A0A087YJH0_POEFO Loading...

Cilia- and flagella-associated protein 251

AlphaFold DB , UniProt , Accession A0A087YJH0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 960 aa.

						>A0A087YJH0_POEFO|A0A087YJH0
AEQPTSSEPTEHPTLISAKQQQNSGYAGKEENVQTTHSITNVHGQSQVYTATQDTLFSNEAARPAMHALSLERVFGMNPVLPVYSLQDSDQLIFLYASAHVGIIFNHTLNSQYILQGHCCPISCMCVSEDRRWIATVDRGPRNMVIIWDSYSGIPVNTLFECHPDSSVAAVGFSNDTKYLATLGDAEDQQSVVIWDWTSKEQKCLCHVELNPKDGFQDHIIFNPNDSTQLLSGSKTHILIYKWDTEGLKYFALKLKKVTPATDPDVSAQLTTDPSKSIPFADLCLSRSVFHWKKLQVLKAIGSSIVVWEIGKNLIEKQSQCFGRIQTVHIQQEPITVLTITDTYIVTGDIQGNVRFYDENFLLVSWYTDFNQDPVVYISFSKELPKETNEEDYFQDVDPLIIRNFITSTINAKIMHLNTQTGVIQTVLQNDYDPLHALTCHPFQPVVAFGNLQGMLRLWDYNCKAIIGNRIFETEKQIQSITFDPKGLFLAVGFRTGAVYILDATTLQNNPQEIFNCIKDSIHLITFSHDSQYLATADASRVVSLFRNEGHTDSSPRWMFVGRYCSHYKPIQDLLFGVQLYSAKPRLLSVGLDRQLEQQVEYDLEKSESNKLLLISIKRIEQSAVPRCMTWYPFFNPEEFLLVSSDNYKMKLFNSTTTMCRNRKTLLGPTYGSPIRKIIVLPKATTSKTKSHHLAFITDNMLGLQILPMDGNPYKSSALICHPTGVSTFSCSYDGKFVFTAGGSDSSALSWKVNLDVLDAAAALGGADMDPFYSLIEGGRDGRFYKEMEDFFFYCQIRHQGTDMMKRIEVSTKIPLSEVPFLMRALGHFPTEQEIEDMFNEIKFSRYAETGKYVTDIDLEDFIKLYINHRPAFGISSEELLQAFNVLGKKNLLGSPIIQKSEMIKFLQARGEHMTEEEVADCLTHLVSKSGVYTAEECSLGSVIPERISVELFTHQILGL
					

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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	A	33.9	Very low	28.6	Very low	143 Å²	143	150.7 Å²	150.7	100%	1.182	88%	0.877	S	S	*	*				0	63.4	0	0	0	0	0	0	107.3
2	E	28.6	Very low	28.2	Very low	187 Å²	187	152 Å²	152	87%	0.874	87%	0.868	S	S	*	*				60.9	89.1	51.2	-72.2	-174.7	176.4	0	0	113.3
3	Q	27.2	Very low	28	Very low	196 Å²	196	150.5 Å²	150.5	92%	0.916	87%	0.867	S	S	*	*				-169.6	128.9	113.7	-97.3	-177.1	-6.7	0	0	109.9
4	P	36.4	Very low	27.8	Very low	129 Å²	129	149.3 Å²	149.3	84%	0.838	86%	0.864	S	S	*	*			trans	-111.6	147.9	155.9	34.2	-22.7	0	0	0	111.5
5	T	28.8	Very low	27.6	Very low	135 Å²	135	150.3 Å²	150.3	83%	0.828	86%	0.863	S	S	*	*			trans	-87.4	122.5	-178	42.8	0	0	0	0	112.4
6	S	26.3	Very low	27.4	Very low	116 Å²	116	151.8 Å²	151.8	81%	0.811	87%	0.865	S	S	*	*			trans	22	110.5	148.8	60	0	0	0	0	120.2
7	S	27.1	Very low	27.2	Very low	118 Å²	118	148.2 Å²	148.2	83%	0.825	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-97.5	126.6	156.6	52.2	0	0	0	0	110.5
8	E	26.8	Very low	27	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-76.7	139.2	165	-70.6	177.2	157	0	0	110.1
9	P	29	Very low	26.9	Very low	121 Å²	121	147.9 Å²	147.9	79%	0.786	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-91.5	137.5	170.5	33	-27.5	0	0	0	111.8
10	T	25.3	Very low	26.8	Very low	129 Å²	129	150.3 Å²	150.3	79%	0.791	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-61.8	124.7	168.8	40.6	0	0	0	0	111.9
11	E	24.8	Very low	26.7	Very low	194 Å²	194	152.1 Å²	152.1	91%	0.907	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-76.4	131	170.9	-71.5	-177.1	153.1	0	0	111.3
12	H	24.3	Very low	26.2	Very low	166 Å²	166	154.2 Å²	154.2	77%	0.769	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-86.5	146.1	166.2	-75.7	-79.8	0	0	0	110.4	T14	H12-T14 PolarHBondContact O-N 3Å
13	P	25.6	Very low	25.9	Very low	133 Å²	133	153.5 Å²	153.5	86%	0.864	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-74.2	121	-179.1	29.3	-31.3	0	0	0	111.1
14	T	25.2	Very low	25.8	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-88.6	143.9	175.3	20.7	0	0	0	0	111.1	H12 I16	H12-T14 PolarHBondContact O-N 3Å; T14-I16 PolarHBondContact O-N 3.09Å
15	L	24.6	Very low	25.3	Very low	164 Å²	164	147 Å²	147	86%	0.859	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-51.8	131.2	173.9	-79.1	109	0	0	0	112.1	S17	L15-S17 PolarHBondContact O-N 3.22Å; L15-S17 VanDerWaalsContact O-N 3.1Å
16	I	24.3	Very low	25.2	Very low	174 Å²	174	151.6 Å²	151.6	89%	0.892	84%	0.837	S	S	*	*			trans	-69.4	106.1	176.2	-63.3	171.6	0	0	0	108.8	T14	T14-I16 PolarHBondContact O-N 3.09Å
17	S	23.6	Very low	25.3	Very low	92 Å²	92	151.4 Å²	151.4	64%	0.643	84%	0.843	S	S	*	*			trans	-76.8	134.6	164	49.3	0	0	0	0	110	L15 K19	L15-S17 PolarHBondContact O-N 3.22Å; L15-S17 VanDerWaalsContact O-N 3.1Å; S17-K19 PolarHBondContact O-N 3.14Å
18	A	24.1	Very low	25.2	Very low	104 Å²	104	149 Å²	149	86%	0.86	84%	0.836	S	S	*	*			trans	-61.6	106.5	173	0	0	0	0	0	110.2
19	K	24.6	Very low	25.2	Very low	187 Å²	187	150.2 Å²	150.2	81%	0.813	84%	0.839	S	S	*	*			trans	-78.8	121.2	170.9	-84.1	-178.6	175.4	174.9	0	110.3	S17 Q21	S17-K19 PolarHBondContact O-N 3.14Å; K19-Q21 PolarHBondContact O-N 3.28Å
20	Q	24.6	Very low	25	Very low	194 Å²	194	153.2 Å²	153.2	91%	0.907	84%	0.842	S	S	*	*			trans	-51	115.2	157.9	-77.1	172.6	-25.9	0	0	109.5	Q22	Q20-Q22 PolarHBondContact O-N 3.19Å
21	Q	25	Very low	25	Very low	190 Å²	190	156.3 Å²	156.3	89%	0.888	85%	0.848	S	S	*	*			trans	-76.2	115.8	170.5	-83.6	-178.9	-18.7	0	0	109.9	K19	K19-Q21 PolarHBondContact O-N 3.28Å
22	Q	23.8	Very low	24.8	Very low	186 Å²	186	154 Å²	154	87%	0.869	84%	0.842	S	S	*	*			trans	-74.4	123.2	161	-74.3	179.3	-20	0	0	108.9	Q20 S24	Q20-Q22 PolarHBondContact O-N 3.19Å; Q22-S24 PolarHBondContact O-N 3.06Å
23	N	23.6	Very low	25	Very low	172 Å²	172	152.3 Å²	152.3	92%	0.92	84%	0.843	S	S	*	*			trans	-60.4	120.5	170.2	-86.3	-21.6	0	0	0	110.7
24	S	25.1	Very low	24.9	Very low	113 Å²	113	154.2 Å²	154.2	79%	0.79	84%	0.84	S	S	*	*			trans	-118.8	133.9	157.5	58.9	0	0	0	0	109.1	Q22	Q22-S24 PolarHBondContact O-N 3.06Å
25	G	24.9	Very low	24.8	Very low	75 Å²	75	153.6 Å²	153.6	77%	0.773	84%	0.836	S	S	*	*			trans	-72.2	143.1	-159.9	0	0	0	0	0	115.2
26	Y	26.4	Very low	24.8	Very low	232 Å²	232	152.1 Å²	152.1	91%	0.91	83%	0.834	S	S	*	*			trans	-123.7	117.7	155.2	-98.5	-89.2	0	0	0	108.7	G28	Y26-G28 PolarHBondContact O-N 3.26Å
27	A	27.9	Very low	24.9	Very low	113 Å²	113	152 Å²	152	93%	0.934	83%	0.829	S	S	*	*			trans	-74	118	174.5	0	0	0	0	0	109.8
28	G	25.7	Very low	24.8	Very low	66 Å²	66	152.8 Å²	152.8	68%	0.68	84%	0.835	S	S	*	*			trans	-142	127	171.4	0	0	0	0	0	109.1	Y26	Y26-G28 PolarHBondContact O-N 3.26Å
29	K	26.5	Very low	24.9	Very low	216 Å²	216	155 Å²	155	94%	0.939	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-56.2	125.6	-167.8	-68.3	167	173.1	176.1	0	113.7
30	E	24.8	Very low	25	Very low	185 Å²	185	151.5 Å²	151.5	86%	0.864	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-83.3	125	166.1	-72.6	179.4	155.8	0	0	110.6
31	E	25	Very low	25.1	Very low	194 Å²	194	149 Å²	149	91%	0.907	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-85.7	126.1	155.5	-82.7	-173.5	159.5	0	0	108.9	V33	E31-V33 PolarHBondContact O-N 2.97Å
32	N	22.3	Very low	25.5	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-59.9	119.2	-178.9	-80	-48.6	0	0	0	112.7
33	V	27	Very low	26.1	Very low	130 Å²	130	145.1 Å²	145.1	79%	0.788	81%	0.807	S	S	*	*			trans	-124.5	101.9	147.3	-178.8	0	0	0	0	107.7	E31 T35	E31-V33 PolarHBondContact O-N 2.97Å; V33-T35 PolarHBondContact O-N 2.84Å
34	Q	23.4	Very low	27.1	Very low	173 Å²	173	140 Å²	140	81%	0.808	80%	0.795	S	S	*	*			trans	-69.5	108.1	174.2	-74.6	175.4	-23.3	0	0	109.8
35	T	24.6	Very low	28.6	Very low	120 Å²	120	142 Å²	142	74%	0.736	79%	0.792	S	S	*	*			trans	-118.9	105.4	153.3	34.5	0	0	0	0	108.3	V33 H37	V33-T35 PolarHBondContact O-N 2.84Å; T35-H37 PolarHBondContact O-N 2.84Å
36	T	24.4	Very low	30.7	Very low	133 Å²	133	141.4 Å²	141.4	82%	0.816	78%	0.776	S	S	*	*			trans	-66.2	97.7	177.6	45.4	0	0	0	0	110.8
37	H	25.2	Very low	32.9	Very low	170 Å²	170	136.6 Å²	136.6	79%	0.787	76%	0.762	S	S	*	*			trans	-112.6	108.8	149.8	-77.2	-57.5	0	0	0	107.9	T35 I39	T35-H37 PolarHBondContact O-N 2.84Å; H37-I39 PolarHBondContact O-N 3.05Å
38	S	22.6	Very low	35.1	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	72%	0.723	S	S	*	*			trans	-59	100.4	172	49.7	0	0	0	0	109.5	T40	S38-T40 VanDerWaalsContact C-N 3.31Å; S38-T40 PolarHBondContact O-N 3.48Å
39	I	25.7	Very low	37.3	Very low	151 Å²	151	138.5 Å²	138.5	77%	0.774	73%	0.728	S	S	*	*			trans	-68.7	95.9	164.8	-61	170.5	0	0	0	106	H37 N41	H37-I39 PolarHBondContact O-N 3.05Å; I39-N41 PolarHBondContact O-N 3.37Å; I39-N41 VanDerWaalsContact O-N 3.09Å
40	T	26.2	Very low	39.6	Very low	112 Å²	112	131.5 Å²	131.5	69%	0.687	70%	0.703	S	S	*	*			trans	-63.3	106.7	161.5	43.1	0	0	0	0	107.2	S38 V42	S38-T40 VanDerWaalsContact C-N 3.31Å; S38-T40 PolarHBondContact O-N 3.48Å; T40-V42 VanDerWaalsContact C-N 3.27Å; T40-V42 PolarHBondContact O-N 3.18Å
41	N	27.6	Very low	42.1	Very low	143 Å²	143	123.3 Å²	123.3	77%	0.765	67%	0.667	S	S	*	*			trans	-58.3	89.4	166.3	-84.8	-24	0	0	0	109.2	I39 H43	I39-N41 PolarHBondContact O-N 3.37Å; I39-N41 VanDerWaalsContact O-N 3.09Å; N41-H43 PolarHBondContact O-N 2.76Å
42	V	33.4	Very low	44.6	Very low	120 Å²	120	117.8 Å²	117.8	73%	0.727	65%	0.647	S	S	*	*			trans	-76.2	100.8	163.1	-177.3	0	0	0	0	105.8	T40 G44	T40-V42 VanDerWaalsContact C-N 3.27Å; T40-V42 PolarHBondContact O-N 3.18Å; V42-G44 PolarHBondContact O-N 3.31Å
43	H	35.8	Very low	46.9	Very low	173 Å²	173	115 Å²	115	80%	0.801	63%	0.629	S	S	*	*			trans	-62.3	87.9	158.2	-84.4	8.8	0	0	0	107.2	N41 Q45	N41-H43 PolarHBondContact O-N 2.76Å; H43-Q45 PolarHBondContact O-N 3.37Å
44	G	44.8	Very low	49	Very low	64 Å²	64	113 Å²	113	66%	0.66	61%	0.614	S	S	*	*			trans	-62.9	108.5	177.9	0	0	0	0	0	109.2	V42	V42-G44 PolarHBondContact O-N 3.31Å
45	Q	55.4	Low	51.6	Low	157 Å²	157	106.9 Å²	106.9	73%	0.734	59%	0.588	S	S	*	*			trans	-59.9	140.1	168.4	-67.7	177.9	-17.1	0	0	108.6	H43 Q47 T50	H43-Q45 PolarHBondContact O-N 3.37Å; Q45-Q47 PolarHBondContact O-N 2.81Å; Q45-T50 HydrophobicContact CB-CG2 3.98Å
46	S	69.8	Low	54	Low	61 Å²	61	101.8 Å²	101.8	43%	0.427	56%	0.557	S	S	.	*			trans	-60.9	133.5	-178.2	164.7	0	0	0	0	111	V48 Y49 T50	S46-V48 PolarHBondContact O-N 2.74Å; S46-V48 PolarHBondContact OG-N 2.97Å; S46-Y49 PolarHBondContact O-N 2.93Å; S46-Y49 VanDerWaalsContact O-N 3.08Å; S46-T50 PolarHBondContact O-N 3.42Å; S46-T50 PolarHBondContact O-OG1 3.39Å; S46-T50 VanDerWaalsContact O-OG1 3.1Å
47	Q	72.3	Confident	56.4	Low	131 Å²	131	96.8 Å²	96.8	61%	0.612	52%	0.524	S	S	*	.	H	α-helix	trans	-61.4	-29.6	-178.3	-69.5	-177.4	-8.7	0	0	112.4	Q45 T50 A51 I154	Q45-Q47 PolarHBondContact O-N 2.81Å; Q47-T50 PolarHBondContact O-OG1 3.4Å; Q47-A51 WeakPolarHBondContact O-CB 3.48Å; Q47-A51 PolarHBondContact O-N 3.06Å; Q47-A51 VanDerWaalsContact O-N 3.1Å; Q47-I154 HydrophobicContact CB-CD1 3.89Å
48	V	74.7	Confident	58.1	Low	20 Å²	20	92.1 Å²	92.1	12%	0.121	51%	0.51	C	S	.	.	H	α-helix	trans	-71.4	-32.2	177	-178.6	0	0	0	0	111.9	S46 D149 I154 V156	S46-V48 PolarHBondContact O-N 2.74Å; S46-V48 PolarHBondContact OG-N 2.97Å; V48-D149 HydrophobicContact CG1-CB 4.1Å; V48-I154 HydrophobicContact CG2-CB 4.07Å; V48-I154 HydrophobicContact CG2-CD1 4.07Å; V48-I154 HydrophobicContact CG2-CG2 4.11Å; V48-V156 HydrophobicContact CG1-CG2 4.13Å; V48-V156 HydrophobicContact CG2-CG2 4.44Å
49	Y	71.1	Confident	59.6	Low	199 Å²	199	92.1 Å²	92.1	78%	0.78	50%	0.502	S	S	*	.	H	α-helix	trans	-80.7	-24.7	179.5	-77.2	-89.9	0	0	0	113.1	S46	S46-Y49 PolarHBondContact O-N 2.93Å; S46-Y49 VanDerWaalsContact O-N 3.08Å
50	T	76.6	Confident	60.7	Low	69 Å²	69	92.2 Å²	92.2	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-96.7	-4	178.9	49.6	0	0	0	0	112.9	Q45 S46 Q47	Q45-T50 HydrophobicContact CB-CG2 3.98Å; S46-T50 PolarHBondContact O-N 3.42Å; S46-T50 PolarHBondContact O-OG1 3.39Å; S46-T50 VanDerWaalsContact O-OG1 3.1Å; Q47-T50 PolarHBondContact O-OG1 3.4Å
51	A	77.3	Confident	61.3	Low	13 Å²	13	91.9 Å²	91.9	11%	0.107	51%	0.508	C	S	.	.			trans	-66.1	136	179.4	0	0	0	0	0	112.1	Q47 T55	Q47-A51 WeakPolarHBondContact O-CB 3.48Å; Q47-A51 PolarHBondContact O-N 3.06Å; Q47-A51 VanDerWaalsContact O-N 3.1Å; A51-T55 WeakPolarHBondContact CA-OG1 3.4Å
52	T	76.8	Confident	62	Low	78 Å²	78	88.7 Å²	88.7	48%	0.479	50%	0.501	S	S	.	.			trans	-122.4	170.8	172.8	65.3	0	0	0	0	109.2	D54 T55 Y151	T52-D54 PolarHBondContact O-N 3.1Å; T52-T55 PolarHBondContact N-OG1 3.41Å; T52-T55 PolarHBondContact O-N 3.1Å; T52-T55 PolarHBondContact O-OG1 3.26Å; T52-Y151 WeakPolarHBondContact O-CB 3.42Å
53	Q	71.3	Confident	63.1	Low	88 Å²	88	89 Å²	89	41%	0.411	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-32.3	-178.8	-71.5	174.2	-6.4	0	0	113.1	Y151	Q53-Y151 HydrophobicContact CB-CE1 4.38Å; Q53-Y151 HydrophobicContact CG-CD1 4.15Å; Q53-Y151 HydrophobicContact CG-CE1 3.52Å; Q53-Y151 HydrophobicContact CG-CE2 4.2Å; Q53-Y151 PolarHBondContact NE2-OH 3.48Å
54	D	71	Confident	64.1	Low	88 Å²	88	85.6 Å²	85.6	47%	0.471	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-4.8	-179.7	-54.2	-42.9	0	0	0	114.6	T52 L56 S58	T52-D54 PolarHBondContact O-N 3.1Å; D54-L56 VanDerWaalsContact C-N 3.27Å; D54-L56 PolarHBondContact O-N 3.08Å; D54-S58 VanDerWaalsContact O-CB 3.25Å; D54-S58 WeakPolarHBondContact O-CB 3.19Å; D54-S58 PolarHBondContact O-N 3.23Å; D54-S58 PolarHBondContact O-OG 2.68Å
55	T	76.2	Confident	65.1	Low	44 Å²	44	84.7 Å²	84.7	27%	0.27	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.9	-174	44.8	0	0	0	0	114	A51 T52 S58 Y151	A51-T55 WeakPolarHBondContact CA-OG1 3.4Å; T52-T55 PolarHBondContact N-OG1 3.41Å; T52-T55 PolarHBondContact O-N 3.1Å; T52-T55 PolarHBondContact O-OG1 3.26Å; T55-S58 WeakPolarHBondContact CA-OG 3.23Å; T55-S58 PolarHBondContact O-OG 2.85Å; T55-Y151 PolarHBondContact OG1-O 3.14Å
56	L	76.8	Confident	65.8	Low	13 Å²	13	84.3 Å²	84.3	7%	0.068	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-42.4	-174.9	-158.1	101.2	0	0	0	112.2	D54 I104 Y113 S150 Y151	D54-L56 VanDerWaalsContact C-N 3.27Å; D54-L56 PolarHBondContact O-N 3.08Å; L56-I104 HydrophobicContact CD1-CD1 4.35Å; L56-I104 HydrophobicContact CD2-CB 4.22Å; L56-I104 HydrophobicContact CD2-CD1 4.34Å; L56-I104 HydrophobicContact CD2-CG2 3.85Å; L56-Y113 HydrophobicContact CD1-CD1 3.96Å; L56-Y113 HydrophobicContact CD1-CD2 4.19Å; L56-Y113 HydrophobicContact CD1-CE1 4.13Å; L56-Y113 HydrophobicContact CD1-CE2 4.32Å; L56-Y113 HydrophobicContact CD1-CG 4Å; L56-Y113 HydrophobicContact CD2-CD1 4.11Å; L56-Y113 HydrophobicContact CD2-CD2 4.03Å; L56-Y113 HydrophobicContact CD2-CG 3.56Å; L56-Y113 HydrophobicContact CG-CD1 4.29Å; L56-Y113 HydrophobicContact CG-CD2 3.84Å; L56-Y113 HydrophobicContact CG-CE2 4.33Å; L56-Y113 HydrophobicContact CG-CG 3.81Å; L56-S150 WeakPolarHBondContact CD1-O 3.38Å; L56-Y151 WeakPolarHBondContact CA-O 3.29Å; L56-Y151 WeakPolarHBondContact CB-O 3.32Å; L56-Y151 PolarHBondContact N-O 2.94Å; L56-Y151 VanDerWaalsContact N-O 3.16Å
57	F	73.8	Confident	66.4	Low	28 Å²	28	86.6 Å²	86.6	12%	0.123	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-3.8	-172.2	-65.2	-70.9	0	0	0	114.2	I93 I104 N106 L109 S111	F57-I93 HydrophobicContact CD2-CD1 4.05Å; F57-I93 HydrophobicContact CE2-CD1 3.9Å; F57-I93 HydrophobicContact CE2-CG1 4.28Å; F57-I93 HydrophobicContact CE2-CG2 4.22Å; F57-I104 HydrophobicContact CE2-CG2 4.2Å; F57-I104 HydrophobicContact CZ-CG2 4.12Å; F57-N106 HydrophobicContact CD1-CB 4.31Å; F57-N106 HydrophobicContact CD2-CB 4.15Å; F57-N106 HydrophobicContact CE1-CB 3.88Å; F57-N106 HydrophobicContact CE2-CB 3.71Å; F57-N106 HydrophobicContact CG-CB 4.43Å; F57-N106 HydrophobicContact CZ-CB 3.56Å; F57-L109 HydrophobicContact CB-CD1 4.33Å; F57-S111 VanDerWaalsContact CD1-OG 3.25Å; F57-S111 WeakPolarHBondContact CD1-OG 3.41Å; F57-S111 VanDerWaalsContact CE1-OG 3.29Å; F57-S111 WeakPolarHBondContact CE1-OG 3.41Å
58	S	60.6	Low	67	Low	72 Å²	72	80.5 Å²	80.5	50%	0.503	44%	0.444	S	S	.	.	S	Bend	trans	-83.6	-15.7	-176.5	48.1	0	0	0	0	115.1	D54 T55	D54-S58 VanDerWaalsContact O-CB 3.25Å; D54-S58 WeakPolarHBondContact O-CB 3.19Å; D54-S58 PolarHBondContact O-N 3.23Å; D54-S58 PolarHBondContact O-OG 2.68Å; T55-S58 WeakPolarHBondContact CA-OG 3.23Å; T55-S58 PolarHBondContact O-OG 2.85Å
59	N	53.8	Low	67.7	Low	111 Å²	111	79.7 Å²	79.7	59%	0.594	44%	0.439	S	S	*	.			trans	-135.3	65.5	-172.9	-88.5	-31.5	0	0	0	113.5	A61	N59-A61 VanDerWaalsContact C-N 3.27Å; N59-A61 PolarHBondContact O-N 2.8Å
60	E	49.8	Very low	68.6	Low	152 Å²	152	72 Å²	72	71%	0.71	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-69.9	-23.7	169.6	-76	-173.1	166.1	0	0	112.8	A62	E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.43Å
61	A	38.8	Very low	69.2	Low	106 Å²	106	69.7 Å²	69.7	88%	0.876	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-78.3	-4	-169.4	0	0	0	0	0	115.9	N59	N59-A61 VanDerWaalsContact C-N 3.27Å; N59-A61 PolarHBondContact O-N 2.8Å
62	A	42.8	Very low	69.8	Low	75 Å²	75	72.1 Å²	72.1	62%	0.62	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-135.5	13.2	-164.5	0	0	0	0	0	116.5	E60 P64	E60-A62 VanDerWaalsContact C-N 3.34Å; E60-A62 PolarHBondContact O-N 3.43Å; A62-P64 WeakPolarHBondContact O-CD 3.49Å
63	R	56.5	Low	70.4	Confident	127 Å²	127	69.3 Å²	69.3	48%	0.479	39%	0.39	S	S	.	.			trans	-94.8	110.5	171.5	-66.8	-171	-175.5	-166.5	3.8	109.7	A65 Y113 S152	R63-A65 PolarHBondContact O-N 2.9Å; R63-Y113 VanDerWaalsContact NH1-CE2 3.32Å; R63-Y113 PolarHBondContact NH1-OH 3.35Å; R63-S152 PolarHBondContact NH2-O 3.05Å; R63-S152 VanDerWaalsContact NH2-O 3.09Å
64	P	56.9	Low	71.3	Confident	101 Å²	101	65.2 Å²	65.2	66%	0.656	37%	0.37	S	S	*	.			trans	-61.3	134.7	175.1	25.2	-31.7	0	0	0	109.1	A62 M66	A62-P64 WeakPolarHBondContact O-CD 3.49Å; P64-M66 HydrophobicContact CG-SD 4.49Å; P64-M66 PolarHBondContact O-N 3.3Å; P64-M66 VanDerWaalsContact O-N 3.09Å
65	A	64.2	Low	72.1	Confident	46 Å²	46	62.4 Å²	62.4	38%	0.38	35%	0.354	S	S	.	.			trans	-64.3	113	173.9	0	0	0	0	0	109	R63 N754 V757	R63-A65 PolarHBondContact O-N 2.9Å; A65-N754 HydrophobicContact CB-CB 4.28Å; A65-N754 VanDerWaalsContact CB-ND2 3.33Å; A65-N754 WeakPolarHBondContact CB-ND2 3.38Å; A65-V757 HydrophobicContact CB-CG2 4.39Å; A65-V757 WeakPolarHBondContact O-CG2 3.34Å
66	M	71.6	Confident	72.5	Confident	148 Å²	148	60.5 Å²	60.5	73%	0.729	34%	0.343	S	S	*	.			trans	-84	-17.1	179.9	-61.9	-64	-79.4	0	0	112.4	P64	P64-M66 HydrophobicContact CG-SD 4.49Å; P64-M66 PolarHBondContact O-N 3.3Å; P64-M66 VanDerWaalsContact O-N 3.09Å
67	H	81.7	Confident	73	Confident	109 Å²	109	60.1 Å²	60.1	51%	0.505	34%	0.341	S	S	.	.	S	Bend	trans	-126.2	147.8	-175.1	-59.1	-60.7	0	0	0	111.4	L69 L719 N754	H67-L69 WeakPolarHBondContact CB-O 3.37Å; H67-L69 PolarHBondContact O-N 2.83Å; H67-L719 HydrophobicContact CB-CD1 4.28Å; H67-N754 PolarHBondContact O-ND2 3.25Å
68	A	84.4	Confident	73.5	Confident	3 Å²	3	60.5 Å²	60.5	3%	0.025	35%	0.345	C	S	.	.	S	Bend	trans	-61.8	-28.3	176.3	0	0	0	0	0	112.5	L704 N754 L758	A68-L704 HydrophobicContact CB-CD1 4.3Å; A68-N754 PolarHBondContact O-N 2.86Å; A68-L758 HydrophobicContact CB-CB 4.01Å; A68-L758 HydrophobicContact CB-CD1 4.43Å
69	L	89.4	Confident	74.6	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125	172	-71.5	166.6	0	0	0	108.2	H67 L702 L704 L719 W751 V753	H67-L69 WeakPolarHBondContact CB-O 3.37Å; H67-L69 PolarHBondContact O-N 2.83Å; L69-L702 HydrophobicContact CD1-CB 4.44Å; L69-L702 HydrophobicContact CD1-CD2 3.97Å; L69-L702 HydrophobicContact CD1-CG 3.82Å; L69-L702 WeakPolarHBondContact CD1-O 3.42Å; L69-L702 HydrophobicContact CD2-CD2 4.18Å; L69-L704 HydrophobicContact CD1-CD1 4.43Å; L69-L704 HydrophobicContact CD1-CG 4.09Å; L69-L704 HydrophobicContact CD2-CD1 3.63Å; L69-L704 HydrophobicContact CD2-CD2 4.3Å; L69-L704 HydrophobicContact CD2-CG 3.85Å; L69-L704 HydrophobicContact CG-CD1 3.71Å; L69-L704 HydrophobicContact CG-CG 3.91Å; L69-L719 HydrophobicContact CB-CD1 3.93Å; L69-L719 WeakPolarHBondContact O-CD1 3.45Å; L69-W751 HydrophobicContact CB-CE3 4.26Å; L69-W751 HydrophobicContact CD2-CB 4.32Å; L69-V753 HydrophobicContact CD2-CG2 4Å
70	S	89.8	Confident	75.9	Confident	37 Å²	37	57.1 Å²	57.1	26%	0.259	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.1	175.2	53.3	0	0	0	0	109.6	E72 K752 N754	S70-E72 PolarHBondContact O-N 2.79Å; S70-K752 PolarHBondContact N-O 2.85Å; S70-K752 PolarHBondContact O-N 2.63Å; S70-K752 WeakPolarHBondContact OG-CB 3.37Å; S70-K752 PolarHBondContact OG-O 3.16Å; S70-N754 PolarHBondContact OG-ND2 2.77Å
71	L	89.8	Confident	77.7	Confident	22 Å²	22	50.4 Å²	50.4	12%	0.115	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	120.5	178.2	-174.3	60	0	0	0	109.7	V74 V101 I114 L749 S750 W751	L71-V74 HydrophobicContact CD1-CG2 4.44Å; L71-V74 HydrophobicContact CD2-CG2 4.03Å; L71-V74 HydrophobicContact CG-CG2 4.39Å; L71-V101 HydrophobicContact CD2-CG1 4.21Å; L71-I114 HydrophobicContact CB-CD1 4.32Å; L71-I114 HydrophobicContact CD2-CD1 3.98Å; L71-I114 HydrophobicContact CD2-CG2 3.74Å; L71-I114 HydrophobicContact CG-CD1 3.62Å; L71-I114 HydrophobicContact CG-CG2 4.5Å; L71-L749 HydrophobicContact CD1-CB 3.72Å; L71-L749 HydrophobicContact CD1-CD1 4.43Å; L71-L749 HydrophobicContact CD1-CD2 4.07Å; L71-L749 HydrophobicContact CD1-CG 4.28Å; L71-L749 HydrophobicContact CD2-CD2 4.47Å; L71-S750 WeakPolarHBondContact CD1-O 3.42Å; L71-W751 HydrophobicContact CB-CE3 3.89Å; L71-W751 HydrophobicContact CB-CH2 4.14Å; L71-W751 HydrophobicContact CB-CZ3 3.68Å; L71-W751 HydrophobicContact CD1-CD2 3.93Å; L71-W751 HydrophobicContact CD1-CE3 4.13Å; L71-W751 HydrophobicContact CD1-CH2 4.06Å; L71-W751 HydrophobicContact CD1-CZ2 3.84Å; L71-W751 HydrophobicContact CD1-CZ3 4.21Å; L71-W751 HydrophobicContact CD2-CH2 4.33Å; L71-W751 HydrophobicContact CG-CH2 4.4Å; L71-W751 HydrophobicContact CG-CZ3 4.38Å
72	E	88.9	Confident	80	Confident	64 Å²	64	45.8 Å²	45.8	30%	0.299	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-46.1	-178.5	-175.9	-169.2	178.2	0	0	111.6	S70 F737 S750	S70-E72 PolarHBondContact O-N 2.79Å; E72-F737 WeakPolarHBondContact OE2-CD1 3.25Å; E72-F737 WeakPolarHBondContact OE2-CE1 2.99Å; E72-S750 PolarHBondContact N-O 3.31Å
73	R	89.8	Confident	82.2	Confident	19 Å²	19	42.4 Å²	42.4	7%	0.072	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	144.8	-173.2	-157.2	173.4	-177.5	103.8	-4.1	112	F75 N110 S750	R73-F75 HydrophobicContact CB-CZ 4.43Å; R73-F75 HydrophobicContact CG-CE1 4.46Å; R73-F75 HydrophobicContact CG-CZ 4.25Å; R73-N110 PolarHBondContact NH1-O 3.2Å; R73-N110 PolarHBondContact NH2-OD1 3.01Å; R73-S750 PolarHBondContact N-O 3.1Å; R73-S750 PolarHBondContact O-N 2.82Å
74	V	90.5	Very high	83.9	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131	173.7	-178	0	0	0	0	110.2	L71 V101 I103 Q112 I114 L749	L71-V74 HydrophobicContact CD1-CG2 4.44Å; L71-V74 HydrophobicContact CD2-CG2 4.03Å; L71-V74 HydrophobicContact CG-CG2 4.39Å; V74-V101 HydrophobicContact CG2-CG2 3.9Å; V74-I103 HydrophobicContact CB-CD1 3.6Å; V74-I103 HydrophobicContact CB-CG1 4.44Å; V74-I103 HydrophobicContact CG1-CD1 3.74Å; V74-I103 HydrophobicContact CG2-CD1 4.06Å; V74-I103 HydrophobicContact CG2-CG1 4.44Å; V74-Q112 PolarHBondContact O-NE2 2.77Å; V74-Q112 VanDerWaalsContact O-NE2 3.12Å; V74-Q112 PolarHBondContact O-OE1 2.91Å; V74-I114 HydrophobicContact CG2-CD1 3.96Å; V74-L749 HydrophobicContact CB-CD2 3.77Å; V74-L749 HydrophobicContact CG1-CD2 3.48Å; V74-L749 VanDerWaalsContact CG1-CD2 3.48Å; V74-L749 HydrophobicContact CG2-CD2 3.33Å
75	F	87.3	Confident	85.5	Confident	29 Å²	29	32.6 Å²	32.6	13%	0.127	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	140.3	171.3	-51.1	-80.9	0	0	0	108.8	R73 F449 W459 S747 A748	R73-F75 HydrophobicContact CB-CZ 4.43Å; R73-F75 HydrophobicContact CG-CE1 4.46Å; R73-F75 HydrophobicContact CG-CZ 4.25Å; F75-F449 HydrophobicContact CD2-CE1 4.46Å; F75-F449 HydrophobicContact CD2-CZ 4.02Å; F75-F449 HydrophobicContact CE2-CZ 4.06Å; F75-F449 HydrophobicContact CG-CZ 4.42Å; F75-F449 HydrophobicContact CZ-CZ 4.48Å; F75-W459 AromaticContact CE1-CD2 3.95Å; F75-W459 HydrophobicContact CE1-CD2 3.95Å; F75-W459 AromaticContact CE1-CE2 3.69Å; F75-W459 HydrophobicContact CE1-CE3 4.12Å; F75-W459 AromaticContact CE1-CH2 3.92Å; F75-W459 HydrophobicContact CE1-CH2 3.92Å; F75-W459 AromaticContact CE1-CZ2 3.69Å; F75-W459 HydrophobicContact CE1-CZ2 3.69Å; F75-W459 HydrophobicContact CE1-CZ3 4.07Å; F75-W459 HydrophobicContact CE2-CZ3 4.32Å; F75-W459 HydrophobicContact CZ-CD2 4.02Å; F75-W459 AromaticContact CZ-CE3 3.7Å; F75-W459 HydrophobicContact CZ-CE3 3.7Å; F75-W459 AromaticContact CZ-CH2 3.48Å; F75-W459 HydrophobicContact CZ-CH2 3.48Å; F75-W459 VanDerWaalsContact CZ-CH2 3.48Å; F75-W459 AromaticContact CZ-CZ2 3.77Å; F75-W459 HydrophobicContact CZ-CZ2 3.77Å; F75-W459 AromaticContact CZ-CZ3 3.38Å; F75-W459 HydrophobicContact CZ-CZ3 3.38Å; F75-S747 CarbonylContact O-C 3.54Å; F75-S747 VanDerWaalsContact O-CA 3.25Å; F75-S747 WeakPolarHBondContact O-CA 3.42Å; F75-S747 WeakPolarHBondContact O-CB 3.37Å; F75-A748 HydrophobicContact CB-CB 4.16Å; F75-A748 HydrophobicContact CD2-CB 4.07Å; F75-A748 WeakPolarHBondContact CD2-O 3.19Å; F75-A748 PolarHBondContact N-O 3.47Å; F75-A748 PolarHBondContact O-N 2.94Å
76	G	85.6	Confident	86.6	Confident	5 Å²	5	31.5 Å²	31.5	5%	0.052	16%	0.164	C	C	.	.			trans	96.5	154.6	-174.1	0	0	0	0	0	112.1	S98	G76-S98 WeakPolarHBondContact O-CB 3.39Å; G76-S98 PolarHBondContact O-OG 2.48Å; G76-S98 VanDerWaalsContact O-OG 3.1Å
77	M	86.3	Confident	87.2	Confident	4 Å²	4	25.2 Å²	25.2	2%	0.02	13%	0.133	C	C	.	.			trans	-143.4	141.2	176.6	174.3	178.7	78	0	0	107.7	P79 V83 Y96 A412 I414 N430 Y432	M77-P79 VanDerWaalsContact O-CD 3.28Å; M77-P79 WeakPolarHBondContact O-CD 3.47Å; M77-V83 HydrophobicContact SD-CG2 3.96Å; M77-Y96 HydrophobicContact CB-CD2 3.99Å; M77-Y96 HydrophobicContact CB-CE2 4.2Å; M77-Y96 HydrophobicContact CG-CD2 3.72Å; M77-Y96 HydrophobicContact CG-CE2 4.43Å; M77-Y96 HydrophobicContact CG-CG 4.3Å; M77-Y96 HydrophobicContact SD-CD2 4.16Å; M77-Y96 HydrophobicContact SD-CG 4.18Å; M77-A412 HydrophobicContact CB-CB 4.37Å; M77-A412 VanDerWaalsContact CE-C 3.44Å; M77-A412 HydrophobicContact CE-CB 3.7Å; M77-A412 WeakPolarHBondContact CE-O 3.39Å; M77-I414 HydrophobicContact CE-CD1 4.39Å; M77-I414 HydrophobicContact CE-CG1 3.94Å; M77-I414 HydrophobicContact SD-CD1 3.61Å; M77-I414 HydrophobicContact SD-CG1 3.84Å; M77-N430 HydrophobicContact CB-CB 4.42Å; M77-Y432 WeakPolarHBondContact O-CD2 3.39Å
78	N	85.8	Confident	87.2	Confident	37 Å²	37	21 Å²	21	20%	0.198	11%	0.114	C	C	.	.			trans	-80	111.5	169.3	-174.6	-12.9	0	0	0	109.7	V80 L81 A97	N78-V80 PolarHBondContact O-N 3.34Å; N78-V80 WeakPolarHBondContact OD1-CB 3.37Å; N78-V80 PolarHBondContact OD1-N 3.47Å; N78-V80 VanDerWaalsContact OD1-N 3.08Å; N78-L81 HydrophobicContact CB-CD1 3.99Å; N78-L81 HydrophobicContact CB-CG 4.14Å; N78-L81 PolarHBondContact O-N 3.24Å; N78-A97 PolarHBondContact N-O 2.88Å
79	P	82.1	Confident	86.6	Confident	6 Å²	6	23.1 Å²	23.1	4%	0.039	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-16.1	-176.4	31.2	-35.7	0	0	0	112.9	M77 L81 V376 I410 A412 Y432	M77-P79 VanDerWaalsContact O-CD 3.28Å; M77-P79 WeakPolarHBondContact O-CD 3.47Å; P79-L81 VanDerWaalsContact C-N 3.3Å; P79-V376 WeakPolarHBondContact O-CG1 3.43Å; P79-I410 WeakPolarHBondContact CB-O 3.1Å; P79-A412 HydrophobicContact CB-CB 4.21Å; P79-Y432 HydrophobicContact CG-CD1 3.46Å; P79-Y432 VanDerWaalsContact CG-CD1 3.46Å; P79-Y432 HydrophobicContact CG-CD2 3.99Å; P79-Y432 HydrophobicContact CG-CE1 3.72Å; P79-Y432 HydrophobicContact CG-CE2 4.23Å; P79-Y432 HydrophobicContact CG-CG 3.57Å
80	V	82.6	Confident	85.9	Confident	106 Å²	106	28.8 Å²	28.8	64%	0.642	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-27.1	178.6	-175.7	0	0	0	0	111.1	N78	N78-V80 PolarHBondContact O-N 3.34Å; N78-V80 WeakPolarHBondContact OD1-CB 3.37Å; N78-V80 PolarHBondContact OD1-N 3.47Å; N78-V80 VanDerWaalsContact OD1-N 3.08Å
81	L	86.2	Confident	85.6	Confident	11 Å²	11	29.4 Å²	29.4	6%	0.058	16%	0.158	C	C	.	.	S	Bend	trans	-82.7	148.6	-178	-63.4	179.7	0	0	0	111.8	N78 P79 A97 I122 S123	N78-L81 HydrophobicContact CB-CD1 3.99Å; N78-L81 HydrophobicContact CB-CG 4.14Å; N78-L81 PolarHBondContact O-N 3.24Å; P79-L81 VanDerWaalsContact C-N 3.3Å; L81-A97 HydrophobicContact CD1-CB 3.56Å; L81-I122 HydrophobicContact CD1-CB 4.36Å; L81-I122 HydrophobicContact CD1-CG2 4.06Å; L81-S123 WeakPolarHBondContact CD2-O 3.13Å
82	P	86.9	Confident	85.5	Confident	9 Å²	9	28.9 Å²	28.9	6%	0.058	16%	0.155	C	C	.	.			trans	-67.9	146.2	177.2	29	-35.2	0	0	0	111.9	Y84 Y377	P82-Y84 HydrophobicContact CB-CD2 4.38Å; P82-Y84 HydrophobicContact CB-CE2 3.69Å; P82-Y84 HydrophobicContact CG-CD2 4.5Å; P82-Y84 HydrophobicContact CG-CE2 3.58Å; P82-Y377 HydrophobicContact CB-CD1 3.82Å; P82-Y377 HydrophobicContact CB-CD2 3.95Å; P82-Y377 HydrophobicContact CB-CE1 3.68Å; P82-Y377 HydrophobicContact CB-CE2 3.89Å; P82-Y377 HydrophobicContact CB-CG 3.93Å
83	V	90.6	Very high	85.5	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.018	14%	0.143	C	C	.	.			trans	-106.8	130	171.2	178	0	0	0	0	108.6	M77 F94 L95 Y377 S379 I406 I414	M77-V83 HydrophobicContact SD-CG2 3.96Å; V83-F94 HydrophobicContact CG1-CB 4.48Å; V83-F94 HydrophobicContact CG1-CD2 4.01Å; V83-L95 CarbonylContact C-O 3.47Å; V83-L95 WeakPolarHBondContact CA-O 3.27Å; V83-Y377 WeakPolarHBondContact O-CD1 3.49Å; V83-Y377 VanDerWaalsContact O-CE1 3.25Å; V83-Y377 WeakPolarHBondContact O-CE1 3.26Å; V83-S379 WeakPolarHBondContact O-CB 3.36Å; V83-I406 HydrophobicContact CG1-CG2 4.18Å; V83-I414 HydrophobicContact CG1-CD1 4.05Å; V83-I414 HydrophobicContact CG1-CG2 4.46Å; V83-I414 HydrophobicContact CG2-CD1 4.23Å; V83-I414 HydrophobicContact CG2-CG1 4.44Å
84	Y	91.4	Very high	85.6	Confident	22 Å²	22	25.4 Å²	25.4	9%	0.086	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.8	-177.3	-69	-81.5	0	0	0	112.3	P82 F94 L95 V127 Y377 S379	P82-Y84 HydrophobicContact CB-CD2 4.38Å; P82-Y84 HydrophobicContact CB-CE2 3.69Å; P82-Y84 HydrophobicContact CG-CD2 4.5Å; P82-Y84 HydrophobicContact CG-CE2 3.58Å; Y84-F94 CarbonylContact O-C 3.57Å; Y84-F94 WeakPolarHBondContact O-CA 3.11Å; Y84-F94 VanDerWaalsContact O-CB 3.29Å; Y84-F94 WeakPolarHBondContact O-CB 3.37Å; Y84-L95 HydrophobicContact CD2-CD2 4.39Å; Y84-L95 PolarHBondContact N-O 2.9Å; Y84-L95 PolarHBondContact O-N 3.04Å; Y84-V127 HydrophobicContact CD1-CB 4.18Å; Y84-V127 HydrophobicContact CD1-CG2 4.07Å; Y84-V127 HydrophobicContact CD2-CB 4.46Å; Y84-V127 HydrophobicContact CD2-CG2 3.57Å; Y84-V127 HydrophobicContact CE2-CG2 4.14Å; Y84-V127 HydrophobicContact CG-CB 4.12Å; Y84-V127 HydrophobicContact CG-CG2 3.51Å; Y84-Y377 HydrophobicContact CD1-CE1 4.25Å; Y84-Y377 AromaticContact CE1-CE1 3.98Å; Y84-Y377 HydrophobicContact CE1-CE1 3.98Å; Y84-Y377 AromaticContact CE1-CZ 3.96Å; Y84-Y377 WeakPolarHBondContact CE1-OH 3.48Å; Y84-Y377 PolarHBondContact OH-OH 3.18Å; Y84-S379 WeakPolarHBondContact CA-OG 3.49Å
85	S	90.6	Very high	85.8	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.1	167.1	177.8	0	0	0	0	109.6	R131 S379	S85-R131 WeakPolarHBondContact O-CD 3.5Å; S85-R131 PolarHBondContact O-NE 3.15Å; S85-R131 VanDerWaalsContact O-NE 3.08Å; S85-S379 PolarHBondContact N-OG 2.76Å
86	L	87.1	Confident	86	Confident	23 Å²	23	24 Å²	24	12%	0.12	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-46.3	177.6	-61.8	-178.8	0	0	0	111.2	I93 L95 I104 V127 I134	L86-I93 HydrophobicContact CB-CG2 4.34Å; L86-I93 HydrophobicContact CD1-CG2 4.27Å; L86-I93 PolarHBondContact N-O 3.32Å; L86-L95 HydrophobicContact CD1-CB 4.22Å; L86-L95 HydrophobicContact CG-CB 4.35Å; L86-I104 HydrophobicContact CD1-CD1 4.48Å; L86-I104 HydrophobicContact CD1-CG1 4.27Å; L86-I104 HydrophobicContact CD1-CG2 4.04Å; L86-V127 HydrophobicContact CD2-CG1 3.94Å; L86-V127 HydrophobicContact CD2-CG2 4.42Å; L86-I134 HydrophobicContact CD1-CD1 4.3Å
87	Q	85.6	Confident	86.3	Confident	16 Å²	16	23.8 Å²	23.8	8%	0.075	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	145	-179.1	-172.3	176.3	-6.6	0	0	110	Q91 I93	Q87-Q91 CarbonylContact C-O 3.37Å; Q87-Q91 VanDerWaalsContact O-O 3.12Å; Q87-I93 HydrophobicContact CB-CB 4.22Å; Q87-I93 HydrophobicContact CB-CD1 4.38Å; Q87-I93 PolarHBondContact N-O 3.28Å; Q87-I93 PolarHBondContact O-N 2.71Å
88	D	80.2	Confident	86.4	Confident	20 Å²	20	23.7 Å²	23.7	11%	0.107	13%	0.131	C	C	.	.			trans	-141.1	-16.7	-179.7	-165.2	37.9	0	0	0	114.6	L92 N404 H416	D88-L92 WeakPolarHBondContact OD1-CD1 3.5Å; D88-N404 WeakPolarHBondContact OD2-CB 3.06Å; D88-N404 VanDerWaalsContact OD2-CG 3.27Å; D88-N404 PolarHBondContact OD2-ND2 2.64Å; D88-H416 VanDerWaalsContact CG-NE2 3.32Å; D88-H416 IonicContact OD1-CD2 3.78Å; D88-H416 IonicContact OD1-CE1 2.71Å; D88-H416 PolarHBondContact OD1-CE1 3.4Å; D88-H416 IonicContact OD1-NE2 3.92Å; D88-H416 PolarHBondContact OD1-NE2 3.43Å; D88-H416 IonicContact OD2-CE1 3.71Å; D88-H416 IonicContact OD2-NE2 3.11Å; D88-H416 PolarHBondContact OD2-NE2 2.91Å; D88-H416 VanDerWaalsContact OD2-NE2 3.13Å
89	S	71.9	Confident	86.4	Confident	48 Å²	48	22.4 Å²	22.4	34%	0.336	13%	0.126	S	C	.	.	S	Bend	trans	-57.1	-60.5	-177.7	45.2	0	0	0	0	114.6	E383	S89-E383 WeakPolarHBondContact CA-OE2 3.41Å; S89-E383 VanDerWaalsContact CB-CD 3.48Å; S89-E383 WeakPolarHBondContact CB-OE1 3.09Å; S89-E383 WeakPolarHBondContact CB-OE2 3.42Å; S89-E383 PolarHBondContact N-OE2 3.1Å; S89-E383 PolarHBondContact OG-OE1 3.14Å; S89-E383 PolarHBondContact OG-OE2 3.31Å
90	D	75.4	Confident	86.8	Confident	121 Å²	121	22.2 Å²	22.2	65%	0.647	12%	0.124	S	C	*	.	S	Bend	trans	-109.6	-34.2	-175.1	-65.8	-17	0	0	0	112.1
91	Q	82.8	Confident	87.3	Confident	50 Å²	50	17.1 Å²	17.1	23%	0.234	9%	0.094	C	C	.	.	S	Bend	trans	-134.9	129.4	177.8	-62.1	-176.9	4.6	0	0	109.6	Q87 I93 N106 T108	Q87-Q91 CarbonylContact C-O 3.37Å; Q87-Q91 VanDerWaalsContact O-O 3.12Å; Q91-I93 HydrophobicContact CB-CD1 4.27Å; Q91-I93 HydrophobicContact CB-CG1 4.15Å; Q91-I93 PolarHBondContact O-N 3.45Å; Q91-I93 VanDerWaalsContact O-N 3.14Å; Q91-N106 PolarHBondContact OE1-ND2 2.59Å; Q91-T108 HydrophobicContact CB-CG2 4.35Å
92	L	87.3	Confident	87.6	Confident	12 Å²	12	16.6 Å²	16.6	6%	0.063	9%	0.091	C	C	.	.			trans	-75.5	102.4	173.4	178.1	65.2	0	0	0	109.6	D88 F94 H107 I406 H416 V427	D88-L92 WeakPolarHBondContact OD1-CD1 3.5Å; L92-F94 HydrophobicContact CG-CD1 4.32Å; L92-H107 HydrophobicContact CB-CB 4.2Å; L92-H107 HydrophobicContact CD2-CB 4.03Å; L92-H107 HydrophobicContact CG-CB 4.22Å; L92-H107 PolarHBondContact O-N 2.92Å; L92-I406 HydrophobicContact CD1-CD1 3.83Å; L92-I406 HydrophobicContact CD1-CG1 4.41Å; L92-H416 HydrophobicContact CD2-CB 3.98Å; L92-V427 HydrophobicContact CD2-CB 4.4Å; L92-V427 HydrophobicContact CD2-CG1 3.8Å; L92-V427 HydrophobicContact CD2-CG2 3.64Å
93	I	90.3	Very high	87.9	Confident	9 Å²	9	16.2 Å²	16.2	5%	0.046	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126	179	-56.6	172.4	0	0	0	109.4	F57 L86 Q87 Q91 I104 F105 N106	F57-I93 HydrophobicContact CD2-CD1 4.05Å; F57-I93 HydrophobicContact CE2-CD1 3.9Å; F57-I93 HydrophobicContact CE2-CG1 4.28Å; F57-I93 HydrophobicContact CE2-CG2 4.22Å; L86-I93 HydrophobicContact CB-CG2 4.34Å; L86-I93 HydrophobicContact CD1-CG2 4.27Å; L86-I93 PolarHBondContact N-O 3.32Å; Q87-I93 HydrophobicContact CB-CB 4.22Å; Q87-I93 HydrophobicContact CB-CD1 4.38Å; Q87-I93 PolarHBondContact N-O 3.28Å; Q87-I93 PolarHBondContact O-N 2.71Å; Q91-I93 HydrophobicContact CB-CD1 4.27Å; Q91-I93 HydrophobicContact CB-CG1 4.15Å; Q91-I93 PolarHBondContact O-N 3.45Å; Q91-I93 VanDerWaalsContact O-N 3.14Å; I93-I104 HydrophobicContact CG2-CG2 3.45Å; I93-I104 VanDerWaalsContact CG2-CG2 3.45Å; I93-F105 WeakPolarHBondContact CA-O 3.46Å; I93-N106 HydrophobicContact CG1-CB 4.24Å
94	F	91.7	Very high	88	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	156.4	177.7	60.9	-91.1	0	0	0	112.4	V83 Y84 L92 Y96 F105 H107 I406 I414 V427 L428	V83-F94 HydrophobicContact CG1-CB 4.48Å; V83-F94 HydrophobicContact CG1-CD2 4.01Å; Y84-F94 CarbonylContact O-C 3.57Å; Y84-F94 WeakPolarHBondContact O-CA 3.11Å; Y84-F94 VanDerWaalsContact O-CB 3.29Å; Y84-F94 WeakPolarHBondContact O-CB 3.37Å; L92-F94 HydrophobicContact CG-CD1 4.32Å; F94-Y96 AromaticContact CD2-CD1 3.92Å; F94-Y96 HydrophobicContact CD2-CD1 3.92Å; F94-Y96 AromaticContact CE2-CD1 3.6Å; F94-Y96 HydrophobicContact CE2-CD1 3.6Å; F94-Y96 AromaticContact CE2-CE1 3.89Å; F94-Y96 HydrophobicContact CE2-CE1 3.89Å; F94-F105 HydrophobicContact CD1-CD1 4.35Å; F94-F105 HydrophobicContact CD2-CB 4.43Å; F94-F105 HydrophobicContact CE1-CB 4.47Å; F94-F105 AromaticContact CE1-CD1 3.38Å; F94-F105 HydrophobicContact CE1-CD1 3.38Å; F94-F105 HydrophobicContact CE1-CE1 4.04Å; F94-F105 HydrophobicContact CE1-CG 4.33Å; F94-F105 HydrophobicContact CE2-CB 3.97Å; F94-F105 AromaticContact CE2-CD1 4Å; F94-F105 HydrophobicContact CE2-CD1 4Å; F94-F105 HydrophobicContact CE2-CG 4.27Å; F94-F105 HydrophobicContact CZ-CB 4.02Å; F94-F105 AromaticContact CZ-CD1 3.17Å; F94-F105 HydrophobicContact CZ-CD1 3.17Å; F94-F105 AromaticContact CZ-CE1 3.83Å; F94-F105 HydrophobicContact CZ-CE1 3.83Å; F94-F105 AromaticContact CZ-CG 3.87Å; F94-F105 HydrophobicContact CZ-CG 3.87Å; F94-F105 PolarHBondContact N-O 3.3Å; F94-F105 PolarHBondContact O-N 2.78Å; F94-H107 HydrophobicContact CE1-CB 4.32Å; F94-I406 HydrophobicContact CB-CD1 3.64Å; F94-I406 HydrophobicContact CD1-CD1 4.14Å; F94-I406 HydrophobicContact CG-CD1 4.11Å; F94-I414 HydrophobicContact CD2-CD1 3.88Å; F94-I414 HydrophobicContact CE2-CD1 3.27Å; F94-I414 HydrophobicContact CE2-CG2 4.49Å; F94-I414 HydrophobicContact CZ-CD1 3.95Å; F94-V427 HydrophobicContact CD1-CG1 4.31Å; F94-V427 HydrophobicContact CE1-CG1 3.33Å; F94-V427 HydrophobicContact CZ-CG1 3.8Å; F94-L428 HydrophobicContact CE2-CD2 4.35Å; F94-L428 HydrophobicContact CZ-CB 4.34Å; F94-L428 HydrophobicContact CZ-CD2 4.44Å
95	L	93.8	Very high	88	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.4	-179.6	175.2	72.2	0	0	0	109.9	V83 Y84 L86 I103 I104 L115 M125 V127 I134	V83-L95 CarbonylContact C-O 3.47Å; V83-L95 WeakPolarHBondContact CA-O 3.27Å; Y84-L95 HydrophobicContact CD2-CD2 4.39Å; Y84-L95 PolarHBondContact N-O 2.9Å; Y84-L95 PolarHBondContact O-N 3.04Å; L86-L95 HydrophobicContact CD1-CB 4.22Å; L86-L95 HydrophobicContact CG-CB 4.35Å; L95-I103 WeakPolarHBondContact CA-O 3.33Å; L95-I104 HydrophobicContact CD1-CG1 3.97Å; L95-L115 HydrophobicContact CD1-CD1 4.22Å; L95-M125 HydrophobicContact CD1-CE 3.68Å; L95-M125 HydrophobicContact CD2-CE 3.54Å; L95-M125 HydrophobicContact CG-CE 3.48Å; L95-M125 VanDerWaalsContact CG-CE 3.48Å; L95-V127 HydrophobicContact CD2-CG2 3.59Å; L95-I134 HydrophobicContact CD1-CD1 4.25Å; L95-I134 HydrophobicContact CD1-CG2 4.45Å; L95-I134 HydrophobicContact CD2-CB 4.36Å; L95-I134 HydrophobicContact CD2-CD1 3.97Å; L95-I134 HydrophobicContact CD2-CG1 4.01Å; L95-I134 HydrophobicContact CD2-CG2 3.46Å; L95-I134 VanDerWaalsContact CD2-CG2 3.46Å
96	Y	92.8	Very high	88	Confident	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	173.9	166.6	67.9	-87.4	0	0	0	109.8	M77 F94 I103 F105 Q112 I414 L428	M77-Y96 HydrophobicContact CB-CD2 3.99Å; M77-Y96 HydrophobicContact CB-CE2 4.2Å; M77-Y96 HydrophobicContact CG-CD2 3.72Å; M77-Y96 HydrophobicContact CG-CE2 4.43Å; M77-Y96 HydrophobicContact CG-CG 4.3Å; M77-Y96 HydrophobicContact SD-CD2 4.16Å; M77-Y96 HydrophobicContact SD-CG 4.18Å; F94-Y96 AromaticContact CD2-CD1 3.92Å; F94-Y96 HydrophobicContact CD2-CD1 3.92Å; F94-Y96 AromaticContact CE2-CD1 3.6Å; F94-Y96 HydrophobicContact CE2-CD1 3.6Å; F94-Y96 AromaticContact CE2-CE1 3.89Å; F94-Y96 HydrophobicContact CE2-CE1 3.89Å; Y96-I103 HydrophobicContact CD1-CB 4.34Å; Y96-I103 HydrophobicContact CD1-CG2 4.43Å; Y96-I103 HydrophobicContact CD2-CB 4.39Å; Y96-I103 HydrophobicContact CD2-CD1 4.05Å; Y96-I103 HydrophobicContact CE1-CB 4.05Å; Y96-I103 HydrophobicContact CE1-CG2 3.73Å; Y96-I103 HydrophobicContact CE2-CB 4.07Å; Y96-I103 HydrophobicContact CE2-CD1 3.33Å; Y96-I103 HydrophobicContact CE2-CG1 4.3Å; Y96-I103 HydrophobicContact CE2-CG2 4.34Å; Y96-I103 PolarHBondContact N-O 2.71Å; Y96-I103 PolarHBondContact O-N 3.23Å; Y96-F105 HydrophobicContact CD1-CB 4.33Å; Y96-F105 HydrophobicContact CE1-CB 3.7Å; Y96-F105 HydrophobicContact CE1-CG 4.28Å; Y96-Q112 PolarHBondContact OH-NE2 3.09Å; Y96-I414 HydrophobicContact CD1-CD1 4.48Å; Y96-L428 HydrophobicContact CE1-CD2 3.95Å
97	A	91.5	Very high	88	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.008	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.4	172.6	0	0	0	0	0	112.6	N78 L81 V101 I122 M125	N78-A97 PolarHBondContact N-O 2.88Å; L81-A97 HydrophobicContact CD1-CB 3.56Å; A97-V101 WeakPolarHBondContact CA-O 3.4Å; A97-I122 HydrophobicContact CB-CB 4.38Å; A97-I122 HydrophobicContact CB-CD1 4.03Å; A97-I122 HydrophobicContact CB-CG2 4.3Å; A97-M125 HydrophobicContact CB-CE 4.17Å; A97-M125 HydrophobicContact CB-SD 3.18Å; A97-M125 WeakPolarHBondContact CB-SD 3.39Å
98	S	88.8	Confident	88	Confident	2 Å²	2	20 Å²	20	1%	0.014	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	134.5	174.1	-172.5	0	0	0	0	108.6	G76 H100 V101 S747	G76-S98 WeakPolarHBondContact O-CB 3.39Å; G76-S98 PolarHBondContact O-OG 2.48Å; G76-S98 VanDerWaalsContact O-OG 3.1Å; S98-H100 PolarHBondContact O-N 2.62Å; S98-V101 PolarHBondContact N-O 2.97Å; S98-V101 VanDerWaalsContact N-O 3.13Å; S98-V101 WeakPolarHBondContact O-CG2 3.48Å; S98-V101 PolarHBondContact O-N 3.49Å; S98-S747 WeakPolarHBondContact OG-CB 3.39Å
99	A	85.8	Confident	88.2	Confident	10 Å²	10	23.6 Å²	23.6	8%	0.083	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	-110.6	-172.3	0	0	0	0	0	112.8	P121 I122 D745	A99-P121 CarbonylContact O-C 3.54Å; A99-P121 VanDerWaalsContact O-CA 3.25Å; A99-P121 WeakPolarHBondContact O-CA 3.31Å; A99-I122 PolarHBondContact O-N 3.21Å; A99-D745 HydrophobicContact CB-CB 3.97Å; A99-D745 WeakPolarHBondContact CB-OD2 3.32Å
100	H	90.2	Very high	88.9	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	6.2	-177.3	67.3	-70	0	0	0	114.1	S98 H118 C120 C721 P723	S98-H100 PolarHBondContact O-N 2.62Å; H100-H118 HydrophobicContact CB-CB 4.45Å; H100-H118 PolarHBondContact CD2-O 3.16Å; H100-H118 VanDerWaalsContact CD2-O 3.27Å; H100-C120 WeakPolarHBondContact CB-O 3.46Å; H100-C721 PolarHBondContact CE1-O 3Å; H100-C721 PolarHBondContact ND1-O 3.37Å; H100-P723 HydrophobicContact CB-CG 3.67Å; H100-P723 WeakPolarHBondContact ND1-CD 3.42Å
101	V	92	Very high	89.4	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	140	-175.2	-63.6	0	0	0	0	111.6	L71 V74 A97 S98 I103 I114 Q116	L71-V101 HydrophobicContact CD2-CG1 4.21Å; V74-V101 HydrophobicContact CG2-CG2 3.9Å; A97-V101 WeakPolarHBondContact CA-O 3.4Å; S98-V101 PolarHBondContact N-O 2.97Å; S98-V101 VanDerWaalsContact N-O 3.13Å; S98-V101 WeakPolarHBondContact O-CG2 3.48Å; S98-V101 PolarHBondContact O-N 3.49Å; V101-I103 HydrophobicContact CG2-CD1 4.45Å; V101-I103 HydrophobicContact CG2-CG1 4.33Å; V101-I114 HydrophobicContact CB-CG2 3.77Å; V101-I114 HydrophobicContact CG1-CG2 4.07Å; V101-I114 HydrophobicContact CG2-CG2 4.02Å; V101-Q116 HydrophobicContact CG1-CB 4.47Å; V101-Q116 HydrophobicContact CG1-CG 4.45Å
102	G	92.5	Very high	89.7	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	140.9	167.1	0	0	0	0	0	109.7	L115	G102-L115 PolarHBondContact N-O 2.78Å; G102-L115 WeakPolarHBondContact O-CB 3.4Å; G102-L115 PolarHBondContact O-N 3.02Å
103	I	93.4	Very high	89.9	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	117.7	-175	-59.7	156.6	0	0	0	108.8	V74 L95 Y96 V101 F105 Q112	V74-I103 HydrophobicContact CB-CD1 3.6Å; V74-I103 HydrophobicContact CB-CG1 4.44Å; V74-I103 HydrophobicContact CG1-CD1 3.74Å; V74-I103 HydrophobicContact CG2-CD1 4.06Å; V74-I103 HydrophobicContact CG2-CG1 4.44Å; L95-I103 WeakPolarHBondContact CA-O 3.33Å; Y96-I103 HydrophobicContact CD1-CB 4.34Å; Y96-I103 HydrophobicContact CD1-CG2 4.43Å; Y96-I103 HydrophobicContact CD2-CB 4.39Å; Y96-I103 HydrophobicContact CD2-CD1 4.05Å; Y96-I103 HydrophobicContact CE1-CB 4.05Å; Y96-I103 HydrophobicContact CE1-CG2 3.73Å; Y96-I103 HydrophobicContact CE2-CB 4.07Å; Y96-I103 HydrophobicContact CE2-CD1 3.33Å; Y96-I103 HydrophobicContact CE2-CG1 4.3Å; Y96-I103 HydrophobicContact CE2-CG2 4.34Å; Y96-I103 PolarHBondContact N-O 2.71Å; Y96-I103 PolarHBondContact O-N 3.23Å; V101-I103 HydrophobicContact CG2-CD1 4.45Å; V101-I103 HydrophobicContact CG2-CG1 4.33Å; I103-F105 HydrophobicContact CG2-CB 4.41Å; I103-Q112 HydrophobicContact CG2-CB 4.25Å; I103-Q112 HydrophobicContact CG2-CG 3.88Å
104	I	93.1	Very high	89.9	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	110	166.6	-59.4	173.2	0	0	0	106.3	L56 F57 L86 I93 L95 Y113 L115 I134	L56-I104 HydrophobicContact CD1-CD1 4.35Å; L56-I104 HydrophobicContact CD2-CB 4.22Å; L56-I104 HydrophobicContact CD2-CD1 4.34Å; L56-I104 HydrophobicContact CD2-CG2 3.85Å; F57-I104 HydrophobicContact CE2-CG2 4.2Å; F57-I104 HydrophobicContact CZ-CG2 4.12Å; L86-I104 HydrophobicContact CD1-CD1 4.48Å; L86-I104 HydrophobicContact CD1-CG1 4.27Å; L86-I104 HydrophobicContact CD1-CG2 4.04Å; I93-I104 HydrophobicContact CG2-CG2 3.45Å; I93-I104 VanDerWaalsContact CG2-CG2 3.45Å; L95-I104 HydrophobicContact CD1-CG1 3.97Å; I104-Y113 PolarHBondContact N-O 3.21Å; I104-Y113 PolarHBondContact O-N 2.46Å; I104-L115 HydrophobicContact CD1-CD1 4.35Å; I104-L115 HydrophobicContact CD1-CD2 4.31Å; I104-L115 HydrophobicContact CG1-CD1 4.35Å; I104-I134 HydrophobicContact CD1-CD1 3.9Å; I104-I134 HydrophobicContact CG1-CD1 4.28Å
105	F	91.6	Very high	89.9	Confident	2 Å²	2	19.9 Å²	19.9	1%	0.009	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.5	-176.8	-178.1	-93.7	0	0	0	110.6	I93 F94 Y96 I103 H107 Q112 L428	I93-F105 WeakPolarHBondContact CA-O 3.46Å; F94-F105 HydrophobicContact CD1-CD1 4.35Å; F94-F105 HydrophobicContact CD2-CB 4.43Å; F94-F105 HydrophobicContact CE1-CB 4.47Å; F94-F105 AromaticContact CE1-CD1 3.38Å; F94-F105 HydrophobicContact CE1-CD1 3.38Å; F94-F105 HydrophobicContact CE1-CE1 4.04Å; F94-F105 HydrophobicContact CE1-CG 4.33Å; F94-F105 HydrophobicContact CE2-CB 3.97Å; F94-F105 AromaticContact CE2-CD1 4Å; F94-F105 HydrophobicContact CE2-CD1 4Å; F94-F105 HydrophobicContact CE2-CG 4.27Å; F94-F105 HydrophobicContact CZ-CB 4.02Å; F94-F105 AromaticContact CZ-CD1 3.17Å; F94-F105 HydrophobicContact CZ-CD1 3.17Å; F94-F105 AromaticContact CZ-CE1 3.83Å; F94-F105 HydrophobicContact CZ-CE1 3.83Å; F94-F105 AromaticContact CZ-CG 3.87Å; F94-F105 HydrophobicContact CZ-CG 3.87Å; F94-F105 PolarHBondContact N-O 3.3Å; F94-F105 PolarHBondContact O-N 2.78Å; Y96-F105 HydrophobicContact CD1-CB 4.33Å; Y96-F105 HydrophobicContact CE1-CB 3.7Å; Y96-F105 HydrophobicContact CE1-CG 4.28Å; I103-F105 HydrophobicContact CG2-CB 4.41Å; F105-H107 HydrophobicContact CD1-CB 4.26Å; F105-H107 VanDerWaalsContact CE1-CA 3.44Å; F105-H107 HydrophobicContact CE1-CB 3.85Å; F105-H107 AromaticContact CE1-ND1 3.98Å; F105-Q112 HydrophobicContact CD2-CG 3.5Å; F105-Q112 HydrophobicContact CE2-CG 4.1Å; F105-L428 HydrophobicContact CZ-CD1 4.27Å
106	N	90.1	Very high	89.7	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	110.2	170.5	-175.1	-20.3	0	0	0	109	F57 Q91 I93 T108 L109 N110 S111	F57-N106 HydrophobicContact CD1-CB 4.31Å; F57-N106 HydrophobicContact CD2-CB 4.15Å; F57-N106 HydrophobicContact CE1-CB 3.88Å; F57-N106 HydrophobicContact CE2-CB 3.71Å; F57-N106 HydrophobicContact CG-CB 4.43Å; F57-N106 HydrophobicContact CZ-CB 3.56Å; Q91-N106 PolarHBondContact OE1-ND2 2.59Å; I93-N106 HydrophobicContact CG1-CB 4.24Å; N106-T108 PolarHBondContact OD1-N 3.44Å; N106-T108 PolarHBondContact OD1-OG1 3.35Å; N106-L109 WeakPolarHBondContact ND2-CD1 3.26Å; N106-L109 PolarHBondContact OD1-N 2.94Å; N106-N110 WeakPolarHBondContact O-CA 3.33Å; N106-N110 PolarHBondContact O-N 2.81Å; N106-S111 PolarHBondContact N-O 2.82Å; N106-S111 PolarHBondContact O-N 2.71Å
107	H	87.6	Confident	89.3	Confident	64 Å²	64	25 Å²	25	30%	0.296	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-38.5	-179.2	-178.4	61.5	0	0	0	112.7	L92 F94 F105 L109 N110 V427	L92-H107 HydrophobicContact CB-CB 4.2Å; L92-H107 HydrophobicContact CD2-CB 4.03Å; L92-H107 HydrophobicContact CG-CB 4.22Å; L92-H107 PolarHBondContact O-N 2.92Å; F94-H107 HydrophobicContact CE1-CB 4.32Å; F105-H107 HydrophobicContact CD1-CB 4.26Å; F105-H107 VanDerWaalsContact CE1-CA 3.44Å; F105-H107 HydrophobicContact CE1-CB 3.85Å; F105-H107 AromaticContact CE1-ND1 3.98Å; H107-L109 VanDerWaalsContact C-N 3.34Å; H107-L109 PolarHBondContact O-N 2.8Å; H107-N110 PolarHBondContact O-N 3.06Å; H107-V427 HydrophobicContact CB-CG1 3.84Å; H107-V427 PolarHBondContact CE1-O 3.31Å; H107-V427 VanDerWaalsContact CE1-O 3.3Å; H107-V427 PolarHBondContact ND1-O 3.24Å
108	T	85.4	Confident	89.2	Confident	76 Å²	76	25.2 Å²	25.2	47%	0.466	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-37.2	-175.8	63.6	0	0	0	0	112.7	Q91 N106	Q91-T108 HydrophobicContact CB-CG2 4.35Å; N106-T108 PolarHBondContact OD1-N 3.44Å; N106-T108 PolarHBondContact OD1-OG1 3.35Å
109	L	84.3	Confident	89.1	Confident	97 Å²	97	28.4 Å²	28.4	51%	0.508	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-4.9	178.3	-61.2	-179	0	0	0	113.3	F57 N106 H107 S111	F57-L109 HydrophobicContact CB-CD1 4.33Å; N106-L109 WeakPolarHBondContact ND2-CD1 3.26Å; N106-L109 PolarHBondContact OD1-N 2.94Å; H107-L109 VanDerWaalsContact C-N 3.34Å; H107-L109 PolarHBondContact O-N 2.8Å; L109-S111 PolarHBondContact O-N 2.91Å
110	N	86.4	Confident	89.2	Confident	57 Å²	57	29.9 Å²	29.9	31%	0.305	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	37.3	-171.4	-168.8	21	0	0	0	113.1	R73 N106 H107 K464	R73-N110 PolarHBondContact NH1-O 3.2Å; R73-N110 PolarHBondContact NH2-OD1 3.01Å; N106-N110 WeakPolarHBondContact O-CA 3.33Å; N106-N110 PolarHBondContact O-N 2.81Å; H107-N110 PolarHBondContact O-N 3.06Å; N110-K464 PolarHBondContact ND2-O 3.35Å
111	S	86.3	Confident	89.2	Confident	8 Å²	8	31.5 Å²	31.5	6%	0.056	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150	-177.5	61.4	0	0	0	0	111.7	F57 N106 L109	F57-S111 VanDerWaalsContact CD1-OG 3.25Å; F57-S111 WeakPolarHBondContact CD1-OG 3.41Å; F57-S111 VanDerWaalsContact CE1-OG 3.29Å; F57-S111 WeakPolarHBondContact CE1-OG 3.41Å; N106-S111 PolarHBondContact N-O 2.82Å; N106-S111 PolarHBondContact O-N 2.71Å; L109-S111 PolarHBondContact O-N 2.91Å
112	Q	89.9	Confident	89.2	Confident	26 Å²	26	31.7 Å²	31.7	12%	0.121	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.9	179.4	-79.5	178.5	10.2	0	0	108.9	V74 Y96 I103 F105 I114	V74-Q112 PolarHBondContact O-NE2 2.77Å; V74-Q112 VanDerWaalsContact O-NE2 3.12Å; V74-Q112 PolarHBondContact O-OE1 2.91Å; Y96-Q112 PolarHBondContact OH-NE2 3.09Å; I103-Q112 HydrophobicContact CG2-CB 4.25Å; I103-Q112 HydrophobicContact CG2-CG 3.88Å; F105-Q112 HydrophobicContact CD2-CG 3.5Å; F105-Q112 HydrophobicContact CE2-CG 4.1Å; Q112-I114 HydrophobicContact CB-CG1 4.5Å
113	Y	89.8	Confident	89	Confident	42 Å²	42	33 Å²	33	17%	0.165	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.8	164.6	-173.6	-82.9	0	0	0	108.9	L56 R63 I104 L115 S152 G153	L56-Y113 HydrophobicContact CD1-CD1 3.96Å; L56-Y113 HydrophobicContact CD1-CD2 4.19Å; L56-Y113 HydrophobicContact CD1-CE1 4.13Å; L56-Y113 HydrophobicContact CD1-CE2 4.32Å; L56-Y113 HydrophobicContact CD1-CG 4Å; L56-Y113 HydrophobicContact CD2-CD1 4.11Å; L56-Y113 HydrophobicContact CD2-CD2 4.03Å; L56-Y113 HydrophobicContact CD2-CG 3.56Å; L56-Y113 HydrophobicContact CG-CD1 4.29Å; L56-Y113 HydrophobicContact CG-CD2 3.84Å; L56-Y113 HydrophobicContact CG-CE2 4.33Å; L56-Y113 HydrophobicContact CG-CG 3.81Å; R63-Y113 VanDerWaalsContact NH1-CE2 3.32Å; R63-Y113 PolarHBondContact NH1-OH 3.35Å; I104-Y113 PolarHBondContact N-O 3.21Å; I104-Y113 PolarHBondContact O-N 2.46Å; Y113-L115 HydrophobicContact CD1-CD2 4.01Å; Y113-L115 HydrophobicContact CE1-CD2 3.77Å; Y113-S152 PolarHBondContact OH-O 3.44Å; Y113-G153 VanDerWaalsContact CE1-CA 3.45Å; Y113-G153 PolarHBondContact OH-O 3.21Å
114	I	91.6	Very high	88.8	Confident	28 Å²	28	33.5 Å²	33.5	14%	0.144	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.1	-165.9	-52.2	172.7	0	0	0	109.9	L71 V74 V101 Q112 Q116	L71-I114 HydrophobicContact CB-CD1 4.32Å; L71-I114 HydrophobicContact CD2-CD1 3.98Å; L71-I114 HydrophobicContact CD2-CG2 3.74Å; L71-I114 HydrophobicContact CG-CD1 3.62Å; L71-I114 HydrophobicContact CG-CG2 4.5Å; V74-I114 HydrophobicContact CG2-CD1 3.96Å; V101-I114 HydrophobicContact CB-CG2 3.77Å; V101-I114 HydrophobicContact CG1-CG2 4.07Å; V101-I114 HydrophobicContact CG2-CG2 4.02Å; Q112-I114 HydrophobicContact CB-CG1 4.5Å; I114-Q116 PolarHBondContact O-N 2.74Å
115	L	91.4	Very high	88.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	93.5	177.2	-54.1	176.6	0	0	0	108.4	L95 G102 I104 Y113 I134 W148	L95-L115 HydrophobicContact CD1-CD1 4.22Å; G102-L115 PolarHBondContact N-O 2.78Å; G102-L115 WeakPolarHBondContact O-CB 3.4Å; G102-L115 PolarHBondContact O-N 3.02Å; I104-L115 HydrophobicContact CD1-CD1 4.35Å; I104-L115 HydrophobicContact CD1-CD2 4.31Å; I104-L115 HydrophobicContact CG1-CD1 4.35Å; Y113-L115 HydrophobicContact CD1-CD2 4.01Å; Y113-L115 HydrophobicContact CE1-CD2 3.77Å; L115-I134 HydrophobicContact CD1-CD1 4.37Å; L115-I134 HydrophobicContact CD1-CG2 4.45Å; L115-W148 HydrophobicContact CB-CD2 4.04Å; L115-W148 HydrophobicContact CB-CE3 4.24Å; L115-W148 HydrophobicContact CB-CH2 4.26Å; L115-W148 HydrophobicContact CB-CZ2 4.02Å; L115-W148 HydrophobicContact CB-CZ3 4.33Å; L115-W148 HydrophobicContact CD1-CB 4.39Å; L115-W148 HydrophobicContact CD1-CD2 4.3Å; L115-W148 HydrophobicContact CD1-CG 4.03Å; L115-W148 HydrophobicContact CD2-CB 4.42Å; L115-W148 HydrophobicContact CD2-CD2 3.93Å; L115-W148 HydrophobicContact CD2-CE3 3.74Å; L115-W148 HydrophobicContact CD2-CG 4.23Å; L115-W148 HydrophobicContact CD2-CZ3 4.32Å; L115-W148 HydrophobicContact CG-CD2 4.31Å; L115-W148 HydrophobicContact CG-CE3 4.49Å
116	Q	88.6	Confident	88.8	Confident	73 Å²	73	34 Å²	34	34%	0.341	20%	0.197	S	C	.	.			trans	-102.6	125.2	-176.7	-172.3	178.5	-2.1	0	0	111.3	V101 I114 W148	V101-Q116 HydrophobicContact CG1-CB 4.47Å; V101-Q116 HydrophobicContact CG1-CG 4.45Å; I114-Q116 PolarHBondContact O-N 2.74Å; Q116-W148 WeakPolarHBondContact O-CH2 3.5Å
117	G	85.6	Confident	89	Confident	35 Å²	35	34.6 Å²	34.6	36%	0.361	20%	0.201	S	C	.	.			trans	-178.6	-24.8	176.4	0	0	0	0	0	115.5
118	H	90	Very high	89.2	Confident	6 Å²	6	31.6 Å²	31.6	3%	0.028	19%	0.186	C	C	.	.			trans	-75	150.6	177.4	-64.5	-70.5	0	0	0	112.4	H100 T136 D138 M144	H100-H118 HydrophobicContact CB-CB 4.45Å; H100-H118 PolarHBondContact CD2-O 3.16Å; H100-H118 VanDerWaalsContact CD2-O 3.27Å; H118-T136 PolarHBondContact CE1-O 3.24Å; H118-T136 VanDerWaalsContact CE1-O 3.24Å; H118-T136 VanDerWaalsContact NE2-CB 3.31Å; H118-T136 WeakPolarHBondContact NE2-CB 3.39Å; H118-T136 PolarHBondContact NE2-O 3.48Å; H118-T136 PolarHBondContact NE2-OG1 2.76Å; H118-D138 HydrophobicContact CB-CB 4.42Å; H118-M144 PolarHBondContact CE1-O 3.13Å; H118-M144 VanDerWaalsContact CE1-O 3.27Å; H118-M144 WeakPolarHBondContact ND1-CG 3.43Å
119	C	86.2	Confident	89.3	Confident	69 Å²	69	31.7 Å²	31.7	47%	0.466	18%	0.182	S	C	.	.	S	Bend	trans	-98.6	-22.8	179	-68.4	0	0	0	0	112.6	D138 I720 P723	C119-D138 PolarHBondContact N-OD2 3.36Å; C119-I720 HydrophobicContact CB-CD1 4.2Å; C119-P723 WeakPolarHBondContact O-CB 3.32Å; C119-P723 WeakPolarHBondContact O-CG 3.4Å
120	C	88.1	Confident	89.4	Confident	42 Å²	42	30.2 Å²	30.2	28%	0.284	17%	0.174	S	C	.	.	S	Bend	trans	-126.1	170.9	178	-75.5	0	0	0	0	110.2	H100 D138	H100-C120 WeakPolarHBondContact CB-O 3.46Å; C120-D138 WeakPolarHBondContact CA-OD1 3.29Å; C120-D138 VanDerWaalsContact CA-OD2 3.32Å; C120-D138 WeakPolarHBondContact CA-OD2 3.15Å; C120-D138 WeakPolarHBondContact CB-OD1 3.25Å; C120-D138 VanDerWaalsContact CB-OD2 3.23Å; C120-D138 WeakPolarHBondContact CB-OD2 3.27Å; C120-D138 PolarHBondContact N-OD2 3.14Å
121	P	88.9	Confident	89.5	Confident	34 Å²	34	28.9 Å²	28.9	22%	0.221	17%	0.165	C	C	.	.			trans	-64.5	142.9	-172.2	-22.8	35.6	0	0	0	112.7	A99 S123 R139 P723 T724	A99-P121 CarbonylContact O-C 3.54Å; A99-P121 VanDerWaalsContact O-CA 3.25Å; A99-P121 WeakPolarHBondContact O-CA 3.31Å; P121-S123 PolarHBondContact O-N 3.04Å; P121-R139 PolarHBondContact O-N 2.81Å; P121-P723 HydrophobicContact CG-CB 4.33Å; P121-T724 HydrophobicContact CG-CG2 3.48Å; P121-T724 VanDerWaalsContact CG-CG2 3.48Å
122	I	91.8	Very high	89.7	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	121.4	178.4	-66.2	174.6	0	0	0	108.8	L81 A97 A99 C124 M125 T136 V137	L81-I122 HydrophobicContact CD1-CB 4.36Å; L81-I122 HydrophobicContact CD1-CG2 4.06Å; A97-I122 HydrophobicContact CB-CB 4.38Å; A97-I122 HydrophobicContact CB-CD1 4.03Å; A97-I122 HydrophobicContact CB-CG2 4.3Å; A99-I122 PolarHBondContact O-N 3.21Å; I122-C124 WeakPolarHBondContact CG2-O 3.34Å; I122-M125 HydrophobicContact CG2-CG 3.58Å; I122-M125 HydrophobicContact CG2-SD 4.13Å; I122-T136 HydrophobicContact CD1-CG2 4.47Å; I122-V137 CarbonylContact C-O 3.57Å; I122-V137 VanDerWaalsContact CA-O 3.28Å; I122-V137 WeakPolarHBondContact CA-O 3.41Å
123	S	88.4	Confident	89.9	Confident	28 Å²	28	32.5 Å²	32.5	20%	0.196	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-34.9	176.1	65	0	0	0	0	112.3	L81 P121 V137 V168	L81-S123 WeakPolarHBondContact CD2-O 3.13Å; P121-S123 PolarHBondContact O-N 3.04Å; S123-V137 PolarHBondContact N-O 3.45Å; S123-V137 PolarHBondContact OG-O 3.37Å; S123-V168 WeakPolarHBondContact CB-O 3.32Å; S123-V168 PolarHBondContact OG-O 3.44Å
124	C	89.2	Confident	90.1	Very high	11 Å²	11	30.5 Å²	30.5	7%	0.074	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	153.5	-174.3	-51.8	0	0	0	0	112.4	I122 V137 V168 A169 A170 V171	I122-C124 WeakPolarHBondContact CG2-O 3.34Å; C124-V137 HydrophobicContact CB-CB 4.43Å; C124-V137 PolarHBondContact O-N 3.06Å; C124-V168 PolarHBondContact SG-O 2.77Å; C124-A169 PolarHBondContact SG-O 2.8Å; C124-A170 PolarHBondContact SG-N 3.37Å; C124-V171 HydrophobicContact CB-CG1 3.84Å
125	M	93.5	Very high	90.3	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.034	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.7	174.4	-57.5	170.6	66.9	0	0	110.3	L95 A97 I122 A135 T136	L95-M125 HydrophobicContact CD1-CE 3.68Å; L95-M125 HydrophobicContact CD2-CE 3.54Å; L95-M125 HydrophobicContact CG-CE 3.48Å; L95-M125 VanDerWaalsContact CG-CE 3.48Å; A97-M125 HydrophobicContact CB-CE 4.17Å; A97-M125 HydrophobicContact CB-SD 3.18Å; A97-M125 WeakPolarHBondContact CB-SD 3.39Å; I122-M125 HydrophobicContact CG2-CG 3.58Å; I122-M125 HydrophobicContact CG2-SD 4.13Å; M125-A135 VanDerWaalsContact CA-O 3.28Å; M125-A135 WeakPolarHBondContact CA-O 3.17Å; M125-T136 HydrophobicContact CE-CG2 4.06Å; M125-T136 HydrophobicContact CG-CG2 4.2Å
126	C	92.7	Very high	90.4	Very high	6 Å²	6	29.2 Å²	29.2	4%	0.041	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	158.3	166.7	69.6	0	0	0	0	110.7	A135 V171 F173	C126-A135 PolarHBondContact N-O 3.22Å; C126-A135 PolarHBondContact O-N 3.4Å; C126-V171 HydrophobicContact CB-CG1 4Å; C126-F173 HydrophobicContact CB-CD2 4.47Å; C126-F173 WeakPolarHBondContact SG-CD2 3.32Å
127	V	93.1	Very high	90.6	Very high	14 Å²	14	25.7 Å²	25.7	9%	0.085	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.5	177.3	-177.7	0	0	0	0	107.7	Y84 L86 L95 W133 I134	Y84-V127 HydrophobicContact CD1-CB 4.18Å; Y84-V127 HydrophobicContact CD1-CG2 4.07Å; Y84-V127 HydrophobicContact CD2-CB 4.46Å; Y84-V127 HydrophobicContact CD2-CG2 3.57Å; Y84-V127 HydrophobicContact CE2-CG2 4.14Å; Y84-V127 HydrophobicContact CG-CB 4.12Å; Y84-V127 HydrophobicContact CG-CG2 3.51Å; L86-V127 HydrophobicContact CD2-CG1 3.94Å; L86-V127 HydrophobicContact CD2-CG2 4.42Å; L95-V127 HydrophobicContact CD2-CG2 3.59Å; V127-W133 WeakPolarHBondContact CA-O 3.5Å; V127-I134 HydrophobicContact CG2-CG1 4.27Å
128	S	92.2	Very high	90.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.			trans	-65	159.7	174	58.8	0	0	0	0	112.2	D130 R131 R132 W133	S128-D130 WeakPolarHBondContact CB-OD1 2.89Å; S128-D130 PolarHBondContact O-N 3.39Å; S128-D130 PolarHBondContact OG-OD1 2.96Å; S128-R131 PolarHBondContact O-N 3.16Å; S128-R131 PolarHBondContact O-NH1 2.88Å; S128-R132 PolarHBondContact OG-N 3.27Å; S128-W133 PolarHBondContact N-O 2.78Å; S128-W133 PolarHBondContact OG-N 3Å; S128-W133 PolarHBondContact OG-O 3.04Å
129	E	86.7	Confident	90.6	Very high	78 Å²	78	31.8 Å²	31.8	36%	0.364	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.1	-177.9	-174.5	52.9	-150.7	0	0	113	R131 N175 K382	E129-R131 VanDerWaalsContact C-N 3.27Å; E129-R131 IonicContact OE2-NH1 3.46Å; E129-N175 WeakPolarHBondContact CG-OD1 3.48Å; E129-K382 WeakPolarHBondContact O-CD 3.48Å; E129-K382 WeakPolarHBondContact O-CE 3.21Å; E129-K382 PolarHBondContact O-NZ 3.39Å; E129-K382 IonicContact OE1-NZ 2.68Å; E129-K382 PolarHBondContact OE1-NZ 3.12Å
130	D	86.8	Confident	90.3	Very high	67 Å²	67	28.8 Å²	28.8	36%	0.358	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-0.9	171.2	68.9	-14.8	0	0	0	113.3	S128 R132	S128-D130 WeakPolarHBondContact CB-OD1 2.89Å; S128-D130 PolarHBondContact O-N 3.39Å; S128-D130 PolarHBondContact OG-OD1 2.96Å; D130-R132 PolarHBondContact O-N 3.16Å; D130-R132 PolarHBondContact OD1-N 3.25Å; D130-R132 WeakPolarHBondContact OD2-CB 3.5Å
131	R	89.5	Confident	89.6	Confident	28 Å²	28	31.7 Å²	31.7	11%	0.106	16%	0.157	C	C	.	.	S	Bend	trans	59.8	7.9	-176.1	-58.1	-62.5	-172.4	-116.1	-4.3	115.2	S85 S128 E129 S150 F380 K382	S85-R131 WeakPolarHBondContact O-CD 3.5Å; S85-R131 PolarHBondContact O-NE 3.15Å; S85-R131 VanDerWaalsContact O-NE 3.08Å; S128-R131 PolarHBondContact O-N 3.16Å; S128-R131 PolarHBondContact O-NH1 2.88Å; E129-R131 VanDerWaalsContact C-N 3.27Å; E129-R131 IonicContact OE2-NH1 3.46Å; R131-S150 WeakPolarHBondContact O-CB 3.32Å; R131-S150 PolarHBondContact O-OG 3.27Å; R131-F380 PolarHBondContact NH2-O 3.2Å; R131-F380 VanDerWaalsContact NH2-O 3.1Å; R131-K382 HydrophobicContact CG-CB 4.12Å
132	R	89.9	Confident	89	Confident	78 Å²	78	39 Å²	39	29%	0.294	18%	0.18	S	C	.	.			trans	-80.1	-39.7	-178.3	-173	173.4	179.7	174.8	2.5	112.6	S128 D130 D149 S150 Y151	S128-R132 PolarHBondContact OG-N 3.27Å; D130-R132 PolarHBondContact O-N 3.16Å; D130-R132 PolarHBondContact OD1-N 3.25Å; D130-R132 WeakPolarHBondContact OD2-CB 3.5Å; R132-D149 IonicContact NE-OD1 2.95Å; R132-S150 WeakPolarHBondContact CA-OG 3.49Å; R132-S150 VanDerWaalsContact O-CB 3.27Å; R132-S150 WeakPolarHBondContact O-CB 3.34Å; R132-S150 PolarHBondContact O-N 2.9Å; R132-S150 PolarHBondContact O-OG 3.49Å; R132-Y151 HydrophobicContact CG-CE2 4.31Å
133	W	93.4	Very high	88.7	Confident	32 Å²	32	38.8 Å²	38.8	12%	0.121	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.9	-172.1	-54.1	108.4	0	0	0	111.6	V127 S128 I147 W148 D149 V156 F173 W197	V127-W133 WeakPolarHBondContact CA-O 3.5Å; S128-W133 PolarHBondContact N-O 2.78Å; S128-W133 PolarHBondContact OG-N 3Å; S128-W133 PolarHBondContact OG-O 3.04Å; W133-I147 HydrophobicContact CE3-CG2 4.32Å; W133-W148 WeakPolarHBondContact CA-O 3.49Å; W133-D149 HydrophobicContact CE3-CB 4.42Å; W133-D149 HydrophobicContact CZ3-CB 3.91Å; W133-V156 HydrophobicContact CH2-CG2 4.37Å; W133-V156 HydrophobicContact CZ3-CB 4.13Å; W133-V156 HydrophobicContact CZ3-CG1 4.25Å; W133-V156 HydrophobicContact CZ3-CG2 3.68Å; W133-F173 HydrophobicContact CB-CE2 4.47Å; W133-F173 HydrophobicContact CB-CZ 4.16Å; W133-W197 AromaticContact CD2-CH2 3.75Å; W133-W197 HydrophobicContact CD2-CH2 3.75Å; W133-W197 HydrophobicContact CD2-CZ2 4.4Å; W133-W197 AromaticContact CE2-CH2 3.75Å; W133-W197 HydrophobicContact CE3-CH2 4.18Å; W133-W197 HydrophobicContact CG-CH2 4.05Å; W133-W197 HydrophobicContact CG-CZ2 4.23Å; W133-W197 HydrophobicContact CZ2-CH2 4.18Å
134	I	95.3	Very high	88.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.4	177.3	-60.4	166.7	0	0	0	107.6	L86 L95 I104 L115 V127 T136 I147 W148	L86-I134 HydrophobicContact CD1-CD1 4.3Å; L95-I134 HydrophobicContact CD1-CD1 4.25Å; L95-I134 HydrophobicContact CD1-CG2 4.45Å; L95-I134 HydrophobicContact CD2-CB 4.36Å; L95-I134 HydrophobicContact CD2-CD1 3.97Å; L95-I134 HydrophobicContact CD2-CG1 4.01Å; L95-I134 HydrophobicContact CD2-CG2 3.46Å; L95-I134 VanDerWaalsContact CD2-CG2 3.46Å; I104-I134 HydrophobicContact CD1-CD1 3.9Å; I104-I134 HydrophobicContact CG1-CD1 4.28Å; L115-I134 HydrophobicContact CD1-CD1 4.37Å; L115-I134 HydrophobicContact CD1-CG2 4.45Å; V127-I134 HydrophobicContact CG2-CG1 4.27Å; I134-T136 HydrophobicContact CG2-CG2 4.08Å; I134-I147 CarbonylContact O-C 3.53Å; I134-I147 WeakPolarHBondContact O-CA 3.36Å; I134-W148 HydrophobicContact CB-CB 4.28Å; I134-W148 PolarHBondContact N-O 2.98Å; I134-W148 PolarHBondContact O-N 3.04Å
135	A	94.7	Very high	88.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.1	169.4	0	0	0	0	0	110	M125 C126 V145 I146 F173 L180	M125-A135 VanDerWaalsContact CA-O 3.28Å; M125-A135 WeakPolarHBondContact CA-O 3.17Å; C126-A135 PolarHBondContact N-O 3.22Å; C126-A135 PolarHBondContact O-N 3.4Å; A135-V145 HydrophobicContact CB-CG1 4.45Å; A135-I146 WeakPolarHBondContact CA-O 3.48Å; A135-F173 HydrophobicContact CB-CE2 3.59Å; A135-F173 HydrophobicContact CB-CZ 3.71Å; A135-L180 HydrophobicContact CB-CD1 4.14Å
136	T	94.8	Very high	88.9	Confident	1 Å²	1	38 Å²	38	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.7	178.1	52.4	0	0	0	0	108.8	H118 I122 M125 I134 V145 I146 W148	H118-T136 PolarHBondContact CE1-O 3.24Å; H118-T136 VanDerWaalsContact CE1-O 3.24Å; H118-T136 VanDerWaalsContact NE2-CB 3.31Å; H118-T136 WeakPolarHBondContact NE2-CB 3.39Å; H118-T136 PolarHBondContact NE2-O 3.48Å; H118-T136 PolarHBondContact NE2-OG1 2.76Å; I122-T136 HydrophobicContact CD1-CG2 4.47Å; M125-T136 HydrophobicContact CE-CG2 4.06Å; M125-T136 HydrophobicContact CG-CG2 4.2Å; I134-T136 HydrophobicContact CG2-CG2 4.08Å; T136-V145 WeakPolarHBondContact O-CA 3.19Å; T136-I146 PolarHBondContact N-O 3.31Å; T136-I146 PolarHBondContact O-N 2.68Å; T136-I146 PolarHBondContact OG1-O 2.96Å; T136-W148 PolarHBondContact OG1-NE1 3.46Å
137	V	92.3	Very high	89	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.5	-173.8	-165.9	0	0	0	0	111.3	I122 S123 C124 V145 V168 V171	I122-V137 CarbonylContact C-O 3.57Å; I122-V137 VanDerWaalsContact CA-O 3.28Å; I122-V137 WeakPolarHBondContact CA-O 3.41Å; S123-V137 PolarHBondContact N-O 3.45Å; S123-V137 PolarHBondContact OG-O 3.37Å; C124-V137 HydrophobicContact CB-CB 4.43Å; C124-V137 PolarHBondContact O-N 3.06Å; V137-V145 HydrophobicContact CB-CG2 4.39Å; V137-V145 HydrophobicContact CG1-CG2 3.83Å; V137-V145 HydrophobicContact CG2-CB 4.39Å; V137-V145 HydrophobicContact CG2-CG1 4.07Å; V137-V145 HydrophobicContact CG2-CG2 3.85Å; V137-V168 HydrophobicContact CG1-CB 3.57Å; V137-V168 HydrophobicContact CG1-CG1 3.91Å; V137-V168 HydrophobicContact CG1-CG2 3.56Å; V137-V171 HydrophobicContact CG2-CB 3.97Å; V137-V171 HydrophobicContact CG2-CG1 3.9Å; V137-V171 HydrophobicContact CG2-CG2 4.16Å
138	D	90.2	Very high	89	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	147	178.3	-165.8	-15	0	0	0	112.7	H118 C119 C120 G140 N143 M144	H118-D138 HydrophobicContact CB-CB 4.42Å; C119-D138 PolarHBondContact N-OD2 3.36Å; C120-D138 WeakPolarHBondContact CA-OD1 3.29Å; C120-D138 VanDerWaalsContact CA-OD2 3.32Å; C120-D138 WeakPolarHBondContact CA-OD2 3.15Å; C120-D138 WeakPolarHBondContact CB-OD1 3.25Å; C120-D138 VanDerWaalsContact CB-OD2 3.23Å; C120-D138 WeakPolarHBondContact CB-OD2 3.27Å; C120-D138 PolarHBondContact N-OD2 3.14Å; D138-G140 PolarHBondContact OD1-N 3.19Å; D138-N143 VanDerWaalsContact O-CB 3.31Å; D138-N143 WeakPolarHBondContact O-CB 2.98Å; D138-M144 HydrophobicContact CB-CG 4.27Å; D138-M144 PolarHBondContact N-O 3.33Å
139	R	84.1	Confident	89	Confident	165 Å²	165	37.5 Å²	37.5	62%	0.623	17%	0.167	S	C	*	.			trans	-76.4	-14.3	170.7	-158	179.6	175.9	-179	-1.6	114.3	P121 S167	P121-R139 PolarHBondContact O-N 2.81Å; R139-S167 VanDerWaalsContact O-CB 3.27Å; R139-S167 WeakPolarHBondContact O-CB 2.87Å
140	G	80.6	Confident	89.1	Confident	7 Å²	7	34.1 Å²	34.1	7%	0.072	15%	0.153	C	C	.	.	S	Bend	trans	-60.9	161.9	-172.2	0	0	0	0	0	115.7	D138 R142 N143	D138-G140 PolarHBondContact OD1-N 3.19Å; G140-R142 PolarHBondContact O-N 3.11Å; G140-N143 PolarHBondContact O-N 3.33Å; G140-N143 VanDerWaalsContact O-N 3.07Å
141	P	72.9	Confident	89.2	Confident	103 Å²	103	33.1 Å²	33.1	67%	0.669	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.3	-179.8	26.5	-34.8	0	0	0	113.2
142	R	78	Confident	89	Confident	187 Å²	187	32.1 Å²	32.1	71%	0.706	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	66.9	165.7	-67.3	-175.2	-177.8	147.5	2.4	108.5	G140 E161	G140-R142 PolarHBondContact O-N 3.11Å; R142-E161 HydrophobicContact CB-CG 4.38Å; R142-E161 HydrophobicContact CG-CG 4.43Å; R142-E161 IonicContact NE-OE1 4Å
143	N	85.1	Confident	88.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.129	C	C	.	.			trans	-55.5	145.5	-178.9	53.3	56.5	0	0	0	110.6	D138 G140 E161 C162 H163 S166 V168	D138-N143 VanDerWaalsContact O-CB 3.31Å; D138-N143 WeakPolarHBondContact O-CB 2.98Å; G140-N143 PolarHBondContact O-N 3.33Å; G140-N143 VanDerWaalsContact O-N 3.07Å; N143-E161 PolarHBondContact O-N 3.26Å; N143-C162 WeakPolarHBondContact OD1-CB 3.33Å; N143-C162 PolarHBondContact OD1-N 3.1Å; N143-H163 PolarHBondContact ND2-O 3.34Å; N143-H163 PolarHBondContact OD1-N 2.79Å; N143-H163 VanDerWaalsContact OD1-N 3.11Å; N143-S166 PolarHBondContact ND2-O 3.21Å; N143-V168 HydrophobicContact CB-CG2 4.13Å
144	M	89.1	Confident	88.4	Confident	25 Å²	25	29.2 Å²	29.2	12%	0.123	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.8	175.7	64.8	-171.8	-56.9	0	0	108.6	H118 D138 I146 T158 L159 F160	H118-M144 PolarHBondContact CE1-O 3.13Å; H118-M144 VanDerWaalsContact CE1-O 3.27Å; H118-M144 WeakPolarHBondContact ND1-CG 3.43Å; D138-M144 HydrophobicContact CB-CG 4.27Å; D138-M144 PolarHBondContact N-O 3.33Å; M144-I146 HydrophobicContact CE-CD1 3.6Å; M144-I146 HydrophobicContact CE-CG1 3.72Å; M144-I146 HydrophobicContact CG-CG1 4.4Å; M144-I146 HydrophobicContact SD-CD1 4.29Å; M144-T158 HydrophobicContact CB-CG2 4.39Å; M144-T158 HydrophobicContact CE-CG2 3.57Å; M144-L159 WeakPolarHBondContact CA-O 3.48Å; M144-F160 HydrophobicContact CB-CD1 4.48Å; M144-F160 HydrophobicContact CE-CE1 4.16Å
145	V	91.9	Very high	88.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.1	170.5	-178.6	0	0	0	0	107.3	A135 T136 V137 T158 L159 C162 L180 T182	A135-V145 HydrophobicContact CB-CG1 4.45Å; T136-V145 WeakPolarHBondContact O-CA 3.19Å; V137-V145 HydrophobicContact CB-CG2 4.39Å; V137-V145 HydrophobicContact CG1-CG2 3.83Å; V137-V145 HydrophobicContact CG2-CB 4.39Å; V137-V145 HydrophobicContact CG2-CG1 4.07Å; V137-V145 HydrophobicContact CG2-CG2 3.85Å; V145-T158 CarbonylContact O-C 3.57Å; V145-T158 WeakPolarHBondContact O-CA 3.15Å; V145-L159 HydrophobicContact CB-CB 4.17Å; V145-L159 HydrophobicContact CB-CD1 4.49Å; V145-L159 PolarHBondContact N-O 2.92Å; V145-L159 PolarHBondContact O-N 3.22Å; V145-C162 HydrophobicContact CG2-CB 4.49Å; V145-C162 VanDerWaalsContact CG2-SG 3.56Å; V145-L180 HydrophobicContact CG1-CD2 3.79Å; V145-T182 HydrophobicContact CG2-CG2 4.25Å
146	I	93.6	Very high	88	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.8	175.4	-50.4	170.8	0	0	0	108.7	A135 T136 M144 W148 P155 T158	A135-I146 WeakPolarHBondContact CA-O 3.48Å; T136-I146 PolarHBondContact N-O 3.31Å; T136-I146 PolarHBondContact O-N 2.68Å; T136-I146 PolarHBondContact OG1-O 2.96Å; M144-I146 HydrophobicContact CE-CD1 3.6Å; M144-I146 HydrophobicContact CE-CG1 3.72Å; M144-I146 HydrophobicContact CG-CG1 4.4Å; M144-I146 HydrophobicContact SD-CD1 4.29Å; I146-W148 HydrophobicContact CB-CZ2 3.96Å; I146-W148 HydrophobicContact CD1-CZ2 3.8Å; I146-W148 HydrophobicContact CG2-CD2 3.92Å; I146-W148 HydrophobicContact CG2-CG 4.38Å; I146-W148 HydrophobicContact CG2-CH2 4.13Å; I146-W148 HydrophobicContact CG2-CZ2 3.44Å; I146-W148 VanDerWaalsContact CG2-CZ2 3.44Å; I146-W148 PolarHBondContact O-NE1 2.86Å; I146-P155 HydrophobicContact CG2-CB 3.78Å; I146-T158 HydrophobicContact CG1-CG2 4.1Å
147	I	94.2	Very high	87.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	121.4	174.8	-56.4	178.1	0	0	0	108.4	W133 I134 V156 N157 F173 W197	W133-I147 HydrophobicContact CE3-CG2 4.32Å; I134-I147 CarbonylContact O-C 3.53Å; I134-I147 WeakPolarHBondContact O-CA 3.36Å; I147-V156 PolarHBondContact O-N 3Å; I147-N157 PolarHBondContact N-O 3.5Å; I147-N157 PolarHBondContact O-N 3.38Å; I147-F173 HydrophobicContact CG2-CZ 4.43Å; I147-W197 HydrophobicContact CD1-CB 3.38Å; I147-W197 HydrophobicContact CD1-CD2 3.48Å; I147-W197 VanDerWaalsContact CD1-CD2 3.48Å; I147-W197 HydrophobicContact CD1-CE3 3.59Å; I147-W197 HydrophobicContact CD1-CG 3.39Å; I147-W197 HydrophobicContact CG2-CE3 4.13Å; I147-W197 HydrophobicContact CG2-CH2 4.48Å; I147-W197 HydrophobicContact CG2-CZ3 4.08Å
148	W	94	Very high	87.7	Confident	9 Å²	9	37.9 Å²	37.9	3%	0.034	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.9	-176.6	-50.9	85.7	0	0	0	110.6	L115 Q116 W133 I134 T136 I146 P155	L115-W148 HydrophobicContact CB-CD2 4.04Å; L115-W148 HydrophobicContact CB-CE3 4.24Å; L115-W148 HydrophobicContact CB-CH2 4.26Å; L115-W148 HydrophobicContact CB-CZ2 4.02Å; L115-W148 HydrophobicContact CB-CZ3 4.33Å; L115-W148 HydrophobicContact CD1-CB 4.39Å; L115-W148 HydrophobicContact CD1-CD2 4.3Å; L115-W148 HydrophobicContact CD1-CG 4.03Å; L115-W148 HydrophobicContact CD2-CB 4.42Å; L115-W148 HydrophobicContact CD2-CD2 3.93Å; L115-W148 HydrophobicContact CD2-CE3 3.74Å; L115-W148 HydrophobicContact CD2-CG 4.23Å; L115-W148 HydrophobicContact CD2-CZ3 4.32Å; L115-W148 HydrophobicContact CG-CD2 4.31Å; L115-W148 HydrophobicContact CG-CE3 4.49Å; Q116-W148 WeakPolarHBondContact O-CH2 3.5Å; W133-W148 WeakPolarHBondContact CA-O 3.49Å; I134-W148 HydrophobicContact CB-CB 4.28Å; I134-W148 PolarHBondContact N-O 2.98Å; I134-W148 PolarHBondContact O-N 3.04Å; T136-W148 PolarHBondContact OG1-NE1 3.46Å; I146-W148 HydrophobicContact CB-CZ2 3.96Å; I146-W148 HydrophobicContact CD1-CZ2 3.8Å; I146-W148 HydrophobicContact CG2-CD2 3.92Å; I146-W148 HydrophobicContact CG2-CG 4.38Å; I146-W148 HydrophobicContact CG2-CH2 4.13Å; I146-W148 HydrophobicContact CG2-CZ2 3.44Å; I146-W148 VanDerWaalsContact CG2-CZ2 3.44Å; I146-W148 PolarHBondContact O-NE1 2.86Å; W148-P155 HydrophobicContact CD2-CB 4.32Å; W148-P155 HydrophobicContact CE3-CB 3.79Å; W148-P155 HydrophobicContact CE3-CG 4.28Å; W148-P155 HydrophobicContact CH2-CB 4.11Å; W148-P155 HydrophobicContact CH2-CG 4.36Å; W148-P155 HydrophobicContact CZ3-CB 3.69Å; W148-P155 HydrophobicContact CZ3-CG 3.82Å
149	D	91.8	Very high	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.9	162	177.2	51.8	0	0	0	109.4	V48 R132 W133 Y151 S152 G153 I154 V156	V48-D149 HydrophobicContact CG1-CB 4.1Å; R132-D149 IonicContact NE-OD1 2.95Å; W133-D149 HydrophobicContact CE3-CB 4.42Å; W133-D149 HydrophobicContact CZ3-CB 3.91Å; D149-Y151 VanDerWaalsContact C-N 3.25Å; D149-Y151 PolarHBondContact O-N 2.73Å; D149-S152 WeakPolarHBondContact CB-OG 3Å; D149-S152 VanDerWaalsContact OD2-CB 3.26Å; D149-S152 WeakPolarHBondContact OD2-CB 3.44Å; D149-S152 PolarHBondContact OD2-N 2.95Å; D149-S152 PolarHBondContact OD2-OG 3.13Å; D149-G153 WeakPolarHBondContact O-CA 3.36Å; D149-G153 PolarHBondContact O-N 2.74Å; D149-I154 PolarHBondContact N-O 3.45Å; D149-I154 VanDerWaalsContact N-O 3.09Å; D149-V156 HydrophobicContact CB-CG2 4.15Å
150	S	89.9	Confident	87.7	Confident	8 Å²	8	36.4 Å²	36.4	6%	0.056	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-22	-178.5	61.2	0	0	0	0	113.8	L56 R131 R132	L56-S150 WeakPolarHBondContact CD1-O 3.38Å; R131-S150 WeakPolarHBondContact O-CB 3.32Å; R131-S150 PolarHBondContact O-OG 3.27Å; R132-S150 WeakPolarHBondContact CA-OG 3.49Å; R132-S150 VanDerWaalsContact O-CB 3.27Å; R132-S150 WeakPolarHBondContact O-CB 3.34Å; R132-S150 PolarHBondContact O-N 2.9Å; R132-S150 PolarHBondContact O-OG 3.49Å
151	Y	88.3	Confident	87.8	Confident	46 Å²	46	40.9 Å²	40.9	18%	0.18	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-37.8	-175.5	-63.7	-14.4	0	0	0	113.1	T52 Q53 T55 L56 R132 D149	T52-Y151 WeakPolarHBondContact O-CB 3.42Å; Q53-Y151 HydrophobicContact CB-CE1 4.38Å; Q53-Y151 HydrophobicContact CG-CD1 4.15Å; Q53-Y151 HydrophobicContact CG-CE1 3.52Å; Q53-Y151 HydrophobicContact CG-CE2 4.2Å; Q53-Y151 PolarHBondContact NE2-OH 3.48Å; T55-Y151 PolarHBondContact OG1-O 3.14Å; L56-Y151 WeakPolarHBondContact CA-O 3.29Å; L56-Y151 WeakPolarHBondContact CB-O 3.32Å; L56-Y151 PolarHBondContact N-O 2.94Å; L56-Y151 VanDerWaalsContact N-O 3.16Å; R132-Y151 HydrophobicContact CG-CE2 4.31Å; D149-Y151 VanDerWaalsContact C-N 3.25Å; D149-Y151 PolarHBondContact O-N 2.73Å
152	S	84.4	Confident	88.1	Confident	6 Å²	6	36.3 Å²	36.3	4%	0.042	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-25.2	176	62.4	0	0	0	0	113.7	R63 Y113 D149 I154	R63-S152 PolarHBondContact NH2-O 3.05Å; R63-S152 VanDerWaalsContact NH2-O 3.09Å; Y113-S152 PolarHBondContact OH-O 3.44Å; D149-S152 WeakPolarHBondContact CB-OG 3Å; D149-S152 VanDerWaalsContact OD2-CB 3.26Å; D149-S152 WeakPolarHBondContact OD2-CB 3.44Å; D149-S152 PolarHBondContact OD2-N 2.95Å; D149-S152 PolarHBondContact OD2-OG 3.13Å; S152-I154 VanDerWaalsContact C-N 3.28Å; S152-I154 PolarHBondContact OG-N 2.81Å
153	G	84.1	Confident	88.3	Confident	4 Å²	4	27.8 Å²	27.8	4%	0.041	14%	0.144	C	C	.	.			trans	71.5	22.1	-174.5	0	0	0	0	0	113.6	Y113 D149	Y113-G153 VanDerWaalsContact CE1-CA 3.45Å; Y113-G153 PolarHBondContact OH-O 3.21Å; D149-G153 WeakPolarHBondContact O-CA 3.36Å; D149-G153 PolarHBondContact O-N 2.74Å
154	I	88.1	Confident	87.8	Confident	45 Å²	45	31.4 Å²	31.4	23%	0.231	17%	0.167	C	C	.	.			trans	-95.4	138	-179.2	-61.4	172.9	0	0	0	108.9	Q47 V48 D149 S152 V156	Q47-I154 HydrophobicContact CB-CD1 3.89Å; V48-I154 HydrophobicContact CG2-CB 4.07Å; V48-I154 HydrophobicContact CG2-CD1 4.07Å; V48-I154 HydrophobicContact CG2-CG2 4.11Å; D149-I154 PolarHBondContact N-O 3.45Å; D149-I154 VanDerWaalsContact N-O 3.09Å; S152-I154 VanDerWaalsContact C-N 3.28Å; S152-I154 PolarHBondContact OG-N 2.81Å; I154-V156 PolarHBondContact O-N 3.23Å
155	P	91.3	Very high	87.1	Confident	67 Å²	67	37.9 Å²	37.9	44%	0.435	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127	173.9	29.1	-30.5	0	0	0	109.8	I146 W148	I146-P155 HydrophobicContact CG2-CB 3.78Å; W148-P155 HydrophobicContact CD2-CB 4.32Å; W148-P155 HydrophobicContact CE3-CB 3.79Å; W148-P155 HydrophobicContact CE3-CG 4.28Å; W148-P155 HydrophobicContact CH2-CB 4.11Å; W148-P155 HydrophobicContact CH2-CG 4.36Å; W148-P155 HydrophobicContact CZ3-CB 3.69Å; W148-P155 HydrophobicContact CZ3-CG 3.82Å
156	V	90.3	Very high	86.5	Confident	64 Å²	64	38.7 Å²	38.7	39%	0.388	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-39.7	-176.9	175	0	0	0	0	112.1	V48 W133 I147 D149 I154	V48-V156 HydrophobicContact CG1-CG2 4.13Å; V48-V156 HydrophobicContact CG2-CG2 4.44Å; W133-V156 HydrophobicContact CH2-CG2 4.37Å; W133-V156 HydrophobicContact CZ3-CB 4.13Å; W133-V156 HydrophobicContact CZ3-CG1 4.25Å; W133-V156 HydrophobicContact CZ3-CG2 3.68Å; I147-V156 PolarHBondContact O-N 3Å; D149-V156 HydrophobicContact CB-CG2 4.15Å; I154-V156 PolarHBondContact O-N 3.23Å
157	N	89.8	Confident	85.9	Confident	23 Å²	23	39.5 Å²	39.5	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.2	175.3	-162.5	5.3	0	0	0	110.5	I147 W197 Q202	I147-N157 PolarHBondContact N-O 3.5Å; I147-N157 PolarHBondContact O-N 3.38Å; N157-W197 PolarHBondContact ND2-O 3.09Å; N157-Q202 PolarHBondContact OD1-NE2 3.39Å
158	T	90.4	Very high	85.6	Confident	30 Å²	30	39.5 Å²	39.5	18%	0.184	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	118.1	174.3	-54.9	0	0	0	0	108.5	M144 V145 I146 F160 Q202	M144-T158 HydrophobicContact CB-CG2 4.39Å; M144-T158 HydrophobicContact CE-CG2 3.57Å; V145-T158 CarbonylContact O-C 3.57Å; V145-T158 WeakPolarHBondContact O-CA 3.15Å; I146-T158 HydrophobicContact CG1-CG2 4.1Å; T158-F160 HydrophobicContact CG2-CD1 4.12Å; T158-F160 HydrophobicContact CG2-CD2 4.32Å; T158-F160 HydrophobicContact CG2-CE1 3.61Å; T158-F160 HydrophobicContact CG2-CE2 3.83Å; T158-F160 HydrophobicContact CG2-CG 4.45Å; T158-F160 HydrophobicContact CG2-CZ 3.46Å; T158-F160 VanDerWaalsContact CG2-CZ 3.46Å; T158-Q202 PolarHBondContact O-NE2 3.09Å
159	L	88.7	Confident	85.2	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.6	172.2	-51.5	174.1	0	0	0	107.5	M144 V145 L180 W195	M144-L159 WeakPolarHBondContact CA-O 3.48Å; V145-L159 HydrophobicContact CB-CB 4.17Å; V145-L159 HydrophobicContact CB-CD1 4.49Å; V145-L159 PolarHBondContact N-O 2.92Å; V145-L159 PolarHBondContact O-N 3.22Å; L159-L180 HydrophobicContact CD1-CD2 4.17Å; L159-W195 HydrophobicContact CD1-CB 4.09Å; L159-W195 HydrophobicContact CD1-CD2 4.14Å; L159-W195 HydrophobicContact CD1-CE3 4.38Å; L159-W195 HydrophobicContact CD1-CG 4.01Å
160	F	86.5	Confident	84.9	Confident	132 Å²	132	40.8 Å²	40.8	58%	0.579	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	145.9	-179.2	-62.3	-81.4	0	0	0	110.5	M144 T158 C162	M144-F160 HydrophobicContact CB-CD1 4.48Å; M144-F160 HydrophobicContact CE-CE1 4.16Å; T158-F160 HydrophobicContact CG2-CD1 4.12Å; T158-F160 HydrophobicContact CG2-CD2 4.32Å; T158-F160 HydrophobicContact CG2-CE1 3.61Å; T158-F160 HydrophobicContact CG2-CE2 3.83Å; T158-F160 HydrophobicContact CG2-CG 4.45Å; T158-F160 HydrophobicContact CG2-CZ 3.46Å; T158-F160 VanDerWaalsContact CG2-CZ 3.46Å; F160-C162 VanDerWaalsContact C-N 3.3Å; F160-C162 PolarHBondContact O-N 3.08Å
161	E	81.8	Confident	85.1	Confident	101 Å²	101	41 Å²	41	47%	0.472	23%	0.227	S	C	.	.			trans	52.7	46.3	171.4	-59	-176.9	166.3	0	0	112.6	R142 N143 H163	R142-E161 HydrophobicContact CB-CG 4.38Å; R142-E161 HydrophobicContact CG-CG 4.43Å; R142-E161 IonicContact NE-OE1 4Å; N143-E161 PolarHBondContact O-N 3.26Å; E161-H163 PolarHBondContact O-N 2.91Å
162	C	79.4	Confident	85.2	Confident	7 Å²	7	39.1 Å²	39.1	5%	0.047	22%	0.223	C	C	.	.	S	Bend	trans	-58.9	-33.7	178.4	-67.9	0	0	0	0	111.8	N143 V145 F160 W195	N143-C162 WeakPolarHBondContact OD1-CB 3.33Å; N143-C162 PolarHBondContact OD1-N 3.1Å; V145-C162 HydrophobicContact CG2-CB 4.49Å; V145-C162 VanDerWaalsContact CG2-SG 3.56Å; F160-C162 VanDerWaalsContact C-N 3.3Å; F160-C162 PolarHBondContact O-N 3.08Å; C162-W195 HydrophobicContact CB-CZ2 3.82Å
163	H	82.4	Confident	85.7	Confident	7 Å²	7	39.8 Å²	39.8	3%	0.032	23%	0.225	C	C	.	.	S	Bend	trans	-139.2	97.8	172.2	-64.2	-83.6	0	0	0	109.6	N143 E161 D165 S166 T182 G184 S191	N143-H163 PolarHBondContact ND2-O 3.34Å; N143-H163 PolarHBondContact OD1-N 2.79Å; N143-H163 VanDerWaalsContact OD1-N 3.11Å; E161-H163 PolarHBondContact O-N 2.91Å; H163-D165 VanDerWaalsContact C-N 3.29Å; H163-D165 PolarHBondContact O-N 2.79Å; H163-S166 WeakPolarHBondContact CB-OG 3.46Å; H163-S166 PolarHBondContact O-N 2.95Å; H163-T182 PolarHBondContact NE2-OG1 3.27Å; H163-G184 PolarHBondContact CE1-N 3.03Å; H163-G184 PolarHBondContact NE2-N 3.32Å; H163-S191 PolarHBondContact CE1-O 3.28Å; H163-S191 PolarHBondContact CE1-OG 2.81Å; H163-S191 PolarHBondContact ND1-OG 2.78Å
164	P	74.7	Confident	86	Confident	77 Å²	77	39.7 Å²	39.7	50%	0.5	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.9	-171.6	-24.5	33.6	0	0	0	115.1
165	D	73.6	Confident	85.9	Confident	160 Å²	160	41.5 Å²	41.5	86%	0.856	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.9	4.5	-173.7	-59.3	-45.7	0	0	0	113.2	H163	H163-D165 VanDerWaalsContact C-N 3.29Å; H163-D165 PolarHBondContact O-N 2.79Å
166	S	78.4	Confident	85.6	Confident	17 Å²	17	41.9 Å²	41.9	12%	0.119	23%	0.232	C	C	.	.	S	Bend	trans	-147.5	160.9	-176.1	67.7	0	0	0	0	114.2	N143 H163	N143-S166 PolarHBondContact ND2-O 3.21Å; H163-S166 WeakPolarHBondContact CB-OG 3.46Å; H163-S166 PolarHBondContact O-N 2.95Å
167	S	82.6	Confident	85.5	Confident	21 Å²	21	40.1 Å²	40.1	15%	0.147	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	167.7	172.3	75.3	0	0	0	0	110.9	R139 G184 D185	R139-S167 VanDerWaalsContact O-CB 3.27Å; R139-S167 WeakPolarHBondContact O-CB 2.87Å; S167-G184 CarbonylContact O-C 3.57Å; S167-G184 WeakPolarHBondContact O-CA 3.33Å; S167-D185 WeakPolarHBondContact O-CB 3.18Å; S167-D185 PolarHBondContact O-N 3.07Å
168	V	86.8	Confident	85.4	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.5	178.2	-173.9	0	0	0	0	109.8	S123 C124 V137 N143 A170 L183	S123-V168 WeakPolarHBondContact CB-O 3.32Å; S123-V168 PolarHBondContact OG-O 3.44Å; C124-V168 PolarHBondContact SG-O 2.77Å; V137-V168 HydrophobicContact CG1-CB 3.57Å; V137-V168 HydrophobicContact CG1-CG1 3.91Å; V137-V168 HydrophobicContact CG1-CG2 3.56Å; N143-V168 HydrophobicContact CB-CG2 4.13Å; V168-A170 WeakPolarHBondContact CG1-O 3.47Å; V168-L183 CarbonylContact C-O 3.54Å; V168-L183 WeakPolarHBondContact CA-O 3.37Å; V168-L183 VanDerWaalsContact CG1-O 3.31Å; V168-L183 WeakPolarHBondContact CG1-O 3.36Å
169	A	85.4	Confident	85.5	Confident	26 Å²	26	43.2 Å²	43.2	22%	0.215	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-32.7	179.4	0	0	0	0	0	113.6	C124 L183 D185	C124-A169 PolarHBondContact SG-O 2.8Å; A169-L183 HydrophobicContact CB-CD2 3.99Å; A169-L183 HydrophobicContact CB-CG 4.22Å; A169-L183 PolarHBondContact N-O 2.8Å; A169-D185 HydrophobicContact CB-CB 3.68Å
170	A	86.8	Confident	85.6	Confident	9 Å²	9	43 Å²	43	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	153.2	179.9	0	0	0	0	0	112.9	C124 V168 L183 I220	C124-A170 PolarHBondContact SG-N 3.37Å; V168-A170 WeakPolarHBondContact CG1-O 3.47Å; A170-L183 HydrophobicContact CB-CB 4.19Å; A170-L183 HydrophobicContact CB-CD2 4.07Å; A170-L183 PolarHBondContact O-N 2.94Å; A170-I220 HydrophobicContact CB-CB 4.22Å; A170-I220 HydrophobicContact CB-CG2 3.74Å
171	V	92.9	Very high	85.9	Confident	12 Å²	12	36.7 Å²	36.7	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.5	175	66.2	0	0	0	0	110.1	C124 C126 V137 L180 A181 T182	C124-V171 HydrophobicContact CB-CG1 3.84Å; C126-V171 HydrophobicContact CB-CG1 4Å; V137-V171 HydrophobicContact CG2-CB 3.97Å; V137-V171 HydrophobicContact CG2-CG1 3.9Å; V137-V171 HydrophobicContact CG2-CG2 4.16Å; V171-L180 HydrophobicContact CG2-CD1 3.68Å; V171-L180 HydrophobicContact CG2-CD2 4.13Å; V171-L180 HydrophobicContact CG2-CG 3.94Å; V171-A181 WeakPolarHBondContact CA-O 3.26Å; V171-T182 HydrophobicContact CG2-CG2 4.24Å
172	G	91.6	Very high	86.4	Confident	8 Å²	8	31.9 Å²	31.9	8%	0.082	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	142.6	178	0	0	0	0	0	112.6	A181 F222	G172-A181 PolarHBondContact N-O 2.91Å; G172-A181 PolarHBondContact O-N 2.83Å; G172-F222 WeakPolarHBondContact O-CE2 3.31Å
173	F	93.5	Very high	86.9	Confident	20 Å²	20	31.5 Å²	31.5	9%	0.088	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	146.8	169.5	-82.6	-68.2	0	0	0	110.9	C126 W133 A135 I147 L180 W197 F222	C126-F173 HydrophobicContact CB-CD2 4.47Å; C126-F173 WeakPolarHBondContact SG-CD2 3.32Å; W133-F173 HydrophobicContact CB-CE2 4.47Å; W133-F173 HydrophobicContact CB-CZ 4.16Å; A135-F173 HydrophobicContact CB-CE2 3.59Å; A135-F173 HydrophobicContact CB-CZ 3.71Å; I147-F173 HydrophobicContact CG2-CZ 4.43Å; F173-L180 HydrophobicContact CD1-CD1 3.66Å; F173-L180 HydrophobicContact CD2-CD1 4.3Å; F173-L180 HydrophobicContact CE1-CD1 3.58Å; F173-L180 HydrophobicContact CE2-CD1 4.24Å; F173-L180 HydrophobicContact CG-CD1 4.03Å; F173-L180 HydrophobicContact CZ-CD1 3.89Å; F173-W197 AromaticContact CE1-NE1 3.64Å; F173-F222 WeakPolarHBondContact O-CD2 3.09Å
174	S	91.4	Very high	87.1	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.014	18%	0.175	C	C	.	.			trans	-69.6	155.7	163.9	58.5	0	0	0	0	111	D176 T177 K178 Y179	S174-D176 WeakPolarHBondContact CB-OD1 3.22Å; S174-D176 PolarHBondContact O-N 3.41Å; S174-D176 PolarHBondContact OG-OD1 3.02Å; S174-T177 WeakPolarHBondContact O-CA 3Å; S174-T177 PolarHBondContact O-N 3.47Å; S174-K178 PolarHBondContact OG-N 2.87Å; S174-Y179 PolarHBondContact N-O 3.08Å; S174-Y179 PolarHBondContact OG-N 3.46Å; S174-Y179 PolarHBondContact OG-O 2.87Å
175	N	86	Confident	87.4	Confident	83 Å²	83	30.7 Å²	30.7	44%	0.444	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-29.1	179.8	-167	34.2	0	0	0	112.7	E129 T177 P224	E129-N175 WeakPolarHBondContact CG-OD1 3.48Å; N175-T177 PolarHBondContact O-N 2.95Å; N175-P224 PolarHBondContact ND2-O 3.14Å
176	D	85.3	Confident	87.7	Confident	75 Å²	75	24 Å²	24	40%	0.401	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-1.1	172.6	64.4	8	0	0	0	113.4	S174 K178 S227	S174-D176 WeakPolarHBondContact CB-OD1 3.22Å; S174-D176 PolarHBondContact O-N 3.41Å; S174-D176 PolarHBondContact OG-OD1 3.02Å; D176-K178 PolarHBondContact O-N 2.77Å; D176-K178 PolarHBondContact OD1-N 2.93Å; D176-K178 VanDerWaalsContact OD1-N 3.1Å; D176-S227 PolarHBondContact OD2-OG 2.82Å
177	T	87.9	Confident	87.4	Confident	27 Å²	27	31.8 Å²	31.8	17%	0.166	17%	0.17	C	C	.	.	S	Bend	trans	60.8	5	-178	70.3	0	0	0	0	115.7	S174 N175 W197	S174-T177 WeakPolarHBondContact O-CA 3Å; S174-T177 PolarHBondContact O-N 3.47Å; N175-T177 PolarHBondContact O-N 2.95Å; T177-W197 VanDerWaalsContact O-CE2 3.26Å; T177-W197 VanDerWaalsContact O-CZ2 3.27Å; T177-W197 WeakPolarHBondContact O-CZ2 3.44Å; T177-W197 PolarHBondContact O-NE1 2.79Å
178	K	88.2	Confident	87.2	Confident	79 Å²	79	37.4 Å²	37.4	34%	0.343	20%	0.198	S	C	.	.	S	Bend	trans	-81.1	-34.9	-175.9	-172.9	179.5	175.3	-156.6	0	113.1	S174 D176 D196 W197	S174-K178 PolarHBondContact OG-N 2.87Å; D176-K178 PolarHBondContact O-N 2.77Å; D176-K178 PolarHBondContact OD1-N 2.93Å; D176-K178 VanDerWaalsContact OD1-N 3.1Å; K178-D196 VanDerWaalsContact CE-OD2 3.23Å; K178-D196 WeakPolarHBondContact CE-OD2 3.33Å; K178-D196 IonicContact NZ-OD2 3.97Å; K178-W197 VanDerWaalsContact O-CD1 3.25Å; K178-W197 PolarHBondContact O-NE1 2.86Å
179	Y	90.8	Very high	86.9	Confident	38 Å²	38	41.5 Å²	41.5	15%	0.149	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	147	-173.6	-53.7	-68.5	0	0	0	111.4	S174 W195 D196 L205 W243	S174-Y179 PolarHBondContact N-O 3.08Å; S174-Y179 PolarHBondContact OG-N 3.46Å; S174-Y179 PolarHBondContact OG-O 2.87Å; Y179-W195 WeakPolarHBondContact CA-O 3.5Å; Y179-D196 HydrophobicContact CD1-CB 4.33Å; Y179-D196 HydrophobicContact CE1-CB 4.36Å; Y179-L205 HydrophobicContact CD1-CD1 3.69Å; Y179-L205 HydrophobicContact CE1-CD1 3.64Å; Y179-W243 AromaticContact CD1-CH2 3.91Å; Y179-W243 HydrophobicContact CD1-CH2 3.91Å; Y179-W243 HydrophobicContact CD1-CZ2 4.23Å; Y179-W243 AromaticContact CD2-CH2 3.99Å; Y179-W243 HydrophobicContact CD2-CH2 3.99Å; Y179-W243 AromaticContact CD2-CZ2 3.71Å; Y179-W243 HydrophobicContact CD2-CZ2 3.71Å; Y179-W243 AromaticContact CE1-CH2 3.73Å; Y179-W243 HydrophobicContact CE1-CH2 3.73Å; Y179-W243 HydrophobicContact CE1-CZ2 4.4Å; Y179-W243 AromaticContact CE2-CH2 3.78Å; Y179-W243 HydrophobicContact CE2-CH2 3.78Å; Y179-W243 AromaticContact CE2-CZ2 3.87Å; Y179-W243 HydrophobicContact CE2-CZ2 3.87Å; Y179-W243 HydrophobicContact CG-CH2 4.03Å; Y179-W243 AromaticContact CG-CZ2 3.89Å; Y179-W243 HydrophobicContact CG-CZ2 3.89Å; Y179-W243 AromaticContact CZ-CH2 3.65Å
180	L	92.3	Very high	86.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130	175.3	-171.4	79.9	0	0	0	108.8	A135 V145 L159 V171 F173 T182 I194 W195	A135-L180 HydrophobicContact CB-CD1 4.14Å; V145-L180 HydrophobicContact CG1-CD2 3.79Å; L159-L180 HydrophobicContact CD1-CD2 4.17Å; V171-L180 HydrophobicContact CG2-CD1 3.68Å; V171-L180 HydrophobicContact CG2-CD2 4.13Å; V171-L180 HydrophobicContact CG2-CG 3.94Å; F173-L180 HydrophobicContact CD1-CD1 3.66Å; F173-L180 HydrophobicContact CD2-CD1 4.3Å; F173-L180 HydrophobicContact CE1-CD1 3.58Å; F173-L180 HydrophobicContact CE2-CD1 4.24Å; F173-L180 HydrophobicContact CG-CD1 4.03Å; F173-L180 HydrophobicContact CZ-CD1 3.89Å; L180-T182 HydrophobicContact CD2-CG2 4.36Å; L180-I194 CarbonylContact O-C 3.57Å; L180-I194 WeakPolarHBondContact O-CA 3.47Å; L180-W195 HydrophobicContact CB-CB 4.34Å; L180-W195 PolarHBondContact N-O 3.44Å; L180-W195 PolarHBondContact O-N 2.81Å
181	A	91.9	Very high	87	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133	173.6	0	0	0	0	0	110.1	V171 G172 V193 I220 F222 L230	V171-A181 WeakPolarHBondContact CA-O 3.26Å; G172-A181 PolarHBondContact N-O 2.91Å; G172-A181 PolarHBondContact O-N 2.83Å; A181-V193 CarbonylContact C-O 3.6Å; A181-V193 WeakPolarHBondContact CA-O 3.35Å; A181-I220 HydrophobicContact CB-CD1 3.8Å; A181-F222 HydrophobicContact CB-CE2 3.58Å; A181-F222 HydrophobicContact CB-CZ 3.84Å; A181-L230 HydrophobicContact CB-CD1 4.26Å; A181-L230 HydrophobicContact CB-CD2 3.94Å
182	T	91.8	Very high	86.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.8	174.7	62.4	0	0	0	0	110.4	V145 H163 V171 L180 V192 V193 W195	V145-T182 HydrophobicContact CG2-CG2 4.25Å; H163-T182 PolarHBondContact NE2-OG1 3.27Å; V171-T182 HydrophobicContact CG2-CG2 4.24Å; L180-T182 HydrophobicContact CD2-CG2 4.36Å; T182-V192 WeakPolarHBondContact O-CA 3.38Å; T182-V193 PolarHBondContact N-O 2.86Å; T182-V193 PolarHBondContact O-N 3.06Å; T182-W195 PolarHBondContact OG1-NE1 3.02Å
183	L	90.4	Very high	86.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.1	176.8	172.9	70.7	0	0	0	109.3	V168 A169 A170 V192 L210 Q217	V168-L183 CarbonylContact C-O 3.54Å; V168-L183 WeakPolarHBondContact CA-O 3.37Å; V168-L183 VanDerWaalsContact CG1-O 3.31Å; V168-L183 WeakPolarHBondContact CG1-O 3.36Å; A169-L183 HydrophobicContact CB-CD2 3.99Å; A169-L183 HydrophobicContact CB-CG 4.22Å; A169-L183 PolarHBondContact N-O 2.8Å; A170-L183 HydrophobicContact CB-CB 4.19Å; A170-L183 HydrophobicContact CB-CD2 4.07Å; A170-L183 PolarHBondContact O-N 2.94Å; L183-V192 HydrophobicContact CD1-CG2 3.52Å; L183-L210 HydrophobicContact CD1-CD1 4.09Å; L183-Q217 HydrophobicContact CD1-CB 4.38Å; L183-Q217 HydrophobicContact CD2-CB 3.84Å; L183-Q217 WeakPolarHBondContact CD2-O 3.5Å
184	G	86.9	Confident	86.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.7	174.8	0	0	0	0	0	111.6	H163 S167 Q190 S191	H163-G184 PolarHBondContact CE1-N 3.03Å; H163-G184 PolarHBondContact NE2-N 3.32Å; S167-G184 CarbonylContact O-C 3.57Å; S167-G184 WeakPolarHBondContact O-CA 3.33Å; G184-Q190 VanDerWaalsContact O-CB 3.29Å; G184-Q190 WeakPolarHBondContact O-CB 3.35Å; G184-Q190 VanDerWaalsContact O-CG 3.24Å; G184-Q190 WeakPolarHBondContact O-CG 3.29Å; G184-S191 PolarHBondContact N-O 2.89Å
185	D	81.1	Confident	86.7	Confident	66 Å²	66	40.7 Å²	40.7	35%	0.353	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	65.3	-178.6	-164.4	30.9	0	0	0	109.8	S167 A169 Q190	S167-D185 WeakPolarHBondContact O-CB 3.18Å; S167-D185 PolarHBondContact O-N 3.07Å; A169-D185 HydrophobicContact CB-CB 3.68Å; D185-Q190 PolarHBondContact OD1-NE2 2.92Å
186	A	79.1	Confident	86.9	Confident	20 Å²	20	37.9 Å²	37.9	17%	0.165	19%	0.192	C	C	.	.			trans	-85.7	139.4	173.7	0	0	0	0	0	109.6	D188 Q189 F216	A186-D188 PolarHBondContact O-N 2.92Å; A186-Q189 VanDerWaalsContact CB-O 3.3Å; A186-Q189 WeakPolarHBondContact CB-O 3.27Å; A186-F216 WeakPolarHBondContact O-CE1 3.47Å
187	E	73.6	Confident	87	Confident	181 Å²	181	35.1 Å²	35.1	85%	0.846	18%	0.176	S	C	*	.	S	Bend	trans	-63	-31.1	177.4	-65	-170.9	169.6	0	0	112.5	F216	E187-F216 WeakPolarHBondContact O-CE1 3.36Å; E187-F216 WeakPolarHBondContact O-CZ 3.31Å
188	D	76.9	Confident	86.9	Confident	139 Å²	139	37.5 Å²	37.5	74%	0.743	19%	0.19	S	C	*	.	S	Bend	trans	-88.6	-58.6	-179.9	-69.8	-36.7	0	0	0	112.1	A186 P212	A186-D188 PolarHBondContact O-N 2.92Å; D188-P212 WeakPolarHBondContact O-CG 3.32Å
189	Q	80.9	Confident	86.7	Confident	87 Å²	87	35.9 Å²	35.9	41%	0.407	19%	0.189	S	C	.	.			trans	-145.5	107.7	-170.7	-164.1	175.4	-13.1	0	0	112	A186 E209 L210	A186-Q189 VanDerWaalsContact CB-O 3.3Å; A186-Q189 WeakPolarHBondContact CB-O 3.27Å; Q189-E209 HydrophobicContact CG-CB 4.33Å; Q189-E209 PolarHBondContact NE2-OE2 3.19Å; Q189-L210 VanDerWaalsContact CG-O 3.24Å; Q189-L210 WeakPolarHBondContact CG-O 3.14Å
190	Q	86.5	Confident	85.8	Confident	7 Å²	7	44 Å²	44	3%	0.033	23%	0.225	C	C	.	.			trans	-69.5	150.6	176.2	-68.4	-171.2	-35.5	0	0	111.7	G184 D185 L210 F216 Q217	G184-Q190 VanDerWaalsContact O-CB 3.29Å; G184-Q190 WeakPolarHBondContact O-CB 3.35Å; G184-Q190 VanDerWaalsContact O-CG 3.24Å; G184-Q190 WeakPolarHBondContact O-CG 3.29Å; D185-Q190 PolarHBondContact OD1-NE2 2.92Å; Q190-L210 HydrophobicContact CB-CB 4.38Å; Q190-L210 HydrophobicContact CB-CD1 4Å; Q190-L210 HydrophobicContact CB-CG 4.44Å; Q190-L210 WeakPolarHBondContact O-CB 3.35Å; Q190-L210 PolarHBondContact O-N 2.85Å; Q190-F216 HydrophobicContact CG-CD1 3.81Å; Q190-F216 HydrophobicContact CG-CE1 4.35Å; Q190-Q217 PolarHBondContact NE2-O 2.89Å
191	S	88.5	Confident	84.7	Confident	23 Å²	23	50.4 Å²	50.4	16%	0.161	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.4	177	65.9	0	0	0	0	111.5	H163 G184 V208	H163-S191 PolarHBondContact CE1-O 3.28Å; H163-S191 PolarHBondContact CE1-OG 2.81Å; H163-S191 PolarHBondContact ND1-OG 2.78Å; G184-S191 PolarHBondContact N-O 2.89Å; S191-V208 CarbonylContact C-O 3.53Å; S191-V208 VanDerWaalsContact CA-O 3.28Å; S191-V208 WeakPolarHBondContact CA-O 3.25Å
192	V	90.6	Very high	83.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.5	175.4	178.8	0	0	0	0	108.6	T182 L183 H207 V208 L210 I220 Y241 L248	T182-V192 WeakPolarHBondContact O-CA 3.38Å; L183-V192 HydrophobicContact CD1-CG2 3.52Å; V192-H207 CarbonylContact O-C 3.57Å; V192-H207 VanDerWaalsContact O-CA 3.26Å; V192-H207 WeakPolarHBondContact O-CA 3.12Å; V192-V208 HydrophobicContact CB-CG1 4.18Å; V192-V208 PolarHBondContact N-O 2.94Å; V192-V208 PolarHBondContact O-N 2.91Å; V192-L210 HydrophobicContact CG2-CD1 4.19Å; V192-L210 HydrophobicContact CG2-CD2 4.4Å; V192-L210 HydrophobicContact CG2-CG 4.46Å; V192-I220 HydrophobicContact CG1-CD1 3.8Å; V192-Y241 HydrophobicContact CB-CE1 4.39Å; V192-Y241 HydrophobicContact CG2-CE1 3.95Å; V192-L248 HydrophobicContact CB-CD2 4.06Å; V192-L248 HydrophobicContact CG1-CD2 3.9Å
193	V	90.8	Very high	82.6	Confident	9 Å²	9	62.5 Å²	62.5	6%	0.055	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.6	-178.3	-170.7	0	0	0	0	110	A181 T182 W195 C204 C206 H207	A181-V193 CarbonylContact C-O 3.6Å; A181-V193 WeakPolarHBondContact CA-O 3.35Å; T182-V193 PolarHBondContact N-O 2.86Å; T182-V193 PolarHBondContact O-N 3.06Å; V193-W195 HydrophobicContact CB-CZ2 4.25Å; V193-W195 HydrophobicContact CG1-CD2 4.19Å; V193-W195 VanDerWaalsContact CG1-CE2 3.44Å; V193-W195 HydrophobicContact CG1-CH2 4.38Å; V193-W195 HydrophobicContact CG1-CZ2 3.55Å; V193-C204 HydrophobicContact CG1-CB 3.48Å; V193-C204 VanDerWaalsContact CG1-CB 3.48Å; V193-C206 WeakPolarHBondContact CA-O 3.4Å; V193-H207 HydrophobicContact CG1-CB 4.37Å; V193-H207 HydrophobicContact CG2-CB 3.9Å
194	I	91.2	Very high	82.1	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.5	174.5	-54.7	-176	0	0	0	109.4	L180 L205 C206 L230 W243 L248	L180-I194 CarbonylContact O-C 3.57Å; L180-I194 WeakPolarHBondContact O-CA 3.47Å; I194-L205 HydrophobicContact CG2-CD1 4.41Å; I194-L205 PolarHBondContact O-N 2.9Å; I194-C206 PolarHBondContact N-O 2.87Å; I194-L230 HydrophobicContact CD1-CD1 3.7Å; I194-L230 HydrophobicContact CG1-CD1 4.22Å; I194-W243 HydrophobicContact CD1-CB 3.8Å; I194-W243 HydrophobicContact CD1-CD2 3.64Å; I194-W243 HydrophobicContact CD1-CE3 4.41Å; I194-W243 HydrophobicContact CD1-CG 3.31Å; I194-W243 HydrophobicContact CG2-CZ2 4.39Å; I194-L248 HydrophobicContact CD1-CD1 3.98Å; I194-L248 HydrophobicContact CG1-CD2 4.49Å
195	W	90.3	Very high	81.8	Confident	20 Å²	20	69.6 Å²	69.6	8%	0.076	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.6	-176.5	-54.8	88.3	0	0	0	110.2	L159 C162 Y179 L180 T182 V193 C204	L159-W195 HydrophobicContact CD1-CB 4.09Å; L159-W195 HydrophobicContact CD1-CD2 4.14Å; L159-W195 HydrophobicContact CD1-CE3 4.38Å; L159-W195 HydrophobicContact CD1-CG 4.01Å; C162-W195 HydrophobicContact CB-CZ2 3.82Å; Y179-W195 WeakPolarHBondContact CA-O 3.5Å; L180-W195 HydrophobicContact CB-CB 4.34Å; L180-W195 PolarHBondContact N-O 3.44Å; L180-W195 PolarHBondContact O-N 2.81Å; T182-W195 PolarHBondContact OG1-NE1 3.02Å; V193-W195 HydrophobicContact CB-CZ2 4.25Å; V193-W195 HydrophobicContact CG1-CD2 4.19Å; V193-W195 VanDerWaalsContact CG1-CE2 3.44Å; V193-W195 HydrophobicContact CG1-CH2 4.38Å; V193-W195 HydrophobicContact CG1-CZ2 3.55Å; W195-C204 HydrophobicContact CD2-CB 4.32Å; W195-C204 HydrophobicContact CE3-CB 3.96Å; W195-C204 HydrophobicContact CH2-CB 3.86Å; W195-C204 HydrophobicContact CZ2-CB 4.21Å; W195-C204 HydrophobicContact CZ3-CB 3.73Å
196	D	90.5	Very high	81.9	Confident	24 Å²	24	67 Å²	67	13%	0.128	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	95.2	158.3	-171	-23.6	0	0	0	107.7	K178 Y179 T198 S199 L205	K178-D196 VanDerWaalsContact CE-OD2 3.23Å; K178-D196 WeakPolarHBondContact CE-OD2 3.33Å; K178-D196 IonicContact NZ-OD2 3.97Å; Y179-D196 HydrophobicContact CD1-CB 4.33Å; Y179-D196 HydrophobicContact CE1-CB 4.36Å; D196-T198 PolarHBondContact O-N 3.27Å; D196-T198 PolarHBondContact OD1-N 2.98Å; D196-T198 PolarHBondContact OD1-OG1 2.89Å; D196-S199 PolarHBondContact O-N 2.83Å; D196-S199 PolarHBondContact OD1-N 3.22Å; D196-L205 HydrophobicContact CB-CD1 3.9Å; D196-L205 HydrophobicContact CB-CD2 4.32Å; D196-L205 HydrophobicContact CB-CG 4.13Å
197	W	87.7	Confident	82.2	Confident	17 Å²	17	71.7 Å²	71.7	6%	0.064	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-10.7	-177.3	70.4	-89.4	0	0	0	112.8	W133 I147 N157 F173 T177 K178	W133-W197 AromaticContact CD2-CH2 3.75Å; W133-W197 HydrophobicContact CD2-CH2 3.75Å; W133-W197 HydrophobicContact CD2-CZ2 4.4Å; W133-W197 AromaticContact CE2-CH2 3.75Å; W133-W197 HydrophobicContact CE3-CH2 4.18Å; W133-W197 HydrophobicContact CG-CH2 4.05Å; W133-W197 HydrophobicContact CG-CZ2 4.23Å; W133-W197 HydrophobicContact CZ2-CH2 4.18Å; I147-W197 HydrophobicContact CD1-CB 3.38Å; I147-W197 HydrophobicContact CD1-CD2 3.48Å; I147-W197 VanDerWaalsContact CD1-CD2 3.48Å; I147-W197 HydrophobicContact CD1-CE3 3.59Å; I147-W197 HydrophobicContact CD1-CG 3.39Å; I147-W197 HydrophobicContact CG2-CE3 4.13Å; I147-W197 HydrophobicContact CG2-CH2 4.48Å; I147-W197 HydrophobicContact CG2-CZ3 4.08Å; N157-W197 PolarHBondContact ND2-O 3.09Å; F173-W197 AromaticContact CE1-NE1 3.64Å; T177-W197 VanDerWaalsContact O-CE2 3.26Å; T177-W197 VanDerWaalsContact O-CZ2 3.27Å; T177-W197 WeakPolarHBondContact O-CZ2 3.44Å; T177-W197 PolarHBondContact O-NE1 2.79Å; K178-W197 VanDerWaalsContact O-CD1 3.25Å; K178-W197 PolarHBondContact O-NE1 2.86Å
198	T	86.1	Confident	82.9	Confident	77 Å²	77	64.2 Å²	64.2	47%	0.472	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-19.6	177.9	69.9	0	0	0	0	112.4	D196	D196-T198 PolarHBondContact O-N 3.27Å; D196-T198 PolarHBondContact OD1-N 2.98Å; D196-T198 PolarHBondContact OD1-OG1 2.89Å
199	S	82.7	Confident	83.3	Confident	46 Å²	46	62.9 Å²	62.9	32%	0.322	31%	0.312	S	S	.	.	S	Bend	trans	-70.9	145.6	176.2	-172.2	0	0	0	0	111.6	D196 E201	D196-S199 PolarHBondContact O-N 2.83Å; D196-S199 PolarHBondContact OD1-N 3.22Å; S199-E201 PolarHBondContact O-N 3.01Å; S199-E201 PolarHBondContact OG-N 3.27Å
200	K	72.4	Confident	83.4	Confident	209 Å²	209	59 Å²	59	91%	0.909	29%	0.294	S	S	*	.	S	Bend	trans	-70	-25.1	170.6	-67.1	-174.1	178.9	-177.6	0	112	Q202	K200-Q202 PolarHBondContact O-N 3.31Å
201	E	68.8	Low	83.1	Confident	134 Å²	134	62 Å²	62	63%	0.626	31%	0.31	S	S	*	.	S	Bend	trans	-81.8	97	173.8	-62	-174.6	-165.8	0	0	107.4	S199 K203	S199-E201 PolarHBondContact O-N 3.01Å; S199-E201 PolarHBondContact OG-N 3.27Å; E201-K203 PolarHBondContact O-N 3.4Å
202	Q	67.6	Low	82.6	Confident	105 Å²	105	64.2 Å²	64.2	49%	0.491	32%	0.324	S	S	.	.			trans	-70.2	54.3	177.6	-66.1	178.9	-29.4	0	0	111.7	N157 T158 K200	N157-Q202 PolarHBondContact OD1-NE2 3.39Å; T158-Q202 PolarHBondContact O-NE2 3.09Å; K200-Q202 PolarHBondContact O-N 3.31Å
203	K	72.4	Confident	82	Confident	149 Å²	149	72.4 Å²	72.4	65%	0.648	36%	0.36	S	S	*	.			trans	-110.6	147.1	179.2	-70.2	-178.1	178.4	174.5	0	110.1	E201	E201-K203 PolarHBondContact O-N 3.4Å
204	C	79.3	Confident	81.3	Confident	59 Å²	59	73.3 Å²	73.3	40%	0.399	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	139.4	170.1	58.8	0	0	0	0	109.9	V193 W195	V193-C204 HydrophobicContact CG1-CB 3.48Å; V193-C204 VanDerWaalsContact CG1-CB 3.48Å; W195-C204 HydrophobicContact CD2-CB 4.32Å; W195-C204 HydrophobicContact CE3-CB 3.96Å; W195-C204 HydrophobicContact CH2-CB 3.86Å; W195-C204 HydrophobicContact CZ2-CB 4.21Å; W195-C204 HydrophobicContact CZ3-CB 3.73Å
205	L	80.9	Confident	80.6	Confident	90 Å²	90	74.1 Å²	74.1	47%	0.471	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-49.4	176.1	-71.6	177.9	0	0	0	110.6	Y179 I194 D196 W243	Y179-L205 HydrophobicContact CD1-CD1 3.69Å; Y179-L205 HydrophobicContact CE1-CD1 3.64Å; I194-L205 HydrophobicContact CG2-CD1 4.41Å; I194-L205 PolarHBondContact O-N 2.9Å; D196-L205 HydrophobicContact CB-CD1 3.9Å; D196-L205 HydrophobicContact CB-CD2 4.32Å; D196-L205 HydrophobicContact CB-CG 4.13Å; L205-W243 HydrophobicContact CD1-CH2 4.31Å; L205-W243 HydrophobicContact CD1-CZ3 4.24Å
206	C	82.6	Confident	80.2	Confident	12 Å²	12	77.7 Å²	77.7	8%	0.081	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	147.8	179	55	0	0	0	0	110.1	V193 I194 L248	V193-C206 WeakPolarHBondContact CA-O 3.4Å; I194-C206 PolarHBondContact N-O 2.87Å; C206-L248 HydrophobicContact CB-CB 4.11Å
207	H	86.8	Confident	80	Confident	118 Å²	118	76.5 Å²	76.5	55%	0.546	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.7	172.6	67.6	-80.1	0	0	0	109.3	V192 V193	V192-H207 CarbonylContact O-C 3.57Å; V192-H207 VanDerWaalsContact O-CA 3.26Å; V192-H207 WeakPolarHBondContact O-CA 3.12Å; V193-H207 HydrophobicContact CG1-CB 4.37Å; V193-H207 HydrophobicContact CG2-CB 3.9Å
208	V	87.2	Confident	79.7	Confident	23 Å²	23	79.5 Å²	79.5	14%	0.139	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.3	169.8	79	0	0	0	0	109.6	S191 V192 L210 Y241 L248 Y250	S191-V208 CarbonylContact C-O 3.53Å; S191-V208 VanDerWaalsContact CA-O 3.28Å; S191-V208 WeakPolarHBondContact CA-O 3.25Å; V192-V208 HydrophobicContact CB-CG1 4.18Å; V192-V208 PolarHBondContact N-O 2.94Å; V192-V208 PolarHBondContact O-N 2.91Å; V208-L210 HydrophobicContact CG1-CD2 4.26Å; V208-Y241 HydrophobicContact CG1-CD1 4.38Å; V208-Y241 HydrophobicContact CG1-CE1 4.25Å; V208-L248 HydrophobicContact CB-CB 4.11Å; V208-L248 HydrophobicContact CB-CD2 3.83Å; V208-L248 HydrophobicContact CB-CG 3.93Å; V208-L248 HydrophobicContact CG1-CB 4.45Å; V208-L248 HydrophobicContact CG1-CD2 3.42Å; V208-L248 VanDerWaalsContact CG1-CD2 3.42Å; V208-L248 HydrophobicContact CG1-CG 3.72Å; V208-L248 WeakPolarHBondContact CG2-O 3.37Å; V208-Y250 HydrophobicContact CG1-CD1 4.03Å; V208-Y250 HydrophobicContact CG2-CD1 3.71Å; V208-Y250 HydrophobicContact CG2-CE1 3.81Å
209	E	84.5	Confident	79.7	Confident	112 Å²	112	76.6 Å²	76.6	52%	0.523	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.7	172.5	-54.5	178.2	168.5	0	0	110.3	Q189 Y250	Q189-E209 HydrophobicContact CG-CB 4.33Å; Q189-E209 PolarHBondContact NE2-OE2 3.19Å; E209-Y250 WeakPolarHBondContact O-CE1 3.22Å
210	L	84.1	Confident	80.1	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-86.5	146.7	-178	-56.7	-175.9	0	0	0	110.6	L183 Q189 Q190 V192 V208 Q217 L239 Y241 Y250	L183-L210 HydrophobicContact CD1-CD1 4.09Å; Q189-L210 VanDerWaalsContact CG-O 3.24Å; Q189-L210 WeakPolarHBondContact CG-O 3.14Å; Q190-L210 HydrophobicContact CB-CB 4.38Å; Q190-L210 HydrophobicContact CB-CD1 4Å; Q190-L210 HydrophobicContact CB-CG 4.44Å; Q190-L210 WeakPolarHBondContact O-CB 3.35Å; Q190-L210 PolarHBondContact O-N 2.85Å; V192-L210 HydrophobicContact CG2-CD1 4.19Å; V192-L210 HydrophobicContact CG2-CD2 4.4Å; V192-L210 HydrophobicContact CG2-CG 4.46Å; V208-L210 HydrophobicContact CG1-CD2 4.26Å; L210-Q217 HydrophobicContact CD1-CG 3.83Å; L210-L239 HydrophobicContact CD1-CD1 3.98Å; L210-L239 HydrophobicContact CD2-CD1 3.9Å; L210-L239 HydrophobicContact CG-CD1 4.47Å; L210-Y241 HydrophobicContact CD2-CE1 3.79Å; L210-Y250 HydrophobicContact CD2-CD1 4.08Å; L210-Y250 HydrophobicContact CD2-CD2 4.43Å; L210-Y250 HydrophobicContact CD2-CE1 4.05Å; L210-Y250 HydrophobicContact CD2-CE2 4.41Å; L210-Y250 HydrophobicContact CD2-CG 4.27Å
211	N	80.6	Confident	80.9	Confident	70 Å²	70	67.1 Å²	67.1	37%	0.374	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-76.2	127.6	173.5	-166.9	-23.8	0	0	0	109.5	K213 D214 Y250	N211-K213 PolarHBondContact O-N 2.9Å; N211-K213 PolarHBondContact OD1-N 2.81Å; N211-D214 PolarHBondContact O-N 2.88Å; N211-Y250 PolarHBondContact N-OH 3.04Å
212	P	77.9	Confident	81.9	Confident	70 Å²	70	61.2 Å²	61.2	46%	0.455	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-57.3	-22.9	179.4	-26.5	35.5	0	0	0	113.7	D188 D214 G215	D188-P212 WeakPolarHBondContact O-CG 3.32Å; P212-D214 VanDerWaalsContact C-N 3.26Å; P212-D214 PolarHBondContact O-N 2.86Å; P212-G215 PolarHBondContact O-N 3.02Å
213	K	77.3	Confident	82.8	Confident	172 Å²	172	56.6 Å²	56.6	75%	0.748	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-68.6	-21.6	177.2	-65.2	179.9	-178.1	175.1	0	114	N211 G215	N211-K213 PolarHBondContact O-N 2.9Å; N211-K213 PolarHBondContact OD1-N 2.81Å; K213-G215 PolarHBondContact O-N 2.81Å
214	D	76	Confident	83.3	Confident	28 Å²	28	52.1 Å²	52.1	15%	0.15	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-84.6	2.3	179.4	-60.5	-32.5	0	0	0	112.1	N211 P212 Q217 S234 H237 L239 A252	N211-D214 PolarHBondContact O-N 2.88Å; P212-D214 VanDerWaalsContact C-N 3.26Å; P212-D214 PolarHBondContact O-N 2.86Å; D214-Q217 PolarHBondContact O-NE2 2.85Å; D214-S234 PolarHBondContact O-OG 2.87Å; D214-H237 VanDerWaalsContact O-CB 3.24Å; D214-H237 WeakPolarHBondContact O-CB 3.48Å; D214-H237 VanDerWaalsContact O-CG 3.31Å; D214-H237 PolarHBondContact O-ND1 2.84Å; D214-L239 HydrophobicContact CB-CD2 4.12Å; D214-A252 HydrophobicContact CB-CB 4.23Å
215	G	76.3	Confident	83.5	Confident	17 Å²	17	54.9 Å²	54.9	18%	0.175	28%	0.284	C	S	.	.			trans	75.7	151	177	0	0	0	0	0	113.5	P212 K213 Q217	P212-G215 PolarHBondContact O-N 3.02Å; K213-G215 PolarHBondContact O-N 2.81Å; G215-Q217 PolarHBondContact O-N 3.06Å; G215-Q217 PolarHBondContact O-NE2 2.93Å
216	F	82.8	Confident	83.6	Confident	94 Å²	94	52.8 Å²	52.8	41%	0.412	27%	0.273	S	S	.	.			trans	-67.1	122.1	179.9	-62.3	-84.7	0	0	0	111	A186 E187 Q190 S234	A186-F216 WeakPolarHBondContact O-CE1 3.47Å; E187-F216 WeakPolarHBondContact O-CE1 3.36Å; E187-F216 WeakPolarHBondContact O-CZ 3.31Å; Q190-F216 HydrophobicContact CG-CD1 3.81Å; Q190-F216 HydrophobicContact CG-CE1 4.35Å; F216-S234 WeakPolarHBondContact O-CA 3.38Å; F216-S234 WeakPolarHBondContact O-CB 3.34Å
217	Q	85.4	Confident	83.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	141	-179.2	-52.6	-63.8	-57.7	0	0	109.9	L183 Q190 L210 D214 G215 S232 G233 S234 L239	L183-Q217 HydrophobicContact CD1-CB 4.38Å; L183-Q217 HydrophobicContact CD2-CB 3.84Å; L183-Q217 WeakPolarHBondContact CD2-O 3.5Å; Q190-Q217 PolarHBondContact NE2-O 2.89Å; L210-Q217 HydrophobicContact CD1-CG 3.83Å; D214-Q217 PolarHBondContact O-NE2 2.85Å; G215-Q217 PolarHBondContact O-N 3.06Å; G215-Q217 PolarHBondContact O-NE2 2.93Å; Q217-S232 WeakPolarHBondContact CG-OG 3.28Å; Q217-S232 PolarHBondContact OE1-O 2.82Å; Q217-S232 PolarHBondContact OE1-OG 2.87Å; Q217-G233 WeakPolarHBondContact CA-O 3.47Å; Q217-G233 VanDerWaalsContact OE1-CA 3.28Å; Q217-S234 PolarHBondContact NE2-OG 2.78Å; Q217-L239 HydrophobicContact CG-CD1 3.81Å; Q217-L239 HydrophobicContact CG-CG 4.38Å
218	D	83	Confident	83.6	Confident	80 Å²	80	50.2 Å²	50.2	43%	0.428	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-19.9	-171.3	-55.2	-31.4	0	0	0	112.8	G233	D218-G233 PolarHBondContact N-O 2.92Å
219	H	85.1	Confident	83.6	Confident	15 Å²	15	50 Å²	50	7%	0.069	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	157.8	-179.2	66.1	-91.7	0	0	0	112.3	S232 S288	H219-S232 WeakPolarHBondContact O-CA 3.16Å; H219-S232 WeakPolarHBondContact O-CB 3.45Å; H219-S288 PolarHBondContact CE1-N 3.18Å; H219-S288 PolarHBondContact NE2-N 2.8Å; H219-S288 VanDerWaalsContact NE2-N 3.18Å; H219-S288 PolarHBondContact NE2-OG 3.44Å
220	I	90.3	Very high	83.8	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.046	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135	175.4	-163.4	166.6	0	0	0	111.2	A170 A181 V192 L230 L231	A170-I220 HydrophobicContact CB-CB 4.22Å; A170-I220 HydrophobicContact CB-CG2 3.74Å; A181-I220 HydrophobicContact CB-CD1 3.8Å; V192-I220 HydrophobicContact CG1-CD1 3.8Å; I220-L230 HydrophobicContact CD1-CD1 4.43Å; I220-L230 HydrophobicContact CD1-CD2 4.31Å; I220-L230 HydrophobicContact CG1-CD2 4.23Å; I220-L231 CarbonylContact C-O 3.49Å; I220-L231 WeakPolarHBondContact CA-O 3.18Å
221	I	89.3	Confident	84.1	Confident	47 Å²	47	44.4 Å²	44.4	24%	0.241	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.1	-179.4	-61.4	179.1	0	0	0	109.6	L230 L231	I221-L230 CarbonylContact O-C 3.6Å; I221-L230 WeakPolarHBondContact O-CA 3.49Å; I221-L231 PolarHBondContact N-O 2.93Å; I221-L231 PolarHBondContact O-N 2.98Å
222	F	89.9	Confident	84.4	Confident	11 Å²	11	41.1 Å²	41.1	5%	0.048	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	149.5	170.9	-83.2	-93.6	0	0	0	111.6	G172 F173 A181 P224 S227 L230	G172-F222 WeakPolarHBondContact O-CE2 3.31Å; F173-F222 WeakPolarHBondContact O-CD2 3.09Å; A181-F222 HydrophobicContact CB-CE2 3.58Å; A181-F222 HydrophobicContact CB-CZ 3.84Å; F222-P224 WeakPolarHBondContact O-CD 3.48Å; F222-S227 WeakPolarHBondContact CD1-O 3.43Å; F222-S227 VanDerWaalsContact CE1-O 3.31Å; F222-S227 WeakPolarHBondContact CE1-O 3.46Å; F222-L230 HydrophobicContact CB-CD2 4.36Å; F222-L230 HydrophobicContact CD1-CD2 3.46Å; F222-L230 VanDerWaalsContact CD1-CD2 3.46Å; F222-L230 HydrophobicContact CD1-CG 4.19Å; F222-L230 HydrophobicContact CD2-CD2 3.45Å; F222-L230 VanDerWaalsContact CD2-CD2 3.45Å; F222-L230 HydrophobicContact CE1-CD2 3.49Å; F222-L230 VanDerWaalsContact CE1-CD2 3.49Å; F222-L230 HydrophobicContact CE1-CG 4.1Å; F222-L230 HydrophobicContact CE2-CD2 3.47Å; F222-L230 VanDerWaalsContact CE2-CD2 3.47Å; F222-L230 HydrophobicContact CG-CD2 3.47Å; F222-L230 VanDerWaalsContact CG-CD2 3.47Å; F222-L230 HydrophobicContact CZ-CD2 3.52Å; F222-L230 HydrophobicContact CZ-CG 4.42Å
223	N	87.1	Confident	84.6	Confident	8 Å²	8	37.8 Å²	37.8	4%	0.043	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	124.8	169.2	-178.2	-14.6	0	0	0	109.5	N225 D226 Q229 F290	N223-N225 PolarHBondContact O-N 2.82Å; N223-N225 VanDerWaalsContact O-N 3.13Å; N223-N225 PolarHBondContact OD1-N 3.15Å; N223-D226 HydrophobicContact CB-CB 4.34Å; N223-D226 WeakPolarHBondContact CB-O 3.4Å; N223-D226 CarbonylContact O-C 3.54Å; N223-D226 PolarHBondContact O-N 3.49Å; N223-Q229 HydrophobicContact CB-CB 3.88Å; N223-Q229 PolarHBondContact N-O 2.87Å; N223-Q229 PolarHBondContact ND2-OE1 2.86Å; N223-F290 HydrophobicContact CB-CD2 3.88Å; N223-F290 HydrophobicContact CB-CE1 4.43Å; N223-F290 HydrophobicContact CB-CE2 3.76Å; N223-F290 HydrophobicContact CB-CG 4.24Å; N223-F290 HydrophobicContact CB-CZ 4.05Å
224	P	82.9	Confident	84.9	Confident	55 Å²	55	29.8 Å²	29.8	36%	0.357	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.4	-179.8	-26.1	34.5	0	0	0	113.9	N175 F222	N175-P224 PolarHBondContact ND2-O 3.14Å; F222-P224 WeakPolarHBondContact O-CD 3.48Å
225	N	83.2	Confident	84.7	Confident	116 Å²	116	33.7 Å²	33.7	62%	0.62	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-16.4	-177	-63	-41.3	0	0	0	113.8	N223 W292	N223-N225 PolarHBondContact O-N 2.82Å; N223-N225 VanDerWaalsContact O-N 3.13Å; N223-N225 PolarHBondContact OD1-N 3.15Å; N225-W292 PolarHBondContact ND2-O 3.02Å
226	D	83.6	Confident	84.6	Confident	46 Å²	46	36.1 Å²	36.1	25%	0.246	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	108.3	-173.3	-174.4	-5.1	0	0	0	111	N223 T228 Q229	N223-D226 HydrophobicContact CB-CB 4.34Å; N223-D226 WeakPolarHBondContact CB-O 3.4Å; N223-D226 CarbonylContact O-C 3.54Å; N223-D226 PolarHBondContact O-N 3.49Å; D226-T228 PolarHBondContact O-N 3.38Å; D226-T228 VanDerWaalsContact O-N 3.16Å; D226-T228 WeakPolarHBondContact OD1-CB 3.4Å; D226-T228 PolarHBondContact OD1-N 2.92Å; D226-T228 PolarHBondContact OD1-OG1 3.39Å; D226-T228 PolarHBondContact OD2-OG1 3.24Å; D226-Q229 HydrophobicContact CB-CG 4.46Å; D226-Q229 PolarHBondContact O-N 2.96Å; D226-Q229 WeakPolarHBondContact OD2-CG 3.21Å; D226-Q229 PolarHBondContact OD2-NE2 3.03Å
227	S	84.2	Confident	84.6	Confident	33 Å²	33	32.6 Å²	32.6	23%	0.231	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-11.3	179.5	54.6	0	0	0	0	113.8	D176 F222 Q229 W243	D176-S227 PolarHBondContact OD2-OG 2.82Å; F222-S227 WeakPolarHBondContact CD1-O 3.43Å; F222-S227 VanDerWaalsContact CE1-O 3.31Å; F222-S227 WeakPolarHBondContact CE1-O 3.46Å; S227-Q229 VanDerWaalsContact C-N 3.34Å; S227-W243 PolarHBondContact O-NE1 3.01Å
228	T	85	Confident	84.5	Confident	43 Å²	43	32.7 Å²	32.7	26%	0.264	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-7.2	177.9	70.5	0	0	0	0	113.9	D226 K242 W243	D226-T228 PolarHBondContact O-N 3.38Å; D226-T228 VanDerWaalsContact O-N 3.16Å; D226-T228 WeakPolarHBondContact OD1-CB 3.4Å; D226-T228 PolarHBondContact OD1-N 2.92Å; D226-T228 PolarHBondContact OD1-OG1 3.39Å; D226-T228 PolarHBondContact OD2-OG1 3.24Å; T228-K242 WeakPolarHBondContact O-CA 3.36Å; T228-W243 VanDerWaalsContact C-CD1 3.44Å; T228-W243 WeakPolarHBondContact CB-O 3.15Å; T228-W243 PolarHBondContact O-N 2.88Å
229	Q	87.4	Confident	84.6	Confident	19 Å²	19	28.9 Å²	28.9	9%	0.089	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.8	-176.2	-65.3	178.3	26.3	0	0	112.1	N223 D226 S227 Y241	N223-Q229 HydrophobicContact CB-CB 3.88Å; N223-Q229 PolarHBondContact N-O 2.87Å; N223-Q229 PolarHBondContact ND2-OE1 2.86Å; D226-Q229 HydrophobicContact CB-CG 4.46Å; D226-Q229 PolarHBondContact O-N 2.96Å; D226-Q229 WeakPolarHBondContact OD2-CG 3.21Å; D226-Q229 PolarHBondContact OD2-NE2 3.03Å; S227-Q229 VanDerWaalsContact C-N 3.34Å; Q229-Y241 WeakPolarHBondContact CA-O 3.32Å
230	L	89.4	Confident	84.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	158.5	176.2	-61.7	155.6	0	0	0	110.6	A181 I194 I220 I221 F222 I240 Y241 L248	A181-L230 HydrophobicContact CB-CD1 4.26Å; A181-L230 HydrophobicContact CB-CD2 3.94Å; I194-L230 HydrophobicContact CD1-CD1 3.7Å; I194-L230 HydrophobicContact CG1-CD1 4.22Å; I220-L230 HydrophobicContact CD1-CD1 4.43Å; I220-L230 HydrophobicContact CD1-CD2 4.31Å; I220-L230 HydrophobicContact CG1-CD2 4.23Å; I221-L230 CarbonylContact O-C 3.6Å; I221-L230 WeakPolarHBondContact O-CA 3.49Å; F222-L230 HydrophobicContact CB-CD2 4.36Å; F222-L230 HydrophobicContact CD1-CD2 3.46Å; F222-L230 VanDerWaalsContact CD1-CD2 3.46Å; F222-L230 HydrophobicContact CD1-CG 4.19Å; F222-L230 HydrophobicContact CD2-CD2 3.45Å; F222-L230 VanDerWaalsContact CD2-CD2 3.45Å; F222-L230 HydrophobicContact CE1-CD2 3.49Å; F222-L230 VanDerWaalsContact CE1-CD2 3.49Å; F222-L230 HydrophobicContact CE1-CG 4.1Å; F222-L230 HydrophobicContact CE2-CD2 3.47Å; F222-L230 VanDerWaalsContact CE2-CD2 3.47Å; F222-L230 HydrophobicContact CG-CD2 3.47Å; F222-L230 VanDerWaalsContact CG-CD2 3.47Å; F222-L230 HydrophobicContact CZ-CD2 3.52Å; F222-L230 HydrophobicContact CZ-CG 4.42Å; L230-I240 WeakPolarHBondContact O-CA 3.33Å; L230-Y241 HydrophobicContact CB-CD2 3.77Å; L230-Y241 HydrophobicContact CB-CG 4.17Å; L230-Y241 PolarHBondContact N-O 2.89Å; L230-Y241 PolarHBondContact O-N 3.27Å; L230-L248 HydrophobicContact CD1-CD1 4.47Å
231	L	89.1	Confident	84.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.4	174.5	-177.2	71.8	0	0	0	109.3	I220 I221 I238 L239 I240 S288 F290 V297	I220-L231 CarbonylContact C-O 3.49Å; I220-L231 WeakPolarHBondContact CA-O 3.18Å; I221-L231 PolarHBondContact N-O 2.93Å; I221-L231 PolarHBondContact O-N 2.98Å; L231-I238 HydrophobicContact CD1-CG2 3.38Å; L231-I238 HydrophobicContact CG-CG2 4.37Å; L231-L239 WeakPolarHBondContact CA-O 3.34Å; L231-I240 HydrophobicContact CD1-CG1 3.82Å; L231-S288 WeakPolarHBondContact CD2-O 3.43Å; L231-S288 WeakPolarHBondContact CD2-OG 3.27Å; L231-F290 HydrophobicContact CB-CD2 4.12Å; L231-F290 HydrophobicContact CB-CE2 3.35Å; L231-F290 HydrophobicContact CB-CZ 3.61Å; L231-F290 HydrophobicContact CD2-CD2 4.26Å; L231-F290 HydrophobicContact CD2-CE2 4.24Å; L231-F290 HydrophobicContact CG-CE2 4.36Å; L231-F290 HydrophobicContact CG-CZ 4.46Å; L231-V297 HydrophobicContact CD1-CG1 3.92Å; L231-V297 HydrophobicContact CD1-CG2 4.18Å; L231-V297 HydrophobicContact CD2-CG1 3.85Å
232	S	87.3	Confident	84.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	154.8	164.7	75	0	0	0	0	110.8	Q217 H219 I238 L239 Y241	Q217-S232 WeakPolarHBondContact CG-OG 3.28Å; Q217-S232 PolarHBondContact OE1-O 2.82Å; Q217-S232 PolarHBondContact OE1-OG 2.87Å; H219-S232 WeakPolarHBondContact O-CA 3.16Å; H219-S232 WeakPolarHBondContact O-CB 3.45Å; S232-I238 WeakPolarHBondContact O-CA 3.47Å; S232-I238 WeakPolarHBondContact O-CG2 3.42Å; S232-L239 PolarHBondContact N-O 2.84Å; S232-L239 PolarHBondContact O-N 2.91Å; S232-L239 WeakPolarHBondContact OG-CB 3.29Å; S232-Y241 VanDerWaalsContact OG-CE2 3.29Å; S232-Y241 WeakPolarHBondContact OG-CE2 3.32Å; S232-Y241 PolarHBondContact OG-OH 2.82Å
233	G	82.9	Confident	84.2	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.6	176.5	0	0	0	0	0	112.5	Q217 D218	Q217-G233 WeakPolarHBondContact CA-O 3.47Å; Q217-G233 VanDerWaalsContact OE1-CA 3.28Å; D218-G233 PolarHBondContact N-O 2.92Å
234	S	82.4	Confident	84	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	175.5	166.8	67.4	0	0	0	0	111.1	D214 F216 Q217 T236 H237 K299	D214-S234 PolarHBondContact O-OG 2.87Å; F216-S234 WeakPolarHBondContact O-CA 3.38Å; F216-S234 WeakPolarHBondContact O-CB 3.34Å; Q217-S234 PolarHBondContact NE2-OG 2.78Å; S234-T236 PolarHBondContact O-N 2.89Å; S234-T236 VanDerWaalsContact O-N 3.14Å; S234-T236 PolarHBondContact OG-N 3.1Å; S234-H237 PolarHBondContact N-O 2.85Å; S234-H237 PolarHBondContact OG-N 3.05Å; S234-H237 PolarHBondContact OG-O 2.99Å; S234-H237 VanDerWaalsContact OG-O 3.1Å; S234-K299 PolarHBondContact O-NZ 3.25Å
235	K	72.9	Confident	83.3	Confident	111 Å²	111	36 Å²	36	48%	0.483	19%	0.194	S	C	.	.	S	Bend	trans	-57.6	-25.4	171.3	-67	179.6	179.5	171.6	0	113.3	D282 C284	K235-D282 PolarHBondContact NZ-O 3.23Å; K235-D282 IonicContact NZ-OD1 3.49Å; K235-D282 PolarHBondContact NZ-OD1 3.47Å; K235-C284 HydrophobicContact CG-CB 4.18Å
236	T	73	Confident	82.6	Confident	67 Å²	67	38 Å²	38	41%	0.411	20%	0.199	S	C	.	.	S	Bend	trans	-118.2	-28.2	-169.6	57.9	0	0	0	0	114.6	S234 L255	S234-T236 PolarHBondContact O-N 2.89Å; S234-T236 VanDerWaalsContact O-N 3.14Å; S234-T236 PolarHBondContact OG-N 3.1Å; T236-L255 VanDerWaalsContact O-CB 3.29Å; T236-L255 WeakPolarHBondContact O-CB 3.29Å; T236-L255 PolarHBondContact O-N 3.28Å
237	H	82.7	Confident	82.3	Confident	21 Å²	21	36.8 Å²	36.8	10%	0.097	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	165.1	-178.8	-57.5	79.3	0	0	0	111.6	D214 S234 L253 K254	D214-H237 VanDerWaalsContact O-CB 3.24Å; D214-H237 WeakPolarHBondContact O-CB 3.48Å; D214-H237 VanDerWaalsContact O-CG 3.31Å; D214-H237 PolarHBondContact O-ND1 2.84Å; S234-H237 PolarHBondContact N-O 2.85Å; S234-H237 PolarHBondContact OG-N 3.05Å; S234-H237 PolarHBondContact OG-O 2.99Å; S234-H237 VanDerWaalsContact OG-O 3.1Å; H237-L253 CarbonylContact C-O 3.56Å; H237-L253 WeakPolarHBondContact CA-O 2.86Å; H237-L253 WeakPolarHBondContact CB-O 3.37Å; H237-K254 WeakPolarHBondContact CD2-CA 3.4Å; H237-K254 WeakPolarHBondContact NE2-CG 3.39Å
238	I	83.2	Confident	82.4	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.9	167	-60.7	175.5	0	0	0	106.2	L231 S232 L253 L255 K299 W308	L231-I238 HydrophobicContact CD1-CG2 3.38Å; L231-I238 HydrophobicContact CG-CG2 4.37Å; S232-I238 WeakPolarHBondContact O-CA 3.47Å; S232-I238 WeakPolarHBondContact O-CG2 3.42Å; I238-L253 HydrophobicContact CB-CB 4.32Å; I238-L253 PolarHBondContact N-O 3.3Å; I238-L253 WeakPolarHBondContact O-CB 3.5Å; I238-L253 PolarHBondContact O-N 3.42Å; I238-L255 HydrophobicContact CD1-CD2 4.29Å; I238-K299 HydrophobicContact CD1-CB 3.92Å; I238-K299 HydrophobicContact CD1-CD 3.47Å; I238-K299 VanDerWaalsContact CD1-CD 3.47Å; I238-K299 HydrophobicContact CD1-CG 4.33Å; I238-K299 HydrophobicContact CG1-CD 3.73Å; I238-W308 HydrophobicContact CD1-CE3 4.08Å; I238-W308 HydrophobicContact CD1-CH2 3.49Å; I238-W308 VanDerWaalsContact CD1-CH2 3.49Å; I238-W308 HydrophobicContact CD1-CZ2 4.06Å; I238-W308 HydrophobicContact CD1-CZ3 3.51Å
239	L	86.5	Confident	82.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	131	175.6	-50.7	-177	0	0	0	109.8	L210 D214 Q217 L231 S232 Y241 Y250 F251 A252	L210-L239 HydrophobicContact CD1-CD1 3.98Å; L210-L239 HydrophobicContact CD2-CD1 3.9Å; L210-L239 HydrophobicContact CG-CD1 4.47Å; D214-L239 HydrophobicContact CB-CD2 4.12Å; Q217-L239 HydrophobicContact CG-CD1 3.81Å; Q217-L239 HydrophobicContact CG-CG 4.38Å; L231-L239 WeakPolarHBondContact CA-O 3.34Å; S232-L239 PolarHBondContact N-O 2.84Å; S232-L239 PolarHBondContact O-N 2.91Å; S232-L239 WeakPolarHBondContact OG-CB 3.29Å; L239-Y241 HydrophobicContact CB-CE2 3.77Å; L239-Y241 VanDerWaalsContact CD1-OH 3.27Å; L239-Y241 WeakPolarHBondContact CD1-OH 3.28Å; L239-Y250 HydrophobicContact CD1-CD2 4.41Å; L239-Y250 HydrophobicContact CD2-CD2 4.45Å; L239-F251 VanDerWaalsContact CA-O 3.32Å; L239-F251 WeakPolarHBondContact CA-O 3.27Å; L239-A252 HydrophobicContact CD2-CB 3.31Å
240	I	86.3	Confident	82.1	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127	171.7	-58.5	173.3	0	0	0	107.2	L230 L231 Y250 F251 L253 V297 I310 F322	L230-I240 WeakPolarHBondContact O-CA 3.33Å; L231-I240 HydrophobicContact CD1-CG1 3.82Å; I240-Y250 CarbonylContact O-C 3.57Å; I240-Y250 WeakPolarHBondContact O-CA 3.42Å; I240-F251 PolarHBondContact N-O 3.23Å; I240-F251 PolarHBondContact O-N 3.03Å; I240-L253 HydrophobicContact CD1-CD1 3.64Å; I240-L253 HydrophobicContact CG1-CD1 4.11Å; I240-V297 HydrophobicContact CD1-CG2 4.03Å; I240-I310 HydrophobicContact CD1-CD1 4.14Å; I240-I310 HydrophobicContact CD1-CG1 4.08Å; I240-F322 HydrophobicContact CD1-CZ 4.26Å
241	Y	87.1	Confident	81.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.8	178.6	-45.1	-106	0	0	0	110.4	V192 V208 L210 Q229 L230 S232 L239 L248 K249 Y250	V192-Y241 HydrophobicContact CB-CE1 4.39Å; V192-Y241 HydrophobicContact CG2-CE1 3.95Å; V208-Y241 HydrophobicContact CG1-CD1 4.38Å; V208-Y241 HydrophobicContact CG1-CE1 4.25Å; L210-Y241 HydrophobicContact CD2-CE1 3.79Å; Q229-Y241 WeakPolarHBondContact CA-O 3.32Å; L230-Y241 HydrophobicContact CB-CD2 3.77Å; L230-Y241 HydrophobicContact CB-CG 4.17Å; L230-Y241 PolarHBondContact N-O 2.89Å; L230-Y241 PolarHBondContact O-N 3.27Å; S232-Y241 VanDerWaalsContact OG-CE2 3.29Å; S232-Y241 WeakPolarHBondContact OG-CE2 3.32Å; S232-Y241 PolarHBondContact OG-OH 2.82Å; L239-Y241 HydrophobicContact CB-CE2 3.77Å; L239-Y241 VanDerWaalsContact CD1-OH 3.27Å; L239-Y241 WeakPolarHBondContact CD1-OH 3.28Å; Y241-L248 HydrophobicContact CD1-CD1 4.2Å; Y241-L248 HydrophobicContact CD1-CG 4.38Å; Y241-L248 HydrophobicContact CG-CD1 4.42Å; Y241-K249 WeakPolarHBondContact CA-O 3.41Å; Y241-Y250 HydrophobicContact CD1-CG 4.4Å; Y241-Y250 HydrophobicContact CE1-CG 4.17Å
242	K	86.4	Confident	81.2	Confident	62 Å²	62	45.7 Å²	45.7	27%	0.27	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	129.5	165.8	-174.7	172	179.5	173.1	0	108.3	T228 K249 I315	T228-K242 WeakPolarHBondContact O-CA 3.36Å; K242-K249 PolarHBondContact N-O 2.88Å; K242-K249 PolarHBondContact O-N 3.48Å; K242-I315 HydrophobicContact CD-CD1 4.03Å; K242-I315 HydrophobicContact CD-CG1 4.36Å
243	W	85.8	Confident	80.6	Confident	26 Å²	26	46.9 Å²	46.9	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.6	-179.8	73.2	-87	0	0	0	111.4	Y179 I194 L205 S227 T228 L248	Y179-W243 AromaticContact CD1-CH2 3.91Å; Y179-W243 HydrophobicContact CD1-CH2 3.91Å; Y179-W243 HydrophobicContact CD1-CZ2 4.23Å; Y179-W243 AromaticContact CD2-CH2 3.99Å; Y179-W243 HydrophobicContact CD2-CH2 3.99Å; Y179-W243 AromaticContact CD2-CZ2 3.71Å; Y179-W243 HydrophobicContact CD2-CZ2 3.71Å; Y179-W243 AromaticContact CE1-CH2 3.73Å; Y179-W243 HydrophobicContact CE1-CH2 3.73Å; Y179-W243 HydrophobicContact CE1-CZ2 4.4Å; Y179-W243 AromaticContact CE2-CH2 3.78Å; Y179-W243 HydrophobicContact CE2-CH2 3.78Å; Y179-W243 AromaticContact CE2-CZ2 3.87Å; Y179-W243 HydrophobicContact CE2-CZ2 3.87Å; Y179-W243 HydrophobicContact CG-CH2 4.03Å; Y179-W243 AromaticContact CG-CZ2 3.89Å; Y179-W243 HydrophobicContact CG-CZ2 3.89Å; Y179-W243 AromaticContact CZ-CH2 3.65Å; I194-W243 HydrophobicContact CD1-CB 3.8Å; I194-W243 HydrophobicContact CD1-CD2 3.64Å; I194-W243 HydrophobicContact CD1-CE3 4.41Å; I194-W243 HydrophobicContact CD1-CG 3.31Å; I194-W243 HydrophobicContact CG2-CZ2 4.39Å; L205-W243 HydrophobicContact CD1-CH2 4.31Å; L205-W243 HydrophobicContact CD1-CZ3 4.24Å; S227-W243 PolarHBondContact O-NE1 3.01Å; T228-W243 VanDerWaalsContact C-CD1 3.44Å; T228-W243 WeakPolarHBondContact CB-O 3.15Å; T228-W243 PolarHBondContact O-N 2.88Å; W243-L248 HydrophobicContact CB-CB 4.42Å; W243-L248 HydrophobicContact CB-CD1 3.59Å; W243-L248 HydrophobicContact CG-CD1 4.47Å
244	D	81.7	Confident	80.1	Confident	56 Å²	56	54.7 Å²	54.7	30%	0.299	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	-168.5	178	59.1	25.3	0	0	0	109.4	E246 G247	D244-E246 PolarHBondContact O-N 2.88Å; D244-E246 WeakPolarHBondContact OD1-CA 3.26Å; D244-E246 VanDerWaalsContact OD1-CB 3.26Å; D244-E246 WeakPolarHBondContact OD1-CB 3.45Å; D244-E246 PolarHBondContact OD1-N 2.86Å; D244-G247 PolarHBondContact N-O 3.32Å; D244-G247 PolarHBondContact O-N 2.99Å; D244-G247 PolarHBondContact OD1-N 2.89Å; D244-G247 VanDerWaalsContact OD1-N 3.14Å
245	T	69.6	Low	79.3	Confident	151 Å²	151	55.6 Å²	55.6	93%	0.926	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.3	176.5	51.1	0	0	0	0	113.7
246	E	67.3	Low	78.6	Confident	156 Å²	156	59 Å²	59	73%	0.729	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-17.3	179	-54.7	-175.2	162.6	0	0	112.4	D244 K249	D244-E246 PolarHBondContact O-N 2.88Å; D244-E246 WeakPolarHBondContact OD1-CA 3.26Å; D244-E246 VanDerWaalsContact OD1-CB 3.26Å; D244-E246 WeakPolarHBondContact OD1-CB 3.45Å; D244-E246 PolarHBondContact OD1-N 2.86Å; E246-K249 IonicContact OE2-NZ 3.66Å; E246-K249 PolarHBondContact OE2-NZ 2.76Å; E246-K249 VanDerWaalsContact OE2-NZ 3.11Å
247	G	77.8	Confident	77.3	Confident	22 Å²	22	65.5 Å²	65.5	23%	0.227	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	138.7	-170.9	174.5	0	0	0	0	0	113.5	D244	D244-G247 PolarHBondContact N-O 3.32Å; D244-G247 PolarHBondContact O-N 2.99Å; D244-G247 PolarHBondContact OD1-N 2.89Å; D244-G247 VanDerWaalsContact OD1-N 3.14Å
248	L	85.6	Confident	75.2	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.068	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.4	-179.7	178.7	64.2	0	0	0	109.9	V192 I194 C206 V208 L230 Y241 W243	V192-L248 HydrophobicContact CB-CD2 4.06Å; V192-L248 HydrophobicContact CG1-CD2 3.9Å; I194-L248 HydrophobicContact CD1-CD1 3.98Å; I194-L248 HydrophobicContact CG1-CD2 4.49Å; C206-L248 HydrophobicContact CB-CB 4.11Å; V208-L248 HydrophobicContact CB-CB 4.11Å; V208-L248 HydrophobicContact CB-CD2 3.83Å; V208-L248 HydrophobicContact CB-CG 3.93Å; V208-L248 HydrophobicContact CG1-CB 4.45Å; V208-L248 HydrophobicContact CG1-CD2 3.42Å; V208-L248 VanDerWaalsContact CG1-CD2 3.42Å; V208-L248 HydrophobicContact CG1-CG 3.72Å; V208-L248 WeakPolarHBondContact CG2-O 3.37Å; L230-L248 HydrophobicContact CD1-CD1 4.47Å; Y241-L248 HydrophobicContact CD1-CD1 4.2Å; Y241-L248 HydrophobicContact CD1-CG 4.38Å; Y241-L248 HydrophobicContact CG-CD1 4.42Å; W243-L248 HydrophobicContact CB-CB 4.42Å; W243-L248 HydrophobicContact CB-CD1 3.59Å; W243-L248 HydrophobicContact CG-CD1 4.47Å
249	K	84.4	Confident	72.6	Confident	95 Å²	95	74 Å²	74	41%	0.413	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	141.1	177.7	-65.8	168.9	-173.9	153.7	0	109.5	Y241 K242 E246	Y241-K249 WeakPolarHBondContact CA-O 3.41Å; K242-K249 PolarHBondContact N-O 2.88Å; K242-K249 PolarHBondContact O-N 3.48Å; E246-K249 IonicContact OE2-NZ 3.66Å; E246-K249 PolarHBondContact OE2-NZ 2.76Å; E246-K249 VanDerWaalsContact OE2-NZ 3.11Å
250	Y	82.9	Confident	69.9	Low	62 Å²	62	78.9 Å²	78.9	24%	0.243	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	155.8	179.8	73.4	-92.7	0	0	0	113.5	V208 E209 L210 N211 L239 I240 Y241	V208-Y250 HydrophobicContact CG1-CD1 4.03Å; V208-Y250 HydrophobicContact CG2-CD1 3.71Å; V208-Y250 HydrophobicContact CG2-CE1 3.81Å; E209-Y250 WeakPolarHBondContact O-CE1 3.22Å; L210-Y250 HydrophobicContact CD2-CD1 4.08Å; L210-Y250 HydrophobicContact CD2-CD2 4.43Å; L210-Y250 HydrophobicContact CD2-CE1 4.05Å; L210-Y250 HydrophobicContact CD2-CE2 4.41Å; L210-Y250 HydrophobicContact CD2-CG 4.27Å; N211-Y250 PolarHBondContact N-OH 3.04Å; L239-Y250 HydrophobicContact CD1-CD2 4.41Å; L239-Y250 HydrophobicContact CD2-CD2 4.45Å; I240-Y250 CarbonylContact O-C 3.57Å; I240-Y250 WeakPolarHBondContact O-CA 3.42Å; Y241-Y250 HydrophobicContact CD1-CG 4.4Å; Y241-Y250 HydrophobicContact CE1-CG 4.17Å
251	F	80.6	Confident	67.2	Low	64 Å²	64	84.1 Å²	84.1	28%	0.281	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.6	178.4	-62.3	-82.5	0	0	0	110.6	L239 I240 L314	L239-F251 VanDerWaalsContact CA-O 3.32Å; L239-F251 WeakPolarHBondContact CA-O 3.27Å; I240-F251 PolarHBondContact N-O 3.23Å; I240-F251 PolarHBondContact O-N 3.03Å; F251-L314 HydrophobicContact CD2-CD2 4.23Å; F251-L314 HydrophobicContact CE2-CB 4.41Å; F251-L314 HydrophobicContact CE2-CD2 4.48Å; F251-L314 WeakPolarHBondContact CE2-O 3.47Å; F251-L314 WeakPolarHBondContact CZ-O 3.35Å
252	A	78	Confident	64.5	Low	47 Å²	47	89.3 Å²	89.3	39%	0.388	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	129.8	-178.6	0	0	0	0	0	113.5	D214 L239	D214-A252 HydrophobicContact CB-CB 4.23Å; L239-A252 HydrophobicContact CD2-CB 3.31Å
253	L	74.9	Confident	61.8	Low	26 Å²	26	92.8 Å²	92.8	14%	0.136	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.2	176.9	-74.7	148.1	0	0	0	110	H237 I238 I240 F322	H237-L253 CarbonylContact C-O 3.56Å; H237-L253 WeakPolarHBondContact CA-O 2.86Å; H237-L253 WeakPolarHBondContact CB-O 3.37Å; I238-L253 HydrophobicContact CB-CB 4.32Å; I238-L253 PolarHBondContact N-O 3.3Å; I238-L253 WeakPolarHBondContact O-CB 3.5Å; I238-L253 PolarHBondContact O-N 3.42Å; I240-L253 HydrophobicContact CD1-CD1 3.64Å; I240-L253 HydrophobicContact CG1-CD1 4.11Å; L253-F322 HydrophobicContact CD1-CZ 4.23Å; L253-F322 HydrophobicContact CD2-CD2 4.11Å; L253-F322 HydrophobicContact CD2-CE2 4.04Å; L253-F322 HydrophobicContact CD2-CZ 4.35Å
254	K	72.4	Confident	59.3	Low	165 Å²	165	96.6 Å²	96.6	72%	0.717	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.8	179	-172.1	168.2	-175.8	171.3	0	112.2	H237 K256	H237-K254 WeakPolarHBondContact CD2-CA 3.4Å; H237-K254 WeakPolarHBondContact NE2-CG 3.39Å; K254-K256 PolarHBondContact O-N 3.31Å
255	L	65.8	Low	56.9	Low	22 Å²	22	100.4 Å²	100.4	12%	0.115	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-75.6	122.7	172.5	-65.3	158.9	0	0	0	109	T236 I238 K257 K299 I301 W308	T236-L255 VanDerWaalsContact O-CB 3.29Å; T236-L255 WeakPolarHBondContact O-CB 3.29Å; T236-L255 PolarHBondContact O-N 3.28Å; I238-L255 HydrophobicContact CD1-CD2 4.29Å; L255-K257 PolarHBondContact O-N 3.27Å; L255-K299 HydrophobicContact CD1-CD 4.12Å; L255-K299 HydrophobicContact CD2-CD 4.25Å; L255-I301 HydrophobicContact CD2-CD1 3.82Å; L255-W308 HydrophobicContact CD2-CH2 3.59Å; L255-W308 HydrophobicContact CD2-CZ2 3.53Å
256	K	58.5	Low	55.3	Low	183 Å²	183	98.3 Å²	98.3	80%	0.796	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-68.3	125.4	166	-74.1	-176.4	178.2	178.9	0	107.3	K254 V258	K254-K256 PolarHBondContact O-N 3.31Å; K256-V258 PolarHBondContact O-N 2.9Å
257	K	45.1	Very low	53.4	Low	203 Å²	203	95.8 Å²	95.8	88%	0.883	54%	0.536	S	S	*	.			trans	-57.3	103.7	171.3	-76.4	-174.7	176.2	-175.5	0	108.2	L255 T259	L255-K257 PolarHBondContact O-N 3.27Å; K257-T259 PolarHBondContact O-N 2.88Å
258	V	38.6	Very low	51.1	Low	84 Å²	84	98.3 Å²	98.3	51%	0.509	55%	0.554	S	S	.	*			trans	-79.1	104.6	161.3	-179.4	0	0	0	0	104.4	K256 P260	K256-V258 PolarHBondContact O-N 2.9Å; V258-P260 WeakPolarHBondContact O-CD 3Å
259	T	29.4	Very low	48.5	Very low	117 Å²	117	105.8 Å²	105.8	72%	0.718	59%	0.589	S	S	*	*			trans	-59.3	123.7	167	42	0	0	0	0	107.4	K257 A261	K257-T259 PolarHBondContact O-N 2.88Å; T259-A261 PolarHBondContact O-N 3.12Å
260	P	30.5	Very low	46	Very low	102 Å²	102	108.9 Å²	108.9	66%	0.662	61%	0.609	S	S	*	*			trans	-58.3	125.5	169.8	22.8	-28.5	0	0	0	107.5	V258 T262	V258-P260 WeakPolarHBondContact O-CD 3Å; P260-T262 PolarHBondContact O-N 3.27Å
261	A	28.5	Very low	43.6	Very low	110 Å²	110	111.3 Å²	111.3	91%	0.909	63%	0.63	S	S	*	*			trans	-71.6	87.1	166	0	0	0	0	0	106.8	T259	T259-A261 PolarHBondContact O-N 3.12Å
262	T	31	Very low	41.2	Very low	110 Å²	110	114.4 Å²	114.4	68%	0.675	65%	0.654	S	S	*	*			trans	-125	123.2	169.3	38.3	0	0	0	0	107.5	P260	P260-T262 PolarHBondContact O-N 3.27Å
263	D	29.1	Very low	38.9	Very low	134 Å²	134	117 Å²	117	72%	0.717	66%	0.662	S	S	*	*			trans	-48.2	141.9	176	-72.9	-47.6	0	0	0	111.7	D265	D263-D265 PolarHBondContact O-N 3.28Å
264	P	34	Very low	36.8	Very low	107 Å²	107	122.1 Å²	122.1	70%	0.695	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-0.9	-174.6	22	-30.7	0	0	0	115.9
265	D	30.6	Very low	34.9	Very low	135 Å²	135	119.2 Å²	119.2	72%	0.722	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-12.1	-172.9	-73.5	-21.7	0	0	0	115.2	D263	D263-D265 PolarHBondContact O-N 3.28Å
266	V	35.5	Very low	33.3	Very low	108 Å²	108	124.9 Å²	124.9	66%	0.655	72%	0.721	S	S	*	*	S	Bend	trans	-91.4	-16.1	-176.9	-174.4	0	0	0	0	113	A268	V266-A268 VanDerWaalsContact C-N 3.26Å; V266-A268 PolarHBondContact O-N 2.93Å
267	S	27.8	Very low	31.8	Very low	103 Å²	103	120 Å²	120	72%	0.72	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-9.8	178.2	63.6	0	0	0	0	114.2
268	A	29.2	Very low	31.1	Very low	74 Å²	74	115.7 Å²	115.7	61%	0.612	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-3.8	-174.3	0	0	0	0	0	115.3	V266	V266-A268 VanDerWaalsContact C-N 3.26Å; V266-A268 PolarHBondContact O-N 2.93Å
269	Q	31.2	Very low	30.8	Very low	170 Å²	170	115.7 Å²	115.7	79%	0.794	70%	0.697	S	S	*	*	S	Bend	trans	-110.6	2.8	-174	-69.3	-170.5	-6.1	0	0	115.7
270	L	32.1	Very low	31.1	Very low	161 Å²	161	116.6 Å²	116.6	84%	0.843	69%	0.691	S	S	*	*	S	Bend	trans	-110.8	19.7	-179.1	-78.8	163.3	0	0	0	114.7
271	T	32.2	Very low	31	Very low	113 Å²	113	116.5 Å²	116.5	69%	0.693	70%	0.699	S	S	*	*			trans	-113.5	78.1	175.6	58.6	0	0	0	0	112.1
272	T	30.4	Very low	31.2	Very low	128 Å²	128	116.1 Å²	116.1	79%	0.785	68%	0.682	S	S	*	*	S	Bend	trans	-142.8	70.7	158.4	46.5	0	0	0	0	110.1
273	D	29.3	Very low	31.7	Very low	103 Å²	103	114.4 Å²	114.4	55%	0.551	67%	0.668	S	S	*	*			trans	162.8	107.2	143.8	-90.1	-17.2	0	0	0	111	S275	D273-S275 PolarHBondContact O-N 2.84Å; D273-S275 VanDerWaalsContact O-N 3.11Å
274	P	31.8	Very low	32.4	Very low	132 Å²	132	112 Å²	112	86%	0.857	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	8.9	178.5	29.1	-31.9	0	0	0	114.2
275	S	32.4	Very low	33.3	Very low	104 Å²	104	109.5 Å²	109.5	73%	0.727	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-0.4	-178.6	64.1	0	0	0	0	114.2	D273	D273-S275 PolarHBondContact O-N 2.84Å; D273-S275 VanDerWaalsContact O-N 3.11Å
276	K	31.5	Very low	34.7	Very low	142 Å²	142	103.7 Å²	103.7	62%	0.617	61%	0.611	S	S	*	*	S	Bend	trans	-126.5	0.6	179.6	-81.5	-174.2	171.3	-173.6	0	114.7	K476	K276-K476 VanDerWaalsContact CE-NZ 3.28Å
277	S	27.3	Very low	36.6	Very low	81 Å²	81	102.2 Å²	102.2	57%	0.566	59%	0.594	S	S	*	*			trans	-95.5	102.7	175.9	48.4	0	0	0	0	110.3
278	I	31.7	Very low	39.2	Very low	111 Å²	111	97.3 Å²	97.3	57%	0.569	56%	0.56	S	S	*	*			trans	-54.9	128.9	142.4	-58.5	169	0	0	0	104.3	F280	I278-F280 VanDerWaalsContact C-N 3.3Å; I278-F280 PolarHBondContact O-N 2.96Å
279	P	30.8	Very low	41.8	Very low	84 Å²	84	94.6 Å²	94.6	55%	0.545	54%	0.535	S	S	.	.			trans	-63.6	95	-176.2	23.3	-30.1	0	0	0	109.3	A281 D282	P279-A281 PolarHBondContact O-N 2.95Å; P279-D282 PolarHBondContact O-N 2.85Å; P279-D282 VanDerWaalsContact O-N 3.17Å
280	F	35.3	Very low	44.4	Very low	137 Å²	137	86.8 Å²	86.8	60%	0.601	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-11	176.3	-120.6	-91.3	0	0	0	112.3	I278 D282 P374	I278-F280 VanDerWaalsContact C-N 3.3Å; I278-F280 PolarHBondContact O-N 2.96Å; F280-D282 VanDerWaalsContact C-N 3.34Å; F280-P374 HydrophobicContact CZ-CG 3.98Å
281	A	28.6	Very low	46.9	Very low	100 Å²	100	79.2 Å²	79.2	83%	0.826	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.5	177.6	0	0	0	0	0	114.4	P279	P279-A281 PolarHBondContact O-N 2.95Å
282	D	32.9	Very low	49.2	Very low	102 Å²	102	75.2 Å²	75.2	55%	0.545	43%	0.431	S	S	.	.	S	Bend	trans	-105.6	-8.5	-173.9	-111	-21.9	0	0	0	116.1	K235 P279 F280 C284	K235-D282 PolarHBondContact NZ-O 3.23Å; K235-D282 IonicContact NZ-OD1 3.49Å; K235-D282 PolarHBondContact NZ-OD1 3.47Å; P279-D282 PolarHBondContact O-N 2.85Å; P279-D282 VanDerWaalsContact O-N 3.17Å; F280-D282 VanDerWaalsContact C-N 3.34Å; D282-C284 PolarHBondContact O-N 3.48Å; D282-C284 VanDerWaalsContact O-N 3.08Å
283	L	41.7	Very low	51.4	Low	73 Å²	73	75.4 Å²	75.4	38%	0.382	42%	0.421	S	S	.	.			trans	-85.2	69.7	177.4	-78.5	104.7	0	0	0	112.1	L285 I410	L283-L285 HydrophobicContact CB-CD1 4.26Å; L283-L285 HydrophobicContact CB-CG 3.99Å; L283-L285 HydrophobicContact CD2-CD1 3.3Å; L283-L285 HydrophobicContact CD2-CD2 3.99Å; L283-L285 HydrophobicContact CD2-CG 3.57Å; L283-L285 HydrophobicContact CG-CD1 4.33Å; L283-L285 HydrophobicContact CG-CG 4.2Å; L283-L285 PolarHBondContact O-N 3.06Å; L283-I410 HydrophobicContact CD2-CD1 4.4Å
284	C	44.7	Very low	53.7	Low	83 Å²	83	74.7 Å²	74.7	56%	0.561	41%	0.413	S	S	*	.			trans	-75.1	70.8	153.3	-92	0	0	0	0	108.8	K235 D282 S286	K235-C284 HydrophobicContact CG-CB 4.18Å; D282-C284 PolarHBondContact O-N 3.48Å; D282-C284 VanDerWaalsContact O-N 3.08Å; C284-S286 PolarHBondContact O-N 2.96Å
285	L	52.4	Low	55.7	Low	56 Å²	56	71.7 Å²	71.7	29%	0.293	39%	0.389	S	S	.	.			trans	-73	-5.1	-179.8	-77.5	172.3	0	0	0	114.2	L283 R287 T336 V376	L283-L285 HydrophobicContact CB-CD1 4.26Å; L283-L285 HydrophobicContact CB-CG 3.99Å; L283-L285 HydrophobicContact CD2-CD1 3.3Å; L283-L285 HydrophobicContact CD2-CD2 3.99Å; L283-L285 HydrophobicContact CD2-CG 3.57Å; L283-L285 HydrophobicContact CG-CD1 4.33Å; L283-L285 HydrophobicContact CG-CG 4.2Å; L283-L285 PolarHBondContact O-N 3.06Å; L285-R287 PolarHBondContact O-N 3.28Å; L285-T336 CarbonylContact C-O 3.52Å; L285-T336 VanDerWaalsContact CB-O 3.26Å; L285-T336 WeakPolarHBondContact CB-O 3.36Å; L285-T336 VanDerWaalsContact O-O 3.05Å; L285-V376 HydrophobicContact CD1-CG1 4.42Å; L285-V376 HydrophobicContact CD1-CG2 4.39Å
286	S	59.8	Low	58.1	Low	13 Å²	13	68.1 Å²	68.1	9%	0.091	36%	0.361	C	S	.	.			trans	-69.8	97.3	-171.7	52.4	0	0	0	0	112.3	C284 A300 T336	C284-S286 PolarHBondContact O-N 2.96Å; S286-A300 WeakPolarHBondContact CB-O 3.36Å; S286-A300 PolarHBondContact OG-O 2.92Å; S286-T336 PolarHBondContact N-O 2.88Å
287	R	74.6	Confident	60.6	Low	77 Å²	77	61.4 Å²	61.4	29%	0.291	33%	0.332	S	S	.	.			trans	-62.7	150	174.5	-67.9	-175.7	170.4	-172.3	0.3	111.3	L285 Y377	L285-R287 PolarHBondContact O-N 3.28Å; R287-Y377 VanDerWaalsContact NH1-CE2 3.27Å
288	S	83.3	Confident	63.4	Low	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.5	171.9	60	0	0	0	0	109.8	H219 L231 L298	H219-S288 PolarHBondContact CE1-N 3.18Å; H219-S288 PolarHBondContact NE2-N 2.8Å; H219-S288 VanDerWaalsContact NE2-N 3.18Å; H219-S288 PolarHBondContact NE2-OG 3.44Å; L231-S288 WeakPolarHBondContact CD2-O 3.43Å; L231-S288 WeakPolarHBondContact CD2-OG 3.27Å; S288-L298 CarbonylContact C-O 3.49Å; S288-L298 WeakPolarHBondContact CA-O 3.29Å
289	V	84.1	Confident	65.9	Low	16 Å²	16	52.8 Å²	52.8	10%	0.097	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.9	-174.5	-166.4	0	0	0	0	110.4	L298 L338 I340	V289-L298 PolarHBondContact N-O 3.37Å; V289-L298 PolarHBondContact O-N 3.05Å; V289-L338 HydrophobicContact CG2-CG 4.31Å; V289-L338 VanDerWaalsContact CG2-O 3.31Å; V289-L338 WeakPolarHBondContact CG2-O 3.22Å; V289-I340 HydrophobicContact CB-CD1 3.97Å; V289-I340 HydrophobicContact CB-CG1 4.36Å; V289-I340 HydrophobicContact CG1-CB 4.19Å; V289-I340 HydrophobicContact CG1-CD1 3.44Å; V289-I340 VanDerWaalsContact CG1-CD1 3.44Å; V289-I340 HydrophobicContact CG1-CG1 3.8Å
290	F	85.4	Confident	68.4	Low	6 Å²	6	48.8 Å²	48.8	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	135.3	170	-73.5	-75.1	0	0	0	111.4	N223 L231 V297 I310 I340	N223-F290 HydrophobicContact CB-CD2 3.88Å; N223-F290 HydrophobicContact CB-CE1 4.43Å; N223-F290 HydrophobicContact CB-CE2 3.76Å; N223-F290 HydrophobicContact CB-CG 4.24Å; N223-F290 HydrophobicContact CB-CZ 4.05Å; L231-F290 HydrophobicContact CB-CD2 4.12Å; L231-F290 HydrophobicContact CB-CE2 3.35Å; L231-F290 HydrophobicContact CB-CZ 3.61Å; L231-F290 HydrophobicContact CD2-CD2 4.26Å; L231-F290 HydrophobicContact CD2-CE2 4.24Å; L231-F290 HydrophobicContact CG-CE2 4.36Å; L231-F290 HydrophobicContact CG-CZ 4.46Å; F290-V297 HydrophobicContact CD1-CG2 4.15Å; F290-V297 HydrophobicContact CE1-CG2 4.14Å; F290-I310 HydrophobicContact CD1-CD1 4.3Å; F290-I310 HydrophobicContact CE1-CD1 3.99Å; F290-I340 WeakPolarHBondContact O-CD1 3.11Å
291	H	84.4	Confident	70.5	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.014	24%	0.238	C	C	.	.			trans	-62.7	139.3	169.4	-171.4	-43.3	0	0	0	110.6	K293 K294 Q296	H291-K293 PolarHBondContact ND1-N 2.91Å; H291-K293 PolarHBondContact O-N 3.33Å; H291-K294 HydrophobicContact CB-CB 4.46Å; H291-K294 PolarHBondContact ND1-N 2.77Å; H291-Q296 HydrophobicContact CB-CB 3.83Å; H291-Q296 PolarHBondContact CD2-OE1 3.31Å; H291-Q296 PolarHBondContact N-O 2.95Å
292	W	81.3	Confident	72.8	Confident	28 Å²	28	41.8 Å²	41.8	11%	0.106	22%	0.218	C	C	.	.	S	Bend	trans	-67.9	-29.3	-173.7	61.3	103.1	0	0	0	115.6	N225 I340 T343 I345 E359	N225-W292 PolarHBondContact ND2-O 3.02Å; W292-I340 HydrophobicContact CB-CG2 4.23Å; W292-I340 HydrophobicContact CD2-CG2 4.11Å; W292-I340 HydrophobicContact CE3-CD1 4.05Å; W292-I340 HydrophobicContact CE3-CG1 4.38Å; W292-I340 HydrophobicContact CE3-CG2 3.37Å; W292-I340 HydrophobicContact CG-CG2 4.49Å; W292-I340 HydrophobicContact CZ3-CD1 4.37Å; W292-I340 HydrophobicContact CZ3-CG1 4.47Å; W292-I340 HydrophobicContact CZ3-CG2 3.99Å; W292-T343 WeakPolarHBondContact CH2-O 3.48Å; W292-T343 WeakPolarHBondContact CZ2-O 3.46Å; W292-I345 HydrophobicContact CH2-CD1 4.37Å; W292-I345 HydrophobicContact CH2-CG1 3.79Å; W292-I345 HydrophobicContact CZ3-CD1 4.25Å; W292-I345 HydrophobicContact CZ3-CG1 3.51Å; W292-E359 HydrophobicContact CH2-CG 4.16Å; W292-E359 HydrophobicContact CZ2-CG 3.44Å; W292-E359 VanDerWaalsContact CZ2-CG 3.44Å
293	K	77.2	Confident	75.1	Confident	133 Å²	133	38.3 Å²	38.3	58%	0.578	20%	0.202	S	C	*	.	S	Bend	trans	-112.8	-44	176.3	-74.2	171.8	-171.2	167.5	0	114	H291 E359	H291-K293 PolarHBondContact ND1-N 2.91Å; H291-K293 PolarHBondContact O-N 3.33Å; K293-E359 IonicContact NZ-OE1 2.8Å; K293-E359 PolarHBondContact NZ-OE1 3.33Å
294	K	76.7	Confident	77.1	Confident	88 Å²	88	35.8 Å²	35.8	38%	0.383	19%	0.19	S	C	.	.	S	Bend	trans	-86.3	148.5	-175.1	-63.5	174.6	-173.6	159.6	0	109.2	H291 Q296	H291-K294 HydrophobicContact CB-CB 4.46Å; H291-K294 PolarHBondContact ND1-N 2.77Å; K294-Q296 HydrophobicContact CB-CB 4.28Å; K294-Q296 HydrophobicContact CB-CG 3.88Å; K294-Q296 PolarHBondContact O-N 2.84Å
295	L	74.6	Confident	79	Confident	68 Å²	68	31.8 Å²	31.8	36%	0.356	16%	0.163	S	C	.	.	S	Bend	trans	-72.8	68.5	168	-75.1	168.4	0	0	0	108.8	I310 K312	L295-I310 HydrophobicContact CB-CB 4.25Å; L295-I310 PolarHBondContact O-N 3.37Å; L295-K312 HydrophobicContact CD1-CG 3.92Å
296	Q	82.3	Confident	80.5	Confident	30 Å²	30	29.4 Å²	29.4	14%	0.14	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.5	-178.5	-71.4	176.8	-9	0	0	110.7	H291 K294 V307 W308 E309	H291-Q296 HydrophobicContact CB-CB 3.83Å; H291-Q296 PolarHBondContact CD2-OE1 3.31Å; H291-Q296 PolarHBondContact N-O 2.95Å; K294-Q296 HydrophobicContact CB-CB 4.28Å; K294-Q296 HydrophobicContact CB-CG 3.88Å; K294-Q296 PolarHBondContact O-N 2.84Å; Q296-V307 HydrophobicContact CB-CG1 4.22Å; Q296-V307 HydrophobicContact CG-CG1 4.25Å; Q296-W308 CarbonylContact C-O 3.6Å; Q296-W308 WeakPolarHBondContact CA-O 3.16Å; Q296-W308 WeakPolarHBondContact CB-O 3.27Å; Q296-E309 HydrophobicContact CG-CB 4.36Å; Q296-E309 HydrophobicContact CG-CG 4.4Å
297	V	84	Confident	81.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.3	169.4	-179.2	0	0	0	0	108.2	L231 I240 F290 V307 W308 I310	L231-V297 HydrophobicContact CD1-CG1 3.92Å; L231-V297 HydrophobicContact CD1-CG2 4.18Å; L231-V297 HydrophobicContact CD2-CG1 3.85Å; I240-V297 HydrophobicContact CD1-CG2 4.03Å; F290-V297 HydrophobicContact CD1-CG2 4.15Å; F290-V297 HydrophobicContact CE1-CG2 4.14Å; V297-V307 WeakPolarHBondContact O-CA 3.42Å; V297-W308 HydrophobicContact CB-CB 4.47Å; V297-W308 HydrophobicContact CB-CE3 4.28Å; V297-W308 HydrophobicContact CG1-CE3 4.28Å; V297-W308 PolarHBondContact N-O 2.78Å; V297-W308 PolarHBondContact O-N 2.9Å; V297-I310 HydrophobicContact CG2-CD1 3.53Å; V297-I310 HydrophobicContact CG2-CG1 4.02Å
298	L	86.4	Confident	82	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.7	176.3	-55.5	175.1	0	0	0	108.5	S288 V289 I305 V306 V307 L338 I340 I345 F361	S288-L298 CarbonylContact C-O 3.49Å; S288-L298 WeakPolarHBondContact CA-O 3.29Å; V289-L298 PolarHBondContact N-O 3.37Å; V289-L298 PolarHBondContact O-N 3.05Å; L298-I305 HydrophobicContact CB-CG2 4.22Å; L298-I305 HydrophobicContact CD2-CG2 4.26Å; L298-V306 WeakPolarHBondContact CA-O 3.31Å; L298-V307 HydrophobicContact CD2-CB 4.05Å; L298-V307 HydrophobicContact CD2-CG1 3.77Å; L298-V307 HydrophobicContact CD2-CG2 3.61Å; L298-L338 HydrophobicContact CB-CD2 3.97Å; L298-I340 HydrophobicContact CD1-CD1 4.03Å; L298-I345 HydrophobicContact CD1-CD1 3.81Å; L298-I345 HydrophobicContact CD1-CG1 4.13Å; L298-F361 HydrophobicContact CD2-CE1 4.39Å; L298-F361 HydrophobicContact CD2-CZ 3.96Å
299	K	84.6	Confident	81.7	Confident	11 Å²	11	30.8 Å²	30.8	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	132.5	169.1	-174.2	172	-177.8	157.4	0	109.6	S234 I238 L255 V306 W308	S234-K299 PolarHBondContact O-NZ 3.25Å; I238-K299 HydrophobicContact CD1-CB 3.92Å; I238-K299 HydrophobicContact CD1-CD 3.47Å; I238-K299 VanDerWaalsContact CD1-CD 3.47Å; I238-K299 HydrophobicContact CD1-CG 4.33Å; I238-K299 HydrophobicContact CG1-CD 3.73Å; L255-K299 HydrophobicContact CD1-CD 4.12Å; L255-K299 HydrophobicContact CD2-CD 4.25Å; K299-V306 PolarHBondContact N-O 2.72Å; K299-V306 PolarHBondContact O-N 2.91Å; K299-W308 HydrophobicContact CB-CH2 3.75Å; K299-W308 HydrophobicContact CB-CZ3 3.46Å; K299-W308 VanDerWaalsContact CB-CZ3 3.46Å
300	A	82.3	Confident	81	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	137.8	172.1	0	0	0	0	0	110.9	S286 S304 I305 I335 L338	S286-A300 WeakPolarHBondContact CB-O 3.36Å; S286-A300 PolarHBondContact OG-O 2.92Å; A300-S304 CarbonylContact C-O 3.5Å; A300-S304 WeakPolarHBondContact CA-O 3.49Å; A300-I305 HydrophobicContact CB-CG1 4.35Å; A300-I335 HydrophobicContact CB-CB 3.8Å; A300-I335 HydrophobicContact CB-CD1 3.87Å; A300-I335 HydrophobicContact CB-CG1 4.44Å; A300-I335 HydrophobicContact CB-CG2 3.63Å; A300-L338 HydrophobicContact CB-CB 4.42Å; A300-L338 HydrophobicContact CB-CD2 4.35Å
301	I	79.3	Confident	79.9	Confident	50 Å²	50	31.2 Å²	31.2	26%	0.256	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	103	175	-55.3	179.6	0	0	0	106.7	L255 S303 S304 V306	L255-I301 HydrophobicContact CD2-CD1 3.82Å; I301-S303 PolarHBondContact O-N 3.45Å; I301-S303 VanDerWaalsContact O-N 3.12Å; I301-S304 PolarHBondContact N-O 3.02Å; I301-S304 PolarHBondContact O-N 3.48Å; I301-S304 VanDerWaalsContact O-N 3.12Å; I301-V306 HydrophobicContact CD1-CB 4.43Å; I301-V306 HydrophobicContact CD1-CG2 3.52Å; I301-V306 HydrophobicContact CG1-CG2 4.13Å
302	G	77.3	Confident	78.6	Confident	39 Å²	39	40.1 Å²	40.1	40%	0.402	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	-117.4	-170.5	0	0	0	0	0	110	I335	G302-I335 WeakPolarHBondContact O-CB 3.18Å; G302-I335 PolarHBondContact O-N 3.25Å
303	S	80.6	Confident	77.1	Confident	30 Å²	30	43.8 Å²	43.8	21%	0.21	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	1.6	-176.7	52.7	0	0	0	0	115	I301 H329 Q331	I301-S303 PolarHBondContact O-N 3.45Å; I301-S303 VanDerWaalsContact O-N 3.12Å; S303-H329 PolarHBondContact OG-CE1 3.14Å; S303-H329 VanDerWaalsContact OG-CE1 3.24Å; S303-Q331 VanDerWaalsContact CB-O 3.25Å; S303-Q331 WeakPolarHBondContact CB-O 3.42Å
304	S	83.3	Confident	76	Confident	19 Å²	19	38.6 Å²	38.6	13%	0.133	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.1	-176.9	-50.6	0	0	0	0	111.4	A300 I301 V328 H329	A300-S304 CarbonylContact C-O 3.5Å; A300-S304 WeakPolarHBondContact CA-O 3.49Å; I301-S304 PolarHBondContact N-O 3.02Å; I301-S304 PolarHBondContact O-N 3.48Å; I301-S304 VanDerWaalsContact O-N 3.12Å; S304-V328 CarbonylContact C-O 3.56Å; S304-V328 WeakPolarHBondContact CA-O 3.47Å; S304-V328 WeakPolarHBondContact CB-O 3.42Å; S304-H329 PolarHBondContact OG-ND1 3.38Å; S304-H329 VanDerWaalsContact OG-ND1 3.13Å
305	I	84.4	Confident	74.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.9	170.8	-60.8	-175.5	0	0	0	108.7	L298 A300 V307 V328 I330 I335 L338 I345 T347 F361	L298-I305 HydrophobicContact CB-CG2 4.22Å; L298-I305 HydrophobicContact CD2-CG2 4.26Å; A300-I305 HydrophobicContact CB-CG1 4.35Å; I305-V307 HydrophobicContact CG2-CG2 4.44Å; I305-V328 PolarHBondContact N-O 3.46Å; I305-V328 PolarHBondContact O-N 3.32Å; I305-I330 HydrophobicContact CB-CD1 3.92Å; I305-I330 HydrophobicContact CD1-CD1 3.41Å; I305-I330 VanDerWaalsContact CD1-CD1 3.41Å; I305-I330 HydrophobicContact CG1-CD1 3.62Å; I305-I335 HydrophobicContact CD1-CD1 4.35Å; I305-I335 HydrophobicContact CG1-CD1 3.85Å; I305-L338 HydrophobicContact CD1-CD1 3.77Å; I305-I345 HydrophobicContact CD1-CG2 4.23Å; I305-T347 HydrophobicContact CD1-CG2 4.09Å; I305-F361 HydrophobicContact CB-CE1 4.49Å; I305-F361 HydrophobicContact CD1-CE1 4.36Å; I305-F361 HydrophobicContact CG2-CE1 4.16Å
306	V	83.9	Confident	73.1	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.6	170.4	-174.1	0	0	0	0	108.8	L298 K299 I301 W308 I325 T327	L298-V306 WeakPolarHBondContact CA-O 3.31Å; K299-V306 PolarHBondContact N-O 2.72Å; K299-V306 PolarHBondContact O-N 2.91Å; I301-V306 HydrophobicContact CD1-CB 4.43Å; I301-V306 HydrophobicContact CD1-CG2 3.52Å; I301-V306 HydrophobicContact CG1-CG2 4.13Å; V306-W308 HydrophobicContact CB-CE3 4.43Å; V306-W308 HydrophobicContact CB-CH2 3.39Å; V306-W308 HydrophobicContact CB-CZ2 3.78Å; V306-W308 HydrophobicContact CB-CZ3 3.76Å; V306-W308 HydrophobicContact CG1-CD2 4Å; V306-W308 HydrophobicContact CG1-CE3 4.14Å; V306-W308 HydrophobicContact CG1-CH2 3.42Å; V306-W308 VanDerWaalsContact CG1-CH2 3.42Å; V306-W308 HydrophobicContact CG1-CZ2 3.24Å; V306-W308 HydrophobicContact CG1-CZ3 3.87Å; V306-W308 HydrophobicContact CG2-CH2 4.37Å; V306-W308 WeakPolarHBondContact O-CZ3 3.4Å; V306-I325 HydrophobicContact CG1-CG2 3.68Å; V306-T327 HydrophobicContact CG2-CG2 4.13Å
307	V	84.2	Confident	70.9	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.048	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.7	-179.6	-171.2	0	0	0	0	108.5	Q296 V297 L298 I305 Q326 F361	Q296-V307 HydrophobicContact CB-CG1 4.22Å; Q296-V307 HydrophobicContact CG-CG1 4.25Å; V297-V307 WeakPolarHBondContact O-CA 3.42Å; L298-V307 HydrophobicContact CD2-CB 4.05Å; L298-V307 HydrophobicContact CD2-CG1 3.77Å; L298-V307 HydrophobicContact CD2-CG2 3.61Å; I305-V307 HydrophobicContact CG2-CG2 4.44Å; V307-Q326 PolarHBondContact N-O 3.29Å; V307-Q326 PolarHBondContact O-N 2.94Å; V307-F361 HydrophobicContact CG2-CE1 4.35Å; V307-F361 HydrophobicContact CG2-CE2 3.93Å; V307-F361 HydrophobicContact CG2-CZ 3.44Å; V307-F361 VanDerWaalsContact CG2-CZ 3.44Å
308	W	81.9	Confident	68.9	Low	15 Å²	15	59.7 Å²	59.7	6%	0.057	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.7	173.4	-64.5	-93.3	0	0	0	110.2	I238 L255 Q296 V297 K299 V306	I238-W308 HydrophobicContact CD1-CE3 4.08Å; I238-W308 HydrophobicContact CD1-CH2 3.49Å; I238-W308 VanDerWaalsContact CD1-CH2 3.49Å; I238-W308 HydrophobicContact CD1-CZ2 4.06Å; I238-W308 HydrophobicContact CD1-CZ3 3.51Å; L255-W308 HydrophobicContact CD2-CH2 3.59Å; L255-W308 HydrophobicContact CD2-CZ2 3.53Å; Q296-W308 CarbonylContact C-O 3.6Å; Q296-W308 WeakPolarHBondContact CA-O 3.16Å; Q296-W308 WeakPolarHBondContact CB-O 3.27Å; V297-W308 HydrophobicContact CB-CB 4.47Å; V297-W308 HydrophobicContact CB-CE3 4.28Å; V297-W308 HydrophobicContact CG1-CE3 4.28Å; V297-W308 PolarHBondContact N-O 2.78Å; V297-W308 PolarHBondContact O-N 2.9Å; K299-W308 HydrophobicContact CB-CH2 3.75Å; K299-W308 HydrophobicContact CB-CZ3 3.46Å; K299-W308 VanDerWaalsContact CB-CZ3 3.46Å; V306-W308 HydrophobicContact CB-CE3 4.43Å; V306-W308 HydrophobicContact CB-CH2 3.39Å; V306-W308 HydrophobicContact CB-CZ2 3.78Å; V306-W308 HydrophobicContact CB-CZ3 3.76Å; V306-W308 HydrophobicContact CG1-CD2 4Å; V306-W308 HydrophobicContact CG1-CE3 4.14Å; V306-W308 HydrophobicContact CG1-CH2 3.42Å; V306-W308 VanDerWaalsContact CG1-CH2 3.42Å; V306-W308 HydrophobicContact CG1-CZ2 3.24Å; V306-W308 HydrophobicContact CG1-CZ3 3.87Å; V306-W308 HydrophobicContact CG2-CH2 4.37Å; V306-W308 WeakPolarHBondContact O-CZ3 3.4Å
309	E	77.3	Confident	66.8	Low	95 Å²	95	64.9 Å²	64.9	44%	0.444	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	112.1	175.1	-170.4	175.8	-157.7	0	0	111.2	Q296 G311 F322 G323	Q296-E309 HydrophobicContact CG-CB 4.36Å; Q296-E309 HydrophobicContact CG-CG 4.4Å; E309-G311 PolarHBondContact O-N 3.13Å; E309-F322 WeakPolarHBondContact O-CD1 3.5Å; E309-G323 PolarHBondContact O-N 3.3Å
310	I	70.6	Confident	64.7	Low	7 Å²	7	72.3 Å²	72.3	4%	0.036	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.6	-179.8	-53.6	160	0	0	0	109.4	I240 F290 L295 V297 L314 F322	I240-I310 HydrophobicContact CD1-CD1 4.14Å; I240-I310 HydrophobicContact CD1-CG1 4.08Å; F290-I310 HydrophobicContact CD1-CD1 4.3Å; F290-I310 HydrophobicContact CE1-CD1 3.99Å; L295-I310 HydrophobicContact CB-CB 4.25Å; L295-I310 PolarHBondContact O-N 3.37Å; V297-I310 HydrophobicContact CG2-CD1 3.53Å; V297-I310 HydrophobicContact CG2-CG1 4.02Å; I310-L314 HydrophobicContact CG2-CD1 3.88Å; I310-L314 HydrophobicContact CG2-CD2 4.23Å; I310-L314 HydrophobicContact CG2-CG 4.14Å; I310-F322 HydrophobicContact CB-CE1 4.06Å; I310-F322 HydrophobicContact CG1-CE1 3.95Å; I310-F322 HydrophobicContact CG2-CE1 4.1Å; I310-F322 HydrophobicContact CG2-CZ 4.46Å
311	G	62.1	Low	62.6	Low	25 Å²	25	75 Å²	75	26%	0.258	39%	0.394	S	S	.	.			trans	-66.7	143.4	172.4	0	0	0	0	0	111.5	E309 N313	E309-G311 PolarHBondContact O-N 3.13Å; G311-N313 PolarHBondContact O-N 3.24Å
312	K	56.7	Low	61.2	Low	189 Å²	189	76.8 Å²	76.8	82%	0.822	40%	0.4	S	S	*	.	S	Bend	trans	-60.5	-17.7	-178.5	-70.4	-177.2	177.3	-178.4	0	114.6	L295	L295-K312 HydrophobicContact CD1-CG 3.92Å
313	N	50.6	Low	59.8	Low	106 Å²	106	76.4 Å²	76.4	57%	0.567	40%	0.395	S	S	*	.			trans	-108.5	75.1	-176.7	-71.7	0.8	0	0	0	112	G311 I315	G311-N313 PolarHBondContact O-N 3.24Å; N313-I315 PolarHBondContact O-N 3.34Å
314	L	52.4	Low	58.5	Low	23 Å²	23	84.7 Å²	84.7	12%	0.12	42%	0.422	C	S	.	.			trans	-71.8	-10.6	174.3	-79.6	158.5	0	0	0	113.8	F251 I310 F322	F251-L314 HydrophobicContact CD2-CD2 4.23Å; F251-L314 HydrophobicContact CE2-CB 4.41Å; F251-L314 HydrophobicContact CE2-CD2 4.48Å; F251-L314 WeakPolarHBondContact CE2-O 3.47Å; F251-L314 WeakPolarHBondContact CZ-O 3.35Å; I310-L314 HydrophobicContact CG2-CD1 3.88Å; I310-L314 HydrophobicContact CG2-CD2 4.23Å; I310-L314 HydrophobicContact CG2-CG 4.14Å; L314-F322 HydrophobicContact CD2-CZ 4.29Å
315	I	46.4	Very low	57.8	Low	108 Å²	108	88.9 Å²	88.9	55%	0.554	44%	0.442	S	S	*	.	S	Bend	trans	-101.1	-20.3	-162.2	-65.7	176	0	0	0	115.5	K242 N313	K242-I315 HydrophobicContact CD-CD1 4.03Å; K242-I315 HydrophobicContact CD-CG1 4.36Å; N313-I315 PolarHBondContact O-N 3.34Å
316	E	43.8	Very low	57.3	Low	164 Å²	164	93.7 Å²	93.7	77%	0.766	46%	0.464	S	S	*	.	S	Bend	trans	-109.4	-15.2	-164.4	-74.4	-174.1	164.5	0	0	118.1
317	K	37.3	Very low	57	Low	163 Å²	163	97 Å²	97	71%	0.709	49%	0.485	S	S	*	.			trans	-145.6	114.4	178.4	-70.5	-174.2	179.8	174.2	0	113.2	S319	K317-S319 PolarHBondContact O-N 2.87Å
318	Q	42.4	Very low	56.9	Low	195 Å²	195	98.1 Å²	98.1	91%	0.911	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	12.8	175.2	-73	179.7	-22.2	0	0	115.7
319	S	40.8	Very low	56.8	Low	110 Å²	110	103 Å²	103	77%	0.769	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.1	-12.7	-171.4	12.7	0	0	0	0	117.2	K317	K317-S319 PolarHBondContact O-N 2.87Å
320	Q	41.4	Very low	57	Low	166 Å²	166	100.1 Å²	100.1	78%	0.776	50%	0.502	S	S	*	.			trans	-152.9	88.7	-179.8	-73.8	-175.3	-18.9	0	0	111.6
321	C	38.7	Very low	57.4	Low	58 Å²	58	100.3 Å²	100.3	39%	0.392	50%	0.503	S	S	.	.			trans	-160.5	63.9	165.9	-106.2	0	0	0	0	112.3
322	F	49.9	Very low	58.2	Low	87 Å²	87	107.4 Å²	107.4	38%	0.382	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.4	160.1	-83.1	-80.5	0	0	0	112.8	I240 L253 E309 I310 L314	I240-F322 HydrophobicContact CD1-CZ 4.26Å; L253-F322 HydrophobicContact CD1-CZ 4.23Å; L253-F322 HydrophobicContact CD2-CD2 4.11Å; L253-F322 HydrophobicContact CD2-CE2 4.04Å; L253-F322 HydrophobicContact CD2-CZ 4.35Å; E309-F322 WeakPolarHBondContact O-CD1 3.5Å; I310-F322 HydrophobicContact CB-CE1 4.06Å; I310-F322 HydrophobicContact CG1-CE1 3.95Å; I310-F322 HydrophobicContact CG2-CE1 4.1Å; I310-F322 HydrophobicContact CG2-CZ 4.46Å; L314-F322 HydrophobicContact CD2-CZ 4.29Å
323	G	46.9	Very low	59.4	Low	30 Å²	30	100.8 Å²	100.8	31%	0.309	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	168.2	168.4	0	0	0	0	0	111.2	E309 I325	E309-G323 PolarHBondContact O-N 3.3Å; G323-I325 PolarHBondContact O-N 3.15Å
324	R	54.5	Low	61	Low	205 Å²	205	98.3 Å²	98.3	77%	0.774	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-36.4	126.3	-171.4	-166.1	172.2	177.1	171.5	-3.5	114.2
325	I	67.3	Low	62.5	Low	107 Å²	107	97.6 Å²	97.6	55%	0.549	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122.2	166.7	-56.6	177.2	0	0	0	107.5	V306 G323	V306-I325 HydrophobicContact CG1-CG2 3.68Å; G323-I325 PolarHBondContact O-N 3.15Å
326	Q	74.4	Confident	64.3	Low	101 Å²	101	93 Å²	93	47%	0.472	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.4	176.1	-174.3	173.4	-8.4	0	0	109.7	V307 V328	V307-Q326 PolarHBondContact N-O 3.29Å; V307-Q326 PolarHBondContact O-N 2.94Å; Q326-V328 HydrophobicContact CG-CG2 3.91Å
327	T	77.5	Confident	66.3	Low	76 Å²	76	85.6 Å²	85.6	47%	0.466	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.2	169.2	-54.7	0	0	0	0	108.1	V306	V306-T327 HydrophobicContact CG2-CG2 4.13Å
328	V	81.3	Confident	68.7	Low	30 Å²	30	78 Å²	78	18%	0.182	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.6	177.3	-171.9	0	0	0	0	107.7	S304 I305 Q326 I330 F361	S304-V328 CarbonylContact C-O 3.56Å; S304-V328 WeakPolarHBondContact CA-O 3.47Å; S304-V328 WeakPolarHBondContact CB-O 3.42Å; I305-V328 PolarHBondContact N-O 3.46Å; I305-V328 PolarHBondContact O-N 3.32Å; Q326-V328 HydrophobicContact CG-CG2 3.91Å; V328-I330 HydrophobicContact CB-CG1 4.28Å; V328-I330 HydrophobicContact CG1-CD1 4.38Å; V328-I330 HydrophobicContact CG1-CG1 3.79Å; V328-F361 HydrophobicContact CG1-CB 4.2Å; V328-F361 HydrophobicContact CG1-CD2 4.48Å; V328-F361 HydrophobicContact CG1-CG 4.28Å; V328-F361 HydrophobicContact CG2-CD2 4.23Å; V328-F361 HydrophobicContact CG2-CE2 4.31Å
329	H	81.4	Confident	70.9	Confident	117 Å²	117	70.1 Å²	70.1	54%	0.542	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	123.2	172.2	-175.3	67.5	0	0	0	108.6	S303 S304 Q331	S303-H329 PolarHBondContact OG-CE1 3.14Å; S303-H329 VanDerWaalsContact OG-CE1 3.24Å; S304-H329 PolarHBondContact OG-ND1 3.38Å; S304-H329 VanDerWaalsContact OG-ND1 3.13Å; H329-Q331 PolarHBondContact CE1-O 3.3Å; H329-Q331 PolarHBondContact NE2-O 2.97Å
330	I	79.9	Confident	73.1	Confident	36 Å²	36	66.5 Å²	66.5	19%	0.185	33%	0.334	C	S	.	.			trans	-119.1	-38.4	-165.6	-56.2	178	0	0	0	112.3	I305 V328 Y357 F361	I305-I330 HydrophobicContact CB-CD1 3.92Å; I305-I330 HydrophobicContact CD1-CD1 3.41Å; I305-I330 VanDerWaalsContact CD1-CD1 3.41Å; I305-I330 HydrophobicContact CG1-CD1 3.62Å; V328-I330 HydrophobicContact CB-CG1 4.28Å; V328-I330 HydrophobicContact CG1-CD1 4.38Å; V328-I330 HydrophobicContact CG1-CG1 3.79Å; I330-Y357 HydrophobicContact CG2-CD1 3.67Å; I330-Y357 HydrophobicContact CG2-CD2 4.43Å; I330-Y357 HydrophobicContact CG2-CE1 3.04Å; I330-Y357 HydrophobicContact CG2-CE2 3.9Å; I330-Y357 HydrophobicContact CG2-CG 4.33Å; I330-Y357 WeakPolarHBondContact CG2-OH 3.16Å; I330-F361 HydrophobicContact CD1-CB 4.14Å; I330-F361 HydrophobicContact CD1-CD1 3.45Å; I330-F361 VanDerWaalsContact CD1-CD1 3.45Å; I330-F361 HydrophobicContact CD1-CE1 4.19Å; I330-F361 HydrophobicContact CD1-CG 4.13Å
331	Q	79.6	Confident	75.1	Confident	11 Å²	11	59.3 Å²	59.3	5%	0.051	30%	0.301	C	S	.	.			trans	-138.7	165.2	-178.3	54.8	176	45	0	0	111.2	S303 H329 E333 I335 T347 Y357	S303-Q331 VanDerWaalsContact CB-O 3.25Å; S303-Q331 WeakPolarHBondContact CB-O 3.42Å; H329-Q331 PolarHBondContact CE1-O 3.3Å; H329-Q331 PolarHBondContact NE2-O 2.97Å; Q331-E333 WeakPolarHBondContact CG-O 3.34Å; Q331-E333 PolarHBondContact NE2-O 3.48Å; Q331-I335 HydrophobicContact CG-CD1 4.32Å; Q331-I335 HydrophobicContact CG-CG1 3.96Å; Q331-T347 PolarHBondContact OE1-OG1 2.97Å; Q331-Y357 PolarHBondContact OE1-OH 3.11Å
332	Q	79	Confident	77.1	Confident	173 Å²	173	60 Å²	60	81%	0.808	30%	0.301	S	S	*	.	S	Bend	trans	-80.3	-40.7	177.9	-68.5	-178.2	-7.5	0	0	111.8
333	E	81.9	Confident	78.8	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.234	30%	0.3	C	S	.	.	S	Bend	trans	-76	144.8	-178.3	-59.1	-55.6	145.3	0	0	112.1	Q331 I335 D349 I350 Q351	Q331-E333 WeakPolarHBondContact CG-O 3.34Å; Q331-E333 PolarHBondContact NE2-O 3.48Å; E333-I335 PolarHBondContact O-N 3.49Å; E333-D349 HydrophobicContact CB-CB 4.03Å; E333-I350 HydrophobicContact CB-CG1 4.37Å; E333-Q351 HydrophobicContact CG-CG 4.34Å; E333-Q351 PolarHBondContact OE1-NE2 2.88Å; E333-Q351 PolarHBondContact OE2-NE2 2.83Å
334	P	83.1	Confident	80.7	Confident	54 Å²	54	59.4 Å²	59.4	35%	0.351	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-57.2	132.8	172	-24	32.6	0	0	0	112.6	D349 I350	P334-D349 WeakPolarHBondContact O-CA 3.44Å; P334-I350 HydrophobicContact CB-CG2 4.13Å; P334-I350 HydrophobicContact CG-CD1 4.15Å; P334-I350 PolarHBondContact O-N 3.42Å
335	I	85.2	Confident	82.4	Confident	9 Å²	9	49.7 Å²	49.7	5%	0.046	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	121.5	175.3	-60.8	163.6	0	0	0	108.3	A300 G302 I305 Q331 E333 V337 T347 G348	A300-I335 HydrophobicContact CB-CB 3.8Å; A300-I335 HydrophobicContact CB-CD1 3.87Å; A300-I335 HydrophobicContact CB-CG1 4.44Å; A300-I335 HydrophobicContact CB-CG2 3.63Å; G302-I335 WeakPolarHBondContact O-CB 3.18Å; G302-I335 PolarHBondContact O-N 3.25Å; I305-I335 HydrophobicContact CD1-CD1 4.35Å; I305-I335 HydrophobicContact CG1-CD1 3.85Å; Q331-I335 HydrophobicContact CG-CD1 4.32Å; Q331-I335 HydrophobicContact CG-CG1 3.96Å; E333-I335 PolarHBondContact O-N 3.49Å; I335-V337 VanDerWaalsContact CG2-O 3.27Å; I335-V337 WeakPolarHBondContact CG2-O 3.47Å; I335-T347 HydrophobicContact CD1-CG2 4.2Å; I335-T347 HydrophobicContact CG1-CG2 4.47Å; I335-T347 HydrophobicContact CG2-CG2 4.21Å; I335-G348 WeakPolarHBondContact CA-O 3.49Å
336	T	83.6	Confident	83.5	Confident	12 Å²	12	44.6 Å²	44.6	7%	0.074	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-41.5	175	55	0	0	0	0	111.3	L285 S286 G348 I350 V375	L285-T336 CarbonylContact C-O 3.52Å; L285-T336 VanDerWaalsContact CB-O 3.26Å; L285-T336 WeakPolarHBondContact CB-O 3.36Å; L285-T336 VanDerWaalsContact O-O 3.05Å; S286-T336 PolarHBondContact N-O 2.88Å; T336-G348 PolarHBondContact N-O 3.22Å; T336-G348 PolarHBondContact OG1-O 3.46Å; T336-I350 HydrophobicContact CG2-CB 4.5Å; T336-I350 HydrophobicContact CG2-CG2 3.58Å; T336-V375 WeakPolarHBondContact CB-O 3.16Å; T336-V375 PolarHBondContact OG1-O 2.93Å
337	V	85.4	Confident	84.2	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134	-176.7	-176.7	0	0	0	0	109.8	I335 T347 G348 V375 V376 I378	I335-V337 VanDerWaalsContact CG2-O 3.27Å; I335-V337 WeakPolarHBondContact CG2-O 3.47Å; V337-T347 CarbonylContact O-C 3.44Å; V337-T347 VanDerWaalsContact O-CA 3.26Å; V337-T347 WeakPolarHBondContact O-CA 3.42Å; V337-G348 PolarHBondContact N-O 2.82Å; V337-G348 PolarHBondContact O-N 3.27Å; V337-V375 HydrophobicContact CG2-CG1 4.19Å; V337-V375 WeakPolarHBondContact CG2-O 3.18Å; V337-V376 WeakPolarHBondContact CG2-O 3.37Å; V337-I378 HydrophobicContact CB-CD1 4.45Å; V337-I378 HydrophobicContact CG1-CD1 4.26Å; V337-I378 HydrophobicContact CG1-CG1 4.16Å
338	L	88.9	Confident	84.7	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.9	169.3	178.5	65.3	0	0	0	108.3	V289 L298 A300 I305 I345 T347	V289-L338 HydrophobicContact CG2-CG 4.31Å; V289-L338 VanDerWaalsContact CG2-O 3.31Å; V289-L338 WeakPolarHBondContact CG2-O 3.22Å; L298-L338 HydrophobicContact CB-CD2 3.97Å; A300-L338 HydrophobicContact CB-CB 4.42Å; A300-L338 HydrophobicContact CB-CD2 4.35Å; I305-L338 HydrophobicContact CD1-CD1 3.77Å; L338-I345 HydrophobicContact CD1-CG2 3.65Å; L338-T347 HydrophobicContact CD1-CG2 3.98Å
339	T	87.6	Confident	85	Confident	30 Å²	30	34.7 Å²	34.7	18%	0.184	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	168.5	178	-169	0	0	0	0	110.5	V346 I378 F380	T339-V346 HydrophobicContact CG2-CB 3.86Å; T339-V346 HydrophobicContact CG2-CG1 4.42Å; T339-V346 PolarHBondContact N-O 3.46Å; T339-V346 PolarHBondContact O-N 2.84Å; T339-I378 HydrophobicContact CG2-CB 4.29Å; T339-F380 HydrophobicContact CG2-CE2 3.7Å; T339-F380 HydrophobicContact CG2-CZ 4.34Å
340	I	87	Confident	85.1	Confident	34 Å²	34	31.8 Å²	31.8	17%	0.174	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.3	-176.9	-67	174.8	0	0	0	108.4	V289 F290 W292 L298 Y344	V289-I340 HydrophobicContact CB-CD1 3.97Å; V289-I340 HydrophobicContact CB-CG1 4.36Å; V289-I340 HydrophobicContact CG1-CB 4.19Å; V289-I340 HydrophobicContact CG1-CD1 3.44Å; V289-I340 VanDerWaalsContact CG1-CD1 3.44Å; V289-I340 HydrophobicContact CG1-CG1 3.8Å; F290-I340 WeakPolarHBondContact O-CD1 3.11Å; W292-I340 HydrophobicContact CB-CG2 4.23Å; W292-I340 HydrophobicContact CD2-CG2 4.11Å; W292-I340 HydrophobicContact CE3-CD1 4.05Å; W292-I340 HydrophobicContact CE3-CG1 4.38Å; W292-I340 HydrophobicContact CE3-CG2 3.37Å; W292-I340 HydrophobicContact CG-CG2 4.49Å; W292-I340 HydrophobicContact CZ3-CD1 4.37Å; W292-I340 HydrophobicContact CZ3-CG1 4.47Å; W292-I340 HydrophobicContact CZ3-CG2 3.99Å; L298-I340 HydrophobicContact CD1-CD1 4.03Å; I340-Y344 WeakPolarHBondContact CA-O 3.27Å
341	T	83.4	Confident	85.2	Confident	15 Å²	15	34.2 Å²	34.2	9%	0.092	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	129.7	177.3	-47.7	0	0	0	0	109.2	T343 Y344 F380	T341-T343 PolarHBondContact O-N 2.83Å; T341-Y344 PolarHBondContact N-O 2.78Å; T341-Y344 VanDerWaalsContact N-O 3.07Å; T341-Y344 PolarHBondContact O-N 3.21Å; T341-F380 HydrophobicContact CG2-CB 4.12Å; T341-F380 HydrophobicContact CG2-CD1 3.8Å; T341-F380 HydrophobicContact CG2-CD2 4.1Å; T341-F380 HydrophobicContact CG2-CE1 4.29Å; T341-F380 HydrophobicContact CG2-CG 3.7Å; T341-F380 WeakPolarHBondContact OG1-CD2 3.48Å; T341-F380 WeakPolarHBondContact OG1-CE2 3.46Å; T341-F380 WeakPolarHBondContact OG1-CG 3.23Å; T341-F380 WeakPolarHBondContact OG1-CZ 3.47Å
342	D	81.1	Confident	85.3	Confident	71 Å²	71	33.7 Å²	33.7	38%	0.38	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	-92.9	178.9	-57.6	-41.2	0	0	0	112.9	R403	D342-R403 IonicContact OD1-CZ 3.72Å; D342-R403 IonicContact OD1-NE 2.78Å; D342-R403 PolarHBondContact OD1-NE 3.47Å; D342-R403 IonicContact OD1-NH2 3.3Å; D342-R403 PolarHBondContact OD1-NH2 3.46Å; D342-R403 IonicContact OD2-CZ 3.32Å; D342-R403 IonicContact OD2-NE 3.61Å; D342-R403 PolarHBondContact OD2-NE 2.7Å; D342-R403 IonicContact OD2-NH2 3.71Å
343	T	85.1	Confident	85.6	Confident	59 Å²	59	26 Å²	26	36%	0.362	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	15.2	-179.6	56	0	0	0	0	114.8	W292 T341	W292-T343 WeakPolarHBondContact CH2-O 3.48Å; W292-T343 WeakPolarHBondContact CZ2-O 3.46Å; T341-T343 PolarHBondContact O-N 2.83Å
344	Y	88.4	Confident	86	Confident	47 Å²	47	23.6 Å²	23.6	18%	0.184	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145	-174.7	-57.1	-70.8	0	0	0	112.9	I340 T341 Y357 V364 L400	I340-Y344 WeakPolarHBondContact CA-O 3.27Å; T341-Y344 PolarHBondContact N-O 2.78Å; T341-Y344 VanDerWaalsContact N-O 3.07Å; T341-Y344 PolarHBondContact O-N 3.21Å; Y344-Y357 WeakPolarHBondContact CA-O 3.26Å; Y344-V364 HydrophobicContact CD1-CG2 4.2Å; Y344-V364 HydrophobicContact CE1-CG1 4.22Å; Y344-V364 HydrophobicContact CE1-CG2 4.06Å; Y344-L400 HydrophobicContact CE1-CD1 4.2Å; Y344-L400 HydrophobicContact CE2-CD1 4.24Å; Y344-L400 WeakPolarHBondContact OH-CD1 3.49Å
345	I	89.1	Confident	86.3	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.5	167.1	-59.1	170.1	0	0	0	107.3	W292 L298 I305 L338 Y357 F361	W292-I345 HydrophobicContact CH2-CD1 4.37Å; W292-I345 HydrophobicContact CH2-CG1 3.79Å; W292-I345 HydrophobicContact CZ3-CD1 4.25Å; W292-I345 HydrophobicContact CZ3-CG1 3.51Å; L298-I345 HydrophobicContact CD1-CD1 3.81Å; L298-I345 HydrophobicContact CD1-CG1 4.13Å; I305-I345 HydrophobicContact CD1-CG2 4.23Å; L338-I345 HydrophobicContact CD1-CG2 3.65Å; I345-Y357 PolarHBondContact N-O 3.24Å; I345-Y357 PolarHBondContact O-N 3.49Å; I345-F361 HydrophobicContact CD1-CD1 3.77Å; I345-F361 HydrophobicContact CD1-CE1 3.37Å; I345-F361 HydrophobicContact CD1-CZ 3.93Å
346	V	90.1	Very high	86.5	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132	-178.3	-171.7	0	0	0	0	110.1	T339 V354 R355 F356 I378 F380	T339-V346 HydrophobicContact CG2-CB 3.86Å; T339-V346 HydrophobicContact CG2-CG1 4.42Å; T339-V346 PolarHBondContact N-O 3.46Å; T339-V346 PolarHBondContact O-N 2.84Å; V346-V354 HydrophobicContact CG1-CG1 3.62Å; V346-R355 WeakPolarHBondContact CA-O 3.31Å; V346-F356 HydrophobicContact CB-CE1 4.46Å; V346-F356 HydrophobicContact CG1-CD1 4.45Å; V346-F356 HydrophobicContact CG1-CE1 4.16Å; V346-F356 HydrophobicContact CG1-CE2 4.42Å; V346-F356 HydrophobicContact CG1-CZ 4.14Å; V346-F356 HydrophobicContact CG2-CD1 3.49Å; V346-F356 VanDerWaalsContact CG2-CD1 3.49Å; V346-F356 HydrophobicContact CG2-CE1 3.45Å; V346-F356 VanDerWaalsContact CG2-CE1 3.45Å; V346-F356 HydrophobicContact CG2-CG 4.31Å; V346-F356 HydrophobicContact CG2-CZ 4.26Å; V346-I378 HydrophobicContact CG1-CD1 4.14Å; V346-F380 HydrophobicContact CB-CZ 4.19Å; V346-F380 HydrophobicContact CG1-CZ 4.1Å; V346-F380 HydrophobicContact CG2-CZ 3.83Å
347	T	89.8	Confident	86.7	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137	176.3	68	0	0	0	0	111.7	I305 Q331 I335 V337 L338 V354 R355 Y357	I305-T347 HydrophobicContact CD1-CG2 4.09Å; Q331-T347 PolarHBondContact OE1-OG1 2.97Å; I335-T347 HydrophobicContact CD1-CG2 4.2Å; I335-T347 HydrophobicContact CG1-CG2 4.47Å; I335-T347 HydrophobicContact CG2-CG2 4.21Å; V337-T347 CarbonylContact O-C 3.44Å; V337-T347 VanDerWaalsContact O-CA 3.26Å; V337-T347 WeakPolarHBondContact O-CA 3.42Å; L338-T347 HydrophobicContact CD1-CG2 3.98Å; T347-V354 WeakPolarHBondContact O-CA 3.31Å; T347-R355 PolarHBondContact N-O 2.81Å; T347-R355 PolarHBondContact O-N 3.1Å; T347-Y357 HydrophobicContact CG2-CD2 4.27Å; T347-Y357 HydrophobicContact CG2-CE2 3.8Å; T347-Y357 WeakPolarHBondContact OG1-CE2 3.4Å
348	G	88.6	Confident	86.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	145.8	164.4	0	0	0	0	0	110.7	I335 T336 V337 N353	I335-G348 WeakPolarHBondContact CA-O 3.49Å; T336-G348 PolarHBondContact N-O 3.22Å; T336-G348 PolarHBondContact OG1-O 3.46Å; V337-G348 PolarHBondContact N-O 2.82Å; V337-G348 PolarHBondContact O-N 3.27Å; G348-N353 WeakPolarHBondContact CA-O 3.28Å
349	D	86.4	Confident	86.5	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	175.6	178.2	74.7	19.8	0	0	0	114.1	E333 P334 Q351 G352 N353 R355 V375	E333-D349 HydrophobicContact CB-CB 4.03Å; P334-D349 WeakPolarHBondContact O-CA 3.44Å; D349-Q351 PolarHBondContact O-N 3.03Å; D349-Q351 WeakPolarHBondContact OD1-CA 3.43Å; D349-Q351 PolarHBondContact OD1-N 2.81Å; D349-G352 PolarHBondContact O-N 2.94Å; D349-G352 PolarHBondContact OD1-N 2.83Å; D349-N353 PolarHBondContact N-O 2.88Å; D349-N353 PolarHBondContact OD1-N 2.86Å; D349-N353 PolarHBondContact OD1-ND2 2.84Å; D349-N353 VanDerWaalsContact OD2-CB 3.28Å; D349-N353 WeakPolarHBondContact OD2-CB 3.24Å; D349-N353 PolarHBondContact OD2-ND2 3.36Å; D349-R355 IonicContact OD2-CZ 3.13Å; D349-R355 IonicContact OD2-NH1 2.81Å; D349-R355 PolarHBondContact OD2-NH1 3.28Å; D349-R355 IonicContact OD2-NH2 2.68Å; D349-R355 PolarHBondContact OD2-NH2 3.18Å; D349-V375 PolarHBondContact O-N 2.8Å
350	I	83.8	Confident	86.3	Confident	56 Å²	56	30.1 Å²	30.1	29%	0.287	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.4	178.8	59.8	164.8	0	0	0	114	E333 P334 T336 G352 P374	E333-I350 HydrophobicContact CB-CG1 4.37Å; P334-I350 HydrophobicContact CB-CG2 4.13Å; P334-I350 HydrophobicContact CG-CD1 4.15Å; P334-I350 PolarHBondContact O-N 3.42Å; T336-I350 HydrophobicContact CG2-CB 4.5Å; T336-I350 HydrophobicContact CG2-CG2 3.58Å; I350-G352 VanDerWaalsContact C-N 3.35Å; I350-P374 WeakPolarHBondContact O-CA 3.46Å; I350-P374 WeakPolarHBondContact O-CD 3.31Å; I350-P374 WeakPolarHBondContact O-CG 3.25Å
351	Q	82.6	Confident	86.2	Confident	86 Å²	86	30 Å²	30	40%	0.402	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	2.1	178.7	-68.7	179.9	2.5	0	0	111.8	E333 D349 Q372	E333-Q351 HydrophobicContact CG-CG 4.34Å; E333-Q351 PolarHBondContact OE1-NE2 2.88Å; E333-Q351 PolarHBondContact OE2-NE2 2.83Å; D349-Q351 PolarHBondContact O-N 3.03Å; D349-Q351 WeakPolarHBondContact OD1-CA 3.43Å; D349-Q351 PolarHBondContact OD1-N 2.81Å; Q351-Q372 WeakPolarHBondContact O-CA 3.34Å
352	G	80.6	Confident	86.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	91.3	-2.4	-179.4	0	0	0	0	0	114.3	D349 I350 F370 D373 V375	D349-G352 PolarHBondContact O-N 2.94Å; D349-G352 PolarHBondContact OD1-N 2.83Å; I350-G352 VanDerWaalsContact C-N 3.35Å; G352-F370 VanDerWaalsContact O-CB 3.24Å; G352-F370 WeakPolarHBondContact O-CB 3.39Å; G352-F370 WeakPolarHBondContact O-CD2 3.28Å; G352-F370 WeakPolarHBondContact O-CG 3.42Å; G352-D373 WeakPolarHBondContact CA-O 3.45Å; G352-D373 PolarHBondContact N-O 2.83Å; G352-V375 WeakPolarHBondContact O-CG2 3.48Å
353	N	87.1	Confident	86.5	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.059	18%	0.179	C	C	.	.			trans	-77.2	142.3	-175.7	-43.7	-60.9	0	0	0	111.4	G348 D349 R355 Y367 T368	G348-N353 WeakPolarHBondContact CA-O 3.28Å; D349-N353 PolarHBondContact N-O 2.88Å; D349-N353 PolarHBondContact OD1-N 2.86Å; D349-N353 PolarHBondContact OD1-ND2 2.84Å; D349-N353 VanDerWaalsContact OD2-CB 3.28Å; D349-N353 WeakPolarHBondContact OD2-CB 3.24Å; D349-N353 PolarHBondContact OD2-ND2 3.36Å; N353-R355 PolarHBondContact ND2-NH2 2.62Å; N353-Y367 VanDerWaalsContact CA-O 3.27Å; N353-Y367 WeakPolarHBondContact CA-O 3.38Å; N353-T368 VanDerWaalsContact OD1-CA 3.27Å; N353-T368 WeakPolarHBondContact OD1-CA 3.11Å; N353-T368 WeakPolarHBondContact OD1-CB 3.41Å; N353-T368 WeakPolarHBondContact OD1-CG2 3.24Å
354	V	89.1	Confident	86.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125	174.2	-179.1	0	0	0	0	109.2	V346 T347 F356 W366 Y367 F370 V375 I378 F405 T407	V346-V354 HydrophobicContact CG1-CG1 3.62Å; T347-V354 WeakPolarHBondContact O-CA 3.31Å; V354-F356 HydrophobicContact CG1-CE2 3.86Å; V354-F356 HydrophobicContact CG1-CZ 4.36Å; V354-W366 CarbonylContact O-C 3.58Å; V354-W366 VanDerWaalsContact O-CA 3.26Å; V354-W366 WeakPolarHBondContact O-CA 3.41Å; V354-Y367 PolarHBondContact N-O 2.81Å; V354-Y367 PolarHBondContact O-N 2.89Å; V354-F370 HydrophobicContact CB-CE2 4.13Å; V354-F370 HydrophobicContact CG2-CD2 4.35Å; V354-F370 HydrophobicContact CG2-CE2 3.73Å; V354-F370 HydrophobicContact CG2-CZ 4.12Å; V354-V375 HydrophobicContact CG2-CG2 4.48Å; V354-I378 HydrophobicContact CG1-CD1 3.98Å; V354-I378 HydrophobicContact CG2-CD1 4.05Å; V354-F405 HydrophobicContact CB-CE2 4.46Å; V354-F405 HydrophobicContact CB-CZ 4.37Å; V354-F405 HydrophobicContact CG1-CE2 4.17Å; V354-F405 HydrophobicContact CG1-CZ 4.01Å; V354-F405 HydrophobicContact CG2-CE2 4.23Å; V354-T407 HydrophobicContact CG2-CG2 4.09Å
355	R	89.1	Confident	86.2	Confident	30 Å²	30	34.2 Å²	34.2	11%	0.113	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.7	-178.4	-62.6	-171.4	-179.4	82.2	10.1	111.3	V346 T347 D349 N353 Y357 L363 W366	V346-R355 WeakPolarHBondContact CA-O 3.31Å; T347-R355 PolarHBondContact N-O 2.81Å; T347-R355 PolarHBondContact O-N 3.1Å; D349-R355 IonicContact OD2-CZ 3.13Å; D349-R355 IonicContact OD2-NH1 2.81Å; D349-R355 PolarHBondContact OD2-NH1 3.28Å; D349-R355 IonicContact OD2-NH2 2.68Å; D349-R355 PolarHBondContact OD2-NH2 3.18Å; N353-R355 PolarHBondContact ND2-NH2 2.62Å; R355-Y357 HydrophobicContact CB-CE2 3.71Å; R355-Y357 WeakPolarHBondContact CB-OH 3.46Å; R355-Y357 WeakPolarHBondContact CD-OH 3.45Å; R355-L363 HydrophobicContact CB-CD1 3.77Å; R355-L363 HydrophobicContact CG-CD1 4.15Å; R355-W366 HydrophobicContact CB-CB 4.47Å; R355-W366 HydrophobicContact CG-CB 3.83Å
356	F	89.6	Confident	86	Confident	2 Å²	2	41 Å²	41	1%	0.009	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.4	179.3	-69.6	-99.6	0	0	0	109.9	V346 V354 V364 S365 Y367 F380 I402 F405	V346-F356 HydrophobicContact CB-CE1 4.46Å; V346-F356 HydrophobicContact CG1-CD1 4.45Å; V346-F356 HydrophobicContact CG1-CE1 4.16Å; V346-F356 HydrophobicContact CG1-CE2 4.42Å; V346-F356 HydrophobicContact CG1-CZ 4.14Å; V346-F356 HydrophobicContact CG2-CD1 3.49Å; V346-F356 VanDerWaalsContact CG2-CD1 3.49Å; V346-F356 HydrophobicContact CG2-CE1 3.45Å; V346-F356 VanDerWaalsContact CG2-CE1 3.45Å; V346-F356 HydrophobicContact CG2-CG 4.31Å; V346-F356 HydrophobicContact CG2-CZ 4.26Å; V354-F356 HydrophobicContact CG1-CE2 3.86Å; V354-F356 HydrophobicContact CG1-CZ 4.36Å; F356-V364 HydrophobicContact CB-CB 4.48Å; F356-V364 PolarHBondContact O-N 2.79Å; F356-S365 PolarHBondContact N-O 3.36Å; F356-S365 PolarHBondContact O-N 2.9Å; F356-Y367 HydrophobicContact CD2-CD2 4.31Å; F356-Y367 HydrophobicContact CD2-CE2 4.08Å; F356-Y367 AromaticContact CE2-CD2 3.81Å; F356-Y367 HydrophobicContact CE2-CD2 3.81Å; F356-Y367 AromaticContact CE2-CE2 3.59Å; F356-Y367 HydrophobicContact CE2-CE2 3.59Å; F356-Y367 HydrophobicContact CZ-CE2 4.48Å; F356-F380 HydrophobicContact CE1-CE1 4.01Å; F356-F380 HydrophobicContact CE1-CZ 4.35Å; F356-F380 HydrophobicContact CZ-CE1 4.1Å; F356-F380 HydrophobicContact CZ-CZ 4.49Å; F356-I402 HydrophobicContact CD1-CD1 4.16Å; F356-I402 HydrophobicContact CD1-CG2 4.19Å; F356-I402 HydrophobicContact CD2-CD1 4.36Å; F356-I402 HydrophobicContact CE1-CD1 4.37Å; F356-I402 HydrophobicContact CE1-CG2 3.46Å; F356-I402 VanDerWaalsContact CE1-CG2 3.46Å; F356-I402 HydrophobicContact CE2-CG2 4.48Å; F356-I402 HydrophobicContact CG-CD1 4.17Å; F356-I402 HydrophobicContact CZ-CG2 3.64Å; F356-F405 AromaticContact CE2-CE1 3.96Å; F356-F405 HydrophobicContact CE2-CE1 3.96Å; F356-F405 HydrophobicContact CE2-CZ 4.24Å; F356-F405 HydrophobicContact CZ-CD1 4.14Å; F356-F405 AromaticContact CZ-CE1 3.61Å; F356-F405 HydrophobicContact CZ-CE1 3.61Å; F356-F405 HydrophobicContact CZ-CZ 4.22Å
357	Y	88.9	Confident	85.7	Confident	6 Å²	6	42.9 Å²	42.9	2%	0.024	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.1	178.4	-52	-87.4	0	0	0	111.9	I330 Q331 Y344 I345 T347 R355 L362 L363	I330-Y357 HydrophobicContact CG2-CD1 3.67Å; I330-Y357 HydrophobicContact CG2-CD2 4.43Å; I330-Y357 HydrophobicContact CG2-CE1 3.04Å; I330-Y357 HydrophobicContact CG2-CE2 3.9Å; I330-Y357 HydrophobicContact CG2-CG 4.33Å; I330-Y357 WeakPolarHBondContact CG2-OH 3.16Å; Q331-Y357 PolarHBondContact OE1-OH 3.11Å; Y344-Y357 WeakPolarHBondContact CA-O 3.26Å; I345-Y357 PolarHBondContact N-O 3.24Å; I345-Y357 PolarHBondContact O-N 3.49Å; T347-Y357 HydrophobicContact CG2-CD2 4.27Å; T347-Y357 HydrophobicContact CG2-CE2 3.8Å; T347-Y357 WeakPolarHBondContact OG1-CE2 3.4Å; R355-Y357 HydrophobicContact CB-CE2 3.71Å; R355-Y357 WeakPolarHBondContact CB-OH 3.46Å; R355-Y357 WeakPolarHBondContact CD-OH 3.45Å; Y357-L362 CarbonylContact C-O 3.55Å; Y357-L362 WeakPolarHBondContact CA-O 3.29Å; Y357-L363 HydrophobicContact CD1-CB 4.15Å; Y357-L363 HydrophobicContact CD1-CD1 4.11Å; Y357-L363 HydrophobicContact CE1-CB 4.02Å; Y357-L363 HydrophobicContact CE1-CD1 3.6Å; Y357-L363 HydrophobicContact CE1-CG 4.43Å
358	D	86.2	Confident	85.2	Confident	38 Å²	38	45.4 Å²	45.4	20%	0.203	22%	0.224	C	C	.	.			trans	-78.8	-176	173.7	79.1	-8.4	0	0	0	112.8	N360 F361 L362 V364	D358-N360 PolarHBondContact O-N 2.8Å; D358-N360 VanDerWaalsContact O-N 3.14Å; D358-N360 VanDerWaalsContact OD1-C 3.25Å; D358-N360 VanDerWaalsContact OD1-CA 3.29Å; D358-N360 WeakPolarHBondContact OD1-CA 3.49Å; D358-N360 WeakPolarHBondContact OD1-CB 3.4Å; D358-N360 PolarHBondContact OD1-N 3.1Å; D358-F361 PolarHBondContact O-N 3.37Å; D358-F361 VanDerWaalsContact O-N 3.08Å; D358-F361 PolarHBondContact OD1-N 3.49Å; D358-L362 PolarHBondContact N-O 2.79Å; D358-L362 WeakPolarHBondContact OD1-CB 3.24Å; D358-L362 PolarHBondContact OD1-N 3.42Å; D358-V364 HydrophobicContact CB-CG2 3.94Å
359	E	83.5	Confident	84.2	Confident	60 Å²	60	51 Å²	51	28%	0.28	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.6	176.4	-71.3	-172.1	-172.6	0	0	114.1	W292 K293	W292-E359 HydrophobicContact CH2-CG 4.16Å; W292-E359 HydrophobicContact CZ2-CG 3.44Å; W292-E359 VanDerWaalsContact CZ2-CG 3.44Å; K293-E359 IonicContact NZ-OE1 2.8Å; K293-E359 PolarHBondContact NZ-OE1 3.33Å
360	N	83.4	Confident	83.2	Confident	117 Å²	117	51.2 Å²	51.2	63%	0.626	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	10.8	-179.6	-59.9	-51	0	0	0	112.5	D358 L362	D358-N360 PolarHBondContact O-N 2.8Å; D358-N360 VanDerWaalsContact O-N 3.14Å; D358-N360 VanDerWaalsContact OD1-C 3.25Å; D358-N360 VanDerWaalsContact OD1-CA 3.29Å; D358-N360 WeakPolarHBondContact OD1-CA 3.49Å; D358-N360 WeakPolarHBondContact OD1-CB 3.4Å; D358-N360 PolarHBondContact OD1-N 3.1Å; N360-L362 HydrophobicContact CB-CD1 4.46Å; N360-L362 HydrophobicContact CB-CG 4.32Å; N360-L362 PolarHBondContact O-N 3.04Å
361	F	84.2	Confident	82.2	Confident	33 Å²	33	53.3 Å²	53.3	15%	0.145	27%	0.267	C	S	.	.	S	Bend	trans	63.1	24	-175.3	-55.4	-87	0	0	0	114.3	L298 I305 V307 V328 I330 I345 D358	L298-F361 HydrophobicContact CD2-CE1 4.39Å; L298-F361 HydrophobicContact CD2-CZ 3.96Å; I305-F361 HydrophobicContact CB-CE1 4.49Å; I305-F361 HydrophobicContact CD1-CE1 4.36Å; I305-F361 HydrophobicContact CG2-CE1 4.16Å; V307-F361 HydrophobicContact CG2-CE1 4.35Å; V307-F361 HydrophobicContact CG2-CE2 3.93Å; V307-F361 HydrophobicContact CG2-CZ 3.44Å; V307-F361 VanDerWaalsContact CG2-CZ 3.44Å; V328-F361 HydrophobicContact CG1-CB 4.2Å; V328-F361 HydrophobicContact CG1-CD2 4.48Å; V328-F361 HydrophobicContact CG1-CG 4.28Å; V328-F361 HydrophobicContact CG2-CD2 4.23Å; V328-F361 HydrophobicContact CG2-CE2 4.31Å; I330-F361 HydrophobicContact CD1-CB 4.14Å; I330-F361 HydrophobicContact CD1-CD1 3.45Å; I330-F361 VanDerWaalsContact CD1-CD1 3.45Å; I330-F361 HydrophobicContact CD1-CE1 4.19Å; I330-F361 HydrophobicContact CD1-CG 4.13Å; I345-F361 HydrophobicContact CD1-CD1 3.77Å; I345-F361 HydrophobicContact CD1-CE1 3.37Å; I345-F361 HydrophobicContact CD1-CZ 3.93Å; D358-F361 PolarHBondContact O-N 3.37Å; D358-F361 VanDerWaalsContact O-N 3.08Å; D358-F361 PolarHBondContact OD1-N 3.49Å
362	L	84.8	Confident	81.5	Confident	112 Å²	112	57.3 Å²	57.3	59%	0.586	29%	0.286	S	S	*	.			trans	-82.7	134.9	171.8	-62.3	173.7	0	0	0	110.1	Y357 D358 N360 V364	Y357-L362 CarbonylContact C-O 3.55Å; Y357-L362 WeakPolarHBondContact CA-O 3.29Å; D358-L362 PolarHBondContact N-O 2.79Å; D358-L362 WeakPolarHBondContact OD1-CB 3.24Å; D358-L362 PolarHBondContact OD1-N 3.42Å; N360-L362 HydrophobicContact CB-CD1 4.46Å; N360-L362 HydrophobicContact CB-CG 4.32Å; N360-L362 PolarHBondContact O-N 3.04Å; L362-V364 PolarHBondContact O-N 3.36Å
363	L	85.6	Confident	81.4	Confident	90 Å²	90	58.3 Å²	58.3	47%	0.471	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.9	179.3	-175.6	71.3	0	0	0	110.3	R355 Y357 S365 W366	R355-L363 HydrophobicContact CB-CD1 3.77Å; R355-L363 HydrophobicContact CG-CD1 4.15Å; Y357-L363 HydrophobicContact CD1-CB 4.15Å; Y357-L363 HydrophobicContact CD1-CD1 4.11Å; Y357-L363 HydrophobicContact CE1-CB 4.02Å; Y357-L363 HydrophobicContact CE1-CD1 3.6Å; Y357-L363 HydrophobicContact CE1-CG 4.43Å; L363-S365 WeakPolarHBondContact CD1-O 3.49Å; L363-W366 HydrophobicContact CD1-CB 4.41Å
364	V	85	Confident	81.2	Confident	56 Å²	56	58.6 Å²	58.6	34%	0.339	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-48.2	178.6	-178.7	0	0	0	0	110.6	Y344 F356 D358 L362 L400	Y344-V364 HydrophobicContact CD1-CG2 4.2Å; Y344-V364 HydrophobicContact CE1-CG1 4.22Å; Y344-V364 HydrophobicContact CE1-CG2 4.06Å; F356-V364 HydrophobicContact CB-CB 4.48Å; F356-V364 PolarHBondContact O-N 2.79Å; D358-V364 HydrophobicContact CB-CG2 3.94Å; L362-V364 PolarHBondContact O-N 3.36Å; V364-L400 HydrophobicContact CG1-CD1 3.51Å; V364-L400 HydrophobicContact CG1-CD2 3.83Å; V364-L400 HydrophobicContact CG1-CG 4.34Å
365	S	83.8	Confident	81.1	Confident	22 Å²	22	58.6 Å²	58.6	15%	0.154	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.6	-176.4	169.8	0	0	0	0	110.5	F356 L363	F356-S365 PolarHBondContact N-O 3.36Å; F356-S365 PolarHBondContact O-N 2.9Å; L363-S365 WeakPolarHBondContact CD1-O 3.49Å
366	W	84.4	Confident	80.9	Confident	142 Å²	142	58.1 Å²	58.1	54%	0.538	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	149.4	174.3	71.5	-47.3	0	0	0	111.8	V354 R355 L363 T368	V354-W366 CarbonylContact O-C 3.58Å; V354-W366 VanDerWaalsContact O-CA 3.26Å; V354-W366 WeakPolarHBondContact O-CA 3.41Å; R355-W366 HydrophobicContact CB-CB 4.47Å; R355-W366 HydrophobicContact CG-CB 3.83Å; L363-W366 HydrophobicContact CD1-CB 4.41Å; W366-T368 HydrophobicContact CD2-CG2 3.97Å; W366-T368 HydrophobicContact CE3-CG2 3.23Å; W366-T368 HydrophobicContact CH2-CG2 3.54Å; W366-T368 HydrophobicContact CZ2-CG2 4.22Å; W366-T368 HydrophobicContact CZ3-CG2 3Å
367	Y	83.4	Confident	80.8	Confident	39 Å²	39	59.7 Å²	59.7	15%	0.153	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	128.6	-179.1	-61.3	-82.4	0	0	0	109.5	N353 V354 F356 F405 L417	N353-Y367 VanDerWaalsContact CA-O 3.27Å; N353-Y367 WeakPolarHBondContact CA-O 3.38Å; V354-Y367 PolarHBondContact N-O 2.81Å; V354-Y367 PolarHBondContact O-N 2.89Å; F356-Y367 HydrophobicContact CD2-CD2 4.31Å; F356-Y367 HydrophobicContact CD2-CE2 4.08Å; F356-Y367 AromaticContact CE2-CD2 3.81Å; F356-Y367 HydrophobicContact CE2-CD2 3.81Å; F356-Y367 AromaticContact CE2-CE2 3.59Å; F356-Y367 HydrophobicContact CE2-CE2 3.59Å; F356-Y367 HydrophobicContact CZ-CE2 4.48Å; Y367-F405 HydrophobicContact CD2-CE1 4.47Å; Y367-F405 HydrophobicContact CD2-CZ 4.17Å; Y367-F405 HydrophobicContact CE2-CE1 4.28Å; Y367-F405 HydrophobicContact CE2-CZ 4.43Å; Y367-L417 HydrophobicContact CD1-CD1 3.48Å; Y367-L417 VanDerWaalsContact CD1-CD1 3.48Å; Y367-L417 HydrophobicContact CD1-CD2 4.29Å; Y367-L417 HydrophobicContact CD1-CG 4.48Å; Y367-L417 HydrophobicContact CD2-CD1 4.18Å; Y367-L417 HydrophobicContact CE1-CD1 3.94Å; Y367-L417 HydrophobicContact CE1-CD2 3.89Å; Y367-L417 HydrophobicContact CE2-CD2 4.23Å; Y367-L417 HydrophobicContact CG-CD1 3.6Å
368	T	78.8	Confident	80.8	Confident	53 Å²	53	59.6 Å²	59.6	33%	0.325	30%	0.3	S	S	.	.			trans	-116.8	-14.4	-169.8	49	0	0	0	0	115.6	N353 W366 F370	N353-T368 VanDerWaalsContact OD1-CA 3.27Å; N353-T368 WeakPolarHBondContact OD1-CA 3.11Å; N353-T368 WeakPolarHBondContact OD1-CB 3.41Å; N353-T368 WeakPolarHBondContact OD1-CG2 3.24Å; W366-T368 HydrophobicContact CD2-CG2 3.97Å; W366-T368 HydrophobicContact CE3-CG2 3.23Å; W366-T368 HydrophobicContact CH2-CG2 3.54Å; W366-T368 HydrophobicContact CZ2-CG2 4.22Å; W366-T368 HydrophobicContact CZ3-CG2 3Å; T368-F370 PolarHBondContact O-N 3.49Å
369	D	67.1	Low	81	Confident	119 Å²	119	58 Å²	58	64%	0.636	29%	0.292	S	S	*	.			trans	-84.8	26	-164.9	-57.4	-22.1	0	0	0	113.5	N371 I424	D369-N371 VanDerWaalsContact C-N 3.32Å; D369-N371 PolarHBondContact O-N 3.07Å; D369-N371 VanDerWaalsContact O-N 3.15Å; D369-I424 HydrophobicContact CB-CD1 3.87Å
370	F	65.8	Low	81.3	Confident	3 Å²	3	55.9 Å²	55.9	1%	0.013	28%	0.282	C	S	.	.	S	Bend	trans	-87.6	55.4	-179.5	-63	-81.6	0	0	0	112.7	G352 V354 T368 Q372 D373 F405 T407 M415 L417 I424	G352-F370 VanDerWaalsContact O-CB 3.24Å; G352-F370 WeakPolarHBondContact O-CB 3.39Å; G352-F370 WeakPolarHBondContact O-CD2 3.28Å; G352-F370 WeakPolarHBondContact O-CG 3.42Å; V354-F370 HydrophobicContact CB-CE2 4.13Å; V354-F370 HydrophobicContact CG2-CD2 4.35Å; V354-F370 HydrophobicContact CG2-CE2 3.73Å; V354-F370 HydrophobicContact CG2-CZ 4.12Å; T368-F370 PolarHBondContact O-N 3.49Å; F370-Q372 PolarHBondContact O-N 3.48Å; F370-D373 PolarHBondContact O-N 2.8Å; F370-F405 HydrophobicContact CZ-CE2 4.01Å; F370-F405 HydrophobicContact CZ-CZ 4.32Å; F370-T407 HydrophobicContact CE1-CG2 4.13Å; F370-T407 HydrophobicContact CZ-CG2 4.25Å; F370-M415 HydrophobicContact CD1-CB 3.87Å; F370-M415 HydrophobicContact CD1-CG 4.05Å; F370-M415 HydrophobicContact CE1-CB 3.99Å; F370-L417 HydrophobicContact CE1-CD1 4.42Å; F370-L417 HydrophobicContact CE2-CD1 4.27Å; F370-L417 HydrophobicContact CZ-CB 4.43Å; F370-L417 HydrophobicContact CZ-CD1 3.63Å; F370-I424 HydrophobicContact CD1-CD1 4.39Å; F370-I424 HydrophobicContact CD1-CG2 3.86Å; F370-I424 HydrophobicContact CD2-CD1 4.23Å; F370-I424 HydrophobicContact CE1-CD1 4.14Å; F370-I424 HydrophobicContact CE1-CG2 3.7Å; F370-I424 HydrophobicContact CE2-CD1 4Å; F370-I424 HydrophobicContact CG-CD1 4.44Å; F370-I424 HydrophobicContact CZ-CD1 3.95Å; F370-I424 HydrophobicContact CZ-CG2 4.44Å
371	N	63.8	Low	81.4	Confident	101 Å²	101	50.5 Å²	50.5	54%	0.54	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.8	20.1	165.8	-75.4	-25.8	0	0	0	118.7	D369 D373	D369-N371 VanDerWaalsContact C-N 3.32Å; D369-N371 PolarHBondContact O-N 3.07Å; D369-N371 VanDerWaalsContact O-N 3.15Å; N371-D373 VanDerWaalsContact C-N 3.31Å; N371-D373 PolarHBondContact O-N 3.34Å
372	Q	66.2	Low	81.3	Confident	170 Å²	170	52.9 Å²	52.9	79%	0.794	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	22.1	177.5	-55.4	178.9	0.4	0	0	116.5	Q351 F370	Q351-Q372 WeakPolarHBondContact O-CA 3.34Å; F370-Q372 PolarHBondContact O-N 3.48Å
373	D	78.8	Confident	80.9	Confident	20 Å²	20	50.6 Å²	50.6	11%	0.107	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-98.3	139	175.1	-72.7	-42	0	0	0	111.2	G352 F370 N371 V375 T409 N411 K413	G352-D373 WeakPolarHBondContact CA-O 3.45Å; G352-D373 PolarHBondContact N-O 2.83Å; F370-D373 PolarHBondContact O-N 2.8Å; N371-D373 VanDerWaalsContact C-N 3.31Å; N371-D373 PolarHBondContact O-N 3.34Å; D373-V375 PolarHBondContact O-N 3.26Å; D373-T409 HydrophobicContact CB-CG2 3.98Å; D373-N411 PolarHBondContact OD1-ND2 3.29Å; D373-K413 IonicContact OD2-NZ 3.32Å; D373-K413 PolarHBondContact OD2-NZ 3.36Å
374	P	84.1	Confident	80.3	Confident	18 Å²	18	51.3 Å²	51.3	12%	0.117	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-55.6	130.5	175.9	-23.8	28.5	0	0	0	113.2	F280 I350 T409 I410	F280-P374 HydrophobicContact CZ-CG 3.98Å; I350-P374 WeakPolarHBondContact O-CA 3.46Å; I350-P374 WeakPolarHBondContact O-CD 3.31Å; I350-P374 WeakPolarHBondContact O-CG 3.25Å; P374-T409 WeakPolarHBondContact O-CA 3.35Å; P374-I410 HydrophobicContact CB-CG2 4.37Å; P374-I410 HydrophobicContact CG-CG2 4.08Å; P374-I410 PolarHBondContact O-N 2.98Å
375	V	86.9	Confident	79.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.9	174.9	-171.4	0	0	0	0	109.5	T336 V337 D349 G352 V354 D373 I378	T336-V375 WeakPolarHBondContact CB-O 3.16Å; T336-V375 PolarHBondContact OG1-O 2.93Å; V337-V375 HydrophobicContact CG2-CG1 4.19Å; V337-V375 WeakPolarHBondContact CG2-O 3.18Å; D349-V375 PolarHBondContact O-N 2.8Å; G352-V375 WeakPolarHBondContact O-CG2 3.48Å; V354-V375 HydrophobicContact CG2-CG2 4.48Å; D373-V375 PolarHBondContact O-N 3.26Å; V375-I378 HydrophobicContact CG1-CD1 4.25Å; V375-I378 HydrophobicContact CG1-CG1 3.75Å
376	V	84.9	Confident	78.4	Confident	20 Å²	20	55.7 Å²	55.7	12%	0.121	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-36	177.6	179.9	0	0	0	0	111.6	P79 L285 V337 S408 I410	P79-V376 WeakPolarHBondContact O-CG1 3.43Å; L285-V376 HydrophobicContact CD1-CG1 4.42Å; L285-V376 HydrophobicContact CD1-CG2 4.39Å; V337-V376 WeakPolarHBondContact CG2-O 3.37Å; V376-S408 PolarHBondContact N-O 3.16Å; V376-I410 HydrophobicContact CG2-CB 4.07Å
377	Y	86.4	Confident	77	Confident	35 Å²	35	56.2 Å²	56.2	14%	0.137	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	151.1	178.3	-158.7	-110.6	0	0	0	112.3	P82 V83 Y84 R287 T407 S408	P82-Y377 HydrophobicContact CB-CD1 3.82Å; P82-Y377 HydrophobicContact CB-CD2 3.95Å; P82-Y377 HydrophobicContact CB-CE1 3.68Å; P82-Y377 HydrophobicContact CB-CE2 3.89Å; P82-Y377 HydrophobicContact CB-CG 3.93Å; V83-Y377 WeakPolarHBondContact O-CD1 3.49Å; V83-Y377 VanDerWaalsContact O-CE1 3.25Å; V83-Y377 WeakPolarHBondContact O-CE1 3.26Å; Y84-Y377 HydrophobicContact CD1-CE1 4.25Å; Y84-Y377 AromaticContact CE1-CE1 3.98Å; Y84-Y377 HydrophobicContact CE1-CE1 3.98Å; Y84-Y377 AromaticContact CE1-CZ 3.96Å; Y84-Y377 WeakPolarHBondContact CE1-OH 3.48Å; Y84-Y377 PolarHBondContact OH-OH 3.18Å; R287-Y377 VanDerWaalsContact NH1-CE2 3.27Å; Y377-T407 VanDerWaalsContact O-CA 3.31Å; Y377-T407 WeakPolarHBondContact O-CA 3.49Å; Y377-S408 VanDerWaalsContact CB-OG 3.22Å; Y377-S408 WeakPolarHBondContact CB-OG 3.44Å; Y377-S408 PolarHBondContact N-O 3.36Å; Y377-S408 PolarHBondContact N-OG 3.2Å; Y377-S408 PolarHBondContact O-N 2.97Å
378	I	89.6	Confident	75.1	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.5	174.7	-55.2	175.5	0	0	0	107.4	V337 T339 V346 V354 V375 F380 F405 I406 T407	V337-I378 HydrophobicContact CB-CD1 4.45Å; V337-I378 HydrophobicContact CG1-CD1 4.26Å; V337-I378 HydrophobicContact CG1-CG1 4.16Å; T339-I378 HydrophobicContact CG2-CB 4.29Å; V346-I378 HydrophobicContact CG1-CD1 4.14Å; V354-I378 HydrophobicContact CG1-CD1 3.98Å; V354-I378 HydrophobicContact CG2-CD1 4.05Å; V375-I378 HydrophobicContact CG1-CD1 4.25Å; V375-I378 HydrophobicContact CG1-CG1 3.75Å; I378-F380 HydrophobicContact CG2-CD2 4.45Å; I378-F380 HydrophobicContact CG2-CE1 4.43Å; I378-F380 HydrophobicContact CG2-CE2 3.65Å; I378-F380 HydrophobicContact CG2-CZ 3.64Å; I378-F405 HydrophobicContact CG2-CB 4.44Å; I378-F405 HydrophobicContact CG2-CD2 3.92Å; I378-F405 HydrophobicContact CG2-CG 4.36Å; I378-I406 WeakPolarHBondContact CA-O 3.49Å; I378-T407 HydrophobicContact CG1-CG2 4.13Å; I378-T407 HydrophobicContact CG2-CG2 4.44Å
379	S	90.4	Very high	73.3	Confident	5 Å²	5	64 Å²	64	4%	0.035	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.8	177.9	-173.4	0	0	0	0	111.2	V83 Y84 S85 F405 I406	V83-S379 WeakPolarHBondContact O-CB 3.36Å; Y84-S379 WeakPolarHBondContact CA-OG 3.49Å; S85-S379 PolarHBondContact N-OG 2.76Å; S379-F405 CarbonylContact O-C 3.49Å; S379-F405 VanDerWaalsContact O-CA 3.27Å; S379-F405 WeakPolarHBondContact O-CA 3.3Å; S379-F405 VanDerWaalsContact O-CB 3.32Å; S379-F405 WeakPolarHBondContact O-CB 3.41Å; S379-I406 PolarHBondContact N-O 3.1Å; S379-I406 PolarHBondContact O-N 2.77Å
380	F	89.8	Confident	72.1	Confident	16 Å²	16	67.2 Å²	67.2	7%	0.07	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	142	-179.5	-62.1	-89.4	0	0	0	111.2	R131 T339 T341 V346 F356 I378 R403 F405	R131-F380 PolarHBondContact NH2-O 3.2Å; R131-F380 VanDerWaalsContact NH2-O 3.1Å; T339-F380 HydrophobicContact CG2-CE2 3.7Å; T339-F380 HydrophobicContact CG2-CZ 4.34Å; T341-F380 HydrophobicContact CG2-CB 4.12Å; T341-F380 HydrophobicContact CG2-CD1 3.8Å; T341-F380 HydrophobicContact CG2-CD2 4.1Å; T341-F380 HydrophobicContact CG2-CE1 4.29Å; T341-F380 HydrophobicContact CG2-CG 3.7Å; T341-F380 WeakPolarHBondContact OG1-CD2 3.48Å; T341-F380 WeakPolarHBondContact OG1-CE2 3.46Å; T341-F380 WeakPolarHBondContact OG1-CG 3.23Å; T341-F380 WeakPolarHBondContact OG1-CZ 3.47Å; V346-F380 HydrophobicContact CB-CZ 4.19Å; V346-F380 HydrophobicContact CG1-CZ 4.1Å; V346-F380 HydrophobicContact CG2-CZ 3.83Å; F356-F380 HydrophobicContact CE1-CE1 4.01Å; F356-F380 HydrophobicContact CE1-CZ 4.35Å; F356-F380 HydrophobicContact CZ-CE1 4.1Å; F356-F380 HydrophobicContact CZ-CZ 4.49Å; I378-F380 HydrophobicContact CG2-CD2 4.45Å; I378-F380 HydrophobicContact CG2-CE1 4.43Å; I378-F380 HydrophobicContact CG2-CE2 3.65Å; I378-F380 HydrophobicContact CG2-CZ 3.64Å; F380-R403 HydrophobicContact CD1-CB 4.39Å; F380-F405 HydrophobicContact CD1-CB 3.6Å; F380-F405 HydrophobicContact CD1-CD1 4.29Å; F380-F405 HydrophobicContact CD1-CG 4.25Å; F380-F405 HydrophobicContact CE1-CB 3.8Å; F380-F405 AromaticContact CE1-CD1 3.88Å; F380-F405 HydrophobicContact CE1-CD1 3.88Å; F380-F405 AromaticContact CE1-CG 3.97Å; F380-F405 HydrophobicContact CE1-CG 3.97Å; F380-F405 HydrophobicContact CG-CB 4.18Å
381	S	86.3	Confident	71	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.021	37%	0.372	C	S	.	.			trans	-59.5	148	167	57	0	0	0	0	110.5	R403 N404	S381-R403 WeakPolarHBondContact O-CD 3.47Å; S381-R403 PolarHBondContact O-NH1 2.8Å; S381-N404 WeakPolarHBondContact CB-O 3.34Å; S381-N404 PolarHBondContact N-O 2.78Å; S381-N404 PolarHBondContact OG-N 3.3Å; S381-N404 PolarHBondContact OG-O 2.87Å
382	K	81.6	Confident	69.7	Low	83 Å²	83	77.9 Å²	77.9	36%	0.361	39%	0.385	S	S	.	.	S	Bend	trans	-77.4	-34.4	178.3	-173.1	65.6	-176.7	-161.3	0	111.8	E129 R131 R403	E129-K382 WeakPolarHBondContact O-CD 3.48Å; E129-K382 WeakPolarHBondContact O-CE 3.21Å; E129-K382 PolarHBondContact O-NZ 3.39Å; E129-K382 IonicContact OE1-NZ 2.68Å; E129-K382 PolarHBondContact OE1-NZ 3.12Å; R131-K382 HydrophobicContact CG-CB 4.12Å; K382-R403 PolarHBondContact O-NH1 3.37Å
383	E	76.6	Confident	68.6	Low	65 Å²	65	80.5 Å²	80.5	30%	0.304	39%	0.389	S	S	.	.	S	Bend	trans	-76.5	141.5	-177.4	-63.2	166.1	141.9	0	0	110.3	S89	S89-E383 WeakPolarHBondContact CA-OE2 3.41Å; S89-E383 VanDerWaalsContact CB-CD 3.48Å; S89-E383 WeakPolarHBondContact CB-OE1 3.09Å; S89-E383 WeakPolarHBondContact CB-OE2 3.42Å; S89-E383 PolarHBondContact N-OE2 3.1Å; S89-E383 PolarHBondContact OG-OE1 3.14Å; S89-E383 PolarHBondContact OG-OE2 3.31Å
384	L	71.7	Confident	66.8	Low	104 Å²	104	88.4 Å²	88.4	55%	0.545	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-77.9	139.7	167	-76.9	156.6	0	0	0	108.1	K386 I401 R403	L384-K386 PolarHBondContact O-N 3.15Å; L384-I401 HydrophobicContact CD2-CG2 3.87Å; L384-R403 HydrophobicContact CD2-CG 4.16Å
385	P	66.1	Low	64.9	Low	21 Å²	21	95.5 Å²	95.5	14%	0.136	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-56.8	130.1	177.2	-19.6	29.9	0	0	0	110.8	E387 I401 Q420	P385-E387 PolarHBondContact O-N 3.45Å; P385-I401 HydrophobicContact CG-CG2 4.49Å; P385-Q420 HydrophobicContact CB-CG 3.51Å; P385-Q420 HydrophobicContact CG-CG 4.29Å
386	K	63.8	Low	62.7	Low	150 Å²	150	103.4 Å²	103.4	65%	0.652	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-67.7	122.9	179	-66.6	175.3	-176.3	165.2	0	109	L384 T388 Q420	L384-K386 PolarHBondContact O-N 3.15Å; K386-T388 PolarHBondContact O-N 3.16Å; K386-Q420 PolarHBondContact O-NE2 2.97Å
387	E	54.7	Low	60.8	Low	152 Å²	152	108.4 Å²	108.4	71%	0.71	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-58.8	118.9	178.6	-67.9	-176.5	171.6	0	0	110.7	P385	P385-E387 PolarHBondContact O-N 3.45Å
388	T	44.2	Very low	59	Low	107 Å²	107	114.2 Å²	114.2	66%	0.656	56%	0.561	S	S	*	*			trans	-93.6	115.8	165.9	43.7	0	0	0	0	109.1	K386	K386-T388 PolarHBondContact O-N 3.16Å
389	N	40.9	Very low	57.4	Low	150 Å²	150	118.2 Å²	118.2	80%	0.802	59%	0.587	S	S	*	*			trans	100.3	100.3	166.4	-52.6	-20.8	0	0	0	116.1	E391	N389-E391 PolarHBondContact O-N 3.22Å; N389-E391 VanDerWaalsContact O-N 3.14Å
390	E	40.8	Very low	56.2	Low	186 Å²	186	122.1 Å²	122.1	87%	0.869	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	21.3	171.1	-70.9	-167.1	148	0	0	115
391	E	42.7	Very low	55.1	Low	175 Å²	175	124.6 Å²	124.6	82%	0.818	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	1.5	-170.1	-72.5	-160.1	166.8	0	0	118.9	N389	N389-E391 PolarHBondContact O-N 3.22Å; N389-E391 VanDerWaalsContact O-N 3.14Å
392	D	37.5	Very low	54.8	Low	153 Å²	153	125 Å²	125	82%	0.818	62%	0.622	S	S	*	*			trans	-125	72.5	175.9	-77.1	-39.7	0	0	0	113.2	F394	D392-F394 PolarHBondContact O-N 3.38Å
393	Y	43.3	Very low	55	Low	224 Å²	224	122.7 Å²	122.7	88%	0.878	61%	0.611	S	S	*	*			trans	-75.5	101.6	162.4	-82.7	-80.9	0	0	0	110.4
394	F	40.4	Very low	55.5	Low	187 Å²	187	120.2 Å²	120.2	82%	0.82	60%	0.6	S	S	*	*			trans	-120.8	111.6	153.9	-86.1	-78.8	0	0	0	110.8	D392	D392-F394 PolarHBondContact O-N 3.38Å
395	Q	44.2	Very low	56.3	Low	166 Å²	166	115.3 Å²	115.3	78%	0.776	57%	0.574	S	S	*	*	S	Bend	trans	23.3	120.6	159.1	-74.6	176.5	-35.7	0	0	121.8	V397	Q395-V397 PolarHBondContact O-N 2.79Å
396	D	40.2	Very low	57.5	Low	166 Å²	166	114.4 Å²	114.4	89%	0.888	57%	0.568	S	S	*	*	S	Bend	trans	55.7	30.4	143.5	-61	-17.5	0	0	0	119.5
397	V	45.7	Very low	58.7	Low	125 Å²	125	107.3 Å²	107.3	76%	0.758	54%	0.538	S	S	*	.			trans	-126.4	117.7	164.3	-173.8	0	0	0	0	108.7	Q395 P399	Q395-V397 PolarHBondContact O-N 2.79Å; V397-P399 WeakPolarHBondContact O-CD 3.24Å
398	D	48	Very low	60.3	Low	157 Å²	157	100.1 Å²	100.1	84%	0.84	50%	0.504	S	S	*	.			trans	-54.9	121.2	171.4	-71	-31.7	0	0	0	108.4	L400	D398-L400 PolarHBondContact O-N 3.26Å
399	P	55.9	Low	62.3	Low	88 Å²	88	95.2 Å²	95.2	57%	0.571	47%	0.474	S	S	*	.			trans	-61.4	136.3	-176.4	22.4	-31.3	0	0	0	110.6	V397 I401	V397-P399 WeakPolarHBondContact O-CD 3.24Å; P399-I401 HydrophobicContact CB-CG1 4.35Å; P399-I401 HydrophobicContact CG-CD1 4.27Å; P399-I401 HydrophobicContact CG-CG1 4.4Å; P399-I401 PolarHBondContact O-N 2.88Å
400	L	65.6	Low	64.2	Low	87 Å²	87	89.6 Å²	89.6	46%	0.455	44%	0.443	S	S	.	.			trans	-71.1	89.3	175.8	179.3	68.3	0	0	0	109.5	Y344 V364 D398 I402	Y344-L400 HydrophobicContact CE1-CD1 4.2Å; Y344-L400 HydrophobicContact CE2-CD1 4.24Å; Y344-L400 WeakPolarHBondContact OH-CD1 3.49Å; V364-L400 HydrophobicContact CG1-CD1 3.51Å; V364-L400 HydrophobicContact CG1-CD2 3.83Å; V364-L400 HydrophobicContact CG1-CG 4.34Å; D398-L400 PolarHBondContact O-N 3.26Å; L400-I402 HydrophobicContact CD1-CD1 4.33Å; L400-I402 HydrophobicContact CD1-CG1 4.14Å; L400-I402 HydrophobicContact CD2-CD1 4.09Å; L400-I402 HydrophobicContact CG-CD1 4.15Å; L400-I402 HydrophobicContact CG-CG1 4.05Å; L400-I402 PolarHBondContact O-N 3.38Å
401	I	67.1	Low	65.9	Low	67 Å²	67	84.6 Å²	84.6	34%	0.344	42%	0.422	S	S	.	.			trans	-94	99.8	177.2	-56.5	172.4	0	0	0	108.6	L384 P385 P399	L384-I401 HydrophobicContact CD2-CG2 3.87Å; P385-I401 HydrophobicContact CG-CG2 4.49Å; P399-I401 HydrophobicContact CB-CG1 4.35Å; P399-I401 HydrophobicContact CG-CD1 4.27Å; P399-I401 HydrophobicContact CG-CG1 4.4Å; P399-I401 PolarHBondContact O-N 2.88Å
402	I	79.4	Confident	67.8	Low	12 Å²	12	76.2 Å²	76.2	6%	0.062	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-96.2	134.4	170.9	-57	174.7	0	0	0	107.9	F356 L400 T419	F356-I402 HydrophobicContact CD1-CD1 4.16Å; F356-I402 HydrophobicContact CD1-CG2 4.19Å; F356-I402 HydrophobicContact CD2-CD1 4.36Å; F356-I402 HydrophobicContact CE1-CD1 4.37Å; F356-I402 HydrophobicContact CE1-CG2 3.46Å; F356-I402 VanDerWaalsContact CE1-CG2 3.46Å; F356-I402 HydrophobicContact CE2-CG2 4.48Å; F356-I402 HydrophobicContact CG-CD1 4.17Å; F356-I402 HydrophobicContact CZ-CG2 3.64Å; L400-I402 HydrophobicContact CD1-CD1 4.33Å; L400-I402 HydrophobicContact CD1-CG1 4.14Å; L400-I402 HydrophobicContact CD2-CD1 4.09Å; L400-I402 HydrophobicContact CG-CD1 4.15Å; L400-I402 HydrophobicContact CG-CG1 4.05Å; L400-I402 PolarHBondContact O-N 3.38Å; I402-T419 HydrophobicContact CB-CG2 3.99Å; I402-T419 HydrophobicContact CG2-CG2 3.81Å; I402-T419 WeakPolarHBondContact O-CB 3.28Å; I402-T419 PolarHBondContact O-OG1 2.84Å
403	R	85.2	Confident	70.1	Confident	35 Å²	35	70.5 Å²	70.5	13%	0.132	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-67.1	146.9	174.6	-54.1	-171.1	-170.6	-152.9	-5.7	111.4	D342 F380 S381 K382 L384 T419	D342-R403 IonicContact OD1-CZ 3.72Å; D342-R403 IonicContact OD1-NE 2.78Å; D342-R403 PolarHBondContact OD1-NE 3.47Å; D342-R403 IonicContact OD1-NH2 3.3Å; D342-R403 PolarHBondContact OD1-NH2 3.46Å; D342-R403 IonicContact OD2-CZ 3.32Å; D342-R403 IonicContact OD2-NE 3.61Å; D342-R403 PolarHBondContact OD2-NE 2.7Å; D342-R403 IonicContact OD2-NH2 3.71Å; F380-R403 HydrophobicContact CD1-CB 4.39Å; S381-R403 WeakPolarHBondContact O-CD 3.47Å; S381-R403 PolarHBondContact O-NH1 2.8Å; K382-R403 PolarHBondContact O-NH1 3.37Å; L384-R403 HydrophobicContact CD2-CG 4.16Å; R403-T419 VanDerWaalsContact O-CG2 3.32Å; R403-T419 WeakPolarHBondContact O-CG2 3.43Å
404	N	87.8	Confident	72.3	Confident	13 Å²	13	59.9 Å²	59.9	7%	0.07	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59.1	146.9	168.2	-66.9	-13.2	0	0	0	110	D88 S381 L417 N418 T419	D88-N404 WeakPolarHBondContact OD2-CB 3.06Å; D88-N404 VanDerWaalsContact OD2-CG 3.27Å; D88-N404 PolarHBondContact OD2-ND2 2.64Å; S381-N404 WeakPolarHBondContact CB-O 3.34Å; S381-N404 PolarHBondContact N-O 2.78Å; S381-N404 PolarHBondContact OG-N 3.3Å; S381-N404 PolarHBondContact OG-O 2.87Å; N404-L417 WeakPolarHBondContact CA-O 3.46Å; N404-N418 WeakPolarHBondContact OD1-CA 3.39Å; N404-T419 PolarHBondContact OD1-N 3.03Å; N404-T419 PolarHBondContact OD1-OG1 2.82Å
405	F	89.3	Confident	74.5	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.5	-178	64.2	-93	0	0	0	112.5	V354 F356 Y367 F370 I378 S379 F380 T407 L417 T419	V354-F405 HydrophobicContact CB-CE2 4.46Å; V354-F405 HydrophobicContact CB-CZ 4.37Å; V354-F405 HydrophobicContact CG1-CE2 4.17Å; V354-F405 HydrophobicContact CG1-CZ 4.01Å; V354-F405 HydrophobicContact CG2-CE2 4.23Å; F356-F405 AromaticContact CE2-CE1 3.96Å; F356-F405 HydrophobicContact CE2-CE1 3.96Å; F356-F405 HydrophobicContact CE2-CZ 4.24Å; F356-F405 HydrophobicContact CZ-CD1 4.14Å; F356-F405 AromaticContact CZ-CE1 3.61Å; F356-F405 HydrophobicContact CZ-CE1 3.61Å; F356-F405 HydrophobicContact CZ-CZ 4.22Å; Y367-F405 HydrophobicContact CD2-CE1 4.47Å; Y367-F405 HydrophobicContact CD2-CZ 4.17Å; Y367-F405 HydrophobicContact CE2-CE1 4.28Å; Y367-F405 HydrophobicContact CE2-CZ 4.43Å; F370-F405 HydrophobicContact CZ-CE2 4.01Å; F370-F405 HydrophobicContact CZ-CZ 4.32Å; I378-F405 HydrophobicContact CG2-CB 4.44Å; I378-F405 HydrophobicContact CG2-CD2 3.92Å; I378-F405 HydrophobicContact CG2-CG 4.36Å; S379-F405 CarbonylContact O-C 3.49Å; S379-F405 VanDerWaalsContact O-CA 3.27Å; S379-F405 WeakPolarHBondContact O-CA 3.3Å; S379-F405 VanDerWaalsContact O-CB 3.32Å; S379-F405 WeakPolarHBondContact O-CB 3.41Å; F380-F405 HydrophobicContact CD1-CB 3.6Å; F380-F405 HydrophobicContact CD1-CD1 4.29Å; F380-F405 HydrophobicContact CD1-CG 4.25Å; F380-F405 HydrophobicContact CE1-CB 3.8Å; F380-F405 AromaticContact CE1-CD1 3.88Å; F380-F405 HydrophobicContact CE1-CD1 3.88Å; F380-F405 AromaticContact CE1-CG 3.97Å; F380-F405 HydrophobicContact CE1-CG 3.97Å; F380-F405 HydrophobicContact CG-CB 4.18Å; F405-T407 HydrophobicContact CD2-CG2 3.62Å; F405-T407 HydrophobicContact CE2-CG2 3.52Å; F405-L417 HydrophobicContact CD1-CD2 4.3Å; F405-L417 HydrophobicContact CD2-CB 4.44Å; F405-L417 HydrophobicContact CE1-CB 4.23Å; F405-L417 HydrophobicContact CE1-CD2 3.59Å; F405-L417 HydrophobicContact CE1-CG 4.31Å; F405-L417 HydrophobicContact CE2-CB 4.07Å; F405-L417 HydrophobicContact CZ-CB 3.96Å; F405-L417 HydrophobicContact CZ-CD1 3.95Å; F405-L417 HydrophobicContact CZ-CD2 3.88Å; F405-L417 HydrophobicContact CZ-CG 4.14Å; F405-L417 PolarHBondContact N-O 3.11Å; F405-L417 PolarHBondContact O-N 3.37Å; F405-T419 HydrophobicContact CD1-CG2 4.27Å; F405-T419 HydrophobicContact CE1-CG2 4.21Å
406	I	91.1	Very high	76.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	138.1	175.8	-61.4	176.2	0	0	0	108.1	V83 L92 F94 I378 S379 I414 M415 H416	V83-I406 HydrophobicContact CG1-CG2 4.18Å; L92-I406 HydrophobicContact CD1-CD1 3.83Å; L92-I406 HydrophobicContact CD1-CG1 4.41Å; F94-I406 HydrophobicContact CB-CD1 3.64Å; F94-I406 HydrophobicContact CD1-CD1 4.14Å; F94-I406 HydrophobicContact CG-CD1 4.11Å; I378-I406 WeakPolarHBondContact CA-O 3.49Å; S379-I406 PolarHBondContact N-O 3.1Å; S379-I406 PolarHBondContact O-N 2.77Å; I406-I414 HydrophobicContact CG2-CG2 3.23Å; I406-M415 CarbonylContact C-O 3.59Å; I406-M415 VanDerWaalsContact CA-O 3.29Å; I406-M415 WeakPolarHBondContact CA-O 3.48Å; I406-H416 HydrophobicContact CG1-CB 4.42Å
407	T	88.4	Confident	79	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	142.6	172.4	66.4	0	0	0	0	110.7	V354 F370 Y377 I378 F405 I414 M415	V354-T407 HydrophobicContact CG2-CG2 4.09Å; F370-T407 HydrophobicContact CE1-CG2 4.13Å; F370-T407 HydrophobicContact CZ-CG2 4.25Å; Y377-T407 VanDerWaalsContact O-CA 3.31Å; Y377-T407 WeakPolarHBondContact O-CA 3.49Å; I378-T407 HydrophobicContact CG1-CG2 4.13Å; I378-T407 HydrophobicContact CG2-CG2 4.44Å; F405-T407 HydrophobicContact CD2-CG2 3.62Å; F405-T407 HydrophobicContact CE2-CG2 3.52Å; T407-I414 WeakPolarHBondContact O-CA 3.47Å; T407-M415 PolarHBondContact N-O 2.99Å; T407-M415 PolarHBondContact O-N 2.75Å
408	S	88.3	Confident	80.8	Confident	1 Å²	1	32 Å²	32	1%	0.007	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	142.5	169.2	70.6	0	0	0	0	110.4	V376 Y377 K413	V376-S408 PolarHBondContact N-O 3.16Å; Y377-S408 VanDerWaalsContact CB-OG 3.22Å; Y377-S408 WeakPolarHBondContact CB-OG 3.44Å; Y377-S408 PolarHBondContact N-O 3.36Å; Y377-S408 PolarHBondContact N-OG 3.2Å; Y377-S408 PolarHBondContact O-N 2.97Å; S408-K413 WeakPolarHBondContact CA-O 3.33Å
409	T	85.8	Confident	82.2	Confident	3 Å²	3	25.8 Å²	25.8	2%	0.018	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	163.9	178.3	75.3	0	0	0	0	112.1	D373 P374 N411 A412 K413	D373-T409 HydrophobicContact CB-CG2 3.98Å; P374-T409 WeakPolarHBondContact O-CA 3.35Å; T409-N411 PolarHBondContact O-N 3.12Å; T409-A412 PolarHBondContact O-N 2.82Å; T409-A412 VanDerWaalsContact O-N 3.12Å; T409-K413 HydrophobicContact CG2-CB 4.48Å; T409-K413 PolarHBondContact N-O 3.24Å; T409-K413 WeakPolarHBondContact OG1-CB 3.46Å; T409-K413 PolarHBondContact OG1-N 3.18Å
410	I	81.2	Confident	83.2	Confident	32 Å²	32	25.9 Å²	25.9	16%	0.164	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.7	178.5	-163.8	167.1	0	0	0	113.2	P79 L283 P374 V376 A412	P79-I410 WeakPolarHBondContact CB-O 3.1Å; L283-I410 HydrophobicContact CD2-CD1 4.4Å; P374-I410 HydrophobicContact CB-CG2 4.37Å; P374-I410 HydrophobicContact CG-CG2 4.08Å; P374-I410 PolarHBondContact O-N 2.98Å; V376-I410 HydrophobicContact CG2-CB 4.07Å; I410-A412 PolarHBondContact O-N 3.44Å
411	N	76.9	Confident	83.7	Confident	81 Å²	81	25.8 Å²	25.8	43%	0.433	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	25.7	178.9	-72.4	-23.4	0	0	0	112.6	D373 T409 K413	D373-N411 PolarHBondContact OD1-ND2 3.29Å; T409-N411 PolarHBondContact O-N 3.12Å; N411-K413 PolarHBondContact O-N 3.36Å; N411-K413 VanDerWaalsContact O-N 3.16Å
412	A	81.9	Confident	84.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	53.8	34.1	178.2	0	0	0	0	0	114.9	M77 P79 T409 I410 N430	M77-A412 HydrophobicContact CB-CB 4.37Å; M77-A412 VanDerWaalsContact CE-C 3.44Å; M77-A412 HydrophobicContact CE-CB 3.7Å; M77-A412 WeakPolarHBondContact CE-O 3.39Å; P79-A412 HydrophobicContact CB-CB 4.21Å; T409-A412 PolarHBondContact O-N 2.82Å; T409-A412 VanDerWaalsContact O-N 3.12Å; I410-A412 PolarHBondContact O-N 3.44Å; A412-N430 WeakPolarHBondContact CB-O 3.27Å; A412-N430 PolarHBondContact O-N 3.21Å
413	K	86.4	Confident	84.2	Confident	33 Å²	33	27.2 Å²	27.2	14%	0.143	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	141.1	169.4	-57.1	177.6	-171.7	153.1	0	110	D373 S408 T409 N411 L428 Q429	D373-K413 IonicContact OD2-NZ 3.32Å; D373-K413 PolarHBondContact OD2-NZ 3.36Å; S408-K413 WeakPolarHBondContact CA-O 3.33Å; T409-K413 HydrophobicContact CG2-CB 4.48Å; T409-K413 PolarHBondContact N-O 3.24Å; T409-K413 WeakPolarHBondContact OG1-CB 3.46Å; T409-K413 PolarHBondContact OG1-N 3.18Å; N411-K413 PolarHBondContact O-N 3.36Å; N411-K413 VanDerWaalsContact O-N 3.16Å; K413-L428 WeakPolarHBondContact CA-O 3.43Å; K413-Q429 HydrophobicContact CG-CG 4.12Å
414	I	88.6	Confident	84.1	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.3	172.6	-57.1	179	0	0	0	107.7	M77 V83 F94 Y96 I406 T407 V427 L428	M77-I414 HydrophobicContact CE-CD1 4.39Å; M77-I414 HydrophobicContact CE-CG1 3.94Å; M77-I414 HydrophobicContact SD-CD1 3.61Å; M77-I414 HydrophobicContact SD-CG1 3.84Å; V83-I414 HydrophobicContact CG1-CD1 4.05Å; V83-I414 HydrophobicContact CG1-CG2 4.46Å; V83-I414 HydrophobicContact CG2-CD1 4.23Å; V83-I414 HydrophobicContact CG2-CG1 4.44Å; F94-I414 HydrophobicContact CD2-CD1 3.88Å; F94-I414 HydrophobicContact CE2-CD1 3.27Å; F94-I414 HydrophobicContact CE2-CG2 4.49Å; F94-I414 HydrophobicContact CZ-CD1 3.95Å; Y96-I414 HydrophobicContact CD1-CD1 4.48Å; I406-I414 HydrophobicContact CG2-CG2 3.23Å; T407-I414 WeakPolarHBondContact O-CA 3.47Å; I414-V427 PolarHBondContact O-N 3.33Å; I414-L428 HydrophobicContact CB-CB 4.01Å; I414-L428 HydrophobicContact CD1-CB 4.07Å; I414-L428 HydrophobicContact CD1-CD2 3.73Å; I414-L428 HydrophobicContact CG1-CB 4.22Å; I414-L428 HydrophobicContact CG1-CD2 4.48Å; I414-L428 PolarHBondContact N-O 3.08Å; I414-L428 PolarHBondContact O-N 3.33Å
415	M	88.2	Confident	84	Confident	7 Å²	7	31.5 Å²	31.5	3%	0.034	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.8	177.8	-49.7	-67.3	-63.6	0	0	108.4	F370 I406 T407 I424 Q425 T426	F370-M415 HydrophobicContact CD1-CB 3.87Å; F370-M415 HydrophobicContact CD1-CG 4.05Å; F370-M415 HydrophobicContact CE1-CB 3.99Å; I406-M415 CarbonylContact C-O 3.59Å; I406-M415 VanDerWaalsContact CA-O 3.29Å; I406-M415 WeakPolarHBondContact CA-O 3.48Å; T407-M415 PolarHBondContact N-O 2.99Å; T407-M415 PolarHBondContact O-N 2.75Å; M415-I424 HydrophobicContact CB-CG2 4.4Å; M415-I424 HydrophobicContact CE-CG2 3.8Å; M415-Q425 CarbonylContact C-O 3.49Å; M415-Q425 WeakPolarHBondContact CA-O 3.25Å; M415-T426 VanDerWaalsContact CE-OG1 3.22Å; M415-T426 WeakPolarHBondContact CE-OG1 2.99Å; M415-T426 HydrophobicContact SD-CG2 3.77Å; M415-T426 PolarHBondContact SD-OG1 2.88Å
416	H	89.8	Confident	83.8	Confident	15 Å²	15	34.4 Å²	34.4	7%	0.069	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	136.6	170	172.6	-105.4	0	0	0	109.1	D88 L92 I406 Q425 V427	D88-H416 VanDerWaalsContact CG-NE2 3.32Å; D88-H416 IonicContact OD1-CD2 3.78Å; D88-H416 IonicContact OD1-CE1 2.71Å; D88-H416 PolarHBondContact OD1-CE1 3.4Å; D88-H416 IonicContact OD1-NE2 3.92Å; D88-H416 PolarHBondContact OD1-NE2 3.43Å; D88-H416 IonicContact OD2-CE1 3.71Å; D88-H416 IonicContact OD2-NE2 3.11Å; D88-H416 PolarHBondContact OD2-NE2 2.91Å; D88-H416 VanDerWaalsContact OD2-NE2 3.13Å; L92-H416 HydrophobicContact CD2-CB 3.98Å; I406-H416 HydrophobicContact CG1-CB 4.42Å; H416-Q425 PolarHBondContact N-O 3.42Å; H416-Q425 PolarHBondContact O-N 3.29Å; H416-V427 HydrophobicContact CB-CG2 3.38Å
417	L	87.9	Confident	83.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.5	174.8	-169.7	141	0	0	0	108.7	Y367 F370 N404 F405 T419 I424	Y367-L417 HydrophobicContact CD1-CD1 3.48Å; Y367-L417 VanDerWaalsContact CD1-CD1 3.48Å; Y367-L417 HydrophobicContact CD1-CD2 4.29Å; Y367-L417 HydrophobicContact CD1-CG 4.48Å; Y367-L417 HydrophobicContact CD2-CD1 4.18Å; Y367-L417 HydrophobicContact CE1-CD1 3.94Å; Y367-L417 HydrophobicContact CE1-CD2 3.89Å; Y367-L417 HydrophobicContact CE2-CD2 4.23Å; Y367-L417 HydrophobicContact CG-CD1 3.6Å; F370-L417 HydrophobicContact CE1-CD1 4.42Å; F370-L417 HydrophobicContact CE2-CD1 4.27Å; F370-L417 HydrophobicContact CZ-CB 4.43Å; F370-L417 HydrophobicContact CZ-CD1 3.63Å; N404-L417 WeakPolarHBondContact CA-O 3.46Å; F405-L417 HydrophobicContact CD1-CD2 4.3Å; F405-L417 HydrophobicContact CD2-CB 4.44Å; F405-L417 HydrophobicContact CE1-CB 4.23Å; F405-L417 HydrophobicContact CE1-CD2 3.59Å; F405-L417 HydrophobicContact CE1-CG 4.31Å; F405-L417 HydrophobicContact CE2-CB 4.07Å; F405-L417 HydrophobicContact CZ-CB 3.96Å; F405-L417 HydrophobicContact CZ-CD1 3.95Å; F405-L417 HydrophobicContact CZ-CD2 3.88Å; F405-L417 HydrophobicContact CZ-CG 4.14Å; F405-L417 PolarHBondContact N-O 3.11Å; F405-L417 PolarHBondContact O-N 3.37Å; L417-T419 HydrophobicContact CD2-CG2 3.54Å; L417-I424 HydrophobicContact CD1-CD1 3.64Å; L417-I424 HydrophobicContact CD1-CG1 3.62Å; L417-I424 HydrophobicContact CG-CG1 4.26Å
418	N	84.3	Confident	83.1	Confident	38 Å²	38	35.6 Å²	35.6	20%	0.203	20%	0.2	C	C	.	.			trans	-87.4	113.3	167.4	-176.8	-37.5	0	0	0	108.2	N404 Q420 T421 G422 V423	N404-N418 WeakPolarHBondContact OD1-CA 3.39Å; N418-Q420 VanDerWaalsContact C-N 3.3Å; N418-Q420 PolarHBondContact O-N 3.05Å; N418-Q420 WeakPolarHBondContact OD1-CB 3.18Å; N418-Q420 PolarHBondContact OD1-N 3.04Å; N418-T421 WeakPolarHBondContact CB-OG1 3.45Å; N418-T421 PolarHBondContact OD1-N 3.36Å; N418-G422 WeakPolarHBondContact O-CA 3.43Å; N418-G422 PolarHBondContact O-N 2.66Å; N418-V423 PolarHBondContact N-O 2.81Å
419	T	78	Confident	82.8	Confident	25 Å²	25	40.6 Å²	40.6	15%	0.153	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-23	-174.5	52.7	0	0	0	0	112.8	I402 R403 N404 F405 L417	I402-T419 HydrophobicContact CB-CG2 3.99Å; I402-T419 HydrophobicContact CG2-CG2 3.81Å; I402-T419 WeakPolarHBondContact O-CB 3.28Å; I402-T419 PolarHBondContact O-OG1 2.84Å; R403-T419 VanDerWaalsContact O-CG2 3.32Å; R403-T419 WeakPolarHBondContact O-CG2 3.43Å; N404-T419 PolarHBondContact OD1-N 3.03Å; N404-T419 PolarHBondContact OD1-OG1 2.82Å; F405-T419 HydrophobicContact CD1-CG2 4.27Å; F405-T419 HydrophobicContact CE1-CG2 4.21Å; L417-T419 HydrophobicContact CD2-CG2 3.54Å
420	Q	76.2	Confident	82.2	Confident	90 Å²	90	41.6 Å²	41.6	42%	0.421	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-43.2	177.6	-57.2	-176.5	-44.9	0	0	111.4	P385 K386 N418	P385-Q420 HydrophobicContact CB-CG 3.51Å; P385-Q420 HydrophobicContact CG-CG 4.29Å; K386-Q420 PolarHBondContact O-NE2 2.97Å; N418-Q420 VanDerWaalsContact C-N 3.3Å; N418-Q420 PolarHBondContact O-N 3.05Å; N418-Q420 WeakPolarHBondContact OD1-CB 3.18Å; N418-Q420 PolarHBondContact OD1-N 3.04Å
421	T	75.7	Confident	81.5	Confident	86 Å²	86	41.9 Å²	41.9	53%	0.528	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-18.9	-178.8	63.7	0	0	0	0	112.5	N418 V423	N418-T421 WeakPolarHBondContact CB-OG1 3.45Å; N418-T421 PolarHBondContact OD1-N 3.36Å; T421-V423 PolarHBondContact O-N 3.33Å; T421-V423 PolarHBondContact OG1-N 3.08Å
422	G	76.1	Confident	81.2	Confident	40 Å²	40	42.3 Å²	42.3	41%	0.412	23%	0.227	S	C	.	.			trans	68.2	8.5	-172	0	0	0	0	0	113.6	N418	N418-G422 WeakPolarHBondContact O-CA 3.43Å; N418-G422 PolarHBondContact O-N 2.66Å
423	V	81.9	Confident	80.8	Confident	69 Å²	69	44 Å²	44	42%	0.418	24%	0.236	S	C	.	.			trans	-84.2	123.8	-176.2	-177.8	0	0	0	0	109.5	N418 T421 Q425	N418-V423 PolarHBondContact N-O 2.81Å; T421-V423 PolarHBondContact O-N 3.33Å; T421-V423 PolarHBondContact OG1-N 3.08Å; V423-Q425 HydrophobicContact CG1-CG 3.82Å
424	I	83.3	Confident	80.1	Confident	36 Å²	36	44 Å²	44	19%	0.185	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.3	172	-45	-165.9	0	0	0	108.5	D369 F370 M415 L417	D369-I424 HydrophobicContact CB-CD1 3.87Å; F370-I424 HydrophobicContact CD1-CD1 4.39Å; F370-I424 HydrophobicContact CD1-CG2 3.86Å; F370-I424 HydrophobicContact CD2-CD1 4.23Å; F370-I424 HydrophobicContact CE1-CD1 4.14Å; F370-I424 HydrophobicContact CE1-CG2 3.7Å; F370-I424 HydrophobicContact CE2-CD1 4Å; F370-I424 HydrophobicContact CG-CD1 4.44Å; F370-I424 HydrophobicContact CZ-CD1 3.95Å; F370-I424 HydrophobicContact CZ-CG2 4.44Å; M415-I424 HydrophobicContact CB-CG2 4.4Å; M415-I424 HydrophobicContact CE-CG2 3.8Å; L417-I424 HydrophobicContact CD1-CD1 3.64Å; L417-I424 HydrophobicContact CD1-CG1 3.62Å; L417-I424 HydrophobicContact CG-CG1 4.26Å
425	Q	85.4	Confident	79.8	Confident	102 Å²	102	45 Å²	45	48%	0.477	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	133.1	178.9	-61	-173.2	-12.6	0	0	110.8	M415 H416 V423 V427	M415-Q425 CarbonylContact C-O 3.49Å; M415-Q425 WeakPolarHBondContact CA-O 3.25Å; H416-Q425 PolarHBondContact N-O 3.42Å; H416-Q425 PolarHBondContact O-N 3.29Å; V423-Q425 HydrophobicContact CG1-CG 3.82Å; Q425-V427 PolarHBondContact O-N 3.05Å
426	T	84.6	Confident	79.5	Confident	62 Å²	62	47.1 Å²	47.1	38%	0.38	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	109.2	167	-49.8	0	0	0	0	108.4	M415 Q429	M415-T426 VanDerWaalsContact CE-OG1 3.22Å; M415-T426 WeakPolarHBondContact CE-OG1 2.99Å; M415-T426 HydrophobicContact SD-CG2 3.77Å; M415-T426 PolarHBondContact SD-OG1 2.88Å; T426-Q429 HydrophobicContact CG2-CB 4.2Å
427	V	82.9	Confident	79.3	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-38.1	-174.4	170.8	0	0	0	0	111.3	L92 F94 H107 I414 H416 Q425	L92-V427 HydrophobicContact CD2-CB 4.4Å; L92-V427 HydrophobicContact CD2-CG1 3.8Å; L92-V427 HydrophobicContact CD2-CG2 3.64Å; F94-V427 HydrophobicContact CD1-CG1 4.31Å; F94-V427 HydrophobicContact CE1-CG1 3.33Å; F94-V427 HydrophobicContact CZ-CG1 3.8Å; H107-V427 HydrophobicContact CB-CG1 3.84Å; H107-V427 PolarHBondContact CE1-O 3.31Å; H107-V427 VanDerWaalsContact CE1-O 3.3Å; H107-V427 PolarHBondContact ND1-O 3.24Å; I414-V427 PolarHBondContact O-N 3.33Å; H416-V427 HydrophobicContact CB-CG2 3.38Å; Q425-V427 PolarHBondContact O-N 3.05Å
428	L	82.2	Confident	79.5	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	130.2	177.5	-166.7	70.6	0	0	0	109.3	F94 Y96 F105 K413 I414 N430	F94-L428 HydrophobicContact CE2-CD2 4.35Å; F94-L428 HydrophobicContact CZ-CB 4.34Å; F94-L428 HydrophobicContact CZ-CD2 4.44Å; Y96-L428 HydrophobicContact CE1-CD2 3.95Å; F105-L428 HydrophobicContact CZ-CD1 4.27Å; K413-L428 WeakPolarHBondContact CA-O 3.43Å; I414-L428 HydrophobicContact CB-CB 4.01Å; I414-L428 HydrophobicContact CD1-CB 4.07Å; I414-L428 HydrophobicContact CD1-CD2 3.73Å; I414-L428 HydrophobicContact CG1-CB 4.22Å; I414-L428 HydrophobicContact CG1-CD2 4.48Å; I414-L428 PolarHBondContact N-O 3.08Å; I414-L428 PolarHBondContact O-N 3.33Å; L428-N430 WeakPolarHBondContact CD2-ND2 3.49Å
429	Q	80.8	Confident	80	Confident	106 Å²	106	45.6 Å²	45.6	50%	0.495	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	96.2	170.8	178.4	169.2	8.5	0	0	108.3	K413 T426	K413-Q429 HydrophobicContact CG-CG 4.12Å; T426-Q429 HydrophobicContact CG2-CB 4.2Å
430	N	73.4	Confident	80.7	Confident	23 Å²	23	44.9 Å²	44.9	12%	0.123	24%	0.243	C	C	.	.			trans	-103	148.5	172.8	-73.7	-18.3	0	0	0	109.2	M77 A412 L428	M77-N430 HydrophobicContact CB-CB 4.42Å; A412-N430 WeakPolarHBondContact CB-O 3.27Å; A412-N430 PolarHBondContact O-N 3.21Å; L428-N430 WeakPolarHBondContact CD2-ND2 3.49Å
431	D	67.6	Low	81.5	Confident	39 Å²	39	41.3 Å²	41.3	21%	0.209	23%	0.226	C	C	.	.			trans	-85.6	134.4	171.3	-62.5	-16.1	0	0	0	108.4	D433 R457	D431-D433 VanDerWaalsContact C-N 3.33Å; D431-R457 IonicContact OD1-CZ 3.51Å; D431-R457 VanDerWaalsContact OD1-CZ 3.32Å; D431-R457 IonicContact OD1-NH1 3.43Å; D431-R457 PolarHBondContact OD1-NH1 3.24Å; D431-R457 IonicContact OD1-NH2 3.12Å; D431-R457 PolarHBondContact OD1-NH2 3.14Å; D431-R457 IonicContact OD2-CZ 2.72Å; D431-R457 IonicContact OD2-NE 3.34Å; D431-R457 PolarHBondContact OD2-NE 3.26Å; D431-R457 IonicContact OD2-NH1 3.66Å; D431-R457 PolarHBondContact OD2-NH1 3.23Å; D431-R457 IonicContact OD2-NH2 3.79Å; D431-R457 PolarHBondContact OD2-NH2 3.35Å
432	Y	70	Confident	82.2	Confident	90 Å²	90	39 Å²	39	35%	0.353	21%	0.213	S	C	.	.			trans	-100.6	60.2	168.4	-173.8	-113.9	0	0	0	109.6	M77 P79	M77-Y432 WeakPolarHBondContact O-CD2 3.39Å; P79-Y432 HydrophobicContact CG-CD1 3.46Å; P79-Y432 VanDerWaalsContact CG-CD1 3.46Å; P79-Y432 HydrophobicContact CG-CD2 3.99Å; P79-Y432 HydrophobicContact CG-CE1 3.72Å; P79-Y432 HydrophobicContact CG-CE2 4.23Å; P79-Y432 HydrophobicContact CG-CG 3.57Å
433	D	72.7	Confident	82.9	Confident	36 Å²	36	43.4 Å²	43.4	19%	0.193	22%	0.221	C	C	.	.	S	Bend	trans	-124.8	141.7	174.1	-76.3	-63.5	0	0	0	109.5	D431 L435 N451 Q453	D431-D433 VanDerWaalsContact C-N 3.33Å; D433-L435 PolarHBondContact O-N 2.85Å; D433-N451 HydrophobicContact CB-CB 4.12Å; D433-Q453 WeakPolarHBondContact OD1-CG 3.24Å; D433-Q453 PolarHBondContact OD1-NE2 2.86Å; D433-Q453 VanDerWaalsContact OD1-NE2 3.08Å; D433-Q453 WeakPolarHBondContact OD2-CG 3.34Å
434	P	72.4	Confident	83.3	Confident	32 Å²	32	44.8 Å²	44.8	21%	0.208	22%	0.223	C	C	.	.			trans	-52.1	127.6	174.1	-32.1	37.9	0	0	0	112.5	L452 G743 S746	P434-L452 HydrophobicContact CB-CD1 3.54Å; P434-L452 HydrophobicContact CB-CG 3.94Å; P434-L452 HydrophobicContact CG-CD1 3.67Å; P434-L452 HydrophobicContact CG-CG 4.47Å; P434-L452 PolarHBondContact O-N 3.36Å; P434-G743 WeakPolarHBondContact CA-O 3.49Å; P434-G743 WeakPolarHBondContact CB-O 3.21Å; P434-S746 WeakPolarHBondContact CD-OG 3.5Å
435	L	82.8	Confident	83.7	Confident	21 Å²	21	44.2 Å²	44.2	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	110	177.3	-65.5	175.9	0	0	0	109.1	D433 N451 S727 A741 G743 A748	D433-L435 PolarHBondContact O-N 2.85Å; L435-N451 HydrophobicContact CD2-CB 3.85Å; L435-S727 PolarHBondContact O-OG 3.27Å; L435-A741 HydrophobicContact CB-CB 4.18Å; L435-G743 WeakPolarHBondContact O-CA 3.44Å; L435-G743 PolarHBondContact O-N 2.92Å; L435-A748 HydrophobicContact CD1-CB 3.74Å
436	H	81.3	Confident	84	Confident	52 Å²	52	39.8 Å²	39.8	24%	0.241	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-23	-179.3	-70.2	-79.2	0	0	0	113.3	L452 T728	H436-L452 WeakPolarHBondContact CD2-CD2 2.82Å; H436-T728 VanDerWaalsContact O-CG2 3.28Å; H436-T728 WeakPolarHBondContact O-CG2 3.38Å
437	A	85.8	Confident	84.5	Confident	3 Å²	3	36.9 Å²	36.9	3%	0.025	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.5	-175	0	0	0	0	0	111.8	G450 I478 I481	A437-G450 PolarHBondContact O-N 2.77Å; A437-I478 HydrophobicContact CB-CG2 3.9Å; A437-I481 HydrophobicContact CB-CB 4.07Å; A437-I481 HydrophobicContact CB-CD1 3.58Å; A437-I481 HydrophobicContact CB-CG1 3.56Å
438	L	92.9	Very high	84.9	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	132.1	-179.6	-169.6	152.5	0	0	0	109.1	V447 A448 F449 T728 S730 F739 A741 A748	L438-V447 HydrophobicContact CD2-CG2 3.97Å; L438-V447 HydrophobicContact CG-CG2 4.08Å; L438-A448 WeakPolarHBondContact CA-O 3.19Å; L438-F449 HydrophobicContact CD1-CD1 3.89Å; L438-F449 HydrophobicContact CD1-CE1 3.57Å; L438-F449 HydrophobicContact CG-CD1 4.22Å; L438-F449 HydrophobicContact CG-CE1 4.19Å; L438-T728 HydrophobicContact CB-CG2 3.76Å; L438-S730 VanDerWaalsContact CD2-CB 3.46Å; L438-F739 HydrophobicContact CD1-CB 3.89Å; L438-F739 HydrophobicContact CD2-CB 3.56Å; L438-F739 HydrophobicContact CG-CB 4.35Å; L438-A741 HydrophobicContact CB-CB 4.38Å; L438-A741 HydrophobicContact CD1-CB 4.16Å; L438-A748 HydrophobicContact CD1-CB 4.36Å
439	T	93.4	Very high	85.3	Confident	12 Å²	12	36.5 Å²	36.5	7%	0.074	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	143.7	173.1	-171.2	0	0	0	0	112	A448 I481 F483 L490	T439-A448 HydrophobicContact CG2-CB 3.96Å; T439-A448 PolarHBondContact N-O 3.38Å; T439-A448 VanDerWaalsContact N-O 3.13Å; T439-A448 PolarHBondContact O-N 3.3Å; T439-I481 HydrophobicContact CG2-CB 4.08Å; T439-I481 HydrophobicContact CG2-CG2 3.54Å; T439-F483 HydrophobicContact CG2-CD2 3.43Å; T439-F483 VanDerWaalsContact CG2-CD2 3.43Å; T439-F483 HydrophobicContact CG2-CE2 3.68Å; T439-F483 HydrophobicContact CG2-CG 4.39Å; T439-L490 HydrophobicContact CG2-CD1 4.15Å
440	C	93.9	Very high	85.7	Confident	10 Å²	10	31.5 Å²	31.5	7%	0.068	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.7	175.6	-62.6	0	0	0	0	110.8	F483 S730 C731 F739	C440-F483 WeakPolarHBondContact O-CD2 3.04Å; C440-S730 PolarHBondContact N-OG 3.28Å; C440-C731 VanDerWaalsContact CB-O 3.22Å; C440-C731 WeakPolarHBondContact CB-O 3.25Å; C440-F739 WeakPolarHBondContact SG-CD2 3.46Å
441	H	93	Very high	86.3	Confident	14 Å²	14	30.7 Å²	30.7	7%	0.065	15%	0.152	C	C	.	.			trans	-68.9	138.3	173.1	-171	-84.8	0	0	0	110.4	F443 Q444 V446 F483 G487	H441-F443 VanDerWaalsContact C-N 3.28Å; H441-F443 PolarHBondContact ND1-N 3.12Å; H441-F443 VanDerWaalsContact ND1-N 3.19Å; H441-F443 PolarHBondContact O-N 3.12Å; H441-Q444 HydrophobicContact CB-CB 4.34Å; H441-Q444 WeakPolarHBondContact ND1-CB 3.18Å; H441-Q444 PolarHBondContact ND1-N 3.13Å; H441-V446 HydrophobicContact CB-CB 4Å; H441-V446 PolarHBondContact N-O 3.01Å; H441-F483 HydrophobicContact CB-CD2 4.44Å; H441-F483 HydrophobicContact CB-CE2 4.3Å; H441-F483 HydrophobicContact CB-CZ 4.45Å; H441-F483 AromaticContact CD2-CD1 3.86Å; H441-F483 AromaticContact CD2-CE1 3.85Å; H441-G487 VanDerWaalsContact NE2-CA 3.34Å; H441-G487 WeakPolarHBondContact NE2-CA 3.4Å; H441-G487 PolarHBondContact NE2-O 3.48Å
442	P	90.1	Very high	87	Confident	39 Å²	39	30.4 Å²	30.4	25%	0.253	15%	0.151	S	C	.	.	S	Bend	trans	-68.5	-18.4	-173.2	26.2	-37.7	0	0	0	115.2	D484 Y733	P442-D484 WeakPolarHBondContact CG-O 3.18Å; P442-Y733 WeakPolarHBondContact O-CB 3.26Å
443	F	89.5	Confident	87.6	Confident	132 Å²	132	30.7 Å²	30.7	58%	0.579	16%	0.155	S	C	*	.	S	Bend	trans	-133.6	-11	-176.2	-57.7	-67.1	0	0	0	115.6	H441 P485	H441-F443 VanDerWaalsContact C-N 3.28Å; H441-F443 PolarHBondContact ND1-N 3.12Å; H441-F443 VanDerWaalsContact ND1-N 3.19Å; H441-F443 PolarHBondContact O-N 3.12Å; F443-P485 WeakPolarHBondContact CE2-O 3.17Å
444	Q	91.3	Very high	88	Confident	97 Å²	97	29 Å²	29	45%	0.453	15%	0.146	S	C	.	.	S	Bend	trans	-124	154.5	-170.4	-66.4	-176.2	-3.4	0	0	109	H441 V446 Y733	H441-Q444 HydrophobicContact CB-CB 4.34Å; H441-Q444 WeakPolarHBondContact ND1-CB 3.18Å; H441-Q444 PolarHBondContact ND1-N 3.13Å; Q444-V446 HydrophobicContact CB-CG2 4.02Å; Q444-V446 PolarHBondContact O-N 3.26Å; Q444-Y733 VanDerWaalsContact C-CD1 3.46Å; Q444-Y733 WeakPolarHBondContact O-CD1 3.31Å
445	P	91.7	Very high	88.7	Confident	25 Å²	25	28.4 Å²	28.4	16%	0.162	14%	0.141	C	C	.	.	S	Bend	trans	-76.8	50	-179	33.6	-37.1	0	0	0	113.1	D460 Y461 N462 Y733	P445-D460 VanDerWaalsContact O-CA 3.31Å; P445-D460 WeakPolarHBondContact O-CA 3.3Å; P445-Y461 HydrophobicContact CB-CD1 4.26Å; P445-Y461 HydrophobicContact CB-CD2 4.07Å; P445-Y461 HydrophobicContact CB-CE1 3.87Å; P445-Y461 HydrophobicContact CB-CE2 3.62Å; P445-Y461 HydrophobicContact CB-CG 4.36Å; P445-Y461 WeakPolarHBondContact O-CD1 3.27Å; P445-Y461 WeakPolarHBondContact O-CE1 3.37Å; P445-Y461 PolarHBondContact O-N 2.9Å; P445-N462 HydrophobicContact CB-CB 4.38Å; P445-N462 VanDerWaalsContact CB-ND2 3.28Å; P445-N462 WeakPolarHBondContact CB-ND2 3.29Å; P445-Y733 HydrophobicContact CB-CE1 3.98Å
446	V	92.6	Very high	89.1	Confident	9 Å²	9	27.4 Å²	27.4	6%	0.055	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.3	-174.9	-173.7	0	0	0	0	110.1	H441 Q444 L458 W459 I467	H441-V446 HydrophobicContact CB-CB 4Å; H441-V446 PolarHBondContact N-O 3.01Å; Q444-V446 HydrophobicContact CB-CG2 4.02Å; Q444-V446 PolarHBondContact O-N 3.26Å; V446-L458 HydrophobicContact CG1-CB 4.1Å; V446-L458 HydrophobicContact CG1-CD2 4.26Å; V446-W459 CarbonylContact C-O 3.42Å; V446-W459 VanDerWaalsContact CA-O 3.31Å; V446-W459 WeakPolarHBondContact CA-O 3.23Å; V446-I467 HydrophobicContact CB-CD1 4.25Å; V446-I467 HydrophobicContact CG1-CD1 3.83Å; V446-I467 HydrophobicContact CG2-CD1 3.47Å; V446-I467 VanDerWaalsContact CG2-CD1 3.47Å
447	V	93.4	Very high	89.5	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.1	170.5	61.5	0	0	0	0	109.7	L438 F449 L458 W459 F739	L438-V447 HydrophobicContact CD2-CG2 3.97Å; L438-V447 HydrophobicContact CG-CG2 4.08Å; V447-F449 HydrophobicContact CG1-CD2 4.46Å; V447-F449 HydrophobicContact CG1-CE2 3.57Å; V447-F449 HydrophobicContact CG1-CZ 3.65Å; V447-F449 HydrophobicContact CG2-CE1 4.25Å; V447-F449 HydrophobicContact CG2-CE2 4.43Å; V447-F449 HydrophobicContact CG2-CZ 4.07Å; V447-L458 WeakPolarHBondContact O-CA 3.47Å; V447-W459 HydrophobicContact CG1-CB 3.97Å; V447-W459 HydrophobicContact CG1-CD2 4.47Å; V447-W459 HydrophobicContact CG1-CE3 3.69Å; V447-W459 PolarHBondContact N-O 2.91Å; V447-W459 PolarHBondContact O-N 2.66Å; V447-F739 HydrophobicContact CG1-CE1 4.3Å; V447-F739 HydrophobicContact CG2-CG 4.3Å
448	A	92.8	Very high	89.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.9	176.2	0	0	0	0	0	110.4	L438 T439 L456 R457 L458 F483	L438-A448 WeakPolarHBondContact CA-O 3.19Å; T439-A448 HydrophobicContact CG2-CB 3.96Å; T439-A448 PolarHBondContact N-O 3.38Å; T439-A448 VanDerWaalsContact N-O 3.13Å; T439-A448 PolarHBondContact O-N 3.3Å; A448-L456 HydrophobicContact CB-CD1 4.36Å; A448-R457 CarbonylContact C-O 3.59Å; A448-R457 VanDerWaalsContact CA-O 3.29Å; A448-R457 WeakPolarHBondContact CA-O 3.27Å; A448-L458 HydrophobicContact CB-CD2 3.57Å; A448-F483 HydrophobicContact CB-CE2 3.7Å; A448-F483 HydrophobicContact CB-CZ 3.94Å
449	F	90.8	Very high	89.7	Confident	21 Å²	21	28.1 Å²	28.1	9%	0.092	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.2	175	-58.3	-78.1	0	0	0	110.5	F75 L438 V447 L456 R457 W459 A748	F75-F449 HydrophobicContact CD2-CE1 4.46Å; F75-F449 HydrophobicContact CD2-CZ 4.02Å; F75-F449 HydrophobicContact CE2-CZ 4.06Å; F75-F449 HydrophobicContact CG-CZ 4.42Å; F75-F449 HydrophobicContact CZ-CZ 4.48Å; L438-F449 HydrophobicContact CD1-CD1 3.89Å; L438-F449 HydrophobicContact CD1-CE1 3.57Å; L438-F449 HydrophobicContact CG-CD1 4.22Å; L438-F449 HydrophobicContact CG-CE1 4.19Å; V447-F449 HydrophobicContact CG1-CD2 4.46Å; V447-F449 HydrophobicContact CG1-CE2 3.57Å; V447-F449 HydrophobicContact CG1-CZ 3.65Å; V447-F449 HydrophobicContact CG2-CE1 4.25Å; V447-F449 HydrophobicContact CG2-CE2 4.43Å; V447-F449 HydrophobicContact CG2-CZ 4.07Å; F449-L456 WeakPolarHBondContact O-CA 3.47Å; F449-R457 PolarHBondContact N-O 3.14Å; F449-R457 PolarHBondContact O-N 2.64Å; F449-W459 HydrophobicContact CD2-CB 4.34Å; F449-W459 HydrophobicContact CE2-CB 3.81Å; F449-W459 HydrophobicContact CE2-CG 4.38Å; F449-A748 HydrophobicContact CD1-CB 4.16Å; F449-A748 HydrophobicContact CE1-CB 3.67Å
450	G	88.8	Confident	89.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.4	172.1	0	0	0	0	0	111.5	A437 I481	A437-G450 PolarHBondContact O-N 2.77Å; G450-I481 VanDerWaalsContact CA-CD1 3.49Å
451	N	85.3	Confident	89.4	Confident	6 Å²	6	28.8 Å²	28.8	3%	0.032	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	171.8	177.3	80.4	3.5	0	0	0	112.8	D433 L435 Q453 G454 M455 I478	D433-N451 HydrophobicContact CB-CB 4.12Å; L435-N451 HydrophobicContact CD2-CB 3.85Å; N451-Q453 VanDerWaalsContact C-N 3.3Å; N451-Q453 PolarHBondContact O-N 3.46Å; N451-Q453 WeakPolarHBondContact OD1-CA 3.21Å; N451-Q453 PolarHBondContact OD1-N 3.23Å; N451-G454 PolarHBondContact O-N 3.04Å; N451-G454 PolarHBondContact OD1-N 2.65Å; N451-M455 PolarHBondContact N-O 3.4Å; N451-M455 VanDerWaalsContact N-O 3.08Å; N451-M455 WeakPolarHBondContact ND2-CB 3.32Å; N451-M455 WeakPolarHBondContact OD1-CA 3.33Å; N451-M455 WeakPolarHBondContact OD1-CB 3.34Å; N451-M455 PolarHBondContact OD1-N 3.29Å; N451-M455 PolarHBondContact OD1-O 3.35Å; N451-I478 PolarHBondContact O-N 2.93Å
452	L	82.7	Confident	89.1	Confident	34 Å²	34	32.7 Å²	32.7	18%	0.178	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-21.9	175.9	-74.4	-175.3	0	0	0	114.5	P434 H436 G454 Q477	P434-L452 HydrophobicContact CB-CD1 3.54Å; P434-L452 HydrophobicContact CB-CG 3.94Å; P434-L452 HydrophobicContact CG-CD1 3.67Å; P434-L452 HydrophobicContact CG-CG 4.47Å; P434-L452 PolarHBondContact O-N 3.36Å; H436-L452 WeakPolarHBondContact CD2-CD2 2.82Å; L452-G454 PolarHBondContact O-N 3.09Å; L452-Q477 HydrophobicContact CB-CG 4.31Å; L452-Q477 HydrophobicContact CD2-CB 3.94Å; L452-Q477 HydrophobicContact CD2-CG 4Å; L452-Q477 WeakPolarHBondContact O-CA 3.3Å; L452-Q477 WeakPolarHBondContact O-CG 3.24Å; L452-Q477 PolarHBondContact O-N 2.86Å
453	Q	81.4	Confident	88.9	Confident	95 Å²	95	35 Å²	35	44%	0.444	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.9	177.8	-58.8	-59.5	-24.1	0	0	113.3	D433 N451	D433-Q453 WeakPolarHBondContact OD1-CG 3.24Å; D433-Q453 PolarHBondContact OD1-NE2 2.86Å; D433-Q453 VanDerWaalsContact OD1-NE2 3.08Å; D433-Q453 WeakPolarHBondContact OD2-CG 3.34Å; N451-Q453 VanDerWaalsContact C-N 3.3Å; N451-Q453 PolarHBondContact O-N 3.46Å; N451-Q453 WeakPolarHBondContact OD1-CA 3.21Å; N451-Q453 PolarHBondContact OD1-N 3.23Å
454	G	82.2	Confident	88.7	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	81.2	24.3	-175.5	0	0	0	0	0	112.8	N451 L452 F472	N451-G454 PolarHBondContact O-N 3.04Å; N451-G454 PolarHBondContact OD1-N 2.65Å; L452-G454 PolarHBondContact O-N 3.09Å; G454-F472 WeakPolarHBondContact O-CD2 3.34Å; G454-F472 PolarHBondContact O-N 2.97Å
455	M	87.7	Confident	88.4	Confident	21 Å²	21	29.5 Å²	29.5	10%	0.103	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.5	169.2	-165.8	174.8	-171.7	0	0	110	N451 R457 N469 R470 I471	N451-M455 PolarHBondContact N-O 3.4Å; N451-M455 VanDerWaalsContact N-O 3.08Å; N451-M455 WeakPolarHBondContact ND2-CB 3.32Å; N451-M455 WeakPolarHBondContact OD1-CA 3.33Å; N451-M455 WeakPolarHBondContact OD1-CB 3.34Å; N451-M455 PolarHBondContact OD1-N 3.29Å; N451-M455 PolarHBondContact OD1-O 3.35Å; M455-R457 HydrophobicContact CE-CG 3.93Å; M455-R457 HydrophobicContact CG-CG 4.18Å; M455-R457 HydrophobicContact SD-CG 4.27Å; M455-R457 PolarHBondContact SD-NE 3.07Å; M455-R457 PolarHBondContact SD-NH2 3.42Å; M455-N469 HydrophobicContact CE-CB 3.73Å; M455-R470 WeakPolarHBondContact CA-O 3.4Å; M455-I471 HydrophobicContact CB-CG1 4.36Å; M455-I471 HydrophobicContact CE-CG1 4.44Å; M455-I471 HydrophobicContact CG-CG1 3.9Å; M455-I471 HydrophobicContact SD-CG1 4.39Å
456	L	90.5	Very high	88.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.4	169.9	177.8	68.3	0	0	0	108.5	A448 F449 N469 R470 F472 I478 I481 L490 V492 L502 L507	A448-L456 HydrophobicContact CB-CD1 4.36Å; F449-L456 WeakPolarHBondContact O-CA 3.47Å; L456-N469 CarbonylContact O-C 3.52Å; L456-N469 WeakPolarHBondContact O-CA 3.44Å; L456-R470 HydrophobicContact CB-CB 4.49Å; L456-R470 PolarHBondContact N-O 3.39Å; L456-R470 PolarHBondContact O-N 3.21Å; L456-F472 HydrophobicContact CB-CE2 4.08Å; L456-F472 HydrophobicContact CD2-CE2 4.49Å; L456-I478 HydrophobicContact CB-CD1 4.33Å; L456-I481 HydrophobicContact CD1-CD1 3.5Å; L456-I481 HydrophobicContact CD1-CG1 4.43Å; L456-L490 HydrophobicContact CD1-CD2 4.36Å; L456-L490 HydrophobicContact CD2-CD2 3.81Å; L456-V492 HydrophobicContact CD2-CG2 4.24Å; L456-L502 HydrophobicContact CD2-CD1 3.48Å; L456-L502 VanDerWaalsContact CD2-CD1 3.48Å; L456-L507 HydrophobicContact CD2-CD2 3.78Å
457	R	89.7	Confident	88	Confident	45 Å²	45	37.2 Å²	37.2	17%	0.17	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.7	176.5	-68.7	-175.9	-177.2	-171.9	-4	110.7	D431 A448 F449 M455 N469	D431-R457 IonicContact OD1-CZ 3.51Å; D431-R457 VanDerWaalsContact OD1-CZ 3.32Å; D431-R457 IonicContact OD1-NH1 3.43Å; D431-R457 PolarHBondContact OD1-NH1 3.24Å; D431-R457 IonicContact OD1-NH2 3.12Å; D431-R457 PolarHBondContact OD1-NH2 3.14Å; D431-R457 IonicContact OD2-CZ 2.72Å; D431-R457 IonicContact OD2-NE 3.34Å; D431-R457 PolarHBondContact OD2-NE 3.26Å; D431-R457 IonicContact OD2-NH1 3.66Å; D431-R457 PolarHBondContact OD2-NH1 3.23Å; D431-R457 IonicContact OD2-NH2 3.79Å; D431-R457 PolarHBondContact OD2-NH2 3.35Å; A448-R457 CarbonylContact C-O 3.59Å; A448-R457 VanDerWaalsContact CA-O 3.29Å; A448-R457 WeakPolarHBondContact CA-O 3.27Å; F449-R457 PolarHBondContact N-O 3.14Å; F449-R457 PolarHBondContact O-N 2.64Å; M455-R457 HydrophobicContact CE-CG 3.93Å; M455-R457 HydrophobicContact CG-CG 4.18Å; M455-R457 HydrophobicContact SD-CG 4.27Å; M455-R457 PolarHBondContact SD-NE 3.07Å; M455-R457 PolarHBondContact SD-NH2 3.42Å; R457-N469 HydrophobicContact CG-CB 4.46Å
458	L	92.1	Very high	87.6	Confident	9 Å²	9	38.2 Å²	38.2	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.7	168.7	-63.3	-177	0	0	0	109.5	V446 V447 A448 I467 G468 F483 L490 L507	V446-L458 HydrophobicContact CG1-CB 4.1Å; V446-L458 HydrophobicContact CG1-CD2 4.26Å; V447-L458 WeakPolarHBondContact O-CA 3.47Å; A448-L458 HydrophobicContact CB-CD2 3.57Å; L458-I467 HydrophobicContact CB-CB 4.28Å; L458-I467 PolarHBondContact O-N 2.89Å; L458-G468 PolarHBondContact N-O 3.33Å; L458-F483 HydrophobicContact CD2-CZ 3.97Å; L458-L490 HydrophobicContact CD2-CD2 4.4Å; L458-L507 HydrophobicContact CD1-CD1 3.93Å; L458-L507 HydrophobicContact CD1-CD2 3.76Å; L458-L507 HydrophobicContact CD1-CG 3.91Å; L458-L507 HydrophobicContact CG-CD1 4.08Å; L458-L507 HydrophobicContact CG-CD2 4.16Å; L458-L507 HydrophobicContact CG-CG 4.48Å
459	W	91.4	Very high	87.4	Confident	21 Å²	21	43.2 Å²	43.2	8%	0.08	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	130.4	-177.1	-171.9	74.7	0	0	0	111	F75 V446 V447 F449 K464 A465 F739	F75-W459 AromaticContact CE1-CD2 3.95Å; F75-W459 HydrophobicContact CE1-CD2 3.95Å; F75-W459 AromaticContact CE1-CE2 3.69Å; F75-W459 HydrophobicContact CE1-CE3 4.12Å; F75-W459 AromaticContact CE1-CH2 3.92Å; F75-W459 HydrophobicContact CE1-CH2 3.92Å; F75-W459 AromaticContact CE1-CZ2 3.69Å; F75-W459 HydrophobicContact CE1-CZ2 3.69Å; F75-W459 HydrophobicContact CE1-CZ3 4.07Å; F75-W459 HydrophobicContact CE2-CZ3 4.32Å; F75-W459 HydrophobicContact CZ-CD2 4.02Å; F75-W459 AromaticContact CZ-CE3 3.7Å; F75-W459 HydrophobicContact CZ-CE3 3.7Å; F75-W459 AromaticContact CZ-CH2 3.48Å; F75-W459 HydrophobicContact CZ-CH2 3.48Å; F75-W459 VanDerWaalsContact CZ-CH2 3.48Å; F75-W459 AromaticContact CZ-CZ2 3.77Å; F75-W459 HydrophobicContact CZ-CZ2 3.77Å; F75-W459 AromaticContact CZ-CZ3 3.38Å; F75-W459 HydrophobicContact CZ-CZ3 3.38Å; V446-W459 CarbonylContact C-O 3.42Å; V446-W459 VanDerWaalsContact CA-O 3.31Å; V446-W459 WeakPolarHBondContact CA-O 3.23Å; V447-W459 HydrophobicContact CG1-CB 3.97Å; V447-W459 HydrophobicContact CG1-CD2 4.47Å; V447-W459 HydrophobicContact CG1-CE3 3.69Å; V447-W459 PolarHBondContact N-O 2.91Å; V447-W459 PolarHBondContact O-N 2.66Å; F449-W459 HydrophobicContact CD2-CB 4.34Å; F449-W459 HydrophobicContact CE2-CB 3.81Å; F449-W459 HydrophobicContact CE2-CG 4.38Å; W459-K464 HydrophobicContact CH2-CG 4.35Å; W459-K464 VanDerWaalsContact CZ2-CA 3.44Å; W459-K464 HydrophobicContact CZ2-CB 3.92Å; W459-K464 HydrophobicContact CZ2-CG 4.14Å; W459-A465 VanDerWaalsContact CD1-O 3.26Å; W459-F739 HydrophobicContact CZ3-CE1 4.19Å
460	D	91	Very high	87.3	Confident	27 Å²	27	44.8 Å²	44.8	14%	0.144	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	119.1	171	-170.5	-38.1	0	0	0	109.2	P445 N462 C463 K464 A465 I467	P445-D460 VanDerWaalsContact O-CA 3.31Å; P445-D460 WeakPolarHBondContact O-CA 3.3Å; D460-N462 WeakPolarHBondContact OD1-CA 2.85Å; D460-N462 WeakPolarHBondContact OD1-CB 3.49Å; D460-N462 PolarHBondContact OD1-N 3.1Å; D460-C463 HydrophobicContact CB-CB 4.08Å; D460-C463 PolarHBondContact OD1-N 3.37Å; D460-C463 PolarHBondContact OD2-SG 3.41Å; D460-K464 VanDerWaalsContact O-CA 3.23Å; D460-K464 WeakPolarHBondContact O-CA 3Å; D460-K464 PolarHBondContact O-N 3.22Å; D460-A465 PolarHBondContact N-O 2.71Å; D460-A465 PolarHBondContact O-N 3.09Å; D460-I467 HydrophobicContact CB-CD1 3.8Å; D460-I467 HydrophobicContact CB-CG1 3.89Å
461	Y	89.4	Confident	87.2	Confident	9 Å²	9	50 Å²	50	4%	0.035	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-17.6	-178.4	60.3	-106.6	0	0	0	115.3	P445 Y733 F737 F739	P445-Y461 HydrophobicContact CB-CD1 4.26Å; P445-Y461 HydrophobicContact CB-CD2 4.07Å; P445-Y461 HydrophobicContact CB-CE1 3.87Å; P445-Y461 HydrophobicContact CB-CE2 3.62Å; P445-Y461 HydrophobicContact CB-CG 4.36Å; P445-Y461 WeakPolarHBondContact O-CD1 3.27Å; P445-Y461 WeakPolarHBondContact O-CE1 3.37Å; P445-Y461 PolarHBondContact O-N 2.9Å; Y461-Y733 WeakPolarHBondContact OH-CD1 3.41Å; Y461-Y733 WeakPolarHBondContact OH-CE1 3.35Å; Y461-F737 HydrophobicContact CD2-CD2 4.02Å; Y461-F737 HydrophobicContact CD2-CE2 4.2Å; Y461-F737 AromaticContact CE2-CD2 3.77Å; Y461-F737 HydrophobicContact CE2-CD2 3.77Å; Y461-F737 HydrophobicContact CE2-CE2 4.09Å; Y461-F739 HydrophobicContact CD1-CE2 4.02Å; Y461-F739 AromaticContact CD1-CZ 3.7Å; Y461-F739 HydrophobicContact CD1-CZ 3.7Å; Y461-F739 HydrophobicContact CE1-CE2 4.23Å; Y461-F739 HydrophobicContact CE1-CZ 4.34Å; Y461-F739 AromaticContact CG-CZ 3.86Å; Y461-F739 HydrophobicContact CG-CZ 3.86Å
462	N	87.8	Confident	87.1	Confident	96 Å²	96	50 Å²	50	51%	0.513	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-46.3	172.6	-72.1	-20.7	0	0	0	110.7	P445 D460 K464	P445-N462 HydrophobicContact CB-CB 4.38Å; P445-N462 VanDerWaalsContact CB-ND2 3.28Å; P445-N462 WeakPolarHBondContact CB-ND2 3.29Å; D460-N462 WeakPolarHBondContact OD1-CA 2.85Å; D460-N462 WeakPolarHBondContact OD1-CB 3.49Å; D460-N462 PolarHBondContact OD1-N 3.1Å; N462-K464 VanDerWaalsContact C-N 3.29Å
463	C	84.1	Confident	86.8	Confident	88 Å²	88	56.8 Å²	56.8	60%	0.595	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.9	179.5	-57.4	0	0	0	0	113	D460 A465	D460-C463 HydrophobicContact CB-CB 4.08Å; D460-C463 PolarHBondContact OD1-N 3.37Å; D460-C463 PolarHBondContact OD2-SG 3.41Å; C463-A465 VanDerWaalsContact C-N 3.25Å; C463-A465 HydrophobicContact CB-CB 4.45Å; C463-A465 PolarHBondContact O-N 2.99Å
464	K	86.1	Confident	86.5	Confident	66 Å²	66	57.4 Å²	57.4	29%	0.287	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	38.2	-177.4	-59.8	174.6	176.9	179	0	113.1	N110 W459 D460 N462	N110-K464 PolarHBondContact ND2-O 3.35Å; W459-K464 HydrophobicContact CH2-CG 4.35Å; W459-K464 VanDerWaalsContact CZ2-CA 3.44Å; W459-K464 HydrophobicContact CZ2-CB 3.92Å; W459-K464 HydrophobicContact CZ2-CG 4.14Å; D460-K464 VanDerWaalsContact O-CA 3.23Å; D460-K464 WeakPolarHBondContact O-CA 3Å; D460-K464 PolarHBondContact O-N 3.22Å; N462-K464 VanDerWaalsContact C-N 3.29Å
465	A	85.8	Confident	86.3	Confident	48 Å²	48	59 Å²	59	40%	0.397	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.1	-172.8	0	0	0	0	0	112.4	W459 D460 C463	W459-A465 VanDerWaalsContact CD1-O 3.26Å; D460-A465 PolarHBondContact N-O 2.71Å; D460-A465 PolarHBondContact O-N 3.09Å; C463-A465 VanDerWaalsContact C-N 3.25Å; C463-A465 HydrophobicContact CB-CB 4.45Å; C463-A465 PolarHBondContact O-N 2.99Å
466	I	86.6	Confident	85.8	Confident	100 Å²	100	62 Å²	62	51%	0.513	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.9	174.7	-59.4	170.3	0	0	0	108.3
467	I	88.5	Confident	85.5	Confident	96 Å²	96	64.9 Å²	64.9	49%	0.492	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-42.2	179.8	-53.1	174.7	0	0	0	110.4	V446 L458 D460	V446-I467 HydrophobicContact CB-CD1 4.25Å; V446-I467 HydrophobicContact CG1-CD1 3.83Å; V446-I467 HydrophobicContact CG2-CD1 3.47Å; V446-I467 VanDerWaalsContact CG2-CD1 3.47Å; L458-I467 HydrophobicContact CB-CB 4.28Å; L458-I467 PolarHBondContact O-N 2.89Å; D460-I467 HydrophobicContact CB-CD1 3.8Å; D460-I467 HydrophobicContact CB-CG1 3.89Å
468	G	84.9	Confident	85.6	Confident	21 Å²	21	62.8 Å²	62.8	22%	0.216	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	150.2	-175.5	0	0	0	0	0	111.9	L458	L458-G468 PolarHBondContact N-O 3.33Å
469	N	88.7	Confident	85.4	Confident	104 Å²	104	63.8 Å²	63.8	56%	0.556	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.2	172.6	63.8	1.1	0	0	0	110.1	M455 L456 R457	M455-N469 HydrophobicContact CE-CB 3.73Å; L456-N469 CarbonylContact O-C 3.52Å; L456-N469 WeakPolarHBondContact O-CA 3.44Å; R457-N469 HydrophobicContact CG-CB 4.46Å
470	R	88.3	Confident	85.4	Confident	55 Å²	55	63.7 Å²	63.7	21%	0.208	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	131.9	171.5	-179.5	169.1	179.9	178.3	1.1	109	M455 L456 F472 L502 L507 N509	M455-R470 WeakPolarHBondContact CA-O 3.4Å; L456-R470 HydrophobicContact CB-CB 4.49Å; L456-R470 PolarHBondContact N-O 3.39Å; L456-R470 PolarHBondContact O-N 3.21Å; R470-F472 HydrophobicContact CG-CE1 4.46Å; R470-F472 HydrophobicContact CG-CE2 4.47Å; R470-F472 HydrophobicContact CG-CZ 4.24Å; R470-L502 VanDerWaalsContact NH1-CD2 3.29Å; R470-L507 HydrophobicContact CB-CB 4.41Å; R470-L507 HydrophobicContact CB-CD1 4.19Å; R470-L507 WeakPolarHBondContact CD-O 3.48Å; R470-L507 PolarHBondContact NH1-O 2.79Å; R470-N509 VanDerWaalsContact CZ-OD1 3.3Å; R470-N509 PolarHBondContact NH1-OD1 3.37Å; R470-N509 PolarHBondContact NH2-OD1 3.42Å
471	I	86.7	Confident	85.5	Confident	108 Å²	108	62.8 Å²	62.8	55%	0.554	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.9	175.1	-60.3	169.6	0	0	0	107.7	M455	M455-I471 HydrophobicContact CB-CG1 4.36Å; M455-I471 HydrophobicContact CE-CG1 4.44Å; M455-I471 HydrophobicContact CG-CG1 3.9Å; M455-I471 HydrophobicContact SD-CG1 4.39Å
472	F	83.7	Confident	85.7	Confident	7 Å²	7	63.6 Å²	63.6	3%	0.031	34%	0.339	C	S	.	.			trans	-92.2	108.9	174.8	-63.4	-79.4	0	0	0	109.1	G454 L456 R470 E475 I478 F494 Y500 L502	G454-F472 WeakPolarHBondContact O-CD2 3.34Å; G454-F472 PolarHBondContact O-N 2.97Å; L456-F472 HydrophobicContact CB-CE2 4.08Å; L456-F472 HydrophobicContact CD2-CE2 4.49Å; R470-F472 HydrophobicContact CG-CE1 4.46Å; R470-F472 HydrophobicContact CG-CE2 4.47Å; R470-F472 HydrophobicContact CG-CZ 4.24Å; F472-E475 WeakPolarHBondContact CB-O 3.49Å; F472-I478 HydrophobicContact CD2-CD1 4.21Å; F472-I478 HydrophobicContact CE2-CD1 4.26Å; F472-F494 HydrophobicContact CB-CE1 4.13Å; F472-F494 HydrophobicContact CB-CZ 4.23Å; F472-F494 AromaticContact CD1-CZ 3.98Å; F472-F494 HydrophobicContact CD1-CZ 3.98Å; F472-F494 AromaticContact CD2-CE1 3.89Å; F472-F494 HydrophobicContact CD2-CE1 3.89Å; F472-F494 AromaticContact CD2-CZ 3.57Å; F472-F494 HydrophobicContact CD2-CZ 3.57Å; F472-F494 HydrophobicContact CE1-CZ 4.21Å; F472-F494 AromaticContact CE2-CZ 3.86Å; F472-F494 HydrophobicContact CE2-CZ 3.86Å; F472-F494 HydrophobicContact CG-CE1 4.01Å; F472-F494 AromaticContact CG-CZ 3.66Å; F472-F494 HydrophobicContact CG-CZ 3.66Å; F472-F494 HydrophobicContact CZ-CZ 4.17Å; F472-Y500 HydrophobicContact CD1-CD1 4.3Å; F472-Y500 HydrophobicContact CD1-CE1 4.19Å; F472-Y500 AromaticContact CE1-CD1 3.81Å; F472-Y500 HydrophobicContact CE1-CD1 3.81Å; F472-Y500 HydrophobicContact CE1-CE1 4.15Å; F472-Y500 HydrophobicContact CE1-CG 4.38Å; F472-L502 HydrophobicContact CZ-CD1 4.01Å; F472-L502 HydrophobicContact CZ-CD2 4.37Å
473	E	76	Confident	86	Confident	176 Å²	176	59.6 Å²	59.6	82%	0.822	32%	0.318	S	S	*	.	S	Bend	trans	-75.2	-33.5	-178.4	-63.8	-177.4	173.2	0	0	112.6
474	T	75.4	Confident	86.4	Confident	108 Å²	108	55.5 Å²	55.5	66%	0.663	29%	0.29	S	S	*	.	S	Bend	trans	-82.5	-50.6	-173.2	47.8	0	0	0	0	112.9
475	E	77.9	Confident	86.5	Confident	33 Å²	33	54.8 Å²	54.8	15%	0.154	29%	0.292	C	S	.	.	S	Bend	trans	-109.9	117.8	-174.9	-59.1	-65.7	166.7	0	0	109.4	F472 F494 T496 A498 Y500	F472-E475 WeakPolarHBondContact CB-O 3.49Å; E475-F494 HydrophobicContact CB-CB 4.5Å; E475-F494 HydrophobicContact CB-CD1 3.73Å; E475-F494 HydrophobicContact CB-CD2 4.38Å; E475-F494 HydrophobicContact CB-CE1 3.98Å; E475-F494 HydrophobicContact CB-CG 3.95Å; E475-F494 HydrophobicContact CB-CZ 4.42Å; E475-F494 VanDerWaalsContact O-CE1 3.31Å; E475-F494 WeakPolarHBondContact O-CE1 3.33Å; E475-T496 WeakPolarHBondContact OE2-CB 2.96Å; E475-T496 WeakPolarHBondContact OE2-CG2 3.34Å; E475-T496 PolarHBondContact OE2-OG1 3.11Å; E475-A498 HydrophobicContact CG-CB 4.02Å; E475-Y500 HydrophobicContact CG-CE2 3.98Å
476	K	76.9	Confident	86.6	Confident	85 Å²	85	57.8 Å²	57.8	37%	0.37	30%	0.296	S	S	.	.			trans	-100.3	159.8	179	-63.6	178.8	-174	165	0	110.4	K276	K276-K476 VanDerWaalsContact CE-NZ 3.28Å
477	Q	85.7	Confident	86.7	Confident	61 Å²	61	53.4 Å²	53.4	29%	0.285	28%	0.275	S	S	.	.			trans	70.9	84.6	176	-54	-179.2	-5.9	0	0	114.1	L452 F494 R495	L452-Q477 HydrophobicContact CB-CG 4.31Å; L452-Q477 HydrophobicContact CD2-CB 3.94Å; L452-Q477 HydrophobicContact CD2-CG 4Å; L452-Q477 WeakPolarHBondContact O-CA 3.3Å; L452-Q477 WeakPolarHBondContact O-CG 3.24Å; L452-Q477 PolarHBondContact O-N 2.86Å; Q477-F494 WeakPolarHBondContact O-CA 3.5Å; Q477-R495 HydrophobicContact CB-CB 3.94Å; Q477-R495 PolarHBondContact O-N 3.06Å
478	I	90.4	Very high	86.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	129	169.8	-60.7	164.6	0	0	0	108.7	A437 N451 L456 F472 I481 V492 F494	A437-I478 HydrophobicContact CB-CG2 3.9Å; N451-I478 PolarHBondContact O-N 2.93Å; L456-I478 HydrophobicContact CB-CD1 4.33Å; F472-I478 HydrophobicContact CD2-CD1 4.21Å; F472-I478 HydrophobicContact CE2-CD1 4.26Å; I478-I481 HydrophobicContact CG2-CD1 3.79Å; I478-I481 HydrophobicContact CG2-CG1 3.58Å; I478-V492 HydrophobicContact CB-CG1 4.41Å; I478-V492 HydrophobicContact CD1-CG1 4.21Å; I478-V492 HydrophobicContact CG1-CG1 3.9Å; I478-V492 HydrophobicContact CG2-CG1 3.68Å; I478-F494 HydrophobicContact CG1-CD1 4.08Å; I478-F494 HydrophobicContact CG1-CE1 3.62Å; I478-F494 HydrophobicContact CG1-CZ 4.18Å
479	Q	89	Confident	86.9	Confident	31 Å²	31	53.8 Å²	53.8	15%	0.145	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	-35.2	-178.1	-71.6	-63.2	-42	0	0	112.7	G493 R495 I522	Q479-G493 PolarHBondContact N-O 3.3Å; Q479-R495 HydrophobicContact CG-CB 4.03Å; Q479-I522 WeakPolarHBondContact CB-O 3.45Å
480	S	89.8	Confident	87.1	Confident	18 Å²	18	48.8 Å²	48.8	13%	0.126	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.3	-177.4	-160.8	0	0	0	0	110.2	G493 H523	S480-G493 PolarHBondContact N-O 2.79Å; S480-G493 PolarHBondContact O-N 2.98Å; S480-H523 WeakPolarHBondContact CB-O 3.28Å; S480-H523 PolarHBondContact OG-O 2.96Å
481	I	93.7	Very high	87.3	Confident	9 Å²	9	46.2 Å²	46.2	5%	0.046	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	139	175	-58.7	163.3	0	0	0	107.4	A437 T439 G450 L456 I478 L490 A491 V492	A437-I481 HydrophobicContact CB-CB 4.07Å; A437-I481 HydrophobicContact CB-CD1 3.58Å; A437-I481 HydrophobicContact CB-CG1 3.56Å; T439-I481 HydrophobicContact CG2-CB 4.08Å; T439-I481 HydrophobicContact CG2-CG2 3.54Å; G450-I481 VanDerWaalsContact CA-CD1 3.49Å; L456-I481 HydrophobicContact CD1-CD1 3.5Å; L456-I481 HydrophobicContact CD1-CG1 4.43Å; I478-I481 HydrophobicContact CG2-CD1 3.79Å; I478-I481 HydrophobicContact CG2-CG1 3.58Å; I481-L490 HydrophobicContact CG2-CD1 3.28Å; I481-L490 HydrophobicContact CG2-CD2 4.47Å; I481-L490 HydrophobicContact CG2-CG 4Å; I481-A491 VanDerWaalsContact CA-O 3.29Å; I481-A491 WeakPolarHBondContact CA-O 3.34Å; I481-V492 HydrophobicContact CG1-CG1 4.25Å; I481-V492 HydrophobicContact CG1-CG2 4.36Å; I481-V492 HydrophobicContact CG2-CG2 4.42Å
482	T	93.7	Very high	87.6	Confident	25 Å²	25	41 Å²	41	15%	0.153	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.1	172.4	-168	0	0	0	0	111.6	L490 A491 I525 F527	T482-L490 WeakPolarHBondContact O-CD1 3.5Å; T482-A491 HydrophobicContact CG2-CB 4.19Å; T482-A491 PolarHBondContact N-O 3.38Å; T482-A491 PolarHBondContact O-N 3.3Å; T482-I525 HydrophobicContact CG2-CB 3.86Å; T482-I525 HydrophobicContact CG2-CG2 3.42Å; T482-I525 VanDerWaalsContact CG2-CG2 3.42Å; T482-F527 HydrophobicContact CG2-CD2 3.65Å; T482-F527 HydrophobicContact CG2-CE2 3.85Å
483	F	94.2	Very high	87.9	Confident	13 Å²	13	40.7 Å²	40.7	6%	0.057	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	146.5	170.1	-79.5	-76.6	0	0	0	110.1	T439 C440 H441 A448 L458 L490 A504	T439-F483 HydrophobicContact CG2-CD2 3.43Å; T439-F483 VanDerWaalsContact CG2-CD2 3.43Å; T439-F483 HydrophobicContact CG2-CE2 3.68Å; T439-F483 HydrophobicContact CG2-CG 4.39Å; C440-F483 WeakPolarHBondContact O-CD2 3.04Å; H441-F483 HydrophobicContact CB-CD2 4.44Å; H441-F483 HydrophobicContact CB-CE2 4.3Å; H441-F483 HydrophobicContact CB-CZ 4.45Å; H441-F483 AromaticContact CD2-CD1 3.86Å; H441-F483 AromaticContact CD2-CE1 3.85Å; A448-F483 HydrophobicContact CB-CE2 3.7Å; A448-F483 HydrophobicContact CB-CZ 3.94Å; L458-F483 HydrophobicContact CD2-CZ 3.97Å; F483-L490 HydrophobicContact CD1-CB 4.2Å; F483-L490 HydrophobicContact CD1-CD1 3.72Å; F483-L490 HydrophobicContact CD1-CG 4.47Å; F483-L490 HydrophobicContact CD2-CD1 4.03Å; F483-L490 HydrophobicContact CE1-CB 4.1Å; F483-L490 HydrophobicContact CE1-CD1 3.69Å; F483-L490 HydrophobicContact CE1-CD2 4.12Å; F483-L490 HydrophobicContact CE1-CG 4.2Å; F483-L490 HydrophobicContact CE2-CD1 4.02Å; F483-L490 HydrophobicContact CG-CD1 3.88Å; F483-L490 HydrophobicContact CZ-CD1 3.85Å; F483-L490 HydrophobicContact CZ-CD2 4.19Å; F483-A504 HydrophobicContact CD1-CB 4.24Å; F483-A504 HydrophobicContact CE1-CB 3.97Å
484	D	92.4	Very high	88.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.168	C	C	.	.			trans	-62.7	138	165.8	174.5	29.6	0	0	0	110.6	P442 K486 G487 F489 F527 S531	P442-D484 WeakPolarHBondContact CG-O 3.18Å; D484-K486 PolarHBondContact O-N 2.88Å; D484-G487 WeakPolarHBondContact O-CA 3.2Å; D484-G487 PolarHBondContact O-N 3.47Å; D484-F489 HydrophobicContact CB-CB 4.02Å; D484-F489 HydrophobicContact CB-CD2 4.38Å; D484-F489 WeakPolarHBondContact CB-O 2.98Å; D484-F489 PolarHBondContact N-O 3.18Å; D484-F527 HydrophobicContact CB-CD1 4.43Å; D484-F527 HydrophobicContact CB-CD2 4.2Å; D484-F527 HydrophobicContact CB-CE1 4.49Å; D484-F527 HydrophobicContact CB-CE2 4.27Å; D484-F527 HydrophobicContact CB-CG 4.28Å; D484-F527 HydrophobicContact CB-CZ 4.41Å; D484-S531 VanDerWaalsContact CG-CB 3.45Å; D484-S531 WeakPolarHBondContact OD1-CA 3.18Å; D484-S531 WeakPolarHBondContact OD1-CB 3.31Å; D484-S531 PolarHBondContact OD1-OG 3.37Å; D484-S531 VanDerWaalsContact OD2-CB 3.25Å; D484-S531 WeakPolarHBondContact OD2-CB 3.49Å; D484-S531 PolarHBondContact OD2-OG 3.03Å
485	P	88.4	Confident	89.2	Confident	52 Å²	52	33.8 Å²	33.8	34%	0.338	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-25.6	175.4	-33.8	37.3	0	0	0	115.6	F443 F527	F443-P485 WeakPolarHBondContact CE2-O 3.17Å; P485-F527 VanDerWaalsContact CD-CB 3.48Å; P485-F527 HydrophobicContact CG-CB 4.4Å
486	K	88.1	Confident	89.6	Confident	110 Å²	110	35.3 Å²	35.3	48%	0.478	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.7	172.9	-69.8	178.2	-171.4	161.2	0	114	D484 L488 D530 S531	D484-K486 PolarHBondContact O-N 2.88Å; K486-L488 VanDerWaalsContact C-N 3.34Å; K486-L488 HydrophobicContact CB-CD1 4.31Å; K486-L488 HydrophobicContact CB-CG 4.29Å; K486-D530 WeakPolarHBondContact CE-O 3.43Å; K486-D530 PolarHBondContact NZ-O 3.38Å; K486-S531 WeakPolarHBondContact CD-OG 3.23Å; K486-S531 WeakPolarHBondContact CG-OG 3.31Å
487	G	87.7	Confident	90	Very high	8 Å²	8	31.2 Å²	31.2	8%	0.082	16%	0.156	C	C	.	.	S	Bend	trans	78.3	12.6	-179.1	0	0	0	0	0	114.8	H441 D484 A504	H441-G487 VanDerWaalsContact NE2-CA 3.34Å; H441-G487 WeakPolarHBondContact NE2-CA 3.4Å; H441-G487 PolarHBondContact NE2-O 3.48Å; D484-G487 WeakPolarHBondContact O-CA 3.2Å; D484-G487 PolarHBondContact O-N 3.47Å; G487-A504 VanDerWaalsContact O-CB 3.31Å; G487-A504 WeakPolarHBondContact O-CB 3.34Å
488	L	87.9	Confident	90.1	Very high	98 Å²	98	28.4 Å²	28.4	51%	0.513	14%	0.143	S	C	.	.	S	Bend	trans	-86.5	-36.8	-177.2	-65.3	173.5	0	0	0	112.4	K486 A504	K486-L488 VanDerWaalsContact C-N 3.34Å; K486-L488 HydrophobicContact CB-CD1 4.31Å; K486-L488 HydrophobicContact CB-CG 4.29Å; L488-A504 WeakPolarHBondContact O-CB 3.19Å; L488-A504 PolarHBondContact O-N 3.47Å
489	F	90.6	Very high	90.1	Very high	27 Å²	27	28.4 Å²	28.4	12%	0.118	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	154.8	-176.2	-52.4	-74.4	0	0	0	112.3	D484 I501 L502 F527 P556 W558	D484-F489 HydrophobicContact CB-CB 4.02Å; D484-F489 HydrophobicContact CB-CD2 4.38Å; D484-F489 WeakPolarHBondContact CB-O 2.98Å; D484-F489 PolarHBondContact N-O 3.18Å; F489-I501 HydrophobicContact CB-CG2 4.13Å; F489-I501 HydrophobicContact CD1-CG2 4.29Å; F489-I501 HydrophobicContact CG-CG2 4.42Å; F489-L502 CarbonylContact C-O 3.56Å; F489-L502 VanDerWaalsContact CA-O 3.27Å; F489-L502 WeakPolarHBondContact CA-O 3.18Å; F489-F527 HydrophobicContact CB-CZ 4.17Å; F489-P556 HydrophobicContact CE1-CB 4.02Å; F489-P556 HydrophobicContact CE1-CG 3.48Å; F489-P556 VanDerWaalsContact CE1-CG 3.48Å; F489-P556 HydrophobicContact CZ-CB 3.64Å; F489-P556 HydrophobicContact CZ-CG 3.47Å; F489-P556 VanDerWaalsContact CZ-CG 3.47Å; F489-W558 HydrophobicContact CD2-CZ2 4.27Å
490	L	92.6	Very high	90.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	115.2	173.2	180	61.5	0	0	0	108.7	T439 L456 L458 I481 T482 F483 L502 L507	T439-L490 HydrophobicContact CG2-CD1 4.15Å; L456-L490 HydrophobicContact CD1-CD2 4.36Å; L456-L490 HydrophobicContact CD2-CD2 3.81Å; L458-L490 HydrophobicContact CD2-CD2 4.4Å; I481-L490 HydrophobicContact CG2-CD1 3.28Å; I481-L490 HydrophobicContact CG2-CD2 4.47Å; I481-L490 HydrophobicContact CG2-CG 4Å; T482-L490 WeakPolarHBondContact O-CD1 3.5Å; F483-L490 HydrophobicContact CD1-CB 4.2Å; F483-L490 HydrophobicContact CD1-CD1 3.72Å; F483-L490 HydrophobicContact CD1-CG 4.47Å; F483-L490 HydrophobicContact CD2-CD1 4.03Å; F483-L490 HydrophobicContact CE1-CB 4.1Å; F483-L490 HydrophobicContact CE1-CD1 3.69Å; F483-L490 HydrophobicContact CE1-CD2 4.12Å; F483-L490 HydrophobicContact CE1-CG 4.2Å; F483-L490 HydrophobicContact CE2-CD1 4.02Å; F483-L490 HydrophobicContact CG-CD1 3.88Å; F483-L490 HydrophobicContact CZ-CD1 3.85Å; F483-L490 HydrophobicContact CZ-CD2 4.19Å; L490-L502 HydrophobicContact CB-CB 4.31Å; L490-L502 HydrophobicContact CD2-CD1 4.47Å; L490-L502 PolarHBondContact N-O 3.43Å; L490-L502 WeakPolarHBondContact O-CB 3.18Å; L490-L502 PolarHBondContact O-N 2.89Å; L490-L507 HydrophobicContact CD2-CD2 3.88Å
491	A	92.2	Very high	90.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.8	176.2	0	0	0	0	0	110.6	I481 T482 Y500 I525 F527 L534	I481-A491 VanDerWaalsContact CA-O 3.29Å; I481-A491 WeakPolarHBondContact CA-O 3.34Å; T482-A491 HydrophobicContact CG2-CB 4.19Å; T482-A491 PolarHBondContact N-O 3.38Å; T482-A491 PolarHBondContact O-N 3.3Å; A491-Y500 CarbonylContact C-O 3.6Å; A491-Y500 WeakPolarHBondContact CA-O 3.45Å; A491-I525 HydrophobicContact CB-CG2 3.85Å; A491-F527 HydrophobicContact CB-CE2 3.49Å; A491-F527 VanDerWaalsContact CB-CE2 3.49Å; A491-F527 HydrophobicContact CB-CZ 3.62Å; A491-L534 HydrophobicContact CB-CD1 3.94Å; A491-L534 HydrophobicContact CB-CD2 4.07Å
492	V	92.6	Very high	90	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.9	-179.6	-174.9	0	0	0	0	109.3	L456 I478 I481 F494 V499 Y500 L502	L456-V492 HydrophobicContact CD2-CG2 4.24Å; I478-V492 HydrophobicContact CB-CG1 4.41Å; I478-V492 HydrophobicContact CD1-CG1 4.21Å; I478-V492 HydrophobicContact CG1-CG1 3.9Å; I478-V492 HydrophobicContact CG2-CG1 3.68Å; I481-V492 HydrophobicContact CG1-CG1 4.25Å; I481-V492 HydrophobicContact CG1-CG2 4.36Å; I481-V492 HydrophobicContact CG2-CG2 4.42Å; V492-F494 HydrophobicContact CB-CE2 4.2Å; V492-F494 HydrophobicContact CG1-CD2 4.37Å; V492-F494 HydrophobicContact CG1-CE1 4.47Å; V492-F494 HydrophobicContact CG1-CE2 3.68Å; V492-F494 HydrophobicContact CG1-CZ 3.76Å; V492-V499 WeakPolarHBondContact O-CA 3.29Å; V492-Y500 PolarHBondContact N-O 2.95Å; V492-Y500 PolarHBondContact O-N 3.23Å; V492-L502 HydrophobicContact CG2-CD1 3.92Å; V492-L502 HydrophobicContact CG2-CG 4.35Å
493	G	91	Very high	89.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.5	176	0	0	0	0	0	111.9	Q479 S480 I525	Q479-G493 PolarHBondContact N-O 3.3Å; S480-G493 PolarHBondContact N-O 2.79Å; S480-G493 PolarHBondContact O-N 2.98Å; G493-I525 VanDerWaalsContact CA-CD1 3.49Å; G493-I525 VanDerWaalsContact N-CD1 3.28Å
494	F	90.6	Very high	89.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	160.1	-179.8	-64.5	-93.7	0	0	0	111.7	F472 E475 Q477 I478 V492 T496 G497 A498 Y500 I522	F472-F494 HydrophobicContact CB-CE1 4.13Å; F472-F494 HydrophobicContact CB-CZ 4.23Å; F472-F494 AromaticContact CD1-CZ 3.98Å; F472-F494 HydrophobicContact CD1-CZ 3.98Å; F472-F494 AromaticContact CD2-CE1 3.89Å; F472-F494 HydrophobicContact CD2-CE1 3.89Å; F472-F494 AromaticContact CD2-CZ 3.57Å; F472-F494 HydrophobicContact CD2-CZ 3.57Å; F472-F494 HydrophobicContact CE1-CZ 4.21Å; F472-F494 AromaticContact CE2-CZ 3.86Å; F472-F494 HydrophobicContact CE2-CZ 3.86Å; F472-F494 HydrophobicContact CG-CE1 4.01Å; F472-F494 AromaticContact CG-CZ 3.66Å; F472-F494 HydrophobicContact CG-CZ 3.66Å; F472-F494 HydrophobicContact CZ-CZ 4.17Å; E475-F494 HydrophobicContact CB-CB 4.5Å; E475-F494 HydrophobicContact CB-CD1 3.73Å; E475-F494 HydrophobicContact CB-CD2 4.38Å; E475-F494 HydrophobicContact CB-CE1 3.98Å; E475-F494 HydrophobicContact CB-CG 3.95Å; E475-F494 HydrophobicContact CB-CZ 4.42Å; E475-F494 VanDerWaalsContact O-CE1 3.31Å; E475-F494 WeakPolarHBondContact O-CE1 3.33Å; Q477-F494 WeakPolarHBondContact O-CA 3.5Å; I478-F494 HydrophobicContact CG1-CD1 4.08Å; I478-F494 HydrophobicContact CG1-CE1 3.62Å; I478-F494 HydrophobicContact CG1-CZ 4.18Å; V492-F494 HydrophobicContact CB-CE2 4.2Å; V492-F494 HydrophobicContact CG1-CD2 4.37Å; V492-F494 HydrophobicContact CG1-CE1 4.47Å; V492-F494 HydrophobicContact CG1-CE2 3.68Å; V492-F494 HydrophobicContact CG1-CZ 3.76Å; F494-T496 PolarHBondContact O-N 3.16Å; F494-G497 PolarHBondContact O-N 3.02Å; F494-A498 HydrophobicContact CB-CB 4.33Å; F494-A498 HydrophobicContact CD2-CB 4.15Å; F494-A498 WeakPolarHBondContact CD2-O 3.32Å; F494-A498 PolarHBondContact N-O 3.28Å; F494-Y500 AromaticContact CD2-CD2 3.77Å; F494-Y500 HydrophobicContact CD2-CD2 3.77Å; F494-Y500 HydrophobicContact CD2-CE2 4.13Å; F494-Y500 AromaticContact CE2-CD2 3.28Å; F494-Y500 HydrophobicContact CE2-CD2 3.28Å; F494-Y500 AromaticContact CE2-CE2 3.78Å; F494-Y500 HydrophobicContact CE2-CE2 3.78Å; F494-Y500 AromaticContact CE2-CG 3.82Å; F494-Y500 HydrophobicContact CE2-CG 3.82Å; F494-Y500 HydrophobicContact CZ-CD2 4.22Å; F494-Y500 HydrophobicContact CZ-CE2 4.49Å; F494-I522 PolarHBondContact O-N 3.3Å
495	R	88.5	Confident	88.9	Confident	138 Å²	138	32.6 Å²	32.6	52%	0.521	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26	173	-168.5	-177	-178.1	167.5	0.6	113	Q477 Q479 G497 S521	Q477-R495 HydrophobicContact CB-CB 3.94Å; Q477-R495 PolarHBondContact O-N 3.06Å; Q479-R495 HydrophobicContact CG-CB 4.03Å; R495-G497 PolarHBondContact O-N 2.87Å; R495-S521 VanDerWaalsContact O-CA 3.24Å; R495-S521 WeakPolarHBondContact O-CA 3.48Å; R495-S521 PolarHBondContact O-N 2.87Å
496	T	85.9	Confident	88.7	Confident	65 Å²	65	33.7 Å²	33.7	40%	0.399	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.9	178	54.8	0	0	0	0	113.2	E475 F494	E475-T496 WeakPolarHBondContact OE2-CB 2.96Å; E475-T496 WeakPolarHBondContact OE2-CG2 3.34Å; E475-T496 PolarHBondContact OE2-OG1 3.11Å; F494-T496 PolarHBondContact O-N 3.16Å
497	G	84.6	Confident	88.6	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	91.3	4.3	-174.1	0	0	0	0	0	113.8	F494 R495 I518 D520 I522	F494-G497 PolarHBondContact O-N 3.02Å; R495-G497 PolarHBondContact O-N 2.87Å; G497-I518 WeakPolarHBondContact O-CB 3.37Å; G497-D520 WeakPolarHBondContact CA-O 3.46Å; G497-D520 PolarHBondContact N-O 2.86Å; G497-I522 VanDerWaalsContact C-CD1 3.45Å; G497-I522 WeakPolarHBondContact O-CD1 3.14Å
498	A	88.8	Confident	88.4	Confident	2 Å²	2	35.2 Å²	35.2	2%	0.017	18%	0.181	C	C	.	.			trans	-73.5	137.8	172.1	0	0	0	0	0	111.2	E475 F494 Y500 F515 N516 I522	E475-A498 HydrophobicContact CG-CB 4.02Å; F494-A498 HydrophobicContact CB-CB 4.33Å; F494-A498 HydrophobicContact CD2-CB 4.15Å; F494-A498 WeakPolarHBondContact CD2-O 3.32Å; F494-A498 PolarHBondContact N-O 3.28Å; A498-Y500 HydrophobicContact CB-CD2 4.28Å; A498-Y500 HydrophobicContact CB-CE2 3.87Å; A498-F515 WeakPolarHBondContact CA-O 3.34Å; A498-N516 WeakPolarHBondContact CB-OD1 3.5Å; A498-I522 VanDerWaalsContact O-CD1 3.25Å; A498-I522 WeakPolarHBondContact O-CD1 3.17Å
499	V	89.9	Confident	88	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126	169	-175.2	0	0	0	0	108.5	V492 F515 I522 L534 T536 F546	V492-V499 WeakPolarHBondContact O-CA 3.29Å; V499-F515 HydrophobicContact CB-CB 4.39Å; V499-F515 PolarHBondContact N-O 2.82Å; V499-F515 PolarHBondContact O-N 3.28Å; V499-I522 HydrophobicContact CG2-CD1 3.41Å; V499-I522 VanDerWaalsContact CG2-CD1 3.41Å; V499-L534 HydrophobicContact CG1-CD2 4.2Å; V499-T536 HydrophobicContact CG1-CG2 4.44Å; V499-T536 HydrophobicContact CG2-CG2 4.01Å; V499-F546 HydrophobicContact CG2-CE2 4.38Å; V499-F546 HydrophobicContact CG2-CZ 4.18Å
500	Y	90.1	Very high	87.2	Confident	11 Å²	11	34.2 Å²	34.2	4%	0.043	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.8	173.6	-77	-120.2	0	0	0	108.8	F472 E475 A491 V492 F494 A498 I514	F472-Y500 HydrophobicContact CD1-CD1 4.3Å; F472-Y500 HydrophobicContact CD1-CE1 4.19Å; F472-Y500 AromaticContact CE1-CD1 3.81Å; F472-Y500 HydrophobicContact CE1-CD1 3.81Å; F472-Y500 HydrophobicContact CE1-CE1 4.15Å; F472-Y500 HydrophobicContact CE1-CG 4.38Å; E475-Y500 HydrophobicContact CG-CE2 3.98Å; A491-Y500 CarbonylContact C-O 3.6Å; A491-Y500 WeakPolarHBondContact CA-O 3.45Å; V492-Y500 PolarHBondContact N-O 2.95Å; V492-Y500 PolarHBondContact O-N 3.23Å; F494-Y500 AromaticContact CD2-CD2 3.77Å; F494-Y500 HydrophobicContact CD2-CD2 3.77Å; F494-Y500 HydrophobicContact CD2-CE2 4.13Å; F494-Y500 AromaticContact CE2-CD2 3.28Å; F494-Y500 HydrophobicContact CE2-CD2 3.28Å; F494-Y500 AromaticContact CE2-CE2 3.78Å; F494-Y500 HydrophobicContact CE2-CE2 3.78Å; F494-Y500 AromaticContact CE2-CG 3.82Å; F494-Y500 HydrophobicContact CE2-CG 3.82Å; F494-Y500 HydrophobicContact CZ-CD2 4.22Å; F494-Y500 HydrophobicContact CZ-CE2 4.49Å; A498-Y500 HydrophobicContact CB-CD2 4.28Å; A498-Y500 HydrophobicContact CB-CE2 3.87Å; Y500-I514 HydrophobicContact CD1-CG1 4.12Å; Y500-I514 HydrophobicContact CD2-CG2 4.36Å; Y500-I514 HydrophobicContact CE1-CD1 3.79Å; Y500-I514 HydrophobicContact CE1-CG1 3.74Å; Y500-I514 HydrophobicContact CE1-CG2 4.29Å; Y500-I514 HydrophobicContact CE2-CG2 3.71Å
501	I	90.3	Very high	85.7	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.7	170.5	-54.5	173.2	0	0	0	106.8	F489 N509 F515 L534 W558	F489-I501 HydrophobicContact CB-CG2 4.13Å; F489-I501 HydrophobicContact CD1-CG2 4.29Å; F489-I501 HydrophobicContact CG-CG2 4.42Å; I501-N509 WeakPolarHBondContact O-CB 3.41Å; I501-F515 HydrophobicContact CD1-CE2 4.08Å; I501-L534 HydrophobicContact CD1-CD2 3.59Å; I501-L534 HydrophobicContact CG1-CD2 3.88Å; I501-W558 HydrophobicContact CD1-CB 3.71Å; I501-W558 HydrophobicContact CD1-CD2 3.4Å; I501-W558 VanDerWaalsContact CD1-CD2 3.4Å; I501-W558 HydrophobicContact CD1-CE3 3.9Å; I501-W558 HydrophobicContact CD1-CG 3.29Å
502	L	90	Very high	84.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.9	-176.9	-45.3	-177.9	0	0	0	109.1	L456 R470 F472 F489 L490 V492 L507 Q508 N509	L456-L502 HydrophobicContact CD2-CD1 3.48Å; L456-L502 VanDerWaalsContact CD2-CD1 3.48Å; R470-L502 VanDerWaalsContact NH1-CD2 3.29Å; F472-L502 HydrophobicContact CZ-CD1 4.01Å; F472-L502 HydrophobicContact CZ-CD2 4.37Å; F489-L502 CarbonylContact C-O 3.56Å; F489-L502 VanDerWaalsContact CA-O 3.27Å; F489-L502 WeakPolarHBondContact CA-O 3.18Å; L490-L502 HydrophobicContact CB-CB 4.31Å; L490-L502 HydrophobicContact CD2-CD1 4.47Å; L490-L502 PolarHBondContact N-O 3.43Å; L490-L502 WeakPolarHBondContact O-CB 3.18Å; L490-L502 PolarHBondContact O-N 2.89Å; V492-L502 HydrophobicContact CG2-CD1 3.92Å; V492-L502 HydrophobicContact CG2-CG 4.35Å; L502-L507 HydrophobicContact CD1-CD2 4.25Å; L502-Q508 WeakPolarHBondContact CA-O 3.33Å; L502-N509 HydrophobicContact CD2-CB 3.68Å
503	D	87.9	Confident	82.8	Confident	57 Å²	57	46.2 Å²	46.2	31%	0.305	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	130.3	157.3	171.1	8.2	0	0	0	109	T505 T506 L507 Q508	D503-T505 PolarHBondContact O-N 3.28Å; D503-T505 PolarHBondContact OD1-N 2.85Å; D503-T505 VanDerWaalsContact OD1-N 3.1Å; D503-T505 PolarHBondContact OD1-OG1 2.86Å; D503-T505 VanDerWaalsContact OD1-OG1 3.07Å; D503-T505 PolarHBondContact OD2-OG1 3.34Å; D503-T506 WeakPolarHBondContact CB-OG1 3.38Å; D503-T506 WeakPolarHBondContact OD2-CG2 3.25Å; D503-T506 PolarHBondContact OD2-OG1 2.7Å; D503-L507 WeakPolarHBondContact O-CA 3.43Å; D503-L507 PolarHBondContact O-N 2.65Å; D503-Q508 PolarHBondContact N-O 3.49Å
504	A	85.9	Confident	81.8	Confident	7 Å²	7	48.8 Å²	48.8	6%	0.058	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-27.9	-175.2	0	0	0	0	0	113.4	F483 G487 L488	F483-A504 HydrophobicContact CD1-CB 4.24Å; F483-A504 HydrophobicContact CE1-CB 3.97Å; G487-A504 VanDerWaalsContact O-CB 3.31Å; G487-A504 WeakPolarHBondContact O-CB 3.34Å; L488-A504 WeakPolarHBondContact O-CB 3.19Å; L488-A504 PolarHBondContact O-N 3.47Å
505	T	84.3	Confident	81	Confident	108 Å²	108	49.7 Å²	49.7	66%	0.663	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-48.1	-175.5	59.9	0	0	0	0	112.8	D503	D503-T505 PolarHBondContact O-N 3.28Å; D503-T505 PolarHBondContact OD1-N 2.85Å; D503-T505 VanDerWaalsContact OD1-N 3.1Å; D503-T505 PolarHBondContact OD1-OG1 2.86Å; D503-T505 VanDerWaalsContact OD1-OG1 3.07Å; D503-T505 PolarHBondContact OD2-OG1 3.34Å
506	T	84.1	Confident	80	Confident	75 Å²	75	47.6 Å²	47.6	46%	0.46	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-15.7	-177.2	61.5	0	0	0	0	113.1	D503 Q508	D503-T506 WeakPolarHBondContact CB-OG1 3.38Å; D503-T506 WeakPolarHBondContact OD2-CG2 3.25Å; D503-T506 PolarHBondContact OD2-OG1 2.7Å; T506-Q508 PolarHBondContact O-N 2.82Å; T506-Q508 VanDerWaalsContact O-N 3.08Å; T506-Q508 PolarHBondContact OG1-N 2.89Å
507	L	84.8	Confident	78.6	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.047	26%	0.261	C	S	.	.			trans	54.8	16	-169.2	-64	177.1	0	0	0	113.5	L456 L458 R470 L490 L502 D503	L456-L507 HydrophobicContact CD2-CD2 3.78Å; L458-L507 HydrophobicContact CD1-CD1 3.93Å; L458-L507 HydrophobicContact CD1-CD2 3.76Å; L458-L507 HydrophobicContact CD1-CG 3.91Å; L458-L507 HydrophobicContact CG-CD1 4.08Å; L458-L507 HydrophobicContact CG-CD2 4.16Å; L458-L507 HydrophobicContact CG-CG 4.48Å; R470-L507 HydrophobicContact CB-CB 4.41Å; R470-L507 HydrophobicContact CB-CD1 4.19Å; R470-L507 WeakPolarHBondContact CD-O 3.48Å; R470-L507 PolarHBondContact NH1-O 2.79Å; L490-L507 HydrophobicContact CD2-CD2 3.88Å; L502-L507 HydrophobicContact CD1-CD2 4.25Å; D503-L507 WeakPolarHBondContact O-CA 3.43Å; D503-L507 PolarHBondContact O-N 2.65Å
508	Q	83.1	Confident	77.6	Confident	140 Å²	140	48.4 Å²	48.4	65%	0.654	27%	0.265	S	S	*	.			trans	-87.8	155.1	177.4	-64.6	-172.4	1.6	0	0	110.9	L502 D503 T506	L502-Q508 WeakPolarHBondContact CA-O 3.33Å; D503-Q508 PolarHBondContact N-O 3.49Å; T506-Q508 PolarHBondContact O-N 2.82Å; T506-Q508 VanDerWaalsContact O-N 3.08Å; T506-Q508 PolarHBondContact OG1-N 2.89Å
509	N	79.9	Confident	76.6	Confident	34 Å²	34	58.4 Å²	58.4	18%	0.182	31%	0.309	C	S	.	.			trans	-126.4	151.6	175.9	66.1	-53.6	0	0	0	110.8	R470 I501 L502 I514	R470-N509 VanDerWaalsContact CZ-OD1 3.3Å; R470-N509 PolarHBondContact NH1-OD1 3.37Å; R470-N509 PolarHBondContact NH2-OD1 3.42Å; I501-N509 WeakPolarHBondContact O-CB 3.41Å; L502-N509 HydrophobicContact CD2-CB 3.68Å; N509-I514 WeakPolarHBondContact ND2-CG1 3.39Å
510	N	74.3	Confident	76.2	Confident	71 Å²	71	61.5 Å²	61.5	38%	0.38	33%	0.325	S	S	.	.			trans	-77	136.6	166	-63.8	-38.4	0	0	0	109.2	Q512 E513	N510-Q512 PolarHBondContact O-N 3.34Å; N510-Q512 VanDerWaalsContact O-N 3.13Å; N510-E513 HydrophobicContact CB-CB 4.43Å; N510-E513 HydrophobicContact CB-CG 3.94Å; N510-E513 WeakPolarHBondContact CB-OE2 3.32Å; N510-E513 PolarHBondContact ND2-OE2 3.32Å; N510-E513 WeakPolarHBondContact O-CB 3.43Å; N510-E513 PolarHBondContact O-N 2.76Å
511	P	61.3	Low	76	Confident	109 Å²	109	61.4 Å²	61.4	71%	0.708	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64.4	-19.8	-178.8	24	-32.9	0	0	0	113.3	E513	P511-E513 VanDerWaalsContact C-N 3.28Å
512	Q	60	Low	76	Confident	133 Å²	133	61.3 Å²	61.3	62%	0.621	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-78.2	-9.4	173.8	-64.3	-172.7	-0.2	0	0	113.6	N510	N510-Q512 PolarHBondContact O-N 3.34Å; N510-Q512 VanDerWaalsContact O-N 3.13Å
513	E	64.1	Low	75.8	Confident	9 Å²	9	65.6 Å²	65.6	4%	0.042	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-105.3	17.5	-177	-60.4	179.2	148.8	0	0	112.3	N510 P511 F515 R557 W558	N510-E513 HydrophobicContact CB-CB 4.43Å; N510-E513 HydrophobicContact CB-CG 3.94Å; N510-E513 WeakPolarHBondContact CB-OE2 3.32Å; N510-E513 PolarHBondContact ND2-OE2 3.32Å; N510-E513 WeakPolarHBondContact O-CB 3.43Å; N510-E513 PolarHBondContact O-N 2.76Å; P511-E513 VanDerWaalsContact C-N 3.28Å; E513-F515 HydrophobicContact CB-CE2 4.31Å; E513-F515 WeakPolarHBondContact O-CD2 3.14Å; E513-F515 WeakPolarHBondContact O-CE2 3.06Å; E513-R557 WeakPolarHBondContact OE1-CA 3.34Å; E513-W558 HydrophobicContact CG-CB 4.42Å; E513-W558 PolarHBondContact OE1-N 2.8Å
514	I	69.6	Low	75.9	Confident	54 Å²	54	64.8 Å²	64.8	28%	0.277	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	107	168.4	-56.9	173.7	0	0	0	107.1	Y500 N509 N516	Y500-I514 HydrophobicContact CD1-CG1 4.12Å; Y500-I514 HydrophobicContact CD2-CG2 4.36Å; Y500-I514 HydrophobicContact CE1-CD1 3.79Å; Y500-I514 HydrophobicContact CE1-CG1 3.74Å; Y500-I514 HydrophobicContact CE1-CG2 4.29Å; Y500-I514 HydrophobicContact CE2-CG2 3.71Å; N509-I514 WeakPolarHBondContact ND2-CG1 3.39Å; I514-N516 WeakPolarHBondContact CG2-OD1 3.3Å
515	F	74.1	Confident	76.2	Confident	19 Å²	19	65.1 Å²	65.1	8%	0.083	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	100.4	-179.4	-58.2	-77.6	0	0	0	110.3	A498 V499 I501 E513 C517 F546 W558 F560	A498-F515 WeakPolarHBondContact CA-O 3.34Å; V499-F515 HydrophobicContact CB-CB 4.39Å; V499-F515 PolarHBondContact N-O 2.82Å; V499-F515 PolarHBondContact O-N 3.28Å; I501-F515 HydrophobicContact CD1-CE2 4.08Å; E513-F515 HydrophobicContact CB-CE2 4.31Å; E513-F515 WeakPolarHBondContact O-CD2 3.14Å; E513-F515 WeakPolarHBondContact O-CE2 3.06Å; F515-C517 VanDerWaalsContact C-N 3.28Å; F515-C517 PolarHBondContact O-N 2.84Å; F515-F546 HydrophobicContact CB-CE1 3.69Å; F515-F546 HydrophobicContact CB-CZ 4.23Å; F515-F546 HydrophobicContact CD1-CD1 4.17Å; F515-F546 AromaticContact CD1-CE1 3.87Å; F515-F546 HydrophobicContact CD1-CE1 3.87Å; F515-F546 AromaticContact CD2-CD1 3.95Å; F515-F546 HydrophobicContact CD2-CD1 3.95Å; F515-F546 AromaticContact CD2-CE1 3.77Å; F515-F546 HydrophobicContact CD2-CE1 3.77Å; F515-F546 HydrophobicContact CE1-CD1 4.33Å; F515-F546 HydrophobicContact CE1-CE1 4.47Å; F515-F546 HydrophobicContact CE2-CD1 4.11Å; F515-F546 HydrophobicContact CE2-CE1 4.39Å; F515-F546 AromaticContact CG-CD1 3.99Å; F515-F546 HydrophobicContact CG-CD1 3.99Å; F515-F546 AromaticContact CG-CE1 3.48Å; F515-F546 HydrophobicContact CG-CE1 3.48Å; F515-F546 VanDerWaalsContact CG-CE1 3.48Å; F515-F546 HydrophobicContact CG-CZ 4.42Å; F515-F546 HydrophobicContact CZ-CD1 4.3Å; F515-W558 HydrophobicContact CE2-CB 3.87Å; F515-W558 HydrophobicContact CZ-CB 3.78Å; F515-W558 WeakPolarHBondContact CZ-O 3.36Å; F515-F560 HydrophobicContact CD1-CB 4.43Å
516	N	67.1	Low	76.5	Confident	95 Å²	95	61.1 Å²	61.1	51%	0.508	32%	0.317	S	S	.	.			trans	-95.8	38.3	173.5	-70.6	6.6	0	0	0	111.5	A498 I514 I518	A498-N516 WeakPolarHBondContact CB-OD1 3.5Å; I514-N516 WeakPolarHBondContact CG2-OD1 3.3Å; N516-I518 PolarHBondContact O-N 2.91Å
517	C	57.1	Low	76.9	Confident	62 Å²	62	58 Å²	58	42%	0.419	30%	0.297	S	S	.	.			trans	-77.9	-10.2	-175	-58.8	0	0	0	0	113	F515	F515-C517 VanDerWaalsContact C-N 3.28Å; F515-C517 PolarHBondContact O-N 2.84Å
518	I	62.9	Low	77.2	Confident	19 Å²	19	57.6 Å²	57.6	10%	0.097	30%	0.295	C	S	.	.			trans	-122.3	141.4	-169.5	-47.9	166.9	0	0	0	108.5	G497 N516 I522 D538	G497-I518 WeakPolarHBondContact O-CB 3.37Å; N516-I518 PolarHBondContact O-N 2.91Å; I518-I522 HydrophobicContact CD1-CD1 4.33Å; I518-I522 HydrophobicContact CD1-CG1 4.24Å; I518-D538 HydrophobicContact CG2-CB 4.04Å
519	K	68.4	Low	77.3	Confident	213 Å²	213	54.5 Å²	54.5	93%	0.926	28%	0.281	S	S	*	.	S	Bend	trans	-107.3	11	178.7	-69.1	-172.1	177.2	-176.3	0	113.2
520	D	81.3	Confident	77.6	Confident	64 Å²	64	54.8 Å²	54.8	34%	0.342	28%	0.282	S	S	.	.	S	Bend	trans	-136.3	160.8	-171.8	-150.9	-11.4	0	0	0	110.6	G497 I522 S540	G497-D520 WeakPolarHBondContact CA-O 3.46Å; G497-D520 PolarHBondContact N-O 2.86Å; D520-I522 PolarHBondContact O-N 3.3Å; D520-S540 WeakPolarHBondContact OD2-CB 3.3Å; D520-S540 PolarHBondContact OD2-N 3.31Å
521	S	86.3	Confident	78.2	Confident	9 Å²	9	51.7 Å²	51.7	6%	0.063	27%	0.266	C	S	.	.			trans	-65.6	128.9	-169.8	-176.8	0	0	0	0	112.6	R495 H523 D538 A539	R495-S521 VanDerWaalsContact O-CA 3.24Å; R495-S521 WeakPolarHBondContact O-CA 3.48Å; R495-S521 PolarHBondContact O-N 2.87Å; S521-H523 PolarHBondContact OG-CE1 2.67Å; S521-D538 CarbonylContact O-C 3.55Å; S521-D538 VanDerWaalsContact O-CA 3.31Å; S521-D538 WeakPolarHBondContact O-CA 3.45Å; S521-A539 PolarHBondContact O-N 2.96Å
522	I	88.9	Confident	79.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.9	174.7	-63.5	151.2	0	0	0	109.4	Q479 F494 G497 A498 V499 I518 D520 I525	Q479-I522 WeakPolarHBondContact CB-O 3.45Å; F494-I522 PolarHBondContact O-N 3.3Å; G497-I522 VanDerWaalsContact C-CD1 3.45Å; G497-I522 WeakPolarHBondContact O-CD1 3.14Å; A498-I522 VanDerWaalsContact O-CD1 3.25Å; A498-I522 WeakPolarHBondContact O-CD1 3.17Å; V499-I522 HydrophobicContact CG2-CD1 3.41Å; V499-I522 VanDerWaalsContact CG2-CD1 3.41Å; I518-I522 HydrophobicContact CD1-CD1 4.33Å; I518-I522 HydrophobicContact CD1-CG1 4.24Å; D520-I522 PolarHBondContact O-N 3.3Å; I522-I525 HydrophobicContact CG2-CD1 3.95Å; I522-I525 HydrophobicContact CG2-CG1 3.69Å
523	H	86.2	Confident	80.8	Confident	91 Å²	91	45.4 Å²	45.4	42%	0.421	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-34	-178.2	-68.9	-57.6	0	0	0	113.2	S480 S521 A537	S480-H523 WeakPolarHBondContact CB-O 3.28Å; S480-H523 PolarHBondContact OG-O 2.96Å; S521-H523 PolarHBondContact OG-CE1 2.67Å; H523-A537 PolarHBondContact N-O 3.42Å
524	L	89.4	Confident	82.1	Confident	40 Å²	40	45 Å²	45	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.6	-176.3	-57.2	167	0	0	0	110.3	T536 A537 I571 L574	L524-T536 CarbonylContact O-C 3.46Å; L524-T536 VanDerWaalsContact O-CA 3.29Å; L524-T536 WeakPolarHBondContact O-CA 3.15Å; L524-A537 HydrophobicContact CB-CB 4.06Å; L524-A537 HydrophobicContact CD1-CB 4.23Å; L524-A537 PolarHBondContact N-O 3.32Å; L524-A537 PolarHBondContact O-N 2.68Å; L524-I571 HydrophobicContact CD1-CG2 4.07Å; L524-L574 HydrophobicContact CB-CB 4.3Å; L524-L574 HydrophobicContact CD1-CB 4.18Å
525	I	92.9	Very high	83.1	Confident	13 Å²	13	42.4 Å²	42.4	7%	0.067	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.8	173.3	-56.3	-175.7	0	0	0	107.6	T482 A491 G493 I522 L534 A535 T536	T482-I525 HydrophobicContact CG2-CB 3.86Å; T482-I525 HydrophobicContact CG2-CG2 3.42Å; T482-I525 VanDerWaalsContact CG2-CG2 3.42Å; A491-I525 HydrophobicContact CB-CG2 3.85Å; G493-I525 VanDerWaalsContact CA-CD1 3.49Å; G493-I525 VanDerWaalsContact N-CD1 3.28Å; I522-I525 HydrophobicContact CG2-CD1 3.95Å; I522-I525 HydrophobicContact CG2-CG1 3.69Å; I525-L534 HydrophobicContact CG2-CD1 3.33Å; I525-L534 HydrophobicContact CG2-CG 4.3Å; I525-A535 WeakPolarHBondContact CA-O 3.45Å; I525-T536 HydrophobicContact CD1-CG2 4.46Å; I525-T536 HydrophobicContact CG1-CG2 4.01Å; I525-T536 HydrophobicContact CG2-CG2 4.2Å
526	T	91.6	Very high	83.9	Confident	25 Å²	25	41.5 Å²	41.5	15%	0.153	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	143.4	176.9	-170	0	0	0	0	110.7	L534 A535 L574 F576 L587	T526-L534 WeakPolarHBondContact O-CD1 3.22Å; T526-A535 HydrophobicContact CG2-CB 4.12Å; T526-A535 PolarHBondContact N-O 2.94Å; T526-A535 PolarHBondContact O-N 2.71Å; T526-L574 HydrophobicContact CG2-CB 4.28Å; T526-L574 HydrophobicContact CG2-CD2 3.75Å; T526-L574 HydrophobicContact CG2-CG 3.69Å; T526-F576 HydrophobicContact CG2-CD2 3.59Å; T526-F576 HydrophobicContact CG2-CE2 3.77Å; T526-F576 WeakPolarHBondContact O-CE2 3.3Å; T526-L587 HydrophobicContact CG2-CD1 4.35Å
527	F	92.6	Very high	85	Confident	9 Å²	9	37 Å²	37	4%	0.039	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	151	175	-83.6	-78.9	0	0	0	110.2	T482 D484 P485 F489 A491 L534 W558 F576	T482-F527 HydrophobicContact CG2-CD2 3.65Å; T482-F527 HydrophobicContact CG2-CE2 3.85Å; D484-F527 HydrophobicContact CB-CD1 4.43Å; D484-F527 HydrophobicContact CB-CD2 4.2Å; D484-F527 HydrophobicContact CB-CE1 4.49Å; D484-F527 HydrophobicContact CB-CE2 4.27Å; D484-F527 HydrophobicContact CB-CG 4.28Å; D484-F527 HydrophobicContact CB-CZ 4.41Å; P485-F527 VanDerWaalsContact CD-CB 3.48Å; P485-F527 HydrophobicContact CG-CB 4.4Å; F489-F527 HydrophobicContact CB-CZ 4.17Å; A491-F527 HydrophobicContact CB-CE2 3.49Å; A491-F527 VanDerWaalsContact CB-CE2 3.49Å; A491-F527 HydrophobicContact CB-CZ 3.62Å; F527-L534 HydrophobicContact CD1-CB 4.11Å; F527-L534 HydrophobicContact CD1-CD1 3.87Å; F527-L534 HydrophobicContact CD2-CD1 3.99Å; F527-L534 HydrophobicContact CE1-CB 3.99Å; F527-L534 HydrophobicContact CE1-CD1 3.76Å; F527-L534 HydrophobicContact CE1-CD2 4.45Å; F527-L534 HydrophobicContact CE1-CG 4.29Å; F527-L534 HydrophobicContact CE2-CD1 3.89Å; F527-L534 HydrophobicContact CG-CD1 3.98Å; F527-L534 HydrophobicContact CZ-CD1 3.77Å; F527-L534 HydrophobicContact CZ-CD2 4.45Å; F527-W558 HydrophobicContact CD1-CH2 4.04Å; F527-W558 AromaticContact CE1-CH2 3.6Å; F527-W558 HydrophobicContact CE1-CH2 3.6Å; F527-W558 AromaticContact CE1-CZ2 3.76Å; F527-W558 HydrophobicContact CE1-CZ2 3.76Å; F527-W558 HydrophobicContact CE1-CZ3 4.49Å; F527-F576 VanDerWaalsContact O-CD2 3.26Å; F527-F576 WeakPolarHBondContact O-CD2 3.21Å
528	S	91	Very high	86.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.			trans	-72.5	151.2	167	61.8	0	0	0	0	111.3	D530 S531 Q532 Y533	S528-D530 WeakPolarHBondContact CB-OD1 3.36Å; S528-D530 PolarHBondContact O-N 2.84Å; S528-D530 VanDerWaalsContact O-N 3.09Å; S528-D530 PolarHBondContact OG-OD1 3.41Å; S528-S531 PolarHBondContact O-N 2.89Å; S528-Q532 PolarHBondContact OG-N 3.46Å; S528-Y533 PolarHBondContact N-O 2.94Å; S528-Y533 PolarHBondContact OG-N 3.28Å; S528-Y533 PolarHBondContact OG-O 3.42Å
529	H	85.3	Confident	87.5	Confident	76 Å²	76	35.4 Å²	35.4	35%	0.352	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.5	179.6	-19.9	73	0	0	0	113.7	F576 G577	H529-F576 VanDerWaalsContact NE2-C 3.29Å; H529-F576 PolarHBondContact NE2-O 2.8Å; H529-F576 VanDerWaalsContact NE2-O 3.15Å; H529-G577 VanDerWaalsContact CE1-CA 3.43Å; H529-G577 WeakPolarHBondContact CE1-CA 3.36Å; H529-G577 PolarHBondContact CE1-N 2.79Å; H529-G577 PolarHBondContact CE1-O 2.98Å; H529-G577 VanDerWaalsContact NE2-CA 3.33Å; H529-G577 WeakPolarHBondContact NE2-CA 3.33Å; H529-G577 PolarHBondContact NE2-N 2.88Å
530	D	85.6	Confident	88.2	Confident	39 Å²	39	27.2 Å²	27.2	21%	0.209	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-2	179.4	65.1	-7.5	0	0	0	113.8	K486 S528 Q532	K486-D530 WeakPolarHBondContact CE-O 3.43Å; K486-D530 PolarHBondContact NZ-O 3.38Å; S528-D530 WeakPolarHBondContact CB-OD1 3.36Å; S528-D530 PolarHBondContact O-N 2.84Å; S528-D530 VanDerWaalsContact O-N 3.09Å; S528-D530 PolarHBondContact OG-OD1 3.41Å; D530-Q532 HydrophobicContact CB-CG 4.3Å; D530-Q532 PolarHBondContact O-N 3.15Å; D530-Q532 PolarHBondContact OD1-N 3.22Å; D530-Q532 VanDerWaalsContact OD1-N 3.15Å
531	S	86.9	Confident	88.4	Confident	7 Å²	7	29 Å²	29	5%	0.049	15%	0.147	C	C	.	.	S	Bend	trans	65.5	16.5	-179	-44.2	0	0	0	0	114.7	D484 K486 S528	D484-S531 VanDerWaalsContact CG-CB 3.45Å; D484-S531 WeakPolarHBondContact OD1-CA 3.18Å; D484-S531 WeakPolarHBondContact OD1-CB 3.31Å; D484-S531 PolarHBondContact OD1-OG 3.37Å; D484-S531 VanDerWaalsContact OD2-CB 3.25Å; D484-S531 WeakPolarHBondContact OD2-CB 3.49Å; D484-S531 PolarHBondContact OD2-OG 3.03Å; K486-S531 WeakPolarHBondContact CD-OG 3.23Å; K486-S531 WeakPolarHBondContact CG-OG 3.31Å; S528-S531 PolarHBondContact O-N 2.89Å
532	Q	86.7	Confident	88.3	Confident	90 Å²	90	29.6 Å²	29.6	42%	0.421	15%	0.151	S	C	.	.	S	Bend	trans	-93.6	-23.3	-178.8	-63.7	-171.2	5.6	0	0	113.3	S528 D530 R547 N548	S528-Q532 PolarHBondContact OG-N 3.46Å; D530-Q532 HydrophobicContact CB-CG 4.3Å; D530-Q532 PolarHBondContact O-N 3.15Å; D530-Q532 PolarHBondContact OD1-N 3.22Å; D530-Q532 VanDerWaalsContact OD1-N 3.15Å; Q532-R547 CarbonylContact O-C 3.5Å; Q532-R547 WeakPolarHBondContact O-CA 3.5Å; Q532-N548 PolarHBondContact O-N 2.67Å
533	Y	88.8	Confident	88.3	Confident	20 Å²	20	29.6 Å²	29.6	8%	0.078	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.9	-176.2	-63.2	-88.9	0	0	0	111.1	S528 L545 F546 R547 P585 L604	S528-Y533 PolarHBondContact N-O 2.94Å; S528-Y533 PolarHBondContact OG-N 3.28Å; S528-Y533 PolarHBondContact OG-O 3.42Å; Y533-L545 HydrophobicContact CD1-CD1 4.18Å; Y533-L545 HydrophobicContact CD1-CD2 4.22Å; Y533-L545 HydrophobicContact CD1-CG 4.34Å; Y533-F546 WeakPolarHBondContact CA-O 3.48Å; Y533-R547 HydrophobicContact CD1-CB 4.15Å; Y533-R547 HydrophobicContact CD1-CG 4.26Å; Y533-R547 HydrophobicContact CE1-CB 4.12Å; Y533-R547 HydrophobicContact CE1-CG 3.9Å; Y533-P585 HydrophobicContact CD2-CG 3.77Å; Y533-P585 HydrophobicContact CE2-CG 3.92Å; Y533-L604 HydrophobicContact CE1-CB 4.36Å
534	L	91	Very high	88.4	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.2	173.8	173	69.7	0	0	0	107.6	A491 V499 I501 I525 T526 F527 F546 W558	A491-L534 HydrophobicContact CB-CD1 3.94Å; A491-L534 HydrophobicContact CB-CD2 4.07Å; V499-L534 HydrophobicContact CG1-CD2 4.2Å; I501-L534 HydrophobicContact CD1-CD2 3.59Å; I501-L534 HydrophobicContact CG1-CD2 3.88Å; I525-L534 HydrophobicContact CG2-CD1 3.33Å; I525-L534 HydrophobicContact CG2-CG 4.3Å; T526-L534 WeakPolarHBondContact O-CD1 3.22Å; F527-L534 HydrophobicContact CD1-CB 4.11Å; F527-L534 HydrophobicContact CD1-CD1 3.87Å; F527-L534 HydrophobicContact CD2-CD1 3.99Å; F527-L534 HydrophobicContact CE1-CB 3.99Å; F527-L534 HydrophobicContact CE1-CD1 3.76Å; F527-L534 HydrophobicContact CE1-CD2 4.45Å; F527-L534 HydrophobicContact CE1-CG 4.29Å; F527-L534 HydrophobicContact CE2-CD1 3.89Å; F527-L534 HydrophobicContact CG-CD1 3.98Å; F527-L534 HydrophobicContact CZ-CD1 3.77Å; F527-L534 HydrophobicContact CZ-CD2 4.45Å; L534-F546 HydrophobicContact CB-CB 4.19Å; L534-F546 HydrophobicContact CD2-CD2 4.24Å; L534-F546 HydrophobicContact CG-CD2 4.29Å; L534-F546 PolarHBondContact N-O 2.88Å; L534-F546 PolarHBondContact O-N 3.36Å; L534-W558 HydrophobicContact CB-CE3 4.3Å; L534-W558 HydrophobicContact CB-CH2 4.11Å; L534-W558 HydrophobicContact CB-CZ3 3.64Å
535	A	90.7	Very high	88.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.2	177	0	0	0	0	0	110.3	I525 T526 S544 L545 L574 F576 L587	I525-A535 WeakPolarHBondContact CA-O 3.45Å; T526-A535 HydrophobicContact CG2-CB 4.12Å; T526-A535 PolarHBondContact N-O 2.94Å; T526-A535 PolarHBondContact O-N 2.71Å; A535-S544 WeakPolarHBondContact CA-O 3.37Å; A535-L545 HydrophobicContact CB-CD1 4.29Å; A535-L574 HydrophobicContact CB-CD2 3.8Å; A535-L574 HydrophobicContact CB-CG 4.46Å; A535-F576 HydrophobicContact CB-CE2 3.65Å; A535-F576 HydrophobicContact CB-CZ 3.76Å; A535-L587 HydrophobicContact CB-CD1 3.77Å; A535-L587 HydrophobicContact CB-CD2 3.63Å; A535-L587 HydrophobicContact CB-CG 4.38Å
536	T	91.3	Very high	88.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.1	179.5	65.6	0	0	0	0	110.5	V499 L524 I525 V543 S544 F546	V499-T536 HydrophobicContact CG1-CG2 4.44Å; V499-T536 HydrophobicContact CG2-CG2 4.01Å; L524-T536 CarbonylContact O-C 3.46Å; L524-T536 VanDerWaalsContact O-CA 3.29Å; L524-T536 WeakPolarHBondContact O-CA 3.15Å; I525-T536 HydrophobicContact CD1-CG2 4.46Å; I525-T536 HydrophobicContact CG1-CG2 4.01Å; I525-T536 HydrophobicContact CG2-CG2 4.2Å; T536-V543 WeakPolarHBondContact O-CA 3.49Å; T536-S544 PolarHBondContact N-O 3.19Å; T536-S544 PolarHBondContact O-N 3.11Å; T536-S544 WeakPolarHBondContact OG1-CB 3.43Å; T536-F546 HydrophobicContact CG2-CD2 4.35Å; T536-F546 HydrophobicContact CG2-CE2 3.78Å
537	A	89.7	Confident	88	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134	171.7	0	0	0	0	0	110.8	H523 L524 I571 L574	H523-A537 PolarHBondContact N-O 3.42Å; L524-A537 HydrophobicContact CB-CB 4.06Å; L524-A537 HydrophobicContact CD1-CB 4.23Å; L524-A537 PolarHBondContact N-O 3.32Å; L524-A537 PolarHBondContact O-N 2.68Å; A537-I571 HydrophobicContact CB-CB 4.26Å; A537-I571 HydrophobicContact CB-CD1 3.9Å; A537-I571 HydrophobicContact CB-CG2 4.1Å; A537-L574 HydrophobicContact CB-CD2 4.31Å
538	D	86.8	Confident	87.6	Confident	11 Å²	11	27.7 Å²	27.7	6%	0.059	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	168.9	-179.9	71.5	11.9	0	0	0	113	I518 S521 S540 R541 V542	I518-D538 HydrophobicContact CG2-CB 4.04Å; S521-D538 CarbonylContact O-C 3.55Å; S521-D538 VanDerWaalsContact O-CA 3.31Å; S521-D538 WeakPolarHBondContact O-CA 3.45Å; D538-S540 PolarHBondContact O-N 2.96Å; D538-S540 VanDerWaalsContact OD1-C 3.26Å; D538-S540 WeakPolarHBondContact OD1-CA 3.47Å; D538-S540 PolarHBondContact OD1-N 3.06Å; D538-S540 PolarHBondContact OD1-OG 3.02Å; D538-S540 PolarHBondContact OD2-OG 2.86Å; D538-R541 PolarHBondContact O-N 2.95Å; D538-R541 PolarHBondContact OD1-N 3.08Å; D538-V542 PolarHBondContact N-O 3.22Å; D538-V542 VanDerWaalsContact N-O 3.16Å; D538-V542 WeakPolarHBondContact OD1-CA 3.29Å; D538-V542 WeakPolarHBondContact OD1-CB 3.43Å; D538-V542 PolarHBondContact OD1-N 3.39Å
539	A	86.1	Confident	86.9	Confident	35 Å²	35	32.3 Å²	32.3	29%	0.289	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.6	173	0	0	0	0	0	112.8	S521 R541	S521-A539 PolarHBondContact O-N 2.96Å; A539-R541 PolarHBondContact O-N 3.27Å
540	S	83.8	Confident	85.8	Confident	42 Å²	42	30.8 Å²	30.8	29%	0.294	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-3.3	176.9	93.8	0	0	0	0	113.6	D520 D538 V542	D520-S540 WeakPolarHBondContact OD2-CB 3.3Å; D520-S540 PolarHBondContact OD2-N 3.31Å; D538-S540 PolarHBondContact O-N 2.96Å; D538-S540 VanDerWaalsContact OD1-C 3.26Å; D538-S540 WeakPolarHBondContact OD1-CA 3.47Å; D538-S540 PolarHBondContact OD1-N 3.06Å; D538-S540 PolarHBondContact OD1-OG 3.02Å; D538-S540 PolarHBondContact OD2-OG 2.86Å; S540-V542 WeakPolarHBondContact OG-CG2 2.99Å
541	R	84.3	Confident	84.3	Confident	101 Å²	101	36.4 Å²	36.4	38%	0.381	19%	0.186	S	C	.	.	S	Bend	trans	77	24.1	178.2	-47.1	156.2	-70.8	-156.8	-6.2	113.7	D538 A539 H567 Y568 K569	D538-R541 PolarHBondContact O-N 2.95Å; D538-R541 PolarHBondContact OD1-N 3.08Å; A539-R541 PolarHBondContact O-N 3.27Å; R541-H567 VanDerWaalsContact CB-O 3.3Å; R541-H567 WeakPolarHBondContact CB-O 3.46Å; R541-Y568 VanDerWaalsContact CD-C 3.49Å; R541-Y568 VanDerWaalsContact CD-O 3.29Å; R541-Y568 WeakPolarHBondContact CD-O 3.22Å; R541-Y568 PolarHBondContact NH1-O 2.99Å; R541-K569 WeakPolarHBondContact CG-O 3.36Å
542	V	85.6	Confident	82.7	Confident	22 Å²	22	42.6 Å²	42.6	13%	0.133	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.4	179.9	180	0	0	0	0	109.6	D538 S540 R563 Y564 C565	D538-V542 PolarHBondContact N-O 3.22Å; D538-V542 VanDerWaalsContact N-O 3.16Å; D538-V542 WeakPolarHBondContact OD1-CA 3.29Å; D538-V542 WeakPolarHBondContact OD1-CB 3.43Å; D538-V542 PolarHBondContact OD1-N 3.39Å; S540-V542 WeakPolarHBondContact OG-CG2 2.99Å; V542-R563 HydrophobicContact CG1-CB 3.69Å; V542-R563 HydrophobicContact CG1-CG 4.31Å; V542-Y564 WeakPolarHBondContact CA-O 3.38Å; V542-C565 HydrophobicContact CG2-CB 4Å
543	V	88.1	Confident	80.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.7	168.6	179.4	0	0	0	0	108.6	T536 R563 Y564 I571 L574 L587 Y602	T536-V543 WeakPolarHBondContact O-CA 3.49Å; V543-R563 CarbonylContact O-C 3.56Å; V543-R563 VanDerWaalsContact O-CA 3.29Å; V543-R563 WeakPolarHBondContact O-CA 3.5Å; V543-Y564 PolarHBondContact N-O 3.13Å; V543-Y564 PolarHBondContact O-N 2.96Å; V543-I571 HydrophobicContact CG2-CD1 3.55Å; V543-L574 HydrophobicContact CG1-CD1 4.09Å; V543-L574 HydrophobicContact CG2-CD1 4.26Å; V543-L587 HydrophobicContact CG1-CD2 4.02Å; V543-Y602 HydrophobicContact CB-CE1 4.38Å; V543-Y602 WeakPolarHBondContact CB-OH 3.12Å; V543-Y602 HydrophobicContact CG1-CE1 4.48Å; V543-Y602 HydrophobicContact CG1-CE2 4.3Å; V543-Y602 VanDerWaalsContact CG2-OH 3.23Å; V543-Y602 WeakPolarHBondContact CG2-OH 3.07Å
544	S	87.8	Confident	79.3	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.1	175.7	-64	0	0	0	0	110.3	A535 T536 G562	A535-S544 WeakPolarHBondContact CA-O 3.37Å; T536-S544 PolarHBondContact N-O 3.19Å; T536-S544 PolarHBondContact O-N 3.11Å; T536-S544 WeakPolarHBondContact OG1-CB 3.43Å; S544-G562 WeakPolarHBondContact CA-O 3.29Å
545	L	89.8	Confident	77.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.9	-178.7	-175.3	73.8	0	0	0	110.6	Y533 A535 V561 G562 F576 L587 L604 L612	Y533-L545 HydrophobicContact CD1-CD1 4.18Å; Y533-L545 HydrophobicContact CD1-CD2 4.22Å; Y533-L545 HydrophobicContact CD1-CG 4.34Å; A535-L545 HydrophobicContact CB-CD1 4.29Å; L545-V561 HydrophobicContact CB-CB 4.31Å; L545-V561 HydrophobicContact CD2-CB 4.14Å; L545-V561 HydrophobicContact CD2-CG1 4.14Å; L545-V561 HydrophobicContact CD2-CG2 4.34Å; L545-V561 HydrophobicContact CG-CB 4.28Å; L545-V561 HydrophobicContact CG-CG2 4.37Å; L545-V561 WeakPolarHBondContact O-CB 3.22Å; L545-V561 PolarHBondContact O-N 2.99Å; L545-G562 PolarHBondContact N-O 3.3Å; L545-G562 PolarHBondContact O-N 3.21Å; L545-F576 HydrophobicContact CD1-CZ 4.15Å; L545-L587 HydrophobicContact CD1-CD2 4.45Å; L545-L604 HydrophobicContact CD1-CD2 4Å; L545-L604 HydrophobicContact CD2-CD2 3.53Å; L545-L604 HydrophobicContact CG-CD2 4.44Å; L545-L612 HydrophobicContact CB-CD1 3.99Å; L545-L612 HydrophobicContact CD2-CD1 3.72Å; L545-L612 HydrophobicContact CG-CD1 4.49Å
546	F	87.6	Confident	76.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	147	173.8	-51.4	-96.2	0	0	0	109.5	V499 F515 Y533 L534 T536 W558 M559 F560	V499-F546 HydrophobicContact CG2-CE2 4.38Å; V499-F546 HydrophobicContact CG2-CZ 4.18Å; F515-F546 HydrophobicContact CB-CE1 3.69Å; F515-F546 HydrophobicContact CB-CZ 4.23Å; F515-F546 HydrophobicContact CD1-CD1 4.17Å; F515-F546 AromaticContact CD1-CE1 3.87Å; F515-F546 HydrophobicContact CD1-CE1 3.87Å; F515-F546 AromaticContact CD2-CD1 3.95Å; F515-F546 HydrophobicContact CD2-CD1 3.95Å; F515-F546 AromaticContact CD2-CE1 3.77Å; F515-F546 HydrophobicContact CD2-CE1 3.77Å; F515-F546 HydrophobicContact CE1-CD1 4.33Å; F515-F546 HydrophobicContact CE1-CE1 4.47Å; F515-F546 HydrophobicContact CE2-CD1 4.11Å; F515-F546 HydrophobicContact CE2-CE1 4.39Å; F515-F546 AromaticContact CG-CD1 3.99Å; F515-F546 HydrophobicContact CG-CD1 3.99Å; F515-F546 AromaticContact CG-CE1 3.48Å; F515-F546 HydrophobicContact CG-CE1 3.48Å; F515-F546 VanDerWaalsContact CG-CE1 3.48Å; F515-F546 HydrophobicContact CG-CZ 4.42Å; F515-F546 HydrophobicContact CZ-CD1 4.3Å; Y533-F546 WeakPolarHBondContact CA-O 3.48Å; L534-F546 HydrophobicContact CB-CB 4.19Å; L534-F546 HydrophobicContact CD2-CD2 4.24Å; L534-F546 HydrophobicContact CG-CD2 4.29Å; L534-F546 PolarHBondContact N-O 2.88Å; L534-F546 PolarHBondContact O-N 3.36Å; T536-F546 HydrophobicContact CG2-CD2 4.35Å; T536-F546 HydrophobicContact CG2-CE2 3.78Å; F546-W558 HydrophobicContact CB-CE3 4.11Å; F546-M559 CarbonylContact C-O 3.11Å; F546-M559 VanDerWaalsContact CA-O 3.24Å; F546-M559 WeakPolarHBondContact CA-O 3.36Å; F546-F560 HydrophobicContact CD1-CB 4.11Å; F546-F560 HydrophobicContact CD1-CD2 4.06Å; F546-F560 HydrophobicContact CE1-CB 4.16Å; F546-F560 AromaticContact CE1-CD2 3.62Å; F546-F560 HydrophobicContact CE1-CD2 3.62Å; F546-F560 HydrophobicContact CE1-CG 4.37Å; F546-F560 HydrophobicContact CZ-CD2 4.03Å
547	R	87.4	Confident	76.1	Confident	108 Å²	108	60.6 Å²	60.6	41%	0.408	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.1	179.2	-177.9	-178.7	-176	-175.2	1.7	109.9	Q532 Y533 W558 M559 V561	Q532-R547 CarbonylContact O-C 3.5Å; Q532-R547 WeakPolarHBondContact O-CA 3.5Å; Y533-R547 HydrophobicContact CD1-CB 4.15Å; Y533-R547 HydrophobicContact CD1-CG 4.26Å; Y533-R547 HydrophobicContact CE1-CB 4.12Å; Y533-R547 HydrophobicContact CE1-CG 3.9Å; R547-W558 CarbonylContact O-C 3.56Å; R547-W558 WeakPolarHBondContact O-CA 3.22Å; R547-M559 PolarHBondContact N-O 3.08Å; R547-M559 PolarHBondContact O-N 3.38Å; R547-V561 HydrophobicContact CB-CG2 3.47Å; R547-V561 VanDerWaalsContact CB-CG2 3.47Å
548	N	86	Confident	75.9	Confident	28 Å²	28	60.8 Å²	60.8	15%	0.15	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.3	172.9	-169.8	-3.3	0	0	0	109.9	Q532 G550 P556 R557 W558	Q532-N548 PolarHBondContact O-N 2.67Å; N548-G550 PolarHBondContact O-N 3.14Å; N548-G550 PolarHBondContact OD1-N 3.27Å; N548-P556 WeakPolarHBondContact OD1-CB 3.38Å; N548-R557 PolarHBondContact OD1-N 3.34Å; N548-W558 HydrophobicContact CB-CD2 3.93Å; N548-W558 HydrophobicContact CB-CE3 3.94Å; N548-W558 HydrophobicContact CB-CH2 3.83Å; N548-W558 HydrophobicContact CB-CZ2 3.81Å; N548-W558 HydrophobicContact CB-CZ3 3.89Å
549	E	75.1	Confident	75.7	Confident	97 Å²	97	63.6 Å²	63.6	45%	0.453	34%	0.343	S	S	.	.			trans	-98.5	63.1	170.7	-67.8	-166.9	165.9	0	0	109.9	H551 R557 M559	E549-H551 PolarHBondContact O-N 3.48Å; E549-R557 PolarHBondContact N-O 3.33Å; E549-M559 HydrophobicContact CG-CE 4.08Å; E549-M559 WeakPolarHBondContact OE1-CE 3.46Å; E549-M559 WeakPolarHBondContact OE2-CE 3.09Å
550	G	62.1	Low	75.7	Confident	43 Å²	43	64 Å²	64	44%	0.443	34%	0.338	S	S	.	.			trans	-85	101.4	169.1	0	0	0	0	0	110.4	N548	N548-G550 PolarHBondContact O-N 3.14Å; N548-G550 PolarHBondContact OD1-N 3.27Å
551	H	53.8	Low	75.7	Confident	158 Å²	158	62.8 Å²	62.8	73%	0.731	33%	0.329	S	S	*	.			trans	-65.6	143.2	154.3	-96.8	-57.7	0	0	0	108.2	E549 D553 S554	E549-H551 PolarHBondContact O-N 3.48Å; H551-D553 PolarHBondContact O-N 2.71Å; H551-S554 PolarHBondContact O-N 2.89Å; H551-S554 PolarHBondContact O-OG 3.39Å
552	T	53.2	Low	75.5	Confident	137 Å²	137	58 Å²	58	84%	0.84	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-12	-169.2	43.7	0	0	0	0	116.1
553	D	49.8	Very low	75.4	Confident	164 Å²	164	64.7 Å²	64.7	88%	0.877	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-2.6	-177.8	-62.2	-34.2	0	0	0	114.9	H551	H551-D553 PolarHBondContact O-N 2.71Å
554	S	55.7	Low	75.2	Confident	64 Å²	64	68.9 Å²	68.9	45%	0.448	35%	0.35	S	S	.	.	S	Bend	trans	-110.1	150.7	178.7	57.6	0	0	0	0	111.6	H551	H551-S554 PolarHBondContact O-N 2.89Å; H551-S554 PolarHBondContact O-OG 3.39Å
555	S	61.1	Low	75	Confident	87 Å²	87	72 Å²	72	61%	0.608	37%	0.372	S	S	*	.			trans	-50.1	132.4	168.9	54.6	0	0	0	0	109.5	R557	S555-R557 PolarHBondContact O-N 3.34Å
556	P	66.6	Low	74.1	Confident	42 Å²	42	72.4 Å²	72.4	27%	0.273	37%	0.374	S	S	.	.			trans	-52.3	135.9	179	25	-35.6	0	0	0	109	F489 N548	F489-P556 HydrophobicContact CE1-CB 4.02Å; F489-P556 HydrophobicContact CE1-CG 3.48Å; F489-P556 VanDerWaalsContact CE1-CG 3.48Å; F489-P556 HydrophobicContact CZ-CB 3.64Å; F489-P556 HydrophobicContact CZ-CG 3.47Å; F489-P556 VanDerWaalsContact CZ-CG 3.47Å; N548-P556 WeakPolarHBondContact OD1-CB 3.38Å
557	R	78.4	Confident	73.6	Confident	131 Å²	131	72.7 Å²	72.7	49%	0.494	38%	0.375	S	S	.	.			trans	-125.9	113.9	179.2	-172.8	-179.3	-174.3	-174.4	1.2	108.9	E513 N548 E549 S555	E513-R557 WeakPolarHBondContact OE1-CA 3.34Å; N548-R557 PolarHBondContact OD1-N 3.34Å; E549-R557 PolarHBondContact N-O 3.33Å; S555-R557 PolarHBondContact O-N 3.34Å
558	W	84.3	Confident	73.1	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.015	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	140.1	175.1	-68.9	89	0	0	0	111.4	F489 I501 E513 F515 F527 L534 F546 R547 N548	F489-W558 HydrophobicContact CD2-CZ2 4.27Å; I501-W558 HydrophobicContact CD1-CB 3.71Å; I501-W558 HydrophobicContact CD1-CD2 3.4Å; I501-W558 VanDerWaalsContact CD1-CD2 3.4Å; I501-W558 HydrophobicContact CD1-CE3 3.9Å; I501-W558 HydrophobicContact CD1-CG 3.29Å; E513-W558 HydrophobicContact CG-CB 4.42Å; E513-W558 PolarHBondContact OE1-N 2.8Å; F515-W558 HydrophobicContact CE2-CB 3.87Å; F515-W558 HydrophobicContact CZ-CB 3.78Å; F515-W558 WeakPolarHBondContact CZ-O 3.36Å; F527-W558 HydrophobicContact CD1-CH2 4.04Å; F527-W558 AromaticContact CE1-CH2 3.6Å; F527-W558 HydrophobicContact CE1-CH2 3.6Å; F527-W558 AromaticContact CE1-CZ2 3.76Å; F527-W558 HydrophobicContact CE1-CZ2 3.76Å; F527-W558 HydrophobicContact CE1-CZ3 4.49Å; L534-W558 HydrophobicContact CB-CE3 4.3Å; L534-W558 HydrophobicContact CB-CH2 4.11Å; L534-W558 HydrophobicContact CB-CZ3 3.64Å; F546-W558 HydrophobicContact CB-CE3 4.11Å; R547-W558 CarbonylContact O-C 3.56Å; R547-W558 WeakPolarHBondContact O-CA 3.22Å; N548-W558 HydrophobicContact CB-CD2 3.93Å; N548-W558 HydrophobicContact CB-CE3 3.94Å; N548-W558 HydrophobicContact CB-CH2 3.83Å; N548-W558 HydrophobicContact CB-CZ2 3.81Å; N548-W558 HydrophobicContact CB-CZ3 3.89Å
559	M	84.1	Confident	73	Confident	70 Å²	70	74.9 Å²	74.9	35%	0.345	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	143.2	173.8	-61.1	-150.4	-50.7	0	0	110.9	F546 R547 E549 V561	F546-M559 CarbonylContact C-O 3.11Å; F546-M559 VanDerWaalsContact CA-O 3.24Å; F546-M559 WeakPolarHBondContact CA-O 3.36Å; R547-M559 PolarHBondContact N-O 3.08Å; R547-M559 PolarHBondContact O-N 3.38Å; E549-M559 HydrophobicContact CG-CE 4.08Å; E549-M559 WeakPolarHBondContact OE1-CE 3.46Å; E549-M559 WeakPolarHBondContact OE2-CE 3.09Å; M559-V561 PolarHBondContact O-N 3.25Å
560	F	84.8	Confident	73.4	Confident	44 Å²	44	73.4 Å²	73.4	19%	0.193	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	122	172.2	176	-102.1	0	0	0	110.1	F515 F546 G562 R563 N610	F515-F560 HydrophobicContact CD1-CB 4.43Å; F546-F560 HydrophobicContact CD1-CB 4.11Å; F546-F560 HydrophobicContact CD1-CD2 4.06Å; F546-F560 HydrophobicContact CE1-CB 4.16Å; F546-F560 AromaticContact CE1-CD2 3.62Å; F546-F560 HydrophobicContact CE1-CD2 3.62Å; F546-F560 HydrophobicContact CE1-CG 4.37Å; F546-F560 HydrophobicContact CZ-CD2 4.03Å; F560-G562 VanDerWaalsContact CZ-C 3.46Å; F560-R563 HydrophobicContact CZ-CB 4.02Å; F560-R563 HydrophobicContact CZ-CG 4.33Å; F560-N610 WeakPolarHBondContact CE1-OD1 3.34Å
561	V	83.4	Confident	74.6	Confident	16 Å²	16	72.1 Å²	72.1	10%	0.097	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-49.8	179.5	-177.9	0	0	0	0	110.4	L545 R547 M559 E608 S609 N610	L545-V561 HydrophobicContact CB-CB 4.31Å; L545-V561 HydrophobicContact CD2-CB 4.14Å; L545-V561 HydrophobicContact CD2-CG1 4.14Å; L545-V561 HydrophobicContact CD2-CG2 4.34Å; L545-V561 HydrophobicContact CG-CB 4.28Å; L545-V561 HydrophobicContact CG-CG2 4.37Å; L545-V561 WeakPolarHBondContact O-CB 3.22Å; L545-V561 PolarHBondContact O-N 2.99Å; R547-V561 HydrophobicContact CB-CG2 3.47Å; R547-V561 VanDerWaalsContact CB-CG2 3.47Å; M559-V561 PolarHBondContact O-N 3.25Å; V561-E608 VanDerWaalsContact O-O 3.12Å; V561-S609 CarbonylContact O-C 3.42Å; V561-S609 WeakPolarHBondContact O-CA 3.46Å; V561-N610 WeakPolarHBondContact O-CA 3.49Å; V561-N610 PolarHBondContact O-N 3.49Å
562	G	81.2	Confident	76.2	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.7	173.7	-176.3	0	0	0	0	0	113.3	S544 L545 F560	S544-G562 WeakPolarHBondContact CA-O 3.29Å; L545-G562 PolarHBondContact N-O 3.3Å; L545-G562 PolarHBondContact O-N 3.21Å; F560-G562 VanDerWaalsContact CZ-C 3.46Å
563	R	83.7	Confident	77.8	Confident	164 Å²	164	61.6 Å²	61.6	62%	0.619	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	147.9	-179.7	67.6	-178.6	-174.4	177.1	2.2	111.7	V542 V543 F560	V542-R563 HydrophobicContact CG1-CB 3.69Å; V542-R563 HydrophobicContact CG1-CG 4.31Å; V543-R563 CarbonylContact O-C 3.56Å; V543-R563 VanDerWaalsContact O-CA 3.29Å; V543-R563 WeakPolarHBondContact O-CA 3.5Å; F560-R563 HydrophobicContact CZ-CB 4.02Å; F560-R563 HydrophobicContact CZ-CG 4.33Å
564	Y	83.9	Confident	79.6	Confident	87 Å²	87	54.2 Å²	54.2	34%	0.341	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	131.8	176.4	-166.2	-85.3	0	0	0	111.1	V542 V543 S566 L612 L614	V542-Y564 WeakPolarHBondContact CA-O 3.38Å; V543-Y564 PolarHBondContact N-O 3.13Å; V543-Y564 PolarHBondContact O-N 2.96Å; Y564-S566 PolarHBondContact O-N 3.48Å; Y564-L612 WeakPolarHBondContact CD2-O 3.35Å; Y564-L614 HydrophobicContact CD1-CD1 4.04Å; Y564-L614 HydrophobicContact CD1-CD2 3.91Å; Y564-L614 HydrophobicContact CD1-CG 4.24Å; Y564-L614 HydrophobicContact CD2-CD2 4.4Å; Y564-L614 HydrophobicContact CD2-CG 4.45Å; Y564-L614 HydrophobicContact CE1-CD1 3.36Å; Y564-L614 HydrophobicContact CE1-CD2 4.1Å; Y564-L614 HydrophobicContact CE1-CG 3.92Å; Y564-L614 HydrophobicContact CE2-CD1 4.26Å; Y564-L614 HydrophobicContact CE2-CG 4.12Å; Y564-L614 HydrophobicContact CG-CD2 4.08Å; Y564-L614 VanDerWaalsContact CZ-CD1 3.47Å
565	C	82.8	Confident	81.2	Confident	69 Å²	69	52.6 Å²	52.6	47%	0.466	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	95.2	172.6	-169.8	0	0	0	0	108.6	V542	V542-C565 HydrophobicContact CG2-CB 4Å
566	S	70.9	Confident	82.4	Confident	7 Å²	7	48.7 Å²	48.7	5%	0.049	23%	0.227	C	C	.	.			trans	-91.2	-18.8	-174.1	46.3	0	0	0	0	114.4	Y564 Y602	Y564-S566 PolarHBondContact O-N 3.48Å; S566-Y602 VanDerWaalsContact CB-OH 3.3Å; S566-Y602 WeakPolarHBondContact CB-OH 3.24Å; S566-Y602 PolarHBondContact OG-OH 2.87Å
567	H	76.9	Confident	82.9	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.028	21%	0.214	C	C	.	.			trans	-129.2	145.7	-172.1	-62.2	-81.8	0	0	0	111.3	R541 K569 I571 S589 D593	R541-H567 VanDerWaalsContact CB-O 3.3Å; R541-H567 WeakPolarHBondContact CB-O 3.46Å; H567-K569 WeakPolarHBondContact CB-O 3.2Å; H567-I571 HydrophobicContact CB-CG1 4.2Å; H567-S589 PolarHBondContact NE2-OG 2.87Å; H567-D593 IonicContact ND1-OD2 2.63Å
568	Y	78.2	Confident	82.7	Confident	105 Å²	105	43.2 Å²	43.2	41%	0.412	21%	0.208	S	C	.	.	S	Bend	trans	-91.3	-16.4	174.9	63.5	-91.3	0	0	0	113.5	R541 D593 Q595	R541-Y568 VanDerWaalsContact CD-C 3.49Å; R541-Y568 VanDerWaalsContact CD-O 3.29Å; R541-Y568 WeakPolarHBondContact CD-O 3.22Å; R541-Y568 PolarHBondContact NH1-O 2.99Å; Y568-D593 HydrophobicContact CD1-CB 3.94Å; Y568-D593 VanDerWaalsContact CD1-OD2 3.27Å; Y568-D593 WeakPolarHBondContact CD1-OD2 3.43Å; Y568-D593 HydrophobicContact CD2-CB 3.97Å; Y568-D593 HydrophobicContact CE1-CB 3.49Å; Y568-D593 VanDerWaalsContact CE1-CB 3.49Å; Y568-D593 VanDerWaalsContact CE1-CG 3.43Å; Y568-D593 WeakPolarHBondContact CE1-OD2 3.12Å; Y568-D593 HydrophobicContact CE2-CB 3.52Å; Y568-D593 HydrophobicContact CG-CB 4.17Å; Y568-D593 PolarHBondContact OH-O 2.83Å; Y568-Q595 WeakPolarHBondContact CE1-O 3.09Å; Y568-Q595 PolarHBondContact OH-N 3.41Å; Y568-Q595 PolarHBondContact OH-O 2.98Å
569	K	82.2	Confident	82	Confident	77 Å²	77	48.1 Å²	48.1	34%	0.335	23%	0.23	S	C	.	.	S	Bend	trans	-115	169.9	167	-58.5	-160.1	-156.6	155.1	0	111.3	R541 H567 I571 L592 D593	R541-K569 WeakPolarHBondContact CG-O 3.36Å; H567-K569 WeakPolarHBondContact CB-O 3.2Å; K569-I571 PolarHBondContact O-N 3.42Å; K569-L592 HydrophobicContact CB-CB 4.02Å; K569-L592 HydrophobicContact CD-CB 4.2Å; K569-L592 WeakPolarHBondContact CD-O 3.5Å; K569-L592 PolarHBondContact NZ-O 2.99Å; K569-L592 VanDerWaalsContact NZ-O 3.09Å; K569-D593 HydrophobicContact CB-CB 3.77Å; K569-D593 HydrophobicContact CD-CB 4.16Å; K569-D593 HydrophobicContact CG-CB 3.69Å; K569-D593 PolarHBondContact NZ-O 3.25Å
570	P	85	Confident	80.7	Confident	66 Å²	66	47.6 Å²	47.6	43%	0.429	23%	0.229	S	C	.	.			trans	-53.9	138.1	-179.4	-29	37.3	0	0	0	113.7	G591 L592	P570-G591 WeakPolarHBondContact O-CA 3.32Å; P570-L592 HydrophobicContact CB-CD1 4.39Å; P570-L592 PolarHBondContact O-N 3.19Å
571	I	87.3	Confident	79.4	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.082	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.2	175	-56	176.8	0	0	0	107.9	L524 A537 V543 H567 K569 V590	L524-I571 HydrophobicContact CD1-CG2 4.07Å; A537-I571 HydrophobicContact CB-CB 4.26Å; A537-I571 HydrophobicContact CB-CD1 3.9Å; A537-I571 HydrophobicContact CB-CG2 4.1Å; V543-I571 HydrophobicContact CG2-CD1 3.55Å; H567-I571 HydrophobicContact CB-CG1 4.2Å; K569-I571 PolarHBondContact O-N 3.42Å; I571-V590 CarbonylContact C-O 3.55Å; I571-V590 WeakPolarHBondContact CG2-O 3.35Å
572	Q	86.4	Confident	78.5	Confident	52 Å²	52	57.3 Å²	57.3	24%	0.243	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-39	179.4	-67.3	-59.6	-67.7	0	0	112.7	V590 L592 R627	Q572-V590 PolarHBondContact N-O 2.85Å; Q572-L592 VanDerWaalsContact CD-CD2 3.5Å; Q572-L592 HydrophobicContact CG-CD2 3.58Å; Q572-L592 HydrophobicContact CG-CG 3.63Å; Q572-L592 VanDerWaalsContact NE2-CD1 3.34Å; Q572-L592 VanDerWaalsContact NE2-CG 3.27Å; Q572-R627 VanDerWaalsContact CB-O 3.31Å; Q572-R627 WeakPolarHBondContact CB-O 3.33Å
573	D	86.3	Confident	78	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.123	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	153	-175.1	-154.3	-3	0	0	0	112.6	V590 M629	D573-V590 PolarHBondContact N-O 2.87Å; D573-V590 PolarHBondContact O-N 3.13Å; D573-M629 HydrophobicContact CB-CE 4.11Å; D573-M629 HydrophobicContact CB-CG 4.13Å; D573-M629 WeakPolarHBondContact O-CE 3.41Å; D573-M629 PolarHBondContact OD2-N 3.19Å; D573-M629 VanDerWaalsContact OD2-O 3.14Å
574	L	89.3	Confident	77.6	Confident	8 Å²	8	57 Å²	57	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	118.6	-175.6	-171	71.7	0	0	0	109.5	L524 T526 A535 A537 V543 L587	L524-L574 HydrophobicContact CB-CB 4.3Å; L524-L574 HydrophobicContact CD1-CB 4.18Å; T526-L574 HydrophobicContact CG2-CB 4.28Å; T526-L574 HydrophobicContact CG2-CD2 3.75Å; T526-L574 HydrophobicContact CG2-CG 3.69Å; A535-L574 HydrophobicContact CB-CD2 3.8Å; A535-L574 HydrophobicContact CB-CG 4.46Å; A537-L574 HydrophobicContact CB-CD2 4.31Å; V543-L574 HydrophobicContact CG1-CD1 4.09Å; V543-L574 HydrophobicContact CG2-CD1 4.26Å; L574-L587 HydrophobicContact CD1-CD1 3.79Å; L574-L587 HydrophobicContact CD1-CD2 4.45Å; L574-L587 HydrophobicContact CD1-CG 4.24Å; L574-L587 HydrophobicContact CG-CD1 4Å
575	L	87.9	Confident	77.4	Confident	30 Å²	30	53.9 Å²	53.9	16%	0.157	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	132.8	-169.9	-174	67.3	0	0	0	111.3	L588 M629 W631 L641	L575-L588 PolarHBondContact N-O 3.03Å; L575-L588 PolarHBondContact O-N 3.33Å; L575-M629 HydrophobicContact CB-CE 3.66Å; L575-M629 HydrophobicContact CB-CG 4.27Å; L575-M629 HydrophobicContact CB-SD 4.06Å; L575-M629 HydrophobicContact CD2-CG 4.22Å; L575-M629 HydrophobicContact CD2-SD 4.42Å; L575-W631 HydrophobicContact CD2-CD2 4.49Å; L575-W631 HydrophobicContact CD2-CG 4.24Å; L575-L641 HydrophobicContact CD2-CD1 3.82Å
576	F	86.7	Confident	77.3	Confident	5 Å²	5	52 Å²	52	2%	0.022	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	142	164.2	-80.7	-78.5	0	0	0	110.2	T526 F527 H529 A535 L545 P585 R586 L587 L604 W631	T526-F576 HydrophobicContact CG2-CD2 3.59Å; T526-F576 HydrophobicContact CG2-CE2 3.77Å; T526-F576 WeakPolarHBondContact O-CE2 3.3Å; F527-F576 VanDerWaalsContact O-CD2 3.26Å; F527-F576 WeakPolarHBondContact O-CD2 3.21Å; H529-F576 VanDerWaalsContact NE2-C 3.29Å; H529-F576 PolarHBondContact NE2-O 2.8Å; H529-F576 VanDerWaalsContact NE2-O 3.15Å; A535-F576 HydrophobicContact CB-CE2 3.65Å; A535-F576 HydrophobicContact CB-CZ 3.76Å; L545-F576 HydrophobicContact CD1-CZ 4.15Å; F576-P585 HydrophobicContact CD1-CB 4.08Å; F576-P585 HydrophobicContact CE1-CB 4.45Å; F576-R586 CarbonylContact C-O 3.55Å; F576-R586 WeakPolarHBondContact CA-O 3.23Å; F576-L587 HydrophobicContact CD1-CB 4.09Å; F576-L587 HydrophobicContact CD1-CD1 4.09Å; F576-L587 HydrophobicContact CD2-CD1 4.05Å; F576-L587 HydrophobicContact CE1-CB 3.85Å; F576-L587 HydrophobicContact CE1-CD1 3.96Å; F576-L587 HydrophobicContact CE1-CG 4.36Å; F576-L587 HydrophobicContact CE2-CD1 3.92Å; F576-L587 HydrophobicContact CG-CD1 4.14Å; F576-L587 HydrophobicContact CZ-CB 4.45Å; F576-L587 HydrophobicContact CZ-CD1 3.88Å; F576-L587 HydrophobicContact CZ-CD2 4.47Å; F576-L604 HydrophobicContact CE1-CD1 3.97Å; F576-W631 PolarHBondContact O-NE1 3.45Å
577	G	77.1	Confident	78	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	164.7	171.6	0	0	0	0	0	112.4	H529 P585 R586 W631	H529-G577 VanDerWaalsContact CE1-CA 3.43Å; H529-G577 WeakPolarHBondContact CE1-CA 3.36Å; H529-G577 PolarHBondContact CE1-N 2.79Å; H529-G577 PolarHBondContact CE1-O 2.98Å; H529-G577 VanDerWaalsContact NE2-CA 3.33Å; H529-G577 WeakPolarHBondContact NE2-CA 3.33Å; H529-G577 PolarHBondContact NE2-N 2.88Å; G577-P585 CarbonylContact O-C 3.6Å; G577-P585 WeakPolarHBondContact O-CA 3.47Å; G577-R586 PolarHBondContact N-O 3.29Å; G577-R586 PolarHBondContact O-N 2.97Å; G577-W631 VanDerWaalsContact CA-CZ2 3.45Å; G577-W631 VanDerWaalsContact CA-NE1 3.31Å
578	V	75.4	Confident	78.4	Confident	58 Å²	58	51.4 Å²	51.4	35%	0.352	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134	178.9	-176.4	0	0	0	0	108.8	L580	V578-L580 PolarHBondContact O-N 3.23Å
579	Q	67.7	Low	78.8	Confident	106 Å²	106	46.4 Å²	46.4	50%	0.495	24%	0.239	S	C	.	.			trans	-77.8	119.1	170.5	-174.2	178.8	22.2	0	0	109.9	Y581 S582 A583 K584	Q579-Y581 PolarHBondContact O-N 2.85Å; Q579-S582 WeakPolarHBondContact CB-OG 3.17Å; Q579-S582 PolarHBondContact O-N 3.19Å; Q579-S582 VanDerWaalsContact O-N 3.14Å; Q579-S582 PolarHBondContact OE1-OG 2.8Å; Q579-A583 PolarHBondContact O-N 2.84Å; Q579-A583 VanDerWaalsContact O-N 3.13Å; Q579-K584 PolarHBondContact N-O 3.06Å
580	L	56.8	Low	78.8	Confident	59 Å²	59	43.1 Å²	43.1	31%	0.309	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-5.9	-172.5	-93.5	152	0	0	0	118.8	V578 E639 T656	V578-L580 PolarHBondContact O-N 3.23Å; L580-E639 HydrophobicContact CD1-CB 3.92Å; L580-E639 VanDerWaalsContact CD1-CD 3.42Å; L580-E639 HydrophobicContact CD1-CG 3.79Å; L580-E639 VanDerWaalsContact CD1-OE2 3.27Å; L580-E639 WeakPolarHBondContact CD1-OE2 3.43Å; L580-E639 HydrophobicContact CD2-CG 3.99Å; L580-E639 WeakPolarHBondContact CD2-OE1 3.37Å; L580-E639 HydrophobicContact CG-CG 4.06Å; L580-E639 VanDerWaalsContact CG-OE1 3.24Å; L580-E639 WeakPolarHBondContact CG-OE1 3.47Å; L580-E639 WeakPolarHBondContact CG-OE2 3.38Å; L580-T656 HydrophobicContact CD1-CG2 3.33Å
581	Y	59.5	Low	78.6	Confident	219 Å²	219	40.1 Å²	40.1	86%	0.859	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.6	-21.1	-179	-61.4	-74.8	0	0	0	114.4	Q579	Q579-Y581 PolarHBondContact O-N 2.85Å
582	S	62.8	Low	78.2	Confident	45 Å²	45	41.7 Å²	41.7	32%	0.315	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-9.1	-175.5	66.8	0	0	0	0	112.6	Q579 K584	Q579-S582 WeakPolarHBondContact CB-OG 3.17Å; Q579-S582 PolarHBondContact O-N 3.19Å; Q579-S582 VanDerWaalsContact O-N 3.14Å; Q579-S582 PolarHBondContact OE1-OG 2.8Å; S582-K584 PolarHBondContact O-N 2.84Å; S582-K584 WeakPolarHBondContact OG-CB 3.4Å; S582-K584 WeakPolarHBondContact OG-CG 3.38Å; S582-K584 PolarHBondContact OG-N 2.92Å
583	A	70.4	Confident	77.3	Confident	81 Å²	81	39.9 Å²	39.9	67%	0.669	21%	0.207	S	C	*	.			trans	54.7	12.2	-169.7	0	0	0	0	0	113.8	Q579	Q579-A583 PolarHBondContact O-N 2.84Å; Q579-A583 VanDerWaalsContact O-N 3.13Å
584	K	75.7	Confident	76.1	Confident	78 Å²	78	45.1 Å²	45.1	34%	0.339	23%	0.225	S	C	.	.			trans	-77.5	144.3	-178	-66.4	173.8	-177.8	-175.3	0	110.3	Q579 S582 E605	Q579-K584 PolarHBondContact N-O 3.06Å; S582-K584 PolarHBondContact O-N 2.84Å; S582-K584 WeakPolarHBondContact OG-CB 3.4Å; S582-K584 WeakPolarHBondContact OG-CG 3.38Å; S582-K584 PolarHBondContact OG-N 2.92Å; K584-E605 WeakPolarHBondContact CD-OE1 3.4Å; K584-E605 WeakPolarHBondContact CE-OE1 3.14Å; K584-E605 IonicContact NZ-OE1 2.67Å; K584-E605 PolarHBondContact NZ-OE1 3.23Å; K584-E605 IonicContact NZ-OE2 3.54Å; K584-E605 PolarHBondContact NZ-OE2 3.22Å
585	P	81.1	Confident	73.6	Confident	20 Å²	20	50 Å²	50	13%	0.13	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	142.7	171.6	25	-28.4	0	0	0	110.8	Y533 F576 G577 L604	Y533-P585 HydrophobicContact CD2-CG 3.77Å; Y533-P585 HydrophobicContact CE2-CG 3.92Å; F576-P585 HydrophobicContact CD1-CB 4.08Å; F576-P585 HydrophobicContact CE1-CB 4.45Å; G577-P585 CarbonylContact O-C 3.6Å; G577-P585 WeakPolarHBondContact O-CA 3.47Å; P585-L604 HydrophobicContact CB-CD1 3.88Å; P585-L604 HydrophobicContact CG-CD1 3.83Å; P585-L604 VanDerWaalsContact O-CD1 3.23Å; P585-L604 WeakPolarHBondContact O-CD1 3.4Å
586	R	80.8	Confident	71.1	Confident	31 Å²	31	52.6 Å²	52.6	12%	0.117	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.4	173.1	173.6	176.9	171.9	-137.5	-5.7	107.4	F576 G577 L588 E601 S655	F576-R586 CarbonylContact C-O 3.55Å; F576-R586 WeakPolarHBondContact CA-O 3.23Å; G577-R586 PolarHBondContact N-O 3.29Å; G577-R586 PolarHBondContact O-N 2.97Å; R586-L588 HydrophobicContact CG-CD2 4.39Å; R586-E601 VanDerWaalsContact CZ-CD 3.43Å; R586-E601 IonicContact CZ-OE1 3Å; R586-E601 IonicContact CZ-OE2 3.5Å; R586-E601 IonicContact NE-OE1 3.43Å; R586-E601 IonicContact NE-OE2 3.71Å; R586-E601 PolarHBondContact NE-OE2 3.45Å; R586-E601 IonicContact NH2-OE1 3.96Å; R586-E601 PolarHBondContact NH2-OE1 2.84Å; R586-E601 IonicContact NH2-OE2 2.66Å; R586-E601 PolarHBondContact NH2-OE2 2.96Å; R586-S655 PolarHBondContact NH1-OG 3.1Å; R586-S655 VanDerWaalsContact NH1-OG 3.12Å
587	L	85.2	Confident	68.7	Low	0 Å²	0	57 Å²	57	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	135.3	178.8	-178.9	63.8	0	0	0	109.9	T526 A535 V543 L545 L574 F576 V600 E601 Y602 L604	T526-L587 HydrophobicContact CG2-CD1 4.35Å; A535-L587 HydrophobicContact CB-CD1 3.77Å; A535-L587 HydrophobicContact CB-CD2 3.63Å; A535-L587 HydrophobicContact CB-CG 4.38Å; V543-L587 HydrophobicContact CG1-CD2 4.02Å; L545-L587 HydrophobicContact CD1-CD2 4.45Å; L574-L587 HydrophobicContact CD1-CD1 3.79Å; L574-L587 HydrophobicContact CD1-CD2 4.45Å; L574-L587 HydrophobicContact CD1-CG 4.24Å; L574-L587 HydrophobicContact CG-CD1 4Å; F576-L587 HydrophobicContact CD1-CB 4.09Å; F576-L587 HydrophobicContact CD1-CD1 4.09Å; F576-L587 HydrophobicContact CD2-CD1 4.05Å; F576-L587 HydrophobicContact CE1-CB 3.85Å; F576-L587 HydrophobicContact CE1-CD1 3.96Å; F576-L587 HydrophobicContact CE1-CG 4.36Å; F576-L587 HydrophobicContact CE2-CD1 3.92Å; F576-L587 HydrophobicContact CG-CD1 4.14Å; F576-L587 HydrophobicContact CZ-CB 4.45Å; F576-L587 HydrophobicContact CZ-CD1 3.88Å; F576-L587 HydrophobicContact CZ-CD2 4.47Å; L587-V600 VanDerWaalsContact O-O 3.05Å; L587-E601 WeakPolarHBondContact O-CA 3.16Å; L587-Y602 HydrophobicContact CB-CD2 3.8Å; L587-Y602 HydrophobicContact CB-CG 4.49Å; L587-Y602 HydrophobicContact CD2-CD2 3.59Å; L587-Y602 HydrophobicContact CD2-CE2 3.98Å; L587-Y602 HydrophobicContact CD2-CG 4.16Å; L587-Y602 HydrophobicContact CG-CD2 3.61Å; L587-Y602 HydrophobicContact CG-CE2 4.03Å; L587-Y602 PolarHBondContact O-N 2.94Å; L587-L604 HydrophobicContact CB-CD2 4.38Å
588	L	84.9	Confident	67.1	Low	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	143.5	175.9	-58.7	176.4	0	0	0	109.6	L575 R586 Q599 E601 M629 W631 L641	L575-L588 PolarHBondContact N-O 3.03Å; L575-L588 PolarHBondContact O-N 3.33Å; R586-L588 HydrophobicContact CG-CD2 4.39Å; L588-Q599 HydrophobicContact CD2-CB 4.25Å; L588-Q599 HydrophobicContact CD2-CG 4.2Å; L588-E601 HydrophobicContact CD2-CG 3.71Å; L588-M629 HydrophobicContact CB-CE 4.05Å; L588-M629 HydrophobicContact CB-SD 4.03Å; L588-M629 WeakPolarHBondContact O-CE 3.31Å; L588-W631 HydrophobicContact CD1-CH2 4.1Å; L588-W631 HydrophobicContact CD1-CZ2 3.8Å; L588-L641 HydrophobicContact CD1-CD1 4.43Å; L588-L641 HydrophobicContact CD1-CD2 4.28Å
589	S	85.7	Confident	65.8	Low	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.6	171.9	64.1	0	0	0	0	111.6	H567 Q599 Y602	H567-S589 PolarHBondContact NE2-OG 2.87Å; S589-Q599 WeakPolarHBondContact O-CA 3.36Å; S589-Y602 PolarHBondContact OG-OH 2.74Å
590	V	83.2	Confident	65.1	Low	7 Å²	7	51.7 Å²	51.7	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	137.5	-178.1	173	0	0	0	0	110.5	I571 Q572 D573 P626 M629	I571-V590 CarbonylContact C-O 3.55Å; I571-V590 WeakPolarHBondContact CG2-O 3.35Å; Q572-V590 PolarHBondContact N-O 2.85Å; D573-V590 PolarHBondContact N-O 2.87Å; D573-V590 PolarHBondContact O-N 3.13Å; V590-P626 HydrophobicContact CG1-CB 3.68Å; V590-P626 HydrophobicContact CG1-CG 3.6Å; V590-M629 HydrophobicContact CB-CE 4.34Å; V590-M629 HydrophobicContact CG2-CE 3.82Å; V590-M629 HydrophobicContact CG2-CG 4.22Å; V590-M629 HydrophobicContact CG2-SD 3.52Å; V590-M629 VanDerWaalsContact CG2-SD 3.52Å
591	G	80.4	Confident	65.6	Low	4 Å²	4	49.9 Å²	49.9	4%	0.041	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	168.7	-177.7	0	0	0	0	0	115.4	P570 D593	P570-G591 WeakPolarHBondContact O-CA 3.32Å; G591-D593 PolarHBondContact O-N 2.97Å; G591-D593 VanDerWaalsContact O-N 3.16Å
592	L	78.1	Confident	66.3	Low	48 Å²	48	39.5 Å²	39.5	25%	0.251	20%	0.202	S	C	.	.	S	Bend	trans	-75.8	10.9	-174.1	-74.1	176.1	0	0	0	116.3	K569 P570 Q572 R594 V625	K569-L592 HydrophobicContact CB-CB 4.02Å; K569-L592 HydrophobicContact CD-CB 4.2Å; K569-L592 WeakPolarHBondContact CD-O 3.5Å; K569-L592 PolarHBondContact NZ-O 2.99Å; K569-L592 VanDerWaalsContact NZ-O 3.09Å; P570-L592 HydrophobicContact CB-CD1 4.39Å; P570-L592 PolarHBondContact O-N 3.19Å; Q572-L592 VanDerWaalsContact CD-CD2 3.5Å; Q572-L592 HydrophobicContact CG-CD2 3.58Å; Q572-L592 HydrophobicContact CG-CG 3.63Å; Q572-L592 VanDerWaalsContact NE2-CD1 3.34Å; Q572-L592 VanDerWaalsContact NE2-CG 3.27Å; L592-R594 PolarHBondContact O-N 3.31Å; L592-V625 HydrophobicContact CB-CG1 4.38Å; L592-V625 HydrophobicContact CD2-CG1 3.55Å
593	D	68.1	Low	66.7	Low	14 Å²	14	38.3 Å²	38.3	8%	0.075	19%	0.192	C	C	.	.			trans	-86.9	-13.3	-145.5	68	-9.8	0	0	0	114.5	H567 Y568 K569 G591 Q595	H567-D593 IonicContact ND1-OD2 2.63Å; Y568-D593 HydrophobicContact CD1-CB 3.94Å; Y568-D593 VanDerWaalsContact CD1-OD2 3.27Å; Y568-D593 WeakPolarHBondContact CD1-OD2 3.43Å; Y568-D593 HydrophobicContact CD2-CB 3.97Å; Y568-D593 HydrophobicContact CE1-CB 3.49Å; Y568-D593 VanDerWaalsContact CE1-CB 3.49Å; Y568-D593 VanDerWaalsContact CE1-CG 3.43Å; Y568-D593 WeakPolarHBondContact CE1-OD2 3.12Å; Y568-D593 HydrophobicContact CE2-CB 3.52Å; Y568-D593 HydrophobicContact CG-CB 4.17Å; Y568-D593 PolarHBondContact OH-O 2.83Å; K569-D593 HydrophobicContact CB-CB 3.77Å; K569-D593 HydrophobicContact CD-CB 4.16Å; K569-D593 HydrophobicContact CG-CB 3.69Å; K569-D593 PolarHBondContact NZ-O 3.25Å; G591-D593 PolarHBondContact O-N 2.97Å; G591-D593 VanDerWaalsContact O-N 3.16Å; D593-Q595 PolarHBondContact O-N 3.42Å
594	R	61	Low	66.9	Low	133 Å²	133	35 Å²	35	50%	0.502	16%	0.164	S	C	.	.	S	Bend	trans	63.7	-21.5	172.9	-65.4	-173.6	-178.6	-169.8	-12.8	116.4	L592 R619 V625 D646	L592-R594 PolarHBondContact O-N 3.31Å; R594-R619 PolarHBondContact O-NH2 3.08Å; R594-V625 HydrophobicContact CG-CG2 3.39Å; R594-D646 IonicContact CZ-OD2 3.41Å; R594-D646 IonicContact NH2-OD2 3.38Å; R594-D646 PolarHBondContact NH2-OD2 3.44Å
595	Q	38.1	Very low	66.7	Low	110 Å²	110	37.5 Å²	37.5	51%	0.514	18%	0.176	S	C	.	.	S	Bend	trans	-134.7	97	180	-83.1	-97	-32.2	0	0	109.7	Y568 D593	Y568-Q595 WeakPolarHBondContact CE1-O 3.09Å; Y568-Q595 PolarHBondContact OH-N 3.41Å; Y568-Q595 PolarHBondContact OH-O 2.98Å; D593-Q595 PolarHBondContact O-N 3.42Å
596	L	35.3	Very low	66	Low	85 Å²	85	43.3 Å²	43.3	45%	0.445	20%	0.2	S	C	.	.	S	Bend	trans	54.9	110	162.6	-72.6	153.3	0	0	0	116.6	R619	L596-R619 HydrophobicContact CD2-CB 3.75Å; L596-R619 HydrophobicContact CD2-CG 4.07Å; L596-R619 HydrophobicContact CG-CG 4.36Å
597	E	34.8	Very low	65.7	Low	97 Å²	97	42.7 Å²	42.7	45%	0.453	20%	0.2	S	C	.	.			trans	147.4	38.7	151.9	-69.9	-162.9	-166	0	0	111.4	I617	E597-I617 VanDerWaalsContact CA-CG2 3.42Å; E597-I617 HydrophobicContact CB-CG2 3.52Å; E597-I617 HydrophobicContact CG-CG2 3.48Å; E597-I617 VanDerWaalsContact CG-CG2 3.48Å
598	Q	44.3	Very low	64.8	Low	49 Å²	49	49.7 Å²	49.7	23%	0.229	23%	0.233	C	C	.	.				69.4	142.2	101.4	-55.3	-174	-51	0	0	114.9	V600 I617 K618 R619	Q598-V600 WeakPolarHBondContact O-CG2 3.49Å; Q598-V600 PolarHBondContact O-N 3.19Å; Q598-I617 HydrophobicContact CB-CB 3.93Å; Q598-I617 HydrophobicContact CB-CG2 3.33Å; Q598-I617 VanDerWaalsContact CD-O 3.26Å; Q598-I617 HydrophobicContact CG-CB 4.32Å; Q598-I617 HydrophobicContact CG-CG2 3.64Å; Q598-I617 PolarHBondContact OE1-O 3.31Å; Q598-K618 WeakPolarHBondContact CA-O 3.22Å; Q598-K618 VanDerWaalsContact CB-CA 3.43Å; Q598-K618 WeakPolarHBondContact CB-O 3.32Å; Q598-K618 VanDerWaalsContact CG-N 3.25Å; Q598-K618 WeakPolarHBondContact CG-O 3.45Å; Q598-K618 VanDerWaalsContact OE1-N 3.08Å; Q598-R619 HydrophobicContact CG-CB 4.15Å
599	Q	47	Very low	64	Low	5 Å²	5	54.5 Å²	54.5	2%	0.023	27%	0.266	C	S	.	.			trans	-39.7	103	168.7	-96.1	168.2	20.1	0	0	110.4	L588 S589 E601 I620	L588-Q599 HydrophobicContact CD2-CB 4.25Å; L588-Q599 HydrophobicContact CD2-CG 4.2Å; S589-Q599 WeakPolarHBondContact O-CA 3.36Å; Q599-E601 PolarHBondContact O-N 2.69Å; Q599-E601 VanDerWaalsContact O-N 3.09Å; Q599-I620 HydrophobicContact CG-CD1 3.95Å
600	V	54.7	Low	63.1	Low	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.297	C	S	.	.			trans	-81.8	103.6	-179.8	177.5	0	0	0	0	105.8	L587 Q598 Y602 L614 I617	L587-V600 VanDerWaalsContact O-O 3.05Å; Q598-V600 WeakPolarHBondContact O-CG2 3.49Å; Q598-V600 PolarHBondContact O-N 3.19Å; V600-Y602 HydrophobicContact CB-CE1 4.41Å; V600-Y602 HydrophobicContact CB-CE2 3.95Å; V600-Y602 HydrophobicContact CG1-CD1 3.96Å; V600-Y602 HydrophobicContact CG1-CD2 4.2Å; V600-Y602 HydrophobicContact CG1-CE1 3.53Å; V600-Y602 HydrophobicContact CG1-CE2 3.78Å; V600-Y602 HydrophobicContact CG1-CG 4.3Å; V600-Y602 VanDerWaalsContact CG1-CZ 3.42Å; V600-Y602 WeakPolarHBondContact O-CD2 3.38Å; V600-Y602 WeakPolarHBondContact O-CE2 3.2Å; V600-Y602 PolarHBondContact O-N 3.42Å; V600-L614 HydrophobicContact CG1-CB 4.38Å; V600-L614 HydrophobicContact CG1-CD1 3.68Å; V600-L614 HydrophobicContact CG1-CD2 3.13Å; V600-L614 HydrophobicContact CG1-CG 3.88Å; V600-I617 HydrophobicContact CG2-CG1 4.48Å
601	E	66.4	Low	62.6	Low	21 Å²	21	66.3 Å²	66.3	10%	0.098	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	117.7	170.6	-66.1	-176	-144.8	0	0	107.3	R586 L587 L588 Q599 I615 S616 K618	R586-E601 VanDerWaalsContact CZ-CD 3.43Å; R586-E601 IonicContact CZ-OE1 3Å; R586-E601 IonicContact CZ-OE2 3.5Å; R586-E601 IonicContact NE-OE1 3.43Å; R586-E601 IonicContact NE-OE2 3.71Å; R586-E601 PolarHBondContact NE-OE2 3.45Å; R586-E601 IonicContact NH2-OE1 3.96Å; R586-E601 PolarHBondContact NH2-OE1 2.84Å; R586-E601 IonicContact NH2-OE2 2.66Å; R586-E601 PolarHBondContact NH2-OE2 2.96Å; L587-E601 WeakPolarHBondContact O-CA 3.16Å; L588-E601 HydrophobicContact CD2-CG 3.71Å; Q599-E601 PolarHBondContact O-N 2.69Å; Q599-E601 VanDerWaalsContact O-N 3.09Å; E601-I615 HydrophobicContact CB-CB 3.83Å; E601-I615 HydrophobicContact CB-CD1 4.37Å; E601-I615 HydrophobicContact CB-CG2 4.39Å; E601-I615 WeakPolarHBondContact O-CB 3.38Å; E601-I615 PolarHBondContact O-N 2.93Å; E601-S616 PolarHBondContact N-O 3.06Å; E601-S616 PolarHBondContact OE1-OG 3.25Å; E601-S616 VanDerWaalsContact OE1-OG 3.1Å; E601-K618 IonicContact OE1-NZ 2.8Å; E601-K618 PolarHBondContact OE1-NZ 3.49Å
602	Y	73.6	Confident	62.5	Low	2 Å²	2	66.3 Å²	66.3	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138.4	179	-57.5	-91.8	0	0	0	110.7	V543 S566 L587 S589 V600 L604 L612 L613 L614	V543-Y602 HydrophobicContact CB-CE1 4.38Å; V543-Y602 WeakPolarHBondContact CB-OH 3.12Å; V543-Y602 HydrophobicContact CG1-CE1 4.48Å; V543-Y602 HydrophobicContact CG1-CE2 4.3Å; V543-Y602 VanDerWaalsContact CG2-OH 3.23Å; V543-Y602 WeakPolarHBondContact CG2-OH 3.07Å; S566-Y602 VanDerWaalsContact CB-OH 3.3Å; S566-Y602 WeakPolarHBondContact CB-OH 3.24Å; S566-Y602 PolarHBondContact OG-OH 2.87Å; L587-Y602 HydrophobicContact CB-CD2 3.8Å; L587-Y602 HydrophobicContact CB-CG 4.49Å; L587-Y602 HydrophobicContact CD2-CD2 3.59Å; L587-Y602 HydrophobicContact CD2-CE2 3.98Å; L587-Y602 HydrophobicContact CD2-CG 4.16Å; L587-Y602 HydrophobicContact CG-CD2 3.61Å; L587-Y602 HydrophobicContact CG-CE2 4.03Å; L587-Y602 PolarHBondContact O-N 2.94Å; S589-Y602 PolarHBondContact OG-OH 2.74Å; V600-Y602 HydrophobicContact CB-CE1 4.41Å; V600-Y602 HydrophobicContact CB-CE2 3.95Å; V600-Y602 HydrophobicContact CG1-CD1 3.96Å; V600-Y602 HydrophobicContact CG1-CD2 4.2Å; V600-Y602 HydrophobicContact CG1-CE1 3.53Å; V600-Y602 HydrophobicContact CG1-CE2 3.78Å; V600-Y602 HydrophobicContact CG1-CG 4.3Å; V600-Y602 VanDerWaalsContact CG1-CZ 3.42Å; V600-Y602 WeakPolarHBondContact O-CD2 3.38Å; V600-Y602 WeakPolarHBondContact O-CE2 3.2Å; V600-Y602 PolarHBondContact O-N 3.42Å; Y602-L604 PolarHBondContact O-N 2.97Å; Y602-L612 HydrophobicContact CD1-CD1 4.23Å; Y602-L612 HydrophobicContact CD1-CD2 3.45Å; Y602-L612 VanDerWaalsContact CD1-CD2 3.45Å; Y602-L612 HydrophobicContact CD1-CG 3.67Å; Y602-L612 HydrophobicContact CE1-CD2 3.65Å; Y602-L612 HydrophobicContact CE1-CG 4.3Å; Y602-L612 HydrophobicContact CG-CD2 4.31Å; Y602-L612 HydrophobicContact CG-CG 4.49Å; Y602-L613 WeakPolarHBondContact CA-O 3.41Å; Y602-L614 HydrophobicContact CD1-CD2 3.37Å; Y602-L614 HydrophobicContact CE1-CD2 3.46Å; Y602-L614 VanDerWaalsContact CE1-CD2 3.46Å; Y602-L614 HydrophobicContact CG-CD2 4.34Å
603	D	71.2	Confident	62.4	Low	19 Å²	19	66.7 Å²	66.7	10%	0.102	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	95.5	175.2	-167	-28.5	0	0	0	109.4	E605 K606 S607 L613 I615	D603-E605 VanDerWaalsContact C-N 3.26Å; D603-E605 PolarHBondContact O-N 3.17Å; D603-E605 PolarHBondContact OD1-N 2.95Å; D603-E605 VanDerWaalsContact OD1-N 3.12Å; D603-K606 PolarHBondContact OD1-N 3.01Å; D603-K606 WeakPolarHBondContact OD2-CD 3.23Å; D603-K606 WeakPolarHBondContact OD2-CE 3.11Å; D603-K606 WeakPolarHBondContact OD2-CG 3.37Å; D603-K606 IonicContact OD2-NZ 3.22Å; D603-K606 PolarHBondContact OD2-NZ 3.49Å; D603-S607 VanDerWaalsContact O-CB 3.3Å; D603-S607 WeakPolarHBondContact O-CB 2.95Å; D603-S607 PolarHBondContact O-N 3.13Å; D603-S607 PolarHBondContact O-OG 3.26Å; D603-L613 HydrophobicContact CB-CB 4.2Å; D603-L613 PolarHBondContact N-O 2.86Å; D603-I615 HydrophobicContact CB-CD1 4.15Å; D603-I615 HydrophobicContact CB-CG1 3.63Å
604	L	75.9	Confident	62.7	Low	13 Å²	13	68.2 Å²	68.2	7%	0.068	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	-18.8	-177.7	-54.4	-177.9	0	0	0	113.2	Y533 L545 F576 P585 L587 Y602	Y533-L604 HydrophobicContact CE1-CB 4.36Å; L545-L604 HydrophobicContact CD1-CD2 4Å; L545-L604 HydrophobicContact CD2-CD2 3.53Å; L545-L604 HydrophobicContact CG-CD2 4.44Å; F576-L604 HydrophobicContact CE1-CD1 3.97Å; P585-L604 HydrophobicContact CB-CD1 3.88Å; P585-L604 HydrophobicContact CG-CD1 3.83Å; P585-L604 VanDerWaalsContact O-CD1 3.23Å; P585-L604 WeakPolarHBondContact O-CD1 3.4Å; L587-L604 HydrophobicContact CB-CD2 4.38Å; Y602-L604 PolarHBondContact O-N 2.97Å
605	E	70.7	Confident	63.3	Low	129 Å²	129	66.5 Å²	66.5	60%	0.603	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	-37.7	-175.6	-57.8	-159.2	127.6	0	0	112.6	K584 D603	K584-E605 WeakPolarHBondContact CD-OE1 3.4Å; K584-E605 WeakPolarHBondContact CE-OE1 3.14Å; K584-E605 IonicContact NZ-OE1 2.67Å; K584-E605 PolarHBondContact NZ-OE1 3.23Å; K584-E605 IonicContact NZ-OE2 3.54Å; K584-E605 PolarHBondContact NZ-OE2 3.22Å; D603-E605 VanDerWaalsContact C-N 3.26Å; D603-E605 PolarHBondContact O-N 3.17Å; D603-E605 PolarHBondContact OD1-N 2.95Å; D603-E605 VanDerWaalsContact OD1-N 3.12Å
606	K	67.1	Low	64.8	Low	143 Å²	143	62.6 Å²	62.6	62%	0.622	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	-6.8	179.4	-58.5	-169.9	-157	107.5	0	113.8	D603 E608 L613	D603-K606 PolarHBondContact OD1-N 3.01Å; D603-K606 WeakPolarHBondContact OD2-CD 3.23Å; D603-K606 WeakPolarHBondContact OD2-CE 3.11Å; D603-K606 WeakPolarHBondContact OD2-CG 3.37Å; D603-K606 IonicContact OD2-NZ 3.22Å; D603-K606 PolarHBondContact OD2-NZ 3.49Å; K606-E608 PolarHBondContact O-N 2.79Å; K606-L613 HydrophobicContact CB-CD1 3.85Å; K606-L613 WeakPolarHBondContact O-CD1 3.26Å
607	S	73.9	Confident	66.5	Low	17 Å²	17	60.9 Å²	60.9	12%	0.119	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	117.8	176.6	-69.2	0	0	0	0	110.1	D603 K611 L613	D603-S607 VanDerWaalsContact O-CB 3.3Å; D603-S607 WeakPolarHBondContact O-CB 2.95Å; D603-S607 PolarHBondContact O-N 3.13Å; D603-S607 PolarHBondContact O-OG 3.26Å; S607-K611 WeakPolarHBondContact CA-O 3.35Å; S607-K611 WeakPolarHBondContact CB-O 3.32Å; S607-L613 PolarHBondContact OG-N 3.26Å
608	E	66.1	Low	68.2	Low	148 Å²	148	58 Å²	58	69%	0.692	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	167.4	176.3	-67.8	179	179	0	0	110.7	V561 K606 N610 K611	V561-E608 VanDerWaalsContact O-O 3.12Å; K606-E608 PolarHBondContact O-N 2.79Å; E608-N610 PolarHBondContact O-N 2.65Å; E608-K611 PolarHBondContact N-O 3.35Å; E608-K611 PolarHBondContact O-N 3.26Å
609	S	67.8	Low	69.5	Low	101 Å²	101	59 Å²	59	71%	0.706	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	124.6	175.7	57.5	0	0	0	0	111.6	V561	V561-S609 CarbonylContact O-C 3.42Å; V561-S609 WeakPolarHBondContact O-CA 3.46Å
610	N	67.4	Low	70.5	Confident	122 Å²	122	59.7 Å²	59.7	65%	0.652	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	6.8	-174.2	-61.6	-31.1	0	0	0	117.8	F560 V561 E608	F560-N610 WeakPolarHBondContact CE1-OD1 3.34Å; V561-N610 WeakPolarHBondContact O-CA 3.49Å; V561-N610 PolarHBondContact O-N 3.49Å; E608-N610 PolarHBondContact O-N 2.65Å
611	K	72	Confident	71.3	Confident	133 Å²	133	60.4 Å²	60.4	58%	0.578	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.2	104.4	177.8	-167.2	179.8	-177.7	-174.9	0	112.3	S607 E608 L613	S607-K611 WeakPolarHBondContact CA-O 3.35Å; S607-K611 WeakPolarHBondContact CB-O 3.32Å; E608-K611 PolarHBondContact N-O 3.35Å; E608-K611 PolarHBondContact O-N 3.26Å; K611-L613 HydrophobicContact CD-CD2 4.13Å; K611-L613 HydrophobicContact CG-CD2 4.15Å
612	L	78.1	Confident	71.5	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.9	173.4	-173.9	68.6	0	0	0	109.6	L545 Y564 Y602	L545-L612 HydrophobicContact CB-CD1 3.99Å; L545-L612 HydrophobicContact CD2-CD1 3.72Å; L545-L612 HydrophobicContact CG-CD1 4.49Å; Y564-L612 WeakPolarHBondContact CD2-O 3.35Å; Y602-L612 HydrophobicContact CD1-CD1 4.23Å; Y602-L612 HydrophobicContact CD1-CD2 3.45Å; Y602-L612 VanDerWaalsContact CD1-CD2 3.45Å; Y602-L612 HydrophobicContact CD1-CG 3.67Å; Y602-L612 HydrophobicContact CE1-CD2 3.65Å; Y602-L612 HydrophobicContact CE1-CG 4.3Å; Y602-L612 HydrophobicContact CG-CD2 4.31Å; Y602-L612 HydrophobicContact CG-CG 4.49Å
613	L	75.8	Confident	71.5	Confident	55 Å²	55	64.2 Å²	64.2	29%	0.288	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	149.9	-177.1	-64.3	179	0	0	0	112.3	Y602 D603 K606 S607 K611	Y602-L613 WeakPolarHBondContact CA-O 3.41Å; D603-L613 HydrophobicContact CB-CB 4.2Å; D603-L613 PolarHBondContact N-O 2.86Å; K606-L613 HydrophobicContact CB-CD1 3.85Å; K606-L613 WeakPolarHBondContact O-CD1 3.26Å; S607-L613 PolarHBondContact OG-N 3.26Å; K611-L613 HydrophobicContact CD-CD2 4.13Å; K611-L613 HydrophobicContact CG-CD2 4.15Å
614	L	76.2	Confident	71.8	Confident	47 Å²	47	63.5 Å²	63.5	25%	0.246	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.5	176.7	-53.9	-165.7	0	0	0	111.5	Y564 V600 Y602 I617	Y564-L614 HydrophobicContact CD1-CD1 4.04Å; Y564-L614 HydrophobicContact CD1-CD2 3.91Å; Y564-L614 HydrophobicContact CD1-CG 4.24Å; Y564-L614 HydrophobicContact CD2-CD2 4.4Å; Y564-L614 HydrophobicContact CD2-CG 4.45Å; Y564-L614 HydrophobicContact CE1-CD1 3.36Å; Y564-L614 HydrophobicContact CE1-CD2 4.1Å; Y564-L614 HydrophobicContact CE1-CG 3.92Å; Y564-L614 HydrophobicContact CE2-CD1 4.26Å; Y564-L614 HydrophobicContact CE2-CG 4.12Å; Y564-L614 HydrophobicContact CG-CD2 4.08Å; Y564-L614 VanDerWaalsContact CZ-CD1 3.47Å; V600-L614 HydrophobicContact CG1-CB 4.38Å; V600-L614 HydrophobicContact CG1-CD1 3.68Å; V600-L614 HydrophobicContact CG1-CD2 3.13Å; V600-L614 HydrophobicContact CG1-CG 3.88Å; Y602-L614 HydrophobicContact CD1-CD2 3.37Å; Y602-L614 HydrophobicContact CE1-CD2 3.46Å; Y602-L614 VanDerWaalsContact CE1-CD2 3.46Å; Y602-L614 HydrophobicContact CG-CD2 4.34Å; L614-I617 HydrophobicContact CD1-CD1 3.66Å; L614-I617 HydrophobicContact CD1-CG1 4.23Å
615	I	73.7	Confident	72.2	Confident	96 Å²	96	63.1 Å²	63.1	49%	0.492	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-57.5	173.3	-61.5	173.7	0	0	0	109.8	E601 D603	E601-I615 HydrophobicContact CB-CB 3.83Å; E601-I615 HydrophobicContact CB-CD1 4.37Å; E601-I615 HydrophobicContact CB-CG2 4.39Å; E601-I615 WeakPolarHBondContact O-CB 3.38Å; E601-I615 PolarHBondContact O-N 2.93Å; D603-I615 HydrophobicContact CB-CD1 4.15Å; D603-I615 HydrophobicContact CB-CG1 3.63Å
616	S	68.9	Low	72.9	Confident	28 Å²	28	57.8 Å²	57.8	20%	0.196	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	154.4	-176.8	84	0	0	0	0	111.6	E601 K618	E601-S616 PolarHBondContact N-O 3.06Å; E601-S616 PolarHBondContact OE1-OG 3.25Å; E601-S616 VanDerWaalsContact OE1-OG 3.1Å; S616-K618 VanDerWaalsContact OG-CE 3.26Å; S616-K618 WeakPolarHBondContact OG-CE 3.47Å
617	I	70.7	Confident	73.8	Confident	50 Å²	50	53.6 Å²	53.6	26%	0.256	28%	0.277	S	S	.	.			trans	-121.4	124.4	174.5	-51.2	-178	0	0	0	98.6	E597 Q598 V600 L614	E597-I617 VanDerWaalsContact CA-CG2 3.42Å; E597-I617 HydrophobicContact CB-CG2 3.52Å; E597-I617 HydrophobicContact CG-CG2 3.48Å; E597-I617 VanDerWaalsContact CG-CG2 3.48Å; Q598-I617 HydrophobicContact CB-CB 3.93Å; Q598-I617 HydrophobicContact CB-CG2 3.33Å; Q598-I617 VanDerWaalsContact CD-O 3.26Å; Q598-I617 HydrophobicContact CG-CB 4.32Å; Q598-I617 HydrophobicContact CG-CG2 3.64Å; Q598-I617 PolarHBondContact OE1-O 3.31Å; V600-I617 HydrophobicContact CG2-CG1 4.48Å; L614-I617 HydrophobicContact CD1-CD1 3.66Å; L614-I617 HydrophobicContact CD1-CG1 4.23Å
618	K	69.8	Low	74.4	Confident	37 Å²	37	52.8 Å²	52.8	16%	0.161	27%	0.272	C	S	.	.			trans	-127.2	132.3	162.4	-88.5	165	-86.7	157	0	121.1	Q598 E601 S616 T658 C660	Q598-K618 WeakPolarHBondContact CA-O 3.22Å; Q598-K618 VanDerWaalsContact CB-CA 3.43Å; Q598-K618 WeakPolarHBondContact CB-O 3.32Å; Q598-K618 VanDerWaalsContact CG-N 3.25Å; Q598-K618 WeakPolarHBondContact CG-O 3.45Å; Q598-K618 VanDerWaalsContact OE1-N 3.08Å; E601-K618 IonicContact OE1-NZ 2.8Å; E601-K618 PolarHBondContact OE1-NZ 3.49Å; S616-K618 VanDerWaalsContact OG-CE 3.26Å; S616-K618 WeakPolarHBondContact OG-CE 3.47Å; K618-T658 WeakPolarHBondContact CD-O 3.04Å; K618-T658 WeakPolarHBondContact CE-O 3.47Å; K618-T658 PolarHBondContact NZ-O 3.05Å; K618-C660 HydrophobicContact CD-CB 4.31Å; K618-C660 PolarHBondContact NZ-SG 2.86Å
619	R	71.3	Confident	75.5	Confident	68 Å²	68	45.9 Å²	45.9	26%	0.257	24%	0.24	S	C	.	.			trans	-86.1	124.9	-169	-174.2	-166.5	-176.1	168.6	5	107.7	R594 L596 Q598 E621	R594-R619 PolarHBondContact O-NH2 3.08Å; L596-R619 HydrophobicContact CD2-CB 3.75Å; L596-R619 HydrophobicContact CD2-CG 4.07Å; L596-R619 HydrophobicContact CG-CG 4.36Å; Q598-R619 HydrophobicContact CG-CB 4.15Å; R619-E621 PolarHBondContact NE-O 2.92Å
620	I	69.8	Low	76.5	Confident	20 Å²	20	41.9 Å²	41.9	10%	0.103	21%	0.211	C	C	.	.			trans	-97.9	-39.2	-171.1	-55.7	-176	0	0	0	111.1	Q599 F653 Q833	Q599-I620 HydrophobicContact CG-CD1 3.95Å; I620-F653 HydrophobicContact CB-CZ 4.43Å; I620-F653 HydrophobicContact CG2-CD1 4.45Å; I620-F653 HydrophobicContact CG2-CD2 4.23Å; I620-F653 HydrophobicContact CG2-CE1 3.65Å; I620-F653 HydrophobicContact CG2-CE2 3.38Å; I620-F653 HydrophobicContact CG2-CZ 3.06Å; I620-Q833 PolarHBondContact O-NE2 3.04Å
621	E	69.9	Low	77.4	Confident	16 Å²	16	38.7 Å²	38.7	8%	0.075	19%	0.19	C	C	.	.			trans	-135.8	147.3	-173	-73.8	-76.2	-171	0	0	112.3	R619 A624 K651	R619-E621 PolarHBondContact NE-O 2.92Å; E621-A624 VanDerWaalsContact CB-O 3.24Å; E621-A624 WeakPolarHBondContact CB-O 3.4Å; E621-K651 WeakPolarHBondContact OE1-CD 3.25Å; E621-K651 WeakPolarHBondContact OE1-CE 3.22Å; E621-K651 IonicContact OE1-NZ 3.42Å; E621-K651 PolarHBondContact OE1-NZ 3.36Å; E621-K651 IonicContact OE2-NZ 3.76Å; E621-K651 PolarHBondContact OE2-NZ 3.18Å
622	Q	70.6	Confident	78	Confident	49 Å²	49	33.3 Å²	33.3	23%	0.229	17%	0.166	C	C	.	.	S	Bend	trans	-105.9	-43.1	173.2	175.9	168.7	-13.9	0	0	112.8
623	S	73.8	Confident	78.3	Confident	54 Å²	54	33.9 Å²	33.9	38%	0.378	17%	0.17	S	C	.	.	S	Bend	trans	-92.2	-45.2	-176.1	53.7	0	0	0	0	112.4	E834	S623-E834 PolarHBondContact OG-OE1 3.44Å
624	A	78.7	Confident	78.2	Confident	3 Å²	3	38 Å²	38	3%	0.025	19%	0.186	C	C	.	.	S	Bend	trans	-98.8	158.8	-172	0	0	0	0	0	114	E621 D646 N647	E621-A624 VanDerWaalsContact CB-O 3.24Å; E621-A624 WeakPolarHBondContact CB-O 3.4Å; A624-D646 WeakPolarHBondContact CA-OD1 3.36Å; A624-D646 WeakPolarHBondContact CB-OD1 3.28Å; A624-N647 HydrophobicContact CB-CB 4.2Å
625	V	83.3	Confident	77.9	Confident	5 Å²	5	39.3 Å²	39.3	3%	0.03	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-95.3	124.7	172.1	-174.6	0	0	0	0	109.8	L592 R594 R627 S645 D646	L592-V625 HydrophobicContact CB-CG1 4.38Å; L592-V625 HydrophobicContact CD2-CG1 3.55Å; R594-V625 HydrophobicContact CG-CG2 3.39Å; V625-R627 PolarHBondContact O-N 3.32Å; V625-S645 CarbonylContact O-C 3.59Å; V625-S645 WeakPolarHBondContact O-CA 3.46Å; V625-D646 HydrophobicContact CB-CB 4.28Å; V625-D646 WeakPolarHBondContact CB-OD2 3.47Å; V625-D646 WeakPolarHBondContact CG2-OD2 3.04Å; V625-D646 PolarHBondContact N-OD1 3.49Å; V625-D646 PolarHBondContact O-N 3.16Å
626	P	85.4	Confident	77.6	Confident	17 Å²	17	38 Å²	38	11%	0.11	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	131.7	170.9	31.1	-35	0	0	0	110.5	V590 V643 S644	V590-P626 HydrophobicContact CG1-CB 3.68Å; V590-P626 HydrophobicContact CG1-CG 3.6Å; P626-V643 HydrophobicContact CB-CG1 3.73Å; P626-S644 CarbonylContact C-O 3.54Å; P626-S644 WeakPolarHBondContact CA-O 3.44Å
627	R	86.3	Confident	77.4	Confident	55 Å²	55	42.4 Å²	42.4	21%	0.208	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-45.2	-178.4	-70.5	-65.3	-164.9	101.6	3.2	112.6	Q572 V625 S644 I675	Q572-R627 VanDerWaalsContact CB-O 3.31Å; Q572-R627 WeakPolarHBondContact CB-O 3.33Å; V625-R627 PolarHBondContact O-N 3.32Å; R627-S644 PolarHBondContact N-O 2.79Å; R627-I675 VanDerWaalsContact CB-O 3.25Å; R627-I675 WeakPolarHBondContact CB-O 3.2Å
628	C	87.5	Confident	77.4	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	165.5	175.3	68.7	0	0	0	0	112.5	V643 S644 R676 I678	C628-V643 WeakPolarHBondContact O-CA 3.42Å; C628-S644 PolarHBondContact N-OG 3.34Å; C628-S644 PolarHBondContact O-N 2.77Å; C628-S644 PolarHBondContact SG-OG 3.48Å; C628-R676 VanDerWaalsContact CB-O 3.3Å; C628-R676 WeakPolarHBondContact CB-O 3.46Å; C628-I678 VanDerWaalsContact SG-CD1 3.58Å; C628-I678 VanDerWaalsContact SG-CG1 3.57Å
629	M	88.9	Confident	77.7	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.015	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	147	178.1	57.9	174.1	166.6	0	0	111.8	D573 L575 L588 V590 L641 L642 V643	D573-M629 HydrophobicContact CB-CE 4.11Å; D573-M629 HydrophobicContact CB-CG 4.13Å; D573-M629 WeakPolarHBondContact O-CE 3.41Å; D573-M629 PolarHBondContact OD2-N 3.19Å; D573-M629 VanDerWaalsContact OD2-O 3.14Å; L575-M629 HydrophobicContact CB-CE 3.66Å; L575-M629 HydrophobicContact CB-CG 4.27Å; L575-M629 HydrophobicContact CB-SD 4.06Å; L575-M629 HydrophobicContact CD2-CG 4.22Å; L575-M629 HydrophobicContact CD2-SD 4.42Å; L588-M629 HydrophobicContact CB-CE 4.05Å; L588-M629 HydrophobicContact CB-SD 4.03Å; L588-M629 WeakPolarHBondContact O-CE 3.31Å; V590-M629 HydrophobicContact CB-CE 4.34Å; V590-M629 HydrophobicContact CG2-CE 3.82Å; V590-M629 HydrophobicContact CG2-CG 4.22Å; V590-M629 HydrophobicContact CG2-SD 3.52Å; V590-M629 VanDerWaalsContact CG2-SD 3.52Å; M629-L641 HydrophobicContact CB-CD1 4.48Å; M629-L641 HydrophobicContact CB-CD2 4.38Å; M629-L642 CarbonylContact C-O 3.5Å; M629-L642 VanDerWaalsContact CA-O 3.24Å; M629-L642 WeakPolarHBondContact CA-O 3.3Å; M629-V643 HydrophobicContact CB-CG2 4.24Å
630	T	88.4	Confident	78.3	Confident	16 Å²	16	39 Å²	39	10%	0.098	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	156.5	173.8	-161.1	0	0	0	0	111.1	L641 L642 I678 V680	T630-L641 WeakPolarHBondContact O-CD1 3.34Å; T630-L642 HydrophobicContact CG2-CB 3.91Å; T630-L642 HydrophobicContact CG2-CD2 3.94Å; T630-L642 HydrophobicContact CG2-CG 4.27Å; T630-L642 PolarHBondContact N-O 2.84Å; T630-L642 PolarHBondContact O-N 3.02Å; T630-I678 HydrophobicContact CG2-CB 4.3Å; T630-I678 HydrophobicContact CG2-CG2 3.51Å; T630-V680 HydrophobicContact CG2-CG2 4.43Å
631	W	86.7	Confident	79	Confident	55 Å²	55	38.3 Å²	38.3	21%	0.208	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.9	172.5	-68	109.9	0	0	0	110.3	L575 F576 G577 L588 L641 S655	L575-W631 HydrophobicContact CD2-CD2 4.49Å; L575-W631 HydrophobicContact CD2-CG 4.24Å; F576-W631 PolarHBondContact O-NE1 3.45Å; G577-W631 VanDerWaalsContact CA-CZ2 3.45Å; G577-W631 VanDerWaalsContact CA-NE1 3.31Å; L588-W631 HydrophobicContact CD1-CH2 4.1Å; L588-W631 HydrophobicContact CD1-CZ2 3.8Å; W631-L641 HydrophobicContact CD2-CD1 3.92Å; W631-L641 HydrophobicContact CE3-CB 4.42Å; W631-L641 HydrophobicContact CE3-CD1 3.9Å; W631-L641 HydrophobicContact CH2-CD1 4.12Å; W631-L641 HydrophobicContact CZ2-CD1 4.12Å; W631-L641 HydrophobicContact CZ3-CB 4.18Å; W631-L641 HydrophobicContact CZ3-CD1 4.02Å; W631-S655 WeakPolarHBondContact CH2-OG 3.44Å; W631-S655 WeakPolarHBondContact CZ3-OG 3.19Å
632	Y	85.2	Confident	79.9	Confident	21 Å²	21	37.6 Å²	37.6	8%	0.082	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-76.7	139.8	176.7	-165.5	-106.9	0	0	0	110.1	F635 F640 L642 L652 L707 P708 M709	Y632-F635 AromaticContact CD1-CD2 3.99Å; Y632-F635 HydrophobicContact CD1-CD2 3.99Å; Y632-F635 HydrophobicContact CD1-CE2 4.39Å; Y632-F635 AromaticContact CE1-CD2 3.31Å; Y632-F635 HydrophobicContact CE1-CD2 3.31Å; Y632-F635 AromaticContact CE1-CE2 3.68Å; Y632-F635 HydrophobicContact CE1-CE2 3.68Å; Y632-F635 HydrophobicContact CE1-CG 4.44Å; Y632-F635 AromaticContact CZ-CD2 3.9Å; Y632-F635 AromaticContact CZ-CE2 3.79Å; Y632-F640 WeakPolarHBondContact CB-O 3.42Å; Y632-F640 HydrophobicContact CD1-CB 4.16Å; Y632-F640 HydrophobicContact CD1-CD2 4.37Å; Y632-F640 HydrophobicContact CG-CB 4.15Å; Y632-F640 PolarHBondContact N-O 3.46Å; Y632-L642 HydrophobicContact CD2-CB 4.5Å; Y632-L642 HydrophobicContact CD2-CD2 4.33Å; Y632-L652 HydrophobicContact CD1-CD2 4.4Å; Y632-L652 HydrophobicContact CD2-CD2 3.53Å; Y632-L652 HydrophobicContact CE2-CD2 3.92Å; Y632-L652 HydrophobicContact CG-CD2 3.8Å; Y632-L707 HydrophobicContact CE2-CD2 3.9Å; Y632-P708 VanDerWaalsContact OH-CA 3.23Å; Y632-P708 WeakPolarHBondContact OH-CA 3.31Å; Y632-P708 WeakPolarHBondContact OH-CB 3.4Å; Y632-M709 HydrophobicContact CE2-CG 4.38Å; Y632-M709 PolarHBondContact OH-N 3.48Å
633	P	82.6	Confident	80.8	Confident	16 Å²	16	35.4 Å²	35.4	10%	0.104	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-59.1	149.6	178	-23.2	33.3	0	0	0	112.8	F635 V680 H692 L707	P633-F635 HydrophobicContact CB-CD2 4.15Å; P633-F635 HydrophobicContact CB-CE2 3.75Å; P633-F635 HydrophobicContact CB-CZ 4.37Å; P633-F635 HydrophobicContact CG-CE2 4.1Å; P633-F635 WeakPolarHBondContact O-CD2 3.46Å; P633-F635 PolarHBondContact O-N 2.95Å; P633-V680 HydrophobicContact CG-CG1 3.76Å; P633-V680 HydrophobicContact CG-CG2 4.32Å; P633-H692 HydrophobicContact CG-CB 4.23Å; P633-L707 HydrophobicContact CG-CD1 3.7Å
634	F	74.6	Confident	81.5	Confident	141 Å²	141	32.9 Å²	32.9	62%	0.618	16%	0.163	S	C	*	.			trans	-70.7	91.6	177.8	-65.5	-93.1	0	0	0	111.2	E639	F634-E639 HydrophobicContact CD1-CG 3.99Å; F634-E639 HydrophobicContact CE1-CG 3.17Å; F634-E639 WeakPolarHBondContact CE1-OE1 3.42Å; F634-E639 HydrophobicContact CZ-CG 3.65Å; F634-E639 WeakPolarHBondContact CZ-OE1 3.17Å
635	F	69.6	Low	82	Confident	75 Å²	75	32.8 Å²	32.8	33%	0.329	16%	0.163	S	C	.	.	S	Bend	trans	-96.8	-32.5	167.7	-66	-81.3	0	0	0	112.3	Y632 P633 H692 L707	Y632-F635 AromaticContact CD1-CD2 3.99Å; Y632-F635 HydrophobicContact CD1-CD2 3.99Å; Y632-F635 HydrophobicContact CD1-CE2 4.39Å; Y632-F635 AromaticContact CE1-CD2 3.31Å; Y632-F635 HydrophobicContact CE1-CD2 3.31Å; Y632-F635 AromaticContact CE1-CE2 3.68Å; Y632-F635 HydrophobicContact CE1-CE2 3.68Å; Y632-F635 HydrophobicContact CE1-CG 4.44Å; Y632-F635 AromaticContact CZ-CD2 3.9Å; Y632-F635 AromaticContact CZ-CE2 3.79Å; P633-F635 HydrophobicContact CB-CD2 4.15Å; P633-F635 HydrophobicContact CB-CE2 3.75Å; P633-F635 HydrophobicContact CB-CZ 4.37Å; P633-F635 HydrophobicContact CG-CE2 4.1Å; P633-F635 WeakPolarHBondContact O-CD2 3.46Å; P633-F635 PolarHBondContact O-N 2.95Å; F635-H692 AromaticContact CE1-CD2 3.53Å; F635-H692 HydrophobicContact CZ-CB 3.83Å; F635-H692 AromaticContact CZ-CD2 3.5Å; F635-H692 VanDerWaalsContact CZ-CD2 3.5Å; F635-H692 WeakPolarHBondContact CZ-CD2 3.27Å; F635-H692 AromaticContact CZ-CG 3.9Å; F635-L707 HydrophobicContact CE2-CB 4Å; F635-L707 HydrophobicContact CE2-CD1 4.46Å; F635-L707 HydrophobicContact CZ-CB 3.72Å
636	N	66.8	Low	82.1	Confident	67 Å²	67	33.6 Å²	33.6	36%	0.358	17%	0.166	S	C	.	.	S	Bend	trans	-116.3	164.2	-178.1	-71.4	-5.4	0	0	0	109.1	E638 F640 R663	N636-E638 PolarHBondContact O-N 3.39Å; N636-F640 HydrophobicContact CB-CE2 4.4Å; N636-R663 PolarHBondContact ND2-NH1 3.02Å
637	P	65.6	Low	82.2	Confident	121 Å²	121	35.9 Å²	35.9	79%	0.786	18%	0.178	S	C	*	.	S	Bend	trans	-63.1	-9.7	172.9	26.3	-36	0	0	0	113.8
638	E	71.3	Confident	82.3	Confident	54 Å²	54	35 Å²	35	25%	0.252	18%	0.175	S	C	.	.	S	Bend	trans	-100.1	138.5	177.9	-62.6	176.5	137.9	0	0	110.9	N636 F640 N654 T656 R663	N636-E638 PolarHBondContact O-N 3.39Å; E638-F640 HydrophobicContact CB-CE2 3.68Å; E638-F640 HydrophobicContact CB-CZ 3.51Å; E638-F640 HydrophobicContact CG-CZ 4.47Å; E638-F640 WeakPolarHBondContact O-CD2 3.18Å; E638-F640 VanDerWaalsContact O-CE2 3.27Å; E638-F640 WeakPolarHBondContact O-CE2 3.28Å; E638-F640 WeakPolarHBondContact OE2-CZ 3.22Å; E638-N654 PolarHBondContact OE1-ND2 3.26Å; E638-T656 HydrophobicContact CB-CG2 4.44Å; E638-R663 IonicContact OE2-CZ 2.81Å; E638-R663 IonicContact OE2-NE 2.92Å; E638-R663 IonicContact OE2-NH1 3.91Å; E638-R663 PolarHBondContact OE2-NH1 3.49Å; E638-R663 IonicContact OE2-NH2 3.98Å
639	E	75.6	Confident	82.3	Confident	22 Å²	22	35.6 Å²	35.6	10%	0.103	18%	0.177	C	C	.	.			trans	-83.7	129.8	172.2	-76.4	179.3	-174.8	0	0	111.7	L580 F634 N654 S655	L580-E639 HydrophobicContact CD1-CB 3.92Å; L580-E639 VanDerWaalsContact CD1-CD 3.42Å; L580-E639 HydrophobicContact CD1-CG 3.79Å; L580-E639 VanDerWaalsContact CD1-OE2 3.27Å; L580-E639 WeakPolarHBondContact CD1-OE2 3.43Å; L580-E639 HydrophobicContact CD2-CG 3.99Å; L580-E639 WeakPolarHBondContact CD2-OE1 3.37Å; L580-E639 HydrophobicContact CG-CG 4.06Å; L580-E639 VanDerWaalsContact CG-OE1 3.24Å; L580-E639 WeakPolarHBondContact CG-OE1 3.47Å; L580-E639 WeakPolarHBondContact CG-OE2 3.38Å; F634-E639 HydrophobicContact CD1-CG 3.99Å; F634-E639 HydrophobicContact CE1-CG 3.17Å; F634-E639 WeakPolarHBondContact CE1-OE1 3.42Å; F634-E639 HydrophobicContact CZ-CG 3.65Å; F634-E639 WeakPolarHBondContact CZ-OE1 3.17Å; E639-N654 PolarHBondContact O-OD1 3.42Å; E639-S655 PolarHBondContact O-N 2.88Å
640	F	83.4	Confident	82.4	Confident	9 Å²	9	35.5 Å²	35.5	4%	0.039	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.4	174.5	-63.9	-73.9	0	0	0	111.5	Y632 N636 E638 L652 F653 N654 R663	Y632-F640 WeakPolarHBondContact CB-O 3.42Å; Y632-F640 HydrophobicContact CD1-CB 4.16Å; Y632-F640 HydrophobicContact CD1-CD2 4.37Å; Y632-F640 HydrophobicContact CG-CB 4.15Å; Y632-F640 PolarHBondContact N-O 3.46Å; N636-F640 HydrophobicContact CB-CE2 4.4Å; E638-F640 HydrophobicContact CB-CE2 3.68Å; E638-F640 HydrophobicContact CB-CZ 3.51Å; E638-F640 HydrophobicContact CG-CZ 4.47Å; E638-F640 WeakPolarHBondContact O-CD2 3.18Å; E638-F640 VanDerWaalsContact O-CE2 3.27Å; E638-F640 WeakPolarHBondContact O-CE2 3.28Å; E638-F640 WeakPolarHBondContact OE2-CZ 3.22Å; F640-L652 HydrophobicContact CB-CB 4.47Å; F640-L652 HydrophobicContact CB-CD2 4.02Å; F640-L652 HydrophobicContact CD1-CB 4.28Å; F640-F653 CarbonylContact C-O 3.47Å; F640-F653 VanDerWaalsContact CA-O 3.27Å; F640-F653 WeakPolarHBondContact CA-O 3.47Å; F640-N654 HydrophobicContact CD1-CB 4.33Å; F640-N654 HydrophobicContact CE1-CB 3.74Å; F640-R663 HydrophobicContact CD1-CB 4.39Å; F640-R663 HydrophobicContact CE1-CB 3.96Å; F640-R663 HydrophobicContact CE1-CG 4.16Å
641	L	85.7	Confident	82.3	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.4	161.9	-172.2	81.3	0	0	0	108.4	L575 L588 M629 T630 W631 V643 F653	L575-L641 HydrophobicContact CD2-CD1 3.82Å; L588-L641 HydrophobicContact CD1-CD1 4.43Å; L588-L641 HydrophobicContact CD1-CD2 4.28Å; M629-L641 HydrophobicContact CB-CD1 4.48Å; M629-L641 HydrophobicContact CB-CD2 4.38Å; T630-L641 WeakPolarHBondContact O-CD1 3.34Å; W631-L641 HydrophobicContact CD2-CD1 3.92Å; W631-L641 HydrophobicContact CE3-CB 4.42Å; W631-L641 HydrophobicContact CE3-CD1 3.9Å; W631-L641 HydrophobicContact CH2-CD1 4.12Å; W631-L641 HydrophobicContact CZ2-CD1 4.12Å; W631-L641 HydrophobicContact CZ3-CB 4.18Å; W631-L641 HydrophobicContact CZ3-CD1 4.02Å; L641-V643 HydrophobicContact CD2-CG2 4.08Å; L641-V643 HydrophobicContact CG-CG2 4.44Å; L641-F653 HydrophobicContact CB-CB 4.47Å; L641-F653 PolarHBondContact N-O 2.89Å; L641-F653 PolarHBondContact O-N 2.9Å
642	L	88.5	Confident	82.3	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	128.4	175.8	177.4	58.3	0	0	0	109.2	M629 T630 Y632 M650 K651 L652 L694	M629-L642 CarbonylContact C-O 3.5Å; M629-L642 VanDerWaalsContact CA-O 3.24Å; M629-L642 WeakPolarHBondContact CA-O 3.3Å; T630-L642 HydrophobicContact CG2-CB 3.91Å; T630-L642 HydrophobicContact CG2-CD2 3.94Å; T630-L642 HydrophobicContact CG2-CG 4.27Å; T630-L642 PolarHBondContact N-O 2.84Å; T630-L642 PolarHBondContact O-N 3.02Å; Y632-L642 HydrophobicContact CD2-CB 4.5Å; Y632-L642 HydrophobicContact CD2-CD2 4.33Å; L642-M650 HydrophobicContact CD1-CB 3.91Å; L642-M650 HydrophobicContact CD1-CE 3.96Å; L642-M650 HydrophobicContact CD2-CE 3.67Å; L642-M650 HydrophobicContact CG-CE 4.03Å; L642-K651 WeakPolarHBondContact CA-O 3.46Å; L642-L652 HydrophobicContact CB-CD2 4.03Å; L642-L652 HydrophobicContact CD1-CD2 3.81Å; L642-L652 HydrophobicContact CD1-CG 4.35Å; L642-L652 HydrophobicContact CG-CD2 4.46Å; L642-L694 HydrophobicContact CD2-CD1 3.63Å
643	V	88.4	Confident	82.2	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.3	176.8	179.5	0	0	0	0	109	P626 C628 M629 L641 M650 K651 F653	P626-V643 HydrophobicContact CB-CG1 3.73Å; C628-V643 WeakPolarHBondContact O-CA 3.42Å; M629-V643 HydrophobicContact CB-CG2 4.24Å; L641-V643 HydrophobicContact CD2-CG2 4.08Å; L641-V643 HydrophobicContact CG-CG2 4.44Å; V643-M650 WeakPolarHBondContact O-CA 3.38Å; V643-K651 PolarHBondContact N-O 3.22Å; V643-K651 PolarHBondContact O-N 3.28Å; V643-F653 HydrophobicContact CB-CD2 4.25Å; V643-F653 HydrophobicContact CB-CE2 3.97Å; V643-F653 HydrophobicContact CG2-CD2 3.78Å; V643-F653 HydrophobicContact CG2-CE2 3.92Å
644	S	90	Very high	81.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.007	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	149.2	170.9	74.7	0	0	0	0	111.3	P626 R627 C628 K649 I675	P626-S644 CarbonylContact C-O 3.54Å; P626-S644 WeakPolarHBondContact CA-O 3.44Å; R627-S644 PolarHBondContact N-O 2.79Å; C628-S644 PolarHBondContact N-OG 3.34Å; C628-S644 PolarHBondContact O-N 2.77Å; C628-S644 PolarHBondContact SG-OG 3.48Å; S644-K649 CarbonylContact C-O 3.58Å; S644-K649 WeakPolarHBondContact CA-O 3.31Å; S644-I675 PolarHBondContact OG-O 3.29Å; S644-I675 VanDerWaalsContact OG-O 3.13Å
645	S	87.9	Confident	81.6	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.014	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	168.3	177.4	75	0	0	0	0	113.6	V625 N647 Y648 K649	V625-S645 CarbonylContact O-C 3.59Å; V625-S645 WeakPolarHBondContact O-CA 3.46Å; S645-N647 PolarHBondContact O-N 3.24Å; S645-N647 PolarHBondContact OG-N 3.5Å; S645-Y648 PolarHBondContact O-N 3.23Å; S645-K649 PolarHBondContact N-O 2.79Å; S645-K649 WeakPolarHBondContact OG-CB 3.4Å; S645-K649 PolarHBondContact OG-N 3.46Å
646	D	86.6	Confident	81.3	Confident	21 Å²	21	25.6 Å²	25.6	11%	0.112	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.6	173.5	62	-12.4	0	0	0	113.7	R594 A624 V625 Y648 P674	R594-D646 IonicContact CZ-OD2 3.41Å; R594-D646 IonicContact NH2-OD2 3.38Å; R594-D646 PolarHBondContact NH2-OD2 3.44Å; A624-D646 WeakPolarHBondContact CA-OD1 3.36Å; A624-D646 WeakPolarHBondContact CB-OD1 3.28Å; V625-D646 HydrophobicContact CB-CB 4.28Å; V625-D646 WeakPolarHBondContact CB-OD2 3.47Å; V625-D646 WeakPolarHBondContact CG2-OD2 3.04Å; V625-D646 PolarHBondContact N-OD1 3.49Å; V625-D646 PolarHBondContact O-N 3.16Å; D646-Y648 PolarHBondContact O-N 2.89Å; D646-P674 HydrophobicContact CB-CG 4.48Å; D646-P674 WeakPolarHBondContact O-CG 3.47Å
647	N	85.8	Confident	81	Confident	66 Å²	66	24.6 Å²	24.6	35%	0.353	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	22.3	176.9	-69.6	-7.6	0	0	0	113.5	A624 S645 K649	A624-N647 HydrophobicContact CB-CB 4.2Å; S645-N647 PolarHBondContact O-N 3.24Å; S645-N647 PolarHBondContact OG-N 3.5Å; N647-K649 HydrophobicContact CB-CG 4.39Å; N647-K649 PolarHBondContact O-N 3.21Å
648	Y	88.8	Confident	80.1	Confident	35 Å²	35	24.4 Å²	24.4	14%	0.137	13%	0.134	C	C	.	.	S	Bend	trans	56.3	31.8	-176.4	-54.6	-95	0	0	0	113	S645 D646 G668 T670 G672 S673 P674 A872 F873	S645-Y648 PolarHBondContact O-N 3.23Å; D646-Y648 PolarHBondContact O-N 2.89Å; Y648-G668 WeakPolarHBondContact O-CA 3.49Å; Y648-G668 PolarHBondContact O-N 3.43Å; Y648-T670 HydrophobicContact CD1-CG2 4.47Å; Y648-T670 HydrophobicContact CG-CG2 4.39Å; Y648-G672 PolarHBondContact OH-O 3.2Å; Y648-S673 WeakPolarHBondContact OH-CA 3.48Å; Y648-P674 HydrophobicContact CD2-CG 4.46Å; Y648-P674 HydrophobicContact CE1-CB 4.39Å; Y648-P674 HydrophobicContact CE1-CG 4.1Å; Y648-P674 HydrophobicContact CE2-CG 3.94Å; Y648-P674 WeakPolarHBondContact OH-CD 3.18Å; Y648-A872 HydrophobicContact CD2-CB 4.26Å; Y648-F873 AromaticContact CD2-CD2 3.94Å; Y648-F873 HydrophobicContact CD2-CD2 3.94Å; Y648-F873 AromaticContact CD2-CE2 3.74Å; Y648-F873 HydrophobicContact CD2-CE2 3.74Å; Y648-F873 HydrophobicContact CE1-CE2 4.42Å; Y648-F873 AromaticContact CE2-CD2 3.67Å; Y648-F873 HydrophobicContact CE2-CD2 3.67Å; Y648-F873 AromaticContact CE2-CE2 3.4Å; Y648-F873 HydrophobicContact CE2-CE2 3.4Å; Y648-F873 VanDerWaalsContact CE2-CE2 3.4Å; Y648-F873 HydrophobicContact CG-CE2 4.4Å; Y648-F873 AromaticContact CZ-CE2 3.78Å
649	K	89	Confident	79.1	Confident	15 Å²	15	27.5 Å²	27.5	7%	0.065	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	149.9	176.3	-57.3	-58.8	-176.7	177.5	0	111.2	S644 S645 N647 T665 L666 L667 N868 R870	S644-K649 CarbonylContact C-O 3.58Å; S644-K649 WeakPolarHBondContact CA-O 3.31Å; S645-K649 PolarHBondContact N-O 2.79Å; S645-K649 WeakPolarHBondContact OG-CB 3.4Å; S645-K649 PolarHBondContact OG-N 3.46Å; N647-K649 HydrophobicContact CB-CG 4.39Å; N647-K649 PolarHBondContact O-N 3.21Å; K649-T665 HydrophobicContact CB-CG2 4.49Å; K649-L666 WeakPolarHBondContact CA-O 3.5Å; K649-L667 HydrophobicContact CD-CD1 4.33Å; K649-N868 WeakPolarHBondContact CE-O 3.15Å; K649-N868 PolarHBondContact NZ-O 3.44Å; K649-R870 VanDerWaalsContact CE-O 3.24Å; K649-R870 WeakPolarHBondContact CE-O 3.34Å; K649-R870 PolarHBondContact NZ-O 3Å
650	M	89.3	Confident	78	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.8	173.3	-62.6	-176.7	83.4	0	0	108.2	L642 V643 L666 I675 I678 M709	L642-M650 HydrophobicContact CD1-CB 3.91Å; L642-M650 HydrophobicContact CD1-CE 3.96Å; L642-M650 HydrophobicContact CD2-CE 3.67Å; L642-M650 HydrophobicContact CG-CE 4.03Å; V643-M650 WeakPolarHBondContact O-CA 3.38Å; M650-L666 PolarHBondContact N-O 3.4Å; M650-L666 PolarHBondContact O-N 2.92Å; M650-I675 HydrophobicContact SD-CD1 4.19Å; M650-I678 HydrophobicContact CE-CD1 3.58Å; M650-M709 HydrophobicContact CE-CE 4.44Å; M650-M709 HydrophobicContact SD-CE 3.59Å; M650-M709 VanDerWaalsContact SD-CE 3.59Å
651	K	87.1	Confident	77	Confident	8 Å²	8	33 Å²	33	4%	0.035	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.9	-178.2	-69.4	-170.7	179.1	-179.9	0	111.2	E621 L642 V643 F653 K664 T665 D837	E621-K651 WeakPolarHBondContact OE1-CD 3.25Å; E621-K651 WeakPolarHBondContact OE1-CE 3.22Å; E621-K651 IonicContact OE1-NZ 3.42Å; E621-K651 PolarHBondContact OE1-NZ 3.36Å; E621-K651 IonicContact OE2-NZ 3.76Å; E621-K651 PolarHBondContact OE2-NZ 3.18Å; L642-K651 WeakPolarHBondContact CA-O 3.46Å; V643-K651 PolarHBondContact N-O 3.22Å; V643-K651 PolarHBondContact O-N 3.28Å; K651-F653 HydrophobicContact CB-CD2 4.3Å; K651-F653 HydrophobicContact CB-CE2 3.43Å; K651-F653 VanDerWaalsContact CB-CE2 3.43Å; K651-F653 HydrophobicContact CB-CZ 3.73Å; K651-F653 HydrophobicContact CD-CE2 4.42Å; K651-F653 HydrophobicContact CD-CZ 3.93Å; K651-F653 HydrophobicContact CG-CZ 4.48Å; K651-K664 WeakPolarHBondContact CA-O 3.36Å; K651-T665 HydrophobicContact CD-CG2 4.5Å; K651-T665 WeakPolarHBondContact CE-OG1 3.42Å; K651-T665 HydrophobicContact CG-CG2 4.07Å; K651-D837 IonicContact NZ-OD2 2.68Å
652	L	87	Confident	75.7	Confident	11 Å²	11	33.3 Å²	33.3	6%	0.058	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	114.8	177.4	-70.5	171.2	0	0	0	110.1	Y632 F640 L642 N662 R663 K664 L666	Y632-L652 HydrophobicContact CD1-CD2 4.4Å; Y632-L652 HydrophobicContact CD2-CD2 3.53Å; Y632-L652 HydrophobicContact CE2-CD2 3.92Å; Y632-L652 HydrophobicContact CG-CD2 3.8Å; F640-L652 HydrophobicContact CB-CB 4.47Å; F640-L652 HydrophobicContact CB-CD2 4.02Å; F640-L652 HydrophobicContact CD1-CB 4.28Å; L642-L652 HydrophobicContact CB-CD2 4.03Å; L642-L652 HydrophobicContact CD1-CD2 3.81Å; L642-L652 HydrophobicContact CD1-CG 4.35Å; L642-L652 HydrophobicContact CG-CD2 4.46Å; L652-N662 PolarHBondContact O-OD1 2.94Å; L652-R663 WeakPolarHBondContact O-CB 3.35Å; L652-R663 PolarHBondContact O-N 3.44Å; L652-K664 HydrophobicContact CD1-CB 4.41Å; L652-K664 PolarHBondContact N-O 3.08Å; L652-L666 HydrophobicContact CD1-CD1 4.43Å
653	F	81.8	Confident	74.9	Confident	8 Å²	8	35 Å²	35	4%	0.035	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	131.1	179.5	-66	-81.5	0	0	0	111.2	I620 F640 L641 V643 K651 S655 C660 R661 N662	I620-F653 HydrophobicContact CB-CZ 4.43Å; I620-F653 HydrophobicContact CG2-CD1 4.45Å; I620-F653 HydrophobicContact CG2-CD2 4.23Å; I620-F653 HydrophobicContact CG2-CE1 3.65Å; I620-F653 HydrophobicContact CG2-CE2 3.38Å; I620-F653 HydrophobicContact CG2-CZ 3.06Å; F640-F653 CarbonylContact C-O 3.47Å; F640-F653 VanDerWaalsContact CA-O 3.27Å; F640-F653 WeakPolarHBondContact CA-O 3.47Å; L641-F653 HydrophobicContact CB-CB 4.47Å; L641-F653 PolarHBondContact N-O 2.89Å; L641-F653 PolarHBondContact O-N 2.9Å; V643-F653 HydrophobicContact CB-CD2 4.25Å; V643-F653 HydrophobicContact CB-CE2 3.97Å; V643-F653 HydrophobicContact CG2-CD2 3.78Å; V643-F653 HydrophobicContact CG2-CE2 3.92Å; K651-F653 HydrophobicContact CB-CD2 4.3Å; K651-F653 HydrophobicContact CB-CE2 3.43Å; K651-F653 VanDerWaalsContact CB-CE2 3.43Å; K651-F653 HydrophobicContact CB-CZ 3.73Å; K651-F653 HydrophobicContact CD-CE2 4.42Å; K651-F653 HydrophobicContact CD-CZ 3.93Å; K651-F653 HydrophobicContact CG-CZ 4.48Å; F653-S655 PolarHBondContact O-N 3.07Å; F653-C660 VanDerWaalsContact CD1-O 3.27Å; F653-C660 WeakPolarHBondContact CD1-O 3.49Å; F653-R661 WeakPolarHBondContact CA-O 3.33Å; F653-N662 HydrophobicContact CD1-CB 4.08Å; F653-N662 HydrophobicContact CE1-CB 3.61Å; F653-N662 HydrophobicContact CZ-CB 4.29Å
654	N	77.6	Confident	74.5	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.07	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	114.6	176.2	-168.2	-17.7	0	0	0	110.3	E638 E639 F640 T656 C660 R661	E638-N654 PolarHBondContact OE1-ND2 3.26Å; E639-N654 PolarHBondContact O-OD1 3.42Å; F640-N654 HydrophobicContact CD1-CB 4.33Å; F640-N654 HydrophobicContact CE1-CB 3.74Å; N654-T656 VanDerWaalsContact CG-OG1 3.26Å; N654-T656 PolarHBondContact ND2-OG1 2.95Å; N654-T656 WeakPolarHBondContact OD1-CB 3.44Å; N654-T656 WeakPolarHBondContact OD1-CG2 3.46Å; N654-T656 PolarHBondContact OD1-N 3.24Å; N654-T656 PolarHBondContact OD1-OG1 3.34Å; N654-C660 WeakPolarHBondContact O-CA 3.28Å; N654-R661 PolarHBondContact N-O 2.84Å
655	S	67.3	Low	74.3	Confident	17 Å²	17	38.8 Å²	38.8	12%	0.119	20%	0.196	C	C	.	.	S	Bend	trans	-77.4	-21.9	-179.8	-173.4	0	0	0	0	113	R586 W631 E639 F653 T657	R586-S655 PolarHBondContact NH1-OG 3.1Å; R586-S655 VanDerWaalsContact NH1-OG 3.12Å; W631-S655 WeakPolarHBondContact CH2-OG 3.44Å; W631-S655 WeakPolarHBondContact CZ3-OG 3.19Å; E639-S655 PolarHBondContact O-N 2.88Å; F653-S655 PolarHBondContact O-N 3.07Å; S655-T657 VanDerWaalsContact C-N 3.27Å; S655-T657 PolarHBondContact O-N 3.27Å
656	T	64.4	Low	74.3	Confident	58 Å²	58	39 Å²	39	36%	0.356	20%	0.196	S	C	.	.	S	Bend	trans	-66.8	-30.6	-176.5	65.5	0	0	0	0	112.3	L580 E638 N654	L580-T656 HydrophobicContact CD1-CG2 3.33Å; E638-T656 HydrophobicContact CB-CG2 4.44Å; N654-T656 VanDerWaalsContact CG-OG1 3.26Å; N654-T656 PolarHBondContact ND2-OG1 2.95Å; N654-T656 WeakPolarHBondContact OD1-CB 3.44Å; N654-T656 WeakPolarHBondContact OD1-CG2 3.46Å; N654-T656 PolarHBondContact OD1-N 3.24Å; N654-T656 PolarHBondContact OD1-OG1 3.34Å
657	T	59.1	Low	74.3	Confident	46 Å²	46	39 Å²	39	28%	0.282	20%	0.196	S	C	.	.	S	Bend	trans	-93.8	136.2	179.8	67	0	0	0	0	110	S655 M659 C660	S655-T657 VanDerWaalsContact C-N 3.27Å; S655-T657 PolarHBondContact O-N 3.27Å; T657-M659 PolarHBondContact O-N 3.08Å; T657-C660 PolarHBondContact O-N 2.77Å
658	T	48	Very low	74.3	Confident	117 Å²	117	36.1 Å²	36.1	72%	0.718	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-11	174.9	52.4	0	0	0	0	113.5	K618	K618-T658 WeakPolarHBondContact CD-O 3.04Å; K618-T658 WeakPolarHBondContact CE-O 3.47Å; K618-T658 PolarHBondContact NZ-O 3.05Å
659	M	49.8	Very low	74.1	Confident	119 Å²	119	34.8 Å²	34.8	59%	0.586	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-2.6	179.3	-66.8	-65.2	177.9	0	0	114.1	T657 R661	T657-M659 PolarHBondContact O-N 3.08Å; M659-R661 HydrophobicContact CB-CG 3.75Å; M659-R661 PolarHBondContact O-N 2.8Å; M659-R661 VanDerWaalsContact O-N 3.16Å
660	C	53.6	Low	74	Confident	16 Å²	16	37.3 Å²	37.3	11%	0.108	20%	0.195	C	C	.	.			trans	38.7	55.9	-176.8	-65.6	0	0	0	0	111.6	K618 F653 N654 T657	K618-C660 HydrophobicContact CD-CB 4.31Å; K618-C660 PolarHBondContact NZ-SG 2.86Å; F653-C660 VanDerWaalsContact CD1-O 3.27Å; F653-C660 WeakPolarHBondContact CD1-O 3.49Å; N654-C660 WeakPolarHBondContact O-CA 3.28Å; T657-C660 PolarHBondContact O-N 2.77Å
661	R	62.2	Low	73.7	Confident	132 Å²	132	40.7 Å²	40.7	50%	0.498	21%	0.208	S	C	.	.			trans	-73.4	136.3	-171.5	-67.7	-178.6	178	162.1	-1	110.5	F653 N654 M659 R663	F653-R661 WeakPolarHBondContact CA-O 3.33Å; N654-R661 PolarHBondContact N-O 2.84Å; M659-R661 HydrophobicContact CB-CG 3.75Å; M659-R661 PolarHBondContact O-N 2.8Å; M659-R661 VanDerWaalsContact O-N 3.16Å; R661-R663 PolarHBondContact O-N 3.06Å
662	N	56.8	Low	73.5	Confident	9 Å²	9	42.8 Å²	42.8	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125.5	169	-171.5	7.4	0	0	0	108.4	L652 F653 K664 T665 D837	L652-N662 PolarHBondContact O-OD1 2.94Å; F653-N662 HydrophobicContact CD1-CB 4.08Å; F653-N662 HydrophobicContact CE1-CB 3.61Å; F653-N662 HydrophobicContact CZ-CB 4.29Å; N662-K664 PolarHBondContact OD1-N 2.92Å; N662-K664 PolarHBondContact OD1-O 3.38Å; N662-K664 VanDerWaalsContact OD1-O 3.13Å; N662-T665 PolarHBondContact ND2-OG1 3.3Å; N662-D837 WeakPolarHBondContact CB-OD1 3.24Å; N662-D837 VanDerWaalsContact ND2-CG 3.3Å; N662-D837 PolarHBondContact ND2-OD2 2.92Å
663	R	71.8	Confident	73.6	Confident	38 Å²	38	43.1 Å²	43.1	14%	0.143	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-34.9	178	-170.5	177.4	-178.9	175.9	13.4	111.5	N636 E638 F640 L652 R661 E841	N636-R663 PolarHBondContact ND2-NH1 3.02Å; E638-R663 IonicContact OE2-CZ 2.81Å; E638-R663 IonicContact OE2-NE 2.92Å; E638-R663 IonicContact OE2-NH1 3.91Å; E638-R663 PolarHBondContact OE2-NH1 3.49Å; E638-R663 IonicContact OE2-NH2 3.98Å; F640-R663 HydrophobicContact CD1-CB 4.39Å; F640-R663 HydrophobicContact CE1-CB 3.96Å; F640-R663 HydrophobicContact CE1-CG 4.16Å; L652-R663 WeakPolarHBondContact O-CB 3.35Å; L652-R663 PolarHBondContact O-N 3.44Å; R661-R663 PolarHBondContact O-N 3.06Å; R663-E841 WeakPolarHBondContact O-CA 3.33Å
664	K	80.9	Confident	74	Confident	78 Å²	78	43.5 Å²	43.5	34%	0.339	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	133.3	-177.8	-70.2	-165.9	173.1	-171.7	0	110.3	K651 L652 N662 L666 E841	K651-K664 WeakPolarHBondContact CA-O 3.36Å; L652-K664 HydrophobicContact CD1-CB 4.41Å; L652-K664 PolarHBondContact N-O 3.08Å; N662-K664 PolarHBondContact OD1-N 2.92Å; N662-K664 PolarHBondContact OD1-O 3.38Å; N662-K664 VanDerWaalsContact OD1-O 3.13Å; K664-L666 HydrophobicContact CB-CG 4.36Å; K664-E841 HydrophobicContact CG-CG 4.23Å
665	T	85.4	Confident	74.7	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.7	164.7	-58.2	0	0	0	0	108.1	K649 K651 N662 E841 N868 H869	K649-T665 HydrophobicContact CB-CG2 4.49Å; K651-T665 HydrophobicContact CD-CG2 4.5Å; K651-T665 WeakPolarHBondContact CE-OG1 3.42Å; K651-T665 HydrophobicContact CG-CG2 4.07Å; N662-T665 PolarHBondContact ND2-OG1 3.3Å; T665-E841 PolarHBondContact N-OE2 2.93Å; T665-N868 WeakPolarHBondContact O-CB 2.94Å; T665-H869 VanDerWaalsContact CB-CE1 3.44Å; T665-H869 WeakPolarHBondContact CB-CE1 3.33Å
666	L	88.1	Confident	75.7	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.6	-177.1	-60.1	170.4	0	0	0	110.1	K649 M650 L652 K664 G668 M709	K649-L666 WeakPolarHBondContact CA-O 3.5Å; M650-L666 PolarHBondContact N-O 3.4Å; M650-L666 PolarHBondContact O-N 2.92Å; L652-L666 HydrophobicContact CD1-CD1 4.43Å; K664-L666 HydrophobicContact CB-CG 4.36Å; L666-G668 PolarHBondContact O-N 3.38Å; L666-M709 HydrophobicContact CD1-CB 3.34Å; L666-M709 WeakPolarHBondContact CD1-O 3.27Å
667	L	86.9	Confident	77	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.11	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	121.3	168.2	-176.4	66	0	0	0	108.8	K649 T670 L775 I867 N868 A872	K649-L667 HydrophobicContact CD-CD1 4.33Å; L667-T670 HydrophobicContact CD1-CG2 4.21Å; L667-L775 HydrophobicContact CD2-CD1 4.33Å; L667-I867 HydrophobicContact CD2-CG2 4.26Å; L667-N868 PolarHBondContact N-OD1 3.38Å; L667-A872 HydrophobicContact CD1-CB 3.95Å
668	G	84.9	Confident	78.6	Confident	6 Å²	6	45.9 Å²	45.9	6%	0.062	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-84.7	170.6	173.4	0	0	0	0	0	111.9	Y648 L666 T670	Y648-G668 WeakPolarHBondContact O-CA 3.49Å; Y648-G668 PolarHBondContact O-N 3.43Å; L666-G668 PolarHBondContact O-N 3.38Å; G668-T670 PolarHBondContact O-N 2.72Å
669	P	86.3	Confident	80.7	Confident	7 Å²	7	42.2 Å²	42.2	5%	0.045	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-53.1	125.3	173.7	-23.8	28.8	0	0	0	112.9	Y671 I675 F696	P669-Y671 VanDerWaalsContact C-N 3.34Å; P669-Y671 HydrophobicContact CB-CD2 3.57Å; P669-Y671 HydrophobicContact CB-CE2 3.85Å; P669-Y671 PolarHBondContact O-N 3.04Å; P669-I675 HydrophobicContact CG-CD1 4.15Å; P669-F696 HydrophobicContact CB-CE1 4.18Å; P669-F696 HydrophobicContact CB-CE2 4.03Å; P669-F696 HydrophobicContact CB-CZ 3.55Å; P669-F696 HydrophobicContact CG-CD1 4.41Å; P669-F696 HydrophobicContact CG-CE1 3.68Å; P669-F696 HydrophobicContact CG-CE2 4.28Å; P669-F696 HydrophobicContact CG-CZ 3.6Å
670	T	85.3	Confident	82.6	Confident	68 Å²	68	38.3 Å²	38.3	42%	0.417	19%	0.194	S	C	.	.			trans	-96.3	44.2	-178.1	57.4	0	0	0	0	112.2	Y648 L667 G668 A872	Y648-T670 HydrophobicContact CD1-CG2 4.47Å; Y648-T670 HydrophobicContact CG-CG2 4.39Å; L667-T670 HydrophobicContact CD1-CG2 4.21Å; G668-T670 PolarHBondContact O-N 2.72Å; T670-A872 HydrophobicContact CG2-CB 4.07Å
671	Y	84.1	Confident	84.3	Confident	72 Å²	72	38.1 Å²	38.1	28%	0.282	19%	0.191	S	C	.	.	S	Bend	trans	-92.6	102.5	-176.7	-65.2	-66.6	0	0	0	112	P669 S673 F696 S716 A718	P669-Y671 VanDerWaalsContact C-N 3.34Å; P669-Y671 HydrophobicContact CB-CD2 3.57Å; P669-Y671 HydrophobicContact CB-CE2 3.85Å; P669-Y671 PolarHBondContact O-N 3.04Å; Y671-S673 PolarHBondContact O-N 3.31Å; Y671-F696 HydrophobicContact CD2-CE2 4.41Å; Y671-F696 HydrophobicContact CD2-CZ 4.01Å; Y671-F696 HydrophobicContact CE2-CZ 4.38Å; Y671-S716 WeakPolarHBondContact CE2-OG 3.45Å; Y671-S716 PolarHBondContact OH-O 2.96Å; Y671-S716 VanDerWaalsContact OH-O 3.08Å; Y671-S716 PolarHBondContact OH-OG 3Å; Y671-A718 HydrophobicContact CD1-CB 4.18Å; Y671-A718 HydrophobicContact CD2-CB 3.44Å; Y671-A718 VanDerWaalsContact CD2-CB 3.44Å; Y671-A718 HydrophobicContact CE2-CB 3.86Å; Y671-A718 HydrophobicContact CG-CB 3.62Å
672	G	83.3	Confident	85.3	Confident	53 Å²	53	34.2 Å²	34.2	55%	0.546	18%	0.183	S	C	.	.	S	Bend	trans	69.5	-90.8	174.2	0	0	0	0	0	112.1	Y648	Y648-G672 PolarHBondContact OH-O 3.2Å
673	S	88.7	Confident	86	Confident	18 Å²	18	40 Å²	40	13%	0.126	21%	0.208	C	C	.	.	S	Bend	trans	-119.1	165	-179	77.9	0	0	0	0	112.5	Y648 Y671 T698 D699	Y648-S673 WeakPolarHBondContact OH-CA 3.48Å; Y671-S673 PolarHBondContact O-N 3.31Å; S673-T698 WeakPolarHBondContact O-CB 3.29Å; S673-T698 WeakPolarHBondContact O-CG2 3.43Å; S673-D699 WeakPolarHBondContact CB-OD2 3.45Å; S673-D699 VanDerWaalsContact OG-CB 3.23Å; S673-D699 WeakPolarHBondContact OG-CB 3.38Å; S673-D699 PolarHBondContact OG-N 3.42Å; S673-D699 PolarHBondContact OG-OD2 2.97Å
674	P	89.4	Confident	85.5	Confident	15 Å²	15	39.3 Å²	39.3	10%	0.097	21%	0.211	C	C	.	.			trans	-63.4	154	-176.9	-21.8	33.7	0	0	0	112.8	D646 Y648 R676	D646-P674 HydrophobicContact CB-CG 4.48Å; D646-P674 WeakPolarHBondContact O-CG 3.47Å; Y648-P674 HydrophobicContact CD2-CG 4.46Å; Y648-P674 HydrophobicContact CE1-CB 4.39Å; Y648-P674 HydrophobicContact CE1-CG 4.1Å; Y648-P674 HydrophobicContact CE2-CG 3.94Å; Y648-P674 WeakPolarHBondContact OH-CD 3.18Å; P674-R676 PolarHBondContact O-N 3.3Å
675	I	92.4	Very high	84.1	Confident	6 Å²	6	43 Å²	43	3%	0.031	24%	0.239	C	C	.	.			trans	-64.9	123.8	-178	-63.4	171.5	0	0	0	110.6	R627 S644 M650 P669 I678 F696	R627-I675 VanDerWaalsContact CB-O 3.25Å; R627-I675 WeakPolarHBondContact CB-O 3.2Å; S644-I675 PolarHBondContact OG-O 3.29Å; S644-I675 VanDerWaalsContact OG-O 3.13Å; M650-I675 HydrophobicContact SD-CD1 4.19Å; P669-I675 HydrophobicContact CG-CD1 4.15Å; I675-I678 HydrophobicContact CG2-CD1 3.85Å; I675-I678 HydrophobicContact CG2-CG1 3.5Å; I675-I678 VanDerWaalsContact CG2-CG1 3.5Å; I675-F696 HydrophobicContact CD1-CB 4.38Å; I675-F696 HydrophobicContact CD1-CD2 4.01Å; I675-F696 HydrophobicContact CD1-CE2 4.48Å; I675-F696 HydrophobicContact CD1-CG 4.12Å; I675-F696 HydrophobicContact CG1-CD2 3.82Å; I675-F696 HydrophobicContact CG1-CE2 4.36Å; I675-F696 HydrophobicContact CG1-CG 4.32Å; I675-F696 HydrophobicContact CG2-CB 3.91Å
676	R	89.4	Confident	82.5	Confident	104 Å²	104	47.9 Å²	47.9	39%	0.392	27%	0.27	S	S	.	.			trans	-94.5	-35.2	-178.5	-179.2	175.4	166.1	177.8	-8.8	113.4	C628 P674 I697 V726	C628-R676 VanDerWaalsContact CB-O 3.3Å; C628-R676 WeakPolarHBondContact CB-O 3.46Å; P674-R676 PolarHBondContact O-N 3.3Å; R676-I697 PolarHBondContact N-O 3.13Å; R676-V726 PolarHBondContact NH1-O 3.18Å
677	K	90.2	Very high	80.8	Confident	67 Å²	67	50.1 Å²	50.1	29%	0.291	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	146.8	179.4	-172.4	-175.6	-178.6	-169.1	0	110.4	F696 I697 F729	K677-F696 WeakPolarHBondContact O-CA 3.26Å; K677-I697 HydrophobicContact CB-CD1 4.11Å; K677-I697 HydrophobicContact CB-CG1 3.85Å; K677-I697 PolarHBondContact N-O 3.32Å; K677-I697 PolarHBondContact O-N 2.85Å; K677-F729 HydrophobicContact CB-CD1 4.29Å; K677-F729 HydrophobicContact CB-CE1 3.75Å; K677-F729 HydrophobicContact CD-CD1 3.91Å; K677-F729 HydrophobicContact CD-CE1 3.8Å; K677-F729 HydrophobicContact CG-CD1 4.26Å; K677-F729 HydrophobicContact CG-CE1 3.66Å; K677-F729 PolarHBondContact NZ-O 3.49Å
678	I	92.9	Very high	79.2	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.041	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.5	-175.9	-70.2	170	0	0	0	109.8	C628 T630 M650 I675 L694 F696	C628-I678 VanDerWaalsContact SG-CD1 3.58Å; C628-I678 VanDerWaalsContact SG-CG1 3.57Å; T630-I678 HydrophobicContact CG2-CB 4.3Å; T630-I678 HydrophobicContact CG2-CG2 3.51Å; M650-I678 HydrophobicContact CE-CD1 3.58Å; I675-I678 HydrophobicContact CG2-CD1 3.85Å; I675-I678 HydrophobicContact CG2-CG1 3.5Å; I675-I678 VanDerWaalsContact CG2-CG1 3.5Å; I678-L694 HydrophobicContact CG1-CD2 4.38Å; I678-L694 HydrophobicContact CG2-CD1 3.4Å; I678-L694 VanDerWaalsContact CG2-CD1 3.4Å; I678-L694 HydrophobicContact CG2-CD2 3.66Å; I678-L694 HydrophobicContact CG2-CG 3.5Å; I678-L694 VanDerWaalsContact CG2-CG 3.5Å; I678-F696 HydrophobicContact CG1-CB 4.1Å
679	I	91.4	Very high	77.9	Confident	39 Å²	39	61 Å²	61	20%	0.2	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.7	171.5	-61.8	176.3	0	0	0	108.7	A695 F729 C731	I679-A695 PolarHBondContact N-O 3.32Å; I679-A695 PolarHBondContact O-N 2.89Å; I679-F729 HydrophobicContact CB-CE2 3.94Å; I679-F729 HydrophobicContact CB-CZ 3.83Å; I679-F729 HydrophobicContact CD1-CD1 4.45Å; I679-F729 HydrophobicContact CD1-CD2 4.12Å; I679-F729 HydrophobicContact CD1-CE1 4.09Å; I679-F729 HydrophobicContact CD1-CE2 3.72Å; I679-F729 HydrophobicContact CD1-CG 4.49Å; I679-F729 HydrophobicContact CD1-CZ 3.73Å; I679-F729 HydrophobicContact CG1-CE1 4.1Å; I679-F729 HydrophobicContact CG1-CE2 3.9Å; I679-F729 HydrophobicContact CG1-CZ 3.54Å; I679-C731 HydrophobicContact CG2-CB 4.13Å
680	V	90.8	Very high	76.6	Confident	38 Å²	38	70.1 Å²	70.1	23%	0.23	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	129.9	171.1	176.9	0	0	0	0	108.9	T630 P633	T630-V680 HydrophobicContact CG2-CG2 4.43Å; P633-V680 HydrophobicContact CG-CG1 3.76Å; P633-V680 HydrophobicContact CG-CG2 4.32Å
681	L	88.7	Confident	75.9	Confident	11 Å²	11	68.2 Å²	68.2	6%	0.058	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-70	131.5	178.4	-69.1	177.9	0	0	0	110.6	H693 A695 L704 C731 V738 V753 L755	L681-H693 HydrophobicContact CB-CB 4.49Å; L681-H693 WeakPolarHBondContact CB-O 3.41Å; L681-H693 HydrophobicContact CD1-CB 3.83Å; L681-H693 PolarHBondContact N-O 2.69Å; L681-A695 HydrophobicContact CD2-CB 4.17Å; L681-A695 HydrophobicContact CG-CB 4.41Å; L681-L704 HydrophobicContact CD1-CD2 3.92Å; L681-C731 HydrophobicContact CD2-CB 4Å; L681-V738 HydrophobicContact CD2-CG2 4.19Å; L681-V753 HydrophobicContact CD1-CG1 4.14Å; L681-L755 HydrophobicContact CD1-CD2 4.34Å
682	P	83.7	Confident	75.9	Confident	51 Å²	51	66.3 Å²	66.3	33%	0.331	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-65.1	144.2	173.2	26.4	-30.7	0	0	0	109.7	A684 S732 Y733	P682-A684 PolarHBondContact O-N 3.44Å; P682-A684 VanDerWaalsContact O-N 3.16Å; P682-S732 WeakPolarHBondContact CG-O 3.45Å; P682-Y733 WeakPolarHBondContact CB-O 3.16Å; P682-Y733 VanDerWaalsContact CG-O 3.23Å; P682-Y733 WeakPolarHBondContact CG-O 3.38Å
683	K	70.8	Confident	76.2	Confident	130 Å²	130	64.1 Å²	64.1	57%	0.565	33%	0.332	S	S	*	.			trans	-69.4	114	178.4	-84.3	-178	166.8	165.3	0	109.5	T685 H692	K683-T685 PolarHBondContact O-N 3.2Å; K683-H692 WeakPolarHBondContact CE-CE1 3.4Å; K683-H692 WeakPolarHBondContact CE-NE2 3.25Å; K683-H692 PolarHBondContact NZ-CE1 3.41Å; K683-H692 VanDerWaalsContact NZ-CE1 3.28Å; K683-H692 PolarHBondContact NZ-NE2 2.92Å
684	A	62.3	Low	76.3	Confident	24 Å²	24	63.3 Å²	63.3	20%	0.198	33%	0.326	C	S	.	.			trans	-60.1	131.6	163.7	0	0	0	0	0	108.7	P682 T686 S687 D734	P682-A684 PolarHBondContact O-N 3.44Å; P682-A684 VanDerWaalsContact O-N 3.16Å; A684-T686 PolarHBondContact O-N 3.04Å; A684-S687 PolarHBondContact O-N 3.5Å; A684-D734 VanDerWaalsContact CB-O 3.25Å; A684-D734 WeakPolarHBondContact CB-O 2.98Å
685	T	51.9	Low	76.6	Confident	154 Å²	154	62.6 Å²	62.6	95%	0.945	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-13.9	178.5	-10.9	0	0	0	0	113.5	K683	K683-T685 PolarHBondContact O-N 3.2Å
686	T	50.8	Low	76.6	Confident	109 Å²	109	62.3 Å²	62.3	67%	0.669	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-2.9	-172	55.3	0	0	0	0	114.9	A684 K688	A684-T686 PolarHBondContact O-N 3.04Å; T686-K688 PolarHBondContact O-N 2.71Å
687	S	52.5	Low	76.9	Confident	51 Å²	51	57.4 Å²	57.4	36%	0.357	30%	0.301	S	S	.	.			trans	-75.4	126.5	179.2	131.4	0	0	0	0	110.6	A684 T689	A684-S687 PolarHBondContact O-N 3.5Å; S687-T689 VanDerWaalsContact C-N 3.25Å; S687-T689 PolarHBondContact OG-N 3.35Å; S687-T689 PolarHBondContact OG-O 2.7Å; S687-T689 PolarHBondContact OG-OG1 3.18Å
688	K	53.3	Low	76.9	Confident	212 Å²	212	54.2 Å²	54.2	92%	0.922	29%	0.288	S	S	*	.			trans	-78.8	-11	176.1	-67.1	-178.8	-176.5	175.9	0	112.4	T686	T686-K688 PolarHBondContact O-N 2.71Å
689	T	56.8	Low	76.8	Confident	45 Å²	45	56.9 Å²	56.9	28%	0.276	30%	0.302	S	S	.	.			trans	-91.3	135.6	-173.8	53.5	0	0	0	0	110.5	S687 S691	S687-T689 VanDerWaalsContact C-N 3.25Å; S687-T689 PolarHBondContact OG-N 3.35Å; S687-T689 PolarHBondContact OG-O 2.7Å; S687-T689 PolarHBondContact OG-OG1 3.18Å; T689-S691 WeakPolarHBondContact CB-OG 3.4Å; T689-S691 PolarHBondContact O-N 3.05Å
690	K	60.6	Low	76.8	Confident	198 Å²	198	57.1 Å²	57.1	86%	0.861	30%	0.304	S	S	*	.			trans	-77.2	-7.8	174.6	-69.5	-178.1	179.7	178.4	0	112.5
691	S	70.3	Confident	76.9	Confident	28 Å²	28	57 Å²	57	20%	0.196	30%	0.301	C	S	.	.			trans	-71.1	130.7	-179.2	42.2	0	0	0	0	111	T689 H693	T689-S691 WeakPolarHBondContact CB-OG 3.4Å; T689-S691 PolarHBondContact O-N 3.05Å; S691-H693 PolarHBondContact O-ND1 3.13Å; S691-H693 PolarHBondContact OG-CE1 2.87Å; S691-H693 VanDerWaalsContact OG-CE1 3.3Å
692	H	84.3	Confident	77.1	Confident	31 Å²	31	56.4 Å²	56.4	14%	0.144	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	153.5	165.6	-69.7	-106.2	0	0	0	109	P633 F635 K683 L707	P633-H692 HydrophobicContact CG-CB 4.23Å; F635-H692 AromaticContact CE1-CD2 3.53Å; F635-H692 HydrophobicContact CZ-CB 3.83Å; F635-H692 AromaticContact CZ-CD2 3.5Å; F635-H692 VanDerWaalsContact CZ-CD2 3.5Å; F635-H692 WeakPolarHBondContact CZ-CD2 3.27Å; F635-H692 AromaticContact CZ-CG 3.9Å; K683-H692 WeakPolarHBondContact CE-CE1 3.4Å; K683-H692 WeakPolarHBondContact CE-NE2 3.25Å; K683-H692 PolarHBondContact NZ-CE1 3.41Å; K683-H692 VanDerWaalsContact NZ-CE1 3.28Å; K683-H692 PolarHBondContact NZ-NE2 2.92Å; H692-L707 HydrophobicContact CB-CB 4.08Å; H692-L707 HydrophobicContact CB-CD1 3.86Å; H692-L707 HydrophobicContact CB-CG 4.43Å; H692-L707 WeakPolarHBondContact O-CB 3.38Å; H692-L707 PolarHBondContact O-N 2.97Å
693	H	89.5	Confident	77.6	Confident	7 Å²	7	54 Å²	54	3%	0.032	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.7	-179.1	-62.6	84.4	0	0	0	109.5	L681 S691 Q705 L755 D759	L681-H693 HydrophobicContact CB-CB 4.49Å; L681-H693 WeakPolarHBondContact CB-O 3.41Å; L681-H693 HydrophobicContact CD1-CB 3.83Å; L681-H693 PolarHBondContact N-O 2.69Å; S691-H693 PolarHBondContact O-ND1 3.13Å; S691-H693 PolarHBondContact OG-CE1 2.87Å; S691-H693 VanDerWaalsContact OG-CE1 3.3Å; H693-Q705 CarbonylContact C-O 3.56Å; H693-Q705 WeakPolarHBondContact CA-O 3.49Å; H693-L755 HydrophobicContact CB-CD2 4.03Å; H693-D759 IonicContact NE2-OD1 3.19Å
694	L	91.3	Very high	78.6	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.4	-177.6	175.8	155.9	0	0	0	108.1	L642 I678 F696 L704 Q705 L707	L642-L694 HydrophobicContact CD2-CD1 3.63Å; I678-L694 HydrophobicContact CG1-CD2 4.38Å; I678-L694 HydrophobicContact CG2-CD1 3.4Å; I678-L694 VanDerWaalsContact CG2-CD1 3.4Å; I678-L694 HydrophobicContact CG2-CD2 3.66Å; I678-L694 HydrophobicContact CG2-CG 3.5Å; I678-L694 VanDerWaalsContact CG2-CG 3.5Å; L694-F696 HydrophobicContact CD2-CB 4.07Å; L694-F696 HydrophobicContact CD2-CD1 4.15Å; L694-L704 CarbonylContact O-C 3.56Å; L694-L704 WeakPolarHBondContact O-CA 3.12Å; L694-Q705 HydrophobicContact CB-CB 4.33Å; L694-Q705 HydrophobicContact CD2-CB 4.11Å; L694-Q705 PolarHBondContact N-O 2.87Å; L694-Q705 PolarHBondContact O-N 3.22Å; L694-L707 HydrophobicContact CB-CD1 4.24Å; L694-L707 HydrophobicContact CB-CD2 4.35Å; L694-L707 HydrophobicContact CB-CG 4.32Å; L694-L707 HydrophobicContact CD1-CD2 4.34Å
695	A	93.9	Very high	80	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.5	171.1	0	0	0	0	0	109.3	I679 L681 G703 L704 F729 V738	I679-A695 PolarHBondContact N-O 3.32Å; I679-A695 PolarHBondContact O-N 2.89Å; L681-A695 HydrophobicContact CD2-CB 4.17Å; L681-A695 HydrophobicContact CG-CB 4.41Å; A695-G703 CarbonylContact C-O 3.54Å; A695-G703 WeakPolarHBondContact CA-O 3.33Å; A695-L704 HydrophobicContact CB-CD2 3.92Å; A695-F729 HydrophobicContact CB-CE2 3.91Å; A695-V738 HydrophobicContact CB-CG2 4.38Å
696	F	94.1	Very high	81.9	Confident	1 Å²	1	40 Å²	40	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.2	178.5	66.2	-92.2	0	0	0	110.9	P669 Y671 I675 K677 I678 L694 T698 G703 Q705 A718	P669-F696 HydrophobicContact CB-CE1 4.18Å; P669-F696 HydrophobicContact CB-CE2 4.03Å; P669-F696 HydrophobicContact CB-CZ 3.55Å; P669-F696 HydrophobicContact CG-CD1 4.41Å; P669-F696 HydrophobicContact CG-CE1 3.68Å; P669-F696 HydrophobicContact CG-CE2 4.28Å; P669-F696 HydrophobicContact CG-CZ 3.6Å; Y671-F696 HydrophobicContact CD2-CE2 4.41Å; Y671-F696 HydrophobicContact CD2-CZ 4.01Å; Y671-F696 HydrophobicContact CE2-CZ 4.38Å; I675-F696 HydrophobicContact CD1-CB 4.38Å; I675-F696 HydrophobicContact CD1-CD2 4.01Å; I675-F696 HydrophobicContact CD1-CE2 4.48Å; I675-F696 HydrophobicContact CD1-CG 4.12Å; I675-F696 HydrophobicContact CG1-CD2 3.82Å; I675-F696 HydrophobicContact CG1-CE2 4.36Å; I675-F696 HydrophobicContact CG1-CG 4.32Å; I675-F696 HydrophobicContact CG2-CB 3.91Å; K677-F696 WeakPolarHBondContact O-CA 3.26Å; I678-F696 HydrophobicContact CG1-CB 4.1Å; L694-F696 HydrophobicContact CD2-CB 4.07Å; L694-F696 HydrophobicContact CD2-CD1 4.15Å; F696-T698 HydrophobicContact CD2-CG2 4.27Å; F696-T698 HydrophobicContact CE2-CG2 4.2Å; F696-G703 VanDerWaalsContact CE1-C 3.48Å; F696-G703 PolarHBondContact N-O 2.95Å; F696-G703 PolarHBondContact O-N 2.96Å; F696-Q705 HydrophobicContact CD1-CB 4.28Å; F696-Q705 HydrophobicContact CE1-CB 4.23Å; F696-A718 HydrophobicContact CE2-CB 4.41Å; F696-A718 HydrophobicContact CZ-CB 4.23Å
697	I	94	Very high	83.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	144.9	168.3	62.1	166.3	0	0	0	110.6	R676 K677 M701 L702 V726 F729	R676-I697 PolarHBondContact N-O 3.13Å; K677-I697 HydrophobicContact CB-CD1 4.11Å; K677-I697 HydrophobicContact CB-CG1 3.85Å; K677-I697 PolarHBondContact N-O 3.32Å; K677-I697 PolarHBondContact O-N 2.85Å; I697-M701 WeakPolarHBondContact CA-O 3.38Å; I697-L702 HydrophobicContact CG2-CD1 3.75Å; I697-V726 HydrophobicContact CD1-CB 4.32Å; I697-V726 HydrophobicContact CD1-CG1 3.76Å; I697-V726 HydrophobicContact CG2-CG1 4.44Å; I697-F729 HydrophobicContact CB-CD1 4.07Å; I697-F729 HydrophobicContact CB-CE1 4.29Å; I697-F729 HydrophobicContact CD1-CD1 3.58Å; I697-F729 HydrophobicContact CD1-CE1 4.2Å; I697-F729 HydrophobicContact CD1-CG 4.47Å; I697-F729 HydrophobicContact CG1-CD1 3.53Å; I697-F729 HydrophobicContact CG1-CE1 3.7Å; I697-F729 HydrophobicContact CG1-CG 4.48Å; I697-F729 HydrophobicContact CG2-CB 3.85Å; I697-F729 HydrophobicContact CG2-CD1 3.42Å; I697-F729 VanDerWaalsContact CG2-CD1 3.42Å; I697-F729 HydrophobicContact CG2-CD2 4.13Å; I697-F729 HydrophobicContact CG2-CE1 3.88Å; I697-F729 HydrophobicContact CG2-CG 3.53Å; I697-F729 HydrophobicContact CG2-CZ 4.41Å
698	T	92.3	Very high	85.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.			trans	-101.1	-157.9	164.7	67.7	0	0	0	0	108.2	S673 F696 N700 M701	S673-T698 WeakPolarHBondContact O-CB 3.29Å; S673-T698 WeakPolarHBondContact O-CG2 3.43Å; F696-T698 HydrophobicContact CD2-CG2 4.27Å; F696-T698 HydrophobicContact CE2-CG2 4.2Å; T698-N700 VanDerWaalsContact C-N 3.34Å; T698-M701 PolarHBondContact N-O 3.47Å; T698-M701 WeakPolarHBondContact OG1-CB 3.18Å; T698-M701 PolarHBondContact OG1-N 3.25Å; T698-M701 VanDerWaalsContact OG1-N 3.08Å
699	D	90.3	Very high	86.6	Confident	64 Å²	64	26.2 Å²	26.2	34%	0.342	14%	0.136	S	C	.	.	S	Bend	trans	-69.6	-32	176.4	-64.7	-42.5	0	0	0	112.3	S673 G725 V726	S673-D699 WeakPolarHBondContact CB-OD2 3.45Å; S673-D699 VanDerWaalsContact OG-CB 3.23Å; S673-D699 WeakPolarHBondContact OG-CB 3.38Å; S673-D699 PolarHBondContact OG-N 3.42Å; S673-D699 PolarHBondContact OG-OD2 2.97Å; D699-G725 CarbonylContact O-C 3.56Å; D699-G725 WeakPolarHBondContact O-CA 3.06Å; D699-V726 PolarHBondContact O-N 3.04Å
700	N	91.1	Very high	87.8	Confident	44 Å²	44	26.4 Å²	26.4	24%	0.235	14%	0.135	C	C	.	.	S	Bend	trans	-136	-4.9	-177.1	63.8	-13.1	0	0	0	114.9	T698 C721 H722	T698-N700 VanDerWaalsContact C-N 3.34Å; N700-C721 PolarHBondContact O-N 3.46Å; N700-C721 PolarHBondContact O-SG 2.94Å; N700-C721 VanDerWaalsContact O-SG 3.37Å; N700-H722 WeakPolarHBondContact CA-O 3.14Å; N700-H722 WeakPolarHBondContact CB-O 3.46Å; N700-H722 PolarHBondContact O-N 3.13Å
701	M	91.9	Very high	88.8	Confident	34 Å²	34	17.2 Å²	17.2	17%	0.167	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.6	-177.4	-50.9	-170.4	-177.1	0	0	112.2	I697 T698 A718 L719 I720	I697-M701 WeakPolarHBondContact CA-O 3.38Å; T698-M701 PolarHBondContact N-O 3.47Å; T698-M701 WeakPolarHBondContact OG1-CB 3.18Å; T698-M701 PolarHBondContact OG1-N 3.25Å; T698-M701 VanDerWaalsContact OG1-N 3.08Å; M701-A718 HydrophobicContact CB-CB 4.35Å; M701-L719 CarbonylContact C-O 3.6Å; M701-L719 VanDerWaalsContact CA-O 3.24Å; M701-L719 WeakPolarHBondContact CA-O 3.15Å; M701-L719 WeakPolarHBondContact CB-O 3.09Å; M701-I720 HydrophobicContact CE-CG1 4.17Å; M701-I720 HydrophobicContact CG-CG1 4.36Å
702	L	94.4	Very high	89.6	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.1	166.8	174.5	69.1	0	0	0	108.3	L69 I697 A718 L719 C721 F729 V738 T740 W751	L69-L702 HydrophobicContact CD1-CB 4.44Å; L69-L702 HydrophobicContact CD1-CD2 3.97Å; L69-L702 HydrophobicContact CD1-CG 3.82Å; L69-L702 WeakPolarHBondContact CD1-O 3.42Å; L69-L702 HydrophobicContact CD2-CD2 4.18Å; I697-L702 HydrophobicContact CG2-CD1 3.75Å; L702-A718 CarbonylContact O-C 3.2Å; L702-A718 VanDerWaalsContact O-CA 3.27Å; L702-A718 WeakPolarHBondContact O-CA 3.09Å; L702-L719 PolarHBondContact N-O 3.18Å; L702-L719 PolarHBondContact O-N 2.91Å; L702-C721 HydrophobicContact CB-CB 4.08Å; L702-F729 HydrophobicContact CD1-CD2 4.34Å; L702-V738 HydrophobicContact CD1-CG1 3.8Å; L702-V738 HydrophobicContact CD2-CB 4.28Å; L702-V738 HydrophobicContact CD2-CG1 3.91Å; L702-T740 HydrophobicContact CB-CG2 4.36Å; L702-T740 HydrophobicContact CD1-CG2 4.14Å; L702-T740 HydrophobicContact CD2-CG2 3.97Å; L702-T740 HydrophobicContact CG-CG2 4.38Å; L702-W751 HydrophobicContact CD2-CB 3.97Å; L702-W751 VanDerWaalsContact CD2-CD1 3.46Å; L702-W751 HydrophobicContact CD2-CD2 3.88Å; L702-W751 HydrophobicContact CD2-CG 3.49Å; L702-W751 VanDerWaalsContact CD2-CG 3.49Å
703	G	92.9	Very high	89.5	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.3	177.6	0	0	0	0	0	114.8	A695 F696 S717	A695-G703 CarbonylContact C-O 3.54Å; A695-G703 WeakPolarHBondContact CA-O 3.33Å; F696-G703 VanDerWaalsContact CE1-C 3.48Å; F696-G703 PolarHBondContact N-O 2.95Å; F696-G703 PolarHBondContact O-N 2.96Å; G703-S717 CarbonylContact C-O 3.53Å; G703-S717 WeakPolarHBondContact CA-O 3.24Å
704	L	93.4	Very high	89.4	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	148.5	175.1	-66.7	175.3	0	0	0	109.9	A68 L69 L681 L694 A695 S716 S717 V753 L758	A68-L704 HydrophobicContact CB-CD1 4.3Å; L69-L704 HydrophobicContact CD1-CD1 4.43Å; L69-L704 HydrophobicContact CD1-CG 4.09Å; L69-L704 HydrophobicContact CD2-CD1 3.63Å; L69-L704 HydrophobicContact CD2-CD2 4.3Å; L69-L704 HydrophobicContact CD2-CG 3.85Å; L69-L704 HydrophobicContact CG-CD1 3.71Å; L69-L704 HydrophobicContact CG-CG 3.91Å; L681-L704 HydrophobicContact CD1-CD2 3.92Å; L694-L704 CarbonylContact O-C 3.56Å; L694-L704 WeakPolarHBondContact O-CA 3.12Å; A695-L704 HydrophobicContact CB-CD2 3.92Å; L704-S716 WeakPolarHBondContact O-CA 3.27Å; L704-S717 PolarHBondContact N-O 3.32Å; L704-S717 PolarHBondContact O-N 3.42Å; L704-V753 HydrophobicContact CD1-CG1 3.76Å; L704-V753 HydrophobicContact CD2-CG1 4.42Å; L704-L758 HydrophobicContact CB-CD2 3.77Å
705	Q	91.7	Very high	89.3	Confident	4 Å²	4	23.3 Å²	23.3	2%	0.019	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	130.5	-177.4	175.6	67	53.7	0	0	110.2	H693 L694 F696 M709 K715	H693-Q705 CarbonylContact C-O 3.56Å; H693-Q705 WeakPolarHBondContact CA-O 3.49Å; L694-Q705 HydrophobicContact CB-CB 4.33Å; L694-Q705 HydrophobicContact CD2-CB 4.11Å; L694-Q705 PolarHBondContact N-O 2.87Å; L694-Q705 PolarHBondContact O-N 3.22Å; F696-Q705 HydrophobicContact CD1-CB 4.28Å; F696-Q705 HydrophobicContact CE1-CB 4.23Å; Q705-M709 HydrophobicContact CG-CE 3.48Å; Q705-M709 VanDerWaalsContact CG-CE 3.48Å; Q705-M709 HydrophobicContact CG-SD 3.14Å; Q705-M709 WeakPolarHBondContact CG-SD 3.34Å; Q705-M709 PolarHBondContact NE2-SD 3.4Å; Q705-M709 VanDerWaalsContact NE2-SD 3.42Å; Q705-K715 WeakPolarHBondContact CA-O 3.41Å; Q705-K715 PolarHBondContact NE2-O 2.68Å
706	I	90.3	Very high	89.1	Confident	11 Å²	11	23.8 Å²	23.8	6%	0.056	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.7	173.7	-57.9	168.3	0	0	0	109.9	K715 L758 D759 A762	I706-K715 HydrophobicContact CB-CB 4.17Å; I706-K715 HydrophobicContact CB-CD 4.44Å; I706-K715 HydrophobicContact CB-CG 4.37Å; I706-K715 HydrophobicContact CD1-CB 4.49Å; I706-K715 HydrophobicContact CD1-CG 4.37Å; I706-K715 PolarHBondContact N-O 3.29Å; I706-L758 HydrophobicContact CD1-CD2 4.24Å; I706-L758 HydrophobicContact CD1-CG 3.83Å; I706-L758 HydrophobicContact CG1-CD2 3.68Å; I706-L758 HydrophobicContact CG1-CG 3.85Å; I706-D759 VanDerWaalsContact CD1-OD1 3.3Å; I706-D759 WeakPolarHBondContact CD1-OD1 3.4Å; I706-A762 HydrophobicContact CD1-CB 3.83Å
707	L	87.1	Confident	89	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	145.4	172.2	-55.2	175.4	0	0	0	110.6	Y632 P633 F635 H692 L694 M709	Y632-L707 HydrophobicContact CE2-CD2 3.9Å; P633-L707 HydrophobicContact CG-CD1 3.7Å; F635-L707 HydrophobicContact CE2-CB 4Å; F635-L707 HydrophobicContact CE2-CD1 4.46Å; F635-L707 HydrophobicContact CZ-CB 3.72Å; H692-L707 HydrophobicContact CB-CB 4.08Å; H692-L707 HydrophobicContact CB-CD1 3.86Å; H692-L707 HydrophobicContact CB-CG 4.43Å; H692-L707 WeakPolarHBondContact O-CB 3.38Å; H692-L707 PolarHBondContact O-N 2.97Å; L694-L707 HydrophobicContact CB-CD1 4.24Å; L694-L707 HydrophobicContact CB-CD2 4.35Å; L694-L707 HydrophobicContact CB-CG 4.32Å; L694-L707 HydrophobicContact CD1-CD2 4.34Å; L707-M709 HydrophobicContact CD2-CG 3.53Å; L707-M709 HydrophobicContact CD2-SD 3.56Å; L707-M709 VanDerWaalsContact CD2-SD 3.56Å
708	P	85.5	Confident	88.8	Confident	72 Å²	72	26.1 Å²	26.1	47%	0.468	14%	0.143	S	C	.	.	S	Bend	cis	-76.3	148.8	7.3	30.7	-35.9	0	0	0	114.1	Y632	Y632-P708 VanDerWaalsContact OH-CA 3.23Å; Y632-P708 WeakPolarHBondContact OH-CA 3.31Å; Y632-P708 WeakPolarHBondContact OH-CB 3.4Å
709	M	83.1	Confident	88.8	Confident	8 Å²	8	27.9 Å²	27.9	4%	0.039	15%	0.153	C	C	.	.			trans	-71.1	133	177.7	-61.6	-57.9	-72.1	0	0	111.1	Y632 M650 L666 Q705 L707	Y632-M709 HydrophobicContact CE2-CG 4.38Å; Y632-M709 PolarHBondContact OH-N 3.48Å; M650-M709 HydrophobicContact CE-CE 4.44Å; M650-M709 HydrophobicContact SD-CE 3.59Å; M650-M709 VanDerWaalsContact SD-CE 3.59Å; L666-M709 HydrophobicContact CD1-CB 3.34Å; L666-M709 WeakPolarHBondContact CD1-O 3.27Å; Q705-M709 HydrophobicContact CG-CE 3.48Å; Q705-M709 VanDerWaalsContact CG-CE 3.48Å; Q705-M709 HydrophobicContact CG-SD 3.14Å; Q705-M709 WeakPolarHBondContact CG-SD 3.34Å; Q705-M709 PolarHBondContact NE2-SD 3.4Å; Q705-M709 VanDerWaalsContact NE2-SD 3.42Å; L707-M709 HydrophobicContact CD2-CG 3.53Å; L707-M709 HydrophobicContact CD2-SD 3.56Å; L707-M709 VanDerWaalsContact CD2-SD 3.56Å
710	D	82	Confident	88.7	Confident	48 Å²	48	26.8 Å²	26.8	26%	0.257	15%	0.146	S	C	.	.			trans	-136.2	-5.4	177.8	58.6	-4.3	0	0	0	113.8	N712 K715 F772 N868	D710-N712 WeakPolarHBondContact OD1-CB 3.49Å; D710-N712 PolarHBondContact OD1-N 3.46Å; D710-K715 IonicContact OD1-NZ 2.65Å; D710-K715 IonicContact OD2-NZ 2.85Å; D710-K715 PolarHBondContact OD2-NZ 2.73Å; D710-F772 WeakPolarHBondContact O-CE1 3.36Å; D710-F772 WeakPolarHBondContact O-CZ 3.44Å; D710-N868 PolarHBondContact O-ND2 3.04Å
711	G	81.7	Confident	88.6	Confident	6 Å²	6	24.7 Å²	24.7	6%	0.062	14%	0.135	C	C	.	.			trans	87.6	8.6	-175.4	0	0	0	0	0	114.2
712	N	86.6	Confident	88.5	Confident	12 Å²	12	23.1 Å²	23.1	6%	0.064	13%	0.127	C	C	.	.			trans	-71.6	122.2	176.7	-179.5	-15.1	0	0	0	111	D710 Y714 K715 P771	D710-N712 WeakPolarHBondContact OD1-CB 3.49Å; D710-N712 PolarHBondContact OD1-N 3.46Å; N712-Y714 VanDerWaalsContact C-N 3.32Å; N712-Y714 PolarHBondContact O-N 2.97Å; N712-Y714 WeakPolarHBondContact OD1-CB 3.43Å; N712-Y714 PolarHBondContact OD1-N 2.9Å; N712-K715 HydrophobicContact CB-CB 4.43Å; N712-K715 HydrophobicContact CB-CD 4.08Å; N712-K715 HydrophobicContact CB-CG 4.09Å; N712-K715 PolarHBondContact O-N 3.27Å; N712-P771 HydrophobicContact CB-CB 4.5Å; N712-P771 WeakPolarHBondContact ND2-CG 3.27Å; N712-P771 WeakPolarHBondContact OD1-CB 3.12Å
713	P	83.1	Confident	88.1	Confident	40 Å²	40	24.2 Å²	24.2	26%	0.26	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-67	-31.3	-177.7	28	-34.9	0	0	0	112.8	K715 S716 L775	P713-K715 PolarHBondContact O-N 2.92Å; P713-S716 PolarHBondContact O-N 3Å; P713-S716 PolarHBondContact O-OG 3.42Å; P713-L775 HydrophobicContact CB-CD2 4.39Å; P713-L775 HydrophobicContact CG-CD1 4.22Å; P713-L775 HydrophobicContact CG-CD2 4.02Å; P713-L775 HydrophobicContact CG-CG 4.16Å
714	Y	87.6	Confident	87.8	Confident	99 Å²	99	27.2 Å²	27.2	39%	0.388	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-75.5	-10.4	-178.8	-59.4	-73.8	0	0	0	113.8	N712 A762 P771	N712-Y714 VanDerWaalsContact C-N 3.32Å; N712-Y714 PolarHBondContact O-N 2.97Å; N712-Y714 WeakPolarHBondContact OD1-CB 3.43Å; N712-Y714 PolarHBondContact OD1-N 2.9Å; Y714-A762 WeakPolarHBondContact O-CA 3.29Å; Y714-P771 HydrophobicContact CD2-CB 3.95Å; Y714-P771 HydrophobicContact CD2-CG 4.35Å; Y714-P771 HydrophobicContact CE2-CB 4.24Å
715	K	88.5	Confident	87.5	Confident	43 Å²	43	28.3 Å²	28.3	19%	0.187	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-82.5	-0.7	171.7	-73.9	-173.8	178.5	172.4	0	113.3	Q705 I706 D710 N712 P713 A762	Q705-K715 WeakPolarHBondContact CA-O 3.41Å; Q705-K715 PolarHBondContact NE2-O 2.68Å; I706-K715 HydrophobicContact CB-CB 4.17Å; I706-K715 HydrophobicContact CB-CD 4.44Å; I706-K715 HydrophobicContact CB-CG 4.37Å; I706-K715 HydrophobicContact CD1-CB 4.49Å; I706-K715 HydrophobicContact CD1-CG 4.37Å; I706-K715 PolarHBondContact N-O 3.29Å; D710-K715 IonicContact OD1-NZ 2.65Å; D710-K715 IonicContact OD2-NZ 2.85Å; D710-K715 PolarHBondContact OD2-NZ 2.73Å; N712-K715 HydrophobicContact CB-CB 4.43Å; N712-K715 HydrophobicContact CB-CD 4.08Å; N712-K715 HydrophobicContact CB-CG 4.09Å; N712-K715 PolarHBondContact O-N 3.27Å; P713-K715 PolarHBondContact O-N 2.92Å; K715-A762 HydrophobicContact CG-CB 4Å
716	S	90	Very high	87.4	Confident	10 Å²	10	28.2 Å²	28.2	7%	0.07	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	146.5	-179.1	79.7	0	0	0	0	110.3	Y671 L704 P713	Y671-S716 WeakPolarHBondContact CE2-OG 3.45Å; Y671-S716 PolarHBondContact OH-O 2.96Å; Y671-S716 VanDerWaalsContact OH-O 3.08Å; Y671-S716 PolarHBondContact OH-OG 3Å; L704-S716 WeakPolarHBondContact O-CA 3.27Å; P713-S716 PolarHBondContact O-N 3Å; P713-S716 PolarHBondContact O-OG 3.42Å
717	S	91	Very high	87.3	Confident	36 Å²	36	28.8 Å²	28.8	25%	0.252	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	136.1	172	-176.6	0	0	0	0	108.7	G703 L704	G703-S717 CarbonylContact C-O 3.53Å; G703-S717 WeakPolarHBondContact CA-O 3.24Å; L704-S717 PolarHBondContact N-O 3.32Å; L704-S717 PolarHBondContact O-N 3.42Å
718	A	91.4	Very high	87.4	Confident	16 Å²	16	29.7 Å²	29.7	13%	0.132	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.6	177.2	0	0	0	0	0	111.6	Y671 F696 M701 L702	Y671-A718 HydrophobicContact CD1-CB 4.18Å; Y671-A718 HydrophobicContact CD2-CB 3.44Å; Y671-A718 VanDerWaalsContact CD2-CB 3.44Å; Y671-A718 HydrophobicContact CE2-CB 3.86Å; Y671-A718 HydrophobicContact CG-CB 3.62Å; F696-A718 HydrophobicContact CE2-CB 4.41Å; F696-A718 HydrophobicContact CZ-CB 4.23Å; M701-A718 HydrophobicContact CB-CB 4.35Å; L702-A718 CarbonylContact O-C 3.2Å; L702-A718 VanDerWaalsContact O-CA 3.27Å; L702-A718 WeakPolarHBondContact O-CA 3.09Å
719	L	91	Very high	87.8	Confident	37 Å²	37	26.3 Å²	26.3	19%	0.194	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.1	175.8	-68.9	178.4	0	0	0	109.9	H67 L69 M701 L702 C721 W751	H67-L719 HydrophobicContact CB-CD1 4.28Å; L69-L719 HydrophobicContact CB-CD1 3.93Å; L69-L719 WeakPolarHBondContact O-CD1 3.45Å; M701-L719 CarbonylContact C-O 3.6Å; M701-L719 VanDerWaalsContact CA-O 3.24Å; M701-L719 WeakPolarHBondContact CA-O 3.15Å; M701-L719 WeakPolarHBondContact CB-O 3.09Å; L702-L719 PolarHBondContact N-O 3.18Å; L702-L719 PolarHBondContact O-N 2.91Å; L719-C721 PolarHBondContact O-N 3.25Å; L719-W751 HydrophobicContact CD1-CZ3 4.42Å
720	I	89.2	Confident	88.3	Confident	41 Å²	41	26.6 Å²	26.6	21%	0.21	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127	172.5	-59.8	171.1	0	0	0	108	C119 M701 P723	C119-I720 HydrophobicContact CB-CD1 4.2Å; M701-I720 HydrophobicContact CE-CG1 4.17Å; M701-I720 HydrophobicContact CG-CG1 4.36Å; I720-P723 HydrophobicContact CG2-CG 4.09Å
721	C	89	Confident	88.9	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-110.5	-49.4	175.4	58	0	0	0	0	111.8	H100 N700 L702 L719 V726 L749 W751	H100-C721 PolarHBondContact CE1-O 3Å; H100-C721 PolarHBondContact ND1-O 3.37Å; N700-C721 PolarHBondContact O-N 3.46Å; N700-C721 PolarHBondContact O-SG 2.94Å; N700-C721 VanDerWaalsContact O-SG 3.37Å; L702-C721 HydrophobicContact CB-CB 4.08Å; L719-C721 PolarHBondContact O-N 3.25Å; C721-V726 WeakPolarHBondContact SG-CG2 3.27Å; C721-L749 HydrophobicContact CB-CD1 4.33Å; C721-L749 WeakPolarHBondContact O-CD1 3.47Å; C721-W751 HydrophobicContact CB-CH2 4.23Å; C721-W751 HydrophobicContact CB-CZ2 3.37Å
722	H	90.1	Very high	89.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.145	C	C	.	.			trans	-136	102.5	-179.5	-64.1	-78.5	0	0	0	109.4	N700 T724 G725 V726 T740 G742 D745 S747 L749	N700-H722 WeakPolarHBondContact CA-O 3.14Å; N700-H722 WeakPolarHBondContact CB-O 3.46Å; N700-H722 PolarHBondContact O-N 3.13Å; H722-T724 PolarHBondContact O-N 2.93Å; H722-G725 PolarHBondContact O-N 3.42Å; H722-G725 VanDerWaalsContact O-N 3.11Å; H722-V726 HydrophobicContact CB-CG2 4.08Å; H722-T740 PolarHBondContact CD2-OG1 2.97Å; H722-T740 WeakPolarHBondContact NE2-CB 3.48Å; H722-T740 PolarHBondContact NE2-OG1 2.52Å; H722-G742 PolarHBondContact CE1-N 3.22Å; H722-G742 VanDerWaalsContact CE1-N 3.32Å; H722-G742 VanDerWaalsContact ND1-CA 3.3Å; H722-G742 WeakPolarHBondContact ND1-CA 3.42Å; H722-G742 PolarHBondContact NE2-N 3.32Å; H722-D745 WeakPolarHBondContact CB-OD2 3.35Å; H722-D745 IonicContact CE1-OD2 3.96Å; H722-D745 IonicContact CG-OD2 2.79Å; H722-D745 IonicContact ND1-OD1 2.79Å; H722-D745 IonicContact ND1-OD2 3.56Å; H722-D745 PolarHBondContact ND1-OD2 3.15Å; H722-S747 PolarHBondContact CE1-OG 2.82Å; H722-S747 VanDerWaalsContact CE1-OG 3.22Å; H722-S747 PolarHBondContact ND1-OG 2.87Å; H722-L749 VanDerWaalsContact CE1-CD1 3.48Å; H722-L749 WeakPolarHBondContact CE1-CD1 3.47Å; H722-L749 VanDerWaalsContact CE1-CG 3.46Å; H722-L749 WeakPolarHBondContact CE1-CG 3.26Å
723	P	86	Confident	89.5	Confident	23 Å²	23	28.2 Å²	28.2	15%	0.149	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.1	-174.7	-23.1	30.5	0	0	0	114.5	H100 C119 P121 I720 G725	H100-P723 HydrophobicContact CB-CG 3.67Å; H100-P723 WeakPolarHBondContact ND1-CD 3.42Å; C119-P723 WeakPolarHBondContact O-CB 3.32Å; C119-P723 WeakPolarHBondContact O-CG 3.4Å; P121-P723 HydrophobicContact CG-CB 4.33Å; I720-P723 HydrophobicContact CG2-CG 4.09Å; P723-G725 VanDerWaalsContact C-N 3.3Å
724	T	84.9	Confident	89.6	Confident	64 Å²	64	27.4 Å²	27.4	39%	0.393	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-7	-179.4	58.1	0	0	0	0	113.4	P121 H722 S744 D745	P121-T724 HydrophobicContact CG-CG2 3.48Å; P121-T724 VanDerWaalsContact CG-CG2 3.48Å; H722-T724 PolarHBondContact O-N 2.93Å; T724-S744 WeakPolarHBondContact CB-OG 3.22Å; T724-S744 PolarHBondContact O-OG 3.44Å; T724-S744 PolarHBondContact OG1-OG 3.49Å; T724-D745 WeakPolarHBondContact OG1-CB 3.36Å
725	G	87.4	Confident	89.5	Confident	22 Å²	22	23 Å²	23	23%	0.227	14%	0.136	C	C	.	.			trans	123.3	131.7	177.3	0	0	0	0	0	113.9	D699 H722 P723 G742	D699-G725 CarbonylContact O-C 3.56Å; D699-G725 WeakPolarHBondContact O-CA 3.06Å; H722-G725 PolarHBondContact O-N 3.42Å; H722-G725 VanDerWaalsContact O-N 3.11Å; P723-G725 VanDerWaalsContact C-N 3.3Å; G725-G742 CarbonylContact O-C 3.58Å; G725-G742 WeakPolarHBondContact O-CA 3.14Å
726	V	90.1	Very high	89.5	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.018	15%	0.148	C	C	.	.			trans	-80.4	129.2	173.7	-171.5	0	0	0	0	109.8	R676 I697 D699 C721 H722 A741	R676-V726 PolarHBondContact NH1-O 3.18Å; I697-V726 HydrophobicContact CD1-CB 4.32Å; I697-V726 HydrophobicContact CD1-CG1 3.76Å; I697-V726 HydrophobicContact CG2-CG1 4.44Å; D699-V726 PolarHBondContact O-N 3.04Å; C721-V726 WeakPolarHBondContact SG-CG2 3.27Å; H722-V726 HydrophobicContact CB-CG2 4.08Å; V726-A741 WeakPolarHBondContact CG1-O 3.24Å
727	S	87.8	Confident	89.6	Confident	23 Å²	23	26.4 Å²	26.4	16%	0.161	15%	0.15	C	C	.	.			trans	-82.7	-50	174.2	63.5	0	0	0	0	111.4	L435 A741	L435-S727 PolarHBondContact O-OG 3.27Å; S727-A741 PolarHBondContact N-O 2.91Å; S727-A741 WeakPolarHBondContact OG-CB 3.05Å; S727-A741 PolarHBondContact OG-O 2.81Å; S727-A741 VanDerWaalsContact OG-O 3.06Å
728	T	90	Very high	89.8	Confident	21 Å²	21	24.7 Å²	24.7	13%	0.129	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	165.9	-179.1	-172.6	0	0	0	0	111.4	H436 L438 A741	H436-T728 VanDerWaalsContact O-CG2 3.28Å; H436-T728 WeakPolarHBondContact O-CG2 3.38Å; L438-T728 HydrophobicContact CB-CG2 3.76Å; T728-A741 HydrophobicContact CG2-CB 4.26Å; T728-A741 PolarHBondContact O-N 2.83Å
729	F	94.3	Very high	89.9	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	159.5	170.8	86.3	-71.8	0	0	0	111.9	K677 I679 A695 I697 L702 V738 F739 T740	K677-F729 HydrophobicContact CB-CD1 4.29Å; K677-F729 HydrophobicContact CB-CE1 3.75Å; K677-F729 HydrophobicContact CD-CD1 3.91Å; K677-F729 HydrophobicContact CD-CE1 3.8Å; K677-F729 HydrophobicContact CG-CD1 4.26Å; K677-F729 HydrophobicContact CG-CE1 3.66Å; K677-F729 PolarHBondContact NZ-O 3.49Å; I679-F729 HydrophobicContact CB-CE2 3.94Å; I679-F729 HydrophobicContact CB-CZ 3.83Å; I679-F729 HydrophobicContact CD1-CD1 4.45Å; I679-F729 HydrophobicContact CD1-CD2 4.12Å; I679-F729 HydrophobicContact CD1-CE1 4.09Å; I679-F729 HydrophobicContact CD1-CE2 3.72Å; I679-F729 HydrophobicContact CD1-CG 4.49Å; I679-F729 HydrophobicContact CD1-CZ 3.73Å; I679-F729 HydrophobicContact CG1-CE1 4.1Å; I679-F729 HydrophobicContact CG1-CE2 3.9Å; I679-F729 HydrophobicContact CG1-CZ 3.54Å; A695-F729 HydrophobicContact CB-CE2 3.91Å; I697-F729 HydrophobicContact CB-CD1 4.07Å; I697-F729 HydrophobicContact CB-CE1 4.29Å; I697-F729 HydrophobicContact CD1-CD1 3.58Å; I697-F729 HydrophobicContact CD1-CE1 4.2Å; I697-F729 HydrophobicContact CD1-CG 4.47Å; I697-F729 HydrophobicContact CG1-CD1 3.53Å; I697-F729 HydrophobicContact CG1-CE1 3.7Å; I697-F729 HydrophobicContact CG1-CG 4.48Å; I697-F729 HydrophobicContact CG2-CB 3.85Å; I697-F729 HydrophobicContact CG2-CD1 3.42Å; I697-F729 VanDerWaalsContact CG2-CD1 3.42Å; I697-F729 HydrophobicContact CG2-CD2 4.13Å; I697-F729 HydrophobicContact CG2-CE1 3.88Å; I697-F729 HydrophobicContact CG2-CG 3.53Å; I697-F729 HydrophobicContact CG2-CZ 4.41Å; L702-F729 HydrophobicContact CD1-CD2 4.34Å; F729-V738 HydrophobicContact CD2-CG1 3.82Å; F729-V738 HydrophobicContact CE2-CG1 4.48Å; F729-F739 CarbonylContact C-O 3.59Å; F729-F739 WeakPolarHBondContact CA-O 3.35Å; F729-F739 VanDerWaalsContact CB-O 3.3Å; F729-F739 WeakPolarHBondContact CB-O 3.45Å; F729-T740 HydrophobicContact CB-CG2 3.95Å
730	S	93.3	Very high	90.1	Very high	15 Å²	15	22.2 Å²	22.2	11%	0.105	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.1	176.5	-167.5	0	0	0	0	110.9	L438 C440 F739	L438-S730 VanDerWaalsContact CD2-CB 3.46Å; C440-S730 PolarHBondContact N-OG 3.28Å; S730-F739 PolarHBondContact N-O 3.34Å; S730-F739 PolarHBondContact O-N 3.19Å
731	C	93.3	Very high	90.2	Very high	15 Å²	15	20.2 Å²	20.2	10%	0.101	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142	-179.6	-61.2	0	0	0	0	110.1	C440 I679 L681	C440-C731 VanDerWaalsContact CB-O 3.22Å; C440-C731 WeakPolarHBondContact CB-O 3.25Å; I679-C731 HydrophobicContact CG2-CB 4.13Å; L681-C731 HydrophobicContact CD2-CB 4Å
732	S	93.1	Very high	89.9	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.007	11%	0.112	C	C	.	.			trans	-58.2	153.8	170.2	53.4	0	0	0	0	112.2	P682 D734 G735 K736 F737	P682-S732 WeakPolarHBondContact CG-O 3.45Å; S732-D734 WeakPolarHBondContact CB-OD1 3.4Å; S732-D734 PolarHBondContact O-N 3.25Å; S732-D734 PolarHBondContact OG-OD1 3.16Å; S732-D734 VanDerWaalsContact OG-OD1 3.1Å; S732-G735 PolarHBondContact O-N 3.47Å; S732-G735 VanDerWaalsContact O-N 3.11Å; S732-G735 PolarHBondContact OG-N 3.17Å; S732-K736 PolarHBondContact OG-N 2.98Å; S732-F737 WeakPolarHBondContact CB-O 3.06Å; S732-F737 PolarHBondContact N-O 3Å; S732-F737 WeakPolarHBondContact OG-CA 3.37Å; S732-F737 PolarHBondContact OG-N 2.99Å; S732-F737 PolarHBondContact OG-O 2.77Å
733	Y	87.6	Confident	89.5	Confident	84 Å²	84	20.4 Å²	20.4	33%	0.329	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.6	178.2	71.2	-89.1	0	0	0	113.9	P442 Q444 P445 Y461 P682	P442-Y733 WeakPolarHBondContact O-CB 3.26Å; Q444-Y733 VanDerWaalsContact C-CD1 3.46Å; Q444-Y733 WeakPolarHBondContact O-CD1 3.31Å; P445-Y733 HydrophobicContact CB-CE1 3.98Å; Y461-Y733 WeakPolarHBondContact OH-CD1 3.41Å; Y461-Y733 WeakPolarHBondContact OH-CE1 3.35Å; P682-Y733 WeakPolarHBondContact CB-O 3.16Å; P682-Y733 VanDerWaalsContact CG-O 3.23Å; P682-Y733 WeakPolarHBondContact CG-O 3.38Å
734	D	86.3	Confident	89.2	Confident	22 Å²	22	22.8 Å²	22.8	12%	0.118	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-4	178.8	74	-15.6	0	0	0	113.1	A684 S732 K736	A684-D734 VanDerWaalsContact CB-O 3.25Å; A684-D734 WeakPolarHBondContact CB-O 2.98Å; S732-D734 WeakPolarHBondContact CB-OD1 3.4Å; S732-D734 PolarHBondContact O-N 3.25Å; S732-D734 PolarHBondContact OG-OD1 3.16Å; S732-D734 VanDerWaalsContact OG-OD1 3.1Å; D734-K736 PolarHBondContact O-N 3.24Å; D734-K736 PolarHBondContact OD1-N 3.14Å; D734-K736 VanDerWaalsContact OD1-N 3.14Å; D734-K736 WeakPolarHBondContact OD2-CD 3.44Å; D734-K736 VanDerWaalsContact OD2-CE 3.31Å; D734-K736 WeakPolarHBondContact OD2-CE 3.37Å; D734-K736 WeakPolarHBondContact OD2-CG 3.19Å; D734-K736 IonicContact OD2-NZ 3.77Å; D734-K736 PolarHBondContact OD2-NZ 2.74Å; D734-K736 VanDerWaalsContact OD2-NZ 3.12Å
735	G	86.2	Confident	89	Confident	8 Å²	8	20.6 Å²	20.6	8%	0.082	12%	0.117	C	C	.	.	S	Bend	trans	72	8.2	178.1	0	0	0	0	0	114.4	S732	S732-G735 PolarHBondContact O-N 3.47Å; S732-G735 VanDerWaalsContact O-N 3.11Å; S732-G735 PolarHBondContact OG-N 3.17Å
736	K	88.2	Confident	88.8	Confident	98 Å²	98	19.8 Å²	19.8	43%	0.426	11%	0.108	S	C	.	.	S	Bend	trans	-84.5	-26	178.8	-66	-173.7	-162.6	141.1	0	113.2	S732 D734 K752 V753	S732-K736 PolarHBondContact OG-N 2.98Å; D734-K736 PolarHBondContact O-N 3.24Å; D734-K736 PolarHBondContact OD1-N 3.14Å; D734-K736 VanDerWaalsContact OD1-N 3.14Å; D734-K736 WeakPolarHBondContact OD2-CD 3.44Å; D734-K736 VanDerWaalsContact OD2-CE 3.31Å; D734-K736 WeakPolarHBondContact OD2-CE 3.37Å; D734-K736 WeakPolarHBondContact OD2-CG 3.19Å; D734-K736 IonicContact OD2-NZ 3.77Å; D734-K736 PolarHBondContact OD2-NZ 2.74Å; D734-K736 VanDerWaalsContact OD2-NZ 3.12Å; K736-K752 WeakPolarHBondContact O-CA 2.86Å; K736-V753 WeakPolarHBondContact O-CB 3.05Å; K736-V753 PolarHBondContact O-N 3.4Å
737	F	92	Very high	88.7	Confident	26 Å²	26	19.6 Å²	19.6	11%	0.114	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.7	179.5	-56.8	-74.3	0	0	0	112.2	E72 Y461 S732 F739 W751 K752	E72-F737 WeakPolarHBondContact OE2-CD1 3.25Å; E72-F737 WeakPolarHBondContact OE2-CE1 2.99Å; Y461-F737 HydrophobicContact CD2-CD2 4.02Å; Y461-F737 HydrophobicContact CD2-CE2 4.2Å; Y461-F737 AromaticContact CE2-CD2 3.77Å; Y461-F737 HydrophobicContact CE2-CD2 3.77Å; Y461-F737 HydrophobicContact CE2-CE2 4.09Å; S732-F737 WeakPolarHBondContact CB-O 3.06Å; S732-F737 PolarHBondContact N-O 3Å; S732-F737 WeakPolarHBondContact OG-CA 3.37Å; S732-F737 PolarHBondContact OG-N 2.99Å; S732-F737 PolarHBondContact OG-O 2.77Å; F737-F739 HydrophobicContact CB-CE2 3.83Å; F737-F739 HydrophobicContact CB-CZ 4.16Å; F737-W751 CarbonylContact C-O 3.6Å; F737-W751 WeakPolarHBondContact CA-O 3.11Å; F737-K752 HydrophobicContact CD1-CB 4.07Å; F737-K752 HydrophobicContact CD1-CG 4.47Å; F737-K752 HydrophobicContact CE1-CB 3.88Å; F737-K752 HydrophobicContact CE1-CD 4.4Å; F737-K752 HydrophobicContact CE1-CG 4Å
738	V	94.6	Very high	88.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	134.9	170	178.9	0	0	0	0	108	L681 A695 L702 F729 W751 V753	L681-V738 HydrophobicContact CD2-CG2 4.19Å; A695-V738 HydrophobicContact CB-CG2 4.38Å; L702-V738 HydrophobicContact CD1-CG1 3.8Å; L702-V738 HydrophobicContact CD2-CB 4.28Å; L702-V738 HydrophobicContact CD2-CG1 3.91Å; F729-V738 HydrophobicContact CD2-CG1 3.82Å; F729-V738 HydrophobicContact CE2-CG1 4.48Å; V738-W751 HydrophobicContact CB-CB 4.38Å; V738-W751 PolarHBondContact N-O 3.37Å; V738-W751 WeakPolarHBondContact O-CB 3.39Å; V738-W751 PolarHBondContact O-N 3.28Å; V738-V753 HydrophobicContact CG2-CG2 3.63Å
739	F	94.6	Very high	89	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.5	-178.7	-65	-90.7	0	0	0	109.9	L438 C440 V447 W459 Y461 F729 S730 F737 L749 S750	L438-F739 HydrophobicContact CD1-CB 3.89Å; L438-F739 HydrophobicContact CD2-CB 3.56Å; L438-F739 HydrophobicContact CG-CB 4.35Å; C440-F739 WeakPolarHBondContact SG-CD2 3.46Å; V447-F739 HydrophobicContact CG1-CE1 4.3Å; V447-F739 HydrophobicContact CG2-CG 4.3Å; W459-F739 HydrophobicContact CZ3-CE1 4.19Å; Y461-F739 HydrophobicContact CD1-CE2 4.02Å; Y461-F739 AromaticContact CD1-CZ 3.7Å; Y461-F739 HydrophobicContact CD1-CZ 3.7Å; Y461-F739 HydrophobicContact CE1-CE2 4.23Å; Y461-F739 HydrophobicContact CE1-CZ 4.34Å; Y461-F739 AromaticContact CG-CZ 3.86Å; Y461-F739 HydrophobicContact CG-CZ 3.86Å; F729-F739 CarbonylContact C-O 3.59Å; F729-F739 WeakPolarHBondContact CA-O 3.35Å; F729-F739 VanDerWaalsContact CB-O 3.3Å; F729-F739 WeakPolarHBondContact CB-O 3.45Å; S730-F739 PolarHBondContact N-O 3.34Å; S730-F739 PolarHBondContact O-N 3.19Å; F737-F739 HydrophobicContact CB-CE2 3.83Å; F737-F739 HydrophobicContact CB-CZ 4.16Å; F739-L749 CarbonylContact C-O 3.59Å; F739-L749 VanDerWaalsContact CA-O 3.29Å; F739-L749 WeakPolarHBondContact CA-O 3.47Å; F739-S750 WeakPolarHBondContact CE1-OG 3.19Å
740	T	94.3	Very high	88.9	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.9	178.7	61.2	0	0	0	0	110.6	L702 H722 F729 A748 L749 W751	L702-T740 HydrophobicContact CB-CG2 4.36Å; L702-T740 HydrophobicContact CD1-CG2 4.14Å; L702-T740 HydrophobicContact CD2-CG2 3.97Å; L702-T740 HydrophobicContact CG-CG2 4.38Å; H722-T740 PolarHBondContact CD2-OG1 2.97Å; H722-T740 WeakPolarHBondContact NE2-CB 3.48Å; H722-T740 PolarHBondContact NE2-OG1 2.52Å; F729-T740 HydrophobicContact CB-CG2 3.95Å; T740-A748 CarbonylContact O-C 3.09Å; T740-A748 WeakPolarHBondContact O-CA 3.31Å; T740-A748 WeakPolarHBondContact O-CB 3.49Å; T740-L749 PolarHBondContact N-O 2.82Å; T740-L749 PolarHBondContact O-N 3.43Å; T740-L749 WeakPolarHBondContact OG1-CB 3.35Å; T740-W751 PolarHBondContact OG1-NE1 2.95Å; T740-W751 VanDerWaalsContact OG1-NE1 3.11Å
741	A	91.6	Very high	88.9	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.1	172.4	0	0	0	0	0	109.8	L435 L438 V726 S727 T728	L435-A741 HydrophobicContact CB-CB 4.18Å; L438-A741 HydrophobicContact CB-CB 4.38Å; L438-A741 HydrophobicContact CD1-CB 4.16Å; V726-A741 WeakPolarHBondContact CG1-O 3.24Å; S727-A741 PolarHBondContact N-O 2.91Å; S727-A741 WeakPolarHBondContact OG-CB 3.05Å; S727-A741 PolarHBondContact OG-O 2.81Å; S727-A741 VanDerWaalsContact OG-O 3.06Å; T728-A741 HydrophobicContact CG2-CB 4.26Å; T728-A741 PolarHBondContact O-N 2.83Å
742	G	82.9	Confident	88.9	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.			trans	-101.1	11.4	-170.9	0	0	0	0	0	115.4	H722 G725 S744 D745 S747	H722-G742 PolarHBondContact CE1-N 3.22Å; H722-G742 VanDerWaalsContact CE1-N 3.32Å; H722-G742 VanDerWaalsContact ND1-CA 3.3Å; H722-G742 WeakPolarHBondContact ND1-CA 3.42Å; H722-G742 PolarHBondContact NE2-N 3.32Å; G725-G742 CarbonylContact O-C 3.58Å; G725-G742 WeakPolarHBondContact O-CA 3.14Å; G742-S744 VanDerWaalsContact C-N 3.35Å; G742-S744 PolarHBondContact O-N 2.66Å; G742-S744 PolarHBondContact O-OG 2.72Å; G742-D745 VanDerWaalsContact C-OD1 3.31Å; G742-D745 WeakPolarHBondContact CA-OD1 3.5Å; G742-D745 PolarHBondContact O-N 2.96Å; G742-S747 PolarHBondContact N-O 3.37Å
743	G	80.8	Confident	88.7	Confident	4 Å²	4	21.6 Å²	21.6	4%	0.041	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	54.2	-92.3	174.7	0	0	0	0	0	112.5	P434 L435 D745 S746	P434-G743 WeakPolarHBondContact CA-O 3.49Å; P434-G743 WeakPolarHBondContact CB-O 3.21Å; L435-G743 WeakPolarHBondContact O-CA 3.44Å; L435-G743 PolarHBondContact O-N 2.92Å; G743-D745 PolarHBondContact O-N 3.42Å; G743-S746 PolarHBondContact O-N 2.93Å
744	S	80.6	Confident	88.8	Confident	73 Å²	73	18.9 Å²	18.9	51%	0.51	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-27.5	-179.9	49.4	0	0	0	0	115.6	T724 G742 S746	T724-S744 WeakPolarHBondContact CB-OG 3.22Å; T724-S744 PolarHBondContact O-OG 3.44Å; T724-S744 PolarHBondContact OG1-OG 3.49Å; G742-S744 VanDerWaalsContact C-N 3.35Å; G742-S744 PolarHBondContact O-N 2.66Å; G742-S744 PolarHBondContact O-OG 2.72Å; S744-S746 VanDerWaalsContact C-N 3.25Å; S744-S746 PolarHBondContact O-N 2.82Å
745	D	79.6	Confident	88.9	Confident	17 Å²	17	19.7 Å²	19.7	9%	0.091	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	0.6	176.3	66.3	19.2	0	0	0	113.8	A99 H722 T724 G742 G743 S747	A99-D745 HydrophobicContact CB-CB 3.97Å; A99-D745 WeakPolarHBondContact CB-OD2 3.32Å; H722-D745 WeakPolarHBondContact CB-OD2 3.35Å; H722-D745 IonicContact CE1-OD2 3.96Å; H722-D745 IonicContact CG-OD2 2.79Å; H722-D745 IonicContact ND1-OD1 2.79Å; H722-D745 IonicContact ND1-OD2 3.56Å; H722-D745 PolarHBondContact ND1-OD2 3.15Å; T724-D745 WeakPolarHBondContact OG1-CB 3.36Å; G742-D745 VanDerWaalsContact C-OD1 3.31Å; G742-D745 WeakPolarHBondContact CA-OD1 3.5Å; G742-D745 PolarHBondContact O-N 2.96Å; G743-D745 PolarHBondContact O-N 3.42Å; D745-S747 PolarHBondContact O-N 3.03Å; D745-S747 WeakPolarHBondContact OD1-CB 3.32Å; D745-S747 PolarHBondContact OD1-N 2.88Å; D745-S747 PolarHBondContact OD1-OG 2.68Å; D745-S747 PolarHBondContact OD2-OG 3.2Å
746	S	83.3	Confident	88.8	Confident	5 Å²	5	25.3 Å²	25.3	4%	0.035	13%	0.132	C	C	.	.			trans	51.8	28.7	-179.8	-57.1	0	0	0	0	113.6	P434 G743 S744	P434-S746 WeakPolarHBondContact CD-OG 3.5Å; G743-S746 PolarHBondContact O-N 2.93Å; S744-S746 VanDerWaalsContact C-N 3.25Å; S744-S746 PolarHBondContact O-N 2.82Å
747	S	88.2	Confident	88.8	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.			trans	-120.9	153.1	-177.4	76.1	0	0	0	0	112	F75 S98 H722 G742 D745	F75-S747 CarbonylContact O-C 3.54Å; F75-S747 VanDerWaalsContact O-CA 3.25Å; F75-S747 WeakPolarHBondContact O-CA 3.42Å; F75-S747 WeakPolarHBondContact O-CB 3.37Å; S98-S747 WeakPolarHBondContact OG-CB 3.39Å; H722-S747 PolarHBondContact CE1-OG 2.82Å; H722-S747 VanDerWaalsContact CE1-OG 3.22Å; H722-S747 PolarHBondContact ND1-OG 2.87Å; G742-S747 PolarHBondContact N-O 3.37Å; D745-S747 PolarHBondContact O-N 3.03Å; D745-S747 WeakPolarHBondContact OD1-CB 3.32Å; D745-S747 PolarHBondContact OD1-N 2.88Å; D745-S747 PolarHBondContact OD1-OG 2.68Å; D745-S747 PolarHBondContact OD2-OG 3.2Å
748	A	91.2	Very high	88.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.7	165.1	0	0	0	0	0	109.7	F75 L435 L438 F449 T740	F75-A748 HydrophobicContact CB-CB 4.16Å; F75-A748 HydrophobicContact CD2-CB 4.07Å; F75-A748 WeakPolarHBondContact CD2-O 3.19Å; F75-A748 PolarHBondContact N-O 3.47Å; F75-A748 PolarHBondContact O-N 2.94Å; L435-A748 HydrophobicContact CD1-CB 3.74Å; L438-A748 HydrophobicContact CD1-CB 4.36Å; F449-A748 HydrophobicContact CD1-CB 4.16Å; F449-A748 HydrophobicContact CE1-CB 3.67Å; T740-A748 CarbonylContact O-C 3.09Å; T740-A748 WeakPolarHBondContact O-CA 3.31Å; T740-A748 WeakPolarHBondContact O-CB 3.49Å
749	L	92.4	Very high	88.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139	-174.6	-57.4	174.8	0	0	0	109.8	L71 V74 C721 H722 F739 T740 W751	L71-L749 HydrophobicContact CD1-CB 3.72Å; L71-L749 HydrophobicContact CD1-CD1 4.43Å; L71-L749 HydrophobicContact CD1-CD2 4.07Å; L71-L749 HydrophobicContact CD1-CG 4.28Å; L71-L749 HydrophobicContact CD2-CD2 4.47Å; V74-L749 HydrophobicContact CB-CD2 3.77Å; V74-L749 HydrophobicContact CG1-CD2 3.48Å; V74-L749 VanDerWaalsContact CG1-CD2 3.48Å; V74-L749 HydrophobicContact CG2-CD2 3.33Å; C721-L749 HydrophobicContact CB-CD1 4.33Å; C721-L749 WeakPolarHBondContact O-CD1 3.47Å; H722-L749 VanDerWaalsContact CE1-CD1 3.48Å; H722-L749 WeakPolarHBondContact CE1-CD1 3.47Å; H722-L749 VanDerWaalsContact CE1-CG 3.46Å; H722-L749 WeakPolarHBondContact CE1-CG 3.26Å; F739-L749 CarbonylContact C-O 3.59Å; F739-L749 VanDerWaalsContact CA-O 3.29Å; F739-L749 WeakPolarHBondContact CA-O 3.47Å; T740-L749 PolarHBondContact N-O 2.82Å; T740-L749 PolarHBondContact O-N 3.43Å; T740-L749 WeakPolarHBondContact OG1-CB 3.35Å; L749-W751 HydrophobicContact CB-CZ2 4.26Å; L749-W751 HydrophobicContact CD1-CZ2 3.7Å
750	S	93.2	Very high	87.9	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.007	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.2	173.5	-174	0	0	0	0	109.8	L71 E72 R73 F739	L71-S750 WeakPolarHBondContact CD1-O 3.42Å; E72-S750 PolarHBondContact N-O 3.31Å; R73-S750 PolarHBondContact N-O 3.1Å; R73-S750 PolarHBondContact O-N 2.82Å; F739-S750 WeakPolarHBondContact CE1-OG 3.19Å
751	W	93.4	Very high	87.6	Confident	1 Å²	1	27.8 Å²	27.8	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.3	-175.8	-58.3	87.1	0	0	0	109.8	L69 L71 L702 L719 C721 F737 V738 T740 L749	L69-W751 HydrophobicContact CB-CE3 4.26Å; L69-W751 HydrophobicContact CD2-CB 4.32Å; L71-W751 HydrophobicContact CB-CE3 3.89Å; L71-W751 HydrophobicContact CB-CH2 4.14Å; L71-W751 HydrophobicContact CB-CZ3 3.68Å; L71-W751 HydrophobicContact CD1-CD2 3.93Å; L71-W751 HydrophobicContact CD1-CE3 4.13Å; L71-W751 HydrophobicContact CD1-CH2 4.06Å; L71-W751 HydrophobicContact CD1-CZ2 3.84Å; L71-W751 HydrophobicContact CD1-CZ3 4.21Å; L71-W751 HydrophobicContact CD2-CH2 4.33Å; L71-W751 HydrophobicContact CG-CH2 4.4Å; L71-W751 HydrophobicContact CG-CZ3 4.38Å; L702-W751 HydrophobicContact CD2-CB 3.97Å; L702-W751 VanDerWaalsContact CD2-CD1 3.46Å; L702-W751 HydrophobicContact CD2-CD2 3.88Å; L702-W751 HydrophobicContact CD2-CG 3.49Å; L702-W751 VanDerWaalsContact CD2-CG 3.49Å; L719-W751 HydrophobicContact CD1-CZ3 4.42Å; C721-W751 HydrophobicContact CB-CH2 4.23Å; C721-W751 HydrophobicContact CB-CZ2 3.37Å; F737-W751 CarbonylContact C-O 3.6Å; F737-W751 WeakPolarHBondContact CA-O 3.11Å; V738-W751 HydrophobicContact CB-CB 4.38Å; V738-W751 PolarHBondContact N-O 3.37Å; V738-W751 WeakPolarHBondContact O-CB 3.39Å; V738-W751 PolarHBondContact O-N 3.28Å; T740-W751 PolarHBondContact OG1-NE1 2.95Å; T740-W751 VanDerWaalsContact OG1-NE1 3.11Å; L749-W751 HydrophobicContact CB-CZ2 4.26Å; L749-W751 HydrophobicContact CD1-CZ2 3.7Å
752	K	91.8	Very high	87.3	Confident	101 Å²	101	28.4 Å²	28.4	44%	0.439	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	130.1	169.1	-178.4	179.1	179.6	-179.7	0	110.1	S70 K736 F737	S70-K752 PolarHBondContact N-O 2.85Å; S70-K752 PolarHBondContact O-N 2.63Å; S70-K752 WeakPolarHBondContact OG-CB 3.37Å; S70-K752 PolarHBondContact OG-O 3.16Å; K736-K752 WeakPolarHBondContact O-CA 2.86Å; F737-K752 HydrophobicContact CD1-CB 4.07Å; F737-K752 HydrophobicContact CD1-CG 4.47Å; F737-K752 HydrophobicContact CE1-CB 3.88Å; F737-K752 HydrophobicContact CE1-CD 4.4Å; F737-K752 HydrophobicContact CE1-CG 4Å
753	V	90.9	Very high	87.5	Confident	13 Å²	13	32.2 Å²	32.2	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122	-177.3	175.5	0	0	0	0	109.7	L69 L681 L704 K736 V738 L755	L69-V753 HydrophobicContact CD2-CG2 4Å; L681-V753 HydrophobicContact CD1-CG1 4.14Å; L704-V753 HydrophobicContact CD1-CG1 3.76Å; L704-V753 HydrophobicContact CD2-CG1 4.42Å; K736-V753 WeakPolarHBondContact O-CB 3.05Å; K736-V753 PolarHBondContact O-N 3.4Å; V738-V753 HydrophobicContact CG2-CG2 3.63Å; V753-L755 HydrophobicContact CG1-CD2 3.37Å; V753-L755 HydrophobicContact CG1-CG 3.95Å
754	N	88.5	Confident	87.8	Confident	27 Å²	27	39.4 Å²	39.4	14%	0.144	24%	0.239	C	C	.	.			trans	-115.8	92.1	176.7	-56.8	-53.4	0	0	0	109.5	A65 H67 A68 S70 D756 V757	A65-N754 HydrophobicContact CB-CB 4.28Å; A65-N754 VanDerWaalsContact CB-ND2 3.33Å; A65-N754 WeakPolarHBondContact CB-ND2 3.38Å; H67-N754 PolarHBondContact O-ND2 3.25Å; A68-N754 PolarHBondContact O-N 2.86Å; S70-N754 PolarHBondContact OG-ND2 2.77Å; N754-D756 PolarHBondContact O-N 2.91Å; N754-V757 HydrophobicContact CB-CG2 4.09Å
755	L	87.6	Confident	87.7	Confident	39 Å²	39	36.5 Å²	36.5	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-35.8	-175.7	-56.8	178.7	0	0	0	112.5	L681 H693 V753 V757 L758 D759	L681-L755 HydrophobicContact CD1-CD2 4.34Å; H693-L755 HydrophobicContact CB-CD2 4.03Å; V753-L755 HydrophobicContact CG1-CD2 3.37Å; V753-L755 HydrophobicContact CG1-CG 3.95Å; L755-V757 PolarHBondContact O-N 2.84Å; L755-L758 WeakPolarHBondContact O-CB 3.43Å; L755-L758 PolarHBondContact O-N 3.42Å; L755-D759 PolarHBondContact O-N 2.8Å
756	D	86	Confident	87.8	Confident	126 Å²	126	37 Å²	37	67%	0.674	23%	0.229	S	C	*	.	H	α-helix	trans	-60.7	-33.7	-177.7	-59.7	-29.6	0	0	0	112.6	N754 A760	N754-D756 PolarHBondContact O-N 2.91Å; D756-A760 VanDerWaalsContact O-CB 3.29Å; D756-A760 WeakPolarHBondContact O-CB 3.41Å; D756-A760 PolarHBondContact O-N 2.88Å
757	V	87	Confident	87.6	Confident	40 Å²	40	39.7 Å²	39.7	24%	0.242	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-38.6	178.1	-179.2	0	0	0	0	110.6	A65 N754 L755 A760 A761	A65-V757 HydrophobicContact CB-CG2 4.39Å; A65-V757 WeakPolarHBondContact O-CG2 3.34Å; N754-V757 HydrophobicContact CB-CG2 4.09Å; L755-V757 PolarHBondContact O-N 2.84Å; V757-A760 PolarHBondContact O-N 3.24Å; V757-A761 WeakPolarHBondContact O-CB 3.49Å; V757-A761 PolarHBondContact O-N 3.36Å
758	L	86.9	Confident	87.3	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-70.5	-42.6	177.9	-171.7	62.3	0	0	0	111.2	A68 L704 I706 L755 A760 A761 A762	A68-L758 HydrophobicContact CB-CB 4.01Å; A68-L758 HydrophobicContact CB-CD1 4.43Å; L704-L758 HydrophobicContact CB-CD2 3.77Å; I706-L758 HydrophobicContact CD1-CD2 4.24Å; I706-L758 HydrophobicContact CD1-CG 3.83Å; I706-L758 HydrophobicContact CG1-CD2 3.68Å; I706-L758 HydrophobicContact CG1-CG 3.85Å; L755-L758 WeakPolarHBondContact O-CB 3.43Å; L755-L758 PolarHBondContact O-N 3.42Å; L758-A760 VanDerWaalsContact C-N 3.3Å; L758-A760 PolarHBondContact O-N 2.99Å; L758-A761 PolarHBondContact O-N 3.37Å; L758-A762 WeakPolarHBondContact O-CB 3.41Å; L758-A762 PolarHBondContact O-N 3Å
759	D	87.8	Confident	87	Confident	42 Å²	42	46.8 Å²	46.8	23%	0.225	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-40.4	174.4	-77.9	-26.1	0	0	0	111	H693 I706 L755 A762 A763	H693-D759 IonicContact NE2-OD1 3.19Å; I706-D759 VanDerWaalsContact CD1-OD1 3.3Å; I706-D759 WeakPolarHBondContact CD1-OD1 3.4Å; L755-D759 PolarHBondContact O-N 2.8Å; D759-A762 PolarHBondContact O-N 3.11Å; D759-A763 WeakPolarHBondContact O-CB 3.39Å; D759-A763 PolarHBondContact O-N 3.3Å
760	A	87.8	Confident	86.6	Confident	51 Å²	51	51 Å²	51	42%	0.421	31%	0.312	S	S	.	.	H	α-helix	trans	-65.5	-42.4	174.4	0	0	0	0	0	112.5	D756 V757 L758 A762 A763 L764	D756-A760 VanDerWaalsContact O-CB 3.29Å; D756-A760 WeakPolarHBondContact O-CB 3.41Å; D756-A760 PolarHBondContact O-N 2.88Å; V757-A760 PolarHBondContact O-N 3.24Å; L758-A760 VanDerWaalsContact C-N 3.3Å; L758-A760 PolarHBondContact O-N 2.99Å; A760-A762 VanDerWaalsContact C-N 3.34Å; A760-A762 PolarHBondContact O-N 3.19Å; A760-A763 PolarHBondContact O-N 2.84Å; A760-L764 WeakPolarHBondContact O-CG 3.25Å; A760-L764 PolarHBondContact O-N 2.91Å
761	A	87	Confident	86.2	Confident	41 Å²	41	51 Å²	51	34%	0.339	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-41.8	176	0	0	0	0	0	111.8	V757 L758 A763 L764 G765	V757-A761 WeakPolarHBondContact O-CB 3.49Å; V757-A761 PolarHBondContact O-N 3.36Å; L758-A761 PolarHBondContact O-N 3.37Å; A761-A763 VanDerWaalsContact C-N 3.33Å; A761-A763 PolarHBondContact O-N 3.47Å; A761-L764 PolarHBondContact O-N 3.08Å; A761-G765 PolarHBondContact O-N 3.35Å; A761-G765 VanDerWaalsContact O-N 3.14Å
762	A	87.1	Confident	85.9	Confident	14 Å²	14	51.2 Å²	51.2	12%	0.116	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-38.6	175.2	0	0	0	0	0	112.2	I706 Y714 K715 L758 D759 A760 G765	I706-A762 HydrophobicContact CD1-CB 3.83Å; Y714-A762 WeakPolarHBondContact O-CA 3.29Å; K715-A762 HydrophobicContact CG-CB 4Å; L758-A762 WeakPolarHBondContact O-CB 3.41Å; L758-A762 PolarHBondContact O-N 3Å; D759-A762 PolarHBondContact O-N 3.11Å; A760-A762 VanDerWaalsContact C-N 3.34Å; A760-A762 PolarHBondContact O-N 3.19Å; A762-G765 PolarHBondContact O-N 2.92Å
763	A	86.9	Confident	85.6	Confident	79 Å²	79	47.1 Å²	47.1	65%	0.653	30%	0.295	S	S	*	.	H	α-helix	trans	-68.4	-35.1	176	0	0	0	0	0	112.9	D759 A760 A761 G765	D759-A763 WeakPolarHBondContact O-CB 3.39Å; D759-A763 PolarHBondContact O-N 3.3Å; A760-A763 PolarHBondContact O-N 2.84Å; A761-A763 VanDerWaalsContact C-N 3.33Å; A761-A763 PolarHBondContact O-N 3.47Å; A763-G765 VanDerWaalsContact C-N 3.3Å
764	L	86.3	Confident	85.3	Confident	156 Å²	156	49.6 Å²	49.6	82%	0.817	31%	0.312	S	S	*	.	H	α-helix	trans	-70.3	-25.3	175.7	-71.7	171.7	0	0	0	113	A760 A761 G766	A760-L764 WeakPolarHBondContact O-CG 3.25Å; A760-L764 PolarHBondContact O-N 2.91Å; A761-L764 PolarHBondContact O-N 3.08Å; L764-G766 PolarHBondContact O-N 2.88Å
765	G	79.5	Confident	85.2	Confident	12 Å²	12	50.4 Å²	50.4	12%	0.124	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.3	177.6	0	0	0	0	0	115.2	A761 A762 A763	A761-G765 PolarHBondContact O-N 3.35Å; A761-G765 VanDerWaalsContact O-N 3.14Å; A762-G765 PolarHBondContact O-N 2.92Å; A763-G765 VanDerWaalsContact C-N 3.3Å
766	G	81.6	Confident	85.2	Confident	26 Å²	26	48.9 Å²	48.9	27%	0.268	31%	0.308	S	S	.	.			trans	95.2	166.9	-177.9	0	0	0	0	0	113.4	L764	L764-G766 PolarHBondContact O-N 2.88Å
767	A	79.4	Confident	85	Confident	63 Å²	63	50.3 Å²	50.3	52%	0.521	31%	0.311	S	S	.	.	S	Bend	trans	-100.8	151.2	-177.5	0	0	0	0	0	111.2	M769 D770	A767-M769 PolarHBondContact O-N 3.35Å; A767-D770 PolarHBondContact O-N 3.27Å
768	D	80.9	Confident	84.7	Confident	137 Å²	137	51.6 Å²	51.6	73%	0.733	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-93.7	172.8	-58.3	-39.6	0	0	0	115.4	F772	D768-F772 VanDerWaalsContact O-CD2 3.27Å; D768-F772 WeakPolarHBondContact O-CD2 3.41Å; D768-F772 VanDerWaalsContact O-CE2 3.3Å; D768-F772 WeakPolarHBondContact O-CE2 3.42Å
769	M	84.1	Confident	84.7	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.059	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-22.1	-172.6	-72.3	-60.2	-68.5	0	0	114.3	A767 P771 F772 Y773 E860 I863 K864	A767-M769 PolarHBondContact O-N 3.35Å; M769-P771 VanDerWaalsContact C-CD 3.44Å; M769-P771 VanDerWaalsContact C-N 3.31Å; M769-F772 PolarHBondContact O-N 2.93Å; M769-F772 HydrophobicContact SD-CD2 4.43Å; M769-Y773 HydrophobicContact CB-CD2 4.11Å; M769-Y773 HydrophobicContact CB-CE2 3.46Å; M769-Y773 VanDerWaalsContact CB-CE2 3.46Å; M769-Y773 HydrophobicContact CE-CE1 3.97Å; M769-Y773 HydrophobicContact CG-CE2 4.5Å; M769-Y773 WeakPolarHBondContact O-CD2 3.36Å; M769-Y773 PolarHBondContact O-N 3.47Å; M769-Y773 VanDerWaalsContact O-N 3.09Å; M769-E860 HydrophobicContact CE-CB 3.95Å; M769-E860 HydrophobicContact CE-CG 4.26Å; M769-E860 HydrophobicContact CG-CB 4.35Å; M769-E860 HydrophobicContact CG-CG 4.27Å; M769-E860 HydrophobicContact SD-CB 3.97Å; M769-E860 HydrophobicContact SD-CG 4.47Å; M769-I863 HydrophobicContact CE-CB 4.1Å; M769-I863 HydrophobicContact CE-CD1 4.46Å; M769-I863 HydrophobicContact CE-CG2 3.98Å; M769-K864 HydrophobicContact SD-CD 4.25Å; M769-K864 WeakPolarHBondContact SD-CE 3.3Å; M769-K864 HydrophobicContact SD-CG 4.1Å
770	D	84.7	Confident	84.6	Confident	89 Å²	89	57.2 Å²	57.2	48%	0.476	36%	0.356	S	S	.	.	H	α-helix	trans	-53.5	-42.6	-175.7	-61.1	-31.3	0	0	0	113	A767 F772 Y773 S774	A767-D770 PolarHBondContact O-N 3.27Å; D770-F772 VanDerWaalsContact C-N 3.34Å; D770-F772 PolarHBondContact O-N 3.33Å; D770-Y773 PolarHBondContact O-N 3.01Å; D770-S774 PolarHBondContact O-N 2.79Å
771	P	85.2	Confident	84.5	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-61.5	-39.3	176	-26.1	36.4	0	0	0	113.8	N712 Y714 M769 S774	N712-P771 HydrophobicContact CB-CB 4.5Å; N712-P771 WeakPolarHBondContact ND2-CG 3.27Å; N712-P771 WeakPolarHBondContact OD1-CB 3.12Å; Y714-P771 HydrophobicContact CD2-CB 3.95Å; Y714-P771 HydrophobicContact CD2-CG 4.35Å; Y714-P771 HydrophobicContact CE2-CB 4.24Å; M769-P771 VanDerWaalsContact C-CD 3.44Å; M769-P771 VanDerWaalsContact C-N 3.31Å; P771-S774 WeakPolarHBondContact O-CB 3.18Å; P771-S774 PolarHBondContact O-N 2.81Å; P771-S774 PolarHBondContact O-OG 2.89Å
772	F	86.1	Confident	84.6	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.018	36%	0.361	C	S	.	.	H	α-helix	trans	-72.4	-35.1	-176.6	-63.7	-79.1	0	0	0	111.6	D710 D768 M769 D770 S774 L775 K864 I867	D710-F772 WeakPolarHBondContact O-CE1 3.36Å; D710-F772 WeakPolarHBondContact O-CZ 3.44Å; D768-F772 VanDerWaalsContact O-CD2 3.27Å; D768-F772 WeakPolarHBondContact O-CD2 3.41Å; D768-F772 VanDerWaalsContact O-CE2 3.3Å; D768-F772 WeakPolarHBondContact O-CE2 3.42Å; M769-F772 PolarHBondContact O-N 2.93Å; M769-F772 HydrophobicContact SD-CD2 4.43Å; D770-F772 VanDerWaalsContact C-N 3.34Å; D770-F772 PolarHBondContact O-N 3.33Å; F772-S774 PolarHBondContact O-N 2.75Å; F772-L775 WeakPolarHBondContact O-CB 3.46Å; F772-L775 PolarHBondContact O-N 2.94Å; F772-L775 VanDerWaalsContact O-N 3.14Å; F772-K864 HydrophobicContact CD1-CG 4.3Å; F772-K864 HydrophobicContact CD2-CG 4.26Å; F772-K864 HydrophobicContact CE1-CG 4.35Å; F772-K864 HydrophobicContact CE2-CD 4.35Å; F772-K864 HydrophobicContact CE2-CG 4.31Å; F772-K864 HydrophobicContact CG-CG 4.26Å; F772-K864 HydrophobicContact CZ-CD 4.49Å; F772-K864 HydrophobicContact CZ-CG 4.35Å; F772-I867 HydrophobicContact CB-CD1 3.8Å; F772-I867 HydrophobicContact CD1-CD1 4.23Å; F772-I867 VanDerWaalsContact O-CD1 3.29Å; F772-I867 WeakPolarHBondContact O-CD1 3.43Å
773	Y	87.5	Confident	84.7	Confident	16 Å²	16	69.5 Å²	69.5	6%	0.063	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-32.9	173.5	-63.9	-47	0	0	0	112	M769 D770 L775 I776 G779 R780 Y785 I863	M769-Y773 HydrophobicContact CB-CD2 4.11Å; M769-Y773 HydrophobicContact CB-CE2 3.46Å; M769-Y773 VanDerWaalsContact CB-CE2 3.46Å; M769-Y773 HydrophobicContact CE-CE1 3.97Å; M769-Y773 HydrophobicContact CG-CE2 4.5Å; M769-Y773 WeakPolarHBondContact O-CD2 3.36Å; M769-Y773 PolarHBondContact O-N 3.47Å; M769-Y773 VanDerWaalsContact O-N 3.09Å; D770-Y773 PolarHBondContact O-N 3.01Å; Y773-L775 PolarHBondContact O-N 3.22Å; Y773-I776 HydrophobicContact CD1-CD1 4.18Å; Y773-I776 PolarHBondContact O-N 2.84Å; Y773-I776 VanDerWaalsContact O-N 3.09Å; Y773-G779 WeakPolarHBondContact O-CA 3.45Å; Y773-R780 HydrophobicContact CD1-CB 4.3Å; Y773-R780 HydrophobicContact CD2-CB 4.28Å; Y773-R780 HydrophobicContact CG-CB 4.04Å; Y773-Y785 HydrophobicContact CD1-CD2 4.41Å; Y773-Y785 HydrophobicContact CD1-CE2 4.28Å; Y773-Y785 HydrophobicContact CE1-CD2 4.23Å; Y773-Y785 AromaticContact CE1-CE2 3.67Å; Y773-Y785 HydrophobicContact CE1-CE2 3.67Å; Y773-I863 HydrophobicContact CE1-CD1 4.15Å
774	S	84.6	Confident	84.8	Confident	64 Å²	64	67.8 Å²	67.8	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-24.1	177.2	81.5	0	0	0	0	113.4	D770 P771 F772 I776	D770-S774 PolarHBondContact O-N 2.79Å; P771-S774 WeakPolarHBondContact O-CB 3.18Å; P771-S774 PolarHBondContact O-N 2.81Å; P771-S774 PolarHBondContact O-OG 2.89Å; F772-S774 PolarHBondContact O-N 2.75Å; S774-I776 VanDerWaalsContact C-N 3.35Å
775	L	85.2	Confident	85	Confident	45 Å²	45	61.1 Å²	61.1	24%	0.236	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-13.1	176.4	-65.5	175.7	0	0	0	113	L667 P713 F772 Y773 I867 R870	L667-L775 HydrophobicContact CD2-CD1 4.33Å; P713-L775 HydrophobicContact CB-CD2 4.39Å; P713-L775 HydrophobicContact CG-CD1 4.22Å; P713-L775 HydrophobicContact CG-CD2 4.02Å; P713-L775 HydrophobicContact CG-CG 4.16Å; F772-L775 WeakPolarHBondContact O-CB 3.46Å; F772-L775 PolarHBondContact O-N 2.94Å; F772-L775 VanDerWaalsContact O-N 3.14Å; Y773-L775 PolarHBondContact O-N 3.22Å; L775-I867 HydrophobicContact CB-CD1 4.37Å; L775-I867 HydrophobicContact CB-CG2 4.34Å; L775-I867 HydrophobicContact CD1-CG2 3.63Å; L775-R870 PolarHBondContact O-NH2 3.06Å
776	I	86.9	Confident	85.5	Confident	6 Å²	6	66.3 Å²	66.3	3%	0.031	36%	0.355	C	S	.	.	S	Bend	trans	-87.3	138.4	178	-56.5	179.5	0	0	0	108.9	Y773 S774 G778 G779 F784 Y785 M788 I863 I867	Y773-I776 HydrophobicContact CD1-CD1 4.18Å; Y773-I776 PolarHBondContact O-N 2.84Å; Y773-I776 VanDerWaalsContact O-N 3.09Å; S774-I776 VanDerWaalsContact C-N 3.35Å; I776-G778 PolarHBondContact O-N 3.13Å; I776-G779 PolarHBondContact O-N 3.19Å; I776-F784 HydrophobicContact CG2-CD1 3.59Å; I776-F784 HydrophobicContact CG2-CE1 4.23Å; I776-Y785 HydrophobicContact CD1-CD2 4.38Å; I776-M788 HydrophobicContact CD1-SD 4.47Å; I776-I863 HydrophobicContact CD1-CG2 3.73Å; I776-I867 HydrophobicContact CD1-CD1 4.37Å; I776-I867 HydrophobicContact CG1-CD1 4.02Å
777	E	82.7	Confident	85.9	Confident	157 Å²	157	69.5 Å²	69.5	73%	0.734	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	122.7	177	-67	-175.2	-176.5	0	0	111.3	G779	E777-G779 VanDerWaalsContact C-N 3.25Å; E777-G779 PolarHBondContact O-N 3.14Å
778	G	81.1	Confident	86.4	Confident	67 Å²	67	66.5 Å²	66.5	69%	0.691	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	2.7	-176.7	0	0	0	0	0	115	I776 G782	I776-G778 PolarHBondContact O-N 3.13Å; G778-G782 WeakPolarHBondContact O-CA 3.24Å; G778-G782 PolarHBondContact O-N 2.89Å
779	G	87.2	Confident	86.8	Confident	19 Å²	19	62.9 Å²	62.9	20%	0.196	32%	0.316	C	S	.	.			trans	68	-162.5	177.7	0	0	0	0	0	114.1	Y773 I776 E777 D781 G782	Y773-G779 WeakPolarHBondContact O-CA 3.45Å; I776-G779 PolarHBondContact O-N 3.19Å; E777-G779 VanDerWaalsContact C-N 3.25Å; E777-G779 PolarHBondContact O-N 3.14Å; G779-D781 VanDerWaalsContact C-N 3.31Å; G779-D781 PolarHBondContact O-N 2.86Å; G779-G782 PolarHBondContact O-N 2.89Å; G779-G782 VanDerWaalsContact O-N 3.1Å
780	R	84.9	Confident	87.1	Confident	143 Å²	143	67.5 Å²	67.5	54%	0.54	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-37.6	180	-175.4	179.2	179.1	173.8	2.9	113.2	Y773 G782 Y785	Y773-R780 HydrophobicContact CD1-CB 4.3Å; Y773-R780 HydrophobicContact CD2-CB 4.28Å; Y773-R780 HydrophobicContact CG-CB 4.04Å; R780-G782 VanDerWaalsContact C-N 3.26Å; R780-G782 PolarHBondContact O-N 2.92Å; R780-Y785 HydrophobicContact CG-CE1 4.43Å; R780-Y785 WeakPolarHBondContact O-CD1 3.39Å; R780-Y785 VanDerWaalsContact O-CG 3.29Å
781	D	85.6	Confident	87.4	Confident	144 Å²	144	66.9 Å²	66.9	77%	0.77	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	4.7	179.9	-62.6	-43.7	0	0	0	113	G779	G779-D781 VanDerWaalsContact C-N 3.31Å; G779-D781 PolarHBondContact O-N 2.86Å
782	G	88.4	Confident	87.6	Confident	8 Å²	8	67 Å²	67	8%	0.082	34%	0.335	C	S	.	.	S	Bend	trans	-66.7	158.2	-179.5	0	0	0	0	0	113.2	G778 G779 R780 F784 Y785 K786	G778-G782 WeakPolarHBondContact O-CA 3.24Å; G778-G782 PolarHBondContact O-N 2.89Å; G779-G782 PolarHBondContact O-N 2.89Å; G779-G782 VanDerWaalsContact O-N 3.1Å; R780-G782 VanDerWaalsContact C-N 3.26Å; R780-G782 PolarHBondContact O-N 2.92Å; G782-F784 VanDerWaalsContact C-N 3.3Å; G782-F784 PolarHBondContact O-N 3.11Å; G782-Y785 PolarHBondContact O-N 3.08Å; G782-K786 PolarHBondContact O-N 3.21Å
783	R	89.8	Confident	87.6	Confident	212 Å²	212	71.3 Å²	71.3	80%	0.8	35%	0.354	S	S	*	.	H	α-helix	trans	-61.9	-41.4	174.7	-66.5	-177.4	-177.3	177.2	1.1	111.5	Y785 K786 E787	R783-Y785 VanDerWaalsContact C-N 3.34Å; R783-Y785 PolarHBondContact O-N 3.39Å; R783-K786 WeakPolarHBondContact O-CB 3.47Å; R783-K786 PolarHBondContact O-N 3.15Å; R783-K786 VanDerWaalsContact O-N 3.13Å; R783-E787 WeakPolarHBondContact O-CG 3.11Å; R783-E787 PolarHBondContact O-N 3.46Å
784	F	88.7	Confident	87.6	Confident	42 Å²	42	76.4 Å²	76.4	18%	0.184	37%	0.374	C	S	.	.	H	α-helix	trans	-64.9	-36.5	-178.1	-173.9	-118.6	0	0	0	113	I776 G782 E787 M788 L826 Y866	I776-F784 HydrophobicContact CG2-CD1 3.59Å; I776-F784 HydrophobicContact CG2-CE1 4.23Å; G782-F784 VanDerWaalsContact C-N 3.3Å; G782-F784 PolarHBondContact O-N 3.11Å; F784-E787 WeakPolarHBondContact O-CB 3.27Å; F784-E787 PolarHBondContact O-N 3.28Å; F784-M788 HydrophobicContact CD1-CE 4.05Å; F784-M788 HydrophobicContact CE1-CE 3.23Å; F784-M788 HydrophobicContact CE1-SD 4.24Å; F784-M788 HydrophobicContact CZ-CE 3.54Å; F784-M788 WeakPolarHBondContact O-CG 3.43Å; F784-M788 PolarHBondContact O-N 3.26Å; F784-L826 HydrophobicContact CE2-CD2 4.21Å; F784-L826 HydrophobicContact CZ-CD2 4.39Å; F784-Y866 HydrophobicContact CE1-CE1 4.17Å; F784-Y866 HydrophobicContact CZ-CE1 4.23Å
785	Y	90.6	Very high	87.6	Confident	17 Å²	17	73.8 Å²	73.8	7%	0.067	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-40.5	172.9	177.2	-90.7	0	0	0	111.9	Y773 I776 R780 G782 R783 E787 M788 E789 I863	Y773-Y785 HydrophobicContact CD1-CD2 4.41Å; Y773-Y785 HydrophobicContact CD1-CE2 4.28Å; Y773-Y785 HydrophobicContact CE1-CD2 4.23Å; Y773-Y785 AromaticContact CE1-CE2 3.67Å; Y773-Y785 HydrophobicContact CE1-CE2 3.67Å; I776-Y785 HydrophobicContact CD1-CD2 4.38Å; R780-Y785 HydrophobicContact CG-CE1 4.43Å; R780-Y785 WeakPolarHBondContact O-CD1 3.39Å; R780-Y785 VanDerWaalsContact O-CG 3.29Å; G782-Y785 PolarHBondContact O-N 3.08Å; R783-Y785 VanDerWaalsContact C-N 3.34Å; R783-Y785 PolarHBondContact O-N 3.39Å; Y785-E787 VanDerWaalsContact C-N 3.33Å; Y785-E787 PolarHBondContact O-N 3.41Å; Y785-M788 WeakPolarHBondContact O-CB 3.48Å; Y785-M788 PolarHBondContact O-N 3.41Å; Y785-E789 HydrophobicContact CD1-CG 4.4Å; Y785-E789 HydrophobicContact CE1-CG 3.8Å; Y785-E789 WeakPolarHBondContact CE1-OE1 3.36Å; Y785-E789 PolarHBondContact O-N 3.38Å; Y785-E789 PolarHBondContact OH-OE1 3.21Å; Y785-I863 HydrophobicContact CD2-CD1 4.18Å; Y785-I863 HydrophobicContact CE2-CD1 3.57Å
786	K	89.8	Confident	87.5	Confident	121 Å²	121	72.1 Å²	72.1	53%	0.526	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-39.5	174.8	-66.5	178.6	-177.9	176.8	0	111.9	G782 R783 M788 E789 D790	G782-K786 PolarHBondContact O-N 3.21Å; R783-K786 WeakPolarHBondContact O-CB 3.47Å; R783-K786 PolarHBondContact O-N 3.15Å; R783-K786 VanDerWaalsContact O-N 3.13Å; K786-M788 VanDerWaalsContact C-N 3.33Å; K786-M788 PolarHBondContact O-N 3.15Å; K786-E789 PolarHBondContact O-N 3.1Å; K786-D790 WeakPolarHBondContact O-CB 3.49Å; K786-D790 PolarHBondContact O-N 3.36Å
787	E	90.1	Very high	87.3	Confident	92 Å²	92	75 Å²	75	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-41.7	173.5	-70.5	168	-170.1	0	0	111.5	R783 F784 Y785 D790 F791	R783-E787 WeakPolarHBondContact O-CG 3.11Å; R783-E787 PolarHBondContact O-N 3.46Å; F784-E787 WeakPolarHBondContact O-CB 3.27Å; F784-E787 PolarHBondContact O-N 3.28Å; Y785-E787 VanDerWaalsContact C-N 3.33Å; Y785-E787 PolarHBondContact O-N 3.41Å; E787-D790 PolarHBondContact O-N 2.85Å; E787-F791 HydrophobicContact CB-CD2 4.47Å; E787-F791 HydrophobicContact CB-CE2 4.31Å; E787-F791 WeakPolarHBondContact O-CD2 3.24Å; E787-F791 WeakPolarHBondContact O-CG 3.5Å; E787-F791 PolarHBondContact O-N 3.42Å
788	M	90.4	Very high	87.3	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-59.1	-45.4	172.7	-74.3	179.2	165.5	0	0	112.6	I776 F784 Y785 K786 F792 L826 I863 Y866	I776-M788 HydrophobicContact CD1-SD 4.47Å; F784-M788 HydrophobicContact CD1-CE 4.05Å; F784-M788 HydrophobicContact CE1-CE 3.23Å; F784-M788 HydrophobicContact CE1-SD 4.24Å; F784-M788 HydrophobicContact CZ-CE 3.54Å; F784-M788 WeakPolarHBondContact O-CG 3.43Å; F784-M788 PolarHBondContact O-N 3.26Å; Y785-M788 WeakPolarHBondContact O-CB 3.48Å; Y785-M788 PolarHBondContact O-N 3.41Å; K786-M788 VanDerWaalsContact C-N 3.33Å; K786-M788 PolarHBondContact O-N 3.15Å; M788-F792 VanDerWaalsContact O-CB 3.28Å; M788-F792 WeakPolarHBondContact O-CB 3.35Å; M788-F792 PolarHBondContact O-N 2.99Å; M788-L826 HydrophobicContact CB-CD2 4.33Å; M788-L826 HydrophobicContact CE-CD1 3.93Å; M788-L826 HydrophobicContact CE-CD2 4.38Å; M788-L826 HydrophobicContact CG-CD1 3.82Å; M788-L826 HydrophobicContact CG-CD2 3.47Å; M788-L826 VanDerWaalsContact CG-CD2 3.47Å; M788-L826 HydrophobicContact CG-CG 4.3Å; M788-I863 HydrophobicContact SD-CG1 4.49Å; M788-Y866 HydrophobicContact CE-CD1 3.32Å; M788-Y866 HydrophobicContact CE-CD2 4.34Å; M788-Y866 HydrophobicContact CE-CE1 3.23Å; M788-Y866 HydrophobicContact CE-CE2 4.3Å; M788-Y866 HydrophobicContact CE-CG 3.91Å
789	E	90.1	Very high	87.3	Confident	60 Å²	60	75.2 Å²	75.2	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-60	-48.9	175.3	-78.6	-171.9	162.8	0	0	111.2	Y785 K786 F791 F792 F793 L859	Y785-E789 HydrophobicContact CD1-CG 4.4Å; Y785-E789 HydrophobicContact CE1-CG 3.8Å; Y785-E789 WeakPolarHBondContact CE1-OE1 3.36Å; Y785-E789 PolarHBondContact O-N 3.38Å; Y785-E789 PolarHBondContact OH-OE1 3.21Å; K786-E789 PolarHBondContact O-N 3.1Å; E789-F791 PolarHBondContact O-N 3.23Å; E789-F792 WeakPolarHBondContact O-CB 3.48Å; E789-F792 PolarHBondContact O-N 3.44Å; E789-F793 HydrophobicContact CB-CE2 4.22Å; E789-F793 WeakPolarHBondContact O-CD2 3.14Å; E789-F793 PolarHBondContact O-N 2.88Å; E789-L859 HydrophobicContact CG-CD2 3.67Å
790	D	90.2	Very high	86.7	Confident	109 Å²	109	77.6 Å²	77.6	58%	0.583	34%	0.344	S	S	*	.	H	α-helix	trans	-60.9	-44	-179.6	-73.2	-20.9	0	0	0	112	K786 E787 F793 Y794	K786-D790 WeakPolarHBondContact O-CB 3.49Å; K786-D790 PolarHBondContact O-N 3.36Å; E787-D790 PolarHBondContact O-N 2.85Å; D790-F793 PolarHBondContact O-N 3.23Å; D790-Y794 WeakPolarHBondContact O-CB 3.48Å; D790-Y794 PolarHBondContact O-N 2.9Å
791	F	90	Very high	86.1	Confident	76 Å²	76	72.4 Å²	72.4	33%	0.333	34%	0.335	S	S	.	.	H	α-helix	trans	-67.1	-37.3	175.7	-72.5	-56.1	0	0	0	112.4	E787 E789 Y794 C795 L822 A825 L826	E787-F791 HydrophobicContact CB-CD2 4.47Å; E787-F791 HydrophobicContact CB-CE2 4.31Å; E787-F791 WeakPolarHBondContact O-CD2 3.24Å; E787-F791 WeakPolarHBondContact O-CG 3.5Å; E787-F791 PolarHBondContact O-N 3.42Å; E789-F791 PolarHBondContact O-N 3.23Å; F791-Y794 WeakPolarHBondContact O-CB 3.38Å; F791-Y794 PolarHBondContact O-N 2.9Å; F791-C795 PolarHBondContact O-N 3.39Å; F791-L822 HydrophobicContact CB-CD1 3.39Å; F791-A825 HydrophobicContact CD1-CB 4.21Å; F791-A825 HydrophobicContact CE1-CB 4.32Å; F791-A825 HydrophobicContact CG-CB 4.35Å; F791-L826 HydrophobicContact CD2-CD2 3.81Å; F791-L826 HydrophobicContact CE2-CD2 4.32Å
792	F	89.4	Confident	85.1	Confident	5 Å²	5	70.2 Å²	70.2	2%	0.022	33%	0.328	C	S	.	.	H	α-helix	trans	-61.9	-44.7	175.2	-170.7	-89.1	0	0	0	110.9	M788 E789 Y794 C795 Q796 I814 L822 L859 F862	M788-F792 VanDerWaalsContact O-CB 3.28Å; M788-F792 WeakPolarHBondContact O-CB 3.35Å; M788-F792 PolarHBondContact O-N 2.99Å; E789-F792 WeakPolarHBondContact O-CB 3.48Å; E789-F792 PolarHBondContact O-N 3.44Å; F792-Y794 VanDerWaalsContact C-N 3.34Å; F792-Y794 PolarHBondContact O-N 3.29Å; F792-C795 PolarHBondContact O-N 2.85Å; F792-Q796 PolarHBondContact O-N 3.23Å; F792-I814 HydrophobicContact CD1-CG2 4.17Å; F792-I814 HydrophobicContact CD2-CD1 3.84Å; F792-I814 HydrophobicContact CD2-CG1 4.32Å; F792-I814 HydrophobicContact CD2-CG2 4.16Å; F792-I814 HydrophobicContact CE1-CG2 3.85Å; F792-I814 HydrophobicContact CE2-CB 4.28Å; F792-I814 HydrophobicContact CE2-CD1 3.53Å; F792-I814 HydrophobicContact CE2-CG1 3.58Å; F792-I814 HydrophobicContact CE2-CG2 3.82Å; F792-I814 HydrophobicContact CG-CG2 4.33Å; F792-I814 HydrophobicContact CZ-CB 4.25Å; F792-I814 HydrophobicContact CZ-CD1 4.34Å; F792-I814 HydrophobicContact CZ-CG1 3.92Å; F792-I814 HydrophobicContact CZ-CG2 3.65Å; F792-L822 HydrophobicContact CB-CD2 4.46Å; F792-L822 HydrophobicContact CD2-CD2 3.83Å; F792-L859 HydrophobicContact CB-CD1 3.9Å; F792-L859 HydrophobicContact CD1-CB 4.42Å; F792-L859 HydrophobicContact CD1-CD1 4.34Å; F792-L859 HydrophobicContact CD2-CB 4.43Å; F792-L859 HydrophobicContact CD2-CD1 3.74Å; F792-L859 HydrophobicContact CE1-CB 4.2Å; F792-L859 HydrophobicContact CE2-CB 4.21Å; F792-L859 HydrophobicContact CE2-CD1 4.32Å; F792-L859 HydrophobicContact CG-CD1 3.75Å; F792-L859 HydrophobicContact CZ-CB 4.09Å; F792-F862 HydrophobicContact CE2-CB 4.38Å
793	F	86.2	Confident	83.7	Confident	93 Å²	93	77.5 Å²	77.5	41%	0.408	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-39.8	173.3	-71.3	-58	0	0	0	112.2	E789 D790 C795 Q796 I797 V810	E789-F793 HydrophobicContact CB-CE2 4.22Å; E789-F793 WeakPolarHBondContact O-CD2 3.14Å; E789-F793 PolarHBondContact O-N 2.88Å; D790-F793 PolarHBondContact O-N 3.23Å; F793-C795 PolarHBondContact O-N 3.08Å; F793-Q796 WeakPolarHBondContact O-CB 3.34Å; F793-Q796 PolarHBondContact O-N 3.02Å; F793-I797 PolarHBondContact O-N 2.73Å; F793-V810 HydrophobicContact CD1-CG1 4.28Å; F793-V810 HydrophobicContact CE1-CG1 4.06Å
794	Y	87.2	Confident	82.3	Confident	124 Å²	124	73.4 Å²	73.4	49%	0.486	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-41.8	176.8	-178.6	-103.4	0	0	0	112.4	D790 F791 F792 Q796 I797 R798	D790-Y794 WeakPolarHBondContact O-CB 3.48Å; D790-Y794 PolarHBondContact O-N 2.9Å; F791-Y794 WeakPolarHBondContact O-CB 3.38Å; F791-Y794 PolarHBondContact O-N 2.9Å; F792-Y794 VanDerWaalsContact C-N 3.34Å; F792-Y794 PolarHBondContact O-N 3.29Å; Y794-Q796 VanDerWaalsContact C-N 3.29Å; Y794-Q796 PolarHBondContact O-N 3.27Å; Y794-I797 PolarHBondContact O-N 2.91Å; Y794-R798 WeakPolarHBondContact O-CB 3.38Å; Y794-R798 PolarHBondContact O-N 3.29Å
795	C	85.6	Confident	81	Confident	8 Å²	8	81.2 Å²	81.2	5%	0.054	40%	0.396	C	S	.	.	H	α-helix	trans	-60.2	-36.8	174.8	-77.1	0	0	0	0	112.5	F791 F792 F793 R798 H799 I814 E818	F791-C795 PolarHBondContact O-N 3.39Å; F792-C795 PolarHBondContact O-N 2.85Å; F793-C795 PolarHBondContact O-N 3.08Å; C795-R798 PolarHBondContact O-N 3.13Å; C795-H799 WeakPolarHBondContact O-CB 3.14Å; C795-H799 PolarHBondContact O-N 3.48Å; C795-I814 HydrophobicContact CB-CG2 4.39Å; C795-E818 HydrophobicContact CB-CB 4.2Å
796	Q	83.8	Confident	79.4	Confident	10 Å²	10	88.3 Å²	88.3	5%	0.047	43%	0.427	C	S	.	.	H	α-helix	trans	-62.7	-44.1	174.8	-65.3	179.1	-10.6	0	0	111.9	F792 F793 Y794 H799 Q800 S811 I814	F792-Q796 PolarHBondContact O-N 3.23Å; F793-Q796 WeakPolarHBondContact O-CB 3.34Å; F793-Q796 PolarHBondContact O-N 3.02Å; Y794-Q796 VanDerWaalsContact C-N 3.29Å; Y794-Q796 PolarHBondContact O-N 3.27Å; Q796-H799 PolarHBondContact O-N 3.25Å; Q796-Q800 WeakPolarHBondContact O-CG 3.35Å; Q796-Q800 PolarHBondContact O-N 3.46Å; Q796-S811 PolarHBondContact NE2-O 3.21Å; Q796-S811 PolarHBondContact OE1-O 2.93Å; Q796-I814 HydrophobicContact CG-CG2 3.59Å
797	I	82.8	Confident	78	Confident	66 Å²	66	93.9 Å²	93.9	34%	0.338	45%	0.445	S	S	.	.	H	α-helix	trans	-64.5	-45.4	178	-62.6	169.5	0	0	0	110.1	F793 Y794 H799 Q800 G801 I808	F793-I797 PolarHBondContact O-N 2.73Å; Y794-I797 PolarHBondContact O-N 2.91Å; I797-H799 VanDerWaalsContact C-N 3.33Å; I797-H799 PolarHBondContact O-N 3.15Å; I797-Q800 PolarHBondContact O-N 3.3Å; I797-G801 PolarHBondContact O-N 2.95Å; I797-G801 VanDerWaalsContact O-N 3.15Å; I797-I808 HydrophobicContact CG2-CD1 4.39Å
798	R	82	Confident	76.8	Confident	123 Å²	123	93.8 Å²	93.8	46%	0.464	45%	0.446	S	S	.	.	H	α-helix	trans	-58.5	-44.4	179	-177.1	-177.3	171.1	106.7	-2	111.6	Y794 C795 Q800 G801 E818	Y794-R798 WeakPolarHBondContact O-CB 3.38Å; Y794-R798 PolarHBondContact O-N 3.29Å; C795-R798 PolarHBondContact O-N 3.13Å; R798-Q800 VanDerWaalsContact C-N 3.34Å; R798-Q800 PolarHBondContact O-N 3.32Å; R798-G801 PolarHBondContact O-N 2.49Å; R798-G801 VanDerWaalsContact O-N 3.15Å; R798-E818 IonicContact NE-OE2 2.88Å
799	H	80.6	Confident	75.4	Confident	107 Å²	107	101.3 Å²	101.3	50%	0.495	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-37.4	179.8	-175.7	68.8	0	0	0	112.9	C795 Q796 I797 G801 P815 E818	C795-H799 WeakPolarHBondContact O-CB 3.14Å; C795-H799 PolarHBondContact O-N 3.48Å; Q796-H799 PolarHBondContact O-N 3.25Å; I797-H799 VanDerWaalsContact C-N 3.33Å; I797-H799 PolarHBondContact O-N 3.15Å; H799-G801 PolarHBondContact O-N 3.09Å; H799-P815 HydrophobicContact CB-CG 4.32Å; H799-E818 HydrophobicContact CB-CG 4.38Å
800	Q	75.8	Confident	74.2	Confident	68 Å²	68	103.5 Å²	103.5	32%	0.318	50%	0.498	S	S	.	.	H	α-helix	trans	-75.5	-12.3	177.4	-65.5	-179.6	19.4	0	0	113.1	Q796 I797 R798 E809	Q796-Q800 WeakPolarHBondContact O-CG 3.35Å; Q796-Q800 PolarHBondContact O-N 3.46Å; I797-Q800 PolarHBondContact O-N 3.3Å; R798-Q800 VanDerWaalsContact C-N 3.34Å; R798-Q800 PolarHBondContact O-N 3.32Å; Q800-E809 PolarHBondContact NE2-O 3.11Å
801	G	70.6	Confident	73.3	Confident	34 Å²	34	100.8 Å²	100.8	35%	0.351	49%	0.488	S	S	.	.			trans	90.6	126.3	-178.4	0	0	0	0	0	111.9	I797 R798 H799 D803	I797-G801 PolarHBondContact O-N 2.95Å; I797-G801 VanDerWaalsContact O-N 3.15Å; R798-G801 PolarHBondContact O-N 2.49Å; R798-G801 VanDerWaalsContact O-N 3.15Å; H799-G801 PolarHBondContact O-N 3.09Å; G801-D803 PolarHBondContact O-N 2.76Å
802	T	66.4	Low	72.9	Confident	99 Å²	99	102 Å²	102	61%	0.607	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.5	-178	48.2	0	0	0	0	114.1
803	D	58.8	Low	72.7	Confident	160 Å²	160	105.9 Å²	105.9	86%	0.856	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	20	-172.2	-76.1	-22.2	0	0	0	114.6	G801	G801-D803 PolarHBondContact O-N 2.76Å
804	M	58.4	Low	72.8	Confident	127 Å²	127	101.5 Å²	101.5	63%	0.626	50%	0.499	S	S	*	.			trans	-90.2	124.8	176.8	-66.1	-134.5	179.2	0	0	112.3	K806	M804-K806 PolarHBondContact O-N 3.43Å; M804-K806 VanDerWaalsContact O-N 3.14Å
805	M	61.5	Low	72.9	Confident	205 Å²	205	96.6 Å²	96.6	100%	1.01	48%	0.483	S	S	*	.			trans	-70.7	3.3	168.9	-82.2	-165.1	177.8	0	0	114
806	K	58.5	Low	72.9	Confident	167 Å²	167	97.6 Å²	97.6	73%	0.726	49%	0.487	S	S	*	.	S	Bend	trans	-83.8	149.7	178.8	-73.7	-178.9	178.2	176.3	0	110.2	M804 I808	M804-K806 PolarHBondContact O-N 3.43Å; M804-K806 VanDerWaalsContact O-N 3.14Å; K806-I808 PolarHBondContact O-N 3.14Å
807	R	60	Low	73.2	Confident	238 Å²	238	100.1 Å²	100.1	90%	0.898	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-59.7	122.7	175.3	-168.2	178.6	-166	179.8	3.2	109.3	E809	R807-E809 PolarHBondContact O-N 2.96Å
808	I	64.6	Low	73.5	Confident	90 Å²	90	97.8 Å²	97.8	46%	0.462	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-65.9	125.6	175	-60.6	173.1	0	0	0	108	I797 K806	I797-I808 HydrophobicContact CG2-CD1 4.39Å; K806-I808 PolarHBondContact O-N 3.14Å
809	E	61.5	Low	73.9	Confident	158 Å²	158	91.9 Å²	91.9	74%	0.738	47%	0.472	S	S	*	.			trans	-93.3	115.7	171.4	-70.1	-175.2	175.5	0	0	108.1	Q800 R807 S811	Q800-E809 PolarHBondContact NE2-O 3.11Å; R807-E809 PolarHBondContact O-N 2.96Å; E809-S811 PolarHBondContact O-N 3.35Å
810	V	65.2	Low	74.4	Confident	106 Å²	106	87.3 Å²	87.3	64%	0.642	45%	0.451	S	S	*	.			trans	-77.9	105	176.9	-172.5	0	0	0	0	107.8	F793	F793-V810 HydrophobicContact CD1-CG1 4.28Å; F793-V810 HydrophobicContact CE1-CG1 4.06Å
811	S	70.7	Confident	75	Confident	52 Å²	52	88.7 Å²	88.7	36%	0.364	46%	0.457	S	S	.	.			trans	-80.6	165.3	169.8	54.7	0	0	0	0	110.2	Q796 E809 K813	Q796-S811 PolarHBondContact NE2-O 3.21Å; Q796-S811 PolarHBondContact OE1-O 2.93Å; E809-S811 PolarHBondContact O-N 3.35Å; S811-K813 VanDerWaalsContact C-N 3.26Å; S811-K813 PolarHBondContact OG-O 2.89Å
812	T	80.8	Confident	76	Confident	103 Å²	103	87.1 Å²	87.1	63%	0.632	44%	0.44	S	S	*	.	S	Bend	trans	-84.9	-3	167.4	62.5	0	0	0	0	112.6	D858	T812-D858 PolarHBondContact OG1-OD1 3.04Å
813	K	85.8	Confident	77.1	Confident	86 Å²	86	82.4 Å²	82.4	37%	0.374	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.1	-166.2	-68.4	-178.8	-176.9	-161.6	0	112.9	S811 D856 I857 D858	S811-K813 VanDerWaalsContact C-N 3.26Å; S811-K813 PolarHBondContact OG-O 2.89Å; K813-D856 HydrophobicContact CB-CB 4.11Å; K813-D856 HydrophobicContact CD-CB 4.11Å; K813-I857 WeakPolarHBondContact CA-O 3.38Å; K813-D858 WeakPolarHBondContact CE-OD1 3.29Å; K813-D858 VanDerWaalsContact CE-OD2 3.24Å; K813-D858 WeakPolarHBondContact CE-OD2 3.42Å; K813-D858 WeakPolarHBondContact CG-OD1 3.45Å; K813-D858 IonicContact NZ-OD2 2.67Å
814	I	88.3	Confident	78.6	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.8	168.1	62.9	173.3	0	0	0	110.7	F792 C795 Q796 V819 L822 D856 I857	F792-I814 HydrophobicContact CD1-CG2 4.17Å; F792-I814 HydrophobicContact CD2-CD1 3.84Å; F792-I814 HydrophobicContact CD2-CG1 4.32Å; F792-I814 HydrophobicContact CD2-CG2 4.16Å; F792-I814 HydrophobicContact CE1-CG2 3.85Å; F792-I814 HydrophobicContact CE2-CB 4.28Å; F792-I814 HydrophobicContact CE2-CD1 3.53Å; F792-I814 HydrophobicContact CE2-CG1 3.58Å; F792-I814 HydrophobicContact CE2-CG2 3.82Å; F792-I814 HydrophobicContact CG-CG2 4.33Å; F792-I814 HydrophobicContact CZ-CB 4.25Å; F792-I814 HydrophobicContact CZ-CD1 4.34Å; F792-I814 HydrophobicContact CZ-CG1 3.92Å; F792-I814 HydrophobicContact CZ-CG2 3.65Å; C795-I814 HydrophobicContact CB-CG2 4.39Å; Q796-I814 HydrophobicContact CG-CG2 3.59Å; I814-V819 HydrophobicContact CD1-CG2 4.32Å; I814-L822 HydrophobicContact CD1-CD2 3.93Å; I814-D856 CarbonylContact O-C 3.48Å; I814-D856 VanDerWaalsContact O-CA 3.28Å; I814-D856 WeakPolarHBondContact O-CA 3.12Å; I814-I857 HydrophobicContact CD1-CG2 3.93Å; I814-I857 HydrophobicContact CG1-CG2 3.41Å; I814-I857 VanDerWaalsContact CG1-CG2 3.41Å; I814-I857 PolarHBondContact N-O 2.99Å; I814-I857 PolarHBondContact O-N 2.88Å
815	P	88.4	Confident	79.9	Confident	21 Å²	21	75.5 Å²	75.5	14%	0.136	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	153.8	173.5	30.5	-33.6	0	0	0	111.3	H799 S817 E818	H799-P815 HydrophobicContact CB-CG 4.32Å; P815-S817 PolarHBondContact O-N 2.89Å; P815-S817 VanDerWaalsContact O-N 3.13Å; P815-E818 HydrophobicContact CG-CG 3.99Å; P815-E818 PolarHBondContact O-N 2.75Å; P815-E818 VanDerWaalsContact O-N 3.11Å
816	L	87.3	Confident	81.1	Confident	29 Å²	29	66.3 Å²	66.3	15%	0.152	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-55.4	-32.5	-178	-73.1	173.6	0	0	0	114.4	E818 V819 F839 I842 T855	L816-E818 PolarHBondContact O-N 2.75Å; L816-E818 VanDerWaalsContact O-N 3.14Å; L816-V819 PolarHBondContact O-N 2.94Å; L816-F839 HydrophobicContact CB-CD1 4.36Å; L816-F839 HydrophobicContact CB-CE1 4.37Å; L816-F839 WeakPolarHBondContact O-CE1 3.4Å; L816-I842 HydrophobicContact CD2-CB 3.7Å; L816-I842 HydrophobicContact CD2-CD1 3.34Å; L816-I842 HydrophobicContact CD2-CG1 4.14Å; L816-I842 HydrophobicContact CD2-CG2 3.56Å; L816-T855 WeakPolarHBondContact CG-O 3.11Å; L816-T855 PolarHBondContact N-O 3.29Å
817	S	88.4	Confident	82.3	Confident	63 Å²	63	60.9 Å²	60.9	44%	0.441	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61.6	-22.5	-179.4	56.2	0	0	0	0	113.9	P815 F821	P815-S817 PolarHBondContact O-N 2.89Å; P815-S817 VanDerWaalsContact O-N 3.13Å; S817-F821 WeakPolarHBondContact O-CD2 3.46Å; S817-F821 WeakPolarHBondContact O-CE2 3.24Å
818	E	89	Confident	83.5	Confident	17 Å²	17	50.6 Å²	50.6	8%	0.079	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-88.2	-16.1	-178.5	-62.3	-61.3	148.7	0	0	113.3	C795 R798 H799 P815 L816 F821 L822	C795-E818 HydrophobicContact CB-CB 4.2Å; R798-E818 IonicContact NE-OE2 2.88Å; H799-E818 HydrophobicContact CB-CG 4.38Å; P815-E818 HydrophobicContact CG-CG 3.99Å; P815-E818 PolarHBondContact O-N 2.75Å; P815-E818 VanDerWaalsContact O-N 3.11Å; L816-E818 PolarHBondContact O-N 2.75Å; L816-E818 VanDerWaalsContact O-N 3.14Å; E818-F821 PolarHBondContact O-N 3.01Å; E818-L822 PolarHBondContact O-N 2.55Å; E818-L822 VanDerWaalsContact O-N 3.08Å
819	V	90.6	Very high	84.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-44.9	-175.8	176.1	0	0	0	0	113.1	I814 L816 F821 L822 M823 I842 I857 F862 L865	I814-V819 HydrophobicContact CD1-CG2 4.32Å; L816-V819 PolarHBondContact O-N 2.94Å; V819-F821 VanDerWaalsContact C-N 3.31Å; V819-F821 PolarHBondContact O-N 3.31Å; V819-L822 PolarHBondContact O-N 2.61Å; V819-M823 HydrophobicContact CG1-CE 4.47Å; V819-M823 HydrophobicContact CG1-CG 4.45Å; V819-M823 WeakPolarHBondContact O-CG 3.38Å; V819-M823 PolarHBondContact O-N 2.97Å; V819-I842 HydrophobicContact CG2-CD1 4.48Å; V819-I857 HydrophobicContact CG2-CG2 3.89Å; V819-F862 HydrophobicContact CG1-CD2 4.4Å; V819-F862 HydrophobicContact CG1-CE2 4.2Å; V819-L865 HydrophobicContact CG1-CD2 3.9Å
820	P	91.4	Very high	85.7	Confident	10 Å²	10	46.5 Å²	46.5	7%	0.065	26%	0.263	C	S	.	.	H	α-helix	trans	-64.4	-35.6	179.4	-22.2	35	0	0	0	112.8	R824 I835 F839	P820-R824 WeakPolarHBondContact O-CD 3.37Å; P820-R824 WeakPolarHBondContact O-CG 3.5Å; P820-R824 PolarHBondContact O-N 3.28Å; P820-R824 VanDerWaalsContact O-N 3.1Å; P820-I835 HydrophobicContact CB-CD1 4.02Å; P820-I835 HydrophobicContact CB-CG1 4.23Å; P820-I835 HydrophobicContact CB-CG2 4.47Å; P820-I835 HydrophobicContact CG-CD1 4.45Å; P820-I835 HydrophobicContact CG-CG1 4.34Å; P820-I835 HydrophobicContact CG-CG2 3.75Å; P820-F839 HydrophobicContact CG-CE1 3.95Å; P820-F839 HydrophobicContact CG-CZ 3.61Å
821	F	89.2	Confident	86.6	Confident	98 Å²	98	42.8 Å²	42.8	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-68.4	-39.6	177.7	-60.2	-68	0	0	0	111.3	S817 E818 V819 R824 A825	S817-F821 WeakPolarHBondContact O-CD2 3.46Å; S817-F821 WeakPolarHBondContact O-CE2 3.24Å; E818-F821 PolarHBondContact O-N 3.01Å; V819-F821 VanDerWaalsContact C-N 3.31Å; V819-F821 PolarHBondContact O-N 3.31Å; F821-R824 PolarHBondContact O-N 3.12Å; F821-A825 WeakPolarHBondContact O-CB 3.49Å; F821-A825 PolarHBondContact O-N 2.86Å
822	L	91.1	Very high	87.3	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-42.7	176.3	-174	58.2	0	0	0	112	F791 F792 I814 E818 V819 R824 A825 L826 F862	F791-L822 HydrophobicContact CB-CD1 3.39Å; F792-L822 HydrophobicContact CB-CD2 4.46Å; F792-L822 HydrophobicContact CD2-CD2 3.83Å; I814-L822 HydrophobicContact CD1-CD2 3.93Å; E818-L822 PolarHBondContact O-N 2.55Å; E818-L822 VanDerWaalsContact O-N 3.08Å; V819-L822 PolarHBondContact O-N 2.61Å; L822-R824 VanDerWaalsContact C-N 3.34Å; L822-R824 PolarHBondContact O-N 3.35Å; L822-A825 PolarHBondContact O-N 3.39Å; L822-L826 HydrophobicContact CD1-CD1 4.35Å; L822-L826 HydrophobicContact CG-CD1 4.26Å; L822-L826 WeakPolarHBondContact O-CG 3.18Å; L822-L826 PolarHBondContact O-N 3Å; L822-L826 VanDerWaalsContact O-N 3.13Å; L822-F862 HydrophobicContact CB-CE2 4.21Å; L822-F862 HydrophobicContact CB-CZ 4.09Å; L822-F862 HydrophobicContact CD2-CD1 3.77Å; L822-F862 HydrophobicContact CD2-CD2 3.89Å; L822-F862 HydrophobicContact CD2-CE1 3.44Å; L822-F862 VanDerWaalsContact CD2-CE1 3.44Å; L822-F862 HydrophobicContact CD2-CE2 3.56Å; L822-F862 HydrophobicContact CD2-CG 4Å; L822-F862 HydrophobicContact CD2-CZ 3.35Å; L822-F862 HydrophobicContact CG-CE1 3.77Å; L822-F862 HydrophobicContact CG-CE2 3.89Å; L822-F862 HydrophobicContact CG-CZ 3.39Å
823	M	90.3	Very high	87.4	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.9	-47.4	173.7	-71.2	-78.6	-179.7	0	0	111.6	V819 L826 G827 H828 P830 M838 F862 L865 Y866	V819-M823 HydrophobicContact CG1-CE 4.47Å; V819-M823 HydrophobicContact CG1-CG 4.45Å; V819-M823 WeakPolarHBondContact O-CG 3.38Å; V819-M823 PolarHBondContact O-N 2.97Å; M823-L826 PolarHBondContact O-N 2.91Å; M823-G827 PolarHBondContact O-N 3.34Å; M823-H828 CarbonylContact C-O 3.48Å; M823-H828 PolarHBondContact O-N 3.36Å; M823-P830 HydrophobicContact CB-CG 4.32Å; M823-M838 HydrophobicContact CE-SD 3.7Å; M823-M838 HydrophobicContact CG-SD 4.32Å; M823-M838 HydrophobicContact SD-SD 4.41Å; M823-F862 HydrophobicContact CE-CD2 4.48Å; M823-F862 HydrophobicContact CE-CE2 3.77Å; M823-F862 HydrophobicContact CE-CZ 4.25Å; M823-F862 HydrophobicContact CG-CE2 4.29Å; M823-F862 HydrophobicContact SD-CE2 4.34Å; M823-F862 HydrophobicContact SD-CZ 4.37Å; M823-L865 HydrophobicContact CE-CB 4.39Å; M823-L865 HydrophobicContact CE-CD2 3.81Å; M823-L865 HydrophobicContact CE-CG 3.94Å; M823-Y866 HydrophobicContact CE-CD2 4.42Å; M823-Y866 HydrophobicContact SD-CD2 3.55Å; M823-Y866 VanDerWaalsContact SD-CD2 3.55Å; M823-Y866 HydrophobicContact SD-CE2 4.34Å; M823-Y866 HydrophobicContact SD-CG 4.39Å
824	R	88.9	Confident	87.3	Confident	89 Å²	89	39.9 Å²	39.9	34%	0.336	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-38.7	179.4	-69	169.6	-175.3	176.4	2	112.3	P820 F821 L822 L826 G827 H828 F829 E832	P820-R824 WeakPolarHBondContact O-CD 3.37Å; P820-R824 WeakPolarHBondContact O-CG 3.5Å; P820-R824 PolarHBondContact O-N 3.28Å; P820-R824 VanDerWaalsContact O-N 3.1Å; F821-R824 PolarHBondContact O-N 3.12Å; L822-R824 VanDerWaalsContact C-N 3.34Å; L822-R824 PolarHBondContact O-N 3.35Å; R824-L826 VanDerWaalsContact C-N 3.27Å; R824-L826 PolarHBondContact O-N 3.46Å; R824-G827 PolarHBondContact O-N 3.33Å; R824-H828 WeakPolarHBondContact CA-O 3.32Å; R824-H828 PolarHBondContact N-O 3Å; R824-F829 HydrophobicContact CB-CD1 4.33Å; R824-F829 HydrophobicContact CB-CE1 4.38Å; R824-F829 HydrophobicContact CG-CD1 4.09Å; R824-E832 IonicContact NH2-OE1 2.74Å; R824-E832 PolarHBondContact NH2-OE1 3.16Å
825	A	86.5	Confident	87.4	Confident	53 Å²	53	40.2 Å²	40.2	44%	0.438	22%	0.217	S	C	.	.	H	α-helix	trans	-64	-33.2	175.8	0	0	0	0	0	112.5	F791 F821 L822 G827	F791-A825 HydrophobicContact CD1-CB 4.21Å; F791-A825 HydrophobicContact CE1-CB 4.32Å; F791-A825 HydrophobicContact CG-CB 4.35Å; F821-A825 WeakPolarHBondContact O-CB 3.49Å; F821-A825 PolarHBondContact O-N 2.86Å; L822-A825 PolarHBondContact O-N 3.39Å; A825-G827 PolarHBondContact O-N 3.29Å
826	L	87.3	Confident	87.3	Confident	13 Å²	13	45.1 Å²	45.1	7%	0.068	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	13.3	176.7	-64.6	170.1	0	0	0	113.7	F784 M788 F791 L822 M823 R824 H828 F862 Y866	F784-L826 HydrophobicContact CE2-CD2 4.21Å; F784-L826 HydrophobicContact CZ-CD2 4.39Å; M788-L826 HydrophobicContact CB-CD2 4.33Å; M788-L826 HydrophobicContact CE-CD1 3.93Å; M788-L826 HydrophobicContact CE-CD2 4.38Å; M788-L826 HydrophobicContact CG-CD1 3.82Å; M788-L826 HydrophobicContact CG-CD2 3.47Å; M788-L826 VanDerWaalsContact CG-CD2 3.47Å; M788-L826 HydrophobicContact CG-CG 4.3Å; F791-L826 HydrophobicContact CD2-CD2 3.81Å; F791-L826 HydrophobicContact CE2-CD2 4.32Å; L822-L826 HydrophobicContact CD1-CD1 4.35Å; L822-L826 HydrophobicContact CG-CD1 4.26Å; L822-L826 WeakPolarHBondContact O-CG 3.18Å; L822-L826 PolarHBondContact O-N 3Å; L822-L826 VanDerWaalsContact O-N 3.13Å; M823-L826 PolarHBondContact O-N 2.91Å; R824-L826 VanDerWaalsContact C-N 3.27Å; R824-L826 PolarHBondContact O-N 3.46Å; L826-H828 PolarHBondContact O-N 3.2Å; L826-F862 HydrophobicContact CD1-CE1 3.69Å; L826-F862 HydrophobicContact CD1-CZ 3.82Å; L826-Y866 HydrophobicContact CB-CD2 4.39Å; L826-Y866 HydrophobicContact CB-CE2 3.58Å; L826-Y866 HydrophobicContact CD1-CD2 3.91Å; L826-Y866 HydrophobicContact CD1-CE2 3.9Å; L826-Y866 HydrophobicContact CG-CE2 4.41Å; L826-Y866 PolarHBondContact O-OH 2.81Å
827	G	82.9	Confident	87.1	Confident	52 Å²	52	44.5 Å²	44.5	54%	0.536	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	8.5	175.9	0	0	0	0	0	115.4	M823 R824 A825	M823-G827 PolarHBondContact O-N 3.34Å; R824-G827 PolarHBondContact O-N 3.33Å; A825-G827 PolarHBondContact O-N 3.29Å
828	H	85.4	Confident	87.1	Confident	23 Å²	23	41.6 Å²	41.6	11%	0.106	22%	0.215	C	C	.	.			trans	-104.3	122.7	173.6	-178.8	53.7	0	0	0	111	M823 R824 L826 P830 Y866 P871	M823-H828 CarbonylContact C-O 3.48Å; M823-H828 PolarHBondContact O-N 3.36Å; R824-H828 WeakPolarHBondContact CA-O 3.32Å; R824-H828 PolarHBondContact N-O 3Å; L826-H828 PolarHBondContact O-N 3.2Å; H828-P830 WeakPolarHBondContact O-CD 3.34Å; H828-Y866 HydrophobicContact CB-CE2 4.18Å; H828-P871 VanDerWaalsContact ND1-CD 3.33Å; H828-P871 WeakPolarHBondContact ND1-CD 3.39Å
829	F	86.3	Confident	87.1	Confident	153 Å²	153	43.8 Å²	43.8	67%	0.671	22%	0.224	S	C	*	.			trans	-108.4	87.4	-177.2	-57	-81.8	0	0	0	110.4	R824	R824-F829 HydrophobicContact CB-CD1 4.33Å; R824-F829 HydrophobicContact CB-CE1 4.38Å; R824-F829 HydrophobicContact CG-CD1 4.09Å
830	P	85.9	Confident	86.8	Confident	8 Å²	8	45.9 Å²	45.9	5%	0.052	24%	0.235	C	C	.	.			trans	-73.1	147.9	179.5	30.8	-36.4	0	0	0	111.4	M823 H828 E834 I835 M838	M823-P830 HydrophobicContact CB-CG 4.32Å; H828-P830 WeakPolarHBondContact O-CD 3.34Å; P830-E834 HydrophobicContact CB-CB 4.11Å; P830-I835 HydrophobicContact CB-CG1 4.08Å; P830-I835 HydrophobicContact CG-CD1 4.2Å; P830-I835 HydrophobicContact CG-CG1 3.84Å; P830-M838 HydrophobicContact CB-CE 3.82Å; P830-M838 HydrophobicContact CG-CE 3.86Å
831	T	85.3	Confident	86.6	Confident	28 Å²	28	46.5 Å²	46.5	17%	0.172	24%	0.237	C	C	.	.			trans	-68.7	158.3	169	56.4	0	0	0	0	111.2	Q833 E834 I835 E912	T831-Q833 PolarHBondContact O-N 2.96Å; T831-E834 PolarHBondContact N-OE2 2.83Å; T831-E834 CarbonylContact O-C 3.56Å; T831-E834 PolarHBondContact O-N 3.34Å; T831-E834 WeakPolarHBondContact OG1-CB 3.38Å; T831-E834 WeakPolarHBondContact OG1-CG 3.49Å; T831-E834 PolarHBondContact OG1-N 2.78Å; T831-E834 PolarHBondContact OG1-OE2 3.16Å; T831-I835 WeakPolarHBondContact O-CG1 3.48Å; T831-I835 PolarHBondContact O-N 3.23Å; T831-E912 WeakPolarHBondContact CA-OE1 3.49Å; T831-E912 WeakPolarHBondContact CB-OE1 3.41Å
832	E	84.8	Confident	86.5	Confident	100 Å²	100	42.4 Å²	42.4	47%	0.467	22%	0.22	S	C	.	.	H	α-helix	trans	-58.3	-36.5	174.3	-66.7	-58.9	138.4	0	0	111.5	R824 I835 E836 E912	R824-E832 IonicContact NH2-OE1 2.74Å; R824-E832 PolarHBondContact NH2-OE1 3.16Å; E832-I835 PolarHBondContact O-N 3.5Å; E832-E836 WeakPolarHBondContact O-CG 3.4Å; E832-E836 PolarHBondContact O-N 2.97Å; E832-E912 PolarHBondContact N-OE1 3.33Å
833	Q	82.1	Confident	86.2	Confident	44 Å²	44	46.3 Å²	46.3	21%	0.206	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-43	172.3	-173.7	179	-17.4	0	0	112	I620 T831 I835 E836 D837	I620-Q833 PolarHBondContact O-NE2 3.04Å; T831-Q833 PolarHBondContact O-N 2.96Å; Q833-I835 VanDerWaalsContact C-N 3.33Å; Q833-E836 PolarHBondContact O-N 2.9Å; Q833-D837 PolarHBondContact O-N 2.99Å
834	E	84.8	Confident	85.7	Confident	36 Å²	36	48.6 Å²	48.6	17%	0.168	25%	0.247	C	C	.	.	H	α-helix	trans	-67.5	-33.1	176.3	-73.8	158.6	172.8	0	0	111.9	S623 P830 T831 D837 M838	S623-E834 PolarHBondContact OG-OE1 3.44Å; P830-E834 HydrophobicContact CB-CB 4.11Å; T831-E834 PolarHBondContact N-OE2 2.83Å; T831-E834 CarbonylContact O-C 3.56Å; T831-E834 PolarHBondContact O-N 3.34Å; T831-E834 WeakPolarHBondContact OG1-CB 3.38Å; T831-E834 WeakPolarHBondContact OG1-CG 3.49Å; T831-E834 PolarHBondContact OG1-N 2.78Å; T831-E834 PolarHBondContact OG1-OE2 3.16Å; E834-D837 WeakPolarHBondContact O-CB 3.43Å; E834-D837 PolarHBondContact O-N 3.37Å; E834-M838 WeakPolarHBondContact O-CG 3.48Å; E834-M838 PolarHBondContact O-N 3.09Å
835	I	88.6	Confident	85.2	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.036	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-46.4	173.3	-68.5	165	0	0	0	111	P820 P830 T831 E832 Q833 D837 M838 F839	P820-I835 HydrophobicContact CB-CD1 4.02Å; P820-I835 HydrophobicContact CB-CG1 4.23Å; P820-I835 HydrophobicContact CB-CG2 4.47Å; P820-I835 HydrophobicContact CG-CD1 4.45Å; P820-I835 HydrophobicContact CG-CG1 4.34Å; P820-I835 HydrophobicContact CG-CG2 3.75Å; P830-I835 HydrophobicContact CB-CG1 4.08Å; P830-I835 HydrophobicContact CG-CD1 4.2Å; P830-I835 HydrophobicContact CG-CG1 3.84Å; T831-I835 WeakPolarHBondContact O-CG1 3.48Å; T831-I835 PolarHBondContact O-N 3.23Å; E832-I835 PolarHBondContact O-N 3.5Å; Q833-I835 VanDerWaalsContact C-N 3.33Å; I835-D837 VanDerWaalsContact C-N 3.3Å; I835-D837 PolarHBondContact O-N 3.44Å; I835-M838 HydrophobicContact CB-CE 4.3Å; I835-M838 HydrophobicContact CG1-CE 3.85Å; I835-M838 PolarHBondContact O-N 3.38Å; I835-F839 HydrophobicContact CG2-CD2 3.98Å; I835-F839 HydrophobicContact CG2-CE1 4.27Å; I835-F839 HydrophobicContact CG2-CE2 3.49Å; I835-F839 VanDerWaalsContact CG2-CE2 3.49Å; I835-F839 HydrophobicContact CG2-CZ 3.67Å; I835-F839 WeakPolarHBondContact O-CG 3.36Å; I835-F839 PolarHBondContact O-N 2.95Å
836	E	86.4	Confident	84.7	Confident	125 Å²	125	50.3 Å²	50.3	58%	0.584	25%	0.25	S	C	*	.	H	α-helix	trans	-59.7	-42.1	173.9	-73.9	-172.9	177	0	0	111.7	E832 Q833 F839 N840	E832-E836 WeakPolarHBondContact O-CG 3.4Å; E832-E836 PolarHBondContact O-N 2.97Å; Q833-E836 PolarHBondContact O-N 2.9Å; E836-F839 PolarHBondContact O-N 3.32Å; E836-N840 WeakPolarHBondContact O-CB 3.23Å; E836-N840 PolarHBondContact O-N 2.84Å; E836-N840 PolarHBondContact O-ND2 3.32Å
837	D	84.9	Confident	84.1	Confident	16 Å²	16	54 Å²	54	9%	0.086	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-45.3	175.6	-80.7	-7.1	0	0	0	111.7	K651 N662 Q833 E834 I835 N840 E841	K651-D837 IonicContact NZ-OD2 2.68Å; N662-D837 WeakPolarHBondContact CB-OD1 3.24Å; N662-D837 VanDerWaalsContact ND2-CG 3.3Å; N662-D837 PolarHBondContact ND2-OD2 2.92Å; Q833-D837 PolarHBondContact O-N 2.99Å; E834-D837 WeakPolarHBondContact O-CB 3.43Å; E834-D837 PolarHBondContact O-N 3.37Å; I835-D837 VanDerWaalsContact C-N 3.3Å; I835-D837 PolarHBondContact O-N 3.44Å; D837-N840 PolarHBondContact O-N 3.46Å; D837-E841 WeakPolarHBondContact O-CB 3.45Å; D837-E841 PolarHBondContact O-N 2.7Å
838	M	87.9	Confident	83.4	Confident	1 Å²	1	54 Å²	54	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-45	175.3	-75.7	-173.7	-69	0	0	112	M823 P830 E834 I835 N840 E841 I842 L865 H869	M823-M838 HydrophobicContact CE-SD 3.7Å; M823-M838 HydrophobicContact CG-SD 4.32Å; M823-M838 HydrophobicContact SD-SD 4.41Å; P830-M838 HydrophobicContact CB-CE 3.82Å; P830-M838 HydrophobicContact CG-CE 3.86Å; E834-M838 WeakPolarHBondContact O-CG 3.48Å; E834-M838 PolarHBondContact O-N 3.09Å; I835-M838 HydrophobicContact CB-CE 4.3Å; I835-M838 HydrophobicContact CG1-CE 3.85Å; I835-M838 PolarHBondContact O-N 3.38Å; M838-N840 VanDerWaalsContact C-N 3.34Å; M838-N840 PolarHBondContact O-N 3.4Å; M838-E841 PolarHBondContact O-N 3.44Å; M838-I842 WeakPolarHBondContact O-CG1 3.22Å; M838-I842 PolarHBondContact O-N 3.45Å; M838-I842 VanDerWaalsContact O-N 3.08Å; M838-L865 HydrophobicContact CG-CD1 4.34Å; M838-L865 HydrophobicContact CG-CD2 4.41Å; M838-L865 HydrophobicContact CG-CG 4.46Å; M838-L865 HydrophobicContact SD-CD2 4.25Å; M838-L865 HydrophobicContact SD-CG 4.49Å; M838-H869 WeakPolarHBondContact CG-CE1 3.27Å; M838-H869 HydrophobicContact SD-CB 4.32Å
839	F	88.3	Confident	82.8	Confident	63 Å²	63	61 Å²	61	28%	0.276	29%	0.291	S	S	.	.	H	α-helix	trans	-62.5	-42.3	177.1	-70.4	-18.8	0	0	0	112	L816 P820 I835 E836 K843	L816-F839 HydrophobicContact CB-CD1 4.36Å; L816-F839 HydrophobicContact CB-CE1 4.37Å; L816-F839 WeakPolarHBondContact O-CE1 3.4Å; P820-F839 HydrophobicContact CG-CE1 3.95Å; P820-F839 HydrophobicContact CG-CZ 3.61Å; I835-F839 HydrophobicContact CG2-CD2 3.98Å; I835-F839 HydrophobicContact CG2-CE1 4.27Å; I835-F839 HydrophobicContact CG2-CE2 3.49Å; I835-F839 VanDerWaalsContact CG2-CE2 3.49Å; I835-F839 HydrophobicContact CG2-CZ 3.67Å; I835-F839 WeakPolarHBondContact O-CG 3.36Å; I835-F839 PolarHBondContact O-N 2.95Å; E836-F839 PolarHBondContact O-N 3.32Å; F839-K843 WeakPolarHBondContact O-CB 3.34Å; F839-K843 PolarHBondContact O-N 2.88Å
840	N	85.4	Confident	82.3	Confident	45 Å²	45	57.5 Å²	57.5	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-63.9	-46.1	176.5	-72.2	-40.1	0	0	0	111	E836 D837 M838 I842 K843 F844	E836-N840 WeakPolarHBondContact O-CB 3.23Å; E836-N840 PolarHBondContact O-N 2.84Å; E836-N840 PolarHBondContact O-ND2 3.32Å; D837-N840 PolarHBondContact O-N 3.46Å; M838-N840 VanDerWaalsContact C-N 3.34Å; M838-N840 PolarHBondContact O-N 3.4Å; N840-I842 VanDerWaalsContact C-N 3.34Å; N840-I842 PolarHBondContact O-N 3.04Å; N840-K843 PolarHBondContact O-N 3.22Å; N840-F844 HydrophobicContact CB-CD2 4.27Å; N840-F844 HydrophobicContact CB-CE2 4.46Å; N840-F844 WeakPolarHBondContact O-CB 3.49Å; N840-F844 WeakPolarHBondContact O-CD2 3.43Å; N840-F844 PolarHBondContact O-N 3.19Å
841	E	86.6	Confident	81.7	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.103	31%	0.305	C	S	.	.	H	α-helix	trans	-54.3	-49.3	177.8	175.6	167.7	-177.9	0	0	111.8	R663 K664 T665 D837 M838 S845 L865 H869	R663-E841 WeakPolarHBondContact O-CA 3.33Å; K664-E841 HydrophobicContact CG-CG 4.23Å; T665-E841 PolarHBondContact N-OE2 2.93Å; D837-E841 WeakPolarHBondContact O-CB 3.45Å; D837-E841 PolarHBondContact O-N 2.7Å; M838-E841 PolarHBondContact O-N 3.44Å; E841-S845 WeakPolarHBondContact O-CA 3.42Å; E841-S845 WeakPolarHBondContact O-CB 3.43Å; E841-S845 PolarHBondContact O-N 3.04Å; E841-L865 HydrophobicContact CG-CD1 4.44Å; E841-H869 IonicContact OE2-CE1 3.8Å; E841-H869 IonicContact OE2-NE2 3.67Å; E841-H869 PolarHBondContact OE2-NE2 3.1Å
842	I	86.1	Confident	81.6	Confident	12 Å²	12	65.8 Å²	65.8	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-70.7	-47.1	-178.7	-55.6	158.7	0	0	0	110.7	L816 V819 M838 N840 F844 S845 V854 I857 L865	L816-I842 HydrophobicContact CD2-CB 3.7Å; L816-I842 HydrophobicContact CD2-CD1 3.34Å; L816-I842 HydrophobicContact CD2-CG1 4.14Å; L816-I842 HydrophobicContact CD2-CG2 3.56Å; V819-I842 HydrophobicContact CG2-CD1 4.48Å; M838-I842 WeakPolarHBondContact O-CG1 3.22Å; M838-I842 PolarHBondContact O-N 3.45Å; M838-I842 VanDerWaalsContact O-N 3.08Å; N840-I842 VanDerWaalsContact C-N 3.34Å; N840-I842 PolarHBondContact O-N 3.04Å; I842-F844 VanDerWaalsContact C-N 3.26Å; I842-F844 PolarHBondContact O-N 3.49Å; I842-S845 VanDerWaalsContact O-CB 3.31Å; I842-S845 WeakPolarHBondContact O-CB 3.47Å; I842-S845 PolarHBondContact O-N 3.16Å; I842-S845 PolarHBondContact O-OG 3.12Å; I842-V854 HydrophobicContact CG2-CG1 4.28Å; I842-I857 HydrophobicContact CD1-CD1 3.87Å; I842-I857 HydrophobicContact CG1-CD1 4.14Å; I842-L865 HydrophobicContact CD1-CD2 3.75Å; I842-L865 HydrophobicContact CG1-CD1 4.38Å; I842-L865 HydrophobicContact CG1-CD2 4.32Å
843	K	85.1	Confident	81.5	Confident	82 Å²	82	66.8 Å²	66.8	36%	0.357	33%	0.33	S	S	.	.	H	α-helix	trans	-58.2	-37.7	-177.1	-178	175.8	-179.2	177.5	0	112.6	F839 N840 Y853 V854	F839-K843 WeakPolarHBondContact O-CB 3.34Å; F839-K843 PolarHBondContact O-N 2.88Å; N840-K843 PolarHBondContact O-N 3.22Å; K843-Y853 HydrophobicContact CD-CD1 4.27Å; K843-Y853 HydrophobicContact CG-CD1 3.66Å; K843-Y853 HydrophobicContact CG-CE1 4.47Å; K843-Y853 HydrophobicContact CG-CG 4.17Å; K843-V854 PolarHBondContact O-N 3.41Å
844	F	79.6	Confident	81.6	Confident	49 Å²	49	66.4 Å²	66.4	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-99.5	0.7	-178	-64.3	-75.2	0	0	0	114.2	N840 I842 R846 Y847 Y853	N840-F844 HydrophobicContact CB-CD2 4.27Å; N840-F844 HydrophobicContact CB-CE2 4.46Å; N840-F844 WeakPolarHBondContact O-CB 3.49Å; N840-F844 WeakPolarHBondContact O-CD2 3.43Å; N840-F844 PolarHBondContact O-N 3.19Å; I842-F844 VanDerWaalsContact C-N 3.26Å; I842-F844 PolarHBondContact O-N 3.49Å; F844-R846 VanDerWaalsContact C-N 3.34Å; F844-R846 PolarHBondContact O-N 3.28Å; F844-Y847 HydrophobicContact CD1-CD1 4.22Å; F844-Y847 HydrophobicContact CD1-CG 4.07Å; F844-Y847 PolarHBondContact O-N 3.04Å; F844-Y853 HydrophobicContact CD1-CD1 4.46Å; F844-Y853 HydrophobicContact CD1-CE1 4.05Å; F844-Y853 HydrophobicContact CE1-CD1 4.28Å; F844-Y853 AromaticContact CE1-CE1 3.53Å; F844-Y853 HydrophobicContact CE1-CE1 3.53Å; F844-Y853 HydrophobicContact CZ-CE1 4.17Å
845	S	78.6	Confident	81.7	Confident	52 Å²	52	68.8 Å²	68.8	36%	0.364	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-48.2	-176.4	58.5	0	0	0	0	113.5	E841 I842	E841-S845 WeakPolarHBondContact O-CA 3.42Å; E841-S845 WeakPolarHBondContact O-CB 3.43Å; E841-S845 PolarHBondContact O-N 3.04Å; I842-S845 VanDerWaalsContact O-CB 3.31Å; I842-S845 WeakPolarHBondContact O-CB 3.47Å; I842-S845 PolarHBondContact O-N 3.16Å; I842-S845 PolarHBondContact O-OG 3.12Å
846	R	75.9	Confident	81.7	Confident	126 Å²	126	71.6 Å²	71.6	48%	0.475	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	7.9	-179.5	-57.8	-176.3	-170.1	179.3	4.7	113.6	F844 A848 E849 T850 V854 D861	F844-R846 VanDerWaalsContact C-N 3.34Å; F844-R846 PolarHBondContact O-N 3.28Å; R846-A848 PolarHBondContact O-N 2.89Å; R846-E849 PolarHBondContact O-N 3.08Å; R846-T850 HydrophobicContact CB-CG2 4.25Å; R846-T850 WeakPolarHBondContact O-CB 3.3Å; R846-T850 PolarHBondContact O-N 2.9Å; R846-T850 PolarHBondContact O-OG1 3.38Å; R846-V854 HydrophobicContact CB-CG2 4.19Å; R846-V854 HydrophobicContact CG-CG2 4.39Å; R846-D861 IonicContact NH2-OD2 2.76Å
847	Y	75.6	Confident	81.9	Confident	90 Å²	90	65.9 Å²	65.9	35%	0.353	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-39.1	-172.5	-177.6	-98.6	0	0	0	112.5	F844 E849 G851 Y853	F844-Y847 HydrophobicContact CD1-CD1 4.22Å; F844-Y847 HydrophobicContact CD1-CG 4.07Å; F844-Y847 PolarHBondContact O-N 3.04Å; Y847-E849 PolarHBondContact O-N 3.45Å; Y847-G851 WeakPolarHBondContact CE2-O 3.49Å; Y847-G851 VanDerWaalsContact O-CA 3.27Å; Y847-G851 WeakPolarHBondContact O-CA 3.23Å; Y847-G851 PolarHBondContact O-N 3.33Å; Y847-Y853 AromaticContact CD2-CD1 3.85Å; Y847-Y853 HydrophobicContact CD2-CD1 3.85Å; Y847-Y853 AromaticContact CD2-CE1 3.68Å; Y847-Y853 HydrophobicContact CD2-CE1 3.68Å; Y847-Y853 HydrophobicContact CE2-CD1 4.17Å; Y847-Y853 AromaticContact CE2-CE1 3.62Å; Y847-Y853 HydrophobicContact CE2-CE1 3.62Å; Y847-Y853 HydrophobicContact CE2-CE2 4.48Å; Y847-Y853 AromaticContact CE2-CZ 3.81Å; Y847-Y853 HydrophobicContact CG-CE1 4.47Å
848	A	67.8	Low	82.2	Confident	53 Å²	53	67.1 Å²	67.1	44%	0.438	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-29.8	179.3	0	0	0	0	0	113.3	R846	R846-A848 PolarHBondContact O-N 2.89Å
849	E	72.6	Confident	82.3	Confident	169 Å²	169	68.4 Å²	68.4	79%	0.79	35%	0.35	S	S	*	.	H	α-helix	trans	-94.7	-37.6	-177.7	-64.5	173.6	-174.6	0	0	112.5	R846 Y847	R846-E849 PolarHBondContact O-N 3.08Å; Y847-E849 PolarHBondContact O-N 3.45Å
850	T	75.3	Confident	82.3	Confident	79 Å²	79	70.5 Å²	70.5	49%	0.485	36%	0.36	S	S	.	.	H	α-helix	trans	-108.6	-16.5	-170.4	66	0	0	0	0	114.3	R846 K852	R846-T850 HydrophobicContact CB-CG2 4.25Å; R846-T850 WeakPolarHBondContact O-CB 3.3Å; R846-T850 PolarHBondContact O-N 2.9Å; R846-T850 PolarHBondContact O-OG1 3.38Å; T850-K852 PolarHBondContact O-N 3.45Å; T850-K852 VanDerWaalsContact O-N 3.16Å; T850-K852 PolarHBondContact OG1-N 3.38Å
851	G	75.2	Confident	82.4	Confident	51 Å²	51	71.2 Å²	71.2	53%	0.526	36%	0.364	S	S	.	.	S	Bend	trans	65.9	5.9	-173.7	0	0	0	0	0	114.9	Y847	Y847-G851 WeakPolarHBondContact CE2-O 3.49Å; Y847-G851 VanDerWaalsContact O-CA 3.27Å; Y847-G851 WeakPolarHBondContact O-CA 3.23Å; Y847-G851 PolarHBondContact O-N 3.33Å
852	K	81.2	Confident	82.6	Confident	160 Å²	160	70.2 Å²	70.2	70%	0.696	36%	0.359	S	S	*	.	S	Bend	trans	-111.6	145.9	-179	-67.5	-176.3	-178.9	179.8	0	111.1	T850	T850-K852 PolarHBondContact O-N 3.45Å; T850-K852 VanDerWaalsContact O-N 3.16Å; T850-K852 PolarHBondContact OG1-N 3.38Å
853	Y	84.3	Confident	82.8	Confident	121 Å²	121	69.6 Å²	69.6	48%	0.475	36%	0.357	S	S	.	.			trans	-76.9	138.2	172	-62	-58.4	0	0	0	110.5	K843 F844 Y847	K843-Y853 HydrophobicContact CD-CD1 4.27Å; K843-Y853 HydrophobicContact CG-CD1 3.66Å; K843-Y853 HydrophobicContact CG-CE1 4.47Å; K843-Y853 HydrophobicContact CG-CG 4.17Å; F844-Y853 HydrophobicContact CD1-CD1 4.46Å; F844-Y853 HydrophobicContact CD1-CE1 4.05Å; F844-Y853 HydrophobicContact CE1-CD1 4.28Å; F844-Y853 AromaticContact CE1-CE1 3.53Å; F844-Y853 HydrophobicContact CE1-CE1 3.53Å; F844-Y853 HydrophobicContact CZ-CE1 4.17Å; Y847-Y853 AromaticContact CD2-CD1 3.85Å; Y847-Y853 HydrophobicContact CD2-CD1 3.85Å; Y847-Y853 AromaticContact CD2-CE1 3.68Å; Y847-Y853 HydrophobicContact CD2-CE1 3.68Å; Y847-Y853 HydrophobicContact CE2-CD1 4.17Å; Y847-Y853 AromaticContact CE2-CE1 3.62Å; Y847-Y853 HydrophobicContact CE2-CE1 3.62Å; Y847-Y853 HydrophobicContact CE2-CE2 4.48Å; Y847-Y853 AromaticContact CE2-CZ 3.81Å; Y847-Y853 HydrophobicContact CG-CE1 4.47Å
854	V	84.6	Confident	83	Confident	35 Å²	35	68.6 Å²	68.6	21%	0.212	35%	0.352	C	S	.	.			trans	-90	131	171.9	-178	0	0	0	0	108.6	I842 K843 R846 D856	I842-V854 HydrophobicContact CG2-CG1 4.28Å; K843-V854 PolarHBondContact O-N 3.41Å; R846-V854 HydrophobicContact CB-CG2 4.19Å; R846-V854 HydrophobicContact CG-CG2 4.39Å; V854-D856 WeakPolarHBondContact CG1-O 3.43Å
855	T	85.8	Confident	83.5	Confident	86 Å²	86	66.6 Å²	66.6	53%	0.528	34%	0.344	S	S	.	.			trans	-112.7	-9	-177	46	0	0	0	0	113.9	L816	L816-T855 WeakPolarHBondContact CG-O 3.11Å; L816-T855 PolarHBondContact N-O 3.29Å
856	D	89.1	Confident	84.1	Confident	66 Å²	66	64.9 Å²	64.9	35%	0.353	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.9	-170.3	-50.3	-81.9	0	0	0	110.2	K813 I814 V854	K813-D856 HydrophobicContact CB-CB 4.11Å; K813-D856 HydrophobicContact CD-CB 4.11Å; I814-D856 CarbonylContact O-C 3.48Å; I814-D856 VanDerWaalsContact O-CA 3.28Å; I814-D856 WeakPolarHBondContact O-CA 3.12Å; V854-D856 WeakPolarHBondContact CG1-O 3.43Å
857	I	90	Very high	84.7	Confident	6 Å²	6	58.9 Å²	58.9	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.7	-177.4	-169.7	170	0	0	0	111.3	K813 I814 V819 I842 D861 F862 L865	K813-I857 WeakPolarHBondContact CA-O 3.38Å; I814-I857 HydrophobicContact CD1-CG2 3.93Å; I814-I857 HydrophobicContact CG1-CG2 3.41Å; I814-I857 VanDerWaalsContact CG1-CG2 3.41Å; I814-I857 PolarHBondContact N-O 2.99Å; I814-I857 PolarHBondContact O-N 2.88Å; V819-I857 HydrophobicContact CG2-CG2 3.89Å; I842-I857 HydrophobicContact CD1-CD1 3.87Å; I842-I857 HydrophobicContact CG1-CD1 4.14Å; I857-D861 HydrophobicContact CD1-CB 4.19Å; I857-D861 HydrophobicContact CG1-CB 3.76Å; I857-F862 HydrophobicContact CD1-CB 4.06Å; I857-F862 HydrophobicContact CG1-CB 4.33Å; I857-L865 HydrophobicContact CD1-CD2 4.23Å
858	D	91.1	Very high	85.4	Confident	41 Å²	41	54.9 Å²	54.9	22%	0.219	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	160.5	173.8	-68.5	-60.4	0	0	0	110.8	T812 K813 E860 D861 F862	T812-D858 PolarHBondContact OG1-OD1 3.04Å; K813-D858 WeakPolarHBondContact CE-OD1 3.29Å; K813-D858 VanDerWaalsContact CE-OD2 3.24Å; K813-D858 WeakPolarHBondContact CE-OD2 3.42Å; K813-D858 WeakPolarHBondContact CG-OD1 3.45Å; K813-D858 IonicContact NZ-OD2 2.67Å; D858-E860 VanDerWaalsContact C-N 3.34Å; D858-E860 PolarHBondContact O-N 3.02Å; D858-D861 PolarHBondContact O-N 3.27Å; D858-F862 PolarHBondContact O-N 3.49Å
859	L	89.4	Confident	86.4	Confident	29 Å²	29	53.2 Å²	53.2	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-57.3	-42.6	-178.3	178.4	67.6	0	0	0	113.1	E789 F792 F862 I863	E789-L859 HydrophobicContact CG-CD2 3.67Å; F792-L859 HydrophobicContact CB-CD1 3.9Å; F792-L859 HydrophobicContact CD1-CB 4.42Å; F792-L859 HydrophobicContact CD1-CD1 4.34Å; F792-L859 HydrophobicContact CD2-CB 4.43Å; F792-L859 HydrophobicContact CD2-CD1 3.74Å; F792-L859 HydrophobicContact CE1-CB 4.2Å; F792-L859 HydrophobicContact CE2-CB 4.21Å; F792-L859 HydrophobicContact CE2-CD1 4.32Å; F792-L859 HydrophobicContact CG-CD1 3.75Å; F792-L859 HydrophobicContact CZ-CB 4.09Å; L859-F862 WeakPolarHBondContact O-CB 3.09Å; L859-F862 PolarHBondContact O-N 2.87Å; L859-I863 HydrophobicContact CD1-CD1 4.41Å; L859-I863 HydrophobicContact CG-CD1 4.12Å; L859-I863 WeakPolarHBondContact O-CG1 3.31Å; L859-I863 PolarHBondContact O-N 2.81Å
860	E	88.8	Confident	87.1	Confident	106 Å²	106	47.4 Å²	47.4	50%	0.495	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-44	-179.6	-67.3	178.9	-173.9	0	0	112.3	M769 D858 F862 I863 K864	M769-E860 HydrophobicContact CE-CB 3.95Å; M769-E860 HydrophobicContact CE-CG 4.26Å; M769-E860 HydrophobicContact CG-CB 4.35Å; M769-E860 HydrophobicContact CG-CG 4.27Å; M769-E860 HydrophobicContact SD-CB 3.97Å; M769-E860 HydrophobicContact SD-CG 4.47Å; D858-E860 VanDerWaalsContact C-N 3.34Å; D858-E860 PolarHBondContact O-N 3.02Å; E860-F862 VanDerWaalsContact C-N 3.29Å; E860-F862 PolarHBondContact O-N 3.25Å; E860-I863 PolarHBondContact O-N 3.45Å; E860-K864 PolarHBondContact O-N 3.37Å; E860-K864 VanDerWaalsContact O-N 3.14Å
861	D	88.4	Confident	87.5	Confident	60 Å²	60	46.9 Å²	46.9	32%	0.321	24%	0.243	S	C	.	.	H	α-helix	trans	-66.1	-35	175.9	-76.5	-20.7	0	0	0	110.8	R846 I857 D858 K864 L865	R846-D861 IonicContact NH2-OD2 2.76Å; I857-D861 HydrophobicContact CD1-CB 4.19Å; I857-D861 HydrophobicContact CG1-CB 3.76Å; D858-D861 PolarHBondContact O-N 3.27Å; D861-K864 PolarHBondContact O-N 3.24Å; D861-L865 WeakPolarHBondContact O-CB 3.07Å; D861-L865 PolarHBondContact O-N 3Å
862	F	91.4	Very high	87.7	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-41.8	172.8	174.3	-97.1	0	0	0	112.2	F792 V819 L822 M823 L826 I857 D858 L859 E860 K864 L865 Y866	F792-F862 HydrophobicContact CE2-CB 4.38Å; V819-F862 HydrophobicContact CG1-CD2 4.4Å; V819-F862 HydrophobicContact CG1-CE2 4.2Å; L822-F862 HydrophobicContact CB-CE2 4.21Å; L822-F862 HydrophobicContact CB-CZ 4.09Å; L822-F862 HydrophobicContact CD2-CD1 3.77Å; L822-F862 HydrophobicContact CD2-CD2 3.89Å; L822-F862 HydrophobicContact CD2-CE1 3.44Å; L822-F862 VanDerWaalsContact CD2-CE1 3.44Å; L822-F862 HydrophobicContact CD2-CE2 3.56Å; L822-F862 HydrophobicContact CD2-CG 4Å; L822-F862 HydrophobicContact CD2-CZ 3.35Å; L822-F862 HydrophobicContact CG-CE1 3.77Å; L822-F862 HydrophobicContact CG-CE2 3.89Å; L822-F862 HydrophobicContact CG-CZ 3.39Å; M823-F862 HydrophobicContact CE-CD2 4.48Å; M823-F862 HydrophobicContact CE-CE2 3.77Å; M823-F862 HydrophobicContact CE-CZ 4.25Å; M823-F862 HydrophobicContact CG-CE2 4.29Å; M823-F862 HydrophobicContact SD-CE2 4.34Å; M823-F862 HydrophobicContact SD-CZ 4.37Å; L826-F862 HydrophobicContact CD1-CE1 3.69Å; L826-F862 HydrophobicContact CD1-CZ 3.82Å; I857-F862 HydrophobicContact CD1-CB 4.06Å; I857-F862 HydrophobicContact CG1-CB 4.33Å; D858-F862 PolarHBondContact O-N 3.49Å; L859-F862 WeakPolarHBondContact O-CB 3.09Å; L859-F862 PolarHBondContact O-N 2.87Å; E860-F862 VanDerWaalsContact C-N 3.29Å; E860-F862 PolarHBondContact O-N 3.25Å; F862-K864 VanDerWaalsContact C-N 3.33Å; F862-K864 PolarHBondContact O-N 3.13Å; F862-L865 CarbonylContact O-C 3.52Å; F862-L865 WeakPolarHBondContact O-CB 3.2Å; F862-L865 PolarHBondContact O-N 2.8Å; F862-Y866 HydrophobicContact CZ-CD2 4.34Å; F862-Y866 WeakPolarHBondContact O-CB 3.49Å; F862-Y866 PolarHBondContact O-N 2.86Å
863	I	90.2	Very high	87.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.3	177.2	-71.9	165.2	0	0	0	111	M769 Y773 I776 Y785 M788 L859 E860 L865 Y866 I867	M769-I863 HydrophobicContact CE-CB 4.1Å; M769-I863 HydrophobicContact CE-CD1 4.46Å; M769-I863 HydrophobicContact CE-CG2 3.98Å; Y773-I863 HydrophobicContact CE1-CD1 4.15Å; I776-I863 HydrophobicContact CD1-CG2 3.73Å; Y785-I863 HydrophobicContact CD2-CD1 4.18Å; Y785-I863 HydrophobicContact CE2-CD1 3.57Å; M788-I863 HydrophobicContact SD-CG1 4.49Å; L859-I863 HydrophobicContact CD1-CD1 4.41Å; L859-I863 HydrophobicContact CG-CD1 4.12Å; L859-I863 WeakPolarHBondContact O-CG1 3.31Å; L859-I863 PolarHBondContact O-N 2.81Å; E860-I863 PolarHBondContact O-N 3.45Å; I863-L865 VanDerWaalsContact C-N 3.33Å; I863-L865 PolarHBondContact O-N 2.81Å; I863-Y866 PolarHBondContact O-N 2.9Å; I863-I867 HydrophobicContact CG2-CD1 3.75Å; I863-I867 WeakPolarHBondContact O-CG1 3.2Å; I863-I867 PolarHBondContact O-N 3.37Å
864	K	88.9	Confident	87.2	Confident	61 Å²	61	41.6 Å²	41.6	27%	0.265	23%	0.233	S	C	.	.	H	α-helix	trans	-59.9	-45.6	174.3	-68.7	179.8	-168.9	169.4	0	111.2	M769 F772 E860 D861 F862 N868	M769-K864 HydrophobicContact SD-CD 4.25Å; M769-K864 WeakPolarHBondContact SD-CE 3.3Å; M769-K864 HydrophobicContact SD-CG 4.1Å; F772-K864 HydrophobicContact CD1-CG 4.3Å; F772-K864 HydrophobicContact CD2-CG 4.26Å; F772-K864 HydrophobicContact CE1-CG 4.35Å; F772-K864 HydrophobicContact CE2-CD 4.35Å; F772-K864 HydrophobicContact CE2-CG 4.31Å; F772-K864 HydrophobicContact CG-CG 4.26Å; F772-K864 HydrophobicContact CZ-CD 4.49Å; F772-K864 HydrophobicContact CZ-CG 4.35Å; E860-K864 PolarHBondContact O-N 3.37Å; E860-K864 VanDerWaalsContact O-N 3.14Å; D861-K864 PolarHBondContact O-N 3.24Å; F862-K864 VanDerWaalsContact C-N 3.33Å; F862-K864 PolarHBondContact O-N 3.13Å; K864-N868 VanDerWaalsContact O-CB 3.26Å; K864-N868 WeakPolarHBondContact O-CB 3.22Å; K864-N868 VanDerWaalsContact O-CG 3.32Å; K864-N868 PolarHBondContact O-N 2.79Å; K864-N868 PolarHBondContact O-ND2 2.9Å; K864-N868 VanDerWaalsContact O-ND2 3.13Å
865	L	90.1	Very high	86.9	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.037	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-46.9	176.8	-169.7	79	0	0	0	111.2	V819 M823 M838 E841 I842 I857 D861 F862 I863 I867 N868 H869	V819-L865 HydrophobicContact CG1-CD2 3.9Å; M823-L865 HydrophobicContact CE-CB 4.39Å; M823-L865 HydrophobicContact CE-CD2 3.81Å; M823-L865 HydrophobicContact CE-CG 3.94Å; M838-L865 HydrophobicContact CG-CD1 4.34Å; M838-L865 HydrophobicContact CG-CD2 4.41Å; M838-L865 HydrophobicContact CG-CG 4.46Å; M838-L865 HydrophobicContact SD-CD2 4.25Å; M838-L865 HydrophobicContact SD-CG 4.49Å; E841-L865 HydrophobicContact CG-CD1 4.44Å; I842-L865 HydrophobicContact CD1-CD2 3.75Å; I842-L865 HydrophobicContact CG1-CD1 4.38Å; I842-L865 HydrophobicContact CG1-CD2 4.32Å; I857-L865 HydrophobicContact CD1-CD2 4.23Å; D861-L865 WeakPolarHBondContact O-CB 3.07Å; D861-L865 PolarHBondContact O-N 3Å; F862-L865 CarbonylContact O-C 3.52Å; F862-L865 WeakPolarHBondContact O-CB 3.2Å; F862-L865 PolarHBondContact O-N 2.8Å; I863-L865 VanDerWaalsContact C-N 3.33Å; I863-L865 PolarHBondContact O-N 2.81Å; L865-I867 PolarHBondContact O-N 2.94Å; L865-N868 PolarHBondContact O-N 2.9Å; L865-H869 WeakPolarHBondContact O-CB 3.12Å; L865-H869 PolarHBondContact O-CD2 2.66Å; L865-H869 VanDerWaalsContact O-CD2 3.27Å; L865-H869 PolarHBondContact O-N 2.88Å
866	Y	90.9	Very high	86.7	Confident	16 Å²	16	43.1 Å²	43.1	6%	0.063	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-49.8	178.8	178.5	-94.2	0	0	0	111.7	F784 M788 M823 L826 H828 F862 I863 N868 H869 R870	F784-Y866 HydrophobicContact CE1-CE1 4.17Å; F784-Y866 HydrophobicContact CZ-CE1 4.23Å; M788-Y866 HydrophobicContact CE-CD1 3.32Å; M788-Y866 HydrophobicContact CE-CD2 4.34Å; M788-Y866 HydrophobicContact CE-CE1 3.23Å; M788-Y866 HydrophobicContact CE-CE2 4.3Å; M788-Y866 HydrophobicContact CE-CG 3.91Å; M823-Y866 HydrophobicContact CE-CD2 4.42Å; M823-Y866 HydrophobicContact SD-CD2 3.55Å; M823-Y866 VanDerWaalsContact SD-CD2 3.55Å; M823-Y866 HydrophobicContact SD-CE2 4.34Å; M823-Y866 HydrophobicContact SD-CG 4.39Å; L826-Y866 HydrophobicContact CB-CD2 4.39Å; L826-Y866 HydrophobicContact CB-CE2 3.58Å; L826-Y866 HydrophobicContact CD1-CD2 3.91Å; L826-Y866 HydrophobicContact CD1-CE2 3.9Å; L826-Y866 HydrophobicContact CG-CE2 4.41Å; L826-Y866 PolarHBondContact O-OH 2.81Å; H828-Y866 HydrophobicContact CB-CE2 4.18Å; F862-Y866 HydrophobicContact CZ-CD2 4.34Å; F862-Y866 WeakPolarHBondContact O-CB 3.49Å; F862-Y866 PolarHBondContact O-N 2.86Å; I863-Y866 PolarHBondContact O-N 2.9Å; Y866-N868 VanDerWaalsContact C-N 3.3Å; Y866-N868 PolarHBondContact O-N 3.03Å; Y866-H869 PolarHBondContact O-N 2.95Å; Y866-R870 WeakPolarHBondContact O-CB 3.48Å; Y866-R870 WeakPolarHBondContact O-CG 3.33Å; Y866-R870 PolarHBondContact O-N 3.34Å
867	I	89.1	Confident	86.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-38.9	179	-68.4	165.5	0	0	0	111.5	L667 F772 L775 I776 I863 L865	L667-I867 HydrophobicContact CD2-CG2 4.26Å; F772-I867 HydrophobicContact CB-CD1 3.8Å; F772-I867 HydrophobicContact CD1-CD1 4.23Å; F772-I867 VanDerWaalsContact O-CD1 3.29Å; F772-I867 WeakPolarHBondContact O-CD1 3.43Å; L775-I867 HydrophobicContact CB-CD1 4.37Å; L775-I867 HydrophobicContact CB-CG2 4.34Å; L775-I867 HydrophobicContact CD1-CG2 3.63Å; I776-I867 HydrophobicContact CD1-CD1 4.37Å; I776-I867 HydrophobicContact CG1-CD1 4.02Å; I863-I867 HydrophobicContact CG2-CD1 3.75Å; I863-I867 WeakPolarHBondContact O-CG1 3.2Å; I863-I867 PolarHBondContact O-N 3.37Å; L865-I867 PolarHBondContact O-N 2.94Å
868	N	89.3	Confident	85.9	Confident	5 Å²	5	50 Å²	50	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-74.5	-31.4	-177.7	-80	-34.5	0	0	0	113.5	K649 T665 L667 D710 K864 L865 Y866	K649-N868 WeakPolarHBondContact CE-O 3.15Å; K649-N868 PolarHBondContact NZ-O 3.44Å; T665-N868 WeakPolarHBondContact O-CB 2.94Å; L667-N868 PolarHBondContact N-OD1 3.38Å; D710-N868 PolarHBondContact O-ND2 3.04Å; K864-N868 VanDerWaalsContact O-CB 3.26Å; K864-N868 WeakPolarHBondContact O-CB 3.22Å; K864-N868 VanDerWaalsContact O-CG 3.32Å; K864-N868 PolarHBondContact O-N 2.79Å; K864-N868 PolarHBondContact O-ND2 2.9Å; K864-N868 VanDerWaalsContact O-ND2 3.13Å; L865-N868 PolarHBondContact O-N 2.9Å; Y866-N868 VanDerWaalsContact C-N 3.3Å; Y866-N868 PolarHBondContact O-N 3.03Å
869	H	88.3	Confident	85.3	Confident	19 Å²	19	52.9 Å²	52.9	9%	0.088	29%	0.29	C	S	.	.	H	α-helix	trans	-93.7	-30.9	179.9	-75.4	-93.9	0	0	0	113.5	T665 M838 E841 L865 Y866	T665-H869 VanDerWaalsContact CB-CE1 3.44Å; T665-H869 WeakPolarHBondContact CB-CE1 3.33Å; M838-H869 WeakPolarHBondContact CG-CE1 3.27Å; M838-H869 HydrophobicContact SD-CB 4.32Å; E841-H869 IonicContact OE2-CE1 3.8Å; E841-H869 IonicContact OE2-NE2 3.67Å; E841-H869 PolarHBondContact OE2-NE2 3.1Å; L865-H869 WeakPolarHBondContact O-CB 3.12Å; L865-H869 PolarHBondContact O-CD2 2.66Å; L865-H869 VanDerWaalsContact O-CD2 3.27Å; L865-H869 PolarHBondContact O-N 2.88Å; Y866-H869 PolarHBondContact O-N 2.95Å
870	R	87.1	Confident	85.1	Confident	46 Å²	46	52.4 Å²	52.4	17%	0.174	29%	0.287	C	S	.	.	S	Bend	trans	-58.8	145	178.1	76.4	-175.8	-176.5	168.5	1.4	111.8	K649 L775 Y866	K649-R870 VanDerWaalsContact CE-O 3.24Å; K649-R870 WeakPolarHBondContact CE-O 3.34Å; K649-R870 PolarHBondContact NZ-O 3Å; L775-R870 PolarHBondContact O-NH2 3.06Å; Y866-R870 WeakPolarHBondContact O-CB 3.48Å; Y866-R870 WeakPolarHBondContact O-CG 3.33Å; Y866-R870 PolarHBondContact O-N 3.34Å
871	P	83.8	Confident	84.8	Confident	69 Å²	69	50.9 Å²	50.9	45%	0.448	28%	0.282	S	S	.	.			trans	-61.1	142.6	176.8	28.5	-36.3	0	0	0	110.5	H828 F873	H828-P871 VanDerWaalsContact ND1-CD 3.33Å; H828-P871 WeakPolarHBondContact ND1-CD 3.39Å; P871-F873 VanDerWaalsContact C-N 3.29Å; P871-F873 PolarHBondContact O-N 3.09Å
872	A	80.1	Confident	84.6	Confident	34 Å²	34	54 Å²	54	28%	0.281	29%	0.294	S	S	.	.	S	Bend	trans	-67.4	-34.1	-179	0	0	0	0	0	112.1	Y648 L667 T670	Y648-A872 HydrophobicContact CD2-CB 4.26Å; L667-A872 HydrophobicContact CD1-CB 3.95Å; T670-A872 HydrophobicContact CG2-CB 4.07Å
873	F	80.1	Confident	84.2	Confident	122 Å²	122	55.9 Å²	55.9	54%	0.535	31%	0.31	S	S	.	.	S	Bend	trans	-127.5	145.1	176.5	-59.3	-76.9	0	0	0	108.9	Y648 P871	Y648-F873 AromaticContact CD2-CD2 3.94Å; Y648-F873 HydrophobicContact CD2-CD2 3.94Å; Y648-F873 AromaticContact CD2-CE2 3.74Å; Y648-F873 HydrophobicContact CD2-CE2 3.74Å; Y648-F873 HydrophobicContact CE1-CE2 4.42Å; Y648-F873 AromaticContact CE2-CD2 3.67Å; Y648-F873 HydrophobicContact CE2-CD2 3.67Å; Y648-F873 AromaticContact CE2-CE2 3.4Å; Y648-F873 HydrophobicContact CE2-CE2 3.4Å; Y648-F873 VanDerWaalsContact CE2-CE2 3.4Å; Y648-F873 HydrophobicContact CG-CE2 4.4Å; Y648-F873 AromaticContact CZ-CE2 3.78Å; P871-F873 VanDerWaalsContact C-N 3.29Å; P871-F873 PolarHBondContact O-N 3.09Å
874	G	74.4	Confident	84	Confident	64 Å²	64	56.3 Å²	56.3	66%	0.66	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-64.2	167.6	171.1	0	0	0	0	0	111.7	S876	G874-S876 PolarHBondContact O-N 3.38Å
875	I	79.8	Confident	83.7	Confident	110 Å²	110	57.4 Å²	57.4	56%	0.564	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-63	122.7	176.9	-59.1	169.9	0	0	0	108.8	L880	I875-L880 HydrophobicContact CG2-CD1 4.1Å; I875-L880 HydrophobicContact CG2-CD2 3.85Å; I875-L880 HydrophobicContact CG2-CG 3.68Å
876	S	80.3	Confident	83.4	Confident	44 Å²	44	62.8 Å²	62.8	31%	0.308	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-81.4	152.8	180	66.7	0	0	0	0	112	G874 E878 E879 L880	G874-S876 PolarHBondContact O-N 3.38Å; S876-E878 PolarHBondContact O-N 2.98Å; S876-E879 PolarHBondContact N-OE2 2.69Å; S876-E879 PolarHBondContact O-N 2.84Å; S876-E879 WeakPolarHBondContact OG-CB 3.29Å; S876-E879 VanDerWaalsContact OG-CD 3.22Å; S876-E879 WeakPolarHBondContact OG-CG 3.34Å; S876-E879 PolarHBondContact OG-N 2.87Å; S876-E879 VanDerWaalsContact OG-N 3.16Å; S876-E879 PolarHBondContact OG-OE2 3.38Å; S876-L880 PolarHBondContact O-N 3.48Å
877	S	80.3	Confident	83.1	Confident	76 Å²	76	64.8 Å²	64.8	53%	0.531	37%	0.365	S	S	.	.	H	α-helix	trans	-60.6	-30.5	173.6	-175.1	0	0	0	0	112.1	L881	S877-L881 VanDerWaalsContact O-CG 3.32Å; S877-L881 WeakPolarHBondContact O-CG 3.39Å; S877-L881 PolarHBondContact O-N 3.33Å
878	E	81.4	Confident	82.7	Confident	141 Å²	141	65.4 Å²	65.4	66%	0.659	37%	0.371	S	S	*	.	H	α-helix	trans	-69.7	-42.9	178.3	-66.6	-176.7	-176.9	0	0	112	S876 L880 L881 Q882	S876-E878 PolarHBondContact O-N 2.98Å; E878-L880 VanDerWaalsContact C-N 3.3Å; E878-L880 PolarHBondContact O-N 2.71Å; E878-L881 WeakPolarHBondContact O-CB 3.41Å; E878-L881 PolarHBondContact O-N 2.75Å; E878-Q882 WeakPolarHBondContact O-CG 3.46Å; E878-Q882 PolarHBondContact O-N 2.89Å
879	E	80.5	Confident	82.3	Confident	101 Å²	101	71.1 Å²	71.1	47%	0.472	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-40.9	174.9	-76	165.2	156.9	0	0	111.5	S876 Q882 A883	S876-E879 PolarHBondContact N-OE2 2.69Å; S876-E879 PolarHBondContact O-N 2.84Å; S876-E879 WeakPolarHBondContact OG-CB 3.29Å; S876-E879 VanDerWaalsContact OG-CD 3.22Å; S876-E879 WeakPolarHBondContact OG-CG 3.34Å; S876-E879 PolarHBondContact OG-N 2.87Å; S876-E879 VanDerWaalsContact OG-N 3.16Å; S876-E879 PolarHBondContact OG-OE2 3.38Å; E879-Q882 PolarHBondContact O-N 2.87Å; E879-A883 WeakPolarHBondContact O-CB 3.17Å; E879-A883 PolarHBondContact O-N 3.16Å
880	L	83.1	Confident	81.9	Confident	18 Å²	18	77.5 Å²	77.5	9%	0.094	42%	0.423	C	S	.	.	H	α-helix	trans	-63.4	-45.3	174.4	-69.8	174	0	0	0	111.4	I875 S876 E878 Q882 A883 F884 V950 F953 T954 L958	I875-L880 HydrophobicContact CG2-CD1 4.1Å; I875-L880 HydrophobicContact CG2-CD2 3.85Å; I875-L880 HydrophobicContact CG2-CG 3.68Å; S876-L880 PolarHBondContact O-N 3.48Å; E878-L880 VanDerWaalsContact C-N 3.3Å; E878-L880 PolarHBondContact O-N 2.71Å; L880-Q882 VanDerWaalsContact C-N 3.33Å; L880-Q882 PolarHBondContact O-N 3.25Å; L880-A883 PolarHBondContact O-N 2.96Å; L880-F884 VanDerWaalsContact O-CD2 3.29Å; L880-F884 WeakPolarHBondContact O-CD2 3.35Å; L880-F884 PolarHBondContact O-N 2.95Å; L880-V950 HydrophobicContact CB-CG1 4.32Å; L880-F953 HydrophobicContact CD2-CD1 4.35Å; L880-F953 HydrophobicContact CD2-CE1 4.09Å; L880-T954 HydrophobicContact CD1-CG2 3.46Å; L880-T954 VanDerWaalsContact CD1-CG2 3.46Å; L880-L958 HydrophobicContact CD1-CD1 3.93Å; L880-L958 HydrophobicContact CD2-CD1 4.31Å
881	L	83.8	Confident	81.3	Confident	74 Å²	74	78.1 Å²	78.1	39%	0.387	43%	0.43	S	S	.	.	H	α-helix	trans	-59.2	-43.6	175.1	-77.4	163.6	0	0	0	111.8	S877 E878 F884 N885 V950	S877-L881 VanDerWaalsContact O-CG 3.32Å; S877-L881 WeakPolarHBondContact O-CG 3.39Å; S877-L881 PolarHBondContact O-N 3.33Å; E878-L881 WeakPolarHBondContact O-CB 3.41Å; E878-L881 PolarHBondContact O-N 2.75Å; L881-F884 PolarHBondContact O-N 3Å; L881-N885 WeakPolarHBondContact O-CB 3.49Å; L881-N885 VanDerWaalsContact O-CG 3.27Å; L881-N885 PolarHBondContact O-N 3.46Å; L881-N885 PolarHBondContact O-ND2 2.56Å; L881-N885 VanDerWaalsContact O-ND2 3.12Å; L881-V950 HydrophobicContact CD2-CB 4.22Å; L881-V950 HydrophobicContact CD2-CG1 4.02Å; L881-V950 HydrophobicContact CD2-CG2 4.03Å; L881-V950 HydrophobicContact CG-CG1 4.16Å
882	Q	83	Confident	80.6	Confident	125 Å²	125	83.9 Å²	83.9	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-63.9	-44.9	176.2	-72.5	-178.4	15.2	0	0	111.9	E878 E879 L880 F884 N885 V886	E878-Q882 WeakPolarHBondContact O-CG 3.46Å; E878-Q882 PolarHBondContact O-N 2.89Å; E879-Q882 PolarHBondContact O-N 2.87Å; L880-Q882 VanDerWaalsContact C-N 3.33Å; L880-Q882 PolarHBondContact O-N 3.25Å; Q882-F884 VanDerWaalsContact C-N 3.33Å; Q882-F884 PolarHBondContact O-N 3.18Å; Q882-N885 WeakPolarHBondContact O-CB 3.47Å; Q882-N885 PolarHBondContact O-N 3.28Å; Q882-N885 VanDerWaalsContact O-N 3.16Å; Q882-V886 WeakPolarHBondContact O-CG2 2.93Å; Q882-V886 PolarHBondContact O-N 2.73Å
883	A	83.6	Confident	80	Confident	41 Å²	41	90.1 Å²	90.1	34%	0.339	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-44.8	176.9	0	0	0	0	0	111.3	E879 L880 N885 V886 L887	E879-A883 WeakPolarHBondContact O-CB 3.17Å; E879-A883 PolarHBondContact O-N 3.16Å; L880-A883 PolarHBondContact O-N 2.96Å; A883-N885 PolarHBondContact O-N 3.01Å; A883-V886 PolarHBondContact O-N 3.35Å; A883-L887 WeakPolarHBondContact O-CB 3.24Å; A883-L887 WeakPolarHBondContact O-CG 3.37Å; A883-L887 PolarHBondContact O-N 3.3Å
884	F	85.5	Confident	79.6	Confident	10 Å²	10	86.3 Å²	86.3	4%	0.044	48%	0.479	C	S	.	.	H	α-helix	trans	-67.5	-33.1	175.7	-87.8	-107.5	0	0	0	112.7	L880 L881 Q882 V886 G888 P896 I898 I948 V950 F953	L880-F884 VanDerWaalsContact O-CD2 3.29Å; L880-F884 WeakPolarHBondContact O-CD2 3.35Å; L880-F884 PolarHBondContact O-N 2.95Å; L881-F884 PolarHBondContact O-N 3Å; Q882-F884 VanDerWaalsContact C-N 3.33Å; Q882-F884 PolarHBondContact O-N 3.18Å; F884-V886 VanDerWaalsContact C-N 3.27Å; F884-V886 PolarHBondContact O-N 3.33Å; F884-G888 WeakPolarHBondContact O-CA 3.16Å; F884-G888 PolarHBondContact O-N 3.43Å; F884-P896 HydrophobicContact CB-CB 4.04Å; F884-P896 HydrophobicContact CB-CG 3.9Å; F884-P896 VanDerWaalsContact O-CB 3.24Å; F884-P896 WeakPolarHBondContact O-CB 3.16Å; F884-I898 HydrophobicContact CD1-CD1 3.82Å; F884-I898 HydrophobicContact CD1-CG1 3.96Å; F884-I898 HydrophobicContact CE1-CB 4.45Å; F884-I898 HydrophobicContact CE1-CD1 3.76Å; F884-I898 HydrophobicContact CE1-CG1 4.03Å; F884-I898 HydrophobicContact CG-CD1 4.23Å; F884-I898 HydrophobicContact CZ-CD1 4.14Å; F884-I948 HydrophobicContact CE1-CG2 4.01Å; F884-I948 HydrophobicContact CZ-CG2 3.99Å; F884-V950 HydrophobicContact CB-CG2 3.47Å; F884-V950 VanDerWaalsContact CB-CG2 3.47Å; F884-V950 HydrophobicContact CD1-CG2 3.66Å; F884-V950 HydrophobicContact CD2-CG2 3.78Å; F884-V950 HydrophobicContact CE1-CG2 4.3Å; F884-V950 HydrophobicContact CE2-CG2 4.39Å; F884-V950 HydrophobicContact CG-CG2 3.36Å; F884-F953 HydrophobicContact CE2-CB 4.2Å; F884-F953 AromaticContact CE2-CD1 3.81Å; F884-F953 HydrophobicContact CE2-CD1 3.81Å; F884-F953 HydrophobicContact CE2-CE1 4.33Å; F884-F953 AromaticContact CE2-CG 3.97Å; F884-F953 HydrophobicContact CE2-CG 3.97Å; F884-F953 HydrophobicContact CZ-CB 3.66Å; F884-F953 HydrophobicContact CZ-CD1 4.03Å; F884-F953 HydrophobicContact CZ-CD2 4.13Å; F884-F953 AromaticContact CZ-CG 3.68Å; F884-F953 HydrophobicContact CZ-CG 3.68Å
885	N	84.1	Confident	79.7	Confident	84 Å²	84	86 Å²	86	45%	0.449	47%	0.466	S	S	.	.	H	α-helix	trans	-64.8	-31.2	172.5	-79.8	-38.7	0	0	0	112.8	L881 Q882 A883 P896	L881-N885 WeakPolarHBondContact O-CB 3.49Å; L881-N885 VanDerWaalsContact O-CG 3.27Å; L881-N885 PolarHBondContact O-N 3.46Å; L881-N885 PolarHBondContact O-ND2 2.56Å; L881-N885 VanDerWaalsContact O-ND2 3.12Å; Q882-N885 WeakPolarHBondContact O-CB 3.47Å; Q882-N885 PolarHBondContact O-N 3.28Å; Q882-N885 VanDerWaalsContact O-N 3.16Å; A883-N885 PolarHBondContact O-N 3.01Å; N885-P896 WeakPolarHBondContact OD1-CG 3.24Å
886	V	83.4	Confident	79.8	Confident	120 Å²	120	81.4 Å²	81.4	73%	0.727	44%	0.444	S	S	*	.	H	α-helix	trans	-83.4	-41.5	178.9	173.7	0	0	0	0	111.9	Q882 A883 F884	Q882-V886 WeakPolarHBondContact O-CG2 2.93Å; Q882-V886 PolarHBondContact O-N 2.73Å; A883-V886 PolarHBondContact O-N 3.35Å; F884-V886 VanDerWaalsContact C-N 3.27Å; F884-V886 PolarHBondContact O-N 3.33Å
887	L	83.5	Confident	80	Confident	58 Å²	58	80.4 Å²	80.4	30%	0.304	44%	0.435	S	S	.	.	H	α-helix	trans	-91.7	-32.9	-173.9	-62.7	175.7	0	0	0	113.2	A883 I898 F906	A883-L887 WeakPolarHBondContact O-CB 3.24Å; A883-L887 WeakPolarHBondContact O-CG 3.37Å; A883-L887 PolarHBondContact O-N 3.3Å; L887-I898 HydrophobicContact CB-CD1 3.9Å; L887-F906 HydrophobicContact CB-CE2 4.32Å
888	G	81.3	Confident	80.3	Confident	12 Å²	12	77 Å²	77	12%	0.124	41%	0.411	C	S	.	.	S	Bend	trans	-90.7	154.8	-173.7	0	0	0	0	0	113.5	F884 I897	F884-G888 WeakPolarHBondContact O-CA 3.16Å; F884-G888 PolarHBondContact O-N 3.43Å; G888-I897 CarbonylContact C-O 3.53Å; G888-I897 WeakPolarHBondContact CA-O 3.11Å
889	K	81.5	Confident	80.5	Confident	126 Å²	126	74.8 Å²	74.8	55%	0.548	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	141.4	172	-70.8	170.9	180	156.7	0	109.2	I897 E902	K889-I897 PolarHBondContact N-O 3.42Å; K889-I897 PolarHBondContact O-N 2.99Å; K889-E902 IonicContact NZ-OE1 2.67Å; K889-E902 PolarHBondContact NZ-OE1 2.96Å
890	K	79.1	Confident	80.5	Confident	152 Å²	152	71.2 Å²	71.2	66%	0.661	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.2	175.8	-65.5	-172.7	178.9	-175	0	110.4	S895	K890-S895 WeakPolarHBondContact CA-O 2.92Å
891	N	75.3	Confident	80.5	Confident	60 Å²	60	73.4 Å²	73.4	32%	0.321	40%	0.4	S	S	.	.			trans	-70.9	175.2	169.9	-82.4	-6.5	0	0	0	112.4	L893 G894 S895 I897	N891-L893 PolarHBondContact O-N 3.12Å; N891-L893 VanDerWaalsContact O-N 3.13Å; N891-G894 PolarHBondContact O-N 2.76Å; N891-S895 PolarHBondContact N-O 3.13Å; N891-I897 WeakPolarHBondContact ND2-CD1 3.43Å; N891-I897 WeakPolarHBondContact ND2-CG1 3.43Å
892	L	69.2	Low	80.4	Confident	190 Å²	190	71.6 Å²	71.6	100%	0.995	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.9	170.9	-67.6	165.5	0	0	0	113.8
893	L	66.6	Low	80.3	Confident	165 Å²	165	67.5 Å²	67.5	86%	0.864	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	2.4	176.3	-73.2	158.2	0	0	0	113.4	N891 S895	N891-L893 PolarHBondContact O-N 3.12Å; N891-L893 VanDerWaalsContact O-N 3.13Å; L893-S895 PolarHBondContact O-N 2.94Å
894	G	72	Confident	80.1	Confident	41 Å²	41	66.9 Å²	66.9	42%	0.423	36%	0.362	S	S	.	.	S	Bend	trans	85.5	-7.6	177.8	0	0	0	0	0	116.3	N891	N891-G894 PolarHBondContact O-N 2.76Å
895	S	76	Confident	80	Confident	57 Å²	57	72.8 Å²	72.8	40%	0.399	39%	0.387	S	S	.	.			trans	-77.4	140.8	177.7	56.5	0	0	0	0	112.8	K890 N891 L893	K890-S895 WeakPolarHBondContact CA-O 2.92Å; N891-S895 PolarHBondContact N-O 3.13Å; L893-S895 PolarHBondContact O-N 2.94Å
896	P	81.9	Confident	80	Confident	15 Å²	15	71.1 Å²	71.1	10%	0.097	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.9	179.2	30.2	-34.3	0	0	0	111.8	F884 N885 V950	F884-P896 HydrophobicContact CB-CB 4.04Å; F884-P896 HydrophobicContact CB-CG 3.9Å; F884-P896 VanDerWaalsContact O-CB 3.24Å; F884-P896 WeakPolarHBondContact O-CB 3.16Å; N885-P896 WeakPolarHBondContact OD1-CG 3.24Å; P896-V950 HydrophobicContact CG-CG2 4.45Å
897	I	85.1	Confident	79.8	Confident	22 Å²	22	68.5 Å²	68.5	11%	0.113	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.5	173.5	-65.4	-155.7	0	0	0	110.2	G888 K889 N891 R947 I948	G888-I897 CarbonylContact C-O 3.53Å; G888-I897 WeakPolarHBondContact CA-O 3.11Å; K889-I897 PolarHBondContact N-O 3.42Å; K889-I897 PolarHBondContact O-N 2.99Å; N891-I897 WeakPolarHBondContact ND2-CD1 3.43Å; N891-I897 WeakPolarHBondContact ND2-CG1 3.43Å; I897-R947 HydrophobicContact CG2-CB 3.87Å; I897-R947 HydrophobicContact CG2-CG 4.31Å; I897-I948 WeakPolarHBondContact CA-O 3.34Å
898	I	86.7	Confident	79.7	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.9	170.7	-59.9	173.1	0	0	0	108.7	F884 L887 E902 M903 F906 I948	F884-I898 HydrophobicContact CD1-CD1 3.82Å; F884-I898 HydrophobicContact CD1-CG1 3.96Å; F884-I898 HydrophobicContact CE1-CB 4.45Å; F884-I898 HydrophobicContact CE1-CD1 3.76Å; F884-I898 HydrophobicContact CE1-CG1 4.03Å; F884-I898 HydrophobicContact CG-CD1 4.23Å; F884-I898 HydrophobicContact CZ-CD1 4.14Å; L887-I898 HydrophobicContact CB-CD1 3.9Å; I898-E902 HydrophobicContact CG2-CB 4.43Å; I898-M903 HydrophobicContact CG2-CB 3.98Å; I898-M903 HydrophobicContact CG2-SD 4.38Å; I898-F906 HydrophobicContact CG2-CE2 4.37Å; I898-I948 PolarHBondContact N-O 3.24Å; I898-I948 VanDerWaalsContact N-O 3.08Å; I898-I948 PolarHBondContact O-N 3.45Å
899	Q	85.5	Confident	79.6	Confident	95 Å²	95	71.2 Å²	71.2	44%	0.444	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	145.3	172.6	-67.1	-173.5	-10.3	0	0	110.3	S901 E902 M903	Q899-S901 VanDerWaalsContact C-N 3.31Å; Q899-S901 PolarHBondContact O-N 3.36Å; Q899-E902 HydrophobicContact CB-CB 4.46Å; Q899-E902 HydrophobicContact CB-CG 4.23Å; Q899-E902 WeakPolarHBondContact O-CA 3.29Å; Q899-E902 WeakPolarHBondContact O-CB 3.43Å; Q899-E902 PolarHBondContact O-N 3.09Å; Q899-M903 PolarHBondContact O-N 2.91Å
900	K	81.4	Confident	79.1	Confident	27 Å²	27	72.3 Å²	72.3	12%	0.117	38%	0.381	C	S	.	.	H	α-helix	trans	-50.1	-46.5	178.5	178	178.6	-174.4	143.2	0	114.5	E902 M903 I904 L940 G941 I944 E946	K900-E902 VanDerWaalsContact C-N 3.26Å; K900-E902 PolarHBondContact O-N 3.32Å; K900-M903 PolarHBondContact O-N 2.9Å; K900-I904 HydrophobicContact CG-CD1 4.15Å; K900-I904 WeakPolarHBondContact O-CG1 3.46Å; K900-I904 PolarHBondContact O-N 3.13Å; K900-L940 WeakPolarHBondContact CE-O 3.33Å; K900-L940 PolarHBondContact NZ-O 3.08Å; K900-G941 PolarHBondContact NZ-O 3.41Å; K900-I944 HydrophobicContact CD-CB 4.49Å; K900-I944 HydrophobicContact CG-CB 4.44Å; K900-I944 HydrophobicContact CG-CG2 4.2Å; K900-I944 PolarHBondContact NZ-O 3.4Å; K900-E946 PolarHBondContact N-O 2.84Å; K900-E946 VanDerWaalsContact N-O 3.11Å
901	S	81.1	Confident	78.8	Confident	64 Å²	64	68 Å²	68	45%	0.448	38%	0.38	S	S	.	.	H	α-helix	trans	-66.1	-30.7	-179.6	56.6	0	0	0	0	112.4	Q899 K905	Q899-S901 VanDerWaalsContact C-N 3.31Å; Q899-S901 PolarHBondContact O-N 3.36Å; S901-K905 WeakPolarHBondContact O-CD 3.41Å; S901-K905 VanDerWaalsContact O-CG 3.22Å; S901-K905 WeakPolarHBondContact O-CG 3.32Å; S901-K905 PolarHBondContact O-N 2.85Å
902	E	83.1	Confident	78.9	Confident	36 Å²	36	68.4 Å²	68.4	17%	0.168	38%	0.38	C	S	.	.	H	α-helix	trans	-74.7	-39.5	174.2	-64.3	-180	157.9	0	0	110.8	K889 I898 Q899 K900 K905 F906	K889-E902 IonicContact NZ-OE1 2.67Å; K889-E902 PolarHBondContact NZ-OE1 2.96Å; I898-E902 HydrophobicContact CG2-CB 4.43Å; Q899-E902 HydrophobicContact CB-CB 4.46Å; Q899-E902 HydrophobicContact CB-CG 4.23Å; Q899-E902 WeakPolarHBondContact O-CA 3.29Å; Q899-E902 WeakPolarHBondContact O-CB 3.43Å; Q899-E902 PolarHBondContact O-N 3.09Å; K900-E902 VanDerWaalsContact C-N 3.26Å; K900-E902 PolarHBondContact O-N 3.32Å; E902-K905 WeakPolarHBondContact O-CB 3.26Å; E902-K905 PolarHBondContact O-N 3.25Å; E902-F906 HydrophobicContact CB-CE2 4.11Å; E902-F906 WeakPolarHBondContact O-CD2 3.42Å; E902-F906 VanDerWaalsContact O-CG 3.22Å; E902-F906 WeakPolarHBondContact O-CG 3.5Å; E902-F906 PolarHBondContact O-N 2.8Å
903	M	81.2	Confident	79.1	Confident	38 Å²	38	66.4 Å²	66.4	19%	0.187	37%	0.365	C	S	.	.	H	α-helix	trans	-59.9	-47.1	175.4	-171.2	65.3	170.1	0	0	112.1	I898 Q899 K900 K905 F906 L907 I948 F953	I898-M903 HydrophobicContact CG2-CB 3.98Å; I898-M903 HydrophobicContact CG2-SD 4.38Å; Q899-M903 PolarHBondContact O-N 2.91Å; K900-M903 PolarHBondContact O-N 2.9Å; M903-K905 VanDerWaalsContact C-N 3.33Å; M903-K905 PolarHBondContact O-N 2.95Å; M903-F906 PolarHBondContact O-N 2.63Å; M903-F906 VanDerWaalsContact O-N 3.12Å; M903-L907 WeakPolarHBondContact O-CG 3.14Å; M903-L907 PolarHBondContact O-N 3.12Å; M903-I948 HydrophobicContact CB-CD1 4.21Å; M903-I948 HydrophobicContact CG-CD1 4.12Å; M903-F953 HydrophobicContact CE-CE2 3.94Å; M903-F953 HydrophobicContact CE-CZ 4.5Å
904	I	79.7	Confident	79.7	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.149	34%	0.338	C	S	.	.	H	α-helix	trans	-62.2	-43.4	177.4	-65.5	167.6	0	0	0	110.4	K900 F906 L907 Q908 L940	K900-I904 HydrophobicContact CG-CD1 4.15Å; K900-I904 WeakPolarHBondContact O-CG1 3.46Å; K900-I904 PolarHBondContact O-N 3.13Å; I904-F906 VanDerWaalsContact C-N 3.29Å; I904-F906 PolarHBondContact O-N 3.46Å; I904-L907 PolarHBondContact O-N 3.4Å; I904-Q908 WeakPolarHBondContact O-CG 3.43Å; I904-Q908 PolarHBondContact O-N 3.25Å; I904-Q908 VanDerWaalsContact O-N 3.09Å; I904-L940 HydrophobicContact CD1-CD2 3.96Å
905	K	82.6	Confident	80.2	Confident	133 Å²	133	62 Å²	62	58%	0.578	33%	0.334	S	S	*	.	H	α-helix	trans	-61.1	-37.9	174	-74.9	173.5	-177.1	-178.2	0	112.4	S901 E902 M903 Q908 A909	S901-K905 WeakPolarHBondContact O-CD 3.41Å; S901-K905 VanDerWaalsContact O-CG 3.22Å; S901-K905 WeakPolarHBondContact O-CG 3.32Å; S901-K905 PolarHBondContact O-N 2.85Å; E902-K905 WeakPolarHBondContact O-CB 3.26Å; E902-K905 PolarHBondContact O-N 3.25Å; M903-K905 VanDerWaalsContact C-N 3.33Å; M903-K905 PolarHBondContact O-N 2.95Å; K905-Q908 PolarHBondContact O-N 3.43Å; K905-A909 WeakPolarHBondContact O-CB 3.5Å; K905-A909 PolarHBondContact O-N 2.91Å
906	F	83.6	Confident	80.3	Confident	49 Å²	49	65.8 Å²	65.8	22%	0.215	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-41.4	176.9	-67.6	-40.2	0	0	0	111.8	L887 I898 E902 M903 I904 Q908 A909 R910	L887-F906 HydrophobicContact CB-CE2 4.32Å; I898-F906 HydrophobicContact CG2-CE2 4.37Å; E902-F906 HydrophobicContact CB-CE2 4.11Å; E902-F906 WeakPolarHBondContact O-CD2 3.42Å; E902-F906 VanDerWaalsContact O-CG 3.22Å; E902-F906 WeakPolarHBondContact O-CG 3.5Å; E902-F906 PolarHBondContact O-N 2.8Å; M903-F906 PolarHBondContact O-N 2.63Å; M903-F906 VanDerWaalsContact O-N 3.12Å; I904-F906 VanDerWaalsContact C-N 3.29Å; I904-F906 PolarHBondContact O-N 3.46Å; F906-Q908 VanDerWaalsContact C-N 3.28Å; F906-Q908 PolarHBondContact O-N 2.84Å; F906-A909 PolarHBondContact O-N 2.58Å; F906-R910 WeakPolarHBondContact O-CA 3.16Å; F906-R910 WeakPolarHBondContact O-CB 3.44Å; F906-R910 PolarHBondContact O-N 2.93Å
907	L	79.5	Confident	80.1	Confident	66 Å²	66	72.3 Å²	72.3	35%	0.346	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-34.1	175.6	-68.8	171.1	0	0	0	112.7	M903 I904	M903-L907 WeakPolarHBondContact O-CG 3.14Å; M903-L907 PolarHBondContact O-N 3.12Å; I904-L907 PolarHBondContact O-N 3.4Å
908	Q	81.8	Confident	79.9	Confident	41 Å²	41	75.7 Å²	75.7	19%	0.192	39%	0.39	C	S	.	.	H	α-helix	trans	-79.4	-36.5	177.2	-67.2	169.8	-14.5	0	0	112.8	I904 K905 F906 E916	I904-Q908 WeakPolarHBondContact O-CG 3.43Å; I904-Q908 PolarHBondContact O-N 3.25Å; I904-Q908 VanDerWaalsContact O-N 3.09Å; K905-Q908 PolarHBondContact O-N 3.43Å; F906-Q908 VanDerWaalsContact C-N 3.28Å; F906-Q908 PolarHBondContact O-N 2.84Å; Q908-E916 VanDerWaalsContact NE2-CG 3.3Å; Q908-E916 PolarHBondContact NE2-OE1 2.89Å
909	A	77.8	Confident	79.4	Confident	86 Å²	86	75.9 Å²	75.9	71%	0.711	39%	0.391	S	S	*	.	H	α-helix	trans	-103.1	-18.9	-168	0	0	0	0	0	115.2	K905 F906	K905-A909 WeakPolarHBondContact O-CB 3.5Å; K905-A909 PolarHBondContact O-N 2.91Å; F906-A909 PolarHBondContact O-N 2.58Å
910	R	72.9	Confident	78.8	Confident	149 Å²	149	72.7 Å²	72.7	56%	0.562	38%	0.381	S	S	*	.	S	Bend	trans	-126	135.8	-174.3	-65.1	-170.1	174.9	-167.8	0.3	111.3	F906	F906-R910 WeakPolarHBondContact O-CA 3.16Å; F906-R910 WeakPolarHBondContact O-CB 3.44Å; F906-R910 PolarHBondContact O-N 2.93Å
911	G	72.9	Confident	78.6	Confident	62 Å²	62	75.8 Å²	75.8	64%	0.639	40%	0.399	S	S	*	.	S	Bend	trans	90.2	-137.1	-178.2	0	0	0	0	0	110.9
912	E	75.4	Confident	78.3	Confident	68 Å²	68	75.8 Å²	75.8	32%	0.318	40%	0.398	S	S	.	.	S	Bend	trans	-79.1	128.7	173.5	-61.6	-176.1	159.1	0	0	108.7	T831 E832 M914	T831-E912 WeakPolarHBondContact CA-OE1 3.49Å; T831-E912 WeakPolarHBondContact CB-OE1 3.41Å; E832-E912 PolarHBondContact N-OE1 3.33Å; E912-M914 PolarHBondContact O-N 3.4Å
913	H	74.4	Confident	77.7	Confident	147 Å²	147	75.4 Å²	75.4	68%	0.681	40%	0.397	S	S	*	.			trans	-69.2	106.1	-174.3	177.6	-74.1	0	0	0	109.8
914	M	79	Confident	77.2	Confident	59 Å²	59	76.7 Å²	76.7	29%	0.291	41%	0.407	S	S	.	.			trans	-92.3	129.6	169.7	-59.4	-175.1	69.4	0	0	109.8	E912 E918 V919	E912-M914 PolarHBondContact O-N 3.4Å; M914-E918 HydrophobicContact CE-CB 4.45Å; M914-V919 HydrophobicContact CB-CG2 3.66Å; M914-V919 HydrophobicContact CE-CG2 4.09Å; M914-V919 HydrophobicContact SD-CG2 4.32Å
915	T	83	Confident	76.8	Confident	54 Å²	54	82.7 Å²	82.7	33%	0.331	43%	0.434	S	S	.	.			trans	-68.9	157.9	171.8	60.4	0	0	0	0	110.9	E917 E918 V919	T915-E917 PolarHBondContact O-N 2.72Å; T915-E918 PolarHBondContact N-OE2 2.8Å; T915-E918 PolarHBondContact O-N 3.3Å; T915-E918 WeakPolarHBondContact OG1-CB 3.36Å; T915-E918 WeakPolarHBondContact OG1-CG 3.15Å; T915-E918 PolarHBondContact OG1-N 2.9Å; T915-E918 PolarHBondContact OG1-OE2 2.8Å; T915-V919 WeakPolarHBondContact O-CG2 3.42Å; T915-V919 PolarHBondContact O-N 2.9Å
916	E	76.9	Confident	76	Confident	138 Å²	138	83.1 Å²	83.1	65%	0.645	44%	0.442	S	S	*	.	H	α-helix	trans	-60.5	-33.4	178.4	-48.1	-153.7	123.7	0	0	112.1	Q908 A920	Q908-E916 VanDerWaalsContact NE2-CG 3.3Å; Q908-E916 PolarHBondContact NE2-OE1 2.89Å; E916-A920 WeakPolarHBondContact O-CB 3.22Å; E916-A920 PolarHBondContact O-N 2.86Å
917	E	78.6	Confident	75.2	Confident	151 Å²	151	83.6 Å²	83.6	71%	0.706	45%	0.449	S	S	*	.	H	α-helix	trans	-65.5	-48.2	176.2	-63.4	179.5	-178.6	0	0	111.1	T915 V919 A920 D921	T915-E917 PolarHBondContact O-N 2.72Å; E917-V919 VanDerWaalsContact C-N 3.34Å; E917-V919 PolarHBondContact O-N 3.01Å; E917-A920 WeakPolarHBondContact O-CB 3.49Å; E917-A920 PolarHBondContact O-N 3.36Å; E917-A920 VanDerWaalsContact O-N 3.16Å; E917-D921 WeakPolarHBondContact O-CB 3.49Å; E917-D921 PolarHBondContact O-N 3.44Å
918	E	79.8	Confident	73.9	Confident	94 Å²	94	84.7 Å²	84.7	44%	0.439	46%	0.462	S	S	.	.	H	α-helix	trans	-62.6	-39.5	177.4	-73.7	162.2	162.4	0	0	112.6	M914 T915 A920 D921 C922	M914-E918 HydrophobicContact CE-CB 4.45Å; T915-E918 PolarHBondContact N-OE2 2.8Å; T915-E918 PolarHBondContact O-N 3.3Å; T915-E918 WeakPolarHBondContact OG1-CB 3.36Å; T915-E918 WeakPolarHBondContact OG1-CG 3.15Å; T915-E918 PolarHBondContact OG1-N 2.9Å; T915-E918 PolarHBondContact OG1-OE2 2.8Å; E918-A920 VanDerWaalsContact C-N 3.34Å; E918-D921 PolarHBondContact O-N 2.61Å; E918-C922 WeakPolarHBondContact O-CB 3.32Å; E918-C922 PolarHBondContact O-N 2.83Å; E918-C922 PolarHBondContact O-SG 3.43Å
919	V	77.8	Confident	72.1	Confident	7 Å²	7	92 Å²	92	4%	0.042	49%	0.493	C	S	.	.	H	α-helix	trans	-64.4	-42.1	175.6	175.4	0	0	0	0	110.4	M914 T915 E917 L923	M914-V919 HydrophobicContact CB-CG2 3.66Å; M914-V919 HydrophobicContact CE-CG2 4.09Å; M914-V919 HydrophobicContact SD-CG2 4.32Å; T915-V919 WeakPolarHBondContact O-CG2 3.42Å; T915-V919 PolarHBondContact O-N 2.9Å; E917-V919 VanDerWaalsContact C-N 3.34Å; E917-V919 PolarHBondContact O-N 3.01Å; V919-L923 HydrophobicContact CG1-CD1 4.01Å; V919-L923 WeakPolarHBondContact O-CB 3.49Å; V919-L923 VanDerWaalsContact O-CG 3.24Å; V919-L923 WeakPolarHBondContact O-CG 3.41Å; V919-L923 PolarHBondContact O-N 2.91Å; V919-L923 VanDerWaalsContact O-N 3.09Å
920	A	73.2	Confident	70.3	Confident	28 Å²	28	93.4 Å²	93.4	23%	0.231	50%	0.498	C	S	.	.	H	α-helix	trans	-64.9	-42.4	176.8	0	0	0	0	0	111.9	E916 E917 E918 L923 T924	E916-A920 WeakPolarHBondContact O-CB 3.22Å; E916-A920 PolarHBondContact O-N 2.86Å; E917-A920 WeakPolarHBondContact O-CB 3.49Å; E917-A920 PolarHBondContact O-N 3.36Å; E917-A920 VanDerWaalsContact O-N 3.16Å; E918-A920 VanDerWaalsContact C-N 3.34Å; A920-L923 PolarHBondContact O-N 3.24Å; A920-T924 WeakPolarHBondContact O-CG2 3.44Å; A920-T924 PolarHBondContact O-N 2.92Å; A920-T924 PolarHBondContact O-OG1 3.4Å; A920-T924 VanDerWaalsContact O-OG1 3.08Å
921	D	75.5	Confident	68.5	Low	93 Å²	93	88.5 Å²	88.5	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-43.9	177.1	-73.6	-11.2	0	0	0	111.6	E917 E918 L923 T924 H925	E917-D921 WeakPolarHBondContact O-CB 3.49Å; E917-D921 PolarHBondContact O-N 3.44Å; E918-D921 PolarHBondContact O-N 2.61Å; D921-L923 VanDerWaalsContact C-N 3.34Å; D921-L923 PolarHBondContact O-N 3.09Å; D921-T924 WeakPolarHBondContact CA-OG1 3.49Å; D921-T924 PolarHBondContact O-N 3.06Å; D921-T924 PolarHBondContact O-OG1 3.4Å; D921-H925 WeakPolarHBondContact O-CB 3.46Å; D921-H925 PolarHBondContact O-CD2 3.39Å; D921-H925 PolarHBondContact O-N 3.27Å
922	C	74.7	Confident	67.1	Low	63 Å²	63	92.4 Å²	92.4	43%	0.426	51%	0.505	S	S	.	.	H	α-helix	trans	-61.1	-43.4	176.1	-69.5	0	0	0	0	111.9	E918 H925 L926	E918-C922 WeakPolarHBondContact O-CB 3.32Å; E918-C922 PolarHBondContact O-N 2.83Å; E918-C922 PolarHBondContact O-SG 3.43Å; C922-H925 PolarHBondContact O-N 3.27Å; C922-L926 WeakPolarHBondContact O-CG 3.17Å; C922-L926 PolarHBondContact O-N 3.12Å
923	L	71.1	Confident	65.3	Low	29 Å²	29	99.3 Å²	99.3	15%	0.152	53%	0.53	C	S	.	.	H	α-helix	trans	-67.8	-37.2	179.2	-71	171.7	0	0	0	112.4	V919 A920 D921 V927 L940 I944	V919-L923 HydrophobicContact CG1-CD1 4.01Å; V919-L923 WeakPolarHBondContact O-CB 3.49Å; V919-L923 VanDerWaalsContact O-CG 3.24Å; V919-L923 WeakPolarHBondContact O-CG 3.41Å; V919-L923 PolarHBondContact O-N 2.91Å; V919-L923 VanDerWaalsContact O-N 3.09Å; A920-L923 PolarHBondContact O-N 3.24Å; D921-L923 VanDerWaalsContact C-N 3.34Å; D921-L923 PolarHBondContact O-N 3.09Å; L923-V927 WeakPolarHBondContact O-CG2 3.45Å; L923-V927 PolarHBondContact O-N 2.82Å; L923-L940 HydrophobicContact CD1-CD2 3.91Å; L923-L940 HydrophobicContact CD1-CG 4.24Å; L923-I944 HydrophobicContact CD1-CD1 4.38Å; L923-I944 HydrophobicContact CD2-CD1 3.95Å; L923-I944 HydrophobicContact CD2-CG1 4.37Å
924	T	70.6	Confident	63.5	Low	65 Å²	65	98.2 Å²	98.2	40%	0.399	53%	0.533	S	S	.	.	H	α-helix	trans	-68.5	-39.3	176.5	51.8	0	0	0	0	111.7	A920 D921 V927 S928 C938	A920-T924 WeakPolarHBondContact O-CG2 3.44Å; A920-T924 PolarHBondContact O-N 2.92Å; A920-T924 PolarHBondContact O-OG1 3.4Å; A920-T924 VanDerWaalsContact O-OG1 3.08Å; D921-T924 WeakPolarHBondContact CA-OG1 3.49Å; D921-T924 PolarHBondContact O-N 3.06Å; D921-T924 PolarHBondContact O-OG1 3.4Å; T924-V927 PolarHBondContact O-N 3.46Å; T924-S928 PolarHBondContact O-N 3.26Å; T924-C938 HydrophobicContact CG2-CB 4.44Å
925	H	71.3	Confident	61.6	Low	154 Å²	154	100.6 Å²	100.6	71%	0.713	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-40.2	174.2	-80.5	-61.5	0	0	0	113.4	D921 C922 V927 S928	D921-H925 WeakPolarHBondContact O-CB 3.46Å; D921-H925 PolarHBondContact O-CD2 3.39Å; D921-H925 PolarHBondContact O-N 3.27Å; C922-H925 PolarHBondContact O-N 3.27Å; H925-V927 VanDerWaalsContact C-N 3.28Å; H925-V927 PolarHBondContact O-N 3.27Å; H925-S928 PolarHBondContact O-N 2.96Å
926	L	67.1	Low	59.6	Low	143 Å²	143	106.7 Å²	106.7	75%	0.749	59%	0.587	S	S	*	*	H	α-helix	trans	-63.7	-31.6	177.5	-79.1	166.2	0	0	0	113.3	C922	C922-L926 WeakPolarHBondContact O-CG 3.17Å; C922-L926 PolarHBondContact O-N 3.12Å
927	V	65.4	Low	57.8	Low	59 Å²	59	109 Å²	109	36%	0.358	60%	0.598	S	S	.	*	H	α-helix	trans	-85.6	-19.1	-175	176	0	0	0	0	112.6	L923 T924 H925 K929 V943	L923-V927 WeakPolarHBondContact O-CG2 3.45Å; L923-V927 PolarHBondContact O-N 2.82Å; T924-V927 PolarHBondContact O-N 3.46Å; H925-V927 VanDerWaalsContact C-N 3.28Å; H925-V927 PolarHBondContact O-N 3.27Å; V927-K929 VanDerWaalsContact C-N 3.29Å; V927-K929 PolarHBondContact O-N 3.28Å; V927-V943 HydrophobicContact CG2-CB 4.02Å; V927-V943 HydrophobicContact CG2-CG1 3.45Å; V927-V943 VanDerWaalsContact CG2-CG1 3.45Å; V927-V943 HydrophobicContact CG2-CG2 3.32Å
928	S	52.4	Low	56.1	Low	88 Å²	88	106.2 Å²	106.2	62%	0.615	59%	0.594	S	S	*	*			trans	24.1	64	179.7	-164.5	0	0	0	0	114	T924 H925 S930	T924-S928 PolarHBondContact O-N 3.26Å; H925-S928 PolarHBondContact O-N 2.96Å; S928-S930 VanDerWaalsContact C-N 3.27Å; S928-S930 PolarHBondContact O-N 2.93Å
929	K	43.6	Very low	54.4	Low	194 Å²	194	106.1 Å²	106.1	84%	0.843	60%	0.604	S	S	*	*			trans	-81.8	90.4	149.4	-81.4	-173.7	178.7	178.3	0	105.8	V927 G931	V927-K929 VanDerWaalsContact C-N 3.29Å; V927-K929 PolarHBondContact O-N 3.28Å; K929-G931 PolarHBondContact O-N 3.05Å
930	S	40.7	Very low	53.1	Low	116 Å²	116	109.3 Å²	109.3	81%	0.811	62%	0.62	S	S	*	*			trans	-56.7	95.7	169.7	55	0	0	0	0	109.9	S928	S928-S930 VanDerWaalsContact C-N 3.27Å; S928-S930 PolarHBondContact O-N 2.93Å
931	G	34.9	Very low	51.9	Low	47 Å²	47	110.2 Å²	110.2	49%	0.485	63%	0.633	S	S	.	*			trans	-171.5	116	175.3	0	0	0	0	0	109.9	K929 Y933	K929-G931 PolarHBondContact O-N 3.05Å; G931-Y933 PolarHBondContact O-N 3.25Å
932	V	44.3	Very low	50.8	Low	144 Å²	144	110.4 Å²	110.4	87%	0.873	64%	0.641	S	S	*	*			trans	-52.9	103.7	172.8	177.1	0	0	0	0	109
933	Y	37	Very low	50.1	Low	213 Å²	213	110.6 Å²	110.6	84%	0.835	64%	0.64	S	S	*	*			trans	-143.7	144.6	167.2	-74.1	-73.1	0	0	0	111.6	G931	G931-Y933 PolarHBondContact O-N 3.25Å
934	T	37.1	Very low	50	Low	123 Å²	123	110.3 Å²	110.3	76%	0.755	64%	0.639	S	S	*	*			trans	-56.2	150	179.5	41	0	0	0	0	112.8	E936	T934-E936 PolarHBondContact O-N 2.85Å
935	A	38.9	Very low	50.1	Low	110 Å²	110	109.1 Å²	109.1	91%	0.909	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	29.6	-168.4	0	0	0	0	0	118.2
936	E	40.5	Very low	50.4	Low	181 Å²	181	109.4 Å²	109.4	85%	0.846	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	-2.1	-174.1	-72.1	-173.9	160.8	0	0	116.3	T934	T934-E936 PolarHBondContact O-N 2.85Å
937	E	39.1	Very low	51	Low	188 Å²	188	110.5 Å²	110.5	88%	0.879	63%	0.628	S	S	*	*	S	Bend	trans	-133.3	36.1	-178.8	-71.5	-169.4	164.7	0	0	116
938	C	42.3	Very low	51.9	Low	92 Å²	92	107.8 Å²	107.8	62%	0.622	61%	0.611	S	S	*	*			trans	-119.5	77.7	156	-91.7	0	0	0	0	108.9	T924 L940	T924-C938 HydrophobicContact CG2-CB 4.44Å; C938-L940 PolarHBondContact O-N 2.93Å
939	S	45.9	Very low	53.3	Low	91 Å²	91	105.3 Å²	105.3	64%	0.636	59%	0.594	S	S	*	*			trans	-59.3	128	165.4	61.7	0	0	0	0	107.7	G941 S942	S939-G941 PolarHBondContact O-N 3.16Å; S939-S942 PolarHBondContact O-N 3.03Å
940	L	48.9	Very low	55.2	Low	74 Å²	74	96.8 Å²	96.8	39%	0.387	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-48	-12.7	171.9	-87.5	90.3	0	0	0	113	K900 I904 L923 C938	K900-L940 WeakPolarHBondContact CE-O 3.33Å; K900-L940 PolarHBondContact NZ-O 3.08Å; I904-L940 HydrophobicContact CD1-CD2 3.96Å; L923-L940 HydrophobicContact CD1-CD2 3.91Å; L923-L940 HydrophobicContact CD1-CG 4.24Å; C938-L940 PolarHBondContact O-N 2.93Å
941	G	47.7	Very low	57	Low	48 Å²	48	98.3 Å²	98.3	50%	0.495	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-55.9	-35.4	178.5	0	0	0	0	0	117.6	K900 S939	K900-G941 PolarHBondContact NZ-O 3.41Å; S939-G941 PolarHBondContact O-N 3.16Å
942	S	53.9	Low	59.3	Low	97 Å²	97	97.9 Å²	97.9	68%	0.678	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-89.7	-16.2	-165	61.1	0	0	0	0	116.6	S939	S939-S942 PolarHBondContact O-N 3.03Å
943	V	60.4	Low	61.1	Low	66 Å²	66	92.5 Å²	92.5	40%	0.4	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-45	-166	-171.9	0	0	0	0	112.4	V927	V927-V943 HydrophobicContact CG2-CB 4.02Å; V927-V943 HydrophobicContact CG2-CG1 3.45Å; V927-V943 VanDerWaalsContact CG2-CG1 3.45Å; V927-V943 HydrophobicContact CG2-CG2 3.32Å
944	I	67.3	Low	63.1	Low	24 Å²	24	83.3 Å²	83.3	12%	0.123	47%	0.469	C	S	.	.	S	Bend	trans	-95.6	126.7	179.2	-60.2	172.3	0	0	0	108.7	K900 L923 I948	K900-I944 HydrophobicContact CD-CB 4.49Å; K900-I944 HydrophobicContact CG-CB 4.44Å; K900-I944 HydrophobicContact CG-CG2 4.2Å; K900-I944 PolarHBondContact NZ-O 3.4Å; L923-I944 HydrophobicContact CD1-CD1 4.38Å; L923-I944 HydrophobicContact CD2-CD1 3.95Å; L923-I944 HydrophobicContact CD2-CG1 4.37Å; I944-I948 HydrophobicContact CG2-CD1 3.62Å; I944-I948 HydrophobicContact CG2-CG1 4.22Å
945	P	73.9	Confident	65	Low	39 Å²	39	84 Å²	84	25%	0.253	46%	0.464	S	S	.	.			trans	-54.3	146.6	174.1	-24.1	33.3	0	0	0	112.2	R947 L952	P945-R947 PolarHBondContact O-N 3Å; P945-L952 HydrophobicContact CB-CD2 3.61Å; P945-L952 HydrophobicContact CG-CD2 3.52Å; P945-L952 HydrophobicContact CG-CG 4.32Å
946	E	76.8	Confident	66.5	Low	161 Å²	161	85.2 Å²	85.2	75%	0.752	45%	0.451	S	S	*	.	S	Bend	trans	-61	-31.8	178.2	-72.5	-165.5	158.8	0	0	113.1	K900	K900-E946 PolarHBondContact N-O 2.84Å; K900-E946 VanDerWaalsContact N-O 3.11Å
947	R	80.9	Confident	67.9	Low	166 Å²	166	80.4 Å²	80.4	63%	0.626	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	123.6	177.9	-65.7	-177.1	-177.3	-177	0.2	109.2	I897 P945 L952	I897-R947 HydrophobicContact CG2-CB 3.87Å; I897-R947 HydrophobicContact CG2-CG 4.31Å; P945-R947 PolarHBondContact O-N 3Å; R947-L952 WeakPolarHBondContact O-CD2 3.48Å
948	I	82.9	Confident	69.4	Low	2 Å²	2	74.9 Å²	74.9	1%	0.01	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	110.2	-179.2	-52.4	172.3	0	0	0	107.5	F884 I897 I898 M903 I944 F953 I957	F884-I948 HydrophobicContact CE1-CG2 4.01Å; F884-I948 HydrophobicContact CZ-CG2 3.99Å; I897-I948 WeakPolarHBondContact CA-O 3.34Å; I898-I948 PolarHBondContact N-O 3.24Å; I898-I948 VanDerWaalsContact N-O 3.08Å; I898-I948 PolarHBondContact O-N 3.45Å; M903-I948 HydrophobicContact CB-CD1 4.21Å; M903-I948 HydrophobicContact CG-CD1 4.12Å; I944-I948 HydrophobicContact CG2-CD1 3.62Å; I944-I948 HydrophobicContact CG2-CG1 4.22Å; I948-F953 HydrophobicContact CG2-CB 3.82Å; I948-F953 HydrophobicContact CG2-CD2 3.93Å; I948-F953 HydrophobicContact CG2-CG 4.31Å; I948-I957 HydrophobicContact CG2-CD1 4.23Å
949	S	83.3	Confident	70.5	Confident	36 Å²	36	73.5 Å²	73.5	25%	0.252	41%	0.408	S	S	.	.			trans	-89	164.7	165.5	66.6	0	0	0	0	110	E951 L952 F953	S949-E951 VanDerWaalsContact C-N 3.34Å; S949-E951 PolarHBondContact O-N 3.11Å; S949-L952 PolarHBondContact O-N 2.73Å; S949-L952 WeakPolarHBondContact OG-CB 3.48Å; S949-L952 PolarHBondContact OG-N 2.71Å; S949-F953 WeakPolarHBondContact O-CB 3.37Å; S949-F953 PolarHBondContact O-N 3.44Å
950	V	81.8	Confident	71.1	Confident	14 Å²	14	76.2 Å²	76.2	9%	0.085	41%	0.414	C	S	.	.	H	α-helix	trans	-60.5	-43.2	177.5	179.5	0	0	0	0	111.6	L880 L881 F884 P896 L952 F953 T954	L880-V950 HydrophobicContact CB-CG1 4.32Å; L881-V950 HydrophobicContact CD2-CB 4.22Å; L881-V950 HydrophobicContact CD2-CG1 4.02Å; L881-V950 HydrophobicContact CD2-CG2 4.03Å; L881-V950 HydrophobicContact CG-CG1 4.16Å; F884-V950 HydrophobicContact CB-CG2 3.47Å; F884-V950 VanDerWaalsContact CB-CG2 3.47Å; F884-V950 HydrophobicContact CD1-CG2 3.66Å; F884-V950 HydrophobicContact CD2-CG2 3.78Å; F884-V950 HydrophobicContact CE1-CG2 4.3Å; F884-V950 HydrophobicContact CE2-CG2 4.39Å; F884-V950 HydrophobicContact CG-CG2 3.36Å; P896-V950 HydrophobicContact CG-CG2 4.45Å; V950-L952 VanDerWaalsContact C-N 3.34Å; V950-L952 PolarHBondContact O-N 2.8Å; V950-F953 PolarHBondContact O-N 3Å; V950-T954 WeakPolarHBondContact O-CB 3.36Å; V950-T954 WeakPolarHBondContact O-CG2 3.49Å; V950-T954 PolarHBondContact O-N 3.29Å; V950-T954 PolarHBondContact O-OG1 3.4Å
951	E	80	Confident	72.2	Confident	148 Å²	148	76.4 Å²	76.4	69%	0.692	42%	0.416	S	S	*	.	H	α-helix	trans	-62.6	-39.9	176.8	-66.2	170.2	-171.2	0	0	112.2	S949 T954 H955	S949-E951 VanDerWaalsContact C-N 3.34Å; S949-E951 PolarHBondContact O-N 3.11Å; E951-T954 VanDerWaalsContact CA-OG1 3.31Å; E951-T954 WeakPolarHBondContact CA-OG1 3.49Å; E951-T954 PolarHBondContact O-OG1 3.31Å; E951-H955 WeakPolarHBondContact O-CB 3.3Å; E951-H955 PolarHBondContact O-CD2 3.24Å; E951-H955 PolarHBondContact O-N 2.94Å; E951-H955 VanDerWaalsContact O-N 3.08Å
952	L	82.1	Confident	73.5	Confident	39 Å²	39	77.8 Å²	77.8	20%	0.204	41%	0.411	C	S	.	.	H	α-helix	trans	-68.5	-40.9	176.9	-162.7	75.4	0	0	0	111	P945 R947 S949 V950 Q956	P945-L952 HydrophobicContact CB-CD2 3.61Å; P945-L952 HydrophobicContact CG-CD2 3.52Å; P945-L952 HydrophobicContact CG-CG 4.32Å; R947-L952 WeakPolarHBondContact O-CD2 3.48Å; S949-L952 PolarHBondContact O-N 2.73Å; S949-L952 WeakPolarHBondContact OG-CB 3.48Å; S949-L952 PolarHBondContact OG-N 2.71Å; V950-L952 VanDerWaalsContact C-N 3.34Å; V950-L952 PolarHBondContact O-N 2.8Å; L952-Q956 HydrophobicContact CD1-CG 4.04Å; L952-Q956 WeakPolarHBondContact O-CA 3.22Å; L952-Q956 VanDerWaalsContact O-CB 3.26Å; L952-Q956 WeakPolarHBondContact O-CB 3.48Å; L952-Q956 PolarHBondContact O-N 3.21Å
953	F	81.6	Confident	74.6	Confident	30 Å²	30	76.8 Å²	76.8	13%	0.132	40%	0.397	C	S	.	.	I	π-helix	trans	-66.4	-42.7	179.5	-171.8	-104.8	0	0	0	112.1	L880 F884 M903 I948 S949 V950 I957 L958	L880-F953 HydrophobicContact CD2-CD1 4.35Å; L880-F953 HydrophobicContact CD2-CE1 4.09Å; F884-F953 HydrophobicContact CE2-CB 4.2Å; F884-F953 AromaticContact CE2-CD1 3.81Å; F884-F953 HydrophobicContact CE2-CD1 3.81Å; F884-F953 HydrophobicContact CE2-CE1 4.33Å; F884-F953 AromaticContact CE2-CG 3.97Å; F884-F953 HydrophobicContact CE2-CG 3.97Å; F884-F953 HydrophobicContact CZ-CB 3.66Å; F884-F953 HydrophobicContact CZ-CD1 4.03Å; F884-F953 HydrophobicContact CZ-CD2 4.13Å; F884-F953 AromaticContact CZ-CG 3.68Å; F884-F953 HydrophobicContact CZ-CG 3.68Å; M903-F953 HydrophobicContact CE-CE2 3.94Å; M903-F953 HydrophobicContact CE-CZ 4.5Å; I948-F953 HydrophobicContact CG2-CB 3.82Å; I948-F953 HydrophobicContact CG2-CD2 3.93Å; I948-F953 HydrophobicContact CG2-CG 4.31Å; S949-F953 WeakPolarHBondContact O-CB 3.37Å; S949-F953 PolarHBondContact O-N 3.44Å; V950-F953 PolarHBondContact O-N 3Å; F953-I957 HydrophobicContact CD2-CB 3.99Å; F953-I957 HydrophobicContact CD2-CD1 3.69Å; F953-I957 HydrophobicContact CD2-CG1 4.4Å; F953-I957 HydrophobicContact CD2-CG2 3.99Å; F953-I957 HydrophobicContact CE2-CB 4.3Å; F953-I957 HydrophobicContact CE2-CD1 4.32Å; F953-I957 HydrophobicContact CE2-CG2 3.78Å; F953-I957 WeakPolarHBondContact O-CB 3.43Å; F953-I957 PolarHBondContact O-N 2.65Å; F953-L958 HydrophobicContact CD1-CD1 3.81Å; F953-L958 HydrophobicContact CD1-CG 4.1Å; F953-L958 HydrophobicContact CE1-CD1 3.55Å; F953-L958 HydrophobicContact CE1-CD2 4.21Å; F953-L958 HydrophobicContact CE1-CG 3.8Å; F953-L958 HydrophobicContact CZ-CD1 4.44Å; F953-L958 HydrophobicContact CZ-CD2 4.33Å; F953-L958 HydrophobicContact CZ-CG 4.27Å; F953-L958 PolarHBondContact O-N 2.74Å
954	T	79.1	Confident	75.4	Confident	20 Å²	20	77.4 Å²	77.4	12%	0.123	40%	0.396	C	S	.	.	I	π-helix	trans	-65.6	-55.5	177.5	39.7	0	0	0	0	111.6	L880 V950 E951 G959 L960	L880-T954 HydrophobicContact CD1-CG2 3.46Å; L880-T954 VanDerWaalsContact CD1-CG2 3.46Å; V950-T954 WeakPolarHBondContact O-CB 3.36Å; V950-T954 WeakPolarHBondContact O-CG2 3.49Å; V950-T954 PolarHBondContact O-N 3.29Å; V950-T954 PolarHBondContact O-OG1 3.4Å; E951-T954 VanDerWaalsContact CA-OG1 3.31Å; E951-T954 WeakPolarHBondContact CA-OG1 3.49Å; E951-T954 PolarHBondContact O-OG1 3.31Å; T954-G959 PolarHBondContact O-N 3.01Å; T954-L960 PolarHBondContact O-N 2.89Å
955	H	76.8	Confident	76	Confident	137 Å²	137	80.8 Å²	80.8	63%	0.634	41%	0.413	S	S	*	.	I	π-helix	trans	-77.9	-38.1	-174	-70	-51.5	0	0	0	114.8	E951 L960	E951-H955 WeakPolarHBondContact O-CB 3.3Å; E951-H955 PolarHBondContact O-CD2 3.24Å; E951-H955 PolarHBondContact O-N 2.94Å; E951-H955 VanDerWaalsContact O-N 3.08Å; H955-L960 PolarHBondContact ND1-O 2.77Å
956	Q	70.9	Confident	76.1	Confident	137 Å²	137	83.5 Å²	83.5	64%	0.64	42%	0.424	S	S	*	.	I	π-helix	trans	-99.3	-26.8	-173	-59.8	-169.5	-12.2	0	0	114.2	L952	L952-Q956 HydrophobicContact CD1-CG 4.04Å; L952-Q956 WeakPolarHBondContact O-CA 3.22Å; L952-Q956 VanDerWaalsContact O-CB 3.26Å; L952-Q956 WeakPolarHBondContact O-CB 3.48Å; L952-Q956 PolarHBondContact O-N 3.21Å
957	I	70.9	Confident	76	Confident	80 Å²	80	78 Å²	78	41%	0.41	40%	0.401	S	S	.	.	I	π-helix	trans	-103.8	-47.4	-175.5	-63.6	170.8	0	0	0	111.2	I948 F953	I948-I957 HydrophobicContact CG2-CD1 4.23Å; F953-I957 HydrophobicContact CD2-CB 3.99Å; F953-I957 HydrophobicContact CD2-CD1 3.69Å; F953-I957 HydrophobicContact CD2-CG1 4.4Å; F953-I957 HydrophobicContact CD2-CG2 3.99Å; F953-I957 HydrophobicContact CE2-CB 4.3Å; F953-I957 HydrophobicContact CE2-CD1 4.32Å; F953-I957 HydrophobicContact CE2-CG2 3.78Å; F953-I957 WeakPolarHBondContact O-CB 3.43Å; F953-I957 PolarHBondContact O-N 2.65Å
958	L	70.4	Confident	75.7	Confident	72 Å²	72	71.2 Å²	71.2	38%	0.377	38%	0.383	S	S	.	.	I	π-helix	trans	-84.9	-25.9	177.4	-66	177.4	0	0	0	112.9	L880 F953 L960	L880-L958 HydrophobicContact CD1-CD1 3.93Å; L880-L958 HydrophobicContact CD2-CD1 4.31Å; F953-L958 HydrophobicContact CD1-CD1 3.81Å; F953-L958 HydrophobicContact CD1-CG 4.1Å; F953-L958 HydrophobicContact CE1-CD1 3.55Å; F953-L958 HydrophobicContact CE1-CD2 4.21Å; F953-L958 HydrophobicContact CE1-CG 3.8Å; F953-L958 HydrophobicContact CZ-CD1 4.44Å; F953-L958 HydrophobicContact CZ-CD2 4.33Å; F953-L958 HydrophobicContact CZ-CG 4.27Å; F953-L958 PolarHBondContact O-N 2.74Å; L958-L960 VanDerWaalsContact C-N 3.27Å; L958-L960 HydrophobicContact CB-CD1 3.97Å; L958-L960 HydrophobicContact CB-CG 4.02Å; L958-L960 HydrophobicContact CD1-CD1 3.86Å; L958-L960 PolarHBondContact O-N 2.67Å
959	G	64.3	Low	75.1	Confident	63 Å²	63	77 Å²	77	65%	0.649	41%	0.414	S	S	*	.			trans	66.4	29.2	-177.3	0	0	0	0	0	113.4	T954	T954-G959 PolarHBondContact O-N 3.01Å
960	L	59.4	Low	74.3	Confident	148 Å²	148	80.7 Å²	80.7	78%	0.775	43%	0.429	S	S	*	.			trans	-85.1	0	178.5	-72.8	169.6	0	0	0	112.9	T954 H955 L958	T954-L960 PolarHBondContact O-N 2.89Å; H955-L960 PolarHBondContact ND1-O 2.77Å; L958-L960 VanDerWaalsContact C-N 3.27Å; L958-L960 HydrophobicContact CB-CD1 3.97Å; L958-L960 HydrophobicContact CB-CG 4.02Å; L958-L960 HydrophobicContact CD1-CD1 3.86Å; L958-L960 PolarHBondContact O-N 2.67Å

Retrieved 960 of 960 residues in 1623.5 ms (Link to these results)

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