContact CB-CG1 4.14Å; L733-I757 WeakPolarHBondContact O-CG1 3.21Å; L733-I757 PolarHBondContact O-N 3.35Å
734	T	86	Confident	87.6	Confident	45 Å²	45	35.6 Å²	35.6	28%	0.276	17%	0.172	S	C	.	.			trans	-95.8	-20.9	-176.4	72	0	0	0	0	114.5	S732 Q756 I757 K758	S732-T734 WeakPolarHBondContact O-CG2 3.48Å; S732-T734 PolarHBondContact O-N 2.85Å; S732-T734 VanDerWaalsContact O-N 3.15Å; T734-Q756 HydrophobicContact CG2-CB 4.16Å; T734-I757 WeakPolarHBondContact O-CA 3.25Å; T734-K758 PolarHBondContact O-N 3.01Å
735	Y	81.8	Confident	87.2	Confident	108 Å²	108	37.1 Å²	37.1	42%	0.424	18%	0.179	S	C	.	.			trans	-153	172.3	174.9	68.2	-97.2	0	0	0	110.4	H711 E737	H711-Y735 AromaticContact CD2-CE2 3.99Å; H711-Y735 AromaticContact CD2-CZ 3.62Å; H711-Y735 PolarHBondContact CD2-OH 2.87Å; H711-Y735 AromaticContact NE2-CZ 3.96Å; H711-Y735 PolarHBondContact NE2-OH 2.96Å; Y735-E737 HydrophobicContact CD2-CG 4.43Å; Y735-E737 HydrophobicContact CE2-CB 4.38Å; Y735-E737 HydrophobicContact CE2-CG 3.83Å; Y735-E737 WeakPolarHBondContact CE2-OE1 3.49Å; Y735-E737 PolarHBondContact OH-OE1 3.15Å
736	L	86.3	Confident	87	Confident	16 Å²	16	37.7 Å²	37.7	8%	0.084	19%	0.185	C	C	.	.			trans	-131.8	126.5	170.6	-68.9	170.1	0	0	0	108.9	T740 F741 L752 I757 L760 T764	L736-T740 HydrophobicContact CD2-CG2 4.27Å; L736-F741 HydrophobicContact CD1-CE2 3.97Å; L736-F741 HydrophobicContact CD1-CZ 4.21Å; L736-F741 HydrophobicContact CD2-CE2 4.3Å; L736-F741 HydrophobicContact CD2-CZ 4Å; L736-L752 HydrophobicContact CD1-CD1 4.08Å; L736-I757 HydrophobicContact CD1-CD1 3.85Å; L736-I757 HydrophobicContact CG-CD1 4.2Å; L736-L760 HydrophobicContact CD1-CD2 3.91Å; L736-T764 HydrophobicContact CB-CG2 4.04Å; L736-T764 HydrophobicContact CD1-CG2 4.28Å
737	E	78.8	Confident	86.9	Confident	68 Å²	68	37.7 Å²	37.7	32%	0.318	19%	0.185	S	C	.	.			trans	-79.6	164.3	-175.4	-114.6	168.8	-83.9	0	0	112.4	H711 P714 Y735 K739 T740	H711-E737 IonicContact CD2-OE1 2.73Å; H711-E737 IonicContact CE1-OE1 3.56Å; H711-E737 IonicContact NE2-OE1 2.67Å; H711-E737 PolarHBondContact NE2-OE1 3.43Å; P714-E737 HydrophobicContact CG-CB 4.13Å; P714-E737 HydrophobicContact CG-CG 4.43Å; P714-E737 WeakPolarHBondContact CG-OE2 3.44Å; Y735-E737 HydrophobicContact CD2-CG 4.43Å; Y735-E737 HydrophobicContact CE2-CB 4.38Å; Y735-E737 HydrophobicContact CE2-CG 3.83Å; Y735-E737 WeakPolarHBondContact CE2-OE1 3.49Å; Y735-E737 PolarHBondContact OH-OE1 3.15Å; E737-K739 PolarHBondContact O-N 3.32Å; E737-T740 PolarHBondContact N-OG1 3.36Å; E737-T740 PolarHBondContact O-N 3.3Å; E737-T740 PolarHBondContact O-OG1 3.29Å
738	E	76	Confident	86.7	Confident	65 Å²	65	40.4 Å²	40.4	30%	0.304	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	133.5	166.1	-74.7	-162	-164.5	0	0	109.2	T740 N761 R763	E738-T740 PolarHBondContact O-N 2.85Å; E738-N761 WeakPolarHBondContact CG-ND2 3.04Å; E738-N761 PolarHBondContact OE1-ND2 2.78Å; E738-R763 VanDerWaalsContact CD-CD 3.42Å; E738-R763 HydrophobicContact CG-CB 4.22Å; E738-R763 WeakPolarHBondContact OE1-CD 3.48Å; E738-R763 IonicContact OE1-NH1 3.21Å; E738-R763 PolarHBondContact OE1-NH1 2.84Å; E738-R763 WeakPolarHBondContact OE2-CD 3.04Å; E738-R763 IonicContact OE2-CZ 3.99Å; E738-R763 IonicContact OE2-NE 2.82Å; E738-R763 IonicContact OE2-NH1 2.85Å; E738-R763 PolarHBondContact OE2-NH1 3.49Å
739	K	78.9	Confident	86.6	Confident	122 Å²	122	42.6 Å²	42.6	53%	0.53	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	12.9	179.3	-45.6	160.6	-168.2	161.4	0	115.8	M715 E737 F741 N742	M715-K739 HydrophobicContact CG-CB 4.37Å; M715-K739 PolarHBondContact N-O 2.75Å; E737-K739 PolarHBondContact O-N 3.32Å; K739-F741 VanDerWaalsContact C-N 3.35Å; K739-F741 PolarHBondContact O-N 3.06Å; K739-N742 HydrophobicContact CB-CB 3.84Å; K739-N742 WeakPolarHBondContact O-CB 3.48Å; K739-N742 PolarHBondContact O-N 2.82Å; K739-N742 VanDerWaalsContact O-N 3.13Å
740	T	83.7	Confident	86.8	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.012	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-51.2	169.1	-62	0	0	0	0	111.7	I712 L736 E737 E738 N742	I712-T740 HydrophobicContact CB-CG2 3.79Å; I712-T740 HydrophobicContact CD1-CG2 4.42Å; I712-T740 HydrophobicContact CG2-CG2 3.59Å; L736-T740 HydrophobicContact CD2-CG2 4.27Å; E737-T740 PolarHBondContact N-OG1 3.36Å; E737-T740 PolarHBondContact O-N 3.3Å; E737-T740 PolarHBondContact O-OG1 3.29Å; E738-T740 PolarHBondContact O-N 2.85Å; T740-N742 VanDerWaalsContact C-N 3.28Å; T740-N742 PolarHBondContact O-N 2.9Å
741	F	89.5	Confident	87	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.013	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	20.3	179.5	-57.2	-56.5	0	0	0	114.6	F717 L726 L728 L736 K739 G743 L744 L750 L752 T764 F765 T768	F717-F741 HydrophobicContact CD2-CD1 4.39Å; F717-F741 HydrophobicContact CE2-CD1 4.24Å; F717-F741 HydrophobicContact CE2-CE1 4.46Å; L726-F741 HydrophobicContact CD2-CD1 4.34Å; L726-F741 HydrophobicContact CD2-CE1 4.2Å; L728-F741 HydrophobicContact CD1-CE1 4.15Å; L736-F741 HydrophobicContact CD1-CE2 3.97Å; L736-F741 HydrophobicContact CD1-CZ 4.21Å; L736-F741 HydrophobicContact CD2-CE2 4.3Å; L736-F741 HydrophobicContact CD2-CZ 4Å; K739-F741 VanDerWaalsContact C-N 3.35Å; K739-F741 PolarHBondContact O-N 3.06Å; F741-G743 PolarHBondContact O-N 3.27Å; F741-L744 HydrophobicContact CB-CD1 3.99Å; F741-L744 HydrophobicContact CD1-CD1 3.84Å; F741-L744 HydrophobicContact CG-CD1 4.35Å; F741-L744 WeakPolarHBondContact O-CB 3.43Å; F741-L744 PolarHBondContact O-N 3.16Å; F741-L750 HydrophobicContact CD2-CD2 4.28Å; F741-L750 HydrophobicContact CE1-CD1 4.16Å; F741-L750 HydrophobicContact CE1-CD2 4.36Å; F741-L750 HydrophobicContact CE2-CD2 4Å; F741-L750 HydrophobicContact CZ-CD1 4.34Å; F741-L750 HydrophobicContact CZ-CD2 4.05Å; F741-L752 HydrophobicContact CE2-CD1 4.44Å; F741-L752 HydrophobicContact CZ-CD1 4.11Å; F741-L752 HydrophobicContact CZ-CD2 4.38Å; F741-T764 HydrophobicContact CD2-CG2 4.36Å; F741-T764 HydrophobicContact CE2-CG2 4.27Å; F741-F765 HydrophobicContact CD2-CD1 4.02Å; F741-F765 AromaticContact CD2-CE1 3.94Å; F741-F765 HydrophobicContact CD2-CE1 3.94Å; F741-F765 HydrophobicContact CE2-CD1 4.28Å; F741-F765 AromaticContact CE2-CE1 3.72Å; F741-F765 HydrophobicContact CE2-CE1 3.72Å; F741-T768 HydrophobicContact CB-CG2 4.16Å
742	N	81.2	Confident	87	Confident	28 Å²	28	40.3 Å²	40.3	15%	0.15	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	125.7	-177.3	-173.3	19.4	0	0	0	111.3	M715 F717 R718 K739 T740 Q767	M715-N742 HydrophobicContact CG-CB 4.26Å; F717-N742 CarbonylContact C-O 3.43Å; R718-N742 WeakPolarHBondContact CA-O 3.42Å; R718-N742 PolarHBondContact N-O 3.26Å; K739-N742 HydrophobicContact CB-CB 3.84Å; K739-N742 WeakPolarHBondContact O-CB 3.48Å; K739-N742 PolarHBondContact O-N 2.82Å; K739-N742 VanDerWaalsContact O-N 3.13Å; T740-N742 VanDerWaalsContact C-N 3.28Å; T740-N742 PolarHBondContact O-N 2.9Å; N742-Q767 VanDerWaalsContact OD1-CD 3.22Å; N742-Q767 PolarHBondContact OD1-NE2 3.06Å; N742-Q767 PolarHBondContact OD1-OE1 3.26Å
743	G	75.4	Confident	86.9	Confident	5 Å²	5	39.8 Å²	39.8	5%	0.052	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.8	-24.6	-172.8	0	0	0	0	0	114.2	F741 K745	F741-G743 PolarHBondContact O-N 3.27Å; G743-K745 PolarHBondContact O-N 2.87Å
744	L	88.2	Confident	86.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.201	C	C	.	.			trans	-76.9	51.7	-174.7	-63.7	177	0	0	0	113.9	F717 I723 L726 F741 N746 I747 T768	F717-L744 HydrophobicContact CB-CD1 4.11Å; F717-L744 HydrophobicContact CB-CD2 3.78Å; F717-L744 HydrophobicContact CB-CG 3.76Å; F717-L744 HydrophobicContact CD2-CD1 3.88Å; F717-L744 HydrophobicContact CD2-CG 4.47Å; F717-L744 HydrophobicContact CG-CD1 4Å; F717-L744 HydrophobicContact CG-CD2 4.19Å; F717-L744 HydrophobicContact CG-CG 4.2Å; I723-L744 HydrophobicContact CB-CD2 3.79Å; I723-L744 HydrophobicContact CD1-CD2 3.98Å; I723-L744 HydrophobicContact CG1-CD2 4.37Å; I723-L744 HydrophobicContact CG2-CD2 4.11Å; L726-L744 HydrophobicContact CD2-CD1 3.92Å; F741-L744 HydrophobicContact CB-CD1 3.99Å; F741-L744 HydrophobicContact CD1-CD1 3.84Å; F741-L744 HydrophobicContact CG-CD1 4.35Å; F741-L744 WeakPolarHBondContact O-CB 3.43Å; F741-L744 PolarHBondContact O-N 3.16Å; L744-N746 PolarHBondContact O-N 3.49Å; L744-I747 HydrophobicContact CB-CB 4.23Å; L744-I747 HydrophobicContact CB-CG2 4.06Å; L744-I747 HydrophobicContact CD1-CD1 4.25Å; L744-I747 WeakPolarHBondContact O-CG2 3.03Å; L744-I747 PolarHBondContact O-N 3.09Å; L744-T768 HydrophobicContact CB-CG2 4.25Å
745	K	82.4	Confident	87.3	Confident	120 Å²	120	40.4 Å²	40.4	52%	0.522	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-23	-172.9	-66.3	-179.4	-179.9	177.9	0	114.7	L721 G743 V770	L721-K745 HydrophobicContact CD2-CD 4.49Å; G743-K745 PolarHBondContact O-N 2.87Å; K745-V770 WeakPolarHBondContact O-CG2 3.16Å
746	N	88.3	Confident	87.8	Confident	73 Å²	73	39.2 Å²	39.2	39%	0.39	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	7.3	-176.8	-72.1	-53.2	0	0	0	113.9	L721 I723 L744 E748	L721-N746 PolarHBondContact O-ND2 3.11Å; I723-N746 CarbonylContact O-C 3.56Å; I723-N746 VanDerWaalsContact O-C 3.28Å; L744-N746 PolarHBondContact O-N 3.49Å; N746-E748 PolarHBondContact O-N 3.45Å
747	I	92.8	Very high	88.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.182	C	C	.	.			trans	-70	120.7	-175	-167.2	171.7	0	0	0	111.9	I723 L726 L744 I749 L750 T768 V770 L771	I723-I747 VanDerWaalsContact O-CA 3.26Å; I723-I747 WeakPolarHBondContact O-CA 3.43Å; I723-I747 PolarHBondContact O-N 3.49Å; I723-I747 VanDerWaalsContact O-N 3.16Å; L726-I747 HydrophobicContact CB-CD1 3.71Å; L726-I747 HydrophobicContact CD2-CD1 4.44Å; L744-I747 HydrophobicContact CB-CB 4.23Å; L744-I747 HydrophobicContact CB-CG2 4.06Å; L744-I747 HydrophobicContact CD1-CD1 4.25Å; L744-I747 WeakPolarHBondContact O-CG2 3.03Å; L744-I747 PolarHBondContact O-N 3.09Å; I747-I749 WeakPolarHBondContact CG1-O 3.47Å; I747-L750 HydrophobicContact CD1-CB 3.98Å; I747-L750 HydrophobicContact CD1-CD1 4.2Å; I747-T768 HydrophobicContact CG2-CG2 3.47Å; I747-T768 VanDerWaalsContact CG2-CG2 3.47Å; I747-V770 CarbonylContact O-C 3.6Å; I747-V770 WeakPolarHBondContact O-CG2 3.38Å; I747-L771 HydrophobicContact CG1-CD1 4.24Å; I747-L771 HydrophobicContact CG2-CD1 4.22Å; I747-L771 VanDerWaalsContact O-CA 3.22Å; I747-L771 WeakPolarHBondContact O-CA 3.06Å; I747-L771 PolarHBondContact O-N 2.85Å
748	E	92.1	Very high	88.7	Confident	71 Å²	71	40.8 Å²	40.8	33%	0.332	19%	0.191	S	C	.	.			trans	-99.2	-28.1	176	-55.6	-160.1	155.3	0	0	112.2	K724 N746 K772 I773	K724-E748 PolarHBondContact O-N 2.94Å; N746-E748 PolarHBondContact O-N 3.45Å; E748-K772 HydrophobicContact CB-CD 4.21Å; E748-K772 HydrophobicContact CB-CG 4.44Å; E748-K772 VanDerWaalsContact CD-CE 3.47Å; E748-K772 HydrophobicContact CG-CD 4.48Å; E748-K772 WeakPolarHBondContact O-CA 3.03Å; E748-K772 WeakPolarHBondContact O-CB 3.38Å; E748-K772 PolarHBondContact O-N 3.41Å; E748-K772 WeakPolarHBondContact OE1-CE 3.44Å; E748-K772 IonicContact OE1-NZ 3.28Å; E748-K772 PolarHBondContact OE1-NZ 2.74Å; E748-K772 WeakPolarHBondContact OE2-CE 3.44Å; E748-K772 IonicContact OE2-NZ 3.27Å; E748-K772 PolarHBondContact OE2-NZ 3.41Å; E748-I773 PolarHBondContact O-N 2.77Å
749	I	92.7	Very high	89.1	Confident	46 Å²	46	40.1 Å²	40.1	24%	0.236	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	122.4	-174.4	-55.7	179	0	0	0	110.3	K724 K725 L726 I747 L751 I773	K724-I749 PolarHBondContact O-N 3.41Å; K725-I749 WeakPolarHBondContact CA-O 3.44Å; K725-I749 HydrophobicContact CB-CB 4.37Å; K725-I749 HydrophobicContact CG-CB 4.18Å; K725-I749 HydrophobicContact CG-CG2 4.28Å; L726-I749 PolarHBondContact N-O 3.16Å; I747-I749 WeakPolarHBondContact CG1-O 3.47Å; I749-L751 HydrophobicContact CG2-CD1 4.43Å; I749-L751 HydrophobicContact CG2-CD2 3.94Å; I749-L751 HydrophobicContact CG2-CG 3.93Å; I749-I773 HydrophobicContact CB-CB 4.44Å; I749-I773 HydrophobicContact CD1-CD1 4.18Å; I749-I773 HydrophobicContact CG1-CB 4.18Å; I749-I773 HydrophobicContact CG1-CD1 4.11Å; I749-I773 HydrophobicContact CG1-CG1 4.24Å; I749-I773 HydrophobicContact CG2-CB 4.21Å; I749-I773 HydrophobicContact CG2-CG2 4.44Å
750	L	95	Very high	89.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	114.3	175.2	179.6	56.4	0	0	0	110.3	L726 F741 I747 L752 F765 L771 I773 L774 M775	L726-L750 HydrophobicContact CB-CD1 4.04Å; L726-L750 HydrophobicContact CD2-CD1 3.92Å; L726-L750 HydrophobicContact CG-CD1 4.01Å; L726-L750 WeakPolarHBondContact O-CA 3.36Å; F741-L750 HydrophobicContact CD2-CD2 4.28Å; F741-L750 HydrophobicContact CE1-CD1 4.16Å; F741-L750 HydrophobicContact CE1-CD2 4.36Å; F741-L750 HydrophobicContact CE2-CD2 4Å; F741-L750 HydrophobicContact CZ-CD1 4.34Å; F741-L750 HydrophobicContact CZ-CD2 4.05Å; I747-L750 HydrophobicContact CD1-CB 3.98Å; I747-L750 HydrophobicContact CD1-CD1 4.2Å; L750-L752 HydrophobicContact CD1-CD1 4.24Å; L750-L752 HydrophobicContact CD1-CG 4.16Å; L750-L752 HydrophobicContact CD2-CD1 3.95Å; L750-L752 HydrophobicContact CG-CD1 3.88Å; L750-L752 HydrophobicContact CG-CG 4.16Å; L750-F765 HydrophobicContact CD2-CD1 4.21Å; L750-F765 HydrophobicContact CD2-CE1 3.75Å; L750-L771 HydrophobicContact CB-CD1 3.69Å; L750-L771 HydrophobicContact CB-CD2 4.42Å; L750-I773 PolarHBondContact N-O 2.64Å; L750-L774 HydrophobicContact CB-CD1 4.24Å; L750-L774 HydrophobicContact CD2-CD1 4.11Å; L750-L774 HydrophobicContact CG-CD1 4.14Å; L750-L774 WeakPolarHBondContact O-CA 3.16Å; L750-M775 PolarHBondContact O-N 2.64Å; L750-M775 VanDerWaalsContact O-N 3.07Å
751	L	96.1	Very high	89.6	Confident	30 Å²	30	37.2 Å²	37.2	16%	0.157	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	111.4	-176.5	-55.6	-173.8	0	0	0	110.7	L726 I727 L728 S729 I749 I773 M775	L726-L751 PolarHBondContact O-N 2.04Å; I727-L751 HydrophobicContact CD1-CD1 4.12Å; I727-L751 HydrophobicContact CG1-CD1 4.02Å; I727-L751 HydrophobicContact CG2-CB 4.07Å; I727-L751 HydrophobicContact CG2-CD1 4.27Å; L728-L751 CarbonylContact C-O 3.11Å; L728-L751 WeakPolarHBondContact CA-O 3.5Å; L728-L751 PolarHBondContact N-O 3.24Å; S729-L751 PolarHBondContact N-O 2.04Å; S729-L751 WeakPolarHBondContact OG-CB 3.37Å; S729-L751 PolarHBondContact OG-O 3.09Å; I749-L751 HydrophobicContact CG2-CD1 4.43Å; I749-L751 HydrophobicContact CG2-CD2 3.94Å; I749-L751 HydrophobicContact CG2-CG 3.93Å; L751-I773 HydrophobicContact CD2-CG2 4.23Å; L751-M775 HydrophobicContact CD2-CB 3.82Å; L751-M775 HydrophobicContact CD2-CG 3.54Å
752	L	95.1	Very high	89.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.			trans	-123.1	11.6	-174.6	-71.4	162.3	0	0	0	112.6	L728 L733 L736 F741 L750 N755 I757 L774 M775 L776 N779	L728-L752 HydrophobicContact CB-CD2 3.73Å; L728-L752 HydrophobicContact CD1-CD2 4.1Å; L733-L752 HydrophobicContact CD1-CD2 4Å; L736-L752 HydrophobicContact CD1-CD1 4.08Å; F741-L752 HydrophobicContact CE2-CD1 4.44Å; F741-L752 HydrophobicContact CZ-CD1 4.11Å; F741-L752 HydrophobicContact CZ-CD2 4.38Å; L750-L752 HydrophobicContact CD1-CD1 4.24Å; L750-L752 HydrophobicContact CD1-CG 4.16Å; L750-L752 HydrophobicContact CD2-CD1 3.95Å; L750-L752 HydrophobicContact CG-CD1 3.88Å; L750-L752 HydrophobicContact CG-CG 4.16Å; L752-N755 PolarHBondContact O-ND2 3.19Å; L752-I757 HydrophobicContact CB-CD1 4.38Å; L752-I757 HydrophobicContact CD2-CD1 4.49Å; L752-L774 HydrophobicContact CD1-CD1 4.46Å; L752-M775 CarbonylContact C-O 3.42Å; L752-M775 WeakPolarHBondContact CA-O 3.27Å; L752-M775 WeakPolarHBondContact CB-O 3.43Å; L752-M775 PolarHBondContact N-O 2.79Å; L752-L776 HydrophobicContact CB-CD2 4.03Å; L752-L776 HydrophobicContact CD1-CD2 3.96Å; L752-N779 PolarHBondContact O-ND2 2.93Å
753	Q	91.3	Very high	89	Confident	33 Å²	33	46 Å²	46	15%	0.154	22%	0.22	C	C	.	.			trans	-66.4	153.3	-179.7	72.2	-77	1.1	0	0	113.1	S729 N730 M775 N777	S729-Q753 CarbonylContact C-O 3.56Å; S729-Q753 WeakPolarHBondContact CA-O 3.5Å; S729-Q753 WeakPolarHBondContact CB-O 3.34Å; S729-Q753 PolarHBondContact OG-NE2 2.96Å; S729-Q753 PolarHBondContact OG-OE1 3.31Å; N730-Q753 PolarHBondContact N-O 2.88Å; Q753-M775 HydrophobicContact CB-CB 4.48Å; Q753-M775 PolarHBondContact N-O 3.36Å; Q753-M775 VanDerWaalsContact OE1-CB 3.23Å; Q753-N777 VanDerWaalsContact CA-O 3.24Å; Q753-N777 WeakPolarHBondContact CA-O 3.39Å; Q753-N777 WeakPolarHBondContact CB-O 3.41Å; Q753-N777 VanDerWaalsContact CB-OD1 3.31Å; Q753-N777 WeakPolarHBondContact CB-OD1 3.15Å
754	H	91.7	Very high	89.4	Confident	58 Å²	58	46 Å²	46	27%	0.269	22%	0.219	S	C	.	.	S	Bend	trans	56.6	55.7	-171.4	-49.9	122.3	0	0	0	112.6	N730 N731 N777 N778	N730-H754 VanDerWaalsContact CA-O 3.25Å; N730-H754 WeakPolarHBondContact CA-O 3.45Å; N730-H754 PolarHBondContact N-O 2.87Å; N730-H754 WeakPolarHBondContact OD1-CB 3.26Å; N730-H754 PolarHBondContact OD1-ND1 2.93Å; N731-H754 PolarHBondContact N-O 2.83Å; H754-N777 PolarHBondContact N-O 2.96Å; H754-N778 WeakPolarHBondContact CA-O 3.45Å; H754-N778 WeakPolarHBondContact CD2-CB 3.39Å; H754-N778 PolarHBondContact CD2-ND2 3.05Å; H754-N778 PolarHBondContact N-O 3.07Å; H754-N778 PolarHBondContact NE2-ND2 3.32Å
755	N	95.3	Very high	89.5	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.22	C	C	.	.	S	Bend	trans	-124.8	-176.3	167.4	-82.4	-87.1	0	0	0	109.7	L728 N731 L733 L752 I757 N779	L728-N755 PolarHBondContact O-ND2 2.87Å; N731-N755 WeakPolarHBondContact CA-OD1 3.35Å; N731-N755 WeakPolarHBondContact CB-OD1 3.43Å; N731-N755 WeakPolarHBondContact O-CA 3.48Å; N731-N755 PolarHBondContact O-OD1 2.81Å; L733-N755 HydrophobicContact CB-CB 4.2Å; L733-N755 VanDerWaalsContact CB-OD1 3.28Å; L733-N755 WeakPolarHBondContact CB-OD1 3.45Å; L733-N755 WeakPolarHBondContact CG-OD1 3.36Å; L733-N755 PolarHBondContact N-OD1 3.5Å; L733-N755 VanDerWaalsContact N-OD1 3.14Å; L752-N755 PolarHBondContact O-ND2 3.19Å; N755-I757 HydrophobicContact CB-CD1 4.17Å; N755-I757 HydrophobicContact CB-CG1 4.02Å; N755-N779 WeakPolarHBondContact CB-OD1 3.03Å; N755-N779 WeakPolarHBondContact O-CA 3.33Å; N755-N779 PolarHBondContact O-OD1 3.44Å
756	Q	93.5	Very high	89.4	Confident	82 Å²	82	45.4 Å²	45.4	38%	0.383	22%	0.218	S	C	.	.			trans	-108.1	21	-178.5	-54.6	-58.1	-28.7	0	0	113	L733 T734 K758 K780	L733-Q756 CarbonylContact O-C 3.14Å; L733-Q756 VanDerWaalsContact O-CA 3.25Å; L733-Q756 WeakPolarHBondContact O-CA 3.13Å; L733-Q756 PolarHBondContact O-N 3.38Å; T734-Q756 HydrophobicContact CG2-CB 4.16Å; Q756-K758 WeakPolarHBondContact O-CG 3.3Å; Q756-K758 PolarHBondContact O-N 3.11Å; Q756-K780 HydrophobicContact CB-CG 4.43Å
757	I	93.5	Very high	88.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.218	C	C	.	.			trans	-64.8	122.7	-167	-56	166.8	0	0	0	110.2	L733 T734 L736 L752 N755 L760 N779 K780 L781	L733-I757 HydrophobicContact CB-CG1 4.14Å; L733-I757 WeakPolarHBondContact O-CG1 3.21Å; L733-I757 PolarHBondContact O-N 3.35Å; T734-I757 WeakPolarHBondContact O-CA 3.25Å; L736-I757 HydrophobicContact CD1-CD1 3.85Å; L736-I757 HydrophobicContact CG-CD1 4.2Å; L752-I757 HydrophobicContact CB-CD1 4.38Å; L752-I757 HydrophobicContact CD2-CD1 4.49Å; N755-I757 HydrophobicContact CB-CD1 4.17Å; N755-I757 HydrophobicContact CB-CG1 4.02Å; I757-L760 HydrophobicContact CG2-CD2 3.95Å; I757-L760 HydrophobicContact CG2-CG 4.48Å; I757-N779 VanDerWaalsContact CB-OD1 3.3Å; I757-N779 WeakPolarHBondContact CB-OD1 3.38Å; I757-N779 VanDerWaalsContact CG1-OD1 3.3Å; I757-N779 WeakPolarHBondContact CG1-OD1 3.47Å; I757-N779 PolarHBondContact N-OD1 3.1Å; I757-N779 VanDerWaalsContact N-OD1 3.07Å; I757-K780 CarbonylContact O-C 3.28Å; I757-K780 WeakPolarHBondContact O-CA 3.47Å; I757-K780 PolarHBondContact O-N 3.14Å; I757-K780 VanDerWaalsContact O-N 3.14Å; I757-L781 HydrophobicContact CB-CD2 4.24Å; I757-L781 HydrophobicContact CG2-CD2 3.8Å; I757-L781 WeakPolarHBondContact O-CD2 3.3Å; I757-L781 PolarHBondContact O-N 3.03Å
758	K	89.3	Confident	88.4	Confident	117 Å²	117	46 Å²	46	51%	0.509	22%	0.218	S	C	.	.			trans	-90.7	-35.8	-169.7	-67	165.3	-170.8	160.8	0	115	T734 Q756 K780 L781 R782	T734-K758 PolarHBondContact O-N 3.01Å; Q756-K758 WeakPolarHBondContact O-CG 3.3Å; Q756-K758 PolarHBondContact O-N 3.11Å; K758-K780 HydrophobicContact CG-CB 4.4Å; K758-L781 WeakPolarHBondContact O-CA 3.48Å; K758-R782 PolarHBondContact O-N 3.42Å
759	C	86.1	Confident	87.9	Confident	51 Å²	51	46 Å²	46	35%	0.345	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.6	179.1	-85	0	0	0	0	110.9	C783	C759-C783 VanDerWaalsContact CA-O 3.24Å; C759-C783 WeakPolarHBondContact CA-O 3.38Å; C759-C783 HydrophobicContact CB-CB 4.39Å; C759-C783 WeakPolarHBondContact CB-SG 3.32Å; C759-C783 WeakPolarHBondContact SG-CB 3.43Å; C759-C783 PolarHBondContact SG-N 2.86Å; C759-C783 VanDerWaalsContact SG-N 3.4Å; C759-C783 CovalentContact SG-SG 2.04Å; C759-C783 PolarHBondContact SG-SG 2.8Å
760	L	90	Very high	87.7	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.037	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.6	178.9	-63.9	168.1	0	0	0	112.9	L736 I757 T764 L776 L781 C783 I784 A785 I788	L736-L760 HydrophobicContact CD1-CD2 3.91Å; I757-L760 HydrophobicContact CG2-CD2 3.95Å; I757-L760 HydrophobicContact CG2-CG 4.48Å; L760-T764 HydrophobicContact CD2-CG2 4.47Å; L760-L776 HydrophobicContact CD1-CD1 3.79Å; L760-L776 HydrophobicContact CD1-CD2 4.28Å; L760-L781 HydrophobicContact CD1-CD1 4.04Å; L760-L781 HydrophobicContact CD1-CD2 3.83Å; L760-L781 HydrophobicContact CG-CD2 3.69Å; L760-C783 PolarHBondContact N-O 2.85Å; L760-C783 VanDerWaalsContact N-O 3.15Å; L760-I784 HydrophobicContact CB-CG2 4.45Å; L760-A785 WeakPolarHBondContact O-CB 3.48Å; L760-A785 PolarHBondContact O-N 3.47Å; L760-I788 HydrophobicContact CB-CD1 3.44Å; L760-I788 VanDerWaalsContact CB-CD1 3.44Å; L760-I788 HydrophobicContact CD1-CD1 4.08Å; L760-I788 HydrophobicContact CG-CD1 4.3Å
761	N	83.1	Confident	87.5	Confident	57 Å²	57	46.9 Å²	46.9	31%	0.305	23%	0.232	S	C	.	.			trans	-88.7	150.8	178.2	-178.8	-20	0	0	0	110.2	E738 R763 T764 I788	E738-N761 WeakPolarHBondContact CG-ND2 3.04Å; E738-N761 PolarHBondContact OE1-ND2 2.78Å; N761-R763 PolarHBondContact O-N 2.91Å; N761-R763 PolarHBondContact OD1-N 3.2Å; N761-R763 VanDerWaalsContact OD1-N 3.16Å; N761-T764 PolarHBondContact N-OG1 3.01Å; N761-T764 WeakPolarHBondContact O-CB 3.24Å; N761-T764 PolarHBondContact O-N 2.95Å; N761-T764 PolarHBondContact O-OG1 3.33Å; N761-I788 VanDerWaalsContact O-CD1 3.25Å; N761-I788 WeakPolarHBondContact O-CD1 3.49Å
762	N	77	Confident	87.1	Confident	73 Å²	73	48.3 Å²	48.3	39%	0.39	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.8	-179.1	65.1	11.6	0	0	0	113.3	A785 K786 I788	N762-A785 HydrophobicContact CB-CB 4.01Å; N762-K786 WeakPolarHBondContact CB-O 3.3Å; N762-K786 PolarHBondContact ND2-O 2.86Å; N762-I788 HydrophobicContact CB-CB 4.49Å
763	R	80.9	Confident	86.9	Confident	141 Å²	141	50.7 Å²	50.7	53%	0.532	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.6	174.7	-72.8	173.5	177.5	171.6	4.3	115.2	E738 N761 F765 H766	E738-R763 VanDerWaalsContact CD-CD 3.42Å; E738-R763 HydrophobicContact CG-CB 4.22Å; E738-R763 WeakPolarHBondContact OE1-CD 3.48Å; E738-R763 IonicContact OE1-NH1 3.21Å; E738-R763 PolarHBondContact OE1-NH1 2.84Å; E738-R763 WeakPolarHBondContact OE2-CD 3.04Å; E738-R763 IonicContact OE2-CZ 3.99Å; E738-R763 IonicContact OE2-NE 2.82Å; E738-R763 IonicContact OE2-NH1 2.85Å; E738-R763 PolarHBondContact OE2-NH1 3.49Å; N761-R763 PolarHBondContact O-N 2.91Å; N761-R763 PolarHBondContact OD1-N 3.2Å; N761-R763 VanDerWaalsContact OD1-N 3.16Å; R763-F765 PolarHBondContact O-N 3.27Å; R763-F765 VanDerWaalsContact O-N 3.14Å; R763-H766 PolarHBondContact O-N 3.24Å
764	T	83.8	Confident	87	Confident	6 Å²	6	49.1 Å²	49.1	4%	0.037	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-34.2	-172.6	-54.6	0	0	0	0	113.3	L736 F741 L760 N761	L736-T764 HydrophobicContact CB-CG2 4.04Å; L736-T764 HydrophobicContact CD1-CG2 4.28Å; F741-T764 HydrophobicContact CD2-CG2 4.36Å; F741-T764 HydrophobicContact CE2-CG2 4.27Å; L760-T764 HydrophobicContact CD2-CG2 4.47Å; N761-T764 PolarHBondContact N-OG1 3.01Å; N761-T764 WeakPolarHBondContact O-CB 3.24Å; N761-T764 PolarHBondContact O-N 2.95Å; N761-T764 PolarHBondContact O-OG1 3.33Å
765	F	89.6	Confident	87	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.009	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	10.9	-177.8	-53	-56.5	0	0	0	114.4	F741 L750 R763 Q767 T768 L774 I788 L792	F741-F765 HydrophobicContact CD2-CD1 4.02Å; F741-F765 AromaticContact CD2-CE1 3.94Å; F741-F765 HydrophobicContact CD2-CE1 3.94Å; F741-F765 HydrophobicContact CE2-CD1 4.28Å; F741-F765 AromaticContact CE2-CE1 3.72Å; F741-F765 HydrophobicContact CE2-CE1 3.72Å; L750-F765 HydrophobicContact CD2-CD1 4.21Å; L750-F765 HydrophobicContact CD2-CE1 3.75Å; R763-F765 PolarHBondContact O-N 3.27Å; R763-F765 VanDerWaalsContact O-N 3.14Å; F765-Q767 PolarHBondContact O-N 2.84Å; F765-Q767 VanDerWaalsContact O-N 3.09Å; F765-T768 PolarHBondContact O-N 3.34Å; F765-T768 PolarHBondContact O-OG1 3.32Å; F765-L774 HydrophobicContact CD2-CD2 4.2Å; F765-L774 HydrophobicContact CE1-CD1 4.37Å; F765-L774 HydrophobicContact CE2-CD2 3.8Å; F765-L774 HydrophobicContact CZ-CD1 4.12Å; F765-L774 HydrophobicContact CZ-CD2 4.07Å; F765-I788 HydrophobicContact CD2-CD1 3.9Å; F765-I788 HydrophobicContact CD2-CG1 3.66Å; F765-I788 HydrophobicContact CE2-CD1 3.75Å; F765-I788 HydrophobicContact CE2-CG1 4.03Å; F765-L792 HydrophobicContact CB-CD1 3.92Å; F765-L792 HydrophobicContact CB-CD2 4.32Å; F765-L792 HydrophobicContact CD2-CD1 4.36Å; F765-L792 HydrophobicContact CG-CD1 4.39Å
766	H	79.9	Confident	86.9	Confident	106 Å²	106	46.8 Å²	46.8	49%	0.491	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.8	-176	-176.6	-31.1	0	0	0	113.3	R763 E791	R763-H766 PolarHBondContact O-N 3.24Å; H766-E791 IonicContact CD2-OE2 2.72Å; H766-E791 IonicContact CE1-OE2 3.93Å; H766-E791 IonicContact CG-OE2 3.63Å; H766-E791 IonicContact ND1-OE2 3.92Å; H766-E791 PolarHBondContact ND1-OE2 3.49Å
767	Q	74.2	Confident	86.7	Confident	84 Å²	84	44 Å²	44	39%	0.393	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	9.9	177.5	-66.6	-144.9	35.3	0	0	115.1	N742 F765 P769	N742-Q767 VanDerWaalsContact OD1-CD 3.22Å; N742-Q767 PolarHBondContact OD1-NE2 3.06Å; N742-Q767 PolarHBondContact OD1-OE1 3.26Å; F765-Q767 PolarHBondContact O-N 2.84Å; F765-Q767 VanDerWaalsContact O-N 3.09Å; Q767-P769 VanDerWaalsContact O-CD 3.26Å; Q767-P769 WeakPolarHBondContact O-CD 3.09Å
768	T	87	Confident	86.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	23%	0.233	C	C	.	.			trans	-117.5	54.2	179.1	62.6	0	0	0	0	112.3	F741 L744 I747 F765 V770 L771 L792	F741-T768 HydrophobicContact CB-CG2 4.16Å; L744-T768 HydrophobicContact CB-CG2 4.25Å; I747-T768 HydrophobicContact CG2-CG2 3.47Å; I747-T768 VanDerWaalsContact CG2-CG2 3.47Å; F765-T768 PolarHBondContact O-N 3.34Å; F765-T768 PolarHBondContact O-OG1 3.32Å; T768-V770 VanDerWaalsContact C-N 3.27Å; T768-V770 PolarHBondContact O-N 3.27Å; T768-L771 VanDerWaalsContact O-CB 3.25Å; T768-L771 WeakPolarHBondContact O-CB 3.01Å; T768-L771 PolarHBondContact O-N 3.1Å; T768-L792 VanDerWaalsContact O-CD2 3.27Å; T768-L792 WeakPolarHBondContact O-CD2 3.32Å
769	P	80.4	Confident	86.8	Confident	71 Å²	71	41.3 Å²	41.3	46%	0.461	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.4	-167.5	30	-37.9	0	0	0	114.8	Q767	Q767-P769 VanDerWaalsContact O-CD 3.26Å; Q767-P769 WeakPolarHBondContact O-CD 3.09Å
770	V	88.5	Confident	87.2	Confident	65 Å²	65	43.8 Å²	43.8	39%	0.394	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.9	177.8	-55.8	0	0	0	0	113.4	K745 I747 T768 K772	K745-V770 WeakPolarHBondContact O-CG2 3.16Å; I747-V770 CarbonylContact O-C 3.6Å; I747-V770 WeakPolarHBondContact O-CG2 3.38Å; T768-V770 VanDerWaalsContact C-N 3.27Å; T768-V770 PolarHBondContact O-N 3.27Å; V770-K772 PolarHBondContact O-N 3.31Å
771	L	90.4	Very high	87.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.			trans	-63.4	123.6	179.4	-171	69.2	0	0	0	110.9	I747 L750 T768 L774 L792 L794	I747-L771 HydrophobicContact CG1-CD1 4.24Å; I747-L771 HydrophobicContact CG2-CD1 4.22Å; I747-L771 VanDerWaalsContact O-CA 3.22Å; I747-L771 WeakPolarHBondContact O-CA 3.06Å; I747-L771 PolarHBondContact O-N 2.85Å; L750-L771 HydrophobicContact CB-CD1 3.69Å; L750-L771 HydrophobicContact CB-CD2 4.42Å; T768-L771 VanDerWaalsContact O-CB 3.25Å; T768-L771 WeakPolarHBondContact O-CB 3.01Å; T768-L771 PolarHBondContact O-N 3.1Å; L771-L774 HydrophobicContact CD2-CB 4.03Å; L771-L774 HydrophobicContact CD2-CD1 4.33Å; L771-L774 HydrophobicContact CD2-CD2 4.22Å; L771-L774 HydrophobicContact CD2-CG 4.42Å; L771-L792 HydrophobicContact CB-CD2 4.47Å; L771-L792 HydrophobicContact CD2-CD1 4.35Å; L771-L794 HydrophobicContact CB-CD2 4.47Å; L771-L794 HydrophobicContact CD2-CD2 4.19Å; L771-L794 HydrophobicContact CG-CD2 3.99Å
772	K	88.6	Confident	87.6	Confident	60 Å²	60	48.1 Å²	48.1	26%	0.261	23%	0.227	S	C	.	.			trans	-105.1	-39.5	-179.3	-59.5	174.1	-169	167.4	0	111.9	E748 V770 L794 E795 S796	E748-K772 HydrophobicContact CB-CD 4.21Å; E748-K772 HydrophobicContact CB-CG 4.44Å; E748-K772 VanDerWaalsContact CD-CE 3.47Å; E748-K772 HydrophobicContact CG-CD 4.48Å; E748-K772 WeakPolarHBondContact O-CA 3.03Å; E748-K772 WeakPolarHBondContact O-CB 3.38Å; E748-K772 PolarHBondContact O-N 3.41Å; E748-K772 WeakPolarHBondContact OE1-CE 3.44Å; E748-K772 IonicContact OE1-NZ 3.28Å; E748-K772 PolarHBondContact OE1-NZ 2.74Å; E748-K772 WeakPolarHBondContact OE2-CE 3.44Å; E748-K772 IonicContact OE2-NZ 3.27Å; E748-K772 PolarHBondContact OE2-NZ 3.41Å; V770-K772 PolarHBondContact O-N 3.31Å; K772-L794 CarbonylContact O-C 3.14Å; K772-L794 WeakPolarHBondContact O-CA 3.08Å; K772-E795 HydrophobicContact CB-CB 4.26Å; K772-E795 HydrophobicContact CB-CG 4.07Å; K772-E795 HydrophobicContact CG-CG 4.34Å; K772-E795 WeakPolarHBondContact O-CA 3.33Å; K772-E795 PolarHBondContact O-N 2.81Å; K772-S796 PolarHBondContact O-N 2.97Å
773	I	90.1	Very high	88	Confident	50 Å²	50	47 Å²	47	26%	0.256	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.3	-175.2	-52.4	-173.7	0	0	0	109.1	E748 I749 L750 L751 M775 S796	E748-I773 PolarHBondContact O-N 2.77Å; I749-I773 HydrophobicContact CB-CB 4.44Å; I749-I773 HydrophobicContact CD1-CD1 4.18Å; I749-I773 HydrophobicContact CG1-CB 4.18Å; I749-I773 HydrophobicContact CG1-CD1 4.11Å; I749-I773 HydrophobicContact CG1-CG1 4.24Å; I749-I773 HydrophobicContact CG2-CB 4.21Å; I749-I773 HydrophobicContact CG2-CG2 4.44Å; L750-I773 PolarHBondContact N-O 2.64Å; L751-I773 HydrophobicContact CD2-CG2 4.23Å; I773-M775 HydrophobicContact CG2-CE 3.83Å; I773-M775 HydrophobicContact CG2-CG 4.43Å; I773-S796 WeakPolarHBondContact CA-O 3.2Å
774	L	93.1	Very high	88.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.4	177.4	176.9	56.1	0	0	0	110.2	L750 L752 F765 L771 L776 F789 L794 S796 L797 S798	L750-L774 HydrophobicContact CB-CD1 4.24Å; L750-L774 HydrophobicContact CD2-CD1 4.11Å; L750-L774 HydrophobicContact CG-CD1 4.14Å; L750-L774 WeakPolarHBondContact O-CA 3.16Å; L752-L774 HydrophobicContact CD1-CD1 4.46Å; F765-L774 HydrophobicContact CD2-CD2 4.2Å; F765-L774 HydrophobicContact CE1-CD1 4.37Å; F765-L774 HydrophobicContact CE2-CD2 3.8Å; F765-L774 HydrophobicContact CZ-CD1 4.12Å; F765-L774 HydrophobicContact CZ-CD2 4.07Å; L771-L774 HydrophobicContact CD2-CB 4.03Å; L771-L774 HydrophobicContact CD2-CD1 4.33Å; L771-L774 HydrophobicContact CD2-CD2 4.22Å; L771-L774 HydrophobicContact CD2-CG 4.42Å; L774-L776 HydrophobicContact CD1-CD1 4.2Å; L774-L776 HydrophobicContact CD1-CG 4.03Å; L774-L776 HydrophobicContact CD2-CD1 3.92Å; L774-L776 HydrophobicContact CG-CD1 3.95Å; L774-L776 HydrophobicContact CG-CG 4.11Å; L774-F789 HydrophobicContact CD2-CE1 3.98Å; L774-L794 HydrophobicContact CB-CD1 4.5Å; L774-L794 HydrophobicContact CB-CD2 3.79Å; L774-S796 PolarHBondContact N-O 2.87Å; L774-L797 HydrophobicContact CB-CD1 4.02Å; L774-L797 HydrophobicContact CD2-CD1 4.03Å; L774-L797 HydrophobicContact CG-CD1 3.92Å; L774-L797 VanDerWaalsContact O-CA 3.31Å; L774-L797 WeakPolarHBondContact O-CA 3.05Å; L774-L797 WeakPolarHBondContact O-CD1 3.41Å; L774-S798 PolarHBondContact O-N 2.73Å
775	M	92.2	Very high	88.4	Confident	9 Å²	9	41.8 Å²	41.8	4%	0.044	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.8	178.5	-65.6	-57.7	162.1	0	0	111.1	L750 L751 L752 Q753 I773 S796 S798 N825	L750-M775 PolarHBondContact O-N 2.64Å; L750-M775 VanDerWaalsContact O-N 3.07Å; L751-M775 HydrophobicContact CD2-CB 3.82Å; L751-M775 HydrophobicContact CD2-CG 3.54Å; L752-M775 CarbonylContact C-O 3.42Å; L752-M775 WeakPolarHBondContact CA-O 3.27Å; L752-M775 WeakPolarHBondContact CB-O 3.43Å; L752-M775 PolarHBondContact N-O 2.79Å; Q753-M775 HydrophobicContact CB-CB 4.48Å; Q753-M775 PolarHBondContact N-O 3.36Å; Q753-M775 VanDerWaalsContact OE1-CB 3.23Å; I773-M775 HydrophobicContact CG2-CE 3.83Å; I773-M775 HydrophobicContact CG2-CG 4.43Å; M775-S796 WeakPolarHBondContact CE-OG 3.42Å; M775-S798 WeakPolarHBondContact SD-CB 3.41Å; M775-N825 HydrophobicContact CE-CB 4.26Å
776	L	93.1	Very high	88.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.			trans	-125.6	12.3	-177.3	-74	168.1	0	0	0	111.7	L752 L760 L774 L781 S798 L799 N802	L752-L776 HydrophobicContact CB-CD2 4.03Å; L752-L776 HydrophobicContact CD1-CD2 3.96Å; L760-L776 HydrophobicContact CD1-CD1 3.79Å; L760-L776 HydrophobicContact CD1-CD2 4.28Å; L774-L776 HydrophobicContact CD1-CD1 4.2Å; L774-L776 HydrophobicContact CD1-CG 4.03Å; L774-L776 HydrophobicContact CD2-CD1 3.92Å; L774-L776 HydrophobicContact CG-CD1 3.95Å; L774-L776 HydrophobicContact CG-CG 4.11Å; L776-L781 HydrophobicContact CB-CD1 4.17Å; L776-S798 CarbonylContact C-O 3.58Å; L776-S798 WeakPolarHBondContact CA-O 3.32Å; L776-S798 PolarHBondContact N-O 2.92Å; L776-L799 HydrophobicContact CB-CD2 4.02Å; L776-L799 HydrophobicContact CD1-CD2 4.12Å; L776-N802 PolarHBondContact O-ND2 3.18Å
777	N	90.3	Very high	88.1	Confident	25 Å²	25	44.2 Å²	44.2	13%	0.134	23%	0.226	C	C	.	.			trans	-69.4	164.5	178.9	62.3	-74.3	0	0	0	112.4	Q753 H754 N779 S798 S800	Q753-N777 VanDerWaalsContact CA-O 3.24Å; Q753-N777 WeakPolarHBondContact CA-O 3.39Å; Q753-N777 WeakPolarHBondContact CB-O 3.41Å; Q753-N777 VanDerWaalsContact CB-OD1 3.31Å; Q753-N777 WeakPolarHBondContact CB-OD1 3.15Å; H754-N777 PolarHBondContact N-O 2.96Å; N777-N779 VanDerWaalsContact C-N 3.27Å; N777-N779 PolarHBondContact O-N 3.41Å; N777-N779 PolarHBondContact O-ND2 2.97Å; N777-S798 PolarHBondContact N-O 3.42Å; N777-S800 CarbonylContact C-O 3.58Å; N777-S800 WeakPolarHBondContact CA-O 3.36Å; N777-S800 VanDerWaalsContact CB-O 3.32Å; N777-S800 WeakPolarHBondContact CB-O 3.44Å; N777-S800 VanDerWaalsContact CB-OG 3.22Å; N777-S800 WeakPolarHBondContact CB-OG 3.47Å
778	N	91.5	Very high	88.7	Confident	56 Å²	56	40.5 Å²	40.5	30%	0.299	21%	0.209	S	C	.	.	S	Bend	trans	52.9	45.5	178	-57.7	34.4	0	0	0	112	H754 S800 A801	H754-N778 WeakPolarHBondContact CA-O 3.45Å; H754-N778 WeakPolarHBondContact CD2-CB 3.39Å; H754-N778 PolarHBondContact CD2-ND2 3.05Å; H754-N778 PolarHBondContact N-O 3.07Å; H754-N778 PolarHBondContact NE2-ND2 3.32Å; N778-S800 PolarHBondContact N-O 2.79Å; N778-A801 WeakPolarHBondContact CA-O 3.33Å; N778-A801 WeakPolarHBondContact OD1-CB 3.35Å
779	N	93.8	Very high	88.7	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.016	21%	0.21	C	C	.	.	S	Bend	trans	-118.3	-169.9	179	-96.3	-92.4	0	0	0	110.3	L752 N755 I757 N777 L781 N802 P803	L752-N779 PolarHBondContact O-ND2 2.93Å; N755-N779 WeakPolarHBondContact CB-OD1 3.03Å; N755-N779 WeakPolarHBondContact O-CA 3.33Å; N755-N779 PolarHBondContact O-OD1 3.44Å; I757-N779 VanDerWaalsContact CB-OD1 3.3Å; I757-N779 WeakPolarHBondContact CB-OD1 3.38Å; I757-N779 VanDerWaalsContact CG1-OD1 3.3Å; I757-N779 WeakPolarHBondContact CG1-OD1 3.47Å; I757-N779 PolarHBondContact N-OD1 3.1Å; I757-N779 VanDerWaalsContact N-OD1 3.07Å; N777-N779 VanDerWaalsContact C-N 3.27Å; N777-N779 PolarHBondContact O-N 3.41Å; N777-N779 PolarHBondContact O-ND2 2.97Å; N779-L781 HydrophobicContact CB-CG 4.24Å; N779-N802 WeakPolarHBondContact CA-OD1 3.15Å; N779-N802 WeakPolarHBondContact CB-OD1 3.22Å; N779-N802 PolarHBondContact N-OD1 2.83Å; N779-N802 PolarHBondContact O-OD1 3.42Å; N779-P803 WeakPolarHBondContact O-CD 3.33Å
780	K	93.6	Very high	88.5	Confident	104 Å²	104	42.5 Å²	42.5	45%	0.452	22%	0.219	S	C	.	.			trans	-110.7	26	177.4	-54.5	-60.3	175.9	-170.4	0	112.8	Q756 I757 K758 R782 N802 P803	Q756-K780 HydrophobicContact CB-CG 4.43Å; I757-K780 CarbonylContact O-C 3.28Å; I757-K780 WeakPolarHBondContact O-CA 3.47Å; I757-K780 PolarHBondContact O-N 3.14Å; I757-K780 VanDerWaalsContact O-N 3.14Å; K758-K780 HydrophobicContact CG-CB 4.4Å; K780-R782 PolarHBondContact O-N 3.49Å; K780-N802 PolarHBondContact N-OD1 3.19Å; K780-P803 VanDerWaalsContact C-CD 3.49Å; K780-P803 VanDerWaalsContact C-CG 3.49Å; K780-P803 HydrophobicContact CB-CG 4.43Å; K780-P803 WeakPolarHBondContact O-CG 3.42Å
781	L	92.8	Very high	87.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.226	C	C	.	.			trans	-62.1	107.6	-174.4	-64	172.6	0	0	0	111.4	I757 K758 L760 L776 N779 I784 L799 N802 P803 F804	I757-L781 HydrophobicContact CB-CD2 4.24Å; I757-L781 HydrophobicContact CG2-CD2 3.8Å; I757-L781 WeakPolarHBondContact O-CD2 3.3Å; I757-L781 PolarHBondContact O-N 3.03Å; K758-L781 WeakPolarHBondContact O-CA 3.48Å; L760-L781 HydrophobicContact CD1-CD1 4.04Å; L760-L781 HydrophobicContact CD1-CD2 3.83Å; L760-L781 HydrophobicContact CG-CD2 3.69Å; L776-L781 HydrophobicContact CB-CD1 4.17Å; N779-L781 HydrophobicContact CB-CG 4.24Å; L781-I784 HydrophobicContact CD1-CD1 4.36Å; L781-L799 HydrophobicContact CD1-CD2 4.35Å; L781-N802 HydrophobicContact CB-CB 4.12Å; L781-N802 WeakPolarHBondContact CB-OD1 3.44Å; L781-N802 WeakPolarHBondContact CG-OD1 3.47Å; L781-N802 PolarHBondContact N-OD1 3.47Å; L781-P803 CarbonylContact O-C 3.56Å; L781-F804 HydrophobicContact CB-CE1 3.94Å; L781-F804 HydrophobicContact CB-CZ 4.43Å; L781-F804 WeakPolarHBondContact O-CD1 3.35Å; L781-F804 PolarHBondContact O-N 3.43Å
782	R	88.1	Confident	87.6	Confident	155 Å²	155	45.8 Å²	45.8	59%	0.585	23%	0.231	S	C	*	.			trans	-90.1	-36	170.4	-66.1	-173.8	173.1	-168.4	-4.2	111.5	K758 K780 P803 K805	K758-R782 PolarHBondContact O-N 3.42Å; K780-R782 PolarHBondContact O-N 3.49Å; R782-P803 WeakPolarHBondContact CA-O 3.43Å; R782-P803 HydrophobicContact CG-CG 4.23Å; R782-P803 WeakPolarHBondContact CG-O 3.48Å; R782-K805 HydrophobicContact CB-CB 4.37Å; R782-K805 WeakPolarHBondContact O-CB 3.46Å; R782-K805 PolarHBondContact O-N 3.16Å
783	C	86.9	Confident	87.3	Confident	50 Å²	50	48.9 Å²	48.9	34%	0.338	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147	-177.2	80.5	0	0	0	0	113.6	C759 L760	C759-C783 VanDerWaalsContact CA-O 3.24Å; C759-C783 WeakPolarHBondContact CA-O 3.38Å; C759-C783 HydrophobicContact CB-CB 4.39Å; C759-C783 WeakPolarHBondContact CB-SG 3.32Å; C759-C783 WeakPolarHBondContact SG-CB 3.43Å; C759-C783 PolarHBondContact SG-N 2.86Å; C759-C783 VanDerWaalsContact SG-N 3.4Å; C759-C783 CovalentContact SG-SG 2.04Å; C759-C783 PolarHBondContact SG-SG 2.8Å; L760-C783 PolarHBondContact N-O 2.85Å; L760-C783 VanDerWaalsContact N-O 3.15Å
784	I	88.7	Confident	86.9	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.5	175.6	-53.9	-176.3	0	0	0	108.2	L760 L781 I788 L799 F804 L810 W812	L760-I784 HydrophobicContact CB-CG2 4.45Å; L781-I784 HydrophobicContact CD1-CD1 4.36Å; I784-I788 HydrophobicContact CG2-CB 4.39Å; I784-I788 HydrophobicContact CG2-CD1 4.16Å; I784-I788 HydrophobicContact CG2-CG2 3.45Å; I784-I788 VanDerWaalsContact CG2-CG2 3.45Å; I784-L799 HydrophobicContact CD1-CD2 3.91Å; I784-F804 HydrophobicContact CD1-CE1 3.73Å; I784-F804 HydrophobicContact CD1-CZ 4.3Å; I784-F804 HydrophobicContact CG1-CE1 4.14Å; I784-L810 HydrophobicContact CB-CD1 4Å; I784-L810 HydrophobicContact CG1-CD1 4.44Å; I784-W812 HydrophobicContact CB-CZ2 4.07Å; I784-W812 HydrophobicContact CG2-CH2 4.18Å; I784-W812 HydrophobicContact CG2-CZ2 3.74Å; I784-W812 PolarHBondContact O-NE1 3.13Å; I784-W812 VanDerWaalsContact O-NE1 3.08Å
785	A	84.5	Confident	86.5	Confident	32 Å²	32	52.8 Å²	52.8	26%	0.264	27%	0.268	S	S	.	.			trans	-68.3	138.8	-179.3	0	0	0	0	0	112.9	L760 N762 G787 I788 W812	L760-A785 WeakPolarHBondContact O-CB 3.48Å; L760-A785 PolarHBondContact O-N 3.47Å; N762-A785 HydrophobicContact CB-CB 4.01Å; A785-G787 PolarHBondContact O-N 3.12Å; A785-I788 WeakPolarHBondContact O-CG2 3.18Å; A785-I788 PolarHBondContact O-N 2.82Å; A785-W812 WeakPolarHBondContact O-CZ2 3.27Å
786	K	81.3	Confident	86.1	Confident	138 Å²	138	53 Å²	53	60%	0.6	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	129.7	175.5	-172.3	-174.6	176.3	-168.8	0	110.3	N762 W812	N762-K786 WeakPolarHBondContact CB-O 3.3Å; N762-K786 PolarHBondContact ND2-O 2.86Å; K786-W812 HydrophobicContact CB-CD2 4.3Å; K786-W812 HydrophobicContact CB-CG 3.93Å; K786-W812 HydrophobicContact CD-CB 4.31Å; K786-W812 HydrophobicContact CG-CB 4.03Å; K786-W812 HydrophobicContact CG-CD2 4.29Å; K786-W812 HydrophobicContact CG-CG 3.84Å
787	G	81.5	Confident	85.9	Confident	22 Å²	22	53 Å²	53	23%	0.227	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-10.7	179.1	0	0	0	0	0	115.2	A785 F789 T790	A785-G787 PolarHBondContact O-N 3.12Å; G787-F789 PolarHBondContact O-N 2.71Å; G787-T790 WeakPolarHBondContact CA-OG1 3.38Å; G787-T790 PolarHBondContact O-N 3.39Å; G787-T790 PolarHBondContact O-OG1 3.29Å
788	I	86.3	Confident	85.8	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.031	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.5	-177.6	-169.1	168.1	0	0	0	115	L760 N761 N762 F765 I784 A785 W812	L760-I788 HydrophobicContact CB-CD1 3.44Å; L760-I788 VanDerWaalsContact CB-CD1 3.44Å; L760-I788 HydrophobicContact CD1-CD1 4.08Å; L760-I788 HydrophobicContact CG-CD1 4.3Å; N761-I788 VanDerWaalsContact O-CD1 3.25Å; N761-I788 WeakPolarHBondContact O-CD1 3.49Å; N762-I788 HydrophobicContact CB-CB 4.49Å; F765-I788 HydrophobicContact CD2-CD1 3.9Å; F765-I788 HydrophobicContact CD2-CG1 3.66Å; F765-I788 HydrophobicContact CE2-CD1 3.75Å; F765-I788 HydrophobicContact CE2-CG1 4.03Å; I784-I788 HydrophobicContact CG2-CB 4.39Å; I784-I788 HydrophobicContact CG2-CD1 4.16Å; I784-I788 HydrophobicContact CG2-CG2 3.45Å; I784-I788 VanDerWaalsContact CG2-CG2 3.45Å; A785-I788 WeakPolarHBondContact O-CG2 3.18Å; A785-I788 PolarHBondContact O-N 2.82Å; I788-W812 HydrophobicContact CG2-CH2 3.97Å; I788-W812 HydrophobicContact CG2-CZ2 4.3Å
789	F	87.4	Confident	85.8	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.026	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	2.4	179.7	-50.2	-46.6	0	0	0	113.5	L774 G787 E791 L792 L794 L797 L799 W812 W816	L774-F789 HydrophobicContact CD2-CE1 3.98Å; G787-F789 PolarHBondContact O-N 2.71Å; F789-E791 VanDerWaalsContact C-N 3.27Å; F789-E791 PolarHBondContact O-N 2.9Å; F789-L792 HydrophobicContact CD1-CD1 4.25Å; F789-L792 PolarHBondContact O-N 2.81Å; F789-L794 HydrophobicContact CD1-CD1 4.46Å; F789-L797 HydrophobicContact CD2-CD2 4.41Å; F789-L797 HydrophobicContact CE1-CD1 4.5Å; F789-L797 HydrophobicContact CE2-CD2 4.08Å; F789-L797 HydrophobicContact CZ-CD1 4.45Å; F789-L797 HydrophobicContact CZ-CD2 4.14Å; F789-L799 HydrophobicContact CE2-CD1 4.27Å; F789-L799 HydrophobicContact CZ-CD1 4.44Å; F789-L799 HydrophobicContact CZ-CD2 4.49Å; F789-W812 AromaticContact CD2-CH2 3.94Å; F789-W812 HydrophobicContact CD2-CH2 3.94Å; F789-W812 HydrophobicContact CD2-CZ3 4.27Å; F789-W812 HydrophobicContact CE2-CH2 4.03Å; F789-W816 HydrophobicContact CB-CH2 4.37Å; F789-W816 HydrophobicContact CB-CZ2 3.55Å; F789-W816 HydrophobicContact CD2-CD2 4.14Å; F789-W816 AromaticContact CD2-CE2 3.86Å; F789-W816 HydrophobicContact CD2-CE3 4.22Å; F789-W816 AromaticContact CD2-CH2 3.9Å; F789-W816 HydrophobicContact CD2-CH2 3.9Å; F789-W816 AromaticContact CD2-CZ2 3.75Å; F789-W816 HydrophobicContact CD2-CZ2 3.75Å; F789-W816 HydrophobicContact CD2-CZ3 4.11Å; F789-W816 HydrophobicContact CE2-CZ3 4.47Å; F789-W816 HydrophobicContact CG-CH2 4.3Å; F789-W816 AromaticContact CG-CZ2 3.93Å; F789-W816 HydrophobicContact CG-CZ2 3.93Å
790	T	76.1	Confident	85.4	Confident	107 Å²	107	49.3 Å²	49.3	66%	0.656	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-14	-172.8	47	0	0	0	0	114.4	G787	G787-T790 WeakPolarHBondContact CA-OG1 3.38Å; G787-T790 PolarHBondContact O-N 3.39Å; G787-T790 PolarHBondContact O-OG1 3.29Å
791	E	74.7	Confident	85.1	Confident	113 Å²	113	46.4 Å²	46.4	53%	0.528	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	1.6	176.8	-59.1	-174	165.6	0	0	112.8	H766 F789	H766-E791 IonicContact CD2-OE2 2.72Å; H766-E791 IonicContact CE1-OE2 3.93Å; H766-E791 IonicContact CG-OE2 3.63Å; H766-E791 IonicContact ND1-OE2 3.92Å; H766-E791 PolarHBondContact ND1-OE2 3.49Å; F789-E791 VanDerWaalsContact C-N 3.27Å; F789-E791 PolarHBondContact O-N 2.9Å
792	L	84.3	Confident	84.9	Confident	22 Å²	22	46.7 Å²	46.7	12%	0.115	25%	0.247	C	C	.	.			trans	-107.3	134	-176.9	-53.3	-178.8	0	0	0	111.1	F765 T768 L771 F789 L794	F765-L792 HydrophobicContact CB-CD1 3.92Å; F765-L792 HydrophobicContact CB-CD2 4.32Å; F765-L792 HydrophobicContact CD2-CD1 4.36Å; F765-L792 HydrophobicContact CG-CD1 4.39Å; T768-L792 VanDerWaalsContact O-CD2 3.27Å; T768-L792 WeakPolarHBondContact O-CD2 3.32Å; L771-L792 HydrophobicContact CB-CD2 4.47Å; L771-L792 HydrophobicContact CD2-CD1 4.35Å; F789-L792 HydrophobicContact CD1-CD1 4.25Å; F789-L792 PolarHBondContact O-N 2.81Å; L792-L794 HydrophobicContact CB-CD1 4.46Å; L792-L794 HydrophobicContact CB-CG 4.11Å; L792-L794 HydrophobicContact CD1-CD1 4.42Å
793	N	81.9	Confident	85.1	Confident	124 Å²	124	40.8 Å²	40.8	66%	0.663	23%	0.229	S	C	*	.			trans	-104.6	67.6	172.7	-175.4	81	0	0	0	110.4
794	L	83	Confident	85.4	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	21%	0.213	C	C	.	.			trans	-62.7	135.2	-178.5	-65.6	164.6	0	0	0	111.1	L771 K772 L774 F789 L792 L797 Q823	L771-L794 HydrophobicContact CB-CD2 4.47Å; L771-L794 HydrophobicContact CD2-CD2 4.19Å; L771-L794 HydrophobicContact CG-CD2 3.99Å; K772-L794 CarbonylContact O-C 3.14Å; K772-L794 WeakPolarHBondContact O-CA 3.08Å; L774-L794 HydrophobicContact CB-CD1 4.5Å; L774-L794 HydrophobicContact CB-CD2 3.79Å; F789-L794 HydrophobicContact CD1-CD1 4.46Å; L792-L794 HydrophobicContact CB-CD1 4.46Å; L792-L794 HydrophobicContact CB-CG 4.11Å; L792-L794 HydrophobicContact CD1-CD1 4.42Å; L794-L797 HydrophobicContact CD1-CB 4.17Å; L794-L797 HydrophobicContact CD1-CD1 4.38Å; L794-L797 HydrophobicContact CD1-CD2 4.26Å; L794-Q823 VanDerWaalsContact O-CG 3.32Å; L794-Q823 WeakPolarHBondContact O-CG 3.42Å; L794-Q823 PolarHBondContact O-NE2 3.38Å
795	E	84	Confident	85.4	Confident	129 Å²	129	42.9 Å²	42.9	60%	0.603	23%	0.232	S	C	*	.	S	Bend	trans	-82	-26.2	161.7	-65	-173	-164.1	0	0	111	K772	K772-E795 HydrophobicContact CB-CB 4.26Å; K772-E795 HydrophobicContact CB-CG 4.07Å; K772-E795 HydrophobicContact CG-CG 4.34Å; K772-E795 WeakPolarHBondContact O-CA 3.33Å; K772-E795 PolarHBondContact O-N 2.81Å
796	S	83.5	Confident	85.6	Confident	12 Å²	12	41.3 Å²	41.3	8%	0.084	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	131.2	-170.9	-176.2	0	0	0	0	112.5	K772 I773 L774 M775 Q823 N825	K772-S796 PolarHBondContact O-N 2.97Å; I773-S796 WeakPolarHBondContact CA-O 3.2Å; L774-S796 PolarHBondContact N-O 2.87Å; M775-S796 WeakPolarHBondContact CE-OG 3.42Å; S796-Q823 CarbonylContact C-O 3.17Å; S796-Q823 VanDerWaalsContact CA-O 3.22Å; S796-Q823 WeakPolarHBondContact CA-O 3.48Å; S796-N825 PolarHBondContact OG-ND2 2.95Å; S796-N825 PolarHBondContact OG-OD1 2.9Å
797	L	89.8	Confident	85.8	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	131.1	177.6	175	64.1	0	0	0	110.6	L774 F789 L794 L799 W816 Q823 I824 N825	L774-L797 HydrophobicContact CB-CD1 4.02Å; L774-L797 HydrophobicContact CD2-CD1 4.03Å; L774-L797 HydrophobicContact CG-CD1 3.92Å; L774-L797 VanDerWaalsContact O-CA 3.31Å; L774-L797 WeakPolarHBondContact O-CA 3.05Å; L774-L797 WeakPolarHBondContact O-CD1 3.41Å; F789-L797 HydrophobicContact CD2-CD2 4.41Å; F789-L797 HydrophobicContact CE1-CD1 4.5Å; F789-L797 HydrophobicContact CE2-CD2 4.08Å; F789-L797 HydrophobicContact CZ-CD1 4.45Å; F789-L797 HydrophobicContact CZ-CD2 4.14Å; L794-L797 HydrophobicContact CD1-CB 4.17Å; L794-L797 HydrophobicContact CD1-CD1 4.38Å; L794-L797 HydrophobicContact CD1-CD2 4.26Å; L797-L799 HydrophobicContact CD1-CG 4.29Å; L797-L799 HydrophobicContact CD2-CD1 4.03Å; L797-L799 HydrophobicContact CD2-CG 4.32Å; L797-L799 HydrophobicContact CG-CD1 4.46Å; L797-L799 HydrophobicContact CG-CG 4.22Å; L797-W816 HydrophobicContact CD2-CH2 3.43Å; L797-W816 VanDerWaalsContact CD2-CH2 3.43Å; L797-W816 HydrophobicContact CD2-CZ3 3.54Å; L797-Q823 PolarHBondContact N-O 3.08Å; L797-I824 CarbonylContact O-C 3.6Å; L797-I824 WeakPolarHBondContact O-CA 3.45Å; L797-N825 PolarHBondContact O-N 3Å
798	S	87.6	Confident	85.8	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.014	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.8	163.8	-155	0	0	0	0	112.9	L774 M775 L776 N777 S800 N825	L774-S798 PolarHBondContact O-N 2.73Å; M775-S798 WeakPolarHBondContact SD-CB 3.41Å; L776-S798 CarbonylContact C-O 3.58Å; L776-S798 WeakPolarHBondContact CA-O 3.32Å; L776-S798 PolarHBondContact N-O 2.92Å; N777-S798 PolarHBondContact N-O 3.42Å; S798-S800 PolarHBondContact OG-OG 3.13Å; S798-S800 VanDerWaalsContact OG-OG 3.13Å; S798-N825 WeakPolarHBondContact CB-O 3.24Å; S798-N825 PolarHBondContact OG-O 3.35Å
799	L	91	Very high	85.4	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	23%	0.225	C	C	.	.			trans	-123.7	10.5	177.5	-71.1	171.1	0	0	0	111.7	L776 L781 I784 F789 L797 N802 F804 L813 L817 P831	L776-L799 HydrophobicContact CB-CD2 4.02Å; L776-L799 HydrophobicContact CD1-CD2 4.12Å; L781-L799 HydrophobicContact CD1-CD2 4.35Å; I784-L799 HydrophobicContact CD1-CD2 3.91Å; F789-L799 HydrophobicContact CE2-CD1 4.27Å; F789-L799 HydrophobicContact CZ-CD1 4.44Å; F789-L799 HydrophobicContact CZ-CD2 4.49Å; L797-L799 HydrophobicContact CD1-CG 4.29Å; L797-L799 HydrophobicContact CD2-CD1 4.03Å; L797-L799 HydrophobicContact CD2-CG 4.32Å; L797-L799 HydrophobicContact CG-CD1 4.46Å; L797-L799 HydrophobicContact CG-CG 4.22Å; L799-N802 PolarHBondContact O-ND2 3.08Å; L799-F804 HydrophobicContact CB-CZ 4.21Å; L799-F804 HydrophobicContact CD2-CZ 4.46Å; L799-F804 WeakPolarHBondContact O-CE2 3.43Å; L799-L813 HydrophobicContact CD1-CD1 4.42Å; L799-L817 HydrophobicContact CD1-CD2 4.21Å; L799-P831 HydrophobicContact CB-CG 3.89Å
800	S	85.5	Confident	85.5	Confident	2 Å²	2	42 Å²	42	1%	0.014	22%	0.224	C	C	.	.			trans	-63.3	160.3	-176.8	56.6	0	0	0	0	112.9	N777 N778 S798 N802 S829	N777-S800 CarbonylContact C-O 3.58Å; N777-S800 WeakPolarHBondContact CA-O 3.36Å; N777-S800 VanDerWaalsContact CB-O 3.32Å; N777-S800 WeakPolarHBondContact CB-O 3.44Å; N777-S800 VanDerWaalsContact CB-OG 3.22Å; N777-S800 WeakPolarHBondContact CB-OG 3.47Å; N778-S800 PolarHBondContact N-O 2.79Å; S798-S800 PolarHBondContact OG-OG 3.13Å; S798-S800 VanDerWaalsContact OG-OG 3.13Å; S800-N802 PolarHBondContact O-N 3.22Å; S800-N802 PolarHBondContact O-ND2 3.43Å; S800-S829 WeakPolarHBondContact CB-O 3.44Å
801	A	88.5	Confident	85.9	Confident	42 Å²	42	38.5 Å²	38.5	35%	0.347	20%	0.203	S	C	.	.	S	Bend	trans	48.5	51.4	179.8	0	0	0	0	0	114.6	N778	N778-A801 WeakPolarHBondContact CA-O 3.33Å; N778-A801 WeakPolarHBondContact OD1-CB 3.35Å
802	N	88.8	Confident	86.6	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.032	18%	0.182	C	C	.	.			trans	-126.5	140.8	174.9	-87.2	-80.1	0	0	0	111.4	L776 N779 K780 L781 L799 S800 F804	L776-N802 PolarHBondContact O-ND2 3.18Å; N779-N802 WeakPolarHBondContact CA-OD1 3.15Å; N779-N802 WeakPolarHBondContact CB-OD1 3.22Å; N779-N802 PolarHBondContact N-OD1 2.83Å; N779-N802 PolarHBondContact O-OD1 3.42Å; K780-N802 PolarHBondContact N-OD1 3.19Å; L781-N802 HydrophobicContact CB-CB 4.12Å; L781-N802 WeakPolarHBondContact CB-OD1 3.44Å; L781-N802 WeakPolarHBondContact CG-OD1 3.47Å; L781-N802 PolarHBondContact N-OD1 3.47Å; L799-N802 PolarHBondContact O-ND2 3.08Å; S800-N802 PolarHBondContact O-N 3.22Å; S800-N802 PolarHBondContact O-ND2 3.43Å; N802-F804 VanDerWaalsContact C-N 3.33Å; N802-F804 HydrophobicContact CB-CD2 4.05Å; N802-F804 HydrophobicContact CB-CE1 4.21Å; N802-F804 HydrophobicContact CB-CE2 3.45Å; N802-F804 VanDerWaalsContact CB-CE2 3.45Å; N802-F804 HydrophobicContact CB-CZ 3.54Å; N802-F804 WeakPolarHBondContact O-CD2 3.32Å; N802-F804 PolarHBondContact O-N 2.93Å
803	P	91.2	Very high	86.9	Confident	31 Å²	31	33.1 Å²	33.1	20%	0.201	18%	0.176	C	C	.	.			trans	-82.1	64.4	-174.6	35.6	-38.9	0	0	0	112.9	N779 K780 L781 R782 K805 I834	N779-P803 WeakPolarHBondContact O-CD 3.33Å; K780-P803 VanDerWaalsContact C-CD 3.49Å; K780-P803 VanDerWaalsContact C-CG 3.49Å; K780-P803 HydrophobicContact CB-CG 4.43Å; K780-P803 WeakPolarHBondContact O-CG 3.42Å; L781-P803 CarbonylContact O-C 3.56Å; R782-P803 WeakPolarHBondContact CA-O 3.43Å; R782-P803 HydrophobicContact CG-CG 4.23Å; R782-P803 WeakPolarHBondContact CG-O 3.48Å; P803-K805 PolarHBondContact O-N 2.81Å; P803-I834 VanDerWaalsContact C-CG2 3.44Å; P803-I834 HydrophobicContact CB-CB 4.33Å; P803-I834 HydrophobicContact CB-CG2 3.84Å; P803-I834 VanDerWaalsContact O-CG2 3.28Å; P803-I834 WeakPolarHBondContact O-CG2 3.25Å
804	F	93.6	Very high	87.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	131	-172.3	-68.8	-67	0	0	0	114.1	L781 I784 L799 N802 C806 L810 P831 I832 I834 S835 V844	L781-F804 HydrophobicContact CB-CE1 3.94Å; L781-F804 HydrophobicContact CB-CZ 4.43Å; L781-F804 WeakPolarHBondContact O-CD1 3.35Å; L781-F804 PolarHBondContact O-N 3.43Å; I784-F804 HydrophobicContact CD1-CE1 3.73Å; I784-F804 HydrophobicContact CD1-CZ 4.3Å; I784-F804 HydrophobicContact CG1-CE1 4.14Å; L799-F804 HydrophobicContact CB-CZ 4.21Å; L799-F804 HydrophobicContact CD2-CZ 4.46Å; L799-F804 WeakPolarHBondContact O-CE2 3.43Å; N802-F804 VanDerWaalsContact C-N 3.33Å; N802-F804 HydrophobicContact CB-CD2 4.05Å; N802-F804 HydrophobicContact CB-CE1 4.21Å; N802-F804 HydrophobicContact CB-CE2 3.45Å; N802-F804 VanDerWaalsContact CB-CE2 3.45Å; N802-F804 HydrophobicContact CB-CZ 3.54Å; N802-F804 WeakPolarHBondContact O-CD2 3.32Å; N802-F804 PolarHBondContact O-N 2.93Å; F804-C806 PolarHBondContact O-N 3.2Å; F804-L810 HydrophobicContact CB-CD2 3.88Å; F804-L810 HydrophobicContact CD1-CD2 3.86Å; F804-L810 HydrophobicContact CG-CD2 4.17Å; F804-P831 HydrophobicContact CD2-CB 4.22Å; F804-P831 HydrophobicContact CE2-CB 3.81Å; F804-I832 WeakPolarHBondContact CD2-O 3.25Å; F804-I834 PolarHBondContact O-N 2.87Å; F804-S835 PolarHBondContact O-N 2.88Å; F804-V844 HydrophobicContact CB-CG2 4.45Å; F804-V844 HydrophobicContact CD2-CG2 4.24Å
805	K	89	Confident	87.1	Confident	98 Å²	98	28.9 Å²	28.9	43%	0.426	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	99.6	168.2	-173.2	-173.2	-177.8	-142.1	0	108.5	R782 P803 D807 L810 S835	R782-K805 HydrophobicContact CB-CB 4.37Å; R782-K805 WeakPolarHBondContact O-CB 3.46Å; R782-K805 PolarHBondContact O-N 3.16Å; P803-K805 PolarHBondContact O-N 2.81Å; K805-D807 VanDerWaalsContact CD-OD2 3.27Å; K805-D807 WeakPolarHBondContact CD-OD2 3.49Å; K805-D807 WeakPolarHBondContact CE-OD2 3.49Å; K805-D807 HydrophobicContact CG-CB 4.39Å; K805-D807 IonicContact NZ-OD2 3.15Å; K805-D807 PolarHBondContact NZ-OD2 3.12Å; K805-D807 PolarHBondContact O-N 3.2Å; K805-L810 WeakPolarHBondContact O-CD2 3.41Å; K805-S835 CarbonylContact C-O 3.46Å; K805-S835 WeakPolarHBondContact CA-OG 3.38Å
806	C	89.2	Confident	87.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.131	C	C	.	.			trans	-81.7	58.7	-178.1	-66	0	0	0	0	111.7	F804 C833 S835 L839 F852	F804-C806 PolarHBondContact O-N 3.2Å; C806-C833 HydrophobicContact CB-CB 3.8Å; C806-C833 WeakPolarHBondContact CB-SG 3.3Å; C806-C833 VanDerWaalsContact SG-CA 3.56Å; C806-C833 WeakPolarHBondContact SG-CB 3.3Å; C806-C833 CovalentContact SG-SG 2.02Å; C806-C833 PolarHBondContact SG-SG 3.3Å; C806-S835 PolarHBondContact N-O 3.39Å; C806-L839 HydrophobicContact CB-CD1 3.97Å; C806-F852 VanDerWaalsContact C-CD1 3.46Å; C806-F852 HydrophobicContact CB-CD1 3.74Å; C806-F852 HydrophobicContact CB-CE1 3.37Å; C806-F852 HydrophobicContact CB-CZ 3.84Å; C806-F852 WeakPolarHBondContact O-CA 3.44Å; C806-F852 VanDerWaalsContact SG-CE1 3.59Å
807	D	84.6	Confident	87.4	Confident	13 Å²	13	24.1 Å²	24.1	7%	0.07	13%	0.129	C	C	.	.	S	Bend	trans	-97.2	178.3	170.3	73.5	26.4	0	0	0	111.8	K805 H809 L810 S811 F852	K805-D807 VanDerWaalsContact CD-OD2 3.27Å; K805-D807 WeakPolarHBondContact CD-OD2 3.49Å; K805-D807 WeakPolarHBondContact CE-OD2 3.49Å; K805-D807 HydrophobicContact CG-CB 4.39Å; K805-D807 IonicContact NZ-OD2 3.15Å; K805-D807 PolarHBondContact NZ-OD2 3.12Å; K805-D807 PolarHBondContact O-N 3.2Å; D807-H809 PolarHBondContact O-N 3.49Å; D807-H809 VanDerWaalsContact OD1-CB 3.32Å; D807-H809 WeakPolarHBondContact OD1-CB 3.19Å; D807-H809 IonicContact OD1-CD2 3.07Å; D807-H809 PolarHBondContact OD1-CD2 3.47Å; D807-H809 IonicContact OD1-CG 2.73Å; D807-H809 PolarHBondContact OD1-N 3.34Å; D807-H809 IonicContact OD2-CD2 2.95Å; D807-L810 PolarHBondContact O-N 2.71Å; D807-S811 PolarHBondContact O-N 2.76Å; D807-F852 WeakPolarHBondContact O-CB 3.19Å; D807-F852 WeakPolarHBondContact O-CD1 3.3Å
808	C	81	Confident	87	Confident	45 Å²	45	28.8 Å²	28.8	30%	0.304	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-23.5	-174.7	71.4	0	0	0	0	115.3	S811 F852 C854	C808-S811 VanDerWaalsContact O-CB 3.27Å; C808-S811 WeakPolarHBondContact O-CB 3.2Å; C808-S811 PolarHBondContact O-N 3.14Å; C808-S811 PolarHBondContact O-OG 2.88Å; C808-F852 WeakPolarHBondContact CA-O 3.36Å; C808-F852 WeakPolarHBondContact CB-O 3.43Å; C808-F852 PolarHBondContact N-O 3.07Å; C808-C854 HydrophobicContact CB-CB 3.93Å; C808-C854 WeakPolarHBondContact CB-SG 3.38Å; C808-C854 PolarHBondContact N-SG 2.77Å; C808-C854 WeakPolarHBondContact SG-CB 3.39Å; C808-C854 CovalentContact SG-SG 2.04Å; C808-C854 PolarHBondContact SG-SG 3.15Å
809	H	79.6	Confident	86.7	Confident	128 Å²	128	35 Å²	35	59%	0.593	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-29.8	177.1	-53.8	-68.1	0	0	0	112.6	D807 W812	D807-H809 PolarHBondContact O-N 3.49Å; D807-H809 VanDerWaalsContact OD1-CB 3.32Å; D807-H809 WeakPolarHBondContact OD1-CB 3.19Å; D807-H809 IonicContact OD1-CD2 3.07Å; D807-H809 PolarHBondContact OD1-CD2 3.47Å; D807-H809 IonicContact OD1-CG 2.73Å; D807-H809 PolarHBondContact OD1-N 3.34Å; D807-H809 IonicContact OD2-CD2 2.95Å; H809-W812 VanDerWaalsContact O-CD1 3.25Å; H809-W812 PolarHBondContact O-NE1 3.4Å
810	L	89.1	Confident	86.2	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-1.9	178.2	-157.3	64.9	0	0	0	113.2	I784 F804 K805 D807 W812 L813 F852	I784-L810 HydrophobicContact CB-CD1 4Å; I784-L810 HydrophobicContact CG1-CD1 4.44Å; F804-L810 HydrophobicContact CB-CD2 3.88Å; F804-L810 HydrophobicContact CD1-CD2 3.86Å; F804-L810 HydrophobicContact CG-CD2 4.17Å; K805-L810 WeakPolarHBondContact O-CD2 3.41Å; D807-L810 PolarHBondContact O-N 2.71Å; L810-W812 PolarHBondContact O-N 3.29Å; L810-L813 HydrophobicContact CD1-CB 4.28Å; L810-L813 HydrophobicContact CD1-CD2 3.88Å; L810-L813 HydrophobicContact CD2-CD2 4.26Å; L810-L813 HydrophobicContact CG-CB 4.17Å; L810-L813 HydrophobicContact CG-CD2 4.04Å; L810-L813 WeakPolarHBondContact O-CB 3.47Å; L810-L813 PolarHBondContact O-N 2.79Å; L810-F852 HydrophobicContact CB-CD1 4Å; L810-F852 HydrophobicContact CB-CE1 4.03Å; L810-F852 HydrophobicContact CD2-CE1 4.37Å; L810-F852 HydrophobicContact CG-CE1 4.27Å
811	S	84.6	Confident	85.6	Confident	32 Å²	32	39.5 Å²	39.5	22%	0.224	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-17.5	-176.6	64.3	0	0	0	0	116.4	D807 C808 R849	D807-S811 PolarHBondContact O-N 2.76Å; C808-S811 VanDerWaalsContact O-CB 3.27Å; C808-S811 WeakPolarHBondContact O-CB 3.2Å; C808-S811 PolarHBondContact O-N 3.14Å; C808-S811 PolarHBondContact O-OG 2.88Å; S811-R849 VanDerWaalsContact O-CD 3.32Å; S811-R849 WeakPolarHBondContact O-CD 3.3Å; S811-R849 WeakPolarHBondContact O-CG 3.32Å
812	W	88.6	Confident	84.8	Confident	22 Å²	22	45.4 Å²	45.4	8%	0.083	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.2	176.8	66.7	-87.9	0	0	0	113.4	I784 A785 K786 I788 F789 H809 L810 W816	I784-W812 HydrophobicContact CB-CZ2 4.07Å; I784-W812 HydrophobicContact CG2-CH2 4.18Å; I784-W812 HydrophobicContact CG2-CZ2 3.74Å; I784-W812 PolarHBondContact O-NE1 3.13Å; I784-W812 VanDerWaalsContact O-NE1 3.08Å; A785-W812 WeakPolarHBondContact O-CZ2 3.27Å; K786-W812 HydrophobicContact CB-CD2 4.3Å; K786-W812 HydrophobicContact CB-CG 3.93Å; K786-W812 HydrophobicContact CD-CB 4.31Å; K786-W812 HydrophobicContact CG-CB 4.03Å; K786-W812 HydrophobicContact CG-CD2 4.29Å; K786-W812 HydrophobicContact CG-CG 3.84Å; I788-W812 HydrophobicContact CG2-CH2 3.97Å; I788-W812 HydrophobicContact CG2-CZ2 4.3Å; F789-W812 AromaticContact CD2-CH2 3.94Å; F789-W812 HydrophobicContact CD2-CH2 3.94Å; F789-W812 HydrophobicContact CD2-CZ3 4.27Å; F789-W812 HydrophobicContact CE2-CH2 4.03Å; H809-W812 VanDerWaalsContact O-CD1 3.25Å; H809-W812 PolarHBondContact O-NE1 3.4Å; L810-W812 PolarHBondContact O-N 3.29Å; W812-W816 HydrophobicContact CE3-CB 3.9Å; W812-W816 HydrophobicContact CE3-CG 4.23Å; W812-W816 HydrophobicContact CZ3-CB 3.89Å; W812-W816 HydrophobicContact CZ3-CD2 4.3Å; W812-W816 AromaticContact CZ3-CG 3.8Å; W812-W816 HydrophobicContact CZ3-CG 3.8Å; W812-W816 PolarHBondContact O-N 2.04Å
813	L	90.2	Very high	83.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-169.7	-174.7	58.9	0	0	0	113.9	L799 L810 D815 W816 L817 V844	L799-L813 HydrophobicContact CD1-CD1 4.42Å; L810-L813 HydrophobicContact CD1-CB 4.28Å; L810-L813 HydrophobicContact CD1-CD2 3.88Å; L810-L813 HydrophobicContact CD2-CD2 4.26Å; L810-L813 HydrophobicContact CG-CB 4.17Å; L810-L813 HydrophobicContact CG-CD2 4.04Å; L810-L813 WeakPolarHBondContact O-CB 3.47Å; L810-L813 PolarHBondContact O-N 2.79Å; L813-D815 PolarHBondContact O-N 3.49Å; L813-W816 HydrophobicContact CD1-CE3 4.35Å; L813-W816 PolarHBondContact O-N 2.71Å; L813-W816 VanDerWaalsContact O-N 3.1Å; L813-L817 HydrophobicContact CD1-CD1 4.37Å; L813-L817 HydrophobicContact CD1-CD2 4.1Å; L813-L817 HydrophobicContact CD1-CG 3.93Å; L813-L817 HydrophobicContact CG-CD1 3.99Å; L813-L817 HydrophobicContact CG-CG 4.05Å; L813-L817 WeakPolarHBondContact O-CG 3.35Å; L813-L817 PolarHBondContact O-N 3.28Å; L813-V844 HydrophobicContact CB-CG1 4.29Å; L813-V844 HydrophobicContact CD2-CG1 4Å; L813-V844 HydrophobicContact CG-CG1 3.97Å
814	P	88.2	Confident	82.5	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-43.5	-179.6	-27.8	34.7	0	0	0	114.8	R818 V844 L847 F852	P814-R818 WeakPolarHBondContact O-CG 3.03Å; P814-R818 PolarHBondContact O-N 3.15Å; P814-V844 WeakPolarHBondContact CB-O 3.35Å; P814-V844 HydrophobicContact CG-CG1 4.08Å; P814-V844 WeakPolarHBondContact CG-O 3.31Å; P814-L847 VanDerWaalsContact CB-O 3.25Å; P814-L847 WeakPolarHBondContact CB-O 3.45Å; P814-F852 HydrophobicContact CG-CD2 4.17Å; P814-F852 HydrophobicContact CG-CE1 4.28Å; P814-F852 HydrophobicContact CG-CE2 3.3Å; P814-F852 HydrophobicContact CG-CZ 3.39Å
815	D	81.3	Confident	80.8	Confident	39 Å²	39	48 Å²	48	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-72.9	-34.7	177.8	-69.9	-20.4	0	0	0	111.6	L813 R818 N819 R849	L813-D815 PolarHBondContact O-N 3.49Å; D815-R818 PolarHBondContact O-N 3.08Å; D815-R818 IonicContact OD1-CZ 2.87Å; D815-R818 IonicContact OD1-NE 3.65Å; D815-R818 IonicContact OD1-NH2 2.68Å; D815-R818 PolarHBondContact OD1-NH2 2.72Å; D815-N819 WeakPolarHBondContact O-CB 3.14Å; D815-N819 VanDerWaalsContact O-CG 3.29Å; D815-N819 PolarHBondContact O-N 2.61Å; D815-N819 PolarHBondContact O-ND2 3.19Å; D815-R849 IonicContact OD2-CZ 3.32Å; D815-R849 IonicContact OD2-NE 2.69Å; D815-R849 PolarHBondContact OD2-NE 2.94Å; D815-R849 IonicContact OD2-NH2 3.68Å; D815-R849 PolarHBondContact OD2-NH2 2.97Å
816	W	86.3	Confident	78.9	Confident	35 Å²	35	49 Å²	49	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-42.7	175.6	-170.1	96.7	0	0	0	110.6	F789 L797 W812 L813 N819 N820 I824	F789-W816 HydrophobicContact CB-CH2 4.37Å; F789-W816 HydrophobicContact CB-CZ2 3.55Å; F789-W816 HydrophobicContact CD2-CD2 4.14Å; F789-W816 AromaticContact CD2-CE2 3.86Å; F789-W816 HydrophobicContact CD2-CE3 4.22Å; F789-W816 AromaticContact CD2-CH2 3.9Å; F789-W816 HydrophobicContact CD2-CH2 3.9Å; F789-W816 AromaticContact CD2-CZ2 3.75Å; F789-W816 HydrophobicContact CD2-CZ2 3.75Å; F789-W816 HydrophobicContact CD2-CZ3 4.11Å; F789-W816 HydrophobicContact CE2-CZ3 4.47Å; F789-W816 HydrophobicContact CG-CH2 4.3Å; F789-W816 AromaticContact CG-CZ2 3.93Å; F789-W816 HydrophobicContact CG-CZ2 3.93Å; L797-W816 HydrophobicContact CD2-CH2 3.43Å; L797-W816 VanDerWaalsContact CD2-CH2 3.43Å; L797-W816 HydrophobicContact CD2-CZ3 3.54Å; W812-W816 HydrophobicContact CE3-CB 3.9Å; W812-W816 HydrophobicContact CE3-CG 4.23Å; W812-W816 HydrophobicContact CZ3-CB 3.89Å; W812-W816 HydrophobicContact CZ3-CD2 4.3Å; W812-W816 AromaticContact CZ3-CG 3.8Å; W812-W816 HydrophobicContact CZ3-CG 3.8Å; W812-W816 PolarHBondContact O-N 2.04Å; L813-W816 HydrophobicContact CD1-CE3 4.35Å; L813-W816 PolarHBondContact O-N 2.71Å; L813-W816 VanDerWaalsContact O-N 3.1Å; W816-N819 PolarHBondContact O-N 2.67Å; W816-N820 HydrophobicContact CH2-CB 4.15Å; W816-N820 HydrophobicContact CZ2-CB 4.33Å; W816-N820 HydrophobicContact CZ3-CB 4.25Å; W816-N820 PolarHBondContact NE1-ND2 3.29Å; W816-N820 WeakPolarHBondContact O-CB 3.48Å; W816-N820 PolarHBondContact O-N 2.95Å; W816-N820 VanDerWaalsContact O-N 3.1Å; W816-N820 PolarHBondContact O-ND2 2.89Å; W816-I824 HydrophobicContact CZ3-CD1 4.13Å; W816-I824 HydrophobicContact CZ3-CG1 4.41Å
817	L	87.9	Confident	77.2	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-48	174.3	-65.2	173.7	0	0	0	111.5	L799 L813 N819 N820 A821 I824 P831 V844 A845	L799-L817 HydrophobicContact CD1-CD2 4.21Å; L813-L817 HydrophobicContact CD1-CD1 4.37Å; L813-L817 HydrophobicContact CD1-CD2 4.1Å; L813-L817 HydrophobicContact CD1-CG 3.93Å; L813-L817 HydrophobicContact CG-CD1 3.99Å; L813-L817 HydrophobicContact CG-CG 4.05Å; L813-L817 WeakPolarHBondContact O-CG 3.35Å; L813-L817 PolarHBondContact O-N 3.28Å; L817-N819 PolarHBondContact O-N 2.83Å; L817-N820 CarbonylContact O-C 3.51Å; L817-N820 PolarHBondContact O-N 3.04Å; L817-A821 PolarHBondContact O-N 3.14Å; L817-I824 HydrophobicContact CB-CD1 4.11Å; L817-I824 HydrophobicContact CD2-CD1 3.56Å; L817-I824 HydrophobicContact CD2-CG1 4.46Å; L817-I824 HydrophobicContact CG-CD1 4.43Å; L817-I824 WeakPolarHBondContact O-CD1 3.45Å; L817-P831 HydrophobicContact CD1-CB 4.41Å; L817-P831 HydrophobicContact CD1-CG 4.39Å; L817-V844 HydrophobicContact CD1-CB 3.88Å; L817-V844 HydrophobicContact CD1-CG1 3.67Å; L817-A845 HydrophobicContact CB-CB 3.88Å; L817-A845 HydrophobicContact CD1-CB 4.02Å
818	R	81.5	Confident	75.5	Confident	100 Å²	100	52.9 Å²	52.9	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-41.2	178.4	-79.4	-172	-75.2	-98.6	1.7	113.6	P814 D815 A845 S846 L847	P814-R818 WeakPolarHBondContact O-CG 3.03Å; P814-R818 PolarHBondContact O-N 3.15Å; D815-R818 PolarHBondContact O-N 3.08Å; D815-R818 IonicContact OD1-CZ 2.87Å; D815-R818 IonicContact OD1-NE 3.65Å; D815-R818 IonicContact OD1-NH2 2.68Å; D815-R818 PolarHBondContact OD1-NH2 2.72Å; R818-A845 WeakPolarHBondContact CG-O 3.22Å; R818-A845 PolarHBondContact NH1-O 3.5Å; R818-S846 PolarHBondContact NH1-O 2.87Å; R818-L847 VanDerWaalsContact CZ-O 3.3Å; R818-L847 PolarHBondContact NH1-O 2.93Å; R818-L847 PolarHBondContact NH2-O 3.27Å
819	N	81.6	Confident	74.6	Confident	131 Å²	131	52.8 Å²	52.8	70%	0.701	28%	0.282	S	S	*	.	H	α-helix	trans	-74.5	-27.5	-178.8	-72.5	-49	0	0	0	112.9	D815 W816 L817	D815-N819 WeakPolarHBondContact O-CB 3.14Å; D815-N819 VanDerWaalsContact O-CG 3.29Å; D815-N819 PolarHBondContact O-N 2.61Å; D815-N819 PolarHBondContact O-ND2 3.19Å; W816-N819 PolarHBondContact O-N 2.67Å; L817-N819 PolarHBondContact O-N 2.83Å
820	N	79	Confident	74.5	Confident	42 Å²	42	48.8 Å²	48.8	23%	0.225	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	19.3	-175.9	-59.6	-58.8	0	0	0	113.5	W816 L817 N822 Q823 I824	W816-N820 HydrophobicContact CH2-CB 4.15Å; W816-N820 HydrophobicContact CZ2-CB 4.33Å; W816-N820 HydrophobicContact CZ3-CB 4.25Å; W816-N820 PolarHBondContact NE1-ND2 3.29Å; W816-N820 WeakPolarHBondContact O-CB 3.48Å; W816-N820 PolarHBondContact O-N 2.95Å; W816-N820 VanDerWaalsContact O-N 3.1Å; W816-N820 PolarHBondContact O-ND2 2.89Å; L817-N820 CarbonylContact O-C 3.51Å; L817-N820 PolarHBondContact O-N 3.04Å; N820-N822 PolarHBondContact O-N 3Å; N820-Q823 WeakPolarHBondContact O-CB 3.27Å; N820-Q823 PolarHBondContact O-N 3.07Å; N820-Q823 PolarHBondContact OD1-OE1 3.39Å; N820-I824 HydrophobicContact CB-CD1 4.5Å
821	A	73.7	Confident	74.4	Confident	58 Å²	58	49.2 Å²	49.2	48%	0.479	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-50.6	-33.3	-176.7	0	0	0	0	0	114.3	L817 Q823 I824	L817-A821 PolarHBondContact O-N 3.14Å; A821-Q823 PolarHBondContact O-N 3.03Å; A821-I824 PolarHBondContact O-N 3.29Å
822	N	71.7	Confident	74.6	Confident	167 Å²	167	50.1 Å²	50.1	89%	0.893	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-69.3	-15.7	177.5	-60.4	-29.6	0	0	0	114.6	N820	N820-N822 PolarHBondContact O-N 3Å
823	Q	65.6	Low	74.8	Confident	48 Å²	48	49.1 Å²	49.1	22%	0.224	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-103	-3.3	178.4	-63.2	169.3	-40.7	0	0	111.8	L794 S796 L797 N820 A821	L794-Q823 VanDerWaalsContact O-CG 3.32Å; L794-Q823 WeakPolarHBondContact O-CG 3.42Å; L794-Q823 PolarHBondContact O-NE2 3.38Å; S796-Q823 CarbonylContact C-O 3.17Å; S796-Q823 VanDerWaalsContact CA-O 3.22Å; S796-Q823 WeakPolarHBondContact CA-O 3.48Å; L797-Q823 PolarHBondContact N-O 3.08Å; N820-Q823 WeakPolarHBondContact O-CB 3.27Å; N820-Q823 PolarHBondContact O-N 3.07Å; N820-Q823 PolarHBondContact OD1-OE1 3.39Å; A821-Q823 PolarHBondContact O-N 3.03Å
824	I	66	Low	74.7	Confident	22 Å²	22	53.2 Å²	53.2	11%	0.113	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-99.2	115.8	-174.8	-68	158.9	0	0	0	108.5	L797 W816 L817 N820 A821 E826	L797-I824 CarbonylContact O-C 3.6Å; L797-I824 WeakPolarHBondContact O-CA 3.45Å; W816-I824 HydrophobicContact CZ3-CD1 4.13Å; W816-I824 HydrophobicContact CZ3-CG1 4.41Å; L817-I824 HydrophobicContact CB-CD1 4.11Å; L817-I824 HydrophobicContact CD2-CD1 3.56Å; L817-I824 HydrophobicContact CD2-CG1 4.46Å; L817-I824 HydrophobicContact CG-CD1 4.43Å; L817-I824 WeakPolarHBondContact O-CD1 3.45Å; N820-I824 HydrophobicContact CB-CD1 4.5Å; A821-I824 PolarHBondContact O-N 3.29Å; I824-E826 PolarHBondContact O-N 2.92Å; I824-E826 VanDerWaalsContact O-N 3.12Å
825	N	57.9	Low	74.1	Confident	20 Å²	20	55 Å²	55	11%	0.107	30%	0.302	C	S	.	.			trans	-76.8	98.5	169.2	-73.1	30.5	0	0	0	107.5	M775 S796 L797 S798 G827 E1533	M775-N825 HydrophobicContact CE-CB 4.26Å; S796-N825 PolarHBondContact OG-ND2 2.95Å; S796-N825 PolarHBondContact OG-OD1 2.9Å; L797-N825 PolarHBondContact O-N 3Å; S798-N825 WeakPolarHBondContact CB-O 3.24Å; S798-N825 PolarHBondContact OG-O 3.35Å; N825-G827 PolarHBondContact O-N 3.04Å; N825-G827 VanDerWaalsContact O-N 3.11Å; N825-E1533 WeakPolarHBondContact CB-OE1 3.5Å; N825-E1533 WeakPolarHBondContact ND2-CG 3.46Å; N825-E1533 PolarHBondContact ND2-OE1 2.86Å
826	E	49.8	Very low	74	Confident	121 Å²	121	55 Å²	55	57%	0.565	30%	0.304	S	S	*	.			trans	-60.7	113.8	164.8	-66.1	-169.7	171.4	0	0	108.2	I824 S1454	I824-E826 PolarHBondContact O-N 2.92Å; I824-E826 VanDerWaalsContact O-N 3.12Å; E826-S1454 PolarHBondContact O-OG 2.96Å
827	G	52.5	Low	73.3	Confident	15 Å²	15	59.1 Å²	59.1	16%	0.155	33%	0.325	C	S	.	.			trans	-76.5	-157.3	167.7	0	0	0	0	0	110.3	N825 S829	N825-G827 PolarHBondContact O-N 3.04Å; N825-G827 VanDerWaalsContact O-N 3.11Å; G827-S829 PolarHBondContact O-N 3.33Å
828	P	50	Low	72.7	Confident	79 Å²	79	64.7 Å²	64.7	51%	0.513	36%	0.355	S	S	.	.	S	Bend	trans	-64.6	-10.3	-179.2	27.8	-35.8	0	0	0	114.3
829	S	61.4	Low	72.8	Confident	43 Å²	43	60.4 Å²	60.4	30%	0.301	34%	0.339	S	S	.	.	S	Bend	trans	-149.3	151	169.4	54.3	0	0	0	0	110.8	S800 G827	S800-S829 WeakPolarHBondContact CB-O 3.44Å; G827-S829 PolarHBondContact O-N 3.33Å
830	P	77.4	Confident	72.8	Confident	44 Å²	44	55.1 Å²	55.1	29%	0.286	31%	0.314	S	S	.	.			trans	-65.3	161.2	168.2	29.9	-35.8	0	0	0	110.5	I832 P843	P830-I832 PolarHBondContact O-N 2.98Å; P830-P843 HydrophobicContact CB-CB 4.4Å; P830-P843 HydrophobicContact CG-CB 4.06Å; P830-P843 HydrophobicContact CG-CG 4.09Å
831	P	87.2	Confident	72.9	Confident	9 Å²	9	55 Å²	55	6%	0.058	32%	0.323	C	S	.	.			trans	-54.5	121.2	169.4	-26.3	36.6	0	0	0	110.8	L799 F804 L817 P843 V844	L799-P831 HydrophobicContact CB-CG 3.89Å; F804-P831 HydrophobicContact CD2-CB 4.22Å; F804-P831 HydrophobicContact CE2-CB 3.81Å; L817-P831 HydrophobicContact CD1-CB 4.41Å; L817-P831 HydrophobicContact CD1-CG 4.39Å; P831-P843 CarbonylContact O-C 3.52Å; P831-P843 WeakPolarHBondContact O-CA 3.37Å; P831-V844 HydrophobicContact CB-CB 4.32Å; P831-V844 HydrophobicContact CB-CG2 4.19Å; P831-V844 WeakPolarHBondContact O-CG2 3.31Å; P831-V844 PolarHBondContact O-N 3.01Å
832	I	89.9	Confident	73.4	Confident	52 Å²	52	54.2 Å²	54.2	27%	0.267	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-113.5	149	178.9	55.9	166.1	0	0	0	112	F804 P830 G841 T842 P843	F804-I832 WeakPolarHBondContact CD2-O 3.25Å; P830-I832 PolarHBondContact O-N 2.98Å; I832-G841 WeakPolarHBondContact CG2-O 3.21Å; I832-T842 CarbonylContact C-O 3.45Å; I832-T842 VanDerWaalsContact CA-O 3.3Å; I832-T842 WeakPolarHBondContact CA-O 3.34Å; I832-P843 HydrophobicContact CG2-CG 4.44Å
833	C	91.2	Very high	74.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	140.9	166.9	-60.2	0	0	0	0	110.3	C806 L839 A840 G841 T842 L847	C806-C833 HydrophobicContact CB-CB 3.8Å; C806-C833 WeakPolarHBondContact CB-SG 3.3Å; C806-C833 VanDerWaalsContact SG-CA 3.56Å; C806-C833 WeakPolarHBondContact SG-CB 3.3Å; C806-C833 CovalentContact SG-SG 2.02Å; C806-C833 PolarHBondContact SG-SG 3.3Å; C833-L839 HydrophobicContact CB-CB 4Å; C833-L839 WeakPolarHBondContact CB-O 3.36Å; C833-A840 WeakPolarHBondContact O-CA 3.38Å; C833-G841 PolarHBondContact O-N 2.81Å; C833-T842 PolarHBondContact N-O 3.01Å; C833-L847 WeakPolarHBondContact SG-CD1 3.21Å
834	I	88.2	Confident	75.2	Confident	86 Å²	86	46.3 Å²	46.3	44%	0.441	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-18.4	167.8	-156.2	62.7	0	0	0	112.3	P803 F804	P803-I834 VanDerWaalsContact C-CG2 3.44Å; P803-I834 HydrophobicContact CB-CB 4.33Å; P803-I834 HydrophobicContact CB-CG2 3.84Å; P803-I834 VanDerWaalsContact O-CG2 3.28Å; P803-I834 WeakPolarHBondContact O-CG2 3.25Å; F804-I834 PolarHBondContact O-N 2.87Å
835	S	76.7	Confident	76.2	Confident	38 Å²	38	46.9 Å²	46.9	27%	0.266	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.5	179.5	52.8	0	0	0	0	110.1	F804 K805 C806	F804-S835 PolarHBondContact O-N 2.88Å; K805-S835 CarbonylContact C-O 3.46Å; K805-S835 WeakPolarHBondContact CA-OG 3.38Å; C806-S835 PolarHBondContact N-O 3.39Å
836	P	79.1	Confident	77.5	Confident	38 Å²	38	49.8 Å²	49.8	25%	0.247	30%	0.304	C	S	.	.	S	Bend	cis	-61.7	164.3	-7.9	33.4	-39.9	0	0	0	112.2	D838 L839 A840	P836-D838 VanDerWaalsContact C-N 3.26Å; P836-D838 VanDerWaalsContact CB-OD1 3.27Å; P836-D838 WeakPolarHBondContact CB-OD1 3.41Å; P836-D838 WeakPolarHBondContact CG-OD1 3.24Å; P836-D838 PolarHBondContact O-N 2.99Å; P836-L839 HydrophobicContact CG-CD1 4.17Å; P836-L839 HydrophobicContact CG-CG 4.28Å; P836-L839 PolarHBondContact O-N 3.18Å; P836-A840 PolarHBondContact O-N 3.1Å
837	E	72.1	Confident	79	Confident	122 Å²	122	44.6 Å²	44.6	57%	0.57	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-61.9	-31.6	-165.4	-169.8	166.2	-146.9	0	0	113.4	L839 A840	E837-L839 PolarHBondContact O-N 3.21Å; E837-A840 WeakPolarHBondContact O-CB 3.19Å; E837-A840 PolarHBondContact O-N 2.82Å; E837-A840 VanDerWaalsContact O-N 3.12Å
838	D	74.4	Confident	80.2	Confident	124 Å²	124	45.4 Å²	45.4	66%	0.663	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-65.1	-14.5	172.2	53.8	-61.8	0	0	0	114.4	P836	P836-D838 VanDerWaalsContact C-N 3.26Å; P836-D838 VanDerWaalsContact CB-OD1 3.27Å; P836-D838 WeakPolarHBondContact CB-OD1 3.41Å; P836-D838 WeakPolarHBondContact CG-OD1 3.24Å; P836-D838 PolarHBondContact O-N 2.99Å
839	L	84.1	Confident	80.8	Confident	10 Å²	10	47.3 Å²	47.3	5%	0.052	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-110.4	-1	173.4	-58.2	-178.1	0	0	0	112.9	C806 C833 P836 E837 G841 T842 L847 H851	C806-L839 HydrophobicContact CB-CD1 3.97Å; C833-L839 HydrophobicContact CB-CB 4Å; C833-L839 WeakPolarHBondContact CB-O 3.36Å; P836-L839 HydrophobicContact CG-CD1 4.17Å; P836-L839 HydrophobicContact CG-CG 4.28Å; P836-L839 PolarHBondContact O-N 3.18Å; E837-L839 PolarHBondContact O-N 3.21Å; L839-G841 PolarHBondContact O-N 2.84Å; L839-T842 WeakPolarHBondContact O-CB 3.48Å; L839-T842 WeakPolarHBondContact O-CG2 3.41Å; L839-T842 PolarHBondContact O-N 3.27Å; L839-T842 PolarHBondContact O-OG1 3.26Å; L839-L847 HydrophobicContact CD1-CD1 4.11Å; L839-L847 HydrophobicContact CD2-CD1 4.38Å; L839-L847 HydrophobicContact CD2-CD2 4.2Å; L839-H851 HydrophobicContact CD1-CB 4.01Å; L839-H851 HydrophobicContact CD2-CB 4.17Å
840	A	80.6	Confident	81	Confident	20 Å²	20	48.1 Å²	48.1	17%	0.165	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	119.3	-173.8	0	0	0	0	0	112.2	C833 P836 E837 R1293	C833-A840 WeakPolarHBondContact O-CA 3.38Å; P836-A840 PolarHBondContact O-N 3.1Å; E837-A840 WeakPolarHBondContact O-CB 3.19Å; E837-A840 PolarHBondContact O-N 2.82Å; E837-A840 VanDerWaalsContact O-N 3.12Å; A840-R1293 PolarHBondContact O-NH2 3.36Å; A840-R1293 VanDerWaalsContact O-NH2 3.16Å
841	G	82.6	Confident	80.8	Confident	40 Å²	40	49.8 Å²	49.8	41%	0.412	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.8	-13.3	-174.2	0	0	0	0	0	114.7	I832 C833 L839	I832-G841 WeakPolarHBondContact CG2-O 3.21Å; C833-G841 PolarHBondContact O-N 2.81Å; L839-G841 PolarHBondContact O-N 2.84Å
842	T	83.4	Confident	80.4	Confident	41 Å²	41	49.8 Å²	49.8	25%	0.252	28%	0.28	S	S	.	.			trans	-76	134.5	-177.2	64.1	0	0	0	0	112.3	I832 C833 L839 V844	I832-T842 CarbonylContact C-O 3.45Å; I832-T842 VanDerWaalsContact CA-O 3.3Å; I832-T842 WeakPolarHBondContact CA-O 3.34Å; C833-T842 PolarHBondContact N-O 3.01Å; L839-T842 WeakPolarHBondContact O-CB 3.48Å; L839-T842 WeakPolarHBondContact O-CG2 3.41Å; L839-T842 PolarHBondContact O-N 3.27Å; L839-T842 PolarHBondContact O-OG1 3.26Å; T842-V844 PolarHBondContact O-N 2.73Å
843	P	87.7	Confident	79.1	Confident	48 Å²	48	52.2 Å²	52.2	31%	0.312	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-65.1	124.6	175.5	-24.9	35.3	0	0	0	112.8	P830 P831 I832 A845 S846	P830-P843 HydrophobicContact CB-CB 4.4Å; P830-P843 HydrophobicContact CG-CB 4.06Å; P830-P843 HydrophobicContact CG-CG 4.09Å; P831-P843 CarbonylContact O-C 3.52Å; P831-P843 WeakPolarHBondContact O-CA 3.37Å; I832-P843 HydrophobicContact CG2-CG 4.44Å; P843-A845 PolarHBondContact O-N 3.18Å; P843-A845 VanDerWaalsContact O-N 3.09Å; P843-S846 PolarHBondContact O-N 3.06Å; P843-S846 PolarHBondContact O-OG 3.35Å
844	V	87.6	Confident	78	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.3	-178.7	177.9	0	0	0	0	111.7	F804 L813 P814 L817 P831 T842 S846 L847 F852	F804-V844 HydrophobicContact CB-CG2 4.45Å; F804-V844 HydrophobicContact CD2-CG2 4.24Å; L813-V844 HydrophobicContact CB-CG1 4.29Å; L813-V844 HydrophobicContact CD2-CG1 4Å; L813-V844 HydrophobicContact CG-CG1 3.97Å; P814-V844 WeakPolarHBondContact CB-O 3.35Å; P814-V844 HydrophobicContact CG-CG1 4.08Å; P814-V844 WeakPolarHBondContact CG-O 3.31Å; L817-V844 HydrophobicContact CD1-CB 3.88Å; L817-V844 HydrophobicContact CD1-CG1 3.67Å; P831-V844 HydrophobicContact CB-CB 4.32Å; P831-V844 HydrophobicContact CB-CG2 4.19Å; P831-V844 WeakPolarHBondContact O-CG2 3.31Å; P831-V844 PolarHBondContact O-N 3.01Å; T842-V844 PolarHBondContact O-N 2.73Å; V844-S846 VanDerWaalsContact C-N 3.32Å; V844-S846 PolarHBondContact O-N 3.22Å; V844-L847 PolarHBondContact O-N 3.02Å; V844-F852 HydrophobicContact CG1-CZ 4.14Å
845	A	86.6	Confident	76.2	Confident	35 Å²	35	58.5 Å²	58.5	29%	0.289	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.6	-179.5	0	0	0	0	0	114.9	L817 R818 P843	L817-A845 HydrophobicContact CB-CB 3.88Å; L817-A845 HydrophobicContact CD1-CB 4.02Å; R818-A845 WeakPolarHBondContact CG-O 3.22Å; R818-A845 PolarHBondContact NH1-O 3.5Å; P843-A845 PolarHBondContact O-N 3.18Å; P843-A845 VanDerWaalsContact O-N 3.09Å
846	S	84.4	Confident	74.6	Confident	81 Å²	81	62.9 Å²	62.9	57%	0.566	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-31.9	173.7	74.5	0	0	0	0	112	R818 P843 V844	R818-S846 PolarHBondContact NH1-O 2.87Å; P843-S846 PolarHBondContact O-N 3.06Å; P843-S846 PolarHBondContact O-OG 3.35Å; V844-S846 VanDerWaalsContact C-N 3.32Å; V844-S846 PolarHBondContact O-N 3.22Å
847	L	83	Confident	72.3	Confident	11 Å²	11	66 Å²	66	6%	0.058	36%	0.363	C	S	.	.	S	Bend	trans	-67.8	152.8	-176.2	-60.5	-178.9	0	0	0	113.5	P814 R818 C833 L839 V844 H851 F852	P814-L847 VanDerWaalsContact CB-O 3.25Å; P814-L847 WeakPolarHBondContact CB-O 3.45Å; R818-L847 VanDerWaalsContact CZ-O 3.3Å; R818-L847 PolarHBondContact NH1-O 2.93Å; R818-L847 PolarHBondContact NH2-O 3.27Å; C833-L847 WeakPolarHBondContact SG-CD1 3.21Å; L839-L847 HydrophobicContact CD1-CD1 4.11Å; L839-L847 HydrophobicContact CD2-CD1 4.38Å; L839-L847 HydrophobicContact CD2-CD2 4.2Å; V844-L847 PolarHBondContact O-N 3.02Å; L847-H851 HydrophobicContact CB-CB 4.44Å; L847-H851 HydrophobicContact CD1-CB 4.41Å; L847-H851 HydrophobicContact CD2-CB 4.38Å; L847-F852 HydrophobicContact CB-CE2 3.68Å; L847-F852 HydrophobicContact CB-CZ 4.4Å; L847-F852 HydrophobicContact CD1-CE2 3.67Å; L847-F852 HydrophobicContact CD1-CZ 3.86Å; L847-F852 HydrophobicContact CG-CE2 4.36Å
848	S	76.6	Confident	70.4	Confident	32 Å²	32	64.7 Å²	64.7	22%	0.224	37%	0.372	C	S	.	.			trans	-92.7	159.8	165.8	76.8	0	0	0	0	110.8	Y850 H851 F852	S848-Y850 PolarHBondContact O-N 3.01Å; S848-H851 PolarHBondContact N-ND1 2.79Å; S848-H851 VanDerWaalsContact N-ND1 3.2Å; S848-H851 PolarHBondContact O-N 3.03Å; S848-H851 VanDerWaalsContact O-N 3.09Å; S848-H851 PolarHBondContact O-ND1 2.9Å; S848-H851 VanDerWaalsContact O-ND1 3.11Å; S848-H851 PolarHBondContact OG-CE1 3.38Å; S848-H851 VanDerWaalsContact OG-CE1 3.28Å; S848-H851 PolarHBondContact OG-ND1 3.29Å; S848-F852 WeakPolarHBondContact O-CD2 3.18Å
849	R	63.4	Low	68.1	Low	120 Å²	120	62.4 Å²	62.4	45%	0.453	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-52.9	-22.1	177.6	-52.1	-153.3	-171.3	162.8	7.5	114.3	S811 D815 F852	S811-R849 VanDerWaalsContact O-CD 3.32Å; S811-R849 WeakPolarHBondContact O-CD 3.3Å; S811-R849 WeakPolarHBondContact O-CG 3.32Å; D815-R849 IonicContact OD2-CZ 3.32Å; D815-R849 IonicContact OD2-NE 2.69Å; D815-R849 PolarHBondContact OD2-NE 2.94Å; D815-R849 IonicContact OD2-NH2 3.68Å; D815-R849 PolarHBondContact OD2-NH2 2.97Å; R849-F852 WeakPolarHBondContact O-CB 3.38Å; R849-F852 PolarHBondContact O-N 3.49Å
850	Y	64.5	Low	65.2	Low	59 Å²	59	68.2 Å²	68.2	23%	0.231	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-80.8	-12.3	-175.1	-54.7	-83.7	0	0	0	114	S848 F852 I853 L912 Y919	S848-Y850 PolarHBondContact O-N 3.01Å; Y850-F852 VanDerWaalsContact C-N 3.3Å; Y850-I853 WeakPolarHBondContact O-CG1 3.19Å; Y850-L912 HydrophobicContact CD1-CB 4.12Å; Y850-L912 HydrophobicContact CD1-CD1 4.29Å; Y850-Y919 HydrophobicContact CD1-CD2 4.09Å; Y850-Y919 HydrophobicContact CD1-CG 4.42Å; Y850-Y919 HydrophobicContact CD2-CD1 4.07Å; Y850-Y919 AromaticContact CD2-CD2 3.94Å; Y850-Y919 HydrophobicContact CD2-CD2 3.94Å; Y850-Y919 AromaticContact CD2-CE1 3.86Å; Y850-Y919 HydrophobicContact CD2-CE1 3.86Å; Y850-Y919 AromaticContact CD2-CE2 3.78Å; Y850-Y919 HydrophobicContact CD2-CE2 3.78Å; Y850-Y919 HydrophobicContact CD2-CG 4.11Å; Y850-Y919 AromaticContact CD2-CZ 3.73Å; Y850-Y919 AromaticContact CE1-CD2 3.76Å; Y850-Y919 HydrophobicContact CE1-CD2 3.76Å; Y850-Y919 AromaticContact CE1-CE2 3.97Å; Y850-Y919 HydrophobicContact CE1-CE2 3.97Å; Y850-Y919 HydrophobicContact CE2-CD1 4.39Å; Y850-Y919 AromaticContact CE2-CD2 3.64Å; Y850-Y919 HydrophobicContact CE2-CD2 3.64Å; Y850-Y919 AromaticContact CE2-CE1 3.93Å; Y850-Y919 HydrophobicContact CE2-CE1 3.93Å; Y850-Y919 AromaticContact CE2-CE2 3.13Å; Y850-Y919 HydrophobicContact CE2-CE2 3.13Å; Y850-Y919 HydrophobicContact CE2-CG 4.27Å; Y850-Y919 AromaticContact CE2-CZ 3.28Å; Y850-Y919 HydrophobicContact CG-CD1 4.46Å; Y850-Y919 HydrophobicContact CG-CD2 4.18Å; Y850-Y919 HydrophobicContact CG-CE2 4.45Å; Y850-Y919 HydrophobicContact CG-CG 4.21Å; Y850-Y919 AromaticContact CZ-CD2 3.53Å; Y850-Y919 AromaticContact CZ-CE2 3.23Å; Y850-Y919 AromaticContact CZ-CZ 3.92Å; Y850-Y919 WeakPolarHBondContact OH-CE2 3.28Å
851	H	74.3	Confident	62.5	Low	80 Å²	80	73 Å²	73	37%	0.37	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-75.5	-24.7	168.9	-60.3	76.7	0	0	0	111.3	L839 L847 S848 I853	L839-H851 HydrophobicContact CD1-CB 4.01Å; L839-H851 HydrophobicContact CD2-CB 4.17Å; L847-H851 HydrophobicContact CB-CB 4.44Å; L847-H851 HydrophobicContact CD1-CB 4.41Å; L847-H851 HydrophobicContact CD2-CB 4.38Å; S848-H851 PolarHBondContact N-ND1 2.79Å; S848-H851 VanDerWaalsContact N-ND1 3.2Å; S848-H851 PolarHBondContact O-N 3.03Å; S848-H851 VanDerWaalsContact O-N 3.09Å; S848-H851 PolarHBondContact O-ND1 2.9Å; S848-H851 VanDerWaalsContact O-ND1 3.11Å; S848-H851 PolarHBondContact OG-CE1 3.38Å; S848-H851 VanDerWaalsContact OG-CE1 3.28Å; S848-H851 PolarHBondContact OG-ND1 3.29Å; H851-I853 PolarHBondContact O-N 3.41Å
852	F	78.6	Confident	59.7	Low	8 Å²	8	79 Å²	79	4%	0.035	45%	0.45	C	S	.	.			trans	-83.5	81.1	-174.1	-70.3	-107.3	0	0	0	109.7	C806 D807 C808 L810 P814 V844 L847 S848 R849 Y850	C806-F852 VanDerWaalsContact C-CD1 3.46Å; C806-F852 HydrophobicContact CB-CD1 3.74Å; C806-F852 HydrophobicContact CB-CE1 3.37Å; C806-F852 HydrophobicContact CB-CZ 3.84Å; C806-F852 WeakPolarHBondContact O-CA 3.44Å; C806-F852 VanDerWaalsContact SG-CE1 3.59Å; D807-F852 WeakPolarHBondContact O-CB 3.19Å; D807-F852 WeakPolarHBondContact O-CD1 3.3Å; C808-F852 WeakPolarHBondContact CA-O 3.36Å; C808-F852 WeakPolarHBondContact CB-O 3.43Å; C808-F852 PolarHBondContact N-O 3.07Å; L810-F852 HydrophobicContact CB-CD1 4Å; L810-F852 HydrophobicContact CB-CE1 4.03Å; L810-F852 HydrophobicContact CD2-CE1 4.37Å; L810-F852 HydrophobicContact CG-CE1 4.27Å; P814-F852 HydrophobicContact CG-CD2 4.17Å; P814-F852 HydrophobicContact CG-CE1 4.28Å; P814-F852 HydrophobicContact CG-CE2 3.3Å; P814-F852 HydrophobicContact CG-CZ 3.39Å; V844-F852 HydrophobicContact CG1-CZ 4.14Å; L847-F852 HydrophobicContact CB-CE2 3.68Å; L847-F852 HydrophobicContact CB-CZ 4.4Å; L847-F852 HydrophobicContact CD1-CE2 3.67Å; L847-F852 HydrophobicContact CD1-CZ 3.86Å; L847-F852 HydrophobicContact CG-CE2 4.36Å; S848-F852 WeakPolarHBondContact O-CD2 3.18Å; R849-F852 WeakPolarHBondContact O-CB 3.38Å; R849-F852 PolarHBondContact O-N 3.49Å; Y850-F852 VanDerWaalsContact C-N 3.3Å
853	I	62.9	Low	56.7	Low	104 Å²	104	81.4 Å²	81.4	53%	0.533	47%	0.469	S	S	.	.			trans	-105.7	132.4	-173.9	-57.4	174.9	0	0	0	110.1	Y850 H851	Y850-I853 WeakPolarHBondContact O-CG1 3.19Å; H851-I853 PolarHBondContact O-N 3.41Å
854	C	66.3	Low	53.7	Low	27 Å²	27	85.9 Å²	85.9	18%	0.182	50%	0.495	C	S	.	.			trans	-92.5	123.4	165.1	-68.6	0	0	0	0	109.5	C808	C808-C854 HydrophobicContact CB-CB 3.93Å; C808-C854 WeakPolarHBondContact CB-SG 3.38Å; C808-C854 PolarHBondContact N-SG 2.77Å; C808-C854 WeakPolarHBondContact SG-CB 3.39Å; C808-C854 CovalentContact SG-SG 2.04Å; C808-C854 PolarHBondContact SG-SG 3.15Å
855	K	51.7	Low	50.8	Low	191 Å²	191	93.2 Å²	93.2	83%	0.83	54%	0.535	S	S	*	.	S	Bend	trans	-70.1	138.6	164.2	-68.5	179.3	-179.4	173.5	0	108
856	N	42.1	Very low	47.7	Very low	130 Å²	130	99.5 Å²	99.5	70%	0.695	56%	0.558	S	S	*	*			trans	72.9	82.6	-171.3	-56.3	-16	0	0	0	115.6
857	S	31.5	Very low	44.8	Very low	103 Å²	103	102 Å²	102	72%	0.72	57%	0.565	S	S	*	*	S	Bend	trans	-132.3	51.8	169.6	-56.1	0	0	0	0	112.6
858	A	31.6	Very low	42	Very low	94 Å²	94	109.8 Å²	109.8	78%	0.777	61%	0.606	S	S	*	*	S	Bend	trans	-165.5	-51.9	165.3	0	0	0	0	0	114.3
859	S	27.3	Very low	39.5	Very low	77 Å²	77	115.7 Å²	115.7	54%	0.538	63%	0.629	S	S	.	*	S	Bend	trans	-91.6	-34.2	-151.6	51	0	0	0	0	116.8	C861	S859-C861 VanDerWaalsContact C-N 3.35Å; S859-C861 PolarHBondContact O-N 3.42Å
860	N	22.1	Very low	37.5	Very low	132 Å²	132	116.4 Å²	116.4	71%	0.706	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	5.9	-170.9	-71.3	34	0	0	0	114.2
861	C	24.4	Very low	35.5	Very low	121 Å²	121	119.6 Å²	119.6	82%	0.818	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	33.9	173.3	-64.7	0	0	0	0	112.3	S859	S859-C861 VanDerWaalsContact C-N 3.35Å; S859-C861 PolarHBondContact O-N 3.42Å
862	L	23	Very low	33.1	Very low	165 Å²	165	123.5 Å²	123.5	86%	0.864	68%	0.681	S	S	*	*	S	Bend	trans	-169.8	72.8	160.6	-110.2	169	0	0	0	113.9
863	S	21.8	Very low	30.4	Very low	92 Å²	92	131.9 Å²	131.9	64%	0.643	72%	0.718	S	S	*	*			trans	-164.2	97.8	153.1	41.4	0	0	0	0	112.3	N865	S863-N865 PolarHBondContact O-N 2.98Å
864	T	23.4	Very low	28.7	Very low	141 Å²	141	135.1 Å²	135.1	87%	0.865	74%	0.735	S	S	*	*			trans	-74.7	106.8	161.3	45.7	0	0	0	0	108.5	E866	T864-E866 PolarHBondContact O-N 3.36Å
865	N	26.4	Very low	26.5	Very low	155 Å²	155	140.2 Å²	140.2	83%	0.829	76%	0.76	S	S	*	*			trans	-73.7	111.7	174.8	-83.3	-11.6	0	0	0	110.4	S863	S863-N865 PolarHBondContact O-N 2.98Å
866	E	23.3	Very low	25.1	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	75%	0.753	S	S	*	*			trans	-90.2	133.1	157.7	-74.8	-167.3	166.7	0	0	110.2	T864	T864-E866 PolarHBondContact O-N 3.36Å
867	N	23.2	Very low	24.4	Very low	132 Å²	132	137 Å²	137	71%	0.706	76%	0.756	S	S	*	*			trans	64.6	82.8	154.4	-55.5	-39.4	0	0	0	119.5
868	L	24.1	Very low	24.1	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	76%	0.76	S	S	*	*			trans	-170.9	87.7	144.9	-103.9	158	0	0	0	107.1
869	H	22.4	Very low	23.8	Very low	156 Å²	156	143 Å²	143	72%	0.722	76%	0.762	S	S	*	*			cis	83.9	125.8	43	-148.3	62.9	0	0	0	113.1
870	L	21.9	Very low	23.7	Very low	135 Å²	135	143.3 Å²	143.3	71%	0.707	78%	0.777	S	S	*	*			trans	83.5	126.1	169	-58	164.9	0	0	0	120
871	N	23.2	Very low	23.8	Very low	126 Å²	126	144.8 Å²	144.8	67%	0.674	78%	0.783	S	S	*	*			trans	70.7	145.4	151.3	-57.2	6.5	0	0	0	118.2
872	E	24.7	Very low	23.8	Very low	162 Å²	162	145.1 Å²	145.1	76%	0.757	78%	0.782	S	S	*	*			cis	-147.2	-179.7	5.1	-140.2	149.4	-124.5	0	0	114.7
873	K	21.3	Very low	23.7	Very low	185 Å²	185	145.6 Å²	145.6	80%	0.804	78%	0.779	S	S	*	*			trans	-76	141.5	-164.8	-54.6	146.2	179.5	165.8	0	114.2
874	L	25.9	Very low	23.7	Very low	171 Å²	171	147.2 Å²	147.2	90%	0.895	79%	0.791	S	S	*	*			trans	175.3	96.2	146.8	-97.7	155.2	0	0	0	106.6
875	N	21.2	Very low	23.7	Very low	135 Å²	135	146 Å²	146	72%	0.722	78%	0.783	S	S	*	*			cis	85.7	128.8	48.8	-157.1	46.6	0	0	0	114
876	T	22.2	Very low	23.4	Very low	110 Å²	110	146 Å²	146	68%	0.675	78%	0.778	S	S	*	*			trans	67.9	139.9	169.9	45.5	0	0	0	0	120.9
877	N	27.9	Very low	23.2	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	78%	0.779	S	S	*	*			trans	75.9	91.9	172.2	-52.2	-3.5	0	0	0	115.1
878	E	23.7	Very low	23.2	Very low	170 Å²	170	144.9 Å²	144.9	79%	0.794	78%	0.782	S	S	*	*				78.6	140.9	65.5	-66.5	-165	160	0	0	115.6
879	N	26.5	Very low	23.1	Very low	152 Å²	152	145 Å²	145	81%	0.813	77%	0.771	S	S	*	*			trans	62.6	57.3	170.7	-59.9	-27.1	0	0	0	117.8	I881	N879-I881 PolarHBondContact O-N 3.38Å; N879-I881 VanDerWaalsContact O-N 3.16Å
880	G	24.6	Very low	23.1	Very low	84 Å²	84	143 Å²	143	87%	0.866	77%	0.773	S	S	*	*			trans	-75	93.3	166	0	0	0	0	0	113.6
881	I	23.9	Very low	23.4	Very low	163 Å²	163	142.3 Å²	142.3	84%	0.836	77%	0.771	S	S	*	*			trans	-130.4	72.8	162.5	-49.9	-180	0	0	0	109.4	N879	N879-I881 PolarHBondContact O-N 3.38Å; N879-I881 VanDerWaalsContact O-N 3.16Å
882	V	24.2	Very low	23.7	Very low	129 Å²	129	141.6 Å²	141.6	78%	0.782	77%	0.771	S	S	*	*			trans	-135.9	103.4	170.2	-175.8	0	0	0	0	110.3
883	Q	22.1	Very low	24	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	77%	0.77	S	S	*	*			trans	35.3	94	147.7	-59.7	175.8	-10.2	0	0	117.5	V885	Q883-V885 PolarHBondContact O-N 3.32Å; Q883-V885 VanDerWaalsContact O-N 3.14Å
884	S	21.7	Very low	24.3	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	76%	0.76	S	S	*	*			trans	-67.3	107.5	161.8	45	0	0	0	0	110.7
885	V	22.3	Very low	24.4	Very low	115 Å²	115	132.4 Å²	132.4	70%	0.697	76%	0.76	S	S	*	*			trans	-74.9	127.1	-175.4	172.2	0	0	0	0	111.9	Q883	Q883-V885 PolarHBondContact O-N 3.32Å; Q883-V885 VanDerWaalsContact O-N 3.14Å
886	Q	20.9	Very low	24.7	Very low	155 Å²	155	130.6 Å²	130.6	72%	0.724	76%	0.758	S	S	*	*			trans	45.7	101.9	157.3	-64.7	171.9	-11.4	0	0	117.9	V888	Q886-V888 HydrophobicContact CB-CG2 4.42Å; Q886-V888 PolarHBondContact O-N 2.57Å
887	N	20.1	Very low	24.9	Very low	152 Å²	152	131.3 Å²	131.3	81%	0.813	77%	0.766	S	S	*	*			trans	-63.2	91.4	160.2	-80.6	-10.7	0	0	0	111.3	Y889	N887-Y889 VanDerWaalsContact C-N 3.29Å; N887-Y889 HydrophobicContact CB-CD2 4.22Å; N887-Y889 PolarHBondContact O-N 3Å; N887-Y889 VanDerWaalsContact O-N 3.07Å
888	V	21.4	Very low	24.9	Very low	124 Å²	124	130.7 Å²	130.7	75%	0.752	77%	0.772	S	S	*	*			trans	-81.1	76.9	169.9	-175.8	0	0	0	0	109.2	Q886 C890	Q886-V888 HydrophobicContact CB-CG2 4.42Å; Q886-V888 PolarHBondContact O-N 2.57Å; V888-C890 PolarHBondContact O-N 3.15Å
889	Y	22.5	Very low	24.9	Very low	176 Å²	176	131.1 Å²	131.1	69%	0.69	77%	0.773	S	S	*	*			trans	-82.6	104.1	171.5	-97.2	-102.6	0	0	0	110.9	N887 T892	N887-Y889 VanDerWaalsContact C-N 3.29Å; N887-Y889 HydrophobicContact CB-CD2 4.22Å; N887-Y889 PolarHBondContact O-N 3Å; N887-Y889 VanDerWaalsContact O-N 3.07Å; Y889-T892 HydrophobicContact CD1-CG2 4.44Å; Y889-T892 HydrophobicContact CE1-CG2 4Å
890	C	23.8	Very low	24.9	Very low	114 Å²	114	131.6 Å²	131.6	77%	0.77	77%	0.771	S	S	*	*			trans	-78.4	124.3	141.5	-68.9	0	0	0	0	106.5	V888	V888-C890 PolarHBondContact O-N 3.15Å
891	D	27.4	Very low	24.9	Very low	122 Å²	122	135.2 Å²	135.2	65%	0.652	77%	0.769	S	S	*	*			trans	-65.7	149.2	-170.1	-167.2	19.4	0	0	0	113.1	T893	D891-T893 VanDerWaalsContact C-N 3.31Å; D891-T893 PolarHBondContact O-N 3.07Å
892	T	28.7	Very low	25	Very low	111 Å²	111	132.4 Å²	132.4	68%	0.681	77%	0.77	S	S	*	*	S	Bend	trans	-81	-2.7	-158	55	0	0	0	0	114.8	Y889 G894	Y889-T892 HydrophobicContact CD1-CG2 4.44Å; Y889-T892 HydrophobicContact CE1-CG2 4Å; T892-G894 VanDerWaalsContact C-N 3.29Å; T892-G894 PolarHBondContact O-N 2.97Å
893	T	31.1	Very low	25.2	Very low	121 Å²	121	129 Å²	129	74%	0.742	76%	0.755	S	S	*	*	S	Bend	trans	-83.4	61	-178	54.1	0	0	0	0	113.7	D891	D891-T893 VanDerWaalsContact C-N 3.31Å; D891-T893 PolarHBondContact O-N 3.07Å
894	G	28.5	Very low	25.6	Very low	57 Å²	57	130.5 Å²	130.5	59%	0.588	76%	0.762	S	S	*	*			trans	55.7	84.6	151.6	0	0	0	0	0	118.7	T892	T892-G894 VanDerWaalsContact C-N 3.29Å; T892-G894 PolarHBondContact O-N 2.97Å
895	T	27.9	Very low	26.6	Very low	147 Å²	147	129.6 Å²	129.6	90%	0.902	75%	0.751	S	S	*	*			trans	44.2	88.9	147.2	56.3	0	0	0	0	118.3
896	S	27.2	Very low	28	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	74%	0.739	S	S	*	*			trans	-143.5	76.7	149.8	-164.5	0	0	0	0	112.1
897	C	27.5	Very low	30.2	Very low	124 Å²	124	122.7 Å²	122.7	84%	0.838	72%	0.722	S	S	*	*	S	Bend	trans	-142.4	20.7	171	-89.9	0	0	0	0	113
898	C	26.3	Very low	32.7	Very low	131 Å²	131	116 Å²	116	89%	0.885	69%	0.687	S	S	*	*			trans	-152	62.9	172.7	-87.2	0	0	0	0	111.7
899	E	24	Very low	34.7	Very low	178 Å²	178	117.7 Å²	117.7	83%	0.832	69%	0.691	S	S	*	*			trans	-115.7	76.7	166.3	-75.8	-151.6	130.3	0	0	111.9
900	E	26.7	Very low	36.6	Very low	162 Å²	162	114.7 Å²	114.7	76%	0.757	69%	0.687	S	S	*	*	S	Bend	trans	-124.2	113.2	144.7	-83.3	-169.1	-163.6	0	0	109.5	A902	E900-A902 PolarHBondContact O-N 3.14Å
901	I	25.1	Very low	39.2	Very low	160 Å²	160	110 Å²	110	82%	0.821	66%	0.655	S	S	*	*			trans	-20.3	116.2	174.4	-56	169.7	0	0	0	114	A903	I901-A903 HydrophobicContact CG2-CB 4.23Å; I901-A903 PolarHBondContact O-N 2.94Å
902	A	25.9	Very low	41.5	Very low	104 Å²	104	107.2 Å²	107.2	86%	0.86	64%	0.64	S	S	*	*			trans	-71.2	62	169.3	0	0	0	0	0	112.3	E900 Q904	E900-A902 PolarHBondContact O-N 3.14Å; A902-Q904 PolarHBondContact O-N 3Å
903	A	29.1	Very low	43.6	Very low	58 Å²	58	104.3 Å²	104.3	48%	0.479	62%	0.623	S	S	.	*			trans	-69.3	126.3	169	0	0	0	0	0	108.7	I901 T905	I901-A903 HydrophobicContact CG2-CB 4.23Å; I901-A903 PolarHBondContact O-N 2.94Å; A903-T905 VanDerWaalsContact C-N 3.31Å; A903-T905 HydrophobicContact CB-CG2 4.39Å; A903-T905 PolarHBondContact O-N 3.01Å; A903-T905 PolarHBondContact O-OG1 2.83Å
904	Q	30.2	Very low	45.1	Very low	205 Å²	205	100.2 Å²	100.2	96%	0.958	61%	0.606	S	S	*	*			trans	-65.8	87.9	-179.8	-64.4	176.1	-61.7	0	0	110.4	A902	A902-Q904 PolarHBondContact O-N 3Å
905	T	42	Very low	46.6	Very low	108 Å²	108	103.5 Å²	103.5	66%	0.663	61%	0.614	S	S	*	*			trans	-110	142	-178.8	48.2	0	0	0	0	110.3	A903 C907	A903-T905 VanDerWaalsContact C-N 3.31Å; A903-T905 HydrophobicContact CB-CG2 4.39Å; A903-T905 PolarHBondContact O-N 3.01Å; A903-T905 PolarHBondContact O-OG1 2.83Å; T905-C907 PolarHBondContact O-N 3.12Å; T905-C907 VanDerWaalsContact O-N 3.09Å
906	T	51.7	Low	48.6	Very low	72 Å²	72	99.3 Å²	99.3	44%	0.442	59%	0.586	S	S	.	*			trans	-76.7	101.9	-173.2	56.8	0	0	0	0	109.7	N931	T906-N931 CarbonylContact C-O 3.58Å; T906-N931 VanDerWaalsContact C-O 3.29Å; T906-N931 WeakPolarHBondContact CB-O 3.45Å; T906-N931 PolarHBondContact OG1-O 2.73Å
907	C	67.1	Low	51.1	Low	53 Å²	53	94.7 Å²	94.7	36%	0.358	55%	0.554	S	S	.	*			trans	-107	133.4	164.6	-163.3	0	0	0	0	108.7	T905 C913	T905-C907 PolarHBondContact O-N 3.12Å; T905-C907 VanDerWaalsContact O-N 3.09Å; C907-C913 WeakPolarHBondContact CA-SG 3.45Å; C907-C913 HydrophobicContact CB-CB 3.82Å; C907-C913 WeakPolarHBondContact CB-SG 3.5Å; C907-C913 WeakPolarHBondContact SG-CB 3.45Å; C907-C913 CovalentContact SG-SG 2.04Å; C907-C913 PolarHBondContact SG-SG 3.27Å
908	P	73.7	Confident	53.9	Low	12 Å²	12	89 Å²	89	8%	0.078	52%	0.515	C	S	.	.			trans	-65.3	148.2	175.8	-15.1	26.9	0	0	0	111.6	N910 C911 P929 V930 I932	P908-N910 PolarHBondContact O-N 3.03Å; P908-C911 HydrophobicContact CB-CB 4.27Å; P908-C911 HydrophobicContact CG-CB 4.3Å; P908-C911 PolarHBondContact O-N 2.87Å; P908-P929 HydrophobicContact CB-CB 3.54Å; P908-P929 HydrophobicContact CB-CG 4.44Å; P908-P929 HydrophobicContact CG-CB 3.77Å; P908-V930 WeakPolarHBondContact CG-O 3.41Å; P908-I932 HydrophobicContact CG-CG1 3.71Å
909	L	63.3	Low	56.7	Low	159 Å²	159	84.4 Å²	84.4	83%	0.832	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	143	167.5	-90.5	102.2	0	0	0	110	C911	L909-C911 PolarHBondContact O-N 3.11Å
910	N	62.1	Low	59.6	Low	114 Å²	114	76 Å²	76	61%	0.61	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	11.7	-176.3	-53.6	-16.9	0	0	0	115.7	P908 R923	P908-N910 PolarHBondContact O-N 3.03Å; N910-R923 VanDerWaalsContact O-CD 3.26Å; N910-R923 WeakPolarHBondContact O-CD 3.27Å; N910-R923 VanDerWaalsContact O-CG 3.24Å; N910-R923 WeakPolarHBondContact O-CG 3.39Å; N910-R923 PolarHBondContact O-NH1 2.74Å
911	C	77.1	Confident	62.3	Low	14 Å²	14	69 Å²	69	10%	0.095	41%	0.409	C	S	.	.			trans	-108.1	163.7	167.9	-63.4	0	0	0	0	112.4	P908 L909 V918 C920	P908-C911 HydrophobicContact CB-CB 4.27Å; P908-C911 HydrophobicContact CG-CB 4.3Å; P908-C911 PolarHBondContact O-N 2.87Å; L909-C911 PolarHBondContact O-N 3.11Å; C911-V918 HydrophobicContact CB-CG1 4.46Å; C911-C920 HydrophobicContact CB-CB 4.19Å; C911-C920 WeakPolarHBondContact CB-SG 3.43Å; C911-C920 WeakPolarHBondContact SG-CB 3.5Å; C911-C920 CovalentContact SG-SG 2.04Å; C911-C920 PolarHBondContact SG-SG 3.1Å
912	L	76.4	Confident	65	Low	64 Å²	64	65.6 Å²	65.6	34%	0.335	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.6	167.7	-63.4	173.6	0	0	0	109.1	Y850 Y919	Y850-L912 HydrophobicContact CD1-CB 4.12Å; Y850-L912 HydrophobicContact CD1-CD1 4.29Å; L912-Y919 PolarHBondContact N-O 2.82Å; L912-Y919 PolarHBondContact O-N 2.83Å
913	C	72.6	Confident	67.6	Low	50 Å²	50	65 Å²	65	34%	0.338	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.9	-179.8	-58.3	0	0	0	0	110.4	C907 V918	C907-C913 WeakPolarHBondContact CA-SG 3.45Å; C907-C913 HydrophobicContact CB-CB 3.82Å; C907-C913 WeakPolarHBondContact CB-SG 3.5Å; C907-C913 WeakPolarHBondContact SG-CB 3.45Å; C907-C913 CovalentContact SG-SG 2.04Å; C907-C913 PolarHBondContact SG-SG 3.27Å; C913-V918 HydrophobicContact CB-CG2 4.21Å
914	G	62.6	Low	70.3	Confident	36 Å²	36	67.6 Å²	67.6	37%	0.371	37%	0.374	S	S	.	.			trans	-100.3	-163.6	168.5	0	0	0	0	0	112	D916 G917	G914-D916 VanDerWaalsContact C-N 3.3Å; G914-D916 PolarHBondContact O-N 2.86Å; G914-G917 PolarHBondContact N-O 3.22Å
915	T	60.9	Low	72.9	Confident	125 Å²	125	59.3 Å²	59.3	77%	0.767	34%	0.336	S	S	*	.	S	Bend	trans	-62.2	-33.7	179.6	45.7	0	0	0	0	113.7
916	D	70.1	Confident	74.9	Confident	60 Å²	60	58.5 Å²	58.5	32%	0.321	33%	0.331	S	S	.	.	S	Bend	trans	-140.8	-22.3	-178.9	76.4	-39.9	0	0	0	114.2	G914 T936 T937 Q938	G914-D916 VanDerWaalsContact C-N 3.3Å; G914-D916 PolarHBondContact O-N 2.86Å; D916-T936 CarbonylContact O-C 3.58Å; D916-T936 VanDerWaalsContact O-CA 3.27Å; D916-T936 WeakPolarHBondContact O-CA 3.22Å; D916-T936 WeakPolarHBondContact O-CG2 3.2Å; D916-T937 HydrophobicContact CB-CG2 3.98Å; D916-T937 VanDerWaalsContact CB-OG1 3.3Å; D916-T937 WeakPolarHBondContact CB-OG1 3.32Å; D916-T937 PolarHBondContact O-N 3.39Å; D916-T937 PolarHBondContact O-OG1 3.03Å; D916-T937 PolarHBondContact OD2-OG1 3.43Å; D916-Q938 PolarHBondContact O-N 2.78Å
917	G	78.5	Confident	76.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	145.2	176.5	0	0	0	0	0	114.6	G914 Q938	G914-G917 PolarHBondContact N-O 3.22Å; G917-Q938 CarbonylContact C-O 3.22Å; G917-Q938 WeakPolarHBondContact CA-O 3.14Å
918	V	85.6	Confident	77.7	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.8	173.9	175.8	0	0	0	0	110	C911 C913 I932 T936 Q938 L939 Y940	C911-V918 HydrophobicContact CB-CG1 4.46Å; C913-V918 HydrophobicContact CB-CG2 4.21Å; V918-I932 HydrophobicContact CB-CG2 4.46Å; V918-I932 HydrophobicContact CG1-CG2 4.45Å; V918-I932 HydrophobicContact CG2-CG2 4.2Å; V918-T936 HydrophobicContact CB-CG2 4.07Å; V918-T936 HydrophobicContact CG2-CG2 3.77Å; V918-T936 WeakPolarHBondContact CG2-OG1 3.32Å; V918-Q938 PolarHBondContact N-O 3.22Å; V918-L939 HydrophobicContact CB-CD1 4.02Å; V918-L939 HydrophobicContact CG1-CD1 3.96Å; V918-L939 WeakPolarHBondContact O-CA 3.38Å; V918-Y940 PolarHBondContact O-N 3.5Å
919	Y	85.5	Confident	78.2	Confident	36 Å²	36	57.3 Å²	57.3	14%	0.141	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.4	-167.7	-62.3	-101.7	0	0	0	109.7	Y850 L912 Y940	Y850-Y919 HydrophobicContact CD1-CD2 4.09Å; Y850-Y919 HydrophobicContact CD1-CG 4.42Å; Y850-Y919 HydrophobicContact CD2-CD1 4.07Å; Y850-Y919 AromaticContact CD2-CD2 3.94Å; Y850-Y919 HydrophobicContact CD2-CD2 3.94Å; Y850-Y919 AromaticContact CD2-CE1 3.86Å; Y850-Y919 HydrophobicContact CD2-CE1 3.86Å; Y850-Y919 AromaticContact CD2-CE2 3.78Å; Y850-Y919 HydrophobicContact CD2-CE2 3.78Å; Y850-Y919 HydrophobicContact CD2-CG 4.11Å; Y850-Y919 AromaticContact CD2-CZ 3.73Å; Y850-Y919 AromaticContact CE1-CD2 3.76Å; Y850-Y919 HydrophobicContact CE1-CD2 3.76Å; Y850-Y919 AromaticContact CE1-CE2 3.97Å; Y850-Y919 HydrophobicContact CE1-CE2 3.97Å; Y850-Y919 HydrophobicContact CE2-CD1 4.39Å; Y850-Y919 AromaticContact CE2-CD2 3.64Å; Y850-Y919 HydrophobicContact CE2-CD2 3.64Å; Y850-Y919 AromaticContact CE2-CE1 3.93Å; Y850-Y919 HydrophobicContact CE2-CE1 3.93Å; Y850-Y919 AromaticContact CE2-CE2 3.13Å; Y850-Y919 HydrophobicContact CE2-CE2 3.13Å; Y850-Y919 HydrophobicContact CE2-CG 4.27Å; Y850-Y919 AromaticContact CE2-CZ 3.28Å; Y850-Y919 HydrophobicContact CG-CD1 4.46Å; Y850-Y919 HydrophobicContact CG-CD2 4.18Å; Y850-Y919 HydrophobicContact CG-CE2 4.45Å; Y850-Y919 HydrophobicContact CG-CG 4.21Å; Y850-Y919 AromaticContact CZ-CD2 3.53Å; Y850-Y919 AromaticContact CZ-CE2 3.23Å; Y850-Y919 AromaticContact CZ-CZ 3.92Å; Y850-Y919 WeakPolarHBondContact OH-CE2 3.28Å; L912-Y919 PolarHBondContact N-O 2.82Å; L912-Y919 PolarHBondContact O-N 2.83Å; Y919-Y940 AromaticContact CD1-CD2 3.49Å; Y919-Y940 HydrophobicContact CD1-CD2 3.49Å; Y919-Y940 VanDerWaalsContact CD1-CD2 3.49Å; Y919-Y940 HydrophobicContact CD1-CE2 4.15Å; Y919-Y940 AromaticContact CD1-CG 3.77Å; Y919-Y940 HydrophobicContact CD1-CG 3.77Å; Y919-Y940 HydrophobicContact CE1-CD1 4.41Å; Y919-Y940 AromaticContact CE1-CD2 3.18Å; Y919-Y940 HydrophobicContact CE1-CD2 3.18Å; Y919-Y940 AromaticContact CE1-CE2 3.35Å; Y919-Y940 HydrophobicContact CE1-CE2 3.35Å; Y919-Y940 AromaticContact CE1-CG 3.77Å; Y919-Y940 HydrophobicContact CE1-CG 3.77Å; Y919-Y940 HydrophobicContact CE2-CD2 4.24Å; Y919-Y940 HydrophobicContact CE2-CE2 4.4Å; Y919-Y940 HydrophobicContact CG-CD2 4.16Å; Y919-Y940 AromaticContact CZ-CD2 3.6Å; Y919-Y940 AromaticContact CZ-CE2 3.49Å; Y919-Y940 VanDerWaalsContact CZ-CE2 3.49Å; Y919-Y940 WeakPolarHBondContact OH-CE2 3.11Å
920	C	85.2	Confident	79	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.299	C	S	.	.			trans	-125.8	19.4	-174.1	-62	0	0	0	0	111.4	C911 R923 L925 Y940 L941 N944	C911-C920 HydrophobicContact CB-CB 4.19Å; C911-C920 WeakPolarHBondContact CB-SG 3.43Å; C911-C920 WeakPolarHBondContact SG-CB 3.5Å; C911-C920 CovalentContact SG-SG 2.04Å; C911-C920 PolarHBondContact SG-SG 3.1Å; C920-R923 VanDerWaalsContact O-CG 3.29Å; C920-R923 WeakPolarHBondContact O-CG 3.47Å; C920-L925 HydrophobicContact CB-CD1 3.86Å; C920-Y940 PolarHBondContact N-O 3.27Å; C920-L941 HydrophobicContact CB-CD2 3.58Å; C920-L941 HydrophobicContact CB-CG 4.43Å; C920-N944 PolarHBondContact O-ND2 2.8Å
921	S	84.3	Confident	79.7	Confident	15 Å²	15	53.4 Å²	53.4	11%	0.105	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	145.2	-176.7	-35.4	0	0	0	0	112.3	R923 E942	S921-R923 VanDerWaalsContact C-N 3.29Å; S921-R923 WeakPolarHBondContact O-CG 3.44Å; S921-R923 PolarHBondContact O-N 3.07Å; S921-R923 PolarHBondContact O-NE 2.89Å; S921-R923 VanDerWaalsContact O-NE 3.11Å; S921-E942 VanDerWaalsContact CA-O 3.27Å; S921-E942 WeakPolarHBondContact CA-O 3.39Å; S921-E942 WeakPolarHBondContact CB-O 3.42Å; S921-E942 VanDerWaalsContact CB-OE1 3.29Å; S921-E942 WeakPolarHBondContact CB-OE1 3.48Å; S921-E942 PolarHBondContact OG-OE1 3.21Å
922	D	80.2	Confident	80.1	Confident	90 Å²	90	52.8 Å²	52.8	48%	0.481	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	31.1	179.5	-54.4	-82	0	0	0	114.4	E942 R943	D922-E942 PolarHBondContact N-O 3.17Å; D922-R943 WeakPolarHBondContact CA-O 3.18Å; D922-R943 VanDerWaalsContact CG-NE 3.31Å; D922-R943 WeakPolarHBondContact OD1-CB 3.45Å; D922-R943 WeakPolarHBondContact OD1-CD 3.37Å; D922-R943 IonicContact OD1-CZ 3.59Å; D922-R943 IonicContact OD1-NE 2.94Å; D922-R943 PolarHBondContact OD1-NE 3.3Å; D922-R943 IonicContact OD1-NH2 2.73Å; D922-R943 IonicContact OD2-CZ 3.95Å; D922-R943 VanDerWaalsContact OD2-CZ 3.32Å; D922-R943 IonicContact OD2-NE 3.98Å; D922-R943 PolarHBondContact OD2-NE 2.86Å; D922-R943 VanDerWaalsContact OD2-NE 3.11Å; D922-R943 IonicContact OD2-NH2 3.4Å; D922-R943 PolarHBondContact OD2-NH2 3Å
923	R	82.3	Confident	80.4	Confident	92 Å²	92	51.1 Å²	51.1	35%	0.347	29%	0.288	S	S	.	.	S	Bend	trans	-105.7	12.9	-177.2	-53.3	-58.7	161.6	109.5	-12.9	113.7	N910 C920 S921 L925 N944	N910-R923 VanDerWaalsContact O-CD 3.26Å; N910-R923 WeakPolarHBondContact O-CD 3.27Å; N910-R923 VanDerWaalsContact O-CG 3.24Å; N910-R923 WeakPolarHBondContact O-CG 3.39Å; N910-R923 PolarHBondContact O-NH1 2.74Å; C920-R923 VanDerWaalsContact O-CG 3.29Å; C920-R923 WeakPolarHBondContact O-CG 3.47Å; S921-R923 VanDerWaalsContact C-N 3.29Å; S921-R923 WeakPolarHBondContact O-CG 3.44Å; S921-R923 PolarHBondContact O-N 3.07Å; S921-R923 PolarHBondContact O-NE 2.89Å; S921-R923 VanDerWaalsContact O-NE 3.11Å; R923-L925 HydrophobicContact CB-CD1 3.98Å; R923-L925 HydrophobicContact CB-CD2 4.38Å; R923-L925 HydrophobicContact CB-CG 3.8Å; R923-L925 PolarHBondContact O-N 2.79Å; R923-L925 VanDerWaalsContact O-N 3.13Å; R923-N944 PolarHBondContact N-OD1 3.01Å; R923-N944 VanDerWaalsContact N-OD1 3.09Å
924	N	85	Confident	80.9	Confident	111 Å²	111	51.9 Å²	51.9	59%	0.594	29%	0.292	S	S	*	.			trans	53.9	27	-179.9	-153.9	35.6	0	0	0	114.3	N944 Q945	N924-N944 PolarHBondContact N-OD1 3.25Å; N924-Q945 WeakPolarHBondContact OD1-CG 3.33Å; N924-Q945 PolarHBondContact OD1-NE2 3.26Å
925	L	83.7	Confident	81.8	Confident	31 Å²	31	55.1 Å²	55.1	16%	0.162	30%	0.298	C	S	.	.			trans	-70.5	128.9	-171.4	-63.7	166.6	0	0	0	111.6	C920 R923 P929 L941 N944 Q945 I946	C920-L925 HydrophobicContact CB-CD1 3.86Å; R923-L925 HydrophobicContact CB-CD1 3.98Å; R923-L925 HydrophobicContact CB-CD2 4.38Å; R923-L925 HydrophobicContact CB-CG 3.8Å; R923-L925 PolarHBondContact O-N 2.79Å; R923-L925 VanDerWaalsContact O-N 3.13Å; L925-P929 HydrophobicContact CD1-CG 3.72Å; L925-P929 HydrophobicContact CD2-CG 4.34Å; L925-L941 HydrophobicContact CD1-CD2 4.25Å; L925-N944 HydrophobicContact CB-CB 4.19Å; L925-N944 WeakPolarHBondContact CB-OD1 3.02Å; L925-N944 PolarHBondContact N-OD1 3.16Å; L925-Q945 CarbonylContact O-C 3.55Å; L925-Q945 VanDerWaalsContact O-CA 3.29Å; L925-Q945 WeakPolarHBondContact O-CA 3.5Å; L925-Q945 PolarHBondContact O-N 3.21Å; L925-I946 WeakPolarHBondContact O-CG1 3.45Å; L925-I946 PolarHBondContact O-N 2.93Å; L925-I946 VanDerWaalsContact O-N 3.15Å
926	T	85.9	Confident	83	Confident	92 Å²	92	49.4 Å²	49.4	56%	0.564	26%	0.262	S	S	*	.	S	Bend	trans	-85.8	-14.8	176.4	52.2	0	0	0	0	113.4	Q945 I946	T926-Q945 HydrophobicContact CG2-CB 4.31Å; T926-I946 WeakPolarHBondContact O-CA 3.15Å
927	E	87.7	Confident	83.9	Confident	95 Å²	95	47.5 Å²	47.5	44%	0.444	25%	0.253	S	S	.	.	S	Bend	trans	-149.8	162.1	180	53.2	170	-143.4	0	0	111.4	R953	E927-R953 VanDerWaalsContact CD-CZ 3.4Å; E927-R953 IonicContact OE1-CZ 3.75Å; E927-R953 IonicContact OE1-NH1 3.88Å; E927-R953 PolarHBondContact OE1-NH1 2.91Å; E927-R953 IonicContact OE1-NH2 3.6Å; E927-R953 PolarHBondContact OE1-NH2 3.06Å; E927-R953 IonicContact OE2-CZ 3.96Å; E927-R953 IonicContact OE2-NH1 3.73Å; E927-R953 IonicContact OE2-NH2 3.93Å; E927-R953 PolarHBondContact OE2-NH2 3.14Å
928	I	88.8	Confident	84.4	Confident	2 Å²	2	50 Å²	50	1%	0.01	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-66.7	129.8	176.5	-58.9	178.6	0	0	0	109.2	I932 L941 I946 I949 R953 I954	I928-I932 HydrophobicContact CG2-CD1 4.17Å; I928-L941 HydrophobicContact CD1-CD1 4.48Å; I928-L941 HydrophobicContact CG1-CD1 4.18Å; I928-L941 HydrophobicContact CG2-CD1 4.13Å; I928-I946 HydrophobicContact CG1-CD1 4.18Å; I928-I946 HydrophobicContact CG1-CG2 4.35Å; I928-I949 HydrophobicContact CD1-CG2 4.01Å; I928-R953 VanDerWaalsContact O-CD 3.24Å; I928-R953 WeakPolarHBondContact O-CD 3.36Å; I928-R953 PolarHBondContact O-NH1 3.1Å; I928-I954 HydrophobicContact CD1-CG2 4.03Å; I928-I954 HydrophobicContact CG2-CG2 4.13Å
929	P	85.3	Confident	84.9	Confident	15 Å²	15	49.9 Å²	49.9	10%	0.097	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-61.5	146.2	-179.2	-25.1	35.1	0	0	0	113.9	P908 L925	P908-P929 HydrophobicContact CB-CB 3.54Å; P908-P929 HydrophobicContact CB-CG 4.44Å; P908-P929 HydrophobicContact CG-CB 3.77Å; L925-P929 HydrophobicContact CD1-CG 3.72Å; L925-P929 HydrophobicContact CD2-CG 4.34Å
930	V	80.2	Confident	85.2	Confident	80 Å²	80	50.6 Å²	50.6	49%	0.485	27%	0.267	S	S	.	.	S	Bend	trans	-78.3	167.6	168.1	-64.4	0	0	0	0	111.2	P908 I932	P908-V930 WeakPolarHBondContact CG-O 3.41Å; V930-I932 PolarHBondContact O-N 3.35Å
931	N	76.8	Confident	85.6	Confident	110 Å²	110	50.6 Å²	50.6	59%	0.588	27%	0.267	S	S	*	.			trans	62.8	32.9	175.5	-55.2	-19.6	0	0	0	115	T906	T906-N931 CarbonylContact C-O 3.58Å; T906-N931 VanDerWaalsContact C-O 3.29Å; T906-N931 WeakPolarHBondContact CB-O 3.45Å; T906-N931 PolarHBondContact OG1-O 2.73Å
932	I	84	Confident	85.8	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.269	C	S	.	.			trans	-74.6	137.2	164.8	-56.6	171.6	0	0	0	108.9	P908 V918 I928 V930 T936 L939 H956 L957	P908-I932 HydrophobicContact CG-CG1 3.71Å; V918-I932 HydrophobicContact CB-CG2 4.46Å; V918-I932 HydrophobicContact CG1-CG2 4.45Å; V918-I932 HydrophobicContact CG2-CG2 4.2Å; I928-I932 HydrophobicContact CG2-CD1 4.17Å; V930-I932 PolarHBondContact O-N 3.35Å; I932-T936 HydrophobicContact CG2-CG2 4.35Å; I932-L939 HydrophobicContact CD1-CD1 3.99Å; I932-L939 HydrophobicContact CD1-CD2 3.84Å; I932-H956 PolarHBondContact O-CD2 2.99Å; I932-H956 PolarHBondContact O-NE2 2.95Å; I932-L957 HydrophobicContact CB-CD1 4.47Å; I932-L957 HydrophobicContact CB-CD2 4.01Å; I932-L957 HydrophobicContact CD1-CD1 4.5Å; I932-L957 HydrophobicContact CG2-CD1 4.06Å; I932-L957 HydrophobicContact CG2-CD2 3.63Å
933	S	83	Confident	86.3	Confident	28 Å²	28	53.1 Å²	53.1	20%	0.196	27%	0.269	C	S	.	.			trans	-62.3	137	-177.7	-179.1	0	0	0	0	113.7	E935 T936 L957	S933-E935 PolarHBondContact O-N 3.48Å; S933-E935 VanDerWaalsContact O-N 3.1Å; S933-E935 PolarHBondContact OG-N 3.36Å; S933-T936 WeakPolarHBondContact O-CB 3.21Å; S933-T936 PolarHBondContact O-N 2.9Å; S933-T936 VanDerWaalsContact O-N 3.14Å; S933-T936 PolarHBondContact O-OG1 2.88Å; S933-T936 VanDerWaalsContact O-OG1 3.11Å; S933-L957 WeakPolarHBondContact O-CD2 3.47Å
934	P	82.7	Confident	86.7	Confident	67 Å²	67	49 Å²	49	44%	0.435	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.9	173	-21.6	31.6	0	0	0	115	T936	P934-T936 VanDerWaalsContact C-N 3.35Å
935	E	81.6	Confident	87	Confident	103 Å²	103	48 Å²	48	48%	0.481	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-12.9	179.4	-66.3	-61.3	117.7	0	0	113.7	S933 T937 K959	S933-E935 PolarHBondContact O-N 3.48Å; S933-E935 VanDerWaalsContact O-N 3.1Å; S933-E935 PolarHBondContact OG-N 3.36Å; E935-T937 PolarHBondContact O-N 3.15Å; E935-K959 IonicContact OE1-NZ 3.7Å; E935-K959 PolarHBondContact OE1-NZ 3.1Å; E935-K959 IonicContact OE2-NZ 3.11Å; E935-K959 PolarHBondContact OE2-NZ 2.81Å
936	T	85.8	Confident	87.3	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.031	24%	0.238	C	C	.	.			trans	-60.2	125.4	-174.8	-63	0	0	0	0	112.6	D916 V918 I932 S933 P934 Q938 K959 L960	D916-T936 CarbonylContact O-C 3.58Å; D916-T936 VanDerWaalsContact O-CA 3.27Å; D916-T936 WeakPolarHBondContact O-CA 3.22Å; D916-T936 WeakPolarHBondContact O-CG2 3.2Å; V918-T936 HydrophobicContact CB-CG2 4.07Å; V918-T936 HydrophobicContact CG2-CG2 3.77Å; V918-T936 WeakPolarHBondContact CG2-OG1 3.32Å; I932-T936 HydrophobicContact CG2-CG2 4.35Å; S933-T936 WeakPolarHBondContact O-CB 3.21Å; S933-T936 PolarHBondContact O-N 2.9Å; S933-T936 VanDerWaalsContact O-N 3.14Å; S933-T936 PolarHBondContact O-OG1 2.88Å; S933-T936 VanDerWaalsContact O-OG1 3.11Å; P934-T936 VanDerWaalsContact C-N 3.35Å; T936-Q938 WeakPolarHBondContact CG2-O 3.47Å; T936-K959 CarbonylContact O-C 3.57Å; T936-L960 HydrophobicContact CG2-CD1 4.06Å; T936-L960 WeakPolarHBondContact O-CA 3.46Å; T936-L960 PolarHBondContact O-N 2.82Å
937	T	90.4	Very high	87.4	Confident	21 Å²	21	46.1 Å²	46.1	13%	0.129	24%	0.235	C	C	.	.	S	Bend	trans	-98	-23.4	177.9	63.2	0	0	0	0	112.5	D916 E935 Q961 T962	D916-T937 HydrophobicContact CB-CG2 3.98Å; D916-T937 VanDerWaalsContact CB-OG1 3.3Å; D916-T937 WeakPolarHBondContact CB-OG1 3.32Å; D916-T937 PolarHBondContact O-N 3.39Å; D916-T937 PolarHBondContact O-OG1 3.03Å; D916-T937 PolarHBondContact OD2-OG1 3.43Å; E935-T937 PolarHBondContact O-N 3.15Å; T937-Q961 WeakPolarHBondContact O-CA 3.32Å; T937-Q961 PolarHBondContact O-N 2.79Å; T937-T962 PolarHBondContact O-N 2.88Å; T937-T962 VanDerWaalsContact O-N 3.12Å
938	Q	89.6	Confident	87.3	Confident	53 Å²	53	48.6 Å²	48.6	25%	0.248	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	131.1	-177.4	-54.6	177.4	64.1	0	0	110.6	D916 G917 V918 T936 Y940 T962	D916-Q938 PolarHBondContact O-N 2.78Å; G917-Q938 CarbonylContact C-O 3.22Å; G917-Q938 WeakPolarHBondContact CA-O 3.14Å; V918-Q938 PolarHBondContact N-O 3.22Å; T936-Q938 WeakPolarHBondContact CG2-O 3.47Å; Q938-Y940 HydrophobicContact CB-CD2 4.48Å; Q938-Y940 HydrophobicContact CB-CE2 3.77Å; Q938-Y940 PolarHBondContact OE1-OH 3.32Å; Q938-Y940 VanDerWaalsContact OE1-OH 3.1Å; Q938-T962 WeakPolarHBondContact CA-O 3.26Å
939	L	94.1	Very high	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	119.8	-179.9	179.4	57.2	0	0	0	110.8	V918 I932 L941 L957 L960 T962 L963 V964	V918-L939 HydrophobicContact CB-CD1 4.02Å; V918-L939 HydrophobicContact CG1-CD1 3.96Å; V918-L939 WeakPolarHBondContact O-CA 3.38Å; I932-L939 HydrophobicContact CD1-CD1 3.99Å; I932-L939 HydrophobicContact CD1-CD2 3.84Å; L939-L941 HydrophobicContact CD1-CD1 4.22Å; L939-L941 HydrophobicContact CD1-CG 4.19Å; L939-L941 HydrophobicContact CD2-CD1 3.86Å; L939-L941 HydrophobicContact CG-CD1 3.78Å; L939-L941 HydrophobicContact CG-CG 4.16Å; L939-L957 HydrophobicContact CD2-CD1 3.92Å; L939-L960 HydrophobicContact CB-CD1 3.72Å; L939-L960 HydrophobicContact CB-CD2 4.48Å; L939-T962 PolarHBondContact N-O 3.08Å; L939-L963 HydrophobicContact CB-CD1 4.08Å; L939-L963 HydrophobicContact CD2-CD1 3.98Å; L939-L963 HydrophobicContact CG-CD1 4.04Å; L939-V964 PolarHBondContact O-N 2.84Å
940	Y	93	Very high	87.4	Confident	51 Å²	51	50.7 Å²	50.7	20%	0.2	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.4	-178	-63.8	-94.8	0	0	0	110.2	V918 Y919 C920 Q938 V964	V918-Y940 PolarHBondContact O-N 3.5Å; Y919-Y940 AromaticContact CD1-CD2 3.49Å; Y919-Y940 HydrophobicContact CD1-CD2 3.49Å; Y919-Y940 VanDerWaalsContact CD1-CD2 3.49Å; Y919-Y940 HydrophobicContact CD1-CE2 4.15Å; Y919-Y940 AromaticContact CD1-CG 3.77Å; Y919-Y940 HydrophobicContact CD1-CG 3.77Å; Y919-Y940 HydrophobicContact CE1-CD1 4.41Å; Y919-Y940 AromaticContact CE1-CD2 3.18Å; Y919-Y940 HydrophobicContact CE1-CD2 3.18Å; Y919-Y940 AromaticContact CE1-CE2 3.35Å; Y919-Y940 HydrophobicContact CE1-CE2 3.35Å; Y919-Y940 AromaticContact CE1-CG 3.77Å; Y919-Y940 HydrophobicContact CE1-CG 3.77Å; Y919-Y940 HydrophobicContact CE2-CD2 4.24Å; Y919-Y940 HydrophobicContact CE2-CE2 4.4Å; Y919-Y940 HydrophobicContact CG-CD2 4.16Å; Y919-Y940 AromaticContact CZ-CD2 3.6Å; Y919-Y940 AromaticContact CZ-CE2 3.49Å; Y919-Y940 VanDerWaalsContact CZ-CE2 3.49Å; Y919-Y940 WeakPolarHBondContact OH-CE2 3.11Å; C920-Y940 PolarHBondContact N-O 3.27Å; Q938-Y940 HydrophobicContact CB-CD2 4.48Å; Q938-Y940 HydrophobicContact CB-CE2 3.77Å; Q938-Y940 PolarHBondContact OE1-OH 3.32Å; Q938-Y940 VanDerWaalsContact OE1-OH 3.1Å; Y940-V964 HydrophobicContact CD1-CB 3.96Å; Y940-V964 HydrophobicContact CD1-CG2 3.74Å; Y940-V964 HydrophobicContact CE1-CB 4.49Å; Y940-V964 HydrophobicContact CE1-CG2 3.77Å
941	L	93.4	Very high	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.247	C	C	.	.			trans	-137.6	14.7	-172.4	-73.5	159.9	0	0	0	111.9	C920 L925 I928 L939 N944 I946 L963 V964 L965 N968	C920-L941 HydrophobicContact CB-CD2 3.58Å; C920-L941 HydrophobicContact CB-CG 4.43Å; L925-L941 HydrophobicContact CD1-CD2 4.25Å; I928-L941 HydrophobicContact CD1-CD1 4.48Å; I928-L941 HydrophobicContact CG1-CD1 4.18Å; I928-L941 HydrophobicContact CG2-CD1 4.13Å; L939-L941 HydrophobicContact CD1-CD1 4.22Å; L939-L941 HydrophobicContact CD1-CG 4.19Å; L939-L941 HydrophobicContact CD2-CD1 3.86Å; L939-L941 HydrophobicContact CG-CD1 3.78Å; L939-L941 HydrophobicContact CG-CG 4.16Å; L941-N944 PolarHBondContact O-ND2 2.98Å; L941-I946 HydrophobicContact CB-CD1 4.11Å; L941-I946 HydrophobicContact CD2-CD1 4.05Å; L941-I946 HydrophobicContact CG-CD1 4.47Å; L941-L963 HydrophobicContact CD1-CD1 4.34Å; L941-V964 WeakPolarHBondContact CB-O 3.41Å; L941-V964 PolarHBondContact N-O 2.85Å; L941-L965 HydrophobicContact CB-CD2 3.72Å; L941-L965 HydrophobicContact CB-CG 4.34Å; L941-L965 HydrophobicContact CD1-CD2 3.92Å; L941-L965 HydrophobicContact CD1-CG 4.42Å; L941-L965 HydrophobicContact CG-CD2 4.46Å; L941-N968 PolarHBondContact O-ND2 3.25Å
942	E	88.1	Confident	87.8	Confident	29 Å²	29	49.3 Å²	49.3	14%	0.136	25%	0.248	C	C	.	.			trans	-65.9	157.9	-178.7	62.8	-73.5	166.8	0	0	114.5	S921 D922 N944 V964 S966	S921-E942 VanDerWaalsContact CA-O 3.27Å; S921-E942 WeakPolarHBondContact CA-O 3.39Å; S921-E942 WeakPolarHBondContact CB-O 3.42Å; S921-E942 VanDerWaalsContact CB-OE1 3.29Å; S921-E942 WeakPolarHBondContact CB-OE1 3.48Å; S921-E942 PolarHBondContact OG-OE1 3.21Å; D922-E942 PolarHBondContact N-O 3.17Å; E942-N944 PolarHBondContact O-N 3.17Å; E942-N944 PolarHBondContact O-ND2 3.21Å; E942-V964 HydrophobicContact CB-CG1 4.19Å; E942-V964 HydrophobicContact CG-CG1 4.42Å; E942-V964 WeakPolarHBondContact OE2-CG1 3.4Å; E942-S966 WeakPolarHBondContact CA-O 3.37Å; E942-S966 VanDerWaalsContact CB-O 3.31Å; E942-S966 WeakPolarHBondContact CB-O 3.35Å
943	R	90.4	Very high	88	Confident	128 Å²	128	51.7 Å²	51.7	48%	0.483	26%	0.257	S	S	.	.	S	Bend	trans	54.3	50.5	-178.6	-63.1	-177.6	-60.7	-100.5	-7.2	112.6	D922 S966 Y967	D922-R943 WeakPolarHBondContact CA-O 3.18Å; D922-R943 VanDerWaalsContact CG-NE 3.31Å; D922-R943 WeakPolarHBondContact OD1-CB 3.45Å; D922-R943 WeakPolarHBondContact OD1-CD 3.37Å; D922-R943 IonicContact OD1-CZ 3.59Å; D922-R943 IonicContact OD1-NE 2.94Å; D922-R943 PolarHBondContact OD1-NE 3.3Å; D922-R943 IonicContact OD1-NH2 2.73Å; D922-R943 IonicContact OD2-CZ 3.95Å; D922-R943 VanDerWaalsContact OD2-CZ 3.32Å; D922-R943 IonicContact OD2-NE 3.98Å; D922-R943 PolarHBondContact OD2-NE 2.86Å; D922-R943 VanDerWaalsContact OD2-NE 3.11Å; D922-R943 IonicContact OD2-NH2 3.4Å; D922-R943 PolarHBondContact OD2-NH2 3Å; R943-S966 PolarHBondContact N-O 2.8Å; R943-S966 VanDerWaalsContact N-O 3.09Å; R943-Y967 WeakPolarHBondContact CA-O 3.38Å; R943-Y967 HydrophobicContact CG-CD2 4.16Å; R943-Y967 HydrophobicContact CG-CG 4.12Å; R943-Y967 PolarHBondContact N-O 2.82Å
944	N	90.5	Very high	88.3	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.032	25%	0.248	C	C	.	.	S	Bend	trans	-124.4	-177.6	174.9	-79.5	-65.8	0	0	0	110.2	C920 R923 N924 L925 L941 E942 I946 Y967 N968	C920-N944 PolarHBondContact O-ND2 2.8Å; R923-N944 PolarHBondContact N-OD1 3.01Å; R923-N944 VanDerWaalsContact N-OD1 3.09Å; N924-N944 PolarHBondContact N-OD1 3.25Å; L925-N944 HydrophobicContact CB-CB 4.19Å; L925-N944 WeakPolarHBondContact CB-OD1 3.02Å; L925-N944 PolarHBondContact N-OD1 3.16Å; L941-N944 PolarHBondContact O-ND2 2.98Å; E942-N944 PolarHBondContact O-N 3.17Å; E942-N944 PolarHBondContact O-ND2 3.21Å; N944-I946 HydrophobicContact CB-CD1 4.32Å; N944-I946 HydrophobicContact CB-CG1 4.12Å; N944-Y967 PolarHBondContact N-O 3.18Å; N944-N968 WeakPolarHBondContact CA-OD1 3.5Å; N944-N968 WeakPolarHBondContact CB-OD1 3.22Å; N944-N968 PolarHBondContact O-OD1 2.7Å
945	Q	91.3	Very high	88.4	Confident	90 Å²	90	48.1 Å²	48.1	42%	0.421	23%	0.234	S	C	.	.			trans	-104.7	25.1	179.5	-56.8	-154.4	20.2	0	0	113.1	N924 L925 T926 T947	N924-Q945 WeakPolarHBondContact OD1-CG 3.33Å; N924-Q945 PolarHBondContact OD1-NE2 3.26Å; L925-Q945 CarbonylContact O-C 3.55Å; L925-Q945 VanDerWaalsContact O-CA 3.29Å; L925-Q945 WeakPolarHBondContact O-CA 3.5Å; L925-Q945 PolarHBondContact O-N 3.21Å; T926-Q945 HydrophobicContact CG2-CB 4.31Å; Q945-T947 PolarHBondContact O-N 3.39Å
946	I	91.7	Very high	88.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.			trans	-66.7	122.4	-173.1	-56.1	171.6	0	0	0	109.9	L925 T926 I928 L941 N944 K948 L965 N968 K969 L970	L925-I946 WeakPolarHBondContact O-CG1 3.45Å; L925-I946 PolarHBondContact O-N 2.93Å; L925-I946 VanDerWaalsContact O-N 3.15Å; T926-I946 WeakPolarHBondContact O-CA 3.15Å; I928-I946 HydrophobicContact CG1-CD1 4.18Å; I928-I946 HydrophobicContact CG1-CG2 4.35Å; L941-I946 HydrophobicContact CB-CD1 4.11Å; L941-I946 HydrophobicContact CD2-CD1 4.05Å; L941-I946 HydrophobicContact CG-CD1 4.47Å; N944-I946 HydrophobicContact CB-CD1 4.32Å; N944-I946 HydrophobicContact CB-CG1 4.12Å; I946-K948 WeakPolarHBondContact CG2-O 3.43Å; I946-L965 HydrophobicContact CD1-CD2 3.87Å; I946-N968 HydrophobicContact CB-CB 4.44Å; I946-N968 WeakPolarHBondContact CB-OD1 3.27Å; I946-N968 VanDerWaalsContact CG1-OD1 3.29Å; I946-N968 WeakPolarHBondContact CG1-OD1 3.48Å; I946-N968 PolarHBondContact N-OD1 3.13Å; I946-K969 CarbonylContact O-C 3.58Å; I946-K969 VanDerWaalsContact O-C 3.26Å; I946-K969 WeakPolarHBondContact O-CA 3.31Å; I946-K969 PolarHBondContact O-N 3.42Å; I946-L970 HydrophobicContact CG2-CD2 4.06Å; I946-L970 PolarHBondContact O-N 3.14Å
947	T	87.2	Confident	89	Confident	84 Å²	84	46.2 Å²	46.2	52%	0.515	23%	0.225	S	C	.	.			trans	-97.2	-25.5	-174.7	52	0	0	0	0	114.2	Q945 K969	Q945-T947 PolarHBondContact O-N 3.39Å; T947-K969 HydrophobicContact CG2-CB 4.18Å
948	K	85.1	Confident	88.8	Confident	146 Å²	146	51.8 Å²	51.8	64%	0.635	25%	0.248	S	C	*	.			trans	-147.8	153.1	177.5	65	-179.9	-178.4	178.6	0	111.6	I946	I946-K948 WeakPolarHBondContact CG2-O 3.43Å
949	I	90.4	Very high	88.9	Confident	11 Å²	11	53.7 Å²	53.7	6%	0.056	26%	0.255	C	S	.	.			trans	-94	107.2	170.9	-55	176.4	0	0	0	108.1	I928 S951 I954 L965 L970 L973 V977 F978 L989	I928-I949 HydrophobicContact CD1-CG2 4.01Å; I949-S951 PolarHBondContact O-N 3.33Å; I949-I954 HydrophobicContact CG2-CD1 3.7Å; I949-L965 HydrophobicContact CD1-CD1 3.69Å; I949-L965 HydrophobicContact CG1-CD1 4.07Å; I949-L970 HydrophobicContact CD1-CD1 4.05Å; I949-L970 HydrophobicContact CG1-CD1 4.09Å; I949-L970 HydrophobicContact CG1-CD2 3.91Å; I949-L973 HydrophobicContact CD1-CD2 4.02Å; I949-V977 HydrophobicContact CB-CG2 3.91Å; I949-V977 HydrophobicContact CG2-CG2 3.63Å; I949-F978 HydrophobicContact CD1-CE1 4.02Å; I949-F978 HydrophobicContact CD1-CZ 3.72Å; I949-F978 HydrophobicContact CG2-CE1 4.45Å; I949-L989 HydrophobicContact CD1-CD2 4.38Å
950	D	85.7	Confident	88.9	Confident	50 Å²	50	53.7 Å²	53.7	27%	0.267	26%	0.255	S	S	.	.			trans	-81	108	170.4	-179.6	0.7	0	0	0	109.5	N952 R953	D950-N952 PolarHBondContact O-N 2.86Å; D950-N952 VanDerWaalsContact O-N 3.16Å; D950-N952 WeakPolarHBondContact OD1-CB 3.42Å; D950-N952 PolarHBondContact OD1-N 3.34Å; D950-N952 PolarHBondContact OD1-ND2 3.28Å; D950-R953 HydrophobicContact CB-CG 4.13Å; D950-R953 PolarHBondContact O-N 3.02Å; D950-R953 VanDerWaalsContact O-N 3.09Å; D950-R953 IonicContact OD2-NE 2.59Å
951	S	83	Confident	89	Confident	45 Å²	45	54.4 Å²	54.4	32%	0.315	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.4	-25.6	-178	61.3	0	0	0	0	112.7	I949 R953 I954 A955	I949-S951 PolarHBondContact O-N 3.33Å; S951-R953 VanDerWaalsContact C-N 3.27Å; S951-R953 PolarHBondContact O-N 3.37Å; S951-I954 PolarHBondContact O-N 2.9Å; S951-A955 WeakPolarHBondContact O-CB 3.43Å; S951-A955 PolarHBondContact O-N 2.87Å
952	N	82.4	Confident	89.1	Confident	116 Å²	116	55.7 Å²	55.7	62%	0.62	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-67.1	-28.5	178.3	-57.4	-70.3	0	0	0	112.6	D950 I954	D950-N952 PolarHBondContact O-N 2.86Å; D950-N952 VanDerWaalsContact O-N 3.16Å; D950-N952 WeakPolarHBondContact OD1-CB 3.42Å; D950-N952 PolarHBondContact OD1-N 3.34Å; D950-N952 PolarHBondContact OD1-ND2 3.28Å; N952-I954 VanDerWaalsContact C-N 3.35Å
953	R	87.9	Confident	89.5	Confident	53 Å²	53	54.3 Å²	54.3	20%	0.2	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-82.2	-11.4	-179.4	-62.7	-172.8	178.2	-141.3	2.6	114.4	E927 I928 D950 S951 H956	E927-R953 VanDerWaalsContact CD-CZ 3.4Å; E927-R953 IonicContact OE1-CZ 3.75Å; E927-R953 IonicContact OE1-NH1 3.88Å; E927-R953 PolarHBondContact OE1-NH1 2.91Å; E927-R953 IonicContact OE1-NH2 3.6Å; E927-R953 PolarHBondContact OE1-NH2 3.06Å; E927-R953 IonicContact OE2-CZ 3.96Å; E927-R953 IonicContact OE2-NH1 3.73Å; E927-R953 IonicContact OE2-NH2 3.93Å; E927-R953 PolarHBondContact OE2-NH2 3.14Å; I928-R953 VanDerWaalsContact O-CD 3.24Å; I928-R953 WeakPolarHBondContact O-CD 3.36Å; I928-R953 PolarHBondContact O-NH1 3.1Å; D950-R953 HydrophobicContact CB-CG 4.13Å; D950-R953 PolarHBondContact O-N 3.02Å; D950-R953 VanDerWaalsContact O-N 3.09Å; D950-R953 IonicContact OD2-NE 2.59Å; S951-R953 VanDerWaalsContact C-N 3.27Å; S951-R953 PolarHBondContact O-N 3.37Å; R953-H956 PolarHBondContact O-CE1 3.35Å; R953-H956 VanDerWaalsContact O-CE1 3.23Å
954	I	89.3	Confident	89.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-15.3	177.5	60.6	178.9	0	0	0	112.8	I928 I949 S951 N952 H956 L957 F978 L981	I928-I954 HydrophobicContact CD1-CG2 4.03Å; I928-I954 HydrophobicContact CG2-CG2 4.13Å; I949-I954 HydrophobicContact CG2-CD1 3.7Å; S951-I954 PolarHBondContact O-N 2.9Å; N952-I954 VanDerWaalsContact C-N 3.35Å; I954-H956 PolarHBondContact O-N 3.12Å; I954-L957 HydrophobicContact CB-CD1 4.24Å; I954-L957 HydrophobicContact CG2-CD1 4.2Å; I954-L957 WeakPolarHBondContact O-CB 3.36Å; I954-L957 PolarHBondContact O-N 2.92Å; I954-F978 HydrophobicContact CD1-CD1 4.25Å; I954-F978 HydrophobicContact CD1-CE1 4.41Å; I954-L981 HydrophobicContact CB-CD1 4.23Å; I954-L981 HydrophobicContact CD1-CD1 3.86Å; I954-L981 HydrophobicContact CG1-CD1 4.09Å; I954-L981 WeakPolarHBondContact O-CD2 3.48Å
955	A	86.5	Confident	90	Very high	18 Å²	18	48.9 Å²	48.9	15%	0.149	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-22.2	-176.4	0	0	0	0	0	116.2	S951 K980	S951-A955 WeakPolarHBondContact O-CB 3.43Å; S951-A955 PolarHBondContact O-N 2.87Å; A955-K980 HydrophobicContact CB-CD 3.58Å
956	H	86.8	Confident	90.1	Very high	69 Å²	69	45 Å²	45	32%	0.319	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-15.3	178.4	65	-68.1	0	0	0	113.8	I932 R953 I954 K958	I932-H956 PolarHBondContact O-CD2 2.99Å; I932-H956 PolarHBondContact O-NE2 2.95Å; R953-H956 PolarHBondContact O-CE1 3.35Å; R953-H956 VanDerWaalsContact O-CE1 3.23Å; I954-H956 PolarHBondContact O-N 3.12Å; H956-K958 PolarHBondContact O-N 3.1Å
957	L	91.4	Very high	90.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.			trans	-77.1	48.9	-176.7	-54.3	179.3	0	0	0	112.5	I932 S933 L939 I954 K959 L960 L981	I932-L957 HydrophobicContact CB-CD1 4.47Å; I932-L957 HydrophobicContact CB-CD2 4.01Å; I932-L957 HydrophobicContact CD1-CD1 4.5Å; I932-L957 HydrophobicContact CG2-CD1 4.06Å; I932-L957 HydrophobicContact CG2-CD2 3.63Å; S933-L957 WeakPolarHBondContact O-CD2 3.47Å; L939-L957 HydrophobicContact CD2-CD1 3.92Å; I954-L957 HydrophobicContact CB-CD1 4.24Å; I954-L957 HydrophobicContact CG2-CD1 4.2Å; I954-L957 WeakPolarHBondContact O-CB 3.36Å; I954-L957 PolarHBondContact O-N 2.92Å; L957-K959 PolarHBondContact O-N 3.18Å; L957-L960 HydrophobicContact CB-CB 4.17Å; L957-L960 HydrophobicContact CD1-CD2 4.48Å; L957-L960 WeakPolarHBondContact O-CB 3.25Å; L957-L960 PolarHBondContact O-N 3.22Å; L957-L981 HydrophobicContact CB-CD2 4.11Å; L957-L981 WeakPolarHBondContact O-CD2 3.35Å
958	K	88	Confident	90.6	Very high	138 Å²	138	46.7 Å²	46.7	60%	0.6	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-15.7	-170.3	-64.2	-179.6	-177.8	178.5	0	114.3	H956 N983	H956-K958 PolarHBondContact O-N 3.1Å; K958-N983 PolarHBondContact O-ND2 2.98Å
959	K	90.8	Very high	90.9	Very high	92 Å²	92	45.5 Å²	45.5	40%	0.4	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3.8	176.3	-77.3	171.3	169.1	172.8	0	114.2	E935 T936 L957 Q961	E935-K959 IonicContact OE1-NZ 3.7Å; E935-K959 PolarHBondContact OE1-NZ 3.1Å; E935-K959 IonicContact OE2-NZ 3.11Å; E935-K959 PolarHBondContact OE2-NZ 2.81Å; T936-K959 CarbonylContact O-C 3.57Å; L957-K959 PolarHBondContact O-N 3.18Å; K959-Q961 WeakPolarHBondContact O-CG 3.17Å
960	L	94.6	Very high	91	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.			trans	-63.7	132.1	-176.9	-162.2	72.6	0	0	0	112.1	T936 L939 L957 L963 L981 N983 L984	T936-L960 HydrophobicContact CG2-CD1 4.06Å; T936-L960 WeakPolarHBondContact O-CA 3.46Å; T936-L960 PolarHBondContact O-N 2.82Å; L939-L960 HydrophobicContact CB-CD1 3.72Å; L939-L960 HydrophobicContact CB-CD2 4.48Å; L957-L960 HydrophobicContact CB-CB 4.17Å; L957-L960 HydrophobicContact CD1-CD2 4.48Å; L957-L960 WeakPolarHBondContact O-CB 3.25Å; L957-L960 PolarHBondContact O-N 3.22Å; L960-L963 HydrophobicContact CD2-CB 4.2Å; L960-L963 HydrophobicContact CD2-CD1 4.46Å; L960-L981 HydrophobicContact CB-CD2 4.45Å; L960-L981 HydrophobicContact CD2-CD1 4.3Å; L960-N983 CarbonylContact O-C 3.6Å; L960-N983 WeakPolarHBondContact O-CB 3.38Å; L960-L984 HydrophobicContact CB-CD2 4.45Å; L960-L984 HydrophobicContact CD2-CD2 4.07Å; L960-L984 HydrophobicContact CG-CD2 4.03Å; L960-L984 PolarHBondContact O-N 2.81Å
961	Q	95.5	Very high	91.2	Very high	67 Å²	67	50 Å²	50	31%	0.313	23%	0.231	S	C	.	.			trans	-120.4	-32.4	-177.6	-55.8	-178.3	39.2	0	0	111.9	T937 K959 K985 T986	T937-Q961 WeakPolarHBondContact O-CA 3.32Å; T937-Q961 PolarHBondContact O-N 2.79Å; K959-Q961 WeakPolarHBondContact O-CG 3.17Å; Q961-K985 HydrophobicContact CB-CD 4.33Å; Q961-K985 PolarHBondContact O-N 2.58Å; Q961-T986 PolarHBondContact O-N 3.23Å
962	T	95.3	Very high	91.5	Very high	26 Å²	26	49.4 Å²	49.4	16%	0.16	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.1	178.4	-59.4	0	0	0	0	110.2	T937 Q938 L939 V964 T986	T937-T962 PolarHBondContact O-N 2.88Å; T937-T962 VanDerWaalsContact O-N 3.12Å; Q938-T962 WeakPolarHBondContact CA-O 3.26Å; L939-T962 PolarHBondContact N-O 3.08Å; T962-V964 HydrophobicContact CG2-CG2 4.07Å; T962-T986 WeakPolarHBondContact CA-O 3.43Å; T962-T986 HydrophobicContact CG2-CG2 4.21Å
963	L	96.1	Very high	91.9	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120.9	172.4	178.5	60.1	0	0	0	110.1	L939 L941 L960 L965 F978 L984 T986 I987 V988	L939-L963 HydrophobicContact CB-CD1 4.08Å; L939-L963 HydrophobicContact CD2-CD1 3.98Å; L939-L963 HydrophobicContact CG-CD1 4.04Å; L941-L963 HydrophobicContact CD1-CD1 4.34Å; L960-L963 HydrophobicContact CD2-CB 4.2Å; L960-L963 HydrophobicContact CD2-CD1 4.46Å; L963-L965 HydrophobicContact CD1-CD1 4.18Å; L963-L965 HydrophobicContact CD1-CG 4.32Å; L963-L965 HydrophobicContact CD2-CD1 4.01Å; L963-L965 HydrophobicContact CG-CD1 4.05Å; L963-L965 HydrophobicContact CG-CG 4.45Å; L963-F978 HydrophobicContact CD2-CD1 4.3Å; L963-F978 HydrophobicContact CD2-CE1 3.74Å; L963-L984 HydrophobicContact CB-CD2 4.09Å; L963-T986 PolarHBondContact N-O 3.49Å; L963-I987 WeakPolarHBondContact O-CA 3.43Å; L963-V988 PolarHBondContact O-N 3.39Å
964	V	96.6	Very high	91.8	Very high	18 Å²	18	43.3 Å²	43.3	11%	0.109	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	122.4	178.5	-174.5	0	0	0	0	109.7	L939 Y940 L941 E942 T962 V988	L939-V964 PolarHBondContact O-N 2.84Å; Y940-V964 HydrophobicContact CD1-CB 3.96Å; Y940-V964 HydrophobicContact CD1-CG2 3.74Å; Y940-V964 HydrophobicContact CE1-CB 4.49Å; Y940-V964 HydrophobicContact CE1-CG2 3.77Å; L941-V964 WeakPolarHBondContact CB-O 3.41Å; L941-V964 PolarHBondContact N-O 2.85Å; E942-V964 HydrophobicContact CB-CG1 4.19Å; E942-V964 HydrophobicContact CG-CG1 4.42Å; E942-V964 WeakPolarHBondContact OE2-CG1 3.4Å; T962-V964 HydrophobicContact CG2-CG2 4.07Å; V964-V988 HydrophobicContact CG1-CB 4.18Å; V964-V988 HydrophobicContact CG2-CB 4.31Å; V964-V988 HydrophobicContact CG2-CG2 4.13Å
965	L	94.9	Very high	91.5	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	21%	0.213	C	C	.	.			trans	-134.4	27.2	-176	-86.8	164.7	0	0	0	111.4	L941 I946 I949 L963 N968 L970 V988 L989 N992	L941-L965 HydrophobicContact CB-CD2 3.72Å; L941-L965 HydrophobicContact CB-CG 4.34Å; L941-L965 HydrophobicContact CD1-CD2 3.92Å; L941-L965 HydrophobicContact CD1-CG 4.42Å; L941-L965 HydrophobicContact CG-CD2 4.46Å; I946-L965 HydrophobicContact CD1-CD2 3.87Å; I949-L965 HydrophobicContact CD1-CD1 3.69Å; I949-L965 HydrophobicContact CG1-CD1 4.07Å; L963-L965 HydrophobicContact CD1-CD1 4.18Å; L963-L965 HydrophobicContact CD1-CG 4.32Å; L963-L965 HydrophobicContact CD2-CD1 4.01Å; L963-L965 HydrophobicContact CG-CD1 4.05Å; L963-L965 HydrophobicContact CG-CG 4.45Å; L965-N968 PolarHBondContact O-ND2 2.7Å; L965-L970 HydrophobicContact CB-CD1 4.37Å; L965-V988 PolarHBondContact N-O 2.89Å; L965-L989 HydrophobicContact CB-CD2 3.74Å; L965-L989 HydrophobicContact CD1-CD2 4.2Å; L965-N992 PolarHBondContact O-ND2 3.28Å
966	S	93.7	Very high	91.7	Very high	8 Å²	8	49.8 Å²	49.8	6%	0.056	22%	0.224	C	C	.	.			trans	-70.6	160.1	-176.2	-57.1	0	0	0	0	112.5	E942 R943 N968 V988 S990	E942-S966 WeakPolarHBondContact CA-O 3.37Å; E942-S966 VanDerWaalsContact CB-O 3.31Å; E942-S966 WeakPolarHBondContact CB-O 3.35Å; R943-S966 PolarHBondContact N-O 2.8Å; R943-S966 VanDerWaalsContact N-O 3.09Å; S966-N968 VanDerWaalsContact C-N 3.29Å; S966-N968 PolarHBondContact O-N 3.32Å; S966-N968 PolarHBondContact O-ND2 2.71Å; S966-V988 VanDerWaalsContact OG-CG1 3.29Å; S966-V988 WeakPolarHBondContact OG-CG1 3.37Å; S966-S990 CarbonylContact C-O 3.57Å; S966-S990 WeakPolarHBondContact CA-O 3.25Å; S966-S990 WeakPolarHBondContact CB-O 3.36Å; S966-S990 PolarHBondContact OG-OG 2.92Å
967	Y	94.5	Very high	91.9	Very high	117 Å²	117	46.8 Å²	46.8	46%	0.459	21%	0.211	S	C	.	.	S	Bend	trans	52.9	45	178.8	-59.6	-77.8	0	0	0	113.2	R943 N944 S990 Y991	R943-Y967 WeakPolarHBondContact CA-O 3.38Å; R943-Y967 HydrophobicContact CG-CD2 4.16Å; R943-Y967 HydrophobicContact CG-CG 4.12Å; R943-Y967 PolarHBondContact N-O 2.82Å; N944-Y967 PolarHBondContact N-O 3.18Å; Y967-S990 PolarHBondContact N-O 2.97Å; Y967-Y991 VanDerWaalsContact CA-O 3.22Å; Y967-Y991 WeakPolarHBondContact CA-O 3.46Å; Y967-Y991 VanDerWaalsContact CD1-CB 3.5Å; Y967-Y991 HydrophobicContact CD1-CD2 4.35Å; Y967-Y991 HydrophobicContact CD1-CG 4.12Å; Y967-Y991 HydrophobicContact CE1-CD1 4.42Å; Y967-Y991 AromaticContact CE1-CD2 3.6Å; Y967-Y991 HydrophobicContact CE1-CD2 3.6Å; Y967-Y991 HydrophobicContact CE1-CE2 4.43Å; Y967-Y991 AromaticContact CE1-CG 3.58Å; Y967-Y991 HydrophobicContact CE1-CG 3.58Å; Y967-Y991 AromaticContact CE2-CD2 3.92Å; Y967-Y991 HydrophobicContact CE2-CD2 3.92Å; Y967-Y991 AromaticContact CZ-CD2 3.35Å; Y967-Y991 AromaticContact CZ-CE2 3.97Å; Y967-Y991 AromaticContact CZ-CG 3.88Å; Y967-Y991 PolarHBondContact N-O 3.28Å; Y967-Y991 WeakPolarHBondContact OH-CD2 3.48Å; Y967-Y991 WeakPolarHBondContact OH-CE2 3.38Å
968	N	93.3	Very high	92	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	21%	0.211	C	C	.	.	S	Bend	trans	-117.3	-170.8	176.3	-88	-88.2	0	0	0	110.3	L941 N944 I946 L965 S966 L970 N992	L941-N968 PolarHBondContact O-ND2 3.25Å; N944-N968 WeakPolarHBondContact CA-OD1 3.5Å; N944-N968 WeakPolarHBondContact CB-OD1 3.22Å; N944-N968 PolarHBondContact O-OD1 2.7Å; I946-N968 HydrophobicContact CB-CB 4.44Å; I946-N968 WeakPolarHBondContact CB-OD1 3.27Å; I946-N968 VanDerWaalsContact CG1-OD1 3.29Å; I946-N968 WeakPolarHBondContact CG1-OD1 3.48Å; I946-N968 PolarHBondContact N-OD1 3.13Å; L965-N968 PolarHBondContact O-ND2 2.7Å; S966-N968 VanDerWaalsContact C-N 3.29Å; S966-N968 PolarHBondContact O-N 3.32Å; S966-N968 PolarHBondContact O-ND2 2.71Å; N968-L970 HydrophobicContact CB-CG 4.45Å; N968-N992 WeakPolarHBondContact CA-OD1 3.25Å; N968-N992 WeakPolarHBondContact CB-OD1 3.45Å; N968-N992 PolarHBondContact O-OD1 2.78Å
969	K	92.7	Very high	92	Very high	120 Å²	120	43.8 Å²	43.8	52%	0.522	20%	0.199	S	C	.	.			trans	-113.2	23.7	-176.2	-53.6	-58.7	176.5	-169	0	112.7	I946 T947 N992	I946-K969 CarbonylContact O-C 3.58Å; I946-K969 VanDerWaalsContact O-C 3.26Å; I946-K969 WeakPolarHBondContact O-CA 3.31Å; I946-K969 PolarHBondContact O-N 3.42Å; T947-K969 HydrophobicContact CG2-CB 4.18Å; K969-N992 PolarHBondContact N-OD1 2.95Å
970	L	93	Very high	91.8	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.205	C	C	.	.			trans	-61.5	140.1	178.2	-57.6	175.5	0	0	0	110.7	I946 I949 L965 N968 L989 N992 N993 L994	I946-L970 HydrophobicContact CG2-CD2 4.06Å; I946-L970 PolarHBondContact O-N 3.14Å; I949-L970 HydrophobicContact CD1-CD1 4.05Å; I949-L970 HydrophobicContact CG1-CD1 4.09Å; I949-L970 HydrophobicContact CG1-CD2 3.91Å; L965-L970 HydrophobicContact CB-CD1 4.37Å; N968-L970 HydrophobicContact CB-CG 4.45Å; L970-L989 HydrophobicContact CD1-CD2 3.67Å; L970-N992 HydrophobicContact CB-CB 4.24Å; L970-N992 VanDerWaalsContact CB-OD1 3.27Å; L970-N992 WeakPolarHBondContact CB-OD1 3.41Å; L970-N992 VanDerWaalsContact CG-OD1 3.28Å; L970-N992 WeakPolarHBondContact CG-OD1 3.28Å; L970-N992 PolarHBondContact N-OD1 3.1Å; L970-N992 VanDerWaalsContact N-OD1 3.1Å; L970-N993 CarbonylContact O-C 3.08Å; L970-N993 WeakPolarHBondContact O-CA 3.3Å; L970-N993 PolarHBondContact O-N 3.3Å; L970-L994 HydrophobicContact CB-CD2 3.76Å; L970-L994 HydrophobicContact CB-CG 4.46Å; L970-L994 PolarHBondContact O-N 2.83Å
971	R	88.9	Confident	91.7	Very high	155 Å²	155	45.3 Å²	45.3	59%	0.585	21%	0.206	S	C	*	.			trans	-117.7	-30.5	180	-57.8	-173.4	-176.2	-175.4	0.1	115.2	N993 L994 Q995 L1172	R971-N993 WeakPolarHBondContact CA-O 3.49Å; R971-L994 CarbonylContact O-C 3.24Å; R971-L994 WeakPolarHBondContact O-CA 3.49Å; R971-Q995 PolarHBondContact O-N 2.79Å; R971-L1172 HydrophobicContact CB-CD1 3.57Å; R971-L1172 WeakPolarHBondContact O-CD1 3.14Å
972	E	88.7	Confident	91.3	Very high	33 Å²	33	44.2 Å²	44.2	15%	0.154	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.8	177.7	56.6	178.1	-95.6	0	0	111.9	C996 T1170 Q1171 L1172	E972-C996 CarbonylContact C-O 3.55Å; E972-C996 VanDerWaalsContact CA-O 3.29Å; E972-C996 WeakPolarHBondContact CA-O 3.38Å; E972-C996 HydrophobicContact CB-CB 4.33Å; E972-T1170 WeakPolarHBondContact OE1-CB 3.46Å; E972-T1170 WeakPolarHBondContact OE2-CB 3.41Å; E972-T1170 PolarHBondContact OE2-OG1 3.34Å; E972-Q1171 PolarHBondContact OE1-N 2.93Å; E972-Q1171 PolarHBondContact OE2-N 3.42Å; E972-Q1171 VanDerWaalsContact OE2-N 3.12Å; E972-L1172 HydrophobicContact CB-CD1 3.88Å; E972-L1172 HydrophobicContact CB-CG 4.45Å; E972-L1172 HydrophobicContact CG-CD1 4.29Å; E972-L1172 WeakPolarHBondContact OE2-CB 3.36Å; E972-L1172 PolarHBondContact OE2-N 3.07Å
973	L	91.3	Very high	91.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	107.2	165.6	-61.2	-179.3	0	0	0	109.6	I949 L989 L994 C996 I997 H998 A1001 F1002	I949-L973 HydrophobicContact CD1-CD2 4.02Å; L973-L989 HydrophobicContact CD1-CD1 3.86Å; L973-L989 HydrophobicContact CD2-CD1 4.15Å; L973-L994 HydrophobicContact CD1-CD1 4.28Å; L973-L994 HydrophobicContact CD2-CD1 4.42Å; L973-L994 HydrophobicContact CD2-CD2 4.11Å; L973-L994 HydrophobicContact CG-CD1 4.22Å; L973-L994 HydrophobicContact CG-CD2 4.07Å; L973-C996 PolarHBondContact N-O 3.16Å; L973-I997 HydrophobicContact CB-CG1 4.43Å; L973-I997 HydrophobicContact CB-CG2 4.34Å; L973-I997 HydrophobicContact CD1-CD1 4.08Å; L973-I997 HydrophobicContact CD1-CG1 3.99Å; L973-I997 HydrophobicContact CD1-CG2 4.21Å; L973-I997 HydrophobicContact CG-CG1 4.32Å; L973-H998 PolarHBondContact O-N 3.17Å; L973-H998 VanDerWaalsContact O-N 3.12Å; L973-A1001 HydrophobicContact CB-CB 3.98Å; L973-F1002 HydrophobicContact CD1-CE1 4.08Å; L973-F1002 HydrophobicContact CD1-CE2 4.47Å; L973-F1002 HydrophobicContact CD1-CZ 3.64Å
974	P	85.2	Confident	91.2	Very high	41 Å²	41	46.8 Å²	46.8	27%	0.266	22%	0.221	S	C	.	.			trans	-74	164.3	-178.2	28.1	-31.7	0	0	0	112.5	R976 V977	P974-R976 PolarHBondContact O-N 2.87Å; P974-V977 HydrophobicContact CG-CB 4.12Å; P974-V977 HydrophobicContact CG-CG2 4.2Å
975	P	84.8	Confident	91.1	Very high	54 Å²	54	49.7 Å²	49.7	35%	0.351	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	137.2	173.8	12.9	-27.8	0	0	0	113	V977 H998 E1000	P975-V977 PolarHBondContact O-N 3.14Å; P975-H998 WeakPolarHBondContact CB-ND1 3.09Å; P975-E1000 HydrophobicContact CB-CB 4.38Å
976	R	89.1	Confident	91	Very high	100 Å²	100	51.3 Å²	51.3	38%	0.377	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	17.5	164.1	-55.8	175.8	-171.8	-130.9	1.2	115.1	P974 F978 E979 E1000 H1003	P974-R976 PolarHBondContact O-N 2.87Å; R976-F978 PolarHBondContact O-N 3.03Å; R976-E979 HydrophobicContact CB-CB 3.87Å; R976-E979 HydrophobicContact CB-CG 4.48Å; R976-E979 WeakPolarHBondContact CD-OE1 3.42Å; R976-E979 IonicContact NH1-OE1 3.94Å; R976-E979 PolarHBondContact NH1-OE1 2.84Å; R976-E979 VanDerWaalsContact O-CB 3.23Å; R976-E979 WeakPolarHBondContact O-CB 3.46Å; R976-E979 PolarHBondContact O-N 3.14Å; R976-E1000 HydrophobicContact CG-CB 4.27Å; R976-E1000 IonicContact CZ-OE1 3.89Å; R976-E1000 IonicContact CZ-OE2 3.03Å; R976-E1000 PolarHBondContact N-O 3.34Å; R976-E1000 IonicContact NE-OE1 2.87Å; R976-E1000 IonicContact NE-OE2 3.42Å; R976-E1000 PolarHBondContact NE-OE2 2.88Å; R976-E1000 VanDerWaalsContact NH2-CD 3.29Å; R976-E1000 IonicContact NH2-OE1 3.8Å; R976-E1000 PolarHBondContact NH2-OE1 2.78Å; R976-E1000 IonicContact NH2-OE2 2.97Å; R976-E1000 PolarHBondContact NH2-OE2 3.26Å; R976-H1003 HydrophobicContact CG-CB 4.2Å
977	V	91.5	Very high	91.1	Very high	7 Å²	7	51 Å²	51	4%	0.042	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-26.2	-174.8	67.6	0	0	0	0	113.3	I949 P974 P975	I949-V977 HydrophobicContact CB-CG2 3.91Å; I949-V977 HydrophobicContact CG2-CG2 3.63Å; P974-V977 HydrophobicContact CG-CB 4.12Å; P974-V977 HydrophobicContact CG-CG2 4.2Å; P975-V977 PolarHBondContact O-N 3.14Å
978	F	94.4	Very high	91.2	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	4	176.3	-52.1	-60.3	0	0	0	114.8	I949 I954 L963 R976 K980 L981 L984 I987 F1002 L1005	I949-F978 HydrophobicContact CD1-CE1 4.02Å; I949-F978 HydrophobicContact CD1-CZ 3.72Å; I949-F978 HydrophobicContact CG2-CE1 4.45Å; I954-F978 HydrophobicContact CD1-CD1 4.25Å; I954-F978 HydrophobicContact CD1-CE1 4.41Å; L963-F978 HydrophobicContact CD2-CD1 4.3Å; L963-F978 HydrophobicContact CD2-CE1 3.74Å; R976-F978 PolarHBondContact O-N 3.03Å; F978-K980 PolarHBondContact O-N 2.67Å; F978-K980 VanDerWaalsContact O-N 3.09Å; F978-L981 HydrophobicContact CD1-CD1 4.45Å; F978-L981 WeakPolarHBondContact O-CA 3.25Å; F978-L981 WeakPolarHBondContact O-CB 3.22Å; F978-L981 PolarHBondContact O-N 3.02Å; F978-L984 HydrophobicContact CB-CD1 4.32Å; F978-L984 HydrophobicContact CD1-CD1 4.45Å; F978-I987 HydrophobicContact CD2-CD1 4.06Å; F978-I987 HydrophobicContact CE2-CD1 4.21Å; F978-I987 HydrophobicContact CG-CD1 4.33Å; F978-F1002 AromaticContact CD2-CD1 3.97Å; F978-F1002 HydrophobicContact CD2-CD1 3.97Å; F978-F1002 HydrophobicContact CD2-CE1 4.27Å; F978-F1002 HydrophobicContact CE2-CD1 4.11Å; F978-F1002 AromaticContact CE2-CE1 3.94Å; F978-F1002 HydrophobicContact CE2-CE1 3.94Å; F978-L1005 HydrophobicContact CB-CD1 3.85Å; F978-L1005 HydrophobicContact CB-CD2 4.1Å; F978-L1005 HydrophobicContact CB-CG 4.3Å; F978-L1005 HydrophobicContact CD2-CD1 4.29Å; F978-L1005 HydrophobicContact CG-CD1 4.39Å
979	E	87.8	Confident	91.3	Very high	74 Å²	74	46.4 Å²	46.4	35%	0.346	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-36	-171.6	178.8	-174.3	-126.5	0	0	113.2	R976 L981 H1003	R976-E979 HydrophobicContact CB-CB 3.87Å; R976-E979 HydrophobicContact CB-CG 4.48Å; R976-E979 WeakPolarHBondContact CD-OE1 3.42Å; R976-E979 IonicContact NH1-OE1 3.94Å; R976-E979 PolarHBondContact NH1-OE1 2.84Å; R976-E979 VanDerWaalsContact O-CB 3.23Å; R976-E979 WeakPolarHBondContact O-CB 3.46Å; R976-E979 PolarHBondContact O-N 3.14Å; E979-L981 PolarHBondContact O-N 3.27Å; E979-H1003 IonicContact OE1-CD2 2.85Å
980	K	85.7	Confident	91.3	Very high	122 Å²	122	41.4 Å²	41.4	53%	0.53	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-3.5	179.2	-64.1	175	-176.3	169.8	0	114.1	A955 F978	A955-K980 HydrophobicContact CB-CD 3.58Å; F978-K980 PolarHBondContact O-N 2.67Å; F978-K980 VanDerWaalsContact O-N 3.09Å
981	L	93.1	Very high	91.4	Very high	1 Å²	1	45 Å²	45	1%	0.005	22%	0.218	C	C	.	.			trans	-112.4	44.2	-172.9	-60.8	177	0	0	0	112.6	I954 L957 L960 F978 E979 N983 L984	I954-L981 HydrophobicContact CB-CD1 4.23Å; I954-L981 HydrophobicContact CD1-CD1 3.86Å; I954-L981 HydrophobicContact CG1-CD1 4.09Å; I954-L981 WeakPolarHBondContact O-CD2 3.48Å; L957-L981 HydrophobicContact CB-CD2 4.11Å; L957-L981 WeakPolarHBondContact O-CD2 3.35Å; L960-L981 HydrophobicContact CB-CD2 4.45Å; L960-L981 HydrophobicContact CD2-CD1 4.3Å; F978-L981 HydrophobicContact CD1-CD1 4.45Å; F978-L981 WeakPolarHBondContact O-CA 3.25Å; F978-L981 WeakPolarHBondContact O-CB 3.22Å; F978-L981 PolarHBondContact O-N 3.02Å; E979-L981 PolarHBondContact O-N 3.27Å; L981-N983 PolarHBondContact O-N 3.28Å; L981-L984 HydrophobicContact CB-CD1 3.56Å; L981-L984 HydrophobicContact CB-CG 3.95Å; L981-L984 HydrophobicContact CD1-CD1 3.98Å; L981-L984 HydrophobicContact CG-CD1 4.43Å; L981-L984 WeakPolarHBondContact O-CB 3.34Å; L981-L984 WeakPolarHBondContact O-CG 3.44Å; L981-L984 PolarHBondContact O-N 2.92Å
982	A	86.5	Confident	91.6	Very high	45 Å²	45	38.3 Å²	38.3	37%	0.372	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-6.1	-174.7	0	0	0	0	0	116.6	N1007	A982-N1007 PolarHBondContact O-ND2 2.87Å
983	N	92.4	Very high	91.8	Very high	81 Å²	81	39.6 Å²	39.6	43%	0.433	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.6	173.3	-77.7	-51.5	0	0	0	114.1	K958 L960 L981 K985	K958-N983 PolarHBondContact O-ND2 2.98Å; L960-N983 CarbonylContact O-C 3.6Å; L960-N983 WeakPolarHBondContact O-CB 3.38Å; L981-N983 PolarHBondContact O-N 3.28Å; N983-K985 PolarHBondContact O-N 3.42Å
984	L	96.1	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.			trans	-59.6	132	178	-79.1	170.9	0	0	0	112	L960 L963 F978 L981 I987 L1005 N1007 L1008	L960-L984 HydrophobicContact CB-CD2 4.45Å; L960-L984 HydrophobicContact CD2-CD2 4.07Å; L960-L984 HydrophobicContact CG-CD2 4.03Å; L960-L984 PolarHBondContact O-N 2.81Å; L963-L984 HydrophobicContact CB-CD2 4.09Å; F978-L984 HydrophobicContact CB-CD1 4.32Å; F978-L984 HydrophobicContact CD1-CD1 4.45Å; L981-L984 HydrophobicContact CB-CD1 3.56Å; L981-L984 HydrophobicContact CB-CG 3.95Å; L981-L984 HydrophobicContact CD1-CD1 3.98Å; L981-L984 HydrophobicContact CG-CD1 4.43Å; L981-L984 WeakPolarHBondContact O-CB 3.34Å; L981-L984 WeakPolarHBondContact O-CG 3.44Å; L981-L984 PolarHBondContact O-N 2.92Å; L984-I987 HydrophobicContact CD1-CD1 4.02Å; L984-I987 HydrophobicContact CD1-CG1 4.2Å; L984-L1005 HydrophobicContact CB-CD2 4.38Å; L984-L1005 HydrophobicContact CD1-CD2 4.39Å; L984-N1007 CarbonylContact O-C 3.24Å; L984-L1008 HydrophobicContact CB-CD1 4.36Å; L984-L1008 WeakPolarHBondContact O-CA 3.42Å; L984-L1008 PolarHBondContact O-N 2.97Å
985	K	94.8	Very high	91.9	Very high	78 Å²	78	39.7 Å²	39.7	34%	0.339	20%	0.199	S	C	.	.			trans	-115.3	-30.9	177	-63.5	172.1	-172.5	169.9	0	111.5	Q961 N983 R1009 V1010	Q961-K985 HydrophobicContact CB-CD 4.33Å; Q961-K985 PolarHBondContact O-N 2.58Å; N983-K985 PolarHBondContact O-N 3.42Å; K985-R1009 PolarHBondContact O-N 2.85Å; K985-V1010 PolarHBondContact O-N 3.5Å
986	T	94.2	Very high	91.9	Very high	35 Å²	35	37.1 Å²	37.1	22%	0.215	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.7	-175.3	-60.5	0	0	0	0	110.6	Q961 T962 L963 V988 V1010	Q961-T986 PolarHBondContact O-N 3.23Å; T962-T986 WeakPolarHBondContact CA-O 3.43Å; T962-T986 HydrophobicContact CG2-CG2 4.21Å; L963-T986 PolarHBondContact N-O 3.49Å; T986-V988 HydrophobicContact CG2-CG2 3.82Å; T986-V1010 WeakPolarHBondContact CA-O 3.03Å; T986-V1010 HydrophobicContact CG2-CB 4.15Å; T986-V1010 HydrophobicContact CG2-CG1 4.35Å
987	I	95.9	Very high	92	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.3	170.2	-66.2	170.8	0	0	0	108.6	L963 F978 L984 L989 F1002 L1005 L1008 V1010 L1011 I1012	L963-I987 WeakPolarHBondContact O-CA 3.43Å; F978-I987 HydrophobicContact CD2-CD1 4.06Å; F978-I987 HydrophobicContact CE2-CD1 4.21Å; F978-I987 HydrophobicContact CG-CD1 4.33Å; L984-I987 HydrophobicContact CD1-CD1 4.02Å; L984-I987 HydrophobicContact CD1-CG1 4.2Å; I987-L989 HydrophobicContact CG2-CD1 3.57Å; I987-L989 HydrophobicContact CG2-CG 3.83Å; I987-F1002 HydrophobicContact CD1-CD1 4.42Å; I987-L1005 HydrophobicContact CD1-CD1 3.62Å; I987-L1008 HydrophobicContact CB-CD1 4.3Å; I987-L1008 HydrophobicContact CD1-CD1 3.77Å; I987-L1008 HydrophobicContact CD1-CD2 4.25Å; I987-L1008 HydrophobicContact CG1-CD1 3.74Å; I987-V1010 PolarHBondContact N-O 3.07Å; I987-L1011 HydrophobicContact CB-CD1 4.14Å; I987-L1011 HydrophobicContact CG2-CD1 4.07Å; I987-L1011 WeakPolarHBondContact O-CA 3.49Å; I987-I1012 PolarHBondContact O-N 3.14Å
988	V	96.6	Very high	91.7	Very high	26 Å²	26	34.3 Å²	34.3	16%	0.158	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	112.9	-179.1	-165.8	0	0	0	0	110.2	L963 V964 L965 S966 T986 I1012	L963-V988 PolarHBondContact O-N 3.39Å; V964-V988 HydrophobicContact CG1-CB 4.18Å; V964-V988 HydrophobicContact CG2-CB 4.31Å; V964-V988 HydrophobicContact CG2-CG2 4.13Å; L965-V988 PolarHBondContact N-O 2.89Å; S966-V988 VanDerWaalsContact OG-CG1 3.29Å; S966-V988 WeakPolarHBondContact OG-CG1 3.37Å; T986-V988 HydrophobicContact CG2-CG2 3.82Å; V988-I1012 HydrophobicContact CB-CB 4.46Å; V988-I1012 HydrophobicContact CG1-CB 3.87Å; V988-I1012 HydrophobicContact CG1-CG1 4.26Å; V988-I1012 HydrophobicContact CG1-CG2 4.11Å; V988-I1012 HydrophobicContact CG2-CG1 4.43Å
989	L	95.6	Very high	91.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.			trans	-127.5	20.9	-171.9	-72.8	164.1	0	0	0	112.3	I949 L965 L970 L973 I987 N992 L994 I1012 L1013 N1016	I949-L989 HydrophobicContact CD1-CD2 4.38Å; L965-L989 HydrophobicContact CB-CD2 3.74Å; L965-L989 HydrophobicContact CD1-CD2 4.2Å; L970-L989 HydrophobicContact CD1-CD2 3.67Å; L973-L989 HydrophobicContact CD1-CD1 3.86Å; L973-L989 HydrophobicContact CD2-CD1 4.15Å; I987-L989 HydrophobicContact CG2-CD1 3.57Å; I987-L989 HydrophobicContact CG2-CG 3.83Å; L989-N992 PolarHBondContact O-ND2 3.27Å; L989-L994 HydrophobicContact CB-CD1 4.15Å; L989-I1012 PolarHBondContact N-O 3.05Å; L989-L1013 HydrophobicContact CB-CD2 4Å; L989-L1013 HydrophobicContact CD1-CD2 4.13Å; L989-N1016 PolarHBondContact O-ND2 3.29Å
990	S	92.7	Very high	91.2	Very high	14 Å²	14	36.5 Å²	36.5	10%	0.098	19%	0.188	C	C	.	.			trans	-66	155.8	-178.3	32.1	0	0	0	0	113.3	S966 Y967 N992 Q1014	S966-S990 CarbonylContact C-O 3.57Å; S966-S990 WeakPolarHBondContact CA-O 3.25Å; S966-S990 WeakPolarHBondContact CB-O 3.36Å; S966-S990 PolarHBondContact OG-OG 2.92Å; Y967-S990 PolarHBondContact N-O 2.97Å; S990-N992 VanDerWaalsContact C-N 3.32Å; S990-N992 PolarHBondContact O-N 3.28Å; S990-N992 PolarHBondContact O-ND2 3.4Å; S990-Q1014 CarbonylContact C-O 3.56Å; S990-Q1014 WeakPolarHBondContact CA-O 3.49Å; S990-Q1014 WeakPolarHBondContact CB-O 3.41Å
991	Y	94.4	Very high	91.4	Very high	76 Å²	76	30.7 Å²	30.7	30%	0.298	16%	0.163	S	C	.	.	S	Bend	trans	54.2	46.1	177	-54.9	-66.6	0	0	0	113.5	Y967 Q1014 G1015 Q1039	Y967-Y991 VanDerWaalsContact CA-O 3.22Å; Y967-Y991 WeakPolarHBondContact CA-O 3.46Å; Y967-Y991 VanDerWaalsContact CD1-CB 3.5Å; Y967-Y991 HydrophobicContact CD1-CD2 4.35Å; Y967-Y991 HydrophobicContact CD1-CG 4.12Å; Y967-Y991 HydrophobicContact CE1-CD1 4.42Å; Y967-Y991 AromaticContact CE1-CD2 3.6Å; Y967-Y991 HydrophobicContact CE1-CD2 3.6Å; Y967-Y991 HydrophobicContact CE1-CE2 4.43Å; Y967-Y991 AromaticContact CE1-CG 3.58Å; Y967-Y991 HydrophobicContact CE1-CG 3.58Å; Y967-Y991 AromaticContact CE2-CD2 3.92Å; Y967-Y991 HydrophobicContact CE2-CD2 3.92Å; Y967-Y991 AromaticContact CZ-CD2 3.35Å; Y967-Y991 AromaticContact CZ-CE2 3.97Å; Y967-Y991 AromaticContact CZ-CG 3.88Å; Y967-Y991 PolarHBondContact N-O 3.28Å; Y967-Y991 WeakPolarHBondContact OH-CD2 3.48Å; Y967-Y991 WeakPolarHBondContact OH-CE2 3.38Å; Y991-Q1014 PolarHBondContact N-O 2.99Å; Y991-Q1014 VanDerWaalsContact N-O 3.07Å; Y991-Q1014 PolarHBondContact OH-NE2 2.82Å; Y991-G1015 WeakPolarHBondContact CA-O 3.35Å; Y991-G1015 PolarHBondContact N-O 2.79Å; Y991-Q1039 PolarHBondContact OH-OE1 2.88Å
992	N	93.2	Very high	91.5	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.08	16%	0.163	C	C	.	.	S	Bend	trans	-110	-171.6	167.1	-84.5	-93.7	0	0	0	109	L965 N968 K969 L970 L989 S990 L994 N1016	L965-N992 PolarHBondContact O-ND2 3.28Å; N968-N992 WeakPolarHBondContact CA-OD1 3.25Å; N968-N992 WeakPolarHBondContact CB-OD1 3.45Å; N968-N992 PolarHBondContact O-OD1 2.78Å; K969-N992 PolarHBondContact N-OD1 2.95Å; L970-N992 HydrophobicContact CB-CB 4.24Å; L970-N992 VanDerWaalsContact CB-OD1 3.27Å; L970-N992 WeakPolarHBondContact CB-OD1 3.41Å; L970-N992 VanDerWaalsContact CG-OD1 3.28Å; L970-N992 WeakPolarHBondContact CG-OD1 3.28Å; L970-N992 PolarHBondContact N-OD1 3.1Å; L970-N992 VanDerWaalsContact N-OD1 3.1Å; L989-N992 PolarHBondContact O-ND2 3.27Å; S990-N992 VanDerWaalsContact C-N 3.32Å; S990-N992 PolarHBondContact O-N 3.28Å; S990-N992 PolarHBondContact O-ND2 3.4Å; N992-L994 HydrophobicContact CB-CG 4.12Å; N992-N1016 WeakPolarHBondContact CA-OD1 3.47Å; N992-N1016 WeakPolarHBondContact CB-OD1 3.43Å; N992-N1016 PolarHBondContact N-OD1 3.4Å; N992-N1016 PolarHBondContact O-OD1 3.19Å
993	N	91.6	Very high	91.6	Very high	60 Å²	60	31.6 Å²	31.6	32%	0.321	16%	0.159	S	C	.	.			trans	-110	37.8	172.1	-169.7	3.4	0	0	0	110.3	L970 R971 Q995 N1017	L970-N993 CarbonylContact O-C 3.08Å; L970-N993 WeakPolarHBondContact O-CA 3.3Å; L970-N993 PolarHBondContact O-N 3.3Å; R971-N993 WeakPolarHBondContact CA-O 3.49Å; N993-Q995 PolarHBondContact O-N 3.41Å; N993-Q995 VanDerWaalsContact O-N 3.12Å; N993-Q995 PolarHBondContact OD1-NE2 2.96Å; N993-N1017 WeakPolarHBondContact OD1-CB 3.49Å; N993-N1017 PolarHBondContact OD1-ND2 3.03Å
994	L	93.1	Very high	91.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.			trans	-63.5	116.9	-179.3	-66.4	176.2	0	0	0	109.3	L970 R971 L973 L989 N992 L1013 N1016 N1017 I1018	L970-L994 HydrophobicContact CB-CD2 3.76Å; L970-L994 HydrophobicContact CB-CG 4.46Å; L970-L994 PolarHBondContact O-N 2.83Å; R971-L994 CarbonylContact O-C 3.24Å; R971-L994 WeakPolarHBondContact O-CA 3.49Å; L973-L994 HydrophobicContact CD1-CD1 4.28Å; L973-L994 HydrophobicContact CD2-CD1 4.42Å; L973-L994 HydrophobicContact CD2-CD2 4.11Å; L973-L994 HydrophobicContact CG-CD1 4.22Å; L973-L994 HydrophobicContact CG-CD2 4.07Å; L989-L994 HydrophobicContact CB-CD1 4.15Å; N992-L994 HydrophobicContact CB-CG 4.12Å; L994-L1013 HydrophobicContact CD1-CD2 3.98Å; L994-N1016 HydrophobicContact CB-CB 4.16Å; L994-N1016 VanDerWaalsContact CB-OD1 3.26Å; L994-N1016 WeakPolarHBondContact CB-OD1 3.1Å; L994-N1016 WeakPolarHBondContact CG-OD1 3.35Å; L994-N1016 PolarHBondContact N-OD1 3.23Å; L994-N1017 CarbonylContact O-C 3.53Å; L994-N1017 VanDerWaalsContact O-CA 3.31Å; L994-N1017 WeakPolarHBondContact O-CA 3.25Å; L994-N1017 PolarHBondContact O-N 3.32Å; L994-I1018 HydrophobicContact CB-CG1 4.32Å; L994-I1018 VanDerWaalsContact O-CG1 3.3Å; L994-I1018 WeakPolarHBondContact O-CG1 3.12Å; L994-I1018 PolarHBondContact O-N 3.09Å; L994-I1018 VanDerWaalsContact O-N 3.08Å
995	Q	86.6	Confident	91.1	Very high	43 Å²	43	29.2 Å²	29.2	20%	0.201	15%	0.154	C	C	.	.			trans	-103.1	-30.1	176	-70	167.6	35.5	0	0	111.1	R971 N993 N1017 L1172	R971-Q995 PolarHBondContact O-N 2.79Å; N993-Q995 PolarHBondContact O-N 3.41Å; N993-Q995 VanDerWaalsContact O-N 3.12Å; N993-Q995 PolarHBondContact OD1-NE2 2.96Å; Q995-N1017 HydrophobicContact CG-CB 3.68Å; Q995-N1017 PolarHBondContact NE2-ND2 3.3Å; Q995-L1172 HydrophobicContact CB-CD1 4.47Å; Q995-L1172 HydrophobicContact CB-CD2 4.13Å
996	C	84.5	Confident	90.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138	-171.8	-75.1	0	0	0	0	113.2	E972 L973 K1151 C1152	E972-C996 CarbonylContact C-O 3.55Å; E972-C996 VanDerWaalsContact CA-O 3.29Å; E972-C996 WeakPolarHBondContact CA-O 3.38Å; E972-C996 HydrophobicContact CB-CB 4.33Å; L973-C996 PolarHBondContact N-O 3.16Å; C996-K1151 PolarHBondContact SG-O 2.89Å; C996-C1152 VanDerWaalsContact CA-SG 3.53Å; C996-C1152 HydrophobicContact CB-CB 3.77Å; C996-C1152 WeakPolarHBondContact CB-SG 3.15Å; C996-C1152 WeakPolarHBondContact SG-CA 3.47Å; C996-C1152 WeakPolarHBondContact SG-CB 3.25Å; C996-C1152 PolarHBondContact SG-N 3.03Å; C996-C1152 VanDerWaalsContact SG-N 3.35Å; C996-C1152 CovalentContact SG-SG 2.04Å; C996-C1152 PolarHBondContact SG-SG 3.42Å
997	I	90.3	Very high	90.5	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	118.4	175.5	-58.8	-177.9	0	0	0	107.2	L973 A1001 F1002 L1013 I1018 T1025	L973-I997 HydrophobicContact CB-CG1 4.43Å; L973-I997 HydrophobicContact CB-CG2 4.34Å; L973-I997 HydrophobicContact CD1-CD1 4.08Å; L973-I997 HydrophobicContact CD1-CG1 3.99Å; L973-I997 HydrophobicContact CD1-CG2 4.21Å; L973-I997 HydrophobicContact CG-CG1 4.32Å; I997-A1001 HydrophobicContact CG2-CB 3.76Å; I997-F1002 HydrophobicContact CG2-CE2 3.81Å; I997-F1002 HydrophobicContact CG2-CZ 4.4Å; I997-L1013 HydrophobicContact CD1-CD1 3.9Å; I997-L1013 HydrophobicContact CD1-CD2 4Å; I997-I1018 HydrophobicContact CD1-CD1 3.72Å; I997-I1018 HydrophobicContact CD1-CG1 4.48Å; I997-T1025 HydrophobicContact CG2-CG2 3.7Å
998	H	87.1	Confident	90.4	Very high	47 Å²	47	29.4 Å²	29.4	22%	0.218	16%	0.162	C	C	.	.			trans	-65.1	147.6	178.9	-167.7	-112.2	0	0	0	111.8	L973 P975 E1000 A1001 Q1171	L973-H998 PolarHBondContact O-N 3.17Å; L973-H998 VanDerWaalsContact O-N 3.12Å; P975-H998 WeakPolarHBondContact CB-ND1 3.09Å; H998-E1000 PolarHBondContact ND1-N 2.89Å; H998-E1000 PolarHBondContact O-N 3.2Å; H998-E1000 VanDerWaalsContact O-N 3.09Å; H998-A1001 HydrophobicContact CB-CB 4.29Å; H998-A1001 VanDerWaalsContact O-CB 3.26Å; H998-A1001 WeakPolarHBondContact O-CB 3.5Å; H998-A1001 PolarHBondContact O-N 3.32Å; H998-Q1171 PolarHBondContact CD2-NE2 3.13Å; H998-Q1171 PolarHBondContact CD2-OE1 3.28Å; H998-Q1171 VanDerWaalsContact CD2-OE1 3.24Å
999	P	82.7	Confident	90.1	Very high	54 Å²	54	33.6 Å²	33.6	35%	0.351	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-27.8	174	-24.4	31.7	0	0	0	114.5	P1022 T1025	P999-P1022 HydrophobicContact CB-CB 4.44Å; P999-P1022 HydrophobicContact CG-CB 3.74Å; P999-P1022 HydrophobicContact CG-CG 4.13Å; P999-T1025 WeakPolarHBondContact O-CA 3.11Å
1000	E	87.6	Confident	89.8	Confident	67 Å²	67	35.4 Å²	35.4	31%	0.313	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	12.2	176.6	-57.4	-169.9	149.7	0	0	114.1	P975 R976 H998 F1002 H1003	P975-E1000 HydrophobicContact CB-CB 4.38Å; R976-E1000 HydrophobicContact CG-CB 4.27Å; R976-E1000 IonicContact CZ-OE1 3.89Å; R976-E1000 IonicContact CZ-OE2 3.03Å; R976-E1000 PolarHBondContact N-O 3.34Å; R976-E1000 IonicContact NE-OE1 2.87Å; R976-E1000 IonicContact NE-OE2 3.42Å; R976-E1000 PolarHBondContact NE-OE2 2.88Å; R976-E1000 VanDerWaalsContact NH2-CD 3.29Å; R976-E1000 IonicContact NH2-OE1 3.8Å; R976-E1000 PolarHBondContact NH2-OE1 2.78Å; R976-E1000 IonicContact NH2-OE2 2.97Å; R976-E1000 PolarHBondContact NH2-OE2 3.26Å; H998-E1000 PolarHBondContact ND1-N 2.89Å; H998-E1000 PolarHBondContact O-N 3.2Å; H998-E1000 VanDerWaalsContact O-N 3.09Å; E1000-F1002 VanDerWaalsContact C-N 3.27Å; E1000-F1002 PolarHBondContact O-N 2.03Å; E1000-H1003 HydrophobicContact CB-CB 4.26Å; E1000-H1003 WeakPolarHBondContact O-CB 3.36Å; E1000-H1003 PolarHBondContact O-N 2.97Å
1001	A	90.8	Very high	89.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36	-174.6	0	0	0	0	0	113.4	L973 I997 H998	L973-A1001 HydrophobicContact CB-CB 3.98Å; I997-A1001 HydrophobicContact CG2-CB 3.76Å; H998-A1001 HydrophobicContact CB-CB 4.29Å; H998-A1001 VanDerWaalsContact O-CB 3.26Å; H998-A1001 WeakPolarHBondContact O-CB 3.5Å; H998-A1001 PolarHBondContact O-N 3.32Å
1002	F	94.3	Very high	89.8	Confident	3 Å²	3	32.5 Å²	32.5	1%	0.013	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	20.5	179.3	-52.9	-69.8	0	0	0	113.4	L973 F978 I987 I997 E1000 G1004 L1005 L1011 L1013 T1025 F1026 L1029	L973-F1002 HydrophobicContact CD1-CE1 4.08Å; L973-F1002 HydrophobicContact CD1-CE2 4.47Å; L973-F1002 HydrophobicContact CD1-CZ 3.64Å; F978-F1002 AromaticContact CD2-CD1 3.97Å; F978-F1002 HydrophobicContact CD2-CD1 3.97Å; F978-F1002 HydrophobicContact CD2-CE1 4.27Å; F978-F1002 HydrophobicContact CE2-CD1 4.11Å; F978-F1002 AromaticContact CE2-CE1 3.94Å; F978-F1002 HydrophobicContact CE2-CE1 3.94Å; I987-F1002 HydrophobicContact CD1-CD1 4.42Å; I997-F1002 HydrophobicContact CG2-CE2 3.81Å; I997-F1002 HydrophobicContact CG2-CZ 4.4Å; E1000-F1002 VanDerWaalsContact C-N 3.27Å; E1000-F1002 PolarHBondContact O-N 2.03Å; F1002-G1004 PolarHBondContact O-N 2.78Å; F1002-L1005 HydrophobicContact CB-CD1 4.17Å; F1002-L1005 HydrophobicContact CD1-CD1 4.2Å; F1002-L1005 WeakPolarHBondContact O-CB 3.36Å; F1002-L1005 WeakPolarHBondContact O-CG 3.17Å; F1002-L1005 PolarHBondContact O-N 3.2Å; F1002-L1011 HydrophobicContact CD2-CD2 4.39Å; F1002-L1011 HydrophobicContact CE1-CD1 3.85Å; F1002-L1011 HydrophobicContact CE1-CD2 4.26Å; F1002-L1011 HydrophobicContact CE2-CD2 3.95Å; F1002-L1011 HydrophobicContact CZ-CD1 3.89Å; F1002-L1011 HydrophobicContact CZ-CD2 3.88Å; F1002-L1013 HydrophobicContact CZ-CD1 4.46Å; F1002-T1025 HydrophobicContact CD2-CG2 3.83Å; F1002-T1025 HydrophobicContact CE2-CG2 3.99Å; F1002-F1026 HydrophobicContact CD2-CD1 4.36Å; F1002-F1026 HydrophobicContact CD2-CE1 4.29Å; F1002-F1026 HydrophobicContact CE2-CE1 4.12Å; F1002-L1029 HydrophobicContact CB-CD1 4.47Å; F1002-L1029 HydrophobicContact CB-CD2 4.08Å
1003	H	88.6	Confident	89.9	Confident	61 Å²	61	31.8 Å²	31.8	28%	0.282	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	136.1	-176.2	-172.8	46.4	0	0	0	112.2	R976 E979 E1000 L1005 D1028	R976-H1003 HydrophobicContact CG-CB 4.2Å; E979-H1003 IonicContact OE1-CD2 2.85Å; E1000-H1003 HydrophobicContact CB-CB 4.26Å; E1000-H1003 WeakPolarHBondContact O-CB 3.36Å; E1000-H1003 PolarHBondContact O-N 2.97Å; H1003-L1005 VanDerWaalsContact C-N 3.31Å; H1003-L1005 PolarHBondContact O-N 2.89Å; H1003-D1028 VanDerWaalsContact CA-OD2 3.31Å; H1003-D1028 WeakPolarHBondContact CA-OD2 3.49Å; H1003-D1028 IonicContact CE1-OD2 3.54Å; H1003-D1028 IonicContact CG-OD2 2.86Å; H1003-D1028 IonicContact ND1-OD2 3.05Å; H1003-D1028 PolarHBondContact ND1-OD2 3.3Å
1004	G	85.6	Confident	89.8	Confident	31 Å²	31	30.2 Å²	30.2	32%	0.32	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	-7.2	178.7	0	0	0	0	0	116.2	F1002 S1006 D1028	F1002-G1004 PolarHBondContact O-N 2.78Å; G1004-S1006 PolarHBondContact O-N 2.04Å; G1004-D1028 PolarHBondContact N-OD2 3.17Å
1005	L	92.7	Very high	89.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	17%	0.167	C	C	.	.			trans	-78	49.3	-174.3	-62.4	-171.7	0	0	0	115	F978 L984 I987 F1002 H1003 N1007 L1008 L1029	F978-L1005 HydrophobicContact CB-CD1 3.85Å; F978-L1005 HydrophobicContact CB-CD2 4.1Å; F978-L1005 HydrophobicContact CB-CG 4.3Å; F978-L1005 HydrophobicContact CD2-CD1 4.29Å; F978-L1005 HydrophobicContact CG-CD1 4.39Å; L984-L1005 HydrophobicContact CB-CD2 4.38Å; L984-L1005 HydrophobicContact CD1-CD2 4.39Å; I987-L1005 HydrophobicContact CD1-CD1 3.62Å; F1002-L1005 HydrophobicContact CB-CD1 4.17Å; F1002-L1005 HydrophobicContact CD1-CD1 4.2Å; F1002-L1005 WeakPolarHBondContact O-CB 3.36Å; F1002-L1005 WeakPolarHBondContact O-CG 3.17Å; F1002-L1005 PolarHBondContact O-N 3.2Å; H1003-L1005 VanDerWaalsContact C-N 3.31Å; H1003-L1005 PolarHBondContact O-N 2.89Å; L1005-N1007 PolarHBondContact O-N 2.83Å; L1005-L1008 HydrophobicContact CB-CB 4.21Å; L1005-L1008 HydrophobicContact CD1-CD2 4.38Å; L1005-L1008 WeakPolarHBondContact O-CB 3.26Å; L1005-L1008 PolarHBondContact O-N 3.05Å; L1005-L1029 HydrophobicContact CB-CD2 3.84Å
1006	S	86.8	Confident	90.1	Very high	63 Å²	63	29.4 Å²	29.4	44%	0.441	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-7.5	-178.8	60.6	0	0	0	0	116.3	G1004 D1028 Q1031	G1004-S1006 PolarHBondContact O-N 2.04Å; S1006-D1028 WeakPolarHBondContact CA-O 3.28Å; S1006-Q1031 PolarHBondContact O-NE2 3.34Å
1007	N	89.9	Confident	90.5	Very high	54 Å²	54	32.1 Å²	32.1	29%	0.289	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-4.9	174.4	-72.2	-56.2	0	0	0	114.7	A982 L984 L1005 Q1031	A982-N1007 PolarHBondContact O-ND2 2.87Å; L984-N1007 CarbonylContact O-C 3.24Å; L1005-N1007 PolarHBondContact O-N 2.83Å; N1007-Q1031 PolarHBondContact OD1-NE2 2.99Å
1008	L	93.9	Very high	90.6	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.			trans	-67.3	134.7	-177.3	-162.1	72.8	0	0	0	111	L984 I987 L1005 L1011 L1029 Q1031 L1032	L984-L1008 HydrophobicContact CB-CD1 4.36Å; L984-L1008 WeakPolarHBondContact O-CA 3.42Å; L984-L1008 PolarHBondContact O-N 2.97Å; I987-L1008 HydrophobicContact CB-CD1 4.3Å; I987-L1008 HydrophobicContact CD1-CD1 3.77Å; I987-L1008 HydrophobicContact CD1-CD2 4.25Å; I987-L1008 HydrophobicContact CG1-CD1 3.74Å; L1005-L1008 HydrophobicContact CB-CB 4.21Å; L1005-L1008 HydrophobicContact CD1-CD2 4.38Å; L1005-L1008 WeakPolarHBondContact O-CB 3.26Å; L1005-L1008 PolarHBondContact O-N 3.05Å; L1008-L1011 HydrophobicContact CD2-CB 4.16Å; L1008-L1011 HydrophobicContact CD2-CD2 4.48Å; L1008-L1029 HydrophobicContact CB-CD2 4.15Å; L1008-L1029 HydrophobicContact CD2-CD1 4.24Å; L1008-L1029 HydrophobicContact CD2-CD2 3.97Å; L1008-Q1031 CarbonylContact O-C 3.5Å; L1008-Q1031 WeakPolarHBondContact O-CB 3.25Å; L1008-L1032 HydrophobicContact CD2-CD1 4.5Å; L1008-L1032 PolarHBondContact O-N 2.81Å; L1008-L1032 VanDerWaalsContact O-N 3.12Å
1009	R	90	Very high	90.5	Very high	114 Å²	114	30 Å²	30	43%	0.43	17%	0.166	S	C	.	.			trans	-121.8	-31.7	-176.8	-65.3	-179.9	-179.8	-175.4	-2.1	113.2	K985 Q1031 N1033 N1034	K985-R1009 PolarHBondContact O-N 2.85Å; R1009-Q1031 WeakPolarHBondContact CA-O 3.04Å; R1009-Q1031 HydrophobicContact CG-CB 4.25Å; R1009-N1033 PolarHBondContact O-N 2.98Å; R1009-N1034 PolarHBondContact O-N 3.4Å; R1009-N1034 VanDerWaalsContact O-N 3.1Å
1010	V	89.6	Confident	90.7	Very high	38 Å²	38	28.2 Å²	28.2	23%	0.23	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.7	-176.9	-173.4	0	0	0	0	109	K985 T986 I987 I1012 N1034	K985-V1010 PolarHBondContact O-N 3.5Å; T986-V1010 WeakPolarHBondContact CA-O 3.03Å; T986-V1010 HydrophobicContact CG2-CB 4.15Å; T986-V1010 HydrophobicContact CG2-CG1 4.35Å; I987-V1010 PolarHBondContact N-O 3.07Å; V1010-I1012 HydrophobicContact CG1-CD1 3.92Å; V1010-I1012 HydrophobicContact CG1-CG1 4Å; V1010-N1034 WeakPolarHBondContact CA-O 3.46Å; V1010-N1034 HydrophobicContact CG1-CB 4.38Å; V1010-N1034 HydrophobicContact CG2-CB 4.35Å
1011	L	93.7	Very high	90.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	114.6	174.4	176.3	57.3	0	0	0	109.4	I987 F1002 L1008 L1013 F1026 L1029 L1032 N1034 L1035 A1036	I987-L1011 HydrophobicContact CB-CD1 4.14Å; I987-L1011 HydrophobicContact CG2-CD1 4.07Å; I987-L1011 WeakPolarHBondContact O-CA 3.49Å; F1002-L1011 HydrophobicContact CD2-CD2 4.39Å; F1002-L1011 HydrophobicContact CE1-CD1 3.85Å; F1002-L1011 HydrophobicContact CE1-CD2 4.26Å; F1002-L1011 HydrophobicContact CE2-CD2 3.95Å; F1002-L1011 HydrophobicContact CZ-CD1 3.89Å; F1002-L1011 HydrophobicContact CZ-CD2 3.88Å; L1008-L1011 HydrophobicContact CD2-CB 4.16Å; L1008-L1011 HydrophobicContact CD2-CD2 4.48Å; L1011-L1013 HydrophobicContact CD1-CD1 4.25Å; L1011-L1013 HydrophobicContact CD1-CG 4.13Å; L1011-L1013 HydrophobicContact CD2-CD1 4.06Å; L1011-L1013 HydrophobicContact CG-CD1 4.01Å; L1011-L1013 HydrophobicContact CG-CG 4.2Å; L1011-F1026 HydrophobicContact CD2-CD1 4.43Å; L1011-F1026 HydrophobicContact CD2-CE1 3.83Å; L1011-F1026 HydrophobicContact CD2-CZ 4.5Å; L1011-L1029 HydrophobicContact CD2-CD1 4.28Å; L1011-L1032 HydrophobicContact CB-CD1 3.97Å; L1011-N1034 PolarHBondContact N-O 3.03Å; L1011-L1035 HydrophobicContact CB-CD1 4.09Å; L1011-L1035 HydrophobicContact CD2-CD1 4.07Å; L1011-L1035 HydrophobicContact CG-CD1 4Å; L1011-L1035 WeakPolarHBondContact O-CA 3.49Å; L1011-L1035 WeakPolarHBondContact O-CD1 3.46Å; L1011-A1036 PolarHBondContact O-N 3.18Å; L1011-A1036 VanDerWaalsContact O-N 3.16Å
1012	I	93.6	Very high	90.3	Very high	30 Å²	30	27.1 Å²	27.1	15%	0.154	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	116.5	-177.9	-52.6	-59.1	0	0	0	109.4	I987 V988 L989 V1010 A1036	I987-I1012 PolarHBondContact O-N 3.14Å; V988-I1012 HydrophobicContact CB-CB 4.46Å; V988-I1012 HydrophobicContact CG1-CB 3.87Å; V988-I1012 HydrophobicContact CG1-CG1 4.26Å; V988-I1012 HydrophobicContact CG1-CG2 4.11Å; V988-I1012 HydrophobicContact CG2-CG1 4.43Å; L989-I1012 PolarHBondContact N-O 3.05Å; V1010-I1012 HydrophobicContact CG1-CD1 3.92Å; V1010-I1012 HydrophobicContact CG1-CG1 4Å; I1012-A1036 HydrophobicContact CD1-CB 3.7Å; I1012-A1036 HydrophobicContact CG2-CB 4.22Å
1013	L	93.8	Very high	89.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.			trans	-125.4	9.5	-177.6	-72.3	167.7	0	0	0	112.6	L989 L994 I997 F1002 L1011 N1016 I1018 A1036 L1037 N1040	L989-L1013 HydrophobicContact CB-CD2 4Å; L989-L1013 HydrophobicContact CD1-CD2 4.13Å; L994-L1013 HydrophobicContact CD1-CD2 3.98Å; I997-L1013 HydrophobicContact CD1-CD1 3.9Å; I997-L1013 HydrophobicContact CD1-CD2 4Å; F1002-L1013 HydrophobicContact CZ-CD1 4.46Å; L1011-L1013 HydrophobicContact CD1-CD1 4.25Å; L1011-L1013 HydrophobicContact CD1-CG 4.13Å; L1011-L1013 HydrophobicContact CD2-CD1 4.06Å; L1011-L1013 HydrophobicContact CG-CD1 4.01Å; L1011-L1013 HydrophobicContact CG-CG 4.2Å; L1013-N1016 PolarHBondContact O-ND2 3.1Å; L1013-I1018 HydrophobicContact CB-CD1 4.3Å; L1013-A1036 CarbonylContact C-O 3.28Å; L1013-A1036 WeakPolarHBondContact CA-O 3.33Å; L1013-A1036 PolarHBondContact N-O 3.21Å; L1013-L1037 HydrophobicContact CB-CD2 3.66Å; L1013-L1037 HydrophobicContact CB-CG 4.5Å; L1013-L1037 HydrophobicContact CD1-CD2 3.97Å; L1013-L1037 HydrophobicContact CG-CD2 4.48Å; L1013-N1040 PolarHBondContact O-ND2 3.38Å
1014	Q	90.5	Very high	89.4	Confident	27 Å²	27	32.1 Å²	32.1	13%	0.126	18%	0.182	C	C	.	.			trans	-57.4	146.6	179.4	172	175.1	-12.1	0	0	113.3	S990 Y991 N1016 A1036 G1038 Q1039	S990-Q1014 CarbonylContact C-O 3.56Å; S990-Q1014 WeakPolarHBondContact CA-O 3.49Å; S990-Q1014 WeakPolarHBondContact CB-O 3.41Å; Y991-Q1014 PolarHBondContact N-O 2.99Å; Y991-Q1014 VanDerWaalsContact N-O 3.07Å; Y991-Q1014 PolarHBondContact OH-NE2 2.82Å; Q1014-N1016 PolarHBondContact O-ND2 2.71Å; Q1014-A1036 HydrophobicContact CB-CB 4.43Å; Q1014-A1036 PolarHBondContact N-O 2.8Å; Q1014-G1038 VanDerWaalsContact CA-O 3.25Å; Q1014-G1038 WeakPolarHBondContact CA-O 3.37Å; Q1014-Q1039 HydrophobicContact CG-CB 4.37Å; Q1014-Q1039 HydrophobicContact CG-CG 4.49Å
1015	G	92	Very high	89.5	Confident	13 Å²	13	30.9 Å²	30.9	13%	0.134	17%	0.168	C	C	.	.	S	Bend	trans	69.6	48.5	173.8	0	0	0	0	0	112	Y991 G1038 Q1039	Y991-G1015 WeakPolarHBondContact CA-O 3.35Å; Y991-G1015 PolarHBondContact N-O 2.79Å; G1015-G1038 PolarHBondContact N-O 3.38Å; G1015-Q1039 VanDerWaalsContact CA-O 3.26Å; G1015-Q1039 WeakPolarHBondContact CA-O 3.44Å; G1015-Q1039 PolarHBondContact N-O 3.22Å
1016	N	94.4	Very high	89.5	Confident	13 Å²	13	31 Å²	31	7%	0.07	17%	0.168	C	C	.	.	S	Bend	trans	-129	-176.3	179.1	-85.1	-78.7	0	0	0	109.9	L989 N992 L994 L1013 Q1014 I1018 Q1039 N1040 P1041	L989-N1016 PolarHBondContact O-ND2 3.29Å; N992-N1016 WeakPolarHBondContact CA-OD1 3.47Å; N992-N1016 WeakPolarHBondContact CB-OD1 3.43Å; N992-N1016 PolarHBondContact N-OD1 3.4Å; N992-N1016 PolarHBondContact O-OD1 3.19Å; L994-N1016 HydrophobicContact CB-CB 4.16Å; L994-N1016 VanDerWaalsContact CB-OD1 3.26Å; L994-N1016 WeakPolarHBondContact CB-OD1 3.1Å; L994-N1016 WeakPolarHBondContact CG-OD1 3.35Å; L994-N1016 PolarHBondContact N-OD1 3.23Å; L1013-N1016 PolarHBondContact O-ND2 3.1Å; Q1014-N1016 PolarHBondContact O-ND2 2.71Å; N1016-I1018 HydrophobicContact CB-CD1 4.16Å; N1016-I1018 HydrophobicContact CB-CG1 4.07Å; N1016-Q1039 PolarHBondContact N-O 3.23Å; N1016-N1040 WeakPolarHBondContact CA-OD1 3.43Å; N1016-N1040 WeakPolarHBondContact CB-OD1 3.42Å; N1016-N1040 PolarHBondContact O-OD1 2.87Å; N1016-N1040 VanDerWaalsContact O-OD1 3.13Å; N1016-P1041 WeakPolarHBondContact O-CD 3.37Å
1017	N	92.8	Very high	89.4	Confident	56 Å²	56	34.3 Å²	34.3	30%	0.299	18%	0.181	S	C	.	.			trans	-109.7	27.2	-174.6	-163.8	-3.7	0	0	0	111.6	N993 L994 Q995 S1019	N993-N1017 WeakPolarHBondContact OD1-CB 3.49Å; N993-N1017 PolarHBondContact OD1-ND2 3.03Å; L994-N1017 CarbonylContact O-C 3.53Å; L994-N1017 VanDerWaalsContact O-CA 3.31Å; L994-N1017 WeakPolarHBondContact O-CA 3.25Å; L994-N1017 PolarHBondContact O-N 3.32Å; Q995-N1017 HydrophobicContact CG-CB 3.68Å; Q995-N1017 PolarHBondContact NE2-ND2 3.3Å; N1017-S1019 PolarHBondContact O-N 2.87Å
1018	I	91.6	Very high	89.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.			trans	-74.8	119.4	-176.3	-53.8	166.7	0	0	0	108.8	L994 I997 L1013 N1016 S1020 I1021 L1037 N1040 P1041 L1042	L994-I1018 HydrophobicContact CB-CG1 4.32Å; L994-I1018 VanDerWaalsContact O-CG1 3.3Å; L994-I1018 WeakPolarHBondContact O-CG1 3.12Å; L994-I1018 PolarHBondContact O-N 3.09Å; L994-I1018 VanDerWaalsContact O-N 3.08Å; I997-I1018 HydrophobicContact CD1-CD1 3.72Å; I997-I1018 HydrophobicContact CD1-CG1 4.48Å; L1013-I1018 HydrophobicContact CB-CD1 4.3Å; N1016-I1018 HydrophobicContact CB-CD1 4.16Å; N1016-I1018 HydrophobicContact CB-CG1 4.07Å; I1018-S1020 WeakPolarHBondContact CG2-O 3.23Å; I1018-I1021 HydrophobicContact CG2-CG1 3.91Å; I1018-L1037 HydrophobicContact CD1-CD2 4.45Å; I1018-N1040 HydrophobicContact CB-CB 4.43Å; I1018-N1040 VanDerWaalsContact CB-OD1 3.28Å; I1018-N1040 WeakPolarHBondContact CB-OD1 3.49Å; I1018-N1040 WeakPolarHBondContact CG1-OD1 3.42Å; I1018-N1040 PolarHBondContact N-OD1 3.41Å; I1018-N1040 VanDerWaalsContact N-OD1 3.14Å; I1018-P1041 CarbonylContact O-C 3.33Å; I1018-P1041 VanDerWaalsContact O-CD 3.3Å; I1018-P1041 WeakPolarHBondContact O-CD 3.41Å; I1018-L1042 HydrophobicContact CG2-CD2 4.24Å; I1018-L1042 WeakPolarHBondContact O-CD2 3.19Å
1019	S	86.2	Confident	88.9	Confident	5 Å²	5	35.1 Å²	35.1	4%	0.035	19%	0.185	C	C	.	.			trans	-98.5	-14.5	173.4	51.8	0	0	0	0	114.8	N1017 P1041 H1043 K1151	N1017-S1019 PolarHBondContact O-N 2.87Å; S1019-P1041 VanDerWaalsContact CA-O 3.29Å; S1019-P1041 WeakPolarHBondContact CA-O 3.18Å; S1019-P1041 WeakPolarHBondContact CB-O 3.27Å; S1019-H1043 WeakPolarHBondContact O-CB 3.43Å; S1019-H1043 PolarHBondContact O-N 3.03Å; S1019-K1151 WeakPolarHBondContact OG-CD 3.3Å; S1019-K1151 WeakPolarHBondContact OG-CE 3.46Å; S1019-K1151 PolarHBondContact OG-NZ 3.32Å
1020	S	85.4	Confident	88.4	Confident	16 Å²	16	33.2 Å²	33.2	11%	0.112	20%	0.201	C	C	.	.			trans	-160.5	148.6	174.1	53.7	0	0	0	0	110.2	I1018 I1148	I1018-S1020 WeakPolarHBondContact CG2-O 3.23Å; S1020-I1148 WeakPolarHBondContact OG-CG2 3.31Å
1021	I	88.1	Confident	88.2	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	20%	0.204	C	C	.	.			trans	-113.7	121.4	169.4	-53.2	-178.1	0	0	0	107.5	I1018 T1025 F1026 L1037 W1050	I1018-I1021 HydrophobicContact CG2-CG1 3.91Å; I1021-T1025 HydrophobicContact CG2-CG2 3.78Å; I1021-F1026 HydrophobicContact CD1-CE2 4.48Å; I1021-F1026 HydrophobicContact CD1-CZ 3.98Å; I1021-F1026 HydrophobicContact CG2-CZ 4.27Å; I1021-L1037 HydrophobicContact CD1-CD1 3.66Å; I1021-L1037 HydrophobicContact CD1-CD2 3.65Å; I1021-L1037 HydrophobicContact CD1-CG 4.34Å; I1021-W1050 HydrophobicContact CB-CZ2 4.01Å; I1021-W1050 HydrophobicContact CG2-CH2 4.21Å; I1021-W1050 HydrophobicContact CG2-CZ2 3.79Å; I1021-W1050 WeakPolarHBondContact O-CZ2 3.23Å; I1021-W1050 PolarHBondContact O-NE1 3.49Å
1022	P	83.5	Confident	87.9	Confident	43 Å²	43	34.9 Å²	34.9	28%	0.279	21%	0.207	S	C	.	.			trans	-59	147.1	179.1	-26.9	35.9	0	0	0	113.3	P999 G1024 T1025 W1050	P999-P1022 HydrophobicContact CB-CB 4.44Å; P999-P1022 HydrophobicContact CG-CB 3.74Å; P999-P1022 HydrophobicContact CG-CG 4.13Å; P1022-G1024 PolarHBondContact O-N 2.73Å; P1022-T1025 PolarHBondContact O-N 3.1Å; P1022-T1025 PolarHBondContact O-OG1 3.43Å; P1022-W1050 WeakPolarHBondContact O-CZ2 3.29Å
1023	Q	82.1	Confident	87.4	Confident	153 Å²	153	39.1 Å²	39.1	72%	0.715	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	132	169.5	-171.6	174.7	-11.7	0	0	109.6	W1050	Q1023-W1050 HydrophobicContact CB-CD2 4.38Å; Q1023-W1050 HydrophobicContact CB-CG 3.96Å; Q1023-W1050 HydrophobicContact CG-CB 4.13Å; Q1023-W1050 HydrophobicContact CG-CD2 4.33Å; Q1023-W1050 HydrophobicContact CG-CG 3.91Å
1024	G	81.9	Confident	86.8	Confident	16 Å²	16	43 Å²	43	17%	0.165	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	111.4	-26.2	-176.8	0	0	0	0	0	114.3	P1022 F1026 N1027	P1022-G1024 PolarHBondContact O-N 2.73Å; G1024-F1026 PolarHBondContact O-N 2.94Å; G1024-N1027 WeakPolarHBondContact O-CB 3.44Å; G1024-N1027 PolarHBondContact O-N 2.94Å
1025	T	88.1	Confident	86.8	Confident	4 Å²	4	41.8 Å²	41.8	3%	0.025	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-25.4	-173.4	-57.2	0	0	0	0	115	I997 P999 F1002 I1021 P1022	I997-T1025 HydrophobicContact CG2-CG2 3.7Å; P999-T1025 WeakPolarHBondContact O-CA 3.11Å; F1002-T1025 HydrophobicContact CD2-CG2 3.83Å; F1002-T1025 HydrophobicContact CE2-CG2 3.99Å; I1021-T1025 HydrophobicContact CG2-CG2 3.78Å; P1022-T1025 PolarHBondContact O-N 3.1Å; P1022-T1025 PolarHBondContact O-OG1 3.43Å
1026	F	91	Very high	86.7	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.022	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	9.7	-179.7	-55.7	-30.3	0	0	0	114.6	F1002 L1011 I1021 G1024 D1028 L1029 L1035 L1037 W1050 L1051 F1054	F1002-F1026 HydrophobicContact CD2-CD1 4.36Å; F1002-F1026 HydrophobicContact CD2-CE1 4.29Å; F1002-F1026 HydrophobicContact CE2-CE1 4.12Å; L1011-F1026 HydrophobicContact CD2-CD1 4.43Å; L1011-F1026 HydrophobicContact CD2-CE1 3.83Å; L1011-F1026 HydrophobicContact CD2-CZ 4.5Å; I1021-F1026 HydrophobicContact CD1-CE2 4.48Å; I1021-F1026 HydrophobicContact CD1-CZ 3.98Å; I1021-F1026 HydrophobicContact CG2-CZ 4.27Å; G1024-F1026 PolarHBondContact O-N 2.94Å; F1026-D1028 VanDerWaalsContact C-N 3.3Å; F1026-D1028 PolarHBondContact O-N 2.79Å; F1026-L1029 HydrophobicContact CB-CD1 3.97Å; F1026-L1029 HydrophobicContact CB-CG 4.37Å; F1026-L1029 HydrophobicContact CD1-CD1 3.58Å; F1026-L1029 HydrophobicContact CE1-CD1 4.46Å; F1026-L1029 HydrophobicContact CG-CD1 4.07Å; F1026-L1029 WeakPolarHBondContact O-CB 3.26Å; F1026-L1029 PolarHBondContact O-N 3.48Å; F1026-L1029 VanDerWaalsContact O-N 3.08Å; F1026-L1035 HydrophobicContact CD2-CD2 4.12Å; F1026-L1035 HydrophobicContact CE2-CD2 3.55Å; F1026-L1035 HydrophobicContact CZ-CD1 4.3Å; F1026-L1035 HydrophobicContact CZ-CD2 3.99Å; F1026-L1037 HydrophobicContact CZ-CD1 4.45Å; F1026-W1050 HydrophobicContact CB-CZ3 4.5Å; F1026-W1050 AromaticContact CD2-CH2 3.48Å; F1026-W1050 HydrophobicContact CD2-CH2 3.48Å; F1026-W1050 VanDerWaalsContact CD2-CH2 3.48Å; F1026-W1050 AromaticContact CD2-CZ3 3.74Å; F1026-W1050 HydrophobicContact CD2-CZ3 3.74Å; F1026-W1050 AromaticContact CE2-CH2 3.79Å; F1026-W1050 HydrophobicContact CE2-CH2 3.79Å; F1026-W1050 HydrophobicContact CE2-CZ3 4.38Å; F1026-W1050 HydrophobicContact CG-CH2 4.12Å; F1026-W1050 HydrophobicContact CG-CZ3 4.42Å; F1026-L1051 HydrophobicContact CD2-CD1 4.47Å; F1026-L1051 HydrophobicContact CE2-CD1 3.88Å; F1026-F1054 HydrophobicContact CB-CE1 4.35Å; F1026-F1054 HydrophobicContact CB-CE2 3.94Å; F1026-F1054 HydrophobicContact CB-CZ 3.77Å; F1026-F1054 AromaticContact CD2-CD1 3.95Å; F1026-F1054 HydrophobicContact CD2-CD1 3.95Å; F1026-F1054 AromaticContact CD2-CE1 3.62Å; F1026-F1054 HydrophobicContact CD2-CE1 3.62Å; F1026-F1054 AromaticContact CD2-CZ 3.94Å; F1026-F1054 HydrophobicContact CD2-CZ 3.94Å; F1026-F1054 HydrophobicContact CE2-CE1 4.34Å; F1026-F1054 HydrophobicContact CG-CE1 4.33Å; F1026-F1054 HydrophobicContact CG-CZ 4.22Å
1027	N	85	Confident	86.5	Confident	132 Å²	132	41.6 Å²	41.6	71%	0.706	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-39.5	-173	-79.4	0.1	0	0	0	113.9	G1024 L1029	G1024-N1027 WeakPolarHBondContact O-CB 3.44Å; G1024-N1027 PolarHBondContact O-N 2.94Å; N1027-L1029 VanDerWaalsContact C-N 3.33Å
1028	D	84.4	Confident	86.1	Confident	61 Å²	61	39 Å²	39	33%	0.326	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-10.2	-177	-63.6	-24.8	0	0	0	113.5	H1003 G1004 S1006 F1026 G1030	H1003-D1028 VanDerWaalsContact CA-OD2 3.31Å; H1003-D1028 WeakPolarHBondContact CA-OD2 3.49Å; H1003-D1028 IonicContact CE1-OD2 3.54Å; H1003-D1028 IonicContact CG-OD2 2.86Å; H1003-D1028 IonicContact ND1-OD2 3.05Å; H1003-D1028 PolarHBondContact ND1-OD2 3.3Å; G1004-D1028 PolarHBondContact N-OD2 3.17Å; S1006-D1028 WeakPolarHBondContact CA-O 3.28Å; F1026-D1028 VanDerWaalsContact C-N 3.3Å; F1026-D1028 PolarHBondContact O-N 2.79Å; D1028-G1030 PolarHBondContact O-N 3.42Å
1029	L	89	Confident	85.9	Confident	9 Å²	9	44 Å²	44	5%	0.047	25%	0.253	C	S	.	.			trans	-82.7	46	-166.8	-53.6	-173.7	0	0	0	113.2	F1002 L1005 L1008 L1011 F1026 N1027 Q1031 L1032	F1002-L1029 HydrophobicContact CB-CD1 4.47Å; F1002-L1029 HydrophobicContact CB-CD2 4.08Å; L1005-L1029 HydrophobicContact CB-CD2 3.84Å; L1008-L1029 HydrophobicContact CB-CD2 4.15Å; L1008-L1029 HydrophobicContact CD2-CD1 4.24Å; L1008-L1029 HydrophobicContact CD2-CD2 3.97Å; L1011-L1029 HydrophobicContact CD2-CD1 4.28Å; F1026-L1029 HydrophobicContact CB-CD1 3.97Å; F1026-L1029 HydrophobicContact CB-CG 4.37Å; F1026-L1029 HydrophobicContact CD1-CD1 3.58Å; F1026-L1029 HydrophobicContact CE1-CD1 4.46Å; F1026-L1029 HydrophobicContact CG-CD1 4.07Å; F1026-L1029 WeakPolarHBondContact O-CB 3.26Å; F1026-L1029 PolarHBondContact O-N 3.48Å; F1026-L1029 VanDerWaalsContact O-N 3.08Å; N1027-L1029 VanDerWaalsContact C-N 3.33Å; L1029-Q1031 PolarHBondContact O-N 2.74Å; L1029-L1032 HydrophobicContact CB-CB 4.17Å; L1029-L1032 HydrophobicContact CB-CD2 4.41Å; L1029-L1032 HydrophobicContact CD1-CD2 4.14Å; L1029-L1032 WeakPolarHBondContact O-CB 3.48Å; L1029-L1032 PolarHBondContact O-N 3.14Å
1030	G	80.1	Confident	86.1	Confident	75 Å²	75	44.3 Å²	44.3	77%	0.773	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	4	-173.8	0	0	0	0	0	117	D1028	D1028-G1030 PolarHBondContact O-N 3.42Å
1031	Q	85.5	Confident	86.4	Confident	60 Å²	60	45 Å²	45	28%	0.28	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	5.8	171.9	-82.6	-175.1	77.8	0	0	113.5	S1006 N1007 L1008 R1009 L1029 N1033	S1006-Q1031 PolarHBondContact O-NE2 3.34Å; N1007-Q1031 PolarHBondContact OD1-NE2 2.99Å; L1008-Q1031 CarbonylContact O-C 3.5Å; L1008-Q1031 WeakPolarHBondContact O-CB 3.25Å; R1009-Q1031 WeakPolarHBondContact CA-O 3.04Å; R1009-Q1031 HydrophobicContact CG-CB 4.25Å; L1029-Q1031 PolarHBondContact O-N 2.74Å; Q1031-N1033 PolarHBondContact O-N 3.07Å; Q1031-N1033 PolarHBondContact O-ND2 3.13Å
1032	L	87.4	Confident	86.5	Confident	13 Å²	13	45.1 Å²	45.1	7%	0.068	26%	0.26	C	S	.	.			trans	-65	123.5	-177.3	-161.9	64.2	0	0	0	110.7	L1008 L1011 L1029 L1035 F1054 L1060	L1008-L1032 HydrophobicContact CD2-CD1 4.5Å; L1008-L1032 PolarHBondContact O-N 2.81Å; L1008-L1032 VanDerWaalsContact O-N 3.12Å; L1011-L1032 HydrophobicContact CB-CD1 3.97Å; L1029-L1032 HydrophobicContact CB-CB 4.17Å; L1029-L1032 HydrophobicContact CB-CD2 4.41Å; L1029-L1032 HydrophobicContact CD1-CD2 4.14Å; L1029-L1032 WeakPolarHBondContact O-CB 3.48Å; L1029-L1032 PolarHBondContact O-N 3.14Å; L1032-L1035 HydrophobicContact CD2-CB 4.16Å; L1032-L1035 HydrophobicContact CD2-CD2 4.07Å; L1032-F1054 HydrophobicContact CD2-CE1 4.09Å; L1032-F1054 HydrophobicContact CD2-CZ 4.02Å; L1032-L1060 HydrophobicContact CD2-CD1 4.28Å
1033	N	82.1	Confident	86.8	Confident	119 Å²	119	43.2 Å²	43.2	64%	0.636	25%	0.247	S	C	*	.			trans	-122.8	-8.7	178.1	-54.7	-78.6	0	0	0	112.9	R1009 Q1031	R1009-N1033 PolarHBondContact O-N 2.98Å; Q1031-N1033 PolarHBondContact O-N 3.07Å; Q1031-N1033 PolarHBondContact O-ND2 3.13Å
1034	N	82.7	Confident	87.2	Confident	81 Å²	81	36 Å²	36	43%	0.433	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	122.5	-179.9	-169.1	-3.7	0	0	0	109.8	R1009 V1010 L1011	R1009-N1034 PolarHBondContact O-N 3.4Å; R1009-N1034 VanDerWaalsContact O-N 3.1Å; V1010-N1034 WeakPolarHBondContact CA-O 3.46Å; V1010-N1034 HydrophobicContact CG1-CB 4.38Å; V1010-N1034 HydrophobicContact CG2-CB 4.35Å; L1011-N1034 PolarHBondContact N-O 3.03Å
1035	L	89.6	Confident	87.5	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	108.4	-176.7	173	56.5	0	0	0	110.3	L1011 F1026 L1032 L1037 F1054 F1055 L1060	L1011-L1035 HydrophobicContact CB-CD1 4.09Å; L1011-L1035 HydrophobicContact CD2-CD1 4.07Å; L1011-L1035 HydrophobicContact CG-CD1 4Å; L1011-L1035 WeakPolarHBondContact O-CA 3.49Å; L1011-L1035 WeakPolarHBondContact O-CD1 3.46Å; F1026-L1035 HydrophobicContact CD2-CD2 4.12Å; F1026-L1035 HydrophobicContact CE2-CD2 3.55Å; F1026-L1035 HydrophobicContact CZ-CD1 4.3Å; F1026-L1035 HydrophobicContact CZ-CD2 3.99Å; L1032-L1035 HydrophobicContact CD2-CB 4.16Å; L1032-L1035 HydrophobicContact CD2-CD2 4.07Å; L1035-L1037 HydrophobicContact CD1-CD1 4.09Å; L1035-L1037 HydrophobicContact CD1-CG 4.11Å; L1035-L1037 HydrophobicContact CD2-CD1 4.1Å; L1035-L1037 HydrophobicContact CG-CD1 4.06Å; L1035-L1037 HydrophobicContact CG-CG 4.36Å; L1035-F1054 HydrophobicContact CD2-CD1 4.35Å; L1035-F1054 HydrophobicContact CD2-CE1 3.85Å; L1035-F1055 HydrophobicContact CD2-CD1 4.48Å; L1035-F1055 HydrophobicContact CD2-CE1 3.78Å; L1035-F1055 HydrophobicContact CG-CE1 4.14Å; L1035-L1060 HydrophobicContact CB-CB 4.39Å; L1035-L1060 HydrophobicContact CB-CD1 4.47Å
1036	A	89	Confident	87.3	Confident	20 Å²	20	38.1 Å²	38.1	17%	0.165	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.7	179.7	0	0	0	0	0	111.3	L1011 I1012 L1013 Q1014	L1011-A1036 PolarHBondContact O-N 3.18Å; L1011-A1036 VanDerWaalsContact O-N 3.16Å; I1012-A1036 HydrophobicContact CD1-CB 3.7Å; I1012-A1036 HydrophobicContact CG2-CB 4.22Å; L1013-A1036 CarbonylContact C-O 3.28Å; L1013-A1036 WeakPolarHBondContact CA-O 3.33Å; L1013-A1036 PolarHBondContact N-O 3.21Å; Q1014-A1036 HydrophobicContact CB-CB 4.43Å; Q1014-A1036 PolarHBondContact N-O 2.8Å
1037	L	90.2	Very high	86.9	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	25%	0.245	C	C	.	.			trans	-126.3	5.2	-178.9	-83.1	168.1	0	0	0	114.6	L1013 I1018 I1021 F1026 L1035 N1040 L1051 F1055 S1065	L1013-L1037 HydrophobicContact CB-CD2 3.66Å; L1013-L1037 HydrophobicContact CB-CG 4.5Å; L1013-L1037 HydrophobicContact CD1-CD2 3.97Å; L1013-L1037 HydrophobicContact CG-CD2 4.48Å; I1018-L1037 HydrophobicContact CD1-CD2 4.45Å; I1021-L1037 HydrophobicContact CD1-CD1 3.66Å; I1021-L1037 HydrophobicContact CD1-CD2 3.65Å; I1021-L1037 HydrophobicContact CD1-CG 4.34Å; F1026-L1037 HydrophobicContact CZ-CD1 4.45Å; L1035-L1037 HydrophobicContact CD1-CD1 4.09Å; L1035-L1037 HydrophobicContact CD1-CG 4.11Å; L1035-L1037 HydrophobicContact CD2-CD1 4.1Å; L1035-L1037 HydrophobicContact CG-CD1 4.06Å; L1035-L1037 HydrophobicContact CG-CG 4.36Å; L1037-N1040 PolarHBondContact O-ND2 3.42Å; L1037-N1040 VanDerWaalsContact O-ND2 3.12Å; L1037-L1051 HydrophobicContact CD1-CD1 4.31Å; L1037-L1051 HydrophobicContact CD1-CD2 4.27Å; L1037-F1055 HydrophobicContact CB-CZ 4.41Å; L1037-F1055 HydrophobicContact CD1-CE1 4.31Å; L1037-F1055 HydrophobicContact CD1-CZ 3.95Å; L1037-S1065 WeakPolarHBondContact CB-OG 3.33Å
1038	G	85	Confident	86.9	Confident	2 Å²	2	35.3 Å²	35.3	2%	0.021	21%	0.213	C	C	.	.			trans	-56.7	164.9	174.3	0	0	0	0	0	113.9	Q1014 G1015 N1040	Q1014-G1038 VanDerWaalsContact CA-O 3.25Å; Q1014-G1038 WeakPolarHBondContact CA-O 3.37Å; G1015-G1038 PolarHBondContact N-O 3.38Å; G1038-N1040 PolarHBondContact O-N 2.9Å; G1038-N1040 PolarHBondContact O-ND2 2.93Å; G1038-N1040 VanDerWaalsContact O-ND2 3.14Å
1039	Q	87.8	Confident	87.1	Confident	104 Å²	104	36.7 Å²	36.7	49%	0.486	22%	0.216	S	C	.	.	S	Bend	trans	51.2	50.5	-177.2	-55.4	176.2	6.3	0	0	112.9	Y991 Q1014 G1015 N1016	Y991-Q1039 PolarHBondContact OH-OE1 2.88Å; Q1014-Q1039 HydrophobicContact CG-CB 4.37Å; Q1014-Q1039 HydrophobicContact CG-CG 4.49Å; G1015-Q1039 VanDerWaalsContact CA-O 3.26Å; G1015-Q1039 WeakPolarHBondContact CA-O 3.44Å; G1015-Q1039 PolarHBondContact N-O 3.22Å; N1016-Q1039 PolarHBondContact N-O 3.23Å
1040	N	89.3	Confident	87.1	Confident	13 Å²	13	38.1 Å²	38.1	7%	0.07	22%	0.221	C	C	.	.	S	Bend	trans	-132.4	144.6	172.2	-84	-86.2	0	0	0	109.6	L1013 N1016 I1018 L1037 G1038 L1042	L1013-N1040 PolarHBondContact O-ND2 3.38Å; N1016-N1040 WeakPolarHBondContact CA-OD1 3.43Å; N1016-N1040 WeakPolarHBondContact CB-OD1 3.42Å; N1016-N1040 PolarHBondContact O-OD1 2.87Å; N1016-N1040 VanDerWaalsContact O-OD1 3.13Å; I1018-N1040 HydrophobicContact CB-CB 4.43Å; I1018-N1040 VanDerWaalsContact CB-OD1 3.28Å; I1018-N1040 WeakPolarHBondContact CB-OD1 3.49Å; I1018-N1040 WeakPolarHBondContact CG1-OD1 3.42Å; I1018-N1040 PolarHBondContact N-OD1 3.41Å; I1018-N1040 VanDerWaalsContact N-OD1 3.14Å; L1037-N1040 PolarHBondContact O-ND2 3.42Å; L1037-N1040 VanDerWaalsContact O-ND2 3.12Å; G1038-N1040 PolarHBondContact O-N 2.9Å; G1038-N1040 PolarHBondContact O-ND2 2.93Å; G1038-N1040 VanDerWaalsContact O-ND2 3.14Å; N1040-L1042 HydrophobicContact CB-CD1 4.24Å; N1040-L1042 HydrophobicContact CB-CD2 4.2Å; N1040-L1042 HydrophobicContact CB-CG 3.84Å; N1040-L1042 PolarHBondContact O-N 3.1Å
1041	P	91.9	Very high	87.5	Confident	31 Å²	31	34.7 Å²	34.7	20%	0.201	19%	0.185	C	C	.	.			trans	-77.8	52.6	-178.2	33.6	-37.8	0	0	0	113.2	N1016 I1018 S1019 H1068	N1016-P1041 WeakPolarHBondContact O-CD 3.37Å; I1018-P1041 CarbonylContact O-C 3.33Å; I1018-P1041 VanDerWaalsContact O-CD 3.3Å; I1018-P1041 WeakPolarHBondContact O-CD 3.41Å; S1019-P1041 VanDerWaalsContact CA-O 3.29Å; S1019-P1041 WeakPolarHBondContact CA-O 3.18Å; S1019-P1041 WeakPolarHBondContact CB-O 3.27Å; P1041-H1068 VanDerWaalsContact C-CB 3.5Å; P1041-H1068 HydrophobicContact CB-CB 4.36Å
1042	L	91.9	Very high	87.8	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.016	17%	0.172	C	C	.	.			trans	-66.2	132.8	-170.3	-64	168.9	0	0	0	113.1	I1018 N1040 H1068 S1069 I1078	I1018-L1042 HydrophobicContact CG2-CD2 4.24Å; I1018-L1042 WeakPolarHBondContact O-CD2 3.19Å; N1040-L1042 HydrophobicContact CB-CD1 4.24Å; N1040-L1042 HydrophobicContact CB-CD2 4.2Å; N1040-L1042 HydrophobicContact CB-CG 3.84Å; N1040-L1042 PolarHBondContact O-N 3.1Å; L1042-H1068 PolarHBondContact O-N 3.33Å; L1042-S1069 PolarHBondContact O-N 3Å; L1042-I1078 HydrophobicContact CB-CD1 4.42Å; L1042-I1078 HydrophobicContact CD1-CD1 3.58Å
1043	H	89.5	Confident	87.7	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.019	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-97.8	121.9	173.3	-169.8	85.7	0	0	0	110.1	S1019 D1045 T1048 S1069 E1144 I1148	S1019-H1043 WeakPolarHBondContact O-CB 3.43Å; S1019-H1043 PolarHBondContact O-N 3.03Å; H1043-D1045 VanDerWaalsContact CD2-CG 3.47Å; H1043-D1045 IonicContact CD2-OD1 3.87Å; H1043-D1045 IonicContact CD2-OD2 3.21Å; H1043-D1045 IonicContact NE2-OD2 2.67Å; H1043-T1048 VanDerWaalsContact O-CG2 3.26Å; H1043-T1048 WeakPolarHBondContact O-CG2 3.38Å; H1043-T1048 PolarHBondContact O-OG1 3.47Å; H1043-S1069 CarbonylContact C-O 3.46Å; H1043-S1069 WeakPolarHBondContact CA-O 3.19Å; H1043-S1069 WeakPolarHBondContact ND1-CB 3.09Å; H1043-S1069 PolarHBondContact ND1-OG 2.93Å; H1043-E1144 IonicContact CE1-OE2 3.62Å; H1043-I1148 HydrophobicContact CB-CD1 3.5Å; H1043-I1148 WeakPolarHBondContact ND1-CD1 3.4Å
1044	C	89.8	Confident	87.9	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.007	16%	0.156	C	C	.	.			trans	-106.2	51.1	-169.1	-70	0	0	0	0	112.8	T1048 C1067 S1069 M1073 F1086	C1044-T1048 WeakPolarHBondContact CA-OG1 3.25Å; C1044-C1067 HydrophobicContact CB-CB 3.76Å; C1044-C1067 WeakPolarHBondContact CB-SG 3.37Å; C1044-C1067 WeakPolarHBondContact SG-CB 3.34Å; C1044-C1067 CovalentContact SG-SG 2.02Å; C1044-C1067 PolarHBondContact SG-SG 3.03Å; C1044-S1069 PolarHBondContact N-O 3.33Å; C1044-M1073 HydrophobicContact CB-CB 3.89Å; C1044-M1073 HydrophobicContact CB-CE 3.82Å; C1044-M1073 HydrophobicContact CB-CG 4.11Å; C1044-F1086 HydrophobicContact CB-CD1 3.95Å; C1044-F1086 HydrophobicContact CB-CE1 3.64Å; C1044-F1086 WeakPolarHBondContact O-CD1 3.49Å
1045	D	87.9	Confident	88	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	14%	0.135	C	C	.	.	S	Bend	trans	-86	-170.2	169.5	75.2	-0.9	0	0	0	111.6	H1043 T1047 T1048 K1049 F1086 S1145	H1043-D1045 VanDerWaalsContact CD2-CG 3.47Å; H1043-D1045 IonicContact CD2-OD1 3.87Å; H1043-D1045 IonicContact CD2-OD2 3.21Å; H1043-D1045 IonicContact NE2-OD2 2.67Å; D1045-T1047 PolarHBondContact O-N 2.8Å; D1045-T1047 VanDerWaalsContact O-N 3.15Å; D1045-T1047 WeakPolarHBondContact OD1-CA 3.09Å; D1045-T1047 VanDerWaalsContact OD1-CB 3.24Å; D1045-T1047 WeakPolarHBondContact OD1-CB 3.49Å; D1045-T1047 WeakPolarHBondContact OD1-CG2 3.26Å; D1045-T1047 PolarHBondContact OD1-N 3Å; D1045-T1047 PolarHBondContact OD1-OG1 2.93Å; D1045-T1048 PolarHBondContact O-N 3.05Å; D1045-T1048 PolarHBondContact O-OG1 2.79Å; D1045-K1049 PolarHBondContact O-N 3.23Å; D1045-F1086 WeakPolarHBondContact O-CB 3.44Å; D1045-F1086 WeakPolarHBondContact O-CD1 3.42Å; D1045-S1145 PolarHBondContact OD2-OG 2.9Å
1046	C	84.5	Confident	87.6	Confident	60 Å²	60	28.9 Å²	28.9	41%	0.405	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.7	179.1	78.7	0	0	0	0	114.3	K1049 F1086 C1088	C1046-K1049 VanDerWaalsContact O-CB 3.28Å; C1046-K1049 WeakPolarHBondContact O-CB 3.37Å; C1046-F1086 WeakPolarHBondContact CA-O 3.08Å; C1046-C1088 VanDerWaalsContact CA-SG 3.55Å; C1046-C1088 HydrophobicContact CB-CB 3.89Å; C1046-C1088 WeakPolarHBondContact CB-SG 2.81Å; C1046-C1088 PolarHBondContact N-SG 2.98Å; C1046-C1088 WeakPolarHBondContact SG-CB 3.1Å; C1046-C1088 CovalentContact SG-SG 2.03Å; C1046-C1088 PolarHBondContact SG-SG 3.49Å
1047	T	82.4	Confident	87	Confident	73 Å²	73	35.2 Å²	35.2	45%	0.448	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-26.8	180	73.2	0	0	0	0	112.6	D1045 W1050	D1045-T1047 PolarHBondContact O-N 2.8Å; D1045-T1047 VanDerWaalsContact O-N 3.15Å; D1045-T1047 WeakPolarHBondContact OD1-CA 3.09Å; D1045-T1047 VanDerWaalsContact OD1-CB 3.24Å; D1045-T1047 WeakPolarHBondContact OD1-CB 3.49Å; D1045-T1047 WeakPolarHBondContact OD1-CG2 3.26Å; D1045-T1047 PolarHBondContact OD1-N 3Å; D1045-T1047 PolarHBondContact OD1-OG1 2.93Å; T1047-W1050 PolarHBondContact O-NE1 3.22Å
1048	T	85.8	Confident	86.1	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.031	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-0.2	176.2	54.5	0	0	0	0	113.3	H1043 C1044 D1045 W1050 L1051	H1043-T1048 VanDerWaalsContact O-CG2 3.26Å; H1043-T1048 WeakPolarHBondContact O-CG2 3.38Å; H1043-T1048 PolarHBondContact O-OG1 3.47Å; C1044-T1048 WeakPolarHBondContact CA-OG1 3.25Å; D1045-T1048 PolarHBondContact O-N 3.05Å; D1045-T1048 PolarHBondContact O-OG1 2.79Å; T1048-W1050 PolarHBondContact O-N 3.34Å; T1048-L1051 VanDerWaalsContact O-CB 3.25Å; T1048-L1051 WeakPolarHBondContact O-CB 3.32Å; T1048-L1051 PolarHBondContact O-N 2.82Å
1049	K	86.7	Confident	85.2	Confident	91 Å²	91	46.3 Å²	46.3	40%	0.396	23%	0.23	S	C	.	.	H	α-helix	trans	-49.1	-33.1	173.1	-178.8	168.4	170.1	155	0	114.2	D1045 C1046 L1051 N1052 G1053 P1083 F1086	D1045-K1049 PolarHBondContact O-N 3.23Å; C1046-K1049 VanDerWaalsContact O-CB 3.28Å; C1046-K1049 WeakPolarHBondContact O-CB 3.37Å; K1049-L1051 PolarHBondContact O-N 3.3Å; K1049-N1052 PolarHBondContact O-N 2.92Å; K1049-G1053 PolarHBondContact O-N 2.66Å; K1049-P1083 WeakPolarHBondContact CE-O 3.36Å; K1049-P1083 PolarHBondContact NZ-O 2.97Å; K1049-F1086 HydrophobicContact CB-CB 3.73Å; K1049-F1086 HydrophobicContact CB-CG 4.18Å; K1049-F1086 HydrophobicContact CD-CB 4.21Å; K1049-F1086 HydrophobicContact CG-CB 4.02Å; K1049-F1086 HydrophobicContact CG-CG 4.5Å
1050	W	89.5	Confident	84.2	Confident	39 Å²	39	41.8 Å²	41.8	15%	0.148	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-30.1	177.1	74.5	-91.3	0	0	0	112.4	I1021 P1022 Q1023 F1026 T1047 T1048 G1053 F1054	I1021-W1050 HydrophobicContact CB-CZ2 4.01Å; I1021-W1050 HydrophobicContact CG2-CH2 4.21Å; I1021-W1050 HydrophobicContact CG2-CZ2 3.79Å; I1021-W1050 WeakPolarHBondContact O-CZ2 3.23Å; I1021-W1050 PolarHBondContact O-NE1 3.49Å; P1022-W1050 WeakPolarHBondContact O-CZ2 3.29Å; Q1023-W1050 HydrophobicContact CB-CD2 4.38Å; Q1023-W1050 HydrophobicContact CB-CG 3.96Å; Q1023-W1050 HydrophobicContact CG-CB 4.13Å; Q1023-W1050 HydrophobicContact CG-CD2 4.33Å; Q1023-W1050 HydrophobicContact CG-CG 3.91Å; F1026-W1050 HydrophobicContact CB-CZ3 4.5Å; F1026-W1050 AromaticContact CD2-CH2 3.48Å; F1026-W1050 HydrophobicContact CD2-CH2 3.48Å; F1026-W1050 VanDerWaalsContact CD2-CH2 3.48Å; F1026-W1050 AromaticContact CD2-CZ3 3.74Å; F1026-W1050 HydrophobicContact CD2-CZ3 3.74Å; F1026-W1050 AromaticContact CE2-CH2 3.79Å; F1026-W1050 HydrophobicContact CE2-CH2 3.79Å; F1026-W1050 HydrophobicContact CE2-CZ3 4.38Å; F1026-W1050 HydrophobicContact CG-CH2 4.12Å; F1026-W1050 HydrophobicContact CG-CZ3 4.42Å; T1047-W1050 PolarHBondContact O-NE1 3.22Å; T1048-W1050 PolarHBondContact O-N 3.34Å; W1050-G1053 CarbonylContact O-C 3.51Å; W1050-G1053 PolarHBondContact O-N 2.71Å; W1050-F1054 HydrophobicContact CE3-CB 4.16Å; W1050-F1054 HydrophobicContact CZ3-CB 4.16Å; W1050-F1054 HydrophobicContact CZ3-CD2 4.46Å; W1050-F1054 HydrophobicContact CZ3-CG 4.22Å; W1050-F1054 WeakPolarHBondContact O-CB 3.06Å; W1050-F1054 PolarHBondContact O-N 3.09Å
1051	L	90.1	Very high	82.9	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-71.7	-37.3	-179.1	-173.7	63	0	0	0	111.7	F1026 L1037 T1048 K1049 G1053 F1054 F1055 I1078	F1026-L1051 HydrophobicContact CD2-CD1 4.47Å; F1026-L1051 HydrophobicContact CE2-CD1 3.88Å; L1037-L1051 HydrophobicContact CD1-CD1 4.31Å; L1037-L1051 HydrophobicContact CD1-CD2 4.27Å; T1048-L1051 VanDerWaalsContact O-CB 3.25Å; T1048-L1051 WeakPolarHBondContact O-CB 3.32Å; T1048-L1051 PolarHBondContact O-N 2.82Å; K1049-L1051 PolarHBondContact O-N 3.3Å; L1051-G1053 VanDerWaalsContact C-N 3.32Å; L1051-G1053 PolarHBondContact O-N 3.41Å; L1051-F1054 HydrophobicContact CD1-CD1 4.46Å; L1051-F1054 PolarHBondContact O-N 3.26Å; L1051-F1055 HydrophobicContact CD1-CD1 4.49Å; L1051-F1055 HydrophobicContact CD1-CE1 4.15Å; L1051-F1055 HydrophobicContact CD1-CZ 4.19Å; L1051-F1055 HydrophobicContact CD2-CZ 4.49Å; L1051-F1055 HydrophobicContact CG-CE2 4.17Å; L1051-F1055 HydrophobicContact CG-CZ 4.24Å; L1051-F1055 PolarHBondContact O-N 2.79Å; L1051-I1078 HydrophobicContact CD2-CD1 4.32Å; L1051-I1078 HydrophobicContact CG-CG2 4.41Å
1052	N	89.9	Confident	81.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-57.2	-45.4	167.7	167	-99.5	0	0	0	111.3	K1049 R1056 I1078 S1081 P1083 F1086	K1049-N1052 PolarHBondContact O-N 2.92Å; N1052-R1056 PolarHBondContact ND2-NE 2.8Å; N1052-R1056 WeakPolarHBondContact O-CB 3.47Å; N1052-R1056 VanDerWaalsContact O-CG 3.28Å; N1052-R1056 WeakPolarHBondContact O-CG 3.39Å; N1052-R1056 PolarHBondContact O-N 3.28Å; N1052-R1056 VanDerWaalsContact O-N 3.13Å; N1052-I1078 HydrophobicContact CB-CG2 4.21Å; N1052-I1078 PolarHBondContact ND2-O 2.83Å; N1052-S1081 PolarHBondContact ND2-O 3.02Å; N1052-P1083 WeakPolarHBondContact OD1-CG 3.41Å; N1052-F1086 HydrophobicContact CB-CD2 4.31Å; N1052-F1086 HydrophobicContact CB-CE1 4.45Å; N1052-F1086 HydrophobicContact CB-CE2 3.61Å; N1052-F1086 HydrophobicContact CB-CZ 3.7Å
1053	G	85.4	Confident	79.7	Confident	23 Å²	23	47.5 Å²	47.5	24%	0.237	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-44.3	173	0	0	0	0	0	112.9	K1049 W1050 L1051 R1056 Q1057	K1049-G1053 PolarHBondContact O-N 2.66Å; W1050-G1053 CarbonylContact O-C 3.51Å; W1050-G1053 PolarHBondContact O-N 2.71Å; L1051-G1053 VanDerWaalsContact C-N 3.32Å; L1051-G1053 PolarHBondContact O-N 3.41Å; G1053-R1056 PolarHBondContact O-N 3.26Å; G1053-Q1057 WeakPolarHBondContact O-CB 3.34Å; G1053-Q1057 VanDerWaalsContact O-CG 3.3Å; G1053-Q1057 WeakPolarHBondContact O-CG 3.46Å; G1053-Q1057 PolarHBondContact O-N 2.8Å
1054	F	86.5	Confident	79	Confident	32 Å²	32	51 Å²	51	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-46.1	-178.6	-175.2	-98.6	0	0	0	112.9	F1026 L1032 L1035 W1050 L1051 N1058 L1060	F1026-F1054 HydrophobicContact CB-CE1 4.35Å; F1026-F1054 HydrophobicContact CB-CE2 3.94Å; F1026-F1054 HydrophobicContact CB-CZ 3.77Å; F1026-F1054 AromaticContact CD2-CD1 3.95Å; F1026-F1054 HydrophobicContact CD2-CD1 3.95Å; F1026-F1054 AromaticContact CD2-CE1 3.62Å; F1026-F1054 HydrophobicContact CD2-CE1 3.62Å; F1026-F1054 AromaticContact CD2-CZ 3.94Å; F1026-F1054 HydrophobicContact CD2-CZ 3.94Å; F1026-F1054 HydrophobicContact CE2-CE1 4.34Å; F1026-F1054 HydrophobicContact CG-CE1 4.33Å; F1026-F1054 HydrophobicContact CG-CZ 4.22Å; L1032-F1054 HydrophobicContact CD2-CE1 4.09Å; L1032-F1054 HydrophobicContact CD2-CZ 4.02Å; L1035-F1054 HydrophobicContact CD2-CD1 4.35Å; L1035-F1054 HydrophobicContact CD2-CE1 3.85Å; W1050-F1054 HydrophobicContact CE3-CB 4.16Å; W1050-F1054 HydrophobicContact CZ3-CB 4.16Å; W1050-F1054 HydrophobicContact CZ3-CD2 4.46Å; W1050-F1054 HydrophobicContact CZ3-CG 4.22Å; W1050-F1054 WeakPolarHBondContact O-CB 3.06Å; W1050-F1054 PolarHBondContact O-N 3.09Å; L1051-F1054 HydrophobicContact CD1-CD1 4.46Å; L1051-F1054 PolarHBondContact O-N 3.26Å; F1054-N1058 WeakPolarHBondContact CD2-ND2 3.43Å; F1054-N1058 WeakPolarHBondContact CE2-ND2 3.49Å; F1054-N1058 WeakPolarHBondContact O-CB 3.49Å; F1054-N1058 PolarHBondContact O-N 3.12Å; F1054-N1058 PolarHBondContact O-ND2 3.39Å; F1054-N1058 VanDerWaalsContact O-ND2 3.15Å; F1054-L1060 HydrophobicContact CD1-CD1 3.97Å; F1054-L1060 HydrophobicContact CE1-CD1 3.37Å; F1054-L1060 HydrophobicContact CZ-CD1 3.98Å
1055	F	85.6	Confident	78.8	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-42.8	174.2	-70.1	-27.7	0	0	0	111.7	L1035 L1037 L1051 N1058 F1059 L1060 D1061 I1078 Y1079	L1035-F1055 HydrophobicContact CD2-CD1 4.48Å; L1035-F1055 HydrophobicContact CD2-CE1 3.78Å; L1035-F1055 HydrophobicContact CG-CE1 4.14Å; L1037-F1055 HydrophobicContact CB-CZ 4.41Å; L1037-F1055 HydrophobicContact CD1-CE1 4.31Å; L1037-F1055 HydrophobicContact CD1-CZ 3.95Å; L1051-F1055 HydrophobicContact CD1-CD1 4.49Å; L1051-F1055 HydrophobicContact CD1-CE1 4.15Å; L1051-F1055 HydrophobicContact CD1-CZ 4.19Å; L1051-F1055 HydrophobicContact CD2-CZ 4.49Å; L1051-F1055 HydrophobicContact CG-CE2 4.17Å; L1051-F1055 HydrophobicContact CG-CZ 4.24Å; L1051-F1055 PolarHBondContact O-N 2.79Å; F1055-N1058 PolarHBondContact O-N 2.96Å; F1055-F1059 WeakPolarHBondContact O-CA 3.2Å; F1055-F1059 PolarHBondContact O-N 3.04Å; F1055-L1060 HydrophobicContact CD1-CB 4.2Å; F1055-D1061 HydrophobicContact CD1-CB 4.22Å; F1055-D1061 HydrophobicContact CD2-CB 4.21Å; F1055-D1061 HydrophobicContact CE1-CB 4.23Å; F1055-D1061 HydrophobicContact CE2-CB 4.25Å; F1055-D1061 HydrophobicContact CG-CB 4.2Å; F1055-D1061 HydrophobicContact CZ-CB 4.25Å; F1055-I1078 HydrophobicContact CD2-CB 4.21Å; F1055-I1078 HydrophobicContact CD2-CG2 3.7Å; F1055-I1078 HydrophobicContact CE2-CB 4.03Å; F1055-I1078 HydrophobicContact CE2-CG2 3.77Å; F1055-Y1079 HydrophobicContact CB-CD2 3.92Å
1056	R	81.1	Confident	78.8	Confident	98 Å²	98	54.2 Å²	54.2	37%	0.37	28%	0.275	S	S	.	.	H	α-helix	trans	-67.6	-35.6	179.8	-75.3	176.6	169.2	-133.5	-4.9	113.9	N1052 G1053 Y1079 H1080 S1081	N1052-R1056 PolarHBondContact ND2-NE 2.8Å; N1052-R1056 WeakPolarHBondContact O-CB 3.47Å; N1052-R1056 VanDerWaalsContact O-CG 3.28Å; N1052-R1056 WeakPolarHBondContact O-CG 3.39Å; N1052-R1056 PolarHBondContact O-N 3.28Å; N1052-R1056 VanDerWaalsContact O-N 3.13Å; G1053-R1056 PolarHBondContact O-N 3.26Å; R1056-Y1079 HydrophobicContact CG-CD2 4.01Å; R1056-Y1079 HydrophobicContact CG-CE2 4.13Å; R1056-Y1079 PolarHBondContact NE-O 3.17Å; R1056-Y1079 PolarHBondContact NH2-O 3.43Å; R1056-Y1079 VanDerWaalsContact NH2-O 3.12Å; R1056-H1080 PolarHBondContact NH2-O 3.46Å; R1056-S1081 PolarHBondContact NH2-O 3.07Å
1057	Q	76.1	Confident	79.2	Confident	152 Å²	152	51.5 Å²	51.5	71%	0.71	26%	0.257	S	S	*	.	H	α-helix	trans	-73.9	-32.7	178.2	-74.6	177.1	8.7	0	0	112.9	G1053	G1053-Q1057 WeakPolarHBondContact O-CB 3.34Å; G1053-Q1057 VanDerWaalsContact O-CG 3.3Å; G1053-Q1057 WeakPolarHBondContact O-CG 3.46Å; G1053-Q1057 PolarHBondContact O-N 2.8Å
1058	N	71.5	Confident	79.5	Confident	77 Å²	77	52.3 Å²	52.3	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-108.8	-6.6	-170.9	-63	-49.7	0	0	0	114.6	F1054 F1055 L1060	F1054-N1058 WeakPolarHBondContact CD2-ND2 3.43Å; F1054-N1058 WeakPolarHBondContact CE2-ND2 3.49Å; F1054-N1058 WeakPolarHBondContact O-CB 3.49Å; F1054-N1058 PolarHBondContact O-N 3.12Å; F1054-N1058 PolarHBondContact O-ND2 3.39Å; F1054-N1058 VanDerWaalsContact O-ND2 3.15Å; F1055-N1058 PolarHBondContact O-N 2.96Å; N1058-L1060 HydrophobicContact CB-CD1 3.56Å; N1058-L1060 HydrophobicContact CB-CD2 4.31Å; N1058-L1060 HydrophobicContact CB-CG 3.55Å
1059	F	66.6	Low	79.3	Confident	159 Å²	159	53.2 Å²	53.2	70%	0.697	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	49.5	-178.8	-56.9	-92.2	0	0	0	113.3	F1055	F1055-F1059 WeakPolarHBondContact O-CA 3.2Å; F1055-F1059 PolarHBondContact O-N 3.04Å
1060	L	66.9	Low	79	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	25%	0.247	C	C	.	.			trans	-99	-12.2	-167.3	-68.6	173.5	0	0	0	116.6	L1032 L1035 F1054 F1055 N1058	L1032-L1060 HydrophobicContact CD2-CD1 4.28Å; L1035-L1060 HydrophobicContact CB-CB 4.39Å; L1035-L1060 HydrophobicContact CB-CD1 4.47Å; F1054-L1060 HydrophobicContact CD1-CD1 3.97Å; F1054-L1060 HydrophobicContact CE1-CD1 3.37Å; F1054-L1060 HydrophobicContact CZ-CD1 3.98Å; F1055-L1060 HydrophobicContact CD1-CB 4.2Å; N1058-L1060 HydrophobicContact CB-CD1 3.56Å; N1058-L1060 HydrophobicContact CB-CD2 4.31Å; N1058-L1060 HydrophobicContact CB-CG 3.55Å
1061	D	61	Low	78.3	Confident	15 Å²	15	52.7 Å²	52.7	8%	0.08	28%	0.275	C	S	.	.			trans	-134.3	136.8	-177.3	-174.2	-0.9	0	0	0	109.8	F1055 G1063 I1064 S1065	F1055-D1061 HydrophobicContact CD1-CB 4.22Å; F1055-D1061 HydrophobicContact CD2-CB 4.21Å; F1055-D1061 HydrophobicContact CE1-CB 4.23Å; F1055-D1061 HydrophobicContact CE2-CB 4.25Å; F1055-D1061 HydrophobicContact CG-CB 4.2Å; F1055-D1061 HydrophobicContact CZ-CB 4.25Å; D1061-G1063 PolarHBondContact O-N 2.03Å; D1061-G1063 PolarHBondContact OD1-N 3.03Å; D1061-I1064 PolarHBondContact OD1-N 2.64Å; D1061-S1065 WeakPolarHBondContact OD2-CB 3.49Å; D1061-S1065 PolarHBondContact OD2-N 3.03Å; D1061-S1065 PolarHBondContact OD2-OG 2.93Å
1062	N	55.8	Low	77.8	Confident	141 Å²	141	56.6 Å²	56.6	75%	0.754	30%	0.296	S	S	*	.	S	Bend	trans	-77.9	-7.9	175.2	-57.4	-7.6	0	0	0	112
1063	G	61.5	Low	77.7	Confident	11 Å²	11	56.5 Å²	56.5	11%	0.113	30%	0.296	C	S	.	.	S	Bend	trans	121.6	4.4	178.6	0	0	0	0	0	114.5	D1061 S1065 S1077	D1061-G1063 PolarHBondContact O-N 2.03Å; D1061-G1063 PolarHBondContact OD1-N 3.03Å; G1063-S1065 VanDerWaalsContact C-N 3.34Å; G1063-S1065 PolarHBondContact O-N 2.91Å; G1063-S1077 VanDerWaalsContact C-OG 3.3Å; G1063-S1077 WeakPolarHBondContact CA-OG 3.16Å; G1063-S1077 VanDerWaalsContact O-CB 3.29Å; G1063-S1077 WeakPolarHBondContact O-CB 3.36Å; G1063-S1077 PolarHBondContact O-OG 2.85Å
1064	I	74.4	Confident	77.7	Confident	76 Å²	76	62.5 Å²	62.5	39%	0.39	31%	0.311	S	S	.	.			trans	-75.2	-22.4	-169.2	-54.4	175.7	0	0	0	111.8	D1061 L1066	D1061-I1064 PolarHBondContact OD1-N 2.64Å; I1064-L1066 PolarHBondContact O-N 3.47Å
1065	S	84.7	Confident	77.5	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.338	C	S	.	.			trans	-74.6	92	174.4	-46.4	0	0	0	0	110.7	L1037 D1061 G1063 I1078	L1037-S1065 WeakPolarHBondContact CB-OG 3.33Å; D1061-S1065 WeakPolarHBondContact OD2-CB 3.49Å; D1061-S1065 PolarHBondContact OD2-N 3.03Å; D1061-S1065 PolarHBondContact OD2-OG 2.93Å; G1063-S1065 VanDerWaalsContact C-N 3.34Å; G1063-S1065 PolarHBondContact O-N 2.91Å; S1065-I1078 WeakPolarHBondContact O-CG1 3.22Å; S1065-I1078 PolarHBondContact O-N 2.69Å
1066	L	89.8	Confident	77.6	Confident	73 Å²	73	71.4 Å²	71.4	38%	0.382	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-87	143.4	176.9	-55.2	-173	0	0	0	112.3	I1064 L1075 K1076	I1064-L1066 PolarHBondContact O-N 3.47Å; L1066-L1075 HydrophobicContact CD1-CD2 4.22Å; L1066-K1076 WeakPolarHBondContact CA-O 3.37Å
1067	C	91.3	Very high	77.9	Confident	3 Å²	3	67.4 Å²	67.4	2%	0.02	34%	0.343	C	S	.	.			trans	-72.4	139	168.2	-62.7	0	0	0	0	111.1	C1044 M1073 R1074 L1075 K1076 I1078	C1044-C1067 HydrophobicContact CB-CB 3.76Å; C1044-C1067 WeakPolarHBondContact CB-SG 3.37Å; C1044-C1067 WeakPolarHBondContact SG-CB 3.34Å; C1044-C1067 CovalentContact SG-SG 2.02Å; C1044-C1067 PolarHBondContact SG-SG 3.03Å; C1067-M1073 HydrophobicContact CB-CB 4.13Å; C1067-M1073 WeakPolarHBondContact CB-O 3.01Å; C1067-R1074 CarbonylContact O-C 3.59Å; C1067-R1074 WeakPolarHBondContact O-CA 3.34Å; C1067-L1075 PolarHBondContact O-N 2.94Å; C1067-K1076 PolarHBondContact N-O 3.45Å; C1067-I1078 VanDerWaalsContact SG-CG1 3.52Å
1068	H	89.9	Confident	78.4	Confident	91 Å²	91	60.3 Å²	60.3	42%	0.421	31%	0.31	S	S	.	.			trans	-97.8	-36.7	173.2	-177.8	91.1	0	0	0	112.3	P1041 L1042 R1074	P1041-H1068 VanDerWaalsContact C-CB 3.5Å; P1041-H1068 HydrophobicContact CB-CB 4.36Å; L1042-H1068 PolarHBondContact O-N 3.33Å; H1068-R1074 WeakPolarHBondContact O-CB 3.27Å; H1068-R1074 WeakPolarHBondContact O-CD 3.43Å; H1068-R1074 VanDerWaalsContact O-CG 3.27Å; H1068-R1074 WeakPolarHBondContact O-CG 3.29Å
1069	S	80.5	Confident	79	Confident	23 Å²	23	59.2 Å²	59.2	16%	0.161	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-146.4	172	-179.8	55.1	0	0	0	0	110.2	L1042 H1043 C1044	L1042-S1069 PolarHBondContact O-N 3Å; H1043-S1069 CarbonylContact C-O 3.46Å; H1043-S1069 WeakPolarHBondContact CA-O 3.19Å; H1043-S1069 WeakPolarHBondContact ND1-CB 3.09Å; H1043-S1069 PolarHBondContact ND1-OG 2.93Å; C1044-S1069 PolarHBondContact N-O 3.33Å
1070	P	81.8	Confident	79.9	Confident	13 Å²	13	57.2 Å²	57.2	8%	0.084	29%	0.293	C	S	.	.	S	Bend	cis	-58	169.2	-17.6	26.6	-33.9	0	0	0	112.2	N1072 M1073 R1074	P1070-N1072 WeakPolarHBondContact CB-OD1 3.2Å; P1070-N1072 VanDerWaalsContact CG-OD1 3.32Å; P1070-N1072 WeakPolarHBondContact CG-OD1 3.19Å; P1070-N1072 PolarHBondContact O-N 2.7Å; P1070-N1072 VanDerWaalsContact O-N 3.07Å; P1070-M1073 HydrophobicContact CG-CB 4.49Å; P1070-M1073 HydrophobicContact CG-CG 4.25Å; P1070-M1073 WeakPolarHBondContact O-CA 3.07Å; P1070-M1073 PolarHBondContact O-N 3.31Å; P1070-R1074 PolarHBondContact O-N 2.85Å; P1070-R1074 VanDerWaalsContact O-N 3.11Å
1071	S	74.6	Confident	80.8	Confident	106 Å²	106	57.1 Å²	57.1	74%	0.741	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.2	-169.5	-57.4	0	0	0	0	115.1	M1073	S1071-M1073 VanDerWaalsContact C-N 3.28Å; S1071-M1073 PolarHBondContact O-N 3.48Å
1072	N	79.4	Confident	81.8	Confident	84 Å²	84	62.8 Å²	62.8	45%	0.449	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.2	174.4	65.4	-54.7	0	0	0	114.1	P1070 K1076	P1070-N1072 WeakPolarHBondContact CB-OD1 3.2Å; P1070-N1072 VanDerWaalsContact CG-OD1 3.32Å; P1070-N1072 WeakPolarHBondContact CG-OD1 3.19Å; P1070-N1072 PolarHBondContact O-N 2.7Å; P1070-N1072 VanDerWaalsContact O-N 3.07Å; N1072-K1076 VanDerWaalsContact O-CE 3.24Å; N1072-K1076 WeakPolarHBondContact O-CE 2.94Å; N1072-K1076 PolarHBondContact O-NZ 2.63Å
1073	M	87.7	Confident	83.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-17.6	176.2	-66.7	-65.7	-92.9	0	0	113	C1044 C1067 P1070 S1071 L1075 K1076 D1085 F1086	C1044-M1073 HydrophobicContact CB-CB 3.89Å; C1044-M1073 HydrophobicContact CB-CE 3.82Å; C1044-M1073 HydrophobicContact CB-CG 4.11Å; C1067-M1073 HydrophobicContact CB-CB 4.13Å; C1067-M1073 WeakPolarHBondContact CB-O 3.01Å; P1070-M1073 HydrophobicContact CG-CB 4.49Å; P1070-M1073 HydrophobicContact CG-CG 4.25Å; P1070-M1073 WeakPolarHBondContact O-CA 3.07Å; P1070-M1073 PolarHBondContact O-N 3.31Å; S1071-M1073 VanDerWaalsContact C-N 3.28Å; S1071-M1073 PolarHBondContact O-N 3.48Å; M1073-L1075 PolarHBondContact O-N 2.94Å; M1073-K1076 VanDerWaalsContact O-CB 3.25Å; M1073-K1076 WeakPolarHBondContact O-CB 3.43Å; M1073-K1076 WeakPolarHBondContact O-CG 3.46Å; M1073-K1076 PolarHBondContact O-N 2.96Å; M1073-K1076 HydrophobicContact SD-CD 4Å; M1073-D1085 HydrophobicContact CE-CB 3.72Å; M1073-D1085 HydrophobicContact SD-CB 3.7Å; M1073-F1086 HydrophobicContact CE-CD1 3.97Å; M1073-F1086 HydrophobicContact CE-CD2 3.95Å; M1073-F1086 HydrophobicContact CE-CE1 3.96Å; M1073-F1086 HydrophobicContact CE-CE2 3.92Å; M1073-F1086 HydrophobicContact CE-CG 3.96Å; M1073-F1086 HydrophobicContact CE-CZ 3.92Å
1074	R	85.3	Confident	84	Confident	149 Å²	149	62.8 Å²	62.8	56%	0.562	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	133.9	-179.5	-176.3	163.9	175	159.8	-2.8	112.8	C1067 H1068 P1070 K1076	C1067-R1074 CarbonylContact O-C 3.59Å; C1067-R1074 WeakPolarHBondContact O-CA 3.34Å; H1068-R1074 WeakPolarHBondContact O-CB 3.27Å; H1068-R1074 WeakPolarHBondContact O-CD 3.43Å; H1068-R1074 VanDerWaalsContact O-CG 3.27Å; H1068-R1074 WeakPolarHBondContact O-CG 3.29Å; P1070-R1074 PolarHBondContact O-N 2.85Å; P1070-R1074 VanDerWaalsContact O-N 3.11Å; R1074-K1076 PolarHBondContact O-N 2.66Å
1075	L	82.8	Confident	84.6	Confident	132 Å²	132	61.3 Å²	61.3	69%	0.691	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	3.3	-174.2	-60.2	172.6	0	0	0	116.5	L1066 C1067 M1073	L1066-L1075 HydrophobicContact CD1-CD2 4.22Å; C1067-L1075 PolarHBondContact O-N 2.94Å; M1073-L1075 PolarHBondContact O-N 2.94Å
1076	K	86.4	Confident	84.7	Confident	86 Å²	86	61.5 Å²	61.5	37%	0.374	32%	0.315	S	S	.	.			trans	-77.4	140.9	170.6	-62.6	-178.1	-178.3	163.1	0	111.3	L1066 C1067 N1072 M1073 R1074	L1066-K1076 WeakPolarHBondContact CA-O 3.37Å; C1067-K1076 PolarHBondContact N-O 3.45Å; N1072-K1076 VanDerWaalsContact O-CE 3.24Å; N1072-K1076 WeakPolarHBondContact O-CE 2.94Å; N1072-K1076 PolarHBondContact O-NZ 2.63Å; M1073-K1076 VanDerWaalsContact O-CB 3.25Å; M1073-K1076 WeakPolarHBondContact O-CB 3.43Å; M1073-K1076 WeakPolarHBondContact O-CG 3.46Å; M1073-K1076 PolarHBondContact O-N 2.96Å; M1073-K1076 HydrophobicContact SD-CD 4Å; R1074-K1076 PolarHBondContact O-N 2.66Å
1077	S	87	Confident	84.1	Confident	15 Å²	15	63.3 Å²	63.3	11%	0.105	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-70.8	132	171.3	179	0	0	0	0	111.6	G1063 Y1079 H1080 S1081	G1063-S1077 VanDerWaalsContact C-OG 3.3Å; G1063-S1077 WeakPolarHBondContact CA-OG 3.16Å; G1063-S1077 VanDerWaalsContact O-CB 3.29Å; G1063-S1077 WeakPolarHBondContact O-CB 3.36Å; G1063-S1077 PolarHBondContact O-OG 2.85Å; S1077-Y1079 VanDerWaalsContact C-N 3.29Å; S1077-Y1079 PolarHBondContact O-N 3.26Å; S1077-H1080 PolarHBondContact O-N 2.95Å; S1077-S1081 WeakPolarHBondContact O-CB 3.41Å; S1077-S1081 PolarHBondContact O-N 2.95Å; S1077-S1081 PolarHBondContact O-OG 2.73Å
1078	I	87.6	Confident	83.2	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.01	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-35.7	179	-68.2	171.4	0	0	0	111.2	L1042 L1051 N1052 F1055 S1065 C1067 F1086	L1042-I1078 HydrophobicContact CB-CD1 4.42Å; L1042-I1078 HydrophobicContact CD1-CD1 3.58Å; L1051-I1078 HydrophobicContact CD2-CD1 4.32Å; L1051-I1078 HydrophobicContact CG-CG2 4.41Å; N1052-I1078 HydrophobicContact CB-CG2 4.21Å; N1052-I1078 PolarHBondContact ND2-O 2.83Å; F1055-I1078 HydrophobicContact CD2-CB 4.21Å; F1055-I1078 HydrophobicContact CD2-CG2 3.7Å; F1055-I1078 HydrophobicContact CE2-CB 4.03Å; F1055-I1078 HydrophobicContact CE2-CG2 3.77Å; S1065-I1078 WeakPolarHBondContact O-CG1 3.22Å; S1065-I1078 PolarHBondContact O-N 2.69Å; C1067-I1078 VanDerWaalsContact SG-CG1 3.52Å; I1078-F1086 HydrophobicContact CG2-CZ 4.23Å
1079	Y	84.9	Confident	81.8	Confident	54 Å²	54	61.7 Å²	61.7	21%	0.212	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-48	179	179.2	-113.8	0	0	0	111.9	F1055 R1056 S1077	F1055-Y1079 HydrophobicContact CB-CD2 3.92Å; R1056-Y1079 HydrophobicContact CG-CD2 4.01Å; R1056-Y1079 HydrophobicContact CG-CE2 4.13Å; R1056-Y1079 PolarHBondContact NE-O 3.17Å; R1056-Y1079 PolarHBondContact NH2-O 3.43Å; R1056-Y1079 VanDerWaalsContact NH2-O 3.12Å; S1077-Y1079 VanDerWaalsContact C-N 3.29Å; S1077-Y1079 PolarHBondContact O-N 3.26Å
1080	H	84.2	Confident	80.2	Confident	117 Å²	117	67.1 Å²	67.1	54%	0.542	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-27.5	-176.9	-64.8	136.1	0	0	0	114.3	R1056 S1077	R1056-H1080 PolarHBondContact NH2-O 3.46Å; S1077-H1080 PolarHBondContact O-N 2.95Å
1081	S	86	Confident	78.1	Confident	9 Å²	9	76.1 Å²	76.1	6%	0.063	39%	0.386	C	S	.	.	S	Bend	trans	-59.1	149.5	177.4	-61.2	0	0	0	0	112.9	N1052 R1056 S1077	N1052-S1081 PolarHBondContact ND2-O 3.02Å; R1056-S1081 PolarHBondContact NH2-O 3.07Å; S1077-S1081 WeakPolarHBondContact O-CB 3.41Å; S1077-S1081 PolarHBondContact O-N 2.95Å; S1077-S1081 PolarHBondContact O-OG 2.73Å
1082	K	83.2	Confident	76	Confident	134 Å²	134	79.4 Å²	79.4	58%	0.583	39%	0.389	S	S	*	.			trans	-82.8	149.1	-179.7	-61.3	178.2	178.9	179.7	0	110.7	T1084 D1085 F1086	K1082-T1084 WeakPolarHBondContact CB-OG1 3.06Å; K1082-T1084 PolarHBondContact O-N 3.33Å; K1082-D1085 PolarHBondContact N-OD2 2.95Å; K1082-D1085 WeakPolarHBondContact O-CB 3.48Å; K1082-D1085 PolarHBondContact O-N 3.46Å; K1082-F1086 WeakPolarHBondContact O-CD2 3.41Å
1083	P	81.5	Confident	73.5	Confident	57 Å²	57	82.3 Å²	82.3	37%	0.37	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-12.1	174.3	-22.7	31.6	0	0	0	115.1	K1049 N1052	K1049-P1083 WeakPolarHBondContact CE-O 3.36Å; K1049-P1083 PolarHBondContact NZ-O 2.97Å; N1052-P1083 WeakPolarHBondContact OD1-CG 3.41Å
1084	T	82.3	Confident	70.5	Confident	95 Å²	95	90.1 Å²	90.1	58%	0.583	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-21.5	173.9	47.2	0	0	0	0	113.7	K1082 I1087	K1082-T1084 WeakPolarHBondContact CB-OG1 3.06Å; K1082-T1084 PolarHBondContact O-N 3.33Å; T1084-I1087 WeakPolarHBondContact O-CG1 3.23Å
1085	D	85.4	Confident	67.7	Low	44 Å²	44	90.6 Å²	90.6	24%	0.235	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-24.5	-173	-51.5	-17.3	0	0	0	111.3	M1073 K1082 I1087	M1073-D1085 HydrophobicContact CE-CB 3.72Å; M1073-D1085 HydrophobicContact SD-CB 3.7Å; K1082-D1085 PolarHBondContact N-OD2 2.95Å; K1082-D1085 WeakPolarHBondContact O-CB 3.48Å; K1082-D1085 PolarHBondContact O-N 3.46Å; D1085-I1087 PolarHBondContact O-N 3.37Å
1086	F	87.3	Confident	64.9	Low	5 Å²	5	91.7 Å²	91.7	2%	0.022	46%	0.456	C	S	.	.			trans	-78	78.7	175.9	-65	-94.9	0	0	0	110.9	C1044 D1045 C1046 K1049 N1052 M1073 I1078 K1082	C1044-F1086 HydrophobicContact CB-CD1 3.95Å; C1044-F1086 HydrophobicContact CB-CE1 3.64Å; C1044-F1086 WeakPolarHBondContact O-CD1 3.49Å; D1045-F1086 WeakPolarHBondContact O-CB 3.44Å; D1045-F1086 WeakPolarHBondContact O-CD1 3.42Å; C1046-F1086 WeakPolarHBondContact CA-O 3.08Å; K1049-F1086 HydrophobicContact CB-CB 3.73Å; K1049-F1086 HydrophobicContact CB-CG 4.18Å; K1049-F1086 HydrophobicContact CD-CB 4.21Å; K1049-F1086 HydrophobicContact CG-CB 4.02Å; K1049-F1086 HydrophobicContact CG-CG 4.5Å; N1052-F1086 HydrophobicContact CB-CD2 4.31Å; N1052-F1086 HydrophobicContact CB-CE1 4.45Å; N1052-F1086 HydrophobicContact CB-CE2 3.61Å; N1052-F1086 HydrophobicContact CB-CZ 3.7Å; M1073-F1086 HydrophobicContact CE-CD1 3.97Å; M1073-F1086 HydrophobicContact CE-CD2 3.95Å; M1073-F1086 HydrophobicContact CE-CE1 3.96Å; M1073-F1086 HydrophobicContact CE-CE2 3.92Å; M1073-F1086 HydrophobicContact CE-CG 3.96Å; M1073-F1086 HydrophobicContact CE-CZ 3.92Å; I1078-F1086 HydrophobicContact CG2-CZ 4.23Å; K1082-F1086 WeakPolarHBondContact O-CD2 3.41Å
1087	I	77	Confident	61.9	Low	111 Å²	111	94.5 Å²	94.5	57%	0.569	48%	0.475	S	S	*	.			trans	-105.1	134.3	-176.3	-57.8	173.7	0	0	0	109.6	T1084 D1085	T1084-I1087 WeakPolarHBondContact O-CG1 3.23Å; D1085-I1087 PolarHBondContact O-N 3.37Å
1088	C	71.9	Confident	58.9	Low	29 Å²	29	102.6 Å²	102.6	20%	0.196	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-95.5	155.4	163.3	-70	0	0	0	0	110.3	C1046	C1046-C1088 VanDerWaalsContact CA-SG 3.55Å; C1046-C1088 HydrophobicContact CB-CB 3.89Å; C1046-C1088 WeakPolarHBondContact CB-SG 2.81Å; C1046-C1088 PolarHBondContact N-SG 2.98Å; C1046-C1088 WeakPolarHBondContact SG-CB 3.1Å; C1046-C1088 CovalentContact SG-SG 2.03Å; C1046-C1088 PolarHBondContact SG-SG 3.49Å
1089	P	61.8	Low	55.9	Low	31 Å²	31	109.9 Å²	109.9	20%	0.201	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-52.6	143.4	158.8	25.7	-33.6	0	0	0	110.1	K1091 V1138 R1141 E1142	P1089-K1091 PolarHBondContact O-N 3.37Å; P1089-V1138 HydrophobicContact CB-CG1 4.45Å; P1089-R1141 HydrophobicContact CB-CB 4.43Å; P1089-R1141 HydrophobicContact CG-CB 4.16Å; P1089-E1142 HydrophobicContact CB-CG 3.75Å; P1089-E1142 HydrophobicContact CG-CB 4.49Å; P1089-E1142 HydrophobicContact CG-CG 3.65Å
1090	L	47	Very low	52.9	Low	137 Å²	137	115.3 Å²	115.3	72%	0.717	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-74.2	120	-166.9	-75.1	168.3	0	0	0	111.9	Q1092	L1090-Q1092 HydrophobicContact CB-CG 4.23Å; L1090-Q1092 PolarHBondContact O-N 3.02Å
1091	K	36.4	Very low	50	Low	202 Å²	202	115.2 Å²	115.2	88%	0.878	59%	0.589	S	S	*	*			trans	-67.1	80.7	154.4	-69.8	-173	176.6	-174.6	0	109.2	P1089 H1093	P1089-K1091 PolarHBondContact O-N 3.37Å; K1091-H1093 VanDerWaalsContact C-N 3.31Å; K1091-H1093 PolarHBondContact O-N 2.96Å
1092	Q	30.4	Very low	46.9	Very low	174 Å²	174	121 Å²	121	81%	0.813	63%	0.63	S	S	*	*			trans	-70.3	90.2	170.1	-86.2	-171.5	-53.4	0	0	109.6	L1090	L1090-Q1092 HydrophobicContact CB-CG 4.23Å; L1090-Q1092 PolarHBondContact O-N 3.02Å
1093	H	27	Very low	44.1	Very low	145 Å²	145	119.1 Å²	119.1	67%	0.671	63%	0.633	S	S	*	*			trans	-109.7	29.5	172.6	-152.5	-62.9	0	0	0	111.9	K1091	K1091-H1093 VanDerWaalsContact C-N 3.31Å; K1091-H1093 PolarHBondContact O-N 2.96Å
1094	D	26.2	Very low	41.3	Very low	164 Å²	164	124.4 Å²	124.4	88%	0.877	66%	0.658	S	S	*	*			trans	-105.5	40.9	171.8	-73.9	-52.1	0	0	0	111.4	H1096	D1094-H1096 VanDerWaalsContact C-N 3.27Å
1095	L	24.9	Very low	38.4	Very low	160 Å²	160	127 Å²	127	84%	0.838	67%	0.673	S	S	*	*			trans	-97	53.9	159	-161.5	75.9	0	0	0	109.8
1096	H	24.5	Very low	35.4	Very low	154 Å²	154	129.8 Å²	129.8	71%	0.713	70%	0.696	S	S	*	*			trans	-111.5	63.3	170.1	-91.3	-57.1	0	0	0	110.7	D1094	D1094-H1096 VanDerWaalsContact C-N 3.27Å
1097	N	24.7	Very low	32.3	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	74%	0.74	S	S	*	*	S	Bend	trans	-141	135.7	146.5	-97.7	-28.7	0	0	0	107.9
1098	E	23	Very low	29.7	Very low	184 Å²	184	143.7 Å²	143.7	86%	0.86	75%	0.753	S	S	*	*	S	Bend	trans	56.2	88.8	175.2	-59.9	-174.9	-157.9	0	0	116.9
1099	I	25.3	Very low	27.5	Very low	155 Å²	155	151.5 Å²	151.5	80%	0.795	79%	0.786	S	S	*	*				-164	128	103	-91.2	151.5	0	0	0	109.2
1100	N	21.3	Very low	25.6	Very low	168 Å²	168	157.1 Å²	157.1	90%	0.898	82%	0.815	S	S	*	*			trans	-89.5	110.9	173.2	-91.1	-33.8	0	0	0	110.5
1101	T	23.7	Very low	24.5	Very low	116 Å²	116	157.9 Å²	157.9	71%	0.712	82%	0.819	S	S	*	*			trans	-143.2	93.5	156.6	46.6	0	0	0	0	110.8	S1103	T1101-S1103 PolarHBondContact O-N 3.03Å
1102	S	20.4	Very low	23.8	Very low	131 Å²	131	156 Å²	156	92%	0.916	82%	0.817	S	S	*	*			trans	-81.1	56.4	179.1	48.9	0	0	0	0	113.1
1103	S	23.6	Very low	23.4	Very low	94 Å²	94	157.5 Å²	157.5	66%	0.657	82%	0.817	S	S	*	*			trans	-157.7	103.3	174.3	47.5	0	0	0	0	113.3	T1101	T1101-S1103 PolarHBondContact O-N 3.03Å
1104	L	22.6	Very low	23.2	Very low	168 Å²	168	159.8 Å²	159.8	88%	0.88	83%	0.826	S	S	*	*			trans	176.7	40.4	140.8	-95.9	161.9	0	0	0	113.1	S1106	L1104-S1106 VanDerWaalsContact C-N 3.31Å; L1104-S1106 PolarHBondContact O-N 3.47Å
1105	V	22	Very low	22.9	Very low	149 Å²	149	160 Å²	160	90%	0.903	82%	0.821	S	S	*	*			trans	-74.9	86.7	163.6	-179.8	0	0	0	0	108.3
1106	S	22.5	Very low	22.9	Very low	102 Å²	102	159.3 Å²	159.3	71%	0.713	82%	0.818	S	S	*	*			trans	171.7	82.9	153.1	-81.7	0	0	0	0	113.5	L1104	L1104-S1106 VanDerWaalsContact C-N 3.31Å; L1104-S1106 PolarHBondContact O-N 3.47Å
1107	R	22.2	Very low	22.8	Very low	250 Å²	250	157 Å²	157	94%	0.943	83%	0.826	S	S	*	*			trans	178.7	135.7	130.2	-100.7	165	-176.9	176.8	1.3	110.9
1108	N	22.9	Very low	22.7	Very low	159 Å²	159	159 Å²	159	85%	0.85	83%	0.828	S	S	*	*			trans	-75.4	127	164	-61.2	-32.2	0	0	0	108.2
1109	E	24.6	Very low	22.6	Very low	192 Å²	192	158.5 Å²	158.5	90%	0.897	83%	0.829	S	S	*	*				-167.1	148.6	124.2	-106	165	-151.4	0	0	109.8
1110	N	23.5	Very low	22.5	Very low	150 Å²	150	155.5 Å²	155.5	80%	0.802	82%	0.822	S	S	*	*			trans	-91.2	162.8	-170.5	-67.3	-68	0	0	0	112
1111	L	23.4	Very low	22.5	Very low	152 Å²	152	154.4 Å²	154.4	80%	0.796	82%	0.816	S	S	*	*			trans	73.8	84.1	163.8	-58.4	142.4	0	0	0	116.7
1112	L	21.6	Very low	22.5	Very low	162 Å²	162	156.8 Å²	156.8	85%	0.848	82%	0.819	S	S	*	*			trans	-152.3	79.2	149.9	-117.4	157.6	0	0	0	111.5
1113	Y	21.3	Very low	22.8	Very low	207 Å²	207	157.8 Å²	157.8	81%	0.812	81%	0.809	S	S	*	*			trans	-142.8	154.2	166.2	-127.3	-99.4	0	0	0	109
1114	F	23.4	Very low	22.9	Very low	193 Å²	193	160 Å²	160	85%	0.846	81%	0.814	S	S	*	*	S	Bend	trans	68	53.2	-171.8	-52.4	-70.2	0	0	0	116.5
1115	Q	20.6	Very low	23.2	Very low	168 Å²	168	161.4 Å²	161.4	79%	0.785	82%	0.815	S	S	*	*			trans	-124.1	154.2	140.7	-75.2	-166.4	-16.3	0	0	109.8
1116	N	23.1	Very low	23.2	Very low	145 Å²	145	162.7 Å²	162.7	78%	0.775	81%	0.812	S	S	*	*			trans	67.2	57.4	174	-56.5	-25.2	0	0	0	117.7
1117	A	23.3	Very low	23.5	Very low	107 Å²	107	165.1 Å²	165.1	88%	0.884	82%	0.817	S	S	*	*			trans	-103.4	75.1	142.4	0	0	0	0	0	108.3
1118	K	22.2	Very low	23.7	Very low	188 Å²	188	161.9 Å²	161.9	82%	0.817	81%	0.812	S	S	*	*			trans	-79.9	137	-179.5	-120.9	-175.5	-179.4	-175.6	0	109.7	S1120	K1118-S1120 PolarHBondContact O-N 2.94Å
1119	I	21.6	Very low	23.8	Very low	173 Å²	173	162.2 Å²	162.2	89%	0.887	81%	0.812	S	S	*	*			trans	-76.7	120.3	173.3	-61.4	164.8	0	0	0	108.1
1120	S	22.2	Very low	24.1	Very low	91 Å²	91	158.5 Å²	158.5	64%	0.636	81%	0.808	S	S	*	*			trans	-153.1	101.7	166.9	57.2	0	0	0	0	110.8	K1118	K1118-S1120 PolarHBondContact O-N 2.94Å
1121	D	22.3	Very low	24.5	Very low	145 Å²	145	156.4 Å²	156.4	78%	0.775	80%	0.796	S	S	*	*			trans	70.6	144.1	142.6	-57.6	-51.6	0	0	0	123.3
1122	Q	24.2	Very low	25.2	Very low	166 Å²	166	153.2 Å²	153.2	78%	0.776	79%	0.787	S	S	*	*			trans	84.3	118.2	150.8	-78.2	174.9	28.2	0	0	122.6
1123	H	26.6	Very low	25.8	Very low	152 Å²	152	153.6 Å²	153.6	70%	0.704	78%	0.781	S	S	*	*			trans	69.2	109	146.2	-67	-59.7	0	0	0	121.8
1124	N	24	Very low	26.8	Very low	142 Å²	142	146.1 Å²	146.1	76%	0.759	76%	0.759	S	S	*	*			trans	33	95.3	130.1	-65.1	5.3	0	0	0	117.7
1125	H	29.5	Very low	27.8	Very low	196 Å²	196	142.3 Å²	142.3	91%	0.907	75%	0.747	S	S	*	*				-138.8	138.1	119.3	-95.8	-78.2	0	0	0	109.3
1126	Q	23.3	Very low	29.1	Very low	177 Å²	177	139.1 Å²	139.1	83%	0.827	73%	0.732	S	S	*	*			trans	-79.6	179.2	172	-69.5	167	-83.9	0	0	109.8
1127	D	27.1	Very low	30.2	Very low	153 Å²	153	137.3 Å²	137.3	82%	0.818	72%	0.719	S	S	*	*			trans	77.1	37.4	168.7	-52.1	-22.9	0	0	0	119.7
1128	Q	26.5	Very low	31.6	Very low	182 Å²	182	135.5 Å²	135.5	85%	0.85	70%	0.697	S	S	*	*			trans	-142.6	86	146.8	-76.4	-151.6	25.6	0	0	113.8
1129	I	26.3	Very low	33.1	Very low	165 Å²	165	130 Å²	130	85%	0.846	68%	0.675	S	S	*	*			trans	-128.8	65.3	169.6	-47.9	-178.1	0	0	0	110.7
1130	S	29.4	Very low	34.8	Very low	115 Å²	115	125.3 Å²	125.3	80%	0.804	65%	0.653	S	S	*	*	S	Bend	trans	-135.2	-21.9	176.3	-58.1	0	0	0	0	115.1
1131	N	33.2	Very low	36.1	Very low	106 Å²	106	126.1 Å²	126.1	57%	0.567	64%	0.642	S	S	*	*	S	Bend	trans	-113.2	13.2	-160.6	-132	-3.6	0	0	0	115.5	S1134 I1135	N1131-S1134 PolarHBondContact O-OG 2.88Å; N1131-S1134 PolarHBondContact OD1-OG 3.33Å; N1131-I1135 WeakPolarHBondContact O-CG1 3.15Å
1132	S	37.1	Very low	37.9	Very low	85 Å²	85	123.3 Å²	123.3	59%	0.594	62%	0.624	S	S	*	*	H	α-helix	trans	-80.4	-32.1	179.4	56.5	0	0	0	0	113.7	Q1136	S1132-Q1136 PolarHBondContact O-N 2.95Å
1133	K	35.1	Very low	39.6	Very low	169 Å²	169	120.8 Å²	120.8	74%	0.735	61%	0.61	S	S	*	*	H	α-helix	trans	-67.9	-42.2	178.8	-78.3	-172.6	173.7	-178.6	0	112.8	Q1136 E1137	K1133-Q1136 PolarHBondContact O-N 3.2Å; K1133-E1137 PolarHBondContact O-N 2.57Å
1134	S	41	Very low	41.2	Very low	50 Å²	50	117.2 Å²	117.2	35%	0.35	59%	0.594	S	S	.	*	H	α-helix	trans	-60.1	-46.7	178.5	45.2	0	0	0	0	111.9	N1131 E1137 V1138	N1131-S1134 PolarHBondContact O-OG 2.88Å; N1131-S1134 PolarHBondContact OD1-OG 3.33Å; S1134-E1137 PolarHBondContact O-N 2.95Å; S1134-V1138 WeakPolarHBondContact O-CG2 3.31Å; S1134-V1138 PolarHBondContact O-N 3.44Å; S1134-V1138 VanDerWaalsContact O-N 3.08Å
1135	I	45.9	Very low	43	Very low	113 Å²	113	111.7 Å²	111.7	58%	0.579	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-42.7	179.2	-62.2	172.3	0	0	0	111.3	N1131 V1138 L1139	N1131-I1135 WeakPolarHBondContact O-CG1 3.15Å; I1135-V1138 PolarHBondContact O-N 2.82Å; I1135-L1139 WeakPolarHBondContact O-CB 3.36Å; I1135-L1139 PolarHBondContact O-N 3.13Å
1136	Q	46.9	Very low	44.7	Very low	101 Å²	101	106.5 Å²	106.5	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-33.9	176	-78.6	-66.3	-20.2	0	0	113.1	S1132 K1133 N1140	S1132-Q1136 PolarHBondContact O-N 2.95Å; K1133-Q1136 PolarHBondContact O-N 3.2Å; Q1136-N1140 VanDerWaalsContact O-CB 3.32Å; Q1136-N1140 WeakPolarHBondContact O-CB 3.42Å; Q1136-N1140 VanDerWaalsContact O-CG 3.24Å; Q1136-N1140 PolarHBondContact O-N 2.95Å; Q1136-N1140 PolarHBondContact O-ND2 2.03Å
1137	E	45.9	Very low	46.8	Very low	107 Å²	107	102.6 Å²	102.6	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-40.9	171.5	-82.2	-165.2	-151.8	0	0	112.7	K1133 S1134 R1141	K1133-E1137 PolarHBondContact O-N 2.57Å; S1134-E1137 PolarHBondContact O-N 2.95Å; E1137-R1141 VanDerWaalsContact O-CG 3.26Å; E1137-R1141 WeakPolarHBondContact O-CG 3.45Å; E1137-R1141 PolarHBondContact O-N 3.01Å; E1137-R1141 VanDerWaalsContact O-N 3.09Å; E1137-R1141 IonicContact OE2-CZ 3.75Å; E1137-R1141 IonicContact OE2-NH2 2.79Å; E1137-R1141 PolarHBondContact OE2-NH2 3.16Å
1138	V	54.2	Low	48.7	Very low	70 Å²	70	96.2 Å²	96.2	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-50.1	175.7	174.5	0	0	0	0	110.6	P1089 S1134 I1135 N1140 R1141 E1142	P1089-V1138 HydrophobicContact CB-CG1 4.45Å; S1134-V1138 WeakPolarHBondContact O-CG2 3.31Å; S1134-V1138 PolarHBondContact O-N 3.44Å; S1134-V1138 VanDerWaalsContact O-N 3.08Å; I1135-V1138 PolarHBondContact O-N 2.82Å; V1138-N1140 VanDerWaalsContact C-N 3.27Å; V1138-N1140 PolarHBondContact O-N 3.03Å; V1138-R1141 PolarHBondContact O-N 2.82Å; V1138-R1141 VanDerWaalsContact O-N 3.1Å; V1138-E1142 PolarHBondContact O-N 2.95Å
1139	L	52.8	Low	50.5	Low	71 Å²	71	89.8 Å²	89.8	37%	0.372	47%	0.472	S	S	.	.	H	α-helix	trans	-60	-35.6	-179.4	-169.6	71.8	0	0	0	112.7	I1135 K1143	I1135-L1139 WeakPolarHBondContact O-CB 3.36Å; I1135-L1139 PolarHBondContact O-N 3.13Å; L1139-K1143 WeakPolarHBondContact O-CG 3.31Å; L1139-K1143 PolarHBondContact O-N 3.14Å; L1139-K1143 VanDerWaalsContact O-N 3.14Å
1140	N	56.6	Low	52.6	Low	76 Å²	76	82.4 Å²	82.4	41%	0.406	44%	0.436	S	S	.	.	H	α-helix	trans	-73.1	-37.8	175.8	-73.2	-36.4	0	0	0	112.4	Q1136 V1138 K1143 E1144	Q1136-N1140 VanDerWaalsContact O-CB 3.32Å; Q1136-N1140 WeakPolarHBondContact O-CB 3.42Å; Q1136-N1140 VanDerWaalsContact O-CG 3.24Å; Q1136-N1140 PolarHBondContact O-N 2.95Å; Q1136-N1140 PolarHBondContact O-ND2 2.03Å; V1138-N1140 VanDerWaalsContact C-N 3.27Å; V1138-N1140 PolarHBondContact O-N 3.03Å; N1140-K1143 WeakPolarHBondContact O-CB 3.26Å; N1140-K1143 PolarHBondContact O-N 3Å; N1140-E1144 PolarHBondContact O-N 3.08Å
1141	R	51.2	Low	54.4	Low	108 Å²	108	80 Å²	80	41%	0.408	41%	0.411	S	S	.	.	H	α-helix	trans	-65.1	-39.5	173.9	-69.4	171.9	-158.5	-168.2	9.2	112	P1089 E1137 V1138 E1144 S1145	P1089-R1141 HydrophobicContact CB-CB 4.43Å; P1089-R1141 HydrophobicContact CG-CB 4.16Å; E1137-R1141 VanDerWaalsContact O-CG 3.26Å; E1137-R1141 WeakPolarHBondContact O-CG 3.45Å; E1137-R1141 PolarHBondContact O-N 3.01Å; E1137-R1141 VanDerWaalsContact O-N 3.09Å; E1137-R1141 IonicContact OE2-CZ 3.75Å; E1137-R1141 IonicContact OE2-NH2 2.79Å; E1137-R1141 PolarHBondContact OE2-NH2 3.16Å; V1138-R1141 PolarHBondContact O-N 2.82Å; V1138-R1141 VanDerWaalsContact O-N 3.1Å; R1141-E1144 PolarHBondContact O-N 3.37Å; R1141-S1145 PolarHBondContact O-N 3.02Å; R1141-S1145 VanDerWaalsContact O-N 3.12Å
1142	E	58.9	Low	56.1	Low	85 Å²	85	76.2 Å²	76.2	40%	0.397	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-43.4	174.1	-70.9	-172.9	146.2	0	0	111.5	P1089 V1138 L1146	P1089-E1142 HydrophobicContact CB-CG 3.75Å; P1089-E1142 HydrophobicContact CG-CB 4.49Å; P1089-E1142 HydrophobicContact CG-CG 3.65Å; V1138-E1142 PolarHBondContact O-N 2.95Å; E1142-L1146 WeakPolarHBondContact O-CB 3.37Å; E1142-L1146 PolarHBondContact O-N 3.33Å
1143	K	61.1	Low	57.8	Low	113 Å²	113	77.4 Å²	77.4	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-59.2	-44	172.1	-78.8	176.9	177.6	174.8	0	112.6	L1139 N1140 L1146 I1147	L1139-K1143 WeakPolarHBondContact O-CG 3.31Å; L1139-K1143 PolarHBondContact O-N 3.14Å; L1139-K1143 VanDerWaalsContact O-N 3.14Å; N1140-K1143 WeakPolarHBondContact O-CB 3.26Å; N1140-K1143 PolarHBondContact O-N 3Å; K1143-L1146 PolarHBondContact O-N 3.12Å; K1143-I1147 HydrophobicContact CB-CD1 4.44Å; K1143-I1147 WeakPolarHBondContact O-CB 3.26Å; K1143-I1147 WeakPolarHBondContact O-CD1 2.95Å; K1143-I1147 WeakPolarHBondContact O-CG1 3.38Å; K1143-I1147 PolarHBondContact O-N 2.78Å
1144	E	59.2	Low	59.5	Low	77 Å²	77	70.2 Å²	70.2	36%	0.36	36%	0.361	S	S	.	.	H	α-helix	trans	-57.4	-54.9	177.8	-78.1	-176.1	-172	0	0	111.5	H1043 N1140 R1141 L1146 I1147 I1148	H1043-E1144 IonicContact CE1-OE2 3.62Å; N1140-E1144 PolarHBondContact O-N 3.08Å; R1141-E1144 PolarHBondContact O-N 3.37Å; E1144-L1146 VanDerWaalsContact C-N 3.29Å; E1144-L1146 PolarHBondContact O-N 2.73Å; E1144-I1147 PolarHBondContact O-N 3.29Å; E1144-I1148 WeakPolarHBondContact O-CD1 3.46Å; E1144-I1148 VanDerWaalsContact O-CG1 3.29Å; E1144-I1148 WeakPolarHBondContact O-CG1 3.47Å; E1144-I1148 PolarHBondContact O-N 3.23Å
1145	S	62.2	Low	61.2	Low	26 Å²	26	69.4 Å²	69.4	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-36.5	179	-61.6	0	0	0	0	112.4	D1045 R1141 I1148 A1149	D1045-S1145 PolarHBondContact OD2-OG 2.9Å; R1141-S1145 PolarHBondContact O-N 3.02Å; R1141-S1145 VanDerWaalsContact O-N 3.12Å; S1145-I1148 PolarHBondContact O-N 3.47Å; S1145-A1149 PolarHBondContact O-N 2.99Å
1146	L	65.1	Low	62.6	Low	88 Å²	88	67.6 Å²	67.6	46%	0.461	35%	0.346	S	S	.	.	H	α-helix	trans	-68.9	-41.7	176.6	-120.6	132.2	0	0	0	112.8	E1142 K1143 E1144 I1148 A1149 A1150 L1157	E1142-L1146 WeakPolarHBondContact O-CB 3.37Å; E1142-L1146 PolarHBondContact O-N 3.33Å; K1143-L1146 PolarHBondContact O-N 3.12Å; E1144-L1146 VanDerWaalsContact C-N 3.29Å; E1144-L1146 PolarHBondContact O-N 2.73Å; L1146-I1148 VanDerWaalsContact C-N 3.3Å; L1146-I1148 PolarHBondContact O-N 2.8Å; L1146-A1149 PolarHBondContact O-N 2.8Å; L1146-A1150 VanDerWaalsContact O-CB 3.29Å; L1146-A1150 WeakPolarHBondContact O-CB 3.48Å; L1146-A1150 PolarHBondContact O-N 3.32Å; L1146-L1157 HydrophobicContact CD2-CD2 3.65Å
1147	I	67.3	Low	63.8	Low	94 Å²	94	67.1 Å²	67.1	48%	0.482	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-38.5	175.7	-71.8	163.7	0	0	0	110.6	K1143 E1144 A1150 K1151 L1157	K1143-I1147 HydrophobicContact CB-CD1 4.44Å; K1143-I1147 WeakPolarHBondContact O-CB 3.26Å; K1143-I1147 WeakPolarHBondContact O-CD1 2.95Å; K1143-I1147 WeakPolarHBondContact O-CG1 3.38Å; K1143-I1147 PolarHBondContact O-N 2.78Å; E1144-I1147 PolarHBondContact O-N 3.29Å; I1147-A1150 PolarHBondContact O-N 2.81Å; I1147-K1151 PolarHBondContact O-N 2.91Å; I1147-L1157 HydrophobicContact CG1-CD1 4.32Å
1148	I	66.1	Low	65.1	Low	19 Å²	19	67.1 Å²	67.1	10%	0.097	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-45.3	178.2	-69.7	158.9	0	0	0	111.2	S1020 H1043 E1144 S1145 L1146 A1150 K1151	S1020-I1148 WeakPolarHBondContact OG-CG2 3.31Å; H1043-I1148 HydrophobicContact CB-CD1 3.5Å; H1043-I1148 WeakPolarHBondContact ND1-CD1 3.4Å; E1144-I1148 WeakPolarHBondContact O-CD1 3.46Å; E1144-I1148 VanDerWaalsContact O-CG1 3.29Å; E1144-I1148 WeakPolarHBondContact O-CG1 3.47Å; E1144-I1148 PolarHBondContact O-N 3.23Å; S1145-I1148 PolarHBondContact O-N 3.47Å; L1146-I1148 VanDerWaalsContact C-N 3.3Å; L1146-I1148 PolarHBondContact O-N 2.8Å; I1148-A1150 VanDerWaalsContact C-N 3.3Å; I1148-A1150 PolarHBondContact O-N 2.98Å; I1148-K1151 WeakPolarHBondContact O-CB 3.35Å; I1148-K1151 PolarHBondContact O-N 2.99Å
1149	A	66.1	Low	66.3	Low	47 Å²	47	64.8 Å²	64.8	39%	0.388	34%	0.336	S	S	.	.	H	α-helix	trans	-61	-39.4	174	0	0	0	0	0	112.1	S1145 L1146 K1151 C1152 L1156	S1145-A1149 PolarHBondContact O-N 2.99Å; L1146-A1149 PolarHBondContact O-N 2.8Å; A1149-K1151 VanDerWaalsContact C-N 3.28Å; A1149-K1151 PolarHBondContact O-N 3.09Å; A1149-C1152 PolarHBondContact O-N 2.89Å; A1149-L1156 HydrophobicContact CB-CD2 3.79Å
1150	A	69	Low	67.7	Low	11 Å²	11	62.2 Å²	62.2	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-68.3	-21.2	-178.5	0	0	0	0	0	114.3	L1146 I1147 I1148 C1152 M1153 L1156 L1157	L1146-A1150 VanDerWaalsContact O-CB 3.29Å; L1146-A1150 WeakPolarHBondContact O-CB 3.48Å; L1146-A1150 PolarHBondContact O-N 3.32Å; I1147-A1150 PolarHBondContact O-N 2.81Å; I1148-A1150 VanDerWaalsContact C-N 3.3Å; I1148-A1150 PolarHBondContact O-N 2.98Å; A1150-C1152 PolarHBondContact O-N 3.12Å; A1150-M1153 CarbonylContact O-C 2.98Å; A1150-M1153 VanDerWaalsContact O-C 3.24Å; A1150-M1153 PolarHBondContact O-N 2.89Å; A1150-M1153 VanDerWaalsContact O-O 3.13Å; A1150-L1156 HydrophobicContact CB-CB 4.2Å; A1150-L1156 HydrophobicContact CB-CD2 4.23Å; A1150-L1157 HydrophobicContact CB-CB 4.43Å; A1150-L1157 HydrophobicContact CB-CD1 3.42Å; A1150-L1157 VanDerWaalsContact CB-CD1 3.42Å; A1150-L1157 HydrophobicContact CB-CG 3.57Å
1151	K	68.6	Low	68.8	Low	63 Å²	63	63.4 Å²	63.4	27%	0.274	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.1	173.3	-73.6	-173.7	178.2	-178.3	0	112.5	C996 S1019 I1147 I1148 A1149 L1172	C996-K1151 PolarHBondContact SG-O 2.89Å; S1019-K1151 WeakPolarHBondContact OG-CD 3.3Å; S1019-K1151 WeakPolarHBondContact OG-CE 3.46Å; S1019-K1151 PolarHBondContact OG-NZ 3.32Å; I1147-K1151 PolarHBondContact O-N 2.91Å; I1148-K1151 WeakPolarHBondContact O-CB 3.35Å; I1148-K1151 PolarHBondContact O-N 2.99Å; A1149-K1151 VanDerWaalsContact C-N 3.28Å; A1149-K1151 PolarHBondContact O-N 3.09Å; K1151-L1172 WeakPolarHBondContact O-CD2 3.04Å
1152	C	69	Low	70.2	Confident	27 Å²	27	62 Å²	62	18%	0.182	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	6.2	-175.6	-48	0	0	0	0	113.2	C996 A1149 A1150 Q1171	C996-C1152 VanDerWaalsContact CA-SG 3.53Å; C996-C1152 HydrophobicContact CB-CB 3.77Å; C996-C1152 WeakPolarHBondContact CB-SG 3.15Å; C996-C1152 WeakPolarHBondContact SG-CA 3.47Å; C996-C1152 WeakPolarHBondContact SG-CB 3.25Å; C996-C1152 PolarHBondContact SG-N 3.03Å; C996-C1152 VanDerWaalsContact SG-N 3.35Å; C996-C1152 CovalentContact SG-SG 2.04Å; C996-C1152 PolarHBondContact SG-SG 3.42Å; A1149-C1152 PolarHBondContact O-N 2.89Å; A1150-C1152 PolarHBondContact O-N 3.12Å; C1152-Q1171 CarbonylContact C-O 3.48Å; C1152-Q1171 WeakPolarHBondContact CA-O 3.31Å
1153	M	72.4	Confident	70.8	Confident	111 Å²	111	61.3 Å²	61.3	55%	0.547	34%	0.343	S	S	.	.	S	Bend	trans	-145	79.3	179.5	-67.6	-175.2	67.6	0	0	107.4	A1150 C1155 L1156	A1150-M1153 CarbonylContact O-C 2.98Å; A1150-M1153 VanDerWaalsContact O-C 3.24Å; A1150-M1153 PolarHBondContact O-N 2.89Å; A1150-M1153 VanDerWaalsContact O-O 3.13Å; M1153-C1155 PolarHBondContact O-N 2.04Å; M1153-C1155 VanDerWaalsContact O-N 3.09Å; M1153-L1156 HydrophobicContact CB-CB 3.88Å; M1153-L1156 HydrophobicContact CB-CD2 4.39Å; M1153-L1156 HydrophobicContact CE-CD1 4.44Å; M1153-L1156 WeakPolarHBondContact O-CB 3.4Å; M1153-L1156 PolarHBondContact O-N 3.37Å
1154	P	71.2	Confident	71.8	Confident	17 Å²	17	56.5 Å²	56.5	11%	0.11	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-63	-29	-163.1	20.6	-31.8	0	0	0	113.5	L1156 P1159 A1168 Q1171 Y1174	P1154-L1156 VanDerWaalsContact C-N 3.33Å; P1154-P1159 VanDerWaalsContact O-CD 3.26Å; P1154-P1159 WeakPolarHBondContact O-CD 3.32Å; P1154-P1159 WeakPolarHBondContact O-CG 3.48Å; P1154-A1168 HydrophobicContact CG-CB 4.23Å; P1154-Q1171 WeakPolarHBondContact CD-O 3.19Å; P1154-Y1174 HydrophobicContact CB-CD1 3.52Å; P1154-Y1174 HydrophobicContact CB-CE1 4.3Å; P1154-Y1174 HydrophobicContact CB-CG 4.1Å; P1154-Y1174 HydrophobicContact CG-CD1 4.42Å
1155	C	76.7	Confident	72.7	Confident	33 Å²	33	57.2 Å²	57.2	22%	0.223	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-79.8	-5.8	175.5	-60.7	0	0	0	0	114.6	M1153 L1157 N1158 C1166	M1153-C1155 PolarHBondContact O-N 2.04Å; M1153-C1155 VanDerWaalsContact O-N 3.09Å; C1155-L1157 VanDerWaalsContact C-N 3.26Å; C1155-L1157 PolarHBondContact O-N 2.83Å; C1155-N1158 PolarHBondContact O-N 3.37Å; C1155-C1166 WeakPolarHBondContact CA-SG 3.29Å; C1155-C1166 HydrophobicContact CB-CB 3.76Å; C1155-C1166 WeakPolarHBondContact CB-SG 3.31Å; C1155-C1166 VanDerWaalsContact SG-C 3.6Å; C1155-C1166 WeakPolarHBondContact SG-CB 3.32Å; C1155-C1166 CovalentContact SG-SG 2.04Å; C1155-C1166 PolarHBondContact SG-SG 2.89Å
1156	L	74.3	Confident	73.7	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.393	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-62	-31.1	-176	-174.3	66	0	0	0	113.2	A1149 A1150 M1153 P1154	A1149-L1156 HydrophobicContact CB-CD2 3.79Å; A1150-L1156 HydrophobicContact CB-CB 4.2Å; A1150-L1156 HydrophobicContact CB-CD2 4.23Å; M1153-L1156 HydrophobicContact CB-CB 3.88Å; M1153-L1156 HydrophobicContact CB-CD2 4.39Å; M1153-L1156 HydrophobicContact CE-CD1 4.44Å; M1153-L1156 WeakPolarHBondContact O-CB 3.4Å; M1153-L1156 PolarHBondContact O-N 3.37Å; P1154-L1156 VanDerWaalsContact C-N 3.33Å
1157	L	73.1	Confident	74.4	Confident	91 Å²	91	58.8 Å²	58.8	48%	0.476	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-96.8	10.6	175.7	-73.3	172.7	0	0	0	113.6	L1146 I1147 A1150 C1155	L1146-L1157 HydrophobicContact CD2-CD2 3.65Å; I1147-L1157 HydrophobicContact CG1-CD1 4.32Å; A1150-L1157 HydrophobicContact CB-CB 4.43Å; A1150-L1157 HydrophobicContact CB-CD1 3.42Å; A1150-L1157 VanDerWaalsContact CB-CD1 3.42Å; A1150-L1157 HydrophobicContact CB-CG 3.57Å; C1155-L1157 VanDerWaalsContact C-N 3.26Å; C1155-L1157 PolarHBondContact O-N 2.83Å
1158	N	72.4	Confident	74.6	Confident	107 Å²	107	57 Å²	57	57%	0.572	34%	0.343	S	S	*	.			trans	45.6	63.6	-174.9	-67.9	-51.3	0	0	0	113	C1155 C1160	C1155-N1158 PolarHBondContact O-N 3.37Å; N1158-C1160 PolarHBondContact O-N 3.48Å; N1158-C1160 VanDerWaalsContact O-N 3.09Å
1159	P	78.3	Confident	74.9	Confident	22 Å²	22	61.1 Å²	61.1	14%	0.143	37%	0.365	C	S	.	.			trans	-65.1	-17.4	-174	29.2	-37.4	0	0	0	113.7	P1154 Q1161 Y1174 N1186	P1154-P1159 VanDerWaalsContact O-CD 3.26Å; P1154-P1159 WeakPolarHBondContact O-CD 3.32Å; P1154-P1159 WeakPolarHBondContact O-CG 3.48Å; P1159-Q1161 PolarHBondContact O-N 3.18Å; P1159-Y1174 HydrophobicContact CB-CD2 4.38Å; P1159-Y1174 HydrophobicContact CB-CE1 4.46Å; P1159-Y1174 HydrophobicContact CB-CE2 3.61Å; P1159-Y1174 HydrophobicContact CG-CD2 3.7Å; P1159-Y1174 HydrophobicContact CG-CE1 4.28Å; P1159-Y1174 HydrophobicContact CG-CE2 3.44Å; P1159-Y1174 VanDerWaalsContact CG-CE2 3.44Å; P1159-Y1174 HydrophobicContact CG-CG 4.23Å; P1159-N1186 WeakPolarHBondContact O-CB 3.09Å; P1159-N1186 PolarHBondContact O-ND2 3.1Å; P1159-N1186 VanDerWaalsContact O-ND2 3.17Å
1160	C	82.1	Confident	75.2	Confident	16 Å²	16	61.9 Å²	61.9	11%	0.108	37%	0.365	C	S	.	.			trans	-80.1	112	178.8	-53.3	0	0	0	0	111	N1158 G1164 C1166 C1176	N1158-C1160 PolarHBondContact O-N 3.48Å; N1158-C1160 VanDerWaalsContact O-N 3.09Å; C1160-G1164 WeakPolarHBondContact CB-O 3.49Å; C1160-C1166 HydrophobicContact CB-CB 4.45Å; C1160-C1166 WeakPolarHBondContact SG-CA 3.25Å; C1160-C1166 WeakPolarHBondContact SG-CB 3.49Å; C1160-C1176 WeakPolarHBondContact CA-SG 3.3Å; C1160-C1176 HydrophobicContact CB-CB 3.71Å; C1160-C1176 WeakPolarHBondContact CB-SG 3.19Å; C1160-C1176 WeakPolarHBondContact SG-CA 3.41Å; C1160-C1176 WeakPolarHBondContact SG-CB 3.22Å; C1160-C1176 CovalentContact SG-SG 2.02Å; C1160-C1176 PolarHBondContact SG-SG 3.28Å
1161	Q	81.6	Confident	75.3	Confident	101 Å²	101	63.2 Å²	63.2	47%	0.472	37%	0.369	S	S	.	.			trans	-81.6	175.5	179.2	-55.4	-177.2	5.9	0	0	111.1	P1159 G1163 G1164 N1186	P1159-Q1161 PolarHBondContact O-N 3.18Å; Q1161-G1163 PolarHBondContact O-N 3.23Å; Q1161-G1164 PolarHBondContact O-N 3.1Å; Q1161-N1186 WeakPolarHBondContact CB-O 3.39Å; Q1161-N1186 PolarHBondContact N-O 3.47Å
1162	N	79.4	Confident	75.5	Confident	79 Å²	79	62 Å²	62	42%	0.422	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	28.5	170.9	-61.5	-49.3	0	0	0	115.3	Y1182 C1187	N1162-Y1182 HydrophobicContact CB-CD1 3.98Å; N1162-Y1182 HydrophobicContact CB-CD2 3.75Å; N1162-Y1182 HydrophobicContact CB-CE1 4.15Å; N1162-Y1182 HydrophobicContact CB-CE2 3.92Å; N1162-Y1182 HydrophobicContact CB-CG 3.79Å; N1162-C1187 PolarHBondContact ND2-O 3.3Å
1163	G	72.8	Confident	75.9	Confident	71 Å²	71	63.7 Å²	63.7	73%	0.732	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	15.9	-179.9	0	0	0	0	0	115	Q1161	Q1161-G1163 PolarHBondContact O-N 3.23Å
1164	G	80.8	Confident	76.3	Confident	11 Å²	11	60.3 Å²	60.3	11%	0.113	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-69.1	140.5	172.4	0	0	0	0	0	112.1	C1160 Q1161 S1177	C1160-G1164 WeakPolarHBondContact CB-O 3.49Å; Q1161-G1164 PolarHBondContact O-N 3.1Å; G1164-S1177 WeakPolarHBondContact CA-O 3.42Å
1165	T	79	Confident	76.4	Confident	93 Å²	93	66.1 Å²	66.1	57%	0.571	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.1	179	45.6	0	0	0	0	111.6	C1176 S1177	T1165-C1176 WeakPolarHBondContact O-CA 3.34Å; T1165-S1177 PolarHBondContact N-O 2.73Å; T1165-S1177 PolarHBondContact O-N 3.24Å; T1165-S1177 WeakPolarHBondContact OG1-CB 3.46Å
1166	C	83.4	Confident	76.7	Confident	36 Å²	36	65 Å²	65	24%	0.243	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.1	-179.9	-168.3	0	0	0	0	111.5	C1155 C1160	C1155-C1166 WeakPolarHBondContact CA-SG 3.29Å; C1155-C1166 HydrophobicContact CB-CB 3.76Å; C1155-C1166 WeakPolarHBondContact CB-SG 3.31Å; C1155-C1166 VanDerWaalsContact SG-C 3.6Å; C1155-C1166 WeakPolarHBondContact SG-CB 3.32Å; C1155-C1166 CovalentContact SG-SG 2.04Å; C1155-C1166 PolarHBondContact SG-SG 2.89Å; C1160-C1166 HydrophobicContact CB-CB 4.45Å; C1160-C1166 WeakPolarHBondContact SG-CA 3.25Å; C1160-C1166 WeakPolarHBondContact SG-CB 3.49Å
1167	L	78.1	Confident	76.7	Confident	111 Å²	111	64.8 Å²	64.8	58%	0.581	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	106.7	173.7	-118.2	157.3	0	0	0	108.3	L1169 Y1174 K1175	L1167-L1169 PolarHBondContact O-N 3.16Å; L1167-Y1174 CarbonylContact O-C 3.49Å; L1167-Y1174 WeakPolarHBondContact O-CA 3.41Å; L1167-K1175 WeakPolarHBondContact CB-O 3.05Å; L1167-K1175 PolarHBondContact N-O 3.47Å; L1167-K1175 PolarHBondContact O-N 3.09Å
1168	A	72.2	Confident	77	Confident	57 Å²	57	62.2 Å²	62.2	47%	0.471	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	124.4	173.7	0	0	0	0	0	109.5	P1154	P1154-A1168 HydrophobicContact CG-CB 4.23Å
1169	L	72.8	Confident	77	Confident	104 Å²	104	64.5 Å²	64.5	55%	0.545	37%	0.369	S	S	.	.			trans	-95.9	-38.6	177.7	-60.7	-176.8	0	0	0	111.1	L1167 D1173 K1175	L1167-L1169 PolarHBondContact O-N 3.16Å; L1169-D1173 PolarHBondContact N-O 2.94Å; L1169-K1175 HydrophobicContact CD1-CB 4.02Å; L1169-K1175 HydrophobicContact CD2-CB 4.27Å; L1169-K1175 HydrophobicContact CG-CB 4.19Å
1170	T	71.6	Confident	75.7	Confident	64 Å²	64	68.9 Å²	68.9	39%	0.393	40%	0.397	S	S	.	.	S	Bend	trans	-140	-166.9	174.5	78	0	0	0	0	109.5	E972 L1172 D1173	E972-T1170 WeakPolarHBondContact OE1-CB 3.46Å; E972-T1170 WeakPolarHBondContact OE2-CB 3.41Å; E972-T1170 PolarHBondContact OE2-OG1 3.34Å; T1170-L1172 VanDerWaalsContact C-N 3.3Å; T1170-L1172 PolarHBondContact OG1-N 3.19Å; T1170-D1173 PolarHBondContact N-O 3.47Å; T1170-D1173 PolarHBondContact OG1-N 2.86Å
1171	Q	71.7	Confident	74.1	Confident	38 Å²	38	72.5 Å²	72.5	18%	0.178	42%	0.421	C	S	.	.	S	Bend	trans	-81.2	-10.7	176.7	-50.4	-143.7	-25.8	0	0	113.2	E972 H998 C1152 P1154	E972-Q1171 PolarHBondContact OE1-N 2.93Å; E972-Q1171 PolarHBondContact OE2-N 3.42Å; E972-Q1171 VanDerWaalsContact OE2-N 3.12Å; H998-Q1171 PolarHBondContact CD2-NE2 3.13Å; H998-Q1171 PolarHBondContact CD2-OE1 3.28Å; H998-Q1171 VanDerWaalsContact CD2-OE1 3.24Å; C1152-Q1171 CarbonylContact C-O 3.48Å; C1152-Q1171 WeakPolarHBondContact CA-O 3.31Å; P1154-Q1171 WeakPolarHBondContact CD-O 3.19Å
1172	L	73.3	Confident	73.4	Confident	37 Å²	37	70.6 Å²	70.6	19%	0.194	41%	0.409	C	S	.	.	S	Bend	trans	-115.3	-31.2	171.5	-75.3	161.8	0	0	0	113.8	R971 E972 Q995 K1151 T1170	R971-L1172 HydrophobicContact CB-CD1 3.57Å; R971-L1172 WeakPolarHBondContact O-CD1 3.14Å; E972-L1172 HydrophobicContact CB-CD1 3.88Å; E972-L1172 HydrophobicContact CB-CG 4.45Å; E972-L1172 HydrophobicContact CG-CD1 4.29Å; E972-L1172 WeakPolarHBondContact OE2-CB 3.36Å; E972-L1172 PolarHBondContact OE2-N 3.07Å; Q995-L1172 HydrophobicContact CB-CD1 4.47Å; Q995-L1172 HydrophobicContact CB-CD2 4.13Å; K1151-L1172 WeakPolarHBondContact O-CD2 3.04Å; T1170-L1172 VanDerWaalsContact C-N 3.3Å; T1170-L1172 PolarHBondContact OG1-N 3.19Å
1173	D	76.9	Confident	72.9	Confident	64 Å²	64	71 Å²	71	34%	0.342	41%	0.406	S	S	.	.			trans	-107.2	148.6	-171.3	-158.6	32.3	0	0	0	113.8	L1169 T1170 K1185	L1169-D1173 PolarHBondContact N-O 2.94Å; T1170-D1173 PolarHBondContact N-O 3.47Å; T1170-D1173 PolarHBondContact OG1-N 2.86Å; D1173-K1185 IonicContact OD1-NZ 2.9Å; D1173-K1185 PolarHBondContact OD1-NZ 2.97Å
1174	Y	80.2	Confident	72.8	Confident	40 Å²	40	68.9 Å²	68.9	16%	0.157	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	152	-173.3	60.4	-80.9	0	0	0	110.6	P1154 P1159 L1167 N1186	P1154-Y1174 HydrophobicContact CB-CD1 3.52Å; P1154-Y1174 HydrophobicContact CB-CE1 4.3Å; P1154-Y1174 HydrophobicContact CB-CG 4.1Å; P1154-Y1174 HydrophobicContact CG-CD1 4.42Å; P1159-Y1174 HydrophobicContact CB-CD2 4.38Å; P1159-Y1174 HydrophobicContact CB-CE1 4.46Å; P1159-Y1174 HydrophobicContact CB-CE2 3.61Å; P1159-Y1174 HydrophobicContact CG-CD2 3.7Å; P1159-Y1174 HydrophobicContact CG-CE1 4.28Å; P1159-Y1174 HydrophobicContact CG-CE2 3.44Å; P1159-Y1174 VanDerWaalsContact CG-CE2 3.44Å; P1159-Y1174 HydrophobicContact CG-CG 4.23Å; L1167-Y1174 CarbonylContact O-C 3.49Å; L1167-Y1174 WeakPolarHBondContact O-CA 3.41Å; Y1174-N1186 PolarHBondContact OH-ND2 2.66Å; Y1174-N1186 PolarHBondContact OH-OD1 2.96Å; Y1174-N1186 VanDerWaalsContact OH-OD1 3.09Å
1175	K	74	Confident	72.4	Confident	138 Å²	138	73.5 Å²	73.5	60%	0.6	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.2	169.9	-178.7	174.7	-178.7	-179.9	0	109	L1167 L1169	L1167-K1175 WeakPolarHBondContact CB-O 3.05Å; L1167-K1175 PolarHBondContact N-O 3.47Å; L1167-K1175 PolarHBondContact O-N 3.09Å; L1169-K1175 HydrophobicContact CD1-CB 4.02Å; L1169-K1175 HydrophobicContact CD2-CB 4.27Å; L1169-K1175 HydrophobicContact CG-CB 4.19Å
1176	C	83.5	Confident	72.5	Confident	10 Å²	10	70.7 Å²	70.7	7%	0.068	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	132.3	166.2	-59.4	0	0	0	0	109.9	C1160 T1165 K1185 C1187	C1160-C1176 WeakPolarHBondContact CA-SG 3.3Å; C1160-C1176 HydrophobicContact CB-CB 3.71Å; C1160-C1176 WeakPolarHBondContact CB-SG 3.19Å; C1160-C1176 WeakPolarHBondContact SG-CA 3.41Å; C1160-C1176 WeakPolarHBondContact SG-CB 3.22Å; C1160-C1176 CovalentContact SG-SG 2.02Å; C1160-C1176 PolarHBondContact SG-SG 3.28Å; T1165-C1176 WeakPolarHBondContact O-CA 3.34Å; C1176-K1185 WeakPolarHBondContact CB-O 3.19Å; C1176-K1185 PolarHBondContact SG-O 3.31Å; C1176-C1187 WeakPolarHBondContact CB-SG 3.4Å
1177	S	74.5	Confident	72.3	Confident	71 Å²	71	69 Å²	69	50%	0.497	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	102.4	166.1	-162.8	0	0	0	0	108.4	G1164 T1165	G1164-S1177 WeakPolarHBondContact CA-O 3.42Å; T1165-S1177 PolarHBondContact N-O 2.73Å; T1165-S1177 PolarHBondContact O-N 3.24Å; T1165-S1177 WeakPolarHBondContact OG1-CB 3.46Å
1178	C	78.9	Confident	72.1	Confident	36 Å²	36	67.3 Å²	67.3	24%	0.243	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-84.2	134.8	-173.6	-55.3	0	0	0	0	112.2	Y1182 C1187	C1178-Y1182 WeakPolarHBondContact CB-O 3.27Å; C1178-C1187 WeakPolarHBondContact CA-SG 3.26Å; C1178-C1187 HydrophobicContact CB-CB 3.73Å; C1178-C1187 WeakPolarHBondContact CB-SG 3.24Å; C1178-C1187 WeakPolarHBondContact SG-CA 3.45Å; C1178-C1187 WeakPolarHBondContact SG-CB 3.34Å; C1178-C1187 CovalentContact SG-SG 2.04Å; C1178-C1187 PolarHBondContact SG-SG 2.88Å
1179	K	71.1	Confident	71.5	Confident	155 Å²	155	68.3 Å²	68.3	67%	0.674	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-81.7	122.8	173.6	-163.3	175	-173.6	177.1	0	108.7	Y1182	K1179-Y1182 WeakPolarHBondContact O-CB 3.23Å; K1179-Y1182 WeakPolarHBondContact O-CD2 3.35Å; K1179-Y1182 PolarHBondContact O-N 3.07Å; K1179-Y1182 VanDerWaalsContact O-N 3.07Å
1180	P	52.2	Low	70.7	Confident	114 Å²	114	71.1 Å²	71.1	74%	0.74	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	143.4	178.1	-27.5	35.8	0	0	0	112
1181	P	47.7	Very low	69.1	Low	92 Å²	92	74.3 Å²	74.3	60%	0.597	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.9	14.3	8.7	37.7	-37.6	0	0	0	115
1182	Y	68.3	Low	67.9	Low	61 Å²	61	76.7 Å²	76.7	24%	0.239	38%	0.384	C	S	.	.			trans	-78.8	143	-178	-60.4	-74.7	0	0	0	112.8	N1162 C1178 K1179 Q1189	N1162-Y1182 HydrophobicContact CB-CD1 3.98Å; N1162-Y1182 HydrophobicContact CB-CD2 3.75Å; N1162-Y1182 HydrophobicContact CB-CE1 4.15Å; N1162-Y1182 HydrophobicContact CB-CE2 3.92Å; N1162-Y1182 HydrophobicContact CB-CG 3.79Å; C1178-Y1182 WeakPolarHBondContact CB-O 3.27Å; K1179-Y1182 WeakPolarHBondContact O-CB 3.23Å; K1179-Y1182 WeakPolarHBondContact O-CD2 3.35Å; K1179-Y1182 PolarHBondContact O-N 3.07Å; K1179-Y1182 VanDerWaalsContact O-N 3.07Å; Y1182-Q1189 WeakPolarHBondContact CA-O 3.26Å
1183	Y	68.8	Low	67	Low	88 Å²	88	78.7 Å²	78.7	35%	0.345	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-145.7	-168	173.9	67	-86.4	0	0	0	110.5	C1187 E1188 Q1189 D1191	Y1183-C1187 CarbonylContact O-C 3.49Å; Y1183-C1187 VanDerWaalsContact O-CA 3.22Å; Y1183-C1187 WeakPolarHBondContact O-CA 3.2Å; Y1183-E1188 PolarHBondContact O-N 3.25Å; Y1183-Q1189 HydrophobicContact CD1-CB 4.49Å; Y1183-Q1189 HydrophobicContact CD2-CB 3.89Å; Y1183-Q1189 HydrophobicContact CE1-CB 4.31Å; Y1183-Q1189 HydrophobicContact CE2-CB 3.65Å; Y1183-Q1189 HydrophobicContact CE2-CG 4.44Å; Y1183-Q1189 VanDerWaalsContact CE2-OE1 3.23Å; Y1183-Q1189 HydrophobicContact CG-CB 4.28Å; Y1183-Q1189 PolarHBondContact N-O 3.17Å; Y1183-Q1189 VanDerWaalsContact N-O 3.07Å; Y1183-Q1189 WeakPolarHBondContact O-CA 3.35Å; Y1183-Q1189 WeakPolarHBondContact O-CB 3.11Å; Y1183-Q1189 PolarHBondContact O-N 2.77Å; Y1183-D1191 HydrophobicContact CE1-CB 4.23Å; Y1183-D1191 WeakPolarHBondContact OH-CA 3.33Å
1184	G	69	Low	66.1	Low	26 Å²	26	77 Å²	77	27%	0.268	39%	0.387	S	S	.	.	S	Bend	trans	97.6	173	-169.6	0	0	0	0	0	111.6	N1186 E1188	G1184-N1186 PolarHBondContact O-N 3.32Å; G1184-E1188 VanDerWaalsContact C-OE2 3.3Å; G1184-E1188 WeakPolarHBondContact CA-OE2 3.48Å
1185	K	74	Confident	65	Low	108 Å²	108	79 Å²	79	47%	0.47	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-34.3	-176.9	-175.8	173.9	178.8	165.9	0	111.3	D1173 C1176 E1188	D1173-K1185 IonicContact OD1-NZ 2.9Å; D1173-K1185 PolarHBondContact OD1-NZ 2.97Å; C1176-K1185 WeakPolarHBondContact CB-O 3.19Å; C1176-K1185 PolarHBondContact SG-O 3.31Å; K1185-E1188 PolarHBondContact N-OE1 3.34Å; K1185-E1188 PolarHBondContact N-OE2 2.83Å; K1185-E1188 VanDerWaalsContact N-OE2 3.17Å
1186	N	81.2	Confident	64.3	Low	35 Å²	35	77.2 Å²	77.2	19%	0.187	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	13.4	-171.7	-68.7	28.4	0	0	0	111.4	P1159 Q1161 Y1174 G1184 E1188	P1159-N1186 WeakPolarHBondContact O-CB 3.09Å; P1159-N1186 PolarHBondContact O-ND2 3.1Å; P1159-N1186 VanDerWaalsContact O-ND2 3.17Å; Q1161-N1186 WeakPolarHBondContact CB-O 3.39Å; Q1161-N1186 PolarHBondContact N-O 3.47Å; Y1174-N1186 PolarHBondContact OH-ND2 2.66Å; Y1174-N1186 PolarHBondContact OH-OD1 2.96Å; Y1174-N1186 VanDerWaalsContact OH-OD1 3.09Å; G1184-N1186 PolarHBondContact O-N 3.32Å; N1186-E1188 VanDerWaalsContact C-OE2 3.28Å; N1186-E1188 VanDerWaalsContact CA-OE2 3.24Å; N1186-E1188 WeakPolarHBondContact CA-OE2 3.15Å; N1186-E1188 HydrophobicContact CB-CB 4.43Å; N1186-E1188 WeakPolarHBondContact CB-OE2 3.38Å; N1186-E1188 PolarHBondContact N-OE2 3.47Å; N1186-E1188 PolarHBondContact O-N 3.32Å
1187	C	78.9	Confident	63.2	Low	1 Å²	1	83 Å²	83	1%	0.007	44%	0.438	C	S	.	.	S	Bend	trans	59.1	26	-171	-44.1	0	0	0	0	113.7	N1162 C1176 C1178 Y1183	N1162-C1187 PolarHBondContact ND2-O 3.3Å; C1176-C1187 WeakPolarHBondContact CB-SG 3.4Å; C1178-C1187 WeakPolarHBondContact CA-SG 3.26Å; C1178-C1187 HydrophobicContact CB-CB 3.73Å; C1178-C1187 WeakPolarHBondContact CB-SG 3.24Å; C1178-C1187 WeakPolarHBondContact SG-CA 3.45Å; C1178-C1187 WeakPolarHBondContact SG-CB 3.34Å; C1178-C1187 CovalentContact SG-SG 2.04Å; C1178-C1187 PolarHBondContact SG-SG 2.88Å; Y1183-C1187 CarbonylContact O-C 3.49Å; Y1183-C1187 VanDerWaalsContact O-CA 3.22Å; Y1183-C1187 WeakPolarHBondContact O-CA 3.2Å
1188	E	73.7	Confident	63	Low	74 Å²	74	80.8 Å²	80.8	35%	0.346	42%	0.422	S	S	.	.			trans	-80.6	-18.6	-175.3	76.4	-70.7	177.8	0	0	113.6	Y1183 G1184 K1185 N1186	Y1183-E1188 PolarHBondContact O-N 3.25Å; G1184-E1188 VanDerWaalsContact C-OE2 3.3Å; G1184-E1188 WeakPolarHBondContact CA-OE2 3.48Å; K1185-E1188 PolarHBondContact N-OE1 3.34Å; K1185-E1188 PolarHBondContact N-OE2 2.83Å; K1185-E1188 VanDerWaalsContact N-OE2 3.17Å; N1186-E1188 VanDerWaalsContact C-OE2 3.28Å; N1186-E1188 VanDerWaalsContact CA-OE2 3.24Å; N1186-E1188 WeakPolarHBondContact CA-OE2 3.15Å; N1186-E1188 HydrophobicContact CB-CB 4.43Å; N1186-E1188 WeakPolarHBondContact CB-OE2 3.38Å; N1186-E1188 PolarHBondContact N-OE2 3.47Å; N1186-E1188 PolarHBondContact O-N 3.32Å
1189	Q	59.7	Low	62.7	Low	79 Å²	79	80 Å²	80	37%	0.369	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-100.4	148.7	-169.7	-52.2	-177.5	23.8	0	0	112.6	Y1182 Y1183	Y1182-Q1189 WeakPolarHBondContact CA-O 3.26Å; Y1183-Q1189 HydrophobicContact CD1-CB 4.49Å; Y1183-Q1189 HydrophobicContact CD2-CB 3.89Å; Y1183-Q1189 HydrophobicContact CE1-CB 4.31Å; Y1183-Q1189 HydrophobicContact CE2-CB 3.65Å; Y1183-Q1189 HydrophobicContact CE2-CG 4.44Å; Y1183-Q1189 VanDerWaalsContact CE2-OE1 3.23Å; Y1183-Q1189 HydrophobicContact CG-CB 4.28Å; Y1183-Q1189 PolarHBondContact N-O 3.17Å; Y1183-Q1189 VanDerWaalsContact N-O 3.07Å; Y1183-Q1189 WeakPolarHBondContact O-CA 3.35Å; Y1183-Q1189 WeakPolarHBondContact O-CB 3.11Å; Y1183-Q1189 PolarHBondContact O-N 2.77Å
1190	R	54.6	Low	62.9	Low	162 Å²	162	77.8 Å²	77.8	61%	0.611	41%	0.408	S	S	*	.			trans	-136.4	144.2	173	-160.7	-153.6	-53.2	-104.8	1.1	107
1191	D	38.3	Very low	63.6	Low	132 Å²	132	76 Å²	76	71%	0.706	39%	0.393	S	S	*	.			trans	-60.8	131.4	-162.8	-160.4	-6	0	0	0	114.5	Y1183	Y1183-D1191 HydrophobicContact CE1-CB 4.23Å; Y1183-D1191 WeakPolarHBondContact OH-CA 3.33Å
1192	H	47.3	Very low	64.4	Low	88 Å²	88	75.3 Å²	75.3	41%	0.407	40%	0.402	S	S	.	.			trans	-161	142.2	178.2	-138.5	60.5	0	0	0	115.1	C1194 S1195	H1192-C1194 PolarHBondContact O-N 3.3Å; H1192-S1195 WeakPolarHBondContact O-CB 3.4Å; H1192-S1195 PolarHBondContact O-N 3.46Å; H1192-S1195 PolarHBondContact O-OG 3.06Å
1193	I	54.6	Low	64.4	Low	78 Å²	78	72.9 Å²	72.9	40%	0.4	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-66.2	-32.1	-162	-164.1	64.2	0	0	0	115.9	S1195 T1196	I1193-S1195 PolarHBondContact O-N 3.36Å; I1193-S1195 VanDerWaalsContact O-N 3.12Å; I1193-T1196 PolarHBondContact O-N 3.36Å; I1193-T1196 PolarHBondContact O-OG1 2.89Å
1194	C	58.8	Low	64.2	Low	30 Å²	30	73.7 Å²	73.7	20%	0.203	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-66.6	-14.8	-177.6	-75.1	0	0	0	0	113.8	H1192 T1196 N1197 I1207	H1192-C1194 PolarHBondContact O-N 3.3Å; C1194-T1196 PolarHBondContact O-N 3.09Å; C1194-N1197 PolarHBondContact O-N 2.89Å; C1194-N1197 VanDerWaalsContact O-N 3.17Å; C1194-I1207 WeakPolarHBondContact SG-CG1 3.39Å
1195	S	55.4	Low	64	Low	82 Å²	82	74.7 Å²	74.7	57%	0.573	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-60	-10	173.9	-45.2	0	0	0	0	114	H1192 I1193	H1192-S1195 WeakPolarHBondContact O-CB 3.4Å; H1192-S1195 PolarHBondContact O-N 3.46Å; H1192-S1195 PolarHBondContact O-OG 3.06Å; I1193-S1195 PolarHBondContact O-N 3.36Å; I1193-S1195 VanDerWaalsContact O-N 3.12Å
1196	T	60.8	Low	63.3	Low	99 Å²	99	75.2 Å²	75.2	61%	0.607	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-85.4	-4.1	177.6	56.2	0	0	0	0	114.5	I1193 C1194	I1193-T1196 PolarHBondContact O-N 3.36Å; I1193-T1196 PolarHBondContact O-OG1 2.89Å; C1194-T1196 PolarHBondContact O-N 3.09Å
1197	N	58.8	Low	62	Low	132 Å²	132	78.1 Å²	78.1	71%	0.706	43%	0.425	S	S	*	.			trans	48.2	59.6	-178	-71.2	-22.4	0	0	0	114.8	C1194 C1199	C1194-N1197 PolarHBondContact O-N 2.89Å; C1194-N1197 VanDerWaalsContact O-N 3.17Å; N1197-C1199 VanDerWaalsContact C-N 3.27Å; N1197-C1199 PolarHBondContact O-N 3.01Å
1198	P	71	Confident	60.5	Low	25 Å²	25	80.7 Å²	80.7	16%	0.162	44%	0.44	C	S	.	.			trans	-72	-16.5	-177.1	30.6	-37	0	0	0	114.5	Y1214 T1226	P1198-Y1214 HydrophobicContact CB-CD2 4.23Å; P1198-Y1214 HydrophobicContact CB-CE1 4.05Å; P1198-Y1214 HydrophobicContact CB-CE2 3.61Å; P1198-Y1214 HydrophobicContact CG-CD1 4.16Å; P1198-Y1214 HydrophobicContact CG-CD2 3.71Å; P1198-Y1214 HydrophobicContact CG-CE1 4.07Å; P1198-Y1214 HydrophobicContact CG-CE2 3.63Å; P1198-Y1214 HydrophobicContact CG-CG 4Å; P1198-T1226 WeakPolarHBondContact O-CB 3.39Å; P1198-T1226 VanDerWaalsContact O-CG2 3.28Å; P1198-T1226 WeakPolarHBondContact O-CG2 3.43Å
1199	C	73.5	Confident	59.1	Low	19 Å²	19	82.2 Å²	82.2	13%	0.128	47%	0.466	C	S	.	.			trans	-91.7	117.1	178.9	-55.7	0	0	0	0	110.4	N1197 G1203 C1205 C1216	N1197-C1199 VanDerWaalsContact C-N 3.27Å; N1197-C1199 PolarHBondContact O-N 3.01Å; C1199-G1203 WeakPolarHBondContact CB-O 3.38Å; C1199-C1205 HydrophobicContact CB-CB 4.3Å; C1199-C1205 VanDerWaalsContact SG-CA 3.56Å; C1199-C1205 WeakPolarHBondContact SG-CB 3.3Å; C1199-C1216 WeakPolarHBondContact CA-SG 3.33Å; C1199-C1216 HydrophobicContact CB-CB 3.76Å; C1199-C1216 WeakPolarHBondContact CB-SG 3.35Å; C1199-C1216 WeakPolarHBondContact SG-CA 3.47Å; C1199-C1216 WeakPolarHBondContact SG-CB 3.23Å; C1199-C1216 CovalentContact SG-SG 2.03Å; C1199-C1216 PolarHBondContact SG-SG 3.02Å
1200	Q	75.1	Confident	58	Low	108 Å²	108	87.3 Å²	87.3	51%	0.505	48%	0.483	S	S	.	.			trans	-96	176.4	-178.1	-59.3	-174	-7.8	0	0	110.8	G1202 G1203 T1226 C1227 T1228	Q1200-G1202 VanDerWaalsContact C-N 3.26Å; Q1200-G1202 PolarHBondContact O-N 3.32Å; Q1200-G1202 VanDerWaalsContact O-N 3.13Å; Q1200-G1203 PolarHBondContact O-N 3.39Å; Q1200-T1226 PolarHBondContact N-O 3.09Å; Q1200-C1227 WeakPolarHBondContact O-CB 3.36Å; Q1200-T1228 HydrophobicContact CB-CG2 4.11Å; Q1200-T1228 HydrophobicContact CG-CG2 4.42Å
1201	N	65.7	Low	57.4	Low	78 Å²	78	84.3 Å²	84.3	42%	0.417	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.4	175.5	-58	-23.7	0	0	0	114.3	G1203 P1219 F1222 C1227	N1201-G1203 VanDerWaalsContact C-N 3.27Å; N1201-G1203 PolarHBondContact O-N 3.18Å; N1201-P1219 VanDerWaalsContact O-CG 3.22Å; N1201-P1219 WeakPolarHBondContact O-CG 2.96Å; N1201-F1222 HydrophobicContact CB-CD1 4.04Å; N1201-F1222 HydrophobicContact CB-CD2 4.47Å; N1201-F1222 HydrophobicContact CB-CE1 4.14Å; N1201-F1222 HydrophobicContact CB-CG 4.2Å; N1201-F1222 HydrophobicContact CB-CZ 4.4Å; N1201-F1222 WeakPolarHBondContact ND2-CD1 3.36Å; N1201-F1222 WeakPolarHBondContact ND2-CE1 3.46Å; N1201-C1227 PolarHBondContact ND2-O 3.22Å
1202	G	64.3	Low	57.9	Low	77 Å²	77	82.8 Å²	82.8	79%	0.794	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	8.9	-179.5	0	0	0	0	0	115.4	Q1200 L1204	Q1200-G1202 VanDerWaalsContact C-N 3.26Å; Q1200-G1202 PolarHBondContact O-N 3.32Å; Q1200-G1202 VanDerWaalsContact O-N 3.13Å; G1202-L1204 PolarHBondContact O-N 2.9Å
1203	G	69.6	Low	58	Low	10 Å²	10	80 Å²	80	10%	0.103	48%	0.475	C	S	.	.			trans	-60.8	127.4	-179.6	0	0	0	0	0	113.1	C1199 Q1200 N1201 C1205 I1217	C1199-G1203 WeakPolarHBondContact CB-O 3.38Å; Q1200-G1203 PolarHBondContact O-N 3.39Å; N1201-G1203 VanDerWaalsContact C-N 3.27Å; N1201-G1203 PolarHBondContact O-N 3.18Å; G1203-C1205 PolarHBondContact O-N 3.48Å; G1203-I1217 CarbonylContact C-O 3.54Å; G1203-I1217 VanDerWaalsContact CA-O 3.25Å; G1203-I1217 WeakPolarHBondContact CA-O 3.31Å
1204	L	64.5	Low	58.7	Low	104 Å²	104	80.9 Å²	80.9	55%	0.545	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	113.2	-178.5	-164.3	84.1	0	0	0	110.3	G1202 C1216 I1217	G1202-L1204 PolarHBondContact O-N 2.9Å; L1204-C1216 WeakPolarHBondContact O-CA 3.45Å; L1204-I1217 HydrophobicContact CB-CB 4.31Å; L1204-I1217 PolarHBondContact N-O 3.25Å; L1204-I1217 PolarHBondContact O-N 3.35Å
1205	C	63.8	Low	58.9	Low	47 Å²	47	86.1 Å²	86.1	32%	0.318	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	125.3	176.7	-166.4	0	0	0	0	111.3	C1199 G1203	C1199-C1205 HydrophobicContact CB-CB 4.3Å; C1199-C1205 VanDerWaalsContact SG-CA 3.56Å; C1199-C1205 WeakPolarHBondContact SG-CB 3.3Å; G1203-C1205 PolarHBondContact O-N 3.48Å
1206	K	58.9	Low	59.7	Low	119 Å²	119	82.8 Å²	82.8	52%	0.517	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133	167.3	-71	-170.2	176	-177.3	0	110.5	T1208 Y1214 K1215 I1217	K1206-T1208 PolarHBondContact O-N 3.13Å; K1206-Y1214 CarbonylContact O-C 3.22Å; K1206-Y1214 WeakPolarHBondContact O-CA 3.09Å; K1206-K1215 PolarHBondContact N-O 3.43Å; K1206-K1215 PolarHBondContact O-N 2.62Å; K1206-I1217 HydrophobicContact CD-CD1 4.08Å
1207	I	54	Low	60	Low	97 Å²	97	82.1 Å²	82.1	50%	0.497	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	130	170.1	-62.5	167	0	0	0	108.3	C1194	C1194-I1207 WeakPolarHBondContact SG-CG1 3.39Å
1208	T	47.8	Very low	60.4	Low	54 Å²	54	77.8 Å²	77.8	33%	0.331	44%	0.441	S	S	.	.			trans	-95.7	162.2	169.1	41.9	0	0	0	0	110.4	K1206 Y1210 S1213 Y1214 K1215	K1206-T1208 PolarHBondContact O-N 3.13Å; T1208-Y1210 PolarHBondContact O-N 2.9Å; T1208-Y1210 VanDerWaalsContact O-O 3.07Å; T1208-S1213 VanDerWaalsContact C-OG 3.31Å; T1208-S1213 PolarHBondContact N-O 3.34Å; T1208-S1213 PolarHBondContact O-OG 2.92Å; T1208-S1213 VanDerWaalsContact OG1-C 3.26Å; T1208-S1213 VanDerWaalsContact OG1-CB 3.23Å; T1208-S1213 WeakPolarHBondContact OG1-CB 3.33Å; T1208-S1213 PolarHBondContact OG1-O 3.15Å; T1208-S1213 PolarHBondContact OG1-OG 3.17Å; T1208-Y1214 PolarHBondContact OG1-N 3.14Å; T1208-K1215 HydrophobicContact CG2-CB 3.91Å
1209	A	45.5	Very low	60.1	Low	107 Å²	107	79.2 Å²	79.2	88%	0.884	45%	0.45	S	S	*	.	S	Bend	trans	-62.5	-4.3	-155.9	0	0	0	0	0	118
1210	Y	36.8	Very low	58.9	Low	185 Å²	185	85.1 Å²	85.1	73%	0.725	49%	0.486	S	S	*	.	S	Bend	trans	-101.3	141.8	172.3	-68.8	-83.3	0	0	0	111.4	T1208 S1212 S1213	T1208-Y1210 PolarHBondContact O-N 2.9Å; T1208-Y1210 VanDerWaalsContact O-O 3.07Å; Y1210-S1212 PolarHBondContact O-N 2.94Å; Y1210-S1213 PolarHBondContact N-OG 3.25Å; Y1210-S1213 PolarHBondContact O-N 3.16Å; Y1210-S1213 PolarHBondContact O-OG 3.18Å
1211	P	41.1	Very low	57.8	Low	100 Å²	100	82 Å²	82	65%	0.649	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	13	-167.4	-22.8	35.1	0	0	0	117.9
1212	S	48.8	Very low	57.5	Low	99 Å²	99	81.1 Å²	81.1	69%	0.692	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.6	17.5	178.6	-49.1	0	0	0	0	112.4	Y1210	Y1210-S1212 PolarHBondContact O-N 2.94Å
1213	S	50.3	Low	57.5	Low	31 Å²	31	82.2 Å²	82.2	22%	0.217	46%	0.46	C	S	.	.			trans	-118.1	142.4	-174.7	69.3	0	0	0	0	112.6	T1208 Y1210	T1208-S1213 VanDerWaalsContact C-OG 3.31Å; T1208-S1213 PolarHBondContact N-O 3.34Å; T1208-S1213 PolarHBondContact O-OG 2.92Å; T1208-S1213 VanDerWaalsContact OG1-C 3.26Å; T1208-S1213 VanDerWaalsContact OG1-CB 3.23Å; T1208-S1213 WeakPolarHBondContact OG1-CB 3.33Å; T1208-S1213 PolarHBondContact OG1-O 3.15Å; T1208-S1213 PolarHBondContact OG1-OG 3.17Å; Y1210-S1213 PolarHBondContact N-OG 3.25Å; Y1210-S1213 PolarHBondContact O-N 3.16Å; Y1210-S1213 PolarHBondContact O-OG 3.18Å
1214	Y	68.6	Low	57	Low	96 Å²	96	83.1 Å²	83.1	38%	0.376	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	161.2	179.1	70.1	-87.1	0	0	0	111.3	P1198 K1206 T1208	P1198-Y1214 HydrophobicContact CB-CD2 4.23Å; P1198-Y1214 HydrophobicContact CB-CE1 4.05Å; P1198-Y1214 HydrophobicContact CB-CE2 3.61Å; P1198-Y1214 HydrophobicContact CG-CD1 4.16Å; P1198-Y1214 HydrophobicContact CG-CD2 3.71Å; P1198-Y1214 HydrophobicContact CG-CE1 4.07Å; P1198-Y1214 HydrophobicContact CG-CE2 3.63Å; P1198-Y1214 HydrophobicContact CG-CG 4Å; K1206-Y1214 CarbonylContact O-C 3.22Å; K1206-Y1214 WeakPolarHBondContact O-CA 3.09Å; T1208-Y1214 PolarHBondContact OG1-N 3.14Å
1215	K	62.6	Low	57	Low	139 Å²	139	83.6 Å²	83.6	60%	0.604	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.8	171.9	-178.2	176.3	-179.4	177.4	0	109.9	K1206 T1208	K1206-K1215 PolarHBondContact N-O 3.43Å; K1206-K1215 PolarHBondContact O-N 2.62Å; T1208-K1215 HydrophobicContact CG2-CB 3.91Å
1216	C	72.5	Confident	57.4	Low	13 Å²	13	83 Å²	83	9%	0.088	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	142.8	171.9	-53.5	0	0	0	0	111	C1199 L1204 P1225	C1199-C1216 WeakPolarHBondContact CA-SG 3.33Å; C1199-C1216 HydrophobicContact CB-CB 3.76Å; C1199-C1216 WeakPolarHBondContact CB-SG 3.35Å; C1199-C1216 WeakPolarHBondContact SG-CA 3.47Å; C1199-C1216 WeakPolarHBondContact SG-CB 3.23Å; C1199-C1216 CovalentContact SG-SG 2.03Å; C1199-C1216 PolarHBondContact SG-SG 3.02Å; L1204-C1216 WeakPolarHBondContact O-CA 3.45Å; C1216-P1225 WeakPolarHBondContact CB-O 3.31Å; C1216-P1225 PolarHBondContact SG-O 3.28Å
1217	I	67	Low	58	Low	85 Å²	85	77.3 Å²	77.3	44%	0.436	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.4	168.6	-55.9	174.9	0	0	0	107.3	G1203 L1204 K1206	G1203-I1217 CarbonylContact C-O 3.54Å; G1203-I1217 VanDerWaalsContact CA-O 3.25Å; G1203-I1217 WeakPolarHBondContact CA-O 3.31Å; L1204-I1217 HydrophobicContact CB-CB 4.31Å; L1204-I1217 PolarHBondContact N-O 3.25Å; L1204-I1217 PolarHBondContact O-N 3.35Å; K1206-I1217 HydrophobicContact CD-CD1 4.08Å
1218	C	67.5	Low	58.7	Low	40 Å²	40	75.9 Å²	75.9	27%	0.27	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-90.8	143	-170	-51.2	0	0	0	0	112.5	F1222 G1224 C1227	C1218-F1222 HydrophobicContact CB-CB 4.46Å; C1218-F1222 WeakPolarHBondContact CB-O 2.97Å; C1218-G1224 PolarHBondContact SG-O 3.02Å; C1218-G1224 VanDerWaalsContact SG-O 3.39Å; C1218-C1227 WeakPolarHBondContact CA-SG 3.32Å; C1218-C1227 HydrophobicContact CB-CB 3.63Å; C1218-C1227 WeakPolarHBondContact CB-SG 3.48Å; C1218-C1227 WeakPolarHBondContact SG-CA 3.38Å; C1218-C1227 WeakPolarHBondContact SG-CB 3.31Å; C1218-C1227 CovalentContact SG-SG 2.04Å; C1218-C1227 PolarHBondContact SG-SG 2.94Å
1219	P	64	Low	58.8	Low	55 Å²	55	79.7 Å²	79.7	36%	0.357	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-69.1	161.8	170.1	29.7	-33.5	0	0	0	111.5	N1201 F1222	N1201-P1219 VanDerWaalsContact O-CG 3.22Å; N1201-P1219 WeakPolarHBondContact O-CG 2.96Å; P1219-F1222 HydrophobicContact CG-CD2 4.25Å; P1219-F1222 PolarHBondContact O-N 2.95Å; P1219-F1222 VanDerWaalsContact O-N 3.1Å
1220	T	49.5	Very low	58.8	Low	144 Å²	144	79.2 Å²	79.2	88%	0.883	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	141.7	177.1	33.3	0	0	0	0	112	F1222	T1220-F1222 VanDerWaalsContact C-N 3.29Å; T1220-F1222 PolarHBondContact O-N 2.85Å
1221	G	51.3	Low	58.7	Low	42 Å²	42	77.7 Å²	77.7	43%	0.433	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	-21.5	-171.3	0	0	0	0	0	114.7	Q1230 M1231	G1221-Q1230 VanDerWaalsContact O-CA 3.29Å; G1221-Q1230 WeakPolarHBondContact O-CA 3.2Å; G1221-Q1230 WeakPolarHBondContact O-CG 3.38Å; G1221-M1231 PolarHBondContact O-N 2.99Å; G1221-M1231 VanDerWaalsContact O-N 3.15Å
1222	F	59.7	Low	58.8	Low	59 Å²	59	79.4 Å²	79.4	26%	0.259	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	146.6	-178.4	-66.5	-84.2	0	0	0	113.9	N1201 C1218 P1219 T1220 C1227 K1229 Q1230	N1201-F1222 HydrophobicContact CB-CD1 4.04Å; N1201-F1222 HydrophobicContact CB-CD2 4.47Å; N1201-F1222 HydrophobicContact CB-CE1 4.14Å; N1201-F1222 HydrophobicContact CB-CG 4.2Å; N1201-F1222 HydrophobicContact CB-CZ 4.4Å; N1201-F1222 WeakPolarHBondContact ND2-CD1 3.36Å; N1201-F1222 WeakPolarHBondContact ND2-CE1 3.46Å; C1218-F1222 HydrophobicContact CB-CB 4.46Å; C1218-F1222 WeakPolarHBondContact CB-O 2.97Å; P1219-F1222 HydrophobicContact CG-CD2 4.25Å; P1219-F1222 PolarHBondContact O-N 2.95Å; P1219-F1222 VanDerWaalsContact O-N 3.1Å; T1220-F1222 VanDerWaalsContact C-N 3.29Å; T1220-F1222 PolarHBondContact O-N 2.85Å; F1222-C1227 WeakPolarHBondContact CD1-O 3.45Å; F1222-K1229 CarbonylContact C-O 3.47Å; F1222-K1229 VanDerWaalsContact CA-O 3.27Å; F1222-K1229 WeakPolarHBondContact CA-O 3.27Å; F1222-Q1230 HydrophobicContact CD1-CB 3.92Å; F1222-Q1230 HydrophobicContact CD1-CG 4.08Å; F1222-Q1230 HydrophobicContact CE1-CB 3.9Å; F1222-Q1230 HydrophobicContact CE1-CG 3.78Å; F1222-Q1230 HydrophobicContact CZ-CG 4.17Å
1223	H	64.2	Low	58.7	Low	100 Å²	100	79.3 Å²	79.3	46%	0.463	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	176.3	-179.5	72.4	115.7	0	0	0	112.8	C1227 T1228 K1229	H1223-C1227 CarbonylContact O-C 3.53Å; H1223-T1228 PolarHBondContact O-N 3.34Å; H1223-K1229 VanDerWaalsContact CD2-C 3.4Å; H1223-K1229 PolarHBondContact CD2-O 2.99Å; H1223-K1229 VanDerWaalsContact CD2-O 3.23Å; H1223-K1229 PolarHBondContact N-O 2.95Å; H1223-K1229 VanDerWaalsContact NE2-CB 3.3Å; H1223-K1229 WeakPolarHBondContact NE2-CB 3.21Å; H1223-K1229 PolarHBondContact O-N 2.03Å
1224	G	59.5	Low	59	Low	30 Å²	30	79.8 Å²	79.8	31%	0.309	44%	0.435	S	S	.	.	S	Bend	trans	93.5	166.5	-174.8	0	0	0	0	0	113.3	C1218 T1226 C1227	C1218-G1224 PolarHBondContact SG-O 3.02Å; C1218-G1224 VanDerWaalsContact SG-O 3.39Å; G1224-T1226 PolarHBondContact O-N 3.38Å; G1224-T1226 VanDerWaalsContact O-N 3.15Å; G1224-C1227 PolarHBondContact O-N 3.3Å
1225	P	64.4	Low	58.3	Low	113 Å²	113	80.6 Å²	80.6	73%	0.734	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.8	-167.3	25.9	-35.5	0	0	0	114.5	C1216	C1216-P1225 WeakPolarHBondContact CB-O 3.31Å; C1216-P1225 PolarHBondContact SG-O 3.28Å
1226	T	70.8	Confident	58	Low	35 Å²	35	81.3 Å²	81.3	22%	0.215	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	13.3	175.2	54.5	0	0	0	0	112.8	P1198 Q1200 G1224 T1228	P1198-T1226 WeakPolarHBondContact O-CB 3.39Å; P1198-T1226 VanDerWaalsContact O-CG2 3.28Å; P1198-T1226 WeakPolarHBondContact O-CG2 3.43Å; Q1200-T1226 PolarHBondContact N-O 3.09Å; G1224-T1226 PolarHBondContact O-N 3.38Å; G1224-T1226 VanDerWaalsContact O-N 3.15Å; T1226-T1228 VanDerWaalsContact C-N 3.34Å; T1226-T1228 PolarHBondContact O-N 3.31Å; T1226-T1228 WeakPolarHBondContact OG1-CG2 3.25Å; T1226-T1228 PolarHBondContact OG1-OG1 3.41Å
1227	C	71.9	Confident	57.4	Low	0 Å²	0	87 Å²	87	0%	0	47%	0.472	C	S	.	.	S	Bend	trans	64.5	27.2	179.2	-49.2	0	0	0	0	116	Q1200 N1201 C1218 F1222 H1223 G1224	Q1200-C1227 WeakPolarHBondContact O-CB 3.36Å; N1201-C1227 PolarHBondContact ND2-O 3.22Å; C1218-C1227 WeakPolarHBondContact CA-SG 3.32Å; C1218-C1227 HydrophobicContact CB-CB 3.63Å; C1218-C1227 WeakPolarHBondContact CB-SG 3.48Å; C1218-C1227 WeakPolarHBondContact SG-CA 3.38Å; C1218-C1227 WeakPolarHBondContact SG-CB 3.31Å; C1218-C1227 CovalentContact SG-SG 2.04Å; C1218-C1227 PolarHBondContact SG-SG 2.94Å; F1222-C1227 WeakPolarHBondContact CD1-O 3.45Å; H1223-C1227 CarbonylContact O-C 3.53Å; G1224-C1227 PolarHBondContact O-N 3.3Å
1228	T	68.3	Low	57.4	Low	66 Å²	66	85.8 Å²	85.8	41%	0.405	47%	0.467	S	S	.	.			trans	-92.4	-12.3	-173.1	47.6	0	0	0	0	115.8	Q1200 H1223 T1226	Q1200-T1228 HydrophobicContact CB-CG2 4.11Å; Q1200-T1228 HydrophobicContact CG-CG2 4.42Å; H1223-T1228 PolarHBondContact O-N 3.34Å; T1226-T1228 VanDerWaalsContact C-N 3.34Å; T1226-T1228 PolarHBondContact O-N 3.31Å; T1226-T1228 WeakPolarHBondContact OG1-CG2 3.25Å; T1226-T1228 PolarHBondContact OG1-OG1 3.41Å
1229	K	51.3	Low	57.7	Low	134 Å²	134	84.8 Å²	84.8	58%	0.583	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	147.9	177.3	-59.5	-167.1	176.3	-167.9	0	110.1	F1222 H1223	F1222-K1229 CarbonylContact C-O 3.47Å; F1222-K1229 VanDerWaalsContact CA-O 3.27Å; F1222-K1229 WeakPolarHBondContact CA-O 3.27Å; H1223-K1229 VanDerWaalsContact CD2-C 3.4Å; H1223-K1229 PolarHBondContact CD2-O 2.99Å; H1223-K1229 VanDerWaalsContact CD2-O 3.23Å; H1223-K1229 PolarHBondContact N-O 2.95Å; H1223-K1229 VanDerWaalsContact NE2-CB 3.3Å; H1223-K1229 WeakPolarHBondContact NE2-CB 3.21Å; H1223-K1229 PolarHBondContact O-N 2.03Å
1230	Q	45.5	Very low	58.3	Low	98 Å²	98	86.9 Å²	86.9	46%	0.458	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.3	-168.7	-173.4	-175	16.9	0	0	110.8	G1221 F1222 R1235	G1221-Q1230 VanDerWaalsContact O-CA 3.29Å; G1221-Q1230 WeakPolarHBondContact O-CA 3.2Å; G1221-Q1230 WeakPolarHBondContact O-CG 3.38Å; F1222-Q1230 HydrophobicContact CD1-CB 3.92Å; F1222-Q1230 HydrophobicContact CD1-CG 4.08Å; F1222-Q1230 HydrophobicContact CE1-CB 3.9Å; F1222-Q1230 HydrophobicContact CE1-CG 3.78Å; F1222-Q1230 HydrophobicContact CZ-CG 4.17Å; Q1230-R1235 PolarHBondContact O-NH1 3.27Å; Q1230-R1235 PolarHBondContact O-NH2 3.21Å
1231	M	34.9	Very low	59.5	Low	153 Å²	153	83.6 Å²	83.6	75%	0.754	44%	0.442	S	S	*	.			trans	-89.1	167.7	-169.7	-152.4	153.1	68.1	0	0	113.8	G1221	G1221-M1231 PolarHBondContact O-N 2.99Å; G1221-M1231 VanDerWaalsContact O-N 3.15Å
1232	E	42.7	Very low	60.2	Low	135 Å²	135	84.3 Å²	84.3	63%	0.631	45%	0.449	S	S	*	.	S	Bend	trans	-133.4	75.1	-143.3	-167.5	155.8	-103.3	0	0	115.2	R1235	E1232-R1235 HydrophobicContact CG-CB 4.09Å; E1232-R1235 HydrophobicContact CG-CG 4.19Å; E1232-R1235 WeakPolarHBondContact OE1-CD 3.5Å; E1232-R1235 IonicContact OE1-CZ 2.61Å; E1232-R1235 IonicContact OE1-NE 2.72Å; E1232-R1235 IonicContact OE1-NH1 2.67Å; E1232-R1235 PolarHBondContact OE1-NH1 3.19Å
1233	T	46.1	Very low	60.8	Low	98 Å²	98	82 Å²	82	60%	0.601	44%	0.442	S	S	*	.	S	Bend	trans	-129.8	-51.6	163.9	45.4	0	0	0	0	111.7	R1235 V1247	T1233-R1235 PolarHBondContact O-N 3.12Å; T1233-V1247 VanDerWaalsContact OG1-CG2 3.31Å; T1233-V1247 WeakPolarHBondContact OG1-CG2 3.45Å
1234	C	56.3	Low	61.3	Low	41 Å²	41	81.8 Å²	81.8	28%	0.277	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-62.4	-5.5	170.3	-75.1	0	0	0	0	114.7	Q1236 N1237 C1245	C1234-Q1236 PolarHBondContact O-N 3.49Å; C1234-N1237 PolarHBondContact O-N 3.35Å; C1234-C1245 VanDerWaalsContact CA-SG 3.58Å; C1234-C1245 HydrophobicContact CB-CB 3.67Å; C1234-C1245 WeakPolarHBondContact CB-SG 3.49Å; C1234-C1245 WeakPolarHBondContact SG-CB 3.24Å; C1234-C1245 PolarHBondContact SG-O 3.14Å; C1234-C1245 CovalentContact SG-SG 2.04Å; C1234-C1245 PolarHBondContact SG-SG 3.31Å
1235	R	53.8	Low	61.8	Low	113 Å²	113	82.6 Å²	82.6	43%	0.426	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-65.7	-12.3	178.9	-87.3	-141	-179.3	91.7	15.7	115.3	Q1230 E1232 T1233 N1237	Q1230-R1235 PolarHBondContact O-NH1 3.27Å; Q1230-R1235 PolarHBondContact O-NH2 3.21Å; E1232-R1235 HydrophobicContact CG-CB 4.09Å; E1232-R1235 HydrophobicContact CG-CG 4.19Å; E1232-R1235 WeakPolarHBondContact OE1-CD 3.5Å; E1232-R1235 IonicContact OE1-CZ 2.61Å; E1232-R1235 IonicContact OE1-NE 2.72Å; E1232-R1235 IonicContact OE1-NH1 2.67Å; E1232-R1235 PolarHBondContact OE1-NH1 3.19Å; T1233-R1235 PolarHBondContact O-N 3.12Å; R1235-N1237 PolarHBondContact O-N 2.92Å
1236	Q	55.9	Low	61.8	Low	153 Å²	153	81.1 Å²	81.1	72%	0.715	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-78.4	-1.8	175.3	-67.2	-173.7	-6.6	0	0	113.4	C1234 L1238	C1234-Q1236 PolarHBondContact O-N 3.49Å; Q1236-L1238 VanDerWaalsContact C-N 3.25Å; Q1236-L1238 HydrophobicContact CB-CD1 4.31Å; Q1236-L1238 HydrophobicContact CB-CD2 4.45Å; Q1236-L1238 HydrophobicContact CB-CG 4Å; Q1236-L1238 PolarHBondContact O-N 3.08Å
1237	N	60.2	Low	61.2	Low	133 Å²	133	83.2 Å²	83.2	71%	0.711	44%	0.444	S	S	*	.			trans	51.7	40.1	176.4	-65.5	-10.6	0	0	0	113.8	C1234 R1235 C1239	C1234-N1237 PolarHBondContact O-N 3.35Å; R1235-N1237 PolarHBondContact O-N 2.92Å; N1237-C1239 PolarHBondContact O-N 3.42Å
1238	L	67.1	Low	60.3	Low	60 Å²	60	85.3 Å²	85.3	31%	0.314	46%	0.457	S	S	.	.			trans	-69.7	-10	-178.6	-62.7	169.9	0	0	0	113.8	Q1236 Y1252 N1264	Q1236-L1238 VanDerWaalsContact C-N 3.25Å; Q1236-L1238 HydrophobicContact CB-CD1 4.31Å; Q1236-L1238 HydrophobicContact CB-CD2 4.45Å; Q1236-L1238 HydrophobicContact CB-CG 4Å; Q1236-L1238 PolarHBondContact O-N 3.08Å; L1238-Y1252 HydrophobicContact CB-CD2 4.2Å; L1238-Y1252 HydrophobicContact CB-CE2 3.72Å; L1238-Y1252 HydrophobicContact CD1-CD1 3.88Å; L1238-Y1252 HydrophobicContact CD1-CD2 4.5Å; L1238-Y1252 HydrophobicContact CD1-CE1 3.52Å; L1238-Y1252 HydrophobicContact CD1-CE2 4.18Å; L1238-Y1252 HydrophobicContact CD1-CG 4.37Å; L1238-N1264 WeakPolarHBondContact O-CB 3.19Å; L1238-N1264 PolarHBondContact O-ND2 3.22Å
1239	C	74.9	Confident	59.5	Low	18 Å²	18	89.9 Å²	89.9	12%	0.122	48%	0.479	C	S	.	.			trans	-95.3	107.3	173.7	-52	0	0	0	0	109.4	N1237 G1243 C1254	N1237-C1239 PolarHBondContact O-N 3.42Å; C1239-G1243 VanDerWaalsContact CB-O 3.31Å; C1239-G1243 WeakPolarHBondContact CB-O 3.4Å; C1239-C1254 WeakPolarHBondContact CA-SG 3.31Å; C1239-C1254 HydrophobicContact CB-CB 3.71Å; C1239-C1254 WeakPolarHBondContact CB-SG 3.02Å; C1239-C1254 WeakPolarHBondContact SG-CA 3.48Å; C1239-C1254 WeakPolarHBondContact SG-CB 3.48Å; C1239-C1254 CovalentContact SG-SG 2.03Å; C1239-C1254 PolarHBondContact SG-SG 3.29Å
1240	E	76.5	Confident	59.4	Low	99 Å²	99	92 Å²	92	46%	0.463	50%	0.497	S	S	.	.			trans	-78.1	175.3	178.1	-60.2	-179.4	-171.4	0	0	111	G1242 G1243 N1264	E1240-G1242 PolarHBondContact O-N 2.93Å; E1240-G1243 PolarHBondContact O-N 3.46Å; E1240-N1264 WeakPolarHBondContact CB-O 3.36Å; E1240-N1264 PolarHBondContact N-O 3Å
1241	N	73.4	Confident	59.5	Low	75 Å²	75	91.3 Å²	91.3	40%	0.401	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	30.7	170.8	-57.9	-42.6	0	0	0	115.8	G1243 T1257 F1260 C1265	N1241-G1243 VanDerWaalsContact C-N 3.35Å; N1241-T1257 PolarHBondContact O-OG1 3.46Å; N1241-F1260 HydrophobicContact CB-CB 4.33Å; N1241-F1260 HydrophobicContact CB-CD1 3.66Å; N1241-F1260 HydrophobicContact CB-CD2 3.6Å; N1241-F1260 HydrophobicContact CB-CE1 3.78Å; N1241-F1260 HydrophobicContact CB-CE2 3.72Å; N1241-F1260 HydrophobicContact CB-CG 3.58Å; N1241-F1260 HydrophobicContact CB-CZ 3.82Å; N1241-F1260 WeakPolarHBondContact ND2-CD1 3.4Å; N1241-C1265 PolarHBondContact ND2-O 3.19Å
1242	G	67.9	Low	61.2	Low	57 Å²	57	86.6 Å²	86.6	59%	0.588	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	10.7	177.9	0	0	0	0	0	115.2	E1240 T1257	E1240-G1242 PolarHBondContact O-N 2.93Å; G1242-T1257 WeakPolarHBondContact O-CG2 3.36Å
1243	G	72	Confident	62.1	Low	12 Å²	12	86.7 Å²	86.7	12%	0.124	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-60.3	140.2	175	0	0	0	0	0	112.4	C1239 E1240 N1241 H1255	C1239-G1243 VanDerWaalsContact CB-O 3.31Å; C1239-G1243 WeakPolarHBondContact CB-O 3.4Å; E1240-G1243 PolarHBondContact O-N 3.46Å; N1241-G1243 VanDerWaalsContact C-N 3.35Å; G1243-H1255 CarbonylContact C-O 3.26Å; G1243-H1255 VanDerWaalsContact CA-O 3.23Å; G1243-H1255 WeakPolarHBondContact CA-O 3.47Å
1244	T	73.5	Confident	63.5	Low	95 Å²	95	82.8 Å²	82.8	58%	0.583	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.9	-179.5	51.4	0	0	0	0	111.2	H1255	T1244-H1255 PolarHBondContact N-O 2.99Å; T1244-H1255 PolarHBondContact O-N 2.89Å; T1244-H1255 WeakPolarHBondContact OG1-CB 3.19Å
1245	C	70.6	Confident	64.4	Low	47 Å²	47	84.8 Å²	84.8	32%	0.318	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	122.1	-175.8	-179.6	0	0	0	0	111.7	C1234	C1234-C1245 VanDerWaalsContact CA-SG 3.58Å; C1234-C1245 HydrophobicContact CB-CB 3.67Å; C1234-C1245 WeakPolarHBondContact CB-SG 3.49Å; C1234-C1245 WeakPolarHBondContact SG-CB 3.24Å; C1234-C1245 PolarHBondContact SG-O 3.14Å; C1234-C1245 CovalentContact SG-SG 2.04Å; C1234-C1245 PolarHBondContact SG-SG 3.31Å
1246	E	63.6	Low	65.2	Low	82 Å²	82	81.6 Å²	81.6	38%	0.383	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.2	167.1	-177.2	180	-147.6	0	0	109.5	V1248 Y1252 R1253 H1255	E1246-V1248 HydrophobicContact CB-CG2 4.47Å; E1246-V1248 HydrophobicContact CG-CG2 3.77Å; E1246-Y1252 CarbonylContact O-C 3.53Å; E1246-Y1252 WeakPolarHBondContact O-CA 3.36Å; E1246-R1253 HydrophobicContact CB-CB 4.4Å; E1246-R1253 PolarHBondContact N-O 3.49Å; E1246-R1253 PolarHBondContact O-N 2.87Å; E1246-R1253 IonicContact OE2-NH1 2.69Å; E1246-H1255 IonicContact OE2-CD2 3.69Å; E1246-H1255 IonicContact OE2-CE1 3.7Å; E1246-H1255 IonicContact OE2-NE2 2.57Å; E1246-H1255 PolarHBondContact OE2-NE2 3.44Å
1247	V	58.5	Low	65.9	Low	78 Å²	78	77.1 Å²	77.1	47%	0.473	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	120.2	174.6	-175.5	0	0	0	0	108.4	T1233	T1233-V1247 VanDerWaalsContact OG1-CG2 3.31Å; T1233-V1247 WeakPolarHBondContact OG1-CG2 3.45Å
1248	V	54.2	Low	66.1	Low	45 Å²	45	75 Å²	75	27%	0.273	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	117	-175.6	-172.9	0	0	0	0	108.7	E1246 N1250 D1251 R1253	E1246-V1248 HydrophobicContact CB-CG2 4.47Å; E1246-V1248 HydrophobicContact CG-CG2 3.77Å; V1248-N1250 VanDerWaalsContact C-N 3.34Å; V1248-N1250 PolarHBondContact O-N 2.87Å; V1248-D1251 PolarHBondContact N-O 3.21Å; V1248-D1251 CarbonylContact O-C 3.46Å; V1248-D1251 PolarHBondContact O-N 2.87Å; V1248-D1251 VanDerWaalsContact O-O 3.11Å; V1248-R1253 HydrophobicContact CG2-CB 4.06Å
1249	D	50.6	Low	65.7	Low	162 Å²	162	75.7 Å²	75.7	87%	0.866	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.6	50.2	173.6	-61.8	-30.2	0	0	0	115.4	D1251	D1249-D1251 VanDerWaalsContact C-N 3.25Å; D1249-D1251 PolarHBondContact O-N 3.04Å
1250	N	48.8	Very low	65.9	Low	178 Å²	178	76.6 Å²	76.6	95%	0.952	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	2.7	-176.5	-70.1	-26.4	0	0	0	117.1	V1248	V1248-N1250 VanDerWaalsContact C-N 3.34Å; V1248-N1250 PolarHBondContact O-N 2.87Å
1251	D	48.1	Very low	65.8	Low	84 Å²	84	74.6 Å²	74.6	45%	0.449	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	178.7	162.7	-161.8	3.1	0	0	0	110.1	V1248 D1249 K1263	V1248-D1251 PolarHBondContact N-O 3.21Å; V1248-D1251 CarbonylContact O-C 3.46Å; V1248-D1251 PolarHBondContact O-N 2.87Å; V1248-D1251 VanDerWaalsContact O-O 3.11Å; D1249-D1251 VanDerWaalsContact C-N 3.25Å; D1249-D1251 PolarHBondContact O-N 3.04Å; D1251-K1263 IonicContact OD1-NZ 3.6Å; D1251-K1263 PolarHBondContact OD1-NZ 3.22Å; D1251-K1263 IonicContact OD2-NZ 3.82Å; D1251-K1263 PolarHBondContact OD2-NZ 2.87Å
1252	Y	69.4	Low	65.7	Low	54 Å²	54	72.6 Å²	72.6	21%	0.212	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.1	170.5	65.5	-78.3	0	0	0	111	L1238 E1246 K1263 N1264	L1238-Y1252 HydrophobicContact CB-CD2 4.2Å; L1238-Y1252 HydrophobicContact CB-CE2 3.72Å; L1238-Y1252 HydrophobicContact CD1-CD1 3.88Å; L1238-Y1252 HydrophobicContact CD1-CD2 4.5Å; L1238-Y1252 HydrophobicContact CD1-CE1 3.52Å; L1238-Y1252 HydrophobicContact CD1-CE2 4.18Å; L1238-Y1252 HydrophobicContact CD1-CG 4.37Å; E1246-Y1252 CarbonylContact O-C 3.53Å; E1246-Y1252 WeakPolarHBondContact O-CA 3.36Å; Y1252-K1263 HydrophobicContact CE2-CG 4.48Å; Y1252-N1264 PolarHBondContact OH-OD1 2.94Å; Y1252-N1264 VanDerWaalsContact OH-OD1 3.12Å
1253	R	61.9	Low	66	Low	136 Å²	136	75 Å²	75	51%	0.513	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.3	169.9	171.9	-179.8	-74.7	171.9	-8	108.4	E1246 V1248	E1246-R1253 HydrophobicContact CB-CB 4.4Å; E1246-R1253 PolarHBondContact N-O 3.49Å; E1246-R1253 PolarHBondContact O-N 2.87Å; E1246-R1253 IonicContact OE2-NH1 2.69Å; V1248-R1253 HydrophobicContact CG2-CB 4.06Å
1254	C	76.2	Confident	66.3	Low	17 Å²	17	76.2 Å²	76.2	12%	0.115	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118	170.3	-61.7	0	0	0	0	110.1	C1239 C1256 K1263 C1265	C1239-C1254 WeakPolarHBondContact CA-SG 3.31Å; C1239-C1254 HydrophobicContact CB-CB 3.71Å; C1239-C1254 WeakPolarHBondContact CB-SG 3.02Å; C1239-C1254 WeakPolarHBondContact SG-CA 3.48Å; C1239-C1254 WeakPolarHBondContact SG-CB 3.48Å; C1239-C1254 CovalentContact SG-SG 2.03Å; C1239-C1254 PolarHBondContact SG-SG 3.29Å; C1254-C1256 PolarHBondContact O-N 2.91Å; C1254-K1263 WeakPolarHBondContact CB-O 3.44Å; C1254-K1263 PolarHBondContact SG-O 3Å; C1254-C1265 VanDerWaalsContact CB-SG 3.57Å
1255	H	74.6	Confident	66.6	Low	83 Å²	83	71.7 Å²	71.7	38%	0.384	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	101	168	-67	-81.5	0	0	0	108.3	G1243 T1244 E1246	G1243-H1255 CarbonylContact C-O 3.26Å; G1243-H1255 VanDerWaalsContact CA-O 3.23Å; G1243-H1255 WeakPolarHBondContact CA-O 3.47Å; T1244-H1255 PolarHBondContact N-O 2.99Å; T1244-H1255 PolarHBondContact O-N 2.89Å; T1244-H1255 WeakPolarHBondContact OG1-CB 3.19Å; E1246-H1255 IonicContact OE2-CD2 3.69Å; E1246-H1255 IonicContact OE2-CE1 3.7Å; E1246-H1255 IonicContact OE2-NE2 2.57Å; E1246-H1255 PolarHBondContact OE2-NE2 3.44Å
1256	C	70.8	Confident	66.8	Low	45 Å²	45	73 Å²	73	30%	0.304	39%	0.391	S	S	.	.			trans	-70.6	149.5	-174.7	-53.7	0	0	0	0	112.4	C1254 F1260 C1265	C1254-C1256 PolarHBondContact O-N 2.91Å; C1256-F1260 HydrophobicContact CB-CB 4.47Å; C1256-F1260 WeakPolarHBondContact CB-O 3.3Å; C1256-C1265 WeakPolarHBondContact CA-SG 3.09Å; C1256-C1265 HydrophobicContact CB-CB 3.75Å; C1256-C1265 WeakPolarHBondContact CB-SG 3.03Å; C1256-C1265 WeakPolarHBondContact SG-CA 3.32Å; C1256-C1265 WeakPolarHBondContact SG-CB 3.21Å; C1256-C1265 CovalentContact SG-SG 2.04Å; C1256-C1265 PolarHBondContact SG-SG 3.03Å
1257	T	70.6	Confident	67	Low	59 Å²	59	73.7 Å²	73.7	36%	0.362	39%	0.394	S	S	.	.			trans	-69.7	154.8	167	59.3	0	0	0	0	109.1	N1241 G1242 L1259 F1260	N1241-T1257 PolarHBondContact O-OG1 3.46Å; G1242-T1257 WeakPolarHBondContact O-CG2 3.36Å; T1257-L1259 PolarHBondContact O-N 3.41Å; T1257-F1260 PolarHBondContact O-N 3.45Å; T1257-F1260 WeakPolarHBondContact OG1-CD2 3.46Å
1258	A	64.4	Low	67.2	Low	89 Å²	89	74.5 Å²	74.5	74%	0.736	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-0.7	-166	0	0	0	0	0	116.9
1259	L	59.8	Low	67.2	Low	75 Å²	75	76.3 Å²	76.3	39%	0.393	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-14	175.4	-51.9	-178.9	0	0	0	112.9	T1257 E1268 Y1269 Y1271	T1257-L1259 PolarHBondContact O-N 3.41Å; L1259-E1268 CarbonylContact O-C 3.56Å; L1259-E1268 WeakPolarHBondContact O-CA 3.21Å; L1259-Y1269 PolarHBondContact O-N 3.47Å; L1259-Y1271 HydrophobicContact CD2-CE2 4.06Å; L1259-Y1271 WeakPolarHBondContact CD2-OH 3.39Å
1260	F	78	Confident	67.9	Low	36 Å²	36	71.9 Å²	71.9	16%	0.158	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	156.2	-166	-61	-84.9	0	0	0	114.4	N1241 C1256 T1257 C1265 H1267 E1268	N1241-F1260 HydrophobicContact CB-CB 4.33Å; N1241-F1260 HydrophobicContact CB-CD1 3.66Å; N1241-F1260 HydrophobicContact CB-CD2 3.6Å; N1241-F1260 HydrophobicContact CB-CE1 3.78Å; N1241-F1260 HydrophobicContact CB-CE2 3.72Å; N1241-F1260 HydrophobicContact CB-CG 3.58Å; N1241-F1260 HydrophobicContact CB-CZ 3.82Å; N1241-F1260 WeakPolarHBondContact ND2-CD1 3.4Å; C1256-F1260 HydrophobicContact CB-CB 4.47Å; C1256-F1260 WeakPolarHBondContact CB-O 3.3Å; T1257-F1260 PolarHBondContact O-N 3.45Å; T1257-F1260 WeakPolarHBondContact OG1-CD2 3.46Å; F1260-C1265 HydrophobicContact CB-CB 4.26Å; F1260-H1267 CarbonylContact C-O 3.2Å; F1260-H1267 WeakPolarHBondContact CA-O 3.43Å; F1260-H1267 WeakPolarHBondContact CB-O 3.26Å; F1260-H1267 WeakPolarHBondContact CD1-O 3.16Å; F1260-E1268 HydrophobicContact CD1-CB 3.94Å; F1260-E1268 HydrophobicContact CD1-CG 4.1Å; F1260-E1268 HydrophobicContact CE1-CB 3.8Å; F1260-E1268 HydrophobicContact CE1-CG 3.71Å; F1260-E1268 HydrophobicContact CZ-CG 4.18Å
1261	H	74.2	Confident	68.7	Low	57 Å²	57	64.3 Å²	64.3	26%	0.264	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	176.2	179.7	68.5	-92.6	0	0	0	113.1	C1265 Q1266 H1267 Y1269	H1261-C1265 CarbonylContact O-C 3.59Å; H1261-C1265 VanDerWaalsContact O-C 3.27Å; H1261-C1265 WeakPolarHBondContact O-CA 3.29Å; H1261-Q1266 PolarHBondContact O-N 3.44Å; H1261-H1267 PolarHBondContact N-O 3Å; H1261-H1267 WeakPolarHBondContact NE2-CB 3.24Å; H1261-H1267 PolarHBondContact O-N 3.49Å; H1261-Y1269 HydrophobicContact CB-CE2 3.79Å; H1261-Y1269 AromaticContact CG-CZ 3.95Å; H1261-Y1269 AromaticContact ND1-CD1 3.71Å; H1261-Y1269 AromaticContact ND1-CD2 3.78Å; H1261-Y1269 AromaticContact ND1-CE1 3.7Å; H1261-Y1269 AromaticContact ND1-CE2 3.76Å; H1261-Y1269 AromaticContact ND1-CG 3.76Å; H1261-Y1269 AromaticContact ND1-CZ 3.73Å
1262	G	72.2	Confident	69.6	Low	34 Å²	34	62.4 Å²	62.4	35%	0.351	32%	0.321	S	S	.	.	S	Bend	trans	98.7	163.9	-173	0	0	0	0	0	113	N1264 C1265	G1262-N1264 PolarHBondContact O-N 2.91Å; G1262-N1264 VanDerWaalsContact O-N 3.1Å; G1262-C1265 PolarHBondContact O-N 3.27Å
1263	K	74.6	Confident	69.3	Low	106 Å²	106	67.3 Å²	67.3	46%	0.461	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-32.8	-175	-178.2	169.2	177.6	174.4	0	112.8	D1251 Y1252 C1254	D1251-K1263 IonicContact OD1-NZ 3.6Å; D1251-K1263 PolarHBondContact OD1-NZ 3.22Å; D1251-K1263 IonicContact OD2-NZ 3.82Å; D1251-K1263 PolarHBondContact OD2-NZ 2.87Å; Y1252-K1263 HydrophobicContact CE2-CG 4.48Å; C1254-K1263 WeakPolarHBondContact CB-O 3.44Å; C1254-K1263 PolarHBondContact SG-O 3Å
1264	N	77.1	Confident	69.1	Low	39 Å²	39	66.5 Å²	66.5	21%	0.209	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	11	-180	-67.3	20.3	0	0	0	112.3	L1238 E1240 Y1252 G1262 Q1266	L1238-N1264 WeakPolarHBondContact O-CB 3.19Å; L1238-N1264 PolarHBondContact O-ND2 3.22Å; E1240-N1264 WeakPolarHBondContact CB-O 3.36Å; E1240-N1264 PolarHBondContact N-O 3Å; Y1252-N1264 PolarHBondContact OH-OD1 2.94Å; Y1252-N1264 VanDerWaalsContact OH-OD1 3.12Å; G1262-N1264 PolarHBondContact O-N 2.91Å; G1262-N1264 VanDerWaalsContact O-N 3.1Å; N1264-Q1266 PolarHBondContact O-N 3.48Å
1265	C	80.7	Confident	68.2	Low	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	59.7	30.3	-172.1	-49.6	0	0	0	0	114.3	N1241 C1254 C1256 F1260 H1261 G1262	N1241-C1265 PolarHBondContact ND2-O 3.19Å; C1254-C1265 VanDerWaalsContact CB-SG 3.57Å; C1256-C1265 WeakPolarHBondContact CA-SG 3.09Å; C1256-C1265 HydrophobicContact CB-CB 3.75Å; C1256-C1265 WeakPolarHBondContact CB-SG 3.03Å; C1256-C1265 WeakPolarHBondContact SG-CA 3.32Å; C1256-C1265 WeakPolarHBondContact SG-CB 3.21Å; C1256-C1265 CovalentContact SG-SG 2.04Å; C1256-C1265 PolarHBondContact SG-SG 3.03Å; F1260-C1265 HydrophobicContact CB-CB 4.26Å; H1261-C1265 CarbonylContact O-C 3.59Å; H1261-C1265 VanDerWaalsContact O-C 3.27Å; H1261-C1265 WeakPolarHBondContact O-CA 3.29Å; G1262-C1265 PolarHBondContact O-N 3.27Å
1266	Q	74.2	Confident	68.1	Low	74 Å²	74	69 Å²	69	35%	0.346	36%	0.363	S	S	.	.			trans	-83	-9	-171	76.3	-76	-7.3	0	0	115.4	H1261 N1264	H1261-Q1266 PolarHBondContact O-N 3.44Å; N1264-Q1266 PolarHBondContact O-N 3.48Å
1267	H	69	Low	68.2	Low	97 Å²	97	68.4 Å²	68.4	45%	0.449	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.8	179.3	-59.8	-62.7	0	0	0	111.1	F1260 H1261	F1260-H1267 CarbonylContact C-O 3.2Å; F1260-H1267 WeakPolarHBondContact CA-O 3.43Å; F1260-H1267 WeakPolarHBondContact CB-O 3.26Å; F1260-H1267 WeakPolarHBondContact CD1-O 3.16Å; H1261-H1267 PolarHBondContact N-O 3Å; H1261-H1267 WeakPolarHBondContact NE2-CB 3.24Å; H1261-H1267 PolarHBondContact O-N 3.49Å
1268	E	60.7	Low	68.6	Low	94 Å²	94	66.1 Å²	66.1	44%	0.439	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.4	177.5	-160.9	-178.4	141.4	0	0	109.6	L1259 F1260 N1290	L1259-E1268 CarbonylContact O-C 3.56Å; L1259-E1268 WeakPolarHBondContact O-CA 3.21Å; F1260-E1268 HydrophobicContact CD1-CB 3.94Å; F1260-E1268 HydrophobicContact CD1-CG 4.1Å; F1260-E1268 HydrophobicContact CE1-CB 3.8Å; F1260-E1268 HydrophobicContact CE1-CG 3.71Å; F1260-E1268 HydrophobicContact CZ-CG 4.18Å; E1268-N1290 PolarHBondContact OE1-ND2 3.05Å
1269	Y	54.3	Low	68.9	Low	83 Å²	83	63.1 Å²	63.1	33%	0.325	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-77.6	128.5	177.9	-83.9	-70.3	0	0	0	112	L1259 H1261 Y1271 L1275 N1290	L1259-Y1269 PolarHBondContact O-N 3.47Å; H1261-Y1269 HydrophobicContact CB-CE2 3.79Å; H1261-Y1269 AromaticContact CG-CZ 3.95Å; H1261-Y1269 AromaticContact ND1-CD1 3.71Å; H1261-Y1269 AromaticContact ND1-CD2 3.78Å; H1261-Y1269 AromaticContact ND1-CE1 3.7Å; H1261-Y1269 AromaticContact ND1-CE2 3.76Å; H1261-Y1269 AromaticContact ND1-CG 3.76Å; H1261-Y1269 AromaticContact ND1-CZ 3.73Å; Y1269-Y1271 PolarHBondContact O-N 2.86Å; Y1269-L1275 HydrophobicContact CD1-CB 4.46Å; Y1269-L1275 HydrophobicContact CD2-CD2 4.39Å; Y1269-L1275 HydrophobicContact CG-CD2 4.16Å; Y1269-N1290 PolarHBondContact O-ND2 2.95Å; Y1269-N1290 PolarHBondContact O-OD1 2.82Å
1270	I	66.5	Low	69.2	Low	69 Å²	69	61.2 Å²	61.2	35%	0.354	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-81.4	117	178.3	-55.2	-179.7	0	0	0	111.4	E1273 E1274 L1275 N1290	I1270-E1273 HydrophobicContact CG2-CB 4.01Å; I1270-E1273 HydrophobicContact CG2-CG 4.31Å; I1270-E1274 HydrophobicContact CB-CG 4.12Å; I1270-E1274 PolarHBondContact N-OE2 3.3Å; I1270-E1274 PolarHBondContact O-N 2.89Å; I1270-L1275 PolarHBondContact O-N 2.84Å; I1270-L1275 VanDerWaalsContact O-N 3.16Å; I1270-N1290 WeakPolarHBondContact CA-OD1 3.21Å
1271	Y	64.7	Low	68.4	Low	20 Å²	20	62.6 Å²	62.6	8%	0.078	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-72.6	140.7	-176.4	-78.9	-62.4	0	0	0	114.3	L1259 Y1269 E1273 L1275 P1277 N1290 Y1292	L1259-Y1271 HydrophobicContact CD2-CE2 4.06Å; L1259-Y1271 WeakPolarHBondContact CD2-OH 3.39Å; Y1269-Y1271 PolarHBondContact O-N 2.86Å; Y1271-E1273 PolarHBondContact O-N 2.72Å; Y1271-E1273 VanDerWaalsContact O-N 3.14Å; Y1271-L1275 HydrophobicContact CD1-CB 4.47Å; Y1271-L1275 HydrophobicContact CD1-CD2 4.4Å; Y1271-L1275 HydrophobicContact CD1-CG 4.47Å; Y1271-L1275 HydrophobicContact CE1-CD2 3.85Å; Y1271-L1275 HydrophobicContact CE1-CG 4.31Å; Y1271-P1277 HydrophobicContact CD1-CG 3.93Å; Y1271-P1277 HydrophobicContact CE1-CB 4.29Å; Y1271-P1277 HydrophobicContact CE1-CG 3.98Å; Y1271-N1290 WeakPolarHBondContact CD2-O 3.28Å; Y1271-N1290 PolarHBondContact N-OD1 2.84Å; Y1271-Y1292 AromaticContact CD1-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD1-CD1 3.62Å; Y1271-Y1292 AromaticContact CD1-CE1 3.95Å; Y1271-Y1292 HydrophobicContact CD1-CE1 3.95Å; Y1271-Y1292 HydrophobicContact CD1-CG 4.34Å; Y1271-Y1292 AromaticContact CD2-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD2-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD2-CE1 4.14Å; Y1271-Y1292 AromaticContact CE1-CD1 3.72Å; Y1271-Y1292 HydrophobicContact CE1-CD1 3.72Å; Y1271-Y1292 AromaticContact CE1-CE1 3.53Å; Y1271-Y1292 HydrophobicContact CE1-CE1 3.53Å; Y1271-Y1292 AromaticContact CE2-CD1 3.69Å; Y1271-Y1292 HydrophobicContact CE2-CD1 3.69Å; Y1271-Y1292 AromaticContact CE2-CE1 3.71Å; Y1271-Y1292 HydrophobicContact CE2-CE1 3.71Å; Y1271-Y1292 AromaticContact CG-CD1 3.56Å; Y1271-Y1292 HydrophobicContact CG-CD1 3.56Å; Y1271-Y1292 HydrophobicContact CG-CE1 4.23Å; Y1271-Y1292 HydrophobicContact CG-CG 4.32Å; Y1271-Y1292 AromaticContact CZ-CD1 3.73Å; Y1271-Y1292 AromaticContact CZ-CE1 3.38Å
1272	C	67	Low	68.4	Low	43 Å²	43	60.1 Å²	60.1	29%	0.291	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	-7.5	-172.8	-46.5	0	0	0	0	116	L1275 C1284 I1285 S1286	C1272-L1275 PolarHBondContact N-O 3.4Å; C1272-C1284 WeakPolarHBondContact CA-SG 3.37Å; C1272-C1284 HydrophobicContact CB-CB 3.79Å; C1272-C1284 WeakPolarHBondContact CB-SG 3.48Å; C1272-C1284 VanDerWaalsContact SG-C 3.54Å; C1272-C1284 WeakPolarHBondContact SG-CB 3.3Å; C1272-C1284 CovalentContact SG-SG 2.03Å; C1272-C1284 PolarHBondContact SG-SG 3.01Å; C1272-I1285 VanDerWaalsContact SG-C 3.52Å; C1272-I1285 PolarHBondContact SG-N 2.9Å; C1272-I1285 VanDerWaalsContact SG-N 3.44Å; C1272-S1286 PolarHBondContact SG-N 3.27Å; C1272-S1286 VanDerWaalsContact SG-N 3.4Å
1273	E	63.4	Low	68.5	Low	157 Å²	157	64.9 Å²	64.9	73%	0.734	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-55.4	175	-64.1	-175.7	178.3	0	0	111.3	I1270 Y1271	I1270-E1273 HydrophobicContact CG2-CB 4.01Å; I1270-E1273 HydrophobicContact CG2-CG 4.31Å; Y1271-E1273 PolarHBondContact O-N 2.72Å; Y1271-E1273 VanDerWaalsContact O-N 3.14Å
1274	E	58.3	Low	68.5	Low	120 Å²	120	61 Å²	61	56%	0.561	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-33.1	177.5	-60.6	179.2	143.7	0	0	112.3	I1270	I1270-E1274 HydrophobicContact CB-CG 4.12Å; I1270-E1274 PolarHBondContact N-OE2 3.3Å; I1270-E1274 PolarHBondContact O-N 2.89Å
1275	L	58.1	Low	68.4	Low	60 Å²	60	61.5 Å²	61.5	31%	0.314	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-132.5	118.8	-177.1	-176.2	63.3	0	0	0	111	Y1269 I1270 Y1271 C1272 P1277	Y1269-L1275 HydrophobicContact CD1-CB 4.46Å; Y1269-L1275 HydrophobicContact CD2-CD2 4.39Å; Y1269-L1275 HydrophobicContact CG-CD2 4.16Å; I1270-L1275 PolarHBondContact O-N 2.84Å; I1270-L1275 VanDerWaalsContact O-N 3.16Å; Y1271-L1275 HydrophobicContact CD1-CB 4.47Å; Y1271-L1275 HydrophobicContact CD1-CD2 4.4Å; Y1271-L1275 HydrophobicContact CD1-CG 4.47Å; Y1271-L1275 HydrophobicContact CE1-CD2 3.85Å; Y1271-L1275 HydrophobicContact CE1-CG 4.31Å; C1272-L1275 PolarHBondContact N-O 3.4Å; L1275-P1277 WeakPolarHBondContact O-CD 3.39Å
1276	N	71.7	Confident	67.9	Low	92 Å²	92	64.6 Å²	64.6	49%	0.492	35%	0.347	S	S	.	.			trans	-99.8	107.6	169.6	-178.7	9.1	0	0	0	110.4	C1278 C1284	N1276-C1278 VanDerWaalsContact C-N 3.33Å; N1276-C1278 WeakPolarHBondContact OD1-CB 3.29Å; N1276-C1278 PolarHBondContact OD1-N 3.12Å; N1276-C1284 WeakPolarHBondContact OD1-CB 3.48Å
1277	P	72.6	Confident	67.5	Low	33 Å²	33	62.6 Å²	62.6	21%	0.214	34%	0.339	C	S	.	.			trans	-79.7	-12.4	178.1	32.2	-34.5	0	0	0	113.6	Y1271 L1275 G1279 Y1292	Y1271-P1277 HydrophobicContact CD1-CG 3.93Å; Y1271-P1277 HydrophobicContact CE1-CB 4.29Å; Y1271-P1277 HydrophobicContact CE1-CG 3.98Å; L1275-P1277 WeakPolarHBondContact O-CD 3.39Å; P1277-G1279 PolarHBondContact O-N 3.45Å; P1277-Y1292 HydrophobicContact CB-CD2 4.4Å; P1277-Y1292 HydrophobicContact CB-CE1 4.41Å; P1277-Y1292 HydrophobicContact CB-CE2 3.81Å; P1277-Y1292 HydrophobicContact CG-CD1 3.96Å; P1277-Y1292 HydrophobicContact CG-CD2 3.36Å; P1277-Y1292 HydrophobicContact CG-CE1 3.88Å; P1277-Y1292 HydrophobicContact CG-CE2 3.25Å; P1277-Y1292 HydrophobicContact CG-CG 3.72Å
1278	C	78.3	Confident	67.2	Low	10 Å²	10	63.7 Å²	63.7	7%	0.068	35%	0.354	C	S	.	.			trans	-79.5	105.7	-171.5	-53.3	0	0	0	0	111.9	N1276 G1282 C1284 C1294	N1276-C1278 VanDerWaalsContact C-N 3.33Å; N1276-C1278 WeakPolarHBondContact OD1-CB 3.29Å; N1276-C1278 PolarHBondContact OD1-N 3.12Å; C1278-G1282 VanDerWaalsContact CB-O 3.23Å; C1278-G1282 WeakPolarHBondContact CB-O 3.42Å; C1278-C1284 VanDerWaalsContact SG-CA 3.52Å; C1278-C1294 WeakPolarHBondContact CA-SG 3.22Å; C1278-C1294 HydrophobicContact CB-CB 3.71Å; C1278-C1294 WeakPolarHBondContact CB-SG 3.31Å; C1278-C1294 WeakPolarHBondContact SG-CA 3.33Å; C1278-C1294 WeakPolarHBondContact SG-CB 3.26Å; C1278-C1294 CovalentContact SG-SG 2.03Å; C1278-C1294 PolarHBondContact SG-SG 3.14Å
1279	G	72.3	Confident	67.1	Low	26 Å²	26	68.9 Å²	68.9	27%	0.268	38%	0.376	S	S	.	.			trans	-70	169.5	176.8	0	0	0	0	0	113.6	P1277 G1281 G1282 D1304	P1277-G1279 PolarHBondContact O-N 3.45Å; G1279-G1281 VanDerWaalsContact C-N 3.26Å; G1279-G1281 PolarHBondContact O-N 3.22Å; G1279-G1281 VanDerWaalsContact O-N 3.11Å; G1279-G1282 PolarHBondContact O-N 2.96Å; G1279-D1304 PolarHBondContact N-O 2.97Å
1280	N	65.7	Low	67.4	Low	36 Å²	36	66.8 Å²	66.8	19%	0.193	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	34.8	167.8	-57.6	-52.5	0	0	0	115.5	G1282 L1297 W1300 C1305	N1280-G1282 PolarHBondContact O-N 2.88Å; N1280-L1297 WeakPolarHBondContact O-CD1 3.11Å; N1280-W1300 HydrophobicContact CB-CD2 3.69Å; N1280-W1300 HydrophobicContact CB-CE3 4.09Å; N1280-W1300 HydrophobicContact CB-CG 4.08Å; N1280-W1300 HydrophobicContact CB-CH2 4.32Å; N1280-W1300 HydrophobicContact CB-CZ2 3.95Å; N1280-W1300 HydrophobicContact CB-CZ3 4.39Å; N1280-W1300 WeakPolarHBondContact ND2-CZ3 3.35Å; N1280-C1305 PolarHBondContact ND2-O 3.01Å
1281	G	61.7	Low	67.2	Low	64 Å²	64	67.6 Å²	67.6	66%	0.66	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	12.5	-178.3	0	0	0	0	0	114.2	G1279	G1279-G1281 VanDerWaalsContact C-N 3.26Å; G1279-G1281 PolarHBondContact O-N 3.22Å; G1279-G1281 VanDerWaalsContact O-N 3.11Å
1282	G	72.6	Confident	67.9	Low	5 Å²	5	69.3 Å²	69.3	5%	0.052	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-60.1	138.8	172.5	0	0	0	0	0	111.7	C1278 G1279 N1280 E1295	C1278-G1282 VanDerWaalsContact CB-O 3.23Å; C1278-G1282 WeakPolarHBondContact CB-O 3.42Å; G1279-G1282 PolarHBondContact O-N 2.96Å; N1280-G1282 PolarHBondContact O-N 2.88Å; G1282-E1295 WeakPolarHBondContact CA-O 3.49Å
1283	K	75.4	Confident	68.3	Low	134 Å²	134	70 Å²	70	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	119.3	-176.8	-177.2	-176.2	177.5	-172.8	0	110.6	C1294 E1295	K1283-C1294 WeakPolarHBondContact O-CA 3.21Å; K1283-E1295 HydrophobicContact CB-CB 4.21Å; K1283-E1295 PolarHBondContact N-O 3.16Å; K1283-E1295 PolarHBondContact O-N 2.94Å
1284	C	73.4	Confident	68.8	Low	26 Å²	26	63.1 Å²	63.1	18%	0.176	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	134.2	173.4	-157.8	0	0	0	0	111.2	C1272 N1276 C1278	C1272-C1284 WeakPolarHBondContact CA-SG 3.37Å; C1272-C1284 HydrophobicContact CB-CB 3.79Å; C1272-C1284 WeakPolarHBondContact CB-SG 3.48Å; C1272-C1284 VanDerWaalsContact SG-C 3.54Å; C1272-C1284 WeakPolarHBondContact SG-CB 3.3Å; C1272-C1284 CovalentContact SG-SG 2.03Å; C1272-C1284 PolarHBondContact SG-SG 3.01Å; N1276-C1284 WeakPolarHBondContact OD1-CB 3.48Å; C1278-C1284 VanDerWaalsContact SG-CA 3.52Å
1285	I	75.6	Confident	69.6	Low	49 Å²	49	61.1 Å²	61.1	25%	0.251	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	113.4	175.2	-58.4	165.9	0	0	0	107.2	C1272 Y1292 R1293 E1295	C1272-I1285 VanDerWaalsContact SG-C 3.52Å; C1272-I1285 PolarHBondContact SG-N 2.9Å; C1272-I1285 VanDerWaalsContact SG-N 3.44Å; I1285-Y1292 CarbonylContact O-C 3.53Å; I1285-Y1292 VanDerWaalsContact O-CA 3.28Å; I1285-Y1292 WeakPolarHBondContact O-CA 3.49Å; I1285-R1293 WeakPolarHBondContact CB-O 3.42Å; I1285-R1293 PolarHBondContact N-O 2.8Å; I1285-R1293 PolarHBondContact O-N 2.88Å; I1285-E1295 HydrophobicContact CD1-CB 4.15Å
1286	S	70.2	Confident	70.4	Confident	64 Å²	64	60.4 Å²	60.4	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.8	178.6	-173.1	0	0	0	0	110.7	C1272	C1272-S1286 PolarHBondContact SG-N 3.27Å; C1272-S1286 VanDerWaalsContact SG-N 3.4Å
1287	L	66.2	Low	70.2	Confident	33 Å²	33	60.8 Å²	60.8	17%	0.173	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	151.2	-177.2	-59.1	176.8	0	0	0	110.6	N1290 N1291 R1293	L1287-N1290 PolarHBondContact O-N 3.06Å; L1287-N1291 WeakPolarHBondContact CA-O 3.06Å; L1287-N1291 HydrophobicContact CB-CB 4.09Å; L1287-N1291 WeakPolarHBondContact CB-O 3.02Å; L1287-N1291 PolarHBondContact N-O 3.41Å; L1287-N1291 PolarHBondContact O-N 3.5Å; L1287-R1293 HydrophobicContact CD1-CB 4.2Å
1288	P	63.3	Low	69.8	Low	119 Å²	119	64.2 Å²	64.2	77%	0.773	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	140.8	180	-25.5	34.6	0	0	0	113.4
1289	K	58	Low	69.1	Low	204 Å²	204	64.3 Å²	64.3	89%	0.887	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	49.6	-171.2	-50.5	-178.7	177.9	-174.4	0	113.7	N1291	K1289-N1291 PolarHBondContact O-N 3.2Å
1290	N	59.7	Low	68.9	Low	39 Å²	39	64.9 Å²	64.9	21%	0.209	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.7	54.9	172.2	-166.2	36.7	0	0	0	113.6	E1268 Y1269 I1270 Y1271 L1287	E1268-N1290 PolarHBondContact OE1-ND2 3.05Å; Y1269-N1290 PolarHBondContact O-ND2 2.95Å; Y1269-N1290 PolarHBondContact O-OD1 2.82Å; I1270-N1290 WeakPolarHBondContact CA-OD1 3.21Å; Y1271-N1290 WeakPolarHBondContact CD2-O 3.28Å; Y1271-N1290 PolarHBondContact N-OD1 2.84Å; L1287-N1290 PolarHBondContact O-N 3.06Å
1291	N	63.8	Low	69.2	Low	86 Å²	86	66.4 Å²	66.4	46%	0.46	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	169.4	176.8	-173.9	24.1	0	0	0	108.4	L1287 K1289	L1287-N1291 WeakPolarHBondContact CA-O 3.06Å; L1287-N1291 HydrophobicContact CB-CB 4.09Å; L1287-N1291 WeakPolarHBondContact CB-O 3.02Å; L1287-N1291 PolarHBondContact N-O 3.41Å; L1287-N1291 PolarHBondContact O-N 3.5Å; K1289-N1291 PolarHBondContact O-N 3.2Å
1292	Y	78	Confident	69.5	Low	55 Å²	55	64.9 Å²	64.9	22%	0.216	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	164.1	-177.6	64.6	-83.1	0	0	0	113.1	Y1271 P1277 I1285 D1304	Y1271-Y1292 AromaticContact CD1-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD1-CD1 3.62Å; Y1271-Y1292 AromaticContact CD1-CE1 3.95Å; Y1271-Y1292 HydrophobicContact CD1-CE1 3.95Å; Y1271-Y1292 HydrophobicContact CD1-CG 4.34Å; Y1271-Y1292 AromaticContact CD2-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD2-CD1 3.62Å; Y1271-Y1292 HydrophobicContact CD2-CE1 4.14Å; Y1271-Y1292 AromaticContact CE1-CD1 3.72Å; Y1271-Y1292 HydrophobicContact CE1-CD1 3.72Å; Y1271-Y1292 AromaticContact CE1-CE1 3.53Å; Y1271-Y1292 HydrophobicContact CE1-CE1 3.53Å; Y1271-Y1292 AromaticContact CE2-CD1 3.69Å; Y1271-Y1292 HydrophobicContact CE2-CD1 3.69Å; Y1271-Y1292 AromaticContact CE2-CE1 3.71Å; Y1271-Y1292 HydrophobicContact CE2-CE1 3.71Å; Y1271-Y1292 AromaticContact CG-CD1 3.56Å; Y1271-Y1292 HydrophobicContact CG-CD1 3.56Å; Y1271-Y1292 HydrophobicContact CG-CE1 4.23Å; Y1271-Y1292 HydrophobicContact CG-CG 4.32Å; Y1271-Y1292 AromaticContact CZ-CD1 3.73Å; Y1271-Y1292 AromaticContact CZ-CE1 3.38Å; P1277-Y1292 HydrophobicContact CB-CD2 4.4Å; P1277-Y1292 HydrophobicContact CB-CE1 4.41Å; P1277-Y1292 HydrophobicContact CB-CE2 3.81Å; P1277-Y1292 HydrophobicContact CG-CD1 3.96Å; P1277-Y1292 HydrophobicContact CG-CD2 3.36Å; P1277-Y1292 HydrophobicContact CG-CE1 3.88Å; P1277-Y1292 HydrophobicContact CG-CE2 3.25Å; P1277-Y1292 HydrophobicContact CG-CG 3.72Å; I1285-Y1292 CarbonylContact O-C 3.53Å; I1285-Y1292 VanDerWaalsContact O-CA 3.28Å; I1285-Y1292 WeakPolarHBondContact O-CA 3.49Å; Y1292-D1304 PolarHBondContact OH-OD1 3.13Å; Y1292-D1304 VanDerWaalsContact OH-OD1 3.09Å
1293	R	76.9	Confident	69.6	Low	58 Å²	58	71.2 Å²	71.2	22%	0.219	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	133.3	164.3	170.4	175.1	169.9	-83.4	1	108.4	A840 I1285 L1287 E1295	A840-R1293 PolarHBondContact O-NH2 3.36Å; A840-R1293 VanDerWaalsContact O-NH2 3.16Å; I1285-R1293 WeakPolarHBondContact CB-O 3.42Å; I1285-R1293 PolarHBondContact N-O 2.8Å; I1285-R1293 PolarHBondContact O-N 2.88Å; L1287-R1293 HydrophobicContact CD1-CB 4.2Å; R1293-E1295 IonicContact CZ-OE1 3.7Å; R1293-E1295 VanDerWaalsContact CZ-OE1 3.28Å; R1293-E1295 IonicContact NH1-OE1 2.71Å; R1293-E1295 PolarHBondContact NH1-OE1 2.95Å; R1293-E1295 IonicContact NH2-OE1 2.66Å; R1293-E1295 PolarHBondContact NH2-OE1 3.35Å
1294	C	72.8	Confident	69.4	Low	13 Å²	13	66.6 Å²	66.6	9%	0.088	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	140	169.1	-58.5	0	0	0	0	110.9	C1278 K1283 N1303 C1305	C1278-C1294 WeakPolarHBondContact CA-SG 3.22Å; C1278-C1294 HydrophobicContact CB-CB 3.71Å; C1278-C1294 WeakPolarHBondContact CB-SG 3.31Å; C1278-C1294 WeakPolarHBondContact SG-CA 3.33Å; C1278-C1294 WeakPolarHBondContact SG-CB 3.26Å; C1278-C1294 CovalentContact SG-SG 2.03Å; C1278-C1294 PolarHBondContact SG-SG 3.14Å; K1283-C1294 WeakPolarHBondContact O-CA 3.21Å; C1294-N1303 VanDerWaalsContact CB-O 3.29Å; C1294-N1303 WeakPolarHBondContact CB-O 3.48Å; C1294-N1303 PolarHBondContact SG-O 3.21Å; C1294-C1305 VanDerWaalsContact CB-SG 3.59Å
1295	E	75.2	Confident	69.5	Low	77 Å²	77	65.4 Å²	65.4	36%	0.36	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	104.1	173.4	-155.5	156.1	-109.7	0	0	108.5	G1282 K1283 I1285 R1293	G1282-E1295 WeakPolarHBondContact CA-O 3.49Å; K1283-E1295 HydrophobicContact CB-CB 4.21Å; K1283-E1295 PolarHBondContact N-O 3.16Å; K1283-E1295 PolarHBondContact O-N 2.94Å; I1285-E1295 HydrophobicContact CD1-CB 4.15Å; R1293-E1295 IonicContact CZ-OE1 3.7Å; R1293-E1295 VanDerWaalsContact CZ-OE1 3.28Å; R1293-E1295 IonicContact NH1-OE1 2.71Å; R1293-E1295 PolarHBondContact NH1-OE1 2.95Å; R1293-E1295 IonicContact NH2-OE1 2.66Å; R1293-E1295 PolarHBondContact NH2-OE1 3.35Å
1296	C	75.7	Confident	69.3	Low	46 Å²	46	67.7 Å²	67.7	31%	0.311	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-81.8	146.8	-166.7	-52.6	0	0	0	0	113.6	W1300 C1305	C1296-W1300 HydrophobicContact CB-CB 4.18Å; C1296-W1300 WeakPolarHBondContact CB-O 3.46Å; C1296-C1305 WeakPolarHBondContact CA-SG 3.17Å; C1296-C1305 HydrophobicContact CB-CB 3.76Å; C1296-C1305 WeakPolarHBondContact CB-SG 3.25Å; C1296-C1305 WeakPolarHBondContact SG-CA 3.36Å; C1296-C1305 WeakPolarHBondContact SG-CB 3.28Å; C1296-C1305 CovalentContact SG-SG 2.04Å; C1296-C1305 PolarHBondContact SG-SG 3.44Å
1297	L	67.4	Low	69.3	Low	100 Å²	100	68.9 Å²	68.9	52%	0.524	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-66.7	151	168	-63.2	180	0	0	0	110.5	N1280 G1299 W1300	N1280-L1297 WeakPolarHBondContact O-CD1 3.11Å; L1297-G1299 PolarHBondContact O-N 2.81Å; L1297-W1300 PolarHBondContact O-N 3.05Å
1298	T	64.3	Low	69.2	Low	105 Å²	105	69.1 Å²	69.1	64%	0.644	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	127.1	-177	53.6	0	0	0	0	111	I1327 N1328	T1298-I1327 WeakPolarHBondContact O-CG2 3.33Å; T1298-N1328 WeakPolarHBondContact CB-ND2 3.14Å; T1298-N1328 PolarHBondContact OG1-ND2 2.97Å
1299	G	62.6	Low	69.4	Low	11 Å²	11	67.5 Å²	67.5	11%	0.113	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	106.8	-17.5	-168.6	0	0	0	0	0	113.8	L1297 N1308 Q1309	L1297-G1299 PolarHBondContact O-N 2.81Å; G1299-N1308 PolarHBondContact O-OD1 3.4Å; G1299-Q1309 WeakPolarHBondContact O-CB 3.42Å; G1299-Q1309 PolarHBondContact O-N 3.42Å
1300	W	68.8	Low	69.7	Low	38 Å²	38	61.1 Å²	61.1	14%	0.144	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.6	178	-62.5	95	0	0	0	112.4	N1280 C1296 L1297 C1305 N1308 I1327	N1280-W1300 HydrophobicContact CB-CD2 3.69Å; N1280-W1300 HydrophobicContact CB-CE3 4.09Å; N1280-W1300 HydrophobicContact CB-CG 4.08Å; N1280-W1300 HydrophobicContact CB-CH2 4.32Å; N1280-W1300 HydrophobicContact CB-CZ2 3.95Å; N1280-W1300 HydrophobicContact CB-CZ3 4.39Å; N1280-W1300 WeakPolarHBondContact ND2-CZ3 3.35Å; C1296-W1300 HydrophobicContact CB-CB 4.18Å; C1296-W1300 WeakPolarHBondContact CB-O 3.46Å; L1297-W1300 PolarHBondContact O-N 3.05Å; W1300-C1305 HydrophobicContact CB-CB 4.31Å; W1300-N1308 HydrophobicContact CE3-CB 4.16Å; W1300-N1308 HydrophobicContact CH2-CB 4.26Å; W1300-N1308 HydrophobicContact CZ3-CB 3.85Å; W1300-I1327 HydrophobicContact CZ2-CD1 3.75Å; W1300-I1327 HydrophobicContact CZ2-CG1 3.91Å
1301	I	71.8	Confident	70.1	Confident	68 Å²	68	61.3 Å²	61.3	35%	0.349	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	178.9	178.6	64.9	177.4	0	0	0	110.7	C1305 Q1306 I1307 Q1309	I1301-C1305 CarbonylContact O-C 3.41Å; I1301-Q1306 PolarHBondContact O-N 2.95Å; I1301-I1307 HydrophobicContact CD1-CG2 4.34Å; I1301-I1307 HydrophobicContact CG1-CB 3.89Å; I1301-I1307 HydrophobicContact CG1-CG2 3.93Å; I1301-I1307 PolarHBondContact N-O 3.17Å; I1301-I1307 WeakPolarHBondContact O-CB 3.27Å; I1301-I1307 PolarHBondContact O-N 3.3Å; I1301-Q1309 HydrophobicContact CG2-CB 4.49Å
1302	G	69	Low	70.7	Confident	33 Å²	33	58.1 Å²	58.1	34%	0.34	31%	0.309	S	S	.	.	S	Bend	trans	91.4	159.9	-168.5	0	0	0	0	0	111.5	D1304 C1305	G1302-D1304 PolarHBondContact O-N 3.13Å; G1302-C1305 PolarHBondContact O-N 3.41Å
1303	N	74.1	Confident	70.1	Confident	138 Å²	138	57.9 Å²	57.9	74%	0.738	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.5	-175.4	-66.1	2.6	0	0	0	112.5	C1294	C1294-N1303 VanDerWaalsContact CB-O 3.29Å; C1294-N1303 WeakPolarHBondContact CB-O 3.48Å; C1294-N1303 PolarHBondContact SG-O 3.21Å
1304	D	70.2	Confident	69.3	Low	37 Å²	37	64.2 Å²	64.2	20%	0.198	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	14.3	-171.1	-38.1	-61.2	0	0	0	110.8	G1279 Y1292 G1302 Q1306	G1279-D1304 PolarHBondContact N-O 2.97Å; Y1292-D1304 PolarHBondContact OH-OD1 3.13Å; Y1292-D1304 VanDerWaalsContact OH-OD1 3.09Å; G1302-D1304 PolarHBondContact O-N 3.13Å; D1304-Q1306 PolarHBondContact O-N 3.11Å; D1304-Q1306 PolarHBondContact OD2-NE2 3.02Å
1305	C	76.3	Confident	69.4	Low	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	56.9	26.1	-175.7	-48.2	0	0	0	0	114.5	N1280 C1294 C1296 W1300 I1301 G1302	N1280-C1305 PolarHBondContact ND2-O 3.01Å; C1294-C1305 VanDerWaalsContact CB-SG 3.59Å; C1296-C1305 WeakPolarHBondContact CA-SG 3.17Å; C1296-C1305 HydrophobicContact CB-CB 3.76Å; C1296-C1305 WeakPolarHBondContact CB-SG 3.25Å; C1296-C1305 WeakPolarHBondContact SG-CA 3.36Å; C1296-C1305 WeakPolarHBondContact SG-CB 3.28Å; C1296-C1305 CovalentContact SG-SG 2.04Å; C1296-C1305 PolarHBondContact SG-SG 3.44Å; W1300-C1305 HydrophobicContact CB-CB 4.31Å; I1301-C1305 CarbonylContact O-C 3.41Å; G1302-C1305 PolarHBondContact O-N 3.41Å
1306	Q	70.9	Confident	69.4	Low	98 Å²	98	67.6 Å²	67.6	46%	0.458	35%	0.348	S	S	.	.			trans	-86.7	-9.1	-171.5	75.1	-84.7	59.1	0	0	114.8	I1301 D1304	I1301-Q1306 PolarHBondContact O-N 2.95Å; D1304-Q1306 PolarHBondContact O-N 3.11Å; D1304-Q1306 PolarHBondContact OD2-NE2 3.02Å
1307	I	71	Confident	69.5	Low	88 Å²	88	66.2 Å²	66.2	45%	0.451	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.8	-174.9	-52.4	178.5	0	0	0	109	I1301	I1301-I1307 HydrophobicContact CD1-CG2 4.34Å; I1301-I1307 HydrophobicContact CG1-CB 3.89Å; I1301-I1307 HydrophobicContact CG1-CG2 3.93Å; I1301-I1307 PolarHBondContact N-O 3.17Å; I1301-I1307 WeakPolarHBondContact O-CB 3.27Å; I1301-I1307 PolarHBondContact O-N 3.3Å
1308	N	62.6	Low	69.7	Low	38 Å²	38	66.5 Å²	66.5	20%	0.203	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	136.5	167.7	-166.1	67	0	0	0	109.9	G1299 W1300 D1310 D1325 G1326	G1299-N1308 PolarHBondContact O-OD1 3.4Å; W1300-N1308 HydrophobicContact CE3-CB 4.16Å; W1300-N1308 HydrophobicContact CH2-CB 4.26Å; W1300-N1308 HydrophobicContact CZ3-CB 3.85Å; N1308-D1310 PolarHBondContact O-N 3.29Å; N1308-D1325 VanDerWaalsContact ND2-CG 3.35Å; N1308-D1325 PolarHBondContact ND2-OD2 3.03Å; N1308-G1326 PolarHBondContact ND2-O 2.99Å
1309	Q	68.5	Low	69.8	Low	85 Å²	85	64.9 Å²	64.9	40%	0.397	33%	0.325	S	S	.	.			trans	-73.8	109.8	177.9	176	73.4	83.9	0	0	109.1	G1299 I1301 D1311	G1299-Q1309 WeakPolarHBondContact O-CB 3.42Å; G1299-Q1309 PolarHBondContact O-N 3.42Å; I1301-Q1309 HydrophobicContact CG2-CB 4.49Å; Q1309-D1311 PolarHBondContact O-N 2.91Å
1310	D	65.1	Low	69.8	Low	70 Å²	70	67.2 Å²	67.2	37%	0.374	35%	0.348	S	S	.	.			trans	-60.1	97.4	179.2	179.2	-3.5	0	0	0	111.8	N1308 C1312 I1313 D1325	N1308-D1310 PolarHBondContact O-N 3.29Å; D1310-C1312 VanDerWaalsContact C-N 3.34Å; D1310-C1312 WeakPolarHBondContact OD1-CA 3.34Å; D1310-C1312 VanDerWaalsContact OD1-CB 3.26Å; D1310-C1312 WeakPolarHBondContact OD1-CB 3.14Å; D1310-C1312 PolarHBondContact OD1-N 3.1Å; D1310-I1313 HydrophobicContact CB-CD1 4.06Å; D1310-I1313 HydrophobicContact CB-CG1 4.2Å; D1310-I1313 WeakPolarHBondContact O-CD1 3.45Å; D1310-I1313 WeakPolarHBondContact O-CG1 3.3Å; D1310-I1313 PolarHBondContact OD1-N 3.01Å; D1310-D1325 WeakPolarHBondContact CA-OD1 3.45Å
1311	D	66.5	Low	70.2	Confident	43 Å²	43	66 Å²	66	23%	0.23	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-82.7	-14.7	179.9	-92.5	-70.1	0	0	0	111.8	Q1309 I1313 D1325 N1328 E1329 Y1330	Q1309-D1311 PolarHBondContact O-N 2.91Å; D1311-I1313 PolarHBondContact O-N 3.48Å; D1311-D1325 PolarHBondContact N-OD1 3.03Å; D1311-N1328 WeakPolarHBondContact OD2-CA 3.25Å; D1311-N1328 PolarHBondContact OD2-N 2.73Å; D1311-E1329 PolarHBondContact OD2-N 3.01Å; D1311-Y1330 HydrophobicContact CB-CD1 4.4Å; D1311-Y1330 WeakPolarHBondContact O-CD1 3.15Å
1312	C	76.5	Confident	70.2	Confident	20 Å²	20	67.2 Å²	67.2	14%	0.135	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-65.5	-16.4	175.6	-87.4	0	0	0	0	113.2	D1310 Y1314 N1315 C1323	D1310-C1312 VanDerWaalsContact C-N 3.34Å; D1310-C1312 WeakPolarHBondContact OD1-CA 3.34Å; D1310-C1312 VanDerWaalsContact OD1-CB 3.26Å; D1310-C1312 WeakPolarHBondContact OD1-CB 3.14Å; D1310-C1312 PolarHBondContact OD1-N 3.1Å; C1312-Y1314 PolarHBondContact O-N 3.34Å; C1312-Y1314 VanDerWaalsContact O-N 3.13Å; C1312-N1315 WeakPolarHBondContact O-CB 3.05Å; C1312-N1315 PolarHBondContact O-N 3.49Å; C1312-N1315 PolarHBondContact O-ND2 2.03Å; C1312-C1323 WeakPolarHBondContact CA-SG 3.48Å; C1312-C1323 HydrophobicContact CB-CB 4.02Å; C1312-C1323 WeakPolarHBondContact CB-SG 3.49Å; C1312-C1323 WeakPolarHBondContact SG-CB 3.47Å; C1312-C1323 CovalentContact SG-SG 2.04Å; C1312-C1323 PolarHBondContact SG-SG 2.99Å
1313	I	66.1	Low	70.4	Confident	50 Å²	50	67.2 Å²	67.2	26%	0.256	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-55.9	-30.8	-179.4	-63.9	176.1	0	0	0	113.1	D1310 D1311	D1310-I1313 HydrophobicContact CB-CD1 4.06Å; D1310-I1313 HydrophobicContact CB-CG1 4.2Å; D1310-I1313 WeakPolarHBondContact O-CD1 3.45Å; D1310-I1313 WeakPolarHBondContact O-CG1 3.3Å; D1310-I1313 PolarHBondContact OD1-N 3.01Å; D1311-I1313 PolarHBondContact O-N 3.48Å
1314	Y	60.5	Low	70.2	Confident	191 Å²	191	63 Å²	63	75%	0.749	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-124.4	34.5	177.5	-62	-60.7	0	0	0	113.4	C1312	C1312-Y1314 PolarHBondContact O-N 3.34Å; C1312-Y1314 VanDerWaalsContact O-N 3.13Å
1315	N	74.5	Confident	69.7	Low	52 Å²	52	64.1 Å²	64.1	28%	0.278	34%	0.337	S	S	.	.			trans	-63.1	155.7	-179.2	79.9	81.5	0	0	0	114	C1312 C1317 C1323 Y1330	C1312-N1315 WeakPolarHBondContact O-CB 3.05Å; C1312-N1315 PolarHBondContact O-N 3.49Å; C1312-N1315 PolarHBondContact O-ND2 2.03Å; N1315-C1317 WeakPolarHBondContact OD1-CB 3.44Å; N1315-C1317 PolarHBondContact OD1-N 3.32Å; N1315-C1317 PolarHBondContact OD1-SG 3.4Å; N1315-C1323 HydrophobicContact CB-CB 4.32Å; N1315-C1323 WeakPolarHBondContact CB-SG 3.45Å; N1315-C1323 VanDerWaalsContact CG-SG 3.6Å; N1315-Y1330 VanDerWaalsContact CA-CZ 3.5Å; N1315-Y1330 HydrophobicContact CB-CD1 4.05Å; N1315-Y1330 HydrophobicContact CB-CD2 3.62Å; N1315-Y1330 HydrophobicContact CB-CE1 4.06Å; N1315-Y1330 HydrophobicContact CB-CE2 3.64Å; N1315-Y1330 HydrophobicContact CB-CG 3.85Å
1316	R	75.3	Confident	69	Low	109 Å²	109	64.7 Å²	64.7	41%	0.411	34%	0.342	S	S	.	.			trans	-107.6	27.2	171.7	-56.4	-175.2	-159.8	148.9	10	112.3	E1318 Y1330 Y1342	R1316-E1318 PolarHBondContact O-N 2.78Å; R1316-Y1330 PolarHBondContact N-OH 3.4Å; R1316-Y1330 VanDerWaalsContact N-OH 3.1Å; R1316-Y1342 HydrophobicContact CB-CD1 3.96Å; R1316-Y1342 HydrophobicContact CB-CE1 4.21Å; R1316-Y1342 HydrophobicContact CB-CG 4.16Å; R1316-Y1342 WeakPolarHBondContact O-CB 3.04Å
1317	C	77.7	Confident	68.5	Low	17 Å²	17	62.2 Å²	62.2	12%	0.115	33%	0.332	C	S	.	.			trans	-70	95.6	-175.7	-60.1	0	0	0	0	111	N1315 A1321 C1332	N1315-C1317 WeakPolarHBondContact OD1-CB 3.44Å; N1315-C1317 PolarHBondContact OD1-N 3.32Å; N1315-C1317 PolarHBondContact OD1-SG 3.4Å; C1317-A1321 HydrophobicContact CB-CB 4.16Å; C1317-C1332 WeakPolarHBondContact CA-SG 3.35Å; C1317-C1332 HydrophobicContact CB-CB 3.75Å; C1317-C1332 WeakPolarHBondContact CB-SG 3.48Å; C1317-C1332 WeakPolarHBondContact SG-CA 3.27Å; C1317-C1332 WeakPolarHBondContact SG-CB 3.29Å; C1317-C1332 CovalentContact SG-SG 2.04Å; C1317-C1332 PolarHBondContact SG-SG 3.22Å
1318	E	71.5	Confident	68.1	Low	106 Å²	106	60 Å²	60	50%	0.495	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-68.9	167.1	-178.3	-63.2	-63.2	170.8	0	0	111.7	R1316 G1320 A1321 Y1342 E1344	R1316-E1318 PolarHBondContact O-N 2.78Å; E1318-G1320 PolarHBondContact O-N 2.76Å; E1318-A1321 PolarHBondContact O-N 2.96Å; E1318-A1321 VanDerWaalsContact O-N 3.11Å; E1318-Y1342 WeakPolarHBondContact CB-O 3.31Å; E1318-Y1342 PolarHBondContact N-O 3.33Å; E1318-E1344 HydrophobicContact CB-CB 4.2Å; E1318-E1344 HydrophobicContact CG-CB 4.02Å
1319	N	65.9	Low	67.8	Low	71 Å²	71	61.3 Å²	61.3	38%	0.38	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	56.3	18	173.2	-62.2	-62.9	0	0	0	115.7	Y1338 C1343	N1319-Y1338 HydrophobicContact CB-CD1 3.48Å; N1319-Y1338 VanDerWaalsContact CB-CD1 3.48Å; N1319-Y1338 HydrophobicContact CB-CD2 4.11Å; N1319-Y1338 HydrophobicContact CB-CE1 3.44Å; N1319-Y1338 VanDerWaalsContact CB-CE1 3.44Å; N1319-Y1338 HydrophobicContact CB-CE2 4.08Å; N1319-Y1338 HydrophobicContact CB-CG 3.82Å; N1319-Y1338 VanDerWaalsContact ND2-CD1 3.33Å; N1319-Y1338 WeakPolarHBondContact ND2-CD1 3.45Å; N1319-Y1338 WeakPolarHBondContact ND2-CE1 3.37Å; N1319-Y1338 VanDerWaalsContact OD1-CE1 3.22Å; N1319-Y1338 WeakPolarHBondContact OD1-CE1 2.98Å; N1319-C1343 PolarHBondContact ND2-O 3.37Å
1320	G	63.3	Low	67.9	Low	59 Å²	59	59.4 Å²	59.4	61%	0.608	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	73.7	28.9	-179.7	0	0	0	0	0	113.8	E1318	E1318-G1320 PolarHBondContact O-N 2.76Å
1321	A	76.4	Confident	67.7	Low	13 Å²	13	59.3 Å²	59.3	11%	0.107	31%	0.314	C	S	.	.			trans	-61.2	148.3	167.8	0	0	0	0	0	111.7	C1317 E1318 C1323 C1332 K1333 C1343	C1317-A1321 HydrophobicContact CB-CB 4.16Å; E1318-A1321 PolarHBondContact O-N 2.96Å; E1318-A1321 VanDerWaalsContact O-N 3.11Å; A1321-C1323 PolarHBondContact O-N 3.15Å; A1321-C1332 HydrophobicContact CB-CB 4.26Å; A1321-K1333 WeakPolarHBondContact CA-O 3.46Å; A1321-K1333 WeakPolarHBondContact CB-O 3.48Å; A1321-C1343 HydrophobicContact CB-CB 3.61Å; A1321-C1343 WeakPolarHBondContact CB-SG 3.41Å
1322	T	72.3	Confident	67.9	Low	94 Å²	94	57.8 Å²	57.8	58%	0.577	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.2	-179.8	-56.1	0	0	0	0	109.3	V1324 K1333	T1322-V1324 PolarHBondContact O-N 2.62Å; T1322-K1333 PolarHBondContact N-O 3.21Å; T1322-K1333 PolarHBondContact O-N 3.28Å
1323	C	72.5	Confident	67.4	Low	33 Å²	33	63.1 Å²	63.1	22%	0.223	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	129.9	168.9	-163.7	0	0	0	0	109.7	C1312 N1315 A1321 Y1330	C1312-C1323 WeakPolarHBondContact CA-SG 3.48Å; C1312-C1323 HydrophobicContact CB-CB 4.02Å; C1312-C1323 WeakPolarHBondContact CB-SG 3.49Å; C1312-C1323 WeakPolarHBondContact SG-CB 3.47Å; C1312-C1323 CovalentContact SG-SG 2.04Å; C1312-C1323 PolarHBondContact SG-SG 2.99Å; N1315-C1323 HydrophobicContact CB-CB 4.32Å; N1315-C1323 WeakPolarHBondContact CB-SG 3.45Å; N1315-C1323 VanDerWaalsContact CG-SG 3.6Å; A1321-C1323 PolarHBondContact O-N 3.15Å; C1323-Y1330 VanDerWaalsContact SG-CB 3.54Å
1324	V	70.5	Confident	67.7	Low	49 Å²	49	63 Å²	63	30%	0.297	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.7	171.7	-171.3	0	0	0	0	107.3	T1322 Y1330 I1331 K1333	T1322-V1324 PolarHBondContact O-N 2.62Å; V1324-Y1330 WeakPolarHBondContact O-CA 3.28Å; V1324-I1331 PolarHBondContact N-O 3.08Å; V1324-I1331 PolarHBondContact O-N 3.39Å; V1324-K1333 HydrophobicContact CG2-CD 3.66Å; V1324-K1333 HydrophobicContact CG2-CG 3.91Å
1325	D	60.1	Low	68.3	Low	60 Å²	60	62 Å²	62	32%	0.321	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	152.5	178.6	-169.6	38.8	0	0	0	111.6	N1308 D1310 D1311	N1308-D1325 VanDerWaalsContact ND2-CG 3.35Å; N1308-D1325 PolarHBondContact ND2-OD2 3.03Å; D1310-D1325 WeakPolarHBondContact CA-OD1 3.45Å; D1311-D1325 PolarHBondContact N-OD1 3.03Å
1326	G	61.9	Low	67.8	Low	12 Å²	12	65.1 Å²	65.1	12%	0.124	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	177.4	-177.5	0	0	0	0	0	110.9	N1308 N1328 E1329	N1308-G1326 PolarHBondContact ND2-O 2.99Å; G1326-N1328 PolarHBondContact O-N 2.98Å; G1326-N1328 VanDerWaalsContact O-N 3.16Å; G1326-E1329 CarbonylContact C-O 3.49Å; G1326-E1329 VanDerWaalsContact C-O 3.22Å; G1326-E1329 VanDerWaalsContact CA-O 3.23Å; G1326-E1329 WeakPolarHBondContact CA-O 3.44Å; G1326-E1329 PolarHBondContact N-O 3Å; G1326-E1329 VanDerWaalsContact O-O 3.08Å
1327	I	60.6	Low	67	Low	46 Å²	46	60.6 Å²	60.6	24%	0.236	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	106.9	-173.3	-53.8	170.3	0	0	0	109.4	T1298 W1300 E1329	T1298-I1327 WeakPolarHBondContact O-CG2 3.33Å; W1300-I1327 HydrophobicContact CZ2-CD1 3.75Å; W1300-I1327 HydrophobicContact CZ2-CG1 3.91Å; I1327-E1329 PolarHBondContact O-N 3Å
1328	N	61.8	Low	66.4	Low	42 Å²	42	63 Å²	63	23%	0.225	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	19.7	-180	-162.7	0.9	0	0	0	113.6	T1298 D1311 G1326 R1629	T1298-N1328 WeakPolarHBondContact CB-ND2 3.14Å; T1298-N1328 PolarHBondContact OG1-ND2 2.97Å; D1311-N1328 WeakPolarHBondContact OD2-CA 3.25Å; D1311-N1328 PolarHBondContact OD2-N 2.73Å; G1326-N1328 PolarHBondContact O-N 2.98Å; G1326-N1328 VanDerWaalsContact O-N 3.16Å; N1328-R1629 PolarHBondContact O-NH1 3.21Å; N1328-R1629 PolarHBondContact O-NH2 3Å; N1328-R1629 PolarHBondContact OD1-NH2 3.34Å
1329	E	56.4	Low	65.9	Low	65 Å²	65	59.7 Å²	59.7	30%	0.304	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	172.8	-179.8	66.6	-170.7	158	0	0	112.2	D1311 G1326 I1327 R1635	D1311-E1329 PolarHBondContact OD2-N 3.01Å; G1326-E1329 CarbonylContact C-O 3.49Å; G1326-E1329 VanDerWaalsContact C-O 3.22Å; G1326-E1329 VanDerWaalsContact CA-O 3.23Å; G1326-E1329 WeakPolarHBondContact CA-O 3.44Å; G1326-E1329 PolarHBondContact N-O 3Å; G1326-E1329 VanDerWaalsContact O-O 3.08Å; I1327-E1329 PolarHBondContact O-N 3Å; E1329-R1635 IonicContact OE1-CZ 3.88Å; E1329-R1635 IonicContact OE1-NH1 3.52Å; E1329-R1635 PolarHBondContact OE1-NH1 3.09Å; E1329-R1635 IonicContact OE1-NH2 2.72Å; E1329-R1635 PolarHBondContact OE1-NH2 2.96Å; E1329-R1635 IonicContact OE2-NH1 3.78Å
1330	Y	71.2	Confident	65.3	Low	45 Å²	45	58 Å²	58	18%	0.176	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	153.3	175.1	58.9	-91.6	0	0	0	112.3	D1311 N1315 R1316 C1323 V1324 Y1342	D1311-Y1330 HydrophobicContact CB-CD1 4.4Å; D1311-Y1330 WeakPolarHBondContact O-CD1 3.15Å; N1315-Y1330 VanDerWaalsContact CA-CZ 3.5Å; N1315-Y1330 HydrophobicContact CB-CD1 4.05Å; N1315-Y1330 HydrophobicContact CB-CD2 3.62Å; N1315-Y1330 HydrophobicContact CB-CE1 4.06Å; N1315-Y1330 HydrophobicContact CB-CE2 3.64Å; N1315-Y1330 HydrophobicContact CB-CG 3.85Å; R1316-Y1330 PolarHBondContact N-OH 3.4Å; R1316-Y1330 VanDerWaalsContact N-OH 3.1Å; C1323-Y1330 VanDerWaalsContact SG-CB 3.54Å; V1324-Y1330 WeakPolarHBondContact O-CA 3.28Å; Y1330-Y1342 HydrophobicContact CE2-CD1 4.24Å; Y1330-Y1342 HydrophobicContact CE2-CE1 4.05Å
1331	I	60.9	Low	65.1	Low	68 Å²	68	60.3 Å²	60.3	35%	0.349	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.8	177.7	-55.5	176.3	0	0	0	109.9	V1324 K1333	V1324-I1331 PolarHBondContact N-O 3.08Å; V1324-I1331 PolarHBondContact O-N 3.39Å; I1331-K1333 PolarHBondContact O-N 2.83Å
1332	C	70.4	Confident	65	Low	12 Å²	12	61.8 Å²	61.8	8%	0.081	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	101.4	173.4	-57	0	0	0	0	110.8	C1317 A1321 C1334 C1343	C1317-C1332 WeakPolarHBondContact CA-SG 3.35Å; C1317-C1332 HydrophobicContact CB-CB 3.75Å; C1317-C1332 WeakPolarHBondContact CB-SG 3.48Å; C1317-C1332 WeakPolarHBondContact SG-CA 3.27Å; C1317-C1332 WeakPolarHBondContact SG-CB 3.29Å; C1317-C1332 CovalentContact SG-SG 2.04Å; C1317-C1332 PolarHBondContact SG-SG 3.22Å; A1321-C1332 HydrophobicContact CB-CB 4.26Å; C1332-C1334 PolarHBondContact O-N 3.36Å; C1332-C1334 VanDerWaalsContact O-N 3.15Å; C1332-C1343 PolarHBondContact O-SG 2.67Å
1333	K	66.7	Low	65.2	Low	132 Å²	132	57.3 Å²	57.3	57%	0.574	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	103.4	171.2	-74.3	-175.1	179.5	171.1	0	109.9	A1321 T1322 V1324 I1331	A1321-K1333 WeakPolarHBondContact CA-O 3.46Å; A1321-K1333 WeakPolarHBondContact CB-O 3.48Å; T1322-K1333 PolarHBondContact N-O 3.21Å; T1322-K1333 PolarHBondContact O-N 3.28Å; V1324-K1333 HydrophobicContact CG2-CD 3.66Å; V1324-K1333 HydrophobicContact CG2-CG 3.91Å; I1331-K1333 PolarHBondContact O-N 2.83Å
1334	C	71.6	Confident	64.9	Low	47 Å²	47	59.3 Å²	59.3	32%	0.318	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-64.3	137	-175.5	-53.8	0	0	0	0	112.7	C1332 Y1338 C1343	C1332-C1334 PolarHBondContact O-N 3.36Å; C1332-C1334 VanDerWaalsContact O-N 3.15Å; C1334-Y1338 WeakPolarHBondContact CB-O 3.22Å; C1334-C1343 WeakPolarHBondContact CA-SG 3.37Å; C1334-C1343 HydrophobicContact CB-CB 3.71Å; C1334-C1343 WeakPolarHBondContact CB-SG 3.41Å; C1334-C1343 PolarHBondContact N-SG 2.79Å; C1334-C1343 VanDerWaalsContact N-SG 3.36Å; C1334-C1343 VanDerWaalsContact SG-CA 3.5Å; C1334-C1343 WeakPolarHBondContact SG-CB 3.48Å; C1334-C1343 CovalentContact SG-SG 2.03Å; C1334-C1343 PolarHBondContact SG-SG 3.39Å
1335	R	72.7	Confident	64.3	Low	170 Å²	170	65.5 Å²	65.5	64%	0.642	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-67.8	141	169.1	-168.9	173.5	-172.5	164.6	4.5	109.1	G1337 Y1338	R1335-G1337 PolarHBondContact O-N 2.84Å; R1335-Y1338 HydrophobicContact CB-CD2 4.48Å; R1335-Y1338 PolarHBondContact O-N 2.82Å
1336	P	64	Low	64.1	Low	118 Å²	118	66.9 Å²	66.9	77%	0.766	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	128.8	174.6	-29.8	36	0	0	0	111.6
1337	G	58.6	Low	62.9	Low	13 Å²	13	70.2 Å²	70.2	13%	0.134	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.7	7.2	-169	0	0	0	0	0	115.5	R1335 P1346 T1347 W1348	R1335-G1337 PolarHBondContact O-N 2.84Å; G1337-P1346 CarbonylContact O-C 3.6Å; G1337-P1346 WeakPolarHBondContact O-CA 3.31Å; G1337-T1347 WeakPolarHBondContact CA-OG1 3.32Å; G1337-T1347 PolarHBondContact O-N 2.99Å; G1337-T1347 PolarHBondContact O-OG1 2.78Å; G1337-W1348 VanDerWaalsContact CA-NE1 3.33Å; G1337-W1348 VanDerWaalsContact O-CD1 3.23Å
1338	Y	66.1	Low	61.8	Low	68 Å²	68	75.3 Å²	75.3	27%	0.267	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.4	172	-65.1	-87.6	0	0	0	112.5	N1319 C1334 R1335 R1345 P1346 T1347	N1319-Y1338 HydrophobicContact CB-CD1 3.48Å; N1319-Y1338 VanDerWaalsContact CB-CD1 3.48Å; N1319-Y1338 HydrophobicContact CB-CD2 4.11Å; N1319-Y1338 HydrophobicContact CB-CE1 3.44Å; N1319-Y1338 VanDerWaalsContact CB-CE1 3.44Å; N1319-Y1338 HydrophobicContact CB-CE2 4.08Å; N1319-Y1338 HydrophobicContact CB-CG 3.82Å; N1319-Y1338 VanDerWaalsContact ND2-CD1 3.33Å; N1319-Y1338 WeakPolarHBondContact ND2-CD1 3.45Å; N1319-Y1338 WeakPolarHBondContact ND2-CE1 3.37Å; N1319-Y1338 VanDerWaalsContact OD1-CE1 3.22Å; N1319-Y1338 WeakPolarHBondContact OD1-CE1 2.98Å; C1334-Y1338 WeakPolarHBondContact CB-O 3.22Å; R1335-Y1338 HydrophobicContact CB-CD2 4.48Å; R1335-Y1338 PolarHBondContact O-N 2.82Å; Y1338-R1345 CarbonylContact C-O 3.42Å; Y1338-R1345 VanDerWaalsContact CA-O 3.29Å; Y1338-R1345 WeakPolarHBondContact CA-O 3.45Å; Y1338-P1346 HydrophobicContact CD1-CB 4.13Å; Y1338-P1346 HydrophobicContact CD1-CG 4.25Å; Y1338-P1346 HydrophobicContact CE1-CB 3.92Å; Y1338-P1346 HydrophobicContact CE1-CG 3.88Å; Y1338-T1347 PolarHBondContact N-OG1 2.91Å
1339	A	60.1	Low	60.1	Low	37 Å²	37	83.5 Å²	83.5	31%	0.306	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	177.5	177.9	0	0	0	0	0	111.5	C1343 E1344 R1345 T1347	A1339-C1343 CarbonylContact O-C 3.47Å; A1339-C1343 VanDerWaalsContact O-C 3.24Å; A1339-C1343 WeakPolarHBondContact O-CA 3.17Å; A1339-E1344 PolarHBondContact O-N 2.91Å; A1339-R1345 PolarHBondContact N-O 3.35Å; A1339-R1345 WeakPolarHBondContact O-CB 3.34Å; A1339-R1345 PolarHBondContact O-N 2.89Å; A1339-T1347 HydrophobicContact CB-CG2 3.46Å; A1339-T1347 VanDerWaalsContact CB-CG2 3.46Å
1340	G	52.5	Low	58.6	Low	34 Å²	34	86.6 Å²	86.6	35%	0.351	43%	0.425	S	S	.	.	S	Bend	trans	99.5	158.3	-166.5	0	0	0	0	0	110.9	Y1342 C1343 E1344	G1340-Y1342 PolarHBondContact O-N 2.89Å; G1340-C1343 WeakPolarHBondContact O-CA 3.41Å; G1340-C1343 PolarHBondContact O-N 2.99Å; G1340-E1344 WeakPolarHBondContact CA-OE2 3.45Å
1341	I	60.6	Low	56.3	Low	108 Å²	108	89.4 Å²	89.4	55%	0.554	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.6	-175.9	57.4	175.8	0	0	0	113.3	S1447	I1341-S1447 VanDerWaalsContact CD1-OG 3.23Å; I1341-S1447 WeakPolarHBondContact CD1-OG 3.43Å
1342	Y	72.7	Confident	54.4	Low	45 Å²	45	91.4 Å²	91.4	18%	0.176	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	10.2	171	-60.7	-47.9	0	0	0	112.1	R1316 E1318 Y1330 G1340 E1344 S1447	R1316-Y1342 HydrophobicContact CB-CD1 3.96Å; R1316-Y1342 HydrophobicContact CB-CE1 4.21Å; R1316-Y1342 HydrophobicContact CB-CG 4.16Å; R1316-Y1342 WeakPolarHBondContact O-CB 3.04Å; E1318-Y1342 WeakPolarHBondContact CB-O 3.31Å; E1318-Y1342 PolarHBondContact N-O 3.33Å; Y1330-Y1342 HydrophobicContact CE2-CD1 4.24Å; Y1330-Y1342 HydrophobicContact CE2-CE1 4.05Å; G1340-Y1342 PolarHBondContact O-N 2.89Å; Y1342-E1344 PolarHBondContact N-OE2 2.86Å; Y1342-E1344 VanDerWaalsContact N-OE2 3.09Å; Y1342-E1344 PolarHBondContact O-N 2.03Å; Y1342-S1447 WeakPolarHBondContact CE2-OG 3.47Å; Y1342-S1447 WeakPolarHBondContact OH-CB 3.45Å; Y1342-S1447 PolarHBondContact OH-OG 3.27Å
1343	C	77.8	Confident	52	Low	0 Å²	0	100.4 Å²	100.4	0%	0	50%	0.5	C	S	.	.	S	Bend	trans	59.3	28	-175.3	-48.4	0	0	0	0	113.6	N1319 A1321 C1332 C1334 A1339 G1340 R1345	N1319-C1343 PolarHBondContact ND2-O 3.37Å; A1321-C1343 HydrophobicContact CB-CB 3.61Å; A1321-C1343 WeakPolarHBondContact CB-SG 3.41Å; C1332-C1343 PolarHBondContact O-SG 2.67Å; C1334-C1343 WeakPolarHBondContact CA-SG 3.37Å; C1334-C1343 HydrophobicContact CB-CB 3.71Å; C1334-C1343 WeakPolarHBondContact CB-SG 3.41Å; C1334-C1343 PolarHBondContact N-SG 2.79Å; C1334-C1343 VanDerWaalsContact N-SG 3.36Å; C1334-C1343 VanDerWaalsContact SG-CA 3.5Å; C1334-C1343 WeakPolarHBondContact SG-CB 3.48Å; C1334-C1343 CovalentContact SG-SG 2.03Å; C1334-C1343 PolarHBondContact SG-SG 3.39Å; A1339-C1343 CarbonylContact O-C 3.47Å; A1339-C1343 VanDerWaalsContact O-C 3.24Å; A1339-C1343 WeakPolarHBondContact O-CA 3.17Å; G1340-C1343 WeakPolarHBondContact O-CA 3.41Å; G1340-C1343 PolarHBondContact O-N 2.99Å; C1343-R1345 VanDerWaalsContact C-N 3.33Å; C1343-R1345 PolarHBondContact O-N 2.88Å
1344	E	65.9	Low	50	Low	75 Å²	75	101.4 Å²	101.4	35%	0.35	51%	0.51	S	S	.	.			trans	-75.4	-17.3	-171.5	74.5	-65.6	158.3	0	0	114.2	E1318 A1339 G1340 Y1342	E1318-E1344 HydrophobicContact CB-CB 4.2Å; E1318-E1344 HydrophobicContact CG-CB 4.02Å; A1339-E1344 PolarHBondContact O-N 2.91Å; G1340-E1344 WeakPolarHBondContact CA-OE2 3.45Å; Y1342-E1344 PolarHBondContact N-OE2 2.86Å; Y1342-E1344 VanDerWaalsContact N-OE2 3.09Å; Y1342-E1344 PolarHBondContact O-N 2.03Å
1345	R	57.1	Low	47.5	Very low	179 Å²	179	105.4 Å²	105.4	68%	0.675	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.6	-177.7	-64.1	177	170.8	-167.6	-5	111.8	Y1338 A1339 C1343	Y1338-R1345 CarbonylContact C-O 3.42Å; Y1338-R1345 VanDerWaalsContact CA-O 3.29Å; Y1338-R1345 WeakPolarHBondContact CA-O 3.45Å; A1339-R1345 PolarHBondContact N-O 3.35Å; A1339-R1345 WeakPolarHBondContact O-CB 3.34Å; A1339-R1345 PolarHBondContact O-N 2.89Å; C1343-R1345 VanDerWaalsContact C-N 3.33Å; C1343-R1345 PolarHBondContact O-N 2.88Å
1346	P	55.5	Low	45	Very low	88 Å²	88	108.3 Å²	108.3	57%	0.571	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	131.5	172.7	-14.5	27.9	0	0	0	112.3	G1337 Y1338 W1348	G1337-P1346 CarbonylContact O-C 3.6Å; G1337-P1346 WeakPolarHBondContact O-CA 3.31Å; Y1338-P1346 HydrophobicContact CD1-CB 4.13Å; Y1338-P1346 HydrophobicContact CD1-CG 4.25Å; Y1338-P1346 HydrophobicContact CE1-CB 3.92Å; Y1338-P1346 HydrophobicContact CE1-CG 3.88Å; P1346-W1348 PolarHBondContact O-N 2.89Å
1347	T	37.9	Very low	43	Very low	82 Å²	82	110.5 Å²	110.5	50%	0.503	55%	0.546	S	S	.	.			trans	-97.7	42.2	173.6	58.5	0	0	0	0	112.6	G1337 Y1338 A1339	G1337-T1347 WeakPolarHBondContact CA-OG1 3.32Å; G1337-T1347 PolarHBondContact O-N 2.99Å; G1337-T1347 PolarHBondContact O-OG1 2.78Å; Y1338-T1347 PolarHBondContact N-OG1 2.91Å; A1339-T1347 HydrophobicContact CB-CG2 3.46Å; A1339-T1347 VanDerWaalsContact CB-CG2 3.46Å
1348	W	36.5	Very low	41.2	Very low	154 Å²	154	115.6 Å²	115.6	58%	0.583	57%	0.57	S	S	*	*			trans	-106.2	86.7	175.3	-70.1	90.4	0	0	0	112	G1337 P1346 Q1350	G1337-W1348 VanDerWaalsContact CA-NE1 3.33Å; G1337-W1348 VanDerWaalsContact O-CD1 3.23Å; P1346-W1348 PolarHBondContact O-N 2.89Å; W1348-Q1350 VanDerWaalsContact C-N 3.32Å; W1348-Q1350 HydrophobicContact CE3-CB 4.09Å; W1348-Q1350 HydrophobicContact CE3-CG 4.1Å; W1348-Q1350 HydrophobicContact CZ3-CG 4.3Å; W1348-Q1350 PolarHBondContact O-N 3.09Å
1349	K	26.4	Very low	39.1	Very low	213 Å²	213	122.8 Å²	122.8	93%	0.926	60%	0.597	S	S	*	*			trans	-86.8	79.4	148.1	-86.6	-169.8	174.8	-178.3	0	108	S1351	K1349-S1351 PolarHBondContact O-N 2.66Å
1350	Q	25.5	Very low	37.4	Very low	131 Å²	131	127.2 Å²	127.2	61%	0.612	62%	0.623	S	S	*	*			trans	-81.1	103.4	180	-157.6	173.3	11.2	0	0	110.4	W1348 T1352	W1348-Q1350 VanDerWaalsContact C-N 3.32Å; W1348-Q1350 HydrophobicContact CE3-CB 4.09Å; W1348-Q1350 HydrophobicContact CE3-CG 4.1Å; W1348-Q1350 HydrophobicContact CZ3-CG 4.3Å; W1348-Q1350 PolarHBondContact O-N 3.09Å; Q1350-T1352 HydrophobicContact CG-CG2 4.01Å; Q1350-T1352 PolarHBondContact O-N 3.17Å
1351	S	22.8	Very low	36	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	65%	0.648	S	S	*	*			trans	-71.9	108.5	159	-175.5	0	0	0	0	107.9	K1349 Y1353	K1349-S1351 PolarHBondContact O-N 2.66Å; S1351-Y1353 PolarHBondContact O-N 3.34Å
1352	T	20.8	Very low	34.3	Very low	109 Å²	109	137.7 Å²	137.7	67%	0.669	66%	0.662	S	S	*	*			trans	-90.5	101.5	177.2	51.8	0	0	0	0	110	Q1350	Q1350-T1352 HydrophobicContact CG-CG2 4.01Å; Q1350-T1352 PolarHBondContact O-N 3.17Å
1353	Y	20.3	Very low	31.9	Very low	201 Å²	201	146.4 Å²	146.4	79%	0.788	70%	0.696	S	S	*	*			trans	-130.6	150.9	169	-104.9	-79.7	0	0	0	111.6	S1351	S1351-Y1353 PolarHBondContact O-N 3.34Å
1354	I	23.7	Very low	29.1	Very low	154 Å²	154	155.1 Å²	155.1	79%	0.79	74%	0.737	S	S	*	*			trans	68.5	91.3	170.2	-55.9	161.2	0	0	0	114.7
1355	T	19.8	Very low	27.1	Very low	131 Å²	131	159.3 Å²	159.3	80%	0.804	76%	0.761	S	S	*	*			trans	-66	130.7	148.1	39.3	0	0	0	0	110.6
1356	R	19.8	Very low	25.4	Very low	231 Å²	231	158.3 Å²	158.3	87%	0.872	77%	0.766	S	S	*	*			trans	-177.8	123.8	137.9	-103.1	163.3	-176.3	-167.8	1	114
1357	M	22.1	Very low	23.8	Very low	163 Å²	163	161.6 Å²	161.6	80%	0.803	78%	0.777	S	S	*	*			trans	52.4	139.6	138.7	-58	-46.2	-166.5	0	0	124.3
1358	D	21.9	Very low	23.1	Very low	121 Å²	121	161 Å²	161	65%	0.647	79%	0.787	S	S	*	*			trans	70.9	94	145.4	-72.9	-54.9	0	0	0	123.1
1359	R	21.6	Very low	22.3	Very low	219 Å²	219	165.7 Å²	165.7	83%	0.826	81%	0.805	S	S	*	*				66.7	116.2	122.9	-71.5	177.6	176.2	-177.3	0	119.7
1360	P	24	Very low	22.1	Very low	130 Å²	130	161.9 Å²	161.9	84%	0.844	80%	0.799	S	S	*	*			trans	-79	142.8	168.7	33.9	-33.4	0	0	0	111.8
1361	F	22.9	Very low	22	Very low	201 Å²	201	159.9 Å²	159.9	88%	0.882	80%	0.8	S	S	*	*			trans	-108.3	138.6	160	-112.7	-93.2	0	0	0	109.8
1362	N	24.5	Very low	22.1	Very low	160 Å²	160	161.6 Å²	161.6	86%	0.856	81%	0.806	S	S	*	*			trans	-75	130.1	-174.7	-98.8	-40.4	0	0	0	112.1	Q1364	N1362-Q1364 PolarHBondContact O-N 3.45Å
1363	Y	22.9	Very low	22.4	Very low	228 Å²	228	162.4 Å²	162.4	89%	0.894	81%	0.813	S	S	*	*			trans	-78.1	109	161.6	-87.1	-93.1	0	0	0	109.7
1364	Q	20.1	Very low	22.7	Very low	183 Å²	183	156.5 Å²	156.5	86%	0.855	81%	0.813	S	S	*	*			trans	-140.3	92.5	165.2	-173.9	174.6	0.8	0	0	109.1	N1362	N1362-Q1364 PolarHBondContact O-N 3.45Å
1365	L	23.2	Very low	22.7	Very low	163 Å²	163	156.5 Å²	156.5	85%	0.853	82%	0.82	S	S	*	*			trans	-135.4	111.5	177.3	-100	167.4	0	0	0	110.8
1366	M	20.6	Very low	22.8	Very low	159 Å²	159	161.5 Å²	161.5	78%	0.783	82%	0.824	S	S	*	*			trans	-86	128.8	160.9	-76.8	-82.4	-76.4	0	0	108.5
1367	I	23.7	Very low	22.9	Very low	157 Å²	157	159.5 Å²	159.5	81%	0.805	82%	0.824	S	S	*	*			trans	40.8	90.3	147.6	-45.9	176.5	0	0	0	115.7
1368	G	22	Very low	23.2	Very low	69 Å²	69	157.2 Å²	157.2	71%	0.711	82%	0.824	S	S	*	*			trans	-132.4	133.2	167.8	0	0	0	0	0	111.1
1369	R	20.5	Very low	23.6	Very low	253 Å²	253	156.9 Å²	156.9	96%	0.955	83%	0.829	S	S	*	*			trans	-90.9	121.6	-177.9	-69.3	176.6	176	168	-2.7	111.8
1370	T	22.6	Very low	23.6	Very low	132 Å²	132	154.9 Å²	154.9	81%	0.81	83%	0.833	S	S	*	*			trans	-144.6	146.8	161.9	44.9	0	0	0	0	108.1
1371	S	22	Very low	23.5	Very low	89 Å²	89	157.4 Å²	157.4	62%	0.622	83%	0.83	S	S	*	*			cis	155.6	149.8	-24.7	49.6	0	0	0	0	106.3
1372	V	24.3	Very low	23.4	Very low	141 Å²	141	154.1 Å²	154.1	86%	0.855	83%	0.827	S	S	*	*			trans	64.7	157.5	172.7	-89.6	0	0	0	0	116.6
1373	P	28.1	Very low	23.3	Very low	126 Å²	126	158 Å²	158	82%	0.818	83%	0.829	S	S	*	*			trans	-130.7	-178	-131.3	42.2	-25.4	0	0	0	115.6
1374	G	26.8	Very low	23.1	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	82%	0.82	S	S	*	*			trans	-165.7	-33.9	175.3	0	0	0	0	0	119.4
1375	V	24.2	Very low	23.2	Very low	154 Å²	154	150.2 Å²	150.2	93%	0.933	82%	0.816	S	S	*	*	S	Bend	trans	-129.8	148.3	178.4	-175.6	0	0	0	0	110.5
1376	R	21.1	Very low	23.2	Very low	237 Å²	237	147.7 Å²	147.7	89%	0.894	81%	0.808	S	S	*	*			trans	-78.1	144.7	-161.3	-67.8	177.3	172.7	174.6	-3.5	114.6
1377	Q	23	Very low	23.3	Very low	189 Å²	189	146.3 Å²	146.3	88%	0.883	81%	0.808	S	S	*	*			trans	-81	140.2	143.9	-69	-177.6	-12.6	0	0	110.1
1378	S	28.1	Very low	23.4	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	81%	0.811	S	S	*	*			trans	-158.6	148	135.3	58.9	0	0	0	0	108.8
1379	P	29	Very low	23.7	Very low	114 Å²	114	151.9 Å²	151.9	74%	0.74	82%	0.818	S	S	*	*				-130.4	155.8	-129	39	-25.2	0	0	0	116.9
1380	I	22.8	Very low	24.1	Very low	178 Å²	178	147.5 Å²	147.5	91%	0.913	81%	0.812	S	S	*	*			trans	-111.2	130.6	158.6	-61.7	-175.4	0	0	0	110.3
1381	K	21.9	Very low	24.6	Very low	183 Å²	183	149.2 Å²	149.2	80%	0.796	82%	0.816	S	S	*	*			trans	-66.9	123.6	-163.3	-67.5	164.1	176.7	173.4	0	115.5
1382	T	20.1	Very low	25.7	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	81%	0.81	S	S	*	*				24.7	101.7	126	59	0	0	0	0	119.6
1383	R	21.7	Very low	26.9	Very low	242 Å²	242	145.4 Å²	145.4	91%	0.913	79%	0.787	S	S	*	*			trans	-147.3	126.4	130.5	-96.7	179.9	172.5	174.5	-4	105.7
1384	S	20.6	Very low	28.2	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	76%	0.756	S	S	*	*			cis	88.9	117.9	35.5	-162.9	0	0	0	0	113.3
1385	L	21.3	Very low	29.4	Very low	147 Å²	147	140.3 Å²	140.3	77%	0.77	75%	0.747	S	S	*	*			trans	83.5	121	163.2	-64.9	160.7	0	0	0	120.7
1386	T	22.8	Very low	30.7	Very low	111 Å²	111	143 Å²	143	68%	0.681	74%	0.741	S	S	*	*			trans	68.4	109.1	133.9	55.4	0	0	0	0	122.5
1387	T	22.9	Very low	32.4	Very low	129 Å²	129	138.4 Å²	138.4	79%	0.791	73%	0.73	S	S	*	*				47.6	91.8	129	61	0	0	0	0	119.2
1388	Q	25.3	Very low	34.2	Very low	183 Å²	183	135.2 Å²	135.2	86%	0.855	72%	0.715	S	S	*	*			trans	-168.1	103.3	142.8	-110.6	162.6	17	0	0	111
1389	N	29.1	Very low	36.3	Very low	161 Å²	161	130.5 Å²	130.5	86%	0.861	68%	0.682	S	S	*	*				179.8	156.5	116	-88.9	-11.7	0	0	0	110.7
1390	L	28.9	Very low	38.3	Very low	160 Å²	160	129.8 Å²	129.8	84%	0.838	67%	0.669	S	S	*	*			trans	-74.6	151.1	-172.4	-131.5	65.5	0	0	0	112.1	T1392	L1390-T1392 PolarHBondContact O-N 3.33Å; L1390-T1392 VanDerWaalsContact O-N 3.1Å
1391	D	32.3	Very low	40.3	Very low	168 Å²	168	122.5 Å²	122.5	90%	0.898	63%	0.632	S	S	*	*			trans	-68	101.6	170.5	-62.5	-78.2	0	0	0	110.1
1392	T	45.8	Very low	42.4	Very low	80 Å²	80	119.5 Å²	119.5	49%	0.491	62%	0.624	S	S	.	*			trans	-80.2	131.7	-179.8	46.6	0	0	0	0	111.9	L1390 C1394 A1395 E1407	L1390-T1392 PolarHBondContact O-N 3.33Å; L1390-T1392 VanDerWaalsContact O-N 3.1Å; T1392-C1394 VanDerWaalsContact C-N 3.29Å; T1392-C1394 PolarHBondContact O-N 2.72Å; T1392-A1395 VanDerWaalsContact O-CB 3.23Å; T1392-A1395 WeakPolarHBondContact O-CB 3.49Å; T1392-A1395 PolarHBondContact O-N 2.74Å; T1392-E1407 WeakPolarHBondContact CB-OE1 3.29Å
1393	L	49.6	Very low	44.9	Very low	71 Å²	71	113.7 Å²	113.7	37%	0.372	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-58.5	-36.1	-173.3	-164.7	72.1	0	0	0	113.3	A1395 Y1396 E1407 D1411 Y1413	L1393-A1395 PolarHBondContact O-N 2.81Å; L1393-A1395 VanDerWaalsContact O-N 3.1Å; L1393-Y1396 PolarHBondContact O-N 2.81Å; L1393-E1407 HydrophobicContact CB-CG 4.22Å; L1393-E1407 PolarHBondContact N-OE1 3.24Å; L1393-D1411 VanDerWaalsContact CD2-C 3.47Å; L1393-D1411 WeakPolarHBondContact CD2-O 3.05Å; L1393-Y1413 HydrophobicContact CD2-CD1 3.89Å; L1393-Y1413 HydrophobicContact CG-CD1 4.19Å
1394	C	55.6	Low	47.6	Very low	25 Å²	25	108.9 Å²	108.9	17%	0.169	58%	0.575	C	S	.	*	G	3₁₀ helix	trans	-61.2	-15	176.5	-82.3	0	0	0	0	113.7	T1392 Y1396 C1405 E1407	T1392-C1394 VanDerWaalsContact C-N 3.29Å; T1392-C1394 PolarHBondContact O-N 2.72Å; C1394-Y1396 VanDerWaalsContact C-N 3.28Å; C1394-Y1396 PolarHBondContact O-N 2.96Å; C1394-C1405 HydrophobicContact CB-CB 3.91Å; C1394-C1405 WeakPolarHBondContact CB-SG 3.46Å; C1394-C1405 WeakPolarHBondContact SG-CB 3.35Å; C1394-C1405 CovalentContact SG-SG 2.04Å; C1394-C1405 PolarHBondContact SG-SG 3.26Å; C1394-E1407 WeakPolarHBondContact CB-OE1 3.49Å; C1394-E1407 PolarHBondContact N-OE1 3.35Å
1395	A	52.4	Low	50.1	Low	70 Å²	70	105.7 Å²	105.7	58%	0.579	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-69.3	-23.1	176.2	0	0	0	0	0	113.5	T1392 L1393 Q1397	T1392-A1395 VanDerWaalsContact O-CB 3.23Å; T1392-A1395 WeakPolarHBondContact O-CB 3.49Å; T1392-A1395 PolarHBondContact O-N 2.74Å; L1393-A1395 PolarHBondContact O-N 2.81Å; L1393-A1395 VanDerWaalsContact O-N 3.1Å; A1395-Q1397 VanDerWaalsContact C-N 3.28Å; A1395-Q1397 PolarHBondContact O-N 3.18Å
1396	Y	51.3	Low	52.7	Low	210 Å²	210	101.2 Å²	101.2	82%	0.824	53%	0.531	S	S	*	.	S	Bend	trans	-90.4	64.2	173.7	-80.4	-87.2	0	0	0	110.9	L1393 C1394	L1393-Y1396 PolarHBondContact O-N 2.81Å; C1394-Y1396 VanDerWaalsContact C-N 3.28Å; C1394-Y1396 PolarHBondContact O-N 2.96Å
1397	Q	56	Low	54.8	Low	141 Å²	141	99.8 Å²	99.8	66%	0.659	52%	0.517	S	S	*	.			trans	-49.9	128.7	-167.3	-152.8	108.8	4.3	0	0	115.8	A1395	A1395-Q1397 VanDerWaalsContact C-N 3.28Å; A1395-Q1397 PolarHBondContact O-N 3.18Å
1398	Q	61.5	Low	56.5	Low	121 Å²	121	97.2 Å²	97.2	57%	0.565	50%	0.498	S	S	*	.			trans	-131.9	-12.6	160.4	-61.8	-169.8	-72.3	0	0	115.1	Q1400 Y1413 F1425	Q1398-Q1400 PolarHBondContact O-N 2.9Å; Q1398-Y1413 PolarHBondContact OE1-OH 2.99Å; Q1398-F1425 HydrophobicContact CB-CD1 3.93Å; Q1398-F1425 HydrophobicContact CB-CE1 4.12Å
1399	C	72	Confident	58.1	Low	16 Å²	16	97.9 Å²	97.9	11%	0.108	50%	0.501	C	S	.	.			trans	-58.8	131	173.8	-58.4	0	0	0	0	111	A1403 C1415	C1399-A1403 HydrophobicContact CB-CB 4.32Å; C1399-C1415 WeakPolarHBondContact CA-SG 3.2Å; C1399-C1415 HydrophobicContact CB-CB 3.83Å; C1399-C1415 WeakPolarHBondContact CB-SG 3.47Å; C1399-C1415 WeakPolarHBondContact SG-CB 3.43Å; C1399-C1415 CovalentContact SG-SG 2.04Å; C1399-C1415 PolarHBondContact SG-SG 3.03Å
1400	Q	69.9	Low	59.1	Low	99 Å²	99	96.7 Å²	96.7	46%	0.463	50%	0.495	S	S	.	.			trans	-102	175.3	-179.4	-55.3	-172.8	26.1	0	0	111.3	Q1398 N1402 A1403 F1425	Q1398-Q1400 PolarHBondContact O-N 2.9Å; Q1400-N1402 PolarHBondContact O-N 3.37Å; Q1400-N1402 VanDerWaalsContact O-N 3.08Å; Q1400-A1403 VanDerWaalsContact O-CB 3.31Å; Q1400-A1403 WeakPolarHBondContact O-CB 3.47Å; Q1400-A1403 PolarHBondContact O-N 2.7Å; Q1400-F1425 WeakPolarHBondContact CB-O 3.24Å; Q1400-F1425 HydrophobicContact CG-CB 4.49Å; Q1400-F1425 PolarHBondContact N-O 3.43Å
1401	N	65.9	Low	60.3	Low	24 Å²	24	96.4 Å²	96.4	13%	0.128	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	40.9	170.7	-58.1	-49	0	0	0	113.9	A1403 F1421 C1426	N1401-A1403 PolarHBondContact O-N 3.01Å; N1401-A1403 VanDerWaalsContact O-N 3.12Å; N1401-F1421 HydrophobicContact CB-CD1 3.81Å; N1401-F1421 HydrophobicContact CB-CE1 3.66Å; N1401-F1421 HydrophobicContact CB-CE2 4.41Å; N1401-F1421 HydrophobicContact CB-CG 4.25Å; N1401-F1421 HydrophobicContact CB-CZ 3.97Å; N1401-F1421 WeakPolarHBondContact ND2-CD1 3.39Å; N1401-F1421 WeakPolarHBondContact ND2-CE1 3.49Å; N1401-C1426 PolarHBondContact ND2-O 3.04Å
1402	N	66.4	Low	61.4	Low	121 Å²	121	90.4 Å²	90.4	65%	0.647	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	24.5	-178.8	-57	-64.5	0	0	0	115.6	Q1400 D1642	Q1400-N1402 PolarHBondContact O-N 3.37Å; Q1400-N1402 VanDerWaalsContact O-N 3.08Å; N1402-D1642 PolarHBondContact ND2-OD1 3.42Å
1403	A	72.5	Confident	62.5	Low	9 Å²	9	89.2 Å²	89.2	7%	0.074	46%	0.455	C	S	.	.			trans	-62.8	138.5	176.2	0	0	0	0	0	112.5	C1399 Q1400 N1401 C1405 C1415 I1416 C1426	C1399-A1403 HydrophobicContact CB-CB 4.32Å; Q1400-A1403 VanDerWaalsContact O-CB 3.31Å; Q1400-A1403 WeakPolarHBondContact O-CB 3.47Å; Q1400-A1403 PolarHBondContact O-N 2.7Å; N1401-A1403 PolarHBondContact O-N 3.01Å; N1401-A1403 VanDerWaalsContact O-N 3.12Å; A1403-C1405 PolarHBondContact O-N 3.33Å; A1403-C1415 HydrophobicContact CB-CB 4.11Å; A1403-I1416 WeakPolarHBondContact CA-O 3.31Å; A1403-I1416 WeakPolarHBondContact CB-O 3.5Å; A1403-C1426 HydrophobicContact CB-CB 3.66Å; A1403-C1426 WeakPolarHBondContact CB-SG 3.44Å
1404	K	77.2	Confident	63.6	Low	141 Å²	141	89.2 Å²	89.2	61%	0.613	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	108	-177.1	177.3	-175.2	175.6	-175.3	0	110	V1406 I1416	K1404-V1406 HydrophobicContact CD-CG2 4.48Å; K1404-V1406 HydrophobicContact CG-CG2 4.28Å; K1404-I1416 HydrophobicContact CB-CB 4.28Å; K1404-I1416 PolarHBondContact N-O 3.05Å; K1404-I1416 PolarHBondContact O-N 3.2Å
1405	C	73.1	Confident	64.7	Low	33 Å²	33	88.4 Å²	88.4	22%	0.223	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	132.9	170.7	-165.6	0	0	0	0	110.2	C1394 A1403	C1394-C1405 HydrophobicContact CB-CB 3.91Å; C1394-C1405 WeakPolarHBondContact CB-SG 3.46Å; C1394-C1405 WeakPolarHBondContact SG-CB 3.35Å; C1394-C1405 CovalentContact SG-SG 2.04Å; C1394-C1405 PolarHBondContact SG-SG 3.26Å; A1403-C1405 PolarHBondContact O-N 3.33Å
1406	V	75.5	Confident	65.8	Low	52 Å²	52	89.5 Å²	89.5	32%	0.315	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	135	171.9	178.5	0	0	0	0	108.4	K1404 Y1413 T1414 I1416	K1404-V1406 HydrophobicContact CD-CG2 4.48Å; K1404-V1406 HydrophobicContact CG-CG2 4.28Å; V1406-Y1413 CarbonylContact O-C 3.6Å; V1406-Y1413 VanDerWaalsContact O-CA 3.27Å; V1406-Y1413 WeakPolarHBondContact O-CA 3.48Å; V1406-T1414 PolarHBondContact N-O 2.9Å; V1406-T1414 PolarHBondContact O-N 2.87Å; V1406-I1416 HydrophobicContact CG2-CD1 3.62Å; V1406-I1416 HydrophobicContact CG2-CG1 4.25Å
1407	E	68.3	Low	67	Low	82 Å²	82	81.6 Å²	81.6	38%	0.383	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.1	174.4	-79.1	162.6	-157.1	0	0	110.8	T1392 L1393 C1394	T1392-E1407 WeakPolarHBondContact CB-OE1 3.29Å; L1393-E1407 HydrophobicContact CB-CG 4.22Å; L1393-E1407 PolarHBondContact N-OE1 3.24Å; C1394-E1407 WeakPolarHBondContact CB-OE1 3.49Å; C1394-E1407 PolarHBondContact N-OE1 3.35Å
1408	N	57.9	Low	68	Low	74 Å²	74	80.1 Å²	80.1	40%	0.396	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	156.2	170.9	-57.6	-28.1	0	0	0	108.6	N1410 A1412 T1414	N1408-N1410 PolarHBondContact O-N 2.95Å; N1408-A1412 WeakPolarHBondContact CB-O 3.08Å; N1408-A1412 PolarHBondContact N-O 2.93Å; N1408-T1414 PolarHBondContact ND2-OG1 3Å
1409	Q	59.5	Low	68.6	Low	198 Å²	198	80.9 Å²	80.9	93%	0.925	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	2.1	-171.6	-62.6	179	-6.9	0	0	116
1410	N	50.6	Low	68.5	Low	136 Å²	136	80.5 Å²	80.5	73%	0.727	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	36.6	-171	-62.4	-2.8	0	0	0	112.6	N1408 A1412	N1408-N1410 PolarHBondContact O-N 2.95Å; N1410-A1412 PolarHBondContact O-N 3Å
1411	D	53.2	Low	69	Low	153 Å²	153	76.4 Å²	76.4	82%	0.818	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	42.1	-174.5	-65.6	-29.2	0	0	0	113.4	L1393	L1393-D1411 VanDerWaalsContact CD2-C 3.47Å; L1393-D1411 WeakPolarHBondContact CD2-O 3.05Å
1412	A	54.8	Low	69.3	Low	43 Å²	43	77.2 Å²	77.2	36%	0.355	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.4	176.7	0	0	0	0	0	109.6	N1408 N1410	N1408-A1412 WeakPolarHBondContact CB-O 3.08Å; N1408-A1412 PolarHBondContact N-O 2.93Å; N1410-A1412 PolarHBondContact O-N 3Å
1413	Y	70.2	Confident	69.3	Low	54 Å²	54	73.2 Å²	73.2	21%	0.212	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	164.2	176.4	67.8	-88.3	0	0	0	111.8	L1393 Q1398 V1406 F1425	L1393-Y1413 HydrophobicContact CD2-CD1 3.89Å; L1393-Y1413 HydrophobicContact CG-CD1 4.19Å; Q1398-Y1413 PolarHBondContact OE1-OH 2.99Å; V1406-Y1413 CarbonylContact O-C 3.6Å; V1406-Y1413 VanDerWaalsContact O-CA 3.27Å; V1406-Y1413 WeakPolarHBondContact O-CA 3.48Å; Y1413-F1425 HydrophobicContact CE2-CE1 4.33Å; Y1413-F1425 WeakPolarHBondContact OH-CE1 3.4Å
1414	T	71.3	Confident	69.1	Low	71 Å²	71	77.6 Å²	77.6	44%	0.436	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.5	175.1	-64.6	0	0	0	0	109.6	V1406 N1408	V1406-T1414 PolarHBondContact N-O 2.9Å; V1406-T1414 PolarHBondContact O-N 2.87Å; N1408-T1414 PolarHBondContact ND2-OG1 3Å
1415	C	78.4	Confident	69	Low	9 Å²	9	73.1 Å²	73.1	6%	0.061	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	116.3	178.4	-53.2	0	0	0	0	109.6	C1399 A1403 C1417 Q1424 C1426	C1399-C1415 WeakPolarHBondContact CA-SG 3.2Å; C1399-C1415 HydrophobicContact CB-CB 3.83Å; C1399-C1415 WeakPolarHBondContact CB-SG 3.47Å; C1399-C1415 WeakPolarHBondContact SG-CB 3.43Å; C1399-C1415 CovalentContact SG-SG 2.04Å; C1399-C1415 PolarHBondContact SG-SG 3.03Å; A1403-C1415 HydrophobicContact CB-CB 4.11Å; C1415-C1417 PolarHBondContact O-N 3Å; C1415-Q1424 PolarHBondContact SG-O 3.02Å; C1415-C1426 PolarHBondContact O-SG 3.11Å
1416	I	75.5	Confident	69.2	Low	93 Å²	93	71.6 Å²	71.6	48%	0.477	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	110.6	173.7	-57.1	177.4	0	0	0	108.7	A1403 K1404 V1406	A1403-I1416 WeakPolarHBondContact CA-O 3.31Å; A1403-I1416 WeakPolarHBondContact CB-O 3.5Å; K1404-I1416 HydrophobicContact CB-CB 4.28Å; K1404-I1416 PolarHBondContact N-O 3.05Å; K1404-I1416 PolarHBondContact O-N 3.2Å; V1406-I1416 HydrophobicContact CG2-CD1 3.62Å; V1406-I1416 HydrophobicContact CG2-CG1 4.25Å
1417	C	77.9	Confident	68.9	Low	44 Å²	44	71 Å²	71	30%	0.297	37%	0.374	S	S	.	.			trans	-75.7	146.8	-173.9	-50	0	0	0	0	113.5	C1415 F1421 C1426	C1415-C1417 PolarHBondContact O-N 3Å; C1417-F1421 HydrophobicContact CB-CB 4.18Å; C1417-F1421 WeakPolarHBondContact CB-O 3.47Å; C1417-C1426 WeakPolarHBondContact CA-SG 3.23Å; C1417-C1426 HydrophobicContact CB-CB 3.69Å; C1417-C1426 WeakPolarHBondContact CB-SG 3.45Å; C1417-C1426 PolarHBondContact N-SG 3.46Å; C1417-C1426 VanDerWaalsContact N-SG 3.4Å; C1417-C1426 VanDerWaalsContact SG-CA 3.53Å; C1417-C1426 WeakPolarHBondContact SG-CB 3.36Å; C1417-C1426 CovalentContact SG-SG 2.03Å; C1417-C1426 PolarHBondContact SG-SG 3.03Å
1418	Q	77.3	Confident	69.1	Low	110 Å²	110	68.3 Å²	68.3	51%	0.514	36%	0.363	S	S	.	.			trans	-69.5	149.7	169.1	-172.7	175.9	17	0	0	110.6	G1420 F1421	Q1418-G1420 PolarHBondContact O-N 2.97Å; Q1418-F1421 HydrophobicContact CB-CD2 4.08Å; Q1418-F1421 PolarHBondContact O-N 3.02Å
1419	K	73.1	Confident	70.2	Confident	137 Å²	137	64.8 Å²	64.8	60%	0.596	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	111.5	177.6	-78.1	-170.3	174.9	-172.3	0	110.7	G1671 E1677	K1419-G1671 VanDerWaalsContact O-CA 3.31Å; K1419-G1671 WeakPolarHBondContact O-CA 3.21Å; K1419-E1677 IonicContact NZ-OE1 3.87Å; K1419-E1677 IonicContact NZ-OE2 3.78Å; K1419-E1677 PolarHBondContact NZ-OE2 2.71Å
1420	G	71.1	Confident	71.4	Confident	8 Å²	8	57.9 Å²	57.9	8%	0.082	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	113.5	-13.7	179.7	0	0	0	0	0	115.7	Q1418 F1430	Q1418-G1420 PolarHBondContact O-N 2.97Å; G1420-F1430 VanDerWaalsContact C-CE1 3.45Å; G1420-F1430 WeakPolarHBondContact O-CD1 3.23Å; G1420-F1430 WeakPolarHBondContact O-CE1 3.46Å; G1420-F1430 PolarHBondContact O-N 2.95Å
1421	F	78.5	Confident	73.2	Confident	13 Å²	13	51.6 Å²	51.6	6%	0.057	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.8	176.3	-67.2	-89	0	0	0	112.4	N1401 C1417 Q1418 C1426 N1428 L1429 V1641 P1670	N1401-F1421 HydrophobicContact CB-CD1 3.81Å; N1401-F1421 HydrophobicContact CB-CE1 3.66Å; N1401-F1421 HydrophobicContact CB-CE2 4.41Å; N1401-F1421 HydrophobicContact CB-CG 4.25Å; N1401-F1421 HydrophobicContact CB-CZ 3.97Å; N1401-F1421 WeakPolarHBondContact ND2-CD1 3.39Å; N1401-F1421 WeakPolarHBondContact ND2-CE1 3.49Å; C1417-F1421 HydrophobicContact CB-CB 4.18Å; C1417-F1421 WeakPolarHBondContact CB-O 3.47Å; Q1418-F1421 HydrophobicContact CB-CD2 4.08Å; Q1418-F1421 PolarHBondContact O-N 3.02Å; F1421-C1426 HydrophobicContact CB-CB 4.32Å; F1421-N1428 CarbonylContact C-O 3.59Å; F1421-N1428 VanDerWaalsContact CA-O 3.25Å; F1421-N1428 WeakPolarHBondContact CA-O 3.45Å; F1421-L1429 HydrophobicContact CD1-CB 4.22Å; F1421-L1429 HydrophobicContact CD1-CD1 4.19Å; F1421-L1429 HydrophobicContact CD2-CD1 4.41Å; F1421-L1429 HydrophobicContact CE1-CB 4.05Å; F1421-L1429 HydrophobicContact CE1-CD1 3.92Å; F1421-L1429 HydrophobicContact CE1-CG 4.45Å; F1421-L1429 HydrophobicContact CE2-CD1 4.16Å; F1421-L1429 HydrophobicContact CG-CD1 4.44Å; F1421-L1429 HydrophobicContact CZ-CD1 3.92Å; F1421-V1641 HydrophobicContact CE1-CG2 4.45Å; F1421-V1641 HydrophobicContact CZ-CG1 4.16Å; F1421-P1670 HydrophobicContact CE2-CB 4.1Å; F1421-P1670 HydrophobicContact CZ-CB 4.12Å
1422	S	73.3	Confident	74.8	Confident	41 Å²	41	44.3 Å²	44.3	29%	0.287	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	168.7	179.1	64.3	0	0	0	0	112.3	C1426 E1427 N1428 F1430	S1422-C1426 CarbonylContact O-C 3.48Å; S1422-E1427 PolarHBondContact O-N 3.35Å; S1422-N1428 PolarHBondContact N-O 3.37Å; S1422-N1428 WeakPolarHBondContact O-CB 3.11Å; S1422-N1428 PolarHBondContact O-N 3.03Å; S1422-N1428 PolarHBondContact O-ND2 3.06Å; S1422-F1430 WeakPolarHBondContact OG-CD1 3.3Å
1423	G	67.1	Low	76.3	Confident	36 Å²	36	43 Å²	43	37%	0.371	23%	0.227	S	C	.	.	S	Bend	trans	107.3	164.6	-171.3	0	0	0	0	0	112.2	F1425 C1426 E1427	G1423-F1425 PolarHBondContact O-N 3.46Å; G1423-C1426 PolarHBondContact O-N 2.8Å; G1423-C1426 VanDerWaalsContact O-N 3.12Å; G1423-E1427 WeakPolarHBondContact CA-OE1 3.45Å
1424	Q	67.8	Low	77.1	Confident	101 Å²	101	40.4 Å²	40.4	47%	0.472	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-30.7	-175.5	-174.8	179.1	9.2	0	0	112.3	C1415 E1427	C1415-Q1424 PolarHBondContact SG-O 3.02Å; Q1424-E1427 PolarHBondContact N-OE2 2.82Å
1425	F	74.9	Confident	77.5	Confident	48 Å²	48	40.4 Å²	40.4	21%	0.211	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	13.3	179.4	-49.7	-72.8	0	0	0	111.8	Q1398 Q1400 Y1413 G1423 E1427	Q1398-F1425 HydrophobicContact CB-CD1 3.93Å; Q1398-F1425 HydrophobicContact CB-CE1 4.12Å; Q1400-F1425 WeakPolarHBondContact CB-O 3.24Å; Q1400-F1425 HydrophobicContact CG-CB 4.49Å; Q1400-F1425 PolarHBondContact N-O 3.43Å; Y1413-F1425 HydrophobicContact CE2-CE1 4.33Å; Y1413-F1425 WeakPolarHBondContact OH-CE1 3.4Å; G1423-F1425 PolarHBondContact O-N 3.46Å; F1425-E1427 VanDerWaalsContact C-OE2 3.28Å; F1425-E1427 VanDerWaalsContact CA-OE2 3.31Å; F1425-E1427 WeakPolarHBondContact CA-OE2 3.41Å; F1425-E1427 WeakPolarHBondContact CB-OE2 3.37Å; F1425-E1427 PolarHBondContact N-OE2 3.46Å; F1425-E1427 PolarHBondContact O-N 3.31Å
1426	C	77.2	Confident	77.6	Confident	1 Å²	1	42 Å²	42	1%	0.007	23%	0.229	C	C	.	.	S	Bend	trans	58.3	33	-175.5	-52	0	0	0	0	113.8	N1401 A1403 C1415 C1417 F1421 S1422 G1423	N1401-C1426 PolarHBondContact ND2-O 3.04Å; A1403-C1426 HydrophobicContact CB-CB 3.66Å; A1403-C1426 WeakPolarHBondContact CB-SG 3.44Å; C1415-C1426 PolarHBondContact O-SG 3.11Å; C1417-C1426 WeakPolarHBondContact CA-SG 3.23Å; C1417-C1426 HydrophobicContact CB-CB 3.69Å; C1417-C1426 WeakPolarHBondContact CB-SG 3.45Å; C1417-C1426 PolarHBondContact N-SG 3.46Å; C1417-C1426 VanDerWaalsContact N-SG 3.4Å; C1417-C1426 VanDerWaalsContact SG-CA 3.53Å; C1417-C1426 WeakPolarHBondContact SG-CB 3.36Å; C1417-C1426 CovalentContact SG-SG 2.03Å; C1417-C1426 PolarHBondContact SG-SG 3.03Å; F1421-C1426 HydrophobicContact CB-CB 4.32Å; S1422-C1426 CarbonylContact O-C 3.48Å; G1423-C1426 PolarHBondContact O-N 2.8Å; G1423-C1426 VanDerWaalsContact O-N 3.12Å
1427	E	69.4	Low	77.5	Confident	38 Å²	38	40.2 Å²	40.2	18%	0.178	22%	0.224	C	C	.	.			trans	-78.4	-25.5	-170.2	68.8	-71.7	168.1	0	0	114.9	S1422 G1423 Q1424 F1425	S1422-E1427 PolarHBondContact O-N 3.35Å; G1423-E1427 WeakPolarHBondContact CA-OE1 3.45Å; Q1424-E1427 PolarHBondContact N-OE2 2.82Å; F1425-E1427 VanDerWaalsContact C-OE2 3.28Å; F1425-E1427 VanDerWaalsContact CA-OE2 3.31Å; F1425-E1427 WeakPolarHBondContact CA-OE2 3.41Å; F1425-E1427 WeakPolarHBondContact CB-OE2 3.37Å; F1425-E1427 PolarHBondContact N-OE2 3.46Å; F1425-E1427 PolarHBondContact O-N 3.31Å
1428	N	73	Confident	77.5	Confident	27 Å²	27	45.3 Å²	45.3	14%	0.144	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137.7	-175	-43.8	-87.9	0	0	0	111.2	F1421 S1422	F1421-N1428 CarbonylContact C-O 3.59Å; F1421-N1428 VanDerWaalsContact CA-O 3.25Å; F1421-N1428 WeakPolarHBondContact CA-O 3.45Å; S1422-N1428 PolarHBondContact N-O 3.37Å; S1422-N1428 WeakPolarHBondContact O-CB 3.11Å; S1422-N1428 PolarHBondContact O-N 3.03Å; S1422-N1428 PolarHBondContact O-ND2 3.06Å
1429	L	80.7	Confident	77.7	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	108	174.8	178.1	64	0	0	0	109.5	F1421 A1431 I1432 D1632 F1633 A1634 F1637 P1670	F1421-L1429 HydrophobicContact CD1-CB 4.22Å; F1421-L1429 HydrophobicContact CD1-CD1 4.19Å; F1421-L1429 HydrophobicContact CD2-CD1 4.41Å; F1421-L1429 HydrophobicContact CE1-CB 4.05Å; F1421-L1429 HydrophobicContact CE1-CD1 3.92Å; F1421-L1429 HydrophobicContact CE1-CG 4.45Å; F1421-L1429 HydrophobicContact CE2-CD1 4.16Å; F1421-L1429 HydrophobicContact CG-CD1 4.44Å; F1421-L1429 HydrophobicContact CZ-CD1 3.92Å; L1429-A1431 WeakPolarHBondContact CD1-O 3.35Å; L1429-I1432 HydrophobicContact CD2-CG2 4.11Å; L1429-I1432 HydrophobicContact CG-CG2 4.34Å; L1429-D1632 PolarHBondContact N-OD1 3.23Å; L1429-F1633 HydrophobicContact CB-CB 4.33Å; L1429-F1633 HydrophobicContact CD2-CB 3.97Å; L1429-F1633 HydrophobicContact CG-CB 4.02Å; L1429-F1633 WeakPolarHBondContact O-CB 3.33Å; L1429-F1633 WeakPolarHBondContact O-CD2 3.45Å; L1429-F1633 PolarHBondContact O-N 2.84Å; L1429-A1634 HydrophobicContact CB-CB 3.9Å; L1429-F1637 HydrophobicContact CD2-CE2 4.17Å; L1429-P1670 HydrophobicContact CD1-CB 3.88Å; L1429-P1670 HydrophobicContact CD2-CB 4.31Å
1430	F	83.8	Confident	78.3	Confident	53 Å²	53	34.7 Å²	34.7	23%	0.232	19%	0.194	C	C	.	.			trans	-106.4	-5.3	-172.4	75.8	-89.1	0	0	0	114.4	G1420 S1422 R1622 N1623 M1630	G1420-F1430 VanDerWaalsContact C-CE1 3.45Å; G1420-F1430 WeakPolarHBondContact O-CD1 3.23Å; G1420-F1430 WeakPolarHBondContact O-CE1 3.46Å; G1420-F1430 PolarHBondContact O-N 2.95Å; S1422-F1430 WeakPolarHBondContact OG-CD1 3.3Å; F1430-R1622 WeakPolarHBondContact O-CA 3.48Å; F1430-N1623 VanDerWaalsContact CD2-OD1 3.32Å; F1430-N1623 WeakPolarHBondContact CD2-OD1 3.37Å; F1430-N1623 PolarHBondContact O-N 3.17Å; F1430-N1623 VanDerWaalsContact O-N 3.07Å; F1430-M1630 HydrophobicContact CB-SD 4.23Å
1431	A	87.9	Confident	79.1	Confident	3 Å²	3	34.3 Å²	34.3	3%	0.025	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	141.9	-179.7	0	0	0	0	0	111.7	L1429 I1621 R1622 G1671	L1429-A1431 WeakPolarHBondContact CD1-O 3.35Å; A1431-I1621 WeakPolarHBondContact CA-O 3.23Å; A1431-R1622 HydrophobicContact CB-CB 3.53Å; A1431-G1671 WeakPolarHBondContact O-CA 3.32Å; A1431-G1671 PolarHBondContact O-N 2.76Å
1432	I	87.3	Confident	79.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	137	-177.3	51.5	162.4	0	0	0	112.7	L1429 V1441 C1620 I1621 F1633 I1668 L1669 G1671	L1429-I1432 HydrophobicContact CD2-CG2 4.11Å; L1429-I1432 HydrophobicContact CG-CG2 4.34Å; I1432-V1441 HydrophobicContact CD1-CB 4.27Å; I1432-V1441 HydrophobicContact CD1-CG1 4.04Å; I1432-C1620 WeakPolarHBondContact O-CA 3.29Å; I1432-C1620 PolarHBondContact O-SG 2.62Å; I1432-I1621 HydrophobicContact CG1-CB 4.43Å; I1432-I1621 PolarHBondContact N-O 3.33Å; I1432-I1621 PolarHBondContact O-N 2.04Å; I1432-F1633 HydrophobicContact CD1-CD1 3.79Å; I1432-F1633 HydrophobicContact CD1-CD2 4.48Å; I1432-F1633 HydrophobicContact CD1-CE1 3.47Å; I1432-F1633 VanDerWaalsContact CD1-CE1 3.47Å; I1432-F1633 HydrophobicContact CD1-CE2 4.21Å; I1432-F1633 HydrophobicContact CD1-CG 4.28Å; I1432-F1633 HydrophobicContact CD1-CZ 3.68Å; I1432-F1633 HydrophobicContact CG1-CD1 4.3Å; I1432-F1633 HydrophobicContact CG1-CD2 4.09Å; I1432-F1633 HydrophobicContact CG1-CE1 3.97Å; I1432-F1633 HydrophobicContact CG1-CE2 3.74Å; I1432-F1633 HydrophobicContact CG1-CG 4.35Å; I1432-F1633 HydrophobicContact CG1-CZ 3.66Å; I1432-F1633 HydrophobicContact CG2-CB 4.04Å; I1432-F1633 HydrophobicContact CG2-CD1 4.42Å; I1432-F1633 HydrophobicContact CG2-CD2 3.82Å; I1432-F1633 HydrophobicContact CG2-CE2 4.33Å; I1432-F1633 HydrophobicContact CG2-CG 3.86Å; I1432-I1668 HydrophobicContact CB-CG2 3.55Å; I1432-I1668 HydrophobicContact CD1-CD1 4.15Å; I1432-I1668 HydrophobicContact CD1-CG2 3.92Å; I1432-I1668 HydrophobicContact CG1-CG2 4.3Å; I1432-I1668 HydrophobicContact CG2-CG2 3.78Å; I1432-L1669 CarbonylContact C-O 3.27Å; I1432-L1669 WeakPolarHBondContact CA-O 3.41Å; I1432-G1671 CarbonylContact C-O 3.51Å
1433	S	85.7	Confident	79.5	Confident	15 Å²	15	32 Å²	32	11%	0.105	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	140.3	172.9	-126.8	0	0	0	0	111.3	P1435 G1619 L1669 G1671	S1433-P1435 WeakPolarHBondContact O-CD 3.03Å; S1433-G1619 WeakPolarHBondContact CA-O 3.31Å; S1433-G1619 PolarHBondContact OG-O 2.82Å; S1433-L1669 PolarHBondContact N-O 3.27Å; S1433-L1669 PolarHBondContact O-N 2.81Å; S1433-G1671 WeakPolarHBondContact CB-O 3.31Å; S1433-G1671 PolarHBondContact N-O 2.58Å
1434	L	88.3	Confident	79.7	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	91.2	169.1	-59.3	171.2	0	0	0	107.5	L1617 T1618 G1619 I1621	L1434-L1617 HydrophobicContact CD1-CD1 3.7Å; L1434-L1617 HydrophobicContact CD1-CG 4.48Å; L1434-T1618 VanDerWaalsContact O-CA 3.24Å; L1434-T1618 WeakPolarHBondContact O-CA 3.48Å; L1434-G1619 PolarHBondContact N-O 3.13Å; L1434-G1619 PolarHBondContact O-N 3.28Å; L1434-I1621 HydrophobicContact CD1-CD1 3.78Å; L1434-I1621 HydrophobicContact CD1-CG1 4.15Å
1435	P	79.7	Confident	79.3	Confident	71 Å²	71	30.5 Å²	30.5	46%	0.461	17%	0.167	S	C	.	.			trans	-74.9	-21.7	-178	29.9	-38.2	0	0	0	114.2	S1433 G1667 L1669	S1433-P1435 WeakPolarHBondContact O-CD 3.03Å; P1435-G1667 WeakPolarHBondContact CD-O 3.21Å; P1435-G1667 WeakPolarHBondContact CG-O 3.03Å; P1435-L1669 HydrophobicContact CB-CD1 4.24Å; P1435-L1669 HydrophobicContact CG-CD1 4.1Å; P1435-L1669 HydrophobicContact CG-CG 4.2Å
1436	S	80.2	Confident	78.3	Confident	42 Å²	42	31.4 Å²	31.4	29%	0.294	18%	0.178	S	C	.	.	S	Bend	trans	-129.3	147.1	-176.3	176.1	0	0	0	0	110.8	H1438 S1439	S1436-H1438 PolarHBondContact O-N 2.75Å; S1436-H1438 PolarHBondContact OG-N 3.09Å; S1436-H1438 PolarHBondContact OG-ND1 2.96Å; S1436-S1439 PolarHBondContact N-OG 2.83Å; S1436-S1439 WeakPolarHBondContact O-CB 3.4Å; S1436-S1439 PolarHBondContact O-N 2.92Å; S1436-S1439 PolarHBondContact O-OG 2.91Å; S1436-S1439 VanDerWaalsContact O-OG 3.05Å
1437	P	74.2	Confident	76.9	Confident	56 Å²	56	33.1 Å²	33.1	36%	0.364	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-10.2	170.7	-23	34	0	0	0	114.5	G1616 T1618	P1437-G1616 CarbonylContact O-C 3.48Å; P1437-G1616 VanDerWaalsContact O-CA 3.25Å; P1437-G1616 WeakPolarHBondContact O-CA 3.08Å; P1437-T1618 HydrophobicContact CG-CG2 4.09Å
1438	H	76	Confident	75.7	Confident	151 Å²	151	42.4 Å²	42.4	70%	0.699	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-1.7	173.9	-58.1	86.1	0	0	0	113.1	S1436	S1436-H1438 PolarHBondContact O-N 2.75Å; S1436-H1438 PolarHBondContact OG-N 3.09Å; S1436-H1438 PolarHBondContact OG-ND1 2.96Å
1439	S	83	Confident	74.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.			trans	-78.5	131.2	-179.2	-57.3	0	0	0	0	111.1	S1436 G1595 I1666 G1667	S1436-S1439 PolarHBondContact N-OG 2.83Å; S1436-S1439 WeakPolarHBondContact O-CB 3.4Å; S1436-S1439 PolarHBondContact O-N 2.92Å; S1436-S1439 PolarHBondContact O-OG 2.91Å; S1436-S1439 VanDerWaalsContact O-OG 3.05Å; S1439-G1595 CarbonylContact O-C 3.56Å; S1439-I1666 VanDerWaalsContact CA-O 3.23Å; S1439-I1666 WeakPolarHBondContact CA-O 3.28Å; S1439-G1667 PolarHBondContact OG-O 3.04Å
1440	Y	86.1	Confident	72.8	Confident	23 Å²	23	43.5 Å²	43.5	9%	0.09	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.5	172.9	70.8	-97.9	0	0	0	112.2	Y1593 F1594 P1598 A1665 I1666	Y1440-Y1593 AromaticContact CD2-CD1 3.85Å; Y1440-Y1593 HydrophobicContact CD2-CD1 3.85Å; Y1440-Y1593 HydrophobicContact CD2-CE1 4.34Å; Y1440-Y1593 HydrophobicContact CE2-CD1 4.07Å; Y1440-Y1593 HydrophobicContact CE2-CE1 4.08Å; Y1440-F1594 WeakPolarHBondContact CA-O 3.49Å; Y1440-P1598 HydrophobicContact CE1-CB 4.23Å; Y1440-P1598 HydrophobicContact CE2-CB 4.23Å; Y1440-A1665 WeakPolarHBondContact O-CA 3.14Å; Y1440-I1666 HydrophobicContact CD1-CB 4.31Å; Y1440-I1666 HydrophobicContact CE1-CB 4.01Å; Y1440-I1666 HydrophobicContact CE1-CD1 3.78Å; Y1440-I1666 HydrophobicContact CE1-CG1 4Å; Y1440-I1666 PolarHBondContact N-O 2.93Å; Y1440-I1666 VanDerWaalsContact N-O 3.08Å; Y1440-I1666 PolarHBondContact O-N 3.21Å; Y1440-I1666 WeakPolarHBondContact OH-CD1 3.35Å
1441	V	86.6	Confident	71.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.5	170.3	64.3	0	0	0	0	110.6	I1432 I1443 Y1593 F1594 F1633 L1636 I1668	I1432-V1441 HydrophobicContact CD1-CB 4.27Å; I1432-V1441 HydrophobicContact CD1-CG1 4.04Å; V1441-I1443 HydrophobicContact CG2-CG1 4.32Å; V1441-Y1593 CarbonylContact O-C 3.1Å; V1441-Y1593 VanDerWaalsContact O-CA 3.29Å; V1441-Y1593 WeakPolarHBondContact O-CA 3.28Å; V1441-F1594 HydrophobicContact CG1-CB 3.74Å; V1441-F1594 PolarHBondContact N-O 3.27Å; V1441-F1594 VanDerWaalsContact N-O 3.11Å; V1441-F1594 PolarHBondContact O-N 3.42Å; V1441-F1633 HydrophobicContact CG1-CE1 4.21Å; V1441-F1633 HydrophobicContact CG2-CD1 4.19Å; V1441-F1633 HydrophobicContact CG2-CE1 4.37Å; V1441-L1636 HydrophobicContact CG2-CD1 3.48Å; V1441-L1636 VanDerWaalsContact CG2-CD1 3.48Å; V1441-I1668 HydrophobicContact CB-CD1 3.56Å; V1441-I1668 HydrophobicContact CG2-CD1 4.09Å
1442	A	83.8	Confident	69.3	Low	4 Å²	4	42.6 Å²	42.6	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	103.8	177.9	0	0	0	0	0	110.4	P1591 Y1593 T1664	A1442-P1591 HydrophobicContact CB-CB 4.1Å; A1442-Y1593 HydrophobicContact CB-CD1 3.62Å; A1442-Y1593 HydrophobicContact CB-CE1 3.42Å; A1442-Y1593 VanDerWaalsContact CB-CE1 3.42Å; A1442-T1664 WeakPolarHBondContact CB-O 3.48Å; A1442-T1664 PolarHBondContact N-O 3.13Å
1443	I	77.6	Confident	67.4	Low	3 Å²	3	46.5 Å²	46.5	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117.5	179.8	-60.6	177	0	0	0	108.8	V1441 P1445 L1592 F1594 V1624 I1626 I1631 F1633 L1636	V1441-I1443 HydrophobicContact CG2-CG1 4.32Å; I1443-P1445 WeakPolarHBondContact O-CD 3.15Å; I1443-L1592 PolarHBondContact N-O 3.13Å; I1443-L1592 PolarHBondContact O-N 2.81Å; I1443-F1594 HydrophobicContact CD1-CD2 3.88Å; I1443-F1594 HydrophobicContact CD1-CE2 3.67Å; I1443-F1594 HydrophobicContact CD1-CZ 4.46Å; I1443-F1594 HydrophobicContact CG1-CD2 4.45Å; I1443-F1594 HydrophobicContact CG1-CE2 4.47Å; I1443-V1624 HydrophobicContact CD1-CG1 4Å; I1443-I1626 HydrophobicContact CG2-CD1 3.87Å; I1443-I1631 HydrophobicContact CD1-CG1 4.41Å; I1443-I1631 HydrophobicContact CD1-CG2 4.08Å; I1443-I1631 HydrophobicContact CG2-CD1 4.35Å; I1443-I1631 HydrophobicContact CG2-CG1 4.49Å; I1443-I1631 HydrophobicContact CG2-CG2 4.43Å; I1443-F1633 HydrophobicContact CD1-CE1 4.28Å; I1443-L1636 HydrophobicContact CG1-CD1 3.88Å
1444	V	70.7	Confident	66.1	Low	91 Å²	91	46.8 Å²	46.8	55%	0.552	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-87.6	116	170.7	-179	0	0	0	0	108.5	P1591	V1444-P1591 HydrophobicContact CG2-CB 4.35Å; V1444-P1591 HydrophobicContact CG2-CG 4.3Å
1445	P	59.7	Low	65.2	Low	13 Å²	13	47 Å²	47	8%	0.084	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-65.7	146.4	-175.2	-24.1	36.2	0	0	0	113.1	I1443 S1447 L1588	I1443-P1445 WeakPolarHBondContact O-CD 3.15Å; P1445-S1447 PolarHBondContact O-N 2.8Å; P1445-L1588 HydrophobicContact CB-CB 4.48Å; P1445-L1588 HydrophobicContact CB-CD1 4.12Å; P1445-L1588 HydrophobicContact CG-CB 3.8Å; P1445-L1588 HydrophobicContact CG-CD1 3.52Å; P1445-L1588 HydrophobicContact CG-CG 4.31Å
1446	P	53.6	Low	65.1	Low	68 Å²	68	44.2 Å²	44.2	44%	0.442	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-53	139	176.1	-28.6	35.8	0	0	0	113.1	R1448 G1449	P1446-R1448 PolarHBondContact O-N 2.98Å; P1446-R1448 VanDerWaalsContact O-N 3.17Å; P1446-G1449 WeakPolarHBondContact O-CA 3.4Å; P1446-G1449 PolarHBondContact O-N 2.93Å
1447	S	48.2	Very low	65.4	Low	37 Å²	37	42.3 Å²	42.3	26%	0.259	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	115.2	-160.4	-45.1	0	0	0	0	115.2	I1341 Y1342 P1445	I1341-S1447 VanDerWaalsContact CD1-OG 3.23Å; I1341-S1447 WeakPolarHBondContact CD1-OG 3.43Å; Y1342-S1447 WeakPolarHBondContact CE2-OG 3.47Å; Y1342-S1447 WeakPolarHBondContact OH-CB 3.45Å; Y1342-S1447 PolarHBondContact OH-OG 3.27Å; P1445-S1447 PolarHBondContact O-N 2.8Å
1448	R	43.6	Very low	66.1	Low	232 Å²	232	40.2 Å²	40.2	88%	0.875	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.3	9.1	-169.4	-55.3	-177.7	-179.7	165.5	2.6	116	P1446 A1450	P1446-R1448 PolarHBondContact O-N 2.98Å; P1446-R1448 VanDerWaalsContact O-N 3.17Å; R1448-A1450 PolarHBondContact O-N 3.04Å
1449	G	44.1	Very low	67	Low	22 Å²	22	33.2 Å²	33.2	23%	0.227	19%	0.188	C	C	.	.			trans	-70.1	64.6	166.2	0	0	0	0	0	113	P1446	P1446-G1449 WeakPolarHBondContact O-CA 3.4Å; P1446-G1449 PolarHBondContact O-N 2.93Å
1450	A	48.1	Very low	67.4	Low	29 Å²	29	34.6 Å²	34.6	24%	0.24	20%	0.195	C	C	.	.			trans	-69.3	145.4	157	0	0	0	0	0	108.6	R1448 V1452	R1448-A1450 PolarHBondContact O-N 3.04Å; A1450-V1452 HydrophobicContact CB-CB 3.9Å; A1450-V1452 HydrophobicContact CB-CG2 3.87Å; A1450-V1452 PolarHBondContact O-N 2.7Å
1451	L	49.9	Very low	67.7	Low	6 Å²	6	33.5 Å²	33.5	3%	0.031	19%	0.191	C	C	.	.			trans	-78.1	50.4	175.7	-69.2	163.5	0	0	0	111	S1454 I1457 L1532 L1586 L1588 I1626	L1451-S1454 CarbonylContact C-O 3.58Å; L1451-S1454 VanDerWaalsContact C-O 3.26Å; L1451-S1454 CarbonylContact O-C 3.38Å; L1451-I1457 HydrophobicContact CD1-CD1 3.83Å; L1451-I1457 HydrophobicContact CD1-CG1 4.06Å; L1451-I1457 HydrophobicContact CD2-CG1 4.07Å; L1451-L1532 WeakPolarHBondContact O-CD2 3.44Å; L1451-L1586 HydrophobicContact CD1-CD2 4.27Å; L1451-L1588 HydrophobicContact CD1-CD1 3.91Å; L1451-L1588 HydrophobicContact CD1-CD2 4.19Å; L1451-L1588 HydrophobicContact CD1-CG 4.38Å; L1451-L1588 HydrophobicContact CG-CD1 3.96Å; L1451-L1588 HydrophobicContact CG-CG 4.49Å; L1451-I1626 HydrophobicContact CD2-CG2 4.44Å
1452	V	48.8	Very low	67.9	Low	31 Å²	31	33.6 Å²	33.6	19%	0.188	19%	0.191	C	C	.	.			trans	-152.6	137.2	-154.3	-177.4	0	0	0	0	112.5	A1450 S1454 H1585 L1586	A1450-V1452 HydrophobicContact CB-CB 3.9Å; A1450-V1452 HydrophobicContact CB-CG2 3.87Å; A1450-V1452 PolarHBondContact O-N 2.7Å; V1452-S1454 VanDerWaalsContact C-N 3.26Å; V1452-S1454 PolarHBondContact N-O 2.86Å; V1452-H1585 HydrophobicContact CB-CB 4.42Å; V1452-H1585 HydrophobicContact CG1-CB 3.59Å; V1452-H1585 WeakPolarHBondContact CG1-ND1 3.49Å; V1452-H1585 HydrophobicContact CG2-CB 4.15Å; V1452-L1586 HydrophobicContact CG2-CB 4.16Å; V1452-L1586 VanDerWaalsContact CG2-N 3.28Å; V1452-L1586 VanDerWaalsContact CG2-O 3.26Å; V1452-L1586 WeakPolarHBondContact CG2-O 3.36Å
1453	P	47.3	Very low	68.3	Low	82 Å²	82	33.5 Å²	33.5	53%	0.532	19%	0.19	S	C	.	.	S	Bend	cis	-70.7	-19.4	-1.1	29.9	-35.8	0	0	0	113.1	A1534	P1453-A1534 WeakPolarHBondContact O-CA 3.36Å; P1453-A1534 PolarHBondContact O-N 2.57Å
1454	S	58.2	Low	68.7	Low	20 Å²	20	38.9 Å²	38.9	14%	0.14	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	156.5	165.9	49.3	0	0	0	0	110.3	E826 L1451 V1452 L1532	E826-S1454 PolarHBondContact O-OG 2.96Å; L1451-S1454 CarbonylContact C-O 3.58Å; L1451-S1454 VanDerWaalsContact C-O 3.26Å; L1451-S1454 CarbonylContact O-C 3.38Å; V1452-S1454 VanDerWaalsContact C-N 3.26Å; V1452-S1454 PolarHBondContact N-O 2.86Å; S1454-L1532 CarbonylContact C-O 3.57Å; S1454-L1532 WeakPolarHBondContact CA-O 3.44Å
1455	G	69.8	Low	69.6	Low	6 Å²	6	35.4 Å²	35.4	6%	0.062	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	152.7	173.3	0	0	0	0	0	113	Y1531 L1532 N1627	G1455-Y1531 WeakPolarHBondContact O-CA 3.45Å; G1455-Y1531 WeakPolarHBondContact O-CD2 3.39Å; G1455-L1532 PolarHBondContact N-O 2.96Å; G1455-L1532 PolarHBondContact O-N 3.06Å; G1455-N1627 WeakPolarHBondContact CA-OD1 3.32Å
1456	T	78.4	Confident	70.8	Confident	12 Å²	12	40.4 Å²	40.4	7%	0.074	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.2	179.1	51	0	0	0	0	112.1	L1530 Y1531 I1626 N1627	T1456-L1530 WeakPolarHBondContact CA-O 3.39Å; T1456-Y1531 HydrophobicContact CG2-CD2 3.55Å; T1456-Y1531 HydrophobicContact CG2-CE2 4.28Å; T1456-Y1531 HydrophobicContact CG2-CG 4.36Å; T1456-I1626 WeakPolarHBondContact O-CA 3.29Å; T1456-N1627 PolarHBondContact N-OD1 3.15Å; T1456-N1627 PolarHBondContact O-N 3.32Å; T1456-N1627 WeakPolarHBondContact OG1-CA 3.31Å
1457	I	85.5	Confident	72.3	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.3	158.3	-52.7	168.1	0	0	0	105.9	L1451 F1459 L1471 L1490 K1529 L1530 L1592 F1594 Q1625	L1451-I1457 HydrophobicContact CD1-CD1 3.83Å; L1451-I1457 HydrophobicContact CD1-CG1 4.06Å; L1451-I1457 HydrophobicContact CD2-CG1 4.07Å; I1457-F1459 HydrophobicContact CG2-CD1 4.34Å; I1457-L1471 HydrophobicContact CD1-CD2 3.86Å; I1457-L1490 HydrophobicContact CD1-CD2 4.19Å; I1457-K1529 CarbonylContact O-C 3.26Å; I1457-K1529 WeakPolarHBondContact O-CA 3.3Å; I1457-L1530 HydrophobicContact CB-CB 4.36Å; I1457-L1530 HydrophobicContact CB-CD1 4.47Å; I1457-L1530 HydrophobicContact CD1-CD1 4.37Å; I1457-L1530 PolarHBondContact N-O 3.27Å; I1457-L1530 PolarHBondContact O-N 2.97Å; I1457-L1592 HydrophobicContact CD1-CD1 4.36Å; I1457-L1592 HydrophobicContact CD1-CD2 3.88Å; I1457-L1592 HydrophobicContact CG1-CD2 4.46Å; I1457-F1594 HydrophobicContact CG2-CE1 4.43Å; I1457-F1594 HydrophobicContact CG2-CZ 3.92Å; I1457-Q1625 WeakPolarHBondContact CA-O 3.48Å
1458	S	89.7	Confident	74.2	Confident	12 Å²	12	36.8 Å²	36.8	8%	0.084	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	144.5	171.6	45.3	0	0	0	0	111.3	I1528 V1624 Q1625	S1458-I1528 CarbonylContact C-O 3.59Å; S1458-I1528 VanDerWaalsContact CA-O 3.23Å; S1458-I1528 WeakPolarHBondContact CA-O 3.39Å; S1458-V1624 CarbonylContact O-C 3.39Å; S1458-V1624 WeakPolarHBondContact O-CA 3.03Å; S1458-Q1625 PolarHBondContact N-O 3.34Å; S1458-Q1625 PolarHBondContact O-N 3.42Å
1459	F	93.5	Very high	76.3	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.018	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	158.5	-178.6	59.4	-77.9	0	0	0	110	I1457 I1461 I1528 F1594 I1621 V1624	I1457-F1459 HydrophobicContact CG2-CD1 4.34Å; F1459-I1461 HydrophobicContact CD2-CB 4.35Å; F1459-I1461 HydrophobicContact CE2-CB 4.34Å; F1459-I1461 HydrophobicContact CE2-CG2 4.4Å; F1459-I1528 HydrophobicContact CD1-CB 4.26Å; F1459-I1528 HydrophobicContact CD1-CG2 4.36Å; F1459-I1528 HydrophobicContact CD2-CD1 4.45Å; F1459-I1528 HydrophobicContact CE1-CB 3.91Å; F1459-I1528 HydrophobicContact CE1-CG2 3.64Å; F1459-I1528 HydrophobicContact CE2-CB 4.21Å; F1459-I1528 HydrophobicContact CE2-CD1 3.62Å; F1459-I1528 HydrophobicContact CE2-CG1 4.46Å; F1459-I1528 HydrophobicContact CZ-CB 3.89Å; F1459-I1528 HydrophobicContact CZ-CD1 3.68Å; F1459-I1528 HydrophobicContact CZ-CG1 4.4Å; F1459-I1528 HydrophobicContact CZ-CG2 3.77Å; F1459-I1528 PolarHBondContact N-O 2.03Å; F1459-I1528 PolarHBondContact O-N 2.74Å; F1459-F1594 HydrophobicContact CB-CE1 4.38Å; F1459-F1594 AromaticContact CD1-CE1 3.72Å; F1459-F1594 HydrophobicContact CD1-CE1 3.72Å; F1459-F1594 HydrophobicContact CD2-CD1 4.44Å; F1459-F1594 HydrophobicContact CD2-CE1 4.31Å; F1459-F1594 AromaticContact CE1-CE1 3.96Å; F1459-F1594 HydrophobicContact CE1-CE1 3.96Å; F1459-F1594 HydrophobicContact CE2-CD1 4.45Å; F1459-F1594 HydrophobicContact CE2-CE1 4.5Å; F1459-F1594 HydrophobicContact CG-CD1 4.48Å; F1459-F1594 AromaticContact CG-CE1 3.91Å; F1459-F1594 HydrophobicContact CG-CE1 3.91Å; F1459-F1594 HydrophobicContact CZ-CE1 4.34Å; F1459-I1621 HydrophobicContact CD2-CG2 4.33Å; F1459-V1624 HydrophobicContact CB-CB 4.38Å; F1459-V1624 HydrophobicContact CB-CG2 3.82Å
1460	E	91.8	Very high	78.5	Confident	30 Å²	30	24.7 Å²	24.7	14%	0.14	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.6	170.1	-73	163.3	-127.6	0	0	109	F1525 H1526 Q1527 I1621 R1622 N1623	E1460-F1525 HydrophobicContact CB-CD1 4.16Å; E1460-H1526 WeakPolarHBondContact CA-O 3.47Å; E1460-Q1527 HydrophobicContact CG-CB 4.2Å; E1460-Q1527 HydrophobicContact CG-CG 4.36Å; E1460-I1621 WeakPolarHBondContact O-CA 3.49Å; E1460-R1622 HydrophobicContact CB-CG 3.78Å; E1460-R1622 PolarHBondContact N-O 3.15Å; E1460-R1622 PolarHBondContact O-N 3.32Å; E1460-R1622 IonicContact OE2-CZ 2.69Å; E1460-R1622 IonicContact OE2-NE 2.85Å; E1460-R1622 PolarHBondContact OE2-NE 2.85Å; E1460-R1622 IonicContact OE2-NH2 3.65Å; E1460-R1622 PolarHBondContact OE2-NH2 3.41Å; E1460-N1623 PolarHBondContact OE1-ND2 2.86Å; E1460-N1623 PolarHBondContact OE2-ND2 3.17Å
1461	I	92.6	Very high	80.5	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.4	175.1	-169.1	173	0	0	0	110.8	F1459 T1463 L1470 I1520 F1525 H1526 I1528 L1617 C1620 I1621	F1459-I1461 HydrophobicContact CD2-CB 4.35Å; F1459-I1461 HydrophobicContact CE2-CB 4.34Å; F1459-I1461 HydrophobicContact CE2-CG2 4.4Å; I1461-T1463 HydrophobicContact CD1-CG2 4.47Å; I1461-L1470 HydrophobicContact CD1-CD2 3.37Å; I1461-L1470 HydrophobicContact CG2-CD2 4.47Å; I1461-I1520 HydrophobicContact CG2-CD1 3.88Å; I1461-F1525 WeakPolarHBondContact O-CA 3.39Å; I1461-H1526 PolarHBondContact N-O 2.88Å; I1461-H1526 PolarHBondContact O-N 2.87Å; I1461-I1528 HydrophobicContact CG2-CD1 3.51Å; I1461-I1528 HydrophobicContact CG2-CG1 4.35Å; I1461-L1617 HydrophobicContact CD1-CD1 3.91Å; I1461-L1617 HydrophobicContact CD1-CD2 4.37Å; I1461-C1620 WeakPolarHBondContact CA-O 3.5Å; I1461-I1621 HydrophobicContact CB-CG1 4.41Å; I1461-I1621 HydrophobicContact CD1-CD1 4.35Å; I1461-I1621 HydrophobicContact CD1-CG1 4.01Å; I1461-I1621 HydrophobicContact CG1-CG1 3.93Å
1462	A	91.4	Very high	82.4	Confident	1 Å²	1	23 Å²	23	1%	0.008	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.4	164.4	0	0	0	0	0	109.4	N1524 F1525 G1619 C1620 L1674	A1462-N1524 WeakPolarHBondContact CA-O 3.44Å; A1462-N1524 VanDerWaalsContact CB-O 3.25Å; A1462-N1524 WeakPolarHBondContact CB-O 3.25Å; A1462-F1525 HydrophobicContact CB-CD1 3.67Å; A1462-F1525 HydrophobicContact CB-CD2 4.25Å; A1462-F1525 HydrophobicContact CB-CE1 3.65Å; A1462-F1525 HydrophobicContact CB-CE2 4.25Å; A1462-F1525 HydrophobicContact CB-CG 3.97Å; A1462-F1525 HydrophobicContact CB-CZ 3.93Å; A1462-G1619 CarbonylContact O-C 3.37Å; A1462-G1619 WeakPolarHBondContact O-CA 3.46Å; A1462-C1620 PolarHBondContact N-O 2.69Å; A1462-C1620 PolarHBondContact O-N 3.37Å; A1462-L1674 HydrophobicContact CB-CD2 3.83Å
1463	T	91.3	Very high	84.1	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.018	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	151.3	-176.3	-178.6	0	0	0	0	111	I1461 S1465 L1494 I1520 N1521 G1523 T1618	I1461-T1463 HydrophobicContact CD1-CG2 4.47Å; T1463-S1465 WeakPolarHBondContact OG1-CB 3.46Å; T1463-S1465 PolarHBondContact OG1-N 2.96Å; T1463-S1465 PolarHBondContact OG1-OG 3.08Å; T1463-L1494 HydrophobicContact CG2-CD2 4.1Å; T1463-I1520 HydrophobicContact CG2-CD1 4.33Å; T1463-N1521 CarbonylContact O-C 3.6Å; T1463-N1521 WeakPolarHBondContact O-CA 3.37Å; T1463-G1523 WeakPolarHBondContact O-CA 3.33Å; T1463-G1523 PolarHBondContact O-N 2.86Å; T1463-T1618 WeakPolarHBondContact CB-O 3.47Å; T1463-T1618 PolarHBondContact OG1-O 2.87Å
1464	K	85.7	Confident	85.7	Confident	115 Å²	115	17.8 Å²	17.8	50%	0.5	9%	0.092	S	C	.	.			trans	-115.5	6.9	166.8	-66.7	178.7	-179.9	171	0	111.7	N1521	K1464-N1521 WeakPolarHBondContact CA-O 3.44Å
1465	S	89.5	Confident	86.5	Confident	18 Å²	18	17.2 Å²	17.2	13%	0.126	9%	0.088	C	C	.	.			trans	-73.8	132.4	176	-49.7	0	0	0	0	109	T1463 N1467 L1494 N1521 T1618	T1463-S1465 WeakPolarHBondContact OG1-CB 3.46Å; T1463-S1465 PolarHBondContact OG1-N 2.96Å; T1463-S1465 PolarHBondContact OG1-OG 3.08Å; S1465-N1467 WeakPolarHBondContact CB-O 3.3Å; S1465-L1494 WeakPolarHBondContact O-CD2 3.24Å; S1465-N1521 WeakPolarHBondContact O-CB 3.48Å; S1465-T1618 PolarHBondContact OG-N 2.84Å; S1465-T1618 PolarHBondContact OG-O 3.02Å; S1465-T1618 PolarHBondContact OG-OG1 3.29Å; S1465-T1618 VanDerWaalsContact OG-OG1 3.12Å
1466	M	85.5	Confident	86.3	Confident	118 Å²	118	20.4 Å²	20.4	58%	0.581	11%	0.106	S	C	*	.	S	Bend	trans	-76.9	-34.8	175.6	-62.6	-173.8	-63.3	0	0	111.5	H1495 D1496 G1497	M1466-H1495 CarbonylContact O-C 3.55Å; M1466-D1496 PolarHBondContact O-N 3.07Å; M1466-D1496 VanDerWaalsContact O-N 3.12Å; M1466-G1497 PolarHBondContact O-N 3.15Å
1467	N	85.7	Confident	85.6	Confident	29 Å²	29	23.4 Å²	23.4	16%	0.155	13%	0.127	C	C	.	.	S	Bend	trans	-123.4	157.4	179.4	-57.4	-53.2	0	0	0	110.4	S1465 L1494 H1495 D1496 E1614	S1465-N1467 WeakPolarHBondContact CB-O 3.3Å; N1467-L1494 CarbonylContact C-O 3.53Å; N1467-L1494 VanDerWaalsContact CA-O 3.26Å; N1467-L1494 WeakPolarHBondContact CA-O 3.47Å; N1467-H1495 WeakPolarHBondContact OD1-CA 3.23Å; N1467-H1495 PolarHBondContact OD1-ND1 2.93Å; N1467-D1496 PolarHBondContact OD1-N 3.13Å; N1467-E1614 HydrophobicContact CB-CB 4.06Å; N1467-E1614 HydrophobicContact CB-CG 4.01Å
1468	G	87.8	Confident	84.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.1	170.4	175.4	0	0	0	0	0	114.5	D1493 L1494 E1614 G1616	G1468-D1493 CarbonylContact O-C 3.53Å; G1468-D1493 WeakPolarHBondContact O-CA 3.49Å; G1468-L1494 PolarHBondContact N-O 2.74Å; G1468-L1494 PolarHBondContact O-N 3.4Å; G1468-E1614 CarbonylContact C-O 3.55Å; G1468-E1614 VanDerWaalsContact C-O 3.27Å; G1468-E1614 WeakPolarHBondContact CA-O 3.49Å; G1468-G1616 WeakPolarHBondContact CA-O 3.5Å
1469	I	88.7	Confident	82.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115	170.6	-66.3	175.4	0	0	0	109.8	N1472 D1493 G1595 G1596 V1597 A1605 T1609 E1614 L1615	I1469-N1472 HydrophobicContact CG2-CB 4.02Å; I1469-D1493 HydrophobicContact CG1-CB 4.41Å; I1469-G1595 CarbonylContact O-C 3.32Å; I1469-G1595 WeakPolarHBondContact O-CA 3.39Å; I1469-G1596 PolarHBondContact O-N 3.08Å; I1469-V1597 HydrophobicContact CB-CG2 4.22Å; I1469-V1597 HydrophobicContact CD1-CG2 3.51Å; I1469-V1597 HydrophobicContact CG1-CG2 4.45Å; I1469-V1597 HydrophobicContact CG2-CG2 3.82Å; I1469-A1605 HydrophobicContact CD1-CB 4.07Å; I1469-T1609 HydrophobicContact CD1-CG2 4.35Å; I1469-E1614 PolarHBondContact N-O 2.88Å; I1469-L1615 HydrophobicContact CD1-CD2 4.06Å
1470	L	89.2	Confident	80.3	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-45.9	-179.6	-68.7	160.8	0	0	0	111.2	I1461 V1492 L1494 I1499 I1520 I1528 F1594 G1595 L1617	I1461-L1470 HydrophobicContact CD1-CD2 3.37Å; I1461-L1470 HydrophobicContact CG2-CD2 4.47Å; L1470-V1492 HydrophobicContact CB-CB 4.4Å; L1470-V1492 HydrophobicContact CB-CG1 4.16Å; L1470-V1492 WeakPolarHBondContact CB-O 3.43Å; L1470-V1492 HydrophobicContact CD1-CG1 3.95Å; L1470-V1492 PolarHBondContact N-O 3.1Å; L1470-L1494 HydrophobicContact CD1-CB 4.09Å; L1470-L1494 HydrophobicContact CD1-CD1 4.3Å; L1470-L1494 HydrophobicContact CG-CB 4.26Å; L1470-I1499 HydrophobicContact CD1-CD1 4.05Å; L1470-I1499 HydrophobicContact CD1-CG1 3.93Å; L1470-I1499 HydrophobicContact CD1-CG2 4.45Å; L1470-I1520 HydrophobicContact CD2-CD1 4.46Å; L1470-I1528 HydrophobicContact CD1-CD1 4.45Å; L1470-F1594 WeakPolarHBondContact O-CA 3.43Å; L1470-G1595 PolarHBondContact O-N 3.46Å; L1470-L1617 HydrophobicContact CD2-CD2 3.65Å; L1470-L1617 HydrophobicContact CG-CD2 4.07Å
1471	L	90.4	Very high	78.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	133.9	-176.3	-168.3	72.3	0	0	0	110.4	I1457 L1490 L1491 V1492 L1530 L1592 Y1593 F1594	I1457-L1471 HydrophobicContact CD1-CD2 3.86Å; L1471-L1490 HydrophobicContact CD2-CD2 4.34Å; L1471-L1491 WeakPolarHBondContact O-CA 3.34Å; L1471-V1492 HydrophobicContact CB-CB 3.88Å; L1471-V1492 HydrophobicContact CB-CG2 4.08Å; L1471-V1492 HydrophobicContact CD2-CG2 4.21Å; L1471-V1492 PolarHBondContact N-O 3.36Å; L1471-V1492 PolarHBondContact O-N 3.39Å; L1471-L1530 HydrophobicContact CD2-CD1 3.42Å; L1471-L1530 VanDerWaalsContact CD2-CD1 3.42Å; L1471-L1592 HydrophobicContact CD1-CD1 3.65Å; L1471-L1592 HydrophobicContact CD1-CD2 4.18Å; L1471-L1592 HydrophobicContact CD1-CG 3.77Å; L1471-L1592 HydrophobicContact CD2-CD1 4.23Å; L1471-L1592 HydrophobicContact CG-CD1 3.89Å; L1471-Y1593 CarbonylContact C-O 3.51Å; L1471-Y1593 WeakPolarHBondContact CA-O 3.17Å; L1471-F1594 HydrophobicContact CD1-CD1 3.71Å; L1471-F1594 HydrophobicContact CD1-CD2 3.68Å; L1471-F1594 HydrophobicContact CD1-CE1 3.51Å; L1471-F1594 HydrophobicContact CD1-CE2 3.45Å; L1471-F1594 VanDerWaalsContact CD1-CE2 3.45Å; L1471-F1594 HydrophobicContact CD1-CG 3.81Å; L1471-F1594 HydrophobicContact CD1-CZ 3.38Å
1472	N	88.7	Confident	76.6	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	128.4	173.3	172.8	57.8	0	0	0	112.1	I1469 I1474 Y1593 V1597 Q1601	I1469-N1472 HydrophobicContact CG2-CB 4.02Å; N1472-I1474 WeakPolarHBondContact OD1-CD1 3.46Å; N1472-Y1593 PolarHBondContact N-O 3.17Å; N1472-Y1593 PolarHBondContact O-N 2.95Å; N1472-V1597 HydrophobicContact CB-CG2 3.88Å; N1472-Q1601 PolarHBondContact ND2-OE1 3.45Å
1473	F	86	Confident	74.9	Confident	1 Å²	1	46 Å²	46	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	123.6	168.9	171.5	-96.4	0	0	0	110.1	D1475 Y1489 L1490 L1586 A1587 L1588 S1590 L1592	F1473-D1475 HydrophobicContact CE1-CB 4.38Å; F1473-D1475 HydrophobicContact CZ-CB 4.18Å; F1473-Y1489 CarbonylContact O-C 3.1Å; F1473-Y1489 VanDerWaalsContact O-CA 3.25Å; F1473-Y1489 WeakPolarHBondContact O-CA 3.49Å; F1473-Y1489 WeakPolarHBondContact O-CB 3.35Å; F1473-L1490 HydrophobicContact CB-CB 4.35Å; F1473-L1490 PolarHBondContact N-O 3.04Å; F1473-L1490 PolarHBondContact O-N 2.95Å; F1473-L1586 HydrophobicContact CD1-CD1 4.27Å; F1473-L1586 HydrophobicContact CD1-CD2 4.43Å; F1473-L1586 HydrophobicContact CE1-CD1 3.83Å; F1473-L1586 HydrophobicContact CE1-CD2 4.47Å; F1473-L1586 HydrophobicContact CE1-CG 4.11Å; F1473-A1587 WeakPolarHBondContact CZ-O 3.45Å; F1473-L1588 HydrophobicContact CD1-CD2 4Å; F1473-L1588 HydrophobicContact CD2-CD2 3.59Å; F1473-L1588 HydrophobicContact CE1-CD2 3.96Å; F1473-L1588 HydrophobicContact CE2-CB 4.12Å; F1473-L1588 HydrophobicContact CE2-CD2 3.52Å; F1473-L1588 HydrophobicContact CE2-CG 4.43Å; F1473-L1588 HydrophobicContact CG-CD2 3.83Å; F1473-L1588 HydrophobicContact CZ-CD2 3.74Å; F1473-S1590 WeakPolarHBondContact CE2-OG 3.24Å; F1473-L1592 HydrophobicContact CB-CD1 3.79Å
1474	I	79.6	Confident	73.4	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	120.8	177.4	-72.5	163.6	0	0	0	108.5	N1472 T1476 P1486 S1590 T1604 L1608	N1472-I1474 WeakPolarHBondContact OD1-CD1 3.46Å; I1474-T1476 HydrophobicContact CG2-CG2 4.07Å; I1474-T1476 PolarHBondContact O-N 2.73Å; I1474-T1476 VanDerWaalsContact O-N 3.1Å; I1474-P1486 HydrophobicContact CG1-CG 4.5Å; I1474-P1486 HydrophobicContact CG2-CB 4.02Å; I1474-P1486 HydrophobicContact CG2-CG 3.83Å; I1474-S1590 WeakPolarHBondContact O-CB 3.12Å; I1474-S1590 PolarHBondContact O-OG 2.8Å; I1474-T1604 HydrophobicContact CD1-CG2 3.79Å; I1474-L1608 HydrophobicContact CD1-CD1 4.19Å; I1474-L1608 HydrophobicContact CG1-CD1 4.34Å
1475	D	75.4	Confident	72.4	Confident	9 Å²	9	45.3 Å²	45.3	5%	0.048	27%	0.266	C	S	.	.			trans	-78.2	92.4	172	-172.5	-2	0	0	0	110.2	F1473 S1477 L1478 H1488 T1589	F1473-D1475 HydrophobicContact CE1-CB 4.38Å; F1473-D1475 HydrophobicContact CZ-CB 4.18Å; D1475-S1477 PolarHBondContact O-N 2.79Å; D1475-S1477 VanDerWaalsContact OD1-CB 3.3Å; D1475-S1477 WeakPolarHBondContact OD1-CB 3.38Å; D1475-S1477 PolarHBondContact OD1-N 3.36Å; D1475-S1477 PolarHBondContact OD1-OG 3.37Å; D1475-S1477 PolarHBondContact OD2-OG 3.1Å; D1475-L1478 PolarHBondContact O-N 3.44Å; D1475-H1488 HydrophobicContact CB-CB 4.03Å; D1475-H1488 PolarHBondContact N-O 2.86Å; D1475-H1488 VanDerWaalsContact N-O 3.09Å; D1475-T1589 PolarHBondContact OD1-OG1 2.99Å; D1475-T1589 PolarHBondContact OD2-OG1 3.25Å
1476	T	66.2	Low	71.5	Confident	72 Å²	72	44.5 Å²	44.5	44%	0.442	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-65.7	-14.6	179.4	54.7	0	0	0	0	113.4	I1474 L1478 I1479	I1474-T1476 HydrophobicContact CG2-CG2 4.07Å; I1474-T1476 PolarHBondContact O-N 2.73Å; I1474-T1476 VanDerWaalsContact O-N 3.1Å; T1476-L1478 PolarHBondContact O-N 2.8Å; T1476-I1479 HydrophobicContact CG2-CD1 4.11Å; T1476-I1479 PolarHBondContact O-N 3.19Å
1477	S	62.9	Low	70.7	Confident	76 Å²	76	41.4 Å²	41.4	53%	0.531	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-72.6	-8.8	179.4	77.3	0	0	0	0	114.2	D1475	D1475-S1477 PolarHBondContact O-N 2.79Å; D1475-S1477 VanDerWaalsContact OD1-CB 3.3Å; D1475-S1477 WeakPolarHBondContact OD1-CB 3.38Å; D1475-S1477 PolarHBondContact OD1-N 3.36Å; D1475-S1477 PolarHBondContact OD1-OG 3.37Å; D1475-S1477 PolarHBondContact OD2-OG 3.1Å
1478	L	54.2	Low	70.1	Confident	49 Å²	49	40.8 Å²	40.8	26%	0.257	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-113.3	11.2	-178.9	-63.3	174	0	0	0	113.8	D1475 T1476 N1480 E1487 H1488	D1475-L1478 PolarHBondContact O-N 3.44Å; T1476-L1478 PolarHBondContact O-N 2.8Å; L1478-N1480 PolarHBondContact O-N 3.12Å; L1478-E1487 HydrophobicContact CB-CB 4.22Å; L1478-E1487 HydrophobicContact CB-CG 4.37Å; L1478-E1487 HydrophobicContact CD1-CB 4.29Å; L1478-H1488 HydrophobicContact CD1-CB 4.41Å; L1478-H1488 WeakPolarHBondContact CD1-ND1 3.49Å
1479	I	55.1	Low	69.8	Low	66 Å²	66	41.4 Å²	41.4	34%	0.338	24%	0.243	S	C	.	.			trans	-82.8	79.9	175.5	-52.9	174.6	0	0	0	109.7	T1476 P1486	T1476-I1479 HydrophobicContact CG2-CD1 4.11Å; T1476-I1479 PolarHBondContact O-N 3.19Å; I1479-P1486 HydrophobicContact CG1-CB 4.05Å
1480	N	49.4	Very low	69.6	Low	144 Å²	144	41.6 Å²	41.6	77%	0.77	24%	0.244	S	C	*	.			trans	-118	15.4	177.8	-84.5	-46.2	0	0	0	113.5	L1478	L1478-N1480 PolarHBondContact O-N 3.12Å
1481	N	51.6	Low	69.5	Low	62 Å²	62	41.6 Å²	41.6	33%	0.332	24%	0.244	S	C	.	.	S	Bend	trans	-120.9	149.8	-172.8	-62.9	-61.1	0	0	0	111.6	D1483 G1484 R1507	N1481-D1483 PolarHBondContact O-N 3.03Å; N1481-D1483 VanDerWaalsContact O-N 3.09Å; N1481-G1484 PolarHBondContact O-N 3.25Å; N1481-R1507 PolarHBondContact ND2-NE 3.35Å
1482	S	53.7	Low	69.5	Low	116 Å²	116	41.6 Å²	41.6	81%	0.811	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-28.7	-176.8	39.1	0	0	0	0	115.3	G1484	S1482-G1484 PolarHBondContact O-N 2.81Å
1483	D	55.9	Low	69.5	Low	87 Å²	87	41.6 Å²	41.6	47%	0.465	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	7.1	-163.7	-20.7	-54.7	0	0	0	112.7	N1481 I1485 R1507	N1481-D1483 PolarHBondContact O-N 3.03Å; N1481-D1483 VanDerWaalsContact O-N 3.09Å; D1483-I1485 PolarHBondContact O-N 3.34Å; D1483-R1507 IonicContact OD2-CZ 3.37Å; D1483-R1507 IonicContact OD2-NH1 3.57Å; D1483-R1507 PolarHBondContact OD2-NH1 2.89Å; D1483-R1507 IonicContact OD2-NH2 3.56Å; D1483-R1507 PolarHBondContact OD2-NH2 2.95Å
1484	G	60.6	Low	69.6	Low	36 Å²	36	41.6 Å²	41.6	37%	0.371	24%	0.244	S	C	.	.			trans	70.5	-22.9	179	0	0	0	0	0	116.3	N1481 S1482 P1486	N1481-G1484 PolarHBondContact O-N 3.25Å; S1482-G1484 PolarHBondContact O-N 2.81Å; G1484-P1486 WeakPolarHBondContact O-CD 3.43Å
1485	I	65.2	Low	69.8	Low	67 Å²	67	43.6 Å²	43.6	34%	0.344	25%	0.253	S	S	.	.			trans	-69.8	122.8	-174.9	-58.1	171.7	0	0	0	111.6	D1483	D1483-I1485 PolarHBondContact O-N 3.34Å
1486	P	69.2	Low	70.2	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	28%	0.279	C	S	.	.			trans	-72.2	153.5	177.9	30.2	-35.9	0	0	0	112.8	I1474 I1479 G1484 Y1489 T1604	I1474-P1486 HydrophobicContact CG1-CG 4.5Å; I1474-P1486 HydrophobicContact CG2-CB 4.02Å; I1474-P1486 HydrophobicContact CG2-CG 3.83Å; I1479-P1486 HydrophobicContact CG1-CB 4.05Å; G1484-P1486 WeakPolarHBondContact O-CD 3.43Å; P1486-Y1489 HydrophobicContact CG-CD1 4.02Å; P1486-T1604 HydrophobicContact CG-CG2 4.08Å
1487	E	68.1	Low	70.9	Confident	53 Å²	53	45 Å²	45	25%	0.248	26%	0.258	C	S	.	.	S	Bend	trans	-76.4	-28.5	179.9	-63	-160.6	149.5	0	0	114.4	L1478 L1505 N1506 R1507	L1478-E1487 HydrophobicContact CB-CB 4.22Å; L1478-E1487 HydrophobicContact CB-CG 4.37Å; L1478-E1487 HydrophobicContact CD1-CB 4.29Å; E1487-L1505 CarbonylContact O-C 3.51Å; E1487-N1506 PolarHBondContact O-N 3.35Å; E1487-N1506 VanDerWaalsContact O-N 3.16Å; E1487-R1507 HydrophobicContact CG-CG 4.45Å
1488	H	74.1	Confident	71.9	Confident	16 Å²	16	44.1 Å²	44.1	7%	0.074	25%	0.246	C	C	.	.	S	Bend	trans	-129.6	117.8	-176.2	-69	65.5	0	0	0	109.4	D1475 L1478 S1504 L1505 S1583 L1586	D1475-H1488 HydrophobicContact CB-CB 4.03Å; D1475-H1488 PolarHBondContact N-O 2.86Å; D1475-H1488 VanDerWaalsContact N-O 3.09Å; L1478-H1488 HydrophobicContact CD1-CB 4.41Å; L1478-H1488 WeakPolarHBondContact CD1-ND1 3.49Å; H1488-S1504 WeakPolarHBondContact CA-O 3.42Å; H1488-L1505 PolarHBondContact CE1-O 2.97Å; H1488-L1505 PolarHBondContact NE2-O 3.17Å; H1488-L1505 VanDerWaalsContact NE2-O 3.08Å; H1488-S1583 PolarHBondContact NE2-OG 3.25Å; H1488-L1586 HydrophobicContact CB-CD1 4.17Å
1489	Y	82.2	Confident	73.4	Confident	13 Å²	13	41.8 Å²	41.8	5%	0.051	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	156	178.8	63.1	-94.2	0	0	0	112.1	F1473 P1486 K1502 F1503 S1504 L1608	F1473-Y1489 CarbonylContact O-C 3.1Å; F1473-Y1489 VanDerWaalsContact O-CA 3.25Å; F1473-Y1489 WeakPolarHBondContact O-CA 3.49Å; F1473-Y1489 WeakPolarHBondContact O-CB 3.35Å; P1486-Y1489 HydrophobicContact CG-CD1 4.02Å; Y1489-K1502 HydrophobicContact CE2-CB 4.23Å; Y1489-F1503 WeakPolarHBondContact O-CD2 3.38Å; Y1489-S1504 VanDerWaalsContact CE1-CB 3.46Å; Y1489-S1504 PolarHBondContact N-O 3.13Å; Y1489-S1504 PolarHBondContact O-N 2.81Å; Y1489-L1608 HydrophobicContact CD1-CD2 4.4Å; Y1489-L1608 HydrophobicContact CD2-CD1 4.07Å; Y1489-L1608 HydrophobicContact CD2-CD2 4.2Å; Y1489-L1608 HydrophobicContact CE1-CD2 3.98Å; Y1489-L1608 HydrophobicContact CE2-CD1 4.45Å; Y1489-L1608 HydrophobicContact CE2-CD2 3.78Å; Y1489-L1608 HydrophobicContact CG-CD1 4.17Å; Y1489-L1608 HydrophobicContact CG-CD2 4.5Å
1490	L	84.5	Confident	74.9	Confident	4 Å²	4	39 Å²	39	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	114.5	169.8	170.9	60.8	0	0	0	107.6	I1457 L1471 F1473 V1501 F1503 L1530 L1537	I1457-L1490 HydrophobicContact CD1-CD2 4.19Å; L1471-L1490 HydrophobicContact CD2-CD2 4.34Å; F1473-L1490 HydrophobicContact CB-CB 4.35Å; F1473-L1490 PolarHBondContact N-O 3.04Å; F1473-L1490 PolarHBondContact O-N 2.95Å; L1490-V1501 HydrophobicContact CD1-CG1 4.19Å; L1490-F1503 HydrophobicContact CB-CD2 4.21Å; L1490-F1503 HydrophobicContact CD1-CB 4.24Å; L1490-F1503 HydrophobicContact CD1-CD2 4.08Å; L1490-L1530 HydrophobicContact CD2-CD1 4.45Å; L1490-L1537 HydrophobicContact CD1-CD2 3.61Å
1491	L	87.4	Confident	76.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.7	178.5	179.2	144.9	0	0	0	108.8	L1471 D1493 K1502 L1608 T1609	L1471-L1491 WeakPolarHBondContact O-CA 3.34Å; L1491-D1493 HydrophobicContact CD2-CB 3.98Å; L1491-D1493 VanDerWaalsContact CD2-OD1 3.23Å; L1491-D1493 WeakPolarHBondContact CD2-OD1 3.33Å; L1491-K1502 HydrophobicContact CD2-CB 4.46Å; L1491-K1502 HydrophobicContact CD2-CD 4.15Å; L1491-K1502 HydrophobicContact CD2-CG 4.21Å; L1491-K1502 PolarHBondContact N-O 2.76Å; L1491-K1502 PolarHBondContact O-N 2.69Å; L1491-L1608 HydrophobicContact CD1-CB 4.2Å; L1491-L1608 HydrophobicContact CD1-CD1 4.47Å; L1491-T1609 HydrophobicContact CD1-CG2 4.27Å; L1491-T1609 HydrophobicContact CD2-CG2 4.03Å
1492	V	89.3	Confident	77.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	115.6	173.2	-175.3	0	0	0	0	107.2	L1470 L1471 I1499 H1500 V1501 L1530	L1470-V1492 HydrophobicContact CB-CB 4.4Å; L1470-V1492 HydrophobicContact CB-CG1 4.16Å; L1470-V1492 WeakPolarHBondContact CB-O 3.43Å; L1470-V1492 HydrophobicContact CD1-CG1 3.95Å; L1470-V1492 PolarHBondContact N-O 3.1Å; L1471-V1492 HydrophobicContact CB-CB 3.88Å; L1471-V1492 HydrophobicContact CB-CG2 4.08Å; L1471-V1492 HydrophobicContact CD2-CG2 4.21Å; L1471-V1492 PolarHBondContact N-O 3.36Å; L1471-V1492 PolarHBondContact O-N 3.39Å; V1492-I1499 HydrophobicContact CG1-CG2 3.58Å; V1492-H1500 WeakPolarHBondContact CA-O 3.36Å; V1492-H1500 WeakPolarHBondContact CG1-O 3.44Å; V1492-V1501 HydrophobicContact CG1-CG2 4.26Å; V1492-V1501 HydrophobicContact CG2-CG1 4.19Å; V1492-V1501 HydrophobicContact CG2-CG2 4.19Å; V1492-L1530 HydrophobicContact CG2-CD1 3.95Å; V1492-L1530 HydrophobicContact CG2-CD2 4.33Å
1493	D	88.9	Confident	79.1	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	158.7	179.4	59	-54.8	0	0	0	111.5	G1468 I1469 L1491 H1500 K1502 T1609 S1613	G1468-D1493 CarbonylContact O-C 3.53Å; G1468-D1493 WeakPolarHBondContact O-CA 3.49Å; I1469-D1493 HydrophobicContact CG1-CB 4.41Å; L1491-D1493 HydrophobicContact CD2-CB 3.98Å; L1491-D1493 VanDerWaalsContact CD2-OD1 3.23Å; L1491-D1493 WeakPolarHBondContact CD2-OD1 3.33Å; D1493-H1500 PolarHBondContact N-O 3.38Å; D1493-H1500 VanDerWaalsContact N-O 3.1Å; D1493-H1500 PolarHBondContact O-N 2.87Å; D1493-H1500 WeakPolarHBondContact OD1-CB 3.4Å; D1493-H1500 IonicContact OD2-ND1 2.66Å; D1493-K1502 WeakPolarHBondContact OD1-CE 3.42Å; D1493-T1609 HydrophobicContact CB-CG2 4.31Å; D1493-S1613 PolarHBondContact OD2-OG 2.81Å
1494	L	87.8	Confident	80	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.1	176.5	-169.6	72.4	0	0	0	107.1	T1463 S1465 N1467 G1468 L1470 G1497 Q1498 I1499 I1520	T1463-L1494 HydrophobicContact CG2-CD2 4.1Å; S1465-L1494 WeakPolarHBondContact O-CD2 3.24Å; N1467-L1494 CarbonylContact C-O 3.53Å; N1467-L1494 VanDerWaalsContact CA-O 3.26Å; N1467-L1494 WeakPolarHBondContact CA-O 3.47Å; G1468-L1494 PolarHBondContact N-O 2.74Å; G1468-L1494 PolarHBondContact O-N 3.4Å; L1470-L1494 HydrophobicContact CD1-CB 4.09Å; L1470-L1494 HydrophobicContact CD1-CD1 4.3Å; L1470-L1494 HydrophobicContact CG-CB 4.26Å; L1494-G1497 VanDerWaalsContact CD1-C 3.49Å; L1494-G1497 VanDerWaalsContact CD1-O 3.31Å; L1494-G1497 WeakPolarHBondContact CD1-O 3.36Å; L1494-Q1498 WeakPolarHBondContact CA-O 3.31Å; L1494-I1499 HydrophobicContact CD1-CG1 4.23Å; L1494-I1520 HydrophobicContact CD1-CD1 3.96Å; L1494-I1520 HydrophobicContact CD1-CG1 3.61Å
1495	H	84.6	Confident	80.4	Confident	44 Å²	44	19.9 Å²	19.9	20%	0.204	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	126.9	178.7	-173.7	70.6	0	0	0	109.4	M1466 N1467 G1497 Q1498 H1500 L1612	M1466-H1495 CarbonylContact O-C 3.55Å; N1467-H1495 WeakPolarHBondContact OD1-CA 3.23Å; N1467-H1495 PolarHBondContact OD1-ND1 2.93Å; H1495-G1497 PolarHBondContact O-N 3.06Å; H1495-Q1498 PolarHBondContact N-O 3.03Å; H1495-Q1498 WeakPolarHBondContact O-CB 3.42Å; H1495-Q1498 PolarHBondContact O-N 3.13Å; H1495-H1500 WeakPolarHBondContact CB-CE1 3.23Å; H1495-H1500 AromaticContact CD2-CE1 3.63Å; H1495-H1500 AromaticContact CG-CE1 3.77Å; H1495-L1612 PolarHBondContact CE1-O 3.29Å; H1495-L1612 VanDerWaalsContact CE1-O 3.3Å; H1495-L1612 PolarHBondContact ND1-O 2.99Å
1496	D	83.1	Confident	80.4	Confident	110 Å²	110	18.9 Å²	18.9	59%	0.588	9%	0.093	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	32.6	-169.5	-65.6	-24.7	0	0	0	113.7	M1466 N1467 Q1498	M1466-D1496 PolarHBondContact O-N 3.07Å; M1466-D1496 VanDerWaalsContact O-N 3.12Å; N1467-D1496 PolarHBondContact OD1-N 3.13Å; D1496-Q1498 VanDerWaalsContact C-N 3.27Å; D1496-Q1498 PolarHBondContact O-N 2.77Å
1497	G	80.5	Confident	79.6	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	-5.5	-176.6	0	0	0	0	0	116.2	M1466 L1494 H1495 N1519 I1520 N1521	M1466-G1497 PolarHBondContact O-N 3.15Å; L1494-G1497 VanDerWaalsContact CD1-C 3.49Å; L1494-G1497 VanDerWaalsContact CD1-O 3.31Å; L1494-G1497 WeakPolarHBondContact CD1-O 3.36Å; H1495-G1497 PolarHBondContact O-N 3.06Å; G1497-N1519 VanDerWaalsContact CA-OD1 3.25Å; G1497-N1519 WeakPolarHBondContact CA-OD1 3.19Å; G1497-N1519 WeakPolarHBondContact O-CA 3.23Å; G1497-N1519 PolarHBondContact O-OD1 3.04Å; G1497-N1519 VanDerWaalsContact O-OD1 3.09Å; G1497-I1520 PolarHBondContact O-N 3.08Å; G1497-N1521 WeakPolarHBondContact CA-ND2 3.46Å
1498	Q	84.3	Confident	78.7	Confident	58 Å²	58	25.6 Å²	25.6	27%	0.271	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143.1	177.3	-65.4	-175.3	12.3	0	0	111.9	L1494 H1495 D1496 C1516	L1494-Q1498 WeakPolarHBondContact CA-O 3.31Å; H1495-Q1498 PolarHBondContact N-O 3.03Å; H1495-Q1498 WeakPolarHBondContact O-CB 3.42Å; H1495-Q1498 PolarHBondContact O-N 3.13Å; D1496-Q1498 VanDerWaalsContact C-N 3.27Å; D1496-Q1498 PolarHBondContact O-N 2.77Å; Q1498-C1516 WeakPolarHBondContact CB-O 3.42Å
1499	I	86.5	Confident	77.3	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	124.5	176.4	-63.5	-171.2	0	0	0	110.5	L1470 V1492 L1494 V1501 C1516 I1520 I1528 L1539 I1541	L1470-I1499 HydrophobicContact CD1-CD1 4.05Å; L1470-I1499 HydrophobicContact CD1-CG1 3.93Å; L1470-I1499 HydrophobicContact CD1-CG2 4.45Å; V1492-I1499 HydrophobicContact CG1-CG2 3.58Å; L1494-I1499 HydrophobicContact CD1-CG1 4.23Å; I1499-V1501 HydrophobicContact CG2-CG2 4.23Å; I1499-C1516 HydrophobicContact CB-CB 4.33Å; I1499-C1516 WeakPolarHBondContact O-CB 3.47Å; I1499-C1516 PolarHBondContact O-N 3.27Å; I1499-I1520 HydrophobicContact CD1-CD1 3.82Å; I1499-I1520 HydrophobicContact CD1-CG1 4.24Å; I1499-I1520 HydrophobicContact CD1-CG2 4.4Å; I1499-I1520 HydrophobicContact CG1-CD1 4.04Å; I1499-I1520 HydrophobicContact CG1-CG1 4.08Å; I1499-I1528 HydrophobicContact CD1-CD1 3.48Å; I1499-I1528 VanDerWaalsContact CD1-CD1 3.48Å; I1499-I1528 HydrophobicContact CD1-CG1 3.75Å; I1499-L1539 HydrophobicContact CG2-CD2 3.9Å; I1499-I1541 HydrophobicContact CB-CD1 4.27Å; I1499-I1541 HydrophobicContact CD1-CD1 3.67Å; I1499-I1541 HydrophobicContact CD1-CG1 4.25Å; I1499-I1541 HydrophobicContact CG1-CD1 4.15Å
1500	H	85.5	Confident	75.5	Confident	7 Å²	7	31.1 Å²	31.1	3%	0.032	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	145.4	169.7	-67.2	176.6	0	0	0	110.2	V1492 D1493 H1495 N1515	V1492-H1500 WeakPolarHBondContact CA-O 3.36Å; V1492-H1500 WeakPolarHBondContact CG1-O 3.44Å; D1493-H1500 PolarHBondContact N-O 3.38Å; D1493-H1500 VanDerWaalsContact N-O 3.1Å; D1493-H1500 PolarHBondContact O-N 2.87Å; D1493-H1500 WeakPolarHBondContact OD1-CB 3.4Å; D1493-H1500 IonicContact OD2-ND1 2.66Å; H1495-H1500 WeakPolarHBondContact CB-CE1 3.23Å; H1495-H1500 AromaticContact CD2-CE1 3.63Å; H1495-H1500 AromaticContact CG-CE1 3.77Å; H1500-N1515 VanDerWaalsContact CD2-CG 3.42Å; H1500-N1515 PolarHBondContact CD2-OD1 3.07Å; H1500-N1515 PolarHBondContact NE2-ND2 3.19Å; H1500-N1515 PolarHBondContact NE2-OD1 3.2Å
1501	V	84	Confident	73.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.7	174.1	-172.6	0	0	0	0	110.9	L1490 V1492 I1499 M1514 L1537 L1539 M1549	L1490-V1501 HydrophobicContact CD1-CG1 4.19Å; V1492-V1501 HydrophobicContact CG1-CG2 4.26Å; V1492-V1501 HydrophobicContact CG2-CG1 4.19Å; V1492-V1501 HydrophobicContact CG2-CG2 4.19Å; I1499-V1501 HydrophobicContact CG2-CG2 4.23Å; V1501-M1514 PolarHBondContact N-O 2.93Å; V1501-L1537 HydrophobicContact CG1-CD2 3.69Å; V1501-L1539 HydrophobicContact CG2-CD2 3.91Å; V1501-M1549 HydrophobicContact CB-SD 3.77Å; V1501-M1549 HydrophobicContact CG1-SD 3.54Å; V1501-M1549 VanDerWaalsContact CG1-SD 3.54Å; V1501-M1549 WeakPolarHBondContact O-CE 3.34Å
1502	K	81.3	Confident	71.9	Confident	9 Å²	9	38.9 Å²	38.9	4%	0.039	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	122.2	178.4	-45.5	-168.5	-167.3	-151.3	0	109.2	Y1489 L1491 D1493 N1513 L1608	Y1489-K1502 HydrophobicContact CE2-CB 4.23Å; L1491-K1502 HydrophobicContact CD2-CB 4.46Å; L1491-K1502 HydrophobicContact CD2-CD 4.15Å; L1491-K1502 HydrophobicContact CD2-CG 4.21Å; L1491-K1502 PolarHBondContact N-O 2.76Å; L1491-K1502 PolarHBondContact O-N 2.69Å; D1493-K1502 WeakPolarHBondContact OD1-CE 3.42Å; K1502-N1513 VanDerWaalsContact CE-OD1 3.3Å; K1502-N1513 WeakPolarHBondContact CE-OD1 3.47Å; K1502-N1513 PolarHBondContact NZ-OD1 3.08Å; K1502-L1608 WeakPolarHBondContact CD-O 3.49Å; K1502-L1608 WeakPolarHBondContact CE-O 3.27Å; K1502-L1608 PolarHBondContact NZ-O 2.98Å
1503	F	78.7	Confident	70	Confident	10 Å²	10	41.8 Å²	41.8	4%	0.044	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	135.6	-168.6	171.5	-116.4	0	0	0	111.6	Y1489 L1490 L1505 T1511 L1532 L1537 M1549 L1586	Y1489-F1503 WeakPolarHBondContact O-CD2 3.38Å; L1490-F1503 HydrophobicContact CB-CD2 4.21Å; L1490-F1503 HydrophobicContact CD1-CB 4.24Å; L1490-F1503 HydrophobicContact CD1-CD2 4.08Å; F1503-L1505 HydrophobicContact CE1-CD1 4.19Å; F1503-L1505 HydrophobicContact CE1-CG 4.02Å; F1503-L1505 HydrophobicContact CE2-CD2 3.97Å; F1503-L1505 HydrophobicContact CE2-CG 4.14Å; F1503-L1505 HydrophobicContact CZ-CD1 3.84Å; F1503-L1505 HydrophobicContact CZ-CD2 3.63Å; F1503-L1505 HydrophobicContact CZ-CG 3.46Å; F1503-L1505 VanDerWaalsContact CZ-CG 3.46Å; F1503-T1511 PolarHBondContact O-OG1 3.12Å; F1503-L1532 HydrophobicContact CE1-CD1 3.64Å; F1503-L1532 HydrophobicContact CE2-CD1 4.1Å; F1503-L1532 HydrophobicContact CE2-CD2 4.39Å; F1503-L1532 HydrophobicContact CZ-CD1 3.31Å; F1503-L1532 HydrophobicContact CZ-CD2 4Å; F1503-L1532 HydrophobicContact CZ-CG 4.35Å; F1503-L1537 HydrophobicContact CB-CD2 3.86Å; F1503-L1537 HydrophobicContact CD1-CB 4.03Å; F1503-L1537 HydrophobicContact CD1-CD2 4.25Å; F1503-L1537 HydrophobicContact CD2-CD2 4.32Å; F1503-L1537 HydrophobicContact CE1-CB 4.24Å; F1503-L1537 HydrophobicContact CG-CB 4.49Å; F1503-L1537 HydrophobicContact CG-CD2 3.89Å; F1503-M1549 HydrophobicContact CB-CE 4.46Å; F1503-M1549 HydrophobicContact CB-SD 4.3Å; F1503-L1586 HydrophobicContact CE2-CD1 4.44Å; F1503-L1586 HydrophobicContact CE2-CD2 4.34Å
1504	S	75.3	Confident	68.4	Low	3 Å²	3	45.7 Å²	45.7	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.1	172.1	-169.6	0	0	0	0	113.2	H1488 Y1489 N1506	H1488-S1504 WeakPolarHBondContact CA-O 3.42Å; Y1489-S1504 VanDerWaalsContact CE1-CB 3.46Å; Y1489-S1504 PolarHBondContact N-O 3.13Å; Y1489-S1504 PolarHBondContact O-N 2.81Å; S1504-N1506 PolarHBondContact OG-N 2.84Å; S1504-N1506 PolarHBondContact OG-O 2.86Å
1505	L	68.4	Low	67.3	Low	22 Å²	22	49.3 Å²	49.3	12%	0.115	25%	0.246	C	C	.	.	S	Bend	trans	-114.5	-1.7	171.5	-64.9	174.8	0	0	0	112.5	E1487 H1488 F1503 K1535 L1586	E1487-L1505 CarbonylContact O-C 3.51Å; H1488-L1505 PolarHBondContact CE1-O 2.97Å; H1488-L1505 PolarHBondContact NE2-O 3.17Å; H1488-L1505 VanDerWaalsContact NE2-O 3.08Å; F1503-L1505 HydrophobicContact CE1-CD1 4.19Å; F1503-L1505 HydrophobicContact CE1-CG 4.02Å; F1503-L1505 HydrophobicContact CE2-CD2 3.97Å; F1503-L1505 HydrophobicContact CE2-CG 4.14Å; F1503-L1505 HydrophobicContact CZ-CD1 3.84Å; F1503-L1505 HydrophobicContact CZ-CD2 3.63Å; F1503-L1505 HydrophobicContact CZ-CG 3.46Å; F1503-L1505 VanDerWaalsContact CZ-CG 3.46Å; L1505-K1535 HydrophobicContact CD1-CB 4.37Å; L1505-K1535 HydrophobicContact CD1-CG 4.06Å; L1505-L1586 HydrophobicContact CD2-CB 3.75Å; L1505-L1586 HydrophobicContact CD2-CD1 3.98Å; L1505-L1586 HydrophobicContact CD2-CG 4.47Å
1506	N	63.7	Low	66.7	Low	45 Å²	45	47.2 Å²	47.2	24%	0.241	24%	0.237	C	C	.	.	S	Bend	trans	-176.1	137.8	-176.1	-179.6	-91	0	0	0	109.7	E1487 S1504 N1508 Y1509	E1487-N1506 PolarHBondContact O-N 3.35Å; E1487-N1506 VanDerWaalsContact O-N 3.16Å; S1504-N1506 PolarHBondContact OG-N 2.84Å; S1504-N1506 PolarHBondContact OG-O 2.86Å; N1506-N1508 PolarHBondContact O-N 3.4Å; N1506-N1508 WeakPolarHBondContact OD1-CB 2.98Å; N1506-N1508 PolarHBondContact OD1-N 2.99Å; N1506-Y1509 HydrophobicContact CB-CD2 4.25Å; N1506-Y1509 PolarHBondContact O-N 3.09Å
1507	R	53.8	Low	66.1	Low	76 Å²	76	48.2 Å²	48.2	29%	0.287	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.7	-36.6	178.2	-109.6	-177.8	176.5	-130.8	-9.5	115.7	N1481 D1483 E1487 Y1509	N1481-R1507 PolarHBondContact ND2-NE 3.35Å; D1483-R1507 IonicContact OD2-CZ 3.37Å; D1483-R1507 IonicContact OD2-NH1 3.57Å; D1483-R1507 PolarHBondContact OD2-NH1 2.89Å; D1483-R1507 IonicContact OD2-NH2 3.56Å; D1483-R1507 PolarHBondContact OD2-NH2 2.95Å; E1487-R1507 HydrophobicContact CG-CG 4.45Å; R1507-Y1509 PolarHBondContact O-N 3.1Å
1508	N	49	Very low	66	Low	119 Å²	119	50.8 Å²	50.8	64%	0.636	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.3	-176.8	-65.2	1.5	0	0	0	114.3	N1506 T1554	N1506-N1508 PolarHBondContact O-N 3.4Å; N1506-N1508 WeakPolarHBondContact OD1-CB 2.98Å; N1506-N1508 PolarHBondContact OD1-N 2.99Å; N1508-T1554 HydrophobicContact CB-CG2 4.14Å; N1508-T1554 WeakPolarHBondContact O-CG2 3.44Å
1509	Y	45.3	Very low	66	Low	68 Å²	68	51.8 Å²	51.8	27%	0.267	26%	0.262	S	S	.	.			trans	-124.5	58.1	-179.7	-62.1	-88.5	0	0	0	111.5	N1506 R1507 T1511 K1551 V1552 T1554	N1506-Y1509 HydrophobicContact CB-CD2 4.25Å; N1506-Y1509 PolarHBondContact O-N 3.09Å; R1507-Y1509 PolarHBondContact O-N 3.1Å; Y1509-T1511 PolarHBondContact O-N 3.33Å; Y1509-K1551 HydrophobicContact CD1-CG 4.06Å; Y1509-K1551 HydrophobicContact CE1-CD 4.36Å; Y1509-K1551 HydrophobicContact CE1-CG 3.51Å; Y1509-K1551 WeakPolarHBondContact OH-CE 3.1Å; Y1509-V1552 WeakPolarHBondContact CD1-O 3.39Å; Y1509-V1552 WeakPolarHBondContact CE1-O 3.49Å; Y1509-T1554 HydrophobicContact CD1-CG2 4.28Å; Y1509-T1554 HydrophobicContact CE1-CG2 3.92Å; Y1509-T1554 HydrophobicContact CE2-CG2 4.5Å
1510	T	43.8	Very low	66	Low	78 Å²	78	51.8 Å²	51.8	48%	0.479	26%	0.262	S	S	.	.			trans	-67.7	107.8	162.2	42.9	0	0	0	0	109.4
1511	T	47.7	Very low	66.1	Low	26 Å²	26	53 Å²	53	16%	0.16	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-68.9	141.5	168.3	50.8	0	0	0	0	109.6	F1503 Y1509 M1549	F1503-T1511 PolarHBondContact O-OG1 3.12Å; Y1509-T1511 PolarHBondContact O-N 3.33Å; T1511-M1549 HydrophobicContact CG2-CE 4.1Å; T1511-M1549 WeakPolarHBondContact OG1-CE 3.29Å
1512	H	47.8	Very low	66.1	Low	140 Å²	140	56.9 Å²	56.9	65%	0.648	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-62.7	157	167.6	-68	26.9	0	0	0	109.8	M1514	H1512-M1514 PolarHBondContact O-N 2.81Å; H1512-M1514 VanDerWaalsContact O-N 3.13Å
1513	N	50.9	Low	66.2	Low	62 Å²	62	57 Å²	57	33%	0.332	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-51.6	122.4	166	-61.7	-7.3	0	0	0	107.9	K1502	K1502-N1513 VanDerWaalsContact CE-OD1 3.3Å; K1502-N1513 WeakPolarHBondContact CE-OD1 3.47Å; K1502-N1513 PolarHBondContact NZ-OD1 3.08Å
1514	M	55.5	Low	66.6	Low	83 Å²	83	61.3 Å²	61.3	41%	0.409	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.9	166	-73.8	-178.9	164.4	0	0	106.7	V1501 H1512 I1547 M1549	V1501-M1514 PolarHBondContact N-O 2.93Å; H1512-M1514 PolarHBondContact O-N 2.81Å; H1512-M1514 VanDerWaalsContact O-N 3.13Å; M1514-I1547 HydrophobicContact CB-CD1 3.99Å; M1514-I1547 HydrophobicContact CB-CG2 3.73Å; M1514-I1547 HydrophobicContact CG-CG2 4.32Å; M1514-I1547 VanDerWaalsContact O-CD1 3.3Å; M1514-I1547 WeakPolarHBondContact O-CD1 3.27Å; M1514-I1547 HydrophobicContact SD-CG2 3.68Å; M1514-M1549 HydrophobicContact SD-CG 4.11Å
1515	N	63.3	Low	67.3	Low	75 Å²	75	63.6 Å²	63.6	40%	0.401	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	137.4	-178.7	-59.3	20.1	0	0	0	108.5	H1500	H1500-N1515 VanDerWaalsContact CD2-CG 3.42Å; H1500-N1515 PolarHBondContact CD2-OD1 3.07Å; H1500-N1515 PolarHBondContact NE2-ND2 3.19Å; H1500-N1515 PolarHBondContact NE2-OD1 3.2Å
1516	C	72.6	Confident	68.4	Low	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.6	167.8	-178.8	0	0	0	0	108.8	Q1498 I1499 I1518 L1539 I1541 C1546 I1547	Q1498-C1516 WeakPolarHBondContact CB-O 3.42Å; I1499-C1516 HydrophobicContact CB-CB 4.33Å; I1499-C1516 WeakPolarHBondContact O-CB 3.47Å; I1499-C1516 PolarHBondContact O-N 3.27Å; C1516-I1518 PolarHBondContact O-N 3.43Å; C1516-L1539 HydrophobicContact CB-CD2 4.09Å; C1516-I1541 HydrophobicContact CB-CD1 4.27Å; C1516-I1541 WeakPolarHBondContact SG-CD1 3.3Å; C1516-C1546 WeakPolarHBondContact CA-SG 3.38Å; C1516-C1546 HydrophobicContact CB-CB 4.05Å; C1516-C1546 WeakPolarHBondContact CB-SG 3.49Å; C1516-C1546 WeakPolarHBondContact SG-CB 3.36Å; C1516-C1546 CovalentContact SG-SG 2.03Å; C1516-C1546 PolarHBondContact SG-SG 2.93Å; C1516-I1547 HydrophobicContact CB-CD1 4.02Å; C1516-I1547 HydrophobicContact CB-CG1 4.31Å
1517	N	70.3	Confident	69.6	Low	132 Å²	132	64.5 Å²	64.5	71%	0.706	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	19.2	-177.8	-64.8	8.8	0	0	0	114.1
1518	I	78.4	Confident	71.4	Confident	53 Å²	53	60.9 Å²	60.9	27%	0.272	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.4	170.6	-59.9	172.1	0	0	0	106.7	C1516 I1520 I1541 C1546	C1516-I1518 PolarHBondContact O-N 3.43Å; I1518-I1520 HydrophobicContact CG2-CG2 4.32Å; I1518-I1541 HydrophobicContact CB-CD1 4.15Å; I1518-I1541 HydrophobicContact CD1-CB 4.16Å; I1518-I1541 HydrophobicContact CD1-CD1 4.39Å; I1518-I1541 HydrophobicContact CG2-CD1 4.42Å; I1518-I1541 HydrophobicContact CG2-CG2 4.16Å; I1518-C1546 HydrophobicContact CD1-CB 4.49Å
1519	N	83.4	Confident	73.2	Confident	79 Å²	79	58.1 Å²	58.1	42%	0.422	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	133	172.7	-179.2	13.3	0	0	0	109.9	G1497 N1521	G1497-N1519 VanDerWaalsContact CA-OD1 3.25Å; G1497-N1519 WeakPolarHBondContact CA-OD1 3.19Å; G1497-N1519 WeakPolarHBondContact O-CA 3.23Å; G1497-N1519 PolarHBondContact O-OD1 3.04Å; G1497-N1519 VanDerWaalsContact O-OD1 3.09Å; N1519-N1521 PolarHBondContact ND2-OD1 2.86Å; N1519-N1521 PolarHBondContact OD1-N 2.97Å; N1519-N1521 PolarHBondContact OD1-ND2 3.45Å; N1519-N1521 PolarHBondContact OD1-OD1 2.89Å
1520	I	86.3	Confident	75.2	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.			trans	-119.3	15.4	178.4	66.6	144.7	0	0	0	114.1	I1461 T1463 L1470 L1494 G1497 I1499 I1518 H1526 I1528 I1541	I1461-I1520 HydrophobicContact CG2-CD1 3.88Å; T1463-I1520 HydrophobicContact CG2-CD1 4.33Å; L1470-I1520 HydrophobicContact CD2-CD1 4.46Å; L1494-I1520 HydrophobicContact CD1-CD1 3.96Å; L1494-I1520 HydrophobicContact CD1-CG1 3.61Å; G1497-I1520 PolarHBondContact O-N 3.08Å; I1499-I1520 HydrophobicContact CD1-CD1 3.82Å; I1499-I1520 HydrophobicContact CD1-CG1 4.24Å; I1499-I1520 HydrophobicContact CD1-CG2 4.4Å; I1499-I1520 HydrophobicContact CG1-CD1 4.04Å; I1499-I1520 HydrophobicContact CG1-CG1 4.08Å; I1518-I1520 HydrophobicContact CG2-CG2 4.32Å; I1520-H1526 HydrophobicContact CB-CB 4.22Å; I1520-H1526 HydrophobicContact CG2-CB 3.93Å; I1520-I1528 HydrophobicContact CD1-CD1 4.12Å; I1520-I1541 HydrophobicContact CG2-CG2 4.17Å
1521	N	88.2	Confident	76.9	Confident	34 Å²	34	52.7 Å²	52.7	18%	0.182	27%	0.268	C	S	.	.			trans	-93.9	18.1	-175.4	77.2	9.6	0	0	0	115.5	T1463 K1464 S1465 G1497 N1519 G1523	T1463-N1521 CarbonylContact O-C 3.6Å; T1463-N1521 WeakPolarHBondContact O-CA 3.37Å; K1464-N1521 WeakPolarHBondContact CA-O 3.44Å; S1465-N1521 WeakPolarHBondContact O-CB 3.48Å; G1497-N1521 WeakPolarHBondContact CA-ND2 3.46Å; N1519-N1521 PolarHBondContact ND2-OD1 2.86Å; N1519-N1521 PolarHBondContact OD1-N 2.97Å; N1519-N1521 PolarHBondContact OD1-ND2 3.45Å; N1519-N1521 PolarHBondContact OD1-OD1 2.89Å; N1521-G1523 VanDerWaalsContact C-N 3.33Å; N1521-G1523 PolarHBondContact O-N 2.8Å
1522	D	85.1	Confident	78.1	Confident	81 Å²	81	51.8 Å²	51.8	43%	0.433	26%	0.262	S	S	.	.	S	Bend	trans	-77.7	-15.7	-177	73.4	-11.6	0	0	0	113.9	N1524 H1526	D1522-N1524 WeakPolarHBondContact OD1-CB 3.42Å; D1522-N1524 PolarHBondContact OD1-N 2.79Å; D1522-N1524 PolarHBondContact OD2-ND2 2.85Å; D1522-H1526 IonicContact OD1-CD2 3.34Å; D1522-H1526 IonicContact OD1-NE2 3Å; D1522-H1526 PolarHBondContact OD1-NE2 2.67Å; D1522-H1526 IonicContact OD2-NE2 2.66Å
1523	G	82	Confident	78.8	Confident	10 Å²	10	46.5 Å²	46.5	10%	0.103	24%	0.238	C	C	.	.	S	Bend	trans	91.7	4.2	-175.9	0	0	0	0	0	115.4	T1463 N1521	T1463-G1523 WeakPolarHBondContact O-CA 3.33Å; T1463-G1523 PolarHBondContact O-N 2.86Å; N1521-G1523 VanDerWaalsContact C-N 3.33Å; N1521-G1523 PolarHBondContact O-N 2.8Å
1524	N	87.9	Confident	79.5	Confident	101 Å²	101	46.4 Å²	46.4	54%	0.54	25%	0.245	S	C	.	.	S	Bend	trans	-90.5	167.8	171.4	-65.4	-52.6	0	0	0	111.2	A1462 D1522 H1526	A1462-N1524 WeakPolarHBondContact CA-O 3.44Å; A1462-N1524 VanDerWaalsContact CB-O 3.25Å; A1462-N1524 WeakPolarHBondContact CB-O 3.25Å; D1522-N1524 WeakPolarHBondContact OD1-CB 3.42Å; D1522-N1524 PolarHBondContact OD1-N 2.79Å; D1522-N1524 PolarHBondContact OD2-ND2 2.85Å; N1524-H1526 PolarHBondContact O-N 2.92Å
1525	F	89	Confident	79.9	Confident	51 Å²	51	47.1 Å²	47.1	22%	0.224	25%	0.246	C	C	.	.			trans	-84	112.8	178.2	-76.3	-75.3	0	0	0	112.2	E1460 I1461 A1462 C1620 R1622 C1672 L1674	E1460-F1525 HydrophobicContact CB-CD1 4.16Å; I1461-F1525 WeakPolarHBondContact O-CA 3.39Å; A1462-F1525 HydrophobicContact CB-CD1 3.67Å; A1462-F1525 HydrophobicContact CB-CD2 4.25Å; A1462-F1525 HydrophobicContact CB-CE1 3.65Å; A1462-F1525 HydrophobicContact CB-CE2 4.25Å; A1462-F1525 HydrophobicContact CB-CG 3.97Å; A1462-F1525 HydrophobicContact CB-CZ 3.93Å; F1525-C1620 HydrophobicContact CE1-CB 4.29Å; F1525-C1620 HydrophobicContact CZ-CB 4.25Å; F1525-R1622 HydrophobicContact CD1-CG 4.21Å; F1525-R1622 HydrophobicContact CE1-CG 3.94Å; F1525-R1622 VanDerWaalsContact CE2-NH1 3.3Å; F1525-C1672 HydrophobicContact CZ-CB 4.26Å; F1525-C1672 VanDerWaalsContact CZ-SG 3.58Å; F1525-L1674 HydrophobicContact CD2-CD1 4.27Å; F1525-L1674 HydrophobicContact CE2-CD1 3.59Å; F1525-L1674 HydrophobicContact CE2-CG 4.42Å; F1525-L1674 HydrophobicContact CZ-CD1 4.19Å
1526	H	91.5	Very high	80	Confident	23 Å²	23	46.9 Å²	46.9	11%	0.106	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.1	168.3	-67.2	-82.2	0	0	0	111.1	E1460 I1461 I1520 D1522 N1524 I1541 D1542	E1460-H1526 WeakPolarHBondContact CA-O 3.47Å; I1461-H1526 PolarHBondContact N-O 2.88Å; I1461-H1526 PolarHBondContact O-N 2.87Å; I1520-H1526 HydrophobicContact CB-CB 4.22Å; I1520-H1526 HydrophobicContact CG2-CB 3.93Å; D1522-H1526 IonicContact OD1-CD2 3.34Å; D1522-H1526 IonicContact OD1-NE2 3Å; D1522-H1526 PolarHBondContact OD1-NE2 2.67Å; D1522-H1526 IonicContact OD2-NE2 2.66Å; N1524-H1526 PolarHBondContact O-N 2.92Å; H1526-I1541 HydrophobicContact CB-CG2 4.44Å; H1526-D1542 WeakPolarHBondContact CA-OD1 3.36Å; H1526-D1542 IonicContact CE1-OD2 2.74Å; H1526-D1542 IonicContact CG-OD2 3.07Å; H1526-D1542 IonicContact ND1-OD1 3.16Å; H1526-D1542 IonicContact ND1-OD2 2.71Å; H1526-D1542 PolarHBondContact ND1-OD2 2.65Å
1527	Q	90.6	Very high	80.1	Confident	64 Å²	64	47 Å²	47	30%	0.299	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	103.3	177.8	-175.8	177	55.2	0	0	110.6	E1460 I1541 D1542 N1543	E1460-Q1527 HydrophobicContact CG-CB 4.2Å; E1460-Q1527 HydrophobicContact CG-CG 4.36Å; Q1527-I1541 CarbonylContact O-C 3.52Å; Q1527-I1541 WeakPolarHBondContact O-CA 3.33Å; Q1527-D1542 PolarHBondContact N-OD1 2.9Å; Q1527-D1542 PolarHBondContact O-N 3.27Å; Q1527-N1543 PolarHBondContact OE1-ND2 3.24Å; Q1527-N1543 PolarHBondContact OE1-OD1 2.99Å
1528	I	90.3	Very high	80.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.6	176	-61.1	168.4	0	0	0	109.1	S1458 F1459 I1461 L1470 I1499 I1520 L1539	S1458-I1528 CarbonylContact C-O 3.59Å; S1458-I1528 VanDerWaalsContact CA-O 3.23Å; S1458-I1528 WeakPolarHBondContact CA-O 3.39Å; F1459-I1528 HydrophobicContact CD1-CB 4.26Å; F1459-I1528 HydrophobicContact CD1-CG2 4.36Å; F1459-I1528 HydrophobicContact CD2-CD1 4.45Å; F1459-I1528 HydrophobicContact CE1-CB 3.91Å; F1459-I1528 HydrophobicContact CE1-CG2 3.64Å; F1459-I1528 HydrophobicContact CE2-CB 4.21Å; F1459-I1528 HydrophobicContact CE2-CD1 3.62Å; F1459-I1528 HydrophobicContact CE2-CG1 4.46Å; F1459-I1528 HydrophobicContact CZ-CB 3.89Å; F1459-I1528 HydrophobicContact CZ-CD1 3.68Å; F1459-I1528 HydrophobicContact CZ-CG1 4.4Å; F1459-I1528 HydrophobicContact CZ-CG2 3.77Å; F1459-I1528 PolarHBondContact N-O 2.03Å; F1459-I1528 PolarHBondContact O-N 2.74Å; I1461-I1528 HydrophobicContact CG2-CD1 3.51Å; I1461-I1528 HydrophobicContact CG2-CG1 4.35Å; L1470-I1528 HydrophobicContact CD1-CD1 4.45Å; I1499-I1528 HydrophobicContact CD1-CD1 3.48Å; I1499-I1528 VanDerWaalsContact CD1-CD1 3.48Å; I1499-I1528 HydrophobicContact CD1-CG1 3.75Å; I1520-I1528 HydrophobicContact CD1-CD1 4.12Å; I1528-L1539 HydrophobicContact CG2-CD1 4.06Å
1529	K	87.9	Confident	80.9	Confident	60 Å²	60	40 Å²	40	26%	0.261	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	111.1	178	177.8	170	-173.7	176.7	0	112.1	I1457 Y1540	I1457-K1529 CarbonylContact O-C 3.26Å; I1457-K1529 WeakPolarHBondContact O-CA 3.3Å; K1529-Y1540 PolarHBondContact N-O 2.94Å; K1529-Y1540 PolarHBondContact O-N 2.87Å
1530	L	87.3	Confident	81	Confident	4 Å²	4	38.5 Å²	38.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131	171	-62.4	164	0	0	0	109.1	T1456 I1457 L1471 L1490 V1492 L1537 F1538 L1539	T1456-L1530 WeakPolarHBondContact CA-O 3.39Å; I1457-L1530 HydrophobicContact CB-CB 4.36Å; I1457-L1530 HydrophobicContact CB-CD1 4.47Å; I1457-L1530 HydrophobicContact CD1-CD1 4.37Å; I1457-L1530 PolarHBondContact N-O 3.27Å; I1457-L1530 PolarHBondContact O-N 2.97Å; L1471-L1530 HydrophobicContact CD2-CD1 3.42Å; L1471-L1530 VanDerWaalsContact CD2-CD1 3.42Å; L1490-L1530 HydrophobicContact CD2-CD1 4.45Å; V1492-L1530 HydrophobicContact CG2-CD1 3.95Å; V1492-L1530 HydrophobicContact CG2-CD2 4.33Å; L1530-L1537 HydrophobicContact CB-CD1 4.35Å; L1530-L1537 HydrophobicContact CD2-CD1 4.41Å; L1530-F1538 WeakPolarHBondContact CA-O 3.35Å; L1530-L1539 HydrophobicContact CD2-CB 4.44Å; L1530-L1539 HydrophobicContact CD2-CD1 3.75Å; L1530-L1539 HydrophobicContact CG-CD1 4.47Å
1531	Y	77.8	Confident	81	Confident	28 Å²	28	38.6 Å²	38.6	11%	0.11	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	116	172	175.6	-126.1	0	0	0	109.2	G1455 T1456 E1533 F1538	G1455-Y1531 WeakPolarHBondContact O-CA 3.45Å; G1455-Y1531 WeakPolarHBondContact O-CD2 3.39Å; T1456-Y1531 HydrophobicContact CG2-CD2 3.55Å; T1456-Y1531 HydrophobicContact CG2-CE2 4.28Å; T1456-Y1531 HydrophobicContact CG2-CG 4.36Å; Y1531-E1533 HydrophobicContact CD1-CB 4.45Å; Y1531-E1533 HydrophobicContact CE1-CB 3.84Å; Y1531-E1533 HydrophobicContact CE1-CG 4.28Å; Y1531-E1533 PolarHBondContact OH-OE1 3.05Å; Y1531-F1538 AromaticContact CD1-CD2 3.86Å; Y1531-F1538 HydrophobicContact CD1-CD2 3.86Å; Y1531-F1538 HydrophobicContact CD1-CE2 4.41Å; Y1531-F1538 HydrophobicContact CD1-CG 4.39Å; Y1531-F1538 PolarHBondContact N-O 3.28Å; Y1531-F1538 PolarHBondContact O-N 3.16Å
1532	L	73.1	Confident	80.7	Confident	8 Å²	8	39.8 Å²	39.8	4%	0.042	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.4	170.9	-168.5	69.2	0	0	0	108.7	L1451 S1454 G1455 F1503 I1536 L1537 L1586	L1451-L1532 WeakPolarHBondContact O-CD2 3.44Å; S1454-L1532 CarbonylContact C-O 3.57Å; S1454-L1532 WeakPolarHBondContact CA-O 3.44Å; G1455-L1532 PolarHBondContact N-O 2.96Å; G1455-L1532 PolarHBondContact O-N 3.06Å; F1503-L1532 HydrophobicContact CE1-CD1 3.64Å; F1503-L1532 HydrophobicContact CE2-CD1 4.1Å; F1503-L1532 HydrophobicContact CE2-CD2 4.39Å; F1503-L1532 HydrophobicContact CZ-CD1 3.31Å; F1503-L1532 HydrophobicContact CZ-CD2 4Å; F1503-L1532 HydrophobicContact CZ-CG 4.35Å; L1532-I1536 WeakPolarHBondContact CD1-O 3.01Å; L1532-L1537 HydrophobicContact CB-CD1 4.19Å; L1532-L1537 HydrophobicContact CD1-CB 3.9Å; L1532-L1537 HydrophobicContact CD1-CD1 4.07Å; L1532-L1586 HydrophobicContact CD2-CB 4.31Å
1533	E	63.5	Low	80.3	Confident	29 Å²	29	40.9 Å²	40.9	14%	0.136	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	114.1	174.1	-164.5	176.4	-161.2	0	0	110.5	N825 Y1531 K1535 I1536 F1538	N825-E1533 WeakPolarHBondContact CB-OE1 3.5Å; N825-E1533 WeakPolarHBondContact ND2-CG 3.46Å; N825-E1533 PolarHBondContact ND2-OE1 2.86Å; Y1531-E1533 HydrophobicContact CD1-CB 4.45Å; Y1531-E1533 HydrophobicContact CE1-CB 3.84Å; Y1531-E1533 HydrophobicContact CE1-CG 4.28Å; Y1531-E1533 PolarHBondContact OH-OE1 3.05Å; E1533-K1535 VanDerWaalsContact C-N 3.26Å; E1533-K1535 PolarHBondContact O-N 3.12Å; E1533-I1536 PolarHBondContact N-O 3.01Å; E1533-I1536 PolarHBondContact O-N 2.85Å; E1533-F1538 HydrophobicContact CB-CE2 4.14Å
1534	A	64.5	Low	80	Confident	59 Å²	59	45.5 Å²	45.5	49%	0.488	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	-68.7	-174.4	0	0	0	0	0	115.8	P1453	P1453-A1534 WeakPolarHBondContact O-CA 3.36Å; P1453-A1534 PolarHBondContact O-N 2.57Å
1535	K	64	Low	79.4	Confident	98 Å²	98	44.1 Å²	44.1	43%	0.426	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-148.7	12.4	177.3	-68.8	-160.3	173.2	-158.2	0	113.2	L1505 E1533	L1505-K1535 HydrophobicContact CD1-CB 4.37Å; L1505-K1535 HydrophobicContact CD1-CG 4.06Å; E1533-K1535 VanDerWaalsContact C-N 3.26Å; E1533-K1535 PolarHBondContact O-N 3.12Å
1536	I	66.1	Low	78.6	Confident	70 Å²	70	43.8 Å²	43.8	36%	0.359	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.5	-179.7	-54.3	179.6	0	0	0	107.8	L1532 E1533 F1538 M1549	L1532-I1536 WeakPolarHBondContact CD1-O 3.01Å; E1533-I1536 PolarHBondContact N-O 3.01Å; E1533-I1536 PolarHBondContact O-N 2.85Å; I1536-F1538 HydrophobicContact CB-CE2 3.9Å; I1536-F1538 HydrophobicContact CB-CZ 4.3Å; I1536-F1538 HydrophobicContact CG2-CD2 4.08Å; I1536-F1538 HydrophobicContact CG2-CE1 4.31Å; I1536-F1538 HydrophobicContact CG2-CE2 3.59Å; I1536-F1538 HydrophobicContact CG2-CZ 3.71Å; I1536-M1549 VanDerWaalsContact CA-O 3.3Å; I1536-M1549 WeakPolarHBondContact CA-O 3.48Å
1537	L	74.6	Confident	77.3	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.8	173.2	-177.9	66.3	0	0	0	109	L1490 V1501 F1503 L1530 L1532 T1548 M1549	L1490-L1537 HydrophobicContact CD1-CD2 3.61Å; V1501-L1537 HydrophobicContact CG1-CD2 3.69Å; F1503-L1537 HydrophobicContact CB-CD2 3.86Å; F1503-L1537 HydrophobicContact CD1-CB 4.03Å; F1503-L1537 HydrophobicContact CD1-CD2 4.25Å; F1503-L1537 HydrophobicContact CD2-CD2 4.32Å; F1503-L1537 HydrophobicContact CE1-CB 4.24Å; F1503-L1537 HydrophobicContact CG-CB 4.49Å; F1503-L1537 HydrophobicContact CG-CD2 3.89Å; L1530-L1537 HydrophobicContact CB-CD1 4.35Å; L1530-L1537 HydrophobicContact CD2-CD1 4.41Å; L1532-L1537 HydrophobicContact CB-CD1 4.19Å; L1532-L1537 HydrophobicContact CD1-CB 3.9Å; L1532-L1537 HydrophobicContact CD1-CD1 4.07Å; L1537-T1548 CarbonylContact O-C 3.56Å; L1537-T1548 WeakPolarHBondContact O-CA 3.2Å; L1537-M1549 HydrophobicContact CB-CB 4.3Å; L1537-M1549 HydrophobicContact CD2-SD 4.09Å; L1537-M1549 PolarHBondContact N-O 3.37Å; L1537-M1549 PolarHBondContact O-N 3.2Å
1538	F	80.1	Confident	75.4	Confident	35 Å²	35	43.6 Å²	43.6	15%	0.154	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.2	175.7	-58.4	-102.4	0	0	0	108.9	L1530 Y1531 E1533 I1536 Y1540 L1545 I1547 T1548	L1530-F1538 WeakPolarHBondContact CA-O 3.35Å; Y1531-F1538 AromaticContact CD1-CD2 3.86Å; Y1531-F1538 HydrophobicContact CD1-CD2 3.86Å; Y1531-F1538 HydrophobicContact CD1-CE2 4.41Å; Y1531-F1538 HydrophobicContact CD1-CG 4.39Å; Y1531-F1538 PolarHBondContact N-O 3.28Å; Y1531-F1538 PolarHBondContact O-N 3.16Å; E1533-F1538 HydrophobicContact CB-CE2 4.14Å; I1536-F1538 HydrophobicContact CB-CE2 3.9Å; I1536-F1538 HydrophobicContact CB-CZ 4.3Å; I1536-F1538 HydrophobicContact CG2-CD2 4.08Å; I1536-F1538 HydrophobicContact CG2-CE1 4.31Å; I1536-F1538 HydrophobicContact CG2-CE2 3.59Å; I1536-F1538 HydrophobicContact CG2-CZ 3.71Å; F1538-Y1540 HydrophobicContact CB-CD2 4.36Å; F1538-Y1540 HydrophobicContact CB-CE2 3.74Å; F1538-L1545 HydrophobicContact CB-CD1 4.16Å; F1538-L1545 HydrophobicContact CD1-CD1 4.08Å; F1538-I1547 WeakPolarHBondContact CA-O 3.26Å; F1538-T1548 HydrophobicContact CD1-CG2 3.6Å; F1538-T1548 HydrophobicContact CE1-CG2 3.87Å
1539	L	85.9	Confident	73.7	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.4	169.8	173.9	69.6	0	0	0	109.3	I1499 V1501 C1516 I1528 L1530 I1541 C1546 I1547	I1499-L1539 HydrophobicContact CG2-CD2 3.9Å; V1501-L1539 HydrophobicContact CG2-CD2 3.91Å; C1516-L1539 HydrophobicContact CB-CD2 4.09Å; I1528-L1539 HydrophobicContact CG2-CD1 4.06Å; L1530-L1539 HydrophobicContact CD2-CB 4.44Å; L1530-L1539 HydrophobicContact CD2-CD1 3.75Å; L1530-L1539 HydrophobicContact CG-CD1 4.47Å; L1539-I1541 HydrophobicContact CD2-CD1 4.49Å; L1539-I1541 HydrophobicContact CG-CG1 4.42Å; L1539-C1546 HydrophobicContact CD2-CB 4.45Å; L1539-C1546 PolarHBondContact O-N 3.47Å; L1539-I1547 HydrophobicContact CB-CB 4.13Å; L1539-I1547 HydrophobicContact CD2-CD1 3.84Å; L1539-I1547 HydrophobicContact CD2-CG1 4.14Å; L1539-I1547 PolarHBondContact N-O 2.66Å; L1539-I1547 PolarHBondContact O-N 2.89Å
1540	Y	84.6	Confident	72	Confident	47 Å²	47	42.8 Å²	42.8	18%	0.184	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	142.6	166.6	-60.2	-105	0	0	0	110.1	K1529 F1538 N1544 L1545	K1529-Y1540 PolarHBondContact N-O 2.94Å; K1529-Y1540 PolarHBondContact O-N 2.87Å; F1538-Y1540 HydrophobicContact CB-CD2 4.36Å; F1538-Y1540 HydrophobicContact CB-CE2 3.74Å; Y1540-N1544 CarbonylContact C-O 3.2Å; Y1540-N1544 WeakPolarHBondContact CA-O 3.07Å; Y1540-L1545 HydrophobicContact CD1-CB 3.9Å; Y1540-L1545 HydrophobicContact CD1-CD1 4.32Å; Y1540-L1545 HydrophobicContact CD2-CD1 4.3Å; Y1540-L1545 HydrophobicContact CE1-CB 3.69Å; Y1540-L1545 HydrophobicContact CE1-CD1 3.98Å; Y1540-L1545 HydrophobicContact CE1-CG 4.37Å; Y1540-L1545 HydrophobicContact CE2-CD1 3.95Å; Y1540-L1545 HydrophobicContact CG-CD1 4.46Å
1541	I	87.4	Confident	69.7	Low	1 Å²	1	48.9 Å²	48.9	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.8	168.5	-56.4	177.1	0	0	0	107.2	I1499 C1516 I1518 I1520 H1526 Q1527 L1539 N1543 N1544	I1499-I1541 HydrophobicContact CB-CD1 4.27Å; I1499-I1541 HydrophobicContact CD1-CD1 3.67Å; I1499-I1541 HydrophobicContact CD1-CG1 4.25Å; I1499-I1541 HydrophobicContact CG1-CD1 4.15Å; C1516-I1541 HydrophobicContact CB-CD1 4.27Å; C1516-I1541 WeakPolarHBondContact SG-CD1 3.3Å; I1518-I1541 HydrophobicContact CB-CD1 4.15Å; I1518-I1541 HydrophobicContact CD1-CB 4.16Å; I1518-I1541 HydrophobicContact CD1-CD1 4.39Å; I1518-I1541 HydrophobicContact CG2-CD1 4.42Å; I1518-I1541 HydrophobicContact CG2-CG2 4.16Å; I1520-I1541 HydrophobicContact CG2-CG2 4.17Å; H1526-I1541 HydrophobicContact CB-CG2 4.44Å; Q1527-I1541 CarbonylContact O-C 3.52Å; Q1527-I1541 WeakPolarHBondContact O-CA 3.33Å; L1539-I1541 HydrophobicContact CD2-CD1 4.49Å; L1539-I1541 HydrophobicContact CG-CG1 4.42Å; I1541-N1543 PolarHBondContact O-N 3.12Å; I1541-N1543 VanDerWaalsContact O-N 3.1Å; I1541-N1544 PolarHBondContact N-O 3.03Å; I1541-N1544 WeakPolarHBondContact O-CB 3.35Å; I1541-N1544 PolarHBondContact O-N 3.15Å
1542	D	82.4	Confident	67.5	Low	60 Å²	60	51 Å²	51	32%	0.321	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	35.4	-178.4	-55.7	-38.4	0	0	0	113.1	H1526 Q1527 N1544	H1526-D1542 WeakPolarHBondContact CA-OD1 3.36Å; H1526-D1542 IonicContact CE1-OD2 2.74Å; H1526-D1542 IonicContact CG-OD2 3.07Å; H1526-D1542 IonicContact ND1-OD1 3.16Å; H1526-D1542 IonicContact ND1-OD2 2.71Å; H1526-D1542 PolarHBondContact ND1-OD2 2.65Å; Q1527-D1542 PolarHBondContact N-OD1 2.9Å; Q1527-D1542 PolarHBondContact O-N 3.27Å; D1542-N1544 PolarHBondContact O-N 3.4Å
1543	N	76.4	Confident	65.4	Low	104 Å²	104	57 Å²	57	56%	0.556	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	-1.3	-174.2	-55.9	-83.6	0	0	0	116.3	Q1527 I1541	Q1527-N1543 PolarHBondContact OE1-ND2 3.24Å; Q1527-N1543 PolarHBondContact OE1-OD1 2.99Å; I1541-N1543 PolarHBondContact O-N 3.12Å; I1541-N1543 VanDerWaalsContact O-N 3.1Å
1544	N	74.1	Confident	63.7	Low	106 Å²	106	59.1 Å²	59.1	57%	0.567	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.7	169.6	-62.5	-50.6	0	0	0	110.7	Y1540 I1541 D1542 C1546	Y1540-N1544 CarbonylContact C-O 3.2Å; Y1540-N1544 WeakPolarHBondContact CA-O 3.07Å; I1541-N1544 PolarHBondContact N-O 3.03Å; I1541-N1544 WeakPolarHBondContact O-CB 3.35Å; I1541-N1544 PolarHBondContact O-N 3.15Å; D1542-N1544 PolarHBondContact O-N 3.4Å; N1544-C1546 PolarHBondContact O-N 3.05Å
1545	L	76.7	Confident	61.9	Low	72 Å²	72	64.1 Å²	64.1	38%	0.377	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	118.7	174.5	176.6	65.4	0	0	0	109.7	F1538 Y1540 T1548	F1538-L1545 HydrophobicContact CB-CD1 4.16Å; F1538-L1545 HydrophobicContact CD1-CD1 4.08Å; Y1540-L1545 HydrophobicContact CD1-CB 3.9Å; Y1540-L1545 HydrophobicContact CD1-CD1 4.32Å; Y1540-L1545 HydrophobicContact CD2-CD1 4.3Å; Y1540-L1545 HydrophobicContact CE1-CB 3.69Å; Y1540-L1545 HydrophobicContact CE1-CD1 3.98Å; Y1540-L1545 HydrophobicContact CE1-CG 4.37Å; Y1540-L1545 HydrophobicContact CE2-CD1 3.95Å; Y1540-L1545 HydrophobicContact CG-CD1 4.46Å; L1545-T1548 HydrophobicContact CD1-CG2 4.02Å; L1545-T1548 HydrophobicContact CD2-CG2 3.95Å; L1545-T1548 HydrophobicContact CG-CG2 4.33Å
1546	C	71.4	Confident	60	Low	45 Å²	45	66.2 Å²	66.2	30%	0.304	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-41.8	-179.1	-159.1	0	0	0	0	113.8	C1516 I1518 L1539 N1544	C1516-C1546 WeakPolarHBondContact CA-SG 3.38Å; C1516-C1546 HydrophobicContact CB-CB 4.05Å; C1516-C1546 WeakPolarHBondContact CB-SG 3.49Å; C1516-C1546 WeakPolarHBondContact SG-CB 3.36Å; C1516-C1546 CovalentContact SG-SG 2.03Å; C1516-C1546 PolarHBondContact SG-SG 2.93Å; I1518-C1546 HydrophobicContact CD1-CB 4.49Å; L1539-C1546 HydrophobicContact CD2-CB 4.45Å; L1539-C1546 PolarHBondContact O-N 3.47Å; N1544-C1546 PolarHBondContact O-N 3.05Å
1547	I	65.4	Low	58	Low	12 Å²	12	69.1 Å²	69.1	6%	0.062	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	138.6	-175.5	-51.7	175.4	0	0	0	111	M1514 C1516 F1538 L1539 M1549	M1514-I1547 HydrophobicContact CB-CD1 3.99Å; M1514-I1547 HydrophobicContact CB-CG2 3.73Å; M1514-I1547 HydrophobicContact CG-CG2 4.32Å; M1514-I1547 VanDerWaalsContact O-CD1 3.3Å; M1514-I1547 WeakPolarHBondContact O-CD1 3.27Å; M1514-I1547 HydrophobicContact SD-CG2 3.68Å; C1516-I1547 HydrophobicContact CB-CD1 4.02Å; C1516-I1547 HydrophobicContact CB-CG1 4.31Å; F1538-I1547 WeakPolarHBondContact CA-O 3.26Å; L1539-I1547 HydrophobicContact CB-CB 4.13Å; L1539-I1547 HydrophobicContact CD2-CD1 3.84Å; L1539-I1547 HydrophobicContact CD2-CG1 4.14Å; L1539-I1547 PolarHBondContact N-O 2.66Å; L1539-I1547 PolarHBondContact O-N 2.89Å; I1547-M1549 HydrophobicContact CG2-CG 3.62Å
1548	T	50.3	Low	55.6	Low	70 Å²	70	78.2 Å²	78.2	43%	0.429	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	102.6	166.3	63.8	0	0	0	0	111	L1537 F1538 L1545	L1537-T1548 CarbonylContact O-C 3.56Å; L1537-T1548 WeakPolarHBondContact O-CA 3.2Å; F1538-T1548 HydrophobicContact CD1-CG2 3.6Å; F1538-T1548 HydrophobicContact CE1-CG2 3.87Å; L1545-T1548 HydrophobicContact CD1-CG2 4.02Å; L1545-T1548 HydrophobicContact CD2-CG2 3.95Å; L1545-T1548 HydrophobicContact CG-CG2 4.33Å
1549	M	55	Low	52.9	Low	5 Å²	5	81.1 Å²	81.1	3%	0.025	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	105.9	-179.5	-50.1	179.3	81.9	0	0	110.1	V1501 F1503 T1511 M1514 I1536 L1537 I1547	V1501-M1549 HydrophobicContact CB-SD 3.77Å; V1501-M1549 HydrophobicContact CG1-SD 3.54Å; V1501-M1549 VanDerWaalsContact CG1-SD 3.54Å; V1501-M1549 WeakPolarHBondContact O-CE 3.34Å; F1503-M1549 HydrophobicContact CB-CE 4.46Å; F1503-M1549 HydrophobicContact CB-SD 4.3Å; T1511-M1549 HydrophobicContact CG2-CE 4.1Å; T1511-M1549 WeakPolarHBondContact OG1-CE 3.29Å; M1514-M1549 HydrophobicContact SD-CG 4.11Å; I1536-M1549 VanDerWaalsContact CA-O 3.3Å; I1536-M1549 WeakPolarHBondContact CA-O 3.48Å; L1537-M1549 HydrophobicContact CB-CB 4.3Å; L1537-M1549 HydrophobicContact CD2-SD 4.09Å; L1537-M1549 PolarHBondContact N-O 3.37Å; L1537-M1549 PolarHBondContact O-N 3.2Å; I1547-M1549 HydrophobicContact CG2-CG 3.62Å
1550	G	51.9	Low	49.9	Very low	39 Å²	39	88.9 Å²	88.9	40%	0.402	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	121.4	-176.7	0	0	0	0	0	113.8	V1552	G1550-V1552 PolarHBondContact O-N 3.31Å
1551	K	38.4	Very low	47.1	Very low	132 Å²	132	92.1 Å²	92.1	57%	0.574	51%	0.506	S	S	*	.			trans	25.6	78.9	169.2	-160.6	-160	175.6	-160.7	0	116.8	Y1509	Y1509-K1551 HydrophobicContact CD1-CG 4.06Å; Y1509-K1551 HydrophobicContact CE1-CD 4.36Å; Y1509-K1551 HydrophobicContact CE1-CG 3.51Å; Y1509-K1551 WeakPolarHBondContact OH-CE 3.1Å
1552	V	32	Very low	44	Very low	71 Å²	71	98.7 Å²	98.7	43%	0.43	54%	0.541	S	S	.	.			trans	-56.1	141.3	162.5	-179.1	0	0	0	0	110.2	Y1509 G1550 T1554	Y1509-V1552 WeakPolarHBondContact CD1-O 3.39Å; Y1509-V1552 WeakPolarHBondContact CE1-O 3.49Å; G1550-V1552 PolarHBondContact O-N 3.31Å; V1552-T1554 PolarHBondContact O-N 3.39Å
1553	N	28.4	Very low	41.3	Very low	136 Å²	136	104.7 Å²	104.7	73%	0.727	57%	0.567	S	S	*	*			trans	-76.8	121.6	178.3	-99.8	-25.5	0	0	0	111.7	K1555	N1553-K1555 PolarHBondContact O-N 3.2Å; N1553-K1555 VanDerWaalsContact O-N 3.15Å
1554	T	27.3	Very low	39	Very low	73 Å²	73	103.3 Å²	103.3	45%	0.448	58%	0.577	S	S	.	*	S	Bend	trans	-70.9	101.2	177.4	50.9	0	0	0	0	112.2	N1508 Y1509 V1552	N1508-T1554 HydrophobicContact CB-CG2 4.14Å; N1508-T1554 WeakPolarHBondContact O-CG2 3.44Å; Y1509-T1554 HydrophobicContact CD1-CG2 4.28Å; Y1509-T1554 HydrophobicContact CE1-CG2 3.92Å; Y1509-T1554 HydrophobicContact CE2-CG2 4.5Å; V1552-T1554 PolarHBondContact O-N 3.39Å
1555	K	27.1	Very low	36.6	Very low	164 Å²	164	106.7 Å²	106.7	71%	0.713	59%	0.589	S	S	*	*			trans	-169.6	60.5	147.7	-111.2	-176.1	-179.8	-156.3	0	113.5	N1553	N1553-K1555 PolarHBondContact O-N 3.2Å; N1553-K1555 VanDerWaalsContact O-N 3.15Å
1556	L	23.7	Very low	34.2	Very low	142 Å²	142	110.1 Å²	110.1	74%	0.743	61%	0.608	S	S	*	*			trans	-128.3	163.7	164.8	-152.4	70.8	0	0	0	108.3
1557	N	24.8	Very low	32	Very low	131 Å²	131	114.4 Å²	114.4	70%	0.701	63%	0.628	S	S	*	*			trans	74.9	37.4	177.3	-56.5	12.1	0	0	0	117.5
1558	E	24.4	Very low	30	Very low	194 Å²	194	120.2 Å²	120.2	91%	0.907	67%	0.666	S	S	*	*	S	Bend	trans	-110.2	55.5	152.4	-78	-176.5	160.1	0	0	109.6
1559	S	23.3	Very low	28.8	Very low	97 Å²	97	124.3 Å²	124.3	68%	0.678	68%	0.684	S	S	*	*			trans	-165.3	34.4	-178.3	43.7	0	0	0	0	116.8
1560	I	23.4	Very low	27.3	Very low	165 Å²	165	132.2 Å²	132.2	85%	0.846	72%	0.72	S	S	*	*			trans	-137.7	104.9	151.7	-69.9	95	0	0	0	108.4
1561	S	25.5	Very low	25.9	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	73%	0.733	S	S	*	*			trans	-168.2	80.4	162.8	-172.5	0	0	0	0	108.8
1562	N	22.6	Very low	25.2	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	74%	0.742	S	S	*	*			trans	-80	151.4	175.8	-83.9	-14.6	0	0	0	111
1563	H	25.2	Very low	24.8	Very low	186 Å²	186	134.7 Å²	134.7	86%	0.861	75%	0.751	S	S	*	*			trans	71.2	115.9	169.8	-47.3	-62.8	0	0	0	116.9
1564	G	27.3	Very low	24.5	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	76%	0.758	S	S	*	*			trans	167.8	71.6	176	0	0	0	0	0	112.9	N1566	G1564-N1566 PolarHBondContact O-N 3.22Å
1565	H	23.8	Very low	24.3	Very low	178 Å²	178	140.7 Å²	140.7	82%	0.824	77%	0.771	S	S	*	*			trans	-69.3	128	175.3	-71.6	-100.4	0	0	0	111.2
1566	N	27.6	Very low	23.9	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	77%	0.771	S	S	*	*				161.3	142.1	118.2	-80.9	-38.4	0	0	0	114.2	G1564	G1564-N1566 PolarHBondContact O-N 3.22Å
1567	N	25.5	Very low	23.8	Very low	136 Å²	136	141 Å²	141	73%	0.727	77%	0.773	S	S	*	*			trans	50	111.8	158.5	-67	-10.9	0	0	0	120.8
1568	P	23.7	Very low	23.7	Very low	133 Å²	133	141.2 Å²	141.2	86%	0.864	77%	0.773	S	S	*	*			trans	-79.1	131.1	163.9	32.9	-31.6	0	0	0	111.4
1569	I	24.9	Very low	23.7	Very low	156 Å²	156	139.6 Å²	139.6	80%	0.8	77%	0.768	S	S	*	*			trans	-122	128.6	173.5	-62.1	-177.9	0	0	0	111.2
1570	H	23.1	Very low	23.7	Very low	172 Å²	172	140 Å²	140	80%	0.796	77%	0.766	S	S	*	*			trans	-16.2	116.5	172.8	-88.2	-84.3	0	0	0	120
1571	S	21.6	Very low	23.9	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	76%	0.756	S	S	*	*				28.8	100.2	121.6	64.3	0	0	0	0	119.3
1572	S	23.4	Very low	24.3	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	76%	0.758	S	S	*	*				176.3	163.4	122.8	50.3	0	0	0	0	112.4
1573	S	23.4	Very low	24.9	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	74%	0.736	S	S	*	*			trans	57.8	59.2	171.6	62.8	0	0	0	0	117.5	F1575	S1573-F1575 VanDerWaalsContact C-N 3.31Å; S1573-F1575 PolarHBondContact O-N 2.99Å
1574	I	22.5	Very low	25.8	Very low	169 Å²	169	135.7 Å²	135.7	87%	0.867	73%	0.727	S	S	*	*			trans	-65.8	97.3	154.8	-62.8	178	0	0	0	107.8	T1576	I1574-T1576 PolarHBondContact O-N 3.47Å
1575	F	22.7	Very low	26.9	Very low	165 Å²	165	136.5 Å²	136.5	72%	0.724	71%	0.711	S	S	*	*			trans	-62.6	120.3	169.7	-84.6	-97.1	0	0	0	109	S1573 Y1577	S1573-F1575 VanDerWaalsContact C-N 3.31Å; S1573-F1575 PolarHBondContact O-N 2.99Å; F1575-Y1577 VanDerWaalsContact C-N 3.29Å; F1575-Y1577 PolarHBondContact O-N 2.85Å
1576	T	20.7	Very low	28.4	Very low	116 Å²	116	128 Å²	128	71%	0.712	67%	0.672	S	S	*	*			trans	-68.9	90.2	171.9	37.1	0	0	0	0	109.6	I1574 N1578	I1574-T1576 PolarHBondContact O-N 3.47Å; T1576-N1578 PolarHBondContact O-N 2.63Å; T1576-N1578 PolarHBondContact O-ND2 2.81Å; T1576-N1578 VanDerWaalsContact O-ND2 3.08Å
1577	Y	21.5	Very low	29.9	Very low	198 Å²	198	123.3 Å²	123.3	78%	0.776	65%	0.652	S	S	*	*			trans	-62.8	88.6	171.1	-115.3	-86.8	0	0	0	109	F1575 M1579	F1575-Y1577 VanDerWaalsContact C-N 3.29Å; F1575-Y1577 PolarHBondContact O-N 2.85Å; Y1577-M1579 HydrophobicContact CD1-CG 4.48Å; Y1577-M1579 PolarHBondContact O-N 2.86Å
1578	N	21.9	Very low	31.5	Very low	134 Å²	134	118 Å²	118	72%	0.717	62%	0.624	S	S	*	*			trans	-69.7	76.7	170.4	-75.3	-77.8	0	0	0	108.2	T1576 V1580	T1576-N1578 PolarHBondContact O-N 2.63Å; T1576-N1578 PolarHBondContact O-ND2 2.81Å; T1576-N1578 VanDerWaalsContact O-ND2 3.08Å; N1578-V1580 PolarHBondContact O-N 3.4Å
1579	M	23.4	Very low	33.3	Very low	160 Å²	160	115.7 Å²	115.7	79%	0.788	61%	0.607	S	S	*	*			trans	-64.1	85.6	164.9	-75.9	-166.7	-176.1	0	0	108.3	Y1577 I1581	Y1577-M1579 HydrophobicContact CD1-CG 4.48Å; Y1577-M1579 PolarHBondContact O-N 2.86Å; M1579-I1581 PolarHBondContact O-N 2.94Å
1580	V	23.8	Very low	35.4	Very low	107 Å²	107	108.8 Å²	108.8	65%	0.648	57%	0.573	S	S	*	*			trans	-56.6	111.4	164.8	177.9	0	0	0	0	106.4	N1578 K1582	N1578-V1580 PolarHBondContact O-N 3.4Å; V1580-K1582 VanDerWaalsContact C-N 3.26Å; V1580-K1582 HydrophobicContact CB-CG 4.47Å; V1580-K1582 HydrophobicContact CG1-CG 4.16Å; V1580-K1582 WeakPolarHBondContact O-CG 3.37Å; V1580-K1582 PolarHBondContact O-N 3.18Å
1581	I	27.1	Very low	37.9	Very low	124 Å²	124	102.2 Å²	102.2	64%	0.636	55%	0.545	S	S	*	.			trans	-64.2	91.8	173.3	-59.6	173.6	0	0	0	106.8	M1579 S1583	M1579-I1581 PolarHBondContact O-N 2.94Å; I1581-S1583 VanDerWaalsContact C-N 3.32Å; I1581-S1583 WeakPolarHBondContact CG2-O 3.49Å; I1581-S1583 PolarHBondContact O-N 2.72Å
1582	K	34.1	Very low	40.9	Very low	195 Å²	195	97.8 Å²	97.8	85%	0.848	51%	0.514	S	S	*	.			trans	-74.1	-20.1	-166.1	-87.8	177.6	179.8	176.4	0	113.9	V1580	V1580-K1582 VanDerWaalsContact C-N 3.26Å; V1580-K1582 HydrophobicContact CB-CG 4.47Å; V1580-K1582 HydrophobicContact CG1-CG 4.16Å; V1580-K1582 WeakPolarHBondContact O-CG 3.37Å; V1580-K1582 PolarHBondContact O-N 3.18Å
1583	S	36.7	Very low	44	Very low	40 Å²	40	93.5 Å²	93.5	28%	0.28	48%	0.481	S	S	.	.			trans	-127.5	138.2	171.8	59.5	0	0	0	0	110.1	H1488 I1581	H1488-S1583 PolarHBondContact NE2-OG 3.25Å; I1581-S1583 VanDerWaalsContact C-N 3.32Å; I1581-S1583 WeakPolarHBondContact CG2-O 3.49Å; I1581-S1583 PolarHBondContact O-N 2.72Å
1584	K	43.7	Very low	47.2	Very low	155 Å²	155	89.2 Å²	89.2	67%	0.674	45%	0.452	S	S	*	.	S	Bend	trans	-97.2	24.9	161.3	-69.9	-177.1	173.7	-174.4	0	110
1585	H	50.3	Low	50.1	Low	91 Å²	91	81.2 Å²	81.2	42%	0.421	41%	0.41	S	S	.	.	S	Bend	trans	-149.5	121.3	-139.4	-62.7	-22.6	0	0	0	111	V1452 A1587	V1452-H1585 HydrophobicContact CB-CB 4.42Å; V1452-H1585 HydrophobicContact CG1-CB 3.59Å; V1452-H1585 WeakPolarHBondContact CG1-ND1 3.49Å; V1452-H1585 HydrophobicContact CG2-CB 4.15Å; H1585-A1587 PolarHBondContact O-N 3.42Å; H1585-A1587 VanDerWaalsContact O-N 3.15Å
1586	L	55.6	Low	53	Low	1 Å²	1	73.4 Å²	73.4	1%	0.005	38%	0.377	C	S	.	.			trans	-74.8	89.8	166.2	-166.7	79.8	0	0	0	109.6	L1451 V1452 F1473 H1488 F1503 L1505 L1532 L1588	L1451-L1586 HydrophobicContact CD1-CD2 4.27Å; V1452-L1586 HydrophobicContact CG2-CB 4.16Å; V1452-L1586 VanDerWaalsContact CG2-N 3.28Å; V1452-L1586 VanDerWaalsContact CG2-O 3.26Å; V1452-L1586 WeakPolarHBondContact CG2-O 3.36Å; F1473-L1586 HydrophobicContact CD1-CD1 4.27Å; F1473-L1586 HydrophobicContact CD1-CD2 4.43Å; F1473-L1586 HydrophobicContact CE1-CD1 3.83Å; F1473-L1586 HydrophobicContact CE1-CD2 4.47Å; F1473-L1586 HydrophobicContact CE1-CG 4.11Å; H1488-L1586 HydrophobicContact CB-CD1 4.17Å; F1503-L1586 HydrophobicContact CE2-CD1 4.44Å; F1503-L1586 HydrophobicContact CE2-CD2 4.34Å; L1505-L1586 HydrophobicContact CD2-CB 3.75Å; L1505-L1586 HydrophobicContact CD2-CD1 3.98Å; L1505-L1586 HydrophobicContact CD2-CG 4.47Å; L1532-L1586 HydrophobicContact CD2-CB 4.31Å; L1586-L1588 HydrophobicContact CD2-CD2 4.1Å; L1586-L1588 HydrophobicContact CG-CD2 4.43Å
1587	A	57.9	Low	55.9	Low	43 Å²	43	68.5 Å²	68.5	36%	0.355	35%	0.346	S	S	.	.			trans	-76.4	122.3	170.3	0	0	0	0	0	108.9	F1473 H1585 T1589	F1473-A1587 WeakPolarHBondContact CZ-O 3.45Å; H1585-A1587 PolarHBondContact O-N 3.42Å; H1585-A1587 VanDerWaalsContact O-N 3.15Å; A1587-T1589 HydrophobicContact CB-CG2 4.03Å; A1587-T1589 PolarHBondContact O-N 3.32Å
1588	L	58.8	Low	58.7	Low	25 Å²	25	59.2 Å²	59.2	13%	0.131	31%	0.311	C	S	.	.			trans	-77.1	81.9	172.3	-58.4	-179.3	0	0	0	109	P1445 L1451 F1473 L1586	P1445-L1588 HydrophobicContact CB-CB 4.48Å; P1445-L1588 HydrophobicContact CB-CD1 4.12Å; P1445-L1588 HydrophobicContact CG-CB 3.8Å; P1445-L1588 HydrophobicContact CG-CD1 3.52Å; P1445-L1588 HydrophobicContact CG-CG 4.31Å; L1451-L1588 HydrophobicContact CD1-CD1 3.91Å; L1451-L1588 HydrophobicContact CD1-CD2 4.19Å; L1451-L1588 HydrophobicContact CD1-CG 4.38Å; L1451-L1588 HydrophobicContact CG-CD1 3.96Å; L1451-L1588 HydrophobicContact CG-CG 4.49Å; F1473-L1588 HydrophobicContact CD1-CD2 4Å; F1473-L1588 HydrophobicContact CD2-CD2 3.59Å; F1473-L1588 HydrophobicContact CE1-CD2 3.96Å; F1473-L1588 HydrophobicContact CE2-CB 4.12Å; F1473-L1588 HydrophobicContact CE2-CD2 3.52Å; F1473-L1588 HydrophobicContact CE2-CG 4.43Å; F1473-L1588 HydrophobicContact CG-CD2 3.83Å; F1473-L1588 HydrophobicContact CZ-CD2 3.74Å; L1586-L1588 HydrophobicContact CD2-CD2 4.1Å; L1586-L1588 HydrophobicContact CG-CD2 4.43Å
1589	T	61.5	Low	61.2	Low	84 Å²	84	58.8 Å²	58.8	52%	0.515	31%	0.313	S	S	.	.			trans	-82.6	-29.8	-179.3	47	0	0	0	0	112.8	D1475 A1587	D1475-T1589 PolarHBondContact OD1-OG1 2.99Å; D1475-T1589 PolarHBondContact OD2-OG1 3.25Å; A1587-T1589 HydrophobicContact CB-CG2 4.03Å; A1587-T1589 PolarHBondContact O-N 3.32Å
1590	S	69.3	Low	63.4	Low	12 Å²	12	57 Å²	57	8%	0.084	31%	0.306	C	S	.	.	S	Bend	trans	-108.4	167.8	175.9	52.6	0	0	0	0	111.3	F1473 I1474	F1473-S1590 WeakPolarHBondContact CE2-OG 3.24Å; I1474-S1590 WeakPolarHBondContact O-CB 3.12Å; I1474-S1590 PolarHBondContact O-OG 2.8Å
1591	P	76.5	Confident	66	Low	33 Å²	33	52.2 Å²	52.2	21%	0.214	28%	0.277	C	S	.	.			trans	-64.9	152.9	176.2	-18.4	32.3	0	0	0	112.6	A1442 V1444 Y1593	A1442-P1591 HydrophobicContact CB-CB 4.1Å; V1444-P1591 HydrophobicContact CG2-CB 4.35Å; V1444-P1591 HydrophobicContact CG2-CG 4.3Å; P1591-Y1593 HydrophobicContact CB-CE1 4.38Å; P1591-Y1593 HydrophobicContact CB-CE2 3.97Å; P1591-Y1593 HydrophobicContact CG-CE2 4.41Å; P1591-Y1593 WeakPolarHBondContact O-CE2 3.45Å
1592	L	84.7	Confident	68.2	Low	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	112.4	171.8	-177.1	66.3	0	0	0	108.4	I1443 I1457 L1471 F1473 F1594 I1626	I1443-L1592 PolarHBondContact N-O 3.13Å; I1443-L1592 PolarHBondContact O-N 2.81Å; I1457-L1592 HydrophobicContact CD1-CD1 4.36Å; I1457-L1592 HydrophobicContact CD1-CD2 3.88Å; I1457-L1592 HydrophobicContact CG1-CD2 4.46Å; L1471-L1592 HydrophobicContact CD1-CD1 3.65Å; L1471-L1592 HydrophobicContact CD1-CD2 4.18Å; L1471-L1592 HydrophobicContact CD1-CG 3.77Å; L1471-L1592 HydrophobicContact CD2-CD1 4.23Å; L1471-L1592 HydrophobicContact CG-CD1 3.89Å; F1473-L1592 HydrophobicContact CB-CD1 3.79Å; L1592-F1594 HydrophobicContact CD2-CE2 3.65Å; L1592-F1594 HydrophobicContact CD2-CZ 4.07Å; L1592-F1594 HydrophobicContact CG-CD2 4.35Å; L1592-F1594 HydrophobicContact CG-CE2 3.72Å; L1592-F1594 HydrophobicContact CG-CZ 4.48Å; L1592-I1626 HydrophobicContact CD2-CD1 3.85Å
1593	Y	88.9	Confident	70.1	Confident	20 Å²	20	46 Å²	46	8%	0.078	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.8	-176.3	-60	-88.1	0	0	0	111.2	Y1440 V1441 A1442 L1471 N1472 P1591 P1598	Y1440-Y1593 AromaticContact CD2-CD1 3.85Å; Y1440-Y1593 HydrophobicContact CD2-CD1 3.85Å; Y1440-Y1593 HydrophobicContact CD2-CE1 4.34Å; Y1440-Y1593 HydrophobicContact CE2-CD1 4.07Å; Y1440-Y1593 HydrophobicContact CE2-CE1 4.08Å; V1441-Y1593 CarbonylContact O-C 3.1Å; V1441-Y1593 VanDerWaalsContact O-CA 3.29Å; V1441-Y1593 WeakPolarHBondContact O-CA 3.28Å; A1442-Y1593 HydrophobicContact CB-CD1 3.62Å; A1442-Y1593 HydrophobicContact CB-CE1 3.42Å; A1442-Y1593 VanDerWaalsContact CB-CE1 3.42Å; L1471-Y1593 CarbonylContact C-O 3.51Å; L1471-Y1593 WeakPolarHBondContact CA-O 3.17Å; N1472-Y1593 PolarHBondContact N-O 3.17Å; N1472-Y1593 PolarHBondContact O-N 2.95Å; P1591-Y1593 HydrophobicContact CB-CE1 4.38Å; P1591-Y1593 HydrophobicContact CB-CE2 3.97Å; P1591-Y1593 HydrophobicContact CG-CE2 4.41Å; P1591-Y1593 WeakPolarHBondContact O-CE2 3.45Å; Y1593-P1598 HydrophobicContact CD1-CG 4.15Å; Y1593-P1598 HydrophobicContact CE1-CB 4.24Å; Y1593-P1598 HydrophobicContact CE1-CG 3.63Å; Y1593-P1598 HydrophobicContact CE2-CG 4.16Å
1594	F	89.7	Confident	71.9	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.4	173	-69.1	-113.9	0	0	0	110.7	Y1440 V1441 I1443 I1457 F1459 L1470 L1471 L1592 G1596 I1621 V1624	Y1440-F1594 WeakPolarHBondContact CA-O 3.49Å; V1441-F1594 HydrophobicContact CG1-CB 3.74Å; V1441-F1594 PolarHBondContact N-O 3.27Å; V1441-F1594 VanDerWaalsContact N-O 3.11Å; V1441-F1594 PolarHBondContact O-N 3.42Å; I1443-F1594 HydrophobicContact CD1-CD2 3.88Å; I1443-F1594 HydrophobicContact CD1-CE2 3.67Å; I1443-F1594 HydrophobicContact CD1-CZ 4.46Å; I1443-F1594 HydrophobicContact CG1-CD2 4.45Å; I1443-F1594 HydrophobicContact CG1-CE2 4.47Å; I1457-F1594 HydrophobicContact CG2-CE1 4.43Å; I1457-F1594 HydrophobicContact CG2-CZ 3.92Å; F1459-F1594 HydrophobicContact CB-CE1 4.38Å; F1459-F1594 AromaticContact CD1-CE1 3.72Å; F1459-F1594 HydrophobicContact CD1-CE1 3.72Å; F1459-F1594 HydrophobicContact CD2-CD1 4.44Å; F1459-F1594 HydrophobicContact CD2-CE1 4.31Å; F1459-F1594 AromaticContact CE1-CE1 3.96Å; F1459-F1594 HydrophobicContact CE1-CE1 3.96Å; F1459-F1594 HydrophobicContact CE2-CD1 4.45Å; F1459-F1594 HydrophobicContact CE2-CE1 4.5Å; F1459-F1594 HydrophobicContact CG-CD1 4.48Å; F1459-F1594 AromaticContact CG-CE1 3.91Å; F1459-F1594 HydrophobicContact CG-CE1 3.91Å; F1459-F1594 HydrophobicContact CZ-CE1 4.34Å; L1470-F1594 WeakPolarHBondContact O-CA 3.43Å; L1471-F1594 HydrophobicContact CD1-CD1 3.71Å; L1471-F1594 HydrophobicContact CD1-CD2 3.68Å; L1471-F1594 HydrophobicContact CD1-CE1 3.51Å; L1471-F1594 HydrophobicContact CD1-CE2 3.45Å; L1471-F1594 VanDerWaalsContact CD1-CE2 3.45Å; L1471-F1594 HydrophobicContact CD1-CG 3.81Å; L1471-F1594 HydrophobicContact CD1-CZ 3.38Å; L1592-F1594 HydrophobicContact CD2-CE2 3.65Å; L1592-F1594 HydrophobicContact CD2-CZ 4.07Å; L1592-F1594 HydrophobicContact CG-CD2 4.35Å; L1592-F1594 HydrophobicContact CG-CE2 3.72Å; L1592-F1594 HydrophobicContact CG-CZ 4.48Å; F1594-G1596 PolarHBondContact O-N 3.19Å; F1594-I1621 HydrophobicContact CB-CD1 4.02Å; F1594-I1621 HydrophobicContact CD1-CD1 4.44Å; F1594-V1624 HydrophobicContact CE1-CG1 4.15Å; F1594-V1624 HydrophobicContact CE1-CG2 4.44Å; F1594-V1624 HydrophobicContact CE2-CG1 4.35Å; F1594-V1624 HydrophobicContact CZ-CG1 3.75Å
1595	G	83.4	Confident	73.3	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	81	-17	175.1	0	0	0	0	0	115.9	S1439 I1469 L1470 G1616 L1617	S1439-G1595 CarbonylContact O-C 3.56Å; I1469-G1595 CarbonylContact O-C 3.32Å; I1469-G1595 WeakPolarHBondContact O-CA 3.39Å; L1470-G1595 PolarHBondContact O-N 3.46Å; G1595-G1616 CarbonylContact O-C 3.5Å; G1595-G1616 WeakPolarHBondContact O-CA 3.5Å; G1595-L1617 PolarHBondContact O-N 3.26Å
1596	G	84.1	Confident	74.6	Confident	2 Å²	2	40 Å²	40	2%	0.021	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	178.9	-171.4	177.2	0	0	0	0	0	112.4	I1469 F1594 L1615	I1469-G1596 PolarHBondContact O-N 3.08Å; F1594-G1596 PolarHBondContact O-N 3.19Å; G1596-L1615 VanDerWaalsContact CA-O 3.28Å; G1596-L1615 WeakPolarHBondContact CA-O 3.33Å
1597	V	81.1	Confident	75.5	Confident	12 Å²	12	46.4 Å²	46.4	7%	0.073	25%	0.245	C	C	.	.			trans	-129	137	-174.2	178.1	0	0	0	0	110.6	I1469 N1472 Q1601 A1605 L1615	I1469-V1597 HydrophobicContact CB-CG2 4.22Å; I1469-V1597 HydrophobicContact CD1-CG2 3.51Å; I1469-V1597 HydrophobicContact CG1-CG2 4.45Å; I1469-V1597 HydrophobicContact CG2-CG2 3.82Å; N1472-V1597 HydrophobicContact CB-CG2 3.88Å; V1597-Q1601 HydrophobicContact CG1-CB 3.57Å; V1597-A1605 HydrophobicContact CB-CB 4.46Å; V1597-A1605 HydrophobicContact CG1-CB 3.95Å; V1597-A1605 HydrophobicContact CG2-CB 4.11Å; V1597-L1615 PolarHBondContact N-O 2.87Å
1598	P	80.2	Confident	76.3	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.026	23%	0.232	C	C	.	.			trans	-69.4	158.5	177.9	33.9	-41.1	0	0	0	112.2	Y1440 Y1593 D1600 Q1601 L1602	Y1440-P1598 HydrophobicContact CE1-CB 4.23Å; Y1440-P1598 HydrophobicContact CE2-CB 4.23Å; Y1593-P1598 HydrophobicContact CD1-CG 4.15Å; Y1593-P1598 HydrophobicContact CE1-CB 4.24Å; Y1593-P1598 HydrophobicContact CE1-CG 3.63Å; Y1593-P1598 HydrophobicContact CE2-CG 4.16Å; P1598-D1600 WeakPolarHBondContact CB-OD1 3.5Å; P1598-D1600 WeakPolarHBondContact CG-OD1 3.45Å; P1598-D1600 PolarHBondContact O-N 3.28Å; P1598-D1600 VanDerWaalsContact O-N 3.1Å; P1598-Q1601 HydrophobicContact CG-CB 4.25Å; P1598-Q1601 HydrophobicContact CG-CG 4.25Å; P1598-Q1601 PolarHBondContact O-N 2.95Å; P1598-L1602 PolarHBondContact O-N 2.99Å
1599	V	73.5	Confident	76.8	Confident	125 Å²	125	43.9 Å²	43.9	76%	0.758	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-56.1	-33.4	-171.5	-177.6	0	0	0	0	113.5	Q1601 L1602	V1599-Q1601 VanDerWaalsContact C-N 3.34Å; V1599-Q1601 PolarHBondContact O-N 3.06Å; V1599-L1602 HydrophobicContact CB-CD1 4.36Å; V1599-L1602 HydrophobicContact CG1-CD1 4.17Å
1600	D	70.2	Confident	77.1	Confident	123 Å²	123	45.5 Å²	45.5	66%	0.658	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-75.3	-15.9	179.8	65.3	-53.3	0	0	0	114.5	P1598	P1598-D1600 WeakPolarHBondContact CB-OD1 3.5Å; P1598-D1600 WeakPolarHBondContact CG-OD1 3.45Å; P1598-D1600 PolarHBondContact O-N 3.28Å; P1598-D1600 VanDerWaalsContact O-N 3.1Å
1601	Q	78	Confident	76.8	Confident	6 Å²	6	47.4 Å²	47.4	3%	0.028	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-108.2	0.8	177.1	-63.9	-165.3	5.9	0	0	113.8	N1472 V1597 P1598 V1599 E1603 T1604 A1605	N1472-Q1601 PolarHBondContact ND2-OE1 3.45Å; V1597-Q1601 HydrophobicContact CG1-CB 3.57Å; P1598-Q1601 HydrophobicContact CG-CB 4.25Å; P1598-Q1601 HydrophobicContact CG-CG 4.25Å; P1598-Q1601 PolarHBondContact O-N 2.95Å; V1599-Q1601 VanDerWaalsContact C-N 3.34Å; V1599-Q1601 PolarHBondContact O-N 3.06Å; Q1601-E1603 PolarHBondContact O-N 3.49Å; Q1601-T1604 PolarHBondContact O-N 3.26Å; Q1601-A1605 WeakPolarHBondContact O-CB 3.47Å; Q1601-A1605 PolarHBondContact O-N 3.27Å
1602	L	74.3	Confident	75.9	Confident	41 Å²	41	50 Å²	50	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-55.7	-44.4	-177.5	-72.1	175.6	0	0	0	113.6	P1598 V1599 R1606 L1615	P1598-L1602 PolarHBondContact O-N 2.99Å; V1599-L1602 HydrophobicContact CB-CD1 4.36Å; V1599-L1602 HydrophobicContact CG1-CD1 4.17Å; L1602-R1606 WeakPolarHBondContact O-CB 3.17Å; L1602-R1606 VanDerWaalsContact O-CG 3.3Å; L1602-R1606 WeakPolarHBondContact O-CG 2.95Å; L1602-R1606 PolarHBondContact O-N 3.15Å; L1602-L1615 HydrophobicContact CD2-CB 4.1Å; L1602-L1615 HydrophobicContact CD2-CD1 3.86Å; L1602-L1615 HydrophobicContact CD2-CD2 3.95Å; L1602-L1615 HydrophobicContact CD2-CG 4.17Å
1603	E	73.4	Confident	74.6	Confident	147 Å²	147	50.4 Å²	50.4	69%	0.687	27%	0.267	S	S	*	.	H	α-helix	trans	-69.1	-42.4	-179.4	-66.1	-158.7	145.6	0	0	112.1	Q1601 A1605 R1606 H1607	Q1601-E1603 PolarHBondContact O-N 3.49Å; E1603-A1605 VanDerWaalsContact C-N 3.34Å; E1603-A1605 PolarHBondContact O-N 2.87Å; E1603-R1606 PolarHBondContact O-N 3.3Å; E1603-H1607 WeakPolarHBondContact O-CB 3.33Å; E1603-H1607 PolarHBondContact O-CD2 3.09Å; E1603-H1607 PolarHBondContact O-N 2.73Å
1604	T	74.4	Confident	73.3	Confident	27 Å²	27	54.6 Å²	54.6	17%	0.166	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-41.1	176.2	-42.6	0	0	0	0	111.2	I1474 P1486 Q1601 H1607 L1608	I1474-T1604 HydrophobicContact CD1-CG2 3.79Å; P1486-T1604 HydrophobicContact CG-CG2 4.08Å; Q1601-T1604 PolarHBondContact O-N 3.26Å; T1604-H1607 PolarHBondContact O-N 3.28Å; T1604-L1608 HydrophobicContact CG2-CD1 4.37Å; T1604-L1608 WeakPolarHBondContact O-CB 3.33Å; T1604-L1608 VanDerWaalsContact O-CG 3.3Å; T1604-L1608 WeakPolarHBondContact O-CG 3.32Å; T1604-L1608 PolarHBondContact O-N 2.95Å
1605	A	74.1	Confident	72.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65	-44.2	174.8	0	0	0	0	0	112	I1469 V1597 Q1601 E1603 H1607 L1608 T1609 L1615	I1469-A1605 HydrophobicContact CD1-CB 4.07Å; V1597-A1605 HydrophobicContact CB-CB 4.46Å; V1597-A1605 HydrophobicContact CG1-CB 3.95Å; V1597-A1605 HydrophobicContact CG2-CB 4.11Å; Q1601-A1605 WeakPolarHBondContact O-CB 3.47Å; Q1601-A1605 PolarHBondContact O-N 3.27Å; E1603-A1605 VanDerWaalsContact C-N 3.34Å; E1603-A1605 PolarHBondContact O-N 2.87Å; A1605-H1607 PolarHBondContact O-N 2.82Å; A1605-L1608 PolarHBondContact O-N 2.94Å; A1605-T1609 WeakPolarHBondContact O-CG2 3.18Å; A1605-T1609 PolarHBondContact O-N 3.42Å; A1605-T1609 PolarHBondContact O-OG1 3.11Å; A1605-L1615 HydrophobicContact CB-CD2 4.23Å
1606	R	76.9	Confident	71.8	Confident	134 Å²	134	56.5 Å²	56.5	51%	0.506	30%	0.298	S	S	.	.	H	α-helix	trans	-58.8	-44.2	173.2	-77.9	177.8	176.2	162.4	3.6	112.3	L1602 E1603 T1609 N1610 G1611 L1615	L1602-R1606 WeakPolarHBondContact O-CB 3.17Å; L1602-R1606 VanDerWaalsContact O-CG 3.3Å; L1602-R1606 WeakPolarHBondContact O-CG 2.95Å; L1602-R1606 PolarHBondContact O-N 3.15Å; E1603-R1606 PolarHBondContact O-N 3.3Å; R1606-T1609 PolarHBondContact O-N 2.98Å; R1606-T1609 PolarHBondContact O-OG1 3.04Å; R1606-N1610 CarbonylContact O-C 3.6Å; R1606-N1610 WeakPolarHBondContact O-CA 3.47Å; R1606-N1610 PolarHBondContact O-N 2.95Å; R1606-G1611 PolarHBondContact O-N 3.29Å; R1606-L1615 HydrophobicContact CG-CD1 4.21Å; R1606-L1615 HydrophobicContact CG-CD2 4.05Å
1607	H	74.6	Confident	72	Confident	135 Å²	135	56.5 Å²	56.5	63%	0.625	30%	0.297	S	S	*	.	H	α-helix	trans	-63.3	-39.2	176.1	-90.2	-69.8	0	0	0	112.3	E1603 T1604 A1605	E1603-H1607 WeakPolarHBondContact O-CB 3.33Å; E1603-H1607 PolarHBondContact O-CD2 3.09Å; E1603-H1607 PolarHBondContact O-N 2.73Å; T1604-H1607 PolarHBondContact O-N 3.28Å; A1605-H1607 PolarHBondContact O-N 2.82Å
1608	L	73.9	Confident	72.3	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-73.4	-34.4	177.2	-70.3	173	0	0	0	112.9	I1474 Y1489 L1491 K1502 T1604 A1605 N1610	I1474-L1608 HydrophobicContact CD1-CD1 4.19Å; I1474-L1608 HydrophobicContact CG1-CD1 4.34Å; Y1489-L1608 HydrophobicContact CD1-CD2 4.4Å; Y1489-L1608 HydrophobicContact CD2-CD1 4.07Å; Y1489-L1608 HydrophobicContact CD2-CD2 4.2Å; Y1489-L1608 HydrophobicContact CE1-CD2 3.98Å; Y1489-L1608 HydrophobicContact CE2-CD1 4.45Å; Y1489-L1608 HydrophobicContact CE2-CD2 3.78Å; Y1489-L1608 HydrophobicContact CG-CD1 4.17Å; Y1489-L1608 HydrophobicContact CG-CD2 4.5Å; L1491-L1608 HydrophobicContact CD1-CB 4.2Å; L1491-L1608 HydrophobicContact CD1-CD1 4.47Å; K1502-L1608 WeakPolarHBondContact CD-O 3.49Å; K1502-L1608 WeakPolarHBondContact CE-O 3.27Å; K1502-L1608 PolarHBondContact NZ-O 2.98Å; T1604-L1608 HydrophobicContact CG2-CD1 4.37Å; T1604-L1608 WeakPolarHBondContact O-CB 3.33Å; T1604-L1608 VanDerWaalsContact O-CG 3.3Å; T1604-L1608 WeakPolarHBondContact O-CG 3.32Å; T1604-L1608 PolarHBondContact O-N 2.95Å; A1605-L1608 PolarHBondContact O-N 2.94Å; L1608-N1610 VanDerWaalsContact C-N 3.31Å
1609	T	70.8	Confident	72.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-81	-6.3	175.8	58.6	0	0	0	0	113.7	I1469 L1491 D1493 A1605 R1606 G1611 L1612	I1469-T1609 HydrophobicContact CD1-CG2 4.35Å; L1491-T1609 HydrophobicContact CD1-CG2 4.27Å; L1491-T1609 HydrophobicContact CD2-CG2 4.03Å; D1493-T1609 HydrophobicContact CB-CG2 4.31Å; A1605-T1609 WeakPolarHBondContact O-CG2 3.18Å; A1605-T1609 PolarHBondContact O-N 3.42Å; A1605-T1609 PolarHBondContact O-OG1 3.11Å; R1606-T1609 PolarHBondContact O-N 2.98Å; R1606-T1609 PolarHBondContact O-OG1 3.04Å; T1609-G1611 PolarHBondContact O-N 3.24Å; T1609-G1611 PolarHBondContact OG1-N 2.96Å; T1609-L1612 PolarHBondContact O-N 3.28Å
1610	N	67.3	Low	73.5	Confident	117 Å²	117	53 Å²	53	63%	0.626	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	20.3	-164.1	-58.2	-13	0	0	0	113.3	R1606 L1608 L1612	R1606-N1610 CarbonylContact O-C 3.6Å; R1606-N1610 WeakPolarHBondContact O-CA 3.47Å; R1606-N1610 PolarHBondContact O-N 2.95Å; L1608-N1610 VanDerWaalsContact C-N 3.31Å; N1610-L1612 HydrophobicContact CB-CD1 4.24Å; N1610-L1612 HydrophobicContact CB-CG 4.27Å; N1610-L1612 PolarHBondContact O-N 3.12Å
1611	G	62.5	Low	74.5	Confident	53 Å²	53	47.1 Å²	47.1	55%	0.546	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	10.6	-175.3	0	0	0	0	0	115.4	R1606 T1609	R1606-G1611 PolarHBondContact O-N 3.29Å; T1609-G1611 PolarHBondContact O-N 3.24Å; T1609-G1611 PolarHBondContact OG1-N 2.96Å
1612	L	57.2	Low	75.1	Confident	87 Å²	87	50.4 Å²	50.4	46%	0.455	26%	0.261	S	S	.	.			trans	-79.1	-16	-176.2	-66.3	170.6	0	0	0	114.5	H1495 T1609 N1610	H1495-L1612 PolarHBondContact CE1-O 3.29Å; H1495-L1612 VanDerWaalsContact CE1-O 3.3Å; H1495-L1612 PolarHBondContact ND1-O 2.99Å; T1609-L1612 PolarHBondContact O-N 3.28Å; N1610-L1612 HydrophobicContact CB-CD1 4.24Å; N1610-L1612 HydrophobicContact CB-CG 4.27Å; N1610-L1612 PolarHBondContact O-N 3.12Å
1613	S	58	Low	75.6	Confident	9 Å²	9	50.4 Å²	50.4	6%	0.063	26%	0.261	C	S	.	.	S	Bend	trans	-122.9	136	-168.1	-41.4	0	0	0	0	109.9	D1493	D1493-S1613 PolarHBondContact OD2-OG 2.81Å
1614	E	61.6	Low	76.2	Confident	108 Å²	108	43.5 Å²	43.5	51%	0.505	23%	0.229	S	C	.	.			trans	-61.5	149.2	173.6	-72.9	178.9	-132.4	0	0	110.7	N1467 G1468 I1469 G1616	N1467-E1614 HydrophobicContact CB-CB 4.06Å; N1467-E1614 HydrophobicContact CB-CG 4.01Å; G1468-E1614 CarbonylContact C-O 3.55Å; G1468-E1614 VanDerWaalsContact C-O 3.27Å; G1468-E1614 WeakPolarHBondContact CA-O 3.49Å; I1469-E1614 PolarHBondContact N-O 2.88Å; E1614-G1616 PolarHBondContact O-N 3.13Å
1615	L	67	Low	76.8	Confident	41 Å²	41	45.2 Å²	45.2	22%	0.215	24%	0.235	C	C	.	.	S	Bend	trans	-82.5	0.7	-164.7	-73.3	156	0	0	0	114.6	I1469 G1596 V1597 L1602 A1605 R1606	I1469-L1615 HydrophobicContact CD1-CD2 4.06Å; G1596-L1615 VanDerWaalsContact CA-O 3.28Å; G1596-L1615 WeakPolarHBondContact CA-O 3.33Å; V1597-L1615 PolarHBondContact N-O 2.87Å; L1602-L1615 HydrophobicContact CD2-CB 4.1Å; L1602-L1615 HydrophobicContact CD2-CD1 3.86Å; L1602-L1615 HydrophobicContact CD2-CD2 3.95Å; L1602-L1615 HydrophobicContact CD2-CG 4.17Å; A1605-L1615 HydrophobicContact CB-CD2 4.23Å; R1606-L1615 HydrophobicContact CG-CD1 4.21Å; R1606-L1615 HydrophobicContact CG-CD2 4.05Å
1616	G	75.2	Confident	77.1	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.01	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-170.9	-176.9	170.4	0	0	0	0	0	109.8	P1437 G1468 G1595 E1614	P1437-G1616 CarbonylContact O-C 3.48Å; P1437-G1616 VanDerWaalsContact O-CA 3.25Å; P1437-G1616 WeakPolarHBondContact O-CA 3.08Å; G1468-G1616 WeakPolarHBondContact CA-O 3.5Å; G1595-G1616 CarbonylContact O-C 3.5Å; G1595-G1616 WeakPolarHBondContact O-CA 3.5Å; E1614-G1616 PolarHBondContact O-N 3.13Å
1617	L	87.1	Confident	76.9	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.232	C	C	.	.			trans	-145.3	163.6	-170.3	59.9	90.9	0	0	0	113	L1434 I1461 L1470 G1595	L1434-L1617 HydrophobicContact CD1-CD1 3.7Å; L1434-L1617 HydrophobicContact CD1-CG 4.48Å; I1461-L1617 HydrophobicContact CD1-CD1 3.91Å; I1461-L1617 HydrophobicContact CD1-CD2 4.37Å; L1470-L1617 HydrophobicContact CD2-CD2 3.65Å; L1470-L1617 HydrophobicContact CG-CD2 4.07Å; G1595-L1617 PolarHBondContact O-N 3.26Å
1618	T	87.3	Confident	76.6	Confident	48 Å²	48	38.4 Å²	38.4	29%	0.294	22%	0.223	S	C	.	.			trans	-104	144.1	170.5	60.8	0	0	0	0	111.8	L1434 P1437 T1463 S1465	L1434-T1618 VanDerWaalsContact O-CA 3.24Å; L1434-T1618 WeakPolarHBondContact O-CA 3.48Å; P1437-T1618 HydrophobicContact CG-CG2 4.09Å; T1463-T1618 WeakPolarHBondContact CB-O 3.47Å; T1463-T1618 PolarHBondContact OG1-O 2.87Å; S1465-T1618 PolarHBondContact OG-N 2.84Å; S1465-T1618 PolarHBondContact OG-O 3.02Å; S1465-T1618 PolarHBondContact OG-OG1 3.29Å; S1465-T1618 VanDerWaalsContact OG-OG1 3.12Å
1619	G	88.7	Confident	76.3	Confident	18 Å²	18	42.4 Å²	42.4	19%	0.186	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.7	-158	-177.4	0	0	0	0	0	114.7	S1433 L1434 A1462	S1433-G1619 WeakPolarHBondContact CA-O 3.31Å; S1433-G1619 PolarHBondContact OG-O 2.82Å; L1434-G1619 PolarHBondContact N-O 3.13Å; L1434-G1619 PolarHBondContact O-N 3.28Å; A1462-G1619 CarbonylContact O-C 3.37Å; A1462-G1619 WeakPolarHBondContact O-CA 3.46Å
1620	C	90.3	Very high	76.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.007	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.6	165	-165.2	0	0	0	0	111	I1432 I1461 A1462 F1525 C1672	I1432-C1620 WeakPolarHBondContact O-CA 3.29Å; I1432-C1620 PolarHBondContact O-SG 2.62Å; I1461-C1620 WeakPolarHBondContact CA-O 3.5Å; A1462-C1620 PolarHBondContact N-O 2.69Å; A1462-C1620 PolarHBondContact O-N 3.37Å; F1525-C1620 HydrophobicContact CE1-CB 4.29Å; F1525-C1620 HydrophobicContact CZ-CB 4.25Å; C1620-C1672 HydrophobicContact CB-CB 3.68Å; C1620-C1672 WeakPolarHBondContact CB-SG 3.46Å; C1620-C1672 WeakPolarHBondContact SG-CA 3.5Å; C1620-C1672 WeakPolarHBondContact SG-CB 3.49Å; C1620-C1672 CovalentContact SG-SG 2.03Å; C1620-C1672 PolarHBondContact SG-SG 3.24Å
1621	I	91.2	Very high	77.1	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.8	171.6	-63.1	178.6	0	0	0	108.5	A1431 I1432 L1434 F1459 E1460 I1461 F1594 V1624 F1633	A1431-I1621 WeakPolarHBondContact CA-O 3.23Å; I1432-I1621 HydrophobicContact CG1-CB 4.43Å; I1432-I1621 PolarHBondContact N-O 3.33Å; I1432-I1621 PolarHBondContact O-N 2.04Å; L1434-I1621 HydrophobicContact CD1-CD1 3.78Å; L1434-I1621 HydrophobicContact CD1-CG1 4.15Å; F1459-I1621 HydrophobicContact CD2-CG2 4.33Å; E1460-I1621 WeakPolarHBondContact O-CA 3.49Å; I1461-I1621 HydrophobicContact CB-CG1 4.41Å; I1461-I1621 HydrophobicContact CD1-CD1 4.35Å; I1461-I1621 HydrophobicContact CD1-CG1 4.01Å; I1461-I1621 HydrophobicContact CG1-CG1 3.93Å; F1594-I1621 HydrophobicContact CB-CD1 4.02Å; F1594-I1621 HydrophobicContact CD1-CD1 4.44Å; I1621-V1624 HydrophobicContact CG2-CG2 3.51Å; I1621-F1633 HydrophobicContact CG2-CZ 4.45Å
1622	R	90.9	Very high	77.8	Confident	75 Å²	75	41.5 Å²	41.5	28%	0.283	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	169.4	176.1	72.5	-177.2	-168.1	-168.8	1.2	112.2	F1430 A1431 E1460 F1525 V1624	F1430-R1622 WeakPolarHBondContact O-CA 3.48Å; A1431-R1622 HydrophobicContact CB-CB 3.53Å; E1460-R1622 HydrophobicContact CB-CG 3.78Å; E1460-R1622 PolarHBondContact N-O 3.15Å; E1460-R1622 PolarHBondContact O-N 3.32Å; E1460-R1622 IonicContact OE2-CZ 2.69Å; E1460-R1622 IonicContact OE2-NE 2.85Å; E1460-R1622 PolarHBondContact OE2-NE 2.85Å; E1460-R1622 IonicContact OE2-NH2 3.65Å; E1460-R1622 PolarHBondContact OE2-NH2 3.41Å; F1525-R1622 HydrophobicContact CD1-CG 4.21Å; F1525-R1622 HydrophobicContact CE1-CG 3.94Å; F1525-R1622 VanDerWaalsContact CE2-NH1 3.3Å; R1622-V1624 PolarHBondContact O-N 2.96Å; R1622-V1624 VanDerWaalsContact O-N 3.12Å
1623	N	85.5	Confident	78.6	Confident	41 Å²	41	37.3 Å²	37.3	22%	0.219	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.5	33	173.3	-64.5	-14.6	0	0	0	113.6	F1430 E1460 Q1625	F1430-N1623 VanDerWaalsContact CD2-OD1 3.32Å; F1430-N1623 WeakPolarHBondContact CD2-OD1 3.37Å; F1430-N1623 PolarHBondContact O-N 3.17Å; F1430-N1623 VanDerWaalsContact O-N 3.07Å; E1460-N1623 PolarHBondContact OE1-ND2 2.86Å; E1460-N1623 PolarHBondContact OE2-ND2 3.17Å; N1623-Q1625 PolarHBondContact O-N 2.95Å
1624	V	86.9	Confident	79	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	125.6	177.4	-179.2	0	0	0	0	109.2	I1443 S1458 F1459 F1594 I1621 R1622 M1630 I1631 F1633	I1443-V1624 HydrophobicContact CD1-CG1 4Å; S1458-V1624 CarbonylContact O-C 3.39Å; S1458-V1624 WeakPolarHBondContact O-CA 3.03Å; F1459-V1624 HydrophobicContact CB-CB 4.38Å; F1459-V1624 HydrophobicContact CB-CG2 3.82Å; F1594-V1624 HydrophobicContact CE1-CG1 4.15Å; F1594-V1624 HydrophobicContact CE1-CG2 4.44Å; F1594-V1624 HydrophobicContact CE2-CG1 4.35Å; F1594-V1624 HydrophobicContact CZ-CG1 3.75Å; I1621-V1624 HydrophobicContact CG2-CG2 3.51Å; R1622-V1624 PolarHBondContact O-N 2.96Å; R1622-V1624 VanDerWaalsContact O-N 3.12Å; V1624-M1630 CarbonylContact O-C 3.22Å; V1624-M1630 WeakPolarHBondContact O-CA 3.45Å; V1624-I1631 HydrophobicContact CB-CB 4.37Å; V1624-I1631 HydrophobicContact CB-CG1 4.44Å; V1624-I1631 HydrophobicContact CG1-CB 4.38Å; V1624-I1631 HydrophobicContact CG1-CG1 3.97Å; V1624-I1631 PolarHBondContact O-N 3.38Å; V1624-F1633 HydrophobicContact CB-CZ 4.21Å; V1624-F1633 HydrophobicContact CG2-CE1 4.36Å; V1624-F1633 HydrophobicContact CG2-CE2 4.36Å; V1624-F1633 HydrophobicContact CG2-CZ 3.57Å
1625	Q	86	Confident	78.9	Confident	64 Å²	64	37.2 Å²	37.2	30%	0.299	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	133.5	178.3	-67.7	177.3	6.6	0	0	110.3	I1457 S1458 N1623 R1629 M1630	I1457-Q1625 WeakPolarHBondContact CA-O 3.48Å; S1458-Q1625 PolarHBondContact N-O 3.34Å; S1458-Q1625 PolarHBondContact O-N 3.42Å; N1623-Q1625 PolarHBondContact O-N 2.95Å; Q1625-R1629 CarbonylContact C-O 3.09Å; Q1625-R1629 WeakPolarHBondContact CA-O 3.13Å; Q1625-M1630 HydrophobicContact CG-CB 4.29Å
1626	I	79.4	Confident	78.5	Confident	9 Å²	9	36.7 Å²	36.7	5%	0.046	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.6	173	-56.3	177.8	0	0	0	107.8	I1443 L1451 T1456 L1592 G1628 R1629 I1631	I1443-I1626 HydrophobicContact CG2-CD1 3.87Å; L1451-I1626 HydrophobicContact CD2-CG2 4.44Å; T1456-I1626 WeakPolarHBondContact O-CA 3.29Å; L1592-I1626 HydrophobicContact CD2-CD1 3.85Å; I1626-G1628 PolarHBondContact O-N 2.93Å; I1626-R1629 PolarHBondContact N-O 2.96Å; I1626-R1629 PolarHBondContact O-N 3.48Å; I1626-I1631 HydrophobicContact CD1-CD1 4.19Å; I1626-I1631 HydrophobicContact CD1-CG1 4.35Å; I1626-I1631 HydrophobicContact CG1-CD1 4.32Å; I1626-I1631 HydrophobicContact CG1-CG1 4.33Å
1627	N	72.8	Confident	77.6	Confident	73 Å²	73	38.3 Å²	38.3	39%	0.39	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	40.6	-172.7	-65.1	-19.1	0	0	0	112.9	G1455 T1456 R1629	G1455-N1627 WeakPolarHBondContact CA-OD1 3.32Å; T1456-N1627 PolarHBondContact N-OD1 3.15Å; T1456-N1627 PolarHBondContact O-N 3.32Å; T1456-N1627 WeakPolarHBondContact OG1-CA 3.31Å; N1627-R1629 VanDerWaalsContact C-N 3.26Å; N1627-R1629 PolarHBondContact O-N 3.3Å
1628	G	68.4	Low	75.3	Confident	43 Å²	43	42.6 Å²	42.6	44%	0.443	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	-4.4	-179.4	0	0	0	0	0	116	I1626	I1626-G1628 PolarHBondContact O-N 2.93Å
1629	R	68.9	Low	72.8	Confident	100 Å²	100	42.9 Å²	42.9	38%	0.377	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.7	172	-72.4	-179.9	164.1	-103.3	-12.4	110.1	N1328 Q1625 I1626 N1627	N1328-R1629 PolarHBondContact O-NH1 3.21Å; N1328-R1629 PolarHBondContact O-NH2 3Å; N1328-R1629 PolarHBondContact OD1-NH2 3.34Å; Q1625-R1629 CarbonylContact C-O 3.09Å; Q1625-R1629 WeakPolarHBondContact CA-O 3.13Å; I1626-R1629 PolarHBondContact N-O 2.96Å; I1626-R1629 PolarHBondContact O-N 3.48Å; N1627-R1629 VanDerWaalsContact C-N 3.26Å; N1627-R1629 PolarHBondContact O-N 3.3Å
1630	M	77	Confident	70.5	Confident	103 Å²	103	46.1 Å²	46.1	51%	0.507	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.2	171.7	-166.1	179.7	-61.8	0	0	110.2	F1430 V1624 Q1625	F1430-M1630 HydrophobicContact CB-SD 4.23Å; V1624-M1630 CarbonylContact O-C 3.22Å; V1624-M1630 WeakPolarHBondContact O-CA 3.45Å; Q1625-M1630 HydrophobicContact CG-CB 4.29Å
1631	I	78.2	Confident	68	Low	22 Å²	22	46.5 Å²	46.5	11%	0.113	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-95	118.5	177.2	-55.1	-59.6	0	0	0	109.4	I1443 V1624 I1626 F1633	I1443-I1631 HydrophobicContact CD1-CG1 4.41Å; I1443-I1631 HydrophobicContact CD1-CG2 4.08Å; I1443-I1631 HydrophobicContact CG2-CD1 4.35Å; I1443-I1631 HydrophobicContact CG2-CG1 4.49Å; I1443-I1631 HydrophobicContact CG2-CG2 4.43Å; V1624-I1631 HydrophobicContact CB-CB 4.37Å; V1624-I1631 HydrophobicContact CB-CG1 4.44Å; V1624-I1631 HydrophobicContact CG1-CB 4.38Å; V1624-I1631 HydrophobicContact CG1-CG1 3.97Å; V1624-I1631 PolarHBondContact O-N 3.38Å; I1626-I1631 HydrophobicContact CD1-CD1 4.19Å; I1626-I1631 HydrophobicContact CD1-CG1 4.35Å; I1626-I1631 HydrophobicContact CG1-CD1 4.32Å; I1626-I1631 HydrophobicContact CG1-CG1 4.33Å; I1631-F1633 PolarHBondContact O-N 3.12Å
1632	D	76.4	Confident	65.5	Low	25 Å²	25	50.2 Å²	50.2	13%	0.134	29%	0.289	C	S	.	.			trans	-78.9	110.6	164.4	170.3	25.2	0	0	0	109.3	L1429 A1634 R1635	L1429-D1632 PolarHBondContact N-OD1 3.23Å; D1632-A1634 PolarHBondContact O-N 2.93Å; D1632-A1634 WeakPolarHBondContact OD1-CB 3.48Å; D1632-A1634 PolarHBondContact OD1-N 3.16Å; D1632-R1635 WeakPolarHBondContact OD2-CD 3.29Å; D1632-R1635 VanDerWaalsContact OD2-CG 3.31Å; D1632-R1635 WeakPolarHBondContact OD2-CG 3.08Å; D1632-R1635 IonicContact OD2-CZ 2.71Å; D1632-R1635 IonicContact OD2-NE 3.66Å; D1632-R1635 PolarHBondContact OD2-NE 3.1Å; D1632-R1635 IonicContact OD2-NH2 2.7Å
1633	F	73.6	Confident	62.8	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-66.3	-25.9	179	-67.3	-71.7	0	0	0	112.4	L1429 I1432 V1441 I1443 I1621 V1624 I1631 R1635 L1636 F1637	L1429-F1633 HydrophobicContact CB-CB 4.33Å; L1429-F1633 HydrophobicContact CD2-CB 3.97Å; L1429-F1633 HydrophobicContact CG-CB 4.02Å; L1429-F1633 WeakPolarHBondContact O-CB 3.33Å; L1429-F1633 WeakPolarHBondContact O-CD2 3.45Å; L1429-F1633 PolarHBondContact O-N 2.84Å; I1432-F1633 HydrophobicContact CD1-CD1 3.79Å; I1432-F1633 HydrophobicContact CD1-CD2 4.48Å; I1432-F1633 HydrophobicContact CD1-CE1 3.47Å; I1432-F1633 VanDerWaalsContact CD1-CE1 3.47Å; I1432-F1633 HydrophobicContact CD1-CE2 4.21Å; I1432-F1633 HydrophobicContact CD1-CG 4.28Å; I1432-F1633 HydrophobicContact CD1-CZ 3.68Å; I1432-F1633 HydrophobicContact CG1-CD1 4.3Å; I1432-F1633 HydrophobicContact CG1-CD2 4.09Å; I1432-F1633 HydrophobicContact CG1-CE1 3.97Å; I1432-F1633 HydrophobicContact CG1-CE2 3.74Å; I1432-F1633 HydrophobicContact CG1-CG 4.35Å; I1432-F1633 HydrophobicContact CG1-CZ 3.66Å; I1432-F1633 HydrophobicContact CG2-CB 4.04Å; I1432-F1633 HydrophobicContact CG2-CD1 4.42Å; I1432-F1633 HydrophobicContact CG2-CD2 3.82Å; I1432-F1633 HydrophobicContact CG2-CE2 4.33Å; I1432-F1633 HydrophobicContact CG2-CG 3.86Å; V1441-F1633 HydrophobicContact CG1-CE1 4.21Å; V1441-F1633 HydrophobicContact CG2-CD1 4.19Å; V1441-F1633 HydrophobicContact CG2-CE1 4.37Å; I1443-F1633 HydrophobicContact CD1-CE1 4.28Å; I1621-F1633 HydrophobicContact CG2-CZ 4.45Å; V1624-F1633 HydrophobicContact CB-CZ 4.21Å; V1624-F1633 HydrophobicContact CG2-CE1 4.36Å; V1624-F1633 HydrophobicContact CG2-CE2 4.36Å; V1624-F1633 HydrophobicContact CG2-CZ 3.57Å; I1631-F1633 PolarHBondContact O-N 3.12Å; F1633-R1635 PolarHBondContact O-N 3.07Å; F1633-R1635 VanDerWaalsContact O-N 3.14Å; F1633-L1636 HydrophobicContact CD1-CD1 4Å; F1633-L1636 WeakPolarHBondContact O-CB 3.43Å; F1633-L1636 PolarHBondContact O-N 3.3Å; F1633-F1637 HydrophobicContact CB-CE2 4.32Å; F1633-F1637 WeakPolarHBondContact O-CD2 3.02Å; F1633-F1637 VanDerWaalsContact O-CE2 3.32Å; F1633-F1637 WeakPolarHBondContact O-CE2 3.4Å
1634	A	65.9	Low	60.4	Low	19 Å²	19	55.8 Å²	55.8	16%	0.157	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-57.7	-35.1	-174.6	0	0	0	0	0	111.7	L1429 D1632 L1636 F1637	L1429-A1634 HydrophobicContact CB-CB 3.9Å; D1632-A1634 PolarHBondContact O-N 2.93Å; D1632-A1634 WeakPolarHBondContact OD1-CB 3.48Å; D1632-A1634 PolarHBondContact OD1-N 3.16Å; A1634-L1636 VanDerWaalsContact C-N 3.31Å; A1634-L1636 PolarHBondContact O-N 3.15Å; A1634-F1637 PolarHBondContact O-N 3.01Å; A1634-F1637 VanDerWaalsContact O-O 3.06Å
1635	R	60.8	Low	57.7	Low	95 Å²	95	60.9 Å²	60.9	36%	0.358	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-75.7	-13.5	-178.7	-64.1	171.7	-162.2	-164.9	21.3	115	E1329 D1632 F1633 F1637	E1329-R1635 IonicContact OE1-CZ 3.88Å; E1329-R1635 IonicContact OE1-NH1 3.52Å; E1329-R1635 PolarHBondContact OE1-NH1 3.09Å; E1329-R1635 IonicContact OE1-NH2 2.72Å; E1329-R1635 PolarHBondContact OE1-NH2 2.96Å; E1329-R1635 IonicContact OE2-NH1 3.78Å; D1632-R1635 WeakPolarHBondContact OD2-CD 3.29Å; D1632-R1635 VanDerWaalsContact OD2-CG 3.31Å; D1632-R1635 WeakPolarHBondContact OD2-CG 3.08Å; D1632-R1635 IonicContact OD2-CZ 2.71Å; D1632-R1635 IonicContact OD2-NE 3.66Å; D1632-R1635 PolarHBondContact OD2-NE 3.1Å; D1632-R1635 IonicContact OD2-NH2 2.7Å; F1633-R1635 PolarHBondContact O-N 3.07Å; F1633-R1635 VanDerWaalsContact O-N 3.14Å; R1635-F1637 VanDerWaalsContact C-N 3.29Å
1636	L	59	Low	54.8	Low	31 Å²	31	64.1 Å²	64.1	16%	0.162	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-77.6	-22.4	172.9	-56.9	173.5	0	0	0	111	V1441 I1443 F1633 A1634 T1664	V1441-L1636 HydrophobicContact CG2-CD1 3.48Å; V1441-L1636 VanDerWaalsContact CG2-CD1 3.48Å; I1443-L1636 HydrophobicContact CG1-CD1 3.88Å; F1633-L1636 HydrophobicContact CD1-CD1 4Å; F1633-L1636 WeakPolarHBondContact O-CB 3.43Å; F1633-L1636 PolarHBondContact O-N 3.3Å; A1634-L1636 VanDerWaalsContact C-N 3.31Å; A1634-L1636 PolarHBondContact O-N 3.15Å; L1636-T1664 WeakPolarHBondContact O-CB 3.46Å; L1636-T1664 PolarHBondContact O-OG1 2.87Å
1637	F	54.4	Low	52.2	Low	34 Å²	34	67.7 Å²	67.7	15%	0.149	40%	0.396	C	S	.	.	S	Bend	trans	-91.4	115.3	171.2	-50	-83	0	0	0	109	L1429 F1633 A1634 R1635 A1639 M1644 A1665 I1668	L1429-F1637 HydrophobicContact CD2-CE2 4.17Å; F1633-F1637 HydrophobicContact CB-CE2 4.32Å; F1633-F1637 WeakPolarHBondContact O-CD2 3.02Å; F1633-F1637 VanDerWaalsContact O-CE2 3.32Å; F1633-F1637 WeakPolarHBondContact O-CE2 3.4Å; A1634-F1637 PolarHBondContact O-N 3.01Å; A1634-F1637 VanDerWaalsContact O-O 3.06Å; R1635-F1637 VanDerWaalsContact C-N 3.29Å; F1637-A1639 PolarHBondContact O-N 3.06Å; F1637-M1644 HydrophobicContact CD1-CE 4.44Å; F1637-M1644 HydrophobicContact CD1-SD 4.04Å; F1637-M1644 HydrophobicContact CE1-CE 4Å; F1637-M1644 HydrophobicContact CE1-SD 4.17Å; F1637-M1644 HydrophobicContact CG-SD 4.38Å; F1637-M1644 HydrophobicContact CZ-CE 4.41Å; F1637-A1665 HydrophobicContact CD1-CB 4.05Å; F1637-A1665 HydrophobicContact CE1-CB 3.42Å; F1637-A1665 VanDerWaalsContact CE1-CB 3.42Å; F1637-A1665 HydrophobicContact CZ-CB 4.02Å; F1637-I1668 HydrophobicContact CZ-CB 4.27Å; F1637-I1668 HydrophobicContact CZ-CD1 4.21Å; F1637-I1668 HydrophobicContact CZ-CG2 4.38Å
1638	G	39.5	Very low	49.9	Very low	91 Å²	91	73.1 Å²	73.1	94%	0.938	42%	0.419	S	S	*	.	S	Bend	trans	-71.7	20.4	-178.2	0	0	0	0	0	115.7
1639	A	34.9	Very low	47.8	Very low	54 Å²	54	80.1 Å²	80.1	45%	0.446	44%	0.44	S	S	.	.	S	Bend	trans	-152.2	152	-173.1	0	0	0	0	0	110.8	F1637	F1637-A1639 PolarHBondContact O-N 3.06Å
1640	P	39.5	Very low	45.9	Very low	86 Å²	86	83.3 Å²	83.3	56%	0.558	46%	0.459	S	S	*	.			trans	-63.4	142.1	177.5	26.4	-34.7	0	0	0	112.2	D1642 K1643	P1640-D1642 PolarHBondContact O-N 2.84Å; P1640-D1642 VanDerWaalsContact O-N 3.15Å; P1640-K1643 PolarHBondContact O-N 2.82Å
1641	V	39.1	Very low	43.5	Very low	10 Å²	10	86.1 Å²	86.1	6%	0.061	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-65.1	-21.5	-168.3	-170.4	0	0	0	0	113.2	F1421 K1643 M1644 P1670	F1421-V1641 HydrophobicContact CE1-CG2 4.45Å; F1421-V1641 HydrophobicContact CZ-CG1 4.16Å; V1641-K1643 PolarHBondContact O-N 3.2Å; V1641-M1644 HydrophobicContact CG1-SD 4.35Å; V1641-M1644 WeakPolarHBondContact O-CB 3.31Å; V1641-M1644 PolarHBondContact O-N 3.31Å; V1641-P1670 HydrophobicContact CG1-CB 4.44Å; V1641-P1670 HydrophobicContact CG1-CG 3.56Å
1642	D	38.3	Very low	41.1	Very low	78 Å²	78	92.7 Å²	92.7	42%	0.417	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-53.2	-26.7	175.6	-54.6	-60.4	0	0	0	113.2	N1402 P1640 M1644	N1402-D1642 PolarHBondContact ND2-OD1 3.42Å; P1640-D1642 PolarHBondContact O-N 2.84Å; P1640-D1642 VanDerWaalsContact O-N 3.15Å; D1642-M1644 VanDerWaalsContact C-N 3.31Å; D1642-M1644 PolarHBondContact O-N 2.66Å
1643	K	33.9	Very low	38.8	Very low	171 Å²	171	96.6 Å²	96.6	74%	0.743	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-74.8	-12.3	175.8	-72.9	-164.3	171.4	-166.9	0	115.1	P1640 V1641	P1640-K1643 PolarHBondContact O-N 2.82Å; V1641-K1643 PolarHBondContact O-N 3.2Å
1644	M	35.1	Very low	36.6	Very low	62 Å²	62	102.1 Å²	102.1	31%	0.305	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-89.8	-8.7	177.6	-65.3	177.8	67.1	0	0	113.3	F1637 V1641 D1642 V1646 I1668	F1637-M1644 HydrophobicContact CD1-CE 4.44Å; F1637-M1644 HydrophobicContact CD1-SD 4.04Å; F1637-M1644 HydrophobicContact CE1-CE 4Å; F1637-M1644 HydrophobicContact CE1-SD 4.17Å; F1637-M1644 HydrophobicContact CG-SD 4.38Å; F1637-M1644 HydrophobicContact CZ-CE 4.41Å; V1641-M1644 HydrophobicContact CG1-SD 4.35Å; V1641-M1644 WeakPolarHBondContact O-CB 3.31Å; V1641-M1644 PolarHBondContact O-N 3.31Å; D1642-M1644 VanDerWaalsContact C-N 3.31Å; D1642-M1644 PolarHBondContact O-N 2.66Å; M1644-V1646 VanDerWaalsContact C-N 3.34Å; M1644-I1668 WeakPolarHBondContact CE-O 3.4Å
1645	I	29.6	Very low	34.8	Very low	109 Å²	109	105.3 Å²	105.3	56%	0.559	59%	0.59	S	S	*	*	S	Bend	trans	-84.4	-11.6	-175.5	-58.9	177.8	0	0	0	111.9
1646	V	26	Very low	33.2	Very low	132 Å²	132	103 Å²	103	80%	0.8	59%	0.589	S	S	*	*			trans	-111.4	70.8	-178.3	-167.7	0	0	0	0	111	M1644	M1644-V1646 VanDerWaalsContact C-N 3.34Å
1647	A	23.9	Very low	31.8	Very low	83 Å²	83	106.6 Å²	106.6	69%	0.686	61%	0.614	S	S	*	*			trans	-144.6	110.9	163	0	0	0	0	0	108.1
1648	E	25.3	Very low	30.4	Very low	187 Å²	187	112.5 Å²	112.5	87%	0.874	64%	0.642	S	S	*	*			trans	-74.5	161.3	172.2	-62.4	179.8	147.3	0	0	109.4	H1650	E1648-H1650 PolarHBondContact O-N 3.48Å
1649	E	25.2	Very low	29.8	Very low	190 Å²	190	110.9 Å²	110.9	89%	0.888	62%	0.62	S	S	*	*	S	Bend	trans	-73.1	26.3	-160.6	-70.8	-175.7	132.8	0	0	116.7
1650	H	27.8	Very low	29.6	Very low	168 Å²	168	117 Å²	117	78%	0.778	64%	0.636	S	S	*	*	S	Bend	trans	-130.6	151.5	178	-62.5	-40.1	0	0	0	112.4	E1648	E1648-H1650 PolarHBondContact O-N 3.48Å
1651	D	27.5	Very low	29.2	Very low	161 Å²	161	120.8 Å²	120.8	86%	0.861	65%	0.646	S	S	*	*			trans	65.9	55.6	172	-56	-17.1	0	0	0	118.6	D1653	D1651-D1653 PolarHBondContact O-N 2.79Å
1652	I	28	Very low	28.9	Very low	160 Å²	160	127.7 Å²	127.7	82%	0.821	68%	0.677	S	S	*	*			trans	-89.2	80.1	152.8	-54.6	-178.7	0	0	0	109.1	S1654	I1652-S1654 PolarHBondContact O-N 3.04Å
1653	D	27.4	Very low	29.1	Very low	108 Å²	108	126 Å²	126	58%	0.578	68%	0.678	S	S	*	*			trans	-74.8	114.3	173	-174.4	-13.4	0	0	0	110.8	D1651 S1655	D1651-D1653 PolarHBondContact O-N 2.79Å; D1653-S1655 PolarHBondContact O-N 3.3Å; D1653-S1655 WeakPolarHBondContact OD1-CB 3.44Å; D1653-S1655 PolarHBondContact OD1-N 2.03Å; D1653-S1655 PolarHBondContact OD1-OG 3.28Å; D1653-S1655 PolarHBondContact OD2-OG 2.85Å; D1653-S1655 VanDerWaalsContact OD2-OG 3.05Å
1654	S	28.6	Very low	30.1	Very low	116 Å²	116	120.8 Å²	120.8	81%	0.811	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-5	-179.6	62.3	0	0	0	0	114.6	I1652	I1652-S1654 PolarHBondContact O-N 3.04Å
1655	S	27.6	Very low	31.1	Very low	86 Å²	86	118.8 Å²	118.8	60%	0.601	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-13.2	-177.4	74.7	0	0	0	0	115.1	D1653	D1653-S1655 PolarHBondContact O-N 3.3Å; D1653-S1655 WeakPolarHBondContact OD1-CB 3.44Å; D1653-S1655 PolarHBondContact OD1-N 2.03Å; D1653-S1655 PolarHBondContact OD1-OG 3.28Å; D1653-S1655 PolarHBondContact OD2-OG 2.85Å; D1653-S1655 VanDerWaalsContact OD2-OG 3.05Å
1656	S	27.8	Very low	32.9	Very low	47 Å²	47	117 Å²	117	33%	0.329	65%	0.645	S	S	.	*			trans	-60.7	128.3	-178	178.8	0	0	0	0	112.7	E1658 A1659	S1656-E1658 PolarHBondContact O-N 2.94Å; S1656-E1658 VanDerWaalsContact O-N 3.16Å; S1656-E1658 PolarHBondContact OG-N 3.03Å; S1656-A1659 PolarHBondContact O-N 3.23Å
1657	P	28	Very low	35	Very low	105 Å²	105	112.3 Å²	112.3	68%	0.682	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-58.9	-26.5	176.9	-25.9	35.2	0	0	0	114.5	A1659 K1660	P1657-A1659 VanDerWaalsContact C-N 3.27Å; P1657-A1659 PolarHBondContact O-N 3.21Å; P1657-K1660 WeakPolarHBondContact O-CB 3.3Å; P1657-K1660 PolarHBondContact O-N 3.08Å; P1657-K1660 VanDerWaalsContact O-N 3.14Å
1658	E	25	Very low	37.6	Very low	158 Å²	158	108.8 Å²	108.8	74%	0.738	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-68.5	-27.3	-175.3	-61.2	-178.4	135.1	0	0	112.2	S1656 K1660 H1661	S1656-E1658 PolarHBondContact O-N 2.94Å; S1656-E1658 VanDerWaalsContact O-N 3.16Å; S1656-E1658 PolarHBondContact OG-N 3.03Å; E1658-K1660 PolarHBondContact O-N 2.85Å; E1658-H1661 PolarHBondContact O-N 3.1Å
1659	A	28.3	Very low	40.1	Very low	58 Å²	58	103.6 Å²	103.6	48%	0.479	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-62.2	-26.7	173.6	0	0	0	0	0	112.9	S1656 P1657 H1661	S1656-A1659 PolarHBondContact O-N 3.23Å; P1657-A1659 VanDerWaalsContact C-N 3.27Å; P1657-A1659 PolarHBondContact O-N 3.21Å; A1659-H1661 PolarHBondContact O-N 3.43Å; A1659-H1661 VanDerWaalsContact O-N 3.15Å
1660	K	30.4	Very low	42.4	Very low	182 Å²	182	96.5 Å²	96.5	79%	0.791	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-75.2	1.5	-175.9	-66.9	-171.7	175	178.1	0	114.7	P1657 E1658	P1657-K1660 WeakPolarHBondContact O-CB 3.3Å; P1657-K1660 PolarHBondContact O-N 3.08Å; P1657-K1660 VanDerWaalsContact O-N 3.14Å; E1658-K1660 PolarHBondContact O-N 2.85Å
1661	H	31.5	Very low	44.8	Very low	165 Å²	165	88.6 Å²	88.6	76%	0.764	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-122.7	3.9	-178.6	-73.9	-4.8	0	0	0	115.4	E1658 A1659	E1658-H1661 PolarHBondContact O-N 3.1Å; A1659-H1661 PolarHBondContact O-N 3.43Å; A1659-H1661 VanDerWaalsContact O-N 3.15Å
1662	H	32.7	Very low	47.1	Very low	155 Å²	155	82.3 Å²	82.3	72%	0.718	47%	0.474	S	S	*	.			trans	-134.2	37	-177	-66.8	-69.8	0	0	0	114.6	T1664	H1662-T1664 PolarHBondContact O-N 2.67Å
1663	G	40.9	Very low	48.7	Very low	42 Å²	42	85 Å²	85	43%	0.433	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	41.5	-167.2	0	0	0	0	0	119.1
1664	T	56.1	Low	49.8	Very low	62 Å²	62	83.5 Å²	83.5	38%	0.38	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-25.2	172.4	45.6	0	0	0	0	114.1	A1442 L1636 H1662	A1442-T1664 WeakPolarHBondContact CB-O 3.48Å; A1442-T1664 PolarHBondContact N-O 3.13Å; L1636-T1664 WeakPolarHBondContact O-CB 3.46Å; L1636-T1664 PolarHBondContact O-OG1 2.87Å; H1662-T1664 PolarHBondContact O-N 2.67Å
1665	A	54.9	Low	50.2	Low	21 Å²	21	82.2 Å²	82.2	17%	0.174	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	140.6	178	0	0	0	0	0	110.3	Y1440 F1637 I1668	Y1440-A1665 WeakPolarHBondContact O-CA 3.14Å; F1637-A1665 HydrophobicContact CD1-CB 4.05Å; F1637-A1665 HydrophobicContact CE1-CB 3.42Å; F1637-A1665 VanDerWaalsContact CE1-CB 3.42Å; F1637-A1665 HydrophobicContact CZ-CB 4.02Å; A1665-I1668 HydrophobicContact CB-CD1 3.61Å; A1665-I1668 HydrophobicContact CB-CG1 4.25Å
1666	I	68.2	Low	50.5	Low	70 Å²	70	85.5 Å²	85.5	36%	0.359	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.6	174.8	-63.3	-169.3	0	0	0	109.5	S1439 Y1440 I1668	S1439-I1666 VanDerWaalsContact CA-O 3.23Å; S1439-I1666 WeakPolarHBondContact CA-O 3.28Å; Y1440-I1666 HydrophobicContact CD1-CB 4.31Å; Y1440-I1666 HydrophobicContact CE1-CB 4.01Å; Y1440-I1666 HydrophobicContact CE1-CD1 3.78Å; Y1440-I1666 HydrophobicContact CE1-CG1 4Å; Y1440-I1666 PolarHBondContact N-O 2.93Å; Y1440-I1666 VanDerWaalsContact N-O 3.08Å; Y1440-I1666 PolarHBondContact O-N 3.21Å; Y1440-I1666 WeakPolarHBondContact OH-CD1 3.35Å; I1666-I1668 VanDerWaalsContact C-N 3.32Å; I1666-I1668 WeakPolarHBondContact O-CG1 3.23Å; I1666-I1668 PolarHBondContact O-N 3.48Å
1667	G	70.2	Confident	50.5	Low	35 Å²	35	90.4 Å²	90.4	36%	0.361	49%	0.485	S	S	.	.	S	Bend	trans	65.9	21.5	168.8	0	0	0	0	0	116.3	P1435 S1439	P1435-G1667 WeakPolarHBondContact CD-O 3.21Å; P1435-G1667 WeakPolarHBondContact CG-O 3.03Å; S1439-G1667 PolarHBondContact OG-O 3.04Å
1668	I	78.8	Confident	50.2	Low	8 Å²	8	94.9 Å²	94.9	4%	0.041	49%	0.494	C	S	.	.			trans	-93.1	143.7	-173.7	-47.2	-171.4	0	0	0	111.6	I1432 V1441 F1637 M1644 A1665 I1666	I1432-I1668 HydrophobicContact CB-CG2 3.55Å; I1432-I1668 HydrophobicContact CD1-CD1 4.15Å; I1432-I1668 HydrophobicContact CD1-CG2 3.92Å; I1432-I1668 HydrophobicContact CG1-CG2 4.3Å; I1432-I1668 HydrophobicContact CG2-CG2 3.78Å; V1441-I1668 HydrophobicContact CB-CD1 3.56Å; V1441-I1668 HydrophobicContact CG2-CD1 4.09Å; F1637-I1668 HydrophobicContact CZ-CB 4.27Å; F1637-I1668 HydrophobicContact CZ-CD1 4.21Å; F1637-I1668 HydrophobicContact CZ-CG2 4.38Å; M1644-I1668 WeakPolarHBondContact CE-O 3.4Å; A1665-I1668 HydrophobicContact CB-CD1 3.61Å; A1665-I1668 HydrophobicContact CB-CG1 4.25Å; I1666-I1668 VanDerWaalsContact C-N 3.32Å; I1666-I1668 WeakPolarHBondContact O-CG1 3.23Å; I1666-I1668 PolarHBondContact O-N 3.48Å
1669	L	78.3	Confident	50.1	Low	78 Å²	78	92.4 Å²	92.4	41%	0.408	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.6	168.6	-66.5	173.2	0	0	0	111.8	I1432 S1433 P1435	I1432-L1669 CarbonylContact C-O 3.27Å; I1432-L1669 WeakPolarHBondContact CA-O 3.41Å; S1433-L1669 PolarHBondContact N-O 3.27Å; S1433-L1669 PolarHBondContact O-N 2.81Å; P1435-L1669 HydrophobicContact CB-CD1 4.24Å; P1435-L1669 HydrophobicContact CG-CD1 4.1Å; P1435-L1669 HydrophobicContact CG-CG 4.2Å
1670	P	73.5	Confident	49.7	Very low	42 Å²	42	98.4 Å²	98.4	27%	0.273	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	136.9	172.9	-22.4	33.8	0	0	0	112.9	F1421 L1429 V1641	F1421-P1670 HydrophobicContact CE2-CB 4.1Å; F1421-P1670 HydrophobicContact CZ-CB 4.12Å; L1429-P1670 HydrophobicContact CD1-CB 3.88Å; L1429-P1670 HydrophobicContact CD2-CB 4.31Å; V1641-P1670 HydrophobicContact CG1-CB 4.44Å; V1641-P1670 HydrophobicContact CG1-CG 3.56Å
1671	G	77	Confident	49.3	Very low	2 Å²	2	100.1 Å²	100.1	2%	0.021	52%	0.515	C	S	.	.	B	Isolated β-bridge	trans	75.8	177.3	177	0	0	0	0	0	115.1	K1419 A1431 I1432 S1433	K1419-G1671 VanDerWaalsContact O-CA 3.31Å; K1419-G1671 WeakPolarHBondContact O-CA 3.21Å; A1431-G1671 WeakPolarHBondContact O-CA 3.32Å; A1431-G1671 PolarHBondContact O-N 2.76Å; I1432-G1671 CarbonylContact C-O 3.51Å; S1433-G1671 WeakPolarHBondContact CB-O 3.31Å; S1433-G1671 PolarHBondContact N-O 2.58Å
1672	C	76.8	Confident	48.8	Very low	28 Å²	28	100.2 Å²	100.2	19%	0.189	52%	0.518	C	S	.	.			trans	-104.6	120.9	177.7	-58.9	0	0	0	0	111.7	F1525 C1620	F1525-C1672 HydrophobicContact CZ-CB 4.26Å; F1525-C1672 VanDerWaalsContact CZ-SG 3.58Å; C1620-C1672 HydrophobicContact CB-CB 3.68Å; C1620-C1672 WeakPolarHBondContact CB-SG 3.46Å; C1620-C1672 WeakPolarHBondContact SG-CA 3.5Å; C1620-C1672 WeakPolarHBondContact SG-CB 3.49Å; C1620-C1672 CovalentContact SG-SG 2.03Å; C1620-C1672 PolarHBondContact SG-SG 3.24Å
1673	R	61.8	Low	48.1	Very low	217 Å²	217	102.6 Å²	102.6	82%	0.819	53%	0.529	S	S	*	.			trans	-103.6	85.5	162.8	-75.6	-176.7	172.6	178.1	-1.8	109.5	S1675	R1673-S1675 PolarHBondContact O-N 3.23Å
1674	L	49.5	Very low	47.1	Very low	77 Å²	77	105.2 Å²	105.2	40%	0.403	54%	0.541	S	S	.	.			trans	-74.4	123.3	169.5	-68.9	-178.2	0	0	0	109.7	A1462 F1525 N1676	A1462-L1674 HydrophobicContact CB-CD2 3.83Å; F1525-L1674 HydrophobicContact CD2-CD1 4.27Å; F1525-L1674 HydrophobicContact CE2-CD1 3.59Å; F1525-L1674 HydrophobicContact CE2-CG 4.42Å; F1525-L1674 HydrophobicContact CZ-CD1 4.19Å; L1674-N1676 PolarHBondContact O-N 3.26Å
1675	S	37.4	Very low	45.5	Very low	89 Å²	89	107.1 Å²	107.1	62%	0.622	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	88.6	179.9	44.9	0	0	0	0	111.2	R1673	R1673-S1675 PolarHBondContact O-N 3.23Å
1676	N	34	Very low	43.8	Very low	154 Å²	154	112.3 Å²	112.3	82%	0.824	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.7	-24.7	155.5	-96.3	-13.6	0	0	0	113.2	L1674 K1678	L1674-N1676 PolarHBondContact O-N 3.26Å; N1676-K1678 PolarHBondContact O-N 2.78Å
1677	E	26.5	Very low	41.4	Very low	150 Å²	150	116.8 Å²	116.8	70%	0.701	61%	0.611	S	S	*	*			trans	-72.9	85.2	173.9	-71.7	-179.1	-178.9	0	0	111.7	K1419 S1679	K1419-E1677 IonicContact NZ-OE1 3.87Å; K1419-E1677 IonicContact NZ-OE2 3.78Å; K1419-E1677 PolarHBondContact NZ-OE2 2.71Å; E1677-S1679 PolarHBondContact O-N 3.11Å
1678	K	22.9	Very low	39	Very low	200 Å²	200	124.2 Å²	124.2	87%	0.87	63%	0.634	S	S	*	*			trans	-69.3	107	154.3	-83.7	-172.6	174.4	-177	0	107.8	N1676 E1680	N1676-K1678 PolarHBondContact O-N 2.78Å; K1678-E1680 PolarHBondContact O-N 3.45Å
1679	S	22.1	Very low	36.1	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	67%	0.672	S	S	*	*			trans	-61.9	126.8	176.9	53.7	0	0	0	0	111.5	E1677 Y1681	E1677-S1679 PolarHBondContact O-N 3.11Å; S1679-Y1681 PolarHBondContact O-N 3Å
1680	E	19.6	Very low	33.3	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.864	69%	0.693	S	S	*	*			trans	-68.9	88.5	-178.3	-63.6	168.4	122	0	0	112.2	K1678	K1678-E1680 PolarHBondContact O-N 3.45Å
1681	Y	21.7	Very low	30.7	Very low	218 Å²	218	138.7 Å²	138.7	86%	0.855	72%	0.718	S	S	*	*			trans	-140.9	143.4	155.8	-90.5	-84.3	0	0	0	109.1	S1679	S1679-Y1681 PolarHBondContact O-N 3Å
1682	M	21.8	Very low	28.1	Very low	167 Å²	167	145 Å²	145	82%	0.823	75%	0.751	S	S	*	*			trans	74	75.7	-175.2	-51.6	-168.4	70	0	0	115.9	S1684	M1682-S1684 PolarHBondContact O-N 3.07Å
1683	E	17.9	Very low	25.4	Very low	205 Å²	205	151.3 Å²	151.3	96%	0.958	78%	0.783	S	S	*	*			trans	-63.8	108.2	147.8	-65.6	-178.1	117.9	0	0	109.7
1684	S	19.7	Very low	23.6	Very low	97 Å²	97	149.5 Å²	149.5	68%	0.678	78%	0.784	S	S	*	*			trans	-166.5	62.3	164.6	65.3	0	0	0	0	114.6	M1682	M1682-S1684 PolarHBondContact O-N 3.07Å
1685	A	23.6	Very low	22.1	Very low	101 Å²	101	151.3 Å²	151.3	84%	0.835	80%	0.803	S	S	*	*			trans	-166.3	115.6	156.1	0	0	0	0	0	111.3
1686	V	18.4	Very low	21.4	Very low	131 Å²	131	154.9 Å²	154.9	79%	0.794	81%	0.809	S	S	*	*			trans	-97.9	159.4	163.6	171.7	0	0	0	0	107.9
1687	E	17	Very low	20.7	Very low	164 Å²	164	155.5 Å²	155.5	77%	0.766	81%	0.805	S	S	*	*			trans	67.6	138.8	177.4	-80.4	159.1	-136.3	0	0	115
1688	F	20.5	Very low	20.4	Very low	191 Å²	191	157 Å²	157	84%	0.838	82%	0.817	S	S	*	*			cis	-144.7	165.3	32.3	-139.6	-90.7	0	0	0	112.6
1689	Q	17.3	Very low	20.4	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	81%	0.814	S	S	*	*			trans	-90.6	141.6	173.5	-62.8	174.4	-25.3	0	0	112.5
1690	A	20.8	Very low	20.3	Very low	101 Å²	101	156.1 Å²	156.1	84%	0.835	81%	0.812	S	S	*	*			trans	-156.8	126.5	156.6	0	0	0	0	0	112.2
1691	N	19.4	Very low	20.4	Very low	149 Å²	149	154.5 Å²	154.5	80%	0.797	81%	0.808	S	S	*	*			trans	-89.4	164	176.6	-72.7	-32.4	0	0	0	112.3
1692	N	21.1	Very low	20.3	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	81%	0.806	S	S	*	*			trans	56.6	115.1	151.1	-59.3	-9	0	0	0	118.9
1693	N	21.3	Very low	20.2	Very low	160 Å²	160	150.2 Å²	150.2	86%	0.856	80%	0.803	S	S	*	*				-176.3	129.5	94.5	-88.8	-45.3	0	0	0	111.8
1694	E	22.3	Very low	20.4	Very low	180 Å²	180	147.7 Å²	147.7	84%	0.841	80%	0.796	S	S	*	*			trans	-78.9	179.6	157.9	-73.1	-160.2	126	0	0	111.4
1695	S	19.6	Very low	20.4	Very low	114 Å²	114	147.8 Å²	147.8	80%	0.797	79%	0.792	S	S	*	*			trans	68.5	80.2	163.4	-66.2	0	0	0	0	117.7
1696	Q	21.3	Very low	20.2	Very low	164 Å²	164	149.9 Å²	149.9	77%	0.766	79%	0.789	S	S	*	*			trans	-131.9	106.9	145	-73.3	-148	43.3	0	0	114.6
1697	K	19.6	Very low	20.3	Very low	168 Å²	168	152.7 Å²	152.7	73%	0.73	79%	0.794	S	S	*	*			trans	59.5	84.3	134	-64.2	168.7	-175.7	157	0	118.8	K1699	K1697-K1699 PolarHBondContact O-N 3.33Å
1698	L	20.3	Very low	20.4	Very low	180 Å²	180	154 Å²	154	94%	0.942	80%	0.8	S	S	*	*				-3.5	116.4	115.3	-170.9	86.4	0	0	0	115.1
1699	K	22.5	Very low	20.3	Very low	187 Å²	187	152 Å²	152	81%	0.813	80%	0.797	S	S	*	*			trans	-164.6	126.4	164.2	-119.6	-177.2	-177.1	-172.7	0	113	K1697	K1697-K1699 PolarHBondContact O-N 3.33Å
1700	S	21.3	Very low	20.4	Very low	100 Å²	100	151.3 Å²	151.3	70%	0.699	79%	0.794	S	S	*	*			trans	56.9	144.3	152.7	48.7	0	0	0	0	120.9
1701	I	20.5	Very low	20.2	Very low	151 Å²	151	152.5 Å²	152.5	77%	0.774	79%	0.791	S	S	*	*			cis	-156.8	144.4	-8.8	-111.3	160.2	0	0	0	108.2
1702	N	20.6	Very low	20.3	Very low	151 Å²	151	156.6 Å²	156.6	81%	0.807	80%	0.795	S	S	*	*			trans	32.5	145.3	164.2	-74.2	-0.1	0	0	0	124.3
1703	L	19.1	Very low	20.1	Very low	145 Å²	145	160.2 Å²	160.2	76%	0.759	80%	0.804	S	S	*	*			trans	-63.7	147.1	157.5	-60.3	84.8	0	0	0	111.8
1704	N	21.5	Very low	20.1	Very low	152 Å²	152	156 Å²	156	81%	0.813	79%	0.788	S	S	*	*			trans	-169.7	99.1	131.6	-90.9	-15.9	0	0	0	106.4
1705	T	19.6	Very low	19.9	Very low	98 Å²	98	157 Å²	157	60%	0.601	79%	0.792	S	S	*	*				52.3	109.5	92.5	63.7	0	0	0	0	114.9
1706	N	20.4	Very low	20	Very low	145 Å²	145	156.4 Å²	156.4	78%	0.775	79%	0.788	S	S	*	*			trans	44.9	117	136.1	-49.4	-15.8	0	0	0	119
1707	Q	19.9	Very low	19.9	Very low	191 Å²	191	157.1 Å²	157.1	89%	0.893	80%	0.797	S	S	*	*				-165.6	166.5	116	-106.8	156.3	2.7	0	0	113.1
1708	E	19.5	Very low	20.1	Very low	191 Å²	191	158.5 Å²	158.5	89%	0.893	80%	0.803	S	S	*	*			trans	65.1	72.2	172.7	-62.3	-174.2	170.3	0	0	117.6
1709	L	18.7	Very low	20.2	Very low	150 Å²	150	157.7 Å²	157.7	79%	0.785	80%	0.797	S	S	*	*			trans	-54.6	157.3	137	-88.5	76.8	0	0	0	110.8
1710	E	18.6	Very low	20.1	Very low	165 Å²	165	152 Å²	152	77%	0.771	79%	0.792	S	S	*	*			trans	46.3	103.5	155.8	-66.2	-172.4	-159.3	0	0	118.8
1711	T	18.2	Very low	20	Very low	126 Å²	126	155.1 Å²	155.1	77%	0.773	80%	0.795	S	S	*	*				177.2	97.1	103.2	30.8	0	0	0	0	112.2
1712	R	19.9	Very low	19.9	Very low	236 Å²	236	156.2 Å²	156.2	89%	0.891	80%	0.802	S	S	*	*			trans	-120.1	52.6	158.7	-74.5	-160.2	178.9	-150.3	0.8	113
1713	K	17.9	Very low	20	Very low	210 Å²	210	156.2 Å²	156.2	91%	0.913	80%	0.797	S	S	*	*			trans	-79.3	97.7	131.9	-80.7	-175.4	176.1	178	0	106.8
1714	S	21.6	Very low	20.1	Very low	73 Å²	73	156.1 Å²	156.1	51%	0.51	80%	0.797	S	S	.	*			trans	-140.9	79.7	-179.8	59.8	0	0	0	0	110.3
1715	E	18.4	Very low	20	Very low	200 Å²	200	154.2 Å²	154.2	94%	0.935	79%	0.791	S	S	*	*			trans	-63.3	127.8	165.2	-62.3	172	119.4	0	0	109.3
1716	S	20.5	Very low	19.9	Very low	101 Å²	101	159 Å²	159	71%	0.706	80%	0.803	S	S	*	*			trans	-162.5	27.9	164.1	47.1	0	0	0	0	114.3	K1718	S1716-K1718 PolarHBondContact O-N 3.16Å
1717	L	20.3	Very low	20	Very low	180 Å²	180	159.3 Å²	159.3	94%	0.942	81%	0.811	S	S	*	*			trans	-67.8	128.6	151	-101.9	90.1	0	0	0	107.7
1718	K	22.6	Very low	20	Very low	197 Å²	197	155.1 Å²	155.1	86%	0.857	80%	0.802	S	S	*	*			trans	-80	149.7	-168.2	-66.9	175.8	177.8	175.9	0	112.1	S1716 G1720	S1716-K1718 PolarHBondContact O-N 3.16Å; K1718-G1720 PolarHBondContact O-N 3.06Å
1719	I	22	Very low	20.2	Very low	163 Å²	163	153.9 Å²	153.9	84%	0.836	80%	0.802	S	S	*	*			trans	-67.1	100.9	164	-62.4	173.1	0	0	0	108.6
1720	G	22.2	Very low	20.4	Very low	67 Å²	67	155.7 Å²	155.7	69%	0.691	80%	0.804	S	S	*	*			trans	-77.8	140.4	145.9	0	0	0	0	0	108.7	K1718	K1718-G1720 PolarHBondContact O-N 3.06Å
1721	Q	18.1	Very low	20.6	Very low	165 Å²	165	152.7 Å²	152.7	77%	0.771	81%	0.807	S	S	*	*			trans	-82.5	128	-173.8	-65.9	170.3	-47.6	0	0	111.9
1722	L	19.4	Very low	21.1	Very low	174 Å²	174	152.1 Å²	152.1	91%	0.911	80%	0.803	S	S	*	*			trans	-144	125.4	145.2	-145.9	84.3	0	0	0	109.6
1723	H	20.9	Very low	21.9	Very low	152 Å²	152	146 Å²	146	70%	0.704	79%	0.787	S	S	*	*			trans	-86.9	139.8	172.4	-75.6	-112.9	0	0	0	109.8
1724	N	21.6	Very low	22.8	Very low	143 Å²	143	138.8 Å²	138.8	77%	0.765	76%	0.763	S	S	*	*				-175.2	108.6	116.2	-92.8	-15.3	0	0	0	114.7
1725	T	20.1	Very low	23.8	Very low	111 Å²	111	139.5 Å²	139.5	68%	0.681	76%	0.761	S	S	*	*				41.1	107.6	127.7	59.6	0	0	0	0	121
1726	K	18.2	Very low	24.9	Very low	199 Å²	199	135.4 Å²	135.4	87%	0.865	75%	0.752	S	S	*	*				39.1	114.8	122.8	-60.9	178.5	177.8	179.9	0	118.5
1727	T	20.8	Very low	25.9	Very low	152 Å²	152	139 Å²	139	93%	0.933	76%	0.757	S	S	*	*				-122.9	148.8	108.7	45	0	0	0	0	109.3
1728	S	20.5	Very low	26.7	Very low	103 Å²	103	132.4 Å²	132.4	72%	0.72	73%	0.733	S	S	*	*			trans	-112.2	137.9	175.2	55.4	0	0	0	0	108.8
1729	D	24.6	Very low	27.6	Very low	165 Å²	165	130 Å²	130	88%	0.882	73%	0.73	S	S	*	*			trans	-137.3	157.9	150.7	-110.9	-45.2	0	0	0	111.6
1730	K	23	Very low	28.9	Very low	188 Å²	188	125.9 Å²	125.9	82%	0.817	71%	0.709	S	S	*	*			trans	-95.2	159.1	-155.3	-67.5	174.4	-179.4	172.5	0	113.7	T1732	K1730-T1732 PolarHBondContact O-N 3.23Å
1731	A	22.6	Very low	30.6	Very low	102 Å²	102	126 Å²	126	84%	0.843	70%	0.699	S	S	*	*			trans	-69.4	125	178.4	0	0	0	0	0	113.1
1732	T	27.2	Very low	32.6	Very low	114 Å²	114	119.2 Å²	119.2	70%	0.699	67%	0.67	S	S	*	*			trans	-107.4	116.3	153.8	45.5	0	0	0	0	106.6	K1730	K1730-T1732 PolarHBondContact O-N 3.23Å
1733	L	37.4	Very low	34.4	Very low	106 Å²	106	114.8 Å²	114.8	56%	0.555	65%	0.647	S	S	*	*	S	Bend	cis	66	105.2	49.8	-153.7	80.4	0	0	0	111.5	D1735 N1750 I1757	L1733-D1735 PolarHBondContact O-N 3.29Å; L1733-N1750 HydrophobicContact CD1-CB 3.99Å; L1733-N1750 WeakPolarHBondContact CD1-OD1 3.44Å; L1733-I1757 HydrophobicContact CD1-CG2 4.34Å
1734	C	37.7	Very low	35.9	Very low	59 Å²	59	111.3 Å²	111.3	40%	0.399	63%	0.634	S	S	.	*			trans	41.6	50.6	178.8	-70.1	0	0	0	0	117	P1736 C1748 N1750	C1734-P1736 WeakPolarHBondContact O-CD 3.05Å; C1734-C1748 PolarHBondContact SG-O 2.86Å; C1734-N1750 PolarHBondContact SG-ND2 2.96Å; C1734-N1750 PolarHBondContact SG-OD1 2.94Å
1735	D	41.8	Very low	37.8	Very low	89 Å²	89	107.4 Å²	107.4	48%	0.476	63%	0.627	S	S	.	*			trans	-70.7	123	172.5	-170.9	-38.4	0	0	0	111.3	L1733 H1737	L1733-D1735 PolarHBondContact O-N 3.29Å; D1735-H1737 PolarHBondContact O-N 2.75Å; D1735-H1737 VanDerWaalsContact O-N 3.16Å; D1735-H1737 WeakPolarHBondContact OD1-CB 3.48Å; D1735-H1737 IonicContact OD1-CD2 3.53Å; D1735-H1737 IonicContact OD1-CG 2.76Å; D1735-H1737 PolarHBondContact OD1-N 3.2Å
1736	P	41.5	Very low	40.1	Very low	113 Å²	113	102.9 Å²	102.9	73%	0.734	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-3.4	-178.8	28.3	-34.6	0	0	0	115.4	C1734	C1734-P1736 WeakPolarHBondContact O-CD 3.05Å
1737	H	40.9	Very low	42.5	Very low	176 Å²	176	98.7 Å²	98.7	82%	0.815	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-5.4	-174	-64.2	-66.2	0	0	0	115.9	D1735	D1735-H1737 PolarHBondContact O-N 2.75Å; D1735-H1737 VanDerWaalsContact O-N 3.16Å; D1735-H1737 WeakPolarHBondContact OD1-CB 3.48Å; D1735-H1737 IonicContact OD1-CD2 3.53Å; D1735-H1737 IonicContact OD1-CG 2.76Å; D1735-H1737 PolarHBondContact OD1-N 3.2Å
1738	G	38.1	Very low	44.7	Very low	43 Å²	43	93.3 Å²	93.3	44%	0.443	56%	0.556	S	S	.	*	S	Bend	trans	-134.9	106.5	-170.8	0	0	0	0	0	116.3	N1740	G1738-N1740 PolarHBondContact O-N 3.32Å
1739	N	41.6	Very low	46.7	Very low	146 Å²	146	92.6 Å²	92.6	78%	0.781	54%	0.542	S	S	*	.	S	Bend	trans	53.1	-23.7	162.6	-93.8	-10.1	0	0	0	121.3	R1771	N1739-R1771 PolarHBondContact O-NH1 3.31Å; N1739-R1771 PolarHBondContact O-NH2 3.43Å
1740	N	49.1	Very low	48.4	Very low	76 Å²	76	87.5 Å²	87.5	41%	0.406	51%	0.514	S	S	.	.			trans	-101.2	25.3	-174.3	-69.5	-14.6	0	0	0	113.5	G1738 C1742 Y1759	G1738-N1740 PolarHBondContact O-N 3.32Å; N1740-C1742 PolarHBondContact O-N 2.83Å; N1740-Y1759 HydrophobicContact CB-CD1 4.1Å; N1740-Y1759 HydrophobicContact CB-CD2 4.01Å; N1740-Y1759 HydrophobicContact CB-CE1 4Å; N1740-Y1759 HydrophobicContact CB-CE2 3.89Å; N1740-Y1759 HydrophobicContact CB-CG 4.13Å; N1740-Y1759 VanDerWaalsContact OD1-CE1 3.31Å; N1740-Y1759 WeakPolarHBondContact OD1-CE1 3.39Å
1741	S	56.8	Low	49.5	Very low	69 Å²	69	81.9 Å²	81.9	48%	0.483	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-72.3	124.7	-178.2	50	0	0	0	0	113.3
1742	C	60.4	Low	50.3	Low	23 Å²	23	84.8 Å²	84.8	16%	0.155	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-69	134.8	162.8	-50.7	0	0	0	0	109.7	N1740 G1746 C1761	N1740-C1742 PolarHBondContact O-N 2.83Å; C1742-G1746 VanDerWaalsContact CB-O 3.29Å; C1742-G1746 WeakPolarHBondContact CB-O 3.46Å; C1742-C1761 WeakPolarHBondContact CA-SG 3.33Å; C1742-C1761 HydrophobicContact CB-CB 3.76Å; C1742-C1761 WeakPolarHBondContact CB-SG 3.09Å; C1742-C1761 WeakPolarHBondContact SG-CA 3.28Å; C1742-C1761 WeakPolarHBondContact SG-CB 3.37Å; C1742-C1761 CovalentContact SG-SG 2.03Å; C1742-C1761 PolarHBondContact SG-SG 3.13Å
1743	L	58.7	Low	50.8	Low	82 Å²	82	85.7 Å²	85.7	43%	0.429	49%	0.487	S	S	.	.	S	Bend	trans	-87.2	172.7	177.7	-52.7	169.7	0	0	0	110.5	G1745 G1746 R1771 E1773	L1743-G1745 PolarHBondContact O-N 3.38Å; L1743-G1746 PolarHBondContact O-N 3.48Å; L1743-R1771 WeakPolarHBondContact CA-O 3.32Å; L1743-R1771 WeakPolarHBondContact CB-O 3.38Å; L1743-R1771 HydrophobicContact CD1-CB 4.34Å; L1743-R1771 HydrophobicContact CG-CB 4.19Å; L1743-R1771 PolarHBondContact N-O 3.03Å; L1743-E1773 HydrophobicContact CD1-CB 4.09Å
1744	N	50.9	Low	50.9	Low	79 Å²	79	87.9 Å²	87.9	42%	0.422	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	20.7	171.2	-63.8	-38.8	0	0	0	116.1	P1764 F1767 C1772	N1744-P1764 VanDerWaalsContact O-CG 3.27Å; N1744-P1764 WeakPolarHBondContact O-CG 3.13Å; N1744-F1767 HydrophobicContact CB-CD1 3.51Å; N1744-F1767 HydrophobicContact CB-CE1 3.5Å; N1744-F1767 VanDerWaalsContact CB-CE1 3.5Å; N1744-F1767 HydrophobicContact CB-CG 4.19Å; N1744-F1767 HydrophobicContact CB-CZ 4.2Å; N1744-F1767 VanDerWaalsContact CG-CE1 3.46Å; N1744-C1772 PolarHBondContact ND2-O 2.93Å
1745	G	61.2	Low	51	Low	61 Å²	61	94.8 Å²	94.8	63%	0.629	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	19.6	-178.4	0	0	0	0	0	115.1	L1743	L1743-G1745 PolarHBondContact O-N 3.38Å
1746	G	68.3	Low	50.6	Low	15 Å²	15	95.9 Å²	95.9	16%	0.155	54%	0.536	C	S	.	.			trans	-62.9	142.6	169.3	0	0	0	0	0	112.6	C1742 L1743 K1762	C1742-G1746 VanDerWaalsContact CB-O 3.29Å; C1742-G1746 WeakPolarHBondContact CB-O 3.46Å; L1743-G1746 PolarHBondContact O-N 3.48Å; G1746-K1762 VanDerWaalsContact CA-O 3.32Å; G1746-K1762 WeakPolarHBondContact CA-O 3.37Å
1747	I	68.7	Low	50.4	Low	111 Å²	111	95.4 Å²	95.4	57%	0.569	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.3	177.8	-59.6	175.3	0	0	0	109	C1761 K1762	I1747-C1761 WeakPolarHBondContact O-CA 3.22Å; I1747-K1762 HydrophobicContact CB-CB 4.5Å; I1747-K1762 PolarHBondContact N-O 3.36Å; I1747-K1762 PolarHBondContact O-N 3.2Å
1748	C	67.9	Low	50.6	Low	39 Å²	39	94.9 Å²	94.9	26%	0.264	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	109.2	-178.6	-168.5	0	0	0	0	110.9	C1734	C1734-C1748 PolarHBondContact SG-O 2.86Å
1749	E	61.4	Low	51.6	Low	89 Å²	89	96.3 Å²	96.3	42%	0.416	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	148.9	174.9	-68.7	175	170.2	0	0	109.9	Y1759 Q1760 K1762	E1749-Y1759 WeakPolarHBondContact O-CA 3.35Å; E1749-Q1760 PolarHBondContact N-O 2.79Å; E1749-Q1760 PolarHBondContact O-N 2.94Å; E1749-K1762 WeakPolarHBondContact OE1-CD 3.43Å; E1749-K1762 IonicContact OE1-NZ 2.74Å; E1749-K1762 PolarHBondContact OE1-NZ 3.16Å; E1749-K1762 IonicContact OE2-NZ 2.81Å; E1749-K1762 PolarHBondContact OE2-NZ 3.47Å
1750	N	60.3	Low	52.5	Low	57 Å²	57	95.1 Å²	95.1	31%	0.305	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.8	175.7	-56.8	-78.3	0	0	0	108.8	L1733 C1734 I1757	L1733-N1750 HydrophobicContact CD1-CB 3.99Å; L1733-N1750 WeakPolarHBondContact CD1-OD1 3.44Å; C1734-N1750 PolarHBondContact SG-ND2 2.96Å; C1734-N1750 PolarHBondContact SG-OD1 2.94Å; N1750-I1757 HydrophobicContact CB-CG2 4.1Å
1751	N	46.6	Very low	53.6	Low	71 Å²	71	92.3 Å²	92.3	38%	0.38	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	106.6	-174.6	-157.9	-19.3	0	0	0	110.4	M1753 K1758	N1751-M1753 PolarHBondContact O-N 3.12Å; N1751-K1758 PolarHBondContact N-O 3.45Å
1752	E	40.8	Very low	53.9	Low	162 Å²	162	94.7 Å²	94.7	76%	0.757	49%	0.492	S	S	*	.			trans	-86.2	79.6	-179.4	-67.5	-168.1	165.6	0	0	111.5
1753	M	36.3	Very low	54.2	Low	134 Å²	134	95.7 Å²	95.7	66%	0.66	50%	0.498	S	S	*	.	S	Bend	trans	-121.8	126.9	162.5	-71.9	-156.6	-68.5	0	0	111.1	N1751	N1751-M1753 PolarHBondContact O-N 3.12Å
1754	N	40.2	Very low	54.3	Low	152 Å²	152	94 Å²	94	81%	0.813	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	64.3	167.4	-62.3	-12.8	0	0	0	115.8	T1756	N1754-T1756 PolarHBondContact O-N 3.48Å
1755	Q	39.4	Very low	54.4	Low	203 Å²	203	95 Å²	95	95%	0.949	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-0.4	160.9	-62.2	-177.7	-16.8	0	0	117.9
1756	T	33.9	Very low	53.9	Low	113 Å²	113	93 Å²	93	69%	0.693	48%	0.48	S	S	*	.			trans	-123	94.9	169.9	46.3	0	0	0	0	111	N1754 K1758	N1754-T1756 PolarHBondContact O-N 3.48Å; T1756-K1758 PolarHBondContact O-N 2.74Å; T1756-K1758 VanDerWaalsContact O-N 3.11Å
1757	I	37.3	Very low	53.3	Low	102 Å²	102	94.9 Å²	94.9	52%	0.523	48%	0.484	S	S	.	.			trans	-65.9	110.4	-177.8	-56.6	172.3	0	0	0	109.6	L1733 N1750	L1733-I1757 HydrophobicContact CD1-CG2 4.34Å; N1750-I1757 HydrophobicContact CB-CG2 4.1Å
1758	K	45.5	Very low	53	Low	165 Å²	165	96.5 Å²	96.5	72%	0.717	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	144.4	170	-98.2	-173.1	172.3	-172.6	0	110.8	N1751 T1756	N1751-K1758 PolarHBondContact N-O 3.45Å; T1756-K1758 PolarHBondContact O-N 2.74Å; T1756-K1758 VanDerWaalsContact O-N 3.11Å
1759	Y	57.9	Low	52.5	Low	74 Å²	74	96.1 Å²	96.1	29%	0.29	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	150.3	169.2	75.3	-81.3	0	0	0	110.2	N1740 E1749 R1771	N1740-Y1759 HydrophobicContact CB-CD1 4.1Å; N1740-Y1759 HydrophobicContact CB-CD2 4.01Å; N1740-Y1759 HydrophobicContact CB-CE1 4Å; N1740-Y1759 HydrophobicContact CB-CE2 3.89Å; N1740-Y1759 HydrophobicContact CB-CG 4.13Å; N1740-Y1759 VanDerWaalsContact OD1-CE1 3.31Å; N1740-Y1759 WeakPolarHBondContact OD1-CE1 3.39Å; E1749-Y1759 WeakPolarHBondContact O-CA 3.35Å; Y1759-R1771 PolarHBondContact OH-NH2 3.38Å
1760	Q	61.8	Low	52.8	Low	121 Å²	121	100 Å²	100	57%	0.565	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.9	137.5	176.8	-171.2	172.9	-1.4	0	0	111	E1749	E1749-Q1760 PolarHBondContact N-O 2.79Å; E1749-Q1760 PolarHBondContact O-N 2.94Å
1761	C	70.4	Confident	53	Low	17 Å²	17	100.8 Å²	100.8	12%	0.115	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.6	-179.6	-65.2	0	0	0	0	112.7	C1742 I1747 E1770	C1742-C1761 WeakPolarHBondContact CA-SG 3.33Å; C1742-C1761 HydrophobicContact CB-CB 3.76Å; C1742-C1761 WeakPolarHBondContact CB-SG 3.09Å; C1742-C1761 WeakPolarHBondContact SG-CA 3.28Å; C1742-C1761 WeakPolarHBondContact SG-CB 3.37Å; C1742-C1761 CovalentContact SG-SG 2.03Å; C1742-C1761 PolarHBondContact SG-SG 3.13Å; I1747-C1761 WeakPolarHBondContact O-CA 3.22Å; C1761-E1770 VanDerWaalsContact CB-O 3.23Å; C1761-E1770 WeakPolarHBondContact CB-O 3.18Å; C1761-E1770 PolarHBondContact SG-O 3.16Å; C1761-E1770 VanDerWaalsContact SG-O 3.36Å
1762	K	64.3	Low	53.9	Low	119 Å²	119	97.4 Å²	97.4	52%	0.517	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	107.2	174.9	-153.8	-178.8	-145	138.1	0	109.1	G1746 I1747 E1749	G1746-K1762 VanDerWaalsContact CA-O 3.32Å; G1746-K1762 WeakPolarHBondContact CA-O 3.37Å; I1747-K1762 HydrophobicContact CB-CB 4.5Å; I1747-K1762 PolarHBondContact N-O 3.36Å; I1747-K1762 PolarHBondContact O-N 3.2Å; E1749-K1762 WeakPolarHBondContact OE1-CD 3.43Å; E1749-K1762 IonicContact OE1-NZ 2.74Å; E1749-K1762 PolarHBondContact OE1-NZ 3.16Å; E1749-K1762 IonicContact OE2-NZ 2.81Å; E1749-K1762 PolarHBondContact OE2-NZ 3.47Å
1763	C	67.2	Low	54.6	Low	43 Å²	43	94.1 Å²	94.1	29%	0.291	47%	0.473	S	S	.	.			trans	-84.3	143.2	-167.5	-57.6	0	0	0	0	114.2	F1767 C1772	C1763-F1767 HydrophobicContact CB-CB 4.23Å; C1763-F1767 WeakPolarHBondContact CB-O 3.29Å; C1763-C1772 WeakPolarHBondContact CA-SG 3.48Å; C1763-C1772 HydrophobicContact CB-CB 3.71Å; C1763-C1772 WeakPolarHBondContact CB-SG 3.45Å; C1763-C1772 WeakPolarHBondContact SG-CA 3.28Å; C1763-C1772 WeakPolarHBondContact SG-CB 3.48Å; C1763-C1772 CovalentContact SG-SG 2.03Å; C1763-C1772 PolarHBondContact SG-SG 3.34Å
1764	P	59.9	Low	55.3	Low	47 Å²	47	92.4 Å²	92.4	31%	0.305	47%	0.465	S	S	.	.			trans	-67.9	158.6	173.6	26.5	-31.8	0	0	0	112.1	N1744 G1766 F1767	N1744-P1764 VanDerWaalsContact O-CG 3.27Å; N1744-P1764 WeakPolarHBondContact O-CG 3.13Å; P1764-G1766 PolarHBondContact O-N 3.07Å; P1764-G1766 VanDerWaalsContact O-N 3.11Å; P1764-F1767 HydrophobicContact CG-CB 4.49Å; P1764-F1767 HydrophobicContact CG-CD2 3.92Å; P1764-F1767 HydrophobicContact CG-CG 4.4Å; P1764-F1767 PolarHBondContact O-N 3.45Å
1765	T	53.7	Low	55.6	Low	101 Å²	101	89.2 Å²	89.2	62%	0.62	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	114.2	-164.8	-30.4	0	0	0	0	113.1	D1810	T1765-D1810 HydrophobicContact CG2-CB 4.41Å
1766	G	49.6	Very low	55.9	Low	17 Å²	17	83 Å²	83	18%	0.175	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.4	-15.6	179.6	0	0	0	0	0	115.3	P1764 P1776	P1764-G1766 PolarHBondContact O-N 3.07Å; P1764-G1766 VanDerWaalsContact O-N 3.11Å; G1766-P1776 WeakPolarHBondContact O-CB 3.36Å
1767	F	55.9	Low	56.5	Low	56 Å²	56	82.5 Å²	82.5	25%	0.246	43%	0.425	C	S	.	.			trans	-86.2	149.8	173.4	-68.1	-97.3	0	0	0	111.7	N1744 C1763 P1764 C1772 I1774 V1775 P1776	N1744-F1767 HydrophobicContact CB-CD1 3.51Å; N1744-F1767 HydrophobicContact CB-CE1 3.5Å; N1744-F1767 VanDerWaalsContact CB-CE1 3.5Å; N1744-F1767 HydrophobicContact CB-CG 4.19Å; N1744-F1767 HydrophobicContact CB-CZ 4.2Å; N1744-F1767 VanDerWaalsContact CG-CE1 3.46Å; C1763-F1767 HydrophobicContact CB-CB 4.23Å; C1763-F1767 WeakPolarHBondContact CB-O 3.29Å; P1764-F1767 HydrophobicContact CG-CB 4.49Å; P1764-F1767 HydrophobicContact CG-CD2 3.92Å; P1764-F1767 HydrophobicContact CG-CG 4.4Å; P1764-F1767 PolarHBondContact O-N 3.45Å; F1767-C1772 HydrophobicContact CB-CB 4.22Å; F1767-I1774 VanDerWaalsContact CA-O 3.31Å; F1767-I1774 WeakPolarHBondContact CA-O 3.33Å; F1767-V1775 HydrophobicContact CD1-CG1 4.31Å; F1767-V1775 HydrophobicContact CE1-CB 4.45Å; F1767-V1775 HydrophobicContact CE1-CG1 3.71Å; F1767-P1776 HydrophobicContact CE2-CG 4.46Å
1768	K	62.1	Low	56.5	Low	145 Å²	145	81 Å²	81	63%	0.63	42%	0.422	S	S	*	.	B	Isolated β-bridge	trans	-145.4	171	-178.9	-61.2	-169.7	178.1	-167.5	0	111.9	C1772 E1773 I1774	K1768-C1772 CarbonylContact O-C 3.59Å; K1768-C1772 VanDerWaalsContact O-CA 3.24Å; K1768-C1772 WeakPolarHBondContact O-CA 3.36Å; K1768-E1773 PolarHBondContact O-N 3.16Å; K1768-I1774 HydrophobicContact CB-CB 4.19Å; K1768-I1774 HydrophobicContact CB-CD1 4.44Å; K1768-I1774 PolarHBondContact N-O 2.84Å; K1768-I1774 WeakPolarHBondContact O-CA 3.34Å; K1768-I1774 VanDerWaalsContact O-CB 3.29Å; K1768-I1774 WeakPolarHBondContact O-CB 3.44Å; K1768-I1774 WeakPolarHBondContact O-CG1 3.35Å; K1768-I1774 PolarHBondContact O-N 3.16Å
1769	G	58.3	Low	56.5	Low	30 Å²	30	78.6 Å²	78.6	31%	0.309	41%	0.414	S	S	.	.	S	Bend	trans	104.7	161.6	-175.8	0	0	0	0	0	112.1	R1771 C1772 E1773	G1769-R1771 PolarHBondContact O-N 3.3Å; G1769-R1771 VanDerWaalsContact O-N 3.17Å; G1769-C1772 PolarHBondContact O-N 2.86Å; G1769-E1773 WeakPolarHBondContact CA-OE1 3.43Å
1770	E	66.7	Low	55.8	Low	170 Å²	170	85.4 Å²	85.4	79%	0.794	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-21.5	-176	-80	-150	146	0	0	112.9	C1761 E1773	C1761-E1770 VanDerWaalsContact CB-O 3.23Å; C1761-E1770 WeakPolarHBondContact CB-O 3.18Å; C1761-E1770 PolarHBondContact SG-O 3.16Å; C1761-E1770 VanDerWaalsContact SG-O 3.36Å; E1770-E1773 PolarHBondContact N-OE1 3.38Å
1771	R	66.1	Low	54.9	Low	75 Å²	75	84.5 Å²	84.5	28%	0.283	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	22.9	172.7	-60.9	-179.3	174.7	-140.7	-4.7	111.4	N1739 L1743 Y1759 G1769 E1773	N1739-R1771 PolarHBondContact O-NH1 3.31Å; N1739-R1771 PolarHBondContact O-NH2 3.43Å; L1743-R1771 WeakPolarHBondContact CA-O 3.32Å; L1743-R1771 WeakPolarHBondContact CB-O 3.38Å; L1743-R1771 HydrophobicContact CD1-CB 4.34Å; L1743-R1771 HydrophobicContact CG-CB 4.19Å; L1743-R1771 PolarHBondContact N-O 3.03Å; Y1759-R1771 PolarHBondContact OH-NH2 3.38Å; G1769-R1771 PolarHBondContact O-N 3.3Å; G1769-R1771 VanDerWaalsContact O-N 3.17Å; R1771-E1773 VanDerWaalsContact CA-OE2 3.24Å; R1771-E1773 WeakPolarHBondContact CA-OE2 3.3Å; R1771-E1773 WeakPolarHBondContact CB-OE2 3.28Å; R1771-E1773 PolarHBondContact N-OE2 3.37Å; R1771-E1773 PolarHBondContact O-N 3.04Å
1772	C	63.6	Low	54	Low	0 Å²	0	87.3 Å²	87.3	0%	0	45%	0.452	C	S	.	.	S	Bend	trans	62.7	22.4	179.4	-43.8	0	0	0	0	114.8	N1744 C1763 F1767 K1768 G1769 I1774	N1744-C1772 PolarHBondContact ND2-O 2.93Å; C1763-C1772 WeakPolarHBondContact CA-SG 3.48Å; C1763-C1772 HydrophobicContact CB-CB 3.71Å; C1763-C1772 WeakPolarHBondContact CB-SG 3.45Å; C1763-C1772 WeakPolarHBondContact SG-CA 3.28Å; C1763-C1772 WeakPolarHBondContact SG-CB 3.48Å; C1763-C1772 CovalentContact SG-SG 2.03Å; C1763-C1772 PolarHBondContact SG-SG 3.34Å; F1767-C1772 HydrophobicContact CB-CB 4.22Å; K1768-C1772 CarbonylContact O-C 3.59Å; K1768-C1772 VanDerWaalsContact O-CA 3.24Å; K1768-C1772 WeakPolarHBondContact O-CA 3.36Å; G1769-C1772 PolarHBondContact O-N 2.86Å; C1772-I1774 VanDerWaalsContact C-N 3.29Å; C1772-I1774 PolarHBondContact O-N 3.47Å
1773	E	57	Low	53.3	Low	93 Å²	93	86.6 Å²	86.6	44%	0.435	45%	0.45	S	S	.	.			trans	-63.7	-24.2	-176.1	61.6	-78.1	177.2	0	0	114.9	L1743 K1768 G1769 E1770 R1771	L1743-E1773 HydrophobicContact CD1-CB 4.09Å; K1768-E1773 PolarHBondContact O-N 3.16Å; G1769-E1773 WeakPolarHBondContact CA-OE1 3.43Å; E1770-E1773 PolarHBondContact N-OE1 3.38Å; R1771-E1773 VanDerWaalsContact CA-OE2 3.24Å; R1771-E1773 WeakPolarHBondContact CA-OE2 3.3Å; R1771-E1773 WeakPolarHBondContact CB-OE2 3.28Å; R1771-E1773 PolarHBondContact N-OE2 3.37Å; R1771-E1773 PolarHBondContact O-N 3.04Å
1774	I	50.4	Low	53.1	Low	98 Å²	98	93.9 Å²	93.9	50%	0.503	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-87	113.3	-176.8	-49.8	177.3	0	0	0	110.2	F1767 K1768 C1772	F1767-I1774 VanDerWaalsContact CA-O 3.31Å; F1767-I1774 WeakPolarHBondContact CA-O 3.33Å; K1768-I1774 HydrophobicContact CB-CB 4.19Å; K1768-I1774 HydrophobicContact CB-CD1 4.44Å; K1768-I1774 PolarHBondContact N-O 2.84Å; K1768-I1774 WeakPolarHBondContact O-CA 3.34Å; K1768-I1774 VanDerWaalsContact O-CB 3.29Å; K1768-I1774 WeakPolarHBondContact O-CB 3.44Å; K1768-I1774 WeakPolarHBondContact O-CG1 3.35Å; K1768-I1774 PolarHBondContact O-N 3.16Å; C1772-I1774 VanDerWaalsContact C-N 3.29Å; C1772-I1774 PolarHBondContact O-N 3.47Å
1775	V	45.8	Very low	53.2	Low	85 Å²	85	93.8 Å²	93.8	52%	0.515	47%	0.472	S	S	.	.			trans	-73.4	148.8	176.7	-77.3	0	0	0	0	113.9	F1767 V1777	F1767-V1775 HydrophobicContact CD1-CG1 4.31Å; F1767-V1775 HydrophobicContact CE1-CB 4.45Å; F1767-V1775 HydrophobicContact CE1-CG1 3.71Å; V1775-V1777 PolarHBondContact O-N 3.2Å; V1775-V1777 VanDerWaalsContact O-N 3.16Å
1776	P	46.1	Very low	54.6	Low	73 Å²	73	95.2 Å²	95.2	47%	0.474	47%	0.467	S	S	.	.			trans	-68.4	107.3	177	22.9	-31.4	0	0	0	113.7	G1766 F1767	G1766-P1776 WeakPolarHBondContact O-CB 3.36Å; F1767-P1776 HydrophobicContact CE2-CG 4.46Å
1777	V	45.8	Very low	55.8	Low	101 Å²	101	96 Å²	96	61%	0.612	47%	0.467	S	S	*	.			trans	-91.1	105.9	179.2	-175.5	0	0	0	0	112.5	V1775 H1779	V1775-V1777 PolarHBondContact O-N 3.2Å; V1775-V1777 VanDerWaalsContact O-N 3.16Å; V1777-H1779 PolarHBondContact O-N 3.11Å; V1777-H1779 VanDerWaalsContact O-N 3.16Å; V1777-H1779 PolarHBondContact O-ND1 3.1Å
1778	C	39.2	Very low	57	Low	70 Å²	70	99.6 Å²	99.6	47%	0.473	48%	0.479	S	S	.	.			trans	-70.4	106.6	177.8	-174.8	0	0	0	0	112.8	C1805	C1778-C1805 VanDerWaalsContact SG-CB 3.52Å
1779	H	44.2	Very low	57.7	Low	115 Å²	115	93.1 Å²	93.1	53%	0.532	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.3	178.7	-85.3	50.7	0	0	0	111.9	V1777 C1805 S1806	V1777-H1779 PolarHBondContact O-N 3.11Å; V1777-H1779 VanDerWaalsContact O-N 3.16Å; V1777-H1779 PolarHBondContact O-ND1 3.1Å; H1779-C1805 WeakPolarHBondContact O-CA 3.26Å; H1779-S1806 PolarHBondContact N-O 2.65Å; H1779-S1806 PolarHBondContact O-N 3.1Å
1780	R	42.9	Very low	58.3	Low	217 Å²	217	97.4 Å²	97.4	82%	0.819	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	74.9	-170.8	-64.3	179.5	-178.6	166.4	3.1	112.4
1781	E	43.7	Very low	58.6	Low	102 Å²	102	96.3 Å²	96.3	48%	0.477	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	132.5	176.4	-69.6	-166.5	172.4	0	0	112.5	R1803 K1804	E1781-R1803 CarbonylContact O-C 3.58Å; E1781-R1803 WeakPolarHBondContact O-CA 3.3Å; E1781-K1804 PolarHBondContact N-O 3.38Å; E1781-K1804 VanDerWaalsContact N-O 3.12Å; E1781-K1804 PolarHBondContact O-N 2.8Å
1782	T	51.6	Low	59.2	Low	77 Å²	77	95.7 Å²	95.7	47%	0.472	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	82.1	-178	-57.9	0	0	0	0	110.3	S1801 R1803	T1782-S1801 WeakPolarHBondContact CG2-OG 2.97Å; T1782-R1803 HydrophobicContact CG2-CG 4.34Å
1783	Q	49.2	Very low	59.9	Low	103 Å²	103	100.3 Å²	100.3	48%	0.481	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	144	178.9	-67.5	-174.4	-11.5	0	0	111.4	S1801 I1802	Q1783-S1801 CarbonylContact O-C 3.07Å; Q1783-S1801 WeakPolarHBondContact O-CA 3.01Å; Q1783-I1802 PolarHBondContact N-O 3.46Å; Q1783-I1802 PolarHBondContact O-N 3.25Å
1784	R	63.8	Low	61.2	Low	196 Å²	196	96 Å²	96	74%	0.74	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	86.7	173.9	-74.2	-175.4	178	-176.9	1.6	110.6	L1800	R1784-L1800 WeakPolarHBondContact CA-O 3.36Å
1785	S	62.2	Low	62.9	Low	45 Å²	45	94.4 Å²	94.4	32%	0.315	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	164.4	177.8	56.8	0	0	0	0	111.8	K1799 L1800	S1785-K1799 CarbonylContact O-C 3.59Å; S1785-K1799 WeakPolarHBondContact O-CA 3.42Å; S1785-L1800 PolarHBondContact N-O 2.98Å; S1785-L1800 PolarHBondContact O-N 3.42Å
1786	Y	81.3	Confident	64.9	Low	131 Å²	131	90.4 Å²	90.4	51%	0.514	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-79.7	133.1	162.2	-65.5	-72.6	0	0	0	108.5	I1795 S1796 K1799	Y1786-I1795 HydrophobicContact CD1-CG2 4.48Å; Y1786-I1795 HydrophobicContact CG-CG2 4.17Å; Y1786-S1796 VanDerWaalsContact CD1-O 3.26Å; Y1786-S1796 WeakPolarHBondContact CD1-O 3.26Å; Y1786-K1799 HydrophobicContact CD1-CB 4.47Å; Y1786-K1799 HydrophobicContact CD1-CG 3.83Å; Y1786-K1799 HydrophobicContact CD2-CG 3.92Å; Y1786-K1799 HydrophobicContact CE1-CB 4.42Å; Y1786-K1799 HydrophobicContact CE1-CG 3.61Å; Y1786-K1799 HydrophobicContact CE2-CD 4.23Å; Y1786-K1799 VanDerWaalsContact CE2-CE 3.48Å; Y1786-K1799 HydrophobicContact CE2-CG 3.7Å; Y1786-K1799 HydrophobicContact CG-CG 3.99Å
1787	I	76.2	Confident	66.6	Low	35 Å²	35	89.7 Å²	89.7	18%	0.179	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-84.4	134.3	174.1	-61.4	-176.6	0	0	0	107.9	I1795 S1796 L1800 I1802 F1912 I1924 L1926	I1787-I1795 CarbonylContact O-C 3.44Å; I1787-I1795 WeakPolarHBondContact O-CA 3.34Å; I1787-S1796 PolarHBondContact N-OG 3.43Å; I1787-S1796 PolarHBondContact O-N 3.38Å; I1787-S1796 PolarHBondContact O-OG 2.73Å; I1787-L1800 HydrophobicContact CB-CD1 4.41Å; I1787-L1800 HydrophobicContact CD1-CB 4.21Å; I1787-L1800 HydrophobicContact CD1-CD1 3.64Å; I1787-L1800 HydrophobicContact CG1-CB 4.39Å; I1787-L1800 HydrophobicContact CG1-CD1 3.96Å; I1787-I1802 HydrophobicContact CD1-CD1 4.03Å; I1787-I1802 HydrophobicContact CD1-CG1 4.34Å; I1787-I1802 HydrophobicContact CG1-CD1 3.93Å; I1787-F1912 HydrophobicContact CG2-CE1 4.26Å; I1787-F1912 HydrophobicContact CG2-CZ 4.2Å; I1787-F1912 WeakPolarHBondContact O-CE1 3.42Å; I1787-I1924 HydrophobicContact CD1-CD1 4.37Å; I1787-I1924 HydrophobicContact CG2-CD1 4.45Å; I1787-L1926 HydrophobicContact CD1-CD2 4.25Å
1788	R	81.1	Confident	68	Low	131 Å²	131	92.3 Å²	92.3	49%	0.494	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-99.3	130	166.8	-164.3	-178.6	-66.5	-94.2	11.3	108.8	P1790 N1793 C1794 I1795	R1788-P1790 WeakPolarHBondContact O-CD 3.46Å; R1788-N1793 WeakPolarHBondContact CD-OD1 3.4Å; R1788-N1793 WeakPolarHBondContact CG-O 3.47Å; R1788-N1793 PolarHBondContact NH1-O 3.06Å; R1788-C1794 CarbonylContact C-O 3.59Å; R1788-C1794 VanDerWaalsContact CA-O 3.28Å; R1788-C1794 WeakPolarHBondContact CA-O 3.26Å; R1788-C1794 WeakPolarHBondContact CG-O 2.97Å; R1788-I1795 HydrophobicContact CG-CG1 4.41Å
1789	D	75.4	Confident	69.9	Low	8 Å²	8	95 Å²	95	4%	0.043	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-77	117.7	172.4	-174.9	-28.4	0	0	0	108.3	Q1791 T1792 N1793 C1794 F1912 Y1920 R1922	D1789-Q1791 PolarHBondContact O-N 3.13Å; D1789-Q1791 PolarHBondContact OD1-N 2.83Å; D1789-T1792 WeakPolarHBondContact CB-OG1 3.31Å; D1789-T1792 PolarHBondContact O-N 3.37Å; D1789-N1793 VanDerWaalsContact O-CA 3.27Å; D1789-N1793 WeakPolarHBondContact O-CA 3.44Å; D1789-N1793 PolarHBondContact O-N 2.79Å; D1789-C1794 PolarHBondContact N-O 2.93Å; D1789-F1912 HydrophobicContact CB-CD1 3.98Å; D1789-F1912 HydrophobicContact CB-CE1 3.68Å; D1789-F1912 HydrophobicContact CB-CE2 4.48Å; D1789-F1912 HydrophobicContact CB-CZ 3.93Å; D1789-Y1920 VanDerWaalsContact CB-OH 3.3Å; D1789-Y1920 WeakPolarHBondContact CB-OH 3.27Å; D1789-Y1920 PolarHBondContact OD2-OH 2.8Å; D1789-R1922 VanDerWaalsContact CG-NH1 3.29Å; D1789-R1922 IonicContact OD1-NH1 3.78Å; D1789-R1922 PolarHBondContact OD1-NH1 2.8Å; D1789-R1922 WeakPolarHBondContact OD2-CD 3.26Å; D1789-R1922 IonicContact OD2-CZ 2.89Å; D1789-R1922 IonicContact OD2-NE 3.81Å; D1789-R1922 IonicContact OD2-NH1 2.72Å; D1789-R1922 PolarHBondContact OD2-NH1 3.4Å
1790	P	72.4	Confident	70.9	Confident	120 Å²	120	90.4 Å²	90.4	78%	0.779	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.4	-173.9	28.9	-35.9	0	0	0	113.5	R1788	R1788-P1790 WeakPolarHBondContact O-CD 3.46Å
1791	Q	72.4	Confident	71.9	Confident	148 Å²	148	83 Å²	83	69%	0.692	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-19.5	-179.6	-69	-176.9	-39.3	0	0	113.6	D1789 R1922	D1789-Q1791 PolarHBondContact O-N 3.13Å; D1789-Q1791 PolarHBondContact OD1-N 2.83Å; Q1791-R1922 VanDerWaalsContact OE1-CZ 3.28Å
1792	T	78.6	Confident	72.3	Confident	61 Å²	61	80.6 Å²	80.6	37%	0.374	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-8.7	-176.5	65.1	0	0	0	0	112.9	D1789 C1794 Y1920	D1789-T1792 WeakPolarHBondContact CB-OG1 3.31Å; D1789-T1792 PolarHBondContact O-N 3.37Å; T1792-C1794 WeakPolarHBondContact CB-SG 3.37Å; T1792-C1794 PolarHBondContact O-N 3.21Å; T1792-C1794 VanDerWaalsContact O-N 3.1Å; T1792-C1794 PolarHBondContact O-SG 3.33Å; T1792-C1794 WeakPolarHBondContact OG1-CB 3.5Å; T1792-C1794 PolarHBondContact OG1-N 2.9Å; T1792-C1794 PolarHBondContact OG1-SG 3.22Å; T1792-Y1920 HydrophobicContact CG2-CE1 4.25Å; T1792-Y1920 WeakPolarHBondContact CG2-OH 3.4Å; T1792-Y1920 PolarHBondContact OG1-OH 3.27Å
1793	N	78	Confident	72.1	Confident	98 Å²	98	86 Å²	86	52%	0.524	41%	0.407	S	S	.	.			trans	60.2	6	-170.2	-115.5	-20	0	0	0	115.1	R1788 D1789	R1788-N1793 WeakPolarHBondContact CD-OD1 3.4Å; R1788-N1793 WeakPolarHBondContact CG-O 3.47Å; R1788-N1793 PolarHBondContact NH1-O 3.06Å; D1789-N1793 VanDerWaalsContact O-CA 3.27Å; D1789-N1793 WeakPolarHBondContact O-CA 3.44Å; D1789-N1793 PolarHBondContact O-N 2.79Å
1794	C	85.1	Confident	71.9	Confident	2 Å²	2	87.4 Å²	87.4	1%	0.014	41%	0.411	C	S	.	.			trans	-76.8	154.7	-176.1	-51	0	0	0	0	112.2	R1788 D1789 T1792 F1912 N1913 C1914 Y1920	R1788-C1794 CarbonylContact C-O 3.59Å; R1788-C1794 VanDerWaalsContact CA-O 3.28Å; R1788-C1794 WeakPolarHBondContact CA-O 3.26Å; R1788-C1794 WeakPolarHBondContact CG-O 2.97Å; D1789-C1794 PolarHBondContact N-O 2.93Å; T1792-C1794 WeakPolarHBondContact CB-SG 3.37Å; T1792-C1794 PolarHBondContact O-N 3.21Å; T1792-C1794 VanDerWaalsContact O-N 3.1Å; T1792-C1794 PolarHBondContact O-SG 3.33Å; T1792-C1794 WeakPolarHBondContact OG1-CB 3.5Å; T1792-C1794 PolarHBondContact OG1-N 2.9Å; T1792-C1794 PolarHBondContact OG1-SG 3.22Å; C1794-F1912 HydrophobicContact CB-CB 4.09Å; C1794-F1912 WeakPolarHBondContact O-CD1 3.3Å; C1794-N1913 CarbonylContact C-O 3.55Å; C1794-N1913 WeakPolarHBondContact CA-O 3.36Å; C1794-N1913 WeakPolarHBondContact CB-O 3.49Å; C1794-C1914 HydrophobicContact CB-CB 3.91Å; C1794-C1914 WeakPolarHBondContact CB-SG 3.48Å; C1794-C1914 WeakPolarHBondContact SG-CA 3.49Å; C1794-C1914 WeakPolarHBondContact SG-CB 3.41Å; C1794-C1914 CovalentContact SG-SG 2.03Å; C1794-C1914 PolarHBondContact SG-SG 3.4Å; C1794-Y1920 HydrophobicContact CB-CE1 3.83Å
1795	I	86.9	Confident	70.8	Confident	64 Å²	64	82.3 Å²	82.3	33%	0.328	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131.6	-169.5	-52.8	176.3	0	0	0	110.4	Y1786 I1787 R1788 S1797 N1913	Y1786-I1795 HydrophobicContact CD1-CG2 4.48Å; Y1786-I1795 HydrophobicContact CG-CG2 4.17Å; I1787-I1795 CarbonylContact O-C 3.44Å; I1787-I1795 WeakPolarHBondContact O-CA 3.34Å; R1788-I1795 HydrophobicContact CG-CG1 4.41Å; I1795-S1797 PolarHBondContact O-N 3.23Å; I1795-N1913 PolarHBondContact N-O 3.3Å; I1795-N1913 PolarHBondContact O-N 3.16Å
1796	S	86.4	Confident	69.7	Low	2 Å²	2	83 Å²	83	1%	0.014	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	131.9	-179.3	64.1	0	0	0	0	111.6	Y1786 I1787 R1798 L1911 F1912	Y1786-S1796 VanDerWaalsContact CD1-O 3.26Å; Y1786-S1796 WeakPolarHBondContact CD1-O 3.26Å; I1787-S1796 PolarHBondContact N-OG 3.43Å; I1787-S1796 PolarHBondContact O-N 3.38Å; I1787-S1796 PolarHBondContact O-OG 2.73Å; S1796-R1798 PolarHBondContact O-N 2.02Å; S1796-R1798 PolarHBondContact OG-O 2.95Å; S1796-R1798 VanDerWaalsContact OG-O 3.13Å; S1796-L1911 WeakPolarHBondContact CA-O 3.27Å; S1796-F1912 VanDerWaalsContact N-CD1 3.32Å
1797	S	81.6	Confident	67.7	Low	58 Å²	58	79.8 Å²	79.8	41%	0.406	42%	0.416	S	S	.	.	S	Bend	trans	-57.9	-16.9	-173.1	59.4	0	0	0	0	116.1	I1795 L1911 N1913	I1795-S1797 PolarHBondContact O-N 3.23Å; S1797-L1911 WeakPolarHBondContact CB-O 3.49Å; S1797-L1911 PolarHBondContact N-O 2.84Å; S1797-L1911 PolarHBondContact OG-O 3.44Å; S1797-L1911 VanDerWaalsContact OG-O 3.1Å; S1797-N1913 WeakPolarHBondContact CB-OD1 2.99Å
1798	R	76.1	Confident	65.6	Low	156 Å²	156	81.5 Å²	81.5	59%	0.589	43%	0.431	S	S	*	.	S	Bend	trans	-140.9	152.3	176.7	55.5	176.9	171.2	178.7	-7.6	110.7	S1796 L1800	S1796-R1798 PolarHBondContact O-N 2.02Å; S1796-R1798 PolarHBondContact OG-O 2.95Å; S1796-R1798 VanDerWaalsContact OG-O 3.13Å; R1798-L1800 PolarHBondContact O-N 2.84Å
1799	K	78.9	Confident	63.3	Low	126 Å²	126	81.4 Å²	81.4	55%	0.548	45%	0.449	S	S	.	.			trans	-62.5	130.9	170.7	-64.9	-175.4	-180	-177.3	0	109.4	S1785 Y1786	S1785-K1799 CarbonylContact O-C 3.59Å; S1785-K1799 WeakPolarHBondContact O-CA 3.42Å; Y1786-K1799 HydrophobicContact CD1-CB 4.47Å; Y1786-K1799 HydrophobicContact CD1-CG 3.83Å; Y1786-K1799 HydrophobicContact CD2-CG 3.92Å; Y1786-K1799 HydrophobicContact CE1-CB 4.42Å; Y1786-K1799 HydrophobicContact CE1-CG 3.61Å; Y1786-K1799 HydrophobicContact CE2-CD 4.23Å; Y1786-K1799 VanDerWaalsContact CE2-CE 3.48Å; Y1786-K1799 HydrophobicContact CE2-CG 3.7Å; Y1786-K1799 HydrophobicContact CG-CG 3.99Å
1800	L	66.3	Low	60.9	Low	18 Å²	18	86 Å²	86	9%	0.094	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.8	-178.4	-73.2	159.5	0	0	0	109.9	R1784 S1785 I1787 R1798 I1802 I1910	R1784-L1800 WeakPolarHBondContact CA-O 3.36Å; S1785-L1800 PolarHBondContact N-O 2.98Å; S1785-L1800 PolarHBondContact O-N 3.42Å; I1787-L1800 HydrophobicContact CB-CD1 4.41Å; I1787-L1800 HydrophobicContact CD1-CB 4.21Å; I1787-L1800 HydrophobicContact CD1-CD1 3.64Å; I1787-L1800 HydrophobicContact CG1-CB 4.39Å; I1787-L1800 HydrophobicContact CG1-CD1 3.96Å; R1798-L1800 PolarHBondContact O-N 2.84Å; L1800-I1802 PolarHBondContact O-N 3.2Å; L1800-I1910 HydrophobicContact CD1-CD1 3.52Å; L1800-I1910 HydrophobicContact CD1-CG1 4.14Å; L1800-I1910 HydrophobicContact CD1-CG2 3.98Å; L1800-I1910 HydrophobicContact CD2-CD1 4.02Å; L1800-I1910 HydrophobicContact CD2-CG1 4.34Å; L1800-I1910 HydrophobicContact CG-CD1 4.44Å
1801	S	62.2	Low	58.7	Low	61 Å²	61	85.5 Å²	85.5	43%	0.427	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	97.8	177.7	-164.9	0	0	0	0	109.3	T1782 Q1783	T1782-S1801 WeakPolarHBondContact CG2-OG 2.97Å; Q1783-S1801 CarbonylContact O-C 3.07Å; Q1783-S1801 WeakPolarHBondContact O-CA 3.01Å
1802	I	52.3	Low	56.3	Low	52 Å²	52	83.2 Å²	83.2	27%	0.267	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128	175.9	-51.7	176.5	0	0	0	107.6	Q1783 I1787 L1800	Q1783-I1802 PolarHBondContact N-O 3.46Å; Q1783-I1802 PolarHBondContact O-N 3.25Å; I1787-I1802 HydrophobicContact CD1-CD1 4.03Å; I1787-I1802 HydrophobicContact CD1-CG1 4.34Å; I1787-I1802 HydrophobicContact CG1-CD1 3.93Å; L1800-I1802 PolarHBondContact O-N 3.2Å
1803	R	48.5	Very low	53.6	Low	190 Å²	190	88.5 Å²	88.5	72%	0.717	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	104.6	172	-67.1	-176.4	178.3	-173.7	-1.8	108.2	E1781 T1782	E1781-R1803 CarbonylContact O-C 3.58Å; E1781-R1803 WeakPolarHBondContact O-CA 3.3Å; T1782-R1803 HydrophobicContact CG2-CG 4.34Å
1804	K	44.8	Very low	51	Low	133 Å²	133	91.8 Å²	91.8	58%	0.578	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	146	168.3	-88.2	-173.3	172.9	-177.2	0	108.9	E1781	E1781-K1804 PolarHBondContact N-O 3.38Å; E1781-K1804 VanDerWaalsContact N-O 3.12Å; E1781-K1804 PolarHBondContact O-N 2.8Å
1805	C	39.7	Very low	47.8	Very low	89 Å²	89	98 Å²	98	60%	0.601	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	115.9	170.9	-73.5	0	0	0	0	106.2	C1778 H1779	C1778-C1805 VanDerWaalsContact SG-CB 3.52Å; H1779-C1805 WeakPolarHBondContact O-CA 3.26Å
1806	S	39.2	Very low	44.7	Very low	60 Å²	60	103.1 Å²	103.1	42%	0.42	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.5	144.9	174.5	45.7	0	0	0	0	110.6	H1779	H1779-S1806 PolarHBondContact N-O 2.65Å; H1779-S1806 PolarHBondContact O-N 3.1Å
1807	G	38.8	Very low	41.4	Very low	63 Å²	63	110.5 Å²	110.5	65%	0.649	60%	0.602	S	S	*	*			trans	151.7	140.9	-170	0	0	0	0	0	109.2	C1809	G1807-C1809 PolarHBondContact O-N 3.23Å
1808	S	32.5	Very low	38.5	Very low	71 Å²	71	116.8 Å²	116.8	50%	0.497	63%	0.625	S	S	.	*			trans	-84.5	111.1	-171.2	52.3	0	0	0	0	112.6
1809	C	32.7	Very low	35.8	Very low	129 Å²	129	118 Å²	118	87%	0.872	64%	0.638	S	S	*	*			trans	-105	80.2	152.4	-59.3	0	0	0	0	106.7	G1807	G1807-C1809 PolarHBondContact O-N 3.23Å
1810	D	26.5	Very low	33	Very low	106 Å²	106	121.1 Å²	121.1	57%	0.567	65%	0.654	S	S	*	*			trans	-74.7	145.7	-175.4	-156	-4.7	0	0	0	111.4	T1765 T1812	T1765-D1810 HydrophobicContact CG2-CB 4.41Å; D1810-T1812 VanDerWaalsContact CG-OG1 3.29Å; D1810-T1812 PolarHBondContact OD1-OG1 2.99Å; D1810-T1812 PolarHBondContact OD2-OG1 2.97Å
1811	S	26	Very low	30.7	Very low	109 Å²	109	125 Å²	125	76%	0.762	68%	0.683	S	S	*	*			trans	-111.5	30.8	-162.3	57.6	0	0	0	0	113.3
1812	T	21.9	Very low	28.7	Very low	100 Å²	100	130.9 Å²	130.9	61%	0.613	70%	0.701	S	S	*	*			trans	-113.1	35.2	-157.1	39.4	0	0	0	0	114.6	D1810	D1810-T1812 VanDerWaalsContact CG-OG1 3.29Å; D1810-T1812 PolarHBondContact OD1-OG1 2.99Å; D1810-T1812 PolarHBondContact OD2-OG1 2.97Å
1813	M	21.3	Very low	27.3	Very low	172 Å²	172	134.8 Å²	134.8	85%	0.847	72%	0.723	S	S	*	*			trans	-131.5	59.3	165.1	-75	-61.3	-71.6	0	0	112.2
1814	I	23.3	Very low	25.9	Very low	167 Å²	167	132.8 Å²	132.8	86%	0.856	73%	0.726	S	S	*	*			trans	-125.4	74.2	153.4	-54.3	179.8	0	0	0	106.8
1815	N	18.9	Very low	25	Very low	131 Å²	131	133.3 Å²	133.3	70%	0.701	74%	0.735	S	S	*	*			trans	-154.9	65.9	170	-145.6	1.6	0	0	0	111.1
1816	L	19.9	Very low	24.2	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	74%	0.737	S	S	*	*			trans	-103.9	110.1	156	-87.6	171.1	0	0	0	107.3
1817	Q	18.5	Very low	23.3	Very low	158 Å²	158	138.3 Å²	138.3	74%	0.738	75%	0.751	S	S	*	*			trans	-88.6	118.8	172.4	-64.8	174.5	-45.5	0	0	109
1818	Q	19.6	Very low	22.5	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	76%	0.76	S	S	*	*			trans	-174.3	98.3	155	-102.7	155.8	28.3	0	0	104.6
1819	Q	19.3	Very low	21.9	Very low	181 Å²	181	146.4 Å²	146.4	85%	0.846	77%	0.773	S	S	*	*			cis	77.5	56.5	45.2	-154.8	-174.2	3.8	0	0	114
1820	E	21	Very low	21.5	Very low	192 Å²	192	146.4 Å²	146.4	90%	0.897	77%	0.769	S	S	*	*			trans	-142	100.8	147.4	-98.2	168.2	-158.2	0	0	105.2
1821	S	17.2	Very low	21.2	Very low	100 Å²	100	148.2 Å²	148.2	70%	0.699	78%	0.778	S	S	*	*				68.4	88.5	64.6	-174.9	0	0	0	0	113.5
1822	F	20.2	Very low	21	Very low	184 Å²	184	150.5 Å²	150.5	81%	0.807	78%	0.782	S	S	*	*				-164.7	138.4	129.7	-110.4	-70.4	0	0	0	111.6
1823	N	22.6	Very low	20.8	Very low	134 Å²	134	153.4 Å²	153.4	72%	0.717	79%	0.794	S	S	*	*			trans	53.4	111.8	168.7	-62.1	-15.3	0	0	0	117.3
1824	N	19.7	Very low	20.8	Very low	148 Å²	148	153.1 Å²	153.1	79%	0.791	79%	0.79	S	S	*	*				42.1	108.1	71.7	-75.6	-4.3	0	0	0	113.8
1825	D	26.3	Very low	20.6	Very low	143 Å²	143	150 Å²	150	77%	0.765	78%	0.783	S	S	*	*				-152.8	132.4	106.4	-106.4	-28.1	0	0	0	112.4
1826	N	21.8	Very low	20.7	Very low	119 Å²	119	153.6 Å²	153.6	64%	0.636	79%	0.793	S	S	*	*			trans	32.3	114.2	150.9	-52.9	-50.5	0	0	0	120.5
1827	N	20.6	Very low	20.7	Very low	136 Å²	136	154 Å²	154	73%	0.727	79%	0.788	S	S	*	*				35.2	118.6	112.2	-53.1	-33.2	0	0	0	117.5
1828	D	23.7	Very low	20.7	Very low	157 Å²	157	157.5 Å²	157.5	84%	0.84	80%	0.796	S	S	*	*				-144.7	139.9	111.2	-129.6	-25.7	0	0	0	111.9
1829	I	18.8	Very low	20.9	Very low	147 Å²	147	157 Å²	157	75%	0.754	79%	0.793	S	S	*	*			trans	-113.5	110	179.1	-61.8	170.9	0	0	0	107.7
1830	T	23.5	Very low	20.9	Very low	129 Å²	129	157.5 Å²	157.5	79%	0.791	79%	0.792	S	S	*	*			trans	-135.6	128.6	160.5	30.1	0	0	0	0	110.5
1831	N	20.2	Very low	20.8	Very low	143 Å²	143	161 Å²	161	77%	0.765	80%	0.798	S	S	*	*			trans	-67.3	149.3	157.4	-65.1	-61.8	0	0	0	108.1
1832	D	22.6	Very low	20.9	Very low	157 Å²	157	165.4 Å²	165.4	84%	0.84	80%	0.804	S	S	*	*				-162.3	135.6	108.4	-96.2	-24	0	0	0	111.2
1833	N	18.9	Very low	21	Very low	162 Å²	162	161.4 Å²	161.4	87%	0.866	81%	0.805	S	S	*	*			trans	-125.4	47.1	-164.6	-151	-4.6	0	0	0	111.6	S1835	N1833-S1835 PolarHBondContact O-N 3.12Å
1834	E	20.6	Very low	20.9	Very low	165 Å²	165	163.9 Å²	163.9	77%	0.771	81%	0.81	S	S	*	*			trans	-96.4	82.9	-174.5	-80.5	-101.1	114.5	0	0	113.1	F1836	E1834-F1836 PolarHBondContact O-N 2.04Å; E1834-F1836 VanDerWaalsContact O-N 3.1Å
1835	S	19.5	Very low	21	Very low	101 Å²	101	165.7 Å²	165.7	71%	0.706	81%	0.813	S	S	*	*			trans	31.7	68.2	130.8	-156.8	0	0	0	0	119.2	N1833 K1837	N1833-S1835 PolarHBondContact O-N 3.12Å; S1835-K1837 PolarHBondContact O-N 3.4Å
1836	F	20.1	Very low	20.8	Very low	208 Å²	208	168.1 Å²	168.1	91%	0.912	82%	0.817	S	S	*	*			trans	-68.5	96.1	170	-103.1	-91.9	0	0	0	112.5	E1834 Y1838	E1834-F1836 PolarHBondContact O-N 2.04Å; E1834-F1836 VanDerWaalsContact O-N 3.1Å; F1836-Y1838 PolarHBondContact O-N 3.46Å
1837	K	19.8	Very low	20.6	Very low	181 Å²	181	173.9 Å²	173.9	79%	0.787	83%	0.83	S	S	*	*			trans	-63.5	130.2	174	-91.4	176.3	177.2	165.3	0	112.1	S1835 H1839	S1835-K1837 PolarHBondContact O-N 3.4Å; K1837-H1839 PolarHBondContact O-N 3.2Å
1838	Y	19.8	Very low	20.7	Very low	230 Å²	230	172.6 Å²	172.6	90%	0.902	83%	0.831	S	S	*	*			trans	-56.1	124.1	162.8	-97.7	-118.6	0	0	0	110.9	F1836	F1836-Y1838 PolarHBondContact O-N 3.46Å
1839	H	21.8	Very low	20.5	Very low	179 Å²	179	170.9 Å²	170.9	83%	0.829	83%	0.826	S	S	*	*			trans	-134.5	141.3	155.2	-111.3	-92.4	0	0	0	112.8	K1837	K1837-H1839 PolarHBondContact O-N 3.2Å
1840	K	20.3	Very low	20.6	Very low	192 Å²	192	171.2 Å²	171.2	84%	0.835	83%	0.83	S	S	*	*			trans	-50.9	140.1	-164.2	-67.7	170.9	175.6	174.6	0	114.6	K1842	K1840-K1842 PolarHBondContact O-N 3.33Å
1841	W	18.9	Very low	20.5	Very low	266 Å²	266	169.9 Å²	169.9	100%	1.008	83%	0.826	S	S	*	*			trans	-48.4	121.3	163.1	-72.5	35.6	0	0	0	110.7
1842	K	20.1	Very low	20.4	Very low	193 Å²	193	169.2 Å²	169.2	84%	0.839	82%	0.822	S	S	*	*			trans	-112.1	120.8	157.9	-83.1	-172.2	172.7	-177	0	107.8	K1840 F1844	K1840-K1842 PolarHBondContact O-N 3.33Å; K1842-F1844 PolarHBondContact O-N 2.68Å; K1842-F1844 VanDerWaalsContact O-N 3.14Å
1843	A	21.8	Very low	20.3	Very low	100 Å²	100	169.7 Å²	169.7	83%	0.826	82%	0.819	S	S	*	*			trans	-65.8	111.4	174.5	0	0	0	0	0	109.2
1844	F	20.2	Very low	20.3	Very low	185 Å²	185	166.9 Å²	166.9	81%	0.811	81%	0.808	S	S	*	*			trans	-86	116.7	178.6	-132.3	-80.9	0	0	0	109.8	K1842 K1846	K1842-F1844 PolarHBondContact O-N 2.68Å; K1842-F1844 VanDerWaalsContact O-N 3.14Å; F1844-K1846 PolarHBondContact O-N 2.82Å; F1844-K1846 VanDerWaalsContact O-N 3.14Å
1845	H	22.5	Very low	20.4	Very low	186 Å²	186	169.9 Å²	169.9	86%	0.861	81%	0.812	S	S	*	*			trans	-65.5	111.7	168.9	-79.4	-93.2	0	0	0	109.4
1846	K	21	Very low	20.5	Very low	194 Å²	194	171.3 Å²	171.3	84%	0.843	81%	0.811	S	S	*	*			trans	-138	86.1	159.9	-103.2	-175.8	175.9	-178	0	110.9	F1844	F1844-K1846 PolarHBondContact O-N 2.82Å; F1844-K1846 VanDerWaalsContact O-N 3.14Å
1847	R	18.9	Very low	20.9	Very low	241 Å²	241	166.7 Å²	166.7	91%	0.909	80%	0.802	S	S	*	*			trans	-74	133.6	143.1	-73.6	176.1	170.1	168.3	-5.8	106.8
1848	S	21.3	Very low	21	Very low	109 Å²	109	167 Å²	167	76%	0.762	81%	0.806	S	S	*	*			trans	-82.7	107.3	153.3	49.6	0	0	0	0	108.2
1849	T	20.8	Very low	21.4	Very low	120 Å²	120	163.6 Å²	163.6	74%	0.736	80%	0.803	S	S	*	*				31.1	133.9	129	52	0	0	0	0	120
1850	N	19.4	Very low	21.4	Very low	154 Å²	154	161.5 Å²	161.5	82%	0.824	80%	0.798	S	S	*	*			trans	-56.2	138.5	152.9	-63	-2.4	0	0	0	110.5
1851	S	21	Very low	21.7	Very low	101 Å²	101	157.9 Å²	157.9	71%	0.706	79%	0.788	S	S	*	*			trans	-167.4	91.9	141.3	56.3	0	0	0	0	105.6
1852	D	19.5	Very low	21.9	Very low	130 Å²	130	151.5 Å²	151.5	70%	0.695	77%	0.769	S	S	*	*				100.9	117.8	75.4	-84.4	-38.1	0	0	0	110.3
1853	H	19.9	Very low	22	Very low	167 Å²	167	149.2 Å²	149.2	77%	0.773	76%	0.759	S	S	*	*			trans	59.7	142.3	149.9	-72.3	-83.5	0	0	0	122.1
1854	V	19.8	Very low	22	Very low	103 Å²	103	152.1 Å²	152.1	62%	0.624	76%	0.755	S	S	*	*			trans	63.6	134.3	164.5	-120	0	0	0	0	114.7	L1856	V1854-L1856 HydrophobicContact CG1-CD1 4.28Å
1855	W	21.1	Very low	22	Very low	228 Å²	228	148.1 Å²	148.1	86%	0.864	75%	0.75	S	S	*	*			cis	-137.8	163.2	34.2	-92.7	85.7	0	0	0	117.3
1856	L	22.9	Very low	22.1	Very low	131 Å²	131	148 Å²	148	69%	0.686	75%	0.75	S	S	*	*			trans	-81.6	-178.3	171.2	-57.6	90.2	0	0	0	111.3	V1854	V1854-L1856 HydrophobicContact CG1-CD1 4.28Å
1857	P	29.2	Very low	22	Very low	111 Å²	111	145.8 Å²	145.8	72%	0.721	75%	0.746	S	S	*	*			cis	-127.9	174.1	-27.7	20.8	1.3	0	0	0	113.2
1858	Q	21.8	Very low	22.2	Very low	188 Å²	188	141.7 Å²	141.7	88%	0.879	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-91.8	148.3	147.8	-82	-172.8	-30.7	0	0	109.9
1859	N	27.6	Very low	22	Very low	157 Å²	157	145.7 Å²	145.7	84%	0.84	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-76.9	157	-171.1	-124.3	-14.6	0	0	0	113.4
1860	L	21.3	Very low	22	Very low	135 Å²	135	147.6 Å²	147.6	71%	0.707	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-73	166.8	174.9	-64.6	91.3	0	0	0	109.9
1861	D	26	Very low	22.1	Very low	117 Å²	117	147.7 Å²	147.7	63%	0.626	74%	0.739	S	S	*	*			cis	-164.7	158.4	42.2	-128.4	-30	0	0	0	117.2
1862	H	24	Very low	22.2	Very low	132 Å²	132	148.3 Å²	148.3	61%	0.611	74%	0.735	S	S	*	*			trans	58.3	141.3	154.1	-73.6	18.5	0	0	0	120.5
1863	K	22	Very low	22.4	Very low	144 Å²	144	147.2 Å²	147.2	63%	0.626	74%	0.737	S	S	*	*			cis	-161.4	128.7	-6.6	-120	171.2	179.6	152.8	0	113.5
1864	Q	21.2	Very low	22.5	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.752	74%	0.737	S	S	*	*			trans	59.9	144	139.4	-68.4	171.8	-52	0	0	124.9
1865	S	20.7	Very low	22.6	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	74%	0.744	S	S	*	*			trans	62.1	115.5	160.8	51.6	0	0	0	0	118.9
1866	H	24.3	Very low	22.7	Very low	183 Å²	183	142 Å²	142	85%	0.847	74%	0.739	S	S	*	*				-143.6	-161.9	56.4	-97.3	-90.2	0	0	0	114.3
1867	I	20.3	Very low	22.7	Very low	148 Å²	148	143.9 Å²	143.9	76%	0.759	75%	0.749	S	S	*	*			trans	-129.6	161	-152.3	-37.2	179	0	0	0	113.3
1868	I	22.4	Very low	22.3	Very low	154 Å²	154	143.9 Å²	143.9	79%	0.79	75%	0.751	S	S	*	*			trans	79.6	115.2	169.1	-46.9	177.8	0	0	0	113.4
1869	K	17.9	Very low	22.5	Very low	194 Å²	194	139.9 Å²	139.9	84%	0.843	74%	0.744	S	S	*	*			cis	75.7	96.6	27.3	-79.4	-170.9	172.7	178.5	0	117.8
1870	M	20.1	Very low	22.5	Very low	160 Å²	160	137.6 Å²	137.6	79%	0.788	74%	0.738	S	S	*	*				171	136.2	104.4	-94.1	-161.8	168.1	0	0	114.6
1871	K	20.5	Very low	22.5	Very low	156 Å²	156	141.8 Å²	141.8	68%	0.678	75%	0.746	S	S	*	*			trans	50.9	148.4	134.7	-65.8	-177.2	149.3	-74.9	0	121.2
1872	D	23.3	Very low	22.2	Very low	114 Å²	114	141.3 Å²	141.3	61%	0.61	75%	0.752	S	S	*	*			cis	-162.4	162	-3.4	-104.3	-23	0	0	0	110.3
1873	S	23.4	Very low	22.1	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	76%	0.756	S	S	*	*			trans	72.7	148.7	157.7	86.6	0	0	0	0	119
1874	N	22.3	Very low	22	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	76%	0.763	S	S	*	*			cis	-159.1	167.3	-21.4	-127.5	-25	0	0	0	114
1875	T	23.1	Very low	22	Very low	125 Å²	125	142.9 Å²	142.9	77%	0.767	77%	0.769	S	S	*	*			trans	61.2	107.6	162.3	51.7	0	0	0	0	121
1876	P	23.1	Very low	22.1	Very low	119 Å²	119	144.9 Å²	144.9	77%	0.773	77%	0.771	S	S	*	*			trans	-109.3	176.6	157.2	40.4	-32.1	0	0	0	112.6
1877	I	22.2	Very low	21.9	Very low	171 Å²	171	141.5 Å²	141.5	88%	0.877	77%	0.768	S	S	*	*			trans	-176.3	141.4	135	-97	154.7	0	0	0	109.8
1878	S	21	Very low	21.9	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	77%	0.773	S	S	*	*			trans	-140.6	172.5	178.4	61.2	0	0	0	0	112.2
1879	S	25.6	Very low	21.7	Very low	104 Å²	104	147 Å²	147	73%	0.727	78%	0.777	S	S	*	*			trans	-57	159.5	172.7	67.1	0	0	0	0	112.3
1880	P	28.4	Very low	21.8	Very low	110 Å²	110	145.5 Å²	145.5	71%	0.714	78%	0.776	S	S	*	*				-149.2	168.1	64.2	41.1	-22.2	0	0	0	117.6
1881	Y	20.9	Very low	21.8	Very low	222 Å²	222	144.1 Å²	144.1	87%	0.871	78%	0.777	S	S	*	*			trans	-151.7	124.3	146.4	-105.2	-77.2	0	0	0	110	I1883	Y1881-I1883 HydrophobicContact CD1-CD1 4.47Å; Y1881-I1883 HydrophobicContact CE1-CD1 4.45Å
1882	S	20	Very low	21.7	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	78%	0.784	S	S	*	*			trans	-149.8	128.6	169.6	179.8	0	0	0	0	108.1
1883	I	21	Very low	21.6	Very low	136 Å²	136	142.1 Å²	142.1	70%	0.697	79%	0.792	S	S	*	*			trans	-138.8	119.9	177.4	-62.8	-178.7	0	0	0	107.8	Y1881	Y1881-I1883 HydrophobicContact CD1-CD1 4.47Å; Y1881-I1883 HydrophobicContact CE1-CD1 4.45Å
1884	H	20.3	Very low	21.5	Very low	166 Å²	166	146.5 Å²	146.5	77%	0.769	80%	0.802	S	S	*	*			trans	-70.5	140.9	169.8	-91.4	-95.8	0	0	0	110.7
1885	L	21.6	Very low	21.4	Very low	167 Å²	167	145.9 Å²	145.9	87%	0.874	80%	0.804	S	S	*	*			trans	-118.5	129.3	160.9	-88	164.7	0	0	0	108.6
1886	N	21.6	Very low	21.3	Very low	144 Å²	144	147.6 Å²	147.6	77%	0.77	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.4	152.8	-169.3	-86.2	-21.9	0	0	0	113.5
1887	S	21.4	Very low	21.3	Very low	112 Å²	112	149.5 Å²	149.5	78%	0.783	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.1	125.3	176.4	55.2	0	0	0	0	112.5
1888	Y	19.4	Very low	21.5	Very low	219 Å²	219	150.2 Å²	150.2	86%	0.859	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-89.7	123.5	158	-87.9	-94.5	0	0	0	109.8
1889	K	18.6	Very low	21.6	Very low	200 Å²	200	150.3 Å²	150.3	87%	0.87	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-73	131.2	163.2	-77.2	179.6	174.1	177.6	0	108.4
1890	I	20.7	Very low	21.5	Very low	162 Å²	162	151 Å²	151	83%	0.831	80%	0.802	S	S	*	*			trans	-120.7	135	161.9	-65.3	178.8	0	0	0	107
1891	T	19.7	Very low	21.5	Very low	131 Å²	131	153.5 Å²	153.5	80%	0.804	80%	0.804	S	S	*	*			trans	-82.8	159.4	-173.7	39.1	0	0	0	0	112.7
1892	S	18.7	Very low	21.9	Very low	119 Å²	119	146.9 Å²	146.9	83%	0.832	80%	0.795	S	S	*	*	S	Bend	trans	-84.4	109.6	-177.7	51.7	0	0	0	0	112.9
1893	S	20.3	Very low	22.6	Very low	109 Å²	109	145.8 Å²	145.8	76%	0.762	78%	0.78	S	S	*	*			trans	-176.2	55.9	155.4	53.3	0	0	0	0	115.9
1894	M	20.7	Very low	23.2	Very low	198 Å²	198	148.7 Å²	148.7	98%	0.975	79%	0.787	S	S	*	*			trans	-141.5	142.3	156.2	-86	-154	155.4	0	0	112.6
1895	T	21.5	Very low	24	Very low	131 Å²	131	145 Å²	145	80%	0.804	77%	0.773	S	S	*	*			trans	-91.6	158.8	-167	40.1	0	0	0	0	113.7	Q1897	T1895-Q1897 PolarHBondContact O-N 3.27Å
1896	K	21	Very low	25	Very low	161 Å²	161	144.7 Å²	144.7	70%	0.7	76%	0.764	S	S	*	*			trans	-47.6	109.2	-177	-73.3	-172.1	175.9	-171.3	0	112.1	C1935 D1936	K1896-C1935 PolarHBondContact NZ-O 2.68Å; K1896-D1936 IonicContact NZ-OD1 2.78Å; K1896-D1936 PolarHBondContact NZ-OD1 3.08Å
1897	Q	23.4	Very low	26.4	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	75%	0.754	S	S	*	*			trans	-131.9	116.8	162.3	-77.4	-166.6	-15	0	0	112.4	T1895 C1899	T1895-Q1897 PolarHBondContact O-N 3.27Å; Q1897-C1899 PolarHBondContact O-N 3.13Å
1898	H	26.1	Very low	28.3	Very low	186 Å²	186	145.2 Å²	145.2	86%	0.861	75%	0.745	S	S	*	*			trans	35	68.9	149.1	-55.9	101.4	0	0	0	119.9
1899	C	22.7	Very low	31	Very low	113 Å²	113	138 Å²	138	76%	0.764	73%	0.725	S	S	*	*			trans	-101.6	91.8	175	-82.1	0	0	0	0	114.5	Q1897 Q1901	Q1897-C1899 PolarHBondContact O-N 3.13Å; C1899-Q1901 PolarHBondContact O-N 3.34Å; C1899-Q1901 VanDerWaalsContact O-N 3.15Å
1900	C	23.3	Very low	33.8	Very low	119 Å²	119	128.7 Å²	128.7	80%	0.804	69%	0.685	S	S	*	*			trans	-79.9	82.5	167.3	-84	0	0	0	0	112	A1902	C1900-A1902 PolarHBondContact O-N 2.86Å
1901	Q	28.3	Very low	37	Very low	162 Å²	162	124.6 Å²	124.6	76%	0.757	66%	0.664	S	S	*	*			trans	-69.3	129.9	178	-72.9	-166.9	-8.5	0	0	113.3	C1899 I1903	C1899-Q1901 PolarHBondContact O-N 3.34Å; C1899-Q1901 VanDerWaalsContact O-N 3.15Å; Q1901-I1903 PolarHBondContact O-N 2.87Å
1902	A	29	Very low	40.3	Very low	82 Å²	82	118.5 Å²	118.5	68%	0.678	63%	0.627	S	S	*	*			trans	-86.9	102.8	-177.4	0	0	0	0	0	112.5	C1900	C1900-A1902 PolarHBondContact O-N 2.86Å
1903	I	35	Very low	43.6	Very low	85 Å²	85	115.4 Å²	115.4	44%	0.436	60%	0.601	S	S	.	*	B	Isolated β-bridge	trans	-75	135.7	-173.9	-59.8	179.4	0	0	0	112.7	Q1901 I1905 I1933	Q1901-I1903 PolarHBondContact O-N 2.87Å; I1903-I1905 PolarHBondContact O-N 3.16Å; I1903-I1933 HydrophobicContact CD1-CD1 4.25Å
1904	K	33.5	Very low	46.6	Very low	198 Å²	198	111.1 Å²	111.1	86%	0.861	57%	0.57	S	S	*	*			trans	6.6	96	171.6	-79.6	-176.9	175.1	174.5	0	116.2	K1906	K1904-K1906 PolarHBondContact O-N 2.8Å
1905	I	38	Very low	49.3	Very low	89 Å²	89	106.8 Å²	106.8	46%	0.456	56%	0.557	S	S	.	*			trans	-54.9	122	169.9	-64.8	155.3	0	0	0	110.5	I1903 L1907 K1925	I1903-I1905 PolarHBondContact O-N 3.16Å; I1905-L1907 HydrophobicContact CG2-CD2 4.21Å; I1905-L1907 HydrophobicContact CG2-CG 4.11Å; I1905-L1907 PolarHBondContact O-N 2.86Å; I1905-K1925 HydrophobicContact CG2-CD 4.17Å; I1905-K1925 HydrophobicContact CG2-CG 3.43Å; I1905-K1925 VanDerWaalsContact CG2-CG 3.43Å
1906	K	42.2	Very low	52.1	Low	160 Å²	160	106.9 Å²	106.9	70%	0.696	55%	0.553	S	S	*	*			trans	-88.8	101.7	167.2	-77.2	-167.1	174.7	-176.1	0	110.9	K1904 L1926	K1904-K1906 PolarHBondContact O-N 2.8Å; K1906-L1926 PolarHBondContact O-N 2.93Å
1907	L	51.8	Low	54.5	Low	105 Å²	105	102.2 Å²	102.2	55%	0.55	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.9	141.7	164.5	-69.9	175.2	0	0	0	110	I1905 T1923 I1924 K1925	I1905-L1907 HydrophobicContact CG2-CD2 4.21Å; I1905-L1907 HydrophobicContact CG2-CG 4.11Å; I1905-L1907 PolarHBondContact O-N 2.86Å; L1907-T1923 HydrophobicContact CB-CG2 3.68Å; L1907-T1923 HydrophobicContact CD1-CG2 4.47Å; L1907-T1923 HydrophobicContact CD2-CG2 4.22Å; L1907-T1923 HydrophobicContact CG-CG2 4.33Å; L1907-I1924 WeakPolarHBondContact CA-O 3.5Å; L1907-K1925 HydrophobicContact CD2-CG 4.29Å
1908	R	60.4	Low	57.2	Low	162 Å²	162	97 Å²	97	61%	0.611	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	136.1	166.8	-85.3	-169.6	166.7	168.4	-6.3	111.6	T1923 I1924 L1926	R1908-T1923 CarbonylContact O-C 3.48Å; R1908-T1923 WeakPolarHBondContact O-CA 3.41Å; R1908-I1924 PolarHBondContact N-O 3.19Å; R1908-I1924 PolarHBondContact O-N 3.05Å; R1908-L1926 HydrophobicContact CB-CD1 3.79Å; R1908-L1926 HydrophobicContact CG-CD1 4.13Å
1909	P	75.8	Confident	59.9	Low	67 Å²	67	92.1 Å²	92.1	44%	0.435	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136	168.1	31.3	-35	0	0	0	110.6	E1921	P1909-E1921 HydrophobicContact CB-CG 3.8Å
1910	I	78.8	Confident	62.8	Low	4 Å²	4	89.7 Å²	89.7	2%	0.021	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	126.4	-177	-75.8	160.4	0	0	0	108.6	L1800 F1912 E1921 R1922 I1924 L1926	L1800-I1910 HydrophobicContact CD1-CD1 3.52Å; L1800-I1910 HydrophobicContact CD1-CG1 4.14Å; L1800-I1910 HydrophobicContact CD1-CG2 3.98Å; L1800-I1910 HydrophobicContact CD2-CD1 4.02Å; L1800-I1910 HydrophobicContact CD2-CG1 4.34Å; L1800-I1910 HydrophobicContact CG-CD1 4.44Å; I1910-F1912 HydrophobicContact CB-CE2 4.4Å; I1910-F1912 HydrophobicContact CG2-CD2 4.15Å; I1910-F1912 HydrophobicContact CG2-CE2 3.89Å; I1910-F1912 HydrophobicContact CG2-CZ 4.35Å; I1910-F1912 WeakPolarHBondContact O-CD2 3.05Å; I1910-E1921 WeakPolarHBondContact O-CA 3.22Å; I1910-R1922 PolarHBondContact N-O 3.33Å; I1910-R1922 PolarHBondContact O-N 3.25Å; I1910-I1924 HydrophobicContact CB-CD1 4Å; I1910-I1924 HydrophobicContact CB-CG1 4.17Å; I1910-I1924 HydrophobicContact CD1-CB 4.26Å; I1910-I1924 HydrophobicContact CD1-CD1 3.42Å; I1910-I1924 VanDerWaalsContact CD1-CD1 3.42Å; I1910-I1924 HydrophobicContact CD1-CG1 3.75Å; I1910-I1924 HydrophobicContact CG1-CD1 4.29Å; I1910-I1924 HydrophobicContact CG1-CG1 4.46Å; I1910-I1924 HydrophobicContact CG2-CD1 4.07Å; I1910-L1926 HydrophobicContact CD1-CD1 4.09Å; I1910-L1926 HydrophobicContact CD1-CD2 3.89Å; I1910-L1926 HydrophobicContact CD1-CG 4.18Å
1911	L	87.5	Confident	65.4	Low	77 Å²	77	89.8 Å²	89.8	40%	0.403	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.9	170.8	-79.8	154.4	0	0	0	111.2	S1796 S1797 V1919 Y1920 E1921	S1796-L1911 WeakPolarHBondContact CA-O 3.27Å; S1797-L1911 WeakPolarHBondContact CB-O 3.49Å; S1797-L1911 PolarHBondContact N-O 2.84Å; S1797-L1911 PolarHBondContact OG-O 3.44Å; S1797-L1911 VanDerWaalsContact OG-O 3.1Å; L1911-V1919 HydrophobicContact CD2-CG1 3.77Å; L1911-Y1920 CarbonylContact C-O 3.21Å; L1911-Y1920 WeakPolarHBondContact CA-O 3.43Å; L1911-E1921 HydrophobicContact CD2-CB 4.04Å; L1911-E1921 HydrophobicContact CG-CB 4.24Å; L1911-E1921 HydrophobicContact CG-CG 4.44Å
1912	F	89.2	Confident	67.5	Low	3 Å²	3	86.6 Å²	86.6	1%	0.013	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136.7	175.8	-78.9	-88.6	0	0	0	110.5	I1787 D1789 C1794 S1796 I1910 V1919 Y1920 R1922 I1924	I1787-F1912 HydrophobicContact CG2-CE1 4.26Å; I1787-F1912 HydrophobicContact CG2-CZ 4.2Å; I1787-F1912 WeakPolarHBondContact O-CE1 3.42Å; D1789-F1912 HydrophobicContact CB-CD1 3.98Å; D1789-F1912 HydrophobicContact CB-CE1 3.68Å; D1789-F1912 HydrophobicContact CB-CE2 4.48Å; D1789-F1912 HydrophobicContact CB-CZ 3.93Å; C1794-F1912 HydrophobicContact CB-CB 4.09Å; C1794-F1912 WeakPolarHBondContact O-CD1 3.3Å; S1796-F1912 VanDerWaalsContact N-CD1 3.32Å; I1910-F1912 HydrophobicContact CB-CE2 4.4Å; I1910-F1912 HydrophobicContact CG2-CD2 4.15Å; I1910-F1912 HydrophobicContact CG2-CE2 3.89Å; I1910-F1912 HydrophobicContact CG2-CZ 4.35Å; I1910-F1912 WeakPolarHBondContact O-CD2 3.05Å; F1912-V1919 VanDerWaalsContact O-CA 3.28Å; F1912-V1919 WeakPolarHBondContact O-CA 3.39Å; F1912-Y1920 HydrophobicContact CB-CD1 4.09Å; F1912-Y1920 HydrophobicContact CB-CE1 3.58Å; F1912-Y1920 HydrophobicContact CB-CE2 4.39Å; F1912-Y1920 HydrophobicContact CD2-CE2 4.31Å; F1912-Y1920 HydrophobicContact CG-CE1 4.41Å; F1912-Y1920 PolarHBondContact N-O 3.05Å; F1912-Y1920 PolarHBondContact O-N 2.94Å; F1912-R1922 HydrophobicContact CD2-CB 4.2Å; F1912-R1922 HydrophobicContact CE2-CB 4.18Å; F1912-I1924 HydrophobicContact CE2-CD1 3.55Å; F1912-I1924 HydrophobicContact CE2-CG1 4.07Å; F1912-I1924 HydrophobicContact CZ-CD1 3.42Å; F1912-I1924 VanDerWaalsContact CZ-CD1 3.42Å; F1912-I1924 HydrophobicContact CZ-CG1 4.34Å
1913	N	86.8	Confident	69.7	Low	53 Å²	53	86.6 Å²	86.6	28%	0.283	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.6	176.4	-66	35.1	0	0	0	109.3	C1794 I1795 S1797 V1919	C1794-N1913 CarbonylContact C-O 3.55Å; C1794-N1913 WeakPolarHBondContact CA-O 3.36Å; C1794-N1913 WeakPolarHBondContact CB-O 3.49Å; I1795-N1913 PolarHBondContact N-O 3.3Å; I1795-N1913 PolarHBondContact O-N 3.16Å; S1797-N1913 WeakPolarHBondContact CB-OD1 2.99Å; N1913-V1919 HydrophobicContact CB-CG2 4.5Å
1914	C	84.5	Confident	71.1	Confident	19 Å²	19	84.3 Å²	84.3	13%	0.128	44%	0.443	C	S	.	.			trans	-95.6	156.5	-174.4	-62.9	0	0	0	0	113.2	C1794 N1916 G1917 A1918	C1794-C1914 HydrophobicContact CB-CB 3.91Å; C1794-C1914 WeakPolarHBondContact CB-SG 3.48Å; C1794-C1914 WeakPolarHBondContact SG-CA 3.49Å; C1794-C1914 WeakPolarHBondContact SG-CB 3.41Å; C1794-C1914 CovalentContact SG-SG 2.03Å; C1794-C1914 PolarHBondContact SG-SG 3.4Å; C1914-N1916 WeakPolarHBondContact CB-OD1 3.24Å; C1914-N1916 PolarHBondContact O-N 3.02Å; C1914-G1917 PolarHBondContact O-N 3.17Å; C1914-A1918 HydrophobicContact CB-CB 4.08Å; C1914-A1918 VanDerWaalsContact CB-O 3.27Å; C1914-A1918 WeakPolarHBondContact CB-O 3.44Å; C1914-A1918 PolarHBondContact N-O 3.41Å
1915	P	76.9	Confident	72.2	Confident	107 Å²	107	81.5 Å²	81.5	70%	0.695	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-32.2	176.1	-23.9	34.5	0	0	0	113.4	G1917	P1915-G1917 PolarHBondContact O-N 3.06Å
1916	N	80.1	Confident	73.1	Confident	133 Å²	133	79.3 Å²	79.3	71%	0.711	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	24	175.7	62.6	-6.2	0	0	0	113.5	C1914 A1918	C1914-N1916 WeakPolarHBondContact CB-OD1 3.24Å; C1914-N1916 PolarHBondContact O-N 3.02Å; N1916-A1918 PolarHBondContact O-N 3.27Å
1917	G	71.9	Confident	73.1	Confident	64 Å²	64	74.2 Å²	74.2	66%	0.66	41%	0.407	S	S	*	.	S	Bend	trans	75	-14	175.1	0	0	0	0	0	116.1	C1914 P1915	C1914-G1917 PolarHBondContact O-N 3.17Å; P1915-G1917 PolarHBondContact O-N 3.06Å
1918	A	79.9	Confident	72.5	Confident	49 Å²	49	77.7 Å²	77.7	41%	0.405	42%	0.418	S	S	.	.			trans	-61.5	146.5	176.9	0	0	0	0	0	111.9	C1914 N1916	C1914-A1918 HydrophobicContact CB-CB 4.08Å; C1914-A1918 VanDerWaalsContact CB-O 3.27Å; C1914-A1918 WeakPolarHBondContact CB-O 3.44Å; C1914-A1918 PolarHBondContact N-O 3.41Å; N1916-A1918 PolarHBondContact O-N 3.27Å
1919	V	83.1	Confident	71.3	Confident	83 Å²	83	76.8 Å²	76.8	50%	0.503	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130	175.4	-178.9	0	0	0	0	108.7	L1911 F1912 N1913	L1911-V1919 HydrophobicContact CD2-CG1 3.77Å; F1912-V1919 VanDerWaalsContact O-CA 3.28Å; F1912-V1919 WeakPolarHBondContact O-CA 3.39Å; N1913-V1919 HydrophobicContact CB-CG2 4.5Å
1920	Y	83.1	Confident	69.2	Low	63 Å²	63	79 Å²	79	25%	0.247	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.4	178.6	72.6	-79.4	0	0	0	111.2	D1789 T1792 C1794 L1911 F1912 R1922	D1789-Y1920 VanDerWaalsContact CB-OH 3.3Å; D1789-Y1920 WeakPolarHBondContact CB-OH 3.27Å; D1789-Y1920 PolarHBondContact OD2-OH 2.8Å; T1792-Y1920 HydrophobicContact CG2-CE1 4.25Å; T1792-Y1920 WeakPolarHBondContact CG2-OH 3.4Å; T1792-Y1920 PolarHBondContact OG1-OH 3.27Å; C1794-Y1920 HydrophobicContact CB-CE1 3.83Å; L1911-Y1920 CarbonylContact C-O 3.21Å; L1911-Y1920 WeakPolarHBondContact CA-O 3.43Å; F1912-Y1920 HydrophobicContact CB-CD1 4.09Å; F1912-Y1920 HydrophobicContact CB-CE1 3.58Å; F1912-Y1920 HydrophobicContact CB-CE2 4.39Å; F1912-Y1920 HydrophobicContact CD2-CE2 4.31Å; F1912-Y1920 HydrophobicContact CG-CE1 4.41Å; F1912-Y1920 PolarHBondContact N-O 3.05Å; F1912-Y1920 PolarHBondContact O-N 2.94Å; Y1920-R1922 HydrophobicContact CD2-CB 4.2Å; Y1920-R1922 HydrophobicContact CE2-CB 3.79Å
1921	E	77.4	Confident	67	Low	120 Å²	120	81.4 Å²	81.4	56%	0.561	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.3	175.9	-172.8	165	-125.1	0	0	110.8	P1909 I1910 L1911	P1909-E1921 HydrophobicContact CB-CG 3.8Å; I1910-E1921 WeakPolarHBondContact O-CA 3.22Å; L1911-E1921 HydrophobicContact CD2-CB 4.04Å; L1911-E1921 HydrophobicContact CG-CB 4.24Å; L1911-E1921 HydrophobicContact CG-CG 4.44Å
1922	R	71.8	Confident	64.3	Low	96 Å²	96	83.8 Å²	83.8	36%	0.362	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.1	177.7	-169.5	178.3	-168.9	166.5	10	111.8	D1789 Q1791 I1910 F1912 Y1920 I1924	D1789-R1922 VanDerWaalsContact CG-NH1 3.29Å; D1789-R1922 IonicContact OD1-NH1 3.78Å; D1789-R1922 PolarHBondContact OD1-NH1 2.8Å; D1789-R1922 WeakPolarHBondContact OD2-CD 3.26Å; D1789-R1922 IonicContact OD2-CZ 2.89Å; D1789-R1922 IonicContact OD2-NE 3.81Å; D1789-R1922 IonicContact OD2-NH1 2.72Å; D1789-R1922 PolarHBondContact OD2-NH1 3.4Å; Q1791-R1922 VanDerWaalsContact OE1-CZ 3.28Å; I1910-R1922 PolarHBondContact N-O 3.33Å; I1910-R1922 PolarHBondContact O-N 3.25Å; F1912-R1922 HydrophobicContact CD2-CB 4.2Å; F1912-R1922 HydrophobicContact CE2-CB 4.18Å; Y1920-R1922 HydrophobicContact CD2-CB 4.2Å; Y1920-R1922 HydrophobicContact CE2-CB 3.79Å; R1922-I1924 PolarHBondContact O-N 3.2Å
1923	T	75.5	Confident	61.5	Low	81 Å²	81	89.6 Å²	89.6	50%	0.497	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	108.7	179	-53.7	0	0	0	0	111.2	L1907 R1908	L1907-T1923 HydrophobicContact CB-CG2 3.68Å; L1907-T1923 HydrophobicContact CD1-CG2 4.47Å; L1907-T1923 HydrophobicContact CD2-CG2 4.22Å; L1907-T1923 HydrophobicContact CG-CG2 4.33Å; R1908-T1923 CarbonylContact O-C 3.48Å; R1908-T1923 WeakPolarHBondContact O-CA 3.41Å
1924	I	65.6	Low	58.7	Low	38 Å²	38	96 Å²	96	20%	0.195	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	148.2	-178.4	-26.6	177.1	0	0	0	112.1	I1787 L1907 R1908 I1910 F1912 R1922 L1926	I1787-I1924 HydrophobicContact CD1-CD1 4.37Å; I1787-I1924 HydrophobicContact CG2-CD1 4.45Å; L1907-I1924 WeakPolarHBondContact CA-O 3.5Å; R1908-I1924 PolarHBondContact N-O 3.19Å; R1908-I1924 PolarHBondContact O-N 3.05Å; I1910-I1924 HydrophobicContact CB-CD1 4Å; I1910-I1924 HydrophobicContact CB-CG1 4.17Å; I1910-I1924 HydrophobicContact CD1-CB 4.26Å; I1910-I1924 HydrophobicContact CD1-CD1 3.42Å; I1910-I1924 VanDerWaalsContact CD1-CD1 3.42Å; I1910-I1924 HydrophobicContact CD1-CG1 3.75Å; I1910-I1924 HydrophobicContact CG1-CD1 4.29Å; I1910-I1924 HydrophobicContact CG1-CG1 4.46Å; I1910-I1924 HydrophobicContact CG2-CD1 4.07Å; F1912-I1924 HydrophobicContact CE2-CD1 3.55Å; F1912-I1924 HydrophobicContact CE2-CG1 4.07Å; F1912-I1924 HydrophobicContact CZ-CD1 3.42Å; F1912-I1924 VanDerWaalsContact CZ-CD1 3.42Å; F1912-I1924 HydrophobicContact CZ-CG1 4.34Å; R1922-I1924 PolarHBondContact O-N 3.2Å; I1924-L1926 PolarHBondContact O-N 3.18Å
1925	K	56.7	Low	55.7	Low	138 Å²	138	99.9 Å²	99.9	60%	0.6	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.6	101.5	165.8	-124.6	168.3	-176.3	168.7	0	109.6	I1905 L1907	I1905-K1925 HydrophobicContact CG2-CD 4.17Å; I1905-K1925 HydrophobicContact CG2-CG 3.43Å; I1905-K1925 VanDerWaalsContact CG2-CG 3.43Å; L1907-K1925 HydrophobicContact CD2-CG 4.29Å
1926	L	55.7	Low	53.4	Low	43 Å²	43	105 Å²	105	23%	0.225	58%	0.576	C	S	.	*			trans	-91.6	-15.3	-175.5	-78	179.4	0	0	0	115.3	I1787 K1906 R1908 I1910 I1924	I1787-L1926 HydrophobicContact CD1-CD2 4.25Å; K1906-L1926 PolarHBondContact O-N 2.93Å; R1908-L1926 HydrophobicContact CB-CD1 3.79Å; R1908-L1926 HydrophobicContact CG-CD1 4.13Å; I1910-L1926 HydrophobicContact CD1-CD1 4.09Å; I1910-L1926 HydrophobicContact CD1-CD2 3.89Å; I1910-L1926 HydrophobicContact CD1-CG 4.18Å; I1924-L1926 PolarHBondContact O-N 3.18Å
1927	A	43.2	Very low	52	Low	53 Å²	53	103.7 Å²	103.7	44%	0.438	57%	0.57	S	S	.	*			trans	-153.2	137.1	175.4	0	0	0	0	0	111.4
1928	K	37.8	Very low	51	Low	178 Å²	178	105.7 Å²	105.7	77%	0.774	57%	0.565	S	S	*	*			trans	-109.4	107.5	160.3	-151.3	-174	-174.3	-169.1	0	105.2
1929	K	35.3	Very low	49.4	Very low	144 Å²	144	108.9 Å²	108.9	63%	0.626	57%	0.574	S	S	*	*	B	Isolated β-bridge	trans	-83.9	113.5	168.9	-100.2	-164.9	172.5	-166.9	0	107.4	T1931	K1929-T1931 HydrophobicContact CD-CG2 4.27Å
1930	C	31.8	Very low	47.4	Very low	112 Å²	112	110.4 Å²	110.4	76%	0.757	58%	0.578	S	S	*	*			trans	-86.7	131.2	150.8	-59.9	0	0	0	0	106.7
1931	T	33.3	Very low	45.1	Very low	55 Å²	55	113.4 Å²	113.4	34%	0.337	60%	0.599	S	S	.	*			trans	-135.5	112.9	170.7	42.8	0	0	0	0	106.9	K1929 I1933	K1929-T1931 HydrophobicContact CD-CG2 4.27Å; T1931-I1933 PolarHBondContact O-N 2.93Å
1932	C	30.7	Very low	43	Very low	127 Å²	127	112.9 Å²	112.9	86%	0.858	60%	0.601	S	S	*	*			trans	-63.8	104	165.3	-55.7	0	0	0	0	106.9
1933	I	30	Very low	40.9	Very low	126 Å²	126	114.1 Å²	114.1	65%	0.646	62%	0.618	S	S	*	*			trans	-84	135.4	166.4	-63.9	178	0	0	0	105.8	I1903 T1931	I1903-I1933 HydrophobicContact CD1-CD1 4.25Å; T1931-I1933 PolarHBondContact O-N 2.93Å
1934	Q	28.1	Very low	38.3	Very low	188 Å²	188	116.7 Å²	116.7	88%	0.879	63%	0.628	S	S	*	*			trans	-59.9	139.3	176.3	-98.9	170.2	-71.7	0	0	110.6	D1936	Q1934-D1936 PolarHBondContact O-N 3.14Å
1935	C	22.5	Very low	36	Very low	100 Å²	100	123.3 Å²	123.3	68%	0.676	66%	0.664	S	S	*	*			trans	-93.1	60.6	-170.6	-66.4	0	0	0	0	113.5	K1896	K1896-C1935 PolarHBondContact NZ-O 2.68Å
1936	D	26.9	Very low	34.1	Very low	215 Å²	215	121.9 Å²	121.9	100%	1.15	67%	0.67	S	S	*	*			trans	-137.4	0	165.7	-78.9	-41.1	0	0	0	112.2	K1896 Q1934	K1896-D1936 IonicContact NZ-OD1 2.78Å; K1896-D1936 PolarHBondContact NZ-OD1 3.08Å; Q1934-D1936 PolarHBondContact O-N 3.14Å

Retrieved 1,936 of 1,936 residues in 2774.3 ms (Link to these results)

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