A0A087YF92_POEFO Loading...

Sortilin related VPS10 domain containing receptor 3b

AlphaFold DB , UniProt , Accession A0A087YF92, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,230 aa.

						>A0A087YF92_POEFO|A0A087YF92
MALWCFWSCFLLAFIQLFPFHLKLATRAEISFPRLANRFYPMEVTSPMGRMIRESAGIKVSLKVSDRNEVLRRSETDGPARPKNKQEVKNETVVTNGTTVNNVNSLKIPDKKCDNISTAVIETPKATFSIGERKKRSVGVSYNENLDRSIAGEARRSVRTVHDASNFESEYQSTEEESEDSNSTQSEPHLDPSTFALSGDSTHNLAMVHWSGQNSSVILILTKLYDVTMGTVTESSLWRSTDYGSTYTKLNDKVISRTVLSYLYVCPTNKQKILMLSDPEVESAVFISSDEGASFEKFPINFNVLSLLFHPAQENWILAYSHDYKLYSSMDFGKKWQLVHENVMPGRFYWAVMGLDRESDVVHIETRIAKGRAQYVKCRAQRCTEGDRQYLFPGHVDTNSLVVQDEYVFTQVTKSGRASYFVSYMRGSFRQMKLPKYCLPKDMHIISTDEKQVFAAVQEWNQNNTYSLYISDSPGVYFILSLENLRTSRGPAGNLLVDFYKVEGINGMYLANKIVDNHIKTFITYNKGQTWALLPAPTKDVSGKKLHCILPFCSLHLHLEMSENPYTSGPITSKKSVPGIIVATGNIGNELSSANLGMFITSDAGNSWRQIFDEEYNIWFLDNGGALLAVLRAAVRIRHLWISLDEGKKWDRHSFSWVPLHVDGVLMEPESDNHIITFFGHFNHYSEWQLIKIDYKGLFSRRCMDGDYQTWSLHNKEEQCVMGEKQKYMKRRPGNRCMLSQDYSRIYSSEPCPCNAYDFECDYGWERQADGKCSPAFWFNPNGVAKSCSSSQSFLNSTGYRKVLSNNCKEEGRNVYSPKRMACRPKPPQGLHLSTSHGELSAAIGSNVTFMIHLDNGESPSTSIQLDFGDGIKITYSNLSRTDDGIKHIYRKTGIYRVIATAENHLGSDSSALFLHITSPVDRVYLSAPIVAIREKAANLTAVVWPSHTRTLTFFWWFENSSEPIITLEGSISHMFLREGENKVTVQVACGSSVLEDSKVITVKESFRSLLLSFSPALDEHNPDIPEWREDIGRVVRTALSQVSGVSESQLMVSLYPGLPTTAELFILSDEQMSSEHKKRSEEALDTISDIFITALNQGLVHFELKANVHIVVSMTQQTLAPLVDSNSIHSGPAMLMLISVVFIGIAAFFIYKFKRKIPWIHVETEDRHEKDPEVISTVGQNDAMSKVKLNEFPSQKELMEKELEGRSRGGFGRNMERIVTREFPNCTNV
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.2	Very low	26.7	Very low	246 Å²	246	161.2 Å²	161.2	100%	1.212	82%	0.817	S	S	*	*				0	134.7	0	-75.1	-176	-77.1	0	0	107.8
2	A	27.3	Very low	26.7	Very low	85 Å²	85	160.8 Å²	160.8	70%	0.702	82%	0.817	S	S	*	*			cis	-150.8	159.3	-9.9	0	0	0	0	0	110.6
3	L	26.9	Very low	26.8	Very low	138 Å²	138	155.2 Å²	155.2	72%	0.723	81%	0.811	S	S	*	*			trans	22.6	128.5	141.3	-85.4	66.5	0	0	0	118.2
4	W	27.3	Very low	26.5	Very low	238 Å²	238	156.9 Å²	156.9	90%	0.902	81%	0.809	S	S	*	*				47.3	120.5	87.8	-68.8	4.9	0	0	0	113.8
5	C	31	Very low	26.6	Very low	112 Å²	112	154.6 Å²	154.6	76%	0.757	80%	0.797	S	S	*	*			trans	-141.4	122.1	142.6	-93.7	0	0	0	0	108.5
6	F	30.3	Very low	26.6	Very low	177 Å²	177	154.6 Å²	154.6	78%	0.776	79%	0.792	S	S	*	*			trans	40.1	108.9	149.2	-58.7	-81.7	0	0	0	117.3
7	W	22.2	Very low	26.5	Very low	242 Å²	242	153.3 Å²	153.3	92%	0.917	79%	0.786	S	S	*	*			cis	61.3	136.6	36.6	-133.4	66.6	0	0	0	113
8	S	25.7	Very low	26.5	Very low	95 Å²	95	155.2 Å²	155.2	66%	0.664	79%	0.788	S	S	*	*			trans	85.6	159.6	-177.4	80.8	0	0	0	0	118.2
9	C	28.7	Very low	27.6	Very low	122 Å²	122	152.2 Å²	152.2	82%	0.824	78%	0.78	S	S	*	*			trans	58.2	85	-174	-57.2	0	0	0	0	115.8
10	F	22.9	Very low	27.6	Very low	183 Å²	183	153.5 Å²	153.5	80%	0.803	78%	0.78	S	S	*	*			cis	69.6	124.5	14.2	-128.4	-40.3	0	0	0	116.5
11	L	23.9	Very low	27.7	Very low	135 Å²	135	152.9 Å²	152.9	71%	0.707	77%	0.774	S	S	*	*			trans	82.1	133.5	159.7	-82.7	141.9	0	0	0	121.5
12	L	26.7	Very low	27.6	Very low	156 Å²	156	148.9 Å²	148.9	82%	0.817	76%	0.757	S	S	*	*			trans	67.1	144.8	155.5	-59.9	162.1	0	0	0	117.5
13	A	27.6	Very low	27.6	Very low	89 Å²	89	152.6 Å²	152.6	74%	0.736	76%	0.757	S	S	*	*			cis	-142.3	148.4	4.7	0	0	0	0	0	109.5
14	F	23.6	Very low	27.6	Very low	179 Å²	179	153.6 Å²	153.6	79%	0.785	76%	0.762	S	S	*	*				78.3	106.7	62	-116.2	-109.3	0	0	0	116.3
15	I	27.6	Very low	27.6	Very low	122 Å²	122	146.4 Å²	146.4	63%	0.626	75%	0.753	S	S	*	*			trans	87.5	115.2	135.4	-92.2	-172.3	0	0	0	123.2
16	Q	26.8	Very low	27.4	Very low	154 Å²	154	148 Å²	148	72%	0.72	76%	0.76	S	S	*	*				94.9	143	129	-84.5	-176.1	0.4	0	0	127.5
17	L	25.3	Very low	27.3	Very low	133 Å²	133	150.3 Å²	150.3	70%	0.696	76%	0.763	S	S	*	*			trans	77.6	107.6	145.2	-70.6	158.5	0	0	0	122.3
18	F	25.3	Very low	27.4	Very low	188 Å²	188	143.6 Å²	143.6	83%	0.825	76%	0.76	S	S	*	*				32.8	165.1	108.3	-75	-75.4	0	0	0	120.9
19	P	48.2	Very low	27.5	Very low	98 Å²	98	146.9 Å²	146.9	64%	0.636	77%	0.765	S	S	*	*			cis	-146.8	-164.5	24.7	24.9	5.2	0	0	0	118.1
20	F	27.3	Very low	27.2	Very low	178 Å²	178	148.7 Å²	148.7	78%	0.781	76%	0.764	S	S	*	*			trans	75.4	150.7	166.6	-69.8	-99.1	0	0	0	119.6
21	H	28.9	Very low	27.3	Very low	141 Å²	141	145 Å²	145	65%	0.653	76%	0.761	S	S	*	*			cis	-171.2	154	-42.1	-115.6	-56.8	0	0	0	108
22	L	26.1	Very low	27.3	Very low	161 Å²	161	148.4 Å²	148.4	84%	0.843	77%	0.771	S	S	*	*				-176.4	172.9	83.7	-163.5	60.7	0	0	0	111.8
23	K	27.7	Very low	27.5	Very low	164 Å²	164	145.9 Å²	145.9	71%	0.713	76%	0.764	S	S	*	*			trans	-104.3	156.1	-161.2	-54.3	160.7	176	174.2	0	116
24	L	27	Very low	27.6	Very low	159 Å²	159	153.6 Å²	153.6	83%	0.832	77%	0.774	S	S	*	*				170.4	130	118.3	-106	85	0	0	0	107.7
25	A	26.6	Very low	27.8	Very low	86 Å²	86	152.4 Å²	152.4	71%	0.711	78%	0.775	S	S	*	*				70.4	130.2	59.1	0	0	0	0	0	113.1
26	T	27.3	Very low	27.8	Very low	146 Å²	146	150.6 Å²	150.6	90%	0.896	78%	0.778	S	S	*	*			cis	-144.9	-176.6	29.2	47	0	0	0	0	115.4
27	R	27.8	Very low	27.7	Very low	225 Å²	225	150.6 Å²	150.6	85%	0.849	78%	0.783	S	S	*	*			trans	-84.5	156.8	178.8	-80.9	171	151.2	166.8	-11.6	114.7
28	A	24.8	Very low	27.7	Very low	102 Å²	102	154 Å²	154	84%	0.843	79%	0.787	S	S	*	*			trans	-151.1	149.8	135.1	0	0	0	0	0	110.7
29	E	26.3	Very low	27.7	Very low	163 Å²	163	154.3 Å²	154.3	76%	0.762	79%	0.788	S	S	*	*			trans	-114.4	157.2	172.5	-66.1	168.5	117.3	0	0	109.4
30	I	24.4	Very low	26.6	Very low	160 Å²	160	158.4 Å²	158.4	82%	0.821	79%	0.792	S	S	*	*			trans	161.9	145.8	139.4	-84.1	157.4	0	0	0	111.7
31	S	23.8	Very low	26.5	Very low	105 Å²	105	155 Å²	155	73%	0.734	79%	0.788	S	S	*	*			trans	-24.7	140.7	-179	58.7	0	0	0	0	120.8
32	F	24.3	Very low	26.3	Very low	208 Å²	208	157.1 Å²	157.1	91%	0.912	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-92.4	141.7	153.1	-85.8	-89.6	0	0	0	111.8
33	P	30.1	Very low	26.1	Very low	103 Å²	103	157.5 Å²	157.5	67%	0.669	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.5	153.6	-176.3	34.3	-35.8	0	0	0	113.8	L35	P33-L35 HydrophobicContact CB-CD1 4.48Å
34	R	30.8	Very low	26	Very low	251 Å²	251	156.5 Å²	156.5	95%	0.947	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.6	121	162.5	-77.1	178.2	169.2	173.5	-4	110.1
35	L	27.4	Very low	25.9	Very low	153 Å²	153	154.6 Å²	154.6	80%	0.801	80%	0.801	S	S	*	*			trans	-127	123.3	148.5	-76.6	98.5	0	0	0	107.1	P33	P33-L35 HydrophobicContact CB-CD1 4.48Å
36	A	26.7	Very low	25.9	Very low	85 Å²	85	155.7 Å²	155.7	70%	0.702	80%	0.803	S	S	*	*			cis	86.8	57.7	47.2	0	0	0	0	0	113.8	R38	A36-R38 PolarHBondContact O-N 3.18Å
37	N	25.6	Very low	26.1	Very low	154 Å²	154	155.1 Å²	155.1	82%	0.824	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-67.6	117.1	160.8	-82.9	-1.8	0	0	0	109.6	F39	N37-F39 PolarHBondContact O-N 3.42Å
38	R	25.1	Very low	26	Very low	204 Å²	204	153.2 Å²	153.2	77%	0.77	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71.9	116.8	169	-76.2	179.6	171.4	168.1	-2	109.7	A36 Y40	A36-R38 PolarHBondContact O-N 3.18Å; R38-Y40 HydrophobicContact CB-CD2 4.46Å; R38-Y40 HydrophobicContact CB-CE2 4.31Å; R38-Y40 PolarHBondContact NH1-OH 3.48Å
39	F	25.8	Very low	26	Very low	195 Å²	195	152 Å²	152	86%	0.855	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-87.1	131.3	149.4	-77	-90.2	0	0	0	108.1	N37 P41	N37-F39 PolarHBondContact O-N 3.42Å; F39-P41 WeakPolarHBondContact O-CD 3.42Å
40	Y	23.8	Very low	26	Very low	183 Å²	183	154.9 Å²	154.9	72%	0.718	81%	0.806	S	S	*	*			trans	-95.8	108.3	166.6	-82.8	-89.8	0	0	0	108.4	R38	R38-Y40 HydrophobicContact CB-CD2 4.46Å; R38-Y40 HydrophobicContact CB-CE2 4.31Å; R38-Y40 PolarHBondContact NH1-OH 3.48Å
41	P	27.2	Very low	26	Very low	108 Å²	108	155.4 Å²	155.4	70%	0.701	81%	0.807	S	S	*	*			trans	-73.3	126.7	162.1	30.8	-30.7	0	0	0	108.4	F39 E43	F39-P41 WeakPolarHBondContact O-CD 3.42Å; P41-E43 PolarHBondContact O-N 2.86Å
42	M	23.2	Very low	26.1	Very low	184 Å²	184	156.7 Å²	156.7	91%	0.906	80%	0.804	S	S	*	*			trans	-89.2	99.8	171.2	-163.1	169.4	-167.8	0	0	108.3	V44	M42-V44 PolarHBondContact O-N 3.12Å
43	E	22.8	Very low	26.1	Very low	170 Å²	170	156 Å²	156	79%	0.794	80%	0.796	S	S	*	*			trans	-68.8	117.4	179.6	-65	-177.2	127.2	0	0	110.7	P41	P41-E43 PolarHBondContact O-N 2.86Å
44	V	25.8	Very low	25.9	Very low	142 Å²	142	157.8 Å²	157.8	86%	0.861	80%	0.795	S	S	*	*			trans	-92	96.9	164.7	-179.9	0	0	0	0	107.7	M42	M42-V44 PolarHBondContact O-N 3.12Å
45	T	23.7	Very low	25.6	Very low	120 Å²	120	150.8 Å²	150.8	74%	0.736	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-71	125.8	179	50.1	0	0	0	0	111.5
46	S	26.9	Very low	25.6	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.2	140.9	167.2	59.2	0	0	0	0	111.3
47	P	32.2	Very low	25.5	Very low	133 Å²	133	147.9 Å²	147.9	86%	0.864	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.2	125.3	177.2	29.8	-33	0	0	0	111.3
48	M	25.1	Very low	25.4	Very low	186 Å²	186	148.9 Å²	148.9	92%	0.916	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.6	121.4	-176.6	-166.2	-171.6	-154.2	0	0	112.3
49	G	25.5	Very low	25.3	Very low	76 Å²	76	147.5 Å²	147.5	78%	0.784	79%	0.792	S	S	*	*			trans	-109.7	128.1	171.9	0	0	0	0	0	112.2
50	R	26	Very low	25.2	Very low	224 Å²	224	144.7 Å²	144.7	85%	0.845	79%	0.79	S	S	*	*			trans	-90	141.2	-176.7	-65.6	173.4	171.9	173.5	-3.9	112.9
51	M	23.6	Very low	25.1	Very low	171 Å²	171	139.9 Å²	139.9	84%	0.842	78%	0.784	S	S	*	*				-179.5	125.1	114.6	-93.3	-168.1	178.7	0	0	108.4
52	I	25.8	Very low	25	Very low	132 Å²	132	142.2 Å²	142.2	68%	0.677	79%	0.789	S	S	*	*				96.9	128.3	57.3	-79.7	179.6	0	0	0	112.1
53	R	25.9	Very low	25	Very low	194 Å²	194	142.4 Å²	142.4	73%	0.732	79%	0.785	S	S	*	*			trans	74.2	118.3	168.9	-79.3	-168.4	150	-176.7	-25	117.5
54	E	25.3	Very low	25.4	Very low	140 Å²	140	140.7 Å²	140.7	65%	0.654	79%	0.786	S	S	*	*				88.8	145.3	72.4	-85.8	175.1	-153.8	0	0	111.6
55	S	24.2	Very low	25.4	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	79%	0.785	S	S	*	*			cis	-178.7	103.8	-30.7	47.7	0	0	0	0	109.2
56	A	26.5	Very low	25.6	Very low	111 Å²	111	139.9 Å²	139.9	92%	0.917	78%	0.781	S	S	*	*			trans	-170.4	141.1	161.1	0	0	0	0	0	109.9
57	G	25.1	Very low	25.8	Very low	66 Å²	66	143.8 Å²	143.8	68%	0.68	78%	0.78	S	S	*	*			cis	151.7	136.5	-10.7	0	0	0	0	0	112.4
58	I	24.7	Very low	25.6	Very low	175 Å²	175	143 Å²	143	90%	0.897	77%	0.768	S	S	*	*			trans	70.8	151	167.1	-56.3	168.7	0	0	0	115
59	K	22.2	Very low	25.8	Very low	176 Å²	176	141.5 Å²	141.5	77%	0.765	76%	0.759	S	S	*	*			cis	179.7	143	-43	-148.5	-174.3	-177	-179.7	0	106.5
60	V	22.9	Very low	25.9	Very low	135 Å²	135	143.4 Å²	143.4	82%	0.818	76%	0.755	S	S	*	*			trans	66.9	151.4	153.7	149.5	0	0	0	0	115.9
61	S	22.2	Very low	26.1	Very low	83 Å²	83	140.1 Å²	140.1	58%	0.58	75%	0.754	S	S	*	*			cis	-176.8	145.6	-20.8	-177.1	0	0	0	0	110.3
62	L	24.7	Very low	26.1	Very low	156 Å²	156	143.9 Å²	143.9	82%	0.817	76%	0.758	S	S	*	*			trans	63	170	164	-68.5	162.1	0	0	0	114.8
63	K	23.9	Very low	26.3	Very low	189 Å²	189	148.1 Å²	148.1	82%	0.822	77%	0.766	S	S	*	*			cis	-150.1	164.2	14.6	-154.3	170.6	-176.7	-177	0	111.9
64	V	31.4	Very low	26.6	Very low	134 Å²	134	143.6 Å²	143.6	81%	0.812	76%	0.764	S	S	*	*			trans	-66.5	147.6	169.6	177	0	0	0	0	111.6
65	S	26.6	Very low	27.1	Very low	121 Å²	121	144.2 Å²	144.2	85%	0.846	77%	0.767	S	S	*	*			trans	-141.3	166.6	157.7	-162.8	0	0	0	0	109.9
66	D	27.8	Very low	27.5	Very low	123 Å²	123	144.9 Å²	144.9	66%	0.658	77%	0.766	S	S	*	*			trans	-135.6	163.5	-150.4	-162	13	0	0	0	113.9
67	R	30	Very low	27.7	Very low	192 Å²	192	147.2 Å²	147.2	73%	0.725	76%	0.764	S	S	*	*			trans	68.3	135.7	154.9	-78.5	168.7	-177.3	-133.9	-7	124.7
68	N	27.9	Very low	27.8	Very low	115 Å²	115	147.4 Å²	147.4	62%	0.615	77%	0.765	S	S	*	*				70.7	154.8	129.6	-65.5	22.7	0	0	0	120.6
69	E	30.1	Very low	29.3	Very low	155 Å²	155	145.4 Å²	145.4	72%	0.724	76%	0.764	S	S	*	*			cis	-162.3	157	-8.5	-115.9	173.7	121.3	0	0	114.2
70	V	26.7	Very low	29.6	Very low	117 Å²	117	142.1 Å²	142.1	71%	0.709	77%	0.769	S	S	*	*			trans	44	104	139.8	176.9	0	0	0	0	122.7
71	L	31.2	Very low	30.1	Very low	155 Å²	155	147.2 Å²	147.2	81%	0.812	77%	0.774	S	S	*	*				46.6	129.7	108.4	-138.5	149.1	0	0	0	122.4
72	R	23.2	Very low	31.3	Very low	249 Å²	249	148.6 Å²	148.6	94%	0.94	78%	0.781	S	S	*	*			trans	-156.2	174	150.4	-114.5	176.3	-166	-156.5	2.6	114.1
73	R	30.6	Very low	31.6	Very low	222 Å²	222	150.4 Å²	150.4	84%	0.838	78%	0.782	S	S	*	*			trans	-154.2	172.7	-162.5	-164.9	-177.3	-175.9	-176.2	3.1	111.5
74	S	32.4	Very low	31.9	Very low	98 Å²	98	149 Å²	149	69%	0.685	78%	0.784	S	S	*	*			trans	96	151	173.8	86.4	0	0	0	0	116.8
75	E	34.4	Very low	31.8	Very low	154 Å²	154	150.9 Å²	150.9	72%	0.72	78%	0.781	S	S	*	*			cis	-158	-162.5	-25.5	-125.6	71.8	-92.7	0	0	106.7
76	T	32.6	Very low	31.8	Very low	116 Å²	116	151 Å²	151	71%	0.712	77%	0.768	S	S	*	*			cis	-161.5	162.8	8.7	-13.8	0	0	0	0	112.1
77	D	30.2	Very low	31.9	Very low	161 Å²	161	152.8 Å²	152.8	86%	0.861	77%	0.772	S	S	*	*			trans	63.2	160.6	145.9	-74.5	-34.6	0	0	0	127
78	G	29	Very low	31.8	Very low	69 Å²	69	149.8 Å²	149.8	71%	0.711	78%	0.775	S	S	*	*			trans	-123.9	-144.2	169.2	0	0	0	0	0	111.5
79	P	56.4	Low	31.8	Very low	134 Å²	134	152.8 Å²	152.8	87%	0.87	78%	0.783	S	S	*	*			cis	-136.2	-174.7	-5.3	44.7	-28	0	0	0	115.2
80	A	27.2	Very low	31.7	Very low	106 Å²	106	150.3 Å²	150.3	88%	0.876	78%	0.775	S	S	*	*			trans	-175.1	166.1	154.3	0	0	0	0	0	115.5
81	R	33.2	Very low	31.7	Very low	242 Å²	242	151.6 Å²	151.6	91%	0.913	77%	0.773	S	S	*	*			trans	-159.9	154.1	177.4	-139.7	-177.6	-167.5	-171.7	5.9	111.3
82	P	46.9	Very low	31.5	Very low	113 Å²	113	150.1 Å²	150.1	73%	0.734	77%	0.771	S	S	*	*				-163.2	161.8	102.5	40.5	-19.6	0	0	0	120.9
83	K	31.8	Very low	31.6	Very low	194 Å²	194	144 Å²	144	84%	0.843	76%	0.76	S	S	*	*			trans	64.1	102.7	142.1	-72.3	174.3	-180	177.6	0	125.8
84	N	30.6	Very low	31.4	Very low	159 Å²	159	139 Å²	139	85%	0.85	75%	0.754	S	S	*	*				68	151.9	107.8	-101.5	26.6	0	0	0	127.4
85	K	28.3	Very low	31.1	Very low	173 Å²	173	139.7 Å²	139.7	75%	0.752	75%	0.754	S	S	*	*			trans	88.3	143.6	165.5	-67.2	-177.6	155.8	-130.1	0	117.4
86	Q	27.8	Very low	30.7	Very low	124 Å²	124	140 Å²	140	58%	0.579	76%	0.761	S	S	*	*			cis	-159	149.8	-8.9	-124.2	172.2	-77.2	0	0	112
87	E	29.6	Very low	30.4	Very low	160 Å²	160	138.1 Å²	138.1	75%	0.748	77%	0.765	S	S	*	*			trans	30.5	159.1	142.8	-61.5	170.7	134.7	0	0	122.8
88	V	27.1	Very low	30.2	Very low	130 Å²	130	136.7 Å²	136.7	79%	0.788	76%	0.762	S	S	*	*			cis	-149.3	154.4	28.8	179.6	0	0	0	0	112.9
89	K	29.1	Very low	30.2	Very low	177 Å²	177	139.5 Å²	139.5	77%	0.77	77%	0.765	S	S	*	*			trans	-25.1	171.1	153.1	-67.4	-175.4	178	-175.7	0	119.8
90	N	27.1	Very low	28.9	Very low	104 Å²	104	138.3 Å²	138.3	56%	0.556	76%	0.755	S	S	*	*			cis	-162.4	158.5	3.4	-120.7	20.4	0	0	0	114.6
91	E	27.7	Very low	29.1	Very low	143 Å²	143	139.7 Å²	139.7	67%	0.668	75%	0.748	S	S	*	*			trans	35.8	126.7	131.9	-64.4	169.3	-176.5	0	0	125.3
92	T	26.5	Very low	28.8	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	74%	0.739	S	S	*	*				72.2	164.8	126.8	71.3	0	0	0	0	121.1
93	V	26.2	Very low	28.1	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	74%	0.736	S	S	*	*			cis	-163.3	135	-18	130.5	0	0	0	0	112.7
94	V	25.6	Very low	27.9	Very low	118 Å²	118	131.7 Å²	131.7	72%	0.715	73%	0.73	S	S	*	*			trans	61.1	154.6	144.6	176.1	0	0	0	0	123
95	T	26.7	Very low	27.8	Very low	112 Å²	112	128.6 Å²	128.6	69%	0.687	72%	0.721	S	S	*	*			trans	85.9	115.6	158.3	26.4	0	0	0	0	123.8
96	N	25.7	Very low	27.8	Very low	161 Å²	161	126.7 Å²	126.7	86%	0.861	72%	0.718	S	S	*	*				46.3	135.8	129.3	-59.8	1.1	0	0	0	123.6
97	G	25.1	Very low	27.7	Very low	76 Å²	76	129.2 Å²	129.2	78%	0.784	73%	0.728	S	S	*	*			trans	158.5	104.2	144.3	0	0	0	0	0	119.7
98	T	26.6	Very low	27.7	Very low	131 Å²	131	129 Å²	129	80%	0.804	73%	0.73	S	S	*	*			trans	-36.7	156.1	149.7	45.7	0	0	0	0	115.9
99	T	28.5	Very low	28.4	Very low	128 Å²	128	129 Å²	129	79%	0.785	73%	0.732	S	S	*	*			cis	-171.9	-166.9	1.7	29.4	0	0	0	0	107.6
100	V	29.5	Very low	28.3	Very low	109 Å²	109	126.6 Å²	126.6	66%	0.661	73%	0.728	S	S	*	*			cis	-162.2	151.6	12.8	88.5	0	0	0	0	112.2
101	N	31.9	Very low	28.4	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	74%	0.737	S	S	*	*			trans	58.4	159.9	158.9	-65.4	-6.7	0	0	0	121.1
102	N	27.3	Very low	28.4	Very low	136 Å²	136	132.7 Å²	132.7	73%	0.727	75%	0.747	S	S	*	*			cis	-136.3	135.5	18.2	-107.3	-25.9	0	0	0	111.1
103	V	31	Very low	28.3	Very low	111 Å²	111	132 Å²	132	67%	0.673	75%	0.747	S	S	*	*				68.9	124.9	90.8	170.6	0	0	0	0	113.3
104	N	28.5	Very low	28.3	Very low	135 Å²	135	133.8 Å²	133.8	72%	0.722	75%	0.752	S	S	*	*			cis	-161.4	-169	10.2	-127.2	-3.1	0	0	0	108.7
105	S	28.2	Very low	28.3	Very low	93 Å²	93	135 Å²	135	65%	0.65	75%	0.754	S	S	*	*			cis	-179.9	166.7	-15.1	45.5	0	0	0	0	109.2
106	L	28.2	Very low	28.4	Very low	133 Å²	133	137.8 Å²	137.8	70%	0.696	76%	0.763	S	S	*	*			cis	-173.9	130.5	-24.8	-95.6	170.7	0	0	0	110.5
107	K	26.2	Very low	28.5	Very low	178 Å²	178	134.9 Å²	134.9	77%	0.774	76%	0.755	S	S	*	*			trans	66	142.4	154.9	-61.1	171.4	177.3	175.4	0	118.9
108	I	29.2	Very low	28.5	Very low	156 Å²	156	138.3 Å²	138.3	80%	0.8	76%	0.762	S	S	*	*			cis	69.3	116.7	44	-57.1	175.2	0	0	0	111.8
109	P	41.8	Very low	28.6	Very low	128 Å²	128	136.5 Å²	136.5	83%	0.831	76%	0.76	S	S	*	*				-157.5	-170.1	79.8	44	-22.3	0	0	0	118.9
110	D	27.8	Very low	28.6	Very low	127 Å²	127	136.4 Å²	136.4	68%	0.679	76%	0.759	S	S	*	*			trans	-65.4	164.6	-176.7	-82.6	-25.4	0	0	0	120
111	K	28.8	Very low	28.7	Very low	174 Å²	174	138.1 Å²	138.1	76%	0.757	76%	0.763	S	S	*	*				101.7	134.8	126.2	-96.8	155.1	-166	134.7	0	123.6
112	K	26.4	Very low	28.3	Very low	201 Å²	201	140.5 Å²	140.5	87%	0.874	77%	0.77	S	S	*	*			trans	86.6	154	143.3	-90.3	-164.8	170.4	-163.4	0	120.9
113	C	25.7	Very low	28.3	Very low	112 Å²	112	139.9 Å²	139.9	76%	0.757	77%	0.771	S	S	*	*			trans	-93.2	163.3	-174.7	-37.1	0	0	0	0	111.8
114	D	24.8	Very low	28.7	Very low	156 Å²	156	140.1 Å²	140.1	83%	0.834	78%	0.775	S	S	*	*				-166.4	170.3	109	-106.4	-39.1	0	0	0	112.9
115	N	27	Very low	28.8	Very low	143 Å²	143	143.2 Å²	143.2	77%	0.765	78%	0.781	S	S	*	*			trans	-85.8	159.3	-179.5	-63.4	-67.4	0	0	0	112.9
116	I	27.6	Very low	28.8	Very low	171 Å²	171	142.5 Å²	142.5	88%	0.877	78%	0.782	S	S	*	*				174.1	156.3	117.1	-90.6	160.2	0	0	0	111.3
117	S	28.4	Very low	28.8	Very low	99 Å²	99	141.9 Å²	141.9	69%	0.692	78%	0.784	S	S	*	*			trans	-96	161.9	-175.5	55.8	0	0	0	0	114.3
118	T	25.7	Very low	28.7	Very low	149 Å²	149	142 Å²	142	91%	0.914	78%	0.784	S	S	*	*			trans	-166.2	167.4	133.1	10.3	0	0	0	0	110.2
119	A	28.1	Very low	28.5	Very low	92 Å²	92	140.4 Å²	140.4	76%	0.76	79%	0.787	S	S	*	*			trans	-126.9	173.9	-173.3	0	0	0	0	0	111.4
120	V	28.7	Very low	27.9	Very low	127 Å²	127	142 Å²	142	77%	0.77	79%	0.787	S	S	*	*			trans	-176.9	118.3	140.8	139.9	0	0	0	0	113.6
121	I	30.4	Very low	27.8	Very low	144 Å²	144	139.5 Å²	139.5	74%	0.738	79%	0.791	S	S	*	*			trans	43.7	125.2	135	-43.2	168.5	0	0	0	121.4
122	E	24.9	Very low	27.7	Very low	186 Å²	186	138.8 Å²	138.8	87%	0.869	79%	0.79	S	S	*	*				-170.3	163.5	110.1	-100.2	-164.4	176.3	0	0	115
123	T	26.8	Very low	27.8	Very low	122 Å²	122	138.9 Å²	138.9	75%	0.748	79%	0.785	S	S	*	*			trans	-149.6	153	-172.3	64.5	0	0	0	0	112.7
124	P	39.8	Very low	27.9	Very low	117 Å²	117	142.1 Å²	142.1	76%	0.76	79%	0.786	S	S	*	*				-141	156.8	112.9	29.9	-11.5	0	0	0	112.8
125	K	29.2	Very low	28	Very low	199 Å²	199	143.1 Å²	143.1	87%	0.865	78%	0.783	S	S	*	*				64.2	133.4	57	-78.5	-175.7	-178.8	178.1	0	113.4
126	A	29.2	Very low	28.1	Very low	79 Å²	79	147 Å²	147	65%	0.653	79%	0.787	S	S	*	*			cis	-165.2	160.4	5.3	0	0	0	0	0	116.2
127	T	27.5	Very low	28	Very low	120 Å²	120	143.6 Å²	143.6	74%	0.736	78%	0.778	S	S	*	*			trans	66.3	129	138.6	48.1	0	0	0	0	126.8
128	F	25.6	Very low	28	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.794	79%	0.787	S	S	*	*			trans	61.1	128.5	136.9	-82.9	-73.3	0	0	0	124.7
129	S	24.9	Very low	28	Very low	121 Å²	121	141.6 Å²	141.6	85%	0.846	77%	0.774	S	S	*	*				-171.2	168.6	109.7	38.4	0	0	0	0	112.2
130	I	28.6	Very low	28	Very low	162 Å²	162	144 Å²	144	83%	0.831	78%	0.779	S	S	*	*			trans	-133.3	146.5	-172.6	-70.1	172.5	0	0	0	110
131	G	25.9	Very low	27.9	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	77%	0.772	S	S	*	*			trans	-150	138.4	175.7	0	0	0	0	0	114.7
132	E	27.5	Very low	27.7	Very low	159 Å²	159	145.4 Å²	145.4	74%	0.743	78%	0.776	S	S	*	*			trans	-78.6	-179.3	-179.8	-77.3	-156.7	108.4	0	0	114
133	R	26.9	Very low	27.8	Very low	203 Å²	203	142.8 Å²	142.8	77%	0.766	77%	0.768	S	S	*	*			cis	158.4	157.6	-27	-162.7	178.1	-170.6	-176.3	5.4	106.9
134	K	28.2	Very low	27.9	Very low	180 Å²	180	143.4 Å²	143.4	78%	0.783	76%	0.763	S	S	*	*			trans	75.5	158.7	173.9	-62	171.8	-176.5	164.3	0	116.5
135	K	27.9	Very low	27.3	Very low	177 Å²	177	143.7 Å²	143.7	77%	0.77	76%	0.757	S	S	*	*			cis	-176	145.5	-38.1	-124.1	-177.9	-178.1	-179.6	0	110.2
136	R	27.7	Very low	27.3	Very low	226 Å²	226	141.3 Å²	141.3	85%	0.853	75%	0.753	S	S	*	*			trans	66.5	163	157.7	-81.6	-179.2	174.8	177.2	-4.3	116.6
137	S	25.9	Very low	27.3	Very low	98 Å²	98	142 Å²	142	69%	0.685	75%	0.746	S	S	*	*			cis	-164.1	156.4	4.1	24.7	0	0	0	0	113.1
138	V	27.9	Very low	27.4	Very low	144 Å²	144	146 Å²	146	87%	0.873	75%	0.748	S	S	*	*			trans	45	139	139.3	-177.4	0	0	0	0	119.6
139	G	26.8	Very low	27.4	Very low	63 Å²	63	142 Å²	142	65%	0.649	74%	0.742	S	S	*	*			cis	153.6	-168.5	4.2	0	0	0	0	0	110.9
140	V	28.2	Very low	27.7	Very low	141 Å²	141	143.7 Å²	143.7	86%	0.855	74%	0.74	S	S	*	*			trans	74.6	142.9	165.8	-178.8	0	0	0	0	116.7
141	S	27.1	Very low	27.6	Very low	89 Å²	89	140.8 Å²	140.8	62%	0.622	74%	0.741	S	S	*	*			cis	-171.6	145.7	-26.3	63.4	0	0	0	0	115.4
142	Y	26	Very low	27.6	Very low	212 Å²	212	140.8 Å²	140.8	83%	0.831	74%	0.741	S	S	*	*			trans	69	158.8	136.3	-96.3	-91.9	0	0	0	126.6
143	N	26.4	Very low	27.6	Very low	131 Å²	131	143 Å²	143	70%	0.701	75%	0.751	S	S	*	*			trans	77.7	149.1	163.1	-75.4	29.2	0	0	0	121.4
144	E	29.2	Very low	27.5	Very low	136 Å²	136	137.4 Å²	137.4	64%	0.636	75%	0.748	S	S	*	*			cis	-174.2	166	-34.9	-146	177.7	-137.1	0	0	111.4
145	N	27.4	Very low	27.4	Very low	122 Å²	122	140.3 Å²	140.3	65%	0.652	75%	0.754	S	S	*	*			trans	68.4	153.3	159.2	-62.3	-42.9	0	0	0	118.5
146	L	28.4	Very low	27.2	Very low	149 Å²	149	143.6 Å²	143.6	78%	0.78	76%	0.761	S	S	*	*			cis	-166.7	-175.8	-24.7	-144.4	67.2	0	0	0	106.2
147	D	29.6	Very low	27.1	Very low	94 Å²	94	138 Å²	138	50%	0.503	76%	0.757	S	S	.	*			cis	-164.6	161.8	3.6	-172.7	23.7	0	0	0	111.3
148	R	29.7	Very low	27	Very low	204 Å²	204	139.6 Å²	139.6	77%	0.77	76%	0.763	S	S	*	*			trans	57.8	159.5	156.4	-88.6	172.5	-176.3	117.2	-7.1	120.8
149	S	26.3	Very low	26.8	Very low	96 Å²	96	143.8 Å²	143.8	67%	0.671	76%	0.763	S	S	*	*			cis	-156.3	130.4	-3.6	47.4	0	0	0	0	114.8
150	I	29.6	Very low	26.7	Very low	157 Å²	157	147.3 Å²	147.3	81%	0.805	77%	0.772	S	S	*	*				47	114.6	119.9	-51.9	165.5	0	0	0	121.6
151	A	26.6	Very low	26.6	Very low	102 Å²	102	145.7 Å²	145.7	84%	0.843	76%	0.762	S	S	*	*				171.8	149	127.4	0	0	0	0	0	111.3
152	G	26.8	Very low	26.5	Very low	74 Å²	74	149 Å²	149	76%	0.763	77%	0.768	S	S	*	*			cis	146.1	63.7	-17.1	0	0	0	0	0	117.8
153	E	26.3	Very low	26.3	Very low	206 Å²	206	146.1 Å²	146.1	96%	0.963	77%	0.766	S	S	*	*			trans	-158.9	178.3	158.8	-126.1	173.3	-162	0	0	115
154	A	26.4	Very low	26.2	Very low	85 Å²	85	144 Å²	144	70%	0.702	77%	0.767	S	S	*	*			trans	-144.8	158.5	-136.6	0	0	0	0	0	118.8
155	R	26.3	Very low	26.1	Very low	240 Å²	240	143.3 Å²	143.3	91%	0.906	78%	0.777	S	S	*	*			trans	37.7	120.7	151.3	-69.3	178	172	176.5	-2.6	119.3
156	R	23.5	Very low	25.9	Very low	246 Å²	246	144.2 Å²	144.2	93%	0.928	78%	0.782	S	S	*	*				-157.1	137.3	109.9	-122.4	172.8	-179.8	163.6	0.5	114.3
157	S	24.3	Very low	25.7	Very low	110 Å²	110	146.3 Å²	146.3	77%	0.769	79%	0.785	S	S	*	*			trans	-99	143.3	167.1	54.7	0	0	0	0	110.3
158	V	24	Very low	25.6	Very low	131 Å²	131	148.8 Å²	148.8	79%	0.794	79%	0.793	S	S	*	*			trans	-129.3	117.3	156.1	179.8	0	0	0	0	108
159	R	23.9	Very low	25.3	Very low	231 Å²	231	143.8 Å²	143.8	87%	0.872	79%	0.79	S	S	*	*			trans	-91.9	139.3	156.3	-80.8	-179.6	170.3	175	-4.4	107.2
160	T	24.4	Very low	25.4	Very low	137 Å²	137	146.7 Å²	146.7	84%	0.84	79%	0.793	S	S	*	*			trans	-117.8	139.5	148.4	34.3	0	0	0	0	107.8
161	V	25.4	Very low	25.1	Very low	108 Å²	108	149.7 Å²	149.7	66%	0.655	80%	0.796	S	S	*	*			trans	-136.1	167	-178.8	177.8	0	0	0	0	105.6
162	H	26.1	Very low	25.1	Very low	159 Å²	159	153.7 Å²	153.7	74%	0.736	80%	0.797	S	S	*	*			trans	99.8	128.2	-174.5	-59.2	-63.8	0	0	0	113
163	D	22.8	Very low	25.1	Very low	151 Å²	151	155.6 Å²	155.6	81%	0.807	80%	0.798	S	S	*	*			cis	-140.9	169.2	0.7	-100.8	-33.6	0	0	0	113.7
164	A	23.9	Very low	25	Very low	85 Å²	85	152.2 Å²	152.2	70%	0.702	79%	0.792	S	S	*	*			trans	-114.6	155.7	-174.1	0	0	0	0	0	112.9
165	S	25.6	Very low	25.1	Very low	122 Å²	122	157.4 Å²	157.4	85%	0.853	80%	0.802	S	S	*	*			trans	-145.8	134.9	150.7	51.6	0	0	0	0	109.2
166	N	25.2	Very low	25.2	Very low	141 Å²	141	154.9 Å²	154.9	75%	0.754	80%	0.8	S	S	*	*			trans	-98.3	159	-173.3	-62.2	-18.2	0	0	0	111
167	F	23.5	Very low	25.5	Very low	194 Å²	194	152.8 Å²	152.8	85%	0.851	80%	0.801	S	S	*	*				-146.5	137.9	124.2	-121.2	-79.9	0	0	0	111.5
168	E	26.4	Very low	25.7	Very low	145 Å²	145	152.8 Å²	152.8	68%	0.678	80%	0.801	S	S	*	*			trans	-36.4	143.4	175.3	-72.2	159.3	147	0	0	115.3
169	S	25.1	Very low	26.2	Very low	100 Å²	100	156.3 Å²	156.3	70%	0.699	81%	0.809	S	S	*	*				52.3	142.8	73	68.8	0	0	0	0	113.5
170	E	26.8	Very low	26.3	Very low	157 Å²	157	152.1 Å²	152.1	73%	0.734	80%	0.804	S	S	*	*			cis	-142.9	171	22.1	-134.1	158	-151.8	0	0	109.2
171	Y	24.6	Very low	26.9	Very low	220 Å²	220	151 Å²	151	86%	0.863	80%	0.801	S	S	*	*				-160.4	144.9	77.2	-113	-97	0	0	0	111.4
172	Q	26.4	Very low	27	Very low	186 Å²	186	152.8 Å²	152.8	87%	0.869	81%	0.807	S	S	*	*			trans	-126	125	176.7	-173.7	173.9	1.7	0	0	108.7
173	S	25.5	Very low	27.2	Very low	113 Å²	113	149.6 Å²	149.6	79%	0.79	80%	0.803	S	S	*	*			trans	-119.6	126.6	177	55.8	0	0	0	0	110.6
174	T	25.3	Very low	27.6	Very low	135 Å²	135	149.3 Å²	149.3	83%	0.828	81%	0.807	S	S	*	*			trans	-68.3	140.1	176.8	45.1	0	0	0	0	112.5
175	E	28.5	Very low	28.4	Very low	195 Å²	195	152 Å²	152	91%	0.911	81%	0.805	S	S	*	*			trans	-116.1	148.9	150.2	-69.9	-169.5	135.9	0	0	108.3
176	E	27.4	Very low	29.3	Very low	186 Å²	186	150.7 Å²	150.7	87%	0.869	80%	0.796	S	S	*	*			trans	-92.9	141.4	-167.3	-61.4	175.7	126.1	0	0	111.8	S178	E176-S178 PolarHBondContact O-N 3.31Å
177	E	30.3	Very low	30.7	Very low	203 Å²	203	152.4 Å²	152.4	95%	0.949	80%	0.799	S	S	*	*			trans	-71.7	107.9	174.4	-69.6	-175.4	133.6	0	0	110.5
178	S	28.1	Very low	32.4	Very low	109 Å²	109	143.9 Å²	143.9	76%	0.762	76%	0.763	S	S	*	*			trans	-98.2	113.1	161.9	50	0	0	0	0	109.3	E176 D180	E176-S178 PolarHBondContact O-N 3.31Å; S178-D180 PolarHBondContact O-N 3.47Å; S178-D180 VanDerWaalsContact O-N 3.15Å
179	E	34.5	Very low	34.4	Very low	205 Å²	205	142.9 Å²	142.9	96%	0.958	76%	0.758	S	S	*	*			trans	-65.9	110.1	171.8	-70.2	-171.1	119	0	0	109.8
180	D	26.8	Very low	37	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	73%	0.731	S	S	*	*			trans	-127.4	107.9	166.3	-151.5	-11.6	0	0	0	109.8	S178 N182	S178-D180 PolarHBondContact O-N 3.47Å; S178-D180 VanDerWaalsContact O-N 3.15Å; D180-N182 PolarHBondContact O-N 2.82Å; D180-N182 VanDerWaalsContact O-N 3.14Å
181	S	36.1	Very low	39.5	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	72%	0.72	S	S	*	*			trans	-79.1	102.2	-163.3	62.8	0	0	0	0	112
182	N	29	Very low	42.4	Very low	145 Å²	145	128.5 Å²	128.5	78%	0.775	70%	0.697	S	S	*	*			trans	-131.8	153.9	167.6	-95.1	-67.6	0	0	0	112.9	D180 T184	D180-N182 PolarHBondContact O-N 2.82Å; D180-N182 VanDerWaalsContact O-N 3.14Å; N182-T184 PolarHBondContact O-N 3.43Å
183	S	29.4	Very low	45.4	Very low	92 Å²	92	121.8 Å²	121.8	64%	0.643	67%	0.67	S	S	*	*			trans	-52.8	128.2	-165.5	59.3	0	0	0	0	113.7	Q185	S183-Q185 VanDerWaalsContact C-N 3.31Å; S183-Q185 PolarHBondContact O-N 2.94Å
184	T	31.8	Very low	48.3	Very low	146 Å²	146	119.9 Å²	119.9	90%	0.896	65%	0.654	S	S	*	*			trans	-63.9	87.3	171.5	-35.1	0	0	0	0	110.3	N182 S186	N182-T184 PolarHBondContact O-N 3.43Å; T184-S186 PolarHBondContact O-N 2.84Å
185	Q	40.7	Very low	51.4	Low	141 Å²	141	115.9 Å²	115.9	66%	0.659	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-67	122.5	164.2	-65.1	-171.1	14.8	0	0	107.2	S183 E187	S183-Q185 VanDerWaalsContact C-N 3.31Å; S183-Q185 PolarHBondContact O-N 2.94Å; Q185-E187 PolarHBondContact O-N 3.46Å
186	S	43.5	Very low	54.2	Low	94 Å²	94	108 Å²	108	66%	0.657	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-53.5	137.7	176.1	55.4	0	0	0	0	110.5	T184 R736	T184-S186 PolarHBondContact O-N 2.84Å; S186-R736 PolarHBondContact O-NH1 2.97Å; S186-R736 VanDerWaalsContact O-NH1 3.13Å
187	E	56	Low	57.1	Low	177 Å²	177	99.2 Å²	99.2	83%	0.827	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-53.1	139.1	168.7	-66.7	-166.7	128.9	0	0	109.3	Q185 H189	Q185-E187 PolarHBondContact O-N 3.46Å; E187-H189 PolarHBondContact O-N 3.28Å
188	P	59.3	Low	59.5	Low	16 Å²	16	92.8 Å²	92.8	10%	0.104	53%	0.53	C	S	.	.			trans	-66.8	109.1	-177.9	20.5	-23.5	0	0	0	109.7	H653 L698	P188-H653 PolarHBondContact O-CE1 3.49Å; P188-L698 HydrophobicContact CB-CD2 3.82Å
189	H	66.8	Low	61.7	Low	123 Å²	123	90.2 Å²	90.2	57%	0.569	52%	0.521	S	S	*	.			trans	-70.5	129.3	179.1	-153.6	-99.3	0	0	0	109.5	E187 D191	E187-H189 PolarHBondContact O-N 3.28Å; H189-D191 IonicContact CE1-OD1 2.62Å; H189-D191 PolarHBondContact CE1-OD1 2.84Å; H189-D191 IonicContact CE1-OD2 2.64Å; H189-D191 PolarHBondContact CE1-OD2 3.26Å; H189-D191 IonicContact CG-OD2 2.62Å; H189-D191 VanDerWaalsContact ND1-CG 3.34Å; H189-D191 IonicContact ND1-OD1 3.34Å; H189-D191 PolarHBondContact ND1-OD1 2.85Å; H189-D191 IonicContact ND1-OD2 3.78Å; H189-D191 PolarHBondContact ND1-OD2 3.46Å
190	L	80.4	Confident	63.5	Low	25 Å²	25	80.5 Å²	80.5	13%	0.131	48%	0.475	C	S	.	.			trans	-113	136.5	165.6	-66.8	174.7	0	0	0	106.6	P192 L640 I642 H653 I693 L698	L190-P192 WeakPolarHBondContact O-CD 3.21Å; L190-L640 HydrophobicContact CD1-CD1 4.29Å; L190-I642 HydrophobicContact CD1-CD1 3.72Å; L190-I642 HydrophobicContact CD2-CD1 4.21Å; L190-I642 HydrophobicContact CG-CD1 4.47Å; L190-H653 HydrophobicContact CD1-CB 3.7Å; L190-I693 HydrophobicContact CB-CG2 4.16Å; L190-I693 HydrophobicContact CD2-CG2 4.22Å; L190-L698 HydrophobicContact CD2-CD1 4.49Å; L190-L698 HydrophobicContact CD2-CD2 3.79Å; L190-L698 HydrophobicContact CD2-CG 4.05Å; L190-L698 HydrophobicContact CG-CD2 4.48Å
191	D	78.9	Confident	65.5	Low	94 Å²	94	76.9 Å²	76.9	50%	0.503	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	90.6	179.2	-76.3	-83.5	0	0	0	109.9	H189 D694	H189-D191 IonicContact CE1-OD1 2.62Å; H189-D191 PolarHBondContact CE1-OD1 2.84Å; H189-D191 IonicContact CE1-OD2 2.64Å; H189-D191 PolarHBondContact CE1-OD2 3.26Å; H189-D191 IonicContact CG-OD2 2.62Å; H189-D191 VanDerWaalsContact ND1-CG 3.34Å; H189-D191 IonicContact ND1-OD1 3.34Å; H189-D191 PolarHBondContact ND1-OD1 2.85Å; H189-D191 IonicContact ND1-OD2 3.78Å; H189-D191 PolarHBondContact ND1-OD2 3.46Å; D191-D694 PolarHBondContact O-N 2.93Å
192	P	86.7	Confident	67.1	Low	57 Å²	57	75 Å²	75	37%	0.37	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	126.6	174.2	31.8	-33.8	0	0	0	111.3	L190 F655 I691 K692 I693	L190-P192 WeakPolarHBondContact O-CD 3.21Å; P192-F655 WeakPolarHBondContact CB-O 3.38Å; P192-I691 HydrophobicContact CB-CG2 4.13Å; P192-K692 CarbonylContact C-O 3.59Å; P192-K692 WeakPolarHBondContact CA-O 3.41Å; P192-I693 HydrophobicContact CB-CG1 4.39Å
193	S	87.6	Confident	69.5	Low	44 Å²	44	68.8 Å²	68.8	31%	0.308	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.2	168.5	67.9	0	0	0	0	110.4	K692	S193-K692 PolarHBondContact N-O 3.5Å; S193-K692 PolarHBondContact O-N 3Å
194	T	87.8	Confident	72	Confident	74 Å²	74	68.1 Å²	68.1	45%	0.454	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.2	179.6	-53.4	0	0	0	0	111.3	L690 I691	T194-L690 CarbonylContact C-O 3.6Å; T194-L690 WeakPolarHBondContact CA-O 3.16Å; T194-I691 HydrophobicContact CG2-CG1 4.04Å
195	F	89.3	Confident	74.5	Confident	50 Å²	50	64.6 Å²	64.6	22%	0.219	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.5	172.4	-168.1	-83.5	0	0	0	110.3	L197 S245 T246 Y247 L690	F195-L197 HydrophobicContact CD1-CD2 4.14Å; F195-L197 HydrophobicContact CE1-CD2 4.11Å; F195-S245 WeakPolarHBondContact CD2-O 3.33Å; F195-T246 HydrophobicContact CE2-CG2 4.38Å; F195-Y247 HydrophobicContact CB-CD2 4.41Å; F195-Y247 AromaticContact CD1-CD2 3.66Å; F195-Y247 HydrophobicContact CD1-CD2 3.66Å; F195-Y247 HydrophobicContact CD1-CG 4.34Å; F195-Y247 HydrophobicContact CE1-CD2 4.09Å; F195-Y247 HydrophobicContact CE1-CG 4.37Å; F195-Y247 AromaticContact CG-CD2 4Å; F195-Y247 HydrophobicContact CG-CD2 4Å; F195-Y247 WeakPolarHBondContact CZ-O 3.49Å; F195-L690 PolarHBondContact N-O 2.79Å; F195-L690 PolarHBondContact O-N 2.84Å
196	A	88.1	Confident	76.6	Confident	29 Å²	29	58.8 Å²	58.8	24%	0.24	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.1	175.9	0	0	0	0	0	110.6	S198	A196-S198 VanDerWaalsContact C-N 3.26Å; A196-S198 PolarHBondContact O-N 3.49Å
197	L	87.8	Confident	78.7	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	33%	0.325	C	S	.	.			trans	-78	78.6	171.2	-58.6	-170.6	0	0	0	109.2	F195 D200 I220 T222 W238 Y247 W688 L690	F195-L197 HydrophobicContact CD1-CD2 4.14Å; F195-L197 HydrophobicContact CE1-CD2 4.11Å; L197-D200 HydrophobicContact CB-CB 4.41Å; L197-D200 WeakPolarHBondContact O-CB 3.17Å; L197-I220 HydrophobicContact CD1-CD1 4.2Å; L197-I220 HydrophobicContact CD1-CG2 4.28Å; L197-T222 HydrophobicContact CD1-CG2 4Å; L197-W238 HydrophobicContact CB-CD2 4.49Å; L197-W238 HydrophobicContact CB-CH2 4.19Å; L197-W238 HydrophobicContact CB-CZ2 3.79Å; L197-W238 HydrophobicContact CD1-CD2 4.48Å; L197-W238 HydrophobicContact CD1-CG 4.33Å; L197-W238 HydrophobicContact CD2-CD2 3.83Å; L197-W238 HydrophobicContact CD2-CE3 3.89Å; L197-W238 HydrophobicContact CD2-CG 4.18Å; L197-W238 HydrophobicContact CD2-CZ3 4.28Å; L197-W238 HydrophobicContact CG-CD2 4.49Å; L197-Y247 HydrophobicContact CD2-CD2 4.46Å; L197-Y247 HydrophobicContact CD2-CG 4.19Å; L197-W688 HydrophobicContact CB-CB 4.24Å; L197-W688 HydrophobicContact CD1-CB 4.04Å; L197-W688 HydrophobicContact CG-CB 4.23Å; L197-W688 PolarHBondContact N-O 2.81Å; L197-L690 HydrophobicContact CD1-CD1 3.96Å; L197-L690 HydrophobicContact CD2-CD1 3.73Å; L197-L690 HydrophobicContact CG-CD1 3.61Å
198	S	80.6	Confident	80.1	Confident	68 Å²	68	46.9 Å²	46.9	48%	0.476	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	136.9	-170.5	-66.4	0	0	0	0	114.2	A196 W238 E687	A196-S198 VanDerWaalsContact C-N 3.26Å; A196-S198 PolarHBondContact O-N 3.49Å; S198-W238 WeakPolarHBondContact O-CH2 3.3Å; S198-E687 VanDerWaalsContact CA-CD 3.43Å; S198-E687 VanDerWaalsContact CA-OE1 3.26Å; S198-E687 WeakPolarHBondContact CA-OE1 3.42Å; S198-E687 WeakPolarHBondContact CA-OE2 3.47Å; S198-E687 WeakPolarHBondContact CB-OE2 3.31Å; S198-E687 PolarHBondContact OG-OE2 3Å
199	G	73.9	Confident	81.4	Confident	56 Å²	56	48.8 Å²	48.8	58%	0.577	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	18.8	-172.5	0	0	0	0	0	115.2	E687	G199-E687 PolarHBondContact N-OE1 3.06Å
200	D	73.3	Confident	82.2	Confident	0 Å²	0	44 Å²	44	0%	0	27%	0.271	C	S	.	.			trans	-119.8	13.2	-176.9	-106.2	35.4	0	0	0	114.7	L197 T202 H203 T222 S236 W238 K249	L197-D200 HydrophobicContact CB-CB 4.41Å; L197-D200 WeakPolarHBondContact O-CB 3.17Å; D200-T202 PolarHBondContact O-N 3.41Å; D200-H203 VanDerWaalsContact CG-CE1 3.43Å; D200-H203 PolarHBondContact O-N 2.8Å; D200-H203 PolarHBondContact O-ND1 2.81Å; D200-H203 IonicContact OD1-CE1 2.6Å; D200-H203 PolarHBondContact OD1-CE1 3.31Å; D200-H203 IonicContact OD1-ND1 2.71Å; D200-H203 IonicContact OD2-CE1 3.9Å; D200-H203 IonicContact OD2-ND1 3.55Å; D200-T222 WeakPolarHBondContact OD2-CB 3.23Å; D200-T222 WeakPolarHBondContact OD2-CG2 3.23Å; D200-T222 PolarHBondContact OD2-OG1 2.94Å; D200-S236 WeakPolarHBondContact OD1-CB 3.13Å; D200-S236 PolarHBondContact OD1-OG 2.75Å; D200-S236 WeakPolarHBondContact OD2-CB 3.21Å; D200-W238 HydrophobicContact CB-CZ2 4.21Å; D200-W238 PolarHBondContact OD2-NE1 3.17Å; D200-K249 IonicContact OD1-NZ 2.69Å; D200-K249 PolarHBondContact OD1-NZ 3.05Å
201	S	69.1	Low	82.2	Confident	68 Å²	68	42.9 Å²	42.9	48%	0.476	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-3.7	-171.6	54.5	0	0	0	0	117.1
202	T	69	Low	81.7	Confident	75 Å²	75	38.8 Å²	38.8	46%	0.46	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-19.9	175.1	52.5	0	0	0	0	114.1	D200 L224 E234	D200-T202 PolarHBondContact O-N 3.41Å; T202-L224 WeakPolarHBondContact O-CD1 3.47Å; T202-E234 PolarHBondContact OG1-OE2 3.5Å
203	H	78.9	Confident	80.7	Confident	14 Å²	14	42 Å²	42	7%	0.065	26%	0.255	C	S	.	.			trans	-82.4	127.3	-170.2	-53.5	85.6	0	0	0	112.3	D200 S236 W688	D200-H203 VanDerWaalsContact CG-CE1 3.43Å; D200-H203 PolarHBondContact O-N 2.8Å; D200-H203 PolarHBondContact O-ND1 2.81Å; D200-H203 IonicContact OD1-CE1 2.6Å; D200-H203 PolarHBondContact OD1-CE1 3.31Å; D200-H203 IonicContact OD1-ND1 2.71Å; D200-H203 IonicContact OD2-CE1 3.9Å; D200-H203 IonicContact OD2-ND1 3.55Å; H203-S236 PolarHBondContact CE1-OG 3.11Å; H203-S236 PolarHBondContact NE2-OG 3.48Å; H203-W688 PolarHBondContact O-NE1 3.03Å
204	N	81.6	Confident	79.7	Confident	77 Å²	77	44.5 Å²	44.5	41%	0.412	27%	0.265	S	S	.	.			trans	-97.5	-7.6	-174.1	65.8	-4.8	0	0	0	115	K223 L224 Y225	N204-K223 PolarHBondContact N-O 3.47Å; N204-K223 VanDerWaalsContact N-O 3.15Å; N204-K223 PolarHBondContact OD1-O 2.81Å; N204-L224 HydrophobicContact CB-CD1 4.42Å; N204-Y225 PolarHBondContact ND2-O 2.64Å; N204-Y225 PolarHBondContact OD1-N 2.8Å
205	L	84.6	Confident	79.2	Confident	72 Å²	72	41.6 Å²	41.6	38%	0.377	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.2	176.4	-66	174.6	0	0	0	111	T222 K223 Y225	L205-T222 WeakPolarHBondContact O-CA 3.21Å; L205-K223 HydrophobicContact CB-CG 3.89Å; L205-K223 PolarHBondContact N-O 3.08Å; L205-K223 PolarHBondContact O-N 3.48Å; L205-Y225 HydrophobicContact CD1-CG 4.39Å
206	A	85.9	Confident	79	Confident	19 Å²	19	40.9 Å²	40.9	16%	0.157	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.6	173.9	0	0	0	0	0	111.6	L221 T222 W688	A206-L221 CarbonylContact C-O 3.55Å; A206-L221 WeakPolarHBondContact CA-O 3.35Å; A206-T222 HydrophobicContact CB-CG2 4.35Å; A206-W688 HydrophobicContact CB-CD2 4.41Å; A206-W688 HydrophobicContact CB-CE3 4.37Å; A206-W688 HydrophobicContact CB-CH2 4.13Å; A206-W688 HydrophobicContact CB-CZ2 4.16Å; A206-W688 HydrophobicContact CB-CZ3 4.24Å
207	M	87	Confident	79	Confident	18 Å²	18	39.9 Å²	39.9	9%	0.089	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.8	170.5	-68.6	171.5	164.4	0	0	108.5	I220 L221 Y262 E1223	M207-I220 CarbonylContact O-C 3.43Å; M207-I220 VanDerWaalsContact O-CA 3.3Å; M207-I220 WeakPolarHBondContact O-CA 3.23Å; M207-L221 HydrophobicContact CB-CB 4.4Å; M207-L221 PolarHBondContact N-O 2.86Å; M207-L221 PolarHBondContact O-N 2.77Å; M207-L221 HydrophobicContact SD-CD2 4.35Å; M207-Y262 HydrophobicContact CE-CD1 3.74Å; M207-Y262 HydrophobicContact CE-CE1 4.03Å; M207-Y262 HydrophobicContact SD-CD1 4.49Å; M207-E1223 VanDerWaalsContact CE-OE1 3.23Å; M207-E1223 WeakPolarHBondContact CE-OE1 3.35Å; M207-E1223 WeakPolarHBondContact CE-OE2 3.38Å
208	V	86.6	Confident	79.1	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.1	-169.1	-176.8	0	0	0	0	109.9	I218 I220 Y566 L666 F679	V208-I218 HydrophobicContact CG1-CG2 4.26Å; V208-I220 HydrophobicContact CG1-CG1 4.2Å; V208-I220 HydrophobicContact CG2-CG1 4.28Å; V208-I220 HydrophobicContact CG2-CG2 4.16Å; V208-Y566 HydrophobicContact CB-CE1 4.3Å; V208-Y566 PolarHBondContact N-OH 2.95Å; V208-Y566 VanDerWaalsContact N-OH 3.16Å; V208-Y566 PolarHBondContact O-OH 3.19Å; V208-L666 HydrophobicContact CB-CD1 4.5Å; V208-L666 HydrophobicContact CG1-CB 4.38Å; V208-L666 HydrophobicContact CG1-CD1 3.97Å; V208-L666 HydrophobicContact CG1-CD2 3.65Å; V208-L666 HydrophobicContact CG1-CG 4.2Å; V208-F679 HydrophobicContact CG2-CD1 4.3Å; V208-F679 HydrophobicContact CG2-CE1 4.39Å; V208-F679 HydrophobicContact CG2-CG 4.43Å
209	H	85.3	Confident	79.6	Confident	57 Å²	57	36.5 Å²	36.5	26%	0.264	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.2	-174.1	-63.1	-92.2	0	0	0	113.5	L219 L263 V265	H209-L219 PolarHBondContact N-O 3.44Å; H209-L219 PolarHBondContact O-N 3.28Å; H209-L263 HydrophobicContact CB-CD2 4.31Å; H209-V265 HydrophobicContact CB-CG2 3.78Å
210	W	84.4	Confident	80.4	Confident	23 Å²	23	34 Å²	34	9%	0.087	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	139.6	162.8	-70.9	101.5	0	0	0	110.5	I218 Y243 L666 E668	W210-I218 HydrophobicContact CD2-CD1 4.43Å; W210-I218 HydrophobicContact CD2-CG1 3.87Å; W210-I218 HydrophobicContact CE3-CD1 4.25Å; W210-I218 HydrophobicContact CE3-CG1 3.52Å; W210-I218 HydrophobicContact CH2-CD1 3.56Å; W210-I218 HydrophobicContact CH2-CG1 3.76Å; W210-I218 HydrophobicContact CZ2-CD1 3.74Å; W210-I218 HydrophobicContact CZ2-CG1 4.09Å; W210-I218 HydrophobicContact CZ3-CD1 3.83Å; W210-I218 HydrophobicContact CZ3-CG1 3.47Å; W210-I218 VanDerWaalsContact CZ3-CG1 3.47Å; W210-Y243 AromaticContact CH2-CD1 3.84Å; W210-Y243 HydrophobicContact CH2-CD1 3.84Å; W210-Y243 HydrophobicContact CH2-CG 4.45Å; W210-Y243 AromaticContact CZ3-CD1 3.74Å; W210-Y243 HydrophobicContact CZ3-CD1 3.74Å; W210-Y243 HydrophobicContact CZ3-CG 4.49Å; W210-L666 HydrophobicContact CD2-CD2 4.5Å; W210-L666 HydrophobicContact CG-CD2 4.39Å; W210-L666 HydrophobicContact CZ2-CD2 4.42Å; W210-L666 VanDerWaalsContact NE1-CD2 3.26Å; W210-E668 HydrophobicContact CD2-CB 4.35Å; W210-E668 HydrophobicContact CG-CB 4.42Å; W210-E668 HydrophobicContact CG-CG 4.5Å
211	S	79.3	Confident	81.2	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.			trans	-93.1	14.4	177.2	60.9	0	0	0	0	114.7	V217 K270 Q271 E291	S211-V217 PolarHBondContact N-O 3.09Å; S211-V217 VanDerWaalsContact OG-CB 3.24Å; S211-V217 WeakPolarHBondContact OG-CB 3.19Å; S211-V217 WeakPolarHBondContact OG-CG1 3.34Å; S211-V217 PolarHBondContact OG-O 2.81Å; S211-K270 VanDerWaalsContact C-CB 3.45Å; S211-K270 CarbonylContact O-C 3.49Å; S211-K270 WeakPolarHBondContact O-CB 3.28Å; S211-Q271 PolarHBondContact O-N 2.82Å; S211-E291 PolarHBondContact OG-OE2 2.9Å
212	G	69.1	Low	82.2	Confident	8 Å²	8	30.8 Å²	30.8	8%	0.082	17%	0.167	C	C	.	.			trans	-157	176.3	-173.1	0	0	0	0	0	116.5	K270	G212-K270 WeakPolarHBondContact O-CD 3.49Å; G212-K270 PolarHBondContact O-NZ 3.36Å
213	Q	65	Low	83.1	Confident	124 Å²	124	27.3 Å²	27.3	58%	0.579	15%	0.146	S	C	*	.	S	Bend	trans	-103	133.5	139	-100.6	166.7	-29	0	0	105.8	S215 E668	Q213-S215 PolarHBondContact O-N 2.87Å; Q213-E668 WeakPolarHBondContact CA-OE1 3.22Å
214	N	67.3	Low	83.5	Confident	98 Å²	98	28.8 Å²	28.8	52%	0.524	15%	0.154	S	C	.	.	S	Bend	trans	59.2	23.7	-176.2	-58.1	-17	0	0	0	115	E668	N214-E668 PolarHBondContact N-OE1 3Å
215	S	77.8	Confident	83.6	Confident	13 Å²	13	27.7 Å²	27.7	9%	0.091	14%	0.144	C	C	.	.			trans	-93	143.6	168.9	176.4	0	0	0	0	110.9	Q213 V217 Y243 E291	Q213-S215 PolarHBondContact O-N 2.87Å; S215-V217 PolarHBondContact O-N 3.32Å; S215-V217 WeakPolarHBondContact OG-CB 3.33Å; S215-V217 PolarHBondContact OG-N 3.34Å; S215-Y243 WeakPolarHBondContact O-CE1 3.46Å; S215-E291 VanDerWaalsContact CB-OE2 3.27Å; S215-E291 WeakPolarHBondContact CB-OE2 3.22Å; S215-E291 PolarHBondContact OG-OE2 3.34Å
216	S	84.3	Confident	83.6	Confident	34 Å²	34	26.6 Å²	26.6	24%	0.238	14%	0.139	C	C	.	.			trans	-82.6	4.4	171.5	65.4	0	0	0	0	114.2	T241 D242 Y243	S216-T241 VanDerWaalsContact CB-O 3.31Å; S216-T241 WeakPolarHBondContact CB-O 3.34Å; S216-T241 CarbonylContact O-C 3.57Å; S216-T241 PolarHBondContact OG-O 2.87Å; S216-D242 PolarHBondContact O-N 2.84Å; S216-Y243 WeakPolarHBondContact O-CA 3.41Å; S216-Y243 PolarHBondContact O-N 3.11Å
217	V	89.1	Confident	83.3	Confident	8 Å²	8	31 Å²	31	5%	0.048	16%	0.163	C	C	.	.			trans	-100	126.8	-170.6	175.1	0	0	0	0	112.2	S211 S215 R239 S240 T241 E291	S211-V217 PolarHBondContact N-O 3.09Å; S211-V217 VanDerWaalsContact OG-CB 3.24Å; S211-V217 WeakPolarHBondContact OG-CB 3.19Å; S211-V217 WeakPolarHBondContact OG-CG1 3.34Å; S211-V217 PolarHBondContact OG-O 2.81Å; S215-V217 PolarHBondContact O-N 3.32Å; S215-V217 WeakPolarHBondContact OG-CB 3.33Å; S215-V217 PolarHBondContact OG-N 3.34Å; V217-R239 HydrophobicContact CG1-CG 4.25Å; V217-S240 WeakPolarHBondContact CA-O 3.45Å; V217-S240 WeakPolarHBondContact CG1-O 3.28Å; V217-T241 HydrophobicContact CG2-CG2 4.17Å; V217-E291 HydrophobicContact CB-CB 4.47Å; V217-E291 HydrophobicContact CG1-CB 4.21Å; V217-E291 WeakPolarHBondContact CG1-O 3.4Å; V217-E291 HydrophobicContact CG2-CB 4.46Å
218	I	89.4	Confident	83.1	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.4	173.4	-55.5	172.9	0	0	0	108.1	V208 W210 I220 R239 S240 Y247 L666	V208-I218 HydrophobicContact CG1-CG2 4.26Å; W210-I218 HydrophobicContact CD2-CD1 4.43Å; W210-I218 HydrophobicContact CD2-CG1 3.87Å; W210-I218 HydrophobicContact CE3-CD1 4.25Å; W210-I218 HydrophobicContact CE3-CG1 3.52Å; W210-I218 HydrophobicContact CH2-CD1 3.56Å; W210-I218 HydrophobicContact CH2-CG1 3.76Å; W210-I218 HydrophobicContact CZ2-CD1 3.74Å; W210-I218 HydrophobicContact CZ2-CG1 4.09Å; W210-I218 HydrophobicContact CZ3-CD1 3.83Å; W210-I218 HydrophobicContact CZ3-CG1 3.47Å; W210-I218 VanDerWaalsContact CZ3-CG1 3.47Å; I218-I220 HydrophobicContact CG2-CG1 4.4Å; I218-R239 WeakPolarHBondContact O-CA 3.25Å; I218-S240 PolarHBondContact N-O 2.83Å; I218-S240 PolarHBondContact O-N 3.04Å; I218-Y247 HydrophobicContact CB-CE1 4.08Å; I218-Y247 WeakPolarHBondContact CD1-OH 3.48Å; I218-Y247 HydrophobicContact CG2-CE1 4.02Å; I218-L666 HydrophobicContact CD1-CD2 4.38Å; I218-L666 HydrophobicContact CG2-CD2 4.2Å
219	L	90.9	Very high	82.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138	174.1	-66.7	164.4	0	0	0	110	H209 W238 R239 L263 I273	H209-L219 PolarHBondContact N-O 3.44Å; H209-L219 PolarHBondContact O-N 3.28Å; L219-W238 WeakPolarHBondContact CA-O 3.27Å; L219-R239 HydrophobicContact CD2-CB 3.8Å; L219-R239 HydrophobicContact CD2-CG 3.72Å; L219-L263 HydrophobicContact CB-CD1 4.03Å; L219-I273 HydrophobicContact CD1-CB 4.47Å; L219-I273 HydrophobicContact CD1-CD1 3.64Å; L219-I273 HydrophobicContact CD1-CG1 3.71Å; L219-I273 HydrophobicContact CD1-CG2 4.27Å
220	I	91.1	Very high	82	Confident	3 Å²	3	39 Å²	39	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.7	175.5	-53.1	171.2	0	0	0	108.8	L197 M207 V208 I218 T222 W238 Y247 L690	L197-I220 HydrophobicContact CD1-CD1 4.2Å; L197-I220 HydrophobicContact CD1-CG2 4.28Å; M207-I220 CarbonylContact O-C 3.43Å; M207-I220 VanDerWaalsContact O-CA 3.3Å; M207-I220 WeakPolarHBondContact O-CA 3.23Å; V208-I220 HydrophobicContact CG1-CG1 4.2Å; V208-I220 HydrophobicContact CG2-CG1 4.28Å; V208-I220 HydrophobicContact CG2-CG2 4.16Å; I218-I220 HydrophobicContact CG2-CG1 4.4Å; I220-T222 HydrophobicContact CG2-CG2 4.17Å; I220-W238 HydrophobicContact CB-CB 4.22Å; I220-W238 PolarHBondContact N-O 2.75Å; I220-W238 PolarHBondContact O-N 3.43Å; I220-Y247 HydrophobicContact CD1-CD1 3.84Å; I220-Y247 HydrophobicContact CD1-CE1 3.42Å; I220-Y247 VanDerWaalsContact CD1-CE1 3.42Å; I220-Y247 HydrophobicContact CG1-CD1 4.45Å; I220-Y247 HydrophobicContact CG1-CE1 4Å; I220-L690 HydrophobicContact CD1-CD1 3.95Å; I220-L690 HydrophobicContact CD1-CD2 3.51Å; I220-L690 HydrophobicContact CD1-CG 4.39Å
221	L	90.5	Very high	81.9	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	107.4	166.5	172	61.5	0	0	0	108.3	A206 M207 L260 L263	A206-L221 CarbonylContact C-O 3.55Å; A206-L221 WeakPolarHBondContact CA-O 3.35Å; M207-L221 HydrophobicContact CB-CB 4.4Å; M207-L221 PolarHBondContact N-O 2.86Å; M207-L221 PolarHBondContact O-N 2.77Å; M207-L221 HydrophobicContact SD-CD2 4.35Å; L221-L260 HydrophobicContact CD1-CB 3.79Å; L221-L260 HydrophobicContact CD1-CD1 4.18Å; L221-L260 HydrophobicContact CD2-CB 4.25Å; L221-L263 HydrophobicContact CB-CB 4.25Å; L221-L263 HydrophobicContact CB-CD1 4.05Å; L221-L263 HydrophobicContact CD2-CB 4.07Å
222	T	89.9	Confident	82.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	141.9	166.3	54	0	0	0	0	109	L197 D200 L205 A206 I220 S235 S236	L197-T222 HydrophobicContact CD1-CG2 4Å; D200-T222 WeakPolarHBondContact OD2-CB 3.23Å; D200-T222 WeakPolarHBondContact OD2-CG2 3.23Å; D200-T222 PolarHBondContact OD2-OG1 2.94Å; L205-T222 WeakPolarHBondContact O-CA 3.21Å; A206-T222 HydrophobicContact CB-CG2 4.35Å; I220-T222 HydrophobicContact CG2-CG2 4.17Å; T222-S235 CarbonylContact O-C 3.55Å; T222-S235 VanDerWaalsContact O-CA 3.24Å; T222-S235 WeakPolarHBondContact O-CA 3.5Å; T222-S236 PolarHBondContact N-O 2.82Å; T222-S236 PolarHBondContact O-N 3.33Å; T222-S236 WeakPolarHBondContact OG1-CB 3.36Å; T222-S236 PolarHBondContact OG1-O 3.07Å; T222-S236 VanDerWaalsContact OG1-O 3.09Å
223	K	87.9	Confident	82.9	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.8	178.2	64	-177.7	178.5	174.1	0	112.3	N204 L205 V232 E234 S261 E1223	N204-K223 PolarHBondContact N-O 3.47Å; N204-K223 VanDerWaalsContact N-O 3.15Å; N204-K223 PolarHBondContact OD1-O 2.81Å; L205-K223 HydrophobicContact CB-CG 3.89Å; L205-K223 PolarHBondContact N-O 3.08Å; L205-K223 PolarHBondContact O-N 3.48Å; K223-V232 HydrophobicContact CB-CG1 3.82Å; K223-V232 HydrophobicContact CB-CG2 4.48Å; K223-V232 HydrophobicContact CD-CG2 3.99Å; K223-E234 WeakPolarHBondContact CA-O 3.3Å; K223-S261 PolarHBondContact NZ-O 3.35Å; K223-E1223 IonicContact NZ-OE1 3.49Å; K223-E1223 PolarHBondContact NZ-OE1 2.91Å
224	L	87.1	Confident	83.9	Confident	44 Å²	44	40 Å²	40	23%	0.23	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	101.1	168.3	175.3	50	0	0	0	108.1	T202 N204 V232 T233 E234	T202-L224 WeakPolarHBondContact O-CD1 3.47Å; N204-L224 HydrophobicContact CB-CD1 4.42Å; L224-V232 WeakPolarHBondContact O-CA 3.4Å; L224-T233 WeakPolarHBondContact CG-OG1 3.44Å; L224-T233 PolarHBondContact O-N 2.88Å; L224-T233 PolarHBondContact O-OG1 2.91Å; L224-E234 HydrophobicContact CB-CB 4.12Å; L224-E234 PolarHBondContact N-O 2.99Å
225	Y	83.9	Confident	85	Confident	55 Å²	55	35.9 Å²	35.9	22%	0.216	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.5	176.8	-175.3	-102.5	0	0	0	110.6	N204 L205 V227 G230 T231 V232	N204-Y225 PolarHBondContact ND2-O 2.64Å; N204-Y225 PolarHBondContact OD1-N 2.8Å; L205-Y225 HydrophobicContact CD1-CG 4.39Å; Y225-V227 HydrophobicContact CD1-CG2 4.07Å; Y225-V227 HydrophobicContact CE1-CG2 4.26Å; Y225-G230 VanDerWaalsContact CE2-C 3.46Å; Y225-G230 WeakPolarHBondContact CE2-O 3.49Å; Y225-G230 WeakPolarHBondContact OH-CA 3.31Å; Y225-G230 PolarHBondContact OH-O 2.91Å; Y225-T231 WeakPolarHBondContact CD2-O 3.1Å; Y225-V232 HydrophobicContact CD2-CG2 4.17Å
226	D	83.7	Confident	85.5	Confident	49 Å²	49	35.5 Å²	35.5	26%	0.262	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.8	174.1	-171.3	-45.1	0	0	0	109.4	T228 M229 G230 T231 T233	D226-T228 PolarHBondContact O-N 2.84Å; D226-T228 WeakPolarHBondContact OD1-CA 3.47Å; D226-T228 WeakPolarHBondContact OD1-CB 3.07Å; D226-T228 PolarHBondContact OD1-N 3.09Å; D226-T228 PolarHBondContact OD1-OG1 3.34Å; D226-M229 HydrophobicContact CB-CB 4.22Å; D226-M229 HydrophobicContact CB-CE 3.92Å; D226-M229 PolarHBondContact O-N 2.9Å; D226-M229 PolarHBondContact OD1-N 3.26Å; D226-G230 WeakPolarHBondContact O-CA 3.32Å; D226-G230 PolarHBondContact O-N 3.05Å; D226-T231 PolarHBondContact N-O 2.9Å; D226-T231 PolarHBondContact O-N 3.39Å; D226-T233 HydrophobicContact CB-CG2 4.31Å
227	V	79.5	Confident	85.8	Confident	110 Å²	110	33.9 Å²	33.9	67%	0.667	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.9	-178.3	-176.9	0	0	0	0	112.5	Y225	Y225-V227 HydrophobicContact CD1-CG2 4.07Å; Y225-V227 HydrophobicContact CE1-CG2 4.26Å
228	T	82.3	Confident	85.8	Confident	129 Å²	129	34.1 Å²	34.1	79%	0.791	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-37.3	178.7	74.5	0	0	0	0	112.1	D226	D226-T228 PolarHBondContact O-N 2.84Å; D226-T228 WeakPolarHBondContact OD1-CA 3.47Å; D226-T228 WeakPolarHBondContact OD1-CB 3.07Å; D226-T228 PolarHBondContact OD1-N 3.09Å; D226-T228 PolarHBondContact OD1-OG1 3.34Å
229	M	71.8	Confident	85.9	Confident	91 Å²	91	35.9 Å²	35.9	45%	0.448	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-26.3	175	-61.8	-163.6	-69.5	0	0	112.4	D226 T231 T233 R1218	D226-M229 HydrophobicContact CB-CB 4.22Å; D226-M229 HydrophobicContact CB-CE 3.92Å; D226-M229 PolarHBondContact O-N 2.9Å; D226-M229 PolarHBondContact OD1-N 3.26Å; M229-T231 WeakPolarHBondContact CB-OG1 3.39Å; M229-T233 HydrophobicContact CE-CG2 3.44Å; M229-T233 VanDerWaalsContact CE-CG2 3.44Å; M229-R1218 PolarHBondContact O-NH1 3.33Å
230	G	78.6	Confident	86	Confident	28 Å²	28	36 Å²	36	29%	0.289	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	16.9	-177.2	0	0	0	0	0	114.3	Y225 D226	Y225-G230 VanDerWaalsContact CE2-C 3.46Å; Y225-G230 WeakPolarHBondContact CE2-O 3.49Å; Y225-G230 WeakPolarHBondContact OH-CA 3.31Å; Y225-G230 PolarHBondContact OH-O 2.91Å; D226-G230 WeakPolarHBondContact O-CA 3.32Å; D226-G230 PolarHBondContact O-N 3.05Å
231	T	82.5	Confident	86	Confident	21 Å²	21	39.4 Å²	39.4	13%	0.129	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	165.3	-168.4	56.8	0	0	0	0	111.8	Y225 D226 M229 E280	Y225-T231 WeakPolarHBondContact CD2-O 3.1Å; D226-T231 PolarHBondContact N-O 2.9Å; D226-T231 PolarHBondContact O-N 3.39Å; M229-T231 WeakPolarHBondContact CB-OG1 3.39Å; T231-E280 HydrophobicContact CG2-CB 4.43Å; T231-E280 HydrophobicContact CG2-CG 3.83Å
232	V	85	Confident	85.9	Confident	7 Å²	7	41.6 Å²	41.6	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.7	168.8	-174.7	0	0	0	0	109.4	K223 L224 Y225 E234 V259 D278	K223-V232 HydrophobicContact CB-CG1 3.82Å; K223-V232 HydrophobicContact CB-CG2 4.48Å; K223-V232 HydrophobicContact CD-CG2 3.99Å; L224-V232 WeakPolarHBondContact O-CA 3.4Å; Y225-V232 HydrophobicContact CD2-CG2 4.17Å; V232-E234 VanDerWaalsContact CG1-O 3.23Å; V232-E234 WeakPolarHBondContact CG1-O 3.18Å; V232-V259 HydrophobicContact CB-CG1 3.86Å; V232-V259 HydrophobicContact CG1-CG1 3.47Å; V232-V259 VanDerWaalsContact CG1-CG1 3.47Å; V232-D278 HydrophobicContact CB-CB 4.49Å; V232-D278 PolarHBondContact N-OD2 3.1Å
233	T	84.1	Confident	85.6	Confident	54 Å²	54	44.8 Å²	44.8	33%	0.331	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-38.6	178.5	55.5	0	0	0	0	112.7	L224 D226 M229	L224-T233 WeakPolarHBondContact CG-OG1 3.44Å; L224-T233 PolarHBondContact O-N 2.88Å; L224-T233 PolarHBondContact O-OG1 2.91Å; D226-T233 HydrophobicContact CB-CG2 4.31Å; M229-T233 HydrophobicContact CE-CG2 3.44Å; M229-T233 VanDerWaalsContact CE-CG2 3.44Å
234	E	86.2	Confident	85.5	Confident	94 Å²	94	44.7 Å²	44.7	44%	0.439	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	148.5	177.3	-60.7	-172.2	151.7	0	0	110.5	T202 K223 L224 V232	T202-E234 PolarHBondContact OG1-OE2 3.5Å; K223-E234 WeakPolarHBondContact CA-O 3.3Å; L224-E234 HydrophobicContact CB-CB 4.12Å; L224-E234 PolarHBondContact N-O 2.99Å; V232-E234 VanDerWaalsContact CG1-O 3.23Å; V232-E234 WeakPolarHBondContact CG1-O 3.18Å
235	S	88.9	Confident	85.5	Confident	11 Å²	11	44.8 Å²	44.8	8%	0.077	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	142.1	179.6	64.6	0	0	0	0	111.8	T222 N251 L260	T222-S235 CarbonylContact O-C 3.55Å; T222-S235 VanDerWaalsContact O-CA 3.24Å; T222-S235 WeakPolarHBondContact O-CA 3.5Å; S235-N251 PolarHBondContact O-ND2 2.99Å; S235-L260 WeakPolarHBondContact CB-O 3.36Å; S235-L260 PolarHBondContact OG-N 2.86Å
236	S	88.6	Confident	85.9	Confident	5 Å²	5	45.6 Å²	45.6	4%	0.035	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.9	174	-58.5	0	0	0	0	113	D200 H203 T222 K249 N251	D200-S236 WeakPolarHBondContact OD1-CB 3.13Å; D200-S236 PolarHBondContact OD1-OG 2.75Å; D200-S236 WeakPolarHBondContact OD2-CB 3.21Å; H203-S236 PolarHBondContact CE1-OG 3.11Å; H203-S236 PolarHBondContact NE2-OG 3.48Å; T222-S236 PolarHBondContact N-O 2.82Å; T222-S236 PolarHBondContact O-N 3.33Å; T222-S236 WeakPolarHBondContact OG1-CB 3.36Å; T222-S236 PolarHBondContact OG1-O 3.07Å; T222-S236 VanDerWaalsContact OG1-O 3.09Å; S236-K249 WeakPolarHBondContact OG-CE 3.38Å; S236-K249 PolarHBondContact OG-NZ 3.3Å; S236-N251 WeakPolarHBondContact CA-OD1 3.49Å
237	L	90.3	Very high	86.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.1	175.1	178.5	65.9	0	0	0	110.1	L250 N251 I255 L260 L263 M275 F295	L237-L250 HydrophobicContact CB-CB 4.47Å; L237-L250 HydrophobicContact CD2-CB 4.13Å; L237-L250 HydrophobicContact CD2-CD1 3.88Å; L237-L250 HydrophobicContact CG-CB 4.26Å; L237-L250 HydrophobicContact CG-CD1 4.19Å; L237-L250 PolarHBondContact O-N 2.87Å; L237-N251 PolarHBondContact N-OD1 3.14Å; L237-I255 HydrophobicContact CD2-CD1 3.65Å; L237-L260 HydrophobicContact CB-CD1 4.36Å; L237-L263 HydrophobicContact CD1-CD1 4.24Å; L237-M275 HydrophobicContact CD1-CE 3.43Å; L237-M275 VanDerWaalsContact CD1-CE 3.43Å; L237-M275 HydrophobicContact CD1-SD 4.16Å; L237-M275 HydrophobicContact CD2-CE 3.67Å; L237-M275 HydrophobicContact CD2-SD 3.88Å; L237-M275 HydrophobicContact CG-CE 4.21Å; L237-F295 HydrophobicContact CD2-CE2 3.81Å; L237-F295 HydrophobicContact CD2-CZ 4.13Å
238	W	90.3	Very high	86.7	Confident	13 Å²	13	41.8 Å²	41.8	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.4	176.3	-60	83	0	0	0	111.4	L197 S198 D200 L219 I220 Y247 T248 K249	L197-W238 HydrophobicContact CB-CD2 4.49Å; L197-W238 HydrophobicContact CB-CH2 4.19Å; L197-W238 HydrophobicContact CB-CZ2 3.79Å; L197-W238 HydrophobicContact CD1-CD2 4.48Å; L197-W238 HydrophobicContact CD1-CG 4.33Å; L197-W238 HydrophobicContact CD2-CD2 3.83Å; L197-W238 HydrophobicContact CD2-CE3 3.89Å; L197-W238 HydrophobicContact CD2-CG 4.18Å; L197-W238 HydrophobicContact CD2-CZ3 4.28Å; L197-W238 HydrophobicContact CG-CD2 4.49Å; S198-W238 WeakPolarHBondContact O-CH2 3.3Å; D200-W238 HydrophobicContact CB-CZ2 4.21Å; D200-W238 PolarHBondContact OD2-NE1 3.17Å; L219-W238 WeakPolarHBondContact CA-O 3.27Å; I220-W238 HydrophobicContact CB-CB 4.22Å; I220-W238 PolarHBondContact N-O 2.75Å; I220-W238 PolarHBondContact O-N 3.43Å; W238-Y247 HydrophobicContact CB-CD1 4.48Å; W238-T248 CarbonylContact C-O 3.54Å; W238-T248 WeakPolarHBondContact CA-O 3.12Å; W238-K249 HydrophobicContact CD2-CB 4.07Å; W238-K249 HydrophobicContact CD2-CG 4.41Å; W238-K249 HydrophobicContact CE3-CB 3.83Å; W238-K249 HydrophobicContact CH2-CB 4.05Å; W238-K249 HydrophobicContact CH2-CD 4.1Å; W238-K249 HydrophobicContact CZ2-CB 4.26Å; W238-K249 HydrophobicContact CZ2-CD 3.76Å; W238-K249 HydrophobicContact CZ2-CG 4.31Å; W238-K249 HydrophobicContact CZ3-CB 3.83Å
239	R	91.9	Very high	87	Confident	37 Å²	37	38.4 Å²	38.4	14%	0.14	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	127.7	178.1	-175.5	173.8	-172.8	-104	5.4	112	V217 I218 L219 T241 T248 L250 D290 E291 G292	V217-R239 HydrophobicContact CG1-CG 4.25Å; I218-R239 WeakPolarHBondContact O-CA 3.25Å; L219-R239 HydrophobicContact CD2-CB 3.8Å; L219-R239 HydrophobicContact CD2-CG 3.72Å; R239-T241 VanDerWaalsContact NH1-CG2 3.27Å; R239-T248 PolarHBondContact N-O 3.49Å; R239-T248 PolarHBondContact O-N 2.95Å; R239-T248 PolarHBondContact O-OG1 3.42Å; R239-L250 HydrophobicContact CB-CD1 3.7Å; R239-L250 HydrophobicContact CB-CG 4.15Å; R239-D290 PolarHBondContact NH2-O 3.49Å; R239-E291 VanDerWaalsContact CZ-O 3.25Å; R239-E291 PolarHBondContact NE-O 2.82Å; R239-E291 PolarHBondContact NH2-O 2.86Å; R239-G292 WeakPolarHBondContact CD-O 3.46Å; R239-G292 PolarHBondContact NE-O 2.8Å
240	S	91.7	Very high	87.6	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	154.6	164.7	168.7	0	0	0	0	110	V217 I218 D242 G244 T246	V217-S240 WeakPolarHBondContact CA-O 3.45Å; V217-S240 WeakPolarHBondContact CG1-O 3.28Å; I218-S240 PolarHBondContact N-O 2.83Å; I218-S240 PolarHBondContact O-N 3.04Å; S240-D242 PolarHBondContact OG-N 2.82Å; S240-D242 PolarHBondContact OG-OD1 2.83Å; S240-G244 VanDerWaalsContact OG-CA 3.32Å; S240-G244 WeakPolarHBondContact OG-CA 3.48Å; S240-G244 PolarHBondContact OG-N 3.1Å; S240-T246 VanDerWaalsContact CA-O 3.26Å; S240-T246 WeakPolarHBondContact CA-O 3.39Å; S240-T246 WeakPolarHBondContact CB-O 3.31Å; S240-T246 PolarHBondContact OG-O 2.81Å; S240-T246 VanDerWaalsContact OG-O 3.08Å
241	T	90.8	Very high	87.4	Confident	75 Å²	75	34.8 Å²	34.8	46%	0.46	19%	0.188	S	C	.	.	S	Bend	trans	-128.8	14	170	66	0	0	0	0	112.7	S216 V217 R239	S216-T241 VanDerWaalsContact CB-O 3.31Å; S216-T241 WeakPolarHBondContact CB-O 3.34Å; S216-T241 CarbonylContact O-C 3.57Å; S216-T241 PolarHBondContact OG-O 2.87Å; V217-T241 HydrophobicContact CG2-CG2 4.17Å; R239-T241 VanDerWaalsContact NH1-CG2 3.27Å
242	D	88.8	Confident	86.6	Confident	46 Å²	46	40.2 Å²	40.2	25%	0.246	22%	0.216	C	C	.	.	S	Bend	trans	-133	32.3	-170	63.9	2.8	0	0	0	112.4	S216 S240 G244 S245 T246 K692	S216-D242 PolarHBondContact O-N 2.84Å; S240-D242 PolarHBondContact OG-N 2.82Å; S240-D242 PolarHBondContact OG-OD1 2.83Å; D242-G244 VanDerWaalsContact C-N 3.27Å; D242-G244 PolarHBondContact O-N 3.49Å; D242-G244 PolarHBondContact OD1-N 3.04Å; D242-S245 PolarHBondContact OD1-N 3.19Å; D242-S245 WeakPolarHBondContact OD2-CB 3.36Å; D242-T246 VanDerWaalsContact CG-N 3.29Å; D242-T246 PolarHBondContact OD1-N 2.77Å; D242-T246 WeakPolarHBondContact OD2-CB 3.46Å; D242-T246 PolarHBondContact OD2-N 2.85Å; D242-T246 PolarHBondContact OD2-OG1 2.95Å; D242-K692 PolarHBondContact O-NZ 2.99Å
243	Y	84.1	Confident	85.4	Confident	68 Å²	68	47.8 Å²	47.8	27%	0.267	25%	0.248	S	C	.	.	S	Bend	trans	58	35	-174.7	-52.9	-92	0	0	0	113.1	W210 S215 S216 I675 K692	W210-Y243 AromaticContact CH2-CD1 3.84Å; W210-Y243 HydrophobicContact CH2-CD1 3.84Å; W210-Y243 HydrophobicContact CH2-CG 4.45Å; W210-Y243 AromaticContact CZ3-CD1 3.74Å; W210-Y243 HydrophobicContact CZ3-CD1 3.74Å; W210-Y243 HydrophobicContact CZ3-CG 4.49Å; S215-Y243 WeakPolarHBondContact O-CE1 3.46Å; S216-Y243 WeakPolarHBondContact O-CA 3.41Å; S216-Y243 PolarHBondContact O-N 3.11Å; Y243-I675 VanDerWaalsContact CB-CD1 3.44Å; Y243-I675 HydrophobicContact CD1-CD1 3.83Å; Y243-I675 HydrophobicContact CD2-CD1 4.29Å; Y243-I675 HydrophobicContact CG-CD1 3.62Å; Y243-K692 WeakPolarHBondContact O-CD 3.45Å; Y243-K692 WeakPolarHBondContact O-CE 3.12Å; Y243-K692 PolarHBondContact O-NZ 2.86Å
244	G	86.6	Confident	84.2	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.01	25%	0.247	C	C	.	.	S	Bend	trans	81.6	23.9	176.4	0	0	0	0	0	115.8	S240 D242 Y247	S240-G244 VanDerWaalsContact OG-CA 3.32Å; S240-G244 WeakPolarHBondContact OG-CA 3.48Å; S240-G244 PolarHBondContact OG-N 3.1Å; D242-G244 VanDerWaalsContact C-N 3.27Å; D242-G244 PolarHBondContact O-N 3.49Å; D242-G244 PolarHBondContact OD1-N 3.04Å; G244-Y247 WeakPolarHBondContact CA-OH 3.45Å
245	S	87.1	Confident	83.1	Confident	45 Å²	45	43.4 Å²	43.4	32%	0.315	23%	0.227	S	C	.	.	S	Bend	trans	-82.2	-30.7	170.5	-81.8	0	0	0	0	112.4	F195 D242 K692	F195-S245 WeakPolarHBondContact CD2-O 3.33Å; D242-S245 PolarHBondContact OD1-N 3.19Å; D242-S245 WeakPolarHBondContact OD2-CB 3.36Å; S245-K692 WeakPolarHBondContact OG-CD 3.47Å; S245-K692 PolarHBondContact OG-NZ 3.29Å
246	T	90.9	Very high	81.8	Confident	72 Å²	72	46.7 Å²	46.7	44%	0.442	25%	0.25	S	S	.	.	S	Bend	trans	-138.6	143.2	171.3	64	0	0	0	0	111	F195 S240 D242	F195-T246 HydrophobicContact CE2-CG2 4.38Å; S240-T246 VanDerWaalsContact CA-O 3.26Å; S240-T246 WeakPolarHBondContact CA-O 3.39Å; S240-T246 WeakPolarHBondContact CB-O 3.31Å; S240-T246 PolarHBondContact OG-O 2.81Å; S240-T246 VanDerWaalsContact OG-O 3.08Å; D242-T246 VanDerWaalsContact CG-N 3.29Å; D242-T246 PolarHBondContact OD1-N 2.77Å; D242-T246 WeakPolarHBondContact OD2-CB 3.46Å; D242-T246 PolarHBondContact OD2-N 2.85Å; D242-T246 PolarHBondContact OD2-OG1 2.95Å
247	Y	90.4	Very high	80.8	Confident	10 Å²	10	58.2 Å²	58.2	4%	0.039	29%	0.293	C	S	.	.			trans	-121.4	144	175.4	-67.3	-97	0	0	0	111	F195 L197 I218 I220 W238 G244 L690	F195-Y247 HydrophobicContact CB-CD2 4.41Å; F195-Y247 AromaticContact CD1-CD2 3.66Å; F195-Y247 HydrophobicContact CD1-CD2 3.66Å; F195-Y247 HydrophobicContact CD1-CG 4.34Å; F195-Y247 HydrophobicContact CE1-CD2 4.09Å; F195-Y247 HydrophobicContact CE1-CG 4.37Å; F195-Y247 AromaticContact CG-CD2 4Å; F195-Y247 HydrophobicContact CG-CD2 4Å; F195-Y247 WeakPolarHBondContact CZ-O 3.49Å; L197-Y247 HydrophobicContact CD2-CD2 4.46Å; L197-Y247 HydrophobicContact CD2-CG 4.19Å; I218-Y247 HydrophobicContact CB-CE1 4.08Å; I218-Y247 WeakPolarHBondContact CD1-OH 3.48Å; I218-Y247 HydrophobicContact CG2-CE1 4.02Å; I220-Y247 HydrophobicContact CD1-CD1 3.84Å; I220-Y247 HydrophobicContact CD1-CE1 3.42Å; I220-Y247 VanDerWaalsContact CD1-CE1 3.42Å; I220-Y247 HydrophobicContact CG1-CD1 4.45Å; I220-Y247 HydrophobicContact CG1-CE1 4Å; W238-Y247 HydrophobicContact CB-CD1 4.48Å; G244-Y247 WeakPolarHBondContact CA-OH 3.45Å; Y247-L690 HydrophobicContact CE2-CB 4.47Å; Y247-L690 HydrophobicContact CE2-CD1 4.43Å; Y247-L690 HydrophobicContact CE2-CD2 4.29Å
248	T	90.4	Very high	80.2	Confident	70 Å²	70	59.1 Å²	59.1	43%	0.429	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.7	177.9	59.4	0	0	0	0	110.3	W238 R239	W238-T248 CarbonylContact C-O 3.54Å; W238-T248 WeakPolarHBondContact CA-O 3.12Å; R239-T248 PolarHBondContact N-O 3.49Å; R239-T248 PolarHBondContact O-N 2.95Å; R239-T248 PolarHBondContact O-OG1 3.42Å
249	K	88.7	Confident	80	Confident	58 Å²	58	59.5 Å²	59.5	25%	0.252	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	130.5	174.8	-168.9	163	176.9	156.7	0	109.7	D200 S236 W238	D200-K249 IonicContact OD1-NZ 2.69Å; D200-K249 PolarHBondContact OD1-NZ 3.05Å; S236-K249 WeakPolarHBondContact OG-CE 3.38Å; S236-K249 PolarHBondContact OG-NZ 3.3Å; W238-K249 HydrophobicContact CD2-CB 4.07Å; W238-K249 HydrophobicContact CD2-CG 4.41Å; W238-K249 HydrophobicContact CE3-CB 3.83Å; W238-K249 HydrophobicContact CH2-CB 4.05Å; W238-K249 HydrophobicContact CH2-CD 4.1Å; W238-K249 HydrophobicContact CZ2-CB 4.26Å; W238-K249 HydrophobicContact CZ2-CD 3.76Å; W238-K249 HydrophobicContact CZ2-CG 4.31Å; W238-K249 HydrophobicContact CZ3-CB 3.83Å
250	L	84.5	Confident	79.9	Confident	14 Å²	14	57.8 Å²	57.8	7%	0.073	30%	0.296	C	S	.	.			trans	-104.3	-14.7	-171.5	-65.6	-173.7	0	0	0	114.7	L237 R239 D252 K253 V254	L237-L250 HydrophobicContact CB-CB 4.47Å; L237-L250 HydrophobicContact CD2-CB 4.13Å; L237-L250 HydrophobicContact CD2-CD1 3.88Å; L237-L250 HydrophobicContact CG-CB 4.26Å; L237-L250 HydrophobicContact CG-CD1 4.19Å; L237-L250 PolarHBondContact O-N 2.87Å; R239-L250 HydrophobicContact CB-CD1 3.7Å; R239-L250 HydrophobicContact CB-CG 4.15Å; L250-D252 VanDerWaalsContact C-N 3.32Å; L250-D252 PolarHBondContact O-N 3.11Å; L250-K253 PolarHBondContact O-N 3.24Å; L250-V254 PolarHBondContact O-N 2.88Å
251	N	74.1	Confident	79.7	Confident	29 Å²	29	58.1 Å²	58.1	16%	0.155	30%	0.298	C	S	.	.	H	α-helix	trans	-46.6	-52.3	-179	-69.1	35	0	0	0	112.5	S235 S236 L237 K253 I255 S256	S235-N251 PolarHBondContact O-ND2 2.99Å; S236-N251 WeakPolarHBondContact CA-OD1 3.49Å; L237-N251 PolarHBondContact N-OD1 3.14Å; N251-K253 PolarHBondContact O-N 3.45Å; N251-I255 CarbonylContact O-C 3.57Å; N251-I255 PolarHBondContact O-N 3.49Å; N251-S256 PolarHBondContact O-N 2.9Å; N251-S256 PolarHBondContact O-OG 3.19Å
252	D	65.1	Low	79.6	Confident	134 Å²	134	57.7 Å²	57.7	72%	0.717	29%	0.289	S	S	*	.	H	α-helix	trans	-75.1	-8	-173.1	-52.5	-51.2	0	0	0	114.2	L250	L250-D252 VanDerWaalsContact C-N 3.32Å; L250-D252 PolarHBondContact O-N 3.11Å
253	K	60.8	Low	79.7	Confident	166 Å²	166	55.8 Å²	55.8	72%	0.722	28%	0.279	S	S	*	.	H	α-helix	trans	-111	-28.7	-176.9	-67.8	-177.7	-179.6	176	0	114.1	L250 N251	L250-K253 PolarHBondContact O-N 3.24Å; N251-K253 PolarHBondContact O-N 3.45Å
254	V	58.5	Low	80	Confident	53 Å²	53	55 Å²	55	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-137.6	-31.2	-170.1	-165.7	0	0	0	0	113.4	L250 F295	L250-V254 PolarHBondContact O-N 2.88Å; V254-F295 HydrophobicContact CG1-CB 3.95Å; V254-F295 HydrophobicContact CG1-CD2 4.1Å
255	I	63.3	Low	80.1	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.021	28%	0.283	C	S	.	.			trans	-129.4	57.4	-169.1	-49.1	-175.4	0	0	0	109.8	L237 N251 R257 T258 L260 M275 F286 F295	L237-I255 HydrophobicContact CD2-CD1 3.65Å; N251-I255 CarbonylContact O-C 3.57Å; N251-I255 PolarHBondContact O-N 3.49Å; I255-R257 PolarHBondContact O-N 3.44Å; I255-T258 WeakPolarHBondContact CG2-OG1 3.33Å; I255-L260 HydrophobicContact CD1-CD1 3.97Å; I255-L260 HydrophobicContact CG2-CD1 4.25Å; I255-L260 HydrophobicContact CG2-CD2 4.28Å; I255-L260 HydrophobicContact CG2-CG 4.3Å; I255-M275 HydrophobicContact CD1-SD 4.4Å; I255-F286 HydrophobicContact CG2-CE1 4.15Å; I255-F286 HydrophobicContact CG2-CZ 4.26Å; I255-F295 HydrophobicContact CD1-CD2 4.24Å; I255-F295 HydrophobicContact CD1-CG 4.4Å
256	S	60.7	Low	80.3	Confident	80 Å²	80	54.2 Å²	54.2	56%	0.559	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	123.5	-178.4	-50.8	0	0	0	0	111.7	N251 T258	N251-S256 PolarHBondContact O-N 2.9Å; N251-S256 PolarHBondContact O-OG 3.19Å; S256-T258 PolarHBondContact O-N 2.87Å
257	R	67.3	Low	80.2	Confident	246 Å²	246	53.5 Å²	53.5	93%	0.928	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	7.3	172.8	-52.8	-179.1	174.2	-179.2	-2.5	118.2	I255	I255-R257 PolarHBondContact O-N 3.44Å
258	T	78.6	Confident	80	Confident	19 Å²	19	56 Å²	56	12%	0.117	28%	0.282	C	S	.	.			trans	-108.5	125.7	173.8	51.6	0	0	0	0	111.5	I255 S256 E282 F286	I255-T258 WeakPolarHBondContact CG2-OG1 3.33Å; S256-T258 PolarHBondContact O-N 2.87Å; T258-E282 VanDerWaalsContact CG2-OE2 3.24Å; T258-E282 WeakPolarHBondContact CG2-OE2 3.4Å; T258-F286 HydrophobicContact CG2-CZ 4.12Å; T258-F286 WeakPolarHBondContact OG1-CZ 3.47Å
259	V	86.9	Confident	80	Confident	21 Å²	21	54.6 Å²	54.6	13%	0.127	27%	0.272	C	S	.	.			trans	-76	131.3	175.4	-175	0	0	0	0	109.5	V232 S277 D278 V281	V232-V259 HydrophobicContact CB-CG1 3.86Å; V232-V259 HydrophobicContact CG1-CG1 3.47Å; V232-V259 VanDerWaalsContact CG1-CG1 3.47Å; V259-S277 CarbonylContact O-C 3.5Å; V259-S277 WeakPolarHBondContact O-CA 3.36Å; V259-S277 VanDerWaalsContact O-CB 3.29Å; V259-S277 WeakPolarHBondContact O-CB 3.44Å; V259-D278 HydrophobicContact CB-CB 4.37Å; V259-D278 HydrophobicContact CG1-CB 4.25Å; V259-D278 PolarHBondContact O-N 2.82Å; V259-V281 HydrophobicContact CG2-CG2 4.37Å
260	L	88.1	Confident	79.9	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.1	179.3	-63.7	178.8	0	0	0	110.9	L221 S235 L237 I255 M275 L276 F286	L221-L260 HydrophobicContact CD1-CB 3.79Å; L221-L260 HydrophobicContact CD1-CD1 4.18Å; L221-L260 HydrophobicContact CD2-CB 4.25Å; S235-L260 WeakPolarHBondContact CB-O 3.36Å; S235-L260 PolarHBondContact OG-N 2.86Å; L237-L260 HydrophobicContact CB-CD1 4.36Å; I255-L260 HydrophobicContact CD1-CD1 3.97Å; I255-L260 HydrophobicContact CG2-CD1 4.25Å; I255-L260 HydrophobicContact CG2-CD2 4.28Å; I255-L260 HydrophobicContact CG2-CG 4.3Å; L260-M275 HydrophobicContact CD1-SD 3.91Å; L260-M275 HydrophobicContact CD2-CB 4.32Å; L260-L276 WeakPolarHBondContact CA-O 3.4Å; L260-F286 HydrophobicContact CD2-CD2 3.97Å; L260-F286 HydrophobicContact CD2-CE2 4.05Å
261	S	87.6	Confident	80	Confident	8 Å²	8	58.5 Å²	58.5	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-37.4	-176.4	57.9	0	0	0	0	113.2	K223 L276 S277	K223-S261 PolarHBondContact NZ-O 3.35Å; S261-L276 PolarHBondContact N-O 3.36Å; S261-L276 PolarHBondContact OG-O 3.08Å; S261-S277 PolarHBondContact OG-O 2.84Å
262	Y	88.9	Confident	80.9	Confident	66 Å²	66	58.4 Å²	58.4	26%	0.259	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.1	-175.4	-67.2	-83.5	0	0	0	113.1	M207 Y264 M275 L276 E1223	M207-Y262 HydrophobicContact CE-CD1 3.74Å; M207-Y262 HydrophobicContact CE-CE1 4.03Å; M207-Y262 HydrophobicContact SD-CD1 4.49Å; Y262-Y264 HydrophobicContact CG-CE2 4.25Å; Y262-M275 VanDerWaalsContact O-CA 3.28Å; Y262-M275 WeakPolarHBondContact O-CA 3.48Å; Y262-M275 WeakPolarHBondContact O-CB 3.49Å; Y262-L276 HydrophobicContact CD2-CD1 4.33Å; Y262-L276 PolarHBondContact O-N 2.89Å; Y262-E1223 HydrophobicContact CE1-CG 3.92Å; Y262-E1223 VanDerWaalsContact CE1-OE1 3.26Å; Y262-E1223 WeakPolarHBondContact CE1-OE1 3.26Å
263	L	90.6	Very high	82.2	Confident	7 Å²	7	52 Å²	52	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.2	172.2	-172.6	169.1	0	0	0	108.9	H209 L219 L221 L237 V265 I273 M275	H209-L263 HydrophobicContact CB-CD2 4.31Å; L219-L263 HydrophobicContact CB-CD1 4.03Å; L221-L263 HydrophobicContact CB-CB 4.25Å; L221-L263 HydrophobicContact CB-CD1 4.05Å; L221-L263 HydrophobicContact CD2-CB 4.07Å; L237-L263 HydrophobicContact CD1-CD1 4.24Å; L263-V265 HydrophobicContact CD2-CG2 3.96Å; L263-I273 HydrophobicContact CD2-CG2 4.02Å; L263-I273 HydrophobicContact CG-CG2 4.22Å; L263-M275 HydrophobicContact CB-CG 4.36Å; L263-M275 HydrophobicContact CD1-CE 3.8Å; L263-M275 HydrophobicContact CG-CE 3.88Å; L263-M275 HydrophobicContact CG-CG 4.17Å
264	Y	90.8	Very high	83.7	Confident	51 Å²	51	44.1 Å²	44.1	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.7	175.5	-62.1	-86.5	0	0	0	110.8	Y262 I273 L274 L276 L307 F309	Y262-Y264 HydrophobicContact CG-CE2 4.25Å; Y264-I273 WeakPolarHBondContact O-CA 3.32Å; Y264-I273 WeakPolarHBondContact O-CG2 3.25Å; Y264-L274 HydrophobicContact CD2-CD2 4.07Å; Y264-L274 PolarHBondContact N-O 2.85Å; Y264-L274 PolarHBondContact O-N 3.17Å; Y264-L276 HydrophobicContact CE2-CD1 3.84Å; Y264-L276 HydrophobicContact CE2-CG 4.18Å; Y264-L307 HydrophobicContact CD2-CD1 3.79Å; Y264-L307 HydrophobicContact CE2-CD1 3.77Å; Y264-L307 HydrophobicContact CE2-CG 4.41Å; Y264-L307 HydrophobicContact CG-CD1 4.25Å; Y264-F309 HydrophobicContact CD1-CE2 4.07Å; Y264-F309 HydrophobicContact CG-CE2 4.18Å; Y264-F309 HydrophobicContact CG-CZ 4.31Å
265	V	89.4	Confident	85.3	Confident	28 Å²	28	41.6 Å²	41.6	17%	0.17	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.9	168	177.2	0	0	0	0	108.2	H209 L263 K270 I273	H209-V265 HydrophobicContact CB-CG2 3.78Å; L263-V265 HydrophobicContact CD2-CG2 3.96Å; V265-K270 HydrophobicContact CG1-CB 3.73Å; V265-K270 HydrophobicContact CG1-CG 4.07Å; V265-K270 WeakPolarHBondContact CG1-O 3.49Å; V265-I273 HydrophobicContact CG2-CG1 4.18Å
266	C	90.7	Very high	86.6	Confident	1 Å²	1	42 Å²	42	1%	0.007	21%	0.206	C	C	.	.			trans	-66.8	128.2	-179.6	177.1	0	0	0	0	111.1	T268 N269 K270 K272 E314 F332	C266-T268 PolarHBondContact O-N 2.9Å; C266-N269 WeakPolarHBondContact CB-O 3.3Å; C266-N269 CarbonylContact O-C 3.45Å; C266-K270 WeakPolarHBondContact O-CA 3.41Å; C266-K270 PolarHBondContact O-N 2.76Å; C266-K272 HydrophobicContact CB-CB 4.06Å; C266-K272 WeakPolarHBondContact CB-O 3.29Å; C266-K272 PolarHBondContact N-O 2.84Å; C266-E314 PolarHBondContact SG-O 2.86Å; C266-F332 HydrophobicContact CB-CE2 3.64Å; C266-F332 HydrophobicContact CB-CZ 3.81Å
267	P	87.8	Confident	88	Confident	58 Å²	58	38.5 Å²	38.5	38%	0.377	18%	0.181	S	C	.	.	S	Bend	trans	-68.8	-33.2	-175.1	26.4	-34.4	0	0	0	113.1	F309	P267-F309 HydrophobicContact CG-CB 3.78Å; P267-F309 HydrophobicContact CG-CG 4.31Å
268	T	88.1	Confident	88.9	Confident	62 Å²	62	27.2 Å²	27.2	38%	0.38	14%	0.14	S	C	.	.	S	Bend	trans	-81.5	-36.9	-179.7	-44	0	0	0	0	112.8	C266 H310 P311 E314	C266-T268 PolarHBondContact O-N 2.9Å; T268-H310 PolarHBondContact OG1-O 2.99Å; T268-P311 PolarHBondContact OG1-O 2.64Å; T268-E314 HydrophobicContact CG2-CB 4.4Å
269	N	89.2	Confident	89.1	Confident	41 Å²	41	28.9 Å²	28.9	22%	0.219	15%	0.15	C	C	.	.			trans	-137.1	91.9	175.9	-179.1	-1.6	0	0	0	110	C266 Q271 K272 E314	C266-N269 WeakPolarHBondContact CB-O 3.3Å; C266-N269 CarbonylContact O-C 3.45Å; N269-Q271 PolarHBondContact O-N 3.35Å; N269-Q271 WeakPolarHBondContact OD1-CB 3.45Å; N269-Q271 PolarHBondContact OD1-N 2.93Å; N269-K272 PolarHBondContact O-N 2.85Å; N269-E314 HydrophobicContact CB-CB 3.7Å; N269-E314 WeakPolarHBondContact CB-OE2 3.41Å; N269-E314 PolarHBondContact ND2-OE2 2.86Å
270	K	86.3	Confident	88.8	Confident	59 Å²	59	34 Å²	34	26%	0.257	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.8	-174.6	-59.9	174.5	174	179.7	0	114.4	S211 G212 V265 C266 K272	S211-K270 VanDerWaalsContact C-CB 3.45Å; S211-K270 CarbonylContact O-C 3.49Å; S211-K270 WeakPolarHBondContact O-CB 3.28Å; G212-K270 WeakPolarHBondContact O-CD 3.49Å; G212-K270 PolarHBondContact O-NZ 3.36Å; V265-K270 HydrophobicContact CG1-CB 3.73Å; V265-K270 HydrophobicContact CG1-CG 4.07Å; V265-K270 WeakPolarHBondContact CG1-O 3.49Å; C266-K270 WeakPolarHBondContact O-CA 3.41Å; C266-K270 PolarHBondContact O-N 2.76Å; K270-K272 PolarHBondContact O-N 2.9Å
271	Q	87.9	Confident	88.3	Confident	94 Å²	94	38.1 Å²	38.1	44%	0.439	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.8	173.7	-57	-168.8	-58.7	0	0	113.4	S211 N269 E291	S211-Q271 PolarHBondContact O-N 2.82Å; N269-Q271 PolarHBondContact O-N 3.35Å; N269-Q271 WeakPolarHBondContact OD1-CB 3.45Å; N269-Q271 PolarHBondContact OD1-N 2.93Å; Q271-E291 HydrophobicContact CB-CG 3.79Å; Q271-E291 HydrophobicContact CG-CG 3.8Å; Q271-E291 PolarHBondContact NE2-OE1 2.8Å; Q271-E291 PolarHBondContact O-N 3.36Å; Q271-E291 VanDerWaalsContact O-N 3.14Å
272	K	91.9	Very high	88.1	Confident	27 Å²	27	41 Å²	41	12%	0.117	21%	0.21	C	C	.	.			trans	-94.7	118.9	176.7	-67.9	179.6	171	171.8	0	110.2	C266 N269 K270 S288 E314 N315 F332	C266-K272 HydrophobicContact CB-CB 4.06Å; C266-K272 WeakPolarHBondContact CB-O 3.29Å; C266-K272 PolarHBondContact N-O 2.84Å; N269-K272 PolarHBondContact O-N 2.85Å; K270-K272 PolarHBondContact O-N 2.9Å; K272-S288 WeakPolarHBondContact CA-O 3.44Å; K272-E314 IonicContact NZ-OE1 3.99Å; K272-E314 PolarHBondContact NZ-OE1 2.95Å; K272-E314 IonicContact NZ-OE2 3.84Å; K272-E314 PolarHBondContact NZ-OE2 2.88Å; K272-N315 PolarHBondContact NZ-OD1 3.12Å; K272-F332 HydrophobicContact CB-CD1 4.37Å; K272-F332 HydrophobicContact CB-CE1 3.79Å; K272-F332 HydrophobicContact CB-CE2 4.11Å; K272-F332 HydrophobicContact CB-CZ 3.64Å
273	I	92.3	Very high	88.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.4	179.1	-60	107.2	0	0	0	109.2	L219 L263 Y264 V265 M275 S288 F295	L219-I273 HydrophobicContact CD1-CB 4.47Å; L219-I273 HydrophobicContact CD1-CD1 3.64Å; L219-I273 HydrophobicContact CD1-CG1 3.71Å; L219-I273 HydrophobicContact CD1-CG2 4.27Å; L263-I273 HydrophobicContact CD2-CG2 4.02Å; L263-I273 HydrophobicContact CG-CG2 4.22Å; Y264-I273 WeakPolarHBondContact O-CA 3.32Å; Y264-I273 WeakPolarHBondContact O-CG2 3.25Å; V265-I273 HydrophobicContact CG2-CG1 4.18Å; I273-M275 HydrophobicContact CG2-CE 3.83Å; I273-M275 HydrophobicContact CG2-CG 4.31Å; I273-S288 PolarHBondContact N-O 2.92Å; I273-S288 PolarHBondContact O-N 3.12Å; I273-F295 HydrophobicContact CG2-CE1 4.32Å
274	L	93.6	Very high	88.1	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.7	176.8	-175.5	158.5	0	0	0	108.4	Y264 L276 V285 F286 L307 I317 F332	Y264-L274 HydrophobicContact CD2-CD2 4.07Å; Y264-L274 PolarHBondContact N-O 2.85Å; Y264-L274 PolarHBondContact O-N 3.17Å; L274-L276 HydrophobicContact CD2-CD2 3.79Å; L274-L276 HydrophobicContact CD2-CG 4.2Å; L274-V285 HydrophobicContact CD1-CG1 3.9Å; L274-V285 HydrophobicContact CD2-CG1 3.81Å; L274-V285 HydrophobicContact CG-CG1 3.56Å; L274-F286 CarbonylContact C-O 3.12Å; L274-F286 WeakPolarHBondContact CA-O 3.39Å; L274-L307 HydrophobicContact CD1-CD1 4.36Å; L274-L307 HydrophobicContact CD2-CD1 3.67Å; L274-I317 HydrophobicContact CD1-CD1 3.53Å; L274-F332 HydrophobicContact CB-CE1 3.88Å; L274-F332 HydrophobicContact CB-CZ 4.05Å
275	M	91.5	Very high	88.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	148.6	173.5	-59.2	170.8	-174.1	0	0	110.6	L237 I255 L260 Y262 L263 I273 V285 F286 F295	L237-M275 HydrophobicContact CD1-CE 3.43Å; L237-M275 VanDerWaalsContact CD1-CE 3.43Å; L237-M275 HydrophobicContact CD1-SD 4.16Å; L237-M275 HydrophobicContact CD2-CE 3.67Å; L237-M275 HydrophobicContact CD2-SD 3.88Å; L237-M275 HydrophobicContact CG-CE 4.21Å; I255-M275 HydrophobicContact CD1-SD 4.4Å; L260-M275 HydrophobicContact CD1-SD 3.91Å; L260-M275 HydrophobicContact CD2-CB 4.32Å; Y262-M275 VanDerWaalsContact O-CA 3.28Å; Y262-M275 WeakPolarHBondContact O-CA 3.48Å; Y262-M275 WeakPolarHBondContact O-CB 3.49Å; L263-M275 HydrophobicContact CB-CG 4.36Å; L263-M275 HydrophobicContact CD1-CE 3.8Å; L263-M275 HydrophobicContact CG-CE 3.88Å; L263-M275 HydrophobicContact CG-CG 4.17Å; I273-M275 HydrophobicContact CG2-CE 3.83Å; I273-M275 HydrophobicContact CG2-CG 4.31Å; M275-V285 WeakPolarHBondContact O-CA 3.25Å; M275-F286 HydrophobicContact CB-CB 4.26Å; M275-F286 PolarHBondContact N-O 3.05Å; M275-F286 PolarHBondContact O-N 2.97Å; M275-F295 HydrophobicContact CE-CE1 3.56Å; M275-F295 HydrophobicContact CE-CE2 4.27Å; M275-F295 HydrophobicContact CE-CZ 3.31Å; M275-F295 HydrophobicContact CG-CE1 4.4Å; M275-F295 HydrophobicContact SD-CD1 4.47Å; M275-F295 HydrophobicContact SD-CE1 3.82Å; M275-F295 HydrophobicContact SD-CZ 4Å
276	L	91.3	Very high	88.3	Confident	11 Å²	11	35.5 Å²	35.5	6%	0.058	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142.7	175.4	-58.1	179.7	0	0	0	109.5	L260 S261 Y262 Y264 L274 V285 V304	L260-L276 WeakPolarHBondContact CA-O 3.4Å; S261-L276 PolarHBondContact N-O 3.36Å; S261-L276 PolarHBondContact OG-O 3.08Å; Y262-L276 HydrophobicContact CD2-CD1 4.33Å; Y262-L276 PolarHBondContact O-N 2.89Å; Y264-L276 HydrophobicContact CE2-CD1 3.84Å; Y264-L276 HydrophobicContact CE2-CG 4.18Å; L274-L276 HydrophobicContact CD2-CD2 3.79Å; L274-L276 HydrophobicContact CD2-CG 4.2Å; L276-V285 HydrophobicContact CD2-CG1 4.44Å; L276-V285 HydrophobicContact CD2-CG2 3.99Å; L276-V304 HydrophobicContact CD1-CB 4.07Å; L276-V304 HydrophobicContact CD1-CG1 3.83Å
277	S	89.6	Confident	88.4	Confident	7 Å²	7	35.6 Å²	35.6	5%	0.049	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	167.9	166.5	50.2	0	0	0	0	112.3	V259 S261 E282 A284	V259-S277 CarbonylContact O-C 3.5Å; V259-S277 WeakPolarHBondContact O-CA 3.36Å; V259-S277 VanDerWaalsContact O-CB 3.29Å; V259-S277 WeakPolarHBondContact O-CB 3.44Å; S261-S277 PolarHBondContact OG-O 2.84Å; S277-E282 WeakPolarHBondContact CB-O 3.4Å; S277-E282 PolarHBondContact OG-O 3.27Å; S277-A284 PolarHBondContact N-O 3Å; S277-A284 PolarHBondContact OG-N 3.22Å; S277-A284 PolarHBondContact OG-O 2.74Å
278	D	85.4	Confident	88.7	Confident	10 Å²	10	32.9 Å²	32.9	5%	0.053	17%	0.173	C	C	.	.			trans	-75.4	122	168	-168.5	-65.9	0	0	0	110.1	V232 V259 E280 V281 E282	V232-D278 HydrophobicContact CB-CB 4.49Å; V232-D278 PolarHBondContact N-OD2 3.1Å; V259-D278 HydrophobicContact CB-CB 4.37Å; V259-D278 HydrophobicContact CG1-CB 4.25Å; V259-D278 PolarHBondContact O-N 2.82Å; D278-E280 PolarHBondContact O-N 3.34Å; D278-E280 PolarHBondContact OD1-N 2.98Å; D278-V281 PolarHBondContact O-N 3.07Å; D278-E282 CarbonylContact C-O 3.58Å; D278-E282 PolarHBondContact O-N 3.45Å
279	P	82.9	Confident	88.9	Confident	53 Å²	53	33.2 Å²	33.2	34%	0.344	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-15	-169.7	30.1	-37.2	0	0	0	114.4	V281 N303	P279-V281 VanDerWaalsContact C-N 3.26Å; P279-N303 HydrophobicContact CB-CB 4.29Å
280	E	80.6	Confident	88.9	Confident	128 Å²	128	34.1 Å²	34.1	60%	0.598	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-13.9	174.9	-57.3	-101.5	-148.4	0	0	111	T231 D278 R1218	T231-E280 HydrophobicContact CG2-CB 4.43Å; T231-E280 HydrophobicContact CG2-CG 3.83Å; D278-E280 PolarHBondContact O-N 3.34Å; D278-E280 PolarHBondContact OD1-N 2.98Å; E280-R1218 IonicContact OE1-CZ 2.88Å; E280-R1218 IonicContact OE1-NH2 3.63Å; E280-R1218 PolarHBondContact OE1-NH2 3.15Å
281	V	78.1	Confident	89.1	Confident	88 Å²	88	32.8 Å²	32.8	53%	0.533	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-53.6	172.9	-177.6	0	0	0	0	111.3	V259 D278 P279	V259-V281 HydrophobicContact CG2-CG2 4.37Å; D278-V281 PolarHBondContact O-N 3.07Å; P279-V281 VanDerWaalsContact C-N 3.26Å
282	E	84	Confident	89.1	Confident	68 Å²	68	28.3 Å²	28.3	32%	0.318	16%	0.157	S	C	.	.			trans	-159.7	140.2	177.3	-172.6	178.7	-176	0	0	110.2	T258 S277 D278 A284 K297	T258-E282 VanDerWaalsContact CG2-OE2 3.24Å; T258-E282 WeakPolarHBondContact CG2-OE2 3.4Å; S277-E282 WeakPolarHBondContact CB-O 3.4Å; S277-E282 PolarHBondContact OG-O 3.27Å; D278-E282 CarbonylContact C-O 3.58Å; D278-E282 PolarHBondContact O-N 3.45Å; E282-A284 HydrophobicContact CG-CB 4.37Å; E282-K297 WeakPolarHBondContact OE1-CE 3.41Å; E282-K297 IonicContact OE1-NZ 3.71Å; E282-K297 PolarHBondContact OE1-NZ 2.87Å; E282-K297 WeakPolarHBondContact OE2-CE 3.44Å; E282-K297 IonicContact OE2-NZ 2.81Å; E282-K297 PolarHBondContact OE2-NZ 2.83Å
283	S	87.4	Confident	88.9	Confident	28 Å²	28	29.4 Å²	29.4	20%	0.196	17%	0.171	C	C	.	.			trans	-96.4	96.9	172.7	-68	0	0	0	0	110.9	I300 N303	S283-I300 WeakPolarHBondContact CB-O 3.36Å; S283-I300 WeakPolarHBondContact O-CG1 3.35Å; S283-I300 PolarHBondContact O-N 3.2Å; S283-I300 VanDerWaalsContact O-O 3.11Å; S283-N303 PolarHBondContact OG-OD1 2.91Å
284	A	90.4	Very high	88.8	Confident	2 Å²	2	32.4 Å²	32.4	2%	0.017	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	156.1	179.8	0	0	0	0	0	112.1	S277 E282 F286 K297 F298	S277-A284 PolarHBondContact N-O 3Å; S277-A284 PolarHBondContact OG-N 3.22Å; S277-A284 PolarHBondContact OG-O 2.74Å; E282-A284 HydrophobicContact CG-CB 4.37Å; A284-F286 HydrophobicContact CB-CE2 4.28Å; A284-K297 HydrophobicContact CB-CG 4.28Å; A284-F298 WeakPolarHBondContact CA-O 3.43Å
285	V	92.7	Very high	88.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	132.3	172.7	-173.3	0	0	0	0	108.4	L274 M275 L276 I287 F298 I300	L274-V285 HydrophobicContact CD1-CG1 3.9Å; L274-V285 HydrophobicContact CD2-CG1 3.81Å; L274-V285 HydrophobicContact CG-CG1 3.56Å; M275-V285 WeakPolarHBondContact O-CA 3.25Å; L276-V285 HydrophobicContact CD2-CG1 4.44Å; L276-V285 HydrophobicContact CD2-CG2 3.99Å; V285-I287 HydrophobicContact CG1-CD1 4.36Å; V285-I287 HydrophobicContact CG1-CG1 4.07Å; V285-F298 PolarHBondContact N-O 2.75Å; V285-F298 PolarHBondContact O-N 2.81Å; V285-I300 HydrophobicContact CG2-CD1 3.91Å; V285-I300 HydrophobicContact CG2-CG1 4.38Å; V285-I300 HydrophobicContact CG2-CG2 3.8Å
286	F	92.1	Very high	88.6	Confident	7 Å²	7	38.4 Å²	38.4	3%	0.031	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.1	173.6	-66.1	-102.6	0	0	0	109.2	I255 T258 L260 L274 M275 A284 F295 E296 K297	I255-F286 HydrophobicContact CG2-CE1 4.15Å; I255-F286 HydrophobicContact CG2-CZ 4.26Å; T258-F286 HydrophobicContact CG2-CZ 4.12Å; T258-F286 WeakPolarHBondContact OG1-CZ 3.47Å; L260-F286 HydrophobicContact CD2-CD2 3.97Å; L260-F286 HydrophobicContact CD2-CE2 4.05Å; L274-F286 CarbonylContact C-O 3.12Å; L274-F286 WeakPolarHBondContact CA-O 3.39Å; M275-F286 HydrophobicContact CB-CB 4.26Å; M275-F286 PolarHBondContact N-O 3.05Å; M275-F286 PolarHBondContact O-N 2.97Å; A284-F286 HydrophobicContact CB-CE2 4.28Å; F286-F295 HydrophobicContact CB-CB 4.46Å; F286-F295 HydrophobicContact CB-CD1 4.19Å; F286-E296 CarbonylContact C-O 3.58Å; F286-E296 WeakPolarHBondContact CA-O 3.27Å; F286-K297 HydrophobicContact CD1-CB 3.95Å; F286-K297 HydrophobicContact CD1-CG 4.12Å; F286-K297 HydrophobicContact CE1-CB 3.81Å; F286-K297 HydrophobicContact CE1-CD 3.73Å; F286-K297 HydrophobicContact CE1-CG 3.69Å; F286-K297 HydrophobicContact CE2-CG 4.32Å; F286-K297 HydrophobicContact CZ-CB 4.44Å; F286-K297 HydrophobicContact CZ-CD 3.66Å; F286-K297 HydrophobicContact CZ-CG 3.8Å
287	I	94.1	Very high	88.6	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	126.5	-173.9	-68.4	165.6	0	0	0	110	V285 F295 E296 F298 F332 K334	V285-I287 HydrophobicContact CG1-CD1 4.36Å; V285-I287 HydrophobicContact CG1-CG1 4.07Å; I287-F295 WeakPolarHBondContact O-CA 3.39Å; I287-E296 PolarHBondContact N-O 3.32Å; I287-E296 PolarHBondContact O-N 2.86Å; I287-F298 HydrophobicContact CB-CE2 4.38Å; I287-F298 HydrophobicContact CD1-CD2 3.78Å; I287-F298 HydrophobicContact CD1-CE2 4.05Å; I287-F298 HydrophobicContact CG1-CD2 4.4Å; I287-F332 WeakPolarHBondContact CD1-O 3.47Å; I287-F332 HydrophobicContact CG1-CD1 4.28Å; I287-F332 HydrophobicContact CG2-CD1 3.77Å; I287-F332 HydrophobicContact CG2-CE1 4.28Å; I287-K334 HydrophobicContact CD1-CG 3.54Å
288	S	92.8	Very high	88.7	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	150.4	164.1	168.5	0	0	0	0	110	K272 I273 D290 G292 S294	K272-S288 WeakPolarHBondContact CA-O 3.44Å; I273-S288 PolarHBondContact N-O 2.92Å; I273-S288 PolarHBondContact O-N 3.12Å; S288-D290 PolarHBondContact OG-N 3.46Å; S288-D290 VanDerWaalsContact OG-N 3.13Å; S288-D290 PolarHBondContact OG-OD1 2.89Å; S288-G292 VanDerWaalsContact OG-CA 3.3Å; S288-G292 WeakPolarHBondContact OG-CA 3.35Å; S288-G292 PolarHBondContact OG-N 2.97Å; S288-S294 WeakPolarHBondContact CA-O 3.32Å; S288-S294 WeakPolarHBondContact CB-O 3.39Å; S288-S294 PolarHBondContact OG-O 2.95Å
289	S	92.1	Very high	89.1	Confident	69 Å²	69	48.9 Å²	48.9	48%	0.483	28%	0.275	S	S	.	.	S	Bend	trans	-130.6	21.4	166.8	-62	0	0	0	0	111.8
290	D	90.8	Very high	89.5	Confident	60 Å²	60	47.6 Å²	47.6	32%	0.321	26%	0.264	S	S	.	.	S	Bend	trans	-137	34.8	-172.5	66	-3	0	0	0	111.6	R239 S288 G292 A293 S294	R239-D290 PolarHBondContact NH2-O 3.49Å; S288-D290 PolarHBondContact OG-N 3.46Å; S288-D290 VanDerWaalsContact OG-N 3.13Å; S288-D290 PolarHBondContact OG-OD1 2.89Å; D290-G292 PolarHBondContact O-N 3.49Å; D290-A293 HydrophobicContact CB-CB 4.41Å; D290-A293 WeakPolarHBondContact O-CB 3.29Å; D290-A293 PolarHBondContact O-N 3.11Å; D290-A293 PolarHBondContact OD1-N 2.79Å; D290-S294 VanDerWaalsContact CG-N 3.33Å; D290-S294 PolarHBondContact OD1-N 2.75Å; D290-S294 WeakPolarHBondContact OD2-CB 3.2Å; D290-S294 PolarHBondContact OD2-N 2.89Å; D290-S294 PolarHBondContact OD2-OG 2.89Å
291	E	88.9	Confident	90	Very high	31 Å²	31	48.7 Å²	48.7	15%	0.145	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	36.1	-179.2	-63.8	-177.1	-127.2	0	0	113	S211 S215 V217 R239 Q271	S211-E291 PolarHBondContact OG-OE2 2.9Å; S215-E291 VanDerWaalsContact CB-OE2 3.27Å; S215-E291 WeakPolarHBondContact CB-OE2 3.22Å; S215-E291 PolarHBondContact OG-OE2 3.34Å; V217-E291 HydrophobicContact CB-CB 4.47Å; V217-E291 HydrophobicContact CG1-CB 4.21Å; V217-E291 WeakPolarHBondContact CG1-O 3.4Å; V217-E291 HydrophobicContact CG2-CB 4.46Å; R239-E291 VanDerWaalsContact CZ-O 3.25Å; R239-E291 PolarHBondContact NE-O 2.82Å; R239-E291 PolarHBondContact NH2-O 2.86Å; Q271-E291 HydrophobicContact CB-CG 3.79Å; Q271-E291 HydrophobicContact CG-CG 3.8Å; Q271-E291 PolarHBondContact NE2-OE1 2.8Å; Q271-E291 PolarHBondContact O-N 3.36Å; Q271-E291 VanDerWaalsContact O-N 3.14Å
292	G	88.9	Confident	90.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	19.4	177.7	0	0	0	0	0	114.8	R239 S288 D290 F295	R239-G292 WeakPolarHBondContact CD-O 3.46Å; R239-G292 PolarHBondContact NE-O 2.8Å; S288-G292 VanDerWaalsContact OG-CA 3.3Å; S288-G292 WeakPolarHBondContact OG-CA 3.35Å; S288-G292 PolarHBondContact OG-N 2.97Å; D290-G292 PolarHBondContact O-N 3.49Å; G292-F295 WeakPolarHBondContact O-CE2 3.43Å
293	A	88.3	Confident	90.9	Very high	50 Å²	50	45.1 Å²	45.1	41%	0.413	25%	0.254	S	S	.	.	S	Bend	trans	-75.4	-32.6	174.5	0	0	0	0	0	112.2	D290	D290-A293 HydrophobicContact CB-CB 4.41Å; D290-A293 WeakPolarHBondContact O-CB 3.29Å; D290-A293 PolarHBondContact O-N 3.11Å; D290-A293 PolarHBondContact OD1-N 2.79Å
294	S	89.1	Confident	91	Very high	63 Å²	63	44.9 Å²	44.9	44%	0.441	25%	0.251	S	S	.	.			trans	-138.9	153.7	171.9	69.5	0	0	0	0	111.5	S288 D290	S288-S294 WeakPolarHBondContact CA-O 3.32Å; S288-S294 WeakPolarHBondContact CB-O 3.39Å; S288-S294 PolarHBondContact OG-O 2.95Å; D290-S294 VanDerWaalsContact CG-N 3.33Å; D290-S294 PolarHBondContact OD1-N 2.75Å; D290-S294 WeakPolarHBondContact OD2-CB 3.2Å; D290-S294 PolarHBondContact OD2-N 2.89Å; D290-S294 PolarHBondContact OD2-OG 2.89Å
295	F	89.6	Confident	90.9	Very high	24 Å²	24	49 Å²	49	11%	0.105	27%	0.272	C	S	.	.			trans	-131.5	126.6	179.2	-70.6	-89.3	0	0	0	110.9	L237 V254 I255 I273 M275 F286 I287 G292	L237-F295 HydrophobicContact CD2-CE2 3.81Å; L237-F295 HydrophobicContact CD2-CZ 4.13Å; V254-F295 HydrophobicContact CG1-CB 3.95Å; V254-F295 HydrophobicContact CG1-CD2 4.1Å; I255-F295 HydrophobicContact CD1-CD2 4.24Å; I255-F295 HydrophobicContact CD1-CG 4.4Å; I273-F295 HydrophobicContact CG2-CE1 4.32Å; M275-F295 HydrophobicContact CE-CE1 3.56Å; M275-F295 HydrophobicContact CE-CE2 4.27Å; M275-F295 HydrophobicContact CE-CZ 3.31Å; M275-F295 HydrophobicContact CG-CE1 4.4Å; M275-F295 HydrophobicContact SD-CD1 4.47Å; M275-F295 HydrophobicContact SD-CE1 3.82Å; M275-F295 HydrophobicContact SD-CZ 4Å; F286-F295 HydrophobicContact CB-CB 4.46Å; F286-F295 HydrophobicContact CB-CD1 4.19Å; I287-F295 WeakPolarHBondContact O-CA 3.39Å; G292-F295 WeakPolarHBondContact O-CE2 3.43Å
296	E	91.4	Very high	90.8	Very high	102 Å²	102	50.8 Å²	50.8	48%	0.477	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.9	167.7	-67.8	-178.6	162.7	0	0	109.6	F286 I287 F298 K334	F286-E296 CarbonylContact C-O 3.58Å; F286-E296 WeakPolarHBondContact CA-O 3.27Å; I287-E296 PolarHBondContact N-O 3.32Å; I287-E296 PolarHBondContact O-N 2.86Å; E296-F298 HydrophobicContact CB-CD2 4.36Å; E296-F298 HydrophobicContact CB-CE2 3.44Å; E296-F298 VanDerWaalsContact CB-CE2 3.44Å; E296-F298 HydrophobicContact CB-CZ 3.96Å; E296-F298 WeakPolarHBondContact OE2-CZ 3.5Å; E296-K334 WeakPolarHBondContact OE2-CE 3.41Å; E296-K334 IonicContact OE2-NZ 2.83Å; E296-K334 PolarHBondContact OE2-NZ 3Å
297	K	91.1	Very high	90.8	Very high	92 Å²	92	50.7 Å²	50.7	40%	0.4	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.5	-179.4	-176.1	-176.8	-179.8	-177.3	0	111.4	E282 A284 F286	E282-K297 WeakPolarHBondContact OE1-CE 3.41Å; E282-K297 IonicContact OE1-NZ 3.71Å; E282-K297 PolarHBondContact OE1-NZ 2.87Å; E282-K297 WeakPolarHBondContact OE2-CE 3.44Å; E282-K297 IonicContact OE2-NZ 2.81Å; E282-K297 PolarHBondContact OE2-NZ 2.83Å; A284-K297 HydrophobicContact CB-CG 4.28Å; F286-K297 HydrophobicContact CD1-CB 3.95Å; F286-K297 HydrophobicContact CD1-CG 4.12Å; F286-K297 HydrophobicContact CE1-CB 3.81Å; F286-K297 HydrophobicContact CE1-CD 3.73Å; F286-K297 HydrophobicContact CE1-CG 3.69Å; F286-K297 HydrophobicContact CE2-CG 4.32Å; F286-K297 HydrophobicContact CZ-CB 4.44Å; F286-K297 HydrophobicContact CZ-CD 3.66Å; F286-K297 HydrophobicContact CZ-CG 3.8Å
298	F	93	Very high	90.8	Very high	49 Å²	49	52.3 Å²	52.3	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.7	177.4	-64	-86.8	0	0	0	110.3	A284 V285 I287 E296 K334	A284-F298 WeakPolarHBondContact CA-O 3.43Å; V285-F298 PolarHBondContact N-O 2.75Å; V285-F298 PolarHBondContact O-N 2.81Å; I287-F298 HydrophobicContact CB-CE2 4.38Å; I287-F298 HydrophobicContact CD1-CD2 3.78Å; I287-F298 HydrophobicContact CD1-CE2 4.05Å; I287-F298 HydrophobicContact CG1-CD2 4.4Å; E296-F298 HydrophobicContact CB-CD2 4.36Å; E296-F298 HydrophobicContact CB-CE2 3.44Å; E296-F298 VanDerWaalsContact CB-CE2 3.44Å; E296-F298 HydrophobicContact CB-CZ 3.96Å; E296-F298 WeakPolarHBondContact OE2-CZ 3.5Å; F298-K334 HydrophobicContact CD1-CB 4.02Å; F298-K334 HydrophobicContact CD1-CG 4.21Å; F298-K334 HydrophobicContact CD2-CG 4.02Å; F298-K334 HydrophobicContact CE1-CB 3.91Å; F298-K334 HydrophobicContact CE1-CD 4.02Å; F298-K334 HydrophobicContact CE1-CG 3.85Å; F298-K334 HydrophobicContact CE2-CB 4.46Å; F298-K334 HydrophobicContact CE2-CD 3.89Å; F298-K334 HydrophobicContact CE2-CG 3.62Å; F298-K334 HydrophobicContact CG-CB 4.38Å; F298-K334 HydrophobicContact CG-CG 4.3Å; F298-K334 HydrophobicContact CZ-CB 4.16Å; F298-K334 HydrophobicContact CZ-CD 3.5Å; F298-K334 VanDerWaalsContact CZ-CD 3.5Å; F298-K334 HydrophobicContact CZ-CG 3.56Å
299	P	91.9	Very high	90.9	Very high	108 Å²	108	53.6 Å²	53.6	70%	0.701	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	144	176.1	30.4	-34.2	0	0	0	110.8
300	I	92.5	Very high	91	Very high	25 Å²	25	50.4 Å²	50.4	13%	0.128	28%	0.276	C	S	.	.			trans	-125.5	150.8	175.3	58.7	169.4	0	0	0	110.8	S283 V285 F302 V304	S283-I300 WeakPolarHBondContact CB-O 3.36Å; S283-I300 WeakPolarHBondContact O-CG1 3.35Å; S283-I300 PolarHBondContact O-N 3.2Å; S283-I300 VanDerWaalsContact O-O 3.11Å; V285-I300 HydrophobicContact CG2-CD1 3.91Å; V285-I300 HydrophobicContact CG2-CG1 4.38Å; V285-I300 HydrophobicContact CG2-CG2 3.8Å; I300-F302 HydrophobicContact CB-CD1 4.49Å; I300-F302 HydrophobicContact CB-CE1 4.34Å; I300-F302 VanDerWaalsContact CD1-O 3.3Å; I300-F302 WeakPolarHBondContact CD1-O 3.29Å; I300-V304 HydrophobicContact CD1-CG2 3.78Å
301	N	90.8	Very high	90.9	Very high	151 Å²	151	51.3 Å²	51.3	81%	0.807	29%	0.285	S	S	*	.	S	Bend	trans	-104.8	20.9	-175.1	66.2	-29.9	0	0	0	113.5
302	F	91.3	Very high	91	Very high	10 Å²	10	51.2 Å²	51.2	4%	0.044	29%	0.29	C	S	.	.	S	Bend	trans	-150.7	155.3	178.1	66.6	-84.6	0	0	0	110.4	I300 V304 A319 Y327 W336	I300-F302 HydrophobicContact CB-CD1 4.49Å; I300-F302 HydrophobicContact CB-CE1 4.34Å; I300-F302 VanDerWaalsContact CD1-O 3.3Å; I300-F302 WeakPolarHBondContact CD1-O 3.29Å; F302-V304 HydrophobicContact CD2-CG2 4.34Å; F302-V304 HydrophobicContact CE2-CG2 3.76Å; F302-V304 HydrophobicContact CZ-CG2 4.42Å; F302-A319 HydrophobicContact CE2-CB 4Å; F302-A319 HydrophobicContact CZ-CB 4.28Å; F302-Y327 HydrophobicContact CB-CE2 4.19Å; F302-Y327 HydrophobicContact CD1-CD1 4.38Å; F302-Y327 HydrophobicContact CD1-CD2 4.35Å; F302-Y327 HydrophobicContact CD1-CE1 4.16Å; F302-Y327 HydrophobicContact CD1-CE2 4.14Å; F302-Y327 HydrophobicContact CD1-CG 4.47Å; F302-Y327 AromaticContact CD2-CD2 3.75Å; F302-Y327 HydrophobicContact CD2-CD2 3.75Å; F302-Y327 AromaticContact CD2-CE2 3.71Å; F302-Y327 HydrophobicContact CD2-CE2 3.71Å; F302-Y327 HydrophobicContact CD2-CG 4.47Å; F302-Y327 HydrophobicContact CE1-CD1 4.09Å; F302-Y327 HydrophobicContact CE1-CD2 4.24Å; F302-Y327 HydrophobicContact CE1-CE1 4.32Å; F302-Y327 HydrophobicContact CE1-CE2 4.48Å; F302-Y327 HydrophobicContact CE1-CG 4.04Å; F302-Y327 AromaticContact CE2-CD2 3.59Å; F302-Y327 HydrophobicContact CE2-CD2 3.59Å; F302-Y327 HydrophobicContact CE2-CE2 4.06Å; F302-Y327 HydrophobicContact CE2-CG 4.02Å; F302-Y327 HydrophobicContact CG-CD2 4.13Å; F302-Y327 AromaticContact CG-CE2 3.74Å; F302-Y327 HydrophobicContact CG-CE2 3.74Å; F302-Y327 AromaticContact CG-CZ 3.97Å; F302-Y327 HydrophobicContact CZ-CD1 4.31Å; F302-Y327 AromaticContact CZ-CD2 3.87Å; F302-Y327 HydrophobicContact CZ-CD2 3.87Å; F302-Y327 HydrophobicContact CZ-CE2 4.44Å; F302-Y327 AromaticContact CZ-CG 3.8Å; F302-Y327 HydrophobicContact CZ-CG 3.8Å; F302-W336 HydrophobicContact CE1-CB 3.84Å; F302-W336 HydrophobicContact CE1-CD2 4.35Å; F302-W336 AromaticContact CE1-CG 3.79Å; F302-W336 HydrophobicContact CE1-CG 3.79Å; F302-W336 HydrophobicContact CZ-CB 4.17Å; F302-W336 AromaticContact CZ-CD2 3.86Å; F302-W336 HydrophobicContact CZ-CD2 3.86Å; F302-W336 HydrophobicContact CZ-CE3 4.26Å; F302-W336 AromaticContact CZ-CG 3.81Å; F302-W336 HydrophobicContact CZ-CG 3.81Å
303	N	88.8	Confident	91.2	Very high	71 Å²	71	55 Å²	55	38%	0.38	31%	0.308	S	S	.	.			trans	-93.5	116.5	-177.3	-60.4	16.4	0	0	0	109.7	P279 S283 S321 H322	P279-N303 HydrophobicContact CB-CB 4.29Å; S283-N303 PolarHBondContact OG-OD1 2.91Å; N303-S321 VanDerWaalsContact O-CA 3.25Å; N303-S321 WeakPolarHBondContact O-CA 3.33Å; N303-S321 WeakPolarHBondContact O-CB 3.25Å; N303-H322 PolarHBondContact O-N 3.02Å
304	V	90.5	Very high	91.4	Very high	24 Å²	24	55.3 Å²	55.3	15%	0.145	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.4	176.2	179.2	0	0	0	0	109.9	L276 I300 F302 L307 A319	L276-V304 HydrophobicContact CD1-CB 4.07Å; L276-V304 HydrophobicContact CD1-CG1 3.83Å; I300-V304 HydrophobicContact CD1-CG2 3.78Å; F302-V304 HydrophobicContact CD2-CG2 4.34Å; F302-V304 HydrophobicContact CE2-CG2 3.76Å; F302-V304 HydrophobicContact CZ-CG2 4.42Å; V304-L307 HydrophobicContact CG1-CD2 3.61Å; V304-L307 HydrophobicContact CG1-CG 3.95Å; V304-A319 HydrophobicContact CG1-CB 4.45Å; V304-A319 HydrophobicContact CG2-CB 4.3Å
305	L	88.2	Confident	91.7	Very high	87 Å²	87	54.6 Å²	54.6	46%	0.455	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-29.8	169.3	-74.1	-176.7	0	0	0	113	Y320 H322	L305-Y320 HydrophobicContact CB-CD1 4.21Å; L305-Y320 HydrophobicContact CD1-CE1 4.2Å; L305-Y320 PolarHBondContact N-O 2.68Å; L305-H322 HydrophobicContact CD1-CB 3.89Å; L305-H322 HydrophobicContact CD2-CB 4.44Å; L305-H322 HydrophobicContact CG-CB 4.02Å
306	S	90	Very high	91.9	Very high	39 Å²	39	55.9 Å²	55.9	27%	0.273	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	145.6	-177.7	-175	0	0	0	0	111.1	A319 Y320	S306-A319 WeakPolarHBondContact O-CA 3.32Å; S306-Y320 PolarHBondContact N-O 2.89Å; S306-Y320 PolarHBondContact O-N 3.01Å
307	L	92.8	Very high	92.1	Very high	5 Å²	5	51 Å²	51	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.2	174.8	-64	-177.6	0	0	0	110.9	Y264 L274 V304 F309 I317 L318 A319 W336 N1226	Y264-L307 HydrophobicContact CD2-CD1 3.79Å; Y264-L307 HydrophobicContact CE2-CD1 3.77Å; Y264-L307 HydrophobicContact CE2-CG 4.41Å; Y264-L307 HydrophobicContact CG-CD1 4.25Å; L274-L307 HydrophobicContact CD1-CD1 4.36Å; L274-L307 HydrophobicContact CD2-CD1 3.67Å; V304-L307 HydrophobicContact CG1-CD2 3.61Å; V304-L307 HydrophobicContact CG1-CG 3.95Å; L307-F309 HydrophobicContact CB-CE2 4.4Å; L307-F309 HydrophobicContact CD1-CZ 4.44Å; L307-I317 HydrophobicContact CB-CG2 4.34Å; L307-I317 HydrophobicContact CD2-CG2 4.11Å; L307-L318 WeakPolarHBondContact CA-O 3.46Å; L307-A319 HydrophobicContact CD2-CB 3.56Å; L307-W336 HydrophobicContact CD2-CH2 4.24Å; L307-N1226 PolarHBondContact O-ND2 3.32Å; L307-N1226 VanDerWaalsContact O-ND2 3.14Å
308	L	94.3	Very high	92.4	Very high	37 Å²	37	46.6 Å²	46.6	19%	0.194	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	103.9	170.1	-175.3	70.2	0	0	0	109.9	L318 F348 W350	L308-L318 HydrophobicContact CB-CB 4.42Å; L308-L318 HydrophobicContact CD2-CD1 4.43Å; L308-L318 PolarHBondContact N-O 3.4Å; L308-L318 PolarHBondContact O-N 2.99Å; L308-F348 HydrophobicContact CB-CD2 4.49Å; L308-F348 HydrophobicContact CB-CE2 3.87Å; L308-F348 HydrophobicContact CD2-CD2 4.14Å; L308-F348 HydrophobicContact CD2-CE2 4.25Å; L308-W350 HydrophobicContact CD2-CG 4.5Å; L308-W350 PolarHBondContact O-NE1 2.92Å
309	F	94.4	Very high	92.5	Very high	29 Å²	29	44.3 Å²	44.3	13%	0.127	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	145.1	172.9	-63.8	-90.6	0	0	0	110.6	Y264 P267 L307 I317 F332 W350	Y264-F309 HydrophobicContact CD1-CE2 4.07Å; Y264-F309 HydrophobicContact CG-CE2 4.18Å; Y264-F309 HydrophobicContact CG-CZ 4.31Å; P267-F309 HydrophobicContact CG-CB 3.78Å; P267-F309 HydrophobicContact CG-CG 4.31Å; L307-F309 HydrophobicContact CB-CE2 4.4Å; L307-F309 HydrophobicContact CD1-CZ 4.44Å; F309-I317 HydrophobicContact CD1-CD1 4.05Å; F309-I317 HydrophobicContact CD1-CG1 3.86Å; F309-I317 HydrophobicContact CD1-CG2 4.38Å; F309-I317 HydrophobicContact CE1-CD1 3.61Å; F309-I317 HydrophobicContact CE1-CG1 3.97Å; F309-I317 HydrophobicContact CE1-CG2 4.41Å; F309-I317 HydrophobicContact CZ-CD1 4.44Å; F309-F332 HydrophobicContact CD1-CE2 4.11Å; F309-F332 AromaticContact CE1-CE2 3.64Å; F309-F332 HydrophobicContact CE1-CE2 3.64Å; F309-F332 HydrophobicContact CE1-CZ 4.02Å; F309-W350 PolarHBondContact O-NE1 2.78Å
310	H	93.6	Very high	92.6	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.213	C	C	.	.			trans	-71.5	132.6	172.7	-178	-81.3	0	0	0	109.7	T268 A312 Q313 W316 W350 S359	T268-H310 PolarHBondContact OG1-O 2.99Å; H310-A312 PolarHBondContact ND1-N 2.92Å; H310-A312 PolarHBondContact O-N 2.84Å; H310-Q313 HydrophobicContact CB-CB 4.1Å; H310-Q313 VanDerWaalsContact ND1-CB 3.32Å; H310-Q313 WeakPolarHBondContact ND1-CB 3.48Å; H310-Q313 WeakPolarHBondContact ND1-CG 3.16Å; H310-Q313 PolarHBondContact ND1-N 2.8Å; H310-Q313 PolarHBondContact O-N 3.21Å; H310-W316 HydrophobicContact CB-CB 3.64Å; H310-W316 AromaticContact CD2-CE3 3.87Å; H310-W316 PolarHBondContact N-O 3.31Å; H310-W350 HydrophobicContact CB-CD2 4.12Å; H310-W350 HydrophobicContact CB-CG 4.42Å; H310-W350 HydrophobicContact CB-CZ2 3.93Å; H310-W350 AromaticContact CD2-CD2 3.68Å; H310-W350 AromaticContact CD2-CE3 3.68Å; H310-W350 AromaticContact CD2-CG 3.98Å; H310-S359 PolarHBondContact NE2-O 3.43Å
311	P	90.4	Very high	92.7	Very high	79 Å²	79	38.5 Å²	38.5	51%	0.513	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.8	-168.8	20.3	-33.5	0	0	0	114.8	T268	T268-P311 PolarHBondContact OG1-O 2.64Å
312	A	89.7	Confident	92.5	Very high	30 Å²	30	37.4 Å²	37.4	25%	0.248	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.2	22	-176.4	0	0	0	0	0	114.8	H310 M353	H310-A312 PolarHBondContact ND1-N 2.92Å; H310-A312 PolarHBondContact O-N 2.84Å; A312-M353 HydrophobicContact CB-CE 3.47Å; A312-M353 VanDerWaalsContact CB-CE 3.47Å; A312-M353 HydrophobicContact CB-SD 3.45Å; A312-M353 WeakPolarHBondContact CB-SD 3.15Å
313	Q	92.9	Very high	92.5	Very high	80 Å²	80	40.4 Å²	40.4	37%	0.374	21%	0.213	S	C	.	.			trans	-134.3	97.3	177.2	-68	-66.8	-49.3	0	0	108.5	H310 N315 W316	H310-Q313 HydrophobicContact CB-CB 4.1Å; H310-Q313 VanDerWaalsContact ND1-CB 3.32Å; H310-Q313 WeakPolarHBondContact ND1-CB 3.48Å; H310-Q313 WeakPolarHBondContact ND1-CG 3.16Å; H310-Q313 PolarHBondContact ND1-N 2.8Å; H310-Q313 PolarHBondContact O-N 3.21Å; Q313-N315 PolarHBondContact O-N 3.42Å; Q313-W316 HydrophobicContact CB-CB 3.97Å; Q313-W316 HydrophobicContact CB-CD2 3.6Å; Q313-W316 HydrophobicContact CB-CE3 3.82Å; Q313-W316 HydrophobicContact CB-CG 3.68Å; Q313-W316 HydrophobicContact CG-CD2 3.92Å; Q313-W316 HydrophobicContact CG-CE3 3.78Å; Q313-W316 HydrophobicContact CG-CH2 4.39Å; Q313-W316 HydrophobicContact CG-CZ3 4.02Å; Q313-W316 PolarHBondContact O-N 2.98Å
314	E	93	Very high	92.7	Very high	55 Å²	55	42.5 Å²	42.5	26%	0.257	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-15.7	-169.6	49.6	137.3	-137.3	0	0	116.6	C266 T268 N269 K272 F332	C266-E314 PolarHBondContact SG-O 2.86Å; T268-E314 HydrophobicContact CG2-CB 4.4Å; N269-E314 HydrophobicContact CB-CB 3.7Å; N269-E314 WeakPolarHBondContact CB-OE2 3.41Å; N269-E314 PolarHBondContact ND2-OE2 2.86Å; K272-E314 IonicContact NZ-OE1 3.99Å; K272-E314 PolarHBondContact NZ-OE1 2.95Å; K272-E314 IonicContact NZ-OE2 3.84Å; K272-E314 PolarHBondContact NZ-OE2 2.88Å; E314-F332 WeakPolarHBondContact O-CD2 3.39Å; E314-F332 WeakPolarHBondContact O-CE2 3.45Å
315	N	94.9	Very high	92.9	Very high	48 Å²	48	43.5 Å²	43.5	26%	0.257	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	0.5	179.4	-56	-63.5	0	0	0	113.8	K272 Q313 M330 D331 F332	K272-N315 PolarHBondContact NZ-OD1 3.12Å; Q313-N315 PolarHBondContact O-N 3.42Å; N315-M330 WeakPolarHBondContact CB-O 3.41Å; N315-M330 CarbonylContact O-C 3.58Å; N315-M330 WeakPolarHBondContact O-CA 3.4Å; N315-D331 PolarHBondContact O-N 3.33Å; N315-F332 HydrophobicContact CB-CB 4.39Å; N315-F332 WeakPolarHBondContact O-CA 3.46Å; N315-F332 PolarHBondContact O-N 3.15Å
316	W	95.1	Very high	93.3	Very high	51 Å²	51	39.4 Å²	39.4	19%	0.193	20%	0.197	C	C	.	.			trans	-106.3	124.2	-168.7	-66.4	8.6	0	0	0	111.4	H310 Q313 S329 M330 W350 S359 D360	H310-W316 HydrophobicContact CB-CB 3.64Å; H310-W316 AromaticContact CD2-CE3 3.87Å; H310-W316 PolarHBondContact N-O 3.31Å; Q313-W316 HydrophobicContact CB-CB 3.97Å; Q313-W316 HydrophobicContact CB-CD2 3.6Å; Q313-W316 HydrophobicContact CB-CE3 3.82Å; Q313-W316 HydrophobicContact CB-CG 3.68Å; Q313-W316 HydrophobicContact CG-CD2 3.92Å; Q313-W316 HydrophobicContact CG-CE3 3.78Å; Q313-W316 HydrophobicContact CG-CH2 4.39Å; Q313-W316 HydrophobicContact CG-CZ3 4.02Å; Q313-W316 PolarHBondContact O-N 2.98Å; W316-S329 WeakPolarHBondContact CA-O 3.42Å; W316-M330 HydrophobicContact CB-SD 3.81Å; W316-M330 HydrophobicContact CD2-CE 4.37Å; W316-M330 HydrophobicContact CD2-SD 3.45Å; W316-M330 HydrophobicContact CE3-CE 4.43Å; W316-M330 HydrophobicContact CE3-SD 4.06Å; W316-M330 HydrophobicContact CG-SD 3.31Å; W316-W350 HydrophobicContact CB-CH2 4.16Å; W316-W350 HydrophobicContact CB-CZ2 4.21Å; W316-W350 HydrophobicContact CE3-CZ3 4.47Å; W316-S359 WeakPolarHBondContact CH2-OG 3.38Å; W316-S359 WeakPolarHBondContact CZ3-OG 3.25Å; W316-D360 HydrophobicContact CH2-CB 3.94Å; W316-D360 HydrophobicContact CZ3-CB 3.74Å
317	I	95.9	Very high	93.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	137.2	-172.6	-42	179.7	0	0	0	109.9	L274 L307 F309 S328 S329 F332 W336	L274-I317 HydrophobicContact CD1-CD1 3.53Å; L307-I317 HydrophobicContact CB-CG2 4.34Å; L307-I317 HydrophobicContact CD2-CG2 4.11Å; F309-I317 HydrophobicContact CD1-CD1 4.05Å; F309-I317 HydrophobicContact CD1-CG1 3.86Å; F309-I317 HydrophobicContact CD1-CG2 4.38Å; F309-I317 HydrophobicContact CE1-CD1 3.61Å; F309-I317 HydrophobicContact CE1-CG1 3.97Å; F309-I317 HydrophobicContact CE1-CG2 4.41Å; F309-I317 HydrophobicContact CZ-CD1 4.44Å; I317-S328 WeakPolarHBondContact O-CA 3.37Å; I317-S329 PolarHBondContact N-O 3.5Å; I317-S329 PolarHBondContact O-N 2.98Å; I317-F332 HydrophobicContact CD1-CD2 3.75Å; I317-F332 HydrophobicContact CD1-CE2 4.01Å; I317-F332 HydrophobicContact CD1-CG 4.18Å; I317-F332 HydrophobicContact CG1-CD2 4.28Å; I317-W336 HydrophobicContact CB-CH2 4.09Å; I317-W336 HydrophobicContact CB-CZ3 4.44Å; I317-W336 HydrophobicContact CG2-CH2 4.03Å
318	L	96.2	Very high	93.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.7	161.3	-54.5	177.5	0	0	0	110.2	L307 L308 L326 Y327 F348 W350 V362 A380	L307-L318 WeakPolarHBondContact CA-O 3.46Å; L308-L318 HydrophobicContact CB-CB 4.42Å; L308-L318 HydrophobicContact CD2-CD1 4.43Å; L308-L318 PolarHBondContact N-O 3.4Å; L308-L318 PolarHBondContact O-N 2.99Å; L318-L326 HydrophobicContact CB-CD1 4.05Å; L318-L326 HydrophobicContact CD1-CD2 4.39Å; L318-Y327 CarbonylContact C-O 3.55Å; L318-Y327 VanDerWaalsContact CA-O 3.29Å; L318-Y327 WeakPolarHBondContact CA-O 3.29Å; L318-F348 HydrophobicContact CD1-CD2 4.1Å; L318-W350 HydrophobicContact CD1-CD2 4.16Å; L318-W350 HydrophobicContact CD1-CZ2 4.29Å; L318-W350 HydrophobicContact CD2-CH2 3.73Å; L318-W350 HydrophobicContact CD2-CZ2 3.71Å; L318-W350 HydrophobicContact CD2-CZ3 4.26Å; L318-W350 HydrophobicContact CG-CD2 4.28Å; L318-W350 HydrophobicContact CG-CH2 4.05Å; L318-W350 HydrophobicContact CG-CZ2 3.51Å; L318-V362 HydrophobicContact CD1-CG1 3.8Å; L318-V362 HydrophobicContact CD2-CG1 4.06Å; L318-A380 HydrophobicContact CD2-CB 4.48Å
319	A	95.3	Very high	93.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.6	171.7	0	0	0	0	0	110.3	F302 V304 S306 L307 Y327 W336	F302-A319 HydrophobicContact CE2-CB 4Å; F302-A319 HydrophobicContact CZ-CB 4.28Å; V304-A319 HydrophobicContact CG1-CB 4.45Å; V304-A319 HydrophobicContact CG2-CB 4.3Å; S306-A319 WeakPolarHBondContact O-CA 3.32Å; L307-A319 HydrophobicContact CD2-CB 3.56Å; A319-Y327 PolarHBondContact N-O 3.48Å; A319-Y327 PolarHBondContact O-N 3.21Å; A319-W336 HydrophobicContact CB-CE3 4Å; A319-W336 HydrophobicContact CB-CH2 3.69Å; A319-W336 HydrophobicContact CB-CZ2 4.45Å; A319-W336 HydrophobicContact CB-CZ3 3.43Å; A319-W336 VanDerWaalsContact CB-CZ3 3.43Å
320	Y	95.2	Very high	93.8	Very high	12 Å²	12	37.2 Å²	37.2	5%	0.047	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.1	173.3	175.6	-93.5	0	0	0	110	L305 S306 Y324 K325 V343 F348	L305-Y320 HydrophobicContact CB-CD1 4.21Å; L305-Y320 HydrophobicContact CD1-CE1 4.2Å; L305-Y320 PolarHBondContact N-O 2.68Å; S306-Y320 PolarHBondContact N-O 2.89Å; S306-Y320 PolarHBondContact O-N 3.01Å; Y320-Y324 WeakPolarHBondContact OH-CD1 3.47Å; Y320-K325 WeakPolarHBondContact CA-O 3.44Å; Y320-V343 HydrophobicContact CD2-CB 4.45Å; Y320-V343 HydrophobicContact CD2-CG1 4.18Å; Y320-V343 HydrophobicContact CE2-CB 4.19Å; Y320-V343 HydrophobicContact CE2-CG1 4.18Å; Y320-F348 HydrophobicContact CD2-CD1 4.27Å; Y320-F348 AromaticContact CD2-CE1 3.89Å; Y320-F348 HydrophobicContact CD2-CE1 3.89Å; Y320-F348 AromaticContact CG-CE1 3.78Å; Y320-F348 HydrophobicContact CG-CE1 3.78Å; Y320-F348 HydrophobicContact CG-CZ 4.28Å
321	S	93.8	Very high	93.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	162.5	-171.4	67.1	0	0	0	0	114.3	N303 D323 Y324 K325	N303-S321 VanDerWaalsContact O-CA 3.25Å; N303-S321 WeakPolarHBondContact O-CA 3.33Å; N303-S321 WeakPolarHBondContact O-CB 3.25Å; S321-D323 VanDerWaalsContact CB-OD1 3.29Å; S321-D323 WeakPolarHBondContact CB-OD1 3.37Å; S321-D323 PolarHBondContact O-N 2.57Å; S321-D323 PolarHBondContact OG-OD1 2.77Å; S321-Y324 PolarHBondContact O-N 3.47Å; S321-Y324 VanDerWaalsContact O-N 3.16Å; S321-K325 PolarHBondContact N-O 2.98Å; S321-K325 WeakPolarHBondContact OG-CB 3.29Å; S321-K325 PolarHBondContact OG-N 3.02Å; S321-K325 VanDerWaalsContact OG-N 3.11Å; S321-K325 PolarHBondContact OG-O 3.46Å
322	H	86.8	Confident	94	Very high	127 Å²	127	36.1 Å²	36.1	59%	0.588	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-20	178.1	-160.3	-45.8	0	0	0	113.7	N303 L305 Y324	N303-H322 PolarHBondContact O-N 3.02Å; L305-H322 HydrophobicContact CD1-CB 3.89Å; L305-H322 HydrophobicContact CD2-CB 4.44Å; L305-H322 HydrophobicContact CG-CB 4.02Å; H322-Y324 VanDerWaalsContact C-N 3.3Å; H322-Y324 PolarHBondContact O-N 3.42Å
323	D	90.6	Very high	94.2	Very high	73 Å²	73	34.7 Å²	34.7	39%	0.39	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	24.3	174	68.9	-29.4	0	0	0	113.7	S321 K325	S321-D323 VanDerWaalsContact CB-OD1 3.29Å; S321-D323 WeakPolarHBondContact CB-OD1 3.37Å; S321-D323 PolarHBondContact O-N 2.57Å; S321-D323 PolarHBondContact OG-OD1 2.77Å; D323-K325 VanDerWaalsContact C-N 3.34Å; D323-K325 PolarHBondContact O-N 3.1Å; D323-K325 VanDerWaalsContact OD2-CD 3.28Å; D323-K325 WeakPolarHBondContact OD2-CD 3.5Å; D323-K325 WeakPolarHBondContact OD2-CE 3.33Å; D323-K325 IonicContact OD2-NZ 2.8Å; D323-K325 PolarHBondContact OD2-NZ 2.99Å
324	Y	92.6	Very high	94.2	Very high	115 Å²	115	34.4 Å²	34.4	45%	0.451	16%	0.157	S	C	.	.	S	Bend	trans	61.6	33.5	176.2	-52.5	-92.4	0	0	0	114	Y320 S321 H322 E341 N342 V343	Y320-Y324 WeakPolarHBondContact OH-CD1 3.47Å; S321-Y324 PolarHBondContact O-N 3.47Å; S321-Y324 VanDerWaalsContact O-N 3.16Å; H322-Y324 VanDerWaalsContact C-N 3.3Å; H322-Y324 PolarHBondContact O-N 3.42Å; Y324-E341 CarbonylContact O-C 3.47Å; Y324-N342 CarbonylContact O-C 3.52Å; Y324-N342 WeakPolarHBondContact O-CA 3.44Å; Y324-N342 PolarHBondContact O-N 2.98Å; Y324-V343 PolarHBondContact O-N 3.32Å
325	K	95	Very high	94.3	Very high	46 Å²	46	39.1 Å²	39.1	20%	0.2	18%	0.177	C	C	.	.			trans	-109.1	154.2	177	-58.3	178.4	-174.2	155.5	0	111	Y320 S321 D323 Y327 L338 H340 E341	Y320-K325 WeakPolarHBondContact CA-O 3.44Å; S321-K325 PolarHBondContact N-O 2.98Å; S321-K325 WeakPolarHBondContact OG-CB 3.29Å; S321-K325 PolarHBondContact OG-N 3.02Å; S321-K325 VanDerWaalsContact OG-N 3.11Å; S321-K325 PolarHBondContact OG-O 3.46Å; D323-K325 VanDerWaalsContact C-N 3.34Å; D323-K325 PolarHBondContact O-N 3.1Å; D323-K325 VanDerWaalsContact OD2-CD 3.28Å; D323-K325 WeakPolarHBondContact OD2-CD 3.5Å; D323-K325 WeakPolarHBondContact OD2-CE 3.33Å; D323-K325 IonicContact OD2-NZ 2.8Å; D323-K325 PolarHBondContact OD2-NZ 2.99Å; K325-Y327 HydrophobicContact CB-CD2 4.36Å; K325-Y327 HydrophobicContact CB-CE2 3.72Å; K325-Y327 HydrophobicContact CD-CE2 4.49Å; K325-L338 HydrophobicContact CB-CD1 3.84Å; K325-L338 HydrophobicContact CD-CD1 4.04Å; K325-L338 HydrophobicContact CG-CD1 4.26Å; K325-H340 WeakPolarHBondContact CA-O 3.46Å; K325-E341 HydrophobicContact CD-CG 4.14Å; K325-E341 WeakPolarHBondContact CE-OE1 3.25Å; K325-E341 HydrophobicContact CG-CB 4.23Å; K325-E341 HydrophobicContact CG-CG 4.07Å; K325-E341 IonicContact NZ-OE1 2.67Å
326	L	96	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.4	173.2	-171.9	71	0	0	0	108.6	L318 V339 H340 V343 F348 I364	L318-L326 HydrophobicContact CB-CD1 4.05Å; L318-L326 HydrophobicContact CD1-CD2 4.39Å; L326-V339 HydrophobicContact CB-CB 4.48Å; L326-V339 HydrophobicContact CD2-CB 4.46Å; L326-V339 HydrophobicContact CD2-CG1 4.49Å; L326-V339 HydrophobicContact CG-CB 4.47Å; L326-V339 WeakPolarHBondContact O-CA 3.4Å; L326-V339 VanDerWaalsContact O-CB 3.28Å; L326-V339 WeakPolarHBondContact O-CB 3.48Å; L326-V339 PolarHBondContact O-N 2.95Å; L326-H340 PolarHBondContact N-O 2.82Å; L326-H340 PolarHBondContact O-N 2.91Å; L326-V343 HydrophobicContact CB-CB 4.37Å; L326-V343 HydrophobicContact CB-CG1 4.36Å; L326-V343 HydrophobicContact CB-CG2 3.71Å; L326-F348 HydrophobicContact CD1-CB 4.23Å; L326-F348 HydrophobicContact CD1-CD1 4.14Å; L326-F348 HydrophobicContact CD1-CD2 3.63Å; L326-F348 HydrophobicContact CD1-CE1 4.45Å; L326-F348 HydrophobicContact CD1-CE2 3.97Å; L326-F348 HydrophobicContact CD1-CG 3.73Å; L326-F348 HydrophobicContact CD1-CZ 4.38Å; L326-F348 HydrophobicContact CD2-CB 3.92Å; L326-F348 HydrophobicContact CD2-CG 4.35Å; L326-I364 HydrophobicContact CD2-CD1 3.75Å; L326-I364 HydrophobicContact CD2-CG1 4.04Å
327	Y	95.6	Very high	94.2	Very high	28 Å²	28	40.3 Å²	40.3	11%	0.11	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	153.4	173.9	-63.9	-95.7	0	0	0	109.8	F302 L318 A319 K325 W336 Q337 L338	F302-Y327 HydrophobicContact CB-CE2 4.19Å; F302-Y327 HydrophobicContact CD1-CD1 4.38Å; F302-Y327 HydrophobicContact CD1-CD2 4.35Å; F302-Y327 HydrophobicContact CD1-CE1 4.16Å; F302-Y327 HydrophobicContact CD1-CE2 4.14Å; F302-Y327 HydrophobicContact CD1-CG 4.47Å; F302-Y327 AromaticContact CD2-CD2 3.75Å; F302-Y327 HydrophobicContact CD2-CD2 3.75Å; F302-Y327 AromaticContact CD2-CE2 3.71Å; F302-Y327 HydrophobicContact CD2-CE2 3.71Å; F302-Y327 HydrophobicContact CD2-CG 4.47Å; F302-Y327 HydrophobicContact CE1-CD1 4.09Å; F302-Y327 HydrophobicContact CE1-CD2 4.24Å; F302-Y327 HydrophobicContact CE1-CE1 4.32Å; F302-Y327 HydrophobicContact CE1-CE2 4.48Å; F302-Y327 HydrophobicContact CE1-CG 4.04Å; F302-Y327 AromaticContact CE2-CD2 3.59Å; F302-Y327 HydrophobicContact CE2-CD2 3.59Å; F302-Y327 HydrophobicContact CE2-CE2 4.06Å; F302-Y327 HydrophobicContact CE2-CG 4.02Å; F302-Y327 HydrophobicContact CG-CD2 4.13Å; F302-Y327 AromaticContact CG-CE2 3.74Å; F302-Y327 HydrophobicContact CG-CE2 3.74Å; F302-Y327 AromaticContact CG-CZ 3.97Å; F302-Y327 HydrophobicContact CZ-CD1 4.31Å; F302-Y327 AromaticContact CZ-CD2 3.87Å; F302-Y327 HydrophobicContact CZ-CD2 3.87Å; F302-Y327 HydrophobicContact CZ-CE2 4.44Å; F302-Y327 AromaticContact CZ-CG 3.8Å; F302-Y327 HydrophobicContact CZ-CG 3.8Å; L318-Y327 CarbonylContact C-O 3.55Å; L318-Y327 VanDerWaalsContact CA-O 3.29Å; L318-Y327 WeakPolarHBondContact CA-O 3.29Å; A319-Y327 PolarHBondContact N-O 3.48Å; A319-Y327 PolarHBondContact O-N 3.21Å; K325-Y327 HydrophobicContact CB-CD2 4.36Å; K325-Y327 HydrophobicContact CB-CE2 3.72Å; K325-Y327 HydrophobicContact CD-CE2 4.49Å; Y327-W336 HydrophobicContact CD1-CB 4.41Å; Y327-Q337 CarbonylContact C-O 2.98Å; Y327-Q337 VanDerWaalsContact CA-O 3.31Å; Y327-Q337 WeakPolarHBondContact CA-O 3.49Å; Y327-L338 HydrophobicContact CD1-CB 4.2Å; Y327-L338 HydrophobicContact CD1-CD1 4.37Å; Y327-L338 HydrophobicContact CE1-CB 4.05Å; Y327-L338 HydrophobicContact CE1-CD1 4.03Å; Y327-L338 HydrophobicContact CE2-CD1 4.42Å
328	S	96.1	Very high	94.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	144.9	170.6	64.9	0	0	0	0	111.2	I317 W336 Q337 V339 A380 Q381	I317-S328 WeakPolarHBondContact O-CA 3.37Å; S328-W336 WeakPolarHBondContact O-CA 3.14Å; S328-Q337 PolarHBondContact N-O 3.31Å; S328-Q337 PolarHBondContact O-N 3.14Å; S328-V339 WeakPolarHBondContact OG-CG2 3.49Å; S328-A380 PolarHBondContact OG-O 2.64Å; S328-Q381 PolarHBondContact OG-NE2 3.08Å
329	S	95.9	Very high	94.1	Very high	1 Å²	1	44 Å²	44	1%	0.007	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	139.4	167.2	177.5	0	0	0	0	108.8	W316 I317 D331 G333 K335	W316-S329 WeakPolarHBondContact CA-O 3.42Å; I317-S329 PolarHBondContact N-O 3.5Å; I317-S329 PolarHBondContact O-N 2.98Å; S329-D331 PolarHBondContact OG-N 3.46Å; S329-D331 PolarHBondContact OG-OD1 3.37Å; S329-G333 WeakPolarHBondContact OG-CA 3.39Å; S329-G333 PolarHBondContact OG-N 2.85Å; S329-K335 WeakPolarHBondContact CA-O 3.49Å; S329-K335 WeakPolarHBondContact CB-O 3.43Å; S329-K335 PolarHBondContact OG-O 3.03Å
330	M	94.8	Very high	94	Very high	36 Å²	36	45.1 Å²	45.1	18%	0.177	21%	0.205	C	C	.	.	S	Bend	trans	-113.4	4.4	173.8	-56.4	-56.3	-174.5	0	0	112.2	N315 W316 W350 D360 A380 Q381	N315-M330 WeakPolarHBondContact CB-O 3.41Å; N315-M330 CarbonylContact O-C 3.58Å; N315-M330 WeakPolarHBondContact O-CA 3.4Å; W316-M330 HydrophobicContact CB-SD 3.81Å; W316-M330 HydrophobicContact CD2-CE 4.37Å; W316-M330 HydrophobicContact CD2-SD 3.45Å; W316-M330 HydrophobicContact CE3-CE 4.43Å; W316-M330 HydrophobicContact CE3-SD 4.06Å; W316-M330 HydrophobicContact CG-SD 3.31Å; M330-W350 HydrophobicContact CE-CH2 3.96Å; M330-W350 HydrophobicContact CE-CZ3 4.23Å; M330-W350 HydrophobicContact SD-CH2 4.38Å; M330-D360 HydrophobicContact CE-CB 4.14Å; M330-A380 HydrophobicContact CE-CB 3.61Å; M330-Q381 HydrophobicContact CE-CG 3.67Å; M330-Q381 VanDerWaalsContact CG-CD 3.45Å; M330-Q381 HydrophobicContact CG-CG 3.62Å
331	D	94.5	Very high	93.9	Very high	53 Å²	53	48.6 Å²	48.6	28%	0.283	22%	0.222	S	C	.	.	S	Bend	trans	-122.8	35.1	179.5	62.2	0.9	0	0	0	112	N315 S329 G333 K334 K335	N315-D331 PolarHBondContact O-N 3.33Å; S329-D331 PolarHBondContact OG-N 3.46Å; S329-D331 PolarHBondContact OG-OD1 3.37Å; D331-G333 VanDerWaalsContact C-N 3.3Å; D331-G333 PolarHBondContact O-N 3.14Å; D331-K334 HydrophobicContact CB-CB 4.47Å; D331-K334 VanDerWaalsContact O-CG 3.31Å; D331-K334 WeakPolarHBondContact O-CG 3.27Å; D331-K334 PolarHBondContact O-N 2.89Å; D331-K334 PolarHBondContact OD1-N 3.07Å; D331-K335 PolarHBondContact OD1-N 2.93Å; D331-K335 WeakPolarHBondContact OD2-CB 3.3Å; D331-K335 WeakPolarHBondContact OD2-CD 3.29Å; D331-K335 WeakPolarHBondContact OD2-CG 3.32Å; D331-K335 PolarHBondContact OD2-N 2.85Å
332	F	94.8	Very high	93.8	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.018	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	29.5	176.3	-159.7	-107.8	0	0	0	115.2	C266 K272 L274 I287 F309 E314 N315 I317	C266-F332 HydrophobicContact CB-CE2 3.64Å; C266-F332 HydrophobicContact CB-CZ 3.81Å; K272-F332 HydrophobicContact CB-CD1 4.37Å; K272-F332 HydrophobicContact CB-CE1 3.79Å; K272-F332 HydrophobicContact CB-CE2 4.11Å; K272-F332 HydrophobicContact CB-CZ 3.64Å; L274-F332 HydrophobicContact CB-CE1 3.88Å; L274-F332 HydrophobicContact CB-CZ 4.05Å; I287-F332 WeakPolarHBondContact CD1-O 3.47Å; I287-F332 HydrophobicContact CG1-CD1 4.28Å; I287-F332 HydrophobicContact CG2-CD1 3.77Å; I287-F332 HydrophobicContact CG2-CE1 4.28Å; F309-F332 HydrophobicContact CD1-CE2 4.11Å; F309-F332 AromaticContact CE1-CE2 3.64Å; F309-F332 HydrophobicContact CE1-CE2 3.64Å; F309-F332 HydrophobicContact CE1-CZ 4.02Å; E314-F332 WeakPolarHBondContact O-CD2 3.39Å; E314-F332 WeakPolarHBondContact O-CE2 3.45Å; N315-F332 HydrophobicContact CB-CB 4.39Å; N315-F332 WeakPolarHBondContact O-CA 3.46Å; N315-F332 PolarHBondContact O-N 3.15Å; I317-F332 HydrophobicContact CD1-CD2 3.75Å; I317-F332 HydrophobicContact CD1-CE2 4.01Å; I317-F332 HydrophobicContact CD1-CG 4.18Å; I317-F332 HydrophobicContact CG1-CD2 4.28Å
333	G	93.2	Very high	94.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	98	4.4	176.7	0	0	0	0	0	115.1	S329 D331 W336	S329-G333 WeakPolarHBondContact OG-CA 3.39Å; S329-G333 PolarHBondContact OG-N 2.85Å; D331-G333 VanDerWaalsContact C-N 3.3Å; D331-G333 PolarHBondContact O-N 3.14Å; G333-W336 VanDerWaalsContact CA-CZ2 3.47Å; G333-W336 PolarHBondContact O-NE1 2.72Å
334	K	93.8	Very high	94.2	Very high	74 Å²	74	43.4 Å²	43.4	32%	0.322	20%	0.199	S	C	.	.	S	Bend	trans	-71.5	-31.5	177.3	-61.7	-173.1	-176.9	-161	0	112.4	I287 E296 F298 D331	I287-K334 HydrophobicContact CD1-CG 3.54Å; E296-K334 WeakPolarHBondContact OE2-CE 3.41Å; E296-K334 IonicContact OE2-NZ 2.83Å; E296-K334 PolarHBondContact OE2-NZ 3Å; F298-K334 HydrophobicContact CD1-CB 4.02Å; F298-K334 HydrophobicContact CD1-CG 4.21Å; F298-K334 HydrophobicContact CD2-CG 4.02Å; F298-K334 HydrophobicContact CE1-CB 3.91Å; F298-K334 HydrophobicContact CE1-CD 4.02Å; F298-K334 HydrophobicContact CE1-CG 3.85Å; F298-K334 HydrophobicContact CE2-CB 4.46Å; F298-K334 HydrophobicContact CE2-CD 3.89Å; F298-K334 HydrophobicContact CE2-CG 3.62Å; F298-K334 HydrophobicContact CG-CB 4.38Å; F298-K334 HydrophobicContact CG-CG 4.3Å; F298-K334 HydrophobicContact CZ-CB 4.16Å; F298-K334 HydrophobicContact CZ-CD 3.5Å; F298-K334 VanDerWaalsContact CZ-CD 3.5Å; F298-K334 HydrophobicContact CZ-CG 3.56Å; D331-K334 HydrophobicContact CB-CB 4.47Å; D331-K334 VanDerWaalsContact O-CG 3.31Å; D331-K334 WeakPolarHBondContact O-CG 3.27Å; D331-K334 PolarHBondContact O-N 2.89Å; D331-K334 PolarHBondContact OD1-N 3.07Å
335	K	94.1	Very high	94	Very high	153 Å²	153	41 Å²	41	67%	0.665	20%	0.198	S	C	*	.	S	Bend	trans	-136.8	145.5	172.6	-62.9	173.4	-170.8	165.6	0	110.6	S329 D331	S329-K335 WeakPolarHBondContact CA-O 3.49Å; S329-K335 WeakPolarHBondContact CB-O 3.43Å; S329-K335 PolarHBondContact OG-O 3.03Å; D331-K335 PolarHBondContact OD1-N 2.93Å; D331-K335 WeakPolarHBondContact OD2-CB 3.3Å; D331-K335 WeakPolarHBondContact OD2-CD 3.29Å; D331-K335 WeakPolarHBondContact OD2-CG 3.32Å; D331-K335 PolarHBondContact OD2-N 2.85Å
336	W	94.9	Very high	93.6	Very high	48 Å²	48	41.3 Å²	41.3	18%	0.182	21%	0.214	C	C	.	.			trans	-124.2	134.5	-178.7	-64.2	94.7	0	0	0	111	F302 L307 I317 A319 Y327 S328 G333	F302-W336 HydrophobicContact CE1-CB 3.84Å; F302-W336 HydrophobicContact CE1-CD2 4.35Å; F302-W336 AromaticContact CE1-CG 3.79Å; F302-W336 HydrophobicContact CE1-CG 3.79Å; F302-W336 HydrophobicContact CZ-CB 4.17Å; F302-W336 AromaticContact CZ-CD2 3.86Å; F302-W336 HydrophobicContact CZ-CD2 3.86Å; F302-W336 HydrophobicContact CZ-CE3 4.26Å; F302-W336 AromaticContact CZ-CG 3.81Å; F302-W336 HydrophobicContact CZ-CG 3.81Å; L307-W336 HydrophobicContact CD2-CH2 4.24Å; I317-W336 HydrophobicContact CB-CH2 4.09Å; I317-W336 HydrophobicContact CB-CZ3 4.44Å; I317-W336 HydrophobicContact CG2-CH2 4.03Å; A319-W336 HydrophobicContact CB-CE3 4Å; A319-W336 HydrophobicContact CB-CH2 3.69Å; A319-W336 HydrophobicContact CB-CZ2 4.45Å; A319-W336 HydrophobicContact CB-CZ3 3.43Å; A319-W336 VanDerWaalsContact CB-CZ3 3.43Å; Y327-W336 HydrophobicContact CD1-CB 4.41Å; S328-W336 WeakPolarHBondContact O-CA 3.14Å; G333-W336 VanDerWaalsContact CA-CZ2 3.47Å; G333-W336 PolarHBondContact O-NE1 2.72Å
337	Q	93.9	Very high	93.4	Very high	76 Å²	76	44.2 Å²	44.2	36%	0.355	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.2	174.1	-176.4	-178.6	-7.9	0	0	109.4	Y327 S328 V339 Q381	Y327-Q337 CarbonylContact C-O 2.98Å; Y327-Q337 VanDerWaalsContact CA-O 3.31Å; Y327-Q337 WeakPolarHBondContact CA-O 3.49Å; S328-Q337 PolarHBondContact N-O 3.31Å; S328-Q337 PolarHBondContact O-N 3.14Å; Q337-V339 PolarHBondContact O-N 2.95Å; Q337-Q381 PolarHBondContact NE2-O 3.49Å; Q337-Q381 VanDerWaalsContact OE1-CD 3.31Å; Q337-Q381 PolarHBondContact OE1-O 3.18Å
338	L	94.3	Very high	93.3	Very high	73 Å²	73	43.5 Å²	43.5	38%	0.382	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	127.4	173.7	-179.7	63.9	0	0	0	110.3	K325 Y327 E341	K325-L338 HydrophobicContact CB-CD1 3.84Å; K325-L338 HydrophobicContact CD-CD1 4.04Å; K325-L338 HydrophobicContact CG-CD1 4.26Å; Y327-L338 HydrophobicContact CD1-CB 4.2Å; Y327-L338 HydrophobicContact CD1-CD1 4.37Å; Y327-L338 HydrophobicContact CE1-CB 4.05Å; Y327-L338 HydrophobicContact CE1-CD1 4.03Å; Y327-L338 HydrophobicContact CE2-CD1 4.42Å; L338-E341 HydrophobicContact CD1-CG 4.31Å; L338-E341 HydrophobicContact CD2-CG 4.02Å
339	V	94.2	Very high	93.3	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-56	177.4	-172.6	0	0	0	0	109.9	L326 S328 Q337 V362 I364 C383	L326-V339 HydrophobicContact CB-CB 4.48Å; L326-V339 HydrophobicContact CD2-CB 4.46Å; L326-V339 HydrophobicContact CD2-CG1 4.49Å; L326-V339 HydrophobicContact CG-CB 4.47Å; L326-V339 WeakPolarHBondContact O-CA 3.4Å; L326-V339 VanDerWaalsContact O-CB 3.28Å; L326-V339 WeakPolarHBondContact O-CB 3.48Å; L326-V339 PolarHBondContact O-N 2.95Å; S328-V339 WeakPolarHBondContact OG-CG2 3.49Å; Q337-V339 PolarHBondContact O-N 2.95Å; V339-V362 HydrophobicContact CG1-CG2 3.98Å; V339-I364 HydrophobicContact CG1-CD1 3.83Å; V339-C383 HydrophobicContact CG1-CB 3.8Å; V339-C383 VanDerWaalsContact O-CB 3.32Å; V339-C383 WeakPolarHBondContact O-CB 3.29Å; V339-C383 PolarHBondContact O-SG 3.47Å
340	H	93.5	Very high	93.2	Very high	23 Å²	23	46.3 Å²	46.3	11%	0.106	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	151.8	-178	-149.7	-73	0	0	0	111.3	K325 L326 V343 I364 T366 R388	K325-H340 WeakPolarHBondContact CA-O 3.46Å; L326-H340 PolarHBondContact N-O 2.82Å; L326-H340 PolarHBondContact O-N 2.91Å; H340-V343 HydrophobicContact CB-CG2 3.89Å; H340-I364 HydrophobicContact CB-CD1 4.08Å; H340-T366 WeakPolarHBondContact ND1-CG2 3.47Å; H340-R388 PolarHBondContact NE2-NH1 2.99Å
341	E	92.8	Very high	93	Very high	86 Å²	86	44.8 Å²	44.8	40%	0.402	23%	0.226	S	C	.	.	S	Bend	trans	-103.4	163.9	173.4	-53.2	-167.8	135.2	0	0	111.3	Y324 K325 L338 V343	Y324-E341 CarbonylContact O-C 3.47Å; K325-E341 HydrophobicContact CD-CG 4.14Å; K325-E341 WeakPolarHBondContact CE-OE1 3.25Å; K325-E341 HydrophobicContact CG-CB 4.23Å; K325-E341 HydrophobicContact CG-CG 4.07Å; K325-E341 IonicContact NZ-OE1 2.67Å; L338-E341 HydrophobicContact CD1-CG 4.31Å; L338-E341 HydrophobicContact CD2-CG 4.02Å; E341-V343 PolarHBondContact O-N 3.11Å
342	N	92.6	Very high	92.7	Very high	89 Å²	89	44.5 Å²	44.5	48%	0.476	23%	0.226	S	C	.	.	S	Bend	trans	57.7	33.3	-179	-54.9	-74.3	0	0	0	113.8	Y324 R367	Y324-N342 CarbonylContact O-C 3.52Å; Y324-N342 WeakPolarHBondContact O-CA 3.44Å; Y324-N342 PolarHBondContact O-N 2.98Å; N342-R367 HydrophobicContact CB-CB 4.25Å; N342-R367 WeakPolarHBondContact O-CB 3.46Å; N342-R367 PolarHBondContact O-N 2.91Å
343	V	94.1	Very high	92.1	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	142.5	178.1	175.7	0	0	0	0	109.7	Y320 Y324 L326 H340 E341 F348 I364	Y320-V343 HydrophobicContact CD2-CB 4.45Å; Y320-V343 HydrophobicContact CD2-CG1 4.18Å; Y320-V343 HydrophobicContact CE2-CB 4.19Å; Y320-V343 HydrophobicContact CE2-CG1 4.18Å; Y324-V343 PolarHBondContact O-N 3.32Å; L326-V343 HydrophobicContact CB-CB 4.37Å; L326-V343 HydrophobicContact CB-CG1 4.36Å; L326-V343 HydrophobicContact CB-CG2 3.71Å; H340-V343 HydrophobicContact CB-CG2 3.89Å; E341-V343 PolarHBondContact O-N 3.11Å; V343-F348 HydrophobicContact CG1-CB 4.42Å; V343-F348 HydrophobicContact CG1-CD1 4.19Å; V343-I364 HydrophobicContact CB-CG2 4.32Å; V343-I364 HydrophobicContact CG1-CG2 3.81Å; V343-I364 HydrophobicContact CG2-CG2 3.78Å
344	M	91.7	Very high	91.6	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	137.4	178.7	-64.6	-66.5	-155.7	0	0	111.7	G346 R347 E365 R367 A373 T398	M344-G346 PolarHBondContact O-N 2.74Å; M344-R347 HydrophobicContact CB-CB 3.87Å; M344-R347 HydrophobicContact CB-CG 4.12Å; M344-R347 PolarHBondContact O-N 3.08Å; M344-R347 VanDerWaalsContact O-N 3.15Å; M344-E365 HydrophobicContact CB-CB 4.26Å; M344-E365 HydrophobicContact CB-CG 4.46Å; M344-E365 WeakPolarHBondContact CB-OE2 3.38Å; M344-E365 HydrophobicContact CG-CB 4.3Å; M344-E365 HydrophobicContact CG-CG 4.05Å; M344-E365 VanDerWaalsContact CG-OE2 3.31Å; M344-E365 WeakPolarHBondContact CG-OE2 3.19Å; M344-E365 PolarHBondContact N-O 2.98Å; M344-R367 HydrophobicContact CE-CB 3.53Å; M344-R367 HydrophobicContact CE-CG 3.77Å; M344-R367 HydrophobicContact SD-CB 3.93Å; M344-R367 HydrophobicContact SD-CG 4.43Å; M344-R367 VanDerWaalsContact SD-CZ 3.57Å; M344-R367 PolarHBondContact SD-NE 3.38Å; M344-R367 VanDerWaalsContact SD-NE 3.45Å; M344-R367 PolarHBondContact SD-NH2 3.07Å; M344-A373 HydrophobicContact CE-CB 4.04Å; M344-T398 HydrophobicContact CE-CG2 3.35Å
345	P	88.4	Confident	91.3	Very high	66 Å²	66	52.3 Å²	52.3	43%	0.429	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	128.7	179.6	-23	30.2	0	0	0	112.2	R347	P345-R347 PolarHBondContact O-N 3.43Å; P345-R347 VanDerWaalsContact O-N 3.17Å
346	G	86.2	Confident	90.8	Very high	52 Å²	52	45.6 Å²	45.6	54%	0.536	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.5	7.4	178.3	0	0	0	0	0	115.9	M344	M344-G346 PolarHBondContact O-N 2.74Å
347	R	92.5	Very high	90.2	Very high	61 Å²	61	54.3 Å²	54.3	23%	0.23	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	47.4	-176.9	-63.8	-71.1	-177.2	-147.7	4.8	112	M344 P345 Y349 E365 N399 L401	M344-R347 HydrophobicContact CB-CB 3.87Å; M344-R347 HydrophobicContact CB-CG 4.12Å; M344-R347 PolarHBondContact O-N 3.08Å; M344-R347 VanDerWaalsContact O-N 3.15Å; P345-R347 PolarHBondContact O-N 3.43Å; P345-R347 VanDerWaalsContact O-N 3.17Å; R347-Y349 PolarHBondContact NH1-OH 3.29Å; R347-Y349 VanDerWaalsContact NH1-OH 3.14Å; R347-E365 HydrophobicContact CB-CB 3.71Å; R347-E365 PolarHBondContact O-N 3.49Å; R347-N399 VanDerWaalsContact CZ-O 3.29Å; R347-N399 PolarHBondContact NE-O 3.29Å; R347-N399 VanDerWaalsContact NE-O 3.09Å; R347-N399 PolarHBondContact NH2-O 2.84Å; R347-L401 WeakPolarHBondContact CD-O 3.47Å; R347-L401 PolarHBondContact NE-O 2.79Å; R347-L401 PolarHBondContact NH1-O 2.82Å
348	F	94	Very high	89.9	Confident	12 Å²	12	54.1 Å²	54.1	5%	0.053	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	133.9	174.7	57.2	-89.1	0	0	0	109.9	L308 L318 Y320 L326 V343 H363	L308-F348 HydrophobicContact CB-CD2 4.49Å; L308-F348 HydrophobicContact CB-CE2 3.87Å; L308-F348 HydrophobicContact CD2-CD2 4.14Å; L308-F348 HydrophobicContact CD2-CE2 4.25Å; L318-F348 HydrophobicContact CD1-CD2 4.1Å; Y320-F348 HydrophobicContact CD2-CD1 4.27Å; Y320-F348 AromaticContact CD2-CE1 3.89Å; Y320-F348 HydrophobicContact CD2-CE1 3.89Å; Y320-F348 AromaticContact CG-CE1 3.78Å; Y320-F348 HydrophobicContact CG-CE1 3.78Å; Y320-F348 HydrophobicContact CG-CZ 4.28Å; L326-F348 HydrophobicContact CD1-CB 4.23Å; L326-F348 HydrophobicContact CD1-CD1 4.14Å; L326-F348 HydrophobicContact CD1-CD2 3.63Å; L326-F348 HydrophobicContact CD1-CE1 4.45Å; L326-F348 HydrophobicContact CD1-CE2 3.97Å; L326-F348 HydrophobicContact CD1-CG 3.73Å; L326-F348 HydrophobicContact CD1-CZ 4.38Å; L326-F348 HydrophobicContact CD2-CB 3.92Å; L326-F348 HydrophobicContact CD2-CG 4.35Å; V343-F348 HydrophobicContact CG1-CB 4.42Å; V343-F348 HydrophobicContact CG1-CD1 4.19Å; F348-H363 CarbonylContact C-O 3.53Å; F348-H363 VanDerWaalsContact CA-O 3.3Å; F348-H363 WeakPolarHBondContact CA-O 3.4Å
349	Y	95.1	Very high	89.6	Confident	47 Å²	47	52.9 Å²	52.9	18%	0.184	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146	-171.1	-52.1	-90.2	0	0	0	111	R347 V362 H363 L401 V403	R347-Y349 PolarHBondContact NH1-OH 3.29Å; R347-Y349 VanDerWaalsContact NH1-OH 3.14Å; Y349-V362 WeakPolarHBondContact O-CA 3.39Å; Y349-H363 PolarHBondContact N-O 2.83Å; Y349-H363 PolarHBondContact O-N 2.89Å; Y349-L401 HydrophobicContact CD2-CD2 4.46Å; Y349-L401 HydrophobicContact CE2-CD2 4.41Å; Y349-L401 HydrophobicContact CE2-CG 4.25Å; Y349-L401 PolarHBondContact OH-O 2.84Å; Y349-V403 HydrophobicContact CD1-CB 4.26Å; Y349-V403 HydrophobicContact CD2-CB 3.8Å; Y349-V403 HydrophobicContact CD2-CG2 3.74Å; Y349-V403 HydrophobicContact CE2-CB 4.39Å; Y349-V403 HydrophobicContact CE2-CG2 4.32Å; Y349-V403 HydrophobicContact CG-CB 3.74Å; Y349-V403 HydrophobicContact CG-CG2 4.16Å
350	W	94.4	Very high	89.4	Confident	13 Å²	13	53.3 Å²	53.3	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	162.2	169.3	-75.6	113.8	0	0	0	112	L308 F309 H310 W316 L318 M330 V362 A380	L308-W350 HydrophobicContact CD2-CG 4.5Å; L308-W350 PolarHBondContact O-NE1 2.92Å; F309-W350 PolarHBondContact O-NE1 2.78Å; H310-W350 HydrophobicContact CB-CD2 4.12Å; H310-W350 HydrophobicContact CB-CG 4.42Å; H310-W350 HydrophobicContact CB-CZ2 3.93Å; H310-W350 AromaticContact CD2-CD2 3.68Å; H310-W350 AromaticContact CD2-CE3 3.68Å; H310-W350 AromaticContact CD2-CG 3.98Å; W316-W350 HydrophobicContact CB-CH2 4.16Å; W316-W350 HydrophobicContact CB-CZ2 4.21Å; W316-W350 HydrophobicContact CE3-CZ3 4.47Å; L318-W350 HydrophobicContact CD1-CD2 4.16Å; L318-W350 HydrophobicContact CD1-CZ2 4.29Å; L318-W350 HydrophobicContact CD2-CH2 3.73Å; L318-W350 HydrophobicContact CD2-CZ2 3.71Å; L318-W350 HydrophobicContact CD2-CZ3 4.26Å; L318-W350 HydrophobicContact CG-CD2 4.28Å; L318-W350 HydrophobicContact CG-CH2 4.05Å; L318-W350 HydrophobicContact CG-CZ2 3.51Å; M330-W350 HydrophobicContact CE-CH2 3.96Å; M330-W350 HydrophobicContact CE-CZ3 4.23Å; M330-W350 HydrophobicContact SD-CH2 4.38Å; W350-V362 HydrophobicContact CD2-CG1 4.36Å; W350-V362 HydrophobicContact CE3-CG1 3.64Å; W350-V362 HydrophobicContact CZ3-CG1 3.81Å; W350-A380 HydrophobicContact CZ3-CB 4.22Å
351	A	90.6	Very high	89.3	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.033	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-52.6	141.1	166.7	0	0	0	0	0	112.4	D356 V361	A351-D356 HydrophobicContact CB-CB 3.87Å; A351-V361 HydrophobicContact CB-CB 3.9Å; A351-V361 HydrophobicContact CB-CG1 4.08Å; A351-V361 PolarHBondContact N-O 3.44Å
352	V	88.1	Confident	89.4	Confident	47 Å²	47	48.3 Å²	48.3	29%	0.285	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-92.2	119.3	169	179.8	0	0	0	0	108.9	G354 L355 D356 R426	V352-G354 PolarHBondContact O-N 3.16Å; V352-L355 HydrophobicContact CB-CD1 4.17Å; V352-L355 HydrophobicContact CG1-CD1 3.83Å; V352-L355 HydrophobicContact CG1-CG 4.44Å; V352-L355 PolarHBondContact O-N 3.13Å; V352-L355 VanDerWaalsContact O-N 3.17Å; V352-D356 PolarHBondContact N-OD2 3.1Å; V352-D356 PolarHBondContact O-N 3.11Å; V352-R426 VanDerWaalsContact CB-NH2 3.28Å
353	M	82.2	Confident	89.5	Confident	117 Å²	117	44 Å²	44	58%	0.576	25%	0.246	S	C	*	.	B	Isolated β-bridge	trans	-57.3	136.2	-176	-63.8	-164	-63.2	0	0	112.1	A312 L355	A312-M353 HydrophobicContact CB-CE 3.47Å; A312-M353 VanDerWaalsContact CB-CE 3.47Å; A312-M353 HydrophobicContact CB-SD 3.45Å; A312-M353 WeakPolarHBondContact CB-SD 3.15Å; M353-L355 PolarHBondContact O-N 3.12Å
354	G	83.3	Confident	89.6	Confident	83 Å²	83	44 Å²	44	86%	0.856	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.5	-11.7	-179.4	0	0	0	0	0	115	V352	V352-G354 PolarHBondContact O-N 3.16Å
355	L	85.7	Confident	89.7	Confident	42 Å²	42	44 Å²	44	22%	0.22	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-52.1	172.9	-64	174.6	0	0	0	111.5	V352 M353 D405 E406 M425	V352-L355 HydrophobicContact CB-CD1 4.17Å; V352-L355 HydrophobicContact CG1-CD1 3.83Å; V352-L355 HydrophobicContact CG1-CG 4.44Å; V352-L355 PolarHBondContact O-N 3.13Å; V352-L355 VanDerWaalsContact O-N 3.17Å; M353-L355 PolarHBondContact O-N 3.12Å; L355-D405 WeakPolarHBondContact CD1-O 3.43Å; L355-E406 HydrophobicContact CD1-CB 4.36Å; L355-E406 HydrophobicContact CD1-CG 4.03Å; L355-E406 HydrophobicContact CD2-CG 4.44Å; L355-M425 HydrophobicContact CD2-CE 4.19Å; L355-M425 HydrophobicContact CD2-CG 4.48Å
356	D	85.6	Confident	89.9	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.064	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-82.2	137.3	173.2	-71.2	-73.7	0	0	0	109.8	A351 V352 H363 K377 R426	A351-D356 HydrophobicContact CB-CB 3.87Å; V352-D356 PolarHBondContact N-OD2 3.1Å; V352-D356 PolarHBondContact O-N 3.11Å; D356-H363 IonicContact OD1-CE1 3.85Å; D356-H363 PolarHBondContact OD1-CE1 2.98Å; D356-H363 IonicContact OD1-NE2 3.83Å; D356-H363 IonicContact OD2-CE1 3.32Å; D356-H363 IonicContact OD2-NE2 2.68Å; D356-H363 PolarHBondContact OD2-NE2 2.83Å; D356-K377 IonicContact OD1-NZ 3.9Å; D356-K377 PolarHBondContact OD1-NZ 3.14Å; D356-R426 IonicContact OD1-NE 2.72Å; D356-R426 IonicContact OD2-CZ 2.92Å; D356-R426 VanDerWaalsContact OD2-CZ 3.26Å; D356-R426 IonicContact OD2-NE 3.6Å; D356-R426 PolarHBondContact OD2-NE 3Å; D356-R426 IonicContact OD2-NH2 2.84Å; D356-R426 PolarHBondContact OD2-NH2 3.19Å
357	R	81.2	Confident	90.2	Very high	232 Å²	232	43.8 Å²	43.8	88%	0.875	22%	0.22	S	C	*	.	S	Bend	trans	-68.7	-40.4	-170.4	-71.1	-179.3	179.8	-179.8	0.2	113.5
358	E	87.6	Confident	90	Very high	71 Å²	71	44.9 Å²	44.9	33%	0.332	23%	0.23	S	C	.	.	S	Bend	trans	-112.8	136	179	-51.6	77.3	-163.7	0	0	109.5	V361	E358-V361 HydrophobicContact CB-CG2 4.23Å; E358-V361 WeakPolarHBondContact O-CB 3.4Å; E358-V361 PolarHBondContact O-N 2.76Å
359	S	87.1	Confident	89.4	Confident	48 Å²	48	46.6 Å²	46.6	34%	0.336	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.9	-178.5	51.7	0	0	0	0	113.9	H310 W316 V361	H310-S359 PolarHBondContact NE2-O 3.43Å; W316-S359 WeakPolarHBondContact CH2-OG 3.38Å; W316-S359 WeakPolarHBondContact CZ3-OG 3.25Å; S359-V361 PolarHBondContact O-N 2.87Å
360	D	90.4	Very high	88.7	Confident	14 Å²	14	54.4 Å²	54.4	8%	0.075	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	9.9	177.1	70.2	-35.7	0	0	0	112.9	W316 M330 R379 A380	W316-D360 HydrophobicContact CH2-CB 3.94Å; W316-D360 HydrophobicContact CZ3-CB 3.74Å; M330-D360 HydrophobicContact CE-CB 4.14Å; D360-R379 VanDerWaalsContact CG-NE 3.27Å; D360-R379 CarbonylContact O-C 3.6Å; D360-R379 WeakPolarHBondContact O-CA 3.37Å; D360-R379 IonicContact OD1-CZ 3.77Å; D360-R379 IonicContact OD1-NE 3.28Å; D360-R379 PolarHBondContact OD1-NE 3.49Å; D360-R379 IonicContact OD1-NH2 3.07Å; D360-R379 PolarHBondContact OD1-NH2 3.17Å; D360-R379 IonicContact OD2-CZ 2.68Å; D360-R379 VanDerWaalsContact OD2-CZ 3.26Å; D360-R379 IonicContact OD2-NE 3.53Å; D360-R379 PolarHBondContact OD2-NE 2.8Å; D360-R379 IonicContact OD2-NH2 3Å; D360-R379 PolarHBondContact OD2-NH2 2.8Å; D360-A380 PolarHBondContact O-N 2.79Å
361	V	92.9	Very high	88	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.018	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140.4	168.7	151.9	0	0	0	0	110.7	A351 E358 S359 H363 K377 C378 R379	A351-V361 HydrophobicContact CB-CB 3.9Å; A351-V361 HydrophobicContact CB-CG1 4.08Å; A351-V361 PolarHBondContact N-O 3.44Å; E358-V361 HydrophobicContact CB-CG2 4.23Å; E358-V361 WeakPolarHBondContact O-CB 3.4Å; E358-V361 PolarHBondContact O-N 2.76Å; S359-V361 PolarHBondContact O-N 2.87Å; V361-H363 WeakPolarHBondContact CG1-NE2 3.36Å; V361-K377 HydrophobicContact CG1-CD 4.16Å; V361-K377 HydrophobicContact CG1-CG 4.06Å; V361-C378 WeakPolarHBondContact CA-O 3.31Å; V361-R379 HydrophobicContact CG2-CG 4.18Å
362	V	94.6	Very high	87.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.5	172.2	-70.4	0	0	0	0	110.5	L318 V339 Y349 W350 I364 K377 C378 A380	L318-V362 HydrophobicContact CD1-CG1 3.8Å; L318-V362 HydrophobicContact CD2-CG1 4.06Å; V339-V362 HydrophobicContact CG1-CG2 3.98Å; Y349-V362 WeakPolarHBondContact O-CA 3.39Å; W350-V362 HydrophobicContact CD2-CG1 4.36Å; W350-V362 HydrophobicContact CE3-CG1 3.64Å; W350-V362 HydrophobicContact CZ3-CG1 3.81Å; V362-I364 HydrophobicContact CB-CG1 4.36Å; V362-I364 HydrophobicContact CG2-CD1 3.92Å; V362-I364 HydrophobicContact CG2-CG1 4.24Å; V362-K377 WeakPolarHBondContact O-CA 3.49Å; V362-C378 WeakPolarHBondContact CG2-O 3.26Å; V362-C378 PolarHBondContact N-O 2.95Å; V362-C378 PolarHBondContact O-N 3.11Å; V362-C378 VanDerWaalsContact O-N 3.16Å; V362-A380 HydrophobicContact CG1-CB 3.97Å; V362-A380 HydrophobicContact CG2-CB 4.31Å
363	H	94.7	Very high	88	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.4	179	-57	-98.1	0	0	0	107.8	F348 Y349 D356 V361 Y375 V403	F348-H363 CarbonylContact C-O 3.53Å; F348-H363 VanDerWaalsContact CA-O 3.3Å; F348-H363 WeakPolarHBondContact CA-O 3.4Å; Y349-H363 PolarHBondContact N-O 2.83Å; Y349-H363 PolarHBondContact O-N 2.89Å; D356-H363 IonicContact OD1-CE1 3.85Å; D356-H363 PolarHBondContact OD1-CE1 2.98Å; D356-H363 IonicContact OD1-NE2 3.83Å; D356-H363 IonicContact OD2-CE1 3.32Å; D356-H363 IonicContact OD2-NE2 2.68Å; D356-H363 PolarHBondContact OD2-NE2 2.83Å; V361-H363 WeakPolarHBondContact CG1-NE2 3.36Å; H363-Y375 HydrophobicContact CB-CE2 3.95Å; H363-Y375 AromaticContact ND1-CE2 3.91Å; H363-Y375 AromaticContact ND1-CZ 3.81Å; H363-Y375 PolarHBondContact ND1-OH 3.16Å; H363-V403 HydrophobicContact CB-CG2 3.82Å
364	I	94.7	Very high	88.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.9	-166.4	-49.6	176.8	0	0	0	109.6	L326 V339 H340 V343 V362 T366 V376	L326-I364 HydrophobicContact CD2-CD1 3.75Å; L326-I364 HydrophobicContact CD2-CG1 4.04Å; V339-I364 HydrophobicContact CG1-CD1 3.83Å; H340-I364 HydrophobicContact CB-CD1 4.08Å; V343-I364 HydrophobicContact CB-CG2 4.32Å; V343-I364 HydrophobicContact CG1-CG2 3.81Å; V343-I364 HydrophobicContact CG2-CG2 3.78Å; V362-I364 HydrophobicContact CB-CG1 4.36Å; V362-I364 HydrophobicContact CG2-CD1 3.92Å; V362-I364 HydrophobicContact CG2-CG1 4.24Å; I364-T366 HydrophobicContact CB-CG2 4.31Å; I364-T366 HydrophobicContact CG2-CG2 3.65Å; I364-V376 PolarHBondContact N-O 2.8Å; I364-V376 PolarHBondContact O-N 3.21Å
365	E	94.9	Very high	88.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	124.1	163.4	-166.5	-176.9	-101.8	0	0	110.4	M344 R347 A373 Q374 N399 S400 L401	M344-E365 HydrophobicContact CB-CB 4.26Å; M344-E365 HydrophobicContact CB-CG 4.46Å; M344-E365 WeakPolarHBondContact CB-OE2 3.38Å; M344-E365 HydrophobicContact CG-CB 4.3Å; M344-E365 HydrophobicContact CG-CG 4.05Å; M344-E365 VanDerWaalsContact CG-OE2 3.31Å; M344-E365 WeakPolarHBondContact CG-OE2 3.19Å; M344-E365 PolarHBondContact N-O 2.98Å; R347-E365 HydrophobicContact CB-CB 3.71Å; R347-E365 PolarHBondContact O-N 3.49Å; E365-A373 HydrophobicContact CG-CB 3.76Å; E365-Q374 WeakPolarHBondContact CA-O 3.29Å; E365-N399 WeakPolarHBondContact OE2-CA 3.45Å; E365-N399 PolarHBondContact OE2-N 3.3Å; E365-S400 PolarHBondContact OE1-N 2.84Å; E365-S400 PolarHBondContact OE1-OG 2.87Å; E365-L401 HydrophobicContact CB-CB 3.88Å; E365-L401 HydrophobicContact CB-CD2 3.93Å; E365-L401 HydrophobicContact CG-CB 4.24Å; E365-L401 PolarHBondContact OE1-N 2.91Å
366	T	92.6	Very high	89.2	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134	-172.8	63.7	0	0	0	0	111.1	H340 I364 A373 Q374 V376	H340-T366 WeakPolarHBondContact ND1-CG2 3.47Å; I364-T366 HydrophobicContact CB-CG2 4.31Å; I364-T366 HydrophobicContact CG2-CG2 3.65Å; T366-A373 CarbonylContact O-C 3.49Å; T366-A373 WeakPolarHBondContact O-CA 3.32Å; T366-A373 WeakPolarHBondContact O-CB 3.32Å; T366-Q374 PolarHBondContact N-O 3.31Å; T366-Q374 PolarHBondContact O-N 3.39Å; T366-Q374 PolarHBondContact OG1-O 2.95Å; T366-V376 HydrophobicContact CG2-CB 4.3Å; T366-V376 HydrophobicContact CG2-CG2 3.8Å
367	R	91.4	Very high	89.5	Confident	109 Å²	109	51.9 Å²	51.9	41%	0.411	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133	-178.7	-173.4	179.7	-66.4	-99.4	-1.3	110.9	N342 M344	N342-R367 HydrophobicContact CB-CB 4.25Å; N342-R367 WeakPolarHBondContact O-CB 3.46Å; N342-R367 PolarHBondContact O-N 2.91Å; M344-R367 HydrophobicContact CE-CB 3.53Å; M344-R367 HydrophobicContact CE-CG 3.77Å; M344-R367 HydrophobicContact SD-CB 3.93Å; M344-R367 HydrophobicContact SD-CG 4.43Å; M344-R367 VanDerWaalsContact SD-CZ 3.57Å; M344-R367 PolarHBondContact SD-NE 3.38Å; M344-R367 VanDerWaalsContact SD-NE 3.45Å; M344-R367 PolarHBondContact SD-NH2 3.07Å
368	I	88.1	Confident	90.1	Very high	83 Å²	83	41 Å²	41	43%	0.426	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	-47.8	177.2	-50.8	166.4	0	0	0	110.1	R372 Q374 H395	I368-R372 PolarHBondContact N-O 2.91Å; I368-R372 VanDerWaalsContact N-O 3.08Å; I368-Q374 HydrophobicContact CD1-CB 3.88Å; I368-Q374 VanDerWaalsContact CD1-CD 3.47Å; I368-Q374 HydrophobicContact CD1-CG 3.61Å; I368-H395 WeakPolarHBondContact CD1-ND1 3.47Å
369	A	82.8	Confident	90.3	Very high	49 Å²	49	42.4 Å²	42.4	41%	0.405	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	177	-177.2	0	0	0	0	0	110.9	G371 R372	A369-G371 PolarHBondContact O-N 3.05Å; A369-G371 VanDerWaalsContact O-N 3.15Å; A369-R372 HydrophobicContact CB-CB 4.36Å; A369-R372 PolarHBondContact N-O 2.95Å; A369-R372 PolarHBondContact O-N 2.74Å
370	K	78.9	Confident	90.4	Very high	210 Å²	210	40.1 Å²	40.1	91%	0.913	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	119	171.3	-68.1	-176.5	178.4	180	0	109.2	R372	K370-R372 VanDerWaalsContact C-N 3.3Å; K370-R372 PolarHBondContact O-N 3.33Å
371	G	79.6	Confident	90.3	Very high	44 Å²	44	42.6 Å²	42.6	45%	0.454	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	12	-179	0	0	0	0	0	115.8	A369	A369-G371 PolarHBondContact O-N 3.05Å; A369-G371 VanDerWaalsContact O-N 3.15Å
372	R	87.8	Confident	90.1	Very high	144 Å²	144	50.2 Å²	50.2	54%	0.543	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	131.6	174.8	-62.8	-174.6	-176.5	178.5	2	112.7	I368 A369 K370 H395	I368-R372 PolarHBondContact N-O 2.91Å; I368-R372 VanDerWaalsContact N-O 3.08Å; A369-R372 HydrophobicContact CB-CB 4.36Å; A369-R372 PolarHBondContact N-O 2.95Å; A369-R372 PolarHBondContact O-N 2.74Å; K370-R372 VanDerWaalsContact C-N 3.3Å; K370-R372 PolarHBondContact O-N 3.33Å; R372-H395 HydrophobicContact CB-CB 4.5Å
373	A	92.3	Very high	89.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	175.1	174.5	0	0	0	0	0	111.9	M344 E365 T366 H395 V396 T398	M344-A373 HydrophobicContact CE-CB 4.04Å; E365-A373 HydrophobicContact CG-CB 3.76Å; T366-A373 CarbonylContact O-C 3.49Å; T366-A373 WeakPolarHBondContact O-CA 3.32Å; T366-A373 WeakPolarHBondContact O-CB 3.32Å; A373-H395 WeakPolarHBondContact O-CA 3.42Å; A373-V396 HydrophobicContact CB-CG2 3.99Å; A373-V396 PolarHBondContact N-O 2.62Å; A373-V396 PolarHBondContact O-N 2.96Å; A373-T398 HydrophobicContact CB-CG2 4.3Å
374	Q	91.6	Very high	89.4	Confident	50 Å²	50	54.6 Å²	54.6	23%	0.234	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.3	167.3	-103	160.6	-1.6	0	0	110.3	E365 T366 I368 V376 Y390	E365-Q374 WeakPolarHBondContact CA-O 3.29Å; T366-Q374 PolarHBondContact N-O 3.31Å; T366-Q374 PolarHBondContact O-N 3.39Å; T366-Q374 PolarHBondContact OG1-O 2.95Å; I368-Q374 HydrophobicContact CD1-CB 3.88Å; I368-Q374 VanDerWaalsContact CD1-CD 3.47Å; I368-Q374 HydrophobicContact CD1-CG 3.61Å; Q374-V376 HydrophobicContact CB-CG2 4.44Å; Q374-Y390 HydrophobicContact CB-CD1 4.44Å; Q374-Y390 HydrophobicContact CB-CE1 4.42Å; Q374-Y390 HydrophobicContact CG-CD1 4.16Å; Q374-Y390 HydrophobicContact CG-CE1 4.33Å
375	Y	93.1	Very high	88.8	Confident	6 Å²	6	62.2 Å²	62.2	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.7	164.4	169	-146.5	0	0	0	108.9	H363 L391 F392 L401 V408 F429	H363-Y375 HydrophobicContact CB-CE2 3.95Å; H363-Y375 AromaticContact ND1-CE2 3.91Å; H363-Y375 AromaticContact ND1-CZ 3.81Å; H363-Y375 PolarHBondContact ND1-OH 3.16Å; Y375-L391 HydrophobicContact CD1-CB 4.11Å; Y375-L391 HydrophobicContact CE1-CB 3.75Å; Y375-L391 HydrophobicContact CE1-CD1 3.94Å; Y375-L391 HydrophobicContact CE1-CG 4.38Å; Y375-F392 HydrophobicContact CD1-CB 4.46Å; Y375-L401 HydrophobicContact CD1-CD1 4.34Å; Y375-L401 HydrophobicContact CD2-CD1 3.77Å; Y375-L401 HydrophobicContact CD2-CD2 3.75Å; Y375-L401 HydrophobicContact CD2-CG 4.45Å; Y375-L401 HydrophobicContact CE2-CD1 4.11Å; Y375-L401 HydrophobicContact CE2-CD2 4.23Å; Y375-L401 HydrophobicContact CG-CD1 3.92Å; Y375-V408 HydrophobicContact CE1-CG1 4.05Å; Y375-F429 AromaticContact CD1-CE2 3.82Å; Y375-F429 HydrophobicContact CD1-CE2 3.82Å; Y375-F429 AromaticContact CD1-CZ 3.7Å; Y375-F429 HydrophobicContact CD1-CZ 3.7Å; Y375-F429 AromaticContact CE1-CE2 3.75Å; Y375-F429 HydrophobicContact CE1-CE2 3.75Å; Y375-F429 AromaticContact CE1-CZ 3.61Å; Y375-F429 HydrophobicContact CE1-CZ 3.61Å
376	V	92.2	Very high	88	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.1	178.2	-178.1	0	0	0	0	109.2	I364 T366 Q374 R388 Y390	I364-V376 PolarHBondContact N-O 2.8Å; I364-V376 PolarHBondContact O-N 3.21Å; T366-V376 HydrophobicContact CG2-CB 4.3Å; T366-V376 HydrophobicContact CG2-CG2 3.8Å; Q374-V376 HydrophobicContact CB-CG2 4.44Å; V376-R388 HydrophobicContact CG1-CB 4.05Å; V376-R388 HydrophobicContact CG1-CG 3.83Å; V376-Y390 HydrophobicContact CG2-CD1 4.27Å; V376-Y390 HydrophobicContact CG2-CE1 3.78Å
377	K	91.8	Very high	87.6	Confident	21 Å²	21	69 Å²	69	9%	0.091	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.2	164.6	173.2	173.1	173	159.5	0	108.9	D356 V361 V362 Q389 L391	D356-K377 IonicContact OD1-NZ 3.9Å; D356-K377 PolarHBondContact OD1-NZ 3.14Å; V361-K377 HydrophobicContact CG1-CD 4.16Å; V361-K377 HydrophobicContact CG1-CG 4.06Å; V362-K377 WeakPolarHBondContact O-CA 3.49Å; K377-Q389 HydrophobicContact CB-CB 4.26Å; K377-Q389 PolarHBondContact N-O 3Å; K377-Q389 WeakPolarHBondContact O-CB 3.29Å; K377-Q389 PolarHBondContact O-N 2.87Å; K377-L391 HydrophobicContact CB-CD1 4.14Å; K377-L391 HydrophobicContact CB-CG 4.44Å; K377-L391 HydrophobicContact CD-CD1 3.78Å
378	C	92.1	Very high	87.4	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.02	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	177.3	174.2	63.3	0	0	0	0	110.3	V361 V362 C383 R388	V361-C378 WeakPolarHBondContact CA-O 3.31Å; V362-C378 WeakPolarHBondContact CG2-O 3.26Å; V362-C378 PolarHBondContact N-O 2.95Å; V362-C378 PolarHBondContact O-N 3.11Å; V362-C378 VanDerWaalsContact O-N 3.16Å; C378-C383 HydrophobicContact CB-CB 3.79Å; C378-C383 WeakPolarHBondContact CB-SG 3.43Å; C378-C383 WeakPolarHBondContact SG-CB 3.34Å; C378-C383 CovalentContact SG-SG 2.04Å; C378-C383 PolarHBondContact SG-SG 2.56Å; C378-R388 HydrophobicContact CB-CG 4.31Å
379	R	92.4	Very high	87.3	Confident	102 Å²	102	67.2 Å²	67.2	39%	0.385	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.2	170.6	-68.6	179.6	62.5	159.6	4.6	109.4	D360 V361 Q381 R382 C383	D360-R379 VanDerWaalsContact CG-NE 3.27Å; D360-R379 CarbonylContact O-C 3.6Å; D360-R379 WeakPolarHBondContact O-CA 3.37Å; D360-R379 IonicContact OD1-CZ 3.77Å; D360-R379 IonicContact OD1-NE 3.28Å; D360-R379 PolarHBondContact OD1-NE 3.49Å; D360-R379 IonicContact OD1-NH2 3.07Å; D360-R379 PolarHBondContact OD1-NH2 3.17Å; D360-R379 IonicContact OD2-CZ 2.68Å; D360-R379 VanDerWaalsContact OD2-CZ 3.26Å; D360-R379 IonicContact OD2-NE 3.53Å; D360-R379 PolarHBondContact OD2-NE 2.8Å; D360-R379 IonicContact OD2-NH2 3Å; D360-R379 PolarHBondContact OD2-NH2 2.8Å; V361-R379 HydrophobicContact CG2-CG 4.18Å; R379-Q381 VanDerWaalsContact C-N 3.31Å; R379-Q381 PolarHBondContact O-N 2.91Å; R379-R382 HydrophobicContact CB-CB 4.4Å; R379-R382 CarbonylContact O-C 3.48Å; R379-R382 WeakPolarHBondContact O-CA 3.1Å; R379-R382 PolarHBondContact O-N 3.28Å; R379-C383 PolarHBondContact O-N 2.74Å; R379-C383 VanDerWaalsContact O-N 3.16Å
380	A	90.1	Very high	87.4	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.6	-171.6	0	0	0	0	0	113.8	L318 S328 M330 W350 D360 V362 R382	L318-A380 HydrophobicContact CD2-CB 4.48Å; S328-A380 PolarHBondContact OG-O 2.64Å; M330-A380 HydrophobicContact CE-CB 3.61Å; W350-A380 HydrophobicContact CZ3-CB 4.22Å; D360-A380 PolarHBondContact O-N 2.79Å; V362-A380 HydrophobicContact CG1-CB 3.97Å; V362-A380 HydrophobicContact CG2-CB 4.31Å; A380-R382 VanDerWaalsContact C-N 3.34Å
381	Q	88.8	Confident	87.4	Confident	66 Å²	66	63.4 Å²	63.4	31%	0.308	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.8	178.4	-61.3	-77.7	-86.2	0	0	113.5	S328 M330 Q337 R379	S328-Q381 PolarHBondContact OG-NE2 3.08Å; M330-Q381 HydrophobicContact CE-CG 3.67Å; M330-Q381 VanDerWaalsContact CG-CD 3.45Å; M330-Q381 HydrophobicContact CG-CG 3.62Å; Q337-Q381 PolarHBondContact NE2-O 3.49Å; Q337-Q381 VanDerWaalsContact OE1-CD 3.31Å; Q337-Q381 PolarHBondContact OE1-O 3.18Å; R379-Q381 VanDerWaalsContact C-N 3.31Å; R379-Q381 PolarHBondContact O-N 2.91Å
382	R	86.8	Confident	87.6	Confident	163 Å²	163	62.2 Å²	62.2	62%	0.615	30%	0.298	S	S	*	.	B	Isolated β-bridge	trans	-147.2	66.3	-176.5	-61.4	-173.7	-171.6	177.6	3.1	110.2	R379 A380 D387	R379-R382 HydrophobicContact CB-CB 4.4Å; R379-R382 CarbonylContact O-C 3.48Å; R379-R382 WeakPolarHBondContact O-CA 3.1Å; R379-R382 PolarHBondContact O-N 3.28Å; A380-R382 VanDerWaalsContact C-N 3.34Å; R382-D387 WeakPolarHBondContact O-CB 3.49Å
383	C	89.7	Confident	86.7	Confident	10 Å²	10	60.9 Å²	60.9	7%	0.068	31%	0.308	C	S	.	.			trans	-105	40.2	177.1	-160.6	0	0	0	0	111.5	V339 C378 R379 R388	V339-C383 HydrophobicContact CG1-CB 3.8Å; V339-C383 VanDerWaalsContact O-CB 3.32Å; V339-C383 WeakPolarHBondContact O-CB 3.29Å; V339-C383 PolarHBondContact O-SG 3.47Å; C378-C383 HydrophobicContact CB-CB 3.79Å; C378-C383 WeakPolarHBondContact CB-SG 3.43Å; C378-C383 WeakPolarHBondContact SG-CB 3.34Å; C378-C383 CovalentContact SG-SG 2.04Å; C378-C383 PolarHBondContact SG-SG 2.56Å; R379-C383 PolarHBondContact O-N 2.74Å; R379-C383 VanDerWaalsContact O-N 3.16Å; C383-R388 PolarHBondContact O-NE 2.89Å; C383-R388 PolarHBondContact O-NH2 2.94Å
384	T	86.1	Confident	86	Confident	82 Å²	82	62.8 Å²	62.8	50%	0.503	33%	0.328	S	S	.	.			trans	-66.5	162	174.2	81.9	0	0	0	0	110	G386 D387 R388	T384-G386 PolarHBondContact O-N 2.6Å; T384-G386 VanDerWaalsContact O-N 3.16Å; T384-D387 WeakPolarHBondContact CB-OD2 3.43Å; T384-D387 WeakPolarHBondContact CG2-OD2 3.41Å; T384-D387 PolarHBondContact N-OD2 3.24Å; T384-D387 PolarHBondContact O-N 2.81Å; T384-D387 PolarHBondContact OG1-OD2 2.9Å; T384-R388 WeakPolarHBondContact O-CG 3.39Å; T384-R388 PolarHBondContact O-N 2.88Å
385	E	81.6	Confident	85.8	Confident	159 Å²	159	64 Å²	64	74%	0.743	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-30.2	-175.7	-54.2	-159.3	132	0	0	113.3	R388	E385-R388 IonicContact OE1-NH1 3.58Å
386	G	78.1	Confident	85.7	Confident	77 Å²	77	63.9 Å²	63.9	79%	0.794	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-18.5	174.6	0	0	0	0	0	115	T384	T384-G386 PolarHBondContact O-N 2.6Å; T384-G386 VanDerWaalsContact O-N 3.16Å
387	D	84	Confident	85.6	Confident	72 Å²	72	65 Å²	65	39%	0.385	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.6	177.9	-61.4	-61.3	0	0	0	112.9	R382 T384	R382-D387 WeakPolarHBondContact O-CB 3.49Å; T384-D387 WeakPolarHBondContact CB-OD2 3.43Å; T384-D387 WeakPolarHBondContact CG2-OD2 3.41Å; T384-D387 PolarHBondContact N-OD2 3.24Å; T384-D387 PolarHBondContact O-N 2.81Å; T384-D387 PolarHBondContact OG1-OD2 2.9Å
388	R	88.8	Confident	85.6	Confident	52 Å²	52	66.3 Å²	66.3	20%	0.196	35%	0.349	C	S	.	.			trans	-78	122.5	-175.5	-72.8	172.2	-160.7	165	5	111.7	H340 V376 C378 C383 T384 E385 Y390	H340-R388 PolarHBondContact NE2-NH1 2.99Å; V376-R388 HydrophobicContact CG1-CB 4.05Å; V376-R388 HydrophobicContact CG1-CG 3.83Å; C378-R388 HydrophobicContact CB-CG 4.31Å; C383-R388 PolarHBondContact O-NE 2.89Å; C383-R388 PolarHBondContact O-NH2 2.94Å; T384-R388 WeakPolarHBondContact O-CG 3.39Å; T384-R388 PolarHBondContact O-N 2.88Å; E385-R388 IonicContact OE1-NH1 3.58Å; R388-Y390 HydrophobicContact CB-CE2 3.85Å
389	Q	85.5	Confident	85.4	Confident	101 Å²	101	70.2 Å²	70.2	47%	0.472	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-99.7	122.5	175.6	-61.2	175.3	8.8	0	0	110	K377	K377-Q389 HydrophobicContact CB-CB 4.26Å; K377-Q389 PolarHBondContact N-O 3Å; K377-Q389 WeakPolarHBondContact O-CB 3.29Å; K377-Q389 PolarHBondContact O-N 2.87Å
390	Y	85.4	Confident	85.3	Confident	109 Å²	109	66.1 Å²	66.1	43%	0.427	36%	0.357	S	S	.	.			trans	-100.5	90.7	177.4	-62.8	-89.5	0	0	0	108.8	Q374 V376 R388 F392	Q374-Y390 HydrophobicContact CB-CD1 4.44Å; Q374-Y390 HydrophobicContact CB-CE1 4.42Å; Q374-Y390 HydrophobicContact CG-CD1 4.16Å; Q374-Y390 HydrophobicContact CG-CE1 4.33Å; V376-Y390 HydrophobicContact CG2-CD1 4.27Å; V376-Y390 HydrophobicContact CG2-CE1 3.78Å; R388-Y390 HydrophobicContact CB-CE2 3.85Å; Y390-F392 VanDerWaalsContact C-N 3.32Å; Y390-F392 PolarHBondContact O-N 2.77Å
391	L	77.8	Confident	85.5	Confident	70 Å²	70	66.1 Å²	66.1	37%	0.366	36%	0.357	S	S	.	.			trans	-77.6	-14.9	-172	-66.6	180	0	0	0	114.2	Y375 K377 F429	Y375-L391 HydrophobicContact CD1-CB 4.11Å; Y375-L391 HydrophobicContact CE1-CB 3.75Å; Y375-L391 HydrophobicContact CE1-CD1 3.94Å; Y375-L391 HydrophobicContact CE1-CG 4.38Å; K377-L391 HydrophobicContact CB-CD1 4.14Å; K377-L391 HydrophobicContact CB-CG 4.44Å; K377-L391 HydrophobicContact CD-CD1 3.78Å; L391-F429 HydrophobicContact CB-CE2 4.2Å; L391-F429 WeakPolarHBondContact O-CD2 3.05Å
392	F	83.1	Confident	85.7	Confident	19 Å²	19	64.4 Å²	64.4	8%	0.083	35%	0.351	C	S	.	.	S	Bend	trans	-105.5	130	175.7	-169.8	-89	0	0	0	110.7	Y375 Y390 G394 V396 T410 V412 F421 F429	Y375-F392 HydrophobicContact CD1-CB 4.46Å; Y390-F392 VanDerWaalsContact C-N 3.32Å; Y390-F392 PolarHBondContact O-N 2.77Å; F392-G394 PolarHBondContact O-N 3.17Å; F392-V396 HydrophobicContact CB-CG1 4.35Å; F392-V396 HydrophobicContact CD1-CG1 3.55Å; F392-V396 HydrophobicContact CD2-CG1 4.46Å; F392-V396 HydrophobicContact CE1-CG1 3.97Å; F392-V396 HydrophobicContact CG-CG1 3.85Å; F392-T410 HydrophobicContact CD2-CG2 3.63Å; F392-T410 HydrophobicContact CE2-CG2 3.75Å; F392-T410 HydrophobicContact CG-CG2 4.34Å; F392-V412 HydrophobicContact CE1-CG2 3.63Å; F392-V412 HydrophobicContact CE2-CG2 4.49Å; F392-V412 HydrophobicContact CZ-CG2 3.49Å; F392-V412 VanDerWaalsContact CZ-CG2 3.49Å; F392-F421 HydrophobicContact CE2-CB 3.96Å; F392-F421 HydrophobicContact CE2-CD1 4.02Å; F392-F421 HydrophobicContact CE2-CD2 4.02Å; F392-F421 AromaticContact CE2-CG 3.75Å; F392-F421 HydrophobicContact CE2-CG 3.75Å; F392-F421 HydrophobicContact CZ-CD1 4.4Å; F392-F421 HydrophobicContact CZ-CD2 4.04Å; F392-F421 HydrophobicContact CZ-CE2 4.17Å; F392-F421 HydrophobicContact CZ-CG 4.18Å; F392-F421 HydrophobicContact CZ-CZ 4.4Å; F392-F429 HydrophobicContact CB-CD2 4.29Å; F392-F429 HydrophobicContact CB-CE2 4.11Å; F392-F429 HydrophobicContact CD2-CB 4.16Å; F392-F429 HydrophobicContact CD2-CD1 4.09Å; F392-F429 AromaticContact CD2-CD2 3.79Å; F392-F429 HydrophobicContact CD2-CD2 3.79Å; F392-F429 HydrophobicContact CD2-CE1 4.42Å; F392-F429 HydrophobicContact CD2-CE2 4.14Å; F392-F429 AromaticContact CD2-CG 3.75Å; F392-F429 HydrophobicContact CD2-CG 3.75Å; F392-F429 HydrophobicContact CD2-CZ 4.44Å; F392-F429 HydrophobicContact CE2-CB 4.3Å; F392-F429 HydrophobicContact CE2-CD1 4.49Å; F392-F429 HydrophobicContact CE2-CG 4.27Å
393	P	69.9	Low	85.9	Confident	116 Å²	116	57.2 Å²	57.2	75%	0.753	33%	0.325	S	S	*	.	S	Bend	trans	-74.3	91.8	-179.5	30.1	-34.4	0	0	0	111.7
394	G	77.6	Confident	85.9	Confident	41 Å²	41	58.2 Å²	58.2	42%	0.423	33%	0.329	S	S	.	.	S	Bend	trans	121.8	-131.5	170.7	0	0	0	0	0	113.9	F392	F392-G394 PolarHBondContact O-N 3.17Å
395	H	86.5	Confident	86	Confident	76 Å²	76	57.8 Å²	57.8	35%	0.352	32%	0.323	S	S	.	.			trans	-117.6	151.1	178.6	-59.3	-57.7	0	0	0	110.6	I368 R372 A373	I368-H395 WeakPolarHBondContact CD1-ND1 3.47Å; R372-H395 HydrophobicContact CB-CB 4.5Å; A373-H395 WeakPolarHBondContact O-CA 3.42Å
396	V	91.4	Very high	86.5	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-116.9	160.4	177.2	-57.7	0	0	0	0	110.6	A373 F392 T410 V412	A373-V396 HydrophobicContact CB-CG2 3.99Å; A373-V396 PolarHBondContact N-O 2.62Å; A373-V396 PolarHBondContact O-N 2.96Å; F392-V396 HydrophobicContact CB-CG1 4.35Å; F392-V396 HydrophobicContact CD1-CG1 3.55Å; F392-V396 HydrophobicContact CD2-CG1 4.46Å; F392-V396 HydrophobicContact CE1-CG1 3.97Å; F392-V396 HydrophobicContact CG-CG1 3.85Å; V396-T410 VanDerWaalsContact CB-OG1 3.29Å; V396-T410 WeakPolarHBondContact CB-OG1 3.39Å; V396-T410 HydrophobicContact CG1-CG2 4.07Å; V396-T410 WeakPolarHBondContact CG1-OG1 3.35Å; V396-V412 HydrophobicContact CG1-CG2 4.45Å
397	D	90.8	Very high	87.3	Confident	24 Å²	24	48.1 Å²	48.1	13%	0.128	26%	0.257	C	S	.	.			trans	-68.8	150.6	174.4	-65.1	-6.3	0	0	0	109.8	S400 Q411 T413	D397-S400 VanDerWaalsContact O-CB 3.29Å; D397-S400 WeakPolarHBondContact O-CB 3.47Å; D397-S400 PolarHBondContact O-OG 3.19Å; D397-Q411 HydrophobicContact CB-CB 4.31Å; D397-Q411 HydrophobicContact CB-CG 4.49Å; D397-Q411 PolarHBondContact N-O 2.77Å; D397-Q411 WeakPolarHBondContact OD2-CG 3.49Å; D397-Q411 PolarHBondContact OD2-NE2 3.47Å; D397-T413 VanDerWaalsContact CG-N 3.28Å; D397-T413 PolarHBondContact OD1-N 2.94Å; D397-T413 VanDerWaalsContact OD2-CB 3.26Å; D397-T413 WeakPolarHBondContact OD2-CB 3.42Å; D397-T413 PolarHBondContact OD2-N 3Å; D397-T413 PolarHBondContact OD2-OG1 2.9Å
398	T	90.8	Very high	87.8	Confident	48 Å²	48	44.7 Å²	44.7	29%	0.294	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	139.2	-178.6	57.7	0	0	0	0	111.9	M344 A373 S400	M344-T398 HydrophobicContact CE-CG2 3.35Å; A373-T398 HydrophobicContact CB-CG2 4.3Å; T398-S400 VanDerWaalsContact C-N 3.35Å
399	N	88.1	Confident	88.1	Confident	85 Å²	85	42.6 Å²	42.6	46%	0.455	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	29.3	-173.5	-57.3	3.2	0	0	0	113.9	R347 E365	R347-N399 VanDerWaalsContact CZ-O 3.29Å; R347-N399 PolarHBondContact NE-O 3.29Å; R347-N399 VanDerWaalsContact NE-O 3.09Å; R347-N399 PolarHBondContact NH2-O 2.84Å; E365-N399 WeakPolarHBondContact OE2-CA 3.45Å; E365-N399 PolarHBondContact OE2-N 3.3Å
400	S	90.8	Very high	88.5	Confident	17 Å²	17	38 Å²	38	12%	0.119	21%	0.21	C	C	.	.			trans	-101.8	-21.6	-175.6	73.8	0	0	0	0	115.5	E365 D397 T398 V402 T410 Q411	E365-S400 PolarHBondContact OE1-N 2.84Å; E365-S400 PolarHBondContact OE1-OG 2.87Å; D397-S400 VanDerWaalsContact O-CB 3.29Å; D397-S400 WeakPolarHBondContact O-CB 3.47Å; D397-S400 PolarHBondContact O-OG 3.19Å; T398-S400 VanDerWaalsContact C-N 3.35Å; S400-V402 PolarHBondContact O-N 3.19Å; S400-T410 PolarHBondContact OG-OG1 3.46Å; S400-Q411 PolarHBondContact OG-N 3.07Å
401	L	93.6	Very high	88.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.			trans	-67.5	125.6	-178	-177.4	65.3	0	0	0	112.1	R347 Y349 E365 Y375 V403 V408 F409	R347-L401 WeakPolarHBondContact CD-O 3.47Å; R347-L401 PolarHBondContact NE-O 2.79Å; R347-L401 PolarHBondContact NH1-O 2.82Å; Y349-L401 HydrophobicContact CD2-CD2 4.46Å; Y349-L401 HydrophobicContact CE2-CD2 4.41Å; Y349-L401 HydrophobicContact CE2-CG 4.25Å; Y349-L401 PolarHBondContact OH-O 2.84Å; E365-L401 HydrophobicContact CB-CB 3.88Å; E365-L401 HydrophobicContact CB-CD2 3.93Å; E365-L401 HydrophobicContact CG-CB 4.24Å; E365-L401 PolarHBondContact OE1-N 2.91Å; Y375-L401 HydrophobicContact CD1-CD1 4.34Å; Y375-L401 HydrophobicContact CD2-CD1 3.77Å; Y375-L401 HydrophobicContact CD2-CD2 3.75Å; Y375-L401 HydrophobicContact CD2-CG 4.45Å; Y375-L401 HydrophobicContact CE2-CD1 4.11Å; Y375-L401 HydrophobicContact CE2-CD2 4.23Å; Y375-L401 HydrophobicContact CG-CD1 3.92Å; L401-V403 HydrophobicContact CD1-CG2 4.2Å; L401-V403 HydrophobicContact CG-CG2 4.35Å; L401-V408 HydrophobicContact CD1-CG1 3.73Å; L401-F409 WeakPolarHBondContact CA-O 3.2Å
402	V	93.2	Very high	89.4	Confident	30 Å²	30	32.3 Å²	32.3	18%	0.182	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.2	167	179.3	0	0	0	0	108.4	S400 Q404 V408 F409	S400-V402 PolarHBondContact O-N 3.19Å; V402-Q404 HydrophobicContact CG1-CB 4.26Å; V402-V408 CarbonylContact O-C 3.52Å; V402-V408 VanDerWaalsContact O-CA 3.29Å; V402-V408 WeakPolarHBondContact O-CA 3.35Å; V402-F409 HydrophobicContact CB-CB 4.27Å; V402-F409 HydrophobicContact CB-CD2 4.1Å; V402-F409 HydrophobicContact CG1-CD2 4.16Å; V402-F409 PolarHBondContact N-O 2.96Å; V402-F409 VanDerWaalsContact N-O 3.07Å; V402-F409 PolarHBondContact O-N 3.35Å
403	V	91.6	Very high	89.6	Confident	12 Å²	12	34.4 Å²	34.4	7%	0.073	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113.9	172.9	178.4	0	0	0	0	107.4	Y349 H363 L401 V408	Y349-V403 HydrophobicContact CD1-CB 4.26Å; Y349-V403 HydrophobicContact CD2-CB 3.8Å; Y349-V403 HydrophobicContact CD2-CG2 3.74Å; Y349-V403 HydrophobicContact CE2-CB 4.39Å; Y349-V403 HydrophobicContact CE2-CG2 4.32Å; Y349-V403 HydrophobicContact CG-CB 3.74Å; Y349-V403 HydrophobicContact CG-CG2 4.16Å; H363-V403 HydrophobicContact CB-CG2 3.82Å; L401-V403 HydrophobicContact CD1-CG2 4.2Å; L401-V403 HydrophobicContact CG-CG2 4.35Å; V403-V408 HydrophobicContact CG1-CG2 4.24Å; V403-V408 HydrophobicContact CG2-CG1 3.94Å; V403-V408 HydrophobicContact CG2-CG2 4.11Å
404	Q	89.4	Confident	90.2	Very high	30 Å²	30	36.3 Å²	36.3	14%	0.14	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	128.5	-172.3	-166.6	-174.3	-15.5	0	0	109.1	V402 E406 Y407 T448 V1230	V402-Q404 HydrophobicContact CG1-CB 4.26Å; Q404-E406 PolarHBondContact O-N 2.94Å; Q404-Y407 PolarHBondContact N-O 3.1Å; Q404-Y407 VanDerWaalsContact N-O 3.14Å; Q404-Y407 CarbonylContact O-C 3.58Å; Q404-Y407 WeakPolarHBondContact O-CA 3.47Å; Q404-Y407 WeakPolarHBondContact O-CB 3.35Å; Q404-Y407 PolarHBondContact O-N 3.21Å; Q404-Y407 VanDerWaalsContact O-O 3.04Å; Q404-T448 HydrophobicContact CB-CG2 4.45Å; Q404-T448 HydrophobicContact CG-CG2 4.44Å; Q404-T448 WeakPolarHBondContact CG-OG1 3.35Å; Q404-T448 PolarHBondContact NE2-OG1 2.96Å; Q404-V1230 VanDerWaalsContact CD-O 3.29Å; Q404-V1230 PolarHBondContact NE2-O 3.48Å; Q404-V1230 PolarHBondContact NE2-OXT 2.79Å
405	D	88.8	Confident	90.3	Very high	73 Å²	73	40.6 Å²	40.6	39%	0.39	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	-127	-177.1	-55.8	-36.9	0	0	0	113.2	L355 Y407 R426 T448	L355-D405 WeakPolarHBondContact CD1-O 3.43Å; D405-Y407 PolarHBondContact O-N 2.84Å; D405-R426 PolarHBondContact O-NH1 3.19Å; D405-T448 PolarHBondContact OD2-OG1 2.76Å
406	E	91.2	Very high	89.9	Confident	32 Å²	32	40.5 Å²	40.5	15%	0.15	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-1.9	179.2	-59.7	-174.7	148.7	0	0	113.3	L355 Q404 Y424 M425 K451	L355-E406 HydrophobicContact CD1-CB 4.36Å; L355-E406 HydrophobicContact CD1-CG 4.03Å; L355-E406 HydrophobicContact CD2-CG 4.44Å; Q404-E406 PolarHBondContact O-N 2.94Å; E406-Y424 HydrophobicContact CB-CD2 3.96Å; E406-Y424 HydrophobicContact CB-CE2 3.59Å; E406-Y424 HydrophobicContact CG-CE2 4.48Å; E406-Y424 CarbonylContact O-C 3.55Å; E406-Y424 WeakPolarHBondContact O-CA 3.46Å; E406-Y424 PolarHBondContact OE2-OH 3.35Å; E406-M425 HydrophobicContact CB-CG 4.5Å; E406-M425 PolarHBondContact O-N 3.48Å; E406-K451 IonicContact OE1-NZ 2.8Å; E406-K451 PolarHBondContact OE1-NZ 2.86Å; E406-K451 IonicContact OE2-NZ 2.96Å; E406-K451 PolarHBondContact OE2-NZ 2.92Å
407	Y	94.2	Very high	89.3	Confident	1 Å²	1	49.1 Å²	49.1	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153.7	-168.9	-52.5	-86.7	0	0	0	114	Q404 D405 F409 V422 S423 Y424 R426 T448 K451 V453 S473	Q404-Y407 PolarHBondContact N-O 3.1Å; Q404-Y407 VanDerWaalsContact N-O 3.14Å; Q404-Y407 CarbonylContact O-C 3.58Å; Q404-Y407 WeakPolarHBondContact O-CA 3.47Å; Q404-Y407 WeakPolarHBondContact O-CB 3.35Å; Q404-Y407 PolarHBondContact O-N 3.21Å; Q404-Y407 VanDerWaalsContact O-O 3.04Å; D405-Y407 PolarHBondContact O-N 2.84Å; Y407-F409 HydrophobicContact CD1-CZ 4.14Å; Y407-F409 HydrophobicContact CG-CE2 4.24Å; Y407-F409 AromaticContact CG-CZ 3.87Å; Y407-F409 HydrophobicContact CG-CZ 3.87Å; Y407-V422 HydrophobicContact CD1-CG2 3.93Å; Y407-S423 CarbonylContact C-O 3.5Å; Y407-S423 WeakPolarHBondContact CA-O 3.31Å; Y407-Y424 AromaticContact CD1-CD2 3.8Å; Y407-Y424 HydrophobicContact CD1-CD2 3.8Å; Y407-Y424 AromaticContact CE1-CD2 3.44Å; Y407-Y424 HydrophobicContact CE1-CD2 3.44Å; Y407-Y424 VanDerWaalsContact CE1-CD2 3.44Å; Y407-Y424 AromaticContact CE1-CE2 3.94Å; Y407-Y424 HydrophobicContact CE1-CE2 3.94Å; Y407-Y424 HydrophobicContact CE1-CG 4.42Å; Y407-Y424 AromaticContact CZ-CD2 3.96Å; Y407-Y424 AromaticContact CZ-CE2 3.98Å; Y407-R426 PolarHBondContact O-NH1 3.46Å; Y407-T448 HydrophobicContact CD2-CG2 3.5Å; Y407-T448 VanDerWaalsContact CD2-CG2 3.5Å; Y407-T448 HydrophobicContact CE2-CG2 4.02Å; Y407-T448 HydrophobicContact CG-CG2 4.11Å; Y407-K451 PolarHBondContact OH-O 2.91Å; Y407-V453 HydrophobicContact CD1-CG2 3.91Å; Y407-V453 HydrophobicContact CD2-CG2 4.43Å; Y407-V453 HydrophobicContact CE1-CG2 3.6Å; Y407-V453 HydrophobicContact CE2-CG2 4.15Å; Y407-V453 HydrophobicContact CG-CG2 4.32Å; Y407-S473 VanDerWaalsContact CE1-O 3.29Å; Y407-S473 WeakPolarHBondContact CE1-O 3.42Å; Y407-S473 PolarHBondContact OH-O 3.17Å
408	V	94.6	Very high	89.1	Confident	1 Å²	1	49 Å²	49	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	127.5	161.5	-177.4	0	0	0	0	108.3	Y375 L401 V402 V403 V422 S423 F429	Y375-V408 HydrophobicContact CE1-CG1 4.05Å; L401-V408 HydrophobicContact CD1-CG1 3.73Å; V402-V408 CarbonylContact O-C 3.52Å; V402-V408 VanDerWaalsContact O-CA 3.29Å; V402-V408 WeakPolarHBondContact O-CA 3.35Å; V403-V408 HydrophobicContact CG1-CG2 4.24Å; V403-V408 HydrophobicContact CG2-CG1 3.94Å; V403-V408 HydrophobicContact CG2-CG2 4.11Å; V408-V422 CarbonylContact O-C 3.51Å; V408-V422 WeakPolarHBondContact O-CA 3.49Å; V408-S423 PolarHBondContact N-O 3.09Å; V408-S423 PolarHBondContact O-N 2.88Å; V408-F429 HydrophobicContact CB-CE1 4.37Å; V408-F429 HydrophobicContact CB-CZ 4.3Å; V408-F429 HydrophobicContact CG1-CE1 4.12Å; V408-F429 HydrophobicContact CG1-CZ 3.84Å
409	F	95	Very high	89.1	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	151.5	178.7	-51.9	-85.4	0	0	0	111.8	L401 V402 Y407 F421 V422 M432 I445 T448 V453	L401-F409 WeakPolarHBondContact CA-O 3.2Å; V402-F409 HydrophobicContact CB-CB 4.27Å; V402-F409 HydrophobicContact CB-CD2 4.1Å; V402-F409 HydrophobicContact CG1-CD2 4.16Å; V402-F409 PolarHBondContact N-O 2.96Å; V402-F409 VanDerWaalsContact N-O 3.07Å; V402-F409 PolarHBondContact O-N 3.35Å; Y407-F409 HydrophobicContact CD1-CZ 4.14Å; Y407-F409 HydrophobicContact CG-CE2 4.24Å; Y407-F409 AromaticContact CG-CZ 3.87Å; Y407-F409 HydrophobicContact CG-CZ 3.87Å; F409-F421 VanDerWaalsContact CA-O 3.3Å; F409-F421 WeakPolarHBondContact CA-O 3.44Å; F409-V422 HydrophobicContact CD1-CB 3.99Å; F409-V422 HydrophobicContact CD1-CG2 3.84Å; F409-V422 HydrophobicContact CE1-CB 4.06Å; F409-V422 HydrophobicContact CE1-CG2 3.54Å; F409-V422 HydrophobicContact CZ-CG2 4.3Å; F409-M432 HydrophobicContact CD1-CE 3.97Å; F409-M432 HydrophobicContact CD1-SD 3.98Å; F409-M432 HydrophobicContact CE1-CE 4.1Å; F409-I445 HydrophobicContact CD1-CD1 4.06Å; F409-I445 HydrophobicContact CD1-CG1 4.37Å; F409-I445 HydrophobicContact CD2-CG1 4Å; F409-I445 HydrophobicContact CE1-CD1 4.05Å; F409-I445 HydrophobicContact CE2-CD1 4.5Å; F409-I445 HydrophobicContact CE2-CG1 4.17Å; F409-I445 HydrophobicContact CE2-CG2 4.21Å; F409-I445 HydrophobicContact CG-CD1 4.28Å; F409-I445 HydrophobicContact CG-CG1 4.1Å; F409-I445 HydrophobicContact CZ-CD1 4.28Å; F409-I445 HydrophobicContact CZ-CG1 4.44Å; F409-I445 HydrophobicContact CZ-CG2 4.48Å; F409-T448 HydrophobicContact CE2-CG2 3.72Å; F409-T448 HydrophobicContact CZ-CG2 3.86Å; F409-V453 HydrophobicContact CE1-CG1 4Å; F409-V453 HydrophobicContact CE1-CG2 4.19Å; F409-V453 HydrophobicContact CZ-CB 4.4Å; F409-V453 HydrophobicContact CZ-CG1 3.66Å; F409-V453 HydrophobicContact CZ-CG2 3.78Å
410	T	93.9	Very high	89.3	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	163.1	170.4	-171.2	0	0	0	0	111.5	F392 V396 S400 F421 F429	F392-T410 HydrophobicContact CD2-CG2 3.63Å; F392-T410 HydrophobicContact CE2-CG2 3.75Å; F392-T410 HydrophobicContact CG-CG2 4.34Å; V396-T410 VanDerWaalsContact CB-OG1 3.29Å; V396-T410 WeakPolarHBondContact CB-OG1 3.39Å; V396-T410 HydrophobicContact CG1-CG2 4.07Å; V396-T410 WeakPolarHBondContact CG1-OG1 3.35Å; S400-T410 PolarHBondContact OG-OG1 3.46Å; T410-F421 HydrophobicContact CG2-CB 4.07Å; T410-F421 PolarHBondContact N-O 3.06Å; T410-F421 PolarHBondContact O-N 2.66Å; T410-F429 HydrophobicContact CG2-CD1 4.23Å; T410-F429 HydrophobicContact CG2-CE1 3.87Å; T410-F429 HydrophobicContact CG2-CZ 4.42Å
411	Q	92.3	Very high	89.4	Confident	44 Å²	44	46.6 Å²	46.6	21%	0.206	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.1	-177.7	-172	-172.8	-57.2	0	0	110.4	D397 S400 T413 A418 S419 Y420	D397-Q411 HydrophobicContact CB-CB 4.31Å; D397-Q411 HydrophobicContact CB-CG 4.49Å; D397-Q411 PolarHBondContact N-O 2.77Å; D397-Q411 WeakPolarHBondContact OD2-CG 3.49Å; D397-Q411 PolarHBondContact OD2-NE2 3.47Å; S400-Q411 PolarHBondContact OG-N 3.07Å; Q411-T413 PolarHBondContact NE2-OG1 2.88Å; Q411-A418 HydrophobicContact CG-CB 4.29Å; Q411-S419 WeakPolarHBondContact CA-O 3.19Å; Q411-Y420 HydrophobicContact CB-CD1 4.14Å; Q411-Y420 HydrophobicContact CB-CE1 4.18Å; Q411-Y420 HydrophobicContact CG-CD1 3.94Å; Q411-Y420 HydrophobicContact CG-CE1 3.66Å; Q411-Y420 PolarHBondContact OE1-OH 3.48Å
412	V	90.3	Very high	89.5	Confident	16 Å²	16	46.7 Å²	46.7	10%	0.097	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	120.5	169.9	-172.2	0	0	0	0	109.7	F392 V396 K414 S419 F421	F392-V412 HydrophobicContact CE1-CG2 3.63Å; F392-V412 HydrophobicContact CE2-CG2 4.49Å; F392-V412 HydrophobicContact CZ-CG2 3.49Å; F392-V412 VanDerWaalsContact CZ-CG2 3.49Å; V396-V412 HydrophobicContact CG1-CG2 4.45Å; V412-K414 HydrophobicContact CG1-CG 4.2Å; V412-S419 PolarHBondContact N-O 2.75Å; V412-S419 PolarHBondContact O-N 3.02Å; V412-F421 HydrophobicContact CB-CE2 4.17Å; V412-F421 HydrophobicContact CG2-CD2 4.2Å; V412-F421 HydrophobicContact CG2-CE2 3.97Å
413	T	87.4	Confident	89.5	Confident	62 Å²	62	45.5 Å²	45.5	38%	0.38	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.8	176	-63.5	0	0	0	0	111.1	D397 Q411 R417	D397-T413 VanDerWaalsContact CG-N 3.28Å; D397-T413 PolarHBondContact OD1-N 2.94Å; D397-T413 VanDerWaalsContact OD2-CB 3.26Å; D397-T413 WeakPolarHBondContact OD2-CB 3.42Å; D397-T413 PolarHBondContact OD2-N 3Å; D397-T413 PolarHBondContact OD2-OG1 2.9Å; Q411-T413 PolarHBondContact NE2-OG1 2.88Å; T413-R417 WeakPolarHBondContact CA-O 3.31Å
414	K	81.8	Confident	89.5	Confident	156 Å²	156	47.6 Å²	47.6	68%	0.678	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.6	174.5	-64.2	-170.8	-179.8	-175.9	0	109.8	V412 G416 R417	V412-K414 HydrophobicContact CG1-CG 4.2Å; K414-G416 VanDerWaalsContact C-N 3.26Å; K414-G416 PolarHBondContact O-N 3.26Å; K414-R417 PolarHBondContact N-O 3.33Å; K414-R417 PolarHBondContact O-N 3.38Å
415	S	79.8	Confident	89.6	Confident	132 Å²	132	51.2 Å²	51.2	92%	0.923	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	43	178.8	-52.3	0	0	0	0	114	R417	S415-R417 VanDerWaalsContact C-N 3.29Å; S415-R417 PolarHBondContact O-N 3Å
416	G	78.1	Confident	89.6	Confident	74 Å²	74	49.5 Å²	49.5	76%	0.763	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	3.7	-179.3	0	0	0	0	0	115.7	K414	K414-G416 VanDerWaalsContact C-N 3.26Å; K414-G416 PolarHBondContact O-N 3.26Å
417	R	80.3	Confident	89.3	Confident	183 Å²	183	49.9 Å²	49.9	69%	0.691	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.9	173.6	-64.4	-176	178.8	-177	-0.2	110.5	T413 K414 S415	T413-R417 WeakPolarHBondContact CA-O 3.31Å; K414-R417 PolarHBondContact N-O 3.33Å; K414-R417 PolarHBondContact O-N 3.38Å; S415-R417 VanDerWaalsContact C-N 3.29Å; S415-R417 PolarHBondContact O-N 3Å
418	A	86.7	Confident	89	Confident	21 Å²	21	54 Å²	54	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	149.8	169.2	0	0	0	0	0	110.9	Q411 Y420	Q411-A418 HydrophobicContact CG-CB 4.29Å; A418-Y420 HydrophobicContact CB-CE2 3.9Å
419	S	89.4	Confident	88.7	Confident	34 Å²	34	55.5 Å²	55.5	24%	0.238	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	124.8	169.8	-81.7	0	0	0	0	109.3	Q411 V412 F421 Q431	Q411-S419 WeakPolarHBondContact CA-O 3.19Å; V412-S419 PolarHBondContact N-O 2.75Å; V412-S419 PolarHBondContact O-N 3.02Å; S419-F421 WeakPolarHBondContact O-CD2 3.3Å; S419-F421 WeakPolarHBondContact O-CE2 3.31Å; S419-Q431 PolarHBondContact OG-NE2 3.33Å; S419-Q431 VanDerWaalsContact OG-NE2 3.08Å
420	Y	92.6	Very high	88.4	Confident	21 Å²	21	61.9 Å²	61.9	8%	0.082	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	140.8	-175.6	-56.3	-87.7	0	0	0	109.9	Q411 A418 Q431 M432 P440 M443	Q411-Y420 HydrophobicContact CB-CD1 4.14Å; Q411-Y420 HydrophobicContact CB-CE1 4.18Å; Q411-Y420 HydrophobicContact CG-CD1 3.94Å; Q411-Y420 HydrophobicContact CG-CE1 3.66Å; Q411-Y420 PolarHBondContact OE1-OH 3.48Å; A418-Y420 HydrophobicContact CB-CE2 3.9Å; Y420-Q431 WeakPolarHBondContact O-CA 3.4Å; Y420-M432 VanDerWaalsContact CB-SD 3.57Å; Y420-M432 PolarHBondContact O-N 2.96Å; Y420-P440 HydrophobicContact CD2-CG 4.43Å; Y420-P440 HydrophobicContact CE2-CB 4.13Å; Y420-P440 HydrophobicContact CE2-CG 3.85Å; Y420-M443 HydrophobicContact CD1-CB 4.26Å; Y420-M443 HydrophobicContact CD1-SD 4.4Å; Y420-M443 HydrophobicContact CD2-CB 4.32Å; Y420-M443 HydrophobicContact CD2-SD 3.95Å; Y420-M443 HydrophobicContact CE1-CB 3.75Å; Y420-M443 HydrophobicContact CE2-CB 3.85Å; Y420-M443 HydrophobicContact CE2-SD 4.38Å; Y420-M443 HydrophobicContact CG-SD 3.98Å; Y420-M443 PolarHBondContact OH-N 2.99Å
421	F	93.3	Very high	88.2	Confident	44 Å²	44	65.1 Å²	65.1	19%	0.193	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.1	-176.8	-66.7	-98.9	0	0	0	110.6	F392 F409 T410 V412 S419 F429 R430 Q431	F392-F421 HydrophobicContact CE2-CB 3.96Å; F392-F421 HydrophobicContact CE2-CD1 4.02Å; F392-F421 HydrophobicContact CE2-CD2 4.02Å; F392-F421 AromaticContact CE2-CG 3.75Å; F392-F421 HydrophobicContact CE2-CG 3.75Å; F392-F421 HydrophobicContact CZ-CD1 4.4Å; F392-F421 HydrophobicContact CZ-CD2 4.04Å; F392-F421 HydrophobicContact CZ-CE2 4.17Å; F392-F421 HydrophobicContact CZ-CG 4.18Å; F392-F421 HydrophobicContact CZ-CZ 4.4Å; F409-F421 VanDerWaalsContact CA-O 3.3Å; F409-F421 WeakPolarHBondContact CA-O 3.44Å; T410-F421 HydrophobicContact CG2-CB 4.07Å; T410-F421 PolarHBondContact N-O 3.06Å; T410-F421 PolarHBondContact O-N 2.66Å; V412-F421 HydrophobicContact CB-CE2 4.17Å; V412-F421 HydrophobicContact CG2-CD2 4.2Å; V412-F421 HydrophobicContact CG2-CE2 3.97Å; S419-F421 WeakPolarHBondContact O-CD2 3.3Å; S419-F421 WeakPolarHBondContact O-CE2 3.31Å; F421-F429 HydrophobicContact CB-CD1 4.05Å; F421-R430 CarbonylContact C-O 3.51Å; F421-R430 VanDerWaalsContact CA-O 3.31Å; F421-R430 WeakPolarHBondContact CA-O 3.45Å; F421-Q431 HydrophobicContact CD1-CB 3.99Å; F421-Q431 HydrophobicContact CE1-CB 3.74Å; F421-Q431 HydrophobicContact CE1-CG 4.16Å; F421-Q431 HydrophobicContact CZ-CB 4.27Å; F421-Q431 HydrophobicContact CZ-CG 4.2Å
422	V	95	Very high	88.2	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.012	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.3	176.3	65.5	0	0	0	0	110.6	Y407 V408 F409 F429 R430 M432 G475 V476	Y407-V422 HydrophobicContact CD1-CG2 3.93Å; V408-V422 CarbonylContact O-C 3.51Å; V408-V422 WeakPolarHBondContact O-CA 3.49Å; F409-V422 HydrophobicContact CD1-CB 3.99Å; F409-V422 HydrophobicContact CD1-CG2 3.84Å; F409-V422 HydrophobicContact CE1-CB 4.06Å; F409-V422 HydrophobicContact CE1-CG2 3.54Å; F409-V422 HydrophobicContact CZ-CG2 4.3Å; V422-F429 CarbonylContact O-C 3.57Å; V422-F429 WeakPolarHBondContact O-CA 3.27Å; V422-R430 PolarHBondContact N-O 3.24Å; V422-R430 PolarHBondContact O-N 3.18Å; V422-M432 HydrophobicContact CB-CG 3.92Å; V422-M432 HydrophobicContact CB-SD 4.13Å; V422-M432 HydrophobicContact CG1-CG 3.84Å; V422-G475 WeakPolarHBondContact CG1-O 3.49Å; V422-V476 HydrophobicContact CG1-CG2 3.75Å
423	S	93.1	Very high	88.3	Confident	5 Å²	5	67 Å²	67	4%	0.035	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	121.1	162.6	166.3	0	0	0	0	107.9	Y407 V408 R426 G427	Y407-S423 CarbonylContact C-O 3.5Å; Y407-S423 WeakPolarHBondContact CA-O 3.31Å; V408-S423 PolarHBondContact N-O 3.09Å; V408-S423 PolarHBondContact O-N 2.88Å; S423-R426 WeakPolarHBondContact OG-CA 3.36Å; S423-G427 WeakPolarHBondContact CB-O 3.44Å; S423-G427 PolarHBondContact OG-N 3.44Å; S423-G427 PolarHBondContact OG-O 2.96Å
424	Y	92.3	Very high	88.5	Confident	56 Å²	56	65 Å²	65	22%	0.22	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.6	177.1	178.2	-112.2	0	0	0	110.2	E406 Y407 R426 G427 P474	E406-Y424 HydrophobicContact CB-CD2 3.96Å; E406-Y424 HydrophobicContact CB-CE2 3.59Å; E406-Y424 HydrophobicContact CG-CE2 4.48Å; E406-Y424 CarbonylContact O-C 3.55Å; E406-Y424 WeakPolarHBondContact O-CA 3.46Å; E406-Y424 PolarHBondContact OE2-OH 3.35Å; Y407-Y424 AromaticContact CD1-CD2 3.8Å; Y407-Y424 HydrophobicContact CD1-CD2 3.8Å; Y407-Y424 AromaticContact CE1-CD2 3.44Å; Y407-Y424 HydrophobicContact CE1-CD2 3.44Å; Y407-Y424 VanDerWaalsContact CE1-CD2 3.44Å; Y407-Y424 AromaticContact CE1-CE2 3.94Å; Y407-Y424 HydrophobicContact CE1-CE2 3.94Å; Y407-Y424 HydrophobicContact CE1-CG 4.42Å; Y407-Y424 AromaticContact CZ-CD2 3.96Å; Y407-Y424 AromaticContact CZ-CE2 3.98Å; Y424-R426 PolarHBondContact O-N 3.36Å; Y424-R426 VanDerWaalsContact O-N 3.17Å; Y424-G427 PolarHBondContact O-N 2.79Å; Y424-P474 HydrophobicContact CD1-CB 4.38Å
425	M	91	Very high	88.9	Confident	106 Å²	106	58.7 Å²	58.7	52%	0.522	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.1	38.3	-172.4	-60.8	-175.5	76.1	0	0	113.2	L355 E406 G427	L355-M425 HydrophobicContact CD2-CE 4.19Å; L355-M425 HydrophobicContact CD2-CG 4.48Å; E406-M425 HydrophobicContact CB-CG 4.5Å; E406-M425 PolarHBondContact O-N 3.48Å; M425-G427 PolarHBondContact O-N 3.19Å
426	R	88.5	Confident	89.2	Confident	38 Å²	38	58.3 Å²	58.3	14%	0.143	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	21.8	-176.3	-48.2	-55.9	-168.4	-112.7	-4.4	115	V352 D356 D405 Y407 S423 Y424	V352-R426 VanDerWaalsContact CB-NH2 3.28Å; D356-R426 IonicContact OD1-NE 2.72Å; D356-R426 IonicContact OD2-CZ 2.92Å; D356-R426 VanDerWaalsContact OD2-CZ 3.26Å; D356-R426 IonicContact OD2-NE 3.6Å; D356-R426 PolarHBondContact OD2-NE 3Å; D356-R426 IonicContact OD2-NH2 2.84Å; D356-R426 PolarHBondContact OD2-NH2 3.19Å; D405-R426 PolarHBondContact O-NH1 3.19Å; Y407-R426 PolarHBondContact O-NH1 3.46Å; S423-R426 WeakPolarHBondContact OG-CA 3.36Å; Y424-R426 PolarHBondContact O-N 3.36Å; Y424-R426 VanDerWaalsContact O-N 3.17Å
427	G	86.6	Confident	89.4	Confident	40 Å²	40	60.9 Å²	60.9	41%	0.412	29%	0.29	S	S	.	.			trans	-74.7	-170.7	174.5	0	0	0	0	0	114.2	S423 Y424 M425 F429	S423-G427 WeakPolarHBondContact CB-O 3.44Å; S423-G427 PolarHBondContact OG-N 3.44Å; S423-G427 PolarHBondContact OG-O 2.96Å; Y424-G427 PolarHBondContact O-N 2.79Å; M425-G427 PolarHBondContact O-N 3.19Å; G427-F429 PolarHBondContact O-N 3.47Å
428	S	86.1	Confident	89.5	Confident	86 Å²	86	52.7 Å²	52.7	60%	0.601	26%	0.26	S	S	*	.			trans	-54.2	134.6	173.1	59.3	0	0	0	0	112.1
429	F	88.8	Confident	89.4	Confident	33 Å²	33	55.7 Å²	55.7	15%	0.145	27%	0.273	C	S	.	.			trans	-60.4	140.8	170.1	-79.2	-85	0	0	0	111.8	Y375 L391 F392 V408 T410 F421 V422 G427	Y375-F429 AromaticContact CD1-CE2 3.82Å; Y375-F429 HydrophobicContact CD1-CE2 3.82Å; Y375-F429 AromaticContact CD1-CZ 3.7Å; Y375-F429 HydrophobicContact CD1-CZ 3.7Å; Y375-F429 AromaticContact CE1-CE2 3.75Å; Y375-F429 HydrophobicContact CE1-CE2 3.75Å; Y375-F429 AromaticContact CE1-CZ 3.61Å; Y375-F429 HydrophobicContact CE1-CZ 3.61Å; L391-F429 HydrophobicContact CB-CE2 4.2Å; L391-F429 WeakPolarHBondContact O-CD2 3.05Å; F392-F429 HydrophobicContact CB-CD2 4.29Å; F392-F429 HydrophobicContact CB-CE2 4.11Å; F392-F429 HydrophobicContact CD2-CB 4.16Å; F392-F429 HydrophobicContact CD2-CD1 4.09Å; F392-F429 AromaticContact CD2-CD2 3.79Å; F392-F429 HydrophobicContact CD2-CD2 3.79Å; F392-F429 HydrophobicContact CD2-CE1 4.42Å; F392-F429 HydrophobicContact CD2-CE2 4.14Å; F392-F429 AromaticContact CD2-CG 3.75Å; F392-F429 HydrophobicContact CD2-CG 3.75Å; F392-F429 HydrophobicContact CD2-CZ 4.44Å; F392-F429 HydrophobicContact CE2-CB 4.3Å; F392-F429 HydrophobicContact CE2-CD1 4.49Å; F392-F429 HydrophobicContact CE2-CG 4.27Å; V408-F429 HydrophobicContact CB-CE1 4.37Å; V408-F429 HydrophobicContact CB-CZ 4.3Å; V408-F429 HydrophobicContact CG1-CE1 4.12Å; V408-F429 HydrophobicContact CG1-CZ 3.84Å; T410-F429 HydrophobicContact CG2-CD1 4.23Å; T410-F429 HydrophobicContact CG2-CE1 3.87Å; T410-F429 HydrophobicContact CG2-CZ 4.42Å; F421-F429 HydrophobicContact CB-CD1 4.05Å; V422-F429 CarbonylContact O-C 3.57Å; V422-F429 WeakPolarHBondContact O-CA 3.27Å; G427-F429 PolarHBondContact O-N 3.47Å
430	R	88.8	Confident	89.3	Confident	143 Å²	143	55.9 Å²	55.9	54%	0.54	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.1	176.7	-66.6	178.6	177.8	168.4	1.2	109.3	F421 V422 M432 V476	F421-R430 CarbonylContact C-O 3.51Å; F421-R430 VanDerWaalsContact CA-O 3.31Å; F421-R430 WeakPolarHBondContact CA-O 3.45Å; V422-R430 PolarHBondContact N-O 3.24Å; V422-R430 PolarHBondContact O-N 3.18Å; R430-M432 PolarHBondContact O-N 3.28Å; R430-V476 HydrophobicContact CB-CG2 4.14Å
431	Q	89.9	Confident	89	Confident	72 Å²	72	59.6 Å²	59.6	34%	0.336	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	126.7	174.9	-166.2	-164.1	31.3	0	0	109.6	S419 Y420 F421 K433	S419-Q431 PolarHBondContact OG-NE2 3.33Å; S419-Q431 VanDerWaalsContact OG-NE2 3.08Å; Y420-Q431 WeakPolarHBondContact O-CA 3.4Å; F421-Q431 HydrophobicContact CD1-CB 3.99Å; F421-Q431 HydrophobicContact CE1-CB 3.74Å; F421-Q431 HydrophobicContact CE1-CG 4.16Å; F421-Q431 HydrophobicContact CZ-CB 4.27Å; F421-Q431 HydrophobicContact CZ-CG 4.2Å; Q431-K433 WeakPolarHBondContact O-CE 3.28Å
432	M	92.8	Very high	88.7	Confident	17 Å²	17	59.3 Å²	59.3	8%	0.084	29%	0.29	C	S	.	.			trans	-66.4	143.6	176.3	-63.4	157.2	75.1	0	0	109.8	F409 Y420 V422 R430 M443 I445 F478	F409-M432 HydrophobicContact CD1-CE 3.97Å; F409-M432 HydrophobicContact CD1-SD 3.98Å; F409-M432 HydrophobicContact CE1-CE 4.1Å; Y420-M432 VanDerWaalsContact CB-SD 3.57Å; Y420-M432 PolarHBondContact O-N 2.96Å; V422-M432 HydrophobicContact CB-CG 3.92Å; V422-M432 HydrophobicContact CB-SD 4.13Å; V422-M432 HydrophobicContact CG1-CG 3.84Å; R430-M432 PolarHBondContact O-N 3.28Å; M432-M443 HydrophobicContact CE-CE 3.67Å; M432-M443 HydrophobicContact CE-SD 4.34Å; M432-I445 HydrophobicContact CE-CD1 4.18Å; M432-F478 HydrophobicContact CB-CD2 4.46Å; M432-F478 HydrophobicContact CB-CE2 4.06Å; M432-F478 HydrophobicContact CE-CE2 3.45Å; M432-F478 VanDerWaalsContact CE-CE2 3.45Å; M432-F478 HydrophobicContact CE-CZ 3.49Å; M432-F478 VanDerWaalsContact CE-CZ 3.49Å; M432-F478 HydrophobicContact CG-CE2 4.16Å
433	K	91.5	Very high	88.5	Confident	81 Å²	81	60 Å²	60	35%	0.352	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-119.5	99.8	-172.5	-57	-58.9	-179.6	177	0	109.6	Q431 V476 Y477 F478 Y763	Q431-K433 WeakPolarHBondContact O-CE 3.28Å; K433-V476 HydrophobicContact CG-CG1 4.32Å; K433-V476 PolarHBondContact N-O 2.85Å; K433-Y477 HydrophobicContact CB-CD1 4.04Å; K433-Y477 HydrophobicContact CB-CE1 4.45Å; K433-Y477 HydrophobicContact CG-CD1 4.32Å; K433-Y477 HydrophobicContact CG-CE1 4.26Å; K433-F478 PolarHBondContact O-N 2.91Å; K433-Y763 HydrophobicContact CB-CE2 3.97Å; K433-Y763 VanDerWaalsContact O-CE2 3.32Å; K433-Y763 WeakPolarHBondContact O-CE2 3.29Å
434	L	92.5	Very high	88.4	Confident	22 Å²	22	62.6 Å²	62.6	12%	0.115	31%	0.305	C	S	.	.			trans	-81.4	165.2	163.5	-67.4	167.4	0	0	0	109.9	C438 P440 M443 V457 Y469 F478 Y763	L434-C438 HydrophobicContact CB-CB 4.42Å; L434-P440 HydrophobicContact CD1-CB 4.11Å; L434-P440 HydrophobicContact CD1-CG 3.98Å; L434-M443 HydrophobicContact CD1-SD 4.2Å; L434-M443 HydrophobicContact CD2-CE 4.44Å; L434-V457 HydrophobicContact CD1-CG1 4.12Å; L434-V457 HydrophobicContact CD1-CG2 4.26Å; L434-V457 HydrophobicContact CD2-CG2 3.85Å; L434-Y469 HydrophobicContact CD2-CD1 3.98Å; L434-Y469 HydrophobicContact CD2-CD2 4.37Å; L434-Y469 HydrophobicContact CD2-CE1 4.37Å; L434-Y469 HydrophobicContact CD2-CG 4Å; L434-F478 HydrophobicContact CD2-CB 3.89Å; L434-F478 HydrophobicContact CD2-CG 4.29Å; L434-Y763 PolarHBondContact O-OH 3.08Å
435	P	90.7	Very high	88.4	Confident	22 Å²	22	61.9 Å²	61.9	14%	0.143	31%	0.305	C	S	.	.			trans	-50.6	140.2	172.5	-29	36.8	0	0	0	112.6	Y437 C438 Y469 W778	P435-Y437 PolarHBondContact O-N 2.96Å; P435-C438 HydrophobicContact CB-CB 4Å; P435-C438 HydrophobicContact CG-CB 4.36Å; P435-C438 WeakPolarHBondContact O-CA 3.2Å; P435-C438 VanDerWaalsContact O-CB 3.3Å; P435-C438 WeakPolarHBondContact O-CB 3.02Å; P435-C438 PolarHBondContact O-N 2.92Å; P435-Y469 HydrophobicContact CG-CE1 3.84Å; P435-W778 HydrophobicContact CB-CH2 4.21Å; P435-W778 HydrophobicContact CB-CZ2 3.61Å; P435-W778 HydrophobicContact CG-CZ2 4.37Å
436	K	84.6	Confident	88.3	Confident	125 Å²	125	58.2 Å²	58.2	54%	0.543	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-29.3	-166.1	-175.8	-177.9	178.9	-171.3	0	115.6	W778	K436-W778 HydrophobicContact CB-CB 4.41Å; K436-W778 HydrophobicContact CB-CD2 3.79Å; K436-W778 HydrophobicContact CB-CE3 3.33Å; K436-W778 HydrophobicContact CB-CG 4.27Å; K436-W778 HydrophobicContact CB-CZ3 3.84Å; K436-W778 HydrophobicContact CD-CB 4.39Å; K436-W778 HydrophobicContact CD-CE3 4.35Å; K436-W778 HydrophobicContact CG-CE3 4.47Å
437	Y	83.4	Confident	88.4	Confident	128 Å²	128	57.3 Å²	57.3	50%	0.502	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-1.2	179.4	-62.7	-63.8	0	0	0	114	P435 L439 F777 W778	P435-Y437 PolarHBondContact O-N 2.96Å; Y437-L439 VanDerWaalsContact C-N 3.29Å; Y437-L439 PolarHBondContact O-N 2.8Å; Y437-F777 HydrophobicContact CD2-CE2 4.02Å; Y437-F777 AromaticContact CD2-CZ 3.63Å; Y437-F777 HydrophobicContact CD2-CZ 3.63Å; Y437-F777 AromaticContact CE2-CE2 3.7Å; Y437-F777 HydrophobicContact CE2-CE2 3.7Å; Y437-F777 AromaticContact CE2-CZ 3.83Å; Y437-F777 HydrophobicContact CE2-CZ 3.83Å; Y437-W778 HydrophobicContact CD2-CB 3.7Å; Y437-W778 HydrophobicContact CD2-CG 4.18Å; Y437-W778 HydrophobicContact CE2-CB 3.46Å; Y437-W778 VanDerWaalsContact CE2-CB 3.46Å; Y437-W778 HydrophobicContact CE2-CG 4.41Å
438	C	83.1	Confident	88.6	Confident	10 Å²	10	55.4 Å²	55.4	7%	0.068	27%	0.267	C	S	.	.			trans	-73.4	86.3	162.1	178.3	0	0	0	0	107.8	L434 P435 P440 Y469	L434-C438 HydrophobicContact CB-CB 4.42Å; P435-C438 HydrophobicContact CB-CB 4Å; P435-C438 HydrophobicContact CG-CB 4.36Å; P435-C438 WeakPolarHBondContact O-CA 3.2Å; P435-C438 VanDerWaalsContact O-CB 3.3Å; P435-C438 WeakPolarHBondContact O-CB 3.02Å; P435-C438 PolarHBondContact O-N 2.92Å; C438-P440 VanDerWaalsContact O-CD 3.28Å; C438-P440 WeakPolarHBondContact O-CD 3.34Å; C438-Y469 PolarHBondContact SG-OH 3.08Å
439	L	83.8	Confident	88.6	Confident	85 Å²	85	53.6 Å²	53.6	45%	0.445	25%	0.25	S	C	.	.			trans	-80.7	112.3	168.8	-60.5	175.4	0	0	0	108.1	Y437 W460	Y437-L439 VanDerWaalsContact C-N 3.29Å; Y437-L439 PolarHBondContact O-N 2.8Å; L439-W460 HydrophobicContact CB-CB 4.08Å; L439-W460 HydrophobicContact CB-CG 4.12Å; L439-W460 PolarHBondContact O-N 2.84Å
440	P	86.9	Confident	88.3	Confident	37 Å²	37	53.4 Å²	53.4	24%	0.24	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	135.1	178.3	30.8	-35.4	0	0	0	110.7	Y420 L434 C438 V457	Y420-P440 HydrophobicContact CD2-CG 4.43Å; Y420-P440 HydrophobicContact CE2-CB 4.13Å; Y420-P440 HydrophobicContact CE2-CG 3.85Å; L434-P440 HydrophobicContact CD1-CB 4.11Å; L434-P440 HydrophobicContact CD1-CG 3.98Å; C438-P440 VanDerWaalsContact O-CD 3.28Å; C438-P440 WeakPolarHBondContact O-CD 3.34Å; P440-V457 HydrophobicContact CB-CG1 3.9Å
441	K	86.1	Confident	88.1	Confident	100 Å²	100	51.5 Å²	51.5	44%	0.435	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-41.7	159.8	-76.9	167	176.3	148.8	0	110.8	Q458 E459 W460 Q462	K441-Q458 HydrophobicContact CB-CB 4.46Å; K441-Q458 HydrophobicContact CB-CG 4.27Å; K441-Q458 HydrophobicContact CD-CG 4.08Å; K441-Q458 PolarHBondContact N-O 3.48Å; K441-E459 PolarHBondContact NZ-O 2.88Å; K441-W460 WeakPolarHBondContact CE-O 3.32Å; K441-W460 VanDerWaalsContact NZ-C 3.34Å; K441-W460 PolarHBondContact NZ-O 3.26Å; K441-Q462 PolarHBondContact NZ-O 3.16Å
442	D	87.6	Confident	88.1	Confident	38 Å²	38	48.1 Å²	48.1	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	153.2	-175.5	-162.4	0.3	0	0	0	108.9	H444 Q458 Y466 R489	D442-H444 IonicContact OD1-CD2 3.11Å; D442-H444 IonicContact OD1-CE1 3.63Å; D442-H444 IonicContact OD1-NE2 2.64Å; D442-H444 PolarHBondContact OD1-NE2 3.39Å; D442-H444 IonicContact OD2-CD2 3.8Å; D442-H444 IonicContact OD2-CE1 3.89Å; D442-H444 IonicContact OD2-NE2 2.96Å; D442-H444 PolarHBondContact OD2-NE2 2.59Å; D442-Q458 HydrophobicContact CB-CB 4.36Å; D442-Q458 PolarHBondContact O-N 3.03Å; D442-Y466 PolarHBondContact OD2-OH 3.18Å; D442-R489 IonicContact OD2-NH2 2.68Å
443	M	90.5	Very high	88.2	Confident	15 Å²	15	47.3 Å²	47.3	7%	0.074	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	125.1	-179	178.9	174.1	-170.5	0	0	110.7	Y420 M432 L434 A455 A456 V457 F478	Y420-M443 HydrophobicContact CD1-CB 4.26Å; Y420-M443 HydrophobicContact CD1-SD 4.4Å; Y420-M443 HydrophobicContact CD2-CB 4.32Å; Y420-M443 HydrophobicContact CD2-SD 3.95Å; Y420-M443 HydrophobicContact CE1-CB 3.75Å; Y420-M443 HydrophobicContact CE2-CB 3.85Å; Y420-M443 HydrophobicContact CE2-SD 4.38Å; Y420-M443 HydrophobicContact CG-SD 3.98Å; Y420-M443 PolarHBondContact OH-N 2.99Å; M432-M443 HydrophobicContact CE-CE 3.67Å; M432-M443 HydrophobicContact CE-SD 4.34Å; L434-M443 HydrophobicContact CD1-SD 4.2Å; L434-M443 HydrophobicContact CD2-CE 4.44Å; M443-A455 HydrophobicContact CE-CB 3.42Å; M443-A455 VanDerWaalsContact CE-CB 3.42Å; M443-A455 HydrophobicContact CG-CB 4.43Å; M443-A456 CarbonylContact C-O 3.59Å; M443-A456 WeakPolarHBondContact CA-O 3.38Å; M443-V457 HydrophobicContact CB-CG2 4.39Å; M443-V457 HydrophobicContact CE-CG2 4.06Å; M443-V457 HydrophobicContact CG-CG2 3.86Å; M443-V457 HydrophobicContact SD-CG2 4.05Å; M443-F478 HydrophobicContact CE-CD1 4.47Å; M443-F478 HydrophobicContact CE-CE1 4.11Å; M443-F478 HydrophobicContact CE-CE2 4.31Å; M443-F478 HydrophobicContact CE-CZ 4.03Å
444	H	90.3	Very high	88.3	Confident	61 Å²	61	43.4 Å²	43.4	28%	0.282	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.5	-179.8	-64.1	-93.6	0	0	0	109.9	D442 A455 A456 L495	D442-H444 IonicContact OD1-CD2 3.11Å; D442-H444 IonicContact OD1-CE1 3.63Å; D442-H444 IonicContact OD1-NE2 2.64Å; D442-H444 PolarHBondContact OD1-NE2 3.39Å; D442-H444 IonicContact OD2-CD2 3.8Å; D442-H444 IonicContact OD2-CE1 3.89Å; D442-H444 IonicContact OD2-NE2 2.96Å; D442-H444 PolarHBondContact OD2-NE2 2.59Å; H444-A455 CarbonylContact O-C 3.27Å; H444-A455 WeakPolarHBondContact O-CA 3.23Å; H444-A455 WeakPolarHBondContact O-CB 3.4Å; H444-A456 PolarHBondContact N-O 3.33Å; H444-A456 PolarHBondContact O-N 2.03Å; H444-L495 HydrophobicContact CB-CD2 4.15Å; H444-L495 VanDerWaalsContact CD2-CD2 3.48Å; H444-L495 WeakPolarHBondContact CD2-CD2 3.38Å
445	I	92.4	Very high	88.4	Confident	41 Å²	41	42.4 Å²	42.4	21%	0.21	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.6	169.6	-51.6	-55	0	0	0	107.6	F409 M432 T448 V453 A455	F409-I445 HydrophobicContact CD1-CD1 4.06Å; F409-I445 HydrophobicContact CD1-CG1 4.37Å; F409-I445 HydrophobicContact CD2-CG1 4Å; F409-I445 HydrophobicContact CE1-CD1 4.05Å; F409-I445 HydrophobicContact CE2-CD1 4.5Å; F409-I445 HydrophobicContact CE2-CG1 4.17Å; F409-I445 HydrophobicContact CE2-CG2 4.21Å; F409-I445 HydrophobicContact CG-CD1 4.28Å; F409-I445 HydrophobicContact CG-CG1 4.1Å; F409-I445 HydrophobicContact CZ-CD1 4.28Å; F409-I445 HydrophobicContact CZ-CG1 4.44Å; F409-I445 HydrophobicContact CZ-CG2 4.48Å; M432-I445 HydrophobicContact CE-CD1 4.18Å; I445-T448 HydrophobicContact CG2-CG2 4.27Å; I445-V453 HydrophobicContact CD1-CG1 3.99Å; I445-V453 HydrophobicContact CG2-CG1 3.96Å; I445-A455 HydrophobicContact CD1-CB 4.3Å
446	I	90.4	Very high	88.6	Confident	29 Å²	29	41.3 Å²	41.3	15%	0.149	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-40.7	179.9	-55.2	165.8	0	0	0	110.3	F454 A456 L468 V497 F499	I446-F454 HydrophobicContact CB-CB 4.24Å; I446-F454 PolarHBondContact N-O 2.78Å; I446-A456 HydrophobicContact CD1-CB 3.95Å; I446-A456 HydrophobicContact CG1-CB 4.12Å; I446-L468 HydrophobicContact CD1-CD1 3.35Å; I446-V497 HydrophobicContact CD1-CG1 4.32Å; I446-F499 HydrophobicContact CG2-CD1 3.67Å; I446-F499 HydrophobicContact CG2-CE1 4.23Å; I446-F499 HydrophobicContact CG2-CG 4.39Å
447	S	89.9	Confident	89	Confident	18 Å²	18	35.4 Å²	35.4	13%	0.126	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	150.3	177.7	-169.5	0	0	0	0	111.3	D449 F454	S447-D449 WeakPolarHBondContact OG-CB 3.09Å; S447-D449 PolarHBondContact OG-N 2.89Å; S447-F454 PolarHBondContact N-O 3.41Å; S447-F454 PolarHBondContact O-N 2.81Å
448	T	91.6	Very high	89.4	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.151	C	C	.	.			trans	-104.9	11.1	168.5	54.1	0	0	0	0	114.4	Q404 D405 Y407 F409 I445 Q452 V453	Q404-T448 HydrophobicContact CB-CG2 4.45Å; Q404-T448 HydrophobicContact CG-CG2 4.44Å; Q404-T448 WeakPolarHBondContact CG-OG1 3.35Å; Q404-T448 PolarHBondContact NE2-OG1 2.96Å; D405-T448 PolarHBondContact OD2-OG1 2.76Å; Y407-T448 HydrophobicContact CD2-CG2 3.5Å; Y407-T448 VanDerWaalsContact CD2-CG2 3.5Å; Y407-T448 HydrophobicContact CE2-CG2 4.02Å; Y407-T448 HydrophobicContact CG-CG2 4.11Å; F409-T448 HydrophobicContact CE2-CG2 3.72Å; F409-T448 HydrophobicContact CZ-CG2 3.86Å; I445-T448 HydrophobicContact CG2-CG2 4.27Å; T448-Q452 CarbonylContact C-O 3.55Å; T448-Q452 VanDerWaalsContact C-O 3.32Å; T448-Q452 WeakPolarHBondContact CA-O 3.46Å; T448-V453 HydrophobicContact CG2-CG1 4.35Å; T448-V453 HydrophobicContact CG2-CG2 4.29Å
449	D	84.5	Confident	89.7	Confident	47 Å²	47	31.2 Å²	31.2	25%	0.251	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-53.7	150	-176.6	-111.2	-27.1	0	0	0	114	S447 K451 Q452 K501	S447-D449 WeakPolarHBondContact OG-CB 3.09Å; S447-D449 PolarHBondContact OG-N 2.89Å; D449-K451 PolarHBondContact O-N 3.4Å; D449-Q452 PolarHBondContact O-N 2.95Å; D449-K501 IonicContact OD1-NZ 3.4Å; D449-K501 VanDerWaalsContact OD2-CD 3.28Å; D449-K501 WeakPolarHBondContact OD2-CD 3.35Å; D449-K501 IonicContact OD2-NZ 3.56Å; D449-K501 PolarHBondContact OD2-NZ 3.47Å
450	E	82.8	Confident	89.4	Confident	30 Å²	30	34.2 Å²	34.2	14%	0.14	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	53.4	33.7	178.6	-54.9	-175.8	-164.8	0	0	114.7	Q452 N506 G507 K527 S805	E450-Q452 VanDerWaalsContact C-N 3.31Å; E450-Q452 PolarHBondContact O-N 3.36Å; E450-N506 WeakPolarHBondContact OE1-CA 3.35Å; E450-G507 PolarHBondContact OE1-N 2.92Å; E450-K527 PolarHBondContact O-NZ 3.3Å; E450-K527 VanDerWaalsContact OE2-CE 3.28Å; E450-K527 WeakPolarHBondContact OE2-CE 3.43Å; E450-K527 IonicContact OE2-NZ 3.98Å; E450-K527 PolarHBondContact OE2-NZ 2.86Å; E450-S805 PolarHBondContact O-OG 2.9Å
451	K	84.9	Confident	89	Confident	103 Å²	103	36.9 Å²	36.9	45%	0.448	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	59.9	35.6	175.3	-58.1	175.6	168.2	-89.5	0	114.1	E406 Y407 D449	E406-K451 IonicContact OE1-NZ 2.8Å; E406-K451 PolarHBondContact OE1-NZ 2.86Å; E406-K451 IonicContact OE2-NZ 2.96Å; E406-K451 PolarHBondContact OE2-NZ 2.92Å; Y407-K451 PolarHBondContact OH-O 2.91Å; D449-K451 PolarHBondContact O-N 3.4Å
452	Q	89.6	Confident	88.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.156	C	C	.	.			trans	-147.2	143	176.8	-162.8	168.3	16.1	0	0	109	T448 D449 E450 I470 S471 E760 L804	T448-Q452 CarbonylContact C-O 3.55Å; T448-Q452 VanDerWaalsContact C-O 3.32Å; T448-Q452 WeakPolarHBondContact CA-O 3.46Å; D449-Q452 PolarHBondContact O-N 2.95Å; E450-Q452 VanDerWaalsContact C-N 3.31Å; E450-Q452 PolarHBondContact O-N 3.36Å; Q452-I470 VanDerWaalsContact CD-CD1 3.41Å; Q452-I470 HydrophobicContact CG-CD1 4.11Å; Q452-I470 HydrophobicContact CG-CG1 3.75Å; Q452-S471 WeakPolarHBondContact CG-O 3.33Å; Q452-S471 PolarHBondContact NE2-O 3.41Å; Q452-E760 PolarHBondContact NE2-OE1 3.06Å; Q452-L804 HydrophobicContact CB-CD1 4.06Å; Q452-L804 HydrophobicContact CG-CD1 3.83Å
453	V	94.8	Very high	87.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.185	C	C	.	.			trans	-98.2	120.8	-175.8	-169.4	0	0	0	0	109.6	Y407 F409 I445 T448 I470 S471 F478	Y407-V453 HydrophobicContact CD1-CG2 3.91Å; Y407-V453 HydrophobicContact CD2-CG2 4.43Å; Y407-V453 HydrophobicContact CE1-CG2 3.6Å; Y407-V453 HydrophobicContact CE2-CG2 4.15Å; Y407-V453 HydrophobicContact CG-CG2 4.32Å; F409-V453 HydrophobicContact CE1-CG1 4Å; F409-V453 HydrophobicContact CE1-CG2 4.19Å; F409-V453 HydrophobicContact CZ-CB 4.4Å; F409-V453 HydrophobicContact CZ-CG1 3.66Å; F409-V453 HydrophobicContact CZ-CG2 3.78Å; I445-V453 HydrophobicContact CD1-CG1 3.99Å; I445-V453 HydrophobicContact CG2-CG1 3.96Å; T448-V453 HydrophobicContact CG2-CG1 4.35Å; T448-V453 HydrophobicContact CG2-CG2 4.29Å; V453-I470 WeakPolarHBondContact O-CA 3.01Å; V453-S471 WeakPolarHBondContact CB-OG 3.34Å; V453-S471 PolarHBondContact N-OG 2.99Å; V453-S471 PolarHBondContact O-N 2.95Å; V453-F478 HydrophobicContact CB-CE1 4.2Å; V453-F478 HydrophobicContact CB-CZ 4.12Å; V453-F478 HydrophobicContact CG1-CE1 4.25Å; V453-F478 HydrophobicContact CG1-CZ 4.11Å
454	F	94.4	Very high	86.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	134.1	166.1	-72.1	-88.1	0	0	0	109.8	I446 S447 L468 I470 F499 Y509 K527	I446-F454 HydrophobicContact CB-CB 4.24Å; I446-F454 PolarHBondContact N-O 2.78Å; S447-F454 PolarHBondContact N-O 3.41Å; S447-F454 PolarHBondContact O-N 2.81Å; F454-L468 HydrophobicContact CB-CD1 4.49Å; F454-L468 HydrophobicContact CD1-CD1 4.11Å; F454-L468 HydrophobicContact CD1-CD2 4.39Å; F454-L468 HydrophobicContact CD1-CG 4.4Å; F454-I470 HydrophobicContact CD1-CB 4.37Å; F454-I470 HydrophobicContact CD1-CD1 4.25Å; F454-I470 HydrophobicContact CD1-CG1 4.1Å; F454-I470 HydrophobicContact CE1-CB 4.34Å; F454-I470 HydrophobicContact CE1-CD1 3.51Å; F454-I470 HydrophobicContact CE1-CG1 3.87Å; F454-I470 HydrophobicContact CE2-CD1 4.25Å; F454-I470 HydrophobicContact CZ-CD1 3.52Å; F454-I470 HydrophobicContact CZ-CG1 4.13Å; F454-F499 HydrophobicContact CD1-CE2 4.45Å; F454-F499 AromaticContact CD1-CZ 3.86Å; F454-F499 HydrophobicContact CD1-CZ 3.86Å; F454-F499 AromaticContact CE1-CZ 3.96Å; F454-F499 HydrophobicContact CE1-CZ 3.96Å; F454-F499 HydrophobicContact CG-CE1 4.49Å; F454-F499 HydrophobicContact CG-CZ 4.18Å; F454-F499 HydrophobicContact CZ-CZ 4.38Å; F454-Y509 HydrophobicContact CE2-CE1 4.3Å; F454-Y509 HydrophobicContact CE2-CE2 4.48Å; F454-Y509 AromaticContact CE2-CZ 3.85Å; F454-Y509 WeakPolarHBondContact CE2-OH 3.3Å; F454-Y509 HydrophobicContact CZ-CE1 4.41Å; F454-Y509 HydrophobicContact CZ-CE2 4.11Å; F454-Y509 AromaticContact CZ-CZ 3.9Å; F454-K527 HydrophobicContact CE2-CG 4.4Å; F454-K527 HydrophobicContact CZ-CG 3.8Å
455	A	94.9	Very high	86.6	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.8	179	0	0	0	0	0	112.3	M443 H444 I445 Y469 F478	M443-A455 HydrophobicContact CE-CB 3.42Å; M443-A455 VanDerWaalsContact CE-CB 3.42Å; M443-A455 HydrophobicContact CG-CB 4.43Å; H444-A455 CarbonylContact O-C 3.27Å; H444-A455 WeakPolarHBondContact O-CA 3.23Å; H444-A455 WeakPolarHBondContact O-CB 3.4Å; I445-A455 HydrophobicContact CD1-CB 4.3Å; A455-Y469 PolarHBondContact N-O 3.49Å; A455-Y469 PolarHBondContact O-N 3.43Å; A455-F478 HydrophobicContact CB-CE1 4.07Å
456	A	94.2	Very high	86.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.8	167.6	0	0	0	0	0	108.4	M443 H444 I446 Y466 L485 L495 V497	M443-A456 CarbonylContact C-O 3.59Å; M443-A456 WeakPolarHBondContact CA-O 3.38Å; H444-A456 PolarHBondContact N-O 3.33Å; H444-A456 PolarHBondContact O-N 2.03Å; I446-A456 HydrophobicContact CD1-CB 3.95Å; I446-A456 HydrophobicContact CG1-CB 4.12Å; A456-Y466 HydrophobicContact CB-CD1 3.83Å; A456-Y466 HydrophobicContact CB-CG 4.41Å; A456-L485 HydrophobicContact CB-CD1 4.48Å; A456-L495 HydrophobicContact CB-CD2 4.44Å; A456-V497 HydrophobicContact CB-CG2 4.14Å
457	V	93.7	Very high	86.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.2	177.8	-180	0	0	0	0	109.2	L434 P440 M443 Y466 S467 Y469	L434-V457 HydrophobicContact CD1-CG1 4.12Å; L434-V457 HydrophobicContact CD1-CG2 4.26Å; L434-V457 HydrophobicContact CD2-CG2 3.85Å; P440-V457 HydrophobicContact CB-CG1 3.9Å; M443-V457 HydrophobicContact CB-CG2 4.39Å; M443-V457 HydrophobicContact CE-CG2 4.06Å; M443-V457 HydrophobicContact CG-CG2 3.86Å; M443-V457 HydrophobicContact SD-CG2 4.05Å; V457-Y466 CarbonylContact O-C 3.46Å; V457-Y466 WeakPolarHBondContact O-CA 3.36Å; V457-S467 PolarHBondContact N-O 2.87Å; V457-S467 PolarHBondContact O-N 2.97Å; V457-Y469 HydrophobicContact CB-CD2 3.62Å; V457-Y469 HydrophobicContact CB-CE2 3.78Å; V457-Y469 HydrophobicContact CG1-CE2 4.32Å; V457-Y469 HydrophobicContact CG2-CD2 3.47Å; V457-Y469 VanDerWaalsContact CG2-CD2 3.47Å; V457-Y469 HydrophobicContact CG2-CE2 4.06Å; V457-Y469 HydrophobicContact CG2-CG 4.13Å
458	Q	91.3	Very high	87	Confident	22 Å²	22	36.9 Å²	36.9	10%	0.103	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.5	168.9	-179.5	171.8	9.7	0	0	109.9	K441 D442 Q462 Y466	K441-Q458 HydrophobicContact CB-CB 4.46Å; K441-Q458 HydrophobicContact CB-CG 4.27Å; K441-Q458 HydrophobicContact CD-CG 4.08Å; K441-Q458 PolarHBondContact N-O 3.48Å; D442-Q458 HydrophobicContact CB-CB 4.36Å; D442-Q458 PolarHBondContact O-N 3.03Å; Q458-Q462 PolarHBondContact NE2-O 3.44Å; Q458-Y466 HydrophobicContact CB-CD1 3.86Å; Q458-Y466 HydrophobicContact CB-CD2 4.29Å; Q458-Y466 HydrophobicContact CB-CE1 3.58Å; Q458-Y466 HydrophobicContact CB-CE2 3.99Å; Q458-Y466 HydrophobicContact CB-CG 4.2Å; Q458-Y466 HydrophobicContact CG-CE2 4.4Å; Q458-Y466 PolarHBondContact OE1-OH 2.88Å; Q458-Y466 VanDerWaalsContact OE1-OH 3.08Å
459	E	88.3	Confident	87.2	Confident	29 Å²	29	37.2 Å²	37.2	14%	0.136	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	152.5	-177.2	-56	-179.3	-148.4	0	0	112.1	K441 N461 Q462 S467 Y469	K441-E459 PolarHBondContact NZ-O 2.88Å; E459-N461 VanDerWaalsContact CB-OD1 3.29Å; E459-N461 WeakPolarHBondContact CB-OD1 3.4Å; E459-N461 PolarHBondContact O-N 2.77Å; E459-N461 VanDerWaalsContact O-N 3.13Å; E459-Q462 HydrophobicContact CB-CB 4.38Å; E459-Q462 HydrophobicContact CB-CG 3.97Å; E459-Q462 PolarHBondContact O-N 2.76Å; E459-S467 WeakPolarHBondContact OE1-CB 3.06Å; E459-S467 PolarHBondContact OE1-OG 2.81Å; E459-Y469 PolarHBondContact OE1-OH 2.82Å
460	W	79.5	Confident	87.6	Confident	148 Å²	148	35.1 Å²	35.1	56%	0.561	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.4	-175.8	71.4	-84.9	0	0	0	114.5	L439 K441	L439-W460 HydrophobicContact CB-CB 4.08Å; L439-W460 HydrophobicContact CB-CG 4.12Å; L439-W460 PolarHBondContact O-N 2.84Å; K441-W460 WeakPolarHBondContact CE-O 3.32Å; K441-W460 VanDerWaalsContact NZ-C 3.34Å; K441-W460 PolarHBondContact NZ-O 3.26Å
461	N	77.1	Confident	88.2	Confident	93 Å²	93	33.7 Å²	33.7	50%	0.497	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.8	177.4	59	-12.5	0	0	0	113.5	E459	E459-N461 VanDerWaalsContact CB-OD1 3.29Å; E459-N461 WeakPolarHBondContact CB-OD1 3.4Å; E459-N461 PolarHBondContact O-N 2.77Å; E459-N461 VanDerWaalsContact O-N 3.13Å
462	Q	75.3	Confident	88.5	Confident	20 Å²	20	30.2 Å²	30.2	9%	0.093	15%	0.149	C	C	.	.			trans	-83.9	128.1	-176	-75.2	172.2	-11.3	0	0	112.3	K441 Q458 E459 N464 T465 S467	K441-Q462 PolarHBondContact NZ-O 3.16Å; Q458-Q462 PolarHBondContact NE2-O 3.44Å; E459-Q462 HydrophobicContact CB-CB 4.38Å; E459-Q462 HydrophobicContact CB-CG 3.97Å; E459-Q462 PolarHBondContact O-N 2.76Å; Q462-N464 PolarHBondContact O-N 2.72Å; Q462-T465 PolarHBondContact OE1-O 3.1Å; Q462-S467 PolarHBondContact NE2-OG 2.76Å
463	N	66.5	Low	88.6	Confident	151 Å²	151	31.6 Å²	31.6	81%	0.807	16%	0.158	S	C	*	.	S	Bend	trans	-89.5	83	175.1	-78.2	-13.1	0	0	0	110.1	T465	N463-T465 PolarHBondContact O-N 3.03Å
464	N	74.4	Confident	88.4	Confident	105 Å²	105	33.4 Å²	33.4	56%	0.561	17%	0.17	S	C	*	.	S	Bend	trans	63.2	19.2	175.7	-153.9	75.4	0	0	0	115.9	Q462	Q462-N464 PolarHBondContact O-N 2.72Å
465	T	87.2	Confident	88.4	Confident	25 Å²	25	33.4 Å²	33.4	15%	0.153	17%	0.17	C	C	.	.			trans	-94.1	160.9	159.1	57.5	0	0	0	0	110.7	Q462 N463 N484 I514	Q462-T465 PolarHBondContact OE1-O 3.1Å; N463-T465 PolarHBondContact O-N 3.03Å; T465-N484 PolarHBondContact OG1-OD1 3.31Å; T465-N484 VanDerWaalsContact OG1-OD1 3.1Å; T465-I514 HydrophobicContact CG2-CD1 4.09Å
466	Y	93.1	Very high	88.2	Confident	1 Å²	1	33.9 Å²	33.9	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	155.7	174.1	-76.3	-110.8	0	0	0	109.7	D442 A456 V457 Q458 N484 L485 T487 L495	D442-Y466 PolarHBondContact OD2-OH 3.18Å; A456-Y466 HydrophobicContact CB-CD1 3.83Å; A456-Y466 HydrophobicContact CB-CG 4.41Å; V457-Y466 CarbonylContact O-C 3.46Å; V457-Y466 WeakPolarHBondContact O-CA 3.36Å; Q458-Y466 HydrophobicContact CB-CD1 3.86Å; Q458-Y466 HydrophobicContact CB-CD2 4.29Å; Q458-Y466 HydrophobicContact CB-CE1 3.58Å; Q458-Y466 HydrophobicContact CB-CE2 3.99Å; Q458-Y466 HydrophobicContact CB-CG 4.2Å; Q458-Y466 HydrophobicContact CG-CE2 4.4Å; Q458-Y466 PolarHBondContact OE1-OH 2.88Å; Q458-Y466 VanDerWaalsContact OE1-OH 3.08Å; Y466-N484 CarbonylContact O-C 3.5Å; Y466-N484 WeakPolarHBondContact O-CA 3.44Å; Y466-N484 PolarHBondContact O-N 2.59Å; Y466-N484 VanDerWaalsContact O-N 3.16Å; Y466-L485 PolarHBondContact O-N 2.87Å; Y466-T487 HydrophobicContact CD2-CG2 3.89Å; Y466-T487 HydrophobicContact CG-CG2 4.04Å; Y466-L495 HydrophobicContact CD1-CD2 3.94Å; Y466-L495 HydrophobicContact CE1-CD2 3.55Å; Y466-L495 HydrophobicContact CE2-CD1 3.99Å; Y466-L495 HydrophobicContact CE2-CD2 4.26Å; Y466-L495 HydrophobicContact CG-CD2 4.45Å
467	S	94.2	Very high	88.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.7	172.1	-67.8	0	0	0	0	110	V457 E459 Q462	V457-S467 PolarHBondContact N-O 2.87Å; V457-S467 PolarHBondContact O-N 2.97Å; E459-S467 WeakPolarHBondContact OE1-CB 3.06Å; E459-S467 PolarHBondContact OE1-OG 2.81Å; Q462-S467 PolarHBondContact NE2-OG 2.76Å
468	L	95.2	Very high	88.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	123.1	171.4	-170.5	61.7	0	0	0	110.1	I446 F454 S481 L482 L485 F499 W531	I446-L468 HydrophobicContact CD1-CD1 3.35Å; F454-L468 HydrophobicContact CB-CD1 4.49Å; F454-L468 HydrophobicContact CD1-CD1 4.11Å; F454-L468 HydrophobicContact CD1-CD2 4.39Å; F454-L468 HydrophobicContact CD1-CG 4.4Å; L468-S481 WeakPolarHBondContact O-CB 3.29Å; L468-S481 PolarHBondContact O-N 2.78Å; L468-L482 HydrophobicContact CB-CB 3.93Å; L468-L482 WeakPolarHBondContact CB-O 3.43Å; L468-L482 HydrophobicContact CD2-CB 4.22Å; L468-L482 PolarHBondContact N-O 2.9Å; L468-L482 PolarHBondContact O-N 2.79Å; L468-L485 HydrophobicContact CB-CD1 3.86Å; L468-L485 HydrophobicContact CB-CD2 4.23Å; L468-L485 HydrophobicContact CB-CG 4.19Å; L468-L485 HydrophobicContact CD1-CD1 4.3Å; L468-F499 HydrophobicContact CD1-CD2 4.47Å; L468-F499 HydrophobicContact CD1-CE2 4.38Å; L468-F499 HydrophobicContact CD2-CD2 4.03Å; L468-F499 HydrophobicContact CD2-CE2 3.66Å; L468-W531 HydrophobicContact CD2-CZ2 3.82Å
469	Y	94.8	Very high	88.3	Confident	7 Å²	7	37 Å²	37	3%	0.027	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.8	173.1	-76.9	-90.2	0	0	0	110.9	L434 P435 C438 A455 V457 E459 F478 I479 L480	L434-Y469 HydrophobicContact CD2-CD1 3.98Å; L434-Y469 HydrophobicContact CD2-CD2 4.37Å; L434-Y469 HydrophobicContact CD2-CE1 4.37Å; L434-Y469 HydrophobicContact CD2-CG 4Å; P435-Y469 HydrophobicContact CG-CE1 3.84Å; C438-Y469 PolarHBondContact SG-OH 3.08Å; A455-Y469 PolarHBondContact N-O 3.49Å; A455-Y469 PolarHBondContact O-N 3.43Å; V457-Y469 HydrophobicContact CB-CD2 3.62Å; V457-Y469 HydrophobicContact CB-CE2 3.78Å; V457-Y469 HydrophobicContact CG1-CE2 4.32Å; V457-Y469 HydrophobicContact CG2-CD2 3.47Å; V457-Y469 VanDerWaalsContact CG2-CD2 3.47Å; V457-Y469 HydrophobicContact CG2-CE2 4.06Å; V457-Y469 HydrophobicContact CG2-CG 4.13Å; E459-Y469 PolarHBondContact OE1-OH 2.82Å; Y469-F478 HydrophobicContact CD1-CB 4.34Å; Y469-I479 CarbonylContact C-O 3.53Å; Y469-I479 VanDerWaalsContact CA-O 3.31Å; Y469-I479 WeakPolarHBondContact CA-O 3.45Å; Y469-I479 WeakPolarHBondContact CD1-O 3.42Å; Y469-L480 HydrophobicContact CD1-CB 4.36Å; Y469-L480 HydrophobicContact CE1-CB 3.87Å; Y469-L480 HydrophobicContact CE1-CD1 4.24Å; Y469-L480 HydrophobicContact CE2-CD1 4.19Å
470	I	94.6	Very high	88.5	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.8	-178.3	-164.6	-179.8	0	0	0	111.4	Q452 V453 F454 F478 I479 K527	Q452-I470 VanDerWaalsContact CD-CD1 3.41Å; Q452-I470 HydrophobicContact CG-CD1 4.11Å; Q452-I470 HydrophobicContact CG-CG1 3.75Å; V453-I470 WeakPolarHBondContact O-CA 3.01Å; F454-I470 HydrophobicContact CD1-CB 4.37Å; F454-I470 HydrophobicContact CD1-CD1 4.25Å; F454-I470 HydrophobicContact CD1-CG1 4.1Å; F454-I470 HydrophobicContact CE1-CB 4.34Å; F454-I470 HydrophobicContact CE1-CD1 3.51Å; F454-I470 HydrophobicContact CE1-CG1 3.87Å; F454-I470 HydrophobicContact CE2-CD1 4.25Å; F454-I470 HydrophobicContact CZ-CD1 3.52Å; F454-I470 HydrophobicContact CZ-CG1 4.13Å; I470-F478 WeakPolarHBondContact O-CA 3.5Å; I470-I479 HydrophobicContact CG2-CD1 4.08Å; I470-I479 HydrophobicContact CG2-CG1 3.51Å; I470-I479 PolarHBondContact N-O 2.71Å; I470-I479 PolarHBondContact O-N 2.84Å; I470-K527 HydrophobicContact CD1-CG 4.21Å; I470-K527 WeakPolarHBondContact CD1-O 3.44Å
471	S	94.6	Very high	89.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.178	C	C	.	.			trans	-83.9	175.9	-172	75.8	0	0	0	0	114.7	Q452 V453 Y477 R801	Q452-S471 WeakPolarHBondContact CG-O 3.33Å; Q452-S471 PolarHBondContact NE2-O 3.41Å; V453-S471 WeakPolarHBondContact CB-OG 3.34Å; V453-S471 PolarHBondContact N-OG 2.99Å; V453-S471 PolarHBondContact O-N 2.95Å; S471-Y477 CarbonylContact C-O 3.53Å; S471-Y477 WeakPolarHBondContact CA-O 3.32Å; S471-R801 PolarHBondContact O-NH2 3.31Å
472	D	91.3	Very high	90	Very high	31 Å²	31	29.4 Å²	29.4	17%	0.166	16%	0.158	C	C	.	.			trans	-77.7	172.7	152.7	70.4	-32.7	0	0	0	110.9	P474 G475 V476 Y477	D472-P474 WeakPolarHBondContact OD2-CD 3.31Å; D472-G475 WeakPolarHBondContact O-CA 3.49Å; D472-G475 PolarHBondContact O-N 3.24Å; D472-G475 PolarHBondContact OD1-N 3.38Å; D472-V476 WeakPolarHBondContact OD1-CA 3.45Å; D472-V476 PolarHBondContact OD1-N 2.67Å; D472-Y477 PolarHBondContact N-O 2.87Å; D472-Y477 PolarHBondContact OD1-N 2.89Å; D472-Y477 WeakPolarHBondContact OD2-CD2 3.38Å
473	S	90.9	Very high	90.8	Very high	29 Å²	29	32.9 Å²	32.9	20%	0.203	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-40.8	-176.4	155.6	0	0	0	0	113.3	Y407 G475	Y407-S473 VanDerWaalsContact CE1-O 3.29Å; Y407-S473 WeakPolarHBondContact CE1-O 3.42Å; Y407-S473 PolarHBondContact OH-O 3.17Å; S473-G475 PolarHBondContact O-N 3.13Å; S473-G475 VanDerWaalsContact O-N 3.13Å
474	P	91.9	Very high	92.1	Very high	37 Å²	37	28.1 Å²	28.1	24%	0.24	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-4.5	168.8	-28.9	36.2	0	0	0	117.3	Y424 D472 V476	Y424-P474 HydrophobicContact CD1-CB 4.38Å; D472-P474 WeakPolarHBondContact OD2-CD 3.31Å; P474-V476 VanDerWaalsContact C-N 3.32Å; P474-V476 HydrophobicContact CB-CG2 4.1Å; P474-V476 PolarHBondContact O-N 3.36Å
475	G	93	Very high	93	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	74.5	15.3	179.7	0	0	0	0	0	114.9	V422 D472 S473 F478	V422-G475 WeakPolarHBondContact CG1-O 3.49Å; D472-G475 WeakPolarHBondContact O-CA 3.49Å; D472-G475 PolarHBondContact O-N 3.24Å; D472-G475 PolarHBondContact OD1-N 3.38Å; S473-G475 PolarHBondContact O-N 3.13Å; S473-G475 VanDerWaalsContact O-N 3.13Å; G475-F478 WeakPolarHBondContact O-CE2 3.49Å
476	V	92.3	Very high	93.2	Very high	10 Å²	10	25.4 Å²	25.4	6%	0.061	13%	0.128	C	C	.	.			trans	-99.1	-45.8	-169.2	176.7	0	0	0	0	112.6	V422 R430 K433 D472 P474	V422-V476 HydrophobicContact CG1-CG2 3.75Å; R430-V476 HydrophobicContact CB-CG2 4.14Å; K433-V476 HydrophobicContact CG-CG1 4.32Å; K433-V476 PolarHBondContact N-O 2.85Å; D472-V476 WeakPolarHBondContact OD1-CA 3.45Å; D472-V476 PolarHBondContact OD1-N 2.67Å; P474-V476 VanDerWaalsContact C-N 3.32Å; P474-V476 HydrophobicContact CB-CG2 4.1Å; P474-V476 PolarHBondContact O-N 3.36Å
477	Y	92.4	Very high	93	Very high	66 Å²	66	25.9 Å²	25.9	26%	0.259	13%	0.131	S	C	.	.	B	Isolated β-bridge	trans	-109.3	102.6	-168	-68.3	-78.4	0	0	0	112	K433 S471 D472 Y763 R801	K433-Y477 HydrophobicContact CB-CD1 4.04Å; K433-Y477 HydrophobicContact CB-CE1 4.45Å; K433-Y477 HydrophobicContact CG-CD1 4.32Å; K433-Y477 HydrophobicContact CG-CE1 4.26Å; S471-Y477 CarbonylContact C-O 3.53Å; S471-Y477 WeakPolarHBondContact CA-O 3.32Å; D472-Y477 PolarHBondContact N-O 2.87Å; D472-Y477 PolarHBondContact OD1-N 2.89Å; D472-Y477 WeakPolarHBondContact OD2-CD2 3.38Å; Y477-Y763 AromaticContact CD1-CD1 3.77Å; Y477-Y763 HydrophobicContact CD1-CD1 3.77Å; Y477-Y763 HydrophobicContact CD1-CD2 4.1Å; Y477-Y763 HydrophobicContact CD1-CE1 4.21Å; Y477-Y763 AromaticContact CD1-CG 3.71Å; Y477-Y763 HydrophobicContact CD1-CG 3.71Å; Y477-Y763 HydrophobicContact CE1-CD1 4.24Å; Y477-Y763 HydrophobicContact CE1-CE1 4.49Å; Y477-Y763 HydrophobicContact CG-CG 4.37Å; Y477-R801 PolarHBondContact O-NH1 3.45Å; Y477-R801 VanDerWaalsContact O-NH1 3.1Å
478	F	94.1	Very high	92.6	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.139	C	C	.	.			trans	-93.5	136.6	-174.2	-73.6	-94.2	0	0	0	112.8	M432 K433 L434 M443 V453 A455 Y469 I470 G475 Y763	M432-F478 HydrophobicContact CB-CD2 4.46Å; M432-F478 HydrophobicContact CB-CE2 4.06Å; M432-F478 HydrophobicContact CE-CE2 3.45Å; M432-F478 VanDerWaalsContact CE-CE2 3.45Å; M432-F478 HydrophobicContact CE-CZ 3.49Å; M432-F478 VanDerWaalsContact CE-CZ 3.49Å; M432-F478 HydrophobicContact CG-CE2 4.16Å; K433-F478 PolarHBondContact O-N 2.91Å; L434-F478 HydrophobicContact CD2-CB 3.89Å; L434-F478 HydrophobicContact CD2-CG 4.29Å; M443-F478 HydrophobicContact CE-CD1 4.47Å; M443-F478 HydrophobicContact CE-CE1 4.11Å; M443-F478 HydrophobicContact CE-CE2 4.31Å; M443-F478 HydrophobicContact CE-CZ 4.03Å; V453-F478 HydrophobicContact CB-CE1 4.2Å; V453-F478 HydrophobicContact CB-CZ 4.12Å; V453-F478 HydrophobicContact CG1-CE1 4.25Å; V453-F478 HydrophobicContact CG1-CZ 4.11Å; A455-F478 HydrophobicContact CB-CE1 4.07Å; Y469-F478 HydrophobicContact CD1-CB 4.34Å; I470-F478 WeakPolarHBondContact O-CA 3.5Å; G475-F478 WeakPolarHBondContact O-CE2 3.49Å; F478-Y763 WeakPolarHBondContact O-CD2 3.14Å
479	I	93.2	Very high	92	Very high	21 Å²	21	33.5 Å²	33.5	11%	0.108	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	153.8	170.7	67.7	179.4	0	0	0	109.9	Y469 I470 E760 C761	Y469-I479 CarbonylContact C-O 3.53Å; Y469-I479 VanDerWaalsContact CA-O 3.31Å; Y469-I479 WeakPolarHBondContact CA-O 3.45Å; Y469-I479 WeakPolarHBondContact CD1-O 3.42Å; I470-I479 HydrophobicContact CG2-CD1 4.08Å; I470-I479 HydrophobicContact CG2-CG1 3.51Å; I470-I479 PolarHBondContact N-O 2.71Å; I470-I479 PolarHBondContact O-N 2.84Å; I479-E760 HydrophobicContact CD1-CB 4.13Å; I479-E760 HydrophobicContact CD1-CG 4.02Å; I479-C761 WeakPolarHBondContact CD1-O 3.37Å
480	L	92.7	Very high	91	Very high	77 Å²	77	33.7 Å²	33.7	40%	0.403	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	132.6	177.1	177.9	64.1	0	0	0	110.3	Y469 E483	Y469-L480 HydrophobicContact CD1-CB 4.36Å; Y469-L480 HydrophobicContact CE1-CB 3.87Å; Y469-L480 HydrophobicContact CE1-CD1 4.24Å; Y469-L480 HydrophobicContact CE2-CD1 4.19Å; L480-E483 HydrophobicContact CD1-CG 4.22Å; L480-E483 HydrophobicContact CD2-CG 3.88Å; L480-E483 HydrophobicContact CG-CG 4.44Å
481	S	93.9	Very high	89.8	Confident	19 Å²	19	40 Å²	40	13%	0.133	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-44.2	-178.9	175.5	0	0	0	0	112.3	L468 G528 W531	L468-S481 WeakPolarHBondContact O-CB 3.29Å; L468-S481 PolarHBondContact O-N 2.78Å; S481-G528 WeakPolarHBondContact OG-CA 3.19Å; S481-G528 PolarHBondContact OG-O 3.16Å; S481-W531 PolarHBondContact O-NE1 3Å; S481-W531 VanDerWaalsContact O-NE1 3.16Å
482	L	94.1	Very high	88.5	Confident	14 Å²	14	43.8 Å²	43.8	7%	0.073	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	115.2	178.7	-171	63	0	0	0	111.9	L468 L485 A511 K513 W531	L468-L482 HydrophobicContact CB-CB 3.93Å; L468-L482 WeakPolarHBondContact CB-O 3.43Å; L468-L482 HydrophobicContact CD2-CB 4.22Å; L468-L482 PolarHBondContact N-O 2.9Å; L468-L482 PolarHBondContact O-N 2.79Å; L482-L485 HydrophobicContact CD2-CD2 3.96Å; L482-L485 HydrophobicContact CG-CD2 4.39Å; L482-A511 HydrophobicContact CD2-CB 3.66Å; L482-K513 HydrophobicContact CD1-CD 3.79Å; L482-K513 HydrophobicContact CD2-CB 4.47Å; L482-K513 HydrophobicContact CG-CD 4.29Å; L482-W531 HydrophobicContact CB-CZ2 4.48Å; L482-W531 HydrophobicContact CD1-CB 4.37Å; L482-W531 HydrophobicContact CD1-CD2 4.38Å; L482-W531 HydrophobicContact CD1-CG 3.96Å; L482-W531 HydrophobicContact CD2-CD2 4Å; L482-W531 HydrophobicContact CD2-CE3 4.29Å; L482-W531 HydrophobicContact CD2-CG 4.44Å; L482-W531 HydrophobicContact CD2-CH2 4.47Å; L482-W531 HydrophobicContact CD2-CZ2 4.19Å
483	E	92.6	Very high	87.5	Confident	93 Å²	93	44 Å²	44	44%	0.435	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	158.8	176.8	-43.1	149	143.6	0	0	112.3	L480 L485 K513	L480-E483 HydrophobicContact CD1-CG 4.22Å; L480-E483 HydrophobicContact CD2-CG 3.88Å; L480-E483 HydrophobicContact CG-CG 4.44Å; E483-L485 PolarHBondContact O-N 3.48Å; E483-K513 WeakPolarHBondContact O-CD 3.43Å; E483-K513 WeakPolarHBondContact O-CE 3.27Å; E483-K513 WeakPolarHBondContact O-CG 3.49Å; E483-K513 PolarHBondContact O-NZ 2.92Å; E483-K513 IonicContact OE2-NZ 3.64Å; E483-K513 PolarHBondContact OE2-NZ 2.8Å
484	N	92.9	Very high	86.8	Confident	51 Å²	51	46.7 Å²	46.7	27%	0.273	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.4	46.8	169.2	-63.1	-40.3	0	0	0	114.2	T465 Y466 K513 I514	T465-N484 PolarHBondContact OG1-OD1 3.31Å; T465-N484 VanDerWaalsContact OG1-OD1 3.1Å; Y466-N484 CarbonylContact O-C 3.5Å; Y466-N484 WeakPolarHBondContact O-CA 3.44Å; Y466-N484 PolarHBondContact O-N 2.59Å; Y466-N484 VanDerWaalsContact O-N 3.16Å; N484-K513 HydrophobicContact CB-CG 4.41Å; N484-K513 CarbonylContact O-C 3.6Å; N484-K513 WeakPolarHBondContact O-CA 3.31Å; N484-I514 PolarHBondContact O-N 2.87Å
485	L	93.6	Very high	86.5	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	142.9	166.4	-67.4	177.4	0	0	0	111.3	A456 Y466 L468 L482 E483 T487 V497 A511	A456-L485 HydrophobicContact CB-CD1 4.48Å; Y466-L485 PolarHBondContact O-N 2.87Å; L468-L485 HydrophobicContact CB-CD1 3.86Å; L468-L485 HydrophobicContact CB-CD2 4.23Å; L468-L485 HydrophobicContact CB-CG 4.19Å; L468-L485 HydrophobicContact CD1-CD1 4.3Å; L482-L485 HydrophobicContact CD2-CD2 3.96Å; L482-L485 HydrophobicContact CG-CD2 4.39Å; E483-L485 PolarHBondContact O-N 3.48Å; L485-T487 HydrophobicContact CB-CG2 4.36Å; L485-V497 HydrophobicContact CD1-CG1 3.78Å; L485-A511 HydrophobicContact CD2-CB 4.32Å
486	R	91.6	Very high	86.2	Confident	74 Å²	74	49.6 Å²	49.6	28%	0.279	28%	0.275	S	S	.	.			trans	-73.9	126.3	162	167.6	59.7	-175.7	145.9	3.8	108.8	D498 N512 I514 I519 E560	R486-D498 HydrophobicContact CB-CB 4.16Å; R486-D498 HydrophobicContact CG-CB 4.14Å; R486-D498 WeakPolarHBondContact CG-OD1 3.48Å; R486-D498 VanDerWaalsContact CG-OD2 3.23Å; R486-D498 WeakPolarHBondContact CG-OD2 3.42Å; R486-D498 PolarHBondContact O-N 2.86Å; R486-D498 VanDerWaalsContact O-N 3.12Å; R486-N512 HydrophobicContact CB-CB 3.89Å; R486-N512 WeakPolarHBondContact CB-O 3.47Å; R486-N512 HydrophobicContact CG-CB 4.39Å; R486-N512 PolarHBondContact N-O 2.96Å; R486-I514 HydrophobicContact CB-CG1 4.45Å; R486-I519 HydrophobicContact CG-CD1 4.37Å; R486-E560 IonicContact NH2-OE1 2.84Å
487	T	89.7	Confident	86.1	Confident	11 Å²	11	50.7 Å²	50.7	7%	0.067	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.1	176.3	58.7	0	0	0	0	110.8	Y466 L485 L495 L496 V497	Y466-T487 HydrophobicContact CD2-CG2 3.89Å; Y466-T487 HydrophobicContact CG-CG2 4.04Å; L485-T487 HydrophobicContact CB-CG2 4.36Å; T487-L495 HydrophobicContact CG2-CD1 4.48Å; T487-L496 CarbonylContact C-O 3.59Å; T487-L496 WeakPolarHBondContact CA-O 3.49Å; T487-L496 WeakPolarHBondContact CB-O 3.4Å; T487-V497 HydrophobicContact CG2-CB 4.46Å; T487-V497 HydrophobicContact CG2-CG1 4.29Å; T487-V497 HydrophobicContact CG2-CG2 4.06Å
488	S	85.6	Confident	86.1	Confident	24 Å²	24	47.8 Å²	47.8	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	174.3	171.6	65.2	0	0	0	0	110.6	L496	S488-L496 PolarHBondContact N-O 2.85Å; S488-L496 PolarHBondContact O-N 2.88Å; S488-L496 WeakPolarHBondContact OG-CB 3.29Å
489	R	82.8	Confident	86.1	Confident	135 Å²	135	48.9 Å²	48.9	51%	0.509	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.2	170.2	-74.1	-172.7	-179.4	-89.6	-1.4	109.1	D442 G493 N494 L495	D442-R489 IonicContact OD2-NH2 2.68Å; R489-G493 PolarHBondContact NH1-O 2.89Å; R489-N494 CarbonylContact C-O 3.58Å; R489-N494 VanDerWaalsContact CA-O 3.26Å; R489-N494 WeakPolarHBondContact CA-O 3.41Å; R489-L495 HydrophobicContact CG-CD1 4.43Å
490	G	73.4	Confident	86.1	Confident	12 Å²	12	49.1 Å²	49.1	12%	0.124	28%	0.275	C	S	.	.			trans	-70.8	171.2	176.9	0	0	0	0	0	112.4	A492 G493 N494	G490-A492 PolarHBondContact O-N 2.8Å; G490-A492 VanDerWaalsContact O-N 3.12Å; G490-G493 PolarHBondContact O-N 3Å; G490-N494 PolarHBondContact N-O 2.97Å
491	P	70.2	Confident	86.2	Confident	136 Å²	136	47.6 Å²	47.6	88%	0.883	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.2	-177.7	-25.8	35.4	0	0	0	114.4	G493	P491-G493 VanDerWaalsContact C-N 3.29Å; P491-G493 PolarHBondContact O-N 2.91Å
492	A	65.7	Low	86.2	Confident	78 Å²	78	46.7 Å²	46.7	65%	0.645	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	1.9	175.3	0	0	0	0	0	114.4	G490 N494	G490-A492 PolarHBondContact O-N 2.8Å; G490-A492 VanDerWaalsContact O-N 3.12Å; A492-N494 VanDerWaalsContact C-N 3.31Å; A492-N494 PolarHBondContact O-N 2.84Å
493	G	70.8	Confident	86	Confident	37 Å²	37	48.7 Å²	48.7	38%	0.381	27%	0.268	S	S	.	.	S	Bend	trans	86.4	-10.2	-177.8	0	0	0	0	0	115.5	R489 G490 P491	R489-G493 PolarHBondContact NH1-O 2.89Å; G490-G493 PolarHBondContact O-N 3Å; P491-G493 VanDerWaalsContact C-N 3.29Å; P491-G493 PolarHBondContact O-N 2.91Å
494	N	77.6	Confident	85.8	Confident	85 Å²	85	45.4 Å²	45.4	46%	0.455	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-51	138.3	175.1	-65.2	-15.8	0	0	0	111.6	R489 G490 A492 L496	R489-N494 CarbonylContact C-O 3.58Å; R489-N494 VanDerWaalsContact CA-O 3.26Å; R489-N494 WeakPolarHBondContact CA-O 3.41Å; G490-N494 PolarHBondContact N-O 2.97Å; A492-N494 VanDerWaalsContact C-N 3.31Å; A492-N494 PolarHBondContact O-N 2.84Å; N494-L496 PolarHBondContact O-N 3.13Å
495	L	84.2	Confident	85.6	Confident	27 Å²	27	43 Å²	43	14%	0.141	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.6	172.1	-171	74.1	0	0	0	109.2	H444 A456 Y466 T487 R489 V497	H444-L495 HydrophobicContact CB-CD2 4.15Å; H444-L495 VanDerWaalsContact CD2-CD2 3.48Å; H444-L495 WeakPolarHBondContact CD2-CD2 3.38Å; A456-L495 HydrophobicContact CB-CD2 4.44Å; Y466-L495 HydrophobicContact CD1-CD2 3.94Å; Y466-L495 HydrophobicContact CE1-CD2 3.55Å; Y466-L495 HydrophobicContact CE2-CD1 3.99Å; Y466-L495 HydrophobicContact CE2-CD2 4.26Å; Y466-L495 HydrophobicContact CG-CD2 4.45Å; T487-L495 HydrophobicContact CG2-CD1 4.48Å; R489-L495 HydrophobicContact CG-CD1 4.43Å; L495-V497 HydrophobicContact CD2-CG2 4.11Å; L495-V497 HydrophobicContact CG-CG2 4.24Å
496	L	86.8	Confident	85.4	Confident	71 Å²	71	47.3 Å²	47.3	37%	0.372	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	138	169.4	-59.9	176.1	0	0	0	108.1	T487 S488 N494	T487-L496 CarbonylContact C-O 3.59Å; T487-L496 WeakPolarHBondContact CA-O 3.49Å; T487-L496 WeakPolarHBondContact CB-O 3.4Å; S488-L496 PolarHBondContact N-O 2.85Å; S488-L496 PolarHBondContact O-N 2.88Å; S488-L496 WeakPolarHBondContact OG-CB 3.29Å; N494-L496 PolarHBondContact O-N 3.13Å
497	V	90.6	Very high	85.3	Confident	32 Å²	32	43.8 Å²	43.8	19%	0.194	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.7	-176	-175.8	0	0	0	0	108.1	I446 A456 L485 T487 L495 F499	I446-V497 HydrophobicContact CD1-CG1 4.32Å; A456-V497 HydrophobicContact CB-CG2 4.14Å; L485-V497 HydrophobicContact CD1-CG1 3.78Å; T487-V497 HydrophobicContact CG2-CB 4.46Å; T487-V497 HydrophobicContact CG2-CG1 4.29Å; T487-V497 HydrophobicContact CG2-CG2 4.06Å; L495-V497 HydrophobicContact CD2-CG2 4.11Å; L495-V497 HydrophobicContact CG-CG2 4.24Å; V497-F499 HydrophobicContact CG1-CB 4.04Å; V497-F499 PolarHBondContact O-N 3.23Å
498	D	92.4	Very high	85.5	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.027	25%	0.252	C	S	.	.			trans	-74.2	72.5	177.1	-71.9	38.3	0	0	0	110.4	R486 A511 N512 L559	R486-D498 HydrophobicContact CB-CB 4.16Å; R486-D498 HydrophobicContact CG-CB 4.14Å; R486-D498 WeakPolarHBondContact CG-OD1 3.48Å; R486-D498 VanDerWaalsContact CG-OD2 3.23Å; R486-D498 WeakPolarHBondContact CG-OD2 3.42Å; R486-D498 PolarHBondContact O-N 2.86Å; R486-D498 VanDerWaalsContact O-N 3.12Å; D498-A511 VanDerWaalsContact O-CA 3.24Å; D498-A511 WeakPolarHBondContact O-CA 3.45Å; D498-N512 HydrophobicContact CB-CB 3.64Å; D498-N512 PolarHBondContact O-N 2.8Å; D498-N512 PolarHBondContact OD2-ND2 3.33Å; D498-L559 HydrophobicContact CB-CB 4.24Å; D498-L559 HydrophobicContact CB-CD1 4.49Å
499	F	93.4	Very high	86	Confident	25 Å²	25	42.3 Å²	42.3	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	116.4	-178.8	178.6	-97	0	0	0	109.4	I446 F454 L468 V497 Y509 L510 A511 W531	I446-F499 HydrophobicContact CG2-CD1 3.67Å; I446-F499 HydrophobicContact CG2-CE1 4.23Å; I446-F499 HydrophobicContact CG2-CG 4.39Å; F454-F499 HydrophobicContact CD1-CE2 4.45Å; F454-F499 AromaticContact CD1-CZ 3.86Å; F454-F499 HydrophobicContact CD1-CZ 3.86Å; F454-F499 AromaticContact CE1-CZ 3.96Å; F454-F499 HydrophobicContact CE1-CZ 3.96Å; F454-F499 HydrophobicContact CG-CE1 4.49Å; F454-F499 HydrophobicContact CG-CZ 4.18Å; F454-F499 HydrophobicContact CZ-CZ 4.38Å; L468-F499 HydrophobicContact CD1-CD2 4.47Å; L468-F499 HydrophobicContact CD1-CE2 4.38Å; L468-F499 HydrophobicContact CD2-CD2 4.03Å; L468-F499 HydrophobicContact CD2-CE2 3.66Å; V497-F499 HydrophobicContact CG1-CB 4.04Å; V497-F499 PolarHBondContact O-N 3.23Å; F499-Y509 AromaticContact CE1-CD1 3.56Å; F499-Y509 HydrophobicContact CE1-CD1 3.56Å; F499-Y509 AromaticContact CE1-CE1 3.8Å; F499-Y509 HydrophobicContact CE1-CE1 3.8Å; F499-Y509 AromaticContact CE2-CD1 3.99Å; F499-Y509 HydrophobicContact CE2-CD1 3.99Å; F499-Y509 HydrophobicContact CE2-CG 4.23Å; F499-Y509 AromaticContact CZ-CD1 3.23Å; F499-Y509 HydrophobicContact CZ-CD1 3.23Å; F499-Y509 AromaticContact CZ-CE1 3.64Å; F499-Y509 HydrophobicContact CZ-CE1 3.64Å; F499-Y509 AromaticContact CZ-CG 3.85Å; F499-Y509 HydrophobicContact CZ-CG 3.85Å; F499-L510 WeakPolarHBondContact CA-O 3.34Å; F499-A511 HydrophobicContact CD2-CB 4.19Å; F499-W531 HydrophobicContact CD2-CH2 4.39Å; F499-W531 HydrophobicContact CE2-CH2 4.02Å; F499-W531 HydrophobicContact CE2-CZ2 4.4Å
500	Y	94.3	Very high	86.7	Confident	25 Å²	25	35.9 Å²	35.9	10%	0.098	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	120.8	-173.1	-175.3	-96.7	0	0	0	111.1	V502 Y509 L510 I571 S573	Y500-V502 HydrophobicContact CD1-CG2 4.32Å; Y500-V502 HydrophobicContact CE1-CG2 4.42Å; Y500-Y509 CarbonylContact O-C 3.18Å; Y500-Y509 VanDerWaalsContact O-CA 3.26Å; Y500-Y509 WeakPolarHBondContact O-CA 3.29Å; Y500-L510 HydrophobicContact CD1-CD1 4.1Å; Y500-L510 PolarHBondContact N-O 3.39Å; Y500-L510 PolarHBondContact O-N 3.19Å; Y500-I571 HydrophobicContact CD1-CD1 3.62Å; Y500-I571 HydrophobicContact CD1-CG1 4.07Å; Y500-I571 HydrophobicContact CD2-CG2 3.64Å; Y500-I571 HydrophobicContact CE1-CD1 3.88Å; Y500-I571 HydrophobicContact CE1-CG1 3.87Å; Y500-I571 HydrophobicContact CE2-CG1 4.34Å; Y500-I571 HydrophobicContact CE2-CG2 3.8Å; Y500-I571 HydrophobicContact CG-CD1 4Å; Y500-I571 HydrophobicContact CG-CG1 4.39Å; Y500-I571 HydrophobicContact CG-CG2 4.07Å; Y500-S573 PolarHBondContact OH-N 2.93Å; Y500-S573 PolarHBondContact OH-OG 3.48Å
501	K	93.8	Very high	87.8	Confident	45 Å²	45	35.3 Å²	35.3	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.5	170	178	174.6	168.8	174.2	0	109.8	D449 Y509	D449-K501 IonicContact OD1-NZ 3.4Å; D449-K501 VanDerWaalsContact OD2-CD 3.28Å; D449-K501 WeakPolarHBondContact OD2-CD 3.35Å; D449-K501 IonicContact OD2-NZ 3.56Å; D449-K501 PolarHBondContact OD2-NZ 3.47Å; K501-Y509 HydrophobicContact CB-CD1 3.71Å; K501-Y509 HydrophobicContact CB-CE1 3.67Å; K501-Y509 HydrophobicContact CD-CE1 4.03Å; K501-Y509 HydrophobicContact CG-CD1 4.1Å; K501-Y509 HydrophobicContact CG-CE1 3.75Å
502	V	93.9	Very high	89	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-84.6	127.4	176.5	-171.9	0	0	0	0	110.3	Y500 M508 L510 I581	Y500-V502 HydrophobicContact CD1-CG2 4.32Å; Y500-V502 HydrophobicContact CE1-CG2 4.42Å; V502-M508 HydrophobicContact CB-CB 4.44Å; V502-M508 HydrophobicContact CB-CE 3.63Å; V502-M508 HydrophobicContact CG1-CE 3.47Å; V502-M508 VanDerWaalsContact CG1-CE 3.47Å; V502-M508 HydrophobicContact CG2-CE 3.8Å; V502-M508 HydrophobicContact CG2-CG 4.43Å; V502-M508 PolarHBondContact N-O 2.96Å; V502-L510 HydrophobicContact CG2-CD1 3.34Å; V502-I581 HydrophobicContact CB-CD1 4.43Å; V502-I581 HydrophobicContact CG1-CD1 3.69Å; V502-I581 HydrophobicContact CG1-CG1 3.8Å; V502-I581 HydrophobicContact CG2-CD1 3.82Å
503	E	90.7	Very high	90.4	Very high	56 Å²	56	26.6 Å²	26.6	26%	0.262	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	136.6	-174	-75.3	-74.9	-143.3	0	0	113.5	S573 K575	E503-S573 PolarHBondContact N-OG 3.34Å; E503-K575 HydrophobicContact CB-CG 4.04Å; E503-K575 HydrophobicContact CG-CG 4.45Å; E503-K575 WeakPolarHBondContact OE1-CE 3.43Å; E503-K575 IonicContact OE1-NZ 3.17Å; E503-K575 WeakPolarHBondContact OE2-CE 3.42Å; E503-K575 WeakPolarHBondContact OE2-CG 3.46Å; E503-K575 IonicContact OE2-NZ 2.59Å
504	G	87.6	Confident	91.5	Very high	23 Å²	23	27 Å²	27	24%	0.237	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-4.4	180	0	0	0	0	0	116.1	Y728	G504-Y728 PolarHBondContact O-OH 2.98Å; G504-Y728 VanDerWaalsContact O-OH 3.05Å
505	I	90.1	Very high	92.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.01	13%	0.131	C	C	.	.	S	Bend	trans	-130.6	111.9	174.2	-60.9	171.7	0	0	0	108.8	M508 P578 A604 W711 L713	I505-M508 HydrophobicContact CB-CB 4.32Å; I505-M508 HydrophobicContact CB-CE 4.27Å; I505-M508 HydrophobicContact CB-SD 4.49Å; I505-M508 HydrophobicContact CD1-CE 3.8Å; I505-M508 HydrophobicContact CD1-SD 4.3Å; I505-M508 HydrophobicContact CG2-CB 3.89Å; I505-M508 HydrophobicContact CG2-CE 4.44Å; I505-M508 HydrophobicContact CG2-SD 4.02Å; I505-P578 HydrophobicContact CG1-CB 4.25Å; I505-A604 HydrophobicContact CD1-CB 3.62Å; I505-W711 HydrophobicContact CD1-CH2 4.1Å; I505-L713 HydrophobicContact CD1-CD1 4.06Å; I505-L713 HydrophobicContact CG2-CD1 4.47Å; I505-L713 HydrophobicContact CG2-CD2 3.77Å
506	N	89	Confident	92.4	Very high	89 Å²	89	30.3 Å²	30.3	48%	0.476	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	146.9	-178.1	-63.3	-8.6	0	0	0	111.4	E450 M508	E450-N506 WeakPolarHBondContact OE1-CA 3.35Å; N506-M508 PolarHBondContact O-N 3.47Å
507	G	89.4	Confident	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	6.5	177.9	0	0	0	0	0	115.8	E450 Y525 K527	E450-G507 PolarHBondContact OE1-N 2.92Å; G507-Y525 CarbonylContact O-C 3.5Å; G507-K527 WeakPolarHBondContact O-CA 3.33Å; G507-K527 PolarHBondContact O-N 3.46Å
508	M	94.3	Very high	92.7	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.187	C	C	.	.			trans	-107	122.5	-177.2	-159.1	171.6	82.7	0	0	112.5	V502 I505 N506 T524 Y525 I581 A604	V502-M508 HydrophobicContact CB-CB 4.44Å; V502-M508 HydrophobicContact CB-CE 3.63Å; V502-M508 HydrophobicContact CG1-CE 3.47Å; V502-M508 VanDerWaalsContact CG1-CE 3.47Å; V502-M508 HydrophobicContact CG2-CE 3.8Å; V502-M508 HydrophobicContact CG2-CG 4.43Å; V502-M508 PolarHBondContact N-O 2.96Å; I505-M508 HydrophobicContact CB-CB 4.32Å; I505-M508 HydrophobicContact CB-CE 4.27Å; I505-M508 HydrophobicContact CB-SD 4.49Å; I505-M508 HydrophobicContact CD1-CE 3.8Å; I505-M508 HydrophobicContact CD1-SD 4.3Å; I505-M508 HydrophobicContact CG2-CB 3.89Å; I505-M508 HydrophobicContact CG2-CE 4.44Å; I505-M508 HydrophobicContact CG2-SD 4.02Å; N506-M508 PolarHBondContact O-N 3.47Å; M508-T524 WeakPolarHBondContact CA-O 3.5Å; M508-T524 WeakPolarHBondContact CG-O 3.27Å; M508-Y525 HydrophobicContact CG-CD1 4Å; M508-Y525 HydrophobicContact CG-CE1 4.38Å; M508-Y525 HydrophobicContact SD-CD1 3.51Å; M508-Y525 VanDerWaalsContact SD-CD1 3.51Å; M508-Y525 HydrophobicContact SD-CE1 3.53Å; M508-Y525 VanDerWaalsContact SD-CE1 3.53Å; M508-I581 HydrophobicContact CE-CD1 4.19Å; M508-A604 HydrophobicContact CE-CB 3.8Å; M508-A604 HydrophobicContact SD-CB 3.86Å
509	Y	95.6	Very high	92.8	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.5	-173.9	-56	-103.6	0	0	0	111.7	F454 F499 Y500 K501 I523 T524 K527	F454-Y509 HydrophobicContact CE2-CE1 4.3Å; F454-Y509 HydrophobicContact CE2-CE2 4.48Å; F454-Y509 AromaticContact CE2-CZ 3.85Å; F454-Y509 WeakPolarHBondContact CE2-OH 3.3Å; F454-Y509 HydrophobicContact CZ-CE1 4.41Å; F454-Y509 HydrophobicContact CZ-CE2 4.11Å; F454-Y509 AromaticContact CZ-CZ 3.9Å; F499-Y509 AromaticContact CE1-CD1 3.56Å; F499-Y509 HydrophobicContact CE1-CD1 3.56Å; F499-Y509 AromaticContact CE1-CE1 3.8Å; F499-Y509 HydrophobicContact CE1-CE1 3.8Å; F499-Y509 AromaticContact CE2-CD1 3.99Å; F499-Y509 HydrophobicContact CE2-CD1 3.99Å; F499-Y509 HydrophobicContact CE2-CG 4.23Å; F499-Y509 AromaticContact CZ-CD1 3.23Å; F499-Y509 HydrophobicContact CZ-CD1 3.23Å; F499-Y509 AromaticContact CZ-CE1 3.64Å; F499-Y509 HydrophobicContact CZ-CE1 3.64Å; F499-Y509 AromaticContact CZ-CG 3.85Å; F499-Y509 HydrophobicContact CZ-CG 3.85Å; Y500-Y509 CarbonylContact O-C 3.18Å; Y500-Y509 VanDerWaalsContact O-CA 3.26Å; Y500-Y509 WeakPolarHBondContact O-CA 3.29Å; K501-Y509 HydrophobicContact CB-CD1 3.71Å; K501-Y509 HydrophobicContact CB-CE1 3.67Å; K501-Y509 HydrophobicContact CD-CE1 4.03Å; K501-Y509 HydrophobicContact CG-CD1 4.1Å; K501-Y509 HydrophobicContact CG-CE1 3.75Å; Y509-I523 WeakPolarHBondContact O-CA 3.31Å; Y509-T524 HydrophobicContact CD2-CG2 4.09Å; Y509-T524 HydrophobicContact CG-CG2 4.4Å; Y509-T524 PolarHBondContact N-O 2.91Å; Y509-T524 VanDerWaalsContact N-O 3.17Å; Y509-T524 PolarHBondContact O-N 2.85Å; Y509-K527 HydrophobicContact CE2-CG 4.08Å
510	L	97	Very high	92.9	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	149.2	166.6	-62.7	94.3	0	0	0	110.3	F499 Y500 V502 T521 F522 I523 L534 L557 L559 I571 I581	F499-L510 WeakPolarHBondContact CA-O 3.34Å; Y500-L510 HydrophobicContact CD1-CD1 4.1Å; Y500-L510 PolarHBondContact N-O 3.39Å; Y500-L510 PolarHBondContact O-N 3.19Å; V502-L510 HydrophobicContact CG2-CD1 3.34Å; L510-T521 HydrophobicContact CD2-CG2 4.27Å; L510-F522 CarbonylContact C-O 3.4Å; L510-F522 VanDerWaalsContact CA-O 3.24Å; L510-F522 WeakPolarHBondContact CA-O 3.29Å; L510-I523 HydrophobicContact CG-CB 4.39Å; L510-I523 HydrophobicContact CG-CD1 4.44Å; L510-I523 HydrophobicContact CG-CG1 4.26Å; L510-L534 HydrophobicContact CD2-CD1 4.11Å; L510-L534 HydrophobicContact CD2-CD2 4.17Å; L510-L557 HydrophobicContact CD2-CD1 3.91Å; L510-L559 HydrophobicContact CB-CD1 4.04Å; L510-L559 HydrophobicContact CB-CD2 4.11Å; L510-I571 HydrophobicContact CD1-CD1 4.39Å; L510-I581 HydrophobicContact CD1-CD1 4.38Å
511	A	96.9	Very high	93.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	145.5	174.7	0	0	0	0	0	111.8	L482 L485 D498 F499 F522 W531	L482-A511 HydrophobicContact CD2-CB 3.66Å; L485-A511 HydrophobicContact CD2-CB 4.32Å; D498-A511 VanDerWaalsContact O-CA 3.24Å; D498-A511 WeakPolarHBondContact O-CA 3.45Å; F499-A511 HydrophobicContact CD2-CB 4.19Å; A511-F522 PolarHBondContact N-O 2.86Å; A511-F522 PolarHBondContact O-N 2.86Å; A511-W531 HydrophobicContact CB-CE3 4.44Å; A511-W531 HydrophobicContact CB-CH2 3.73Å; A511-W531 HydrophobicContact CB-CZ3 3.67Å
512	N	95.9	Very high	93.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124	169.8	-70.8	-29.1	0	0	0	110.2	R486 D498 I519 T521 L557 L559	R486-N512 HydrophobicContact CB-CB 3.89Å; R486-N512 WeakPolarHBondContact CB-O 3.47Å; R486-N512 HydrophobicContact CG-CB 4.39Å; R486-N512 PolarHBondContact N-O 2.96Å; D498-N512 HydrophobicContact CB-CB 3.64Å; D498-N512 PolarHBondContact O-N 2.8Å; D498-N512 PolarHBondContact OD2-ND2 3.33Å; N512-I519 HydrophobicContact CB-CG2 3.91Å; N512-T521 VanDerWaalsContact OD1-CA 3.24Å; N512-T521 WeakPolarHBondContact OD1-CA 3.35Å; N512-T521 VanDerWaalsContact OD1-CB 3.23Å; N512-T521 WeakPolarHBondContact OD1-CB 3.38Å; N512-T521 WeakPolarHBondContact OD1-CG2 3.2Å; N512-T521 PolarHBondContact OD1-OG1 2.95Å; N512-L557 PolarHBondContact ND2-O 2.83Å; N512-L557 VanDerWaalsContact ND2-O 3.07Å; N512-L557 PolarHBondContact OD1-O 3.04Å; N512-L559 HydrophobicContact CB-CD1 4.49Å
513	K	94.4	Very high	93.4	Very high	31 Å²	31	36.4 Å²	36.4	14%	0.135	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.8	175.8	173.6	170.5	-176.2	160.2	0	110.3	L482 E483 N484 V515 K520 F522	L482-K513 HydrophobicContact CD1-CD 3.79Å; L482-K513 HydrophobicContact CD2-CB 4.47Å; L482-K513 HydrophobicContact CG-CD 4.29Å; E483-K513 WeakPolarHBondContact O-CD 3.43Å; E483-K513 WeakPolarHBondContact O-CE 3.27Å; E483-K513 WeakPolarHBondContact O-CG 3.49Å; E483-K513 PolarHBondContact O-NZ 2.92Å; E483-K513 IonicContact OE2-NZ 3.64Å; E483-K513 PolarHBondContact OE2-NZ 2.8Å; N484-K513 HydrophobicContact CB-CG 4.41Å; N484-K513 CarbonylContact O-C 3.6Å; N484-K513 WeakPolarHBondContact O-CA 3.31Å; K513-V515 HydrophobicContact CD-CG2 4.15Å; K513-V515 HydrophobicContact CG-CG2 3.85Å; K513-K520 PolarHBondContact N-O 3.29Å; K513-K520 PolarHBondContact O-N 2.87Å; K513-F522 HydrophobicContact CB-CD2 3.94Å; K513-F522 HydrophobicContact CB-CE2 3.85Å; K513-F522 HydrophobicContact CD-CE2 4.49Å; K513-F522 HydrophobicContact CG-CE2 4.47Å
514	I	93.5	Very high	93.6	Very high	45 Å²	45	33.8 Å²	33.8	23%	0.231	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120	170.5	-59.8	163.1	0	0	0	108.2	T465 N484 R486 H518 I519	T465-I514 HydrophobicContact CG2-CD1 4.09Å; N484-I514 PolarHBondContact O-N 2.87Å; R486-I514 HydrophobicContact CB-CG1 4.45Å; I514-H518 CarbonylContact C-O 3.53Å; I514-H518 WeakPolarHBondContact CA-O 3.27Å; I514-I519 HydrophobicContact CG1-CG1 4.25Å
515	V	92.5	Very high	94	Very high	40 Å²	40	33.3 Å²	33.3	24%	0.242	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121	179.6	-174.6	0	0	0	0	107.6	K513 N517 H518 F522	K513-V515 HydrophobicContact CD-CG2 4.15Å; K513-V515 HydrophobicContact CG-CG2 3.85Å; V515-N517 PolarHBondContact O-N 3.34Å; V515-H518 PolarHBondContact N-O 2.81Å; V515-H518 WeakPolarHBondContact O-CA 3.45Å; V515-H518 WeakPolarHBondContact O-CB 3.3Å; V515-H518 PolarHBondContact O-N 3.17Å; V515-H518 VanDerWaalsContact O-O 3.1Å; V515-F522 HydrophobicContact CG2-CE2 4.24Å; V515-F522 HydrophobicContact CG2-CZ 4.33Å
516	D	89.4	Confident	94	Very high	143 Å²	143	33.3 Å²	33.3	77%	0.765	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	39.9	-178.2	-51.2	-40.3	0	0	0	113.3	H518	D516-H518 PolarHBondContact O-CE1 2.98Å; D516-H518 PolarHBondContact O-N 3.14Å; D516-H518 PolarHBondContact O-ND1 3.36Å
517	N	89.5	Confident	94.2	Very high	149 Å²	149	29.1 Å²	29.1	80%	0.797	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.9	-1.1	-172.6	-160.5	83	0	0	0	116.3	V515	V515-N517 PolarHBondContact O-N 3.34Å
518	H	93.1	Very high	94.3	Very high	71 Å²	71	29.2 Å²	29.2	33%	0.329	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	142.6	174	-58.1	80.7	0	0	0	110.1	I514 V515 D516 E590	I514-H518 CarbonylContact C-O 3.53Å; I514-H518 WeakPolarHBondContact CA-O 3.27Å; V515-H518 PolarHBondContact N-O 2.81Å; V515-H518 WeakPolarHBondContact O-CA 3.45Å; V515-H518 WeakPolarHBondContact O-CB 3.3Å; V515-H518 PolarHBondContact O-N 3.17Å; V515-H518 VanDerWaalsContact O-O 3.1Å; D516-H518 PolarHBondContact O-CE1 2.98Å; D516-H518 PolarHBondContact O-N 3.14Å; D516-H518 PolarHBondContact O-ND1 3.36Å; H518-E590 HydrophobicContact CB-CB 3.86Å; H518-E590 IonicContact CD2-OE1 3.23Å; H518-E590 IonicContact CD2-OE2 3.31Å; H518-E590 PolarHBondContact CD2-OE2 3.23Å; H518-E590 IonicContact CG-OE2 3.17Å
519	I	94.9	Very high	94	Very high	42 Å²	42	30.5 Å²	30.5	22%	0.215	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.4	175.4	-61.3	169.6	0	0	0	109.2	R486 N512 I514 E590 L591	R486-I519 HydrophobicContact CG-CD1 4.37Å; N512-I519 HydrophobicContact CB-CG2 3.91Å; I514-I519 HydrophobicContact CG1-CG1 4.25Å; I519-E590 CarbonylContact O-C 3.53Å; I519-E590 VanDerWaalsContact O-CA 3.31Å; I519-E590 WeakPolarHBondContact O-CA 3.06Å; I519-L591 HydrophobicContact CB-CB 3.95Å; I519-L591 HydrophobicContact CG2-CB 3.8Å; I519-L591 HydrophobicContact CG2-CD2 3.85Å; I519-L591 HydrophobicContact CG2-CG 4.5Å; I519-L591 PolarHBondContact O-N 3.49Å
520	K	96.1	Very high	93.7	Very high	33 Å²	33	32.9 Å²	32.9	14%	0.143	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.3	178.2	-68.6	-168.2	167.9	-175.4	0	112.1	K513 F522 L533 P551 N589	K513-K520 PolarHBondContact N-O 3.29Å; K513-K520 PolarHBondContact O-N 2.87Å; K520-F522 HydrophobicContact CB-CE2 3.88Å; K520-F522 WeakPolarHBondContact O-CD2 3.44Å; K520-L533 HydrophobicContact CB-CD2 4.03Å; K520-L533 HydrophobicContact CD-CD2 4.14Å; K520-P551 PolarHBondContact NZ-O 2.04Å; K520-N589 WeakPolarHBondContact CE-O 3.35Å
521	T	97.6	Very high	93.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	133.1	175.8	-45.3	0	0	0	0	112.4	L510 N512 L534 H556 L557 L559	L510-T521 HydrophobicContact CD2-CG2 4.27Å; N512-T521 VanDerWaalsContact OD1-CA 3.24Å; N512-T521 WeakPolarHBondContact OD1-CA 3.35Å; N512-T521 VanDerWaalsContact OD1-CB 3.23Å; N512-T521 WeakPolarHBondContact OD1-CB 3.38Å; N512-T521 WeakPolarHBondContact OD1-CG2 3.2Å; N512-T521 PolarHBondContact OD1-OG1 2.95Å; T521-L534 HydrophobicContact CG2-CD1 3.64Å; T521-L534 HydrophobicContact CG2-CG 4.34Å; T521-H556 PolarHBondContact N-ND1 3.4Å; T521-H556 VanDerWaalsContact N-ND1 3.19Å; T521-H556 WeakPolarHBondContact OG1-CA 3.32Å; T521-L557 HydrophobicContact CG2-CB 4.25Å; T521-L557 PolarHBondContact OG1-N 2.83Å; T521-L559 HydrophobicContact CG2-CD1 4.37Å
522	F	97.3	Very high	93.5	Very high	31 Å²	31	36.5 Å²	36.5	14%	0.136	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	154.6	174.8	-68.1	-103.2	0	0	0	111	L510 A511 K513 V515 K520 W531 A532 L533	L510-F522 CarbonylContact C-O 3.4Å; L510-F522 VanDerWaalsContact CA-O 3.24Å; L510-F522 WeakPolarHBondContact CA-O 3.29Å; A511-F522 PolarHBondContact N-O 2.86Å; A511-F522 PolarHBondContact O-N 2.86Å; K513-F522 HydrophobicContact CB-CD2 3.94Å; K513-F522 HydrophobicContact CB-CE2 3.85Å; K513-F522 HydrophobicContact CD-CE2 4.49Å; K513-F522 HydrophobicContact CG-CE2 4.47Å; V515-F522 HydrophobicContact CG2-CE2 4.24Å; V515-F522 HydrophobicContact CG2-CZ 4.33Å; K520-F522 HydrophobicContact CB-CE2 3.88Å; K520-F522 WeakPolarHBondContact O-CD2 3.44Å; F522-W531 HydrophobicContact CB-CB 4.21Å; F522-W531 HydrophobicContact CB-CE3 3.88Å; F522-W531 HydrophobicContact CD1-CB 4.15Å; F522-A532 CarbonylContact C-O 3.5Å; F522-A532 WeakPolarHBondContact CA-O 3.39Å; F522-L533 HydrophobicContact CD1-CD2 4.11Å; F522-L533 HydrophobicContact CD1-CG 4.3Å; F522-L533 HydrophobicContact CD2-CD2 4.2Å; F522-L533 HydrophobicContact CE1-CD2 3.7Å; F522-L533 HydrophobicContact CE1-CG 3.83Å; F522-L533 HydrophobicContact CE2-CD2 3.79Å; F522-L533 HydrophobicContact CG-CD2 4.34Å; F522-L533 HydrophobicContact CZ-CD2 3.52Å; F522-L533 HydrophobicContact CZ-CG 4.09Å
523	I	97.3	Very high	93.5	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.5	172.1	-170.5	165.6	0	0	0	110.6	Y509 L510 Y525 W531 A532 L534	Y509-I523 WeakPolarHBondContact O-CA 3.31Å; L510-I523 HydrophobicContact CG-CB 4.39Å; L510-I523 HydrophobicContact CG-CD1 4.44Å; L510-I523 HydrophobicContact CG-CG1 4.26Å; I523-Y525 HydrophobicContact CD1-CE1 4.42Å; I523-Y525 HydrophobicContact CD1-CE2 4.3Å; I523-Y525 HydrophobicContact CG1-CE2 4.28Å; I523-Y525 HydrophobicContact CG2-CE2 4.07Å; I523-W531 WeakPolarHBondContact O-CA 3.24Å; I523-A532 PolarHBondContact N-O 3.2Å; I523-A532 PolarHBondContact O-N 3.4Å; I523-L534 HydrophobicContact CB-CD2 3.82Å; I523-L534 HydrophobicContact CD1-CD2 4.31Å; I523-L534 HydrophobicContact CG2-CD2 3.79Å
524	T	95.4	Very high	93.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.7	170.7	-176.4	0	0	0	0	110.1	M508 Y509 N526 G528 T530 W531	M508-T524 WeakPolarHBondContact CA-O 3.5Å; M508-T524 WeakPolarHBondContact CG-O 3.27Å; Y509-T524 HydrophobicContact CD2-CG2 4.09Å; Y509-T524 HydrophobicContact CG-CG2 4.4Å; Y509-T524 PolarHBondContact N-O 2.91Å; Y509-T524 VanDerWaalsContact N-O 3.17Å; Y509-T524 PolarHBondContact O-N 2.85Å; T524-N526 PolarHBondContact OG1-N 3.4Å; T524-N526 PolarHBondContact OG1-OD1 3.34Å; T524-G528 PolarHBondContact OG1-N 2.86Å; T524-T530 WeakPolarHBondContact CB-O 3.42Å; T524-T530 PolarHBondContact OG1-O 2.99Å; T524-W531 HydrophobicContact CG2-CD2 4.27Å; T524-W531 HydrophobicContact CG2-CE3 3.99Å; T524-W531 HydrophobicContact CG2-CH2 3.55Å; T524-W531 HydrophobicContact CG2-CZ2 3.84Å; T524-W531 HydrophobicContact CG2-CZ3 3.62Å
525	Y	94.3	Very high	93.7	Very high	13 Å²	13	36.4 Å²	36.4	5%	0.051	19%	0.194	C	C	.	.	S	Bend	trans	-113.5	5.3	173.6	-60.6	-93.7	0	0	0	111.9	G507 M508 I523 A604 N715	G507-Y525 CarbonylContact O-C 3.5Å; M508-Y525 HydrophobicContact CG-CD1 4Å; M508-Y525 HydrophobicContact CG-CE1 4.38Å; M508-Y525 HydrophobicContact SD-CD1 3.51Å; M508-Y525 VanDerWaalsContact SD-CD1 3.51Å; M508-Y525 HydrophobicContact SD-CE1 3.53Å; M508-Y525 VanDerWaalsContact SD-CE1 3.53Å; I523-Y525 HydrophobicContact CD1-CE1 4.42Å; I523-Y525 HydrophobicContact CD1-CE2 4.3Å; I523-Y525 HydrophobicContact CG1-CE2 4.28Å; I523-Y525 HydrophobicContact CG2-CE2 4.07Å; Y525-A604 WeakPolarHBondContact CE1-O 3.28Å; Y525-A604 PolarHBondContact OH-O 3.45Å; Y525-N715 HydrophobicContact CD1-CB 4.22Å; Y525-N715 HydrophobicContact CD2-CB 4.02Å; Y525-N715 VanDerWaalsContact CD2-CG 3.45Å; Y525-N715 HydrophobicContact CE2-CB 4.36Å; Y525-N715 WeakPolarHBondContact CE2-OD1 3.28Å; Y525-N715 HydrophobicContact CG-CB 3.94Å
526	N	91.3	Very high	93.8	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	19%	0.192	C	C	.	.	S	Bend	trans	-137.5	47.7	-175.8	57.9	-18.6	0	0	0	110.9	T524 G528 Q529 T530 Y757	T524-N526 PolarHBondContact OG1-N 3.4Å; T524-N526 PolarHBondContact OG1-OD1 3.34Å; N526-G528 PolarHBondContact O-N 2.9Å; N526-Q529 HydrophobicContact CB-CB 4.45Å; N526-Q529 PolarHBondContact ND2-OE1 3.46Å; N526-Q529 VanDerWaalsContact O-CB 3.24Å; N526-Q529 WeakPolarHBondContact O-CB 3.49Å; N526-Q529 PolarHBondContact O-N 2.98Å; N526-T530 VanDerWaalsContact CG-OG1 3.24Å; N526-T530 PolarHBondContact ND2-N 2.68Å; N526-T530 PolarHBondContact ND2-OG1 3.13Å; N526-T530 PolarHBondContact OD1-N 2.84Å; N526-T530 VanDerWaalsContact OD1-N 3.13Å; N526-T530 PolarHBondContact OD1-O 3.29Å; N526-T530 VanDerWaalsContact OD1-O 3.05Å; N526-T530 PolarHBondContact OD1-OG1 2.98Å; N526-Y757 HydrophobicContact CB-CD1 4.39Å; N526-Y757 HydrophobicContact CB-CE1 3.7Å; N526-Y757 HydrophobicContact CB-CE2 4.41Å; N526-Y757 VanDerWaalsContact CG-CZ 3.42Å; N526-Y757 VanDerWaalsContact CG-OH 3.28Å; N526-Y757 WeakPolarHBondContact ND2-CE2 3.25Å; N526-Y757 PolarHBondContact ND2-OH 3.46Å; N526-Y757 PolarHBondContact OD1-OH 2.92Å
527	K	92.3	Very high	94.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	28.1	167.8	-156.8	159.9	-178.5	171.7	0	114.4	E450 F454 I470 G507 Y509 M722 V803 L804	E450-K527 PolarHBondContact O-NZ 3.3Å; E450-K527 VanDerWaalsContact OE2-CE 3.28Å; E450-K527 WeakPolarHBondContact OE2-CE 3.43Å; E450-K527 IonicContact OE2-NZ 3.98Å; E450-K527 PolarHBondContact OE2-NZ 2.86Å; F454-K527 HydrophobicContact CE2-CG 4.4Å; F454-K527 HydrophobicContact CZ-CG 3.8Å; I470-K527 HydrophobicContact CD1-CG 4.21Å; I470-K527 WeakPolarHBondContact CD1-O 3.44Å; G507-K527 WeakPolarHBondContact O-CA 3.33Å; G507-K527 PolarHBondContact O-N 3.46Å; Y509-K527 HydrophobicContact CE2-CG 4.08Å; K527-M722 HydrophobicContact CB-CE 4.35Å; K527-M722 HydrophobicContact CB-SD 4.38Å; K527-M722 HydrophobicContact CD-CE 4.02Å; K527-V803 HydrophobicContact CB-CG1 3.92Å; K527-V803 HydrophobicContact CD-CG1 4.25Å; K527-L804 WeakPolarHBondContact CD-O 3.24Å; K527-L804 PolarHBondContact NZ-O 2.96Å
528	G	91.2	Very high	94.1	Very high	2 Å²	2	27 Å²	27	2%	0.021	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	9.5	178.7	0	0	0	0	0	115.4	S481 T524 N526 W531	S481-G528 WeakPolarHBondContact OG-CA 3.19Å; S481-G528 PolarHBondContact OG-O 3.16Å; T524-G528 PolarHBondContact OG1-N 2.86Å; N526-G528 PolarHBondContact O-N 2.9Å; G528-W531 PolarHBondContact O-NE1 3.2Å; G528-W531 VanDerWaalsContact O-NE1 3.08Å
529	Q	88.4	Confident	94	Very high	28 Å²	28	29.4 Å²	29.4	13%	0.131	16%	0.16	C	C	.	.	S	Bend	trans	-73.4	-30.8	173.2	177.9	-151.7	15	0	0	112.4	N526 Y757 F759 E760	N526-Q529 HydrophobicContact CB-CB 4.45Å; N526-Q529 PolarHBondContact ND2-OE1 3.46Å; N526-Q529 VanDerWaalsContact O-CB 3.24Å; N526-Q529 WeakPolarHBondContact O-CB 3.49Å; N526-Q529 PolarHBondContact O-N 2.98Å; Q529-Y757 PolarHBondContact NE2-O 2.73Å; Q529-Y757 PolarHBondContact OE1-O 3.13Å; Q529-F759 PolarHBondContact NE2-O 3.17Å; Q529-E760 HydrophobicContact CG-CB 3.96Å
530	T	90.4	Very high	93.7	Very high	53 Å²	53	28.9 Å²	28.9	33%	0.325	16%	0.157	S	C	.	.	S	Bend	trans	-140.8	146.1	169.7	64.3	0	0	0	0	111.2	T524 N526 Y757	T524-T530 WeakPolarHBondContact CB-O 3.42Å; T524-T530 PolarHBondContact OG1-O 2.99Å; N526-T530 VanDerWaalsContact CG-OG1 3.24Å; N526-T530 PolarHBondContact ND2-N 2.68Å; N526-T530 PolarHBondContact ND2-OG1 3.13Å; N526-T530 PolarHBondContact OD1-N 2.84Å; N526-T530 VanDerWaalsContact OD1-N 3.13Å; N526-T530 PolarHBondContact OD1-O 3.29Å; N526-T530 VanDerWaalsContact OD1-O 3.05Å; N526-T530 PolarHBondContact OD1-OG1 2.98Å; T530-Y757 HydrophobicContact CG2-CE2 4.45Å
531	W	94.3	Very high	93.3	Very high	44 Å²	44	30.4 Å²	30.4	17%	0.167	17%	0.169	C	C	.	.			trans	-128.6	142	-176.2	-66.7	91.7	0	0	0	111.1	L468 S481 L482 F499 A511 F522 I523 T524 G528	L468-W531 HydrophobicContact CD2-CZ2 3.82Å; S481-W531 PolarHBondContact O-NE1 3Å; S481-W531 VanDerWaalsContact O-NE1 3.16Å; L482-W531 HydrophobicContact CB-CZ2 4.48Å; L482-W531 HydrophobicContact CD1-CB 4.37Å; L482-W531 HydrophobicContact CD1-CD2 4.38Å; L482-W531 HydrophobicContact CD1-CG 3.96Å; L482-W531 HydrophobicContact CD2-CD2 4Å; L482-W531 HydrophobicContact CD2-CE3 4.29Å; L482-W531 HydrophobicContact CD2-CG 4.44Å; L482-W531 HydrophobicContact CD2-CH2 4.47Å; L482-W531 HydrophobicContact CD2-CZ2 4.19Å; F499-W531 HydrophobicContact CD2-CH2 4.39Å; F499-W531 HydrophobicContact CE2-CH2 4.02Å; F499-W531 HydrophobicContact CE2-CZ2 4.4Å; A511-W531 HydrophobicContact CB-CE3 4.44Å; A511-W531 HydrophobicContact CB-CH2 3.73Å; A511-W531 HydrophobicContact CB-CZ3 3.67Å; F522-W531 HydrophobicContact CB-CB 4.21Å; F522-W531 HydrophobicContact CB-CE3 3.88Å; F522-W531 HydrophobicContact CD1-CB 4.15Å; I523-W531 WeakPolarHBondContact O-CA 3.24Å; T524-W531 HydrophobicContact CG2-CD2 4.27Å; T524-W531 HydrophobicContact CG2-CE3 3.99Å; T524-W531 HydrophobicContact CG2-CH2 3.55Å; T524-W531 HydrophobicContact CG2-CZ2 3.84Å; T524-W531 HydrophobicContact CG2-CZ3 3.62Å; G528-W531 PolarHBondContact O-NE1 3.2Å; G528-W531 VanDerWaalsContact O-NE1 3.08Å
532	A	94.8	Very high	92.8	Very high	32 Å²	32	35.6 Å²	35.6	26%	0.264	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.3	178.2	0	0	0	0	0	111.6	F522 I523	F522-A532 CarbonylContact C-O 3.5Å; F522-A532 WeakPolarHBondContact CA-O 3.39Å; I523-A532 PolarHBondContact N-O 3.2Å; I523-A532 PolarHBondContact O-N 3.4Å
533	L	96.7	Very high	92.3	Very high	29 Å²	29	35.9 Å²	35.9	15%	0.152	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	146.4	171.5	-70.1	171.7	0	0	0	111.1	K520 F522 L550 P551	K520-L533 HydrophobicContact CB-CD2 4.03Å; K520-L533 HydrophobicContact CD-CD2 4.14Å; F522-L533 HydrophobicContact CD1-CD2 4.11Å; F522-L533 HydrophobicContact CD1-CG 4.3Å; F522-L533 HydrophobicContact CD2-CD2 4.2Å; F522-L533 HydrophobicContact CE1-CD2 3.7Å; F522-L533 HydrophobicContact CE1-CG 3.83Å; F522-L533 HydrophobicContact CE2-CD2 3.79Å; F522-L533 HydrophobicContact CG-CD2 4.34Å; F522-L533 HydrophobicContact CZ-CD2 3.52Å; F522-L533 HydrophobicContact CZ-CG 4.09Å; L533-L550 HydrophobicContact CB-CD2 3.69Å; L533-L550 HydrophobicContact CD1-CD2 4.16Å; L533-P551 HydrophobicContact CD1-CB 3.95Å
534	L	96.6	Very high	92	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-71	133.1	176.2	-63.8	174.3	0	0	0	111.7	L510 T521 I523 S554 L555 L557 W608	L510-L534 HydrophobicContact CD2-CD1 4.11Å; L510-L534 HydrophobicContact CD2-CD2 4.17Å; T521-L534 HydrophobicContact CG2-CD1 3.64Å; T521-L534 HydrophobicContact CG2-CG 4.34Å; I523-L534 HydrophobicContact CB-CD2 3.82Å; I523-L534 HydrophobicContact CD1-CD2 4.31Å; I523-L534 HydrophobicContact CG2-CD2 3.79Å; L534-S554 WeakPolarHBondContact O-CB 3.46Å; L534-L555 HydrophobicContact CB-CB 3.9Å; L534-L555 HydrophobicContact CB-CG 4.47Å; L534-L555 HydrophobicContact CD1-CD2 4.38Å; L534-L555 HydrophobicContact CD1-CG 4.27Å; L534-L555 PolarHBondContact O-N 2.85Å; L534-L557 HydrophobicContact CD1-CD1 3.55Å; L534-L557 HydrophobicContact CD1-CG 3.8Å; L534-W608 HydrophobicContact CD1-CZ2 4.49Å; L534-W608 HydrophobicContact CD2-CZ2 4.12Å
535	P	94.6	Very high	91.7	Very high	45 Å²	45	51 Å²	51	29%	0.292	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-71	134.9	172.4	29.6	-31.5	0	0	0	110.4	N606	P535-N606 WeakPolarHBondContact CG-O 3.39Å
536	A	94.6	Very high	91.4	Very high	23 Å²	23	52.7 Å²	52.7	19%	0.19	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-72.2	151.1	174.6	0	0	0	0	0	111.9	C548 I587	A536-C548 HydrophobicContact CB-CB 3.7Å; A536-C548 WeakPolarHBondContact CB-SG 3.23Å; A536-I587 HydrophobicContact CB-CG2 3.94Å
537	P	94.7	Very high	91.3	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.032	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-61	146.1	173.1	27.6	-36.3	0	0	0	111.3	K539 L546 I587 F599 W608	P537-K539 VanDerWaalsContact C-N 3.26Å; P537-K539 PolarHBondContact O-N 3Å; P537-L546 HydrophobicContact CG-CD1 4.09Å; P537-I587 HydrophobicContact CG-CD1 3.51Å; P537-I587 HydrophobicContact CG-CG1 4.48Å; P537-F599 HydrophobicContact CG-CD1 4.08Å; P537-F599 HydrophobicContact CG-CE1 3.95Å; P537-W608 WeakPolarHBondContact CA-O 3.32Å; P537-W608 WeakPolarHBondContact CB-O 3.16Å
538	T	90.8	Very high	91.3	Very high	108 Å²	108	61.9 Å²	61.9	66%	0.663	34%	0.338	S	S	*	.	S	Bend	trans	-77.1	-13.1	-178.8	56	0	0	0	0	113.7	K545 L546	T538-K545 WeakPolarHBondContact O-CA 3.49Å; T538-L546 PolarHBondContact O-N 3.39Å
539	K	90.6	Very high	91.3	Very high	120 Å²	120	66.7 Å²	66.7	52%	0.522	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-142.4	150.5	-179.8	-65.7	-178.8	170.8	-163	0	110.9	P537 G543 K544	P537-K539 VanDerWaalsContact C-N 3.26Å; P537-K539 PolarHBondContact O-N 3Å; K539-G543 WeakPolarHBondContact CD-O 3.42Å; K539-K544 CarbonylContact C-O 3.58Å; K539-K544 WeakPolarHBondContact CA-O 3.36Å
540	D	87.9	Confident	91.5	Very high	31 Å²	31	69 Å²	69	17%	0.166	38%	0.375	C	S	.	.			trans	-80.7	179.1	166.5	57.1	36.7	0	0	0	111.9	S542 G543 K544 L546	D540-S542 PolarHBondContact O-N 3.42Å; D540-S542 WeakPolarHBondContact OD1-CA 3.48Å; D540-S542 WeakPolarHBondContact OD1-CB 3.39Å; D540-S542 PolarHBondContact OD1-N 2.94Å; D540-S542 VanDerWaalsContact OD1-N 3.1Å; D540-G543 WeakPolarHBondContact O-CA 3.41Å; D540-G543 PolarHBondContact O-N 3.37Å; D540-G543 PolarHBondContact OD1-N 3.48Å; D540-G543 VanDerWaalsContact OD1-N 3.11Å; D540-K544 PolarHBondContact N-O 2.98Å; D540-K544 WeakPolarHBondContact OD1-CB 3.45Å; D540-K544 PolarHBondContact OD1-N 3.09Å; D540-K544 WeakPolarHBondContact OD2-CB 3.4Å; D540-L546 HydrophobicContact CB-CD1 4.16Å; D540-L546 HydrophobicContact CB-CD2 4.17Å; D540-L546 HydrophobicContact CB-CG 4.18Å
541	V	88.8	Confident	91.5	Very high	66 Å²	66	70.1 Å²	70.1	40%	0.4	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-32.7	177.9	-173.4	0	0	0	0	111.9	G543 Q610	V541-G543 PolarHBondContact O-N 3.43Å; V541-Q610 HydrophobicContact CG2-CB 4.05Å; V541-Q610 HydrophobicContact CG2-CG 3.63Å
542	S	87.8	Confident	91.3	Very high	109 Å²	109	76 Å²	76	76%	0.762	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	3.4	174.1	-63.3	0	0	0	0	113.5	D540 K544	D540-S542 PolarHBondContact O-N 3.42Å; D540-S542 WeakPolarHBondContact OD1-CA 3.48Å; D540-S542 WeakPolarHBondContact OD1-CB 3.39Å; D540-S542 PolarHBondContact OD1-N 2.94Å; D540-S542 VanDerWaalsContact OD1-N 3.1Å; S542-K544 PolarHBondContact O-N 3.38Å
543	G	86.7	Confident	91.2	Very high	36 Å²	36	75.9 Å²	75.9	37%	0.371	41%	0.407	S	S	.	.			trans	73.1	3.1	179.9	0	0	0	0	0	114.9	K539 D540 V541	K539-G543 WeakPolarHBondContact CD-O 3.42Å; D540-G543 WeakPolarHBondContact O-CA 3.41Å; D540-G543 PolarHBondContact O-N 3.37Å; D540-G543 PolarHBondContact OD1-N 3.48Å; D540-G543 VanDerWaalsContact OD1-N 3.11Å; V541-G543 PolarHBondContact O-N 3.43Å
544	K	89.6	Confident	91.2	Very high	145 Å²	145	74.5 Å²	74.5	63%	0.63	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-75.3	140.4	178.6	158.1	-170.5	171.5	-162.7	0	109.2	K539 D540 S542 L546	K539-K544 CarbonylContact C-O 3.58Å; K539-K544 WeakPolarHBondContact CA-O 3.36Å; D540-K544 PolarHBondContact N-O 2.98Å; D540-K544 WeakPolarHBondContact OD1-CB 3.45Å; D540-K544 PolarHBondContact OD1-N 3.09Å; D540-K544 WeakPolarHBondContact OD2-CB 3.4Å; S542-K544 PolarHBondContact O-N 3.38Å; K544-L546 PolarHBondContact O-N 2.81Å
545	K	89.6	Confident	91.2	Very high	178 Å²	178	74.5 Å²	74.5	77%	0.774	40%	0.4	S	S	*	.	B	Isolated β-bridge	trans	-70.8	125.1	-173.6	-171.2	178.3	-179.5	-179.2	0	111.1	T538	T538-K545 WeakPolarHBondContact O-CA 3.49Å
546	L	88.9	Confident	91.3	Very high	50 Å²	50	72.4 Å²	72.4	26%	0.262	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-86.4	144.4	175	-69.1	171.4	0	0	0	111	P537 T538 D540 K544 I587	P537-L546 HydrophobicContact CG-CD1 4.09Å; T538-L546 PolarHBondContact O-N 3.39Å; D540-L546 HydrophobicContact CB-CD1 4.16Å; D540-L546 HydrophobicContact CB-CD2 4.17Å; D540-L546 HydrophobicContact CB-CG 4.18Å; K544-L546 PolarHBondContact O-N 2.81Å; L546-I587 HydrophobicContact CD1-CD1 3.6Å
547	H	88.8	Confident	91.4	Very high	167 Å²	167	71.3 Å²	71.3	77%	0.773	38%	0.377	S	S	*	.			trans	-116.6	75.1	178.4	-172.5	-73.5	0	0	0	110.5
548	C	91.9	Very high	91.4	Very high	29 Å²	29	72.7 Å²	72.7	20%	0.196	38%	0.383	C	S	.	.			trans	-120.4	124.5	177.6	-176.9	0	0	0	0	108.6	A536 C553 S554 I587	A536-C548 HydrophobicContact CB-CB 3.7Å; A536-C548 WeakPolarHBondContact CB-SG 3.23Å; C548-C553 VanDerWaalsContact CA-SG 3.59Å; C548-C553 HydrophobicContact CB-CB 4.04Å; C548-C553 WeakPolarHBondContact CB-SG 3.39Å; C548-C553 WeakPolarHBondContact SG-CB 3.34Å; C548-C553 PolarHBondContact SG-O 3.45Å; C548-C553 CovalentContact SG-SG 2.04Å; C548-C553 PolarHBondContact SG-SG 3.04Å; C548-S554 PolarHBondContact SG-N 2.96Å; C548-S554 VanDerWaalsContact SG-N 3.36Å; C548-I587 HydrophobicContact CB-CG2 3.91Å; C548-I587 WeakPolarHBondContact SG-CG2 3.29Å
549	I	90.9	Very high	91.5	Very high	102 Å²	102	67.8 Å²	67.8	52%	0.523	35%	0.352	S	S	.	.			trans	-131.1	127.6	-171.6	-55.9	-178.2	0	0	0	110.1	F552 C553	I549-F552 PolarHBondContact O-N 2.88Å; I549-C553 CarbonylContact C-O 3.52Å; I549-C553 VanDerWaalsContact C-O 3.27Å; I549-C553 PolarHBondContact O-N 3.2Å
550	L	92.1	Very high	91.1	Very high	77 Å²	77	66.3 Å²	66.3	40%	0.403	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	146	176.4	-66.2	173.7	0	0	0	111.4	L533 C553	L533-L550 HydrophobicContact CB-CD2 3.69Å; L533-L550 HydrophobicContact CD1-CD2 4.16Å; L550-C553 PolarHBondContact N-O 3.01Å
551	P	90.6	Very high	90.4	Very high	77 Å²	77	72 Å²	72	50%	0.5	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.2	2.2	-0.3	37.8	-36.6	0	0	0	114	K520 L533	K520-P551 PolarHBondContact NZ-O 2.04Å; L533-P551 HydrophobicContact CD1-CB 3.95Å
552	F	89.8	Confident	89.4	Confident	168 Å²	168	70.7 Å²	70.7	74%	0.737	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-38.8	-174.5	-57.3	-73	0	0	0	112.4	I549	I549-F552 PolarHBondContact O-N 2.88Å
553	C	93.6	Very high	88.4	Confident	29 Å²	29	72.1 Å²	72.1	20%	0.196	36%	0.363	C	S	.	.	S	Bend	trans	-127.2	138	175.9	179	0	0	0	0	110.2	C548 I549 L550 G588	C548-C553 VanDerWaalsContact CA-SG 3.59Å; C548-C553 HydrophobicContact CB-CB 4.04Å; C548-C553 WeakPolarHBondContact CB-SG 3.39Å; C548-C553 WeakPolarHBondContact SG-CB 3.34Å; C548-C553 PolarHBondContact SG-O 3.45Å; C548-C553 CovalentContact SG-SG 2.04Å; C548-C553 PolarHBondContact SG-SG 3.04Å; I549-C553 CarbonylContact C-O 3.52Å; I549-C553 VanDerWaalsContact C-O 3.27Å; I549-C553 PolarHBondContact O-N 3.2Å; L550-C553 PolarHBondContact N-O 3.01Å; C553-G588 WeakPolarHBondContact CA-O 3.44Å
554	S	95.9	Very high	87.7	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	169.7	-175.2	18.4	0	0	0	0	111.1	L534 C548 H556 G588	L534-S554 WeakPolarHBondContact O-CB 3.46Å; C548-S554 PolarHBondContact SG-N 2.96Å; C548-S554 VanDerWaalsContact SG-N 3.36Å; S554-H556 PolarHBondContact OG-CE1 3.4Å; S554-H556 PolarHBondContact OG-NE2 2.96Å; S554-G588 PolarHBondContact N-O 2.64Å; S554-G588 PolarHBondContact O-N 3.4Å
555	L	96.8	Very high	86.9	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	136.8	162.6	176.5	62.8	0	0	0	109.6	L534 L557 I587 F599 W608	L534-L555 HydrophobicContact CB-CB 3.9Å; L534-L555 HydrophobicContact CB-CG 4.47Å; L534-L555 HydrophobicContact CD1-CD2 4.38Å; L534-L555 HydrophobicContact CD1-CG 4.27Å; L534-L555 PolarHBondContact O-N 2.85Å; L555-L557 HydrophobicContact CD1-CD2 3.99Å; L555-L557 HydrophobicContact CD2-CD2 4.14Å; L555-L557 HydrophobicContact CG-CD2 3.95Å; L555-L557 HydrophobicContact CG-CG 4.34Å; L555-I587 HydrophobicContact CD1-CG1 4.24Å; L555-F599 HydrophobicContact CD1-CB 4.46Å; L555-F599 HydrophobicContact CD1-CD1 3.88Å; L555-F599 HydrophobicContact CD1-CD2 3.65Å; L555-F599 HydrophobicContact CD1-CE1 4.02Å; L555-F599 HydrophobicContact CD1-CE2 3.81Å; L555-F599 HydrophobicContact CD1-CG 3.69Å; L555-F599 HydrophobicContact CD1-CZ 4Å; L555-F599 HydrophobicContact CD2-CB 4.28Å; L555-F599 HydrophobicContact CD2-CG 4.32Å; L555-W608 HydrophobicContact CD2-CB 3.88Å; L555-W608 HydrophobicContact CD2-CD2 3.46Å; L555-W608 VanDerWaalsContact CD2-CD2 3.46Å; L555-W608 HydrophobicContact CD2-CE3 3.81Å; L555-W608 HydrophobicContact CD2-CG 3.48Å; L555-W608 VanDerWaalsContact CD2-CG 3.48Å
556	H	96.9	Very high	86.4	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.8	177.9	-64.9	-39.4	0	0	0	109.8	T521 S554 G585 N586 G588 E590 L591	T521-H556 PolarHBondContact N-ND1 3.4Å; T521-H556 VanDerWaalsContact N-ND1 3.19Å; T521-H556 WeakPolarHBondContact OG1-CA 3.32Å; S554-H556 PolarHBondContact OG-CE1 3.4Å; S554-H556 PolarHBondContact OG-NE2 2.96Å; H556-G585 CarbonylContact O-C 3.55Å; H556-G585 WeakPolarHBondContact O-CA 3.39Å; H556-N586 PolarHBondContact N-O 3.31Å; H556-N586 PolarHBondContact O-N 2.59Å; H556-G588 PolarHBondContact NE2-O 3.08Å; H556-E590 PolarHBondContact CD2-O 3Å; H556-L591 HydrophobicContact CB-CB 4.06Å; H556-L591 HydrophobicContact CB-CD1 3.85Å
557	L	96.8	Very high	85.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.8	-169.9	-57.7	178.2	0	0	0	111.6	L510 N512 T521 L534 L555 L559 A583 L591 F599 W608	L510-L557 HydrophobicContact CD2-CD1 3.91Å; N512-L557 PolarHBondContact ND2-O 2.83Å; N512-L557 VanDerWaalsContact ND2-O 3.07Å; N512-L557 PolarHBondContact OD1-O 3.04Å; T521-L557 HydrophobicContact CG2-CB 4.25Å; T521-L557 PolarHBondContact OG1-N 2.83Å; L534-L557 HydrophobicContact CD1-CD1 3.55Å; L534-L557 HydrophobicContact CD1-CG 3.8Å; L555-L557 HydrophobicContact CD1-CD2 3.99Å; L555-L557 HydrophobicContact CD2-CD2 4.14Å; L555-L557 HydrophobicContact CG-CD2 3.95Å; L555-L557 HydrophobicContact CG-CG 4.34Å; L557-L559 HydrophobicContact CB-CD2 4.16Å; L557-L559 PolarHBondContact O-N 3.08Å; L557-A583 HydrophobicContact CB-CB 4.41Å; L557-A583 HydrophobicContact CD1-CB 3.76Å; L557-A583 HydrophobicContact CD2-CB 3.76Å; L557-A583 HydrophobicContact CG-CB 4.18Å; L557-L591 VanDerWaalsContact C-CD1 3.5Å; L557-F599 HydrophobicContact CD2-CD2 4.29Å; L557-W608 HydrophobicContact CD1-CH2 3.74Å; L557-W608 HydrophobicContact CD1-CZ2 4.19Å; L557-W608 HydrophobicContact CD1-CZ3 4.24Å
558	H	93.9	Very high	85.2	Confident	34 Å²	34	56.4 Å²	56.4	16%	0.157	30%	0.297	C	S	.	.			trans	-82.2	114.1	171.7	-68.3	-73.5	0	0	0	109	P570 T584 S592 L596	H558-P570 HydrophobicContact CB-CB 4.04Å; H558-P570 HydrophobicContact CB-CG 4.31Å; H558-T584 PolarHBondContact N-O 2.76Å; H558-S592 PolarHBondContact NE2-O 2.76Å; H558-S592 VanDerWaalsContact NE2-O 3.09Å; H558-L596 VanDerWaalsContact NE2-CD2 3.31Å; H558-L596 WeakPolarHBondContact NE2-CD2 3.14Å
559	L	92.8	Very high	84.8	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	30%	0.295	C	S	.	.			trans	-100.4	-0.4	-173.4	-58.5	-177.1	0	0	0	113.7	D498 L510 N512 T521 L557 M561 I571	D498-L559 HydrophobicContact CB-CB 4.24Å; D498-L559 HydrophobicContact CB-CD1 4.49Å; L510-L559 HydrophobicContact CB-CD1 4.04Å; L510-L559 HydrophobicContact CB-CD2 4.11Å; N512-L559 HydrophobicContact CB-CD1 4.49Å; T521-L559 HydrophobicContact CG2-CD1 4.37Å; L557-L559 HydrophobicContact CB-CD2 4.16Å; L557-L559 PolarHBondContact O-N 3.08Å; L559-M561 PolarHBondContact O-N 3.23Å; L559-I571 HydrophobicContact CD2-CD1 3.64Å; L559-I571 HydrophobicContact CD2-CG2 4.4Å
560	E	83.6	Confident	84.7	Confident	90 Å²	90	52 Å²	52	42%	0.421	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-62.6	127.9	179.9	-61.7	-173	156.9	0	0	110.7	R486 P570	R486-E560 IonicContact NH2-OE1 2.84Å; E560-P570 WeakPolarHBondContact O-CD 3.32Å; E560-P570 WeakPolarHBondContact O-CG 3.04Å
561	M	73.2	Confident	84.8	Confident	149 Å²	149	48.9 Å²	48.9	73%	0.734	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-87.1	140.2	-176.3	-166.2	162	178.3	0	0	111.6	L559 E563	L559-M561 PolarHBondContact O-N 3.23Å; M561-E563 PolarHBondContact O-N 3Å
562	S	66.9	Low	84.8	Confident	39 Å²	39	46.1 Å²	46.1	27%	0.273	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-72.5	125.7	179	-176	0	0	0	0	111.6	N564 T567	S562-N564 VanDerWaalsContact C-N 3.26Å; S562-N564 PolarHBondContact OG-N 2.78Å; S562-N564 VanDerWaalsContact OG-N 3.16Å; S562-N564 PolarHBondContact OG-O 3.17Å; S562-T567 PolarHBondContact OG-OG1 2.74Å
563	E	68.3	Low	85	Confident	140 Å²	140	38.5 Å²	38.5	65%	0.654	21%	0.21	S	C	*	.	S	Bend	trans	-71.9	-20.7	167.7	-62	-179	155.2	0	0	112.2	M561	M561-E563 PolarHBondContact O-N 3Å
564	N	71.6	Confident	84.7	Confident	65 Å²	65	42.4 Å²	42.4	35%	0.348	22%	0.224	S	C	.	.			trans	-88.5	119.6	179.3	179.7	-4.2	0	0	0	110.4	S562 Y566 T567	S562-N564 VanDerWaalsContact C-N 3.26Å; S562-N564 PolarHBondContact OG-N 2.78Å; S562-N564 VanDerWaalsContact OG-N 3.16Å; S562-N564 PolarHBondContact OG-O 3.17Å; N564-Y566 VanDerWaalsContact C-N 3.34Å; N564-Y566 PolarHBondContact O-N 2.87Å; N564-Y566 VanDerWaalsContact OD1-CD2 3.31Å; N564-Y566 WeakPolarHBondContact OD1-CD2 3.45Å; N564-Y566 PolarHBondContact OD1-N 2.99Å; N564-T567 PolarHBondContact O-OG1 3.33Å
565	P	72.3	Confident	84.3	Confident	90 Å²	90	47.8 Å²	47.8	58%	0.584	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-14.5	-178.3	32.2	-36.6	0	0	0	114.4	P1225	P565-P1225 HydrophobicContact CG-CB 4.45Å
566	Y	78.1	Confident	83.6	Confident	43 Å²	43	48.7 Å²	48.7	17%	0.169	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.7	-178.5	-51.6	-70.9	0	0	0	113.5	V208 N564 V665 F679	V208-Y566 HydrophobicContact CB-CE1 4.3Å; V208-Y566 PolarHBondContact N-OH 2.95Å; V208-Y566 VanDerWaalsContact N-OH 3.16Å; V208-Y566 PolarHBondContact O-OH 3.19Å; N564-Y566 VanDerWaalsContact C-N 3.34Å; N564-Y566 PolarHBondContact O-N 2.87Å; N564-Y566 VanDerWaalsContact OD1-CD2 3.31Å; N564-Y566 WeakPolarHBondContact OD1-CD2 3.45Å; N564-Y566 PolarHBondContact OD1-N 2.99Å; Y566-V665 PolarHBondContact O-N 2.04Å; Y566-F679 AromaticContact CD1-CE1 3.78Å; Y566-F679 HydrophobicContact CD1-CE1 3.78Å; Y566-F679 AromaticContact CD1-CZ 3.79Å; Y566-F679 HydrophobicContact CD1-CZ 3.79Å; Y566-F679 HydrophobicContact CD2-CZ 4.04Å; Y566-F679 HydrophobicContact CE1-CE1 4.37Å; Y566-F679 HydrophobicContact CE1-CZ 4.34Å; Y566-F679 HydrophobicContact CG-CE1 4.02Å; Y566-F679 AromaticContact CG-CZ 3.6Å; Y566-F679 HydrophobicContact CG-CZ 3.6Å
567	T	79.6	Confident	83	Confident	33 Å²	33	49.3 Å²	49.3	20%	0.202	26%	0.257	C	S	.	.	S	Bend	trans	-124	149.1	176	54.3	0	0	0	0	109.9	S562 N564	S562-T567 PolarHBondContact OG-OG1 2.74Å; N564-T567 PolarHBondContact O-OG1 3.33Å
568	S	74.2	Confident	82.7	Confident	15 Å²	15	49.8 Å²	49.8	11%	0.105	26%	0.26	C	S	.	.			trans	-78.4	137.2	170.7	61.3	0	0	0	0	109.7	N617 I618	S568-N617 PolarHBondContact N-OD1 2.98Å; S568-N617 PolarHBondContact O-OD1 2.75Å; S568-N617 WeakPolarHBondContact OG-CA 3.46Å; S568-N617 WeakPolarHBondContact OG-CB 3.39Å; S568-N617 PolarHBondContact OG-OD1 2.88Å; S568-I618 WeakPolarHBondContact CB-O 3.49Å; S568-I618 PolarHBondContact OG-N 2.95Å
569	G	83.2	Confident	82.5	Confident	16 Å²	16	48.2 Å²	48.2	17%	0.165	25%	0.253	C	S	.	.			trans	-63.7	167.6	168.6	0	0	0	0	0	112.9	I571	G569-I571 PolarHBondContact O-N 2.81Å; G569-I571 VanDerWaalsContact O-N 3.09Å
570	P	89.6	Confident	82.5	Confident	23 Å²	23	48.2 Å²	48.2	15%	0.149	25%	0.253	C	S	.	.	S	Bend	trans	-63.5	-11.6	178.6	28.7	-37.3	0	0	0	113.8	H558 E560 A583 T584	H558-P570 HydrophobicContact CB-CB 4.04Å; H558-P570 HydrophobicContact CB-CG 4.31Å; E560-P570 WeakPolarHBondContact O-CD 3.32Å; E560-P570 WeakPolarHBondContact O-CG 3.04Å; P570-A583 CarbonylContact O-C 3.5Å; P570-A583 VanDerWaalsContact O-CA 3.22Å; P570-A583 WeakPolarHBondContact O-CA 3.47Å; P570-T584 PolarHBondContact O-N 2.85Å
571	I	93.2	Very high	83.1	Confident	10 Å²	10	44 Å²	44	5%	0.051	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	136.9	169	-178.2	162.7	0	0	0	110.8	Y500 L510 L559 G569 I581 V582 A583	Y500-I571 HydrophobicContact CD1-CD1 3.62Å; Y500-I571 HydrophobicContact CD1-CG1 4.07Å; Y500-I571 HydrophobicContact CD2-CG2 3.64Å; Y500-I571 HydrophobicContact CE1-CD1 3.88Å; Y500-I571 HydrophobicContact CE1-CG1 3.87Å; Y500-I571 HydrophobicContact CE2-CG1 4.34Å; Y500-I571 HydrophobicContact CE2-CG2 3.8Å; Y500-I571 HydrophobicContact CG-CD1 4Å; Y500-I571 HydrophobicContact CG-CG1 4.39Å; Y500-I571 HydrophobicContact CG-CG2 4.07Å; L510-I571 HydrophobicContact CD1-CD1 4.39Å; L559-I571 HydrophobicContact CD2-CD1 3.64Å; L559-I571 HydrophobicContact CD2-CG2 4.4Å; G569-I571 PolarHBondContact O-N 2.81Å; G569-I571 VanDerWaalsContact O-N 3.09Å; I571-I581 HydrophobicContact CD1-CG2 4.03Å; I571-I581 HydrophobicContact CG1-CG2 3.99Å; I571-V582 WeakPolarHBondContact CA-O 3.12Å; I571-A583 HydrophobicContact CB-CB 4.1Å; I571-A583 HydrophobicContact CD1-CB 4.15Å; I571-A583 HydrophobicContact CG1-CB 3.96Å
572	T	91.4	Very high	84.2	Confident	20 Å²	20	37 Å²	37	12%	0.123	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.9	179.1	60.5	0	0	0	0	113	I581 V582	T572-I581 WeakPolarHBondContact O-CA 3.47Å; T572-I581 WeakPolarHBondContact O-CG2 3.34Å; T572-V582 PolarHBondContact N-O 3.44Å; T572-V582 PolarHBondContact O-N 3.01Å; T572-V582 PolarHBondContact OG1-O 2.94Å
573	S	92.5	Very high	85.6	Confident	7 Å²	7	35.2 Å²	35.2	5%	0.049	19%	0.186	C	C	.	.			trans	-151	163.3	169.3	64.7	0	0	0	0	108.6	Y500 E503	Y500-S573 PolarHBondContact OH-N 2.93Å; Y500-S573 PolarHBondContact OH-OG 3.48Å; E503-S573 PolarHBondContact N-OG 3.34Å
574	K	88.3	Confident	86.9	Confident	112 Å²	112	28.8 Å²	28.8	49%	0.487	16%	0.157	S	C	.	.			trans	-146.7	141.6	-176.7	-70.5	-65.6	-177	-179.5	0	112.4	S576 V577 F620	K574-S576 PolarHBondContact O-N 3.14Å; K574-V577 HydrophobicContact CB-CG2 4.3Å; K574-V577 CarbonylContact O-C 3.56Å; K574-V577 PolarHBondContact O-N 2.75Å; K574-F620 HydrophobicContact CG-CD2 3.88Å; K574-F620 HydrophobicContact CG-CE2 4.2Å; K574-F620 HydrophobicContact CG-CG 4.28Å
575	K	86.9	Confident	88	Confident	113 Å²	113	25.7 Å²	25.7	49%	0.491	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.7	173.2	-60.4	179.8	-173.7	168.8	0	114	E503 R745	E503-K575 HydrophobicContact CB-CG 4.04Å; E503-K575 HydrophobicContact CG-CG 4.45Å; E503-K575 WeakPolarHBondContact OE1-CE 3.43Å; E503-K575 IonicContact OE1-NZ 3.17Å; E503-K575 WeakPolarHBondContact OE2-CE 3.42Å; E503-K575 WeakPolarHBondContact OE2-CG 3.46Å; E503-K575 IonicContact OE2-NZ 2.59Å; K575-R745 PolarHBondContact O-NH1 2.69Å
576	S	81.4	Confident	89.1	Confident	18 Å²	18	21.9 Å²	21.9	13%	0.126	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-24	172.8	43.9	0	0	0	0	114.1	K574 P578 N623	K574-S576 PolarHBondContact O-N 3.14Å; S576-P578 VanDerWaalsContact C-CD 3.48Å; S576-P578 WeakPolarHBondContact O-CD 3.42Å; S576-N623 VanDerWaalsContact CB-OD1 3.31Å; S576-N623 WeakPolarHBondContact CB-OD1 3.48Å
577	V	86.1	Confident	89.9	Confident	13 Å²	13	22.2 Å²	22.2	8%	0.079	12%	0.119	C	C	.	.	S	Bend	trans	-131.5	58.2	-169.2	-147.5	0	0	0	0	111.5	K574 G579 I580 F620 N623	K574-V577 HydrophobicContact CB-CG2 4.3Å; K574-V577 CarbonylContact O-C 3.56Å; K574-V577 PolarHBondContact O-N 2.75Å; V577-G579 PolarHBondContact O-N 2.96Å; V577-I580 HydrophobicContact CG1-CB 4.19Å; V577-I580 HydrophobicContact CG1-CD1 3.62Å; V577-I580 HydrophobicContact CG1-CG1 3.9Å; V577-I580 PolarHBondContact O-N 3.44Å; V577-I580 VanDerWaalsContact O-N 3.15Å; V577-F620 HydrophobicContact CB-CD1 4.27Å; V577-F620 HydrophobicContact CB-CE1 4.34Å; V577-F620 HydrophobicContact CG2-CD1 3.73Å; V577-F620 HydrophobicContact CG2-CE1 4.27Å; V577-F620 HydrophobicContact CG2-CG 4.39Å; V577-N623 WeakPolarHBondContact CG2-O 3.4Å
578	P	89.4	Confident	90.5	Very high	11 Å²	11	21.3 Å²	21.3	7%	0.071	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	135.6	-173.3	24.2	-34.2	0	0	0	111.9	I505 S576 Y728	I505-P578 HydrophobicContact CG1-CB 4.25Å; S576-P578 VanDerWaalsContact C-CD 3.48Å; S576-P578 WeakPolarHBondContact O-CD 3.42Å; P578-Y728 HydrophobicContact CB-CD1 3.89Å; P578-Y728 HydrophobicContact CB-CE1 3.64Å; P578-Y728 HydrophobicContact CB-CG 4.49Å; P578-Y728 HydrophobicContact CG-CD1 3.4Å; P578-Y728 VanDerWaalsContact CG-CD1 3.4Å; P578-Y728 HydrophobicContact CG-CE1 3.63Å; P578-Y728 HydrophobicContact CG-CG 4.1Å
579	G	90.1	Very high	91.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.01	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	-7.4	-178.4	0	0	0	0	0	115.3	V577 S602 D603 A604	V577-G579 PolarHBondContact O-N 2.96Å; G579-S602 CarbonylContact O-C 3.53Å; G579-D603 PolarHBondContact O-N 3.2Å; G579-A604 PolarHBondContact O-N 2.94Å
580	I	93.8	Very high	92	Very high	5 Å²	5	27 Å²	27	3%	0.026	14%	0.14	C	C	.	.			trans	-95.3	125.2	169.5	-53.4	-165.4	0	0	0	110.2	V577 V582 I600 T601 F620 E646	V577-I580 HydrophobicContact CG1-CB 4.19Å; V577-I580 HydrophobicContact CG1-CD1 3.62Å; V577-I580 HydrophobicContact CG1-CG1 3.9Å; V577-I580 PolarHBondContact O-N 3.44Å; V577-I580 VanDerWaalsContact O-N 3.15Å; I580-V582 HydrophobicContact CG2-CG2 4.35Å; I580-I600 HydrophobicContact CG2-CD1 4.08Å; I580-I600 HydrophobicContact CG2-CG1 4.27Å; I580-T601 WeakPolarHBondContact CA-O 3.37Å; I580-F620 HydrophobicContact CB-CE1 4.34Å; I580-F620 HydrophobicContact CG2-CE1 3.89Å; I580-F620 HydrophobicContact CG2-CZ 4.36Å; I580-E646 HydrophobicContact CD1-CB 4.16Å; I580-E646 HydrophobicContact CD1-CG 3.79Å
581	I	95.8	Very high	92.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	132.3	171.8	-40	172.8	0	0	0	107.1	V502 M508 L510 I571 T572 I600 T601 W608	V502-I581 HydrophobicContact CB-CD1 4.43Å; V502-I581 HydrophobicContact CG1-CD1 3.69Å; V502-I581 HydrophobicContact CG1-CG1 3.8Å; V502-I581 HydrophobicContact CG2-CD1 3.82Å; M508-I581 HydrophobicContact CE-CD1 4.19Å; L510-I581 HydrophobicContact CD1-CD1 4.38Å; I571-I581 HydrophobicContact CD1-CG2 4.03Å; I571-I581 HydrophobicContact CG1-CG2 3.99Å; T572-I581 WeakPolarHBondContact O-CA 3.47Å; T572-I581 WeakPolarHBondContact O-CG2 3.34Å; I581-I600 WeakPolarHBondContact O-CA 3.19Å; I581-T601 HydrophobicContact CB-CG2 3.63Å; I581-T601 HydrophobicContact CD1-CG2 3.94Å; I581-T601 HydrophobicContact CG1-CG2 3.74Å; I581-T601 PolarHBondContact N-O 3.49Å; I581-T601 PolarHBondContact O-N 3.35Å; I581-W608 HydrophobicContact CB-CH2 4.18Å; I581-W608 HydrophobicContact CG2-CH2 4.34Å
582	V	95.5	Very high	92.1	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.2	173.3	-164.7	0	0	0	0	108.5	I571 T572 I580 F599 I600 I611 I618 F620	I571-V582 WeakPolarHBondContact CA-O 3.12Å; T572-V582 PolarHBondContact N-O 3.44Å; T572-V582 PolarHBondContact O-N 3.01Å; T572-V582 PolarHBondContact OG1-O 2.94Å; I580-V582 HydrophobicContact CG2-CG2 4.35Å; V582-F599 WeakPolarHBondContact CA-O 3.43Å; V582-I600 HydrophobicContact CG2-CD1 3.88Å; V582-I600 HydrophobicContact CG2-CG1 4Å; V582-I611 HydrophobicContact CG1-CD1 3.88Å; V582-I618 HydrophobicContact CB-CG2 4.32Å; V582-I618 HydrophobicContact CG1-CD1 4.45Å; V582-I618 HydrophobicContact CG1-CG1 4Å; V582-I618 HydrophobicContact CG1-CG2 4.48Å; V582-I618 HydrophobicContact CG2-CG2 4.23Å; V582-F620 HydrophobicContact CG2-CZ 4.23Å
583	A	95.9	Very high	91.8	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	140.8	-173.6	0	0	0	0	0	113.8	L557 P570 I571 F599	L557-A583 HydrophobicContact CB-CB 4.41Å; L557-A583 HydrophobicContact CD1-CB 3.76Å; L557-A583 HydrophobicContact CD2-CB 3.76Å; L557-A583 HydrophobicContact CG-CB 4.18Å; P570-A583 CarbonylContact O-C 3.5Å; P570-A583 VanDerWaalsContact O-CA 3.22Å; P570-A583 WeakPolarHBondContact O-CA 3.47Å; I571-A583 HydrophobicContact CB-CB 4.1Å; I571-A583 HydrophobicContact CD1-CB 4.15Å; I571-A583 HydrophobicContact CG1-CB 3.96Å; A583-F599 PolarHBondContact N-O 3.01Å; A583-F599 PolarHBondContact O-N 2.95Å
584	T	95.3	Very high	91.2	Very high	5 Å²	5	34.8 Å²	34.8	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.4	166.4	-59.7	0	0	0	0	110.1	H558 P570 L596 G597 E615	H558-T584 PolarHBondContact N-O 2.76Å; P570-T584 PolarHBondContact O-N 2.85Å; T584-L596 HydrophobicContact CG2-CD2 4.37Å; T584-G597 WeakPolarHBondContact CA-O 2.95Å; T584-E615 HydrophobicContact CG2-CG 3.82Å
585	G	95.4	Very high	91	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	-159.6	-177.5	0	0	0	0	0	113	H556 L596 G597	H556-G585 CarbonylContact O-C 3.55Å; H556-G585 WeakPolarHBondContact O-CA 3.39Å; G585-L596 CarbonylContact O-C 3.53Å; G585-L596 WeakPolarHBondContact O-CA 3.41Å; G585-G597 PolarHBondContact N-O 2.98Å; G585-G597 PolarHBondContact O-N 3.48Å
586	N	95.3	Very high	91.1	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	165.6	171.7	71.5	-74.6	0	0	0	110.6	H556 E590 L591 S592 N595	H556-N586 PolarHBondContact N-O 3.31Å; H556-N586 PolarHBondContact O-N 2.59Å; N586-E590 PolarHBondContact ND2-O 2.95Å; N586-L591 WeakPolarHBondContact OD1-CA 3.04Å; N586-S592 PolarHBondContact OD1-N 3.48Å; N586-N595 WeakPolarHBondContact CB-O 3.4Å
587	I	94.9	Very high	91.6	Very high	50 Å²	50	32.9 Å²	32.9	26%	0.256	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.4	173.5	-56.4	172.2	0	0	0	108	A536 P537 L546 C548 L555 F599	A536-I587 HydrophobicContact CB-CG2 3.94Å; P537-I587 HydrophobicContact CG-CD1 3.51Å; P537-I587 HydrophobicContact CG-CG1 4.48Å; L546-I587 HydrophobicContact CD1-CD1 3.6Å; C548-I587 HydrophobicContact CB-CG2 3.91Å; C548-I587 WeakPolarHBondContact SG-CG2 3.29Å; L555-I587 HydrophobicContact CD1-CG1 4.24Å; I587-F599 HydrophobicContact CD1-CE1 3.86Å; I587-F599 HydrophobicContact CD1-CZ 4.19Å; I587-F599 HydrophobicContact CG1-CE1 3.95Å; I587-F599 HydrophobicContact CG1-CZ 3.89Å
588	G	93.5	Very high	92.1	Very high	14 Å²	14	32.4 Å²	32.4	14%	0.144	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166	-157.6	178.2	0	0	0	0	0	114.8	C553 S554 H556	C553-G588 WeakPolarHBondContact CA-O 3.44Å; S554-G588 PolarHBondContact N-O 2.64Å; S554-G588 PolarHBondContact O-N 3.4Å; H556-G588 PolarHBondContact NE2-O 3.08Å
589	N	92.9	Very high	92.4	Very high	79 Å²	79	32 Å²	32	42%	0.422	19%	0.191	S	C	.	.	S	Bend	trans	-81.2	-20	172.8	60.6	-59.1	0	0	0	113.1	K520	K520-N589 WeakPolarHBondContact CE-O 3.35Å
590	E	94	Very high	92.7	Very high	73 Å²	73	32 Å²	32	34%	0.341	19%	0.191	S	C	.	.	S	Bend	trans	-153.6	162.3	-177.5	73.4	-168.8	131.2	0	0	112.7	H518 I519 H556 N586	H518-E590 HydrophobicContact CB-CB 3.86Å; H518-E590 IonicContact CD2-OE1 3.23Å; H518-E590 IonicContact CD2-OE2 3.31Å; H518-E590 PolarHBondContact CD2-OE2 3.23Å; H518-E590 IonicContact CG-OE2 3.17Å; I519-E590 CarbonylContact O-C 3.53Å; I519-E590 VanDerWaalsContact O-CA 3.31Å; I519-E590 WeakPolarHBondContact O-CA 3.06Å; H556-E590 PolarHBondContact CD2-O 3Å; N586-E590 PolarHBondContact ND2-O 2.95Å
591	L	94.4	Very high	92.8	Very high	21 Å²	21	31.8 Å²	31.8	11%	0.11	19%	0.19	C	C	.	.			trans	-69	126.3	168.8	-174.3	70	0	0	0	110.1	I519 H556 L557 N586	I519-L591 HydrophobicContact CB-CB 3.95Å; I519-L591 HydrophobicContact CG2-CB 3.8Å; I519-L591 HydrophobicContact CG2-CD2 3.85Å; I519-L591 HydrophobicContact CG2-CG 4.5Å; I519-L591 PolarHBondContact O-N 3.49Å; H556-L591 HydrophobicContact CB-CB 4.06Å; H556-L591 HydrophobicContact CB-CD1 3.85Å; L557-L591 VanDerWaalsContact C-CD1 3.5Å; N586-L591 WeakPolarHBondContact OD1-CA 3.04Å
592	S	91.4	Very high	92.7	Very high	37 Å²	37	32.6 Å²	32.6	26%	0.259	20%	0.196	S	C	.	.			trans	-128.2	147.7	-173.9	170.8	0	0	0	0	111.3	H558 N586 A594 L596	H558-S592 PolarHBondContact NE2-O 2.76Å; H558-S592 VanDerWaalsContact NE2-O 3.09Å; N586-S592 PolarHBondContact OD1-N 3.48Å; S592-A594 WeakPolarHBondContact CB-O 3.41Å; S592-A594 PolarHBondContact OG-N 2.89Å; S592-A594 PolarHBondContact OG-O 2.81Å; S592-L596 VanDerWaalsContact O-CD2 3.32Å; S592-L596 WeakPolarHBondContact O-CD2 3.34Å
593	S	85.8	Confident	92.5	Very high	104 Å²	104	33.8 Å²	33.8	73%	0.727	20%	0.202	S	C	*	.	S	Bend	trans	-88.3	-8.9	168.7	-51.7	0	0	0	0	113
594	A	79.2	Confident	92.4	Very high	60 Å²	60	33.7 Å²	33.7	50%	0.496	20%	0.201	S	C	.	.	S	Bend	trans	-103.4	149.9	170.2	0	0	0	0	0	110.5	S592	S592-A594 WeakPolarHBondContact CB-O 3.41Å; S592-A594 PolarHBondContact OG-N 2.89Å; S592-A594 PolarHBondContact OG-O 2.81Å
595	N	83.5	Confident	92.4	Very high	155 Å²	155	33.5 Å²	33.5	83%	0.829	20%	0.2	S	C	*	.	S	Bend	trans	56.9	49.5	-173.9	-52.4	-27.7	0	0	0	112.4	N586	N586-N595 WeakPolarHBondContact CB-O 3.4Å
596	L	89.9	Confident	92.3	Very high	47 Å²	47	35.1 Å²	35.1	25%	0.246	21%	0.209	C	C	.	.			trans	-69.5	153.6	172.1	-63.5	170.9	0	0	0	110.7	H558 T584 G585 S592 E615	H558-L596 VanDerWaalsContact NE2-CD2 3.31Å; H558-L596 WeakPolarHBondContact NE2-CD2 3.14Å; T584-L596 HydrophobicContact CG2-CD2 4.37Å; G585-L596 CarbonylContact O-C 3.53Å; G585-L596 WeakPolarHBondContact O-CA 3.41Å; S592-L596 VanDerWaalsContact O-CD2 3.32Å; S592-L596 WeakPolarHBondContact O-CD2 3.34Å; L596-E615 HydrophobicContact CD1-CG 4.46Å
597	G	92.6	Very high	92.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	168.9	168.9	0	0	0	0	0	110.1	T584 G585 F599 F612	T584-G597 WeakPolarHBondContact CA-O 2.95Å; G585-G597 PolarHBondContact N-O 2.98Å; G585-G597 PolarHBondContact O-N 3.48Å; G597-F599 WeakPolarHBondContact O-CD2 3.39Å; G597-F599 VanDerWaalsContact O-CE2 3.27Å; G597-F599 WeakPolarHBondContact O-CE2 3.47Å; G597-F612 WeakPolarHBondContact CA-O 3.36Å
598	M	94.8	Very high	92.3	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.5	175.8	-66.3	-148.6	-45.9	0	0	112.5	Q610 I611 F612 Y616 I618	M598-Q610 WeakPolarHBondContact O-CA 3.44Å; M598-Q610 WeakPolarHBondContact O-CG 3.43Å; M598-I611 HydrophobicContact CB-CD1 4.24Å; M598-I611 HydrophobicContact CB-CG1 3.93Å; M598-I611 HydrophobicContact CE-CD1 4.02Å; M598-I611 VanDerWaalsContact O-CG1 3.29Å; M598-I611 WeakPolarHBondContact O-CG1 3.19Å; M598-I611 PolarHBondContact O-N 3.38Å; M598-F612 HydrophobicContact CB-CB 4.37Å; M598-F612 HydrophobicContact CE-CD2 3.51Å; M598-F612 HydrophobicContact CE-CE2 4.11Å; M598-F612 HydrophobicContact CE-CG 4.36Å; M598-F612 PolarHBondContact N-O 3.12Å; M598-Y616 HydrophobicContact CE-CD2 4.32Å; M598-Y616 HydrophobicContact CE-CG 4.31Å; M598-Y616 PolarHBondContact SD-N 2.94Å; M598-Y616 VanDerWaalsContact SD-N 3.44Å; M598-I618 HydrophobicContact CE-CD1 3.87Å; M598-I618 HydrophobicContact CE-CG1 3.89Å; M598-I618 HydrophobicContact SD-CG1 4.37Å
599	F	96.1	Very high	92.3	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143	-174.6	-56.1	-85.5	0	0	0	110.8	P537 L555 L557 V582 A583 I587 G597 W608 R609 Q610	P537-F599 HydrophobicContact CG-CD1 4.08Å; P537-F599 HydrophobicContact CG-CE1 3.95Å; L555-F599 HydrophobicContact CD1-CB 4.46Å; L555-F599 HydrophobicContact CD1-CD1 3.88Å; L555-F599 HydrophobicContact CD1-CD2 3.65Å; L555-F599 HydrophobicContact CD1-CE1 4.02Å; L555-F599 HydrophobicContact CD1-CE2 3.81Å; L555-F599 HydrophobicContact CD1-CG 3.69Å; L555-F599 HydrophobicContact CD1-CZ 4Å; L555-F599 HydrophobicContact CD2-CB 4.28Å; L555-F599 HydrophobicContact CD2-CG 4.32Å; L557-F599 HydrophobicContact CD2-CD2 4.29Å; V582-F599 WeakPolarHBondContact CA-O 3.43Å; A583-F599 PolarHBondContact N-O 3.01Å; A583-F599 PolarHBondContact O-N 2.95Å; I587-F599 HydrophobicContact CD1-CE1 3.86Å; I587-F599 HydrophobicContact CD1-CZ 4.19Å; I587-F599 HydrophobicContact CG1-CE1 3.95Å; I587-F599 HydrophobicContact CG1-CZ 3.89Å; G597-F599 WeakPolarHBondContact O-CD2 3.39Å; G597-F599 VanDerWaalsContact O-CE2 3.27Å; G597-F599 WeakPolarHBondContact O-CE2 3.47Å; F599-W608 HydrophobicContact CB-CE3 3.89Å; F599-W608 HydrophobicContact CB-CZ3 4.37Å; F599-R609 CarbonylContact C-O 3.54Å; F599-R609 VanDerWaalsContact CA-O 3.25Å; F599-R609 WeakPolarHBondContact CA-O 3.48Å; F599-Q610 HydrophobicContact CD1-CB 3.84Å; F599-Q610 HydrophobicContact CD1-CG 3.95Å; F599-Q610 HydrophobicContact CE1-CB 3.64Å; F599-Q610 HydrophobicContact CE1-CG 3.49Å; F599-Q610 VanDerWaalsContact CE1-CG 3.49Å; F599-Q610 HydrophobicContact CZ-CG 3.98Å
600	I	96.4	Very high	92.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.3	174.8	-172.2	164.5	0	0	0	110.6	I580 I581 V582 W608 R609 I611 L627	I580-I600 HydrophobicContact CG2-CD1 4.08Å; I580-I600 HydrophobicContact CG2-CG1 4.27Å; I581-I600 WeakPolarHBondContact O-CA 3.19Å; V582-I600 HydrophobicContact CG2-CD1 3.88Å; V582-I600 HydrophobicContact CG2-CG1 4Å; I600-W608 CarbonylContact O-C 3.53Å; I600-W608 WeakPolarHBondContact O-CA 3.49Å; I600-R609 HydrophobicContact CG2-CB 4.06Å; I600-R609 PolarHBondContact N-O 2.99Å; I600-R609 PolarHBondContact O-N 3.13Å; I600-I611 HydrophobicContact CB-CD1 4.29Å; I600-I611 HydrophobicContact CB-CG2 4.46Å; I600-I611 HydrophobicContact CG2-CG2 3.56Å; I600-L627 HydrophobicContact CD1-CD1 3.59Å
601	T	95.9	Very high	92.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	149.3	158.6	173.8	0	0	0	0	109.3	I580 I581 D603 G605 S607 W608	I580-T601 WeakPolarHBondContact CA-O 3.37Å; I581-T601 HydrophobicContact CB-CG2 3.63Å; I581-T601 HydrophobicContact CD1-CG2 3.94Å; I581-T601 HydrophobicContact CG1-CG2 3.74Å; I581-T601 PolarHBondContact N-O 3.49Å; I581-T601 PolarHBondContact O-N 3.35Å; T601-D603 PolarHBondContact OG1-N 3.37Å; T601-D603 PolarHBondContact OG1-OD1 3.2Å; T601-G605 WeakPolarHBondContact OG1-CA 3.13Å; T601-G605 PolarHBondContact OG1-N 2.58Å; T601-S607 WeakPolarHBondContact CA-O 3.28Å; T601-S607 WeakPolarHBondContact CB-O 3.3Å; T601-S607 PolarHBondContact OG1-O 3.44Å; T601-W608 HydrophobicContact CG2-CD2 4.26Å; T601-W608 HydrophobicContact CG2-CE3 4.12Å; T601-W608 HydrophobicContact CG2-CH2 3.64Å; T601-W608 HydrophobicContact CG2-CZ2 3.76Å; T601-W608 HydrophobicContact CG2-CZ3 3.82Å
602	S	93.1	Very high	92.4	Very high	18 Å²	18	32.1 Å²	32.1	13%	0.126	19%	0.189	C	C	.	.	S	Bend	trans	-117.9	0.7	175.7	45.3	0	0	0	0	113.3	G579 R609 E646 K730	G579-S602 CarbonylContact O-C 3.53Å; S602-R609 PolarHBondContact OG-NH1 3.28Å; S602-R609 PolarHBondContact OG-NH2 3.42Å; S602-R609 VanDerWaalsContact OG-NH2 3.16Å; S602-E646 WeakPolarHBondContact CB-OE2 3.27Å; S602-K730 PolarHBondContact O-NZ 3.17Å
603	D	92.8	Very high	92.4	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.144	20%	0.203	C	C	.	.	S	Bend	trans	-137.8	35.5	-167.9	63.2	7.6	0	0	0	112.1	G579 T601 G605 N606 S607	G579-D603 PolarHBondContact O-N 3.2Å; T601-D603 PolarHBondContact OG1-N 3.37Å; T601-D603 PolarHBondContact OG1-OD1 3.2Å; D603-G605 VanDerWaalsContact C-N 3.28Å; D603-G605 PolarHBondContact O-N 3.19Å; D603-N606 PolarHBondContact O-ND2 3.1Å; D603-N606 PolarHBondContact OD1-N 2.71Å; D603-S607 PolarHBondContact OD1-N 2.81Å; D603-S607 VanDerWaalsContact OD2-CB 3.29Å; D603-S607 WeakPolarHBondContact OD2-CB 3.44Å; D603-S607 PolarHBondContact OD2-N 2.87Å; D603-S607 PolarHBondContact OD2-OG 2.89Å
604	A	94.3	Very high	92.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	20	176.9	0	0	0	0	0	116.2	I505 M508 Y525 G579 W711 L713	I505-A604 HydrophobicContact CD1-CB 3.62Å; M508-A604 HydrophobicContact CE-CB 3.8Å; M508-A604 HydrophobicContact SD-CB 3.86Å; Y525-A604 WeakPolarHBondContact CE1-O 3.28Å; Y525-A604 PolarHBondContact OH-O 3.45Å; G579-A604 PolarHBondContact O-N 2.94Å; A604-W711 HydrophobicContact CB-CH2 3.91Å; A604-W711 HydrophobicContact CB-CZ2 4.07Å; A604-L713 HydrophobicContact CB-CD1 3.81Å
605	G	94.4	Very high	93	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.9	8.2	175.6	0	0	0	0	0	114.7	T601 D603 W608	T601-G605 WeakPolarHBondContact OG1-CA 3.13Å; T601-G605 PolarHBondContact OG1-N 2.58Å; D603-G605 VanDerWaalsContact C-N 3.28Å; D603-G605 PolarHBondContact O-N 3.19Å; G605-W608 PolarHBondContact O-NE1 2.9Å
606	N	93.6	Very high	93.4	Very high	33 Å²	33	28.6 Å²	28.6	18%	0.176	14%	0.144	C	C	.	.	S	Bend	trans	-71.3	-41.6	172.9	-71.6	-92.3	0	0	0	111.2	P535 D603 H714 K716	P535-N606 WeakPolarHBondContact CG-O 3.39Å; D603-N606 PolarHBondContact O-ND2 3.1Å; D603-N606 PolarHBondContact OD1-N 2.71Å; N606-H714 PolarHBondContact ND2-O 3.16Å; N606-H714 PolarHBondContact OD1-ND1 3.34Å; N606-K716 PolarHBondContact OD1-N 2.66Å
607	S	93.8	Very high	93.4	Very high	52 Å²	52	27.1 Å²	27.1	36%	0.364	14%	0.136	S	C	.	.	S	Bend	trans	-129	138.9	172.1	75.1	0	0	0	0	112.2	T601 D603	T601-S607 WeakPolarHBondContact CA-O 3.28Å; T601-S607 WeakPolarHBondContact CB-O 3.3Å; T601-S607 PolarHBondContact OG1-O 3.44Å; D603-S607 PolarHBondContact OD1-N 2.81Å; D603-S607 VanDerWaalsContact OD2-CB 3.29Å; D603-S607 WeakPolarHBondContact OD2-CB 3.44Å; D603-S607 PolarHBondContact OD2-N 2.87Å; D603-S607 PolarHBondContact OD2-OG 2.89Å
608	W	95.4	Very high	93.3	Very high	11 Å²	11	27.4 Å²	27.4	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	150.1	177.3	-67.1	86.6	0	0	0	110.4	L534 P537 L555 L557 I581 F599 I600 T601 G605	L534-W608 HydrophobicContact CD1-CZ2 4.49Å; L534-W608 HydrophobicContact CD2-CZ2 4.12Å; P537-W608 WeakPolarHBondContact CA-O 3.32Å; P537-W608 WeakPolarHBondContact CB-O 3.16Å; L555-W608 HydrophobicContact CD2-CB 3.88Å; L555-W608 HydrophobicContact CD2-CD2 3.46Å; L555-W608 VanDerWaalsContact CD2-CD2 3.46Å; L555-W608 HydrophobicContact CD2-CE3 3.81Å; L555-W608 HydrophobicContact CD2-CG 3.48Å; L555-W608 VanDerWaalsContact CD2-CG 3.48Å; L557-W608 HydrophobicContact CD1-CH2 3.74Å; L557-W608 HydrophobicContact CD1-CZ2 4.19Å; L557-W608 HydrophobicContact CD1-CZ3 4.24Å; I581-W608 HydrophobicContact CB-CH2 4.18Å; I581-W608 HydrophobicContact CG2-CH2 4.34Å; F599-W608 HydrophobicContact CB-CE3 3.89Å; F599-W608 HydrophobicContact CB-CZ3 4.37Å; I600-W608 CarbonylContact O-C 3.53Å; I600-W608 WeakPolarHBondContact O-CA 3.49Å; T601-W608 HydrophobicContact CG2-CD2 4.26Å; T601-W608 HydrophobicContact CG2-CE3 4.12Å; T601-W608 HydrophobicContact CG2-CH2 3.64Å; T601-W608 HydrophobicContact CG2-CZ2 3.76Å; T601-W608 HydrophobicContact CG2-CZ3 3.82Å; G605-W608 PolarHBondContact O-NE1 2.9Å
609	R	94.9	Very high	93	Very high	61 Å²	61	28.8 Å²	28.8	23%	0.23	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.7	172.5	-60.9	-177.4	-68.1	-80.3	8	108.3	F599 I600 S602 E646	F599-R609 CarbonylContact C-O 3.54Å; F599-R609 VanDerWaalsContact CA-O 3.25Å; F599-R609 WeakPolarHBondContact CA-O 3.48Å; I600-R609 HydrophobicContact CG2-CB 4.06Å; I600-R609 PolarHBondContact N-O 2.99Å; I600-R609 PolarHBondContact O-N 3.13Å; S602-R609 PolarHBondContact OG-NH1 3.28Å; S602-R609 PolarHBondContact OG-NH2 3.42Å; S602-R609 VanDerWaalsContact OG-NH2 3.16Å; R609-E646 PolarHBondContact NH2-O 3.23Å
610	Q	94.5	Very high	92.6	Very high	31 Å²	31	29.6 Å²	29.6	15%	0.145	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	142.4	165	-161.2	-178.1	-10.5	0	0	109	V541 M598 F599 F612 D613	V541-Q610 HydrophobicContact CG2-CB 4.05Å; V541-Q610 HydrophobicContact CG2-CG 3.63Å; M598-Q610 WeakPolarHBondContact O-CA 3.44Å; M598-Q610 WeakPolarHBondContact O-CG 3.43Å; F599-Q610 HydrophobicContact CD1-CB 3.84Å; F599-Q610 HydrophobicContact CD1-CG 3.95Å; F599-Q610 HydrophobicContact CE1-CB 3.64Å; F599-Q610 HydrophobicContact CE1-CG 3.49Å; F599-Q610 VanDerWaalsContact CE1-CG 3.49Å; F599-Q610 HydrophobicContact CZ-CG 3.98Å; Q610-F612 PolarHBondContact NE2-O 2.64Å; Q610-D613 PolarHBondContact NE2-OD1 2.81Å
611	I	94.9	Very high	92.1	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.062	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	-28.8	-179.2	45.5	166.9	0	0	0	113.8	V582 M598 I600 G647 W650	V582-I611 HydrophobicContact CG1-CD1 3.88Å; M598-I611 HydrophobicContact CB-CD1 4.24Å; M598-I611 HydrophobicContact CB-CG1 3.93Å; M598-I611 HydrophobicContact CE-CD1 4.02Å; M598-I611 VanDerWaalsContact O-CG1 3.29Å; M598-I611 WeakPolarHBondContact O-CG1 3.19Å; M598-I611 PolarHBondContact O-N 3.38Å; I600-I611 HydrophobicContact CB-CD1 4.29Å; I600-I611 HydrophobicContact CB-CG2 4.46Å; I600-I611 HydrophobicContact CG2-CG2 3.56Å; I611-G647 VanDerWaalsContact CG2-O 3.23Å; I611-G647 WeakPolarHBondContact CG2-O 3.05Å; I611-W650 HydrophobicContact CD1-CZ2 3.86Å
612	F	93.6	Very high	91.5	Very high	18 Å²	18	30.5 Å²	30.5	8%	0.079	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	154.9	176.6	-62.7	-84.4	0	0	0	110.6	G597 M598 Q610 Y616 A629 W641 W650	G597-F612 WeakPolarHBondContact CA-O 3.36Å; M598-F612 HydrophobicContact CB-CB 4.37Å; M598-F612 HydrophobicContact CE-CD2 3.51Å; M598-F612 HydrophobicContact CE-CE2 4.11Å; M598-F612 HydrophobicContact CE-CG 4.36Å; M598-F612 PolarHBondContact N-O 3.12Å; Q610-F612 PolarHBondContact NE2-O 2.64Å; F612-Y616 HydrophobicContact CB-CD2 3.89Å; F612-Y616 HydrophobicContact CB-CE2 3.87Å; F612-Y616 AromaticContact CD1-CD2 3.91Å; F612-Y616 HydrophobicContact CD1-CD2 3.91Å; F612-Y616 HydrophobicContact CD1-CE1 4.4Å; F612-Y616 AromaticContact CD1-CE2 3.49Å; F612-Y616 HydrophobicContact CD1-CE2 3.49Å; F612-Y616 VanDerWaalsContact CD1-CE2 3.49Å; F612-Y616 AromaticContact CD1-CZ 3.81Å; F612-Y616 HydrophobicContact CD2-CD2 4.15Å; F612-Y616 HydrophobicContact CE1-CD2 4.48Å; F612-Y616 HydrophobicContact CE1-CE1 4.26Å; F612-Y616 HydrophobicContact CE1-CE2 4.16Å; F612-Y616 AromaticContact CG-CD2 3.72Å; F612-Y616 HydrophobicContact CG-CD2 3.72Å; F612-Y616 AromaticContact CG-CE2 3.73Å; F612-Y616 HydrophobicContact CG-CE2 3.73Å; F612-Y616 HydrophobicContact CG-CG 4.45Å; F612-A629 HydrophobicContact CE2-CB 3.99Å; F612-A629 HydrophobicContact CZ-CB 4.05Å; F612-W641 AromaticContact CE1-CD1 3.92Å; F612-W641 HydrophobicContact CE1-CD2 4.2Å; F612-W641 HydrophobicContact CE1-CG 4.07Å; F612-W641 AromaticContact CE1-NE1 3.96Å; F612-W641 HydrophobicContact CZ-CB 4.19Å; F612-W641 HydrophobicContact CZ-CG 4.09Å; F612-W650 AromaticContact CE2-CD2 3.95Å; F612-W650 HydrophobicContact CE2-CD2 3.95Å; F612-W650 AromaticContact CE2-CE2 3.73Å; F612-W650 HydrophobicContact CE2-CE3 4.31Å; F612-W650 HydrophobicContact CE2-CG 4.43Å; F612-W650 HydrophobicContact CE2-CH2 4.27Å; F612-W650 AromaticContact CE2-CZ2 3.91Å; F612-W650 HydrophobicContact CE2-CZ2 3.91Å; F612-W650 HydrophobicContact CE2-CZ3 4.46Å; F612-W650 HydrophobicContact CZ-CB 4.49Å; F612-W650 AromaticContact CZ-CD2 3.73Å; F612-W650 HydrophobicContact CZ-CD2 3.73Å; F612-W650 HydrophobicContact CZ-CE3 4.03Å; F612-W650 AromaticContact CZ-CG 3.95Å; F612-W650 HydrophobicContact CZ-CG 3.95Å
613	D	91.4	Very high	90.8	Very high	101 Å²	101	32 Å²	32	54%	0.54	16%	0.158	S	C	.	.	S	Bend	trans	-98.1	4.4	173.4	-60	-62.3	0	0	0	112.8	Q610	Q610-D613 PolarHBondContact NE2-OD1 2.81Å
614	E	88.6	Confident	90.1	Very high	107 Å²	107	31.7 Å²	31.7	50%	0.5	16%	0.162	S	C	.	.	S	Bend	trans	-130.8	165	175.3	-58.6	178	135.6	0	0	109.6	Y616 L631	E614-Y616 HydrophobicContact CB-CE2 3.99Å; E614-Y616 WeakPolarHBondContact O-CD2 3.34Å; E614-L631 HydrophobicContact CB-CD1 3.97Å; E614-L631 VanDerWaalsContact OE2-CD1 3.3Å; E614-L631 WeakPolarHBondContact OE2-CD1 3.2Å
615	E	89.1	Confident	89.5	Confident	45 Å²	45	31.8 Å²	31.8	21%	0.21	16%	0.162	C	C	.	.			trans	-75.4	129.8	173.9	-63.4	-164	169.9	0	0	111.9	T584 L596 R632	T584-E615 HydrophobicContact CG2-CG 3.82Å; L596-E615 HydrophobicContact CD1-CG 4.46Å; E615-R632 HydrophobicContact CB-CB 4.07Å; E615-R632 WeakPolarHBondContact O-CB 3.36Å; E615-R632 PolarHBondContact O-N 2.87Å; E615-R632 IonicContact OE1-NH1 2.74Å; E615-R632 WeakPolarHBondContact OE2-CD 3.31Å; E615-R632 IonicContact OE2-CZ 2.9Å; E615-R632 IonicContact OE2-NE 2.71Å; E615-R632 IonicContact OE2-NH1 2.69Å; E615-R632 PolarHBondContact OE2-NH1 2.9Å
616	Y	90.9	Very high	89.3	Confident	28 Å²	28	31.8 Å²	31.8	11%	0.11	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	146.4	168.4	-67	-115.5	0	0	0	109.3	M598 F612 E614 A629 V630 L631 W641	M598-Y616 HydrophobicContact CE-CD2 4.32Å; M598-Y616 HydrophobicContact CE-CG 4.31Å; M598-Y616 PolarHBondContact SD-N 2.94Å; M598-Y616 VanDerWaalsContact SD-N 3.44Å; F612-Y616 HydrophobicContact CB-CD2 3.89Å; F612-Y616 HydrophobicContact CB-CE2 3.87Å; F612-Y616 AromaticContact CD1-CD2 3.91Å; F612-Y616 HydrophobicContact CD1-CD2 3.91Å; F612-Y616 HydrophobicContact CD1-CE1 4.4Å; F612-Y616 AromaticContact CD1-CE2 3.49Å; F612-Y616 HydrophobicContact CD1-CE2 3.49Å; F612-Y616 VanDerWaalsContact CD1-CE2 3.49Å; F612-Y616 AromaticContact CD1-CZ 3.81Å; F612-Y616 HydrophobicContact CD2-CD2 4.15Å; F612-Y616 HydrophobicContact CE1-CD2 4.48Å; F612-Y616 HydrophobicContact CE1-CE1 4.26Å; F612-Y616 HydrophobicContact CE1-CE2 4.16Å; F612-Y616 AromaticContact CG-CD2 3.72Å; F612-Y616 HydrophobicContact CG-CD2 3.72Å; F612-Y616 AromaticContact CG-CE2 3.73Å; F612-Y616 HydrophobicContact CG-CE2 3.73Å; F612-Y616 HydrophobicContact CG-CG 4.45Å; E614-Y616 HydrophobicContact CB-CE2 3.99Å; E614-Y616 WeakPolarHBondContact O-CD2 3.34Å; Y616-A629 HydrophobicContact CD1-CB 4.09Å; Y616-A629 HydrophobicContact CG-CB 4.37Å; Y616-V630 CarbonylContact C-O 3.54Å; Y616-V630 VanDerWaalsContact CA-O 3.31Å; Y616-V630 WeakPolarHBondContact CA-O 3.36Å; Y616-V630 VanDerWaalsContact CD1-C 3.4Å; Y616-L631 VanDerWaalsContact CD1-CA 3.45Å; Y616-L631 HydrophobicContact CD1-CB 4.05Å; Y616-L631 HydrophobicContact CD2-CD1 4.27Å; Y616-L631 HydrophobicContact CE1-CB 3.7Å; Y616-L631 HydrophobicContact CE1-CD1 4.15Å; Y616-L631 HydrophobicContact CE2-CD1 3.77Å; Y616-W641 AromaticContact CE1-CD1 3.43Å; Y616-W641 VanDerWaalsContact CE1-CD1 3.43Å; Y616-W641 AromaticContact CE1-NE1 3.41Å; Y616-W641 AromaticContact CZ-NE1 3.84Å
617	N	89.8	Confident	89.2	Confident	16 Å²	16	30.3 Å²	30.3	9%	0.086	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	142.1	162.8	-65.5	-84.3	0	0	0	109.7	S568 W619 A629 V630	S568-N617 PolarHBondContact N-OD1 2.98Å; S568-N617 PolarHBondContact O-OD1 2.75Å; S568-N617 WeakPolarHBondContact OG-CA 3.46Å; S568-N617 WeakPolarHBondContact OG-CB 3.39Å; S568-N617 PolarHBondContact OG-OD1 2.88Å; N617-W619 HydrophobicContact CB-CE3 4.36Å; N617-W619 HydrophobicContact CB-CH2 3.17Å; N617-W619 HydrophobicContact CB-CZ2 3.85Å; N617-W619 HydrophobicContact CB-CZ3 3.45Å; N617-W619 VanDerWaalsContact CB-CZ3 3.45Å; N617-W619 WeakPolarHBondContact O-CZ3 3.46Å; N617-A629 VanDerWaalsContact O-CA 3.31Å; N617-A629 WeakPolarHBondContact O-CA 3.38Å; N617-V630 PolarHBondContact N-O 3.32Å; N617-V630 PolarHBondContact O-N 3.07Å
618	I	90.8	Very high	89.1	Confident	8 Å²	8	28 Å²	28	4%	0.041	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.4	-174.6	-67.4	-71.6	0	0	0	111.5	S568 V582 M598 F620 L628 A629 W650	S568-I618 WeakPolarHBondContact CB-O 3.49Å; S568-I618 PolarHBondContact OG-N 2.95Å; V582-I618 HydrophobicContact CB-CG2 4.32Å; V582-I618 HydrophobicContact CG1-CD1 4.45Å; V582-I618 HydrophobicContact CG1-CG1 4Å; V582-I618 HydrophobicContact CG1-CG2 4.48Å; V582-I618 HydrophobicContact CG2-CG2 4.23Å; M598-I618 HydrophobicContact CE-CD1 3.87Å; M598-I618 HydrophobicContact CE-CG1 3.89Å; M598-I618 HydrophobicContact SD-CG1 4.37Å; I618-F620 HydrophobicContact CG2-CE2 4.37Å; I618-L628 WeakPolarHBondContact CA-O 3.46Å; I618-A629 HydrophobicContact CD1-CB 3.51Å; I618-W650 HydrophobicContact CD1-CH2 4.07Å
619	W	88.9	Confident	89	Confident	31 Å²	31	27.5 Å²	27.5	12%	0.117	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148	170.4	-56.9	-101.2	0	0	0	111.8	N617 L621 L628 V630 V665 M667	N617-W619 HydrophobicContact CB-CE3 4.36Å; N617-W619 HydrophobicContact CB-CH2 3.17Å; N617-W619 HydrophobicContact CB-CZ2 3.85Å; N617-W619 HydrophobicContact CB-CZ3 3.45Å; N617-W619 VanDerWaalsContact CB-CZ3 3.45Å; N617-W619 WeakPolarHBondContact O-CZ3 3.46Å; W619-L621 HydrophobicContact CB-CD2 4.47Å; W619-L628 HydrophobicContact CE3-CD2 4.08Å; W619-L628 HydrophobicContact CE3-CG 4.05Å; W619-L628 PolarHBondContact N-O 3.43Å; W619-L628 PolarHBondContact O-N 2.82Å; W619-V630 HydrophobicContact CE3-CG2 4.38Å; W619-V630 HydrophobicContact CH2-CB 4.18Å; W619-V630 HydrophobicContact CH2-CG2 4.21Å; W619-V630 HydrophobicContact CZ3-CB 3.74Å; W619-V630 HydrophobicContact CZ3-CG2 3.52Å; W619-V665 HydrophobicContact CH2-CB 4.05Å; W619-V665 HydrophobicContact CH2-CG2 3.49Å; W619-V665 VanDerWaalsContact CH2-CG2 3.49Å; W619-V665 HydrophobicContact CZ2-CB 3.45Å; W619-V665 VanDerWaalsContact CZ2-CB 3.45Å; W619-V665 HydrophobicContact CZ2-CG1 4.19Å; W619-V665 HydrophobicContact CZ2-CG2 3.43Å; W619-V665 VanDerWaalsContact CZ2-CG2 3.43Å; W619-V665 HydrophobicContact CZ3-CG2 4.35Å; W619-M667 HydrophobicContact CB-CE 3.73Å; W619-M667 HydrophobicContact CG-CE 4.22Å
620	F	87.6	Confident	88.8	Confident	22 Å²	22	24.7 Å²	24.7	10%	0.096	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.8	178.1	-64.8	-101.8	0	0	0	109.2	K574 V577 I580 V582 I618 L627	K574-F620 HydrophobicContact CG-CD2 3.88Å; K574-F620 HydrophobicContact CG-CE2 4.2Å; K574-F620 HydrophobicContact CG-CG 4.28Å; V577-F620 HydrophobicContact CB-CD1 4.27Å; V577-F620 HydrophobicContact CB-CE1 4.34Å; V577-F620 HydrophobicContact CG2-CD1 3.73Å; V577-F620 HydrophobicContact CG2-CE1 4.27Å; V577-F620 HydrophobicContact CG2-CG 4.39Å; I580-F620 HydrophobicContact CB-CE1 4.34Å; I580-F620 HydrophobicContact CG2-CE1 3.89Å; I580-F620 HydrophobicContact CG2-CZ 4.36Å; V582-F620 HydrophobicContact CG2-CZ 4.23Å; I618-F620 HydrophobicContact CG2-CE2 4.37Å; F620-L627 HydrophobicContact CD1-CD2 3.42Å; F620-L627 VanDerWaalsContact CD1-CD2 3.42Å; F620-L627 HydrophobicContact CE1-CD2 3.6Å; F620-L627 HydrophobicContact CG-CD2 4.1Å; F620-L627 HydrophobicContact CZ-CD2 4.38Å
621	L	86.6	Confident	88.5	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	151.5	178.7	-40.9	-166.8	0	0	0	110	W619 N623 G624 G625 A626 L628 M667 I676 Y695 L698	W619-L621 HydrophobicContact CB-CD2 4.47Å; L621-N623 PolarHBondContact O-N 3.41Å; L621-G624 CarbonylContact O-C 3.54Å; L621-G624 WeakPolarHBondContact O-CA 3.26Å; L621-G624 PolarHBondContact O-N 2.84Å; L621-G625 PolarHBondContact O-N 2.99Å; L621-A626 HydrophobicContact CB-CB 4.03Å; L621-A626 HydrophobicContact CD1-CB 4.11Å; L621-A626 HydrophobicContact CG-CB 4.12Å; L621-A626 PolarHBondContact N-O 2.9Å; L621-A626 PolarHBondContact O-N 2.78Å; L621-A626 VanDerWaalsContact O-N 3.14Å; L621-L628 HydrophobicContact CD1-CB 4.34Å; L621-L628 HydrophobicContact CD2-CB 3.98Å; L621-L628 HydrophobicContact CD2-CD2 4.41Å; L621-L628 HydrophobicContact CG-CB 4.27Å; L621-M667 HydrophobicContact CD2-CE 3.37Å; L621-I676 HydrophobicContact CD1-CD1 4.09Å; L621-I676 HydrophobicContact CD2-CD1 3.52Å; L621-I676 HydrophobicContact CG-CD1 4.48Å; L621-Y695 HydrophobicContact CB-CD2 4.15Å; L621-Y695 HydrophobicContact CB-CE2 3.72Å; L621-Y695 HydrophobicContact CD1-CD1 4.38Å; L621-Y695 HydrophobicContact CD1-CD2 3.92Å; L621-Y695 HydrophobicContact CD1-CE2 4.29Å; L621-Y695 HydrophobicContact CD1-CG 3.97Å; L621-L698 HydrophobicContact CD1-CD1 3.99Å
622	D	81.6	Confident	88	Confident	18 Å²	18	30 Å²	30	10%	0.096	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	38	61.4	179.6	178	38.8	0	0	0	113.5	G624 G625 F699 M738 L739	D622-G624 PolarHBondContact O-N 3.39Å; D622-G625 WeakPolarHBondContact O-CA 3.39Å; D622-G625 PolarHBondContact O-N 2.84Å; D622-F699 HydrophobicContact CB-CD2 4.27Å; D622-F699 HydrophobicContact CB-CE2 3.51Å; D622-F699 HydrophobicContact CB-CZ 3.94Å; D622-M738 VanDerWaalsContact OD2-CA 3.28Å; D622-M738 WeakPolarHBondContact OD2-CA 3.34Å; D622-L739 PolarHBondContact OD2-N 2.54Å
623	N	78.8	Confident	87.1	Confident	48 Å²	48	31.3 Å²	31.3	26%	0.257	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	50.6	35.5	179.3	-68.1	-79.2	0	0	0	114.6	S576 V577 L621 L739	S576-N623 VanDerWaalsContact CB-OD1 3.31Å; S576-N623 WeakPolarHBondContact CB-OD1 3.48Å; V577-N623 WeakPolarHBondContact CG2-O 3.4Å; L621-N623 PolarHBondContact O-N 3.41Å; N623-L739 HydrophobicContact CB-CD1 3.88Å
624	G	78.8	Confident	86.2	Confident	22 Å²	22	30.7 Å²	30.7	23%	0.227	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	95.3	3.8	-176.1	0	0	0	0	0	114.7	L621 D622 A626	L621-G624 CarbonylContact O-C 3.54Å; L621-G624 WeakPolarHBondContact O-CA 3.26Å; L621-G624 PolarHBondContact O-N 2.84Å; D622-G624 PolarHBondContact O-N 3.39Å; G624-A626 PolarHBondContact O-N 3.09Å
625	G	81.8	Confident	86	Confident	1 Å²	1	30 Å²	30	1%	0.01	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.6	172.8	0	0	0	0	0	114.6	L621 D622 F699 R731	L621-G625 PolarHBondContact O-N 2.99Å; D622-G625 WeakPolarHBondContact O-CA 3.39Å; D622-G625 PolarHBondContact O-N 2.84Å; G625-F699 VanDerWaalsContact O-CE1 3.27Å; G625-F699 WeakPolarHBondContact O-CE1 3.29Å; G625-R731 VanDerWaalsContact O-CZ 3.27Å; G625-R731 PolarHBondContact O-NH1 3.45Å; G625-R731 PolarHBondContact O-NH2 2.98Å
626	A	88.8	Confident	85.9	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	162.1	159	0	0	0	0	0	111.6	L621 G624 I642 S643 L644 L698 F699	L621-A626 HydrophobicContact CB-CB 4.03Å; L621-A626 HydrophobicContact CD1-CB 4.11Å; L621-A626 HydrophobicContact CG-CB 4.12Å; L621-A626 PolarHBondContact N-O 2.9Å; L621-A626 PolarHBondContact O-N 2.78Å; L621-A626 VanDerWaalsContact O-N 3.14Å; G624-A626 PolarHBondContact O-N 3.09Å; A626-I642 HydrophobicContact CB-CG2 4.2Å; A626-S643 CarbonylContact C-O 3.52Å; A626-S643 VanDerWaalsContact CA-O 3.3Å; A626-S643 WeakPolarHBondContact CA-O 3.3Å; A626-S643 WeakPolarHBondContact CB-O 3.4Å; A626-L644 HydrophobicContact CB-CD2 3.91Å; A626-L698 HydrophobicContact CB-CD1 4.35Å; A626-F699 HydrophobicContact CB-CE1 4.5Å; A626-F699 HydrophobicContact CB-CZ 4.06Å
627	L	91.9	Very high	85.9	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.016	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.7	165.9	-55.7	177.2	0	0	0	108.7	I600 F620 I642 S643 W650	I600-L627 HydrophobicContact CD1-CD1 3.59Å; F620-L627 HydrophobicContact CD1-CD2 3.42Å; F620-L627 VanDerWaalsContact CD1-CD2 3.42Å; F620-L627 HydrophobicContact CE1-CD2 3.6Å; F620-L627 HydrophobicContact CG-CD2 4.1Å; F620-L627 HydrophobicContact CZ-CD2 4.38Å; L627-I642 CarbonylContact O-C 3.56Å; L627-I642 WeakPolarHBondContact O-CA 3.33Å; L627-S643 PolarHBondContact N-O 2.85Å; L627-S643 PolarHBondContact O-N 2.81Å; L627-W650 HydrophobicContact CB-CH2 3.67Å; L627-W650 HydrophobicContact CB-CZ3 4.04Å; L627-W650 HydrophobicContact CD1-CH2 4.21Å; L627-W650 HydrophobicContact CD1-CZ2 4.41Å
628	L	92.1	Very high	85.8	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.8	172.3	168.1	63	0	0	0	108.9	I618 W619 L621 V630 L640 I642 I676 F678	I618-L628 WeakPolarHBondContact CA-O 3.46Å; W619-L628 HydrophobicContact CE3-CD2 4.08Å; W619-L628 HydrophobicContact CE3-CG 4.05Å; W619-L628 PolarHBondContact N-O 3.43Å; W619-L628 PolarHBondContact O-N 2.82Å; L621-L628 HydrophobicContact CD1-CB 4.34Å; L621-L628 HydrophobicContact CD2-CB 3.98Å; L621-L628 HydrophobicContact CD2-CD2 4.41Å; L621-L628 HydrophobicContact CG-CB 4.27Å; L628-V630 HydrophobicContact CD1-CG2 4.13Å; L628-V630 HydrophobicContact CG-CG2 4.24Å; L628-L640 HydrophobicContact CD1-CB 3.93Å; L628-L640 HydrophobicContact CD1-CD1 3.75Å; L628-L640 HydrophobicContact CD1-CD2 3.95Å; L628-L640 HydrophobicContact CD1-CG 4.09Å; L628-I642 HydrophobicContact CD1-CG1 4.29Å; L628-I676 HydrophobicContact CD2-CD1 3.61Å; L628-I676 HydrophobicContact CD2-CG2 4.48Å; L628-F678 HydrophobicContact CD2-CZ 4.26Å
629	A	92.8	Very high	85.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.4	174	0	0	0	0	0	112	F612 Y616 N617 I618 W641 W650	F612-A629 HydrophobicContact CE2-CB 3.99Å; F612-A629 HydrophobicContact CZ-CB 4.05Å; Y616-A629 HydrophobicContact CD1-CB 4.09Å; Y616-A629 HydrophobicContact CG-CB 4.37Å; N617-A629 VanDerWaalsContact O-CA 3.31Å; N617-A629 WeakPolarHBondContact O-CA 3.38Å; I618-A629 HydrophobicContact CD1-CB 3.51Å; A629-W641 HydrophobicContact CB-CB 4.26Å; A629-W641 PolarHBondContact N-O 2.89Å; A629-W641 PolarHBondContact O-N 2.77Å; A629-W650 HydrophobicContact CB-CE3 4.26Å; A629-W650 HydrophobicContact CB-CH2 4.07Å; A629-W650 HydrophobicContact CB-CZ3 3.65Å
630	V	90.9	Very high	86	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	125.5	-179.2	-178.7	0	0	0	0	109.5	Y616 N617 W619 L628 R632 I637 L640 F678	Y616-V630 CarbonylContact C-O 3.54Å; Y616-V630 VanDerWaalsContact CA-O 3.31Å; Y616-V630 WeakPolarHBondContact CA-O 3.36Å; Y616-V630 VanDerWaalsContact CD1-C 3.4Å; N617-V630 PolarHBondContact N-O 3.32Å; N617-V630 PolarHBondContact O-N 3.07Å; W619-V630 HydrophobicContact CE3-CG2 4.38Å; W619-V630 HydrophobicContact CH2-CB 4.18Å; W619-V630 HydrophobicContact CH2-CG2 4.21Å; W619-V630 HydrophobicContact CZ3-CB 3.74Å; W619-V630 HydrophobicContact CZ3-CG2 3.52Å; L628-V630 HydrophobicContact CD1-CG2 4.13Å; L628-V630 HydrophobicContact CG-CG2 4.24Å; V630-R632 PolarHBondContact O-N 3.35Å; V630-I637 HydrophobicContact CG1-CD1 3.38Å; V630-L640 HydrophobicContact CG2-CB 4.09Å; V630-F678 HydrophobicContact CB-CE1 4.4Å; V630-F678 HydrophobicContact CG1-CE1 3.98Å; V630-F678 HydrophobicContact CG2-CE1 3.59Å; V630-F678 HydrophobicContact CG2-CZ 3.65Å
631	L	89	Confident	86.2	Confident	36 Å²	36	42.4 Å²	42.4	19%	0.188	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	127.2	-172.8	179.5	67	0	0	0	111.7	E614 Y616 A633 I637	E614-L631 HydrophobicContact CB-CD1 3.97Å; E614-L631 VanDerWaalsContact OE2-CD1 3.3Å; E614-L631 WeakPolarHBondContact OE2-CD1 3.2Å; Y616-L631 VanDerWaalsContact CD1-CA 3.45Å; Y616-L631 HydrophobicContact CD1-CB 4.05Å; Y616-L631 HydrophobicContact CD2-CD1 4.27Å; Y616-L631 HydrophobicContact CE1-CB 3.7Å; Y616-L631 HydrophobicContact CE1-CD1 4.15Å; Y616-L631 HydrophobicContact CE2-CD1 3.77Å; L631-A633 HydrophobicContact CD2-CB 3.95Å; L631-A633 HydrophobicContact CG-CB 3.85Å; L631-A633 PolarHBondContact O-N 2.87Å; L631-I637 HydrophobicContact CB-CG2 4.34Å; L631-I637 HydrophobicContact CD2-CG2 4.11Å
632	R	84.2	Confident	86.5	Confident	118 Å²	118	42.7 Å²	42.7	45%	0.445	22%	0.219	S	C	.	.			trans	-90.7	71.3	179.9	-169.9	-177.3	-177.4	-138.9	8.1	109.9	E615 V630	E615-R632 HydrophobicContact CB-CB 4.07Å; E615-R632 WeakPolarHBondContact O-CB 3.36Å; E615-R632 PolarHBondContact O-N 2.87Å; E615-R632 IonicContact OE1-NH1 2.74Å; E615-R632 WeakPolarHBondContact OE2-CD 3.31Å; E615-R632 IonicContact OE2-CZ 2.9Å; E615-R632 IonicContact OE2-NE 2.71Å; E615-R632 IonicContact OE2-NH1 2.69Å; E615-R632 PolarHBondContact OE2-NH1 2.9Å; V630-R632 PolarHBondContact O-N 3.35Å
633	A	73.8	Confident	87.1	Confident	46 Å²	46	41.9 Å²	41.9	38%	0.38	22%	0.215	S	C	.	.			trans	-130.7	151.5	-178.6	0	0	0	0	0	112.2	L631 V635	L631-A633 HydrophobicContact CD2-CB 3.95Å; L631-A633 HydrophobicContact CG-CB 3.85Å; L631-A633 PolarHBondContact O-N 2.87Å; A633-V635 HydrophobicContact CB-CG2 3.86Å; A633-V635 PolarHBondContact O-N 3.18Å
634	A	73.9	Confident	87.7	Confident	89 Å²	89	40.6 Å²	40.6	74%	0.736	21%	0.208	S	C	*	.	S	Bend	trans	-71.1	-5	175.1	0	0	0	0	0	113.8	H661	A634-H661 PolarHBondContact O-CE1 3.03Å; A634-H661 PolarHBondContact O-ND1 3.14Å; A634-H661 VanDerWaalsContact O-ND1 3.09Å
635	V	84.4	Confident	88.3	Confident	91 Å²	91	41.1 Å²	41.1	55%	0.552	21%	0.206	S	C	*	.	S	Bend	trans	-84.3	154.8	176	-58.8	0	0	0	0	111.3	A633	A633-V635 HydrophobicContact CB-CG2 3.86Å; A633-V635 PolarHBondContact O-N 3.18Å
636	R	86.6	Confident	88.7	Confident	149 Å²	149	42.3 Å²	42.3	56%	0.562	21%	0.211	S	C	*	.			trans	-73.6	131.9	177.5	-63.6	177.2	-65.9	-179.3	0.4	110.8	P659 L660 H661 F682	R636-P659 HydrophobicContact CB-CB 3.63Å; R636-L660 CarbonylContact C-O 3.48Å; R636-L660 WeakPolarHBondContact CA-O 3.49Å; R636-H661 HydrophobicContact CG-CB 4.13Å; R636-F682 WeakPolarHBondContact CD-O 3.41Å; R636-F682 PolarHBondContact NH1-O 3.21Å
637	I	89.9	Confident	88.9	Confident	19 Å²	19	42.4 Å²	42.4	10%	0.097	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-120.5	154.5	-175.1	53.9	163.4	0	0	0	111.6	V630 L631 F655 P659 L660 V662	V630-I637 HydrophobicContact CG1-CD1 3.38Å; L631-I637 HydrophobicContact CB-CG2 4.34Å; L631-I637 HydrophobicContact CD2-CG2 4.11Å; I637-F655 HydrophobicContact CD1-CE1 4.45Å; I637-F655 HydrophobicContact CD1-CZ 4.4Å; I637-F655 HydrophobicContact CG1-CZ 4.18Å; I637-F655 WeakPolarHBondContact O-CZ 3.39Å; I637-P659 CarbonylContact O-C 3.6Å; I637-P659 WeakPolarHBondContact O-CA 3.48Å; I637-L660 PolarHBondContact N-O 3.03Å; I637-L660 PolarHBondContact O-N 3.33Å; I637-V662 HydrophobicContact CD1-CB 4.46Å; I637-V662 HydrophobicContact CD1-CG2 3.91Å; I637-V662 HydrophobicContact CG1-CG2 3.97Å
638	R	89.2	Confident	88.8	Confident	118 Å²	118	48.1 Å²	48.1	45%	0.445	24%	0.237	S	C	.	.			trans	-134.2	-4	177.5	68.2	176.6	-178.2	-163.9	-3.1	113.9	S654 F655 P659	R638-S654 CarbonylContact O-C 3.54Å; R638-S654 WeakPolarHBondContact O-CA 3.35Å; R638-F655 WeakPolarHBondContact O-CD1 3.45Å; R638-F655 PolarHBondContact O-N 3.31Å; R638-P659 HydrophobicContact CB-CG 4.47Å
639	H	90.5	Very high	88.8	Confident	54 Å²	54	53.6 Å²	53.6	25%	0.25	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.8	-174.8	-59.2	-57.4	0	0	0	110.2	R652 H653 S654	H639-R652 HydrophobicContact CB-CG 4.18Å; H639-H653 CarbonylContact C-O 3.52Å; H639-H653 WeakPolarHBondContact CA-O 3.5Å; H639-S654 PolarHBondContact CE1-OG 3.4Å; H639-S654 PolarHBondContact ND1-OG 2.84Å
640	L	91.9	Very high	88.8	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	162.6	169.7	59.3	77.9	0	0	0	109	L190 L628 V630 I642 H653 F655 F678 I693	L190-L640 HydrophobicContact CD1-CD1 4.29Å; L628-L640 HydrophobicContact CD1-CB 3.93Å; L628-L640 HydrophobicContact CD1-CD1 3.75Å; L628-L640 HydrophobicContact CD1-CD2 3.95Å; L628-L640 HydrophobicContact CD1-CG 4.09Å; V630-L640 HydrophobicContact CG2-CB 4.09Å; L640-I642 HydrophobicContact CD1-CD1 3.86Å; L640-I642 HydrophobicContact CD1-CG1 3.65Å; L640-H653 HydrophobicContact CD1-CB 3.84Å; L640-H653 HydrophobicContact CG-CB 4.49Å; L640-H653 PolarHBondContact N-O 3.42Å; L640-H653 PolarHBondContact O-N 3.2Å; L640-F655 HydrophobicContact CB-CD1 4.16Å; L640-F655 HydrophobicContact CD2-CB 3.85Å; L640-F655 HydrophobicContact CD2-CD1 3.93Å; L640-F655 HydrophobicContact CD2-CG 4.25Å; L640-F655 HydrophobicContact CG-CB 4.5Å; L640-F655 HydrophobicContact CG-CD1 4.11Å; L640-F678 HydrophobicContact CD2-CE2 4.19Å; L640-F678 HydrophobicContact CD2-CZ 3.92Å; L640-I693 HydrophobicContact CD2-CD1 3.76Å
641	W	93.7	Very high	88.9	Confident	68 Å²	68	57.6 Å²	57.6	26%	0.258	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	142.4	176.7	-55.4	90.6	0	0	0	110.6	F612 Y616 A629 W650 D651 R652	F612-W641 AromaticContact CE1-CD1 3.92Å; F612-W641 HydrophobicContact CE1-CD2 4.2Å; F612-W641 HydrophobicContact CE1-CG 4.07Å; F612-W641 AromaticContact CE1-NE1 3.96Å; F612-W641 HydrophobicContact CZ-CB 4.19Å; F612-W641 HydrophobicContact CZ-CG 4.09Å; Y616-W641 AromaticContact CE1-CD1 3.43Å; Y616-W641 VanDerWaalsContact CE1-CD1 3.43Å; Y616-W641 AromaticContact CE1-NE1 3.41Å; Y616-W641 AromaticContact CZ-NE1 3.84Å; A629-W641 HydrophobicContact CB-CB 4.26Å; A629-W641 PolarHBondContact N-O 2.89Å; A629-W641 PolarHBondContact O-N 2.77Å; W641-W650 HydrophobicContact CB-CB 4.4Å; W641-W650 HydrophobicContact CB-CE3 3.84Å; W641-W650 HydrophobicContact CE3-CB 4Å; W641-D651 CarbonylContact C-O 3.53Å; W641-D651 WeakPolarHBondContact CA-O 3.39Å; W641-R652 HydrophobicContact CD2-CB 4.18Å; W641-R652 HydrophobicContact CD2-CG 4.22Å; W641-R652 HydrophobicContact CE3-CB 3.63Å; W641-R652 HydrophobicContact CE3-CG 4.15Å; W641-R652 HydrophobicContact CH2-CB 4.15Å; W641-R652 HydrophobicContact CH2-CG 4.29Å; W641-R652 HydrophobicContact CZ2-CG 4.33Å; W641-R652 HydrophobicContact CZ3-CB 3.63Å; W641-R652 HydrophobicContact CZ3-CG 4.2Å
642	I	93.1	Very high	89	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.036	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.2	177.3	-60	-173	0	0	0	109.9	L190 A626 L627 L628 L640 W650 D651 L698	L190-I642 HydrophobicContact CD1-CD1 3.72Å; L190-I642 HydrophobicContact CD2-CD1 4.21Å; L190-I642 HydrophobicContact CG-CD1 4.47Å; A626-I642 HydrophobicContact CB-CG2 4.2Å; L627-I642 CarbonylContact O-C 3.56Å; L627-I642 WeakPolarHBondContact O-CA 3.33Å; L628-I642 HydrophobicContact CD1-CG1 4.29Å; L640-I642 HydrophobicContact CD1-CD1 3.86Å; L640-I642 HydrophobicContact CD1-CG1 3.65Å; I642-W650 WeakPolarHBondContact O-CA 3.11Å; I642-D651 PolarHBondContact N-O 2.65Å; I642-D651 PolarHBondContact O-N 3.08Å; I642-L698 HydrophobicContact CD1-CD1 4.06Å; I642-L698 HydrophobicContact CD1-CD2 4.17Å; I642-L698 HydrophobicContact CG2-CD1 4.15Å
643	S	93.6	Very high	89.3	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.3	170.1	178.7	0	0	0	0	111	A626 L627 D645 G647 K649	A626-S643 CarbonylContact C-O 3.52Å; A626-S643 VanDerWaalsContact CA-O 3.3Å; A626-S643 WeakPolarHBondContact CA-O 3.3Å; A626-S643 WeakPolarHBondContact CB-O 3.4Å; L627-S643 PolarHBondContact N-O 2.85Å; L627-S643 PolarHBondContact O-N 2.81Å; S643-D645 PolarHBondContact OG-N 2.76Å; S643-D645 PolarHBondContact OG-OD1 3.09Å; S643-G647 VanDerWaalsContact OG-CA 3.25Å; S643-G647 WeakPolarHBondContact OG-CA 3.48Å; S643-G647 PolarHBondContact OG-N 2.95Å; S643-K649 WeakPolarHBondContact CA-O 3.2Å; S643-K649 WeakPolarHBondContact CB-O 3.47Å; S643-K649 PolarHBondContact OG-O 3.4Å
644	L	91.1	Very high	90.1	Very high	22 Å²	22	60.8 Å²	60.8	12%	0.115	29%	0.292	C	S	.	.	S	Bend	trans	-107.5	-0.7	178.6	-68.2	161.9	0	0	0	112.5	A626 F699 R731 G734 R736	A626-L644 HydrophobicContact CB-CD2 3.91Å; L644-F699 HydrophobicContact CD2-CD1 4.48Å; L644-F699 HydrophobicContact CD2-CE1 3.73Å; L644-R731 PolarHBondContact O-NH2 3.18Å; L644-G734 PolarHBondContact O-N 2.99Å; L644-R736 HydrophobicContact CD1-CG 4.08Å
645	D	90.8	Very high	90.8	Very high	33 Å²	33	56.8 Å²	56.8	18%	0.176	26%	0.258	C	S	.	.	S	Bend	trans	-129	27.6	-164.8	70.9	-2.8	0	0	0	114.7	S643 K648 K649 P733	S643-D645 PolarHBondContact OG-N 2.76Å; S643-D645 PolarHBondContact OG-OD1 3.09Å; D645-K648 WeakPolarHBondContact O-CD 3.43Å; D645-K648 WeakPolarHBondContact O-CE 3.3Å; D645-K648 WeakPolarHBondContact O-CG 3.48Å; D645-K648 PolarHBondContact OD1-N 3.08Å; D645-K649 PolarHBondContact OD1-N 3.19Å; D645-K649 WeakPolarHBondContact OD2-CB 3.29Å; D645-K649 PolarHBondContact OD2-N 2.86Å; D645-K649 VanDerWaalsContact OD2-N 3.12Å; D645-P733 HydrophobicContact CB-CB 4.01Å
646	E	91.5	Very high	90.8	Very high	26 Å²	26	53.1 Å²	53.1	12%	0.121	24%	0.236	C	C	.	.	S	Bend	trans	64.6	44.1	-176.5	-50.7	-175.7	-170	0	0	112.9	I580 S602 R609 K730 P733	I580-E646 HydrophobicContact CD1-CB 4.16Å; I580-E646 HydrophobicContact CD1-CG 3.79Å; S602-E646 WeakPolarHBondContact CB-OE2 3.27Å; R609-E646 PolarHBondContact NH2-O 3.23Å; E646-K730 WeakPolarHBondContact OE1-CE 3.45Å; E646-K730 IonicContact OE1-NZ 2.76Å; E646-K730 PolarHBondContact OE1-NZ 3.15Å; E646-K730 IonicContact OE2-NZ 2.75Å; E646-K730 PolarHBondContact OE2-NZ 3.16Å; E646-P733 HydrophobicContact CG-CG 4.22Å
647	G	91.6	Very high	90.7	Very high	3 Å²	3	58.1 Å²	58.1	3%	0.031	26%	0.255	C	S	.	.	S	Bend	trans	73.6	27.5	171.5	0	0	0	0	0	114.4	I611 S643 W650	I611-G647 VanDerWaalsContact CG2-O 3.23Å; I611-G647 WeakPolarHBondContact CG2-O 3.05Å; S643-G647 VanDerWaalsContact OG-CA 3.25Å; S643-G647 WeakPolarHBondContact OG-CA 3.48Å; S643-G647 PolarHBondContact OG-N 2.95Å; G647-W650 PolarHBondContact O-NE1 2.95Å
648	K	90.8	Very high	90.5	Very high	123 Å²	123	60.8 Å²	60.8	54%	0.535	27%	0.272	S	S	.	.	S	Bend	trans	-93.4	-38.6	177.7	-55.1	169.3	-169.8	170.1	0	111.3	D645	D645-K648 WeakPolarHBondContact O-CD 3.43Å; D645-K648 WeakPolarHBondContact O-CE 3.3Å; D645-K648 WeakPolarHBondContact O-CG 3.48Å; D645-K648 PolarHBondContact OD1-N 3.08Å
649	K	91.8	Very high	90.5	Very high	117 Å²	117	57.3 Å²	57.3	51%	0.509	27%	0.265	S	S	.	.			trans	-119	141.5	168.5	-164.8	-168.8	-177.8	-134.3	0	109.6	S643 D645 D651	S643-K649 WeakPolarHBondContact CA-O 3.2Å; S643-K649 WeakPolarHBondContact CB-O 3.47Å; S643-K649 PolarHBondContact OG-O 3.4Å; D645-K649 PolarHBondContact OD1-N 3.19Å; D645-K649 WeakPolarHBondContact OD2-CB 3.29Å; D645-K649 PolarHBondContact OD2-N 2.86Å; D645-K649 VanDerWaalsContact OD2-N 3.12Å; K649-D651 VanDerWaalsContact CE-OD1 3.3Å; K649-D651 WeakPolarHBondContact CE-OD1 3.06Å; K649-D651 IonicContact NZ-OD1 2.81Å; K649-D651 PolarHBondContact NZ-OD1 3.19Å; K649-D651 IonicContact NZ-OD2 2.66Å; K649-D651 PolarHBondContact NZ-OD2 3.05Å
650	W	93.1	Very high	90.4	Very high	37 Å²	37	54.7 Å²	54.7	14%	0.14	25%	0.253	C	S	.	.			trans	-124.7	117.9	175.4	-67.3	93.8	0	0	0	109.7	I611 F612 I618 L627 A629 W641 I642 G647	I611-W650 HydrophobicContact CD1-CZ2 3.86Å; F612-W650 AromaticContact CE2-CD2 3.95Å; F612-W650 HydrophobicContact CE2-CD2 3.95Å; F612-W650 AromaticContact CE2-CE2 3.73Å; F612-W650 HydrophobicContact CE2-CE3 4.31Å; F612-W650 HydrophobicContact CE2-CG 4.43Å; F612-W650 HydrophobicContact CE2-CH2 4.27Å; F612-W650 AromaticContact CE2-CZ2 3.91Å; F612-W650 HydrophobicContact CE2-CZ2 3.91Å; F612-W650 HydrophobicContact CE2-CZ3 4.46Å; F612-W650 HydrophobicContact CZ-CB 4.49Å; F612-W650 AromaticContact CZ-CD2 3.73Å; F612-W650 HydrophobicContact CZ-CD2 3.73Å; F612-W650 HydrophobicContact CZ-CE3 4.03Å; F612-W650 AromaticContact CZ-CG 3.95Å; F612-W650 HydrophobicContact CZ-CG 3.95Å; I618-W650 HydrophobicContact CD1-CH2 4.07Å; L627-W650 HydrophobicContact CB-CH2 3.67Å; L627-W650 HydrophobicContact CB-CZ3 4.04Å; L627-W650 HydrophobicContact CD1-CH2 4.21Å; L627-W650 HydrophobicContact CD1-CZ2 4.41Å; A629-W650 HydrophobicContact CB-CE3 4.26Å; A629-W650 HydrophobicContact CB-CH2 4.07Å; A629-W650 HydrophobicContact CB-CZ3 3.65Å; W641-W650 HydrophobicContact CB-CB 4.4Å; W641-W650 HydrophobicContact CB-CE3 3.84Å; W641-W650 HydrophobicContact CE3-CB 4Å; I642-W650 WeakPolarHBondContact O-CA 3.11Å; G647-W650 PolarHBondContact O-NE1 2.95Å
651	D	91.8	Very high	90.2	Very high	49 Å²	49	56.3 Å²	56.3	26%	0.262	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.7	177.4	-71.4	-44.4	0	0	0	110	W641 I642 K649	W641-D651 CarbonylContact C-O 3.53Å; W641-D651 WeakPolarHBondContact CA-O 3.39Å; I642-D651 PolarHBondContact N-O 2.65Å; I642-D651 PolarHBondContact O-N 3.08Å; K649-D651 VanDerWaalsContact CE-OD1 3.3Å; K649-D651 WeakPolarHBondContact CE-OD1 3.06Å; K649-D651 IonicContact NZ-OD1 2.81Å; K649-D651 PolarHBondContact NZ-OD1 3.19Å; K649-D651 IonicContact NZ-OD2 2.66Å; K649-D651 PolarHBondContact NZ-OD2 3.05Å
652	R	92.6	Very high	89.9	Confident	160 Å²	160	54.8 Å²	54.8	60%	0.604	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.8	-172.3	-169.5	-179.8	63.6	-170.2	-4.3	111.7	H639 W641	H639-R652 HydrophobicContact CB-CG 4.18Å; W641-R652 HydrophobicContact CD2-CB 4.18Å; W641-R652 HydrophobicContact CD2-CG 4.22Å; W641-R652 HydrophobicContact CE3-CB 3.63Å; W641-R652 HydrophobicContact CE3-CG 4.15Å; W641-R652 HydrophobicContact CH2-CB 4.15Å; W641-R652 HydrophobicContact CH2-CG 4.29Å; W641-R652 HydrophobicContact CZ2-CG 4.33Å; W641-R652 HydrophobicContact CZ3-CB 3.63Å; W641-R652 HydrophobicContact CZ3-CG 4.2Å
653	H	90.6	Very high	89.5	Confident	33 Å²	33	56.7 Å²	56.7	15%	0.153	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	156.7	177.2	-62.2	-92.6	0	0	0	111.6	P188 L190 H639 L640	P188-H653 PolarHBondContact O-CE1 3.49Å; L190-H653 HydrophobicContact CD1-CB 3.7Å; H639-H653 CarbonylContact C-O 3.52Å; H639-H653 WeakPolarHBondContact CA-O 3.5Å; L640-H653 HydrophobicContact CD1-CB 3.84Å; L640-H653 HydrophobicContact CG-CB 4.49Å; L640-H653 PolarHBondContact N-O 3.42Å; L640-H653 PolarHBondContact O-N 3.2Å
654	S	89.9	Confident	89.1	Confident	74 Å²	74	56.8 Å²	56.8	52%	0.517	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.1	172.7	-53.4	0	0	0	0	109.3	R638 H639	R638-S654 CarbonylContact O-C 3.54Å; R638-S654 WeakPolarHBondContact O-CA 3.35Å; H639-S654 PolarHBondContact CE1-OG 3.4Å; H639-S654 PolarHBondContact ND1-OG 2.84Å
655	F	87.7	Confident	88.9	Confident	5 Å²	5	56 Å²	56	2%	0.022	27%	0.266	C	S	.	.	S	Bend	trans	-95.3	-12.9	179.4	66.9	-99.1	0	0	0	113	P192 I637 R638 L640 L660 V662 I691 I693	P192-F655 WeakPolarHBondContact CB-O 3.38Å; I637-F655 HydrophobicContact CD1-CE1 4.45Å; I637-F655 HydrophobicContact CD1-CZ 4.4Å; I637-F655 HydrophobicContact CG1-CZ 4.18Å; I637-F655 WeakPolarHBondContact O-CZ 3.39Å; R638-F655 WeakPolarHBondContact O-CD1 3.45Å; R638-F655 PolarHBondContact O-N 3.31Å; L640-F655 HydrophobicContact CB-CD1 4.16Å; L640-F655 HydrophobicContact CD2-CB 3.85Å; L640-F655 HydrophobicContact CD2-CD1 3.93Å; L640-F655 HydrophobicContact CD2-CG 4.25Å; L640-F655 HydrophobicContact CG-CB 4.5Å; L640-F655 HydrophobicContact CG-CD1 4.11Å; F655-L660 HydrophobicContact CE2-CB 4.35Å; F655-L660 HydrophobicContact CE2-CD2 4.46Å; F655-V662 HydrophobicContact CZ-CG2 4.17Å; F655-I691 HydrophobicContact CD2-CD1 3.79Å; F655-I691 HydrophobicContact CD2-CG2 4.43Å; F655-I691 HydrophobicContact CE2-CD1 4.02Å; F655-I691 WeakPolarHBondContact O-CG2 3.43Å; F655-I693 HydrophobicContact CB-CD1 3.71Å
656	S	86.2	Confident	88.5	Confident	15 Å²	15	55.2 Å²	55.2	11%	0.105	26%	0.261	C	S	.	.			trans	-147	148.9	179.2	-176.1	0	0	0	0	111.2	V658	S656-V658 WeakPolarHBondContact CB-O 3.32Å; S656-V658 PolarHBondContact OG-N 2.97Å; S656-V658 VanDerWaalsContact OG-N 3.09Å; S656-V658 PolarHBondContact OG-O 2.87Å
657	W	83.8	Confident	87.9	Confident	253 Å²	253	56.1 Å²	56.1	96%	0.958	27%	0.266	S	S	*	.	S	Bend	trans	-74.1	-29.4	168.1	-59.4	103.1	0	0	0	112.1
658	V	86	Confident	86.9	Confident	75 Å²	75	56.3 Å²	56.3	46%	0.455	27%	0.266	S	S	.	.	S	Bend	trans	-113.9	128.9	-177.6	-178.9	0	0	0	0	109.7	S656 L660 F682	S656-V658 WeakPolarHBondContact CB-O 3.32Å; S656-V658 PolarHBondContact OG-N 2.97Å; S656-V658 VanDerWaalsContact OG-N 3.09Å; S656-V658 PolarHBondContact OG-O 2.87Å; V658-L660 PolarHBondContact O-N 3.22Å; V658-F682 HydrophobicContact CB-CD1 4.24Å; V658-F682 HydrophobicContact CB-CE1 3.8Å; V658-F682 HydrophobicContact CB-CZ 4.32Å; V658-F682 HydrophobicContact CG1-CD1 3.71Å; V658-F682 HydrophobicContact CG1-CE1 3.81Å; V658-F682 HydrophobicContact CG1-CG 4.35Å; V658-F682 HydrophobicContact CG1-CZ 4.5Å
659	P	88.1	Confident	85.4	Confident	45 Å²	45	54.5 Å²	54.5	29%	0.292	27%	0.267	S	S	.	.			trans	-57.2	127.3	176.8	-25.9	35.3	0	0	0	113.2	R636 I637 R638	R636-P659 HydrophobicContact CB-CB 3.63Å; I637-P659 CarbonylContact O-C 3.6Å; I637-P659 WeakPolarHBondContact O-CA 3.48Å; R638-P659 HydrophobicContact CB-CG 4.47Å
660	L	88.4	Confident	83.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-108.8	140	-178.3	-169.6	72.6	0	0	0	110	R636 I637 F655 V658 V662 H681 F682 Q689 I691	R636-L660 CarbonylContact C-O 3.48Å; R636-L660 WeakPolarHBondContact CA-O 3.49Å; I637-L660 PolarHBondContact N-O 3.03Å; I637-L660 PolarHBondContact O-N 3.33Å; F655-L660 HydrophobicContact CE2-CB 4.35Å; F655-L660 HydrophobicContact CE2-CD2 4.46Å; V658-L660 PolarHBondContact O-N 3.22Å; L660-V662 HydrophobicContact CD2-CG2 4.28Å; L660-H681 VanDerWaalsContact CD1-C 3.46Å; L660-F682 HydrophobicContact CD1-CD1 3.64Å; L660-F682 HydrophobicContact CD1-CE1 3.75Å; L660-F682 HydrophobicContact CD1-CG 4.35Å; L660-Q689 HydrophobicContact CD1-CB 3.74Å; L660-Q689 HydrophobicContact CD1-CG 3.91Å; L660-I691 HydrophobicContact CD2-CD1 3.95Å; L660-I691 HydrophobicContact CD2-CG1 4.42Å
661	H	88.6	Confident	82.1	Confident	37 Å²	37	54.3 Å²	54.3	17%	0.171	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	117.2	161.7	-167.9	93.8	0	0	0	107	A634 R636 D663 G680 H681	A634-H661 PolarHBondContact O-CE1 3.03Å; A634-H661 PolarHBondContact O-ND1 3.14Å; A634-H661 VanDerWaalsContact O-ND1 3.09Å; R636-H661 HydrophobicContact CG-CB 4.13Å; H661-D663 IonicContact CD2-OD1 3.58Å; H661-G680 CarbonylContact O-C 3.6Å; H661-G680 WeakPolarHBondContact O-CA 3.5Å; H661-H681 WeakPolarHBondContact CB-O 3.43Å; H661-H681 AromaticContact CD2-CE1 3.37Å; H661-H681 PolarHBondContact CD2-CE1 2.88Å; H661-H681 AromaticContact CD2-NE2 3.54Å; H661-H681 AromaticContact CG-CE1 3.89Å; H661-H681 AromaticContact CG-NE2 3.61Å; H661-H681 PolarHBondContact N-O 3.08Å; H661-H681 PolarHBondContact O-N 2.79Å
662	V	87.1	Confident	80.6	Confident	36 Å²	36	55.8 Å²	55.8	22%	0.218	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	108.3	-175	176.1	0	0	0	0	108.9	I637 F655 L660 V665 F678	I637-V662 HydrophobicContact CD1-CB 4.46Å; I637-V662 HydrophobicContact CD1-CG2 3.91Å; I637-V662 HydrophobicContact CG1-CG2 3.97Å; F655-V662 HydrophobicContact CZ-CG2 4.17Å; L660-V662 HydrophobicContact CD2-CG2 4.28Å; V662-V665 HydrophobicContact CG1-CG2 4.29Å; V662-F678 HydrophobicContact CG1-CD1 3.92Å; V662-F678 HydrophobicContact CG2-CD1 4.14Å
663	D	84.6	Confident	79.4	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.251	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-27	178.1	-63.4	-57.5	0	0	0	111.7	H661 F679 G680 H681 W688	H661-D663 IonicContact CD2-OD1 3.58Å; D663-F679 HydrophobicContact CB-CD2 4.08Å; D663-F679 HydrophobicContact CB-CE2 3.99Å; D663-F679 PolarHBondContact N-O 2.62Å; D663-G680 WeakPolarHBondContact OD2-CA 3.39Å; D663-H681 IonicContact OD1-CE1 3.85Å; D663-H681 PolarHBondContact OD1-CE1 2.86Å; D663-H681 VanDerWaalsContact OD1-CE1 3.23Å; D663-H681 IonicContact OD1-ND1 2.93Å; D663-H681 IonicContact OD2-CE1 2.66Å; D663-H681 PolarHBondContact OD2-CE1 3.48Å; D663-H681 VanDerWaalsContact OD2-CE1 3.31Å; D663-H681 IonicContact OD2-CG 3.3Å; D663-H681 IonicContact OD2-ND1 2.62Å; D663-H681 PolarHBondContact OD2-ND1 2.69Å; D663-W688 HydrophobicContact CB-CZ3 4.19Å; D663-W688 WeakPolarHBondContact OD2-CZ3 3.12Å
664	G	85.9	Confident	79	Confident	2 Å²	2	49 Å²	49	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	177.2	174.3	0	0	0	0	0	114.3	F679	G664-F679 VanDerWaalsContact C-CE1 3.49Å; G664-F679 PolarHBondContact N-O 2.95Å; G664-F679 WeakPolarHBondContact O-CD1 3.38Å; G664-F679 PolarHBondContact O-N 2.81Å
665	V	85.7	Confident	78.8	Confident	6 Å²	6	46.2 Å²	46.2	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	128.8	177.5	-179	0	0	0	0	110.1	Y566 W619 V662 I676 F678	Y566-V665 PolarHBondContact O-N 2.04Å; W619-V665 HydrophobicContact CH2-CB 4.05Å; W619-V665 HydrophobicContact CH2-CG2 3.49Å; W619-V665 VanDerWaalsContact CH2-CG2 3.49Å; W619-V665 HydrophobicContact CZ2-CB 3.45Å; W619-V665 VanDerWaalsContact CZ2-CB 3.45Å; W619-V665 HydrophobicContact CZ2-CG1 4.19Å; W619-V665 HydrophobicContact CZ2-CG2 3.43Å; W619-V665 VanDerWaalsContact CZ2-CG2 3.43Å; W619-V665 HydrophobicContact CZ3-CG2 4.35Å; V662-V665 HydrophobicContact CG1-CG2 4.29Å; V665-I676 HydrophobicContact CG1-CG2 3.33Å; V665-F678 HydrophobicContact CG2-CD1 3.67Å; V665-F678 HydrophobicContact CG2-CE1 3.72Å; V665-F678 HydrophobicContact CG2-CG 4.13Å; V665-F678 HydrophobicContact CG2-CZ 4.2Å
666	L	83.5	Confident	78.8	Confident	16 Å²	16	46.2 Å²	46.2	8%	0.084	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.4	171.9	-172.7	81.3	0	0	0	109.8	V208 W210 I218 T677	V208-L666 HydrophobicContact CB-CD1 4.5Å; V208-L666 HydrophobicContact CG1-CB 4.38Å; V208-L666 HydrophobicContact CG1-CD1 3.97Å; V208-L666 HydrophobicContact CG1-CD2 3.65Å; V208-L666 HydrophobicContact CG1-CG 4.2Å; W210-L666 HydrophobicContact CD2-CD2 4.5Å; W210-L666 HydrophobicContact CG-CD2 4.39Å; W210-L666 HydrophobicContact CZ2-CD2 4.42Å; W210-L666 VanDerWaalsContact NE1-CD2 3.26Å; I218-L666 HydrophobicContact CD1-CD2 4.38Å; I218-L666 HydrophobicContact CG2-CD2 4.2Å; L666-T677 PolarHBondContact N-O 3.36Å; L666-T677 PolarHBondContact O-N 2.93Å
667	M	78.6	Confident	78.9	Confident	45 Å²	45	45.5 Å²	45.5	22%	0.222	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	140.1	172.6	179.5	-176.6	-71.6	0	0	107.9	W619 L621 P669 I676	W619-M667 HydrophobicContact CB-CE 3.73Å; W619-M667 HydrophobicContact CG-CE 4.22Å; L621-M667 HydrophobicContact CD2-CE 3.37Å; M667-P669 VanDerWaalsContact O-CD 3.32Å; M667-P669 WeakPolarHBondContact O-CD 3.22Å; M667-I676 HydrophobicContact CE-CD1 3.78Å; M667-I676 HydrophobicContact CE-CG1 3.8Å
668	E	70.4	Confident	79.2	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.037	18%	0.184	C	C	.	.			trans	-78.9	113.2	174.8	-171.2	-175.2	161.8	0	0	109.7	W210 Q213 N214 E670 S671 N673	W210-E668 HydrophobicContact CD2-CB 4.35Å; W210-E668 HydrophobicContact CG-CB 4.42Å; W210-E668 HydrophobicContact CG-CG 4.5Å; Q213-E668 WeakPolarHBondContact CA-OE1 3.22Å; N214-E668 PolarHBondContact N-OE1 3Å; E668-E670 PolarHBondContact O-N 2.85Å; E668-S671 VanDerWaalsContact CD-OG 3.31Å; E668-S671 WeakPolarHBondContact CG-OG 3.32Å; E668-S671 PolarHBondContact O-OG 2.88Å; E668-S671 WeakPolarHBondContact OE1-CB 3.45Å; E668-N673 WeakPolarHBondContact OE2-CB 3.5Å; E668-N673 PolarHBondContact OE2-ND2 3.13Å
669	P	59.2	Low	79.3	Confident	84 Å²	84	30.4 Å²	30.4	55%	0.545	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	133.8	-174.5	29	-34.6	0	0	0	111.7	M667 S671	M667-P669 VanDerWaalsContact O-CD 3.32Å; M667-P669 WeakPolarHBondContact O-CD 3.22Å; P669-S671 VanDerWaalsContact C-N 3.26Å; P669-S671 PolarHBondContact O-N 2.82Å
670	E	58.2	Low	79.3	Confident	133 Å²	133	28.2 Å²	28.2	62%	0.621	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	30.8	170	-51.3	-171.2	148.6	0	0	114.6	E668	E668-E670 PolarHBondContact O-N 2.85Å
671	S	57.1	Low	79.2	Confident	18 Å²	18	29.1 Å²	29.1	13%	0.126	16%	0.155	C	C	.	.	S	Bend	trans	-105.5	166.8	176.2	71.5	0	0	0	0	112.9	E668 P669 N673	E668-S671 VanDerWaalsContact CD-OG 3.31Å; E668-S671 WeakPolarHBondContact CG-OG 3.32Å; E668-S671 PolarHBondContact O-OG 2.88Å; E668-S671 WeakPolarHBondContact OE1-CB 3.45Å; P669-S671 VanDerWaalsContact C-N 3.26Å; P669-S671 PolarHBondContact O-N 2.82Å; S671-N673 PolarHBondContact O-N 3.4Å; S671-N673 PolarHBondContact OG-N 3.32Å
672	D	60.2	Low	78.9	Confident	79 Å²	79	29.8 Å²	29.8	42%	0.422	16%	0.157	S	C	.	.	S	Bend	trans	-78.2	0.7	169.6	-86	22	0	0	0	112.4	H674 Q741	D672-H674 PolarHBondContact O-CE1 2.9Å; D672-H674 PolarHBondContact O-N 3.49Å; D672-H674 PolarHBondContact O-ND1 2.81Å; D672-Q741 PolarHBondContact OD1-NE2 3.49Å; D672-Q741 VanDerWaalsContact OD1-NE2 3.13Å
673	N	68.7	Low	78.4	Confident	27 Å²	27	32.1 Å²	32.1	14%	0.144	17%	0.168	C	C	.	.			trans	-84.2	109.9	-174.1	-72.1	-31.5	0	0	0	111.7	E668 S671 I675	E668-N673 WeakPolarHBondContact OE2-CB 3.5Å; E668-N673 PolarHBondContact OE2-ND2 3.13Å; S671-N673 PolarHBondContact O-N 3.4Å; S671-N673 PolarHBondContact OG-N 3.32Å; N673-I675 PolarHBondContact O-N 3.39Å
674	H	81.3	Confident	77.6	Confident	25 Å²	25	36.2 Å²	36.2	12%	0.116	19%	0.186	C	C	.	.			trans	-81	47.1	-176	-69.9	60.9	0	0	0	112.4	D672 D694 Y695 K696 F699	D672-H674 PolarHBondContact O-CE1 2.9Å; D672-H674 PolarHBondContact O-N 3.49Å; D672-H674 PolarHBondContact O-ND1 2.81Å; H674-D694 WeakPolarHBondContact O-CA 3.5Å; H674-Y695 VanDerWaalsContact CA-CE1 3.49Å; H674-Y695 HydrophobicContact CB-CD1 4.39Å; H674-Y695 HydrophobicContact CB-CD2 4.14Å; H674-Y695 HydrophobicContact CB-CE1 4.31Å; H674-Y695 HydrophobicContact CB-CE2 4.02Å; H674-Y695 HydrophobicContact CB-CG 4.33Å; H674-Y695 AromaticContact CD2-CD2 3.95Å; H674-Y695 AromaticContact CD2-CE2 3.65Å; H674-Y695 WeakPolarHBondContact O-CD1 3.04Å; H674-Y695 PolarHBondContact O-N 2.92Å; H674-K696 HydrophobicContact CB-CB 3.79Å; H674-K696 HydrophobicContact CB-CG 4.46Å; H674-F699 AromaticContact CD2-CD2 3.96Å; H674-F699 AromaticContact NE2-CD2 3.97Å
675	I	85.1	Confident	76.8	Confident	14 Å²	14	45.4 Å²	45.4	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.7	-169.7	-58.8	177.1	0	0	0	110.7	Y243 N673 K692 I693 Y695	Y243-I675 VanDerWaalsContact CB-CD1 3.44Å; Y243-I675 HydrophobicContact CD1-CD1 3.83Å; Y243-I675 HydrophobicContact CD2-CD1 4.29Å; Y243-I675 HydrophobicContact CG-CD1 3.62Å; N673-I675 PolarHBondContact O-N 3.39Å; I675-K692 HydrophobicContact CG2-CG 3.78Å; I675-I693 WeakPolarHBondContact CA-O 3.28Å; I675-Y695 VanDerWaalsContact N-CE1 3.33Å
676	I	88.2	Confident	76.2	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.6	175.2	-57.6	172.1	0	0	0	107.9	L621 L628 V665 M667 F678 K692 I693 Y695	L621-I676 HydrophobicContact CD1-CD1 4.09Å; L621-I676 HydrophobicContact CD2-CD1 3.52Å; L621-I676 HydrophobicContact CG-CD1 4.48Å; L628-I676 HydrophobicContact CD2-CD1 3.61Å; L628-I676 HydrophobicContact CD2-CG2 4.48Å; V665-I676 HydrophobicContact CG1-CG2 3.33Å; M667-I676 HydrophobicContact CE-CD1 3.78Å; M667-I676 HydrophobicContact CE-CG1 3.8Å; I676-F678 HydrophobicContact CG2-CD2 4.04Å; I676-F678 HydrophobicContact CG2-CE2 3.74Å; I676-K692 CarbonylContact O-C 3.32Å; I676-K692 WeakPolarHBondContact O-CA 3.35Å; I676-I693 PolarHBondContact N-O 2.78Å; I676-I693 PolarHBondContact O-N 2.6Å; I676-Y695 HydrophobicContact CD1-CD1 3.68Å; I676-Y695 HydrophobicContact CD1-CE1 3.93Å; I676-Y695 HydrophobicContact CG1-CD1 3.63Å; I676-Y695 HydrophobicContact CG1-CE1 3.66Å
677	T	88.3	Confident	76.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	106.3	178.1	-55.2	0	0	0	0	109.7	L666 L690 I691	L666-T677 PolarHBondContact N-O 3.36Å; L666-T677 PolarHBondContact O-N 2.93Å; T677-L690 HydrophobicContact CG2-CB 4.12Å; T677-L690 HydrophobicContact CG2-CD2 3.84Å; T677-I691 WeakPolarHBondContact CA-O 3.46Å
678	F	89.4	Confident	76.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	139.5	167	-71.3	-109.3	0	0	0	108.7	L628 V630 L640 V662 V665 I676 L690 I691 I693	L628-F678 HydrophobicContact CD2-CZ 4.26Å; V630-F678 HydrophobicContact CB-CE1 4.4Å; V630-F678 HydrophobicContact CG1-CE1 3.98Å; V630-F678 HydrophobicContact CG2-CE1 3.59Å; V630-F678 HydrophobicContact CG2-CZ 3.65Å; L640-F678 HydrophobicContact CD2-CE2 4.19Å; L640-F678 HydrophobicContact CD2-CZ 3.92Å; V662-F678 HydrophobicContact CG1-CD1 3.92Å; V662-F678 HydrophobicContact CG2-CD1 4.14Å; V665-F678 HydrophobicContact CG2-CD1 3.67Å; V665-F678 HydrophobicContact CG2-CE1 3.72Å; V665-F678 HydrophobicContact CG2-CG 4.13Å; V665-F678 HydrophobicContact CG2-CZ 4.2Å; I676-F678 HydrophobicContact CG2-CD2 4.04Å; I676-F678 HydrophobicContact CG2-CE2 3.74Å; F678-L690 CarbonylContact O-C 3.15Å; F678-L690 VanDerWaalsContact O-CA 3.32Å; F678-L690 WeakPolarHBondContact O-CA 3.49Å; F678-I691 HydrophobicContact CB-CB 4.29Å; F678-I691 PolarHBondContact N-O 2.03Å; F678-I691 PolarHBondContact O-N 3.3Å; F678-I693 HydrophobicContact CD2-CD1 3.84Å; F678-I693 HydrophobicContact CD2-CG1 4.37Å; F678-I693 HydrophobicContact CE2-CD1 3.58Å; F678-I693 HydrophobicContact CE2-CG1 4.47Å
679	F	88.7	Confident	77.5	Confident	11 Å²	11	48.1 Å²	48.1	5%	0.048	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.6	168.7	63.3	-91.8	0	0	0	110.5	V208 Y566 D663 G664 W688 Q689 L690	V208-F679 HydrophobicContact CG2-CD1 4.3Å; V208-F679 HydrophobicContact CG2-CE1 4.39Å; V208-F679 HydrophobicContact CG2-CG 4.43Å; Y566-F679 AromaticContact CD1-CE1 3.78Å; Y566-F679 HydrophobicContact CD1-CE1 3.78Å; Y566-F679 AromaticContact CD1-CZ 3.79Å; Y566-F679 HydrophobicContact CD1-CZ 3.79Å; Y566-F679 HydrophobicContact CD2-CZ 4.04Å; Y566-F679 HydrophobicContact CE1-CE1 4.37Å; Y566-F679 HydrophobicContact CE1-CZ 4.34Å; Y566-F679 HydrophobicContact CG-CE1 4.02Å; Y566-F679 AromaticContact CG-CZ 3.6Å; Y566-F679 HydrophobicContact CG-CZ 3.6Å; D663-F679 HydrophobicContact CB-CD2 4.08Å; D663-F679 HydrophobicContact CB-CE2 3.99Å; D663-F679 PolarHBondContact N-O 2.62Å; G664-F679 VanDerWaalsContact C-CE1 3.49Å; G664-F679 PolarHBondContact N-O 2.95Å; G664-F679 WeakPolarHBondContact O-CD1 3.38Å; G664-F679 PolarHBondContact O-N 2.81Å; F679-W688 HydrophobicContact CD2-CZ3 4.26Å; F679-Q689 WeakPolarHBondContact CA-O 3.45Å; F679-L690 HydrophobicContact CB-CD2 4.2Å; F679-L690 HydrophobicContact CB-CG 4.24Å
680	G	88.6	Confident	79	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.6	-166.3	-169.3	0	0	0	0	0	113.6	H661 D663 Q689	H661-G680 CarbonylContact O-C 3.6Å; H661-G680 WeakPolarHBondContact O-CA 3.5Å; D663-G680 WeakPolarHBondContact OD2-CA 3.39Å; G680-Q689 PolarHBondContact N-O 3.43Å; G680-Q689 PolarHBondContact O-N 2.77Å
681	H	85.3	Confident	80.5	Confident	18 Å²	18	38 Å²	38	8%	0.083	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	150.3	179.5	55.7	-94.6	0	0	0	112.3	L660 H661 D663 N683 H684	L660-H681 VanDerWaalsContact CD1-C 3.46Å; H661-H681 WeakPolarHBondContact CB-O 3.43Å; H661-H681 AromaticContact CD2-CE1 3.37Å; H661-H681 PolarHBondContact CD2-CE1 2.88Å; H661-H681 AromaticContact CD2-NE2 3.54Å; H661-H681 AromaticContact CG-CE1 3.89Å; H661-H681 AromaticContact CG-NE2 3.61Å; H661-H681 PolarHBondContact N-O 3.08Å; H661-H681 PolarHBondContact O-N 2.79Å; D663-H681 IonicContact OD1-CE1 3.85Å; D663-H681 PolarHBondContact OD1-CE1 2.86Å; D663-H681 VanDerWaalsContact OD1-CE1 3.23Å; D663-H681 IonicContact OD1-ND1 2.93Å; D663-H681 IonicContact OD2-CE1 2.66Å; D663-H681 PolarHBondContact OD2-CE1 3.48Å; D663-H681 VanDerWaalsContact OD2-CE1 3.31Å; D663-H681 IonicContact OD2-CG 3.3Å; D663-H681 IonicContact OD2-ND1 2.62Å; D663-H681 PolarHBondContact OD2-ND1 2.69Å; H681-N683 PolarHBondContact CD2-O 2.94Å; H681-N683 VanDerWaalsContact CD2-O 3.3Å; H681-H684 AromaticContact CD2-ND1 3.72Å; H681-H684 AromaticContact CE1-ND1 3.67Å; H681-H684 AromaticContact NE2-CE1 3.39Å; H681-H684 PolarHBondContact NE2-CE1 2.81Å; H681-H684 AromaticContact NE2-CG 3.94Å; H681-H684 AromaticContact NE2-ND1 2.85Å; H681-H684 PolarHBondContact NE2-ND1 3.47Å
682	F	82.7	Confident	82.1	Confident	52 Å²	52	38.3 Å²	38.3	23%	0.228	18%	0.179	C	C	.	.	S	Bend	trans	-78.8	-23.8	177.1	-64.9	-49.5	0	0	0	112.8	R636 V658 L660 S686 Q689	R636-F682 WeakPolarHBondContact CD-O 3.41Å; R636-F682 PolarHBondContact NH1-O 3.21Å; V658-F682 HydrophobicContact CB-CD1 4.24Å; V658-F682 HydrophobicContact CB-CE1 3.8Å; V658-F682 HydrophobicContact CB-CZ 4.32Å; V658-F682 HydrophobicContact CG1-CD1 3.71Å; V658-F682 HydrophobicContact CG1-CE1 3.81Å; V658-F682 HydrophobicContact CG1-CG 4.35Å; V658-F682 HydrophobicContact CG1-CZ 4.5Å; L660-F682 HydrophobicContact CD1-CD1 3.64Å; L660-F682 HydrophobicContact CD1-CE1 3.75Å; L660-F682 HydrophobicContact CD1-CG 4.35Å; F682-S686 PolarHBondContact N-OG 3.02Å; F682-Q689 HydrophobicContact CD1-CG 4.47Å; F682-Q689 HydrophobicContact CD2-CG 3.7Å; F682-Q689 HydrophobicContact CE1-CG 4.3Å; F682-Q689 HydrophobicContact CE2-CG 3.51Å; F682-Q689 VanDerWaalsContact CE2-OE1 3.25Å; F682-Q689 HydrophobicContact CG-CG 4.19Å; F682-Q689 HydrophobicContact CZ-CG 3.82Å
683	N	75.8	Confident	83.5	Confident	85 Å²	85	34.8 Å²	34.8	46%	0.455	16%	0.161	S	C	.	.	S	Bend	trans	-156.8	156.6	173.9	-172.3	18.2	0	0	0	108.6	H681 Y685 S686	H681-N683 PolarHBondContact CD2-O 2.94Å; H681-N683 VanDerWaalsContact CD2-O 3.3Å; N683-Y685 PolarHBondContact O-N 3.18Å; N683-S686 PolarHBondContact N-OG 2.98Å; N683-S686 PolarHBondContact O-N 2.99Å; N683-S686 PolarHBondContact O-OG 3Å
684	H	68.5	Low	84.4	Confident	133 Å²	133	36.3 Å²	36.3	62%	0.616	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-2.2	-178.2	-57	-51.1	0	0	0	114.9	H681	H681-H684 AromaticContact CD2-ND1 3.72Å; H681-H684 AromaticContact CE1-ND1 3.67Å; H681-H684 AromaticContact NE2-CE1 3.39Å; H681-H684 PolarHBondContact NE2-CE1 2.81Å; H681-H684 AromaticContact NE2-CG 3.94Å; H681-H684 AromaticContact NE2-ND1 2.85Å; H681-H684 PolarHBondContact NE2-ND1 3.47Å
685	Y	70	Confident	84.7	Confident	194 Å²	194	35.8 Å²	35.8	76%	0.761	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.8	12.4	175.8	-50.7	-76	0	0	0	112.8	N683	N683-Y685 PolarHBondContact O-N 3.18Å
686	S	73.1	Confident	84.7	Confident	32 Å²	32	40.9 Å²	40.9	22%	0.224	19%	0.188	C	C	.	.	S	Bend	trans	-96.3	154.6	176.6	68.9	0	0	0	0	111.5	F682 N683	F682-S686 PolarHBondContact N-OG 3.02Å; N683-S686 PolarHBondContact N-OG 2.98Å; N683-S686 PolarHBondContact O-N 2.99Å; N683-S686 PolarHBondContact O-OG 3Å
687	E	82.4	Confident	84.5	Confident	57 Å²	57	42.9 Å²	42.9	27%	0.266	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-51.6	142.1	170.6	-53.3	-174.5	143.9	0	0	112	S198 G199 Q689	S198-E687 VanDerWaalsContact CA-CD 3.43Å; S198-E687 VanDerWaalsContact CA-OE1 3.26Å; S198-E687 WeakPolarHBondContact CA-OE1 3.42Å; S198-E687 WeakPolarHBondContact CA-OE2 3.47Å; S198-E687 WeakPolarHBondContact CB-OE2 3.31Å; S198-E687 PolarHBondContact OG-OE2 3Å; G199-E687 PolarHBondContact N-OE1 3.06Å; E687-Q689 PolarHBondContact O-N 2.83Å; E687-Q689 PolarHBondContact O-NE2 2.91Å
688	W	87.6	Confident	84.4	Confident	29 Å²	29	43 Å²	43	11%	0.11	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-58.7	131.3	175.8	-72.5	88.7	0	0	0	110.8	L197 H203 A206 D663 F679	L197-W688 HydrophobicContact CB-CB 4.24Å; L197-W688 HydrophobicContact CD1-CB 4.04Å; L197-W688 HydrophobicContact CG-CB 4.23Å; L197-W688 PolarHBondContact N-O 2.81Å; H203-W688 PolarHBondContact O-NE1 3.03Å; A206-W688 HydrophobicContact CB-CD2 4.41Å; A206-W688 HydrophobicContact CB-CE3 4.37Å; A206-W688 HydrophobicContact CB-CH2 4.13Å; A206-W688 HydrophobicContact CB-CZ2 4.16Å; A206-W688 HydrophobicContact CB-CZ3 4.24Å; D663-W688 HydrophobicContact CB-CZ3 4.19Å; D663-W688 WeakPolarHBondContact OD2-CZ3 3.12Å; F679-W688 HydrophobicContact CD2-CZ3 4.26Å
689	Q	89.1	Confident	84.3	Confident	15 Å²	15	43.2 Å²	43.2	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135	179.5	-53.9	-60.9	-59.3	0	0	109.5	L660 F679 G680 F682 E687	L660-Q689 HydrophobicContact CD1-CB 3.74Å; L660-Q689 HydrophobicContact CD1-CG 3.91Å; F679-Q689 WeakPolarHBondContact CA-O 3.45Å; G680-Q689 PolarHBondContact N-O 3.43Å; G680-Q689 PolarHBondContact O-N 2.77Å; F682-Q689 HydrophobicContact CD1-CG 4.47Å; F682-Q689 HydrophobicContact CD2-CG 3.7Å; F682-Q689 HydrophobicContact CE1-CG 4.3Å; F682-Q689 HydrophobicContact CE2-CG 3.51Å; F682-Q689 VanDerWaalsContact CE2-OE1 3.25Å; F682-Q689 HydrophobicContact CG-CG 4.19Å; F682-Q689 HydrophobicContact CZ-CG 3.82Å; E687-Q689 PolarHBondContact O-N 2.83Å; E687-Q689 PolarHBondContact O-NE2 2.91Å
690	L	90.3	Very high	84.1	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133	170.3	-64.4	103.6	0	0	0	109.6	T194 F195 L197 I220 Y247 T677 F678 F679	T194-L690 CarbonylContact C-O 3.6Å; T194-L690 WeakPolarHBondContact CA-O 3.16Å; F195-L690 PolarHBondContact N-O 2.79Å; F195-L690 PolarHBondContact O-N 2.84Å; L197-L690 HydrophobicContact CD1-CD1 3.96Å; L197-L690 HydrophobicContact CD2-CD1 3.73Å; L197-L690 HydrophobicContact CG-CD1 3.61Å; I220-L690 HydrophobicContact CD1-CD1 3.95Å; I220-L690 HydrophobicContact CD1-CD2 3.51Å; I220-L690 HydrophobicContact CD1-CG 4.39Å; Y247-L690 HydrophobicContact CE2-CB 4.47Å; Y247-L690 HydrophobicContact CE2-CD1 4.43Å; Y247-L690 HydrophobicContact CE2-CD2 4.29Å; T677-L690 HydrophobicContact CG2-CB 4.12Å; T677-L690 HydrophobicContact CG2-CD2 3.84Å; F678-L690 CarbonylContact O-C 3.15Å; F678-L690 VanDerWaalsContact O-CA 3.32Å; F678-L690 WeakPolarHBondContact O-CA 3.49Å; F679-L690 HydrophobicContact CB-CD2 4.2Å; F679-L690 HydrophobicContact CB-CG 4.24Å
691	I	90.1	Very high	84	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	98.9	176.1	-55.3	-178	0	0	0	107.5	P192 T194 F655 L660 T677 F678 I693	P192-I691 HydrophobicContact CB-CG2 4.13Å; T194-I691 HydrophobicContact CG2-CG1 4.04Å; F655-I691 HydrophobicContact CD2-CD1 3.79Å; F655-I691 HydrophobicContact CD2-CG2 4.43Å; F655-I691 HydrophobicContact CE2-CD1 4.02Å; F655-I691 WeakPolarHBondContact O-CG2 3.43Å; L660-I691 HydrophobicContact CD2-CD1 3.95Å; L660-I691 HydrophobicContact CD2-CG1 4.42Å; T677-I691 WeakPolarHBondContact CA-O 3.46Å; F678-I691 HydrophobicContact CB-CB 4.29Å; F678-I691 PolarHBondContact N-O 2.03Å; F678-I691 PolarHBondContact O-N 3.3Å; I691-I693 HydrophobicContact CG2-CG1 4.21Å
692	K	90.4	Very high	84.1	Confident	24 Å²	24	59.1 Å²	59.1	10%	0.104	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	132.8	169.3	175.7	-166.5	-177	174.4	0	108.3	P192 S193 D242 Y243 S245 I675 I676	P192-K692 CarbonylContact C-O 3.59Å; P192-K692 WeakPolarHBondContact CA-O 3.41Å; S193-K692 PolarHBondContact N-O 3.5Å; S193-K692 PolarHBondContact O-N 3Å; D242-K692 PolarHBondContact O-NZ 2.99Å; Y243-K692 WeakPolarHBondContact O-CD 3.45Å; Y243-K692 WeakPolarHBondContact O-CE 3.12Å; Y243-K692 PolarHBondContact O-NZ 2.86Å; S245-K692 WeakPolarHBondContact OG-CD 3.47Å; S245-K692 PolarHBondContact OG-NZ 3.29Å; I675-K692 HydrophobicContact CG2-CG 3.78Å; I676-K692 CarbonylContact O-C 3.32Å; I676-K692 WeakPolarHBondContact O-CA 3.35Å
693	I	89.5	Confident	84.3	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.7	174.7	-49.4	-177.7	0	0	0	107.8	L190 P192 L640 F655 I675 I676 F678 I691	L190-I693 HydrophobicContact CB-CG2 4.16Å; L190-I693 HydrophobicContact CD2-CG2 4.22Å; P192-I693 HydrophobicContact CB-CG1 4.39Å; L640-I693 HydrophobicContact CD2-CD1 3.76Å; F655-I693 HydrophobicContact CB-CD1 3.71Å; I675-I693 WeakPolarHBondContact CA-O 3.28Å; I676-I693 PolarHBondContact N-O 2.78Å; I676-I693 PolarHBondContact O-N 2.6Å; F678-I693 HydrophobicContact CD2-CD1 3.84Å; F678-I693 HydrophobicContact CD2-CG1 4.37Å; F678-I693 HydrophobicContact CE2-CD1 3.58Å; F678-I693 HydrophobicContact CE2-CG1 4.47Å; I691-I693 HydrophobicContact CG2-CG1 4.21Å
694	D	87.9	Confident	84.9	Confident	59 Å²	59	59.1 Å²	59.1	32%	0.316	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	120.5	164.4	-168	-32.4	0	0	0	108.7	D191 H674 K696	D191-D694 PolarHBondContact O-N 2.93Å; H674-D694 WeakPolarHBondContact O-CA 3.5Å; D694-K696 WeakPolarHBondContact OD1-CB 3.24Å; D694-K696 PolarHBondContact OD1-N 2.92Å
695	Y	87.6	Confident	85.7	Confident	13 Å²	13	59.9 Å²	59.9	5%	0.051	30%	0.295	C	S	.	.			trans	-103.8	7	179	70.8	-98.6	0	0	0	113.5	L621 H674 I675 I676 G697 L698 F699	L621-Y695 HydrophobicContact CB-CD2 4.15Å; L621-Y695 HydrophobicContact CB-CE2 3.72Å; L621-Y695 HydrophobicContact CD1-CD1 4.38Å; L621-Y695 HydrophobicContact CD1-CD2 3.92Å; L621-Y695 HydrophobicContact CD1-CE2 4.29Å; L621-Y695 HydrophobicContact CD1-CG 3.97Å; H674-Y695 VanDerWaalsContact CA-CE1 3.49Å; H674-Y695 HydrophobicContact CB-CD1 4.39Å; H674-Y695 HydrophobicContact CB-CD2 4.14Å; H674-Y695 HydrophobicContact CB-CE1 4.31Å; H674-Y695 HydrophobicContact CB-CE2 4.02Å; H674-Y695 HydrophobicContact CB-CG 4.33Å; H674-Y695 AromaticContact CD2-CD2 3.95Å; H674-Y695 AromaticContact CD2-CE2 3.65Å; H674-Y695 WeakPolarHBondContact O-CD1 3.04Å; H674-Y695 PolarHBondContact O-N 2.92Å; I675-Y695 VanDerWaalsContact N-CE1 3.33Å; I676-Y695 HydrophobicContact CD1-CD1 3.68Å; I676-Y695 HydrophobicContact CD1-CE1 3.93Å; I676-Y695 HydrophobicContact CG1-CD1 3.63Å; I676-Y695 HydrophobicContact CG1-CE1 3.66Å; Y695-G697 PolarHBondContact O-N 2.84Å; Y695-L698 HydrophobicContact CD2-CD1 4.39Å; Y695-L698 VanDerWaalsContact O-CB 3.26Å; Y695-L698 WeakPolarHBondContact O-CB 3.1Å; Y695-L698 VanDerWaalsContact O-CG 3.24Å; Y695-L698 WeakPolarHBondContact O-CG 3.41Å; Y695-L698 PolarHBondContact O-N 2.9Å; Y695-F699 HydrophobicContact CD2-CE2 4.04Å; Y695-F699 HydrophobicContact CE2-CE2 4.11Å
696	K	85.2	Confident	86.5	Confident	122 Å²	122	53 Å²	53	53%	0.53	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-58.9	-31	175.4	-167.3	174.8	-178.6	174.9	0	112.3	H674 D694 L698 F699	H674-K696 HydrophobicContact CB-CB 3.79Å; H674-K696 HydrophobicContact CB-CG 4.46Å; D694-K696 WeakPolarHBondContact OD1-CB 3.24Å; D694-K696 PolarHBondContact OD1-N 2.92Å; K696-L698 PolarHBondContact O-N 2.84Å; K696-L698 VanDerWaalsContact O-N 3.13Å; K696-F699 PolarHBondContact O-N 2.69Å
697	G	84.6	Confident	87.3	Confident	47 Å²	47	51.8 Å²	51.8	49%	0.485	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59.1	-17.4	173.9	0	0	0	0	0	115	Y695 F699	Y695-G697 PolarHBondContact O-N 2.84Å; G697-F699 VanDerWaalsContact C-N 3.28Å; G697-F699 PolarHBondContact O-N 2.71Å
698	L	86.4	Confident	87.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-68.8	-23.8	173.3	-59.9	-177.2	0	0	0	113.3	P188 L190 L621 A626 I642 Y695 K696	P188-L698 HydrophobicContact CB-CD2 3.82Å; L190-L698 HydrophobicContact CD2-CD1 4.49Å; L190-L698 HydrophobicContact CD2-CD2 3.79Å; L190-L698 HydrophobicContact CD2-CG 4.05Å; L190-L698 HydrophobicContact CG-CD2 4.48Å; L621-L698 HydrophobicContact CD1-CD1 3.99Å; A626-L698 HydrophobicContact CB-CD1 4.35Å; I642-L698 HydrophobicContact CD1-CD1 4.06Å; I642-L698 HydrophobicContact CD1-CD2 4.17Å; I642-L698 HydrophobicContact CG2-CD1 4.15Å; Y695-L698 HydrophobicContact CD2-CD1 4.39Å; Y695-L698 VanDerWaalsContact O-CB 3.26Å; Y695-L698 WeakPolarHBondContact O-CB 3.1Å; Y695-L698 VanDerWaalsContact O-CG 3.24Å; Y695-L698 WeakPolarHBondContact O-CG 3.41Å; Y695-L698 PolarHBondContact O-N 2.9Å; K696-L698 PolarHBondContact O-N 2.84Å; K696-L698 VanDerWaalsContact O-N 3.13Å
699	F	86.8	Confident	87.6	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.026	28%	0.276	C	S	.	.			trans	-125	111.3	-169.9	-51.2	-52.2	0	0	0	111.5	D622 G625 A626 L644 H674 Y695 K696 G697 R701 M738	D622-F699 HydrophobicContact CB-CD2 4.27Å; D622-F699 HydrophobicContact CB-CE2 3.51Å; D622-F699 HydrophobicContact CB-CZ 3.94Å; G625-F699 VanDerWaalsContact O-CE1 3.27Å; G625-F699 WeakPolarHBondContact O-CE1 3.29Å; A626-F699 HydrophobicContact CB-CE1 4.5Å; A626-F699 HydrophobicContact CB-CZ 4.06Å; L644-F699 HydrophobicContact CD2-CD1 4.48Å; L644-F699 HydrophobicContact CD2-CE1 3.73Å; H674-F699 AromaticContact CD2-CD2 3.96Å; H674-F699 AromaticContact NE2-CD2 3.97Å; Y695-F699 HydrophobicContact CD2-CE2 4.04Å; Y695-F699 HydrophobicContact CE2-CE2 4.11Å; K696-F699 PolarHBondContact O-N 2.69Å; G697-F699 VanDerWaalsContact C-N 3.28Å; G697-F699 PolarHBondContact O-N 2.71Å; F699-R701 PolarHBondContact O-N 2.62Å; F699-M738 HydrophobicContact CB-CE 4.43Å; F699-M738 HydrophobicContact CB-CG 3.62Å; F699-M738 HydrophobicContact CD2-CG 3.97Å; F699-M738 HydrophobicContact CG-CG 4.1Å
700	S	83.5	Confident	87.7	Confident	101 Å²	101	55.2 Å²	55.2	71%	0.706	30%	0.296	S	S	*	.			trans	-78.9	-18.6	-169.2	60.2	0	0	0	0	114.7	R736	S700-R736 PolarHBondContact N-O 2.84Å; S700-R736 PolarHBondContact OG-O 3.21Å
701	R	87.9	Confident	87.8	Confident	93 Å²	93	56.6 Å²	56.6	35%	0.351	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	172.5	-177.4	57.5	175.1	-178.1	77	0.3	111.3	F699 D707 C737 M738	F699-R701 PolarHBondContact O-N 2.62Å; R701-D707 IonicContact CZ-OD1 3.4Å; R701-D707 IonicContact CZ-OD2 3.51Å; R701-D707 VanDerWaalsContact CZ-OD2 3.32Å; R701-D707 IonicContact NH1-OD1 3.95Å; R701-D707 IonicContact NH1-OD2 3.96Å; R701-D707 PolarHBondContact NH1-OD2 3.49Å; R701-D707 VanDerWaalsContact NH2-CG 3.29Å; R701-D707 IonicContact NH2-OD1 3.21Å; R701-D707 PolarHBondContact NH2-OD1 2.92Å; R701-D707 IonicContact NH2-OD2 2.79Å; R701-D707 PolarHBondContact NH2-OD2 2.86Å; R701-C737 HydrophobicContact CG-CB 4.32Å; R701-C737 CarbonylContact O-C 3.59Å; R701-C737 WeakPolarHBondContact O-CA 3.31Å; R701-C737 WeakPolarHBondContact O-CB 3.49Å; R701-M738 PolarHBondContact O-N 3.42Å
702	R	86.9	Confident	87.9	Confident	168 Å²	168	58.4 Å²	58.4	63%	0.634	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	150.1	164.4	-69.4	-176.2	171.7	-163.2	-8	110.8	M738	R702-M738 HydrophobicContact CG-CB 4.47Å
703	C	87.1	Confident	88.1	Confident	20 Å²	20	57.4 Å²	57.4	14%	0.135	31%	0.31	C	S	.	.			trans	-71.2	147.7	176.9	-63.8	0	0	0	0	111.9	D707 Y708 C737 M738	C703-D707 HydrophobicContact CB-CB 4.06Å; C703-Y708 HydrophobicContact CB-CE1 4.23Å; C703-Y708 HydrophobicContact CB-CE2 3.95Å; C703-Y708 WeakPolarHBondContact CB-OH 3.41Å; C703-C737 WeakPolarHBondContact CA-SG 3.29Å; C703-C737 HydrophobicContact CB-CB 3.95Å; C703-C737 WeakPolarHBondContact CB-SG 3.48Å; C703-C737 WeakPolarHBondContact SG-CB 3.36Å; C703-C737 PolarHBondContact SG-O 3.42Å; C703-C737 CovalentContact SG-SG 2.04Å; C703-C737 PolarHBondContact SG-SG 3.11Å; C703-M738 PolarHBondContact N-O 3.35Å; C703-M738 PolarHBondContact SG-O 2.9Å
704	M	88.1	Confident	88.3	Confident	117 Å²	117	59.6 Å²	59.6	58%	0.576	32%	0.32	S	S	*	.			trans	-118.8	168.6	174.3	-59.2	-176.3	-69.2	0	0	109.2	G706 D707 Y708	M704-G706 PolarHBondContact O-N 2.82Å; M704-D707 PolarHBondContact N-OD2 3.42Å; M704-D707 WeakPolarHBondContact O-CB 3.37Å; M704-D707 PolarHBondContact O-N 3.24Å; M704-Y708 WeakPolarHBondContact O-CD2 3.31Å; M704-Y708 WeakPolarHBondContact O-CE2 3.38Å
705	D	84.8	Confident	88.4	Confident	150 Å²	150	58.1 Å²	58.1	80%	0.802	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-49.6	-37	-176.4	-59	-16.5	0	0	0	114.1	D707 Y708	D705-D707 VanDerWaalsContact C-N 3.27Å; D705-D707 PolarHBondContact O-N 3.15Å; D705-Y708 PolarHBondContact O-N 3.4Å
706	G	87.1	Confident	88.2	Confident	48 Å²	48	64.3 Å²	64.3	50%	0.495	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-70.1	-13	177.1	0	0	0	0	0	115.8	M704 Y708 R732	M704-G706 PolarHBondContact O-N 2.82Å; G706-Y708 VanDerWaalsContact C-N 3.34Å; G706-R732 WeakPolarHBondContact O-CD 3.15Å; G706-R732 PolarHBondContact O-NE 3.41Å; G706-R732 VanDerWaalsContact O-NE 3.13Å; G706-R732 PolarHBondContact O-NH1 2.83Å
707	D	89.1	Confident	88.1	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.037	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-86.2	-4.7	175.1	-61.6	-65.3	0	0	0	113.3	R701 C703 M704 D705 R732 N735 C737	R701-D707 IonicContact CZ-OD1 3.4Å; R701-D707 IonicContact CZ-OD2 3.51Å; R701-D707 VanDerWaalsContact CZ-OD2 3.32Å; R701-D707 IonicContact NH1-OD1 3.95Å; R701-D707 IonicContact NH1-OD2 3.96Å; R701-D707 PolarHBondContact NH1-OD2 3.49Å; R701-D707 VanDerWaalsContact NH2-CG 3.29Å; R701-D707 IonicContact NH2-OD1 3.21Å; R701-D707 PolarHBondContact NH2-OD1 2.92Å; R701-D707 IonicContact NH2-OD2 2.79Å; R701-D707 PolarHBondContact NH2-OD2 2.86Å; C703-D707 HydrophobicContact CB-CB 4.06Å; M704-D707 PolarHBondContact N-OD2 3.42Å; M704-D707 WeakPolarHBondContact O-CB 3.37Å; M704-D707 PolarHBondContact O-N 3.24Å; D705-D707 VanDerWaalsContact C-N 3.27Å; D705-D707 PolarHBondContact O-N 3.15Å; D707-R732 WeakPolarHBondContact O-CB 3.48Å; D707-R732 WeakPolarHBondContact O-CG 2.98Å; D707-R732 PolarHBondContact O-N 3.46Å; D707-N735 PolarHBondContact OD1-ND2 2.92Å; D707-C737 VanDerWaalsContact CG-SG 3.6Å
708	Y	87.4	Confident	88.4	Confident	22 Å²	22	70.9 Å²	70.9	9%	0.086	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	157	-175.4	-61.3	-73.6	0	0	0	113	C703 M704 D705 G706 M729 K730 R732 L739 Y743	C703-Y708 HydrophobicContact CB-CE1 4.23Å; C703-Y708 HydrophobicContact CB-CE2 3.95Å; C703-Y708 WeakPolarHBondContact CB-OH 3.41Å; M704-Y708 WeakPolarHBondContact O-CD2 3.31Å; M704-Y708 WeakPolarHBondContact O-CE2 3.38Å; D705-Y708 PolarHBondContact O-N 3.4Å; G706-Y708 VanDerWaalsContact C-N 3.34Å; Y708-M729 HydrophobicContact CD1-CG 4.27Å; Y708-M729 HydrophobicContact CG-CG 4.17Å; Y708-K730 WeakPolarHBondContact CA-O 3.21Å; Y708-R732 PolarHBondContact O-NE 2.97Å; Y708-R732 PolarHBondContact O-NH2 3.3Å; Y708-L739 HydrophobicContact CE1-CD2 3.6Å; Y708-Y743 AromaticContact CD1-CE2 3.65Å; Y708-Y743 HydrophobicContact CD1-CE2 3.65Å; Y708-Y743 AromaticContact CD1-CZ 3.7Å; Y708-Y743 WeakPolarHBondContact CD1-OH 3.44Å; Y708-Y743 HydrophobicContact CE1-CD2 4Å; Y708-Y743 AromaticContact CE1-CE2 3.19Å; Y708-Y743 HydrophobicContact CE1-CE2 3.19Å; Y708-Y743 AromaticContact CE1-CZ 3.49Å; Y708-Y743 VanDerWaalsContact CE1-CZ 3.49Å; Y708-Y743 WeakPolarHBondContact CE1-OH 3.38Å; Y708-Y743 HydrophobicContact CE2-CE2 4.14Å; Y708-Y743 HydrophobicContact CG-CE2 4.28Å; Y708-Y743 AromaticContact CZ-CD2 3.93Å; Y708-Y743 AromaticContact CZ-CE2 3.46Å; Y708-Y743 VanDerWaalsContact CZ-CE2 3.46Å
709	Q	89.7	Confident	88.5	Confident	73 Å²	73	75.6 Å²	75.6	34%	0.341	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	138	176.5	60	176.4	30.6	0	0	110.5	M729 K730 R732	Q709-M729 VanDerWaalsContact C-SD 3.57Å; Q709-K730 HydrophobicContact CG-CB 4.27Å; Q709-K730 PolarHBondContact N-O 2.76Å; Q709-K730 PolarHBondContact O-N 3.49Å; Q709-R732 HydrophobicContact CB-CG 4Å; Q709-R732 HydrophobicContact CG-CG 4.12Å
710	T	91.3	Very high	88.8	Confident	78 Å²	78	76.6 Å²	76.6	48%	0.479	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.3	172.5	52.7	0	0	0	0	110.2	Y728 M729 Y747	T710-Y728 CarbonylContact C-O 3.59Å; T710-Y728 WeakPolarHBondContact CA-O 3.36Å; T710-M729 HydrophobicContact CG2-CE 3.86Å; T710-M729 HydrophobicContact CG2-SD 3.64Å; T710-Y747 HydrophobicContact CG2-CD1 3.94Å; T710-Y747 HydrophobicContact CG2-CE1 4.26Å; T710-Y747 HydrophobicContact CG2-CG 4.21Å
711	W	92.5	Very high	89.2	Confident	33 Å²	33	71.9 Å²	71.9	13%	0.125	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.3	166.3	166.8	64.4	0	0	0	108.9	I505 A604 L713 K727 Y728 K730	I505-W711 HydrophobicContact CD1-CH2 4.1Å; A604-W711 HydrophobicContact CB-CH2 3.91Å; A604-W711 HydrophobicContact CB-CZ2 4.07Å; W711-L713 HydrophobicContact CH2-CB 4.4Å; W711-L713 HydrophobicContact CH2-CD1 3.8Å; W711-L713 HydrophobicContact CZ2-CD1 4.07Å; W711-K727 CarbonylContact O-C 3.55Å; W711-K727 WeakPolarHBondContact O-CA 3.5Å; W711-Y728 AromaticContact CE3-CD2 3.93Å; W711-Y728 HydrophobicContact CE3-CD2 3.93Å; W711-Y728 HydrophobicContact CE3-CG 4.28Å; W711-Y728 AromaticContact CZ3-CD2 3.7Å; W711-Y728 HydrophobicContact CZ3-CD2 3.7Å; W711-Y728 HydrophobicContact CZ3-CE2 4.19Å; W711-Y728 HydrophobicContact CZ3-CG 4.26Å; W711-Y728 PolarHBondContact N-O 2.77Å; W711-Y728 PolarHBondContact O-N 3.15Å; W711-K730 HydrophobicContact CB-CD 3.84Å; W711-K730 HydrophobicContact CB-CG 4.29Å; W711-K730 HydrophobicContact CD2-CD 4.27Å; W711-K730 HydrophobicContact CE3-CD 4.02Å; W711-K730 HydrophobicContact CG-CD 4.21Å
712	S	92.9	Very high	89.4	Confident	39 Å²	39	68 Å²	68	27%	0.273	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.2	177.4	-56.2	0	0	0	0	109.3	H714	S712-H714 PolarHBondContact O-CD2 3.25Å
713	L	93.9	Very high	89.6	Confident	3 Å²	3	60 Å²	60	2%	0.016	31%	0.311	C	S	.	.			trans	-67.7	136.1	174.1	178.5	61.2	0	0	0	109.8	I505 A604 W711 V721 Q726 Y728	I505-L713 HydrophobicContact CD1-CD1 4.06Å; I505-L713 HydrophobicContact CG2-CD1 4.47Å; I505-L713 HydrophobicContact CG2-CD2 3.77Å; A604-L713 HydrophobicContact CB-CD1 3.81Å; W711-L713 HydrophobicContact CH2-CB 4.4Å; W711-L713 HydrophobicContact CH2-CD1 3.8Å; W711-L713 HydrophobicContact CZ2-CD1 4.07Å; L713-V721 HydrophobicContact CD2-CB 3.95Å; L713-V721 HydrophobicContact CD2-CG1 4.04Å; L713-V721 HydrophobicContact CD2-CG2 4.33Å; L713-V721 HydrophobicContact CG-CB 4.21Å; L713-V721 HydrophobicContact CG-CG2 4.03Å; L713-Q726 HydrophobicContact CB-CB 4.35Å; L713-Q726 PolarHBondContact N-O 2.79Å; L713-Y728 HydrophobicContact CB-CE2 4.13Å; L713-Y728 HydrophobicContact CD2-CE2 4.34Å
714	H	92.7	Very high	89.9	Confident	52 Å²	52	60.5 Å²	60.5	24%	0.241	31%	0.311	C	S	.	.			trans	-151.5	161.8	174.7	59.8	69.6	0	0	0	111.2	N606 S712 E718	N606-H714 PolarHBondContact ND2-O 3.16Å; N606-H714 PolarHBondContact OD1-ND1 3.34Å; S712-H714 PolarHBondContact O-CD2 3.25Å; H714-E718 CarbonylContact C-O 3.5Å; H714-E718 WeakPolarHBondContact CA-O 3.46Å; H714-E718 WeakPolarHBondContact CB-O 3.43Å
715	N	90.4	Very high	90.1	Very high	28 Å²	28	58.9 Å²	58.9	15%	0.15	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-122	106	167.7	170.1	19.6	0	0	0	107.7	Y525 E717 E718 V721 Y757	Y525-N715 HydrophobicContact CD1-CB 4.22Å; Y525-N715 HydrophobicContact CD2-CB 4.02Å; Y525-N715 VanDerWaalsContact CD2-CG 3.45Å; Y525-N715 HydrophobicContact CE2-CB 4.36Å; Y525-N715 WeakPolarHBondContact CE2-OD1 3.28Å; Y525-N715 HydrophobicContact CG-CB 3.94Å; N715-E717 PolarHBondContact O-N 3.06Å; N715-E718 PolarHBondContact N-O 3.02Å; N715-E718 WeakPolarHBondContact O-CB 3.44Å; N715-E718 PolarHBondContact O-N 2.73Å; N715-V721 HydrophobicContact CB-CG2 4.43Å; N715-Y757 PolarHBondContact ND2-OH 3.16Å
716	K	83.9	Confident	90.5	Very high	143 Å²	143	52.7 Å²	52.7	62%	0.622	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	53.1	-179	-58.6	175.5	-178.2	177.8	0	113.7	N606 E718	N606-K716 PolarHBondContact OD1-N 2.66Å; K716-E718 VanDerWaalsContact C-N 3.27Å; K716-E718 PolarHBondContact O-N 2.95Å
717	E	83.7	Confident	90.8	Very high	172 Å²	172	53.1 Å²	53.1	80%	0.804	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-26	-176.4	-51.4	179.3	-166.8	0	0	115.6	N715 Q719	N715-E717 PolarHBondContact O-N 3.06Å; E717-Q719 PolarHBondContact O-N 3.07Å
718	E	89.3	Confident	90.8	Very high	134 Å²	134	53.3 Å²	53.3	63%	0.626	26%	0.256	S	S	*	.	B	Isolated β-bridge	trans	-64.1	108.1	171.7	-99.3	62.8	-133.3	0	0	112.2	H714 N715 K716 C720	H714-E718 CarbonylContact C-O 3.5Å; H714-E718 WeakPolarHBondContact CA-O 3.46Å; H714-E718 WeakPolarHBondContact CB-O 3.43Å; N715-E718 PolarHBondContact N-O 3.02Å; N715-E718 WeakPolarHBondContact O-CB 3.44Å; N715-E718 PolarHBondContact O-N 2.73Å; K716-E718 VanDerWaalsContact C-N 3.27Å; K716-E718 PolarHBondContact O-N 2.95Å; E718-C720 PolarHBondContact O-N 2.89Å
719	Q	89.6	Confident	90.8	Very high	100 Å²	100	54.2 Å²	54.2	47%	0.467	26%	0.261	S	S	.	.			trans	-75.7	-1.9	-179.1	-62.6	178.3	-6.1	0	0	115	E717 K725	E717-Q719 PolarHBondContact O-N 3.07Å; Q719-K725 WeakPolarHBondContact O-CA 3.19Å
720	C	92	Very high	90.7	Very high	27 Å²	27	51.7 Å²	51.7	18%	0.182	25%	0.249	C	C	.	.			trans	-104.3	105.7	-178.6	-169	0	0	0	0	110.1	E718 C752	E718-C720 PolarHBondContact O-N 2.89Å; C720-C752 HydrophobicContact CB-CB 4.2Å; C720-C752 WeakPolarHBondContact CB-SG 3.28Å; C720-C752 WeakPolarHBondContact SG-CB 3.39Å; C720-C752 CovalentContact SG-SG 2.03Å; C720-C752 PolarHBondContact SG-SG 3.31Å
721	V	92.2	Very high	90.4	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.018	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-120.2	132	179.7	-179.9	0	0	0	0	108.2	L713 N715 G723 E724	L713-V721 HydrophobicContact CD2-CB 3.95Å; L713-V721 HydrophobicContact CD2-CG1 4.04Å; L713-V721 HydrophobicContact CD2-CG2 4.33Å; L713-V721 HydrophobicContact CG-CB 4.21Å; L713-V721 HydrophobicContact CG-CG2 4.03Å; N715-V721 HydrophobicContact CB-CG2 4.43Å; V721-G723 PolarHBondContact O-N 2.62Å; V721-E724 PolarHBondContact N-O 3.38Å; V721-E724 PolarHBondContact O-N 2.96Å
722	M	92.4	Very high	90.3	Very high	11 Å²	11	52.8 Å²	52.8	5%	0.054	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	32.7	-172.3	-65.5	-66.2	-74	0	0	113.9	K527 V803 L804 N806 N807	K527-M722 HydrophobicContact CB-CE 4.35Å; K527-M722 HydrophobicContact CB-SD 4.38Å; K527-M722 HydrophobicContact CD-CE 4.02Å; M722-V803 HydrophobicContact CE-CG1 4.01Å; M722-V803 HydrophobicContact SD-CG1 4.24Å; M722-L804 WeakPolarHBondContact CE-O 3.4Å; M722-N806 VanDerWaalsContact C-CG 3.47Å; M722-N806 HydrophobicContact CE-CB 4.5Å; M722-N806 CarbonylContact O-C 3.18Å; M722-N806 VanDerWaalsContact O-CA 3.28Å; M722-N806 WeakPolarHBondContact O-CA 3.49Å; M722-N806 PolarHBondContact O-OD1 3.28Å; M722-N807 PolarHBondContact O-N 3.25Å
723	G	92.1	Very high	90.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	10	179.1	0	0	0	0	0	115.7	V721 C752 N806 C808	V721-G723 PolarHBondContact O-N 2.62Å; G723-C752 VanDerWaalsContact C-SG 3.53Å; G723-C752 PolarHBondContact O-N 2.6Å; G723-C752 PolarHBondContact O-SG 3.17Å; G723-N806 PolarHBondContact N-ND2 2.86Å; G723-C808 WeakPolarHBondContact O-CA 3.41Å; G723-C808 PolarHBondContact O-N 3.22Å
724	E	92.7	Very high	89.7	Confident	31 Å²	31	54.2 Å²	54.2	15%	0.145	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.2	178.9	-61.5	-170.7	159	0	0	113	V721 Q726 S749 N807	V721-E724 PolarHBondContact N-O 3.38Å; V721-E724 PolarHBondContact O-N 2.96Å; E724-Q726 HydrophobicContact CB-CG 3.86Å; E724-Q726 PolarHBondContact OE2-NE2 3.09Å; E724-S749 WeakPolarHBondContact CB-OG 3.45Å; E724-S749 PolarHBondContact OE2-OG 2.82Å; E724-N807 HydrophobicContact CG-CB 3.67Å; E724-N807 WeakPolarHBondContact OE1-CB 3.33Å; E724-N807 PolarHBondContact OE1-ND2 3.14Å
725	K	93.3	Very high	89.5	Confident	83 Å²	83	54.1 Å²	54.1	36%	0.361	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	93.8	163.3	-61	-173.2	178.5	-172.9	0	109	Q719 E750	Q719-K725 WeakPolarHBondContact O-CA 3.19Å; K725-E750 HydrophobicContact CB-CB 4.35Å; K725-E750 PolarHBondContact N-O 2.87Å; K725-E750 PolarHBondContact O-N 2.83Å
726	Q	92.3	Very high	89.4	Confident	20 Å²	20	56 Å²	56	9%	0.093	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.4	-177.6	-67.1	177.7	-13.4	0	0	111	L713 E724 Y728	L713-Q726 HydrophobicContact CB-CB 4.35Å; L713-Q726 PolarHBondContact N-O 2.79Å; E724-Q726 HydrophobicContact CB-CG 3.86Å; E724-Q726 PolarHBondContact OE2-NE2 3.09Å; Q726-Y728 HydrophobicContact CB-CE2 4Å; Q726-Y728 PolarHBondContact OE1-OH 3.3Å
727	K	92.4	Very high	89.5	Confident	57 Å²	57	49.2 Å²	49.2	25%	0.248	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.5	171.4	-51	-175.5	-167.7	116.9	0	108.7	W711 Y747 S748 E750	W711-K727 CarbonylContact O-C 3.55Å; W711-K727 WeakPolarHBondContact O-CA 3.5Å; K727-Y747 WeakPolarHBondContact O-CB 3.42Å; K727-Y747 PolarHBondContact O-N 2.72Å; K727-S748 WeakPolarHBondContact CB-OG 3.49Å; K727-S748 WeakPolarHBondContact CD-OG 3.42Å; K727-S748 WeakPolarHBondContact CG-OG 3.28Å; K727-S748 PolarHBondContact N-O 2.84Å; K727-S748 PolarHBondContact O-N 3.35Å; K727-E750 IonicContact NZ-OE1 3.98Å; K727-E750 PolarHBondContact NZ-OE1 2.95Å
728	Y	90.1	Very high	89.6	Confident	10 Å²	10	42.7 Å²	42.7	4%	0.039	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	141.5	176.6	-65.7	-91.9	0	0	0	109.8	G504 P578 T710 W711 L713 Q726 R745 I746	G504-Y728 PolarHBondContact O-OH 2.98Å; G504-Y728 VanDerWaalsContact O-OH 3.05Å; P578-Y728 HydrophobicContact CB-CD1 3.89Å; P578-Y728 HydrophobicContact CB-CE1 3.64Å; P578-Y728 HydrophobicContact CB-CG 4.49Å; P578-Y728 HydrophobicContact CG-CD1 3.4Å; P578-Y728 VanDerWaalsContact CG-CD1 3.4Å; P578-Y728 HydrophobicContact CG-CE1 3.63Å; P578-Y728 HydrophobicContact CG-CG 4.1Å; T710-Y728 CarbonylContact C-O 3.59Å; T710-Y728 WeakPolarHBondContact CA-O 3.36Å; W711-Y728 AromaticContact CE3-CD2 3.93Å; W711-Y728 HydrophobicContact CE3-CD2 3.93Å; W711-Y728 HydrophobicContact CE3-CG 4.28Å; W711-Y728 AromaticContact CZ3-CD2 3.7Å; W711-Y728 HydrophobicContact CZ3-CD2 3.7Å; W711-Y728 HydrophobicContact CZ3-CE2 4.19Å; W711-Y728 HydrophobicContact CZ3-CG 4.26Å; W711-Y728 PolarHBondContact N-O 2.77Å; W711-Y728 PolarHBondContact O-N 3.15Å; L713-Y728 HydrophobicContact CB-CE2 4.13Å; L713-Y728 HydrophobicContact CD2-CE2 4.34Å; Q726-Y728 HydrophobicContact CB-CE2 4Å; Q726-Y728 PolarHBondContact OE1-OH 3.3Å; Y728-R745 CarbonylContact C-O 3.58Å; Y728-R745 VanDerWaalsContact CA-O 3.26Å; Y728-R745 WeakPolarHBondContact CA-O 3.48Å; Y728-I746 HydrophobicContact CD1-CG1 4.11Å; Y728-I746 HydrophobicContact CE1-CG1 3.91Å
729	M	86.9	Confident	89	Confident	42 Å²	42	37.7 Å²	37.7	21%	0.207	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	114.3	169.1	-164.3	74.9	84.1	0	0	108.4	Y708 Q709 T710 Y743 R745 Y747	Y708-M729 HydrophobicContact CD1-CG 4.27Å; Y708-M729 HydrophobicContact CG-CG 4.17Å; Q709-M729 VanDerWaalsContact C-SD 3.57Å; T710-M729 HydrophobicContact CG2-CE 3.86Å; T710-M729 HydrophobicContact CG2-SD 3.64Å; M729-Y743 WeakPolarHBondContact CB-OH 3.43Å; M729-Y743 HydrophobicContact CG-CE2 4.31Å; M729-Y743 WeakPolarHBondContact CG-OH 3.11Å; M729-Y743 WeakPolarHBondContact O-CE1 3.31Å; M729-Y743 PolarHBondContact O-OH 2.71Å; M729-R745 PolarHBondContact N-O 3.38Å; M729-Y747 HydrophobicContact CE-CD2 3.48Å; M729-Y747 VanDerWaalsContact CE-CD2 3.48Å; M729-Y747 HydrophobicContact CE-CE2 3.8Å; M729-Y747 HydrophobicContact CE-CG 4.06Å
730	K	87	Confident	88	Confident	20 Å²	20	35.6 Å²	35.6	9%	0.087	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	155.1	173.6	-60.4	-178.2	78	-172.8	0	109.3	S602 E646 Y708 Q709 W711	S602-K730 PolarHBondContact O-NZ 3.17Å; E646-K730 WeakPolarHBondContact OE1-CE 3.45Å; E646-K730 IonicContact OE1-NZ 2.76Å; E646-K730 PolarHBondContact OE1-NZ 3.15Å; E646-K730 IonicContact OE2-NZ 2.75Å; E646-K730 PolarHBondContact OE2-NZ 3.16Å; Y708-K730 WeakPolarHBondContact CA-O 3.21Å; Q709-K730 HydrophobicContact CG-CB 4.27Å; Q709-K730 PolarHBondContact N-O 2.76Å; Q709-K730 PolarHBondContact O-N 3.49Å; W711-K730 HydrophobicContact CB-CD 3.84Å; W711-K730 HydrophobicContact CB-CG 4.29Å; W711-K730 HydrophobicContact CD2-CD 4.27Å; W711-K730 HydrophobicContact CE3-CD 4.02Å; W711-K730 HydrophobicContact CG-CD 4.21Å
731	R	86.5	Confident	86.6	Confident	23 Å²	23	40 Å²	40	9%	0.087	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	149.8	163.9	-156.5	-174.6	70.4	-169.9	-3	109	G625 L644 N735 C737 L739	G625-R731 VanDerWaalsContact O-CZ 3.27Å; G625-R731 PolarHBondContact O-NH1 3.45Å; G625-R731 PolarHBondContact O-NH2 2.98Å; L644-R731 PolarHBondContact O-NH2 3.18Å; R731-N735 PolarHBondContact NE-O 2.91Å; R731-N735 PolarHBondContact NH1-O 2.88Å; R731-N735 PolarHBondContact NH2-O 2.91Å; R731-C737 PolarHBondContact NH1-O 3.32Å; R731-L739 HydrophobicContact CB-CD2 4.32Å; R731-L739 HydrophobicContact CG-CD2 4.45Å
732	R	89.3	Confident	85.2	Confident	110 Å²	110	47.4 Å²	47.4	42%	0.415	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-66.6	129.6	171.1	-72.8	175.7	-168	-161.2	5.7	109.7	G706 D707 Y708 Q709 G734 N735	G706-R732 WeakPolarHBondContact O-CD 3.15Å; G706-R732 PolarHBondContact O-NE 3.41Å; G706-R732 VanDerWaalsContact O-NE 3.13Å; G706-R732 PolarHBondContact O-NH1 2.83Å; D707-R732 WeakPolarHBondContact O-CB 3.48Å; D707-R732 WeakPolarHBondContact O-CG 2.98Å; D707-R732 PolarHBondContact O-N 3.46Å; Y708-R732 PolarHBondContact O-NE 2.97Å; Y708-R732 PolarHBondContact O-NH2 3.3Å; Q709-R732 HydrophobicContact CB-CG 4Å; Q709-R732 HydrophobicContact CG-CG 4.12Å; R732-G734 PolarHBondContact O-N 3.37Å; R732-N735 HydrophobicContact CB-CB 4.41Å; R732-N735 PolarHBondContact O-N 2.94Å
733	P	88.8	Confident	83.8	Confident	36 Å²	36	49.1 Å²	49.1	23%	0.234	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	127.9	173.3	-30.6	37.4	0	0	0	111.5	D645 E646	D645-P733 HydrophobicContact CB-CB 4.01Å; E646-P733 HydrophobicContact CG-CG 4.22Å
734	G	85.5	Confident	82.4	Confident	37 Å²	37	53.3 Å²	53.3	38%	0.381	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-17.5	-179.6	0	0	0	0	0	115.9	L644 R732 R736	L644-G734 PolarHBondContact O-N 2.99Å; R732-G734 PolarHBondContact O-N 3.37Å; G734-R736 PolarHBondContact O-N 2.86Å; G734-R736 VanDerWaalsContact O-N 3.15Å
735	N	88.4	Confident	81.6	Confident	50 Å²	50	56 Å²	56	27%	0.267	28%	0.282	S	S	.	.			trans	-71.2	111.4	179.7	-76.1	43	0	0	0	111.1	D707 R731 R732 C737	D707-N735 PolarHBondContact OD1-ND2 2.92Å; R731-N735 PolarHBondContact NE-O 2.91Å; R731-N735 PolarHBondContact NH1-O 2.88Å; R731-N735 PolarHBondContact NH2-O 2.91Å; R732-N735 HydrophobicContact CB-CB 4.41Å; R732-N735 PolarHBondContact O-N 2.94Å; N735-C737 VanDerWaalsContact C-N 3.25Å; N735-C737 PolarHBondContact O-N 2.88Å
736	R	87.9	Confident	81	Confident	67 Å²	67	55.7 Å²	55.7	25%	0.253	28%	0.284	S	S	.	.			trans	-75	63.6	-179.1	-65.4	-171.1	-173.3	173.6	3.4	113.2	S186 L644 S700 G734	S186-R736 PolarHBondContact O-NH1 2.97Å; S186-R736 VanDerWaalsContact O-NH1 3.13Å; L644-R736 HydrophobicContact CD1-CG 4.08Å; S700-R736 PolarHBondContact N-O 2.84Å; S700-R736 PolarHBondContact OG-O 3.21Å; G734-R736 PolarHBondContact O-N 2.86Å; G734-R736 VanDerWaalsContact O-N 3.15Å
737	C	87.5	Confident	80.6	Confident	1 Å²	1	62 Å²	62	1%	0.007	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.9	177.4	64.9	0	0	0	0	113.6	R701 C703 D707 R731 N735	R701-C737 HydrophobicContact CG-CB 4.32Å; R701-C737 CarbonylContact O-C 3.59Å; R701-C737 WeakPolarHBondContact O-CA 3.31Å; R701-C737 WeakPolarHBondContact O-CB 3.49Å; C703-C737 WeakPolarHBondContact CA-SG 3.29Å; C703-C737 HydrophobicContact CB-CB 3.95Å; C703-C737 WeakPolarHBondContact CB-SG 3.48Å; C703-C737 WeakPolarHBondContact SG-CB 3.36Å; C703-C737 PolarHBondContact SG-O 3.42Å; C703-C737 CovalentContact SG-SG 2.04Å; C703-C737 PolarHBondContact SG-SG 3.11Å; D707-C737 VanDerWaalsContact CG-SG 3.6Å; R731-C737 PolarHBondContact NH1-O 3.32Å; N735-C737 VanDerWaalsContact C-N 3.25Å; N735-C737 PolarHBondContact O-N 2.88Å
738	M	84.9	Confident	80.5	Confident	34 Å²	34	60.4 Å²	60.4	17%	0.167	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	135.8	174.8	-74	168	-86.1	0	0	110.9	D622 F699 R701 R702 C703	D622-M738 VanDerWaalsContact OD2-CA 3.28Å; D622-M738 WeakPolarHBondContact OD2-CA 3.34Å; F699-M738 HydrophobicContact CB-CE 4.43Å; F699-M738 HydrophobicContact CB-CG 3.62Å; F699-M738 HydrophobicContact CD2-CG 3.97Å; F699-M738 HydrophobicContact CG-CG 4.1Å; R701-M738 PolarHBondContact O-N 3.42Å; R702-M738 HydrophobicContact CG-CB 4.47Å; C703-M738 PolarHBondContact N-O 3.35Å; C703-M738 PolarHBondContact SG-O 2.9Å
739	L	77.4	Confident	80.6	Confident	29 Å²	29	62.2 Å²	62.2	15%	0.152	32%	0.318	C	S	.	.			trans	-70.9	165.9	170.1	-67.2	176.7	0	0	0	111.9	D622 N623 Y708 R731	D622-L739 PolarHBondContact OD2-N 2.54Å; N623-L739 HydrophobicContact CB-CD1 3.88Å; Y708-L739 HydrophobicContact CE1-CD2 3.6Å; R731-L739 HydrophobicContact CB-CD2 4.32Å; R731-L739 HydrophobicContact CG-CD2 4.45Å
740	S	69.1	Low	80.9	Confident	56 Å²	56	64.5 Å²	64.5	39%	0.392	33%	0.328	S	S	.	.			trans	-105.4	144	176.1	-166.8	0	0	0	0	110.2	D742 Y743	S740-D742 PolarHBondContact O-N 3.16Å; S740-Y743 WeakPolarHBondContact O-CB 3.41Å; S740-Y743 PolarHBondContact O-N 2.93Å
741	Q	62.5	Low	81.2	Confident	121 Å²	121	66 Å²	66	57%	0.565	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-41.6	-172.4	-146.2	171.3	39.2	0	0	112.7	D672 Y743	D672-Q741 PolarHBondContact OD1-NE2 3.49Å; D672-Q741 VanDerWaalsContact OD1-NE2 3.13Å; Q741-Y743 PolarHBondContact O-N 2.77Å
742	D	61.1	Low	81.5	Confident	157 Å²	157	65.2 Å²	65.2	84%	0.84	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	14.9	179	-55	-58.6	0	0	0	114.9	S740 S744	S740-D742 PolarHBondContact O-N 3.16Å; D742-S744 PolarHBondContact O-N 2.78Å
743	Y	64.6	Low	81.6	Confident	47 Å²	47	63.7 Å²	63.7	18%	0.184	34%	0.342	C	S	.	.			trans	-73.8	114.8	-170.6	173.6	-96.9	0	0	0	113.1	Y708 M729 S740 Q741 R745	Y708-Y743 AromaticContact CD1-CE2 3.65Å; Y708-Y743 HydrophobicContact CD1-CE2 3.65Å; Y708-Y743 AromaticContact CD1-CZ 3.7Å; Y708-Y743 WeakPolarHBondContact CD1-OH 3.44Å; Y708-Y743 HydrophobicContact CE1-CD2 4Å; Y708-Y743 AromaticContact CE1-CE2 3.19Å; Y708-Y743 HydrophobicContact CE1-CE2 3.19Å; Y708-Y743 AromaticContact CE1-CZ 3.49Å; Y708-Y743 VanDerWaalsContact CE1-CZ 3.49Å; Y708-Y743 WeakPolarHBondContact CE1-OH 3.38Å; Y708-Y743 HydrophobicContact CE2-CE2 4.14Å; Y708-Y743 HydrophobicContact CG-CE2 4.28Å; Y708-Y743 AromaticContact CZ-CD2 3.93Å; Y708-Y743 AromaticContact CZ-CE2 3.46Å; Y708-Y743 VanDerWaalsContact CZ-CE2 3.46Å; M729-Y743 WeakPolarHBondContact CB-OH 3.43Å; M729-Y743 HydrophobicContact CG-CE2 4.31Å; M729-Y743 WeakPolarHBondContact CG-OH 3.11Å; M729-Y743 WeakPolarHBondContact O-CE1 3.31Å; M729-Y743 PolarHBondContact O-OH 2.71Å; S740-Y743 WeakPolarHBondContact O-CB 3.41Å; S740-Y743 PolarHBondContact O-N 2.93Å; Q741-Y743 PolarHBondContact O-N 2.77Å; Y743-R745 HydrophobicContact CD1-CG 4.01Å; Y743-R745 HydrophobicContact CE1-CG 4.25Å; Y743-R745 PolarHBondContact O-N 2.83Å
744	S	61.3	Low	81.6	Confident	89 Å²	89	63.4 Å²	63.4	62%	0.622	34%	0.341	S	S	*	.			trans	-68.3	100.5	174.8	-172.2	0	0	0	0	111.5	D742 I746	D742-S744 PolarHBondContact O-N 2.78Å; S744-I746 VanDerWaalsContact C-N 3.26Å; S744-I746 PolarHBondContact O-N 3.36Å; S744-I746 PolarHBondContact OG-O 3.42Å
745	R	76.5	Confident	81.7	Confident	86 Å²	86	65 Å²	65	33%	0.325	34%	0.341	S	S	.	.	S	Bend	trans	-62.9	-31.1	-179.6	-58.3	175.3	-168.2	143.7	6.9	112.7	K575 Y728 M729 Y743	K575-R745 PolarHBondContact O-NH1 2.69Å; Y728-R745 CarbonylContact C-O 3.58Å; Y728-R745 VanDerWaalsContact CA-O 3.26Å; Y728-R745 WeakPolarHBondContact CA-O 3.48Å; M729-R745 PolarHBondContact N-O 3.38Å; Y743-R745 HydrophobicContact CD1-CG 4.01Å; Y743-R745 HydrophobicContact CE1-CG 4.25Å; Y743-R745 PolarHBondContact O-N 2.83Å
746	I	81.8	Confident	81.6	Confident	77 Å²	77	64.9 Å²	64.9	40%	0.395	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.8	170.7	-59.8	172.3	0	0	0	107.7	Y728 S744	Y728-I746 HydrophobicContact CD1-CG1 4.11Å; Y728-I746 HydrophobicContact CE1-CG1 3.91Å; S744-I746 VanDerWaalsContact C-N 3.26Å; S744-I746 PolarHBondContact O-N 3.36Å; S744-I746 PolarHBondContact OG-O 3.42Å
747	Y	83.6	Confident	81.5	Confident	152 Å²	152	64.7 Å²	64.7	60%	0.596	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	-42.1	176.3	177.8	-107.6	0	0	0	111.6	T710 K727 M729	T710-Y747 HydrophobicContact CG2-CD1 3.94Å; T710-Y747 HydrophobicContact CG2-CE1 4.26Å; T710-Y747 HydrophobicContact CG2-CG 4.21Å; K727-Y747 WeakPolarHBondContact O-CB 3.42Å; K727-Y747 PolarHBondContact O-N 2.72Å; M729-Y747 HydrophobicContact CE-CD2 3.48Å; M729-Y747 VanDerWaalsContact CE-CD2 3.48Å; M729-Y747 HydrophobicContact CE-CE2 3.8Å; M729-Y747 HydrophobicContact CE-CG 4.06Å
748	S	89.8	Confident	81.6	Confident	25 Å²	25	64.7 Å²	64.7	18%	0.175	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	139.1	173.7	64.8	0	0	0	0	110.1	K727	K727-S748 WeakPolarHBondContact CB-OG 3.49Å; K727-S748 WeakPolarHBondContact CD-OG 3.42Å; K727-S748 WeakPolarHBondContact CG-OG 3.28Å; K727-S748 PolarHBondContact N-O 2.84Å; K727-S748 PolarHBondContact O-N 3.35Å
749	S	91.6	Very high	81.9	Confident	47 Å²	47	63.3 Å²	63.3	33%	0.329	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.8	157.8	-169.2	0	0	0	0	109.6	E724	E724-S749 WeakPolarHBondContact CB-OG 3.45Å; E724-S749 PolarHBondContact OE2-OG 2.82Å
750	E	93.3	Very high	82.5	Confident	91 Å²	91	62.1 Å²	62.1	43%	0.425	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	114.4	-179.5	-66.4	165.4	-141.2	0	0	109.1	K725 K727	K725-E750 HydrophobicContact CB-CB 4.35Å; K725-E750 PolarHBondContact N-O 2.87Å; K725-E750 PolarHBondContact O-N 2.83Å; K727-E750 IonicContact NZ-OE1 3.98Å; K727-E750 PolarHBondContact NZ-OE1 2.95Å
751	P	93.9	Very high	83.6	Confident	50 Å²	50	60 Å²	60	33%	0.325	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.7	-177.9	27.7	-35.3	0	0	0	112	N807 K809	P751-N807 WeakPolarHBondContact CB-O 3.42Å; P751-K809 HydrophobicContact CB-CD 4.39Å; P751-K809 HydrophobicContact CB-CG 4.32Å; P751-K809 HydrophobicContact CG-CD 4.06Å; P751-K809 VanDerWaalsContact CG-CE 3.47Å; P751-K809 HydrophobicContact CG-CG 4.44Å
752	C	92.3	Very high	85	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.047	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-76.2	161.7	180	-47.9	0	0	0	0	112.5	C720 G723 C808 K809	C720-C752 HydrophobicContact CB-CB 4.2Å; C720-C752 WeakPolarHBondContact CB-SG 3.28Å; C720-C752 WeakPolarHBondContact SG-CB 3.39Å; C720-C752 CovalentContact SG-SG 2.03Å; C720-C752 PolarHBondContact SG-SG 3.31Å; G723-C752 VanDerWaalsContact C-SG 3.53Å; G723-C752 PolarHBondContact O-N 2.6Å; G723-C752 PolarHBondContact O-SG 3.17Å; C752-C808 CarbonylContact O-C 3.54Å; C752-C808 WeakPolarHBondContact O-CA 3.05Å; C752-K809 PolarHBondContact O-N 3.19Å
753	P	91.5	Very high	86.4	Confident	78 Å²	78	50.4 Å²	50.4	51%	0.506	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-64.4	137.6	156.4	30	-34.6	0	0	0	110.4	K809	P753-K809 CarbonylContact C-O 3.39Å; P753-K809 WeakPolarHBondContact CA-O 3.42Å
754	C	89.8	Confident	87.6	Confident	31 Å²	31	48.3 Å²	48.3	21%	0.209	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-67.3	138.9	-179.8	-66.4	0	0	0	0	112.8	D758 F759 C808 K809 E810	C754-D758 WeakPolarHBondContact CA-OD2 3.46Å; C754-F759 HydrophobicContact CB-CE2 4.04Å; C754-C808 WeakPolarHBondContact CA-SG 3.24Å; C754-C808 HydrophobicContact CB-CB 3.89Å; C754-C808 WeakPolarHBondContact CB-SG 3.29Å; C754-C808 WeakPolarHBondContact SG-CB 3.04Å; C754-C808 PolarHBondContact SG-O 3.05Å; C754-C808 VanDerWaalsContact SG-O 3.33Å; C754-C808 CovalentContact SG-SG 2.03Å; C754-C808 PolarHBondContact SG-SG 3.3Å; C754-K809 PolarHBondContact N-O 3.01Å; C754-K809 PolarHBondContact SG-O 2.96Å; C754-K809 VanDerWaalsContact SG-O 3.36Å; C754-E810 HydrophobicContact CB-CG 4.41Å
755	N	87.1	Confident	89	Confident	71 Å²	71	46.3 Å²	46.3	38%	0.38	24%	0.24	S	C	.	.			trans	-131.5	179.9	175.9	76.7	84.1	0	0	0	111.3	Y757 D758 F759	N755-Y757 PolarHBondContact O-N 2.81Å; N755-Y757 VanDerWaalsContact O-N 3.17Å; N755-Y757 WeakPolarHBondContact OD1-CB 3.4Å; N755-Y757 PolarHBondContact OD1-N 3.05Å; N755-D758 PolarHBondContact N-OD2 2.94Å; N755-D758 PolarHBondContact ND2-OD2 3.42Å; N755-D758 WeakPolarHBondContact O-CB 3.32Å; N755-D758 PolarHBondContact O-N 3.29Å; N755-F759 WeakPolarHBondContact O-CD2 3.31Å
756	A	85.6	Confident	89.6	Confident	47 Å²	47	45.9 Å²	45.9	39%	0.388	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-64.2	-19.3	-175.7	0	0	0	0	0	114.7	D758	A756-D758 VanDerWaalsContact C-N 3.3Å
757	Y	86.8	Confident	89.9	Confident	63 Å²	63	46.9 Å²	46.9	25%	0.247	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-70.3	-25.2	172.2	-164.1	-110.4	0	0	0	111.8	N526 Q529 T530 N715 N755 F759	N526-Y757 HydrophobicContact CB-CD1 4.39Å; N526-Y757 HydrophobicContact CB-CE1 3.7Å; N526-Y757 HydrophobicContact CB-CE2 4.41Å; N526-Y757 VanDerWaalsContact CG-CZ 3.42Å; N526-Y757 VanDerWaalsContact CG-OH 3.28Å; N526-Y757 WeakPolarHBondContact ND2-CE2 3.25Å; N526-Y757 PolarHBondContact ND2-OH 3.46Å; N526-Y757 PolarHBondContact OD1-OH 2.92Å; Q529-Y757 PolarHBondContact NE2-O 2.73Å; Q529-Y757 PolarHBondContact OE1-O 3.13Å; T530-Y757 HydrophobicContact CG2-CE2 4.45Å; N715-Y757 PolarHBondContact ND2-OH 3.16Å; N755-Y757 PolarHBondContact O-N 2.81Å; N755-Y757 VanDerWaalsContact O-N 3.17Å; N755-Y757 WeakPolarHBondContact OD1-CB 3.4Å; N755-Y757 PolarHBondContact OD1-N 3.05Å; Y757-F759 VanDerWaalsContact C-N 3.27Å; Y757-F759 PolarHBondContact O-N 3.31Å
758	D	90.4	Very high	90.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-81.1	-2.4	-178.4	-55.8	-59.6	0	0	0	114.1	C754 N755 A756 V803 N806 C808	C754-D758 WeakPolarHBondContact CA-OD2 3.46Å; N755-D758 PolarHBondContact N-OD2 2.94Å; N755-D758 PolarHBondContact ND2-OD2 3.42Å; N755-D758 WeakPolarHBondContact O-CB 3.32Å; N755-D758 PolarHBondContact O-N 3.29Å; A756-D758 VanDerWaalsContact C-N 3.3Å; D758-V803 PolarHBondContact O-N 2.81Å; D758-N806 WeakPolarHBondContact CB-ND2 3.45Å; D758-N806 PolarHBondContact OD1-ND2 2.93Å; D758-C808 VanDerWaalsContact CB-SG 3.54Å; D758-C808 VanDerWaalsContact CG-SG 3.58Å
759	F	89.8	Confident	89.7	Confident	5 Å²	5	48.3 Å²	48.3	2%	0.022	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.6	-176.1	-65.6	-92.3	0	0	0	113.2	Q529 C754 N755 Y757 Y800 R801 K802 Y816	Q529-F759 PolarHBondContact NE2-O 3.17Å; C754-F759 HydrophobicContact CB-CE2 4.04Å; N755-F759 WeakPolarHBondContact O-CD2 3.31Å; Y757-F759 VanDerWaalsContact C-N 3.27Å; Y757-F759 PolarHBondContact O-N 3.31Å; F759-Y800 HydrophobicContact CB-CD1 4.17Å; F759-R801 CarbonylContact C-O 3.45Å; F759-R801 WeakPolarHBondContact CA-O 3.34Å; F759-K802 HydrophobicContact CD1-CB 4.1Å; F759-K802 HydrophobicContact CD1-CG 4.46Å; F759-K802 HydrophobicContact CE1-CB 3.94Å; F759-K802 HydrophobicContact CE1-CG 4.18Å; F759-K802 HydrophobicContact CZ-CG 4.49Å; F759-Y816 AromaticContact CD2-CD2 3.93Å; F759-Y816 HydrophobicContact CD2-CD2 3.93Å; F759-Y816 AromaticContact CD2-CG 3.96Å; F759-Y816 HydrophobicContact CD2-CG 3.96Å; F759-Y816 AromaticContact CE2-CD2 3.92Å; F759-Y816 HydrophobicContact CE2-CD2 3.92Å; F759-Y816 HydrophobicContact CE2-CG 4.2Å; F759-Y816 HydrophobicContact CG-CG 4.14Å
760	E	90.8	Very high	89.2	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.019	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	163.7	169.7	61.1	-175.6	-159.4	0	0	111.5	Q452 I479 Q529 Y800 R801 V803	Q452-E760 PolarHBondContact NE2-OE1 3.06Å; I479-E760 HydrophobicContact CD1-CB 4.13Å; I479-E760 HydrophobicContact CD1-CG 4.02Å; Q529-E760 HydrophobicContact CG-CB 3.96Å; E760-Y800 CarbonylContact O-C 3.6Å; E760-Y800 WeakPolarHBondContact O-CA 3.47Å; E760-R801 HydrophobicContact CG-CG 3.64Å; E760-R801 PolarHBondContact N-O 3.17Å; E760-R801 PolarHBondContact O-N 2.91Å; E760-R801 IonicContact OE1-CZ 3.79Å; E760-R801 IonicContact OE1-NE 3.61Å; E760-R801 PolarHBondContact OE1-NE 3.28Å; E760-R801 IonicContact OE1-NH2 3.27Å; E760-R801 PolarHBondContact OE1-NH2 3.14Å; E760-V803 HydrophobicContact CB-CG2 4.12Å; E760-V803 HydrophobicContact CG-CG2 4.19Å
761	C	91.6	Very high	88.6	Confident	11 Å²	11	47.9 Å²	47.9	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	141.1	174.4	-57.4	0	0	0	0	110	I479 W765 C773 G799	I479-C761 WeakPolarHBondContact CD1-O 3.37Å; C761-W765 HydrophobicContact CB-CB 4.18Å; C761-W765 WeakPolarHBondContact CB-O 3.47Å; C761-C773 WeakPolarHBondContact CA-SG 3.33Å; C761-C773 HydrophobicContact CB-CB 3.77Å; C761-C773 WeakPolarHBondContact CB-SG 3.28Å; C761-C773 WeakPolarHBondContact SG-CB 3.4Å; C761-C773 CovalentContact SG-SG 2.04Å; C761-C773 PolarHBondContact SG-SG 3.26Å; C761-G799 WeakPolarHBondContact CA-O 3.45Å
762	D	91.4	Very high	88.4	Confident	39 Å²	39	51.1 Å²	51.1	21%	0.209	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-80.3	167.3	177.2	-161.2	5.4	0	0	0	111.6	G764 W765 S797 G799 R801	D762-G764 PolarHBondContact O-N 2.69Å; D762-W765 WeakPolarHBondContact O-CB 3.35Å; D762-W765 PolarHBondContact O-N 2.74Å; D762-S797 WeakPolarHBondContact CB-OG 3.3Å; D762-S797 WeakPolarHBondContact OD2-CB 3.09Å; D762-S797 PolarHBondContact OD2-OG 3.35Å; D762-G799 PolarHBondContact N-O 3.29Å; D762-R801 HydrophobicContact CB-CB 4.41Å; D762-R801 HydrophobicContact CB-CG 4.45Å; D762-R801 WeakPolarHBondContact OD1-CD 3.17Å
763	Y	91	Very high	88.3	Confident	37 Å²	37	51.2 Å²	51.2	15%	0.145	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	127	-177.9	173	-91.4	0	0	0	112.3	K433 L434 Y477 F478 W778 F779	K433-Y763 HydrophobicContact CB-CE2 3.97Å; K433-Y763 VanDerWaalsContact O-CE2 3.32Å; K433-Y763 WeakPolarHBondContact O-CE2 3.29Å; L434-Y763 PolarHBondContact O-OH 3.08Å; Y477-Y763 AromaticContact CD1-CD1 3.77Å; Y477-Y763 HydrophobicContact CD1-CD1 3.77Å; Y477-Y763 HydrophobicContact CD1-CD2 4.1Å; Y477-Y763 HydrophobicContact CD1-CE1 4.21Å; Y477-Y763 AromaticContact CD1-CG 3.71Å; Y477-Y763 HydrophobicContact CD1-CG 3.71Å; Y477-Y763 HydrophobicContact CE1-CD1 4.24Å; Y477-Y763 HydrophobicContact CE1-CE1 4.49Å; Y477-Y763 HydrophobicContact CG-CG 4.37Å; F478-Y763 WeakPolarHBondContact O-CD2 3.14Å; Y763-W778 HydrophobicContact CE1-CH2 4.12Å; Y763-W778 HydrophobicContact CE1-CZ3 4.18Å; Y763-W778 HydrophobicContact CE2-CH2 4.09Å; Y763-W778 AromaticContact CZ-CH2 3.77Å; Y763-W778 AromaticContact CZ-CZ3 4Å; Y763-F779 HydrophobicContact CD1-CE2 4.01Å; Y763-F779 HydrophobicContact CE1-CD2 4.45Å; Y763-F779 HydrophobicContact CE1-CE2 4.2Å; Y763-F779 WeakPolarHBondContact O-CE2 3.15Å; Y763-F779 VanDerWaalsContact O-CZ 3.29Å; Y763-F779 WeakPolarHBondContact O-CZ 3.32Å
764	G	89	Confident	88.3	Confident	4 Å²	4	49.3 Å²	49.3	4%	0.041	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	8.5	-174.7	0	0	0	0	0	115.1	D762 A776 F779	D762-G764 PolarHBondContact O-N 2.69Å; G764-A776 WeakPolarHBondContact O-CB 3.36Å; G764-A776 PolarHBondContact O-N 2.77Å; G764-F779 VanDerWaalsContact O-CB 3.32Å; G764-F779 WeakPolarHBondContact O-CB 3.36Å; G764-F779 VanDerWaalsContact O-CD1 3.31Å; G764-F779 WeakPolarHBondContact O-CD1 3.04Å; G764-F779 WeakPolarHBondContact O-CG 3.34Å
765	W	90.9	Very high	88.4	Confident	46 Å²	46	50.7 Å²	50.7	17%	0.174	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.9	170.3	-62.8	70.6	0	0	0	110.2	C761 D762 C773 S774 P775 F779 P781 G799	C761-W765 HydrophobicContact CB-CB 4.18Å; C761-W765 WeakPolarHBondContact CB-O 3.47Å; D762-W765 WeakPolarHBondContact O-CB 3.35Å; D762-W765 PolarHBondContact O-N 2.74Å; W765-C773 HydrophobicContact CB-CB 4.25Å; W765-C773 HydrophobicContact CE3-CB 4.44Å; W765-S774 CarbonylContact C-O 3.5Å; W765-S774 VanDerWaalsContact CA-O 3.23Å; W765-S774 WeakPolarHBondContact CA-O 3.48Å; W765-P775 HydrophobicContact CD2-CB 4.23Å; W765-P775 HydrophobicContact CE3-CB 4.36Å; W765-P775 HydrophobicContact CH2-CB 4.43Å; W765-P775 HydrophobicContact CH2-CG 4.44Å; W765-P775 HydrophobicContact CZ2-CB 4.32Å; W765-P775 HydrophobicContact CZ3-CB 4.46Å; W765-P775 VanDerWaalsContact CZ3-CD 3.48Å; W765-P775 HydrophobicContact CZ3-CG 4.39Å; W765-F779 AromaticContact CD1-CE1 3.83Å; W765-F779 AromaticContact NE1-CE1 3.37Å; W765-P781 HydrophobicContact CH2-CG 4.29Å; W765-P781 HydrophobicContact CZ2-CB 4Å; W765-P781 HydrophobicContact CZ2-CG 3.58Å; W765-G799 VanDerWaalsContact CE3-CA 3.46Å
766	E	89.7	Confident	88.5	Confident	78 Å²	78	47.4 Å²	47.4	36%	0.364	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.8	-173.7	-73.7	162.1	-170.6	0	0	108.9	Q768 S774 A776 W778	E766-Q768 PolarHBondContact O-N 2.99Å; E766-Q768 PolarHBondContact O-NE2 2.83Å; E766-S774 PolarHBondContact N-O 2.82Å; E766-S774 PolarHBondContact O-N 3.33Å; E766-S774 VanDerWaalsContact O-N 3.08Å; E766-A776 HydrophobicContact CG-CB 3.94Å; E766-A776 WeakPolarHBondContact OE1-CB 2.8Å; E766-W778 PolarHBondContact OE1-NE1 2.97Å
767	R	88.1	Confident	88.7	Confident	98 Å²	98	53.4 Å²	53.4	37%	0.37	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	120.4	-178.6	-165.7	-176.2	-66.4	-90	9.4	110	G771 K772	R767-G771 WeakPolarHBondContact CG-O 3.11Å; R767-G771 PolarHBondContact NH1-O 3.13Å; R767-K772 WeakPolarHBondContact CA-O 3.49Å
768	Q	87	Confident	88.7	Confident	89 Å²	89	52 Å²	52	42%	0.416	28%	0.277	S	S	.	.			trans	-82.6	168.5	178.2	-58.7	-54.3	-60.4	0	0	111.8	E766 D770 G771 K772 S774	E766-Q768 PolarHBondContact O-N 2.99Å; E766-Q768 PolarHBondContact O-NE2 2.83Å; Q768-D770 PolarHBondContact O-N 3.3Å; Q768-D770 VanDerWaalsContact O-N 3.13Å; Q768-G771 WeakPolarHBondContact O-CA 3.35Å; Q768-G771 PolarHBondContact O-N 2.97Å; Q768-K772 PolarHBondContact N-O 2.88Å; Q768-S774 VanDerWaalsContact CD-OG 3.22Å; Q768-S774 WeakPolarHBondContact CG-OG 3.32Å; Q768-S774 PolarHBondContact NE2-OG 3.31Å; Q768-S774 VanDerWaalsContact NE2-OG 3.08Å
769	A	83.1	Confident	88.4	Confident	117 Å²	117	53.3 Å²	53.3	97%	0.967	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.2	179.7	0	0	0	0	0	114.3	G771	A769-G771 VanDerWaalsContact C-N 3.25Å
770	D	80.6	Confident	88	Confident	94 Å²	94	57.9 Å²	57.9	50%	0.503	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	5.6	172.2	81.6	-25.2	0	0	0	113.5	Q768 K772	Q768-D770 PolarHBondContact O-N 3.3Å; Q768-D770 VanDerWaalsContact O-N 3.13Å; D770-K772 VanDerWaalsContact C-N 3.29Å; D770-K772 PolarHBondContact O-N 2.75Å; D770-K772 WeakPolarHBondContact OD1-CB 3.26Å; D770-K772 PolarHBondContact OD1-N 3.29Å; D770-K772 WeakPolarHBondContact OD2-CD 3.41Å; D770-K772 WeakPolarHBondContact OD2-CG 3.46Å; D770-K772 IonicContact OD2-NZ 3.38Å; D770-K772 PolarHBondContact OD2-NZ 3.35Å
771	G	81.4	Confident	87.3	Confident	35 Å²	35	59.5 Å²	59.5	36%	0.361	32%	0.318	S	S	.	.	S	Bend	trans	81.8	-7.9	-179.1	0	0	0	0	0	115.2	R767 Q768 A769	R767-G771 WeakPolarHBondContact CG-O 3.11Å; R767-G771 PolarHBondContact NH1-O 3.13Å; Q768-G771 WeakPolarHBondContact O-CA 3.35Å; Q768-G771 PolarHBondContact O-N 2.97Å; A769-G771 VanDerWaalsContact C-N 3.25Å
772	K	88.3	Confident	86.1	Confident	118 Å²	118	65.8 Å²	65.8	51%	0.513	35%	0.351	S	S	.	.			trans	-85.4	151	-178.6	-58.2	-169.8	-166.1	83.5	0	111.9	R767 Q768 D770 Y800	R767-K772 WeakPolarHBondContact CA-O 3.49Å; Q768-K772 PolarHBondContact N-O 2.88Å; D770-K772 VanDerWaalsContact C-N 3.29Å; D770-K772 PolarHBondContact O-N 2.75Å; D770-K772 WeakPolarHBondContact OD1-CB 3.26Å; D770-K772 PolarHBondContact OD1-N 3.29Å; D770-K772 WeakPolarHBondContact OD2-CD 3.41Å; D770-K772 WeakPolarHBondContact OD2-CG 3.46Å; D770-K772 IonicContact OD2-NZ 3.38Å; D770-K772 PolarHBondContact OD2-NZ 3.35Å; K772-Y800 WeakPolarHBondContact CA-OH 3.04Å; K772-Y800 WeakPolarHBondContact CB-OH 3.13Å
773	C	90.8	Very high	84.5	Confident	10 Å²	10	65.6 Å²	65.6	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.7	168.2	-54.2	0	0	0	0	109.7	C761 W765 G799 Y800	C761-C773 WeakPolarHBondContact CA-SG 3.33Å; C761-C773 HydrophobicContact CB-CB 3.77Å; C761-C773 WeakPolarHBondContact CB-SG 3.28Å; C761-C773 WeakPolarHBondContact SG-CB 3.4Å; C761-C773 CovalentContact SG-SG 2.04Å; C761-C773 PolarHBondContact SG-SG 3.26Å; W765-C773 HydrophobicContact CB-CB 4.25Å; W765-C773 HydrophobicContact CE3-CB 4.44Å; C773-G799 WeakPolarHBondContact CB-O 3.33Å; C773-Y800 HydrophobicContact CB-CD1 4.33Å; C773-Y800 HydrophobicContact CB-CD2 4.46Å; C773-Y800 HydrophobicContact CB-CE1 3.92Å; C773-Y800 HydrophobicContact CB-CE2 4.04Å; C773-Y800 PolarHBondContact N-OH 2.93Å; C773-Y800 WeakPolarHBondContact SG-CE1 3.44Å
774	S	91.7	Very high	82.8	Confident	38 Å²	38	66.8 Å²	66.8	27%	0.266	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	156.5	169.9	67.7	0	0	0	0	110	W765 E766 Q768 A776	W765-S774 CarbonylContact C-O 3.5Å; W765-S774 VanDerWaalsContact CA-O 3.23Å; W765-S774 WeakPolarHBondContact CA-O 3.48Å; E766-S774 PolarHBondContact N-O 2.82Å; E766-S774 PolarHBondContact O-N 3.33Å; E766-S774 VanDerWaalsContact O-N 3.08Å; Q768-S774 VanDerWaalsContact CD-OG 3.22Å; Q768-S774 WeakPolarHBondContact CG-OG 3.32Å; Q768-S774 PolarHBondContact NE2-OG 3.31Å; Q768-S774 VanDerWaalsContact NE2-OG 3.08Å; S774-A776 PolarHBondContact O-N 2.84Å
775	P	90.7	Very high	80.9	Confident	59 Å²	59	67.8 Å²	67.8	38%	0.383	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	135.7	177.6	29.8	-33.6	0	0	0	108.9	W765 F779 P781	W765-P775 HydrophobicContact CD2-CB 4.23Å; W765-P775 HydrophobicContact CE3-CB 4.36Å; W765-P775 HydrophobicContact CH2-CB 4.43Å; W765-P775 HydrophobicContact CH2-CG 4.44Å; W765-P775 HydrophobicContact CZ2-CB 4.32Å; W765-P775 HydrophobicContact CZ3-CB 4.46Å; W765-P775 VanDerWaalsContact CZ3-CD 3.48Å; W765-P775 HydrophobicContact CZ3-CG 4.39Å; P775-F779 HydrophobicContact CB-CD1 4.33Å; P775-P781 HydrophobicContact CB-CG 3.74Å; P775-P781 HydrophobicContact CG-CG 4.3Å
776	A	89.7	Confident	79.1	Confident	3 Å²	3	71.3 Å²	71.3	3%	0.025	39%	0.394	C	S	.	.			trans	-64.2	150.5	175	0	0	0	0	0	110.7	G764 E766 S774 W778 F779	G764-A776 WeakPolarHBondContact O-CB 3.36Å; G764-A776 PolarHBondContact O-N 2.77Å; E766-A776 HydrophobicContact CG-CB 3.94Å; E766-A776 WeakPolarHBondContact OE1-CB 2.8Å; S774-A776 PolarHBondContact O-N 2.84Å; A776-W778 HydrophobicContact CB-CD2 4.18Å; A776-W778 HydrophobicContact CB-CG 4.13Å; A776-W778 HydrophobicContact CB-CZ2 4.26Å; A776-W778 PolarHBondContact O-N 3.05Å; A776-F779 HydrophobicContact CB-CB 4.24Å; A776-F779 PolarHBondContact O-N 3.26Å
777	F	89.1	Confident	77.3	Confident	173 Å²	173	69.6 Å²	69.6	76%	0.759	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.7	-177.7	78.9	-86.6	0	0	0	113.8	Y437	Y437-F777 HydrophobicContact CD2-CE2 4.02Å; Y437-F777 AromaticContact CD2-CZ 3.63Å; Y437-F777 HydrophobicContact CD2-CZ 3.63Å; Y437-F777 AromaticContact CE2-CE2 3.7Å; Y437-F777 HydrophobicContact CE2-CE2 3.7Å; Y437-F777 AromaticContact CE2-CZ 3.83Å; Y437-F777 HydrophobicContact CE2-CZ 3.83Å
778	W	86.7	Confident	75.7	Confident	33 Å²	33	66.8 Å²	66.8	13%	0.125	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-7	-178.3	60.6	-97.9	0	0	0	114	P435 K436 Y437 Y763 E766 A776	P435-W778 HydrophobicContact CB-CH2 4.21Å; P435-W778 HydrophobicContact CB-CZ2 3.61Å; P435-W778 HydrophobicContact CG-CZ2 4.37Å; K436-W778 HydrophobicContact CB-CB 4.41Å; K436-W778 HydrophobicContact CB-CD2 3.79Å; K436-W778 HydrophobicContact CB-CE3 3.33Å; K436-W778 HydrophobicContact CB-CG 4.27Å; K436-W778 HydrophobicContact CB-CZ3 3.84Å; K436-W778 HydrophobicContact CD-CB 4.39Å; K436-W778 HydrophobicContact CD-CE3 4.35Å; K436-W778 HydrophobicContact CG-CE3 4.47Å; Y437-W778 HydrophobicContact CD2-CB 3.7Å; Y437-W778 HydrophobicContact CD2-CG 4.18Å; Y437-W778 HydrophobicContact CE2-CB 3.46Å; Y437-W778 VanDerWaalsContact CE2-CB 3.46Å; Y437-W778 HydrophobicContact CE2-CG 4.41Å; Y763-W778 HydrophobicContact CE1-CH2 4.12Å; Y763-W778 HydrophobicContact CE1-CZ3 4.18Å; Y763-W778 HydrophobicContact CE2-CH2 4.09Å; Y763-W778 AromaticContact CZ-CH2 3.77Å; Y763-W778 AromaticContact CZ-CZ3 4Å; E766-W778 PolarHBondContact OE1-NE1 2.97Å; A776-W778 HydrophobicContact CB-CD2 4.18Å; A776-W778 HydrophobicContact CB-CG 4.13Å; A776-W778 HydrophobicContact CB-CZ2 4.26Å; A776-W778 PolarHBondContact O-N 3.05Å
779	F	84.9	Confident	74.3	Confident	29 Å²	29	64.7 Å²	64.7	13%	0.127	38%	0.38	C	S	.	.			trans	-115.6	132.9	-171.1	-177.2	-97.7	0	0	0	111.7	Y763 G764 W765 P775 A776 P781 V784	Y763-F779 HydrophobicContact CD1-CE2 4.01Å; Y763-F779 HydrophobicContact CE1-CD2 4.45Å; Y763-F779 HydrophobicContact CE1-CE2 4.2Å; Y763-F779 WeakPolarHBondContact O-CE2 3.15Å; Y763-F779 VanDerWaalsContact O-CZ 3.29Å; Y763-F779 WeakPolarHBondContact O-CZ 3.32Å; G764-F779 VanDerWaalsContact O-CB 3.32Å; G764-F779 WeakPolarHBondContact O-CB 3.36Å; G764-F779 VanDerWaalsContact O-CD1 3.31Å; G764-F779 WeakPolarHBondContact O-CD1 3.04Å; G764-F779 WeakPolarHBondContact O-CG 3.34Å; W765-F779 AromaticContact CD1-CE1 3.83Å; W765-F779 AromaticContact NE1-CE1 3.37Å; P775-F779 HydrophobicContact CB-CD1 4.33Å; A776-F779 HydrophobicContact CB-CB 4.24Å; A776-F779 PolarHBondContact O-N 3.26Å; F779-P781 HydrophobicContact CD1-CG 4.06Å; F779-P781 HydrophobicContact CE1-CB 4.31Å; F779-P781 HydrophobicContact CE1-CG 3.97Å; F779-V784 HydrophobicContact CE1-CG2 4.47Å; F779-V784 HydrophobicContact CE2-CG2 3.58Å; F779-V784 HydrophobicContact CZ-CB 4.35Å; F779-V784 HydrophobicContact CZ-CG2 3.55Å
780	N	81.8	Confident	72.9	Confident	100 Å²	100	63.9 Å²	63.9	54%	0.535	37%	0.368	S	S	.	.			trans	-113.1	106.7	176.1	-177.8	-10.4	0	0	0	109.7	N782 G783	N780-N782 PolarHBondContact O-N 2.88Å; N780-N782 VanDerWaalsContact O-N 3.14Å; N780-N782 WeakPolarHBondContact OD1-CB 3.34Å; N780-N782 PolarHBondContact OD1-N 3.08Å; N780-G783 PolarHBondContact O-N 3.37Å
781	P	75.7	Confident	71.8	Confident	39 Å²	39	64.7 Å²	64.7	25%	0.253	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.6	178.9	-28.3	35.9	0	0	0	114.1	W765 P775 F779 G783 V784	W765-P781 HydrophobicContact CH2-CG 4.29Å; W765-P781 HydrophobicContact CZ2-CB 4Å; W765-P781 HydrophobicContact CZ2-CG 3.58Å; P775-P781 HydrophobicContact CB-CG 3.74Å; P775-P781 HydrophobicContact CG-CG 4.3Å; F779-P781 HydrophobicContact CD1-CG 4.06Å; F779-P781 HydrophobicContact CE1-CB 4.31Å; F779-P781 HydrophobicContact CE1-CG 3.97Å; P781-G783 PolarHBondContact O-N 2.85Å; P781-V784 PolarHBondContact O-N 2.93Å
782	N	66.8	Low	70.9	Confident	142 Å²	142	68.3 Å²	68.3	76%	0.759	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.1	179.4	-60.9	-41.6	0	0	0	112.8	N780	N780-N782 PolarHBondContact O-N 2.88Å; N780-N782 VanDerWaalsContact O-N 3.14Å; N780-N782 WeakPolarHBondContact OD1-CB 3.34Å; N780-N782 PolarHBondContact OD1-N 3.08Å
783	G	58.8	Low	69.9	Low	35 Å²	35	65 Å²	65	36%	0.361	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-35.2	176.2	0	0	0	0	0	113.2	N780 P781 A785 K826	N780-G783 PolarHBondContact O-N 3.37Å; P781-G783 PolarHBondContact O-N 2.85Å; G783-A785 VanDerWaalsContact C-N 3.26Å; G783-A785 PolarHBondContact O-N 2.93Å; G783-A785 VanDerWaalsContact O-N 3.14Å; G783-K826 PolarHBondContact O-NZ 3.44Å
784	V	53.4	Low	69	Low	62 Å²	62	66.1 Å²	66.1	38%	0.376	38%	0.384	S	S	.	.			trans	-83.2	8.2	-160.9	-172.6	0	0	0	0	114.5	F779 P781 K786	F779-V784 HydrophobicContact CE1-CG2 4.47Å; F779-V784 HydrophobicContact CE2-CG2 3.58Å; F779-V784 HydrophobicContact CZ-CB 4.35Å; F779-V784 HydrophobicContact CZ-CG2 3.55Å; P781-V784 PolarHBondContact O-N 2.93Å; V784-K786 PolarHBondContact O-N 3.1Å
785	A	50.5	Low	68.1	Low	26 Å²	26	69.6 Å²	69.6	22%	0.215	40%	0.399	C	S	.	.			trans	-60.1	99.8	162.7	0	0	0	0	0	109.9	G783 F794 K826	G783-A785 VanDerWaalsContact C-N 3.26Å; G783-A785 PolarHBondContact O-N 2.93Å; G783-A785 VanDerWaalsContact O-N 3.14Å; A785-F794 HydrophobicContact CB-CE1 4.02Å; A785-F794 HydrophobicContact CB-CE2 4.15Å; A785-F794 HydrophobicContact CB-CZ 3.5Å; A785-K826 WeakPolarHBondContact O-CE 3.34Å; A785-K826 PolarHBondContact O-NZ 3.17Å
786	K	52.9	Low	67.5	Low	120 Å²	120	68.8 Å²	68.8	52%	0.522	39%	0.391	S	S	.	.			trans	-56.7	149.1	-174.7	-68.9	177.2	177.7	173.5	0	111.4	V784 C788	V784-K786 PolarHBondContact O-N 3.1Å; K786-C788 PolarHBondContact O-N 3.34Å; K786-C788 VanDerWaalsContact O-N 3.12Å
787	S	50.7	Low	67.2	Low	41 Å²	41	70.2 Å²	70.2	29%	0.287	40%	0.401	S	S	.	.			trans	-59.5	116.6	168.6	-154.8	0	0	0	0	108.3	G857 E858	S787-G857 PolarHBondContact OG-N 3.01Å; S787-E858 WeakPolarHBondContact OG-CB 3.25Å; S787-E858 PolarHBondContact OG-N 3.46Å; S787-E858 VanDerWaalsContact OG-N 3.14Å
788	C	55.9	Low	67.1	Low	39 Å²	39	63.3 Å²	63.3	26%	0.264	37%	0.373	S	S	.	.			trans	-150.7	145.7	-172.2	-74.8	0	0	0	0	109.2	K786 C823	K786-C788 PolarHBondContact O-N 3.34Å; K786-C788 VanDerWaalsContact O-N 3.12Å; C788-C823 HydrophobicContact CB-CB 4.07Å; C788-C823 WeakPolarHBondContact CB-SG 3.31Å
789	S	56.2	Low	67.1	Low	45 Å²	45	61.7 Å²	61.7	32%	0.315	37%	0.367	S	S	.	.			trans	-68	153.3	-177.6	55.9	0	0	0	0	112.7	S791 Q792	S789-S791 PolarHBondContact O-N 2.91Å; S789-Q792 PolarHBondContact O-N 2.66Å; S789-Q792 WeakPolarHBondContact OG-CG 3.4Å
790	S	54.1	Low	67.4	Low	101 Å²	101	61.9 Å²	61.9	71%	0.706	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-4.1	-171.4	47.7	0	0	0	0	115.8
791	S	56.9	Low	67.7	Low	111 Å²	111	58.5 Å²	58.5	78%	0.776	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-5.2	174.1	56.8	0	0	0	0	114	S789	S789-S791 PolarHBondContact O-N 2.91Å
792	Q	64.3	Low	68.4	Low	110 Å²	110	59.7 Å²	59.7	51%	0.514	35%	0.348	S	S	.	.			trans	-95.1	165.8	-177.3	-67.3	-178	-4.6	0	0	112.6	S789 C823	S789-Q792 PolarHBondContact O-N 2.66Å; S789-Q792 WeakPolarHBondContact OG-CG 3.4Å; Q792-C823 WeakPolarHBondContact O-CB 3.08Å; Q792-C823 PolarHBondContact O-N 3.16Å; Q792-C823 VanDerWaalsContact O-N 3.11Å; Q792-C823 PolarHBondContact O-SG 3.24Å
793	S	66.3	Low	69.6	Low	50 Å²	50	53 Å²	53	35%	0.35	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	123.2	170.4	66.9	0	0	0	0	109.5	R820 M821	S793-R820 VanDerWaalsContact OG-CD 3.29Å; S793-R820 WeakPolarHBondContact OG-CD 3.37Å; S793-R820 WeakPolarHBondContact OG-CG 3.47Å; S793-R820 PolarHBondContact OG-NE 2.82Å; S793-M821 CarbonylContact C-O 3.57Å; S793-M821 WeakPolarHBondContact CA-O 3.39Å; S793-M821 WeakPolarHBondContact CB-O 3.19Å
794	F	70.9	Confident	71	Confident	32 Å²	32	53.7 Å²	53.7	14%	0.14	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	157.5	176.2	72.9	-78.1	0	0	0	111	A785 N796 R820 M821	A785-F794 HydrophobicContact CB-CE1 4.02Å; A785-F794 HydrophobicContact CB-CE2 4.15Å; A785-F794 HydrophobicContact CB-CZ 3.5Å; F794-N796 HydrophobicContact CD2-CB 4.17Å; F794-N796 HydrophobicContact CE2-CB 3.55Å; F794-N796 HydrophobicContact CZ-CB 4.18Å; F794-R820 WeakPolarHBondContact O-CA 3.49Å; F794-M821 HydrophobicContact CD1-CB 4.47Å; F794-M821 HydrophobicContact CE1-CB 3.97Å; F794-M821 HydrophobicContact CZ-CB 4.12Å; F794-M821 PolarHBondContact N-O 2.92Å; F794-M821 PolarHBondContact O-N 3.26Å
795	L	74	Confident	72.7	Confident	111 Å²	111	53.2 Å²	53.2	58%	0.581	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	111	167.8	-69	176.1	0	0	0	107.5	P818 R820	L795-P818 HydrophobicContact CB-CB 4.08Å; L795-P818 HydrophobicContact CB-CG 4.21Å; L795-P818 HydrophobicContact CD1-CG 4.28Å; L795-R820 HydrophobicContact CD2-CB 4.04Å
796	N	78.6	Confident	74.6	Confident	43 Å²	43	52.5 Å²	52.5	23%	0.23	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	138.1	174.8	-166.9	20.4	0	0	0	110.2	F794 P818 K819 M821	F794-N796 HydrophobicContact CD2-CB 4.17Å; F794-N796 HydrophobicContact CE2-CB 3.55Å; F794-N796 HydrophobicContact CZ-CB 4.18Å; N796-P818 CarbonylContact O-C 3.59Å; N796-P818 VanDerWaalsContact O-CA 3.3Å; N796-P818 WeakPolarHBondContact O-CA 3.43Å; N796-P818 VanDerWaalsContact O-CB 3.27Å; N796-P818 WeakPolarHBondContact O-CB 3.46Å; N796-K819 PolarHBondContact N-O 2.83Å; N796-K819 PolarHBondContact O-N 3.1Å; N796-M821 HydrophobicContact CB-CG 4.05Å; N796-M821 HydrophobicContact CB-SD 3.59Å; N796-M821 VanDerWaalsContact CB-SD 3.59Å; N796-M821 PolarHBondContact ND2-SD 2.78Å
797	S	83.3	Confident	76.5	Confident	33 Å²	33	51 Å²	51	23%	0.231	30%	0.297	C	S	.	.			trans	-68.3	147	179.6	-168	0	0	0	0	111.7	D762 G799	D762-S797 WeakPolarHBondContact CB-OG 3.3Å; D762-S797 WeakPolarHBondContact OD2-CB 3.09Å; D762-S797 PolarHBondContact OD2-OG 3.35Å; S797-G799 VanDerWaalsContact C-N 3.31Å; S797-G799 PolarHBondContact OG-N 3.01Å; S797-G799 VanDerWaalsContact OG-N 3.08Å
798	T	86	Confident	78.4	Confident	27 Å²	27	49.4 Å²	49.4	17%	0.166	29%	0.286	C	S	.	.			trans	-88.4	-4.7	167.7	57.5	0	0	0	0	112.1	Y800 Y816 S817 K819	T798-Y800 PolarHBondContact OG1-N 2.84Å; T798-Y800 PolarHBondContact OG1-O 3.03Å; T798-Y816 WeakPolarHBondContact CG2-O 3.4Å; T798-Y816 PolarHBondContact OG1-O 3.36Å; T798-S817 VanDerWaalsContact CG2-O 3.29Å; T798-S817 WeakPolarHBondContact CG2-O 3.12Å; T798-K819 HydrophobicContact CG2-CG 4.37Å
799	G	88.2	Confident	80	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	94.9	-3.7	-162.1	0	0	0	0	0	114.4	C761 D762 W765 C773 S797	C761-G799 WeakPolarHBondContact CA-O 3.45Å; D762-G799 PolarHBondContact N-O 3.29Å; W765-G799 VanDerWaalsContact CE3-CA 3.46Å; C773-G799 WeakPolarHBondContact CB-O 3.33Å; S797-G799 VanDerWaalsContact C-N 3.31Å; S797-G799 PolarHBondContact OG-N 3.01Å; S797-G799 VanDerWaalsContact OG-N 3.08Å
800	Y	89.7	Confident	81.3	Confident	32 Å²	32	54.7 Å²	54.7	13%	0.125	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.3	179.3	-61.2	-100.7	0	0	0	110.5	F759 E760 K772 C773 T798 Y816	F759-Y800 HydrophobicContact CB-CD1 4.17Å; E760-Y800 CarbonylContact O-C 3.6Å; E760-Y800 WeakPolarHBondContact O-CA 3.47Å; K772-Y800 WeakPolarHBondContact CA-OH 3.04Å; K772-Y800 WeakPolarHBondContact CB-OH 3.13Å; C773-Y800 HydrophobicContact CB-CD1 4.33Å; C773-Y800 HydrophobicContact CB-CD2 4.46Å; C773-Y800 HydrophobicContact CB-CE1 3.92Å; C773-Y800 HydrophobicContact CB-CE2 4.04Å; C773-Y800 PolarHBondContact N-OH 2.93Å; C773-Y800 WeakPolarHBondContact SG-CE1 3.44Å; T798-Y800 PolarHBondContact OG1-N 2.84Å; T798-Y800 PolarHBondContact OG1-O 3.03Å; Y800-Y816 AromaticContact CD1-CD1 3.76Å; Y800-Y816 HydrophobicContact CD1-CD1 3.76Å; Y800-Y816 HydrophobicContact CD1-CE1 4.26Å; Y800-Y816 AromaticContact CD2-CD1 3.92Å; Y800-Y816 HydrophobicContact CD2-CD1 3.92Å; Y800-Y816 AromaticContact CE1-CD1 3.97Å; Y800-Y816 HydrophobicContact CE1-CD1 3.97Å; Y800-Y816 HydrophobicContact CE1-CE1 4.01Å; Y800-Y816 HydrophobicContact CE2-CD1 4.15Å; Y800-Y816 HydrophobicContact CE2-CE1 4.42Å; Y800-Y816 AromaticContact CG-CD1 3.73Å; Y800-Y816 HydrophobicContact CG-CD1 3.73Å
801	R	89.5	Confident	82.3	Confident	30 Å²	30	56.7 Å²	56.7	11%	0.113	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.9	167.7	67.6	-175	-164.9	-164.2	3.3	109.5	S471 Y477 F759 E760 D762	S471-R801 PolarHBondContact O-NH2 3.31Å; Y477-R801 PolarHBondContact O-NH1 3.45Å; Y477-R801 VanDerWaalsContact O-NH1 3.1Å; F759-R801 CarbonylContact C-O 3.45Å; F759-R801 WeakPolarHBondContact CA-O 3.34Å; E760-R801 HydrophobicContact CG-CG 3.64Å; E760-R801 PolarHBondContact N-O 3.17Å; E760-R801 PolarHBondContact O-N 2.91Å; E760-R801 IonicContact OE1-CZ 3.79Å; E760-R801 IonicContact OE1-NE 3.61Å; E760-R801 PolarHBondContact OE1-NE 3.28Å; E760-R801 IonicContact OE1-NH2 3.27Å; E760-R801 PolarHBondContact OE1-NH2 3.14Å; D762-R801 HydrophobicContact CB-CB 4.41Å; D762-R801 HydrophobicContact CB-CG 4.45Å; D762-R801 WeakPolarHBondContact OD1-CD 3.17Å
802	K	89.8	Confident	82.8	Confident	63 Å²	63	55 Å²	55	27%	0.274	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	137.4	178.4	-158.9	-168.5	-165.8	-167.9	0	109.1	F759 L804 N806 C808	F759-K802 HydrophobicContact CD1-CB 4.1Å; F759-K802 HydrophobicContact CD1-CG 4.46Å; F759-K802 HydrophobicContact CE1-CB 3.94Å; F759-K802 HydrophobicContact CE1-CG 4.18Å; F759-K802 HydrophobicContact CZ-CG 4.49Å; K802-L804 PolarHBondContact O-N 3.27Å; K802-N806 VanDerWaalsContact CE-O 3.31Å; K802-N806 WeakPolarHBondContact CE-O 3.44Å; K802-N806 WeakPolarHBondContact CE-OD1 3.39Å; K802-N806 PolarHBondContact NZ-O 3.44Å; K802-C808 WeakPolarHBondContact CE-SG 3.47Å; K802-C808 PolarHBondContact NZ-O 2.99Å
803	V	91	Very high	82.6	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.018	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-59.6	133.8	174.5	177.9	0	0	0	0	109.1	K527 M722 D758 E760 N806	K527-V803 HydrophobicContact CB-CG1 3.92Å; K527-V803 HydrophobicContact CD-CG1 4.25Å; M722-V803 HydrophobicContact CE-CG1 4.01Å; M722-V803 HydrophobicContact SD-CG1 4.24Å; D758-V803 PolarHBondContact O-N 2.81Å; E760-V803 HydrophobicContact CB-CG2 4.12Å; E760-V803 HydrophobicContact CG-CG2 4.19Å; V803-N806 HydrophobicContact CB-CB 4.19Å; V803-N806 WeakPolarHBondContact O-CB 3.34Å; V803-N806 PolarHBondContact O-N 3.46Å; V803-N806 VanDerWaalsContact O-N 3.14Å
804	L	89.5	Confident	82.7	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.257	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	138.8	-175.5	-74.1	166.5	0	0	0	111.5	Q452 K527 M722 K802 N806	Q452-L804 HydrophobicContact CB-CD1 4.06Å; Q452-L804 HydrophobicContact CG-CD1 3.83Å; K527-L804 WeakPolarHBondContact CD-O 3.24Å; K527-L804 PolarHBondContact NZ-O 2.96Å; M722-L804 WeakPolarHBondContact CE-O 3.4Å; K802-L804 PolarHBondContact O-N 3.27Å; L804-N806 PolarHBondContact O-N 3.35Å
805	S	88.5	Confident	82.9	Confident	52 Å²	52	65.6 Å²	65.6	36%	0.364	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	11.2	-168.1	-50.3	0	0	0	0	115.3	E450	E450-S805 PolarHBondContact O-OG 2.9Å
806	N	90.7	Very high	83.2	Confident	10 Å²	10	63.8 Å²	63.8	5%	0.053	33%	0.327	C	S	.	.			trans	-79.6	127	168.6	-176.5	-58.8	0	0	0	111	M722 G723 D758 K802 V803 L804 C808	M722-N806 VanDerWaalsContact C-CG 3.47Å; M722-N806 HydrophobicContact CE-CB 4.5Å; M722-N806 CarbonylContact O-C 3.18Å; M722-N806 VanDerWaalsContact O-CA 3.28Å; M722-N806 WeakPolarHBondContact O-CA 3.49Å; M722-N806 PolarHBondContact O-OD1 3.28Å; G723-N806 PolarHBondContact N-ND2 2.86Å; D758-N806 WeakPolarHBondContact CB-ND2 3.45Å; D758-N806 PolarHBondContact OD1-ND2 2.93Å; K802-N806 VanDerWaalsContact CE-O 3.31Å; K802-N806 WeakPolarHBondContact CE-O 3.44Å; K802-N806 WeakPolarHBondContact CE-OD1 3.39Å; K802-N806 PolarHBondContact NZ-O 3.44Å; V803-N806 HydrophobicContact CB-CB 4.19Å; V803-N806 WeakPolarHBondContact O-CB 3.34Å; V803-N806 PolarHBondContact O-N 3.46Å; V803-N806 VanDerWaalsContact O-N 3.14Å; L804-N806 PolarHBondContact O-N 3.35Å; N806-C808 WeakPolarHBondContact OD1-CB 3.26Å; N806-C808 PolarHBondContact OD1-N 2.78Å; N806-C808 PolarHBondContact OD1-SG 3.25Å
807	N	91.7	Very high	83.2	Confident	89 Å²	89	62.4 Å²	62.4	48%	0.476	32%	0.321	S	S	.	.			trans	-104.8	14.6	-171.3	-77.5	-11.2	0	0	0	115	M722 E724 P751	M722-N807 PolarHBondContact O-N 3.25Å; E724-N807 HydrophobicContact CG-CB 3.67Å; E724-N807 WeakPolarHBondContact OE1-CB 3.33Å; E724-N807 PolarHBondContact OE1-ND2 3.14Å; P751-N807 WeakPolarHBondContact CB-O 3.42Å
808	C	91.2	Very high	83	Confident	7 Å²	7	63.7 Å²	63.7	5%	0.047	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-59.7	151.2	175.5	72.2	0	0	0	0	112.2	G723 C752 C754 D758 K802 N806	G723-C808 WeakPolarHBondContact O-CA 3.41Å; G723-C808 PolarHBondContact O-N 3.22Å; C752-C808 CarbonylContact O-C 3.54Å; C752-C808 WeakPolarHBondContact O-CA 3.05Å; C754-C808 WeakPolarHBondContact CA-SG 3.24Å; C754-C808 HydrophobicContact CB-CB 3.89Å; C754-C808 WeakPolarHBondContact CB-SG 3.29Å; C754-C808 WeakPolarHBondContact SG-CB 3.04Å; C754-C808 PolarHBondContact SG-O 3.05Å; C754-C808 VanDerWaalsContact SG-O 3.33Å; C754-C808 CovalentContact SG-SG 2.03Å; C754-C808 PolarHBondContact SG-SG 3.3Å; D758-C808 VanDerWaalsContact CB-SG 3.54Å; D758-C808 VanDerWaalsContact CG-SG 3.58Å; K802-C808 WeakPolarHBondContact CE-SG 3.47Å; K802-C808 PolarHBondContact NZ-O 2.99Å; N806-C808 WeakPolarHBondContact OD1-CB 3.26Å; N806-C808 PolarHBondContact OD1-N 2.78Å; N806-C808 PolarHBondContact OD1-SG 3.25Å
809	K	90.4	Very high	82.8	Confident	115 Å²	115	68.6 Å²	68.6	50%	0.5	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-93.4	130.1	174.3	-72.8	169.2	173.5	168.2	0	110.6	P751 C752 P753 C754 E811	P751-K809 HydrophobicContact CB-CD 4.39Å; P751-K809 HydrophobicContact CB-CG 4.32Å; P751-K809 HydrophobicContact CG-CD 4.06Å; P751-K809 VanDerWaalsContact CG-CE 3.47Å; P751-K809 HydrophobicContact CG-CG 4.44Å; C752-K809 PolarHBondContact O-N 3.19Å; P753-K809 CarbonylContact C-O 3.39Å; P753-K809 WeakPolarHBondContact CA-O 3.42Å; C754-K809 PolarHBondContact N-O 3.01Å; C754-K809 PolarHBondContact SG-O 2.96Å; C754-K809 VanDerWaalsContact SG-O 3.36Å; K809-E811 PolarHBondContact O-N 3.27Å
810	E	83.3	Confident	82.3	Confident	81 Å²	81	77.8 Å²	77.8	38%	0.379	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-77.9	117.3	174.6	-64.3	-175	-174.1	0	0	110.1	C754 N814 S817	C754-E810 HydrophobicContact CB-CG 4.41Å; E810-N814 PolarHBondContact OE2-ND2 2.89Å; E810-S817 PolarHBondContact OE1-OG 3.42Å; E810-S817 VanDerWaalsContact OE2-CB 3.26Å; E810-S817 WeakPolarHBondContact OE2-CB 3.02Å; E810-S817 PolarHBondContact OE2-OG 3.43Å
811	E	74.4	Confident	81.5	Confident	143 Å²	143	80.4 Å²	80.4	67%	0.668	40%	0.397	S	S	*	.			trans	-121.7	138.7	178.1	-64.6	-172.6	171.3	0	0	110.7	K809	K809-E811 PolarHBondContact O-N 3.27Å
812	G	67.8	Low	80.6	Confident	74 Å²	74	82.7 Å²	82.7	76%	0.763	42%	0.422	S	S	*	.	S	Bend	trans	90.9	-134	178	0	0	0	0	0	114.3
813	R	59.8	Low	79.6	Confident	232 Å²	232	80.4 Å²	80.4	88%	0.875	41%	0.413	S	S	*	.	S	Bend	trans	-91.9	122.4	175.7	-77.8	-175.3	175.1	-179.4	-0.3	109.6	V815	R813-V815 VanDerWaalsContact C-N 3.28Å; R813-V815 PolarHBondContact O-N 3.45Å
814	N	69.2	Low	78.6	Confident	93 Å²	93	90.8 Å²	90.8	50%	0.497	45%	0.452	S	S	.	.			trans	-65.6	80.8	175	-59.9	54.4	0	0	0	110.9	E810 S817	E810-N814 PolarHBondContact OE2-ND2 2.89Å; N814-S817 VanDerWaalsContact CB-OG 3.32Å; N814-S817 WeakPolarHBondContact CB-OG 3.16Å; N814-S817 PolarHBondContact ND2-OG 2.91Å
815	V	74.6	Confident	77.6	Confident	91 Å²	91	91.6 Å²	91.6	55%	0.552	46%	0.46	S	S	*	.	S	Bend	trans	-76.5	-44	-179.6	171.2	0	0	0	0	111.3	R813	R813-V815 VanDerWaalsContact C-N 3.28Å; R813-V815 PolarHBondContact O-N 3.45Å
816	Y	79.7	Confident	76.8	Confident	73 Å²	73	91.3 Å²	91.3	29%	0.286	45%	0.453	S	S	.	.	S	Bend	trans	-89	-33.2	-176.9	-54.3	-70.1	0	0	0	112.7	F759 T798 Y800	F759-Y816 AromaticContact CD2-CD2 3.93Å; F759-Y816 HydrophobicContact CD2-CD2 3.93Å; F759-Y816 AromaticContact CD2-CG 3.96Å; F759-Y816 HydrophobicContact CD2-CG 3.96Å; F759-Y816 AromaticContact CE2-CD2 3.92Å; F759-Y816 HydrophobicContact CE2-CD2 3.92Å; F759-Y816 HydrophobicContact CE2-CG 4.2Å; F759-Y816 HydrophobicContact CG-CG 4.14Å; T798-Y816 WeakPolarHBondContact CG2-O 3.4Å; T798-Y816 PolarHBondContact OG1-O 3.36Å; Y800-Y816 AromaticContact CD1-CD1 3.76Å; Y800-Y816 HydrophobicContact CD1-CD1 3.76Å; Y800-Y816 HydrophobicContact CD1-CE1 4.26Å; Y800-Y816 AromaticContact CD2-CD1 3.92Å; Y800-Y816 HydrophobicContact CD2-CD1 3.92Å; Y800-Y816 AromaticContact CE1-CD1 3.97Å; Y800-Y816 HydrophobicContact CE1-CD1 3.97Å; Y800-Y816 HydrophobicContact CE1-CE1 4.01Å; Y800-Y816 HydrophobicContact CE2-CD1 4.15Å; Y800-Y816 HydrophobicContact CE2-CE1 4.42Å; Y800-Y816 AromaticContact CG-CD1 3.73Å; Y800-Y816 HydrophobicContact CG-CD1 3.73Å
817	S	79.2	Confident	76.3	Confident	13 Å²	13	93 Å²	93	9%	0.091	46%	0.464	C	S	.	.	S	Bend	trans	-63.9	143	-177.5	-11.9	0	0	0	0	112.1	T798 E810 N814	T798-S817 VanDerWaalsContact CG2-O 3.29Å; T798-S817 WeakPolarHBondContact CG2-O 3.12Å; E810-S817 PolarHBondContact OE1-OG 3.42Å; E810-S817 VanDerWaalsContact OE2-CB 3.26Å; E810-S817 WeakPolarHBondContact OE2-CB 3.02Å; E810-S817 PolarHBondContact OE2-OG 3.43Å; N814-S817 VanDerWaalsContact CB-OG 3.32Å; N814-S817 WeakPolarHBondContact CB-OG 3.16Å; N814-S817 PolarHBondContact ND2-OG 2.91Å
818	P	79.8	Confident	76	Confident	60 Å²	60	88.9 Å²	88.9	39%	0.39	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-70	141.3	-169.9	30.1	-37.3	0	0	0	112.2	L795 N796	L795-P818 HydrophobicContact CB-CB 4.08Å; L795-P818 HydrophobicContact CB-CG 4.21Å; L795-P818 HydrophobicContact CD1-CG 4.28Å; N796-P818 CarbonylContact O-C 3.59Å; N796-P818 VanDerWaalsContact O-CA 3.3Å; N796-P818 WeakPolarHBondContact O-CA 3.43Å; N796-P818 VanDerWaalsContact O-CB 3.27Å; N796-P818 WeakPolarHBondContact O-CB 3.46Å
819	K	81.1	Confident	75.6	Confident	130 Å²	130	93.8 Å²	93.8	57%	0.565	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.7	-171.3	-66.7	175.2	-176	169.4	0	110.4	N796 T798 M821	N796-K819 PolarHBondContact N-O 2.83Å; N796-K819 PolarHBondContact O-N 3.1Å; T798-K819 HydrophobicContact CG2-CG 4.37Å; K819-M821 PolarHBondContact O-N 2.91Å
820	R	77.8	Confident	75.1	Confident	193 Å²	193	89.5 Å²	89.5	73%	0.728	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	119	174.2	179.8	172.8	-82.6	-173.8	-6.5	110	S793 F794 L795	S793-R820 VanDerWaalsContact OG-CD 3.29Å; S793-R820 WeakPolarHBondContact OG-CD 3.37Å; S793-R820 WeakPolarHBondContact OG-CG 3.47Å; S793-R820 PolarHBondContact OG-NE 2.82Å; F794-R820 WeakPolarHBondContact O-CA 3.49Å; L795-R820 HydrophobicContact CD2-CB 4.04Å
821	M	72.9	Confident	75.2	Confident	88 Å²	88	86 Å²	86	43%	0.433	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.5	175.5	-70.2	-175.6	63.8	0	0	109.9	S793 F794 N796 K819	S793-M821 CarbonylContact C-O 3.57Å; S793-M821 WeakPolarHBondContact CA-O 3.39Å; S793-M821 WeakPolarHBondContact CB-O 3.19Å; F794-M821 HydrophobicContact CD1-CB 4.47Å; F794-M821 HydrophobicContact CE1-CB 3.97Å; F794-M821 HydrophobicContact CZ-CB 4.12Å; F794-M821 PolarHBondContact N-O 2.92Å; F794-M821 PolarHBondContact O-N 3.26Å; N796-M821 HydrophobicContact CB-CG 4.05Å; N796-M821 HydrophobicContact CB-SD 3.59Å; N796-M821 VanDerWaalsContact CB-SD 3.59Å; N796-M821 PolarHBondContact ND2-SD 2.78Å; K819-M821 PolarHBondContact O-N 2.91Å
822	A	70.4	Confident	75.7	Confident	77 Å²	77	84.2 Å²	84.2	64%	0.636	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	137.4	172.2	0	0	0	0	0	110.1	R824	A822-R824 PolarHBondContact O-N 2.81Å
823	C	68.2	Low	76.6	Confident	15 Å²	15	81.5 Å²	81.5	10%	0.101	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-67	118	176.4	-61.9	0	0	0	0	109.6	C788 Q792	C788-C823 HydrophobicContact CB-CB 4.07Å; C788-C823 WeakPolarHBondContact CB-SG 3.31Å; Q792-C823 WeakPolarHBondContact O-CB 3.08Å; Q792-C823 PolarHBondContact O-N 3.16Å; Q792-C823 VanDerWaalsContact O-N 3.11Å; Q792-C823 PolarHBondContact O-SG 3.24Å
824	R	70.7	Confident	77.8	Confident	221 Å²	221	73 Å²	73	83%	0.834	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-92.4	138.9	167.6	-66	-175.5	179.3	-176.8	-0.9	108.5	A822	A822-R824 PolarHBondContact O-N 2.81Å
825	P	67.9	Low	78.5	Confident	66 Å²	66	69.2 Å²	69.2	43%	0.429	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-57.6	146.7	168.6	25.1	-32	0	0	0	110	L906	P825-L906 HydrophobicContact CB-CD1 3.77Å; P825-L906 HydrophobicContact CG-CD1 4.02Å; P825-L906 WeakPolarHBondContact O-CD1 3.46Å
826	K	71.6	Confident	78.5	Confident	47 Å²	47	67.4 Å²	67.4	20%	0.204	34%	0.344	C	S	.	.			trans	-116.8	152.8	173.8	-81.7	176.8	162.1	177.2	0	108.9	G783 A785 N856 N904	G783-K826 PolarHBondContact O-NZ 3.44Å; A785-K826 WeakPolarHBondContact O-CE 3.34Å; A785-K826 PolarHBondContact O-NZ 3.17Å; K826-N856 HydrophobicContact CD-CB 4.31Å; K826-N856 PolarHBondContact NZ-OD1 2.84Å; K826-N904 PolarHBondContact O-ND2 3.28Å
827	P	81.5	Confident	78	Confident	44 Å²	44	71 Å²	71	29%	0.286	36%	0.363	S	S	.	.			trans	-58.3	155	161.6	28.5	-35.2	0	0	0	110.2	Q829 L906	P827-Q829 PolarHBondContact O-N 3.27Å; P827-L906 HydrophobicContact CB-CB 4.12Å
828	P	84.7	Confident	77.6	Confident	3 Å²	3	73 Å²	73	2%	0.019	39%	0.386	C	S	.	.			trans	-59.4	134.2	170.7	-19.2	35	0	0	0	109.4	L854 N856 T862 A902 N904 G907 D909	P828-L854 HydrophobicContact CB-CD1 4.08Å; P828-L854 HydrophobicContact CB-CD2 4.29Å; P828-N856 WeakPolarHBondContact CA-O 3.26Å; P828-T862 HydrophobicContact CG-CG2 4.11Å; P828-A902 HydrophobicContact CB-CB 3.89Å; P828-A902 HydrophobicContact CG-CB 4.3Å; P828-N904 HydrophobicContact CG-CB 4.41Å; P828-G907 WeakPolarHBondContact CD-O 3.28Å; P828-D909 HydrophobicContact CB-CB 4.11Å; P828-D909 WeakPolarHBondContact O-CB 3.5Å
829	Q	81.8	Confident	77.5	Confident	111 Å²	111	75.9 Å²	75.9	52%	0.519	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	138.8	173.7	-65.2	-172.6	-30.6	0	0	110.9	P827 D855 N856 D909	P827-Q829 PolarHBondContact O-N 3.27Å; Q829-D855 PolarHBondContact O-N 3.47Å; Q829-N856 HydrophobicContact CB-CB 4.21Å; Q829-N856 PolarHBondContact N-O 2.86Å; Q829-N856 PolarHBondContact O-N 3.49Å; Q829-D909 WeakPolarHBondContact CA-OD2 3.27Å
830	G	80.3	Confident	77.6	Confident	25 Å²	25	74.3 Å²	74.3	26%	0.258	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80.4	44.5	-179	0	0	0	0	0	111.8	D855 D909	G830-D855 PolarHBondContact O-N 2.95Å; G830-D855 VanDerWaalsContact O-N 3.11Å; G830-D909 PolarHBondContact N-OD2 2.71Å
831	L	85.6	Confident	77.9	Confident	7 Å²	7	67.8 Å²	67.8	4%	0.037	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.6	173.4	-170.7	67.7	0	0	0	110.4	I852 H853 L854 A900 A902 D909 S911	L831-I852 HydrophobicContact CD1-CG2 3.61Å; L831-H853 WeakPolarHBondContact CA-O 3.2Å; L831-L854 HydrophobicContact CB-CD1 4.13Å; L831-L854 HydrophobicContact CD1-CB 4.26Å; L831-L854 HydrophobicContact CD1-CD1 4.14Å; L831-A900 HydrophobicContact CD2-CB 4Å; L831-A900 VanDerWaalsContact CD2-O 3.3Å; L831-A900 WeakPolarHBondContact CD2-O 3.13Å; L831-A902 HydrophobicContact CD1-CB 3.96Å; L831-A902 HydrophobicContact CD2-CB 3.93Å; L831-D909 HydrophobicContact CB-CB 4.23Å; L831-D909 WeakPolarHBondContact CD2-O 3.45Å; L831-D909 PolarHBondContact N-OD2 2.93Å; L831-S911 WeakPolarHBondContact O-CB 3.21Å; L831-S911 PolarHBondContact O-OG 2.86Å
832	H	84.4	Confident	78.5	Confident	106 Å²	106	64.5 Å²	64.5	49%	0.491	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.4	179.4	-73.5	-59.6	0	0	0	110.7	I852 H853	H832-I852 WeakPolarHBondContact O-CA 3.49Å; H832-H853 HydrophobicContact CB-CB 4.33Å; H832-H853 PolarHBondContact N-O 2.94Å; H832-H853 PolarHBondContact O-N 3.04Å
833	L	87.2	Confident	79.1	Confident	16 Å²	16	63.4 Å²	63.4	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.7	174.4	175.4	63.4	0	0	0	110.1	F850 I852 L866 V898 A900 S911 L913	L833-F850 HydrophobicContact CD1-CB 4.21Å; L833-F850 HydrophobicContact CD1-CD1 4.13Å; L833-I852 HydrophobicContact CD1-CG1 4.1Å; L833-L866 HydrophobicContact CD1-CD1 4Å; L833-L866 HydrophobicContact CD2-CD1 4.23Å; L833-V898 HydrophobicContact CD2-CB 4.08Å; L833-V898 HydrophobicContact CD2-CG1 3.75Å; L833-A900 HydrophobicContact CB-CB 4.21Å; L833-A900 HydrophobicContact CD1-CB 4.38Å; L833-A900 HydrophobicContact CD2-CB 4.18Å; L833-A900 HydrophobicContact CG-CB 4.49Å; L833-S911 PolarHBondContact N-OG 3.2Å; L833-L913 HydrophobicContact CD2-CB 3.7Å; L833-L913 HydrophobicContact CG-CB 4.01Å; L833-L913 HydrophobicContact CG-CD2 4.37Å
834	S	85.2	Confident	80.1	Confident	54 Å²	54	66 Å²	66	38%	0.378	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	169.6	179.3	57.8	0	0	0	0	111.8	F850 M851	S834-F850 CarbonylContact O-C 3.5Å; S834-F850 WeakPolarHBondContact O-CA 3.41Å; S834-M851 PolarHBondContact N-O 3.19Å; S834-M851 PolarHBondContact O-N 3.4Å; S834-M851 PolarHBondContact OG-O 2.89Å
835	T	84.3	Confident	80.7	Confident	13 Å²	13	57.9 Å²	57.9	8%	0.08	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	153.2	169.3	53	0	0	0	0	110.7	H837 G838 E839 V848 T849 F850 L913	T835-H837 PolarHBondContact O-N 2.83Å; T835-H837 VanDerWaalsContact O-N 3.11Å; T835-G838 PolarHBondContact O-N 2.84Å; T835-G838 WeakPolarHBondContact OG1-CA 3.38Å; T835-G838 PolarHBondContact OG1-N 2.81Å; T835-E839 WeakPolarHBondContact CG2-O 3.28Å; T835-E839 PolarHBondContact OG1-N 3.12Å; T835-E839 VanDerWaalsContact OG1-N 3.08Å; T835-E839 PolarHBondContact OG1-O 3.31Å; T835-V848 HydrophobicContact CG2-CG1 4.01Å; T835-T849 CarbonylContact C-O 3.57Å; T835-T849 VanDerWaalsContact CA-O 3.32Å; T835-T849 WeakPolarHBondContact CA-O 3.13Å; T835-F850 HydrophobicContact CG2-CD1 4.26Å; T835-F850 HydrophobicContact CG2-CE1 4.17Å; T835-L913 HydrophobicContact CG2-CD2 4.13Å
836	S	75.3	Confident	81.5	Confident	53 Å²	53	56.8 Å²	56.8	37%	0.371	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-32.4	-179.2	54.5	0	0	0	0	114.4	T849	S836-T849 PolarHBondContact N-O 3.5Å
837	H	69.3	Low	82.3	Confident	150 Å²	150	59.8 Å²	59.8	69%	0.694	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-5	179.8	-55	-65	0	0	0	113.4	T835 E839	T835-H837 PolarHBondContact O-N 2.83Å; T835-H837 VanDerWaalsContact O-N 3.11Å; H837-E839 HydrophobicContact CB-CG 4.15Å; H837-E839 PolarHBondContact O-N 3.32Å
838	G	70.8	Confident	82.6	Confident	55 Å²	55	58.2 Å²	58.2	57%	0.567	35%	0.352	S	S	*	.			trans	74.3	6.5	-174.2	0	0	0	0	0	114.7	T835	T835-G838 PolarHBondContact O-N 2.84Å; T835-G838 WeakPolarHBondContact OG1-CA 3.38Å; T835-G838 PolarHBondContact OG1-N 2.81Å
839	E	76.8	Confident	82.8	Confident	120 Å²	120	59 Å²	59	56%	0.561	36%	0.357	S	S	*	.			trans	-81.8	139.9	-179.6	-62.9	179.6	171.4	0	0	111.5	T835 H837	T835-E839 WeakPolarHBondContact CG2-O 3.28Å; T835-E839 PolarHBondContact OG1-N 3.12Å; T835-E839 VanDerWaalsContact OG1-N 3.08Å; T835-E839 PolarHBondContact OG1-O 3.31Å; H837-E839 HydrophobicContact CB-CG 4.15Å; H837-E839 PolarHBondContact O-N 3.32Å
840	L	83.8	Confident	83.1	Confident	97 Å²	97	53.8 Å²	53.8	51%	0.508	33%	0.332	S	S	.	.	S	Bend	trans	-102.4	12.2	178.9	-56.9	-178.3	0	0	0	112.8	L913 H916	L840-L913 HydrophobicContact CD2-CD1 3.63Å; L840-L913 HydrophobicContact CD2-CG 4.2Å; L840-H916 PolarHBondContact O-N 2.8Å
841	S	83.3	Confident	83.2	Confident	55 Å²	55	55.6 Å²	55.6	39%	0.385	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	138.6	-179.7	55	0	0	0	0	110.4	H916	S841-H916 CarbonylContact C-O 3.58Å; S841-H916 VanDerWaalsContact CA-O 3.25Å; S841-H916 WeakPolarHBondContact CA-O 3.26Å
842	A	85.6	Confident	83.1	Confident	20 Å²	20	56.1 Å²	56.1	17%	0.165	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.5	176	0	0	0	0	0	111.4	V848 H916 I917 T918	A842-V848 HydrophobicContact CB-CG2 3.65Å; A842-H916 PolarHBondContact N-O 2.82Å; A842-I917 HydrophobicContact CB-CD1 3.95Å; A842-I917 WeakPolarHBondContact O-CA 3.23Å; A842-T918 PolarHBondContact O-N 2.78Å
843	A	83.8	Confident	82.9	Confident	54 Å²	54	56.3 Å²	56.3	45%	0.446	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	144.3	175.9	0	0	0	0	0	111.4	G845 S846 T918	A843-G845 PolarHBondContact O-N 3.33Å; A843-S846 VanDerWaalsContact O-CB 3.29Å; A843-S846 WeakPolarHBondContact O-CB 3.48Å; A843-S846 PolarHBondContact O-N 2.66Å; A843-S846 VanDerWaalsContact O-N 3.08Å; A843-S846 PolarHBondContact O-OG 2.91Å; A843-T918 CarbonylContact C-O 3.45Å
844	I	87.8	Confident	82.4	Confident	70 Å²	70	56 Å²	56	36%	0.359	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	135.2	169.8	-169.8	172.6	0	0	0	111	S846 T893 I917 T918	I844-S846 VanDerWaalsContact C-N 3.27Å; I844-S846 PolarHBondContact O-N 2.98Å; I844-T893 HydrophobicContact CD1-CG2 4.39Å; I844-I917 HydrophobicContact CB-CG2 4.1Å; I844-T918 PolarHBondContact N-O 2.84Å
845	G	83.8	Confident	81.7	Confident	50 Å²	50	57.3 Å²	57.3	52%	0.515	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-3.4	-177	0	0	0	0	0	116.2	A843 Y890	A843-G845 PolarHBondContact O-N 3.33Å; G845-Y890 PolarHBondContact N-O 3.2Å; G845-Y890 VanDerWaalsContact N-O 3.07Å
846	S	85.5	Confident	80.9	Confident	42 Å²	42	58.3 Å²	58.3	29%	0.294	34%	0.344	S	S	.	.			trans	-78	155.5	174.1	69.1	0	0	0	0	113.1	A843 I844 V848	A843-S846 VanDerWaalsContact O-CB 3.29Å; A843-S846 WeakPolarHBondContact O-CB 3.48Å; A843-S846 PolarHBondContact O-N 2.66Å; A843-S846 VanDerWaalsContact O-N 3.08Å; A843-S846 PolarHBondContact O-OG 2.91Å; I844-S846 VanDerWaalsContact C-N 3.27Å; I844-S846 PolarHBondContact O-N 2.98Å; S846-V848 PolarHBondContact O-N 2.84Å
847	N	88.4	Confident	80.6	Confident	111 Å²	111	56 Å²	56	59%	0.594	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	99.3	174.4	-81.7	-60.6	0	0	0	110.6	I889	N847-I889 WeakPolarHBondContact OD1-CD1 3.22Å; N847-I889 WeakPolarHBondContact OD1-CG1 3.48Å
848	V	87.8	Confident	80.5	Confident	11 Å²	11	52.4 Å²	52.4	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125	173.3	-173.7	0	0	0	0	108.9	T835 A842 S846 F850 K887 H888 Y890 L915	T835-V848 HydrophobicContact CG2-CG1 4.01Å; A842-V848 HydrophobicContact CB-CG2 3.65Å; S846-V848 PolarHBondContact O-N 2.84Å; V848-F850 HydrophobicContact CB-CE2 3.99Å; V848-F850 HydrophobicContact CB-CZ 4.27Å; V848-F850 HydrophobicContact CG1-CD2 4.25Å; V848-F850 HydrophobicContact CG1-CE1 4.11Å; V848-F850 HydrophobicContact CG1-CE2 3.61Å; V848-F850 HydrophobicContact CG1-CZ 3.54Å; V848-K887 WeakPolarHBondContact O-CA 3.3Å; V848-H888 PolarHBondContact N-O 2.57Å; V848-H888 PolarHBondContact O-N 2.89Å; V848-Y890 HydrophobicContact CB-CE2 4.49Å; V848-Y890 HydrophobicContact CG2-CD2 4.21Å; V848-Y890 HydrophobicContact CG2-CE2 4.32Å; V848-L915 HydrophobicContact CG1-CD2 3.95Å; V848-L915 HydrophobicContact CG2-CD2 4.28Å
849	T	88.6	Confident	80.4	Confident	20 Å²	20	51 Å²	51	12%	0.123	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.6	178.3	-51.8	0	0	0	0	110.1	T835 S836 I886 K887	T835-T849 CarbonylContact C-O 3.57Å; T835-T849 VanDerWaalsContact CA-O 3.32Å; T835-T849 WeakPolarHBondContact CA-O 3.13Å; S836-T849 PolarHBondContact N-O 3.5Å; T849-I886 CarbonylContact C-O 3.53Å; T849-I886 WeakPolarHBondContact CA-O 3.49Å; T849-K887 HydrophobicContact CG2-CG 4.05Å; T849-K887 WeakPolarHBondContact OG1-CG 3.23Å
850	F	87.4	Confident	80	Confident	1 Å²	1	50.5 Å²	50.5	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.8	-179.3	-63.7	-86.3	0	0	0	111.5	L833 S834 T835 V848 L866 F868 G885 I886 H888 Y890 V898 L913 L915	L833-F850 HydrophobicContact CD1-CB 4.21Å; L833-F850 HydrophobicContact CD1-CD1 4.13Å; S834-F850 CarbonylContact O-C 3.5Å; S834-F850 WeakPolarHBondContact O-CA 3.41Å; T835-F850 HydrophobicContact CG2-CD1 4.26Å; T835-F850 HydrophobicContact CG2-CE1 4.17Å; V848-F850 HydrophobicContact CB-CE2 3.99Å; V848-F850 HydrophobicContact CB-CZ 4.27Å; V848-F850 HydrophobicContact CG1-CD2 4.25Å; V848-F850 HydrophobicContact CG1-CE1 4.11Å; V848-F850 HydrophobicContact CG1-CE2 3.61Å; V848-F850 HydrophobicContact CG1-CZ 3.54Å; F850-L866 HydrophobicContact CB-CD2 4.31Å; F850-F868 HydrophobicContact CD2-CD1 4.29Å; F850-F868 AromaticContact CD2-CE1 3.75Å; F850-F868 HydrophobicContact CD2-CE1 3.75Å; F850-F868 AromaticContact CE2-CD1 3.87Å; F850-F868 HydrophobicContact CE2-CD1 3.87Å; F850-F868 AromaticContact CE2-CE1 3.76Å; F850-F868 HydrophobicContact CE2-CE1 3.76Å; F850-F868 HydrophobicContact CZ-CD1 4.38Å; F850-G885 CarbonylContact O-C 3.54Å; F850-G885 WeakPolarHBondContact O-CA 3.24Å; F850-I886 PolarHBondContact N-O 2.83Å; F850-I886 PolarHBondContact O-N 2.82Å; F850-H888 HydrophobicContact CE2-CB 4.18Å; F850-Y890 HydrophobicContact CE2-CE2 4.35Å; F850-Y890 HydrophobicContact CZ-CE2 4.13Å; F850-V898 HydrophobicContact CD1-CG1 4.3Å; F850-V898 HydrophobicContact CE1-CB 4.3Å; F850-V898 HydrophobicContact CE1-CG1 4Å; F850-V898 HydrophobicContact CE1-CG2 3.85Å; F850-V898 HydrophobicContact CZ-CG1 4.38Å; F850-V898 HydrophobicContact CZ-CG2 3.93Å; F850-L913 HydrophobicContact CD1-CD2 4.42Å; F850-L913 HydrophobicContact CE1-CD2 4.26Å; F850-L915 HydrophobicContact CE1-CD2 4.26Å; F850-L915 HydrophobicContact CZ-CD2 3.76Å
851	M	83.1	Confident	79.4	Confident	62 Å²	62	48.9 Å²	48.9	31%	0.305	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.6	175.5	-57.2	-58.3	-62.1	0	0	109	S834 D883	S834-M851 PolarHBondContact N-O 3.19Å; S834-M851 PolarHBondContact O-N 3.4Å; S834-M851 PolarHBondContact OG-O 2.89Å; M851-D883 WeakPolarHBondContact CE-O 3.23Å
852	I	84	Confident	79.3	Confident	18 Å²	18	46.5 Å²	46.5	9%	0.092	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.3	176.1	-56.6	179.7	0	0	0	108.1	L831 H832 L833 I864 L866 L879 I886 A900	L831-I852 HydrophobicContact CD1-CG2 3.61Å; H832-I852 WeakPolarHBondContact O-CA 3.49Å; L833-I852 HydrophobicContact CD1-CG1 4.1Å; I852-I864 HydrophobicContact CD1-CG2 3.85Å; I852-I864 HydrophobicContact CG2-CG2 4.43Å; I852-L866 HydrophobicContact CD1-CD1 4.29Å; I852-L866 HydrophobicContact CD1-CD2 4.43Å; I852-L879 HydrophobicContact CB-CD1 4.25Å; I852-L879 HydrophobicContact CG2-CD1 4.11Å; I852-I886 HydrophobicContact CD1-CD1 3.75Å; I852-I886 HydrophobicContact CG1-CD1 4.47Å; I852-A900 HydrophobicContact CD1-CB 4.22Å
853	H	78.4	Confident	79.4	Confident	110 Å²	110	47.7 Å²	47.7	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.3	172.5	-174.5	-86.2	0	0	0	109.4	L831 H832 D855	L831-H853 WeakPolarHBondContact CA-O 3.2Å; H832-H853 HydrophobicContact CB-CB 4.33Å; H832-H853 PolarHBondContact N-O 2.94Å; H832-H853 PolarHBondContact O-N 3.04Å; H853-D855 IonicContact CE1-OD1 3.03Å; H853-D855 PolarHBondContact CE1-OD1 3.24Å; H853-D855 IonicContact ND1-OD1 3.87Å; H853-D855 PolarHBondContact ND1-OD1 3.13Å
854	L	78.3	Confident	79.6	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.058	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	114.1	179.5	177.6	64	0	0	0	109.7	P828 L831 N856 E858 T862 L879 A902	P828-L854 HydrophobicContact CB-CD1 4.08Å; P828-L854 HydrophobicContact CB-CD2 4.29Å; L831-L854 HydrophobicContact CB-CD1 4.13Å; L831-L854 HydrophobicContact CD1-CB 4.26Å; L831-L854 HydrophobicContact CD1-CD1 4.14Å; L854-N856 WeakPolarHBondContact CD1-O 3.39Å; L854-N856 VanDerWaalsContact CG-O 3.29Å; L854-N856 WeakPolarHBondContact CG-O 3.44Å; L854-N856 PolarHBondContact O-N 2.79Å; L854-E858 HydrophobicContact CD2-CB 4.42Å; L854-T862 HydrophobicContact CD2-CG2 4.33Å; L854-L879 HydrophobicContact CB-CD2 4.36Å; L854-A902 HydrophobicContact CD2-CB 4.39Å
855	D	69.2	Low	79.8	Confident	80 Å²	80	45.8 Å²	45.8	43%	0.428	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-32.8	-174.2	-71.9	6.8	0	0	0	113.5	Q829 G830 H853	Q829-D855 PolarHBondContact O-N 3.47Å; G830-D855 PolarHBondContact O-N 2.95Å; G830-D855 VanDerWaalsContact O-N 3.11Å; H853-D855 IonicContact CE1-OD1 3.03Å; H853-D855 PolarHBondContact CE1-OD1 3.24Å; H853-D855 IonicContact ND1-OD1 3.87Å; H853-D855 PolarHBondContact ND1-OD1 3.13Å
856	N	68.6	Low	80.1	Confident	35 Å²	35	43.4 Å²	43.4	19%	0.187	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150.4	-177.4	-73.7	-95.9	0	0	0	112	K826 P828 Q829 L854	K826-N856 HydrophobicContact CD-CB 4.31Å; K826-N856 PolarHBondContact NZ-OD1 2.84Å; P828-N856 WeakPolarHBondContact CA-O 3.26Å; Q829-N856 HydrophobicContact CB-CB 4.21Å; Q829-N856 PolarHBondContact N-O 2.86Å; Q829-N856 PolarHBondContact O-N 3.49Å; L854-N856 WeakPolarHBondContact CD1-O 3.39Å; L854-N856 VanDerWaalsContact CG-O 3.29Å; L854-N856 WeakPolarHBondContact CG-O 3.44Å; L854-N856 PolarHBondContact O-N 2.79Å
857	G	67.7	Low	80.6	Confident	4 Å²	4	42.7 Å²	42.7	4%	0.041	24%	0.237	C	C	.	.			trans	86.6	15.4	173	0	0	0	0	0	114.5	S787 S859 T862 N904	S787-G857 PolarHBondContact OG-N 3.01Å; G857-S859 PolarHBondContact O-N 3.24Å; G857-T862 PolarHBondContact O-OG1 2.85Å; G857-N904 PolarHBondContact O-ND2 2.84Å
858	E	68.3	Low	80.8	Confident	75 Å²	75	37.4 Å²	37.4	35%	0.35	21%	0.209	S	C	.	.			trans	-65.4	127.2	168.5	-167.7	-168	-174.6	0	0	110	S787 L854 L879	S787-E858 WeakPolarHBondContact OG-CB 3.25Å; S787-E858 PolarHBondContact OG-N 3.46Å; S787-E858 VanDerWaalsContact OG-N 3.14Å; L854-E858 HydrophobicContact CD2-CB 4.42Å; E858-L879 HydrophobicContact CG-CB 4.47Å; E858-L879 HydrophobicContact CG-CD2 4.3Å
859	S	67.4	Low	80.9	Confident	25 Å²	25	38.9 Å²	38.9	18%	0.175	23%	0.225	C	C	.	.			trans	-155.6	158.7	177.9	80.4	0	0	0	0	109.6	G857 S861 T862	G857-S859 PolarHBondContact O-N 3.24Å; S859-S861 PolarHBondContact O-N 3.14Å; S859-S861 WeakPolarHBondContact OG-CA 3.47Å; S859-S861 PolarHBondContact OG-N 2.79Å; S859-S861 VanDerWaalsContact OG-N 3.07Å; S859-S861 PolarHBondContact OG-OG 2.88Å; S859-T862 PolarHBondContact N-OG1 3.05Å; S859-T862 WeakPolarHBondContact O-CB 3.42Å; S859-T862 PolarHBondContact O-N 3.22Å; S859-T862 PolarHBondContact O-OG1 3.28Å; S859-T862 PolarHBondContact OG-N 2.51Å; S859-T862 VanDerWaalsContact OG-N 3.11Å; S859-T862 PolarHBondContact OG-OG1 2.92Å
860	P	68.8	Low	81	Confident	110 Å²	110	40.6 Å²	40.6	71%	0.714	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	0.2	169.1	30.1	-36.5	0	0	0	113.5
861	S	72.8	Confident	81	Confident	63 Å²	63	43.5 Å²	43.5	44%	0.441	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	11	169.7	60.4	0	0	0	0	113.3	S859	S859-S861 PolarHBondContact O-N 3.14Å; S859-S861 WeakPolarHBondContact OG-CA 3.47Å; S859-S861 PolarHBondContact OG-N 2.79Å; S859-S861 VanDerWaalsContact OG-N 3.07Å; S859-S861 PolarHBondContact OG-OG 2.88Å
862	T	80.8	Confident	81.3	Confident	4 Å²	4	44.4 Å²	44.4	3%	0.025	27%	0.27	C	S	.	.			trans	-98.4	107	177.6	-54	0	0	0	0	109.1	P828 L854 G857 S859 A902 E903 N904	P828-T862 HydrophobicContact CG-CG2 4.11Å; L854-T862 HydrophobicContact CD2-CG2 4.33Å; G857-T862 PolarHBondContact O-OG1 2.85Å; S859-T862 PolarHBondContact N-OG1 3.05Å; S859-T862 WeakPolarHBondContact O-CB 3.42Å; S859-T862 PolarHBondContact O-N 3.22Å; S859-T862 PolarHBondContact O-OG1 3.28Å; S859-T862 PolarHBondContact OG-N 2.51Å; S859-T862 VanDerWaalsContact OG-N 3.11Å; S859-T862 PolarHBondContact OG-OG1 2.92Å; T862-A902 HydrophobicContact CG2-CB 4.32Å; T862-E903 CarbonylContact C-O 3.57Å; T862-E903 VanDerWaalsContact CA-O 3.3Å; T862-E903 WeakPolarHBondContact CA-O 3.06Å; T862-N904 HydrophobicContact CG2-CB 4.36Å; T862-N904 PolarHBondContact OG1-ND2 2.87Å
863	S	87.4	Confident	81.6	Confident	45 Å²	45	49.2 Å²	49.2	32%	0.315	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	135.8	173.9	45.9	0	0	0	0	110.8	Y876 A902 E903	S863-Y876 WeakPolarHBondContact CA-O 3.29Å; S863-A902 WeakPolarHBondContact O-CA 3.42Å; S863-E903 PolarHBondContact N-O 3.03Å; S863-E903 PolarHBondContact O-N 3.48Å; S863-E903 PolarHBondContact OG-O 2.85Å
864	I	88.2	Confident	82.2	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	110.7	-179.4	-58.5	-179.3	0	0	0	108.9	I852 T875 Y876 L879 T901 A902	I852-I864 HydrophobicContact CD1-CG2 3.85Å; I852-I864 HydrophobicContact CG2-CG2 4.43Å; I864-T875 CarbonylContact O-C 3.52Å; I864-T875 WeakPolarHBondContact O-CA 3.49Å; I864-Y876 PolarHBondContact N-O 2.82Å; I864-Y876 PolarHBondContact O-N 2.63Å; I864-L879 HydrophobicContact CD1-CB 4.07Å; I864-L879 HydrophobicContact CD1-CD1 3.54Å; I864-L879 HydrophobicContact CD1-CG 4.32Å; I864-T901 CarbonylContact C-O 3.49Å; I864-T901 VanDerWaalsContact CA-O 3.31Å; I864-T901 WeakPolarHBondContact CA-O 3.09Å; I864-A902 HydrophobicContact CG1-CB 4.07Å
865	Q	90.8	Very high	82.6	Confident	78 Å²	78	50.7 Å²	50.7	36%	0.364	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.4	174.9	-176.3	173.6	8	0	0	109.7	I874 T875 A900 T901	Q865-I874 WeakPolarHBondContact CA-O 3.33Å; Q865-T875 HydrophobicContact CB-CG2 4.39Å; Q865-A900 CarbonylContact O-C 3.59Å; Q865-A900 WeakPolarHBondContact O-CA 3.4Å; Q865-T901 PolarHBondContact N-O 2.87Å; Q865-T901 PolarHBondContact O-N 3.01Å
866	L	91.8	Very high	83.3	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	118.9	170.7	-170.9	64.3	0	0	0	109	L833 F850 I852 F868 K873 I874 I886 V898 A900	L833-L866 HydrophobicContact CD1-CD1 4Å; L833-L866 HydrophobicContact CD2-CD1 4.23Å; F850-L866 HydrophobicContact CB-CD2 4.31Å; I852-L866 HydrophobicContact CD1-CD1 4.29Å; I852-L866 HydrophobicContact CD1-CD2 4.43Å; L866-F868 HydrophobicContact CD2-CD1 4.31Å; L866-F868 HydrophobicContact CD2-CE1 3.45Å; L866-F868 VanDerWaalsContact CD2-CE1 3.45Å; L866-F868 HydrophobicContact CD2-CZ 3.63Å; L866-F868 HydrophobicContact CG-CD1 4.43Å; L866-F868 HydrophobicContact CG-CE1 3.97Å; L866-F868 HydrophobicContact CG-CZ 4.14Å; L866-K873 CarbonylContact O-C 3.59Å; L866-K873 VanDerWaalsContact O-CA 3.31Å; L866-K873 WeakPolarHBondContact O-CA 3.33Å; L866-I874 PolarHBondContact N-O 2.94Å; L866-I874 PolarHBondContact O-N 2.88Å; L866-I886 HydrophobicContact CD2-CB 4.19Å; L866-I886 HydrophobicContact CD2-CD1 3.75Å; L866-I886 HydrophobicContact CD2-CG2 3.95Å; L866-V898 HydrophobicContact CD1-CG1 3.74Å; L866-V898 HydrophobicContact CG-CG1 4.36Å; L866-A900 HydrophobicContact CD1-CB 3.91Å
867	D	94.3	Very high	83.4	Confident	27 Å²	27	52.4 Å²	52.4	14%	0.144	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.1	172.9	-176.1	-9.3	0	0	0	108.3	G869 K873 V898 I899	D867-G869 VanDerWaalsContact C-N 3.29Å; D867-G869 PolarHBondContact OD1-N 3.48Å; D867-K873 HydrophobicContact CB-CD 4.07Å; D867-K873 HydrophobicContact CB-CG 4.08Å; D867-K873 WeakPolarHBondContact OD2-CE 3.42Å; D867-K873 IonicContact OD2-NZ 2.64Å; D867-K873 PolarHBondContact OD2-NZ 2.86Å; D867-V898 CarbonylContact O-C 3.54Å; D867-V898 VanDerWaalsContact O-CA 3.25Å; D867-V898 WeakPolarHBondContact O-CA 3.13Å; D867-V898 WeakPolarHBondContact O-CG1 3.48Å; D867-I899 HydrophobicContact CB-CB 4.41Å; D867-I899 PolarHBondContact N-O 3.27Å; D867-I899 PolarHBondContact O-N 3.27Å
868	F	92.8	Very high	83.4	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.329	C	S	.	.			trans	-83.5	-4.5	-179.2	-61.7	-72.9	0	0	0	113.4	F850 L866 D870 I872 I874 I886 H888 Y890 V898	F850-F868 HydrophobicContact CD2-CD1 4.29Å; F850-F868 AromaticContact CD2-CE1 3.75Å; F850-F868 HydrophobicContact CD2-CE1 3.75Å; F850-F868 AromaticContact CE2-CD1 3.87Å; F850-F868 HydrophobicContact CE2-CD1 3.87Å; F850-F868 AromaticContact CE2-CE1 3.76Å; F850-F868 HydrophobicContact CE2-CE1 3.76Å; F850-F868 HydrophobicContact CZ-CD1 4.38Å; L866-F868 HydrophobicContact CD2-CD1 4.31Å; L866-F868 HydrophobicContact CD2-CE1 3.45Å; L866-F868 VanDerWaalsContact CD2-CE1 3.45Å; L866-F868 HydrophobicContact CD2-CZ 3.63Å; L866-F868 HydrophobicContact CG-CD1 4.43Å; L866-F868 HydrophobicContact CG-CE1 3.97Å; L866-F868 HydrophobicContact CG-CZ 4.14Å; F868-D870 PolarHBondContact O-N 3.13Å; F868-I872 HydrophobicContact CD2-CB 4.13Å; F868-I872 HydrophobicContact CD2-CG2 3.91Å; F868-I872 WeakPolarHBondContact CD2-O 3.22Å; F868-I872 HydrophobicContact CE2-CG2 4.22Å; F868-I872 PolarHBondContact N-O 2.9Å; F868-I874 HydrophobicContact CE2-CD1 3.87Å; F868-I874 HydrophobicContact CE2-CG1 4.1Å; F868-I874 HydrophobicContact CZ-CD1 4.46Å; F868-I886 HydrophobicContact CE1-CG2 4.42Å; F868-I886 HydrophobicContact CZ-CG2 3.85Å; F868-H888 HydrophobicContact CD1-CB 3.95Å; F868-H888 AromaticContact CD1-CD2 3.51Å; F868-H888 AromaticContact CD1-CG 3.9Å; F868-H888 AromaticContact CD2-CD2 3.84Å; F868-H888 HydrophobicContact CE1-CB 3.64Å; F868-H888 HydrophobicContact CE2-CB 4.44Å; F868-H888 HydrophobicContact CG-CB 4.46Å; F868-H888 AromaticContact CG-CD2 3.36Å; F868-H888 WeakPolarHBondContact CG-CD2 3.14Å; F868-H888 AromaticContact CG-CG 3.94Å; F868-H888 AromaticContact CG-NE2 3.86Å; F868-H888 HydrophobicContact CZ-CB 3.91Å; F868-Y890 HydrophobicContact CB-CE1 4.35Å; F868-Y890 PolarHBondContact O-OH 3.31Å; F868-V898 HydrophobicContact CD1-CG1 4.3Å
869	G	90.6	Very high	83.3	Confident	41 Å²	41	52.4 Å²	52.4	42%	0.423	32%	0.317	S	S	.	.	S	Bend	trans	73.6	-1.6	-178.9	0	0	0	0	0	114.7	D867	D867-G869 VanDerWaalsContact C-N 3.29Å; D867-G869 PolarHBondContact OD1-N 3.48Å
870	D	90.3	Very high	82.9	Confident	56 Å²	56	54.6 Å²	54.6	30%	0.299	33%	0.332	S	S	.	.	S	Bend	trans	-94.5	0.8	171.8	70.9	-7.5	0	0	0	113.3	F868 I872 H888 Y890 Y896	F868-D870 PolarHBondContact O-N 3.13Å; D870-I872 VanDerWaalsContact OD1-CB 3.32Å; D870-I872 WeakPolarHBondContact OD1-CB 3.47Å; D870-I872 PolarHBondContact OD1-N 3.32Å; D870-H888 IonicContact OD1-NE2 3.53Å; D870-H888 IonicContact OD2-CD2 3.89Å; D870-H888 IonicContact OD2-CE1 2.77Å; D870-H888 PolarHBondContact OD2-CE1 3.18Å; D870-H888 IonicContact OD2-NE2 3.98Å; D870-H888 PolarHBondContact OD2-NE2 2.84Å; D870-Y890 HydrophobicContact CB-CD1 4.43Å; D870-Y890 HydrophobicContact CB-CE1 4.43Å; D870-Y896 HydrophobicContact CB-CD1 3.97Å; D870-Y896 HydrophobicContact CB-CE1 3.54Å
871	G	88.1	Confident	82.4	Confident	62 Å²	62	59.4 Å²	59.4	64%	0.639	34%	0.336	S	S	*	.	S	Bend	trans	104.3	-14.1	-175.3	0	0	0	0	0	114
872	I	89.3	Confident	81.8	Confident	82 Å²	82	56.9 Å²	56.9	42%	0.421	32%	0.318	S	S	.	.			trans	-85.2	127.5	176.4	-61.8	168.9	0	0	0	109.4	F868 D870 I874	F868-I872 HydrophobicContact CD2-CB 4.13Å; F868-I872 HydrophobicContact CD2-CG2 3.91Å; F868-I872 WeakPolarHBondContact CD2-O 3.22Å; F868-I872 HydrophobicContact CE2-CG2 4.22Å; F868-I872 PolarHBondContact N-O 2.9Å; D870-I872 VanDerWaalsContact OD1-CB 3.32Å; D870-I872 WeakPolarHBondContact OD1-CB 3.47Å; D870-I872 PolarHBondContact OD1-N 3.32Å; I872-I874 HydrophobicContact CG2-CD1 4.46Å; I872-I874 HydrophobicContact CG2-CG1 4.19Å
873	K	91.1	Very high	80.9	Confident	119 Å²	119	62.3 Å²	62.3	52%	0.517	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.5	174.1	-43.7	-165.4	-171.7	-150.3	0	109.3	L866 D867	L866-K873 CarbonylContact O-C 3.59Å; L866-K873 VanDerWaalsContact O-CA 3.31Å; L866-K873 WeakPolarHBondContact O-CA 3.33Å; D867-K873 HydrophobicContact CB-CD 4.07Å; D867-K873 HydrophobicContact CB-CG 4.08Å; D867-K873 WeakPolarHBondContact OD2-CE 3.42Å; D867-K873 IonicContact OD2-NZ 2.64Å; D867-K873 PolarHBondContact OD2-NZ 2.86Å
874	I	89.1	Confident	79.8	Confident	66 Å²	66	67.3 Å²	67.3	34%	0.338	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.6	179.7	-52	179.4	0	0	0	108.7	Q865 L866 F868 I872 Y876	Q865-I874 WeakPolarHBondContact CA-O 3.33Å; L866-I874 PolarHBondContact N-O 2.94Å; L866-I874 PolarHBondContact O-N 2.88Å; F868-I874 HydrophobicContact CE2-CD1 3.87Å; F868-I874 HydrophobicContact CE2-CG1 4.1Å; F868-I874 HydrophobicContact CZ-CD1 4.46Å; I872-I874 HydrophobicContact CG2-CD1 4.46Å; I872-I874 HydrophobicContact CG2-CG1 4.19Å; I874-Y876 HydrophobicContact CB-CE2 3.88Å; I874-Y876 HydrophobicContact CG2-CD2 4.22Å; I874-Y876 HydrophobicContact CG2-CE1 4.29Å; I874-Y876 HydrophobicContact CG2-CE2 3.51Å
875	T	88.3	Confident	79.3	Confident	85 Å²	85	67.6 Å²	67.6	52%	0.521	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126	178.5	-52.1	0	0	0	0	110.6	I864 Q865	I864-T875 CarbonylContact O-C 3.52Å; I864-T875 WeakPolarHBondContact O-CA 3.49Å; Q865-T875 HydrophobicContact CB-CG2 4.39Å
876	Y	83.6	Confident	79.1	Confident	65 Å²	65	64.3 Å²	64.3	26%	0.255	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.9	179	-61	-92.9	0	0	0	109.9	S863 I864 I874 T882 I886	S863-Y876 WeakPolarHBondContact CA-O 3.29Å; I864-Y876 PolarHBondContact N-O 2.82Å; I864-Y876 PolarHBondContact O-N 2.63Å; I874-Y876 HydrophobicContact CB-CE2 3.88Å; I874-Y876 HydrophobicContact CG2-CD2 4.22Å; I874-Y876 HydrophobicContact CG2-CE1 4.29Å; I874-Y876 HydrophobicContact CG2-CE2 3.51Å; Y876-T882 HydrophobicContact CD1-CG2 3.93Å; Y876-T882 HydrophobicContact CE1-CG2 4.24Å; Y876-T882 HydrophobicContact CG-CG2 4.15Å; Y876-I886 HydrophobicContact CD2-CD1 4.02Å; Y876-I886 HydrophobicContact CE2-CD1 3.54Å; Y876-I886 HydrophobicContact CE2-CG1 4.08Å; Y876-I886 HydrophobicContact CE2-CG2 4.42Å; Y876-I886 WeakPolarHBondContact OH-CG2 3.42Å
877	S	70.3	Confident	79	Confident	87 Å²	87	70.9 Å²	70.9	61%	0.608	39%	0.388	S	S	*	.	S	Bend	trans	-101.3	2.6	-179.1	52.7	0	0	0	0	114.5
878	N	68.8	Low	78.8	Confident	59 Å²	59	70.7 Å²	70.7	32%	0.316	39%	0.386	S	S	.	.			trans	-156.4	126.8	174.3	-174.1	4	0	0	0	110.8	S880 R881	N878-S880 PolarHBondContact OD1-N 3.25Å; N878-S880 VanDerWaalsContact OD1-N 3.1Å; N878-S880 PolarHBondContact OD1-OG 3.17Å; N878-S880 VanDerWaalsContact OD1-OG 3.11Å; N878-R881 PolarHBondContact O-N 2.83Å
879	L	66.2	Low	78.8	Confident	19 Å²	19	74.1 Å²	74.1	10%	0.099	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-68.2	-30.9	178.5	-172.8	73.1	0	0	0	112.4	I852 L854 E858 I864 R881 T882	I852-L879 HydrophobicContact CB-CD1 4.25Å; I852-L879 HydrophobicContact CG2-CD1 4.11Å; L854-L879 HydrophobicContact CB-CD2 4.36Å; E858-L879 HydrophobicContact CG-CB 4.47Å; E858-L879 HydrophobicContact CG-CD2 4.3Å; I864-L879 HydrophobicContact CD1-CB 4.07Å; I864-L879 HydrophobicContact CD1-CD1 3.54Å; I864-L879 HydrophobicContact CD1-CG 4.32Å; L879-R881 PolarHBondContact O-N 2.98Å; L879-T882 WeakPolarHBondContact CD1-OG1 3.41Å; L879-T882 PolarHBondContact O-N 3.42Å; L879-T882 PolarHBondContact O-OG1 2.59Å
880	S	58.8	Low	78.7	Confident	71 Å²	71	72.3 Å²	72.3	50%	0.497	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-69.1	6	178.9	-21.1	0	0	0	0	114.3	N878	N878-S880 PolarHBondContact OD1-N 3.25Å; N878-S880 VanDerWaalsContact OD1-N 3.1Å; N878-S880 PolarHBondContact OD1-OG 3.17Å; N878-S880 VanDerWaalsContact OD1-OG 3.11Å
881	R	57.3	Low	78.6	Confident	212 Å²	212	80.4 Å²	80.4	80%	0.8	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-106.3	2.1	168.7	-75.9	-176.4	168.4	177.6	-4	113.1	N878 L879	N878-R881 PolarHBondContact O-N 2.83Å; L879-R881 PolarHBondContact O-N 2.98Å
882	T	60.9	Low	78.5	Confident	10 Å²	10	84.7 Å²	84.7	6%	0.061	41%	0.412	C	S	.	.			trans	-116.7	8.1	-177.4	52.7	0	0	0	0	113.7	Y876 L879 D884 G885 I886	Y876-T882 HydrophobicContact CD1-CG2 3.93Å; Y876-T882 HydrophobicContact CE1-CG2 4.24Å; Y876-T882 HydrophobicContact CG-CG2 4.15Å; L879-T882 WeakPolarHBondContact CD1-OG1 3.41Å; L879-T882 PolarHBondContact O-N 3.42Å; L879-T882 PolarHBondContact O-OG1 2.59Å; T882-D884 VanDerWaalsContact C-N 3.27Å; T882-D884 PolarHBondContact O-N 2.97Å; T882-G885 WeakPolarHBondContact O-CA 3.49Å; T882-G885 PolarHBondContact O-N 2.86Å; T882-I886 HydrophobicContact CG2-CD1 3.88Å; T882-I886 HydrophobicContact CG2-CG1 3.81Å
883	D	60.7	Low	78.3	Confident	118 Å²	118	82.8 Å²	82.8	63%	0.631	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-29	175.6	-67	-24.3	0	0	0	113.1	M851 G885	M851-D883 WeakPolarHBondContact CE-O 3.23Å; D883-G885 PolarHBondContact O-N 2.73Å
884	D	65.4	Low	78	Confident	149 Å²	149	77.9 Å²	77.9	80%	0.797	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-3.6	171.7	-73.4	-32.5	0	0	0	113.6	T882	T882-D884 VanDerWaalsContact C-N 3.27Å; T882-D884 PolarHBondContact O-N 2.97Å
885	G	78.3	Confident	77.9	Confident	13 Å²	13	80 Å²	80	13%	0.134	40%	0.398	C	S	.	.			trans	78.3	146.6	-177.7	0	0	0	0	0	114.9	F850 T882 D883	F850-G885 CarbonylContact O-C 3.54Å; F850-G885 WeakPolarHBondContact O-CA 3.24Å; T882-G885 WeakPolarHBondContact O-CA 3.49Å; T882-G885 PolarHBondContact O-N 2.86Å; D883-G885 PolarHBondContact O-N 2.73Å
886	I	86.5	Confident	78	Confident	9 Å²	9	77.4 Å²	77.4	5%	0.046	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.5	179.3	-61.8	161.7	0	0	0	109.4	T849 F850 I852 L866 F868 Y876 T882	T849-I886 CarbonylContact C-O 3.53Å; T849-I886 WeakPolarHBondContact CA-O 3.49Å; F850-I886 PolarHBondContact N-O 2.83Å; F850-I886 PolarHBondContact O-N 2.82Å; I852-I886 HydrophobicContact CD1-CD1 3.75Å; I852-I886 HydrophobicContact CG1-CD1 4.47Å; L866-I886 HydrophobicContact CD2-CB 4.19Å; L866-I886 HydrophobicContact CD2-CD1 3.75Å; L866-I886 HydrophobicContact CD2-CG2 3.95Å; F868-I886 HydrophobicContact CE1-CG2 4.42Å; F868-I886 HydrophobicContact CZ-CG2 3.85Å; Y876-I886 HydrophobicContact CD2-CD1 4.02Å; Y876-I886 HydrophobicContact CE2-CD1 3.54Å; Y876-I886 HydrophobicContact CE2-CG1 4.08Å; Y876-I886 HydrophobicContact CE2-CG2 4.42Å; Y876-I886 WeakPolarHBondContact OH-CG2 3.42Å; T882-I886 HydrophobicContact CG2-CD1 3.88Å; T882-I886 HydrophobicContact CG2-CG1 3.81Å
887	K	88	Confident	78.5	Confident	138 Å²	138	80.8 Å²	80.8	60%	0.6	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	133.6	-176.5	-69.4	169.5	-174.4	167.9	0	111.7	V848 T849	V848-K887 WeakPolarHBondContact O-CA 3.3Å; T849-K887 HydrophobicContact CG2-CG 4.05Å; T849-K887 WeakPolarHBondContact OG1-CG 3.23Å
888	H	90.5	Very high	79.6	Confident	23 Å²	23	76.6 Å²	76.6	11%	0.106	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	156.7	175.9	-170.6	35.3	0	0	0	112.2	V848 F850 F868 D870 Y890	V848-H888 PolarHBondContact N-O 2.57Å; V848-H888 PolarHBondContact O-N 2.89Å; F850-H888 HydrophobicContact CE2-CB 4.18Å; F868-H888 HydrophobicContact CD1-CB 3.95Å; F868-H888 AromaticContact CD1-CD2 3.51Å; F868-H888 AromaticContact CD1-CG 3.9Å; F868-H888 AromaticContact CD2-CD2 3.84Å; F868-H888 HydrophobicContact CE1-CB 3.64Å; F868-H888 HydrophobicContact CE2-CB 4.44Å; F868-H888 HydrophobicContact CG-CB 4.46Å; F868-H888 AromaticContact CG-CD2 3.36Å; F868-H888 WeakPolarHBondContact CG-CD2 3.14Å; F868-H888 AromaticContact CG-CG 3.94Å; F868-H888 AromaticContact CG-NE2 3.86Å; F868-H888 HydrophobicContact CZ-CB 3.91Å; D870-H888 IonicContact OD1-NE2 3.53Å; D870-H888 IonicContact OD2-CD2 3.89Å; D870-H888 IonicContact OD2-CE1 2.77Å; D870-H888 PolarHBondContact OD2-CE1 3.18Å; D870-H888 IonicContact OD2-NE2 3.98Å; D870-H888 PolarHBondContact OD2-NE2 2.84Å; H888-Y890 AromaticContact CD2-CE1 3.96Å; H888-Y890 AromaticContact CD2-CE2 3.76Å; H888-Y890 AromaticContact CD2-CZ 3.64Å
889	I	92.1	Very high	80.8	Confident	73 Å²	73	75.4 Å²	75.4	37%	0.374	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	112.6	-178.6	-55.8	175.5	0	0	0	109.9	N847	N847-I889 WeakPolarHBondContact OD1-CD1 3.22Å; N847-I889 WeakPolarHBondContact OD1-CG1 3.48Å
890	Y	90.4	Very high	82.1	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.008	35%	0.35	C	S	.	.			trans	-79.8	132.7	178.4	-67.6	-90.4	0	0	0	112	G845 V848 F850 F868 D870 H888 Y896 V898 L915 I917	G845-Y890 PolarHBondContact N-O 3.2Å; G845-Y890 VanDerWaalsContact N-O 3.07Å; V848-Y890 HydrophobicContact CB-CE2 4.49Å; V848-Y890 HydrophobicContact CG2-CD2 4.21Å; V848-Y890 HydrophobicContact CG2-CE2 4.32Å; F850-Y890 HydrophobicContact CE2-CE2 4.35Å; F850-Y890 HydrophobicContact CZ-CE2 4.13Å; F868-Y890 HydrophobicContact CB-CE1 4.35Å; F868-Y890 PolarHBondContact O-OH 3.31Å; D870-Y890 HydrophobicContact CB-CD1 4.43Å; D870-Y890 HydrophobicContact CB-CE1 4.43Å; H888-Y890 AromaticContact CD2-CE1 3.96Å; H888-Y890 AromaticContact CD2-CE2 3.76Å; H888-Y890 AromaticContact CD2-CZ 3.64Å; Y890-Y896 AromaticContact CD1-CD1 3.87Å; Y890-Y896 HydrophobicContact CD1-CD1 3.87Å; Y890-Y896 AromaticContact CD1-CD2 3.74Å; Y890-Y896 HydrophobicContact CD1-CD2 3.74Å; Y890-Y896 AromaticContact CD1-CE1 3.87Å; Y890-Y896 HydrophobicContact CD1-CE1 3.87Å; Y890-Y896 AromaticContact CD1-CE2 3.72Å; Y890-Y896 HydrophobicContact CD1-CE2 3.72Å; Y890-Y896 AromaticContact CD1-CG 3.79Å; Y890-Y896 HydrophobicContact CD1-CG 3.79Å; Y890-Y896 AromaticContact CD1-CZ 3.77Å; Y890-Y896 AromaticContact CE1-CD1 3.65Å; Y890-Y896 HydrophobicContact CE1-CD1 3.65Å; Y890-Y896 AromaticContact CE1-CD2 3.92Å; Y890-Y896 HydrophobicContact CE1-CD2 3.92Å; Y890-Y896 HydrophobicContact CE1-CE1 4.11Å; Y890-Y896 HydrophobicContact CE1-CE2 4.34Å; Y890-Y896 AromaticContact CE1-CG 3.53Å; Y890-Y896 HydrophobicContact CE1-CG 3.53Å; Y890-Y896 HydrophobicContact CG-CD2 4.49Å; Y890-Y896 HydrophobicContact CG-CE2 4.39Å; Y890-V898 VanDerWaalsContact OH-CG2 3.25Å; Y890-V898 WeakPolarHBondContact OH-CG2 3.48Å; Y890-L915 HydrophobicContact CD2-CD2 4.23Å; Y890-L915 HydrophobicContact CE2-CD2 3.5Å; Y890-I917 HydrophobicContact CD1-CG1 4.14Å; Y890-I917 HydrophobicContact CD2-CD1 3.51Å; Y890-I917 HydrophobicContact CD2-CG1 3.9Å; Y890-I917 HydrophobicContact CE2-CD1 4.16Å; Y890-I917 HydrophobicContact CG-CD1 3.8Å; Y890-I917 HydrophobicContact CG-CG1 3.65Å
891	R	87.9	Confident	83.7	Confident	227 Å²	227	73 Å²	73	86%	0.857	34%	0.339	S	S	*	.			trans	-101.2	-1.6	-174.7	-62.8	-172.4	179.5	-160.1	0.7	115.2
892	K	85.3	Confident	85.2	Confident	152 Å²	152	63 Å²	63	66%	0.661	30%	0.301	S	S	*	.	S	Bend	trans	-140.7	154.5	176.5	-64.8	179.2	179.6	178.2	0	108.7	Y896 I917	K892-Y896 WeakPolarHBondContact CB-OH 3.5Å; K892-Y896 PolarHBondContact O-OH 2.76Å; K892-Y896 VanDerWaalsContact O-OH 3.12Å; K892-I917 WeakPolarHBondContact O-CG2 3.35Å
893	T	84	Confident	86.5	Confident	42 Å²	42	67.6 Å²	67.6	26%	0.258	32%	0.322	S	S	.	.			trans	-74.8	155.2	168.5	45.5	0	0	0	0	110.9	I844 I917	I844-T893 HydrophobicContact CD1-CG2 4.39Å; T893-I917 VanDerWaalsContact CA-O 3.27Å; T893-I917 WeakPolarHBondContact CA-O 3.43Å; T893-I917 WeakPolarHBondContact CB-O 3.37Å
894	G	85.6	Confident	87.8	Confident	16 Å²	16	62.6 Å²	62.6	17%	0.165	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.9	175	-179.5	0	0	0	0	0	113.2	I917	G894-I917 PolarHBondContact N-O 3.02Å; G894-I917 PolarHBondContact O-N 2.9Å
895	I	87.6	Confident	88.6	Confident	111 Å²	111	61.3 Å²	61.3	57%	0.569	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	116.2	172.1	-59.7	171.2	0	0	0	108	F914	I895-F914 HydrophobicContact CG2-CD1 4.3Å
896	Y	90.5	Very high	88.9	Confident	30 Å²	30	64.7 Å²	64.7	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.4	-179.6	-67.9	-89.9	0	0	0	110.3	D870 Y890 K892 F914 L915 I917	D870-Y896 HydrophobicContact CB-CD1 3.97Å; D870-Y896 HydrophobicContact CB-CE1 3.54Å; Y890-Y896 AromaticContact CD1-CD1 3.87Å; Y890-Y896 HydrophobicContact CD1-CD1 3.87Å; Y890-Y896 AromaticContact CD1-CD2 3.74Å; Y890-Y896 HydrophobicContact CD1-CD2 3.74Å; Y890-Y896 AromaticContact CD1-CE1 3.87Å; Y890-Y896 HydrophobicContact CD1-CE1 3.87Å; Y890-Y896 AromaticContact CD1-CE2 3.72Å; Y890-Y896 HydrophobicContact CD1-CE2 3.72Å; Y890-Y896 AromaticContact CD1-CG 3.79Å; Y890-Y896 HydrophobicContact CD1-CG 3.79Å; Y890-Y896 AromaticContact CD1-CZ 3.77Å; Y890-Y896 AromaticContact CE1-CD1 3.65Å; Y890-Y896 HydrophobicContact CE1-CD1 3.65Å; Y890-Y896 AromaticContact CE1-CD2 3.92Å; Y890-Y896 HydrophobicContact CE1-CD2 3.92Å; Y890-Y896 HydrophobicContact CE1-CE1 4.11Å; Y890-Y896 HydrophobicContact CE1-CE2 4.34Å; Y890-Y896 AromaticContact CE1-CG 3.53Å; Y890-Y896 HydrophobicContact CE1-CG 3.53Å; Y890-Y896 HydrophobicContact CG-CD2 4.49Å; Y890-Y896 HydrophobicContact CG-CE2 4.39Å; K892-Y896 WeakPolarHBondContact CB-OH 3.5Å; K892-Y896 PolarHBondContact O-OH 2.76Å; K892-Y896 VanDerWaalsContact O-OH 3.12Å; Y896-F914 WeakPolarHBondContact O-CA 3.41Å; Y896-L915 PolarHBondContact N-O 3.07Å; Y896-L915 PolarHBondContact O-N 2.94Å; Y896-I917 HydrophobicContact CD2-CB 4.13Å; Y896-I917 HydrophobicContact CD2-CG1 3.55Å; Y896-I917 HydrophobicContact CE2-CB 3.9Å; Y896-I917 HydrophobicContact CE2-CG1 3.69Å
897	R	93.6	Very high	88.9	Confident	135 Å²	135	65.7 Å²	65.7	51%	0.509	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	96.6	171.4	-175.7	-174.9	175.2	-146	-4	108.4	I899 F914	R897-I899 HydrophobicContact CG-CD1 4.36Å; R897-I899 HydrophobicContact CG-CG1 4.07Å; R897-F914 HydrophobicContact CB-CD1 4.03Å; R897-F914 HydrophobicContact CB-CE1 3.78Å; R897-F914 HydrophobicContact CG-CD1 4.22Å; R897-F914 HydrophobicContact CG-CE1 3.73Å; R897-F914 HydrophobicContact CG-CZ 4.02Å
898	V	94.1	Very high	89	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	133.6	174.1	-170.5	0	0	0	0	108.3	L833 F850 L866 D867 F868 Y890 A912 L913 L915	L833-V898 HydrophobicContact CD2-CB 4.08Å; L833-V898 HydrophobicContact CD2-CG1 3.75Å; F850-V898 HydrophobicContact CD1-CG1 4.3Å; F850-V898 HydrophobicContact CE1-CB 4.3Å; F850-V898 HydrophobicContact CE1-CG1 4Å; F850-V898 HydrophobicContact CE1-CG2 3.85Å; F850-V898 HydrophobicContact CZ-CG1 4.38Å; F850-V898 HydrophobicContact CZ-CG2 3.93Å; L866-V898 HydrophobicContact CD1-CG1 3.74Å; L866-V898 HydrophobicContact CG-CG1 4.36Å; D867-V898 CarbonylContact O-C 3.54Å; D867-V898 VanDerWaalsContact O-CA 3.25Å; D867-V898 WeakPolarHBondContact O-CA 3.13Å; D867-V898 WeakPolarHBondContact O-CG1 3.48Å; F868-V898 HydrophobicContact CD1-CG1 4.3Å; Y890-V898 VanDerWaalsContact OH-CG2 3.25Å; Y890-V898 WeakPolarHBondContact OH-CG2 3.48Å; V898-A912 CarbonylContact O-C 3.59Å; V898-A912 VanDerWaalsContact O-CA 3.32Å; V898-A912 WeakPolarHBondContact O-CA 3.43Å; V898-L913 HydrophobicContact CB-CB 4.47Å; V898-L913 PolarHBondContact N-O 2.99Å; V898-L913 PolarHBondContact O-N 3.25Å; V898-L915 HydrophobicContact CG2-CB 4.47Å
899	I	93.8	Very high	89.1	Confident	33 Å²	33	64 Å²	64	17%	0.169	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	118.3	-179	-51.1	176.7	0	0	0	108.9	D867 R897 S911 A912	D867-I899 HydrophobicContact CB-CB 4.41Å; D867-I899 PolarHBondContact N-O 3.27Å; D867-I899 PolarHBondContact O-N 3.27Å; R897-I899 HydrophobicContact CG-CD1 4.36Å; R897-I899 HydrophobicContact CG-CG1 4.07Å; I899-S911 WeakPolarHBondContact CA-O 3.33Å; I899-A912 HydrophobicContact CG1-CB 4.3Å
900	A	92.6	Very high	89.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133.3	164.3	0	0	0	0	0	108.7	L831 L833 I852 Q865 L866 S910 S911	L831-A900 HydrophobicContact CD2-CB 4Å; L831-A900 VanDerWaalsContact CD2-O 3.3Å; L831-A900 WeakPolarHBondContact CD2-O 3.13Å; L833-A900 HydrophobicContact CB-CB 4.21Å; L833-A900 HydrophobicContact CD1-CB 4.38Å; L833-A900 HydrophobicContact CD2-CB 4.18Å; L833-A900 HydrophobicContact CG-CB 4.49Å; I852-A900 HydrophobicContact CD1-CB 4.22Å; Q865-A900 CarbonylContact O-C 3.59Å; Q865-A900 WeakPolarHBondContact O-CA 3.4Å; L866-A900 HydrophobicContact CD1-CB 3.91Å; A900-S910 CarbonylContact O-C 3.51Å; A900-S910 VanDerWaalsContact O-CA 3.29Å; A900-S910 WeakPolarHBondContact O-CA 3.22Å; A900-S911 PolarHBondContact N-O 2.83Å; A900-S911 PolarHBondContact O-N 3.19Å
901	T	91.8	Very high	89.3	Confident	41 Å²	41	65 Å²	65	25%	0.252	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.2	173.1	-54.6	0	0	0	0	108.3	I864 Q865 D909	I864-T901 CarbonylContact C-O 3.49Å; I864-T901 VanDerWaalsContact CA-O 3.31Å; I864-T901 WeakPolarHBondContact CA-O 3.09Å; Q865-T901 PolarHBondContact N-O 2.87Å; Q865-T901 PolarHBondContact O-N 3.01Å; T901-D909 CarbonylContact C-O 3.57Å; T901-D909 WeakPolarHBondContact CA-O 3.45Å
902	A	89.6	Confident	89.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.2	173.1	0	0	0	0	0	108.9	P828 L831 L854 T862 S863 I864 S908 D909	P828-A902 HydrophobicContact CB-CB 3.89Å; P828-A902 HydrophobicContact CG-CB 4.3Å; L831-A902 HydrophobicContact CD1-CB 3.96Å; L831-A902 HydrophobicContact CD2-CB 3.93Å; L854-A902 HydrophobicContact CD2-CB 4.39Å; T862-A902 HydrophobicContact CG2-CB 4.32Å; S863-A902 WeakPolarHBondContact O-CA 3.42Å; I864-A902 HydrophobicContact CG1-CB 4.07Å; A902-S908 CarbonylContact O-C 3.56Å; A902-S908 WeakPolarHBondContact O-CA 3.32Å; A902-S908 VanDerWaalsContact O-CB 3.3Å; A902-S908 WeakPolarHBondContact O-CB 3.34Å; A902-D909 PolarHBondContact N-O 2.65Å; A902-D909 PolarHBondContact O-N 3Å
903	E	89.3	Confident	89.8	Confident	107 Å²	107	50.5 Å²	50.5	50%	0.5	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137.5	-175.2	-179.3	175.1	-171.7	0	0	110.3	T862 S863	T862-E903 CarbonylContact C-O 3.57Å; T862-E903 VanDerWaalsContact CA-O 3.3Å; T862-E903 WeakPolarHBondContact CA-O 3.06Å; S863-E903 PolarHBondContact N-O 3.03Å; S863-E903 PolarHBondContact O-N 3.48Å; S863-E903 PolarHBondContact OG-O 2.85Å
904	N	86.7	Confident	90.1	Very high	14 Å²	14	54.5 Å²	54.5	8%	0.075	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	178.9	167.4	76.8	29.1	0	0	0	110.7	K826 P828 G857 T862 L906 G907	K826-N904 PolarHBondContact O-ND2 3.28Å; P828-N904 HydrophobicContact CG-CB 4.41Å; G857-N904 PolarHBondContact O-ND2 2.84Å; T862-N904 HydrophobicContact CG2-CB 4.36Å; T862-N904 PolarHBondContact OG1-ND2 2.87Å; N904-L906 PolarHBondContact O-N 3.03Å; N904-L906 WeakPolarHBondContact OD1-CB 3.49Å; N904-L906 PolarHBondContact OD1-N 3.34Å; N904-G907 PolarHBondContact N-O 3.13Å; N904-G907 PolarHBondContact O-N 2.8Å; N904-G907 VanDerWaalsContact O-O 3.08Å
905	H	83.4	Confident	90.3	Very high	122 Å²	122	53.8 Å²	53.8	57%	0.565	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	1.6	-175.9	65	-94.1	0	0	0	116
906	L	83.4	Confident	90.2	Very high	83 Å²	83	50.6 Å²	50.6	44%	0.435	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-8.7	175.6	-58.9	176.2	0	0	0	113.8	P825 P827 N904	P825-L906 HydrophobicContact CB-CD1 3.77Å; P825-L906 HydrophobicContact CG-CD1 4.02Å; P825-L906 WeakPolarHBondContact O-CD1 3.46Å; P827-L906 HydrophobicContact CB-CB 4.12Å; N904-L906 PolarHBondContact O-N 3.03Å; N904-L906 WeakPolarHBondContact OD1-CB 3.49Å; N904-L906 PolarHBondContact OD1-N 3.34Å
907	G	87.1	Confident	90.1	Very high	31 Å²	31	49.2 Å²	49.2	32%	0.32	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	150.2	-171.3	-179.3	0	0	0	0	0	113.6	P828 N904	P828-G907 WeakPolarHBondContact CD-O 3.28Å; N904-G907 PolarHBondContact N-O 3.13Å; N904-G907 PolarHBondContact O-N 2.8Å; N904-G907 VanDerWaalsContact O-O 3.08Å
908	S	90.8	Very high	89.7	Confident	78 Å²	78	43.7 Å²	43.7	55%	0.545	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.5	-179.4	54.6	0	0	0	0	113	A902	A902-S908 CarbonylContact O-C 3.56Å; A902-S908 WeakPolarHBondContact O-CA 3.32Å; A902-S908 VanDerWaalsContact O-CB 3.3Å; A902-S908 WeakPolarHBondContact O-CB 3.34Å
909	D	92.1	Very high	89.1	Confident	46 Å²	46	44.6 Å²	44.6	25%	0.246	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.9	171.6	-169.1	10.1	0	0	0	109.3	P828 Q829 G830 L831 T901 A902	P828-D909 HydrophobicContact CB-CB 4.11Å; P828-D909 WeakPolarHBondContact O-CB 3.5Å; Q829-D909 WeakPolarHBondContact CA-OD2 3.27Å; G830-D909 PolarHBondContact N-OD2 2.71Å; L831-D909 HydrophobicContact CB-CB 4.23Å; L831-D909 WeakPolarHBondContact CD2-O 3.45Å; L831-D909 PolarHBondContact N-OD2 2.93Å; T901-D909 CarbonylContact C-O 3.57Å; T901-D909 WeakPolarHBondContact CA-O 3.45Å; A902-D909 PolarHBondContact N-O 2.65Å; A902-D909 PolarHBondContact O-N 3Å
910	S	92.6	Very high	88.4	Confident	77 Å²	77	46.9 Å²	46.9	54%	0.538	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	135.7	-175.7	70.9	0	0	0	0	112.9	A900	A900-S910 CarbonylContact O-C 3.51Å; A900-S910 VanDerWaalsContact O-CA 3.29Å; A900-S910 WeakPolarHBondContact O-CA 3.22Å
911	S	93.1	Very high	87.9	Confident	21 Å²	21	47.6 Å²	47.6	15%	0.147	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.3	-176.3	-149.6	0	0	0	0	109.2	L831 L833 I899 A900	L831-S911 WeakPolarHBondContact O-CB 3.21Å; L831-S911 PolarHBondContact O-OG 2.86Å; L833-S911 PolarHBondContact N-OG 3.2Å; I899-S911 WeakPolarHBondContact CA-O 3.33Å; A900-S911 PolarHBondContact N-O 2.83Å; A900-S911 PolarHBondContact O-N 3.19Å
912	A	92.3	Very high	87.5	Confident	48 Å²	48	51.7 Å²	51.7	40%	0.397	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.6	-177.3	0	0	0	0	0	111.9	V898 I899	V898-A912 CarbonylContact O-C 3.59Å; V898-A912 VanDerWaalsContact O-CA 3.32Å; V898-A912 WeakPolarHBondContact O-CA 3.43Å; I899-A912 HydrophobicContact CG1-CB 4.3Å
913	L	91.6	Very high	87.2	Confident	25 Å²	25	59.2 Å²	59.2	13%	0.131	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.4	179	-169.2	71.9	0	0	0	109.1	L833 T835 L840 F850 V898	L833-L913 HydrophobicContact CD2-CB 3.7Å; L833-L913 HydrophobicContact CG-CB 4.01Å; L833-L913 HydrophobicContact CG-CD2 4.37Å; T835-L913 HydrophobicContact CG2-CD2 4.13Å; L840-L913 HydrophobicContact CD2-CD1 3.63Å; L840-L913 HydrophobicContact CD2-CG 4.2Å; F850-L913 HydrophobicContact CD1-CD2 4.42Å; F850-L913 HydrophobicContact CE1-CD2 4.26Å; V898-L913 HydrophobicContact CB-CB 4.47Å; V898-L913 PolarHBondContact N-O 2.99Å; V898-L913 PolarHBondContact O-N 3.25Å
914	F	90.7	Very high	87.1	Confident	126 Å²	126	54.8 Å²	54.8	55%	0.553	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.3	171.1	-67.2	-84.6	0	0	0	109.3	I895 Y896 R897	I895-F914 HydrophobicContact CG2-CD1 4.3Å; Y896-F914 WeakPolarHBondContact O-CA 3.41Å; R897-F914 HydrophobicContact CB-CD1 4.03Å; R897-F914 HydrophobicContact CB-CE1 3.78Å; R897-F914 HydrophobicContact CG-CD1 4.22Å; R897-F914 HydrophobicContact CG-CE1 3.73Å; R897-F914 HydrophobicContact CG-CZ 4.02Å
915	L	89.3	Confident	87.1	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.9	-177.6	-178.5	70.4	0	0	0	109.6	V848 F850 Y890 Y896 V898 I917	V848-L915 HydrophobicContact CG1-CD2 3.95Å; V848-L915 HydrophobicContact CG2-CD2 4.28Å; F850-L915 HydrophobicContact CE1-CD2 4.26Å; F850-L915 HydrophobicContact CZ-CD2 3.76Å; Y890-L915 HydrophobicContact CD2-CD2 4.23Å; Y890-L915 HydrophobicContact CE2-CD2 3.5Å; Y896-L915 PolarHBondContact N-O 3.07Å; Y896-L915 PolarHBondContact O-N 2.94Å; V898-L915 HydrophobicContact CG2-CB 4.47Å; L915-I917 HydrophobicContact CD2-CD1 3.82Å; L915-I917 HydrophobicContact CG-CD1 4.01Å
916	H	86.8	Confident	87.4	Confident	45 Å²	45	52.8 Å²	52.8	21%	0.208	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.5	178.7	-170.6	-166.7	0	0	0	110.8	L840 S841 A842 T951	L840-H916 PolarHBondContact O-N 2.8Å; S841-H916 CarbonylContact C-O 3.58Å; S841-H916 VanDerWaalsContact CA-O 3.25Å; S841-H916 WeakPolarHBondContact CA-O 3.26Å; A842-H916 PolarHBondContact N-O 2.82Å; H916-T951 PolarHBondContact CE1-O 3.34Å; H916-T951 VanDerWaalsContact CE1-O 3.29Å; H916-T951 WeakPolarHBondContact NE2-CB 3.29Å; H916-T951 PolarHBondContact NE2-O 2.99Å
917	I	87.6	Confident	87.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	110.8	174.8	-56.6	-61.8	0	0	0	109.4	A842 I844 Y890 K892 T893 G894 Y896 L915	A842-I917 HydrophobicContact CB-CD1 3.95Å; A842-I917 WeakPolarHBondContact O-CA 3.23Å; I844-I917 HydrophobicContact CB-CG2 4.1Å; Y890-I917 HydrophobicContact CD1-CG1 4.14Å; Y890-I917 HydrophobicContact CD2-CD1 3.51Å; Y890-I917 HydrophobicContact CD2-CG1 3.9Å; Y890-I917 HydrophobicContact CE2-CD1 4.16Å; Y890-I917 HydrophobicContact CG-CD1 3.8Å; Y890-I917 HydrophobicContact CG-CG1 3.65Å; K892-I917 WeakPolarHBondContact O-CG2 3.35Å; T893-I917 VanDerWaalsContact CA-O 3.27Å; T893-I917 WeakPolarHBondContact CA-O 3.43Å; T893-I917 WeakPolarHBondContact CB-O 3.37Å; G894-I917 PolarHBondContact N-O 3.02Å; G894-I917 PolarHBondContact O-N 2.9Å; Y896-I917 HydrophobicContact CD2-CB 4.13Å; Y896-I917 HydrophobicContact CD2-CG1 3.55Å; Y896-I917 HydrophobicContact CE2-CB 3.9Å; Y896-I917 HydrophobicContact CE2-CG1 3.69Å; L915-I917 HydrophobicContact CD2-CD1 3.82Å; L915-I917 HydrophobicContact CG-CD1 4.01Å
918	T	84.5	Confident	87.4	Confident	18 Å²	18	48.1 Å²	48.1	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	161.1	-179.8	56.1	0	0	0	0	111.6	A842 A843 I844	A842-T918 PolarHBondContact O-N 2.78Å; A843-T918 CarbonylContact C-O 3.45Å; I844-T918 PolarHBondContact N-O 2.84Å
919	S	81.5	Confident	87.1	Confident	19 Å²	19	45 Å²	45	13%	0.133	24%	0.239	C	C	.	.			trans	-122.6	156.3	160.5	73.5	0	0	0	0	107.9	H948 C990	S919-H948 PolarHBondContact OG-NE2 3.15Å; S919-C990 PolarHBondContact O-SG 3.18Å
920	P	79.3	Confident	86.6	Confident	82 Å²	82	44.5 Å²	44.5	53%	0.532	24%	0.236	S	C	.	.			trans	-53.1	151	169.8	23.7	-34.2	0	0	0	111.3
921	V	82.5	Confident	86.1	Confident	15 Å²	15	40.9 Å²	40.9	9%	0.091	21%	0.21	C	C	.	.			trans	-101.5	130.5	161.9	179	0	0	0	0	105.8	V924 V944 L952 C990 L995	V921-V924 HydrophobicContact CG1-CG2 4.14Å; V921-V944 HydrophobicContact CB-CG1 4.36Å; V921-V944 HydrophobicContact CG1-CG1 3.35Å; V921-V944 HydrophobicContact CG2-CG1 4.05Å; V921-L952 HydrophobicContact CG2-CD2 3.9Å; V921-C990 HydrophobicContact CG2-CB 3.74Å; V921-L995 HydrophobicContact CB-CD1 4.02Å; V921-L995 HydrophobicContact CG1-CD1 3.73Å; V921-L995 WeakPolarHBondContact O-CD1 3.31Å
922	D	82.5	Confident	85.7	Confident	126 Å²	126	40.2 Å²	40.2	67%	0.674	21%	0.206	S	C	*	.			trans	-94.2	-32.8	-179.4	-56.7	-44.4	0	0	0	111.4	W945	D922-W945 PolarHBondContact N-O 3.27Å
923	R	83.3	Confident	85.2	Confident	159 Å²	159	40.1 Å²	40.1	60%	0.6	20%	0.198	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-152.2	146.6	-179.4	-172.4	173.5	-177.3	-179	2.4	112.7	W945	R923-W945 HydrophobicContact CB-CE3 4.01Å; R923-W945 HydrophobicContact CG-CE3 4.02Å; R923-W945 HydrophobicContact CG-CZ3 4.23Å; R923-W945 PolarHBondContact N-O 3.47Å; R923-W945 PolarHBondContact O-N 2.95Å
924	V	87.7	Confident	84.8	Confident	13 Å²	13	41.7 Å²	41.7	8%	0.079	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	151.7	166.9	178.6	0	0	0	0	108.6	V921 V943 V986 V988 L995 D997	V921-V924 HydrophobicContact CG1-CG2 4.14Å; V924-V943 CarbonylContact C-O 3.59Å; V924-V943 WeakPolarHBondContact CA-O 3.41Å; V924-V986 HydrophobicContact CG1-CG1 4.3Å; V924-V988 HydrophobicContact CB-CG2 4.46Å; V924-V988 HydrophobicContact CG1-CG2 3.75Å; V924-V988 HydrophobicContact CG2-CB 3.9Å; V924-V988 HydrophobicContact CG2-CG2 3.77Å; V924-L995 HydrophobicContact CG2-CB 3.79Å; V924-L995 HydrophobicContact CG2-CD1 4.32Å; V924-D997 HydrophobicContact CG1-CB 4.3Å
925	Y	87.1	Confident	84.5	Confident	95 Å²	95	41.4 Å²	41.4	37%	0.373	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	131.8	169	175.7	-109.3	0	0	0	111.4	S927 V943 W945 D997	Y925-S927 PolarHBondContact O-N 3.07Å; Y925-V943 PolarHBondContact N-O 2.88Å; Y925-V943 PolarHBondContact O-N 3.12Å; Y925-W945 HydrophobicContact CG-CH2 4.48Å; Y925-D997 VanDerWaalsContact CA-OD2 3.31Å; Y925-D997 WeakPolarHBondContact CA-OD2 3.06Å
926	L	89.1	Confident	84.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	95.9	177.4	178.7	51.6	0	0	0	111.1	A928 W956 V984 V986 D997 K999	L926-A928 HydrophobicContact CD1-CB 4.37Å; L926-A928 HydrophobicContact CG-CB 4.32Å; L926-A928 PolarHBondContact O-N 2.99Å; L926-W956 HydrophobicContact CD1-CH2 4.42Å; L926-W956 HydrophobicContact CD1-CZ3 3.73Å; L926-V984 HydrophobicContact CD2-CB 4.27Å; L926-V984 HydrophobicContact CD2-CG1 4.04Å; L926-V986 HydrophobicContact CB-CG1 4.1Å; L926-V986 HydrophobicContact CD1-CG1 4.14Å; L926-V986 HydrophobicContact CD2-CG1 4.39Å; L926-V986 HydrophobicContact CG-CG1 4.44Å; L926-D997 HydrophobicContact CB-CB 4.28Å; L926-D997 PolarHBondContact N-OD2 2.93Å; L926-K999 HydrophobicContact CD2-CB 3.98Å; L926-K999 HydrophobicContact CG-CB 4.31Å
927	S	86.2	Confident	84.2	Confident	14 Å²	14	47 Å²	47	10%	0.098	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120.6	166	-174.1	0	0	0	0	109.6	Y925 T941	Y925-S927 PolarHBondContact O-N 3.07Å; S927-T941 WeakPolarHBondContact CA-O 3.49Å; S927-T941 WeakPolarHBondContact CB-O 3.44Å; S927-T941 WeakPolarHBondContact CB-OG1 3.2Å; S927-T941 PolarHBondContact N-O 2.86Å; S927-T941 PolarHBondContact O-N 3.48Å
928	A	85.6	Confident	84.1	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.017	24%	0.241	C	C	.	.			trans	-157.8	150.8	-176.5	0	0	0	0	0	110.2	L926 L940 K999 I1001	L926-A928 HydrophobicContact CD1-CB 4.37Å; L926-A928 HydrophobicContact CG-CB 4.32Å; L926-A928 PolarHBondContact O-N 2.99Å; A928-L940 HydrophobicContact CB-CD2 3.35Å; A928-K999 HydrophobicContact CB-CD 4.26Å; A928-K999 PolarHBondContact O-NZ 2.85Å; A928-I1001 HydrophobicContact CB-CD1 3.93Å
929	P	83.8	Confident	84.4	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.078	27%	0.266	C	S	.	.			trans	-60.3	151.6	171.8	27.5	-34.9	0	0	0	111.9	A938 N939 I1001 V1124	P929-A938 HydrophobicContact CG-CB 4.01Å; P929-N939 VanDerWaalsContact CD-O 3.29Å; P929-N939 WeakPolarHBondContact CD-O 3.36Å; P929-I1001 WeakPolarHBondContact O-CG1 3.07Å; P929-V1124 HydrophobicContact CB-CG2 4.28Å
930	I	81.7	Confident	84.8	Confident	35 Å²	35	51.2 Å²	51.2	18%	0.179	26%	0.26	C	S	.	.	S	Bend	trans	-87.7	-41.1	-177.9	-59.3	179.9	0	0	0	110.1	T1002 M1052 S1054 F1066	I930-T1002 PolarHBondContact O-N 3.42Å; I930-M1052 HydrophobicContact CG2-CE 3.43Å; I930-M1052 VanDerWaalsContact CG2-CE 3.43Å; I930-M1052 HydrophobicContact CG2-SD 4.04Å; I930-S1054 WeakPolarHBondContact CD1-OG 3.35Å; I930-F1066 HydrophobicContact CB-CE2 4.46Å
931	V	82.6	Confident	85.3	Confident	1 Å²	1	50 Å²	50	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136	172	-168	0	0	0	0	108.9	T1002 F1007 M1052 F1066 L1068	V931-T1002 CarbonylContact C-O 3.57Å; V931-T1002 VanDerWaalsContact CA-O 3.27Å; V931-T1002 WeakPolarHBondContact CA-O 3.47Å; V931-T1002 WeakPolarHBondContact CG1-O 3.44Å; V931-F1007 HydrophobicContact CB-CD1 4.46Å; V931-F1007 HydrophobicContact CB-CE1 4.05Å; V931-F1007 HydrophobicContact CB-CZ 4.13Å; V931-F1007 HydrophobicContact CG1-CD1 3.56Å; V931-F1007 HydrophobicContact CG1-CE1 3.5Å; V931-F1007 HydrophobicContact CG1-CG 4.15Å; V931-F1007 HydrophobicContact CG1-CZ 4.07Å; V931-M1052 HydrophobicContact CG2-SD 3.84Å; V931-F1066 HydrophobicContact CB-CD1 4.33Å; V931-F1066 HydrophobicContact CB-CG 4.41Å; V931-F1066 HydrophobicContact CG2-CB 4.06Å; V931-F1066 HydrophobicContact CG2-CD1 4.05Å; V931-F1066 HydrophobicContact CG2-CD2 3.72Å; V931-F1066 HydrophobicContact CG2-CE1 4.5Å; V931-F1066 HydrophobicContact CG2-CE2 4.21Å; V931-F1066 HydrophobicContact CG2-CG 3.64Å; V931-L1068 HydrophobicContact CG1-CD2 4.24Å
932	A	84.4	Confident	85.7	Confident	7 Å²	7	49.8 Å²	49.8	6%	0.058	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.3	177.7	0	0	0	0	0	111.4	A938 F976 I1001 T1002 V1003 K1004	A932-A938 HydrophobicContact CB-CB 4.46Å; A932-F976 HydrophobicContact CB-CD2 4.12Å; A932-F976 HydrophobicContact CB-CE2 4.44Å; A932-I1001 HydrophobicContact CB-CG2 3.86Å; A932-T1002 PolarHBondContact N-O 2.8Å; A932-V1003 HydrophobicContact CB-CG2 4.38Å; A932-V1003 WeakPolarHBondContact O-CA 3.33Å; A932-K1004 PolarHBondContact O-N 2.86Å; A932-K1004 VanDerWaalsContact O-N 3.1Å
933	I	82.4	Confident	85.9	Confident	46 Å²	46	46.6 Å²	46.6	24%	0.236	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.6	177.3	-56.1	178.4	0	0	0	108.3	K936 K1004 F1007	I933-K936 HydrophobicContact CB-CB 3.98Å; I933-K936 HydrophobicContact CB-CD 4.04Å; I933-K936 HydrophobicContact CD1-CD 3.97Å; I933-K936 HydrophobicContact CG1-CD 4.39Å; I933-K936 HydrophobicContact CG2-CB 4.35Å; I933-K936 WeakPolarHBondContact O-CB 3.24Å; I933-K936 PolarHBondContact O-N 3.31Å; I933-K1004 WeakPolarHBondContact CA-O 3.46Å; I933-F1007 HydrophobicContact CD1-CE1 4.26Å; I933-F1007 HydrophobicContact CG1-CD1 4.09Å; I933-F1007 HydrophobicContact CG1-CE1 3.51Å; I933-F1007 HydrophobicContact CG1-CZ 4.25Å
934	R	83.3	Confident	86.1	Confident	58 Å²	58	39.7 Å²	39.7	22%	0.219	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	144.9	176.6	-157.8	-175.5	72.1	-138.8	-8.4	110.9	K936 F976 L977 E979 V1003 K1004 E1005	R934-K936 PolarHBondContact O-N 2.95Å; R934-F976 WeakPolarHBondContact CG-O 3.48Å; R934-L977 WeakPolarHBondContact CD-O 3.41Å; R934-E979 IonicContact NH1-OE2 3Å; R934-E979 PolarHBondContact NH1-OE2 3.04Å; R934-V1003 HydrophobicContact CB-CG1 4.12Å; R934-V1003 HydrophobicContact CG-CG1 4.37Å; R934-K1004 PolarHBondContact N-O 2.68Å; R934-E1005 IonicContact CZ-OE1 2.71Å; R934-E1005 IonicContact NH1-OE1 2.8Å; R934-E1005 PolarHBondContact NH1-OE1 2.04Å; R934-E1005 IonicContact NH2-OE1 2.78Å; R934-E1005 PolarHBondContact NH2-OE1 3.3Å
935	E	83	Confident	85.8	Confident	120 Å²	120	44.7 Å²	44.7	56%	0.561	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	3.5	-179	-62.9	154.5	-112.4	0	0	115.2	F976 L977	E935-F976 PolarHBondContact N-O 3.17Å; E935-L977 HydrophobicContact CG-CD2 4.46Å
936	K	84.7	Confident	85.4	Confident	104 Å²	104	43 Å²	43	45%	0.452	23%	0.229	S	C	.	.	S	Bend	trans	-100	144.2	174.6	-163.2	175.9	-177.9	179.6	0	110.6	I933 R934 A938	I933-K936 HydrophobicContact CB-CB 3.98Å; I933-K936 HydrophobicContact CB-CD 4.04Å; I933-K936 HydrophobicContact CD1-CD 3.97Å; I933-K936 HydrophobicContact CG1-CD 4.39Å; I933-K936 HydrophobicContact CG2-CB 4.35Å; I933-K936 WeakPolarHBondContact O-CB 3.24Å; I933-K936 PolarHBondContact O-N 3.31Å; R934-K936 PolarHBondContact O-N 2.95Å; K936-A938 PolarHBondContact O-N 3.01Å
937	A	84.9	Confident	84.7	Confident	59 Å²	59	48.4 Å²	48.4	49%	0.488	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.1	175.3	0	0	0	0	0	111.2	H974 M975	A937-H974 WeakPolarHBondContact CA-O 3.41Å; A937-M975 HydrophobicContact CB-CG 4.13Å
938	A	86.4	Confident	83.9	Confident	10 Å²	10	49.1 Å²	49.1	8%	0.083	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	129.1	170.8	0	0	0	0	0	109.5	P929 A932 K936 S973 H974 F976	P929-A938 HydrophobicContact CG-CB 4.01Å; A932-A938 HydrophobicContact CB-CB 4.46Å; K936-A938 PolarHBondContact O-N 3.01Å; A938-S973 WeakPolarHBondContact O-CA 2.87Å; A938-H974 PolarHBondContact N-O 3.04Å; A938-H974 PolarHBondContact O-N 2.72Å; A938-F976 HydrophobicContact CB-CD2 4.37Å; A938-F976 HydrophobicContact CB-CE2 3.93Å
939	N	89.8	Confident	82.7	Confident	117 Å²	117	54.4 Å²	54.4	63%	0.626	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	134.4	175.9	-68.8	-14	0	0	0	110.3	P929	P929-N939 VanDerWaalsContact CD-O 3.29Å; P929-N939 WeakPolarHBondContact CD-O 3.36Å
940	L	90.1	Very high	81.8	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.2	-177.5	-57.3	167.6	0	0	0	107.9	A928 W956 F958 S971 I972 H974 V984 I1001	A928-L940 HydrophobicContact CB-CD2 3.35Å; L940-W956 HydrophobicContact CB-CE3 4.49Å; L940-W956 HydrophobicContact CB-CH2 4.19Å; L940-W956 HydrophobicContact CB-CZ3 3.76Å; L940-F958 HydrophobicContact CD1-CE1 3.52Å; L940-F958 HydrophobicContact CD1-CZ 3.93Å; L940-S971 VanDerWaalsContact O-CA 3.32Å; L940-S971 WeakPolarHBondContact O-CA 3.49Å; L940-I972 HydrophobicContact CB-CG2 3.9Å; L940-I972 HydrophobicContact CD1-CG2 4.14Å; L940-I972 PolarHBondContact N-O 2.68Å; L940-I972 PolarHBondContact O-N 2.89Å; L940-H974 HydrophobicContact CD1-CB 4Å; L940-V984 HydrophobicContact CD1-CG1 4.28Å; L940-I1001 HydrophobicContact CD2-CD1 3.76Å
941	T	90.4	Very high	81.3	Confident	57 Å²	57	63 Å²	63	35%	0.35	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	123.5	-176.3	35.4	0	0	0	0	112.2	S927 G970	S927-T941 WeakPolarHBondContact CA-O 3.49Å; S927-T941 WeakPolarHBondContact CB-O 3.44Å; S927-T941 WeakPolarHBondContact CB-OG1 3.2Å; S927-T941 PolarHBondContact N-O 2.86Å; S927-T941 PolarHBondContact O-N 3.48Å; T941-G970 CarbonylContact C-O 3.56Å; T941-G970 VanDerWaalsContact CA-O 3.29Å; T941-G970 WeakPolarHBondContact CA-O 3.24Å
942	A	90.4	Very high	81.4	Confident	10 Å²	10	63.3 Å²	63.3	8%	0.083	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	103.5	175.5	0	0	0	0	0	108.9	F954 W956 G970 V986	A942-F954 HydrophobicContact CB-CD1 3.67Å; A942-F954 HydrophobicContact CB-CE1 3.69Å; A942-W956 HydrophobicContact CB-CH2 3.87Å; A942-W956 HydrophobicContact CB-CZ2 4.14Å; A942-G970 PolarHBondContact N-O 3.47Å; A942-V986 HydrophobicContact CB-CG1 4.02Å; A942-V986 HydrophobicContact CB-CG2 3.99Å
943	V	87.4	Confident	81.6	Confident	58 Å²	58	65.1 Å²	65.1	35%	0.352	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	134.8	175.4	-170.9	0	0	0	0	108.5	V924 Y925 W945	V924-V943 CarbonylContact C-O 3.59Å; V924-V943 WeakPolarHBondContact CA-O 3.41Å; Y925-V943 PolarHBondContact N-O 2.88Å; Y925-V943 PolarHBondContact O-N 3.12Å; V943-W945 HydrophobicContact CB-CH2 3.91Å; V943-W945 HydrophobicContact CB-CZ2 4.39Å; V943-W945 HydrophobicContact CB-CZ3 4.21Å; V943-W945 HydrophobicContact CG1-CD2 4.48Å; V943-W945 HydrophobicContact CG1-CE3 4.47Å; V943-W945 HydrophobicContact CG1-CH2 3.52Å; V943-W945 HydrophobicContact CG1-CZ2 3.5Å; V943-W945 VanDerWaalsContact CG1-CZ2 3.5Å; V943-W945 HydrophobicContact CG1-CZ3 4.02Å
944	V	86.4	Confident	82	Confident	15 Å²	15	63.5 Å²	63.5	9%	0.091	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	137	-171.3	-171.9	0	0	0	0	110.1	V921 P946 L952 F954 V988	V921-V944 HydrophobicContact CB-CG1 4.36Å; V921-V944 HydrophobicContact CG1-CG1 3.35Å; V921-V944 HydrophobicContact CG2-CG1 4.05Å; V944-P946 CarbonylContact C-O 3.56Å; V944-P946 CarbonylContact O-C 3.57Å; V944-L952 HydrophobicContact CB-CD1 4.11Å; V944-L952 HydrophobicContact CG1-CD1 3.8Å; V944-L952 HydrophobicContact CG2-CD1 4.03Å; V944-F954 HydrophobicContact CG2-CE1 3.9Å; V944-F954 HydrophobicContact CG2-CZ 4.33Å; V944-V988 HydrophobicContact CG2-CG1 4.35Å; V944-V988 HydrophobicContact CG2-CG2 4.43Å
945	W	81.8	Confident	82.4	Confident	118 Å²	118	63.2 Å²	63.2	45%	0.447	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.1	177.1	-63.3	-91.1	0	0	0	111.5	D922 R923 Y925 V943	D922-W945 PolarHBondContact N-O 3.27Å; R923-W945 HydrophobicContact CB-CE3 4.01Å; R923-W945 HydrophobicContact CG-CE3 4.02Å; R923-W945 HydrophobicContact CG-CZ3 4.23Å; R923-W945 PolarHBondContact N-O 3.47Å; R923-W945 PolarHBondContact O-N 2.95Å; Y925-W945 HydrophobicContact CG-CH2 4.48Å; V943-W945 HydrophobicContact CB-CH2 3.91Å; V943-W945 HydrophobicContact CB-CZ2 4.39Å; V943-W945 HydrophobicContact CB-CZ3 4.21Å; V943-W945 HydrophobicContact CG1-CD2 4.48Å; V943-W945 HydrophobicContact CG1-CE3 4.47Å; V943-W945 HydrophobicContact CG1-CH2 3.52Å; V943-W945 HydrophobicContact CG1-CZ2 3.5Å; V943-W945 VanDerWaalsContact CG1-CZ2 3.5Å; V943-W945 HydrophobicContact CG1-CZ3 4.02Å
946	P	78.8	Confident	82.9	Confident	60 Å²	60	57.5 Å²	57.5	39%	0.39	31%	0.308	S	S	.	.	S	Bend	cis	-61	166.8	-12	29	-36.5	0	0	0	112.1	V944 H948	V944-P946 CarbonylContact C-O 3.56Å; V944-P946 CarbonylContact O-C 3.57Å; P946-H948 PolarHBondContact O-CE1 3.46Å; P946-H948 PolarHBondContact O-N 3.31Å; P946-H948 PolarHBondContact O-ND1 2.9Å
947	S	73.9	Confident	83.2	Confident	113 Å²	113	56 Å²	56	79%	0.79	30%	0.299	S	S	*	.			trans	-80	101	-176.6	45.2	0	0	0	0	112.6
948	H	69.3	Low	83.4	Confident	28 Å²	28	54 Å²	54	13%	0.13	28%	0.279	C	S	.	.			trans	-77.9	148.9	175.9	-59.7	79.1	0	0	0	113.4	S919 P946 L952	S919-H948 PolarHBondContact OG-NE2 3.15Å; P946-H948 PolarHBondContact O-CE1 3.46Å; P946-H948 PolarHBondContact O-N 3.31Å; P946-H948 PolarHBondContact O-ND1 2.9Å; H948-L952 HydrophobicContact CB-CD1 3.72Å; H948-L952 HydrophobicContact CB-CD2 4.35Å; H948-L952 HydrophobicContact CB-CG 3.77Å
949	T	60.9	Low	82.9	Confident	113 Å²	113	57 Å²	57	69%	0.693	29%	0.292	S	S	*	.	S	Bend	trans	-109.6	102.6	172.9	44.8	0	0	0	0	111.3	T951	T949-T951 VanDerWaalsContact C-N 3.28Å; T949-T951 PolarHBondContact O-N 3.41Å
950	R	65.8	Low	82.1	Confident	218 Å²	218	59.9 Å²	59.9	82%	0.823	31%	0.307	S	S	*	.	S	Bend	trans	61.2	21.4	170.7	-57.6	178.8	171.4	170.5	-4.1	116.5
951	T	70.6	Confident	81.4	Confident	9 Å²	9	62.5 Å²	62.5	6%	0.055	33%	0.326	C	S	.	.			trans	-107.6	4	176.9	56.9	0	0	0	0	114.3	H916 T949	H916-T951 PolarHBondContact CE1-O 3.34Å; H916-T951 VanDerWaalsContact CE1-O 3.29Å; H916-T951 WeakPolarHBondContact NE2-CB 3.29Å; H916-T951 PolarHBondContact NE2-O 2.99Å; T949-T951 VanDerWaalsContact C-N 3.28Å; T949-T951 PolarHBondContact O-N 3.41Å
952	L	84.1	Confident	80.8	Confident	8 Å²	8	64.9 Å²	64.9	4%	0.042	34%	0.344	C	S	.	.			trans	-109	147.9	-175.9	-61.2	177.2	0	0	0	110.9	V921 V944 H948 F954 V988 C990	V921-L952 HydrophobicContact CG2-CD2 3.9Å; V944-L952 HydrophobicContact CB-CD1 4.11Å; V944-L952 HydrophobicContact CG1-CD1 3.8Å; V944-L952 HydrophobicContact CG2-CD1 4.03Å; H948-L952 HydrophobicContact CB-CD1 3.72Å; H948-L952 HydrophobicContact CB-CD2 4.35Å; H948-L952 HydrophobicContact CB-CG 3.77Å; L952-F954 HydrophobicContact CB-CD2 4.46Å; L952-F954 HydrophobicContact CB-CE2 3.73Å; L952-F954 HydrophobicContact CB-CZ 3.89Å; L952-F954 HydrophobicContact CD1-CZ 3.93Å; L952-V988 HydrophobicContact CB-CG1 4.14Å; L952-V988 HydrophobicContact CD1-CG1 3.97Å; L952-V988 HydrophobicContact CD2-CG1 4.19Å; L952-V988 HydrophobicContact CG-CG1 4.33Å; L952-C990 HydrophobicContact CD2-CB 3.62Å
953	T	88.4	Confident	80.6	Confident	45 Å²	45	70.7 Å²	70.7	28%	0.276	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.3	169.7	-52.9	0	0	0	0	109	F955 I966 A989	T953-F955 HydrophobicContact CG2-CD2 4.27Å; T953-F955 HydrophobicContact CG2-CE1 4.43Å; T953-F955 HydrophobicContact CG2-CE2 3.56Å; T953-F955 HydrophobicContact CG2-CZ 3.65Å; T953-I966 HydrophobicContact CG2-CG2 3.58Å; T953-A989 PolarHBondContact N-O 2.96Å; T953-A989 PolarHBondContact O-N 3.47Å
954	F	90.8	Very high	80.8	Confident	12 Å²	12	69.7 Å²	69.7	5%	0.053	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.9	-178.1	-57.9	-97.7	0	0	0	109.2	A942 V944 L952 I966 T967 V986 V988	A942-F954 HydrophobicContact CB-CD1 3.67Å; A942-F954 HydrophobicContact CB-CE1 3.69Å; V944-F954 HydrophobicContact CG2-CE1 3.9Å; V944-F954 HydrophobicContact CG2-CZ 4.33Å; L952-F954 HydrophobicContact CB-CD2 4.46Å; L952-F954 HydrophobicContact CB-CE2 3.73Å; L952-F954 HydrophobicContact CB-CZ 3.89Å; L952-F954 HydrophobicContact CD1-CZ 3.93Å; F954-I966 CarbonylContact O-C 3.55Å; F954-I966 WeakPolarHBondContact O-CA 3.36Å; F954-T967 PolarHBondContact N-O 3.12Å; F954-T967 PolarHBondContact O-N 2.91Å; F954-V986 HydrophobicContact CB-CG2 4.43Å; F954-V986 HydrophobicContact CD1-CG2 4.38Å; F954-V988 HydrophobicContact CD1-CG1 4.29Å; F954-V988 HydrophobicContact CD1-CG2 3.7Å; F954-V988 HydrophobicContact CE1-CG1 4.08Å; F954-V988 HydrophobicContact CE1-CG2 3.9Å
955	F	92.6	Very high	81	Confident	52 Å²	52	72.8 Å²	72.8	23%	0.228	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	110.6	177.5	-59.3	-99.7	0	0	0	108.2	T953 P964 I966 V986 Q987 A989	T953-F955 HydrophobicContact CG2-CD2 4.27Å; T953-F955 HydrophobicContact CG2-CE1 4.43Å; T953-F955 HydrophobicContact CG2-CE2 3.56Å; T953-F955 HydrophobicContact CG2-CZ 3.65Å; F955-P964 HydrophobicContact CB-CB 4.09Å; F955-P964 HydrophobicContact CB-CG 4.38Å; F955-P964 HydrophobicContact CD1-CG 3.99Å; F955-I966 HydrophobicContact CD1-CD1 4.06Å; F955-I966 HydrophobicContact CD1-CG1 3.79Å; F955-I966 HydrophobicContact CE1-CD1 3.75Å; F955-I966 HydrophobicContact CE1-CG1 3.96Å; F955-I966 HydrophobicContact CE1-CG2 4.38Å; F955-V986 WeakPolarHBondContact O-CA 3.39Å; F955-Q987 HydrophobicContact CB-CB 4.26Å; F955-Q987 PolarHBondContact N-O 3.23Å; F955-Q987 PolarHBondContact O-N 3.07Å; F955-A989 HydrophobicContact CE2-CB 3.8Å
956	W	92.5	Very high	81.4	Confident	1 Å²	1	72 Å²	72	0%	0.004	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.2	-176.7	-58	89.1	0	0	0	110.3	L926 L940 A942 F958 P964 I965 T967 I972 V986	L926-W956 HydrophobicContact CD1-CH2 4.42Å; L926-W956 HydrophobicContact CD1-CZ3 3.73Å; L940-W956 HydrophobicContact CB-CE3 4.49Å; L940-W956 HydrophobicContact CB-CH2 4.19Å; L940-W956 HydrophobicContact CB-CZ3 3.76Å; A942-W956 HydrophobicContact CB-CH2 3.87Å; A942-W956 HydrophobicContact CB-CZ2 4.14Å; W956-F958 HydrophobicContact CB-CD2 4.33Å; W956-F958 HydrophobicContact CB-CE2 3.47Å; W956-F958 VanDerWaalsContact CB-CE2 3.47Å; W956-F958 HydrophobicContact CB-CZ 3.89Å; W956-P964 WeakPolarHBondContact O-CA 3.34Å; W956-I965 HydrophobicContact CB-CB 4.45Å; W956-I965 PolarHBondContact N-O 3.18Å; W956-I965 PolarHBondContact O-N 2.91Å; W956-T967 PolarHBondContact NE1-OG1 3.28Å; W956-I972 HydrophobicContact CD2-CB 4.41Å; W956-I972 HydrophobicContact CD2-CG2 3.49Å; W956-I972 VanDerWaalsContact CD2-CG2 3.49Å; W956-I972 HydrophobicContact CE3-CG2 3.65Å; W956-I972 HydrophobicContact CG-CD1 4.32Å; W956-I972 HydrophobicContact CG-CG2 4.02Å; W956-I972 HydrophobicContact CH2-CG2 3.96Å; W956-I972 HydrophobicContact CZ2-CB 4.39Å; W956-I972 HydrophobicContact CZ2-CG2 3.83Å; W956-I972 HydrophobicContact CZ3-CG2 3.88Å; W956-V986 HydrophobicContact CD2-CB 4.33Å; W956-V986 HydrophobicContact CD2-CG2 3.82Å; W956-V986 HydrophobicContact CE3-CB 3.84Å; W956-V986 HydrophobicContact CE3-CG2 3.8Å; W956-V986 HydrophobicContact CG-CG2 4.48Å; W956-V986 HydrophobicContact CH2-CG2 4.13Å; W956-V986 HydrophobicContact CZ2-CG2 4.13Å; W956-V986 HydrophobicContact CZ3-CB 3.94Å; W956-V986 HydrophobicContact CZ3-CG2 3.96Å
957	W	91.4	Very high	82	Confident	71 Å²	71	70.5 Å²	70.5	27%	0.269	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.6	178.2	-56.3	85.3	0	0	0	109.4	P964 V984 T985 Q987	W957-P964 HydrophobicContact CD2-CB 3.78Å; W957-P964 HydrophobicContact CD2-CG 4.48Å; W957-P964 HydrophobicContact CE3-CB 4.06Å; W957-P964 HydrophobicContact CG-CB 4.28Å; W957-P964 HydrophobicContact CH2-CB 4.22Å; W957-P964 HydrophobicContact CH2-CG 3.87Å; W957-P964 HydrophobicContact CZ2-CB 3.94Å; W957-P964 HydrophobicContact CZ2-CG 3.77Å; W957-P964 HydrophobicContact CZ3-CB 4.26Å; W957-P964 HydrophobicContact CZ3-CG 4.25Å; W957-V984 WeakPolarHBondContact O-CA 3.04Å; W957-T985 PolarHBondContact N-O 2.57Å; W957-T985 PolarHBondContact O-N 2.93Å; W957-T985 VanDerWaalsContact O-N 3.09Å; W957-Q987 VanDerWaalsContact NE1-CD 3.28Å
958	F	88.8	Confident	82.5	Confident	17 Å²	17	71 Å²	71	8%	0.075	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.4	-179.7	-61.4	-83.1	0	0	0	109.2	L940 W956 S961 I965 I972 H974 F976 V984	L940-F958 HydrophobicContact CD1-CE1 3.52Å; L940-F958 HydrophobicContact CD1-CZ 3.93Å; W956-F958 HydrophobicContact CB-CD2 4.33Å; W956-F958 HydrophobicContact CB-CE2 3.47Å; W956-F958 VanDerWaalsContact CB-CE2 3.47Å; W956-F958 HydrophobicContact CB-CZ 3.89Å; F958-S961 VanDerWaalsContact O-CB 3.28Å; F958-S961 WeakPolarHBondContact O-CB 3.15Å; F958-S961 PolarHBondContact O-N 2.73Å; F958-I965 HydrophobicContact CD2-CD1 3.97Å; F958-I965 HydrophobicContact CD2-CG1 4.49Å; F958-I965 HydrophobicContact CE2-CB 4.42Å; F958-I965 HydrophobicContact CE2-CD1 3.83Å; F958-I965 HydrophobicContact CE2-CG1 4.42Å; F958-I972 HydrophobicContact CE2-CD1 4.36Å; F958-I972 HydrophobicContact CZ-CD1 4.37Å; F958-I972 HydrophobicContact CZ-CG2 4.27Å; F958-H974 HydrophobicContact CD1-CB 4.38Å; F958-H974 AromaticContact CD1-CD2 3.69Å; F958-H974 AromaticContact CD1-CE1 3.6Å; F958-H974 AromaticContact CD1-CG 3.65Å; F958-H974 AromaticContact CD1-ND1 3.59Å; F958-H974 AromaticContact CD1-NE2 3.68Å; F958-H974 AromaticContact CD2-CE1 3.95Å; F958-H974 AromaticContact CD2-ND1 3.89Å; F958-H974 HydrophobicContact CE1-CB 3.62Å; F958-H974 AromaticContact CE1-CD2 3.82Å; F958-H974 AromaticContact CE1-CG 3.36Å; F958-H974 AromaticContact CE1-ND1 3.5Å; F958-H974 AromaticContact CE2-ND1 3.8Å; F958-H974 AromaticContact CG-CE1 3.57Å; F958-H974 AromaticContact CG-ND1 3.79Å; F958-H974 AromaticContact CG-NE2 3.99Å; F958-H974 HydrophobicContact CZ-CB 3.89Å; F958-H974 AromaticContact CZ-CG 3.8Å; F958-H974 AromaticContact CZ-ND1 3.61Å; F958-F976 HydrophobicContact CD1-CE1 4.36Å; F958-V984 HydrophobicContact CD1-CG1 4.3Å; F958-V984 HydrophobicContact CD1-CG2 4.08Å; F958-V984 HydrophobicContact CE1-CG1 4.02Å; F958-V984 HydrophobicContact CE1-CG2 4.25Å
959	E	77.1	Confident	83.3	Confident	75 Å²	75	75.6 Å²	75.6	35%	0.35	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	-148.9	-175.3	-54.8	-172.4	-147.4	0	0	112.1	S961 R978 K983	E959-S961 VanDerWaalsContact C-N 3.26Å; E959-S961 PolarHBondContact O-N 3.25Å; E959-R978 WeakPolarHBondContact OE2-CD 3.12Å; E959-R978 IonicContact OE2-CZ 3.8Å; E959-R978 IonicContact OE2-NE 2.74Å; E959-R978 IonicContact OE2-NH1 3.68Å; E959-R978 PolarHBondContact OE2-NH1 3.35Å; E959-K983 PolarHBondContact N-O 2.9Å
960	N	71.8	Confident	84.5	Confident	176 Å²	176	71.2 Å²	71.2	94%	0.941	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	41.2	171.4	-77.3	-19.8	0	0	0	112.1
961	S	75.8	Confident	85.6	Confident	57 Å²	57	63.7 Å²	63.7	40%	0.399	35%	0.346	S	S	.	.			trans	-66.7	135.5	174.7	-174.4	0	0	0	0	111.5	F958 E959 E963	F958-S961 VanDerWaalsContact O-CB 3.28Å; F958-S961 WeakPolarHBondContact O-CB 3.15Å; F958-S961 PolarHBondContact O-N 2.73Å; E959-S961 VanDerWaalsContact C-N 3.26Å; E959-S961 PolarHBondContact O-N 3.25Å; S961-E963 VanDerWaalsContact C-N 3.28Å; S961-E963 PolarHBondContact OG-N 2.85Å; S961-E963 VanDerWaalsContact OG-N 3.16Å; S961-E963 PolarHBondContact OG-O 2.88Å
962	S	78.9	Confident	86.6	Confident	106 Å²	106	64.6 Å²	64.6	74%	0.741	35%	0.35	S	S	*	.	S	Bend	trans	-78.3	-11.9	170.4	55.4	0	0	0	0	113.6
963	E	85.2	Confident	86.9	Confident	132 Å²	132	68 Å²	68	62%	0.617	38%	0.375	S	S	*	.	S	Bend	trans	-126	126.3	-176.9	-66.7	176.1	-163.7	0	0	109.9	S961	S961-E963 VanDerWaalsContact C-N 3.28Å; S961-E963 PolarHBondContact OG-N 2.85Å; S961-E963 VanDerWaalsContact OG-N 3.16Å; S961-E963 PolarHBondContact OG-O 2.88Å
964	P	91.9	Very high	86.9	Confident	37 Å²	37	67.6 Å²	67.6	24%	0.24	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-84.9	152.2	176.7	32.6	-32.6	0	0	0	112	F955 W956 W957	F955-P964 HydrophobicContact CB-CB 4.09Å; F955-P964 HydrophobicContact CB-CG 4.38Å; F955-P964 HydrophobicContact CD1-CG 3.99Å; W956-P964 WeakPolarHBondContact O-CA 3.34Å; W957-P964 HydrophobicContact CD2-CB 3.78Å; W957-P964 HydrophobicContact CD2-CG 4.48Å; W957-P964 HydrophobicContact CE3-CB 4.06Å; W957-P964 HydrophobicContact CG-CB 4.28Å; W957-P964 HydrophobicContact CH2-CB 4.22Å; W957-P964 HydrophobicContact CH2-CG 3.87Å; W957-P964 HydrophobicContact CZ2-CB 3.94Å; W957-P964 HydrophobicContact CZ2-CG 3.77Å; W957-P964 HydrophobicContact CZ3-CB 4.26Å; W957-P964 HydrophobicContact CZ3-CG 4.25Å
965	I	90.3	Very high	86.9	Confident	80 Å²	80	72.5 Å²	72.5	41%	0.41	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.8	167	-61.2	172.7	0	0	0	108.4	W956 F958 I972	W956-I965 HydrophobicContact CB-CB 4.45Å; W956-I965 PolarHBondContact N-O 3.18Å; W956-I965 PolarHBondContact O-N 2.91Å; F958-I965 HydrophobicContact CD2-CD1 3.97Å; F958-I965 HydrophobicContact CD2-CG1 4.49Å; F958-I965 HydrophobicContact CE2-CB 4.42Å; F958-I965 HydrophobicContact CE2-CD1 3.83Å; F958-I965 HydrophobicContact CE2-CG1 4.42Å; I965-I972 HydrophobicContact CB-CD1 4.35Å; I965-I972 HydrophobicContact CG2-CD1 3.74Å
966	I	90.9	Very high	86.6	Confident	103 Å²	103	70.1 Å²	70.1	53%	0.528	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.4	-175.9	-52.4	179.3	0	0	0	110.1	T953 F954 F955	T953-I966 HydrophobicContact CG2-CG2 3.58Å; F954-I966 CarbonylContact O-C 3.55Å; F954-I966 WeakPolarHBondContact O-CA 3.36Å; F955-I966 HydrophobicContact CD1-CD1 4.06Å; F955-I966 HydrophobicContact CD1-CG1 3.79Å; F955-I966 HydrophobicContact CE1-CD1 3.75Å; F955-I966 HydrophobicContact CE1-CG1 3.96Å; F955-I966 HydrophobicContact CE1-CG2 4.38Å
967	T	90.1	Very high	86.2	Confident	28 Å²	28	76.1 Å²	76.1	17%	0.172	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.2	173.6	69.6	0	0	0	0	112.3	F954 W956 E969 I972	F954-T967 PolarHBondContact N-O 3.12Å; F954-T967 PolarHBondContact O-N 2.91Å; W956-T967 PolarHBondContact NE1-OG1 3.28Å; T967-E969 PolarHBondContact OG1-O 3.31Å; T967-I972 HydrophobicContact CG2-CD1 4.18Å
968	L	86.1	Confident	85.7	Confident	123 Å²	123	80.4 Å²	80.4	64%	0.644	43%	0.431	S	S	*	.	S	Bend	trans	-98.2	-12	171.7	-61.2	178	0	0	0	112.7
969	E	85.3	Confident	85.4	Confident	124 Å²	124	83.7 Å²	83.7	58%	0.579	45%	0.447	S	S	*	.	S	Bend	trans	-104.7	139	173.5	-58.9	-169	150.1	0	0	108.7	T967 S971	T967-E969 PolarHBondContact OG1-O 3.31Å; E969-S971 PolarHBondContact O-N 3.25Å
970	G	85.4	Confident	85.8	Confident	21 Å²	21	81.2 Å²	81.2	22%	0.216	44%	0.441	C	S	.	.	S	Bend	trans	-75.1	24.5	-178	0	0	0	0	0	114.2	T941 A942	T941-G970 CarbonylContact C-O 3.56Å; T941-G970 VanDerWaalsContact CA-O 3.29Å; T941-G970 WeakPolarHBondContact CA-O 3.24Å; A942-G970 PolarHBondContact N-O 3.47Å
971	S	89.5	Confident	86.4	Confident	61 Å²	61	80.5 Å²	80.5	43%	0.427	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.4	-176.5	54.4	0	0	0	0	110.7	L940 E969	L940-S971 VanDerWaalsContact O-CA 3.32Å; L940-S971 WeakPolarHBondContact O-CA 3.49Å; E969-S971 PolarHBondContact O-N 3.25Å
972	I	91.8	Very high	87	Confident	27 Å²	27	78.2 Å²	78.2	14%	0.138	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	144.2	174.9	-168.5	170.3	0	0	0	110.7	L940 W956 F958 I965 T967	L940-I972 HydrophobicContact CB-CG2 3.9Å; L940-I972 HydrophobicContact CD1-CG2 4.14Å; L940-I972 PolarHBondContact N-O 2.68Å; L940-I972 PolarHBondContact O-N 2.89Å; W956-I972 HydrophobicContact CD2-CB 4.41Å; W956-I972 HydrophobicContact CD2-CG2 3.49Å; W956-I972 VanDerWaalsContact CD2-CG2 3.49Å; W956-I972 HydrophobicContact CE3-CG2 3.65Å; W956-I972 HydrophobicContact CG-CD1 4.32Å; W956-I972 HydrophobicContact CG-CG2 4.02Å; W956-I972 HydrophobicContact CH2-CG2 3.96Å; W956-I972 HydrophobicContact CZ2-CB 4.39Å; W956-I972 HydrophobicContact CZ2-CG2 3.83Å; W956-I972 HydrophobicContact CZ3-CG2 3.88Å; F958-I972 HydrophobicContact CE2-CD1 4.36Å; F958-I972 HydrophobicContact CZ-CD1 4.37Å; F958-I972 HydrophobicContact CZ-CG2 4.27Å; I965-I972 HydrophobicContact CB-CD1 4.35Å; I965-I972 HydrophobicContact CG2-CD1 3.74Å; T967-I972 HydrophobicContact CG2-CD1 4.18Å
973	S	90.6	Very high	87.4	Confident	80 Å²	80	78.3 Å²	78.3	56%	0.559	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	120.4	169.2	58.9	0	0	0	0	109.7	A938	A938-S973 WeakPolarHBondContact O-CA 2.87Å
974	H	88.5	Confident	87.7	Confident	37 Å²	37	72 Å²	72	17%	0.171	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.5	179.8	-170.9	85.1	0	0	0	111.3	A937 A938 L940 F958 F976	A937-H974 WeakPolarHBondContact CA-O 3.41Å; A938-H974 PolarHBondContact N-O 3.04Å; A938-H974 PolarHBondContact O-N 2.72Å; L940-H974 HydrophobicContact CD1-CB 4Å; F958-H974 HydrophobicContact CD1-CB 4.38Å; F958-H974 AromaticContact CD1-CD2 3.69Å; F958-H974 AromaticContact CD1-CE1 3.6Å; F958-H974 AromaticContact CD1-CG 3.65Å; F958-H974 AromaticContact CD1-ND1 3.59Å; F958-H974 AromaticContact CD1-NE2 3.68Å; F958-H974 AromaticContact CD2-CE1 3.95Å; F958-H974 AromaticContact CD2-ND1 3.89Å; F958-H974 HydrophobicContact CE1-CB 3.62Å; F958-H974 AromaticContact CE1-CD2 3.82Å; F958-H974 AromaticContact CE1-CG 3.36Å; F958-H974 AromaticContact CE1-ND1 3.5Å; F958-H974 AromaticContact CE2-ND1 3.8Å; F958-H974 AromaticContact CG-CE1 3.57Å; F958-H974 AromaticContact CG-ND1 3.79Å; F958-H974 AromaticContact CG-NE2 3.99Å; F958-H974 HydrophobicContact CZ-CB 3.89Å; F958-H974 AromaticContact CZ-CG 3.8Å; F958-H974 AromaticContact CZ-ND1 3.61Å; H974-F976 AromaticContact CD2-CD1 3.76Å; H974-F976 AromaticContact CD2-CE1 3.64Å; H974-F976 AromaticContact CD2-CZ 3.84Å
975	M	89.6	Confident	87.7	Confident	115 Å²	115	71.3 Å²	71.3	57%	0.567	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	110.6	178.1	-66.2	-174.4	-62.2	0	0	109.8	A937	A937-M975 HydrophobicContact CB-CG 4.13Å
976	F	87.3	Confident	87.8	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.009	35%	0.349	C	S	.	.			trans	-77.5	130.6	-179.1	-62.1	-80.8	0	0	0	111.2	A932 R934 E935 A938 F958 H974 N982 V984 I1001 V1003	A932-F976 HydrophobicContact CB-CD2 4.12Å; A932-F976 HydrophobicContact CB-CE2 4.44Å; R934-F976 WeakPolarHBondContact CG-O 3.48Å; E935-F976 PolarHBondContact N-O 3.17Å; A938-F976 HydrophobicContact CB-CD2 4.37Å; A938-F976 HydrophobicContact CB-CE2 3.93Å; F958-F976 HydrophobicContact CD1-CE1 4.36Å; H974-F976 AromaticContact CD2-CD1 3.76Å; H974-F976 AromaticContact CD2-CE1 3.64Å; H974-F976 AromaticContact CD2-CZ 3.84Å; F976-N982 HydrophobicContact CD1-CB 3.94Å; F976-N982 HydrophobicContact CE1-CB 3.99Å; F976-V984 HydrophobicContact CE1-CG2 4.01Å; F976-V984 HydrophobicContact CZ-CG2 3.84Å; F976-I1001 HydrophobicContact CE2-CD1 4.32Å; F976-I1001 HydrophobicContact CZ-CD1 3.97Å; F976-V1003 HydrophobicContact CB-CB 4.42Å; F976-V1003 HydrophobicContact CB-CG1 3.89Å; F976-V1003 HydrophobicContact CB-CG2 3.67Å; F976-V1003 HydrophobicContact CD1-CG2 4.2Å; F976-V1003 HydrophobicContact CD2-CG2 4.12Å; F976-V1003 HydrophobicContact CG-CG2 3.73Å
977	L	84	Confident	87.9	Confident	127 Å²	127	64.8 Å²	64.8	67%	0.665	33%	0.334	S	S	*	.			trans	-102	-11	-177.3	-61.4	178.7	0	0	0	113.7	R934 E935	R934-L977 WeakPolarHBondContact CD-O 3.41Å; E935-L977 HydrophobicContact CG-CD2 4.46Å
978	R	82.1	Confident	87.9	Confident	160 Å²	160	63.6 Å²	63.6	60%	0.604	33%	0.326	S	S	*	.	S	Bend	trans	-122.2	133	-176.2	-70.9	173.4	168.4	172.1	-5.4	110.3	E959 N982 V1003	E959-R978 WeakPolarHBondContact OE2-CD 3.12Å; E959-R978 IonicContact OE2-CZ 3.8Å; E959-R978 IonicContact OE2-NE 2.74Å; E959-R978 IonicContact OE2-NH1 3.68Å; E959-R978 PolarHBondContact OE2-NH1 3.35Å; R978-N982 PolarHBondContact O-ND2 2.85Å; R978-V1003 WeakPolarHBondContact O-CB 3.14Å; R978-V1003 VanDerWaalsContact O-CG1 3.3Å; R978-V1003 WeakPolarHBondContact O-CG1 3.35Å
979	E	82.5	Confident	87.9	Confident	86 Å²	86	58.5 Å²	58.5	40%	0.402	30%	0.302	S	S	.	.			trans	-76.9	158.5	172.1	-65.1	179.9	87.2	0	0	111.5	R934 V1003 K1004 E1005	R934-E979 IonicContact NH1-OE2 3Å; R934-E979 PolarHBondContact NH1-OE2 3.04Å; E979-V1003 CarbonylContact C-O 3.43Å; E979-V1003 VanDerWaalsContact CA-O 3.31Å; E979-V1003 WeakPolarHBondContact CA-O 3.17Å; E979-V1003 WeakPolarHBondContact CB-O 3.41Å; E979-K1004 WeakPolarHBondContact OE1-CA 3.1Å; E979-E1005 PolarHBondContact OE1-N 3.19Å
980	G	83.9	Confident	87.7	Confident	23 Å²	23	52.8 Å²	52.8	24%	0.237	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.1	-166.9	-173.8	0	0	0	0	0	113.2	N982 V1003	G980-N982 PolarHBondContact O-N 2.76Å; G980-N982 PolarHBondContact O-ND2 2.81Å; G980-V1003 PolarHBondContact N-O 3.45Å; G980-V1003 PolarHBondContact O-N 2.93Å
981	E	85.7	Confident	87.1	Confident	161 Å²	161	53.9 Å²	53.9	75%	0.752	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.4	-176.9	-69	-172.5	168.8	0	0	111.7	V1000	E981-V1000 HydrophobicContact CB-CG1 3.72Å; E981-V1000 HydrophobicContact CG-CG1 4.01Å
982	N	86.8	Confident	86.1	Confident	9 Å²	9	57.2 Å²	57.2	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	112.8	176.9	-74.8	-103	0	0	0	108.9	F976 R978 G980 I1001 V1003	F976-N982 HydrophobicContact CD1-CB 3.94Å; F976-N982 HydrophobicContact CE1-CB 3.99Å; R978-N982 PolarHBondContact O-ND2 2.85Å; G980-N982 PolarHBondContact O-N 2.76Å; G980-N982 PolarHBondContact O-ND2 2.81Å; N982-I1001 PolarHBondContact N-O 3.48Å; N982-I1001 PolarHBondContact O-N 3.06Å; N982-V1003 HydrophobicContact CB-CG2 4.15Å; N982-V1003 VanDerWaalsContact ND2-CG2 3.29Å; N982-V1003 WeakPolarHBondContact ND2-CG2 3.16Å
983	K	88.8	Confident	85.3	Confident	108 Å²	108	58.1 Å²	58.1	47%	0.47	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.3	172.3	-173.1	174	-179.8	175.4	0	110.2	E959 T985 S998	E959-K983 PolarHBondContact N-O 2.9Å; K983-T985 WeakPolarHBondContact CE-OG1 3.11Å; K983-S998 WeakPolarHBondContact CE-OG 3.33Å; K983-S998 PolarHBondContact NZ-OG 3.02Å; K983-S998 VanDerWaalsContact NZ-OG 3.09Å
984	V	91.1	Very high	85.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.1	168.1	-177.3	0	0	0	0	108.4	L926 L940 W957 F958 F976 S998 K999 I1001	L926-V984 HydrophobicContact CD2-CB 4.27Å; L926-V984 HydrophobicContact CD2-CG1 4.04Å; L940-V984 HydrophobicContact CD1-CG1 4.28Å; W957-V984 WeakPolarHBondContact O-CA 3.04Å; F958-V984 HydrophobicContact CD1-CG1 4.3Å; F958-V984 HydrophobicContact CD1-CG2 4.08Å; F958-V984 HydrophobicContact CE1-CG1 4.02Å; F958-V984 HydrophobicContact CE1-CG2 4.25Å; F976-V984 HydrophobicContact CE1-CG2 4.01Å; F976-V984 HydrophobicContact CZ-CG2 3.84Å; V984-S998 CarbonylContact O-C 3.59Å; V984-S998 VanDerWaalsContact O-CA 3.25Å; V984-S998 WeakPolarHBondContact O-CA 3.27Å; V984-S998 WeakPolarHBondContact O-CB 3.46Å; V984-K999 PolarHBondContact N-O 3.46Å; V984-K999 PolarHBondContact O-N 2.75Å; V984-I1001 HydrophobicContact CG2-CD1 3.8Å; V984-I1001 HydrophobicContact CG2-CG1 4.4Å
985	T	91.2	Very high	85.1	Confident	22 Å²	22	59.7 Å²	59.7	14%	0.135	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.8	171	-55.4	0	0	0	0	108.6	W957 K983 Q987 E996 D997 S998	W957-T985 PolarHBondContact N-O 2.57Å; W957-T985 PolarHBondContact O-N 2.93Å; W957-T985 VanDerWaalsContact O-N 3.09Å; K983-T985 WeakPolarHBondContact CE-OG1 3.11Å; T985-Q987 HydrophobicContact CG2-CG 4.27Å; T985-E996 HydrophobicContact CG2-CB 4.39Å; T985-D997 WeakPolarHBondContact CA-O 3.34Å; T985-S998 VanDerWaalsContact OG1-CB 3.27Å; T985-S998 WeakPolarHBondContact OG1-CB 3.3Å
986	V	92.5	Very high	85.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.1	166.9	67.7	0	0	0	0	109.5	V924 L926 A942 F954 F955 W956 V988 E996 D997	V924-V986 HydrophobicContact CG1-CG1 4.3Å; L926-V986 HydrophobicContact CB-CG1 4.1Å; L926-V986 HydrophobicContact CD1-CG1 4.14Å; L926-V986 HydrophobicContact CD2-CG1 4.39Å; L926-V986 HydrophobicContact CG-CG1 4.44Å; A942-V986 HydrophobicContact CB-CG1 4.02Å; A942-V986 HydrophobicContact CB-CG2 3.99Å; F954-V986 HydrophobicContact CB-CG2 4.43Å; F954-V986 HydrophobicContact CD1-CG2 4.38Å; F955-V986 WeakPolarHBondContact O-CA 3.39Å; W956-V986 HydrophobicContact CD2-CB 4.33Å; W956-V986 HydrophobicContact CD2-CG2 3.82Å; W956-V986 HydrophobicContact CE3-CB 3.84Å; W956-V986 HydrophobicContact CE3-CG2 3.8Å; W956-V986 HydrophobicContact CG-CG2 4.48Å; W956-V986 HydrophobicContact CH2-CG2 4.13Å; W956-V986 HydrophobicContact CZ2-CG2 4.13Å; W956-V986 HydrophobicContact CZ3-CB 3.94Å; W956-V986 HydrophobicContact CZ3-CG2 3.96Å; V986-V988 HydrophobicContact CG2-CG2 4.41Å; V986-E996 VanDerWaalsContact O-CA 3.31Å; V986-E996 WeakPolarHBondContact O-CA 3.22Å; V986-D997 PolarHBondContact N-O 3Å; V986-D997 PolarHBondContact O-N 3.36Å
987	Q	92.4	Very high	85.4	Confident	47 Å²	47	62.3 Å²	62.3	22%	0.22	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.2	170.3	-52.7	-177.2	-44.4	0	0	108.7	F955 W957 T985 V994 L995 E996	F955-Q987 HydrophobicContact CB-CB 4.26Å; F955-Q987 PolarHBondContact N-O 3.23Å; F955-Q987 PolarHBondContact O-N 3.07Å; W957-Q987 VanDerWaalsContact NE1-CD 3.28Å; T985-Q987 HydrophobicContact CG2-CG 4.27Å; Q987-V994 HydrophobicContact CB-CG1 4.07Å; Q987-L995 CarbonylContact C-O 3.06Å; Q987-L995 WeakPolarHBondContact CA-O 3.42Å; Q987-E996 HydrophobicContact CB-CB 4.37Å; Q987-E996 HydrophobicContact CG-CB 3.79Å; Q987-E996 PolarHBondContact NE2-OE2 2.67Å
988	V	90.6	Very high	85.7	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.012	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115	-177.6	-174.3	0	0	0	0	108.5	V924 V944 L952 F954 V986 V994 L995	V924-V988 HydrophobicContact CB-CG2 4.46Å; V924-V988 HydrophobicContact CG1-CG2 3.75Å; V924-V988 HydrophobicContact CG2-CB 3.9Å; V924-V988 HydrophobicContact CG2-CG2 3.77Å; V944-V988 HydrophobicContact CG2-CG1 4.35Å; V944-V988 HydrophobicContact CG2-CG2 4.43Å; L952-V988 HydrophobicContact CB-CG1 4.14Å; L952-V988 HydrophobicContact CD1-CG1 3.97Å; L952-V988 HydrophobicContact CD2-CG1 4.19Å; L952-V988 HydrophobicContact CG-CG1 4.33Å; F954-V988 HydrophobicContact CD1-CG1 4.29Å; F954-V988 HydrophobicContact CD1-CG2 3.7Å; F954-V988 HydrophobicContact CE1-CG1 4.08Å; F954-V988 HydrophobicContact CE1-CG2 3.9Å; V986-V988 HydrophobicContact CG2-CG2 4.41Å; V988-V994 WeakPolarHBondContact O-CA 3.49Å; V988-L995 PolarHBondContact N-O 3.39Å; V988-L995 PolarHBondContact O-N 3.21Å
989	A	87.4	Confident	85.9	Confident	17 Å²	17	53.3 Å²	53.3	14%	0.14	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.5	176.1	0	0	0	0	0	111.2	T953 F955 S993 V994	T953-A989 PolarHBondContact N-O 2.96Å; T953-A989 PolarHBondContact O-N 3.47Å; F955-A989 HydrophobicContact CE2-CB 3.8Å; A989-S993 WeakPolarHBondContact CA-O 3.42Å; A989-V994 HydrophobicContact CB-CG2 4.09Å
990	C	80.3	Confident	86.2	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.02	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	96.5	170.2	-166.6	0	0	0	0	109.1	S919 V921 L952 S992 S993	S919-C990 PolarHBondContact O-SG 3.18Å; V921-C990 HydrophobicContact CG2-CB 3.74Å; L952-C990 HydrophobicContact CD2-CB 3.62Å; C990-S992 PolarHBondContact O-N 3.25Å; C990-S992 VanDerWaalsContact O-N 3.1Å; C990-S993 PolarHBondContact N-O 3.29Å; C990-S993 PolarHBondContact O-N 3.46Å; C990-S993 VanDerWaalsContact O-N 3.14Å; C990-S993 PolarHBondContact O-OG 2.8Å
991	G	73.5	Confident	86.3	Confident	44 Å²	44	51.4 Å²	51.4	45%	0.454	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	-111.2	-174.9	0	0	0	0	0	111.8
992	S	67.3	Low	86.4	Confident	131 Å²	131	44.7 Å²	44.7	92%	0.916	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-6.7	179.3	55.7	0	0	0	0	114.8	C990	C990-S992 PolarHBondContact O-N 3.25Å; C990-S992 VanDerWaalsContact O-N 3.1Å
993	S	75.6	Confident	86.4	Confident	46 Å²	46	44.2 Å²	44.2	32%	0.322	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	139.8	174.1	59.3	0	0	0	0	111.5	A989 C990	A989-S993 WeakPolarHBondContact CA-O 3.42Å; C990-S993 PolarHBondContact N-O 3.29Å; C990-S993 PolarHBondContact O-N 3.46Å; C990-S993 VanDerWaalsContact O-N 3.14Å; C990-S993 PolarHBondContact O-OG 2.8Å
994	V	86.3	Confident	86.1	Confident	87 Å²	87	39.9 Å²	39.9	53%	0.527	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132	169.5	-176.6	0	0	0	0	107.7	Q987 V988 A989	Q987-V994 HydrophobicContact CB-CG1 4.07Å; V988-V994 WeakPolarHBondContact O-CA 3.49Å; A989-V994 HydrophobicContact CB-CG2 4.09Å
995	L	87.9	Confident	85.5	Confident	63 Å²	63	43.1 Å²	43.1	33%	0.33	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	154.3	169.9	-69.6	177.8	0	0	0	109.3	V921 V924 Q987 V988	V921-L995 HydrophobicContact CB-CD1 4.02Å; V921-L995 HydrophobicContact CG1-CD1 3.73Å; V921-L995 WeakPolarHBondContact O-CD1 3.31Å; V924-L995 HydrophobicContact CG2-CB 3.79Å; V924-L995 HydrophobicContact CG2-CD1 4.32Å; Q987-L995 CarbonylContact C-O 3.06Å; Q987-L995 WeakPolarHBondContact CA-O 3.42Å; V988-L995 PolarHBondContact N-O 3.39Å; V988-L995 PolarHBondContact O-N 3.21Å
996	E	92.3	Very high	84.8	Confident	125 Å²	125	43 Å²	43	58%	0.584	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	151.4	179.3	70.6	-179.4	-170.3	0	0	112.7	T985 V986 Q987	T985-E996 HydrophobicContact CG2-CB 4.39Å; V986-E996 VanDerWaalsContact O-CA 3.31Å; V986-E996 WeakPolarHBondContact O-CA 3.22Å; Q987-E996 HydrophobicContact CB-CB 4.37Å; Q987-E996 HydrophobicContact CG-CB 3.79Å; Q987-E996 PolarHBondContact NE2-OE2 2.67Å
997	D	90.9	Very high	84.5	Confident	47 Å²	47	43.7 Å²	43.7	25%	0.251	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.3	165.6	-171.1	18.2	0	0	0	109.2	V924 Y925 L926 T985 V986	V924-D997 HydrophobicContact CG1-CB 4.3Å; Y925-D997 VanDerWaalsContact CA-OD2 3.31Å; Y925-D997 WeakPolarHBondContact CA-OD2 3.06Å; L926-D997 HydrophobicContact CB-CB 4.28Å; L926-D997 PolarHBondContact N-OD2 2.93Å; T985-D997 WeakPolarHBondContact CA-O 3.34Å; V986-D997 PolarHBondContact N-O 3Å; V986-D997 PolarHBondContact O-N 3.36Å
998	S	90.4	Very high	84	Confident	48 Å²	48	43.4 Å²	43.4	34%	0.336	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	138	-175.8	77.6	0	0	0	0	113.1	K983 V984 T985	K983-S998 WeakPolarHBondContact CE-OG 3.33Å; K983-S998 PolarHBondContact NZ-OG 3.02Å; K983-S998 VanDerWaalsContact NZ-OG 3.09Å; V984-S998 CarbonylContact O-C 3.59Å; V984-S998 VanDerWaalsContact O-CA 3.25Å; V984-S998 WeakPolarHBondContact O-CA 3.27Å; V984-S998 WeakPolarHBondContact O-CB 3.46Å; T985-S998 VanDerWaalsContact OG1-CB 3.27Å; T985-S998 WeakPolarHBondContact OG1-CB 3.3Å
999	K	87.6	Confident	83.8	Confident	50 Å²	50	43.3 Å²	43.3	22%	0.217	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	142.7	-175.4	-168.6	167	174.6	-171.9	0	110.2	L926 A928 V984	L926-K999 HydrophobicContact CD2-CB 3.98Å; L926-K999 HydrophobicContact CG-CB 4.31Å; A928-K999 HydrophobicContact CB-CD 4.26Å; A928-K999 PolarHBondContact O-NZ 2.85Å; V984-K999 PolarHBondContact N-O 3.46Å; V984-K999 PolarHBondContact O-N 2.75Å
1000	V	87.1	Confident	83.6	Confident	69 Å²	69	42.6 Å²	42.6	42%	0.418	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.6	173.1	-178.2	0	0	0	0	108.6	E981	E981-V1000 HydrophobicContact CB-CG1 3.72Å; E981-V1000 HydrophobicContact CG-CG1 4.01Å
1001	I	87.9	Confident	83.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.7	-179.9	-53.7	-177.8	0	0	0	108	A928 P929 A932 L940 F976 N982 V984	A928-I1001 HydrophobicContact CB-CD1 3.93Å; P929-I1001 WeakPolarHBondContact O-CG1 3.07Å; A932-I1001 HydrophobicContact CB-CG2 3.86Å; L940-I1001 HydrophobicContact CD2-CD1 3.76Å; F976-I1001 HydrophobicContact CE2-CD1 4.32Å; F976-I1001 HydrophobicContact CZ-CD1 3.97Å; N982-I1001 PolarHBondContact N-O 3.48Å; N982-I1001 PolarHBondContact O-N 3.06Å; V984-I1001 HydrophobicContact CG2-CD1 3.8Å; V984-I1001 HydrophobicContact CG2-CG1 4.4Å
1002	T	86.6	Confident	84.6	Confident	20 Å²	20	41.8 Å²	41.8	12%	0.123	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120	179.4	-54.9	0	0	0	0	109.8	I930 V931 A932 K1004	I930-T1002 PolarHBondContact O-N 3.42Å; V931-T1002 CarbonylContact C-O 3.57Å; V931-T1002 VanDerWaalsContact CA-O 3.27Å; V931-T1002 WeakPolarHBondContact CA-O 3.47Å; V931-T1002 WeakPolarHBondContact CG1-O 3.44Å; A932-T1002 PolarHBondContact N-O 2.8Å; T1002-K1004 HydrophobicContact CG2-CG 4.46Å
1003	V	86.8	Confident	85.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.2	-178.3	-177.2	0	0	0	0	110.5	A932 R934 F976 R978 E979 G980 N982	A932-V1003 HydrophobicContact CB-CG2 4.38Å; A932-V1003 WeakPolarHBondContact O-CA 3.33Å; R934-V1003 HydrophobicContact CB-CG1 4.12Å; R934-V1003 HydrophobicContact CG-CG1 4.37Å; F976-V1003 HydrophobicContact CB-CB 4.42Å; F976-V1003 HydrophobicContact CB-CG1 3.89Å; F976-V1003 HydrophobicContact CB-CG2 3.67Å; F976-V1003 HydrophobicContact CD1-CG2 4.2Å; F976-V1003 HydrophobicContact CD2-CG2 4.12Å; F976-V1003 HydrophobicContact CG-CG2 3.73Å; R978-V1003 WeakPolarHBondContact O-CB 3.14Å; R978-V1003 VanDerWaalsContact O-CG1 3.3Å; R978-V1003 WeakPolarHBondContact O-CG1 3.35Å; E979-V1003 CarbonylContact C-O 3.43Å; E979-V1003 VanDerWaalsContact CA-O 3.31Å; E979-V1003 WeakPolarHBondContact CA-O 3.17Å; E979-V1003 WeakPolarHBondContact CB-O 3.41Å; G980-V1003 PolarHBondContact N-O 3.45Å; G980-V1003 PolarHBondContact O-N 2.93Å; N982-V1003 HydrophobicContact CB-CG2 4.15Å; N982-V1003 VanDerWaalsContact ND2-CG2 3.29Å; N982-V1003 WeakPolarHBondContact ND2-CG2 3.16Å
1004	K	83.3	Confident	86.3	Confident	17 Å²	17	35.4 Å²	35.4	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.7	-179.2	-68.3	-69.6	178.9	171.2	0	111.7	A932 I933 R934 E979 T1002 E1071	A932-K1004 PolarHBondContact O-N 2.86Å; A932-K1004 VanDerWaalsContact O-N 3.1Å; I933-K1004 WeakPolarHBondContact CA-O 3.46Å; R934-K1004 PolarHBondContact N-O 2.68Å; E979-K1004 WeakPolarHBondContact OE1-CA 3.1Å; T1002-K1004 HydrophobicContact CG2-CG 4.46Å; K1004-E1071 IonicContact NZ-OE1 3.37Å; K1004-E1071 PolarHBondContact NZ-OE1 2.86Å
1005	E	78.5	Confident	86.3	Confident	68 Å²	68	32.7 Å²	32.7	32%	0.318	17%	0.173	S	C	.	.	S	Bend	trans	-64.1	-39.4	171.2	-86.5	-164.5	179.1	0	0	113.1	R934 E979 K1078	R934-E1005 IonicContact CZ-OE1 2.71Å; R934-E1005 IonicContact NH1-OE1 2.8Å; R934-E1005 PolarHBondContact NH1-OE1 2.04Å; R934-E1005 IonicContact NH2-OE1 2.78Å; R934-E1005 PolarHBondContact NH2-OE1 3.3Å; E979-E1005 PolarHBondContact OE1-N 3.19Å; E1005-K1078 IonicContact OE1-NZ 3.26Å; E1005-K1078 PolarHBondContact OE1-NZ 3.12Å; E1005-K1078 WeakPolarHBondContact OE2-CE 3.35Å; E1005-K1078 IonicContact OE2-NZ 2.59Å; E1005-K1078 PolarHBondContact OE2-NZ 2.91Å
1006	S	76.8	Confident	86.1	Confident	19 Å²	19	34.3 Å²	34.3	13%	0.133	19%	0.188	C	C	.	.			trans	-151.8	152.8	178.8	65.3	0	0	0	0	112.4
1007	F	85.1	Confident	85.7	Confident	15 Å²	15	30.1 Å²	30.1	7%	0.066	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	167.5	169.2	64.4	-95.3	0	0	0	109.9	V931 I933 F1066 I1067 L1068 P1122	V931-F1007 HydrophobicContact CB-CD1 4.46Å; V931-F1007 HydrophobicContact CB-CE1 4.05Å; V931-F1007 HydrophobicContact CB-CZ 4.13Å; V931-F1007 HydrophobicContact CG1-CD1 3.56Å; V931-F1007 HydrophobicContact CG1-CE1 3.5Å; V931-F1007 HydrophobicContact CG1-CG 4.15Å; V931-F1007 HydrophobicContact CG1-CZ 4.07Å; I933-F1007 HydrophobicContact CD1-CE1 4.26Å; I933-F1007 HydrophobicContact CG1-CD1 4.09Å; I933-F1007 HydrophobicContact CG1-CE1 3.51Å; I933-F1007 HydrophobicContact CG1-CZ 4.25Å; F1007-F1066 AromaticContact CD2-CD1 3.93Å; F1007-F1066 HydrophobicContact CD2-CD1 3.93Å; F1007-F1066 AromaticContact CE2-CD1 3.72Å; F1007-F1066 HydrophobicContact CE2-CD1 3.72Å; F1007-F1066 HydrophobicContact CE2-CE1 4.13Å; F1007-I1067 VanDerWaalsContact CA-O 3.29Å; F1007-I1067 WeakPolarHBondContact CA-O 3.31Å; F1007-I1067 VanDerWaalsContact CB-O 3.27Å; F1007-I1067 WeakPolarHBondContact CB-O 2.99Å; F1007-L1068 HydrophobicContact CB-CD2 3.97Å; F1007-P1122 HydrophobicContact CZ-CG 4.43Å
1008	R	82.6	Confident	85.6	Confident	40 Å²	40	27.9 Å²	27.9	15%	0.151	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	147.8	165.5	-66.5	-62.5	-164.9	-114.9	-2.1	109.5	F1066 I1067 E1082 L1085 D1086	R1008-F1066 WeakPolarHBondContact O-CA 3.46Å; R1008-I1067 PolarHBondContact N-O 2.91Å; R1008-I1067 VanDerWaalsContact N-O 3.13Å; R1008-I1067 PolarHBondContact O-N 2.83Å; R1008-E1082 IonicContact NH1-OE1 2.73Å; R1008-E1082 PolarHBondContact NH1-OE1 2.86Å; R1008-L1085 HydrophobicContact CG-CB 4.02Å; R1008-D1086 IonicContact CZ-OD1 2.66Å; R1008-D1086 VanDerWaalsContact CZ-OD1 3.27Å; R1008-D1086 IonicContact CZ-OD2 3.48Å; R1008-D1086 IonicContact NE-OD1 3.26Å; R1008-D1086 PolarHBondContact NE-OD1 2.88Å; R1008-D1086 IonicContact NE-OD2 3.18Å; R1008-D1086 VanDerWaalsContact NH2-CG 3.26Å; R1008-D1086 IonicContact NH2-OD1 2.93Å; R1008-D1086 PolarHBondContact NH2-OD1 3.13Å; R1008-D1086 IonicContact NH2-OD2 2.71Å; R1008-D1086 PolarHBondContact NH2-OD2 3.03Å
1009	S	85.1	Confident	85.4	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.1	179.9	49.5	0	0	0	0	112.2	E1064 L1065 T1119	S1009-E1064 WeakPolarHBondContact CB-OE1 3.31Å; S1009-L1065 VanDerWaalsContact CA-O 3.31Å; S1009-L1065 WeakPolarHBondContact CA-O 3.48Å; S1009-T1119 WeakPolarHBondContact CB-OG1 3.43Å; S1009-T1119 PolarHBondContact O-N 2.96Å; S1009-T1119 VanDerWaalsContact O-N 3.13Å; S1009-T1119 VanDerWaalsContact O-O 3.12Å; S1009-T1119 PolarHBondContact O-OG1 2.92Å; S1009-T1119 PolarHBondContact OG-O 3.18Å; S1009-T1119 PolarHBondContact OG-OG1 2.73Å
1010	L	84.7	Confident	85.3	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	123	178.9	-58.4	178.8	0	0	0	108.9	L1012 L1065 I1067 F1092 I1093 M1115 Q1118	L1010-L1012 PolarHBondContact O-N 2.89Å; L1010-L1065 HydrophobicContact CB-CB 4.42Å; L1010-L1065 HydrophobicContact CD1-CD2 4.23Å; L1010-L1065 PolarHBondContact N-O 2.86Å; L1010-L1065 PolarHBondContact O-N 3.37Å; L1010-I1067 HydrophobicContact CD1-CD1 3.98Å; L1010-I1067 HydrophobicContact CG-CD1 4.38Å; L1010-F1092 HydrophobicContact CD1-CB 3.89Å; L1010-I1093 HydrophobicContact CD1-CG1 4.4Å; L1010-I1093 HydrophobicContact CD2-CD1 4.38Å; L1010-I1093 HydrophobicContact CD2-CG1 4.25Å; L1010-M1115 HydrophobicContact CD2-CE 3.66Å; L1010-M1115 HydrophobicContact CD2-SD 4.17Å; L1010-Q1118 HydrophobicContact CD2-CG 3.81Å
1011	L	86.3	Confident	85.2	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.157	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	112.4	179.7	-172.8	67.5	0	0	0	110.3	Y1056 T1116 Q1117	L1011-Y1056 HydrophobicContact CD1-CE2 4.06Å; L1011-T1116 WeakPolarHBondContact CB-OG1 3.48Å; L1011-T1116 WeakPolarHBondContact CD2-OG1 3.07Å; L1011-T1116 WeakPolarHBondContact CG-OG1 3.38Å; L1011-T1116 PolarHBondContact O-N 3.4Å; L1011-T1116 PolarHBondContact O-OG1 2.93Å; L1011-Q1117 PolarHBondContact N-O 3.32Å; L1011-Q1117 VanDerWaalsContact N-O 3.12Å
1012	L	88.4	Confident	85.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.4	-178.1	-51.5	-179.5	0	0	0	111.3	L1010 V1036 T1062 A1063 L1065 L1096 V1113 S1114	L1010-L1012 PolarHBondContact O-N 2.89Å; L1012-V1036 HydrophobicContact CD1-CG1 4.15Å; L1012-T1062 WeakPolarHBondContact O-CA 3.27Å; L1012-A1063 WeakPolarHBondContact CA-O 3.36Å; L1012-A1063 HydrophobicContact CB-CB 4.24Å; L1012-A1063 WeakPolarHBondContact CB-O 3.32Å; L1012-A1063 HydrophobicContact CD1-CB 4.44Å; L1012-A1063 PolarHBondContact N-O 3.48Å; L1012-A1063 PolarHBondContact O-N 3.21Å; L1012-L1065 HydrophobicContact CD1-CB 3.93Å; L1012-L1065 HydrophobicContact CG-CB 4.23Å; L1012-L1096 HydrophobicContact CD2-CD1 3.52Å; L1012-L1096 HydrophobicContact CD2-CD2 4.07Å; L1012-L1096 HydrophobicContact CD2-CG 4.47Å; L1012-V1113 HydrophobicContact CB-CG1 4.13Å; L1012-V1113 HydrophobicContact CD1-CG1 4Å; L1012-V1113 HydrophobicContact CD2-CG1 4.43Å; L1012-V1113 HydrophobicContact CG-CG1 4.43Å; L1012-S1114 CarbonylContact C-O 3.59Å; L1012-S1114 WeakPolarHBondContact CA-O 3.34Å
1013	S	88.3	Confident	84.9	Confident	28 Å²	28	35.6 Å²	35.6	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	155.5	164.4	59.2	0	0	0	0	110.4	S1114 T1116	S1013-S1114 PolarHBondContact N-O 3Å; S1013-S1114 PolarHBondContact O-N 2.88Å; S1013-S1114 PolarHBondContact O-OG 3.04Å; S1013-S1114 PolarHBondContact OG-O 2.83Å; S1013-S1114 PolarHBondContact OG-OG 3.16Å; S1013-T1116 VanDerWaalsContact OG-CG2 3.29Å; S1013-T1116 WeakPolarHBondContact OG-CG2 3.21Å
1014	F	89	Confident	84.6	Confident	16 Å²	16	39.8 Å²	39.8	7%	0.07	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	157.2	178.1	-60.2	-86.9	0	0	0	110.8	L1018 V1036 L1055 T1061 A1063 F1103 I1111 V1113	F1014-L1018 HydrophobicContact CB-CB 4.1Å; F1014-L1018 HydrophobicContact CB-CD2 3.83Å; F1014-L1018 HydrophobicContact CB-CG 4.38Å; F1014-L1018 HydrophobicContact CD1-CD2 3.91Å; F1014-L1018 HydrophobicContact CD2-CD2 3.98Å; F1014-L1018 HydrophobicContact CE1-CD2 4.48Å; F1014-L1018 HydrophobicContact CG-CD2 3.64Å; F1014-V1036 HydrophobicContact CE1-CG2 3.68Å; F1014-V1036 HydrophobicContact CZ-CG2 4.09Å; F1014-L1055 HydrophobicContact CE2-CD2 4.44Å; F1014-L1055 HydrophobicContact CE2-CG 4.2Å; F1014-L1055 HydrophobicContact CZ-CD1 4.21Å; F1014-L1055 HydrophobicContact CZ-CG 4.36Å; F1014-T1061 HydrophobicContact CD2-CG2 4.01Å; F1014-T1061 HydrophobicContact CE2-CG2 4.27Å; F1014-A1063 HydrophobicContact CE2-CB 3.78Å; F1014-A1063 HydrophobicContact CZ-CB 3.94Å; F1014-F1103 HydrophobicContact CE1-CE1 4.4Å; F1014-I1111 HydrophobicContact CB-CG2 4.24Å; F1014-I1111 HydrophobicContact CD1-CG2 3.93Å; F1014-V1113 HydrophobicContact CD1-CB 4.48Å; F1014-V1113 HydrophobicContact CD1-CG1 4.29Å; F1014-V1113 HydrophobicContact CD1-CG2 3.91Å; F1014-V1113 HydrophobicContact CE1-CB 4.44Å; F1014-V1113 HydrophobicContact CE1-CG1 3.97Å; F1014-V1113 HydrophobicContact CE1-CG2 3.77Å
1015	S	87.3	Confident	84.4	Confident	29 Å²	29	42.9 Å²	42.9	20%	0.203	23%	0.234	C	C	.	.			trans	-58.2	138.2	168.1	55.7	0	0	0	0	111.2	A1017 L1018 I1111 V1112	S1015-A1017 PolarHBondContact O-N 2.97Å; S1015-L1018 PolarHBondContact O-N 2.77Å; S1015-I1111 WeakPolarHBondContact OG-CA 3.5Å; S1015-V1112 PolarHBondContact N-O 2.85Å; S1015-V1112 PolarHBondContact OG-N 3.29Å
1016	P	84.1	Confident	84.3	Confident	98 Å²	98	43.3 Å²	43.3	64%	0.636	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-54.8	-20.5	-173.4	-30.4	36.1	0	0	0	116.9	L1018 D1019	P1016-L1018 PolarHBondContact O-N 3.01Å; P1016-L1018 VanDerWaalsContact O-N 3.1Å; P1016-D1019 WeakPolarHBondContact O-CB 3.3Å; P1016-D1019 PolarHBondContact O-N 2.88Å
1017	A	84.2	Confident	84.5	Confident	36 Å²	36	48.5 Å²	48.5	30%	0.298	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-59.1	-17.5	172.9	0	0	0	0	0	114.1	S1015 H1021 V1109 I1111	S1015-A1017 PolarHBondContact O-N 2.97Å; A1017-H1021 PolarHBondContact O-ND1 3.49Å; A1017-V1109 HydrophobicContact CB-CG1 4.45Å; A1017-I1111 HydrophobicContact CB-CD1 4.01Å
1018	L	87.6	Confident	84.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-76.2	-35.1	172.7	-139.2	-19.9	0	0	0	111.8	F1014 S1015 P1016 E1020 H1021 N1022 W1028 T1061 L1105 I1111	F1014-L1018 HydrophobicContact CB-CB 4.1Å; F1014-L1018 HydrophobicContact CB-CD2 3.83Å; F1014-L1018 HydrophobicContact CB-CG 4.38Å; F1014-L1018 HydrophobicContact CD1-CD2 3.91Å; F1014-L1018 HydrophobicContact CD2-CD2 3.98Å; F1014-L1018 HydrophobicContact CE1-CD2 4.48Å; F1014-L1018 HydrophobicContact CG-CD2 3.64Å; S1015-L1018 PolarHBondContact O-N 2.77Å; P1016-L1018 PolarHBondContact O-N 3.01Å; P1016-L1018 VanDerWaalsContact O-N 3.1Å; L1018-E1020 VanDerWaalsContact C-N 3.34Å; L1018-E1020 PolarHBondContact O-N 3.19Å; L1018-H1021 CarbonylContact O-C 3.57Å; L1018-H1021 WeakPolarHBondContact O-CA 3.45Å; L1018-H1021 PolarHBondContact O-N 3.32Å; L1018-N1022 PolarHBondContact O-N 2.74Å; L1018-W1028 HydrophobicContact CD1-CH2 3.55Å; L1018-W1028 HydrophobicContact CD1-CZ2 3.48Å; L1018-W1028 VanDerWaalsContact CD1-CZ2 3.48Å; L1018-W1028 HydrophobicContact CD2-CH2 4.19Å; L1018-T1061 HydrophobicContact CD2-CG2 3.92Å; L1018-L1105 HydrophobicContact CD1-CD2 3.94Å; L1018-I1111 HydrophobicContact CB-CD1 3.91Å; L1018-I1111 HydrophobicContact CB-CG1 4.49Å; L1018-I1111 HydrophobicContact CB-CG2 4.28Å; L1018-I1111 HydrophobicContact CG-CD1 4.09Å; L1018-I1111 HydrophobicContact CG-CG1 4.15Å; L1018-I1111 HydrophobicContact CG-CG2 3.99Å
1019	D	87.3	Confident	84.9	Confident	40 Å²	40	49.7 Å²	49.7	21%	0.214	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-66.7	-36.7	-177.6	-70.7	-9.7	0	0	0	111.7	P1016 H1021 N1022 L1059 P1060 T1061	P1016-D1019 WeakPolarHBondContact O-CB 3.3Å; P1016-D1019 PolarHBondContact O-N 2.88Å; D1019-H1021 PolarHBondContact O-N 3.46Å; D1019-H1021 VanDerWaalsContact O-N 3.1Å; D1019-N1022 PolarHBondContact O-N 3.15Å; D1019-L1059 HydrophobicContact CB-CD2 3.89Å; D1019-P1060 WeakPolarHBondContact OD2-CA 3.25Å; D1019-P1060 WeakPolarHBondContact OD2-CB 3.44Å; D1019-T1061 WeakPolarHBondContact OD1-CA 3.41Å; D1019-T1061 WeakPolarHBondContact OD1-CB 3.29Å; D1019-T1061 PolarHBondContact OD1-N 3.18Å; D1019-T1061 PolarHBondContact OD1-OG1 3.5Å
1020	E	84.3	Confident	84.9	Confident	163 Å²	163	55.5 Å²	55.5	76%	0.762	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-61.7	-14.6	171.6	-60.7	-174.8	163	0	0	113.3	L1018	L1018-E1020 VanDerWaalsContact C-N 3.34Å; L1018-E1020 PolarHBondContact O-N 3.19Å
1021	H	84.7	Confident	85	Confident	60 Å²	60	59.3 Å²	59.3	28%	0.278	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-121.6	1.4	-173.1	-73.6	99.8	0	0	0	114.3	A1017 L1018 D1019 P1023 L1105 K1106	A1017-H1021 PolarHBondContact O-ND1 3.49Å; L1018-H1021 CarbonylContact O-C 3.57Å; L1018-H1021 WeakPolarHBondContact O-CA 3.45Å; L1018-H1021 PolarHBondContact O-N 3.32Å; D1019-H1021 PolarHBondContact O-N 3.46Å; D1019-H1021 VanDerWaalsContact O-N 3.1Å; H1021-P1023 WeakPolarHBondContact O-CD 3.33Å; H1021-L1105 HydrophobicContact CB-CD2 3.63Å; H1021-K1106 PolarHBondContact CD2-NZ 3.09Å; H1021-K1106 VanDerWaalsContact CD2-NZ 3.31Å; H1021-K1106 PolarHBondContact NE2-NZ 2.76Å
1022	N	86.5	Confident	85.2	Confident	22 Å²	22	58.4 Å²	58.4	12%	0.118	31%	0.312	C	S	.	.			trans	-84.8	114.3	-179.7	179.6	-8.6	0	0	0	110.5	L1018 D1019 D1024 W1028 L1059 T1061	L1018-N1022 PolarHBondContact O-N 2.74Å; D1019-N1022 PolarHBondContact O-N 3.15Å; N1022-D1024 VanDerWaalsContact C-N 3.31Å; N1022-D1024 PolarHBondContact O-N 2.88Å; N1022-D1024 WeakPolarHBondContact OD1-CA 3.43Å; N1022-D1024 PolarHBondContact OD1-N 3.38Å; N1022-W1028 HydrophobicContact CB-CH2 3.63Å; N1022-W1028 HydrophobicContact CB-CZ2 4.31Å; N1022-W1028 HydrophobicContact CB-CZ3 3.94Å; N1022-W1028 WeakPolarHBondContact OD1-CZ3 3.4Å; N1022-L1059 HydrophobicContact CB-CD2 4.08Å; N1022-T1061 PolarHBondContact ND2-OG1 3.22Å
1023	P	83.3	Confident	85.1	Confident	65 Å²	65	58.5 Å²	58.5	42%	0.422	31%	0.313	S	S	.	.			trans	-86.1	3.9	-178.7	37.2	-36.5	0	0	0	113.8	H1021 I1025 W1028	H1021-P1023 WeakPolarHBondContact O-CD 3.33Å; P1023-I1025 HydrophobicContact CB-CB 4.48Å; P1023-I1025 HydrophobicContact CB-CD1 3.92Å; P1023-I1025 HydrophobicContact CB-CG1 4.04Å; P1023-I1025 HydrophobicContact CG-CB 4Å; P1023-I1025 HydrophobicContact CG-CD1 4.14Å; P1023-I1025 HydrophobicContact CG-CG1 4.11Å; P1023-I1025 PolarHBondContact O-N 3.01Å; P1023-W1028 VanDerWaalsContact CD-CD2 3.4Å; P1023-W1028 HydrophobicContact CG-CB 3.94Å; P1023-W1028 HydrophobicContact CG-CD2 3.96Å; P1023-W1028 HydrophobicContact CG-CE3 4.47Å; P1023-W1028 HydrophobicContact CG-CG 3.7Å
1024	D	78.8	Confident	85.1	Confident	88 Å²	88	62.4 Å²	62.4	47%	0.471	32%	0.323	S	S	.	.			trans	58.9	18.8	-171.7	-158.8	38.9	0	0	0	115.2	N1022 R1029 G1058	N1022-D1024 VanDerWaalsContact C-N 3.31Å; N1022-D1024 PolarHBondContact O-N 2.88Å; N1022-D1024 WeakPolarHBondContact OD1-CA 3.43Å; N1022-D1024 PolarHBondContact OD1-N 3.38Å; D1024-R1029 PolarHBondContact O-NH1 3.39Å; D1024-R1029 PolarHBondContact O-NH2 2.89Å; D1024-R1029 IonicContact OD1-CZ 3.77Å; D1024-R1029 IonicContact OD1-NH1 2.84Å; D1024-R1029 PolarHBondContact OD1-NH1 3.4Å; D1024-R1029 IonicContact OD1-NH2 3.65Å; D1024-G1058 PolarHBondContact OD1-N 3.05Å; D1024-G1058 VanDerWaalsContact OD1-N 3.15Å
1025	I	80.8	Confident	85.2	Confident	81 Å²	81	64.6 Å²	64.6	42%	0.415	34%	0.338	S	S	.	.			trans	-87.8	133.9	-179.9	-66.5	174.6	0	0	0	110.7	P1023 E1027 W1028 R1029	P1023-I1025 HydrophobicContact CB-CB 4.48Å; P1023-I1025 HydrophobicContact CB-CD1 3.92Å; P1023-I1025 HydrophobicContact CB-CG1 4.04Å; P1023-I1025 HydrophobicContact CG-CB 4Å; P1023-I1025 HydrophobicContact CG-CD1 4.14Å; P1023-I1025 HydrophobicContact CG-CG1 4.11Å; P1023-I1025 PolarHBondContact O-N 3.01Å; I1025-E1027 HydrophobicContact CG2-CB 4.27Å; I1025-E1027 WeakPolarHBondContact CG2-OE2 3.34Å; I1025-W1028 HydrophobicContact CB-CB 4.25Å; I1025-W1028 HydrophobicContact CG2-CB 4.43Å; I1025-W1028 PolarHBondContact O-N 2.7Å; I1025-R1029 PolarHBondContact O-N 3.05Å
1026	P	75.9	Confident	85.3	Confident	78 Å²	78	63.2 Å²	63.2	51%	0.506	33%	0.328	S	S	.	.	H	α-helix	trans	-68.4	-35.8	-176.8	25.5	-30.8	0	0	0	114	W1028 R1029 E1030	P1026-W1028 VanDerWaalsContact C-N 3.34Å; P1026-W1028 PolarHBondContact O-N 2.9Å; P1026-R1029 WeakPolarHBondContact O-CB 3.36Å; P1026-R1029 PolarHBondContact O-N 2.83Å; P1026-E1030 PolarHBondContact O-N 3.34Å
1027	E	81.4	Confident	85.5	Confident	127 Å²	127	61.7 Å²	61.7	59%	0.593	31%	0.31	S	S	*	.	H	α-helix	trans	-62.5	-42.2	176.6	-62	84.8	168	0	0	111.2	I1025 R1029 E1030 D1031	I1025-E1027 HydrophobicContact CG2-CB 4.27Å; I1025-E1027 WeakPolarHBondContact CG2-OE2 3.34Å; E1027-R1029 VanDerWaalsContact C-N 3.34Å; E1027-R1029 PolarHBondContact O-N 2.79Å; E1027-E1030 PolarHBondContact O-N 3.48Å; E1027-D1031 PolarHBondContact O-N 3.14Å
1028	W	87.8	Confident	85.6	Confident	48 Å²	48	62 Å²	62	18%	0.182	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-40	174.3	177.3	93.6	0	0	0	111.8	L1018 N1022 P1023 I1025 P1026 E1030 D1031 I1032 L1055	L1018-W1028 HydrophobicContact CD1-CH2 3.55Å; L1018-W1028 HydrophobicContact CD1-CZ2 3.48Å; L1018-W1028 VanDerWaalsContact CD1-CZ2 3.48Å; L1018-W1028 HydrophobicContact CD2-CH2 4.19Å; N1022-W1028 HydrophobicContact CB-CH2 3.63Å; N1022-W1028 HydrophobicContact CB-CZ2 4.31Å; N1022-W1028 HydrophobicContact CB-CZ3 3.94Å; N1022-W1028 WeakPolarHBondContact OD1-CZ3 3.4Å; P1023-W1028 VanDerWaalsContact CD-CD2 3.4Å; P1023-W1028 HydrophobicContact CG-CB 3.94Å; P1023-W1028 HydrophobicContact CG-CD2 3.96Å; P1023-W1028 HydrophobicContact CG-CE3 4.47Å; P1023-W1028 HydrophobicContact CG-CG 3.7Å; I1025-W1028 HydrophobicContact CB-CB 4.25Å; I1025-W1028 HydrophobicContact CG2-CB 4.43Å; I1025-W1028 PolarHBondContact O-N 2.7Å; P1026-W1028 VanDerWaalsContact C-N 3.34Å; P1026-W1028 PolarHBondContact O-N 2.9Å; W1028-E1030 VanDerWaalsContact C-N 3.3Å; W1028-E1030 PolarHBondContact O-N 3.43Å; W1028-D1031 PolarHBondContact O-N 2.87Å; W1028-I1032 HydrophobicContact CD2-CG1 3.95Å; W1028-I1032 HydrophobicContact CE3-CG1 4.24Å; W1028-I1032 HydrophobicContact CH2-CG1 4.08Å; W1028-I1032 HydrophobicContact CZ2-CD1 4.17Å; W1028-I1032 HydrophobicContact CZ2-CG1 3.79Å; W1028-I1032 HydrophobicContact CZ3-CG1 4.29Å; W1028-I1032 WeakPolarHBondContact O-CG1 3.04Å; W1028-I1032 PolarHBondContact O-N 3.47Å; W1028-L1055 HydrophobicContact CZ3-CD2 4.1Å
1029	R	86.9	Confident	85.6	Confident	32 Å²	32	62.6 Å²	62.6	12%	0.121	31%	0.313	C	S	.	.	H	α-helix	trans	-62.6	-36.5	174.4	-84.1	-173.4	-77.1	-93.7	-1.9	112.4	D1024 I1025 P1026 E1027 G1033 L1055	D1024-R1029 PolarHBondContact O-NH1 3.39Å; D1024-R1029 PolarHBondContact O-NH2 2.89Å; D1024-R1029 IonicContact OD1-CZ 3.77Å; D1024-R1029 IonicContact OD1-NH1 2.84Å; D1024-R1029 PolarHBondContact OD1-NH1 3.4Å; D1024-R1029 IonicContact OD1-NH2 3.65Å; I1025-R1029 PolarHBondContact O-N 3.05Å; P1026-R1029 WeakPolarHBondContact O-CB 3.36Å; P1026-R1029 PolarHBondContact O-N 2.83Å; E1027-R1029 VanDerWaalsContact C-N 3.34Å; E1027-R1029 PolarHBondContact O-N 2.79Å; R1029-G1033 PolarHBondContact O-N 2.92Å; R1029-L1055 HydrophobicContact CB-CB 3.9Å; R1029-L1055 WeakPolarHBondContact CD-O 3.23Å; R1029-L1055 HydrophobicContact CG-CB 3.67Å; R1029-L1055 HydrophobicContact CG-CD2 4.17Å
1030	E	84.6	Confident	85.6	Confident	123 Å²	123	60.8 Å²	60.8	58%	0.575	30%	0.303	S	S	*	.	H	α-helix	trans	-68.6	-45.5	176.4	-160.4	-159	122.4	0	0	111.6	P1026 E1027 W1028 G1033 R1034	P1026-E1030 PolarHBondContact O-N 3.34Å; E1027-E1030 PolarHBondContact O-N 3.48Å; W1028-E1030 VanDerWaalsContact C-N 3.3Å; W1028-E1030 PolarHBondContact O-N 3.43Å; E1030-G1033 CarbonylContact O-C 3.59Å; E1030-G1033 WeakPolarHBondContact O-CA 3.26Å; E1030-G1033 PolarHBondContact O-N 3.16Å; E1030-R1034 PolarHBondContact O-N 2.85Å; E1030-R1034 IonicContact OE1-CZ 3.87Å; E1030-R1034 IonicContact OE1-NH2 2.81Å; E1030-R1034 PolarHBondContact OE1-NH2 2.99Å
1031	D	87.8	Confident	85.7	Confident	81 Å²	81	54.1 Å²	54.1	43%	0.433	28%	0.275	S	S	.	.	H	α-helix	trans	-63.7	-43.1	178.4	-81.8	-17.8	0	0	0	112.3	E1027 W1028 G1033 R1034 V1035	E1027-D1031 PolarHBondContact O-N 3.14Å; W1028-D1031 PolarHBondContact O-N 2.87Å; D1031-G1033 VanDerWaalsContact C-N 3.34Å; D1031-R1034 WeakPolarHBondContact O-CB 3.46Å; D1031-R1034 PolarHBondContact O-N 2.98Å; D1031-R1034 IonicContact OD1-CZ 3.04Å; D1031-R1034 IonicContact OD1-NH1 2.68Å; D1031-R1034 PolarHBondContact OD1-NH1 3.29Å; D1031-R1034 IonicContact OD1-NH2 3.77Å; D1031-R1034 PolarHBondContact OD1-NH2 3.36Å; D1031-V1035 WeakPolarHBondContact O-CG2 3.23Å; D1031-V1035 PolarHBondContact O-N 3.49Å
1032	I	89.4	Confident	85.7	Confident	11 Å²	11	58.6 Å²	58.6	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-41.2	172.4	-62.6	-66.5	0	0	0	110.7	W1028 R1034 V1035 V1036 L1055 F1103 L1105	W1028-I1032 HydrophobicContact CD2-CG1 3.95Å; W1028-I1032 HydrophobicContact CE3-CG1 4.24Å; W1028-I1032 HydrophobicContact CH2-CG1 4.08Å; W1028-I1032 HydrophobicContact CZ2-CD1 4.17Å; W1028-I1032 HydrophobicContact CZ2-CG1 3.79Å; W1028-I1032 HydrophobicContact CZ3-CG1 4.29Å; W1028-I1032 WeakPolarHBondContact O-CG1 3.04Å; W1028-I1032 PolarHBondContact O-N 3.47Å; I1032-R1034 VanDerWaalsContact C-N 3.26Å; I1032-R1034 PolarHBondContact O-N 3.44Å; I1032-V1035 PolarHBondContact O-N 2.96Å; I1032-V1036 HydrophobicContact CG2-CG2 4.33Å; I1032-V1036 VanDerWaalsContact O-CG2 3.28Å; I1032-V1036 WeakPolarHBondContact O-CG2 3.43Å; I1032-V1036 PolarHBondContact O-N 3.48Å; I1032-L1055 HydrophobicContact CB-CD2 3.94Å; I1032-L1055 HydrophobicContact CG2-CD1 4.25Å; I1032-L1055 HydrophobicContact CG2-CD2 3.66Å; I1032-F1103 HydrophobicContact CD1-CE2 4.11Å; I1032-F1103 HydrophobicContact CD1-CZ 4.3Å; I1032-F1103 HydrophobicContact CG2-CZ 4.09Å; I1032-L1105 HydrophobicContact CD1-CD1 3.71Å
1033	G	88.3	Confident	85.6	Confident	2 Å²	2	60.5 Å²	60.5	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-58.8	-36	173.8	0	0	0	0	0	113	R1029 E1030 D1031 R1037	R1029-G1033 PolarHBondContact O-N 2.92Å; E1030-G1033 CarbonylContact O-C 3.59Å; E1030-G1033 WeakPolarHBondContact O-CA 3.26Å; E1030-G1033 PolarHBondContact O-N 3.16Å; D1031-G1033 VanDerWaalsContact C-N 3.34Å; G1033-R1037 WeakPolarHBondContact O-CB 3.42Å; G1033-R1037 PolarHBondContact O-N 2.79Å
1034	R	87.9	Confident	85.4	Confident	110 Å²	110	58.7 Å²	58.7	42%	0.415	30%	0.297	S	S	.	.	H	α-helix	trans	-67.7	-47.3	174.5	-160.3	-177.6	-55.5	129.7	9.7	111.5	E1030 D1031 I1032 V1036 R1037 T1038	E1030-R1034 PolarHBondContact O-N 2.85Å; E1030-R1034 IonicContact OE1-CZ 3.87Å; E1030-R1034 IonicContact OE1-NH2 2.81Å; E1030-R1034 PolarHBondContact OE1-NH2 2.99Å; D1031-R1034 WeakPolarHBondContact O-CB 3.46Å; D1031-R1034 PolarHBondContact O-N 2.98Å; D1031-R1034 IonicContact OD1-CZ 3.04Å; D1031-R1034 IonicContact OD1-NH1 2.68Å; D1031-R1034 PolarHBondContact OD1-NH1 3.29Å; D1031-R1034 IonicContact OD1-NH2 3.77Å; D1031-R1034 PolarHBondContact OD1-NH2 3.36Å; I1032-R1034 VanDerWaalsContact C-N 3.26Å; I1032-R1034 PolarHBondContact O-N 3.44Å; R1034-V1036 VanDerWaalsContact C-N 3.33Å; R1034-V1036 PolarHBondContact O-N 2.94Å; R1034-R1037 WeakPolarHBondContact O-CB 3.45Å; R1034-R1037 PolarHBondContact O-N 2.9Å; R1034-T1038 PolarHBondContact O-N 2.89Å; R1034-T1038 PolarHBondContact O-OG1 2.83Å
1035	V	89.7	Confident	85.3	Confident	63 Å²	63	58 Å²	58	38%	0.382	31%	0.311	S	S	.	.	H	α-helix	trans	-57.7	-45	175.9	172.3	0	0	0	0	111.5	D1031 I1032 T1038 A1039 F1103	D1031-V1035 WeakPolarHBondContact O-CG2 3.23Å; D1031-V1035 PolarHBondContact O-N 3.49Å; I1032-V1035 PolarHBondContact O-N 2.96Å; V1035-T1038 PolarHBondContact O-N 2.9Å; V1035-A1039 WeakPolarHBondContact O-CB 3.41Å; V1035-A1039 PolarHBondContact O-N 3.4Å; V1035-F1103 HydrophobicContact CG1-CB 3.76Å; V1035-F1103 HydrophobicContact CG1-CD1 4.07Å; V1035-F1103 HydrophobicContact CG1-CD2 3.82Å; V1035-F1103 HydrophobicContact CG1-CE2 4.41Å; V1035-F1103 HydrophobicContact CG1-CG 3.63Å
1036	V	89.3	Confident	85.3	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.2	-41.1	178	176.8	0	0	0	0	111.4	L1012 F1014 I1032 R1034 A1039 L1040 V1053 F1103 V1113	L1012-V1036 HydrophobicContact CD1-CG1 4.15Å; F1014-V1036 HydrophobicContact CE1-CG2 3.68Å; F1014-V1036 HydrophobicContact CZ-CG2 4.09Å; I1032-V1036 HydrophobicContact CG2-CG2 4.33Å; I1032-V1036 VanDerWaalsContact O-CG2 3.28Å; I1032-V1036 WeakPolarHBondContact O-CG2 3.43Å; I1032-V1036 PolarHBondContact O-N 3.48Å; R1034-V1036 VanDerWaalsContact C-N 3.33Å; R1034-V1036 PolarHBondContact O-N 2.94Å; V1036-A1039 PolarHBondContact O-N 2.93Å; V1036-L1040 HydrophobicContact CG1-CD1 3.84Å; V1036-L1040 HydrophobicContact CG1-CG 4.42Å; V1036-L1040 WeakPolarHBondContact O-CB 3.41Å; V1036-L1040 WeakPolarHBondContact O-CD1 3.32Å; V1036-L1040 VanDerWaalsContact O-CG 3.23Å; V1036-L1040 WeakPolarHBondContact O-CG 3.04Å; V1036-L1040 PolarHBondContact O-N 3.16Å; V1036-V1053 HydrophobicContact CB-CG1 4.26Å; V1036-V1053 HydrophobicContact CB-CG2 4.5Å; V1036-V1053 HydrophobicContact CG1-CG1 4.12Å; V1036-V1053 HydrophobicContact CG1-CG2 4.1Å; V1036-F1103 HydrophobicContact CG2-CD1 4.48Å; V1036-F1103 HydrophobicContact CG2-CE1 3.93Å; V1036-V1113 HydrophobicContact CG1-CG1 4.39Å; V1036-V1113 HydrophobicContact CG1-CG2 4.48Å; V1036-V1113 HydrophobicContact CG2-CG2 4.26Å
1037	R	89.1	Confident	85.6	Confident	65 Å²	65	54 Å²	54	25%	0.245	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-46.8	175.4	-174.3	-172.2	-54.6	160.5	5.4	112.1	G1033 R1034 L1040 S1041 L1051 V1053	G1033-R1037 WeakPolarHBondContact O-CB 3.42Å; G1033-R1037 PolarHBondContact O-N 2.79Å; R1034-R1037 WeakPolarHBondContact O-CB 3.45Å; R1034-R1037 PolarHBondContact O-N 2.9Å; R1037-L1040 PolarHBondContact O-N 3.43Å; R1037-S1041 PolarHBondContact O-N 2.86Å; R1037-L1051 WeakPolarHBondContact CD-O 3.37Å; R1037-L1051 HydrophobicContact CG-CB 4Å; R1037-L1051 WeakPolarHBondContact CG-O 3.37Å; R1037-L1051 PolarHBondContact NE-O 3.24Å; R1037-V1053 HydrophobicContact CB-CG2 4.14Å
1038	T	86.8	Confident	85.5	Confident	42 Å²	42	52 Å²	52	26%	0.258	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-41.8	178.1	-61	0	0	0	0	111.8	R1034 V1035 L1040 S1041 Q1042 E1048	R1034-T1038 PolarHBondContact O-N 2.89Å; R1034-T1038 PolarHBondContact O-OG1 2.83Å; V1035-T1038 PolarHBondContact O-N 2.9Å; T1038-L1040 PolarHBondContact O-N 2.83Å; T1038-S1041 PolarHBondContact O-N 3.21Å; T1038-Q1042 HydrophobicContact CG2-CG 4.47Å; T1038-Q1042 WeakPolarHBondContact O-CB 3.45Å; T1038-Q1042 WeakPolarHBondContact O-CG 3.44Å; T1038-Q1042 PolarHBondContact O-N 3.18Å; T1038-E1048 WeakPolarHBondContact CA-OE1 3.37Å; T1038-E1048 VanDerWaalsContact CB-OE1 3.22Å; T1038-E1048 WeakPolarHBondContact CB-OE1 3.36Å; T1038-E1048 WeakPolarHBondContact CG2-OE1 3.44Å; T1038-E1048 PolarHBondContact OG1-OE1 2.85Å
1039	A	86.8	Confident	84.9	Confident	14 Å²	14	54.3 Å²	54.3	12%	0.116	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-42.5	174.7	0	0	0	0	0	112.3	V1035 V1036 Q1042 V1043 V1101	V1035-A1039 WeakPolarHBondContact O-CB 3.41Å; V1035-A1039 PolarHBondContact O-N 3.4Å; V1036-A1039 PolarHBondContact O-N 2.93Å; A1039-Q1042 PolarHBondContact O-N 2.92Å; A1039-V1043 WeakPolarHBondContact O-CG2 3.32Å; A1039-V1043 PolarHBondContact O-N 2.85Å; A1039-V1043 VanDerWaalsContact O-N 3.09Å; A1039-V1101 HydrophobicContact CB-CG1 4.06Å
1040	L	87.4	Confident	84.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-44.7	174.7	-74.5	162.4	0	0	0	112.1	V1036 R1037 T1038 V1043 S1044 L1051 V1053 L1065 F1092 L1096 V1101	V1036-L1040 HydrophobicContact CG1-CD1 3.84Å; V1036-L1040 HydrophobicContact CG1-CG 4.42Å; V1036-L1040 WeakPolarHBondContact O-CB 3.41Å; V1036-L1040 WeakPolarHBondContact O-CD1 3.32Å; V1036-L1040 VanDerWaalsContact O-CG 3.23Å; V1036-L1040 WeakPolarHBondContact O-CG 3.04Å; V1036-L1040 PolarHBondContact O-N 3.16Å; R1037-L1040 PolarHBondContact O-N 3.43Å; T1038-L1040 PolarHBondContact O-N 2.83Å; L1040-V1043 PolarHBondContact O-N 3.18Å; L1040-S1044 WeakPolarHBondContact O-CB 3.06Å; L1040-S1044 PolarHBondContact O-N 2.77Å; L1040-S1044 VanDerWaalsContact O-N 3.13Å; L1040-S1044 PolarHBondContact O-OG 2.72Å; L1040-L1051 HydrophobicContact CB-CD1 4.2Å; L1040-V1053 HydrophobicContact CD1-CG2 3.87Å; L1040-L1065 HydrophobicContact CD1-CD1 3.98Å; L1040-L1065 HydrophobicContact CD1-CD2 3.72Å; L1040-L1065 HydrophobicContact CD1-CG 4.39Å; L1040-L1065 HydrophobicContact CD2-CD2 4.2Å; L1040-F1092 HydrophobicContact CB-CD1 4.44Å; L1040-F1092 HydrophobicContact CB-CE1 3.85Å; L1040-F1092 HydrophobicContact CD2-CD1 3.58Å; L1040-F1092 HydrophobicContact CD2-CE1 3.87Å; L1040-F1092 HydrophobicContact CG-CE1 4.45Å; L1040-L1096 HydrophobicContact CD2-CD2 4.39Å; L1040-V1101 HydrophobicContact CD2-CG1 4.23Å; L1040-V1101 HydrophobicContact CD2-CG2 3.87Å; L1040-V1101 HydrophobicContact CG-CG1 4.21Å
1041	S	86.9	Confident	84.7	Confident	24 Å²	24	48.5 Å²	48.5	17%	0.168	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-46.4	176.8	-178.1	0	0	0	0	111.6	R1037 T1038 V1043 S1044 G1045 V1046	R1037-S1041 PolarHBondContact O-N 2.86Å; T1038-S1041 PolarHBondContact O-N 3.21Å; S1041-V1043 VanDerWaalsContact C-N 3.35Å; S1041-V1043 PolarHBondContact O-N 3.08Å; S1041-S1044 PolarHBondContact O-N 2.69Å; S1041-S1044 PolarHBondContact O-OG 3.38Å; S1041-G1045 PolarHBondContact O-N 2.92Å; S1041-V1046 WeakPolarHBondContact CA-O 3.31Å; S1041-V1046 WeakPolarHBondContact CB-O 3.33Å; S1041-V1046 PolarHBondContact OG-O 3.09Å
1042	Q	84.5	Confident	84.6	Confident	154 Å²	154	47 Å²	47	72%	0.72	27%	0.271	S	S	*	.	H	α-helix	trans	-62.3	-36.5	179.2	-72.8	177.4	9.1	0	0	113.7	T1038 A1039	T1038-Q1042 HydrophobicContact CG2-CG 4.47Å; T1038-Q1042 WeakPolarHBondContact O-CB 3.45Å; T1038-Q1042 WeakPolarHBondContact O-CG 3.44Å; T1038-Q1042 PolarHBondContact O-N 3.18Å; A1039-Q1042 PolarHBondContact O-N 2.92Å
1043	V	83.9	Confident	84.5	Confident	61 Å²	61	46.9 Å²	46.9	37%	0.37	27%	0.27	S	S	.	.	H	α-helix	trans	-79.8	-26.6	-179.4	173.8	0	0	0	0	112.7	A1039 L1040 S1041 A1095 L1100	A1039-V1043 WeakPolarHBondContact O-CG2 3.32Å; A1039-V1043 PolarHBondContact O-N 2.85Å; A1039-V1043 VanDerWaalsContact O-N 3.09Å; L1040-V1043 PolarHBondContact O-N 3.18Å; S1041-V1043 VanDerWaalsContact C-N 3.35Å; S1041-V1043 PolarHBondContact O-N 3.08Å; V1043-A1095 HydrophobicContact CG1-CB 3.74Å; V1043-L1100 HydrophobicContact CG1-CB 3.88Å; V1043-L1100 HydrophobicContact CG1-CD1 4.15Å
1044	S	78.8	Confident	84.4	Confident	28 Å²	28	48.4 Å²	48.4	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-105.7	-22.6	-173.4	62.9	0	0	0	0	115.3	L1040 S1041 V1046 F1092	L1040-S1044 WeakPolarHBondContact O-CB 3.06Å; L1040-S1044 PolarHBondContact O-N 2.77Å; L1040-S1044 VanDerWaalsContact O-N 3.13Å; L1040-S1044 PolarHBondContact O-OG 2.72Å; S1041-S1044 PolarHBondContact O-N 2.69Å; S1041-S1044 PolarHBondContact O-OG 3.38Å; S1044-V1046 PolarHBondContact O-N 2.94Å; S1044-V1046 WeakPolarHBondContact OG-CB 3.42Å; S1044-V1046 PolarHBondContact OG-N 2.83Å; S1044-F1092 WeakPolarHBondContact OG-CE1 3.43Å; S1044-F1092 WeakPolarHBondContact OG-CZ 3.33Å
1045	G	76.7	Confident	84.4	Confident	73 Å²	73	43.6 Å²	43.6	75%	0.753	26%	0.263	S	S	*	.			trans	74.3	4.1	-168.6	0	0	0	0	0	114.6	S1041	S1041-G1045 PolarHBondContact O-N 2.92Å
1046	V	81.9	Confident	84.1	Confident	18 Å²	18	43.1 Å²	43.1	11%	0.109	26%	0.255	C	S	.	.			trans	-78.5	140.2	177	179.4	0	0	0	0	110	S1041 S1044 Q1050 L1051 I1088 F1092	S1041-V1046 WeakPolarHBondContact CA-O 3.31Å; S1041-V1046 WeakPolarHBondContact CB-O 3.33Å; S1041-V1046 PolarHBondContact OG-O 3.09Å; S1044-V1046 PolarHBondContact O-N 2.94Å; S1044-V1046 WeakPolarHBondContact OG-CB 3.42Å; S1044-V1046 PolarHBondContact OG-N 2.83Å; V1046-Q1050 HydrophobicContact CG1-CB 4.2Å; V1046-L1051 HydrophobicContact CG1-CD1 4.37Å; V1046-L1051 HydrophobicContact CG1-CD2 4.02Å; V1046-L1051 HydrophobicContact CG1-CG 4.21Å; V1046-I1088 HydrophobicContact CG2-CG2 4.19Å; V1046-F1092 HydrophobicContact CB-CZ 4.03Å; V1046-F1092 HydrophobicContact CG1-CZ 4.38Å; V1046-F1092 HydrophobicContact CG2-CE2 4.35Å; V1046-F1092 HydrophobicContact CG2-CZ 4.07Å
1047	S	81.6	Confident	83.4	Confident	58 Å²	58	47.4 Å²	47.4	41%	0.406	28%	0.283	S	S	.	.			trans	-61.9	136.2	-179.8	-177.8	0	0	0	0	112	S1049 Q1050	S1047-S1049 PolarHBondContact O-N 2.94Å; S1047-S1049 VanDerWaalsContact O-N 3.08Å; S1047-S1049 PolarHBondContact OG-N 2.92Å; S1047-S1049 PolarHBondContact OG-OG 2.83Å; S1047-Q1050 PolarHBondContact O-N 2.88Å
1048	E	79.6	Confident	82.7	Confident	84 Å²	84	45.8 Å²	45.8	39%	0.393	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-55.5	-26.5	172.6	-67.2	-168.7	158.5	0	0	113	T1038 Q1050 L1051	T1038-E1048 WeakPolarHBondContact CA-OE1 3.37Å; T1038-E1048 VanDerWaalsContact CB-OE1 3.22Å; T1038-E1048 WeakPolarHBondContact CB-OE1 3.36Å; T1038-E1048 WeakPolarHBondContact CG2-OE1 3.44Å; T1038-E1048 PolarHBondContact OG1-OE1 2.85Å; E1048-Q1050 PolarHBondContact O-N 2.84Å; E1048-L1051 PolarHBondContact O-N 2.87Å
1049	S	76.1	Confident	82.2	Confident	97 Å²	97	48.8 Å²	48.8	68%	0.678	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-66.5	-18.7	176.6	62.5	0	0	0	0	114.3	S1047	S1047-S1049 PolarHBondContact O-N 2.94Å; S1047-S1049 VanDerWaalsContact O-N 3.08Å; S1047-S1049 PolarHBondContact OG-N 2.92Å; S1047-S1049 PolarHBondContact OG-OG 2.83Å
1050	Q	80.8	Confident	82.1	Confident	29 Å²	29	52.4 Å²	52.4	14%	0.136	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-94.9	-1.8	177	-64.5	174.6	-1.1	0	0	112.5	V1046 S1047 E1048 L1068 D1070	V1046-Q1050 HydrophobicContact CG1-CB 4.2Å; S1047-Q1050 PolarHBondContact O-N 2.88Å; E1048-Q1050 PolarHBondContact O-N 2.84Å; Q1050-L1068 PolarHBondContact O-N 3.45Å; Q1050-D1070 PolarHBondContact NE2-OD2 2.89Å
1051	L	86	Confident	82.1	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113	-170	-54.7	177.2	0	0	0	111.9	R1037 L1040 V1046 E1048 L1065 F1092	R1037-L1051 WeakPolarHBondContact CD-O 3.37Å; R1037-L1051 HydrophobicContact CG-CB 4Å; R1037-L1051 WeakPolarHBondContact CG-O 3.37Å; R1037-L1051 PolarHBondContact NE-O 3.24Å; L1040-L1051 HydrophobicContact CB-CD1 4.2Å; V1046-L1051 HydrophobicContact CG1-CD1 4.37Å; V1046-L1051 HydrophobicContact CG1-CD2 4.02Å; V1046-L1051 HydrophobicContact CG1-CG 4.21Å; E1048-L1051 PolarHBondContact O-N 2.87Å; L1051-L1065 HydrophobicContact CB-CD1 4.35Å; L1051-L1065 HydrophobicContact CD2-CD1 4.39Å; L1051-F1092 HydrophobicContact CD1-CE1 4.41Å; L1051-F1092 HydrophobicContact CD1-CZ 3.77Å; L1051-F1092 HydrophobicContact CD2-CE2 3.47Å; L1051-F1092 VanDerWaalsContact CD2-CE2 3.47Å; L1051-F1092 HydrophobicContact CD2-CZ 3.47Å; L1051-F1092 VanDerWaalsContact CD2-CZ 3.47Å; L1051-F1092 HydrophobicContact CG-CZ 4.27Å
1052	M	85.4	Confident	82.1	Confident	50 Å²	50	53.2 Å²	53.2	25%	0.246	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	105.2	174.4	-172	-179.1	-165.8	0	0	110.2	I930 V931 F1066 L1068	I930-M1052 HydrophobicContact CG2-CE 3.43Å; I930-M1052 VanDerWaalsContact CG2-CE 3.43Å; I930-M1052 HydrophobicContact CG2-SD 4.04Å; V931-M1052 HydrophobicContact CG2-SD 3.84Å; M1052-F1066 HydrophobicContact CB-CB 4.27Å; M1052-F1066 HydrophobicContact CB-CD2 4.46Å; M1052-F1066 HydrophobicContact CG-CD2 4.46Å; M1052-F1066 PolarHBondContact N-O 2.84Å; M1052-F1066 WeakPolarHBondContact O-CD2 3.25Å; M1052-F1066 PolarHBondContact O-N 2.87Å; M1052-L1068 HydrophobicContact CB-CD1 4.34Å
1053	V	87.8	Confident	82.3	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	136.9	170.6	-178.3	0	0	0	0	109.3	V1036 R1037 L1040 L1055 A1063 L1065	V1036-V1053 HydrophobicContact CB-CG1 4.26Å; V1036-V1053 HydrophobicContact CB-CG2 4.5Å; V1036-V1053 HydrophobicContact CG1-CG1 4.12Å; V1036-V1053 HydrophobicContact CG1-CG2 4.1Å; R1037-V1053 HydrophobicContact CB-CG2 4.14Å; L1040-V1053 HydrophobicContact CD1-CG2 3.87Å; V1053-L1055 HydrophobicContact CG1-CD1 4.2Å; V1053-A1063 HydrophobicContact CG1-CB 4.14Å; V1053-L1065 HydrophobicContact CG2-CD1 3.81Å
1054	S	85.8	Confident	82.5	Confident	34 Å²	34	43 Å²	43	24%	0.238	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.4	167.3	-164.4	0	0	0	0	111.7	I930 A1063 E1064	I930-S1054 WeakPolarHBondContact CD1-OG 3.35Å; S1054-A1063 CarbonylContact O-C 3.37Å; S1054-A1063 WeakPolarHBondContact O-CA 3.44Å; S1054-A1063 VanDerWaalsContact O-CB 3.27Å; S1054-A1063 WeakPolarHBondContact O-CB 3.44Å; S1054-E1064 PolarHBondContact N-O 3.41Å; S1054-E1064 PolarHBondContact O-N 2.04Å
1055	L	86.6	Confident	82.9	Confident	10 Å²	10	41.6 Å²	41.6	5%	0.052	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	139.7	177	-85	67.4	0	0	0	110.8	F1014 W1028 R1029 I1032 V1053 T1061 T1062 A1063	F1014-L1055 HydrophobicContact CE2-CD2 4.44Å; F1014-L1055 HydrophobicContact CE2-CG 4.2Å; F1014-L1055 HydrophobicContact CZ-CD1 4.21Å; F1014-L1055 HydrophobicContact CZ-CG 4.36Å; W1028-L1055 HydrophobicContact CZ3-CD2 4.1Å; R1029-L1055 HydrophobicContact CB-CB 3.9Å; R1029-L1055 WeakPolarHBondContact CD-O 3.23Å; R1029-L1055 HydrophobicContact CG-CB 3.67Å; R1029-L1055 HydrophobicContact CG-CD2 4.17Å; I1032-L1055 HydrophobicContact CB-CD2 3.94Å; I1032-L1055 HydrophobicContact CG2-CD1 4.25Å; I1032-L1055 HydrophobicContact CG2-CD2 3.66Å; V1053-L1055 HydrophobicContact CG1-CD1 4.2Å; L1055-T1061 HydrophobicContact CD2-CG2 3.9Å; L1055-T1061 HydrophobicContact CG-CG2 4.48Å; L1055-T1062 WeakPolarHBondContact CA-O 3.49Å; L1055-A1063 HydrophobicContact CD1-CB 3.78Å; L1055-A1063 HydrophobicContact CG-CB 3.95Å
1056	Y	83.3	Confident	83.4	Confident	52 Å²	52	38.2 Å²	38.2	20%	0.204	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-81	153.5	173.9	-71.3	-66.3	0	0	0	111.9	L1011 T1062 E1064	L1011-Y1056 HydrophobicContact CD1-CE2 4.06Å; Y1056-T1062 PolarHBondContact N-O 3.04Å; Y1056-E1064 HydrophobicContact CE2-CB 3.93Å; Y1056-E1064 PolarHBondContact OH-OE2 3.05Å
1057	P	76.3	Confident	83.6	Confident	90 Å²	90	37.4 Å²	37.4	58%	0.584	23%	0.225	S	C	*	.	S	Bend	trans	-77.8	152.8	173.6	32.4	-34.5	0	0	0	112.6
1058	G	74.3	Confident	83.6	Confident	31 Å²	31	35.4 Å²	35.4	32%	0.32	21%	0.21	S	C	.	.	S	Bend	trans	88.9	-170.7	-176.4	0	0	0	0	0	115.2	D1024	D1024-G1058 PolarHBondContact OD1-N 3.05Å; D1024-G1058 VanDerWaalsContact OD1-N 3.15Å
1059	L	76.3	Confident	83.3	Confident	106 Å²	106	32.6 Å²	32.6	56%	0.555	20%	0.199	S	C	*	.	S	Bend	trans	-128.8	145.4	-177.7	-63.1	178	0	0	0	110.7	D1019 N1022	D1019-L1059 HydrophobicContact CB-CD2 3.89Å; N1022-L1059 HydrophobicContact CB-CD2 4.08Å
1060	P	84.3	Confident	82.8	Confident	89 Å²	89	31.4 Å²	31.4	58%	0.578	19%	0.185	S	C	*	.	S	Bend	cis	-68.8	150.7	-1.5	30.6	-36.5	0	0	0	112.4	D1019 T1062	D1019-P1060 WeakPolarHBondContact OD2-CA 3.25Å; D1019-P1060 WeakPolarHBondContact OD2-CB 3.44Å; P1060-T1062 PolarHBondContact O-N 3.47Å
1061	T	86.9	Confident	81.7	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.012	21%	0.213	C	C	.	.			trans	-66.5	126.5	-177.5	-47.7	0	0	0	0	109.6	F1014 L1018 D1019 N1022 L1055	F1014-T1061 HydrophobicContact CD2-CG2 4.01Å; F1014-T1061 HydrophobicContact CE2-CG2 4.27Å; L1018-T1061 HydrophobicContact CD2-CG2 3.92Å; D1019-T1061 WeakPolarHBondContact OD1-CA 3.41Å; D1019-T1061 WeakPolarHBondContact OD1-CB 3.29Å; D1019-T1061 PolarHBondContact OD1-N 3.18Å; D1019-T1061 PolarHBondContact OD1-OG1 3.5Å; N1022-T1061 PolarHBondContact ND2-OG1 3.22Å; L1055-T1061 HydrophobicContact CD2-CG2 3.9Å; L1055-T1061 HydrophobicContact CG-CG2 4.48Å
1062	T	88	Confident	80.1	Confident	40 Å²	40	45.9 Å²	45.9	25%	0.245	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	156.3	180	46.2	0	0	0	0	109.7	L1012 L1055 Y1056 P1060	L1012-T1062 WeakPolarHBondContact O-CA 3.27Å; L1055-T1062 WeakPolarHBondContact CA-O 3.49Å; Y1056-T1062 PolarHBondContact N-O 3.04Å; P1060-T1062 PolarHBondContact O-N 3.47Å
1063	A	88	Confident	78.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.6	175.4	0	0	0	0	0	110.8	L1012 F1014 V1053 S1054 L1055	L1012-A1063 WeakPolarHBondContact CA-O 3.36Å; L1012-A1063 HydrophobicContact CB-CB 4.24Å; L1012-A1063 WeakPolarHBondContact CB-O 3.32Å; L1012-A1063 HydrophobicContact CD1-CB 4.44Å; L1012-A1063 PolarHBondContact N-O 3.48Å; L1012-A1063 PolarHBondContact O-N 3.21Å; F1014-A1063 HydrophobicContact CE2-CB 3.78Å; F1014-A1063 HydrophobicContact CZ-CB 3.94Å; V1053-A1063 HydrophobicContact CG1-CB 4.14Å; S1054-A1063 CarbonylContact O-C 3.37Å; S1054-A1063 WeakPolarHBondContact O-CA 3.44Å; S1054-A1063 VanDerWaalsContact O-CB 3.27Å; S1054-A1063 WeakPolarHBondContact O-CB 3.44Å; L1055-A1063 HydrophobicContact CD1-CB 3.78Å; L1055-A1063 HydrophobicContact CG-CB 3.95Å
1064	E	87.8	Confident	76.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.1	165.9	-160.8	158.3	-140.4	0	0	109	S1009 S1054 Y1056 F1066 T1119 P1122	S1009-E1064 WeakPolarHBondContact CB-OE1 3.31Å; S1054-E1064 PolarHBondContact N-O 3.41Å; S1054-E1064 PolarHBondContact O-N 2.04Å; Y1056-E1064 HydrophobicContact CE2-CB 3.93Å; Y1056-E1064 PolarHBondContact OH-OE2 3.05Å; E1064-F1066 HydrophobicContact CB-CE1 4.32Å; E1064-F1066 HydrophobicContact CB-CE2 4.14Å; E1064-F1066 HydrophobicContact CB-CZ 3.79Å; E1064-F1066 HydrophobicContact CG-CD1 4.38Å; E1064-F1066 HydrophobicContact CG-CE1 3.72Å; E1064-F1066 HydrophobicContact CG-CE2 4.38Å; E1064-F1066 HydrophobicContact CG-CZ 3.71Å; E1064-F1066 WeakPolarHBondContact OE2-CE1 3.09Å; E1064-F1066 WeakPolarHBondContact OE2-CZ 3.34Å; E1064-T1119 PolarHBondContact OE1-OG1 2.88Å; E1064-P1122 WeakPolarHBondContact OE2-CA 3.43Å
1065	L	87.8	Confident	74.5	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.8	171.1	164.2	63.1	0	0	0	108.3	S1009 L1010 L1012 L1040 L1051 V1053 I1067 F1092	S1009-L1065 VanDerWaalsContact CA-O 3.31Å; S1009-L1065 WeakPolarHBondContact CA-O 3.48Å; L1010-L1065 HydrophobicContact CB-CB 4.42Å; L1010-L1065 HydrophobicContact CD1-CD2 4.23Å; L1010-L1065 PolarHBondContact N-O 2.86Å; L1010-L1065 PolarHBondContact O-N 3.37Å; L1012-L1065 HydrophobicContact CD1-CB 3.93Å; L1012-L1065 HydrophobicContact CG-CB 4.23Å; L1040-L1065 HydrophobicContact CD1-CD1 3.98Å; L1040-L1065 HydrophobicContact CD1-CD2 3.72Å; L1040-L1065 HydrophobicContact CD1-CG 4.39Å; L1040-L1065 HydrophobicContact CD2-CD2 4.2Å; L1051-L1065 HydrophobicContact CB-CD1 4.35Å; L1051-L1065 HydrophobicContact CD2-CD1 4.39Å; V1053-L1065 HydrophobicContact CG2-CD1 3.81Å; L1065-I1067 HydrophobicContact CG-CG1 4.33Å; L1065-F1092 HydrophobicContact CD2-CG 4.42Å
1066	F	86.3	Confident	72.7	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.009	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.7	170.9	-51.2	-76.2	0	0	0	109.7	I930 V931 F1007 R1008 M1052 E1064 L1068 P1122	I930-F1066 HydrophobicContact CB-CE2 4.46Å; V931-F1066 HydrophobicContact CB-CD1 4.33Å; V931-F1066 HydrophobicContact CB-CG 4.41Å; V931-F1066 HydrophobicContact CG2-CB 4.06Å; V931-F1066 HydrophobicContact CG2-CD1 4.05Å; V931-F1066 HydrophobicContact CG2-CD2 3.72Å; V931-F1066 HydrophobicContact CG2-CE1 4.5Å; V931-F1066 HydrophobicContact CG2-CE2 4.21Å; V931-F1066 HydrophobicContact CG2-CG 3.64Å; F1007-F1066 AromaticContact CD2-CD1 3.93Å; F1007-F1066 HydrophobicContact CD2-CD1 3.93Å; F1007-F1066 AromaticContact CE2-CD1 3.72Å; F1007-F1066 HydrophobicContact CE2-CD1 3.72Å; F1007-F1066 HydrophobicContact CE2-CE1 4.13Å; R1008-F1066 WeakPolarHBondContact O-CA 3.46Å; M1052-F1066 HydrophobicContact CB-CB 4.27Å; M1052-F1066 HydrophobicContact CB-CD2 4.46Å; M1052-F1066 HydrophobicContact CG-CD2 4.46Å; M1052-F1066 PolarHBondContact N-O 2.84Å; M1052-F1066 WeakPolarHBondContact O-CD2 3.25Å; M1052-F1066 PolarHBondContact O-N 2.87Å; E1064-F1066 HydrophobicContact CB-CE1 4.32Å; E1064-F1066 HydrophobicContact CB-CE2 4.14Å; E1064-F1066 HydrophobicContact CB-CZ 3.79Å; E1064-F1066 HydrophobicContact CG-CD1 4.38Å; E1064-F1066 HydrophobicContact CG-CE1 3.72Å; E1064-F1066 HydrophobicContact CG-CE2 4.38Å; E1064-F1066 HydrophobicContact CG-CZ 3.71Å; E1064-F1066 WeakPolarHBondContact OE2-CE1 3.09Å; E1064-F1066 WeakPolarHBondContact OE2-CZ 3.34Å; F1066-L1068 HydrophobicContact CB-CD2 4.12Å; F1066-P1122 HydrophobicContact CE1-CB 4.08Å; F1066-P1122 HydrophobicContact CZ-CB 4.39Å
1067	I	85.8	Confident	71.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	116.9	173.6	-52.4	168.3	0	0	0	107.1	F1007 R1008 L1010 L1065 L1085 I1088 F1092	F1007-I1067 VanDerWaalsContact CA-O 3.29Å; F1007-I1067 WeakPolarHBondContact CA-O 3.31Å; F1007-I1067 VanDerWaalsContact CB-O 3.27Å; F1007-I1067 WeakPolarHBondContact CB-O 2.99Å; R1008-I1067 PolarHBondContact N-O 2.91Å; R1008-I1067 VanDerWaalsContact N-O 3.13Å; R1008-I1067 PolarHBondContact O-N 2.83Å; L1010-I1067 HydrophobicContact CD1-CD1 3.98Å; L1010-I1067 HydrophobicContact CG-CD1 4.38Å; L1065-I1067 HydrophobicContact CG-CG1 4.33Å; I1067-L1085 HydrophobicContact CB-CD2 4.43Å; I1067-L1085 HydrophobicContact CG2-CD2 3.73Å; I1067-I1088 HydrophobicContact CD1-CG2 4.43Å; I1067-I1088 HydrophobicContact CG2-CB 4.35Å; I1067-I1088 HydrophobicContact CG2-CG2 3.61Å; I1067-F1092 HydrophobicContact CD1-CD2 3.78Å; I1067-F1092 HydrophobicContact CD1-CE2 4.36Å; I1067-F1092 HydrophobicContact CG1-CD2 4.25Å; I1067-F1092 HydrophobicContact CG1-CE2 4.43Å
1068	L	81.8	Confident	70.1	Confident	17 Å²	17	66.6 Å²	66.6	9%	0.089	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	145.8	-172.2	-51.4	-178.9	0	0	0	111.1	V931 F1007 Q1050 M1052 F1066	V931-L1068 HydrophobicContact CG1-CD2 4.24Å; F1007-L1068 HydrophobicContact CB-CD2 3.97Å; Q1050-L1068 PolarHBondContact O-N 3.45Å; M1052-L1068 HydrophobicContact CB-CD1 4.34Å; F1066-L1068 HydrophobicContact CB-CD2 4.12Å
1069	S	73.9	Confident	69	Low	24 Å²	24	73.6 Å²	73.6	17%	0.168	38%	0.38	C	S	.	.			trans	-69.5	144.3	174.2	58.3	0	0	0	0	112.2
1070	D	66.3	Low	68	Low	73 Å²	73	76.2 Å²	76.2	39%	0.39	38%	0.383	S	S	.	.			trans	-63.1	141.1	176.9	-156.2	-50.6	0	0	0	112.3	Q1050 Q1072	Q1050-D1070 PolarHBondContact NE2-OD2 2.89Å; D1070-Q1072 PolarHBondContact OD1-N 2.82Å
1071	E	57.7	Low	66.8	Low	155 Å²	155	73.6 Å²	73.6	72%	0.724	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-12.2	179.6	-60.3	-170.2	158.5	0	0	113.3	K1004	K1004-E1071 IonicContact NZ-OE1 3.37Å; K1004-E1071 PolarHBondContact NZ-OE1 2.86Å
1072	Q	51	Low	65.8	Low	181 Å²	181	77.9 Å²	77.9	85%	0.846	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.1	-176.8	-62.2	-165.6	-4.3	0	0	115	D1070	D1070-Q1072 PolarHBondContact OD1-N 2.82Å
1073	M	50.8	Low	64.8	Low	122 Å²	122	82.1 Å²	82.1	60%	0.601	40%	0.403	S	S	*	.	S	Bend	trans	-90.7	132.4	179.5	-66.4	-152.4	72.8	0	0	113	H1077	M1073-H1077 HydrophobicContact CE-CB 4.38Å
1074	S	43.8	Very low	64	Low	87 Å²	87	84.1 Å²	84.1	61%	0.608	42%	0.42	S	S	*	.			trans	-71.6	155.6	177.6	61.8	0	0	0	0	112.9	E1076	S1074-E1076 PolarHBondContact O-N 2.86Å
1075	S	48.4	Very low	63.4	Low	102 Å²	102	84.2 Å²	84.2	71%	0.713	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-66.4	-0.9	-168.3	54.9	0	0	0	0	116.5
1076	E	47.2	Very low	62.9	Low	173 Å²	173	86.9 Å²	86.9	81%	0.808	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-85.1	0.3	-178.8	-63.1	-169	127.2	0	0	114.3	S1074	S1074-E1076 PolarHBondContact O-N 2.86Å
1077	H	52.5	Low	62.6	Low	82 Å²	82	90.8 Å²	90.8	38%	0.38	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-120.5	25	-171.2	-90.5	24.3	0	0	0	115.7	M1073 K1079 R1080 S1081	M1073-H1077 HydrophobicContact CE-CB 4.38Å; H1077-K1079 PolarHBondContact O-N 2.89Å; H1077-K1079 VanDerWaalsContact O-N 3.15Å; H1077-R1080 HydrophobicContact CB-CB 4.38Å; H1077-R1080 PolarHBondContact NE2-NH1 2.87Å; H1077-R1080 VanDerWaalsContact NE2-NH1 3.17Å; H1077-R1080 WeakPolarHBondContact O-CA 3.31Å; H1077-R1080 WeakPolarHBondContact O-CB 3.35Å; H1077-R1080 PolarHBondContact O-N 2.96Å; H1077-S1081 PolarHBondContact O-N 2.89Å
1078	K	52.8	Low	62.4	Low	113 Å²	113	92.3 Å²	92.3	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-49.5	-44.3	-172.6	-63.1	-160.5	170.5	-146.8	0	116.4	E1005 R1080 S1081	E1005-K1078 IonicContact OE1-NZ 3.26Å; E1005-K1078 PolarHBondContact OE1-NZ 3.12Å; E1005-K1078 WeakPolarHBondContact OE2-CE 3.35Å; E1005-K1078 IonicContact OE2-NZ 2.59Å; E1005-K1078 PolarHBondContact OE2-NZ 2.91Å; K1078-R1080 VanDerWaalsContact C-N 3.32Å; K1078-R1080 PolarHBondContact O-N 3.09Å; K1078-S1081 WeakPolarHBondContact O-CB 3.49Å; K1078-S1081 PolarHBondContact O-N 2.9Å
1079	K	51.3	Low	62.4	Low	177 Å²	177	91.5 Å²	91.5	77%	0.77	46%	0.463	S	S	*	.	H	α-helix	trans	-64.9	-33.9	176.9	-80.4	-163.9	169.6	-165.5	0	113.7	H1077 S1081 E1082	H1077-K1079 PolarHBondContact O-N 2.89Å; H1077-K1079 VanDerWaalsContact O-N 3.15Å; K1079-S1081 PolarHBondContact O-N 3.48Å; K1079-E1082 PolarHBondContact O-N 3.26Å
1080	R	54.7	Low	62.7	Low	162 Å²	162	94.6 Å²	94.6	61%	0.611	48%	0.477	S	S	*	.	H	α-helix	trans	-72.7	-18.4	-177.5	-149.6	176	-173	177.7	-1.7	112.2	H1077 K1078 A1084	H1077-R1080 HydrophobicContact CB-CB 4.38Å; H1077-R1080 PolarHBondContact NE2-NH1 2.87Å; H1077-R1080 VanDerWaalsContact NE2-NH1 3.17Å; H1077-R1080 WeakPolarHBondContact O-CA 3.31Å; H1077-R1080 WeakPolarHBondContact O-CB 3.35Å; H1077-R1080 PolarHBondContact O-N 2.96Å; K1078-R1080 VanDerWaalsContact C-N 3.32Å; K1078-R1080 PolarHBondContact O-N 3.09Å; R1080-A1084 VanDerWaalsContact O-CB 3.31Å; R1080-A1084 WeakPolarHBondContact O-CB 3.36Å; R1080-A1084 PolarHBondContact O-N 2.9Å
1081	S	59.8	Low	63.5	Low	33 Å²	33	95.1 Å²	95.1	23%	0.231	48%	0.479	C	S	.	.	H	α-helix	trans	-72.8	-42	176.1	-170.8	0	0	0	0	112.8	H1077 K1078 K1079 A1084 L1085	H1077-S1081 PolarHBondContact O-N 2.89Å; K1078-S1081 WeakPolarHBondContact O-CB 3.49Å; K1078-S1081 PolarHBondContact O-N 2.9Å; K1079-S1081 PolarHBondContact O-N 3.48Å; S1081-A1084 PolarHBondContact O-N 2.86Å; S1081-L1085 WeakPolarHBondContact O-CG 3.24Å; S1081-L1085 PolarHBondContact O-N 2.77Å
1082	E	65.6	Low	64.9	Low	93 Å²	93	87.8 Å²	87.8	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-69.2	-43.9	178.6	-66.2	-161.3	102.7	0	0	111.5	R1008 K1079 A1084 L1085 D1086	R1008-E1082 IonicContact NH1-OE1 2.73Å; R1008-E1082 PolarHBondContact NH1-OE1 2.86Å; K1079-E1082 PolarHBondContact O-N 3.26Å; E1082-A1084 PolarHBondContact O-N 2.99Å; E1082-L1085 PolarHBondContact O-N 2.68Å; E1082-L1085 VanDerWaalsContact O-N 3.13Å; E1082-D1086 PolarHBondContact O-N 3.44Å
1083	E	67.4	Low	66.3	Low	128 Å²	128	80.5 Å²	80.5	60%	0.598	41%	0.411	S	S	*	.	H	α-helix	trans	-58.7	-34.6	174.8	-64.9	170.3	179.1	0	0	112.2	T1087	E1083-T1087 PolarHBondContact O-N 3.44Å; E1083-T1087 VanDerWaalsContact O-N 3.12Å; E1083-T1087 PolarHBondContact O-OG1 2.86Å
1084	A	70.6	Confident	67.8	Low	42 Å²	42	78 Å²	78	35%	0.347	40%	0.403	S	S	.	.	H	α-helix	trans	-72.7	-41.4	174.3	0	0	0	0	0	112.7	R1080 S1081 E1082 D1086 T1087 I1088	R1080-A1084 VanDerWaalsContact O-CB 3.31Å; R1080-A1084 WeakPolarHBondContact O-CB 3.36Å; R1080-A1084 PolarHBondContact O-N 2.9Å; S1081-A1084 PolarHBondContact O-N 2.86Å; E1082-A1084 PolarHBondContact O-N 2.99Å; A1084-D1086 VanDerWaalsContact C-N 3.31Å; A1084-D1086 PolarHBondContact O-N 3.06Å; A1084-T1087 WeakPolarHBondContact CA-OG1 3.41Å; A1084-T1087 PolarHBondContact O-N 3.23Å; A1084-T1087 PolarHBondContact O-OG1 2.98Å; A1084-I1088 WeakPolarHBondContact O-CB 3.47Å; A1084-I1088 VanDerWaalsContact O-CG1 3.27Å; A1084-I1088 WeakPolarHBondContact O-CG1 3.42Å; A1084-I1088 PolarHBondContact O-N 2.88Å
1085	L	76.8	Confident	69.7	Low	3 Å²	3	74.2 Å²	74.2	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-64.7	-35.5	175	-72.8	172.4	0	0	0	112	R1008 I1067 S1081 E1082 S1089	R1008-L1085 HydrophobicContact CG-CB 4.02Å; I1067-L1085 HydrophobicContact CB-CD2 4.43Å; I1067-L1085 HydrophobicContact CG2-CD2 3.73Å; S1081-L1085 WeakPolarHBondContact O-CG 3.24Å; S1081-L1085 PolarHBondContact O-N 2.77Å; E1082-L1085 PolarHBondContact O-N 2.68Å; E1082-L1085 VanDerWaalsContact O-N 3.13Å; L1085-S1089 VanDerWaalsContact O-CB 3.3Å; L1085-S1089 WeakPolarHBondContact O-CB 3.48Å; L1085-S1089 PolarHBondContact O-N 3.02Å
1086	D	76.9	Confident	71.5	Confident	55 Å²	55	69.5 Å²	69.5	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-69.1	-42.1	175	-72.7	-32.5	0	0	0	111.8	R1008 E1082 A1084 I1088 S1089 D1090	R1008-D1086 IonicContact CZ-OD1 2.66Å; R1008-D1086 VanDerWaalsContact CZ-OD1 3.27Å; R1008-D1086 IonicContact CZ-OD2 3.48Å; R1008-D1086 IonicContact NE-OD1 3.26Å; R1008-D1086 PolarHBondContact NE-OD1 2.88Å; R1008-D1086 IonicContact NE-OD2 3.18Å; R1008-D1086 VanDerWaalsContact NH2-CG 3.26Å; R1008-D1086 IonicContact NH2-OD1 2.93Å; R1008-D1086 PolarHBondContact NH2-OD1 3.13Å; R1008-D1086 IonicContact NH2-OD2 2.71Å; R1008-D1086 PolarHBondContact NH2-OD2 3.03Å; E1082-D1086 PolarHBondContact O-N 3.44Å; A1084-D1086 VanDerWaalsContact C-N 3.31Å; A1084-D1086 PolarHBondContact O-N 3.06Å; D1086-I1088 PolarHBondContact O-N 3.04Å; D1086-S1089 WeakPolarHBondContact O-CB 3.42Å; D1086-S1089 PolarHBondContact O-N 2.78Å; D1086-D1090 PolarHBondContact O-N 3.38Å
1087	T	79.1	Confident	73.1	Confident	84 Å²	84	66.4 Å²	66.4	52%	0.515	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-35.3	174	29.7	0	0	0	0	113.2	E1083 A1084 D1090 I1091	E1083-T1087 PolarHBondContact O-N 3.44Å; E1083-T1087 VanDerWaalsContact O-N 3.12Å; E1083-T1087 PolarHBondContact O-OG1 2.86Å; A1084-T1087 WeakPolarHBondContact CA-OG1 3.41Å; A1084-T1087 PolarHBondContact O-N 3.23Å; A1084-T1087 PolarHBondContact O-OG1 2.98Å; T1087-D1090 PolarHBondContact O-N 2.86Å; T1087-I1091 WeakPolarHBondContact O-CG1 3.26Å; T1087-I1091 PolarHBondContact O-N 2.81Å
1088	I	81.2	Confident	74.4	Confident	32 Å²	32	68.6 Å²	68.6	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-39.5	172.3	-68.4	166.7	0	0	0	111	V1046 I1067 A1084 D1086 I1091 F1092	V1046-I1088 HydrophobicContact CG2-CG2 4.19Å; I1067-I1088 HydrophobicContact CD1-CG2 4.43Å; I1067-I1088 HydrophobicContact CG2-CB 4.35Å; I1067-I1088 HydrophobicContact CG2-CG2 3.61Å; A1084-I1088 WeakPolarHBondContact O-CB 3.47Å; A1084-I1088 VanDerWaalsContact O-CG1 3.27Å; A1084-I1088 WeakPolarHBondContact O-CG1 3.42Å; A1084-I1088 PolarHBondContact O-N 2.88Å; D1086-I1088 PolarHBondContact O-N 3.04Å; I1088-I1091 PolarHBondContact O-N 3.34Å; I1088-F1092 HydrophobicContact CG2-CD2 3.81Å; I1088-F1092 HydrophobicContact CG2-CE2 3.44Å; I1088-F1092 VanDerWaalsContact CG2-CE2 3.44Å; I1088-F1092 WeakPolarHBondContact O-CD2 3.34Å; I1088-F1092 PolarHBondContact O-N 3.3Å; I1088-F1092 VanDerWaalsContact O-N 3.14Å
1089	S	82.5	Confident	75.7	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.007	34%	0.335	C	S	.	.	H	α-helix	trans	-56.9	-49.3	172	170.6	0	0	0	0	111.2	L1085 D1086 I1091 F1092 I1093 Q1118	L1085-S1089 VanDerWaalsContact O-CB 3.3Å; L1085-S1089 WeakPolarHBondContact O-CB 3.48Å; L1085-S1089 PolarHBondContact O-N 3.02Å; D1086-S1089 WeakPolarHBondContact O-CB 3.42Å; D1086-S1089 PolarHBondContact O-N 2.78Å; S1089-I1091 VanDerWaalsContact C-N 3.31Å; S1089-I1091 PolarHBondContact O-N 2.91Å; S1089-F1092 PolarHBondContact O-N 2.81Å; S1089-F1092 VanDerWaalsContact O-N 3.1Å; S1089-I1093 WeakPolarHBondContact O-CB 3.07Å; S1089-I1093 WeakPolarHBondContact O-CD1 3.47Å; S1089-I1093 WeakPolarHBondContact O-CG1 3.33Å; S1089-I1093 PolarHBondContact O-N 2.8Å; S1089-I1093 WeakPolarHBondContact OG-CD1 3.38Å; S1089-Q1118 PolarHBondContact OG-NE2 2.69Å
1090	D	80.9	Confident	77.1	Confident	88 Å²	88	60.1 Å²	60.1	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-63.6	-33.2	-179.1	-73.6	-13	0	0	0	113.3	D1086 T1087 T1094	D1086-D1090 PolarHBondContact O-N 3.38Å; T1087-D1090 PolarHBondContact O-N 2.86Å; D1090-T1094 WeakPolarHBondContact O-CB 3.37Å; D1090-T1094 PolarHBondContact O-N 2.75Å; D1090-T1094 PolarHBondContact O-OG1 3.02Å
1091	I	83.3	Confident	78.6	Confident	84 Å²	84	52.5 Å²	52.5	43%	0.431	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-48.1	171.1	-69.7	164.4	0	0	0	110.4	T1087 I1088 S1089 T1094 A1095	T1087-I1091 WeakPolarHBondContact O-CG1 3.26Å; T1087-I1091 PolarHBondContact O-N 2.81Å; I1088-I1091 PolarHBondContact O-N 3.34Å; S1089-I1091 VanDerWaalsContact C-N 3.31Å; S1089-I1091 PolarHBondContact O-N 2.91Å; I1091-T1094 PolarHBondContact O-N 3.35Å; I1091-A1095 PolarHBondContact O-N 3.15Å
1092	F	85.6	Confident	79.9	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	30%	0.303	C	S	.	.	H	α-helix	trans	-67.2	-40.8	178.3	-73.5	-56.7	0	0	0	113.2	L1010 L1040 S1044 V1046 L1051 L1065 I1067 I1088 S1089 T1094 A1095 L1096	L1010-F1092 HydrophobicContact CD1-CB 3.89Å; L1040-F1092 HydrophobicContact CB-CD1 4.44Å; L1040-F1092 HydrophobicContact CB-CE1 3.85Å; L1040-F1092 HydrophobicContact CD2-CD1 3.58Å; L1040-F1092 HydrophobicContact CD2-CE1 3.87Å; L1040-F1092 HydrophobicContact CG-CE1 4.45Å; S1044-F1092 WeakPolarHBondContact OG-CE1 3.43Å; S1044-F1092 WeakPolarHBondContact OG-CZ 3.33Å; V1046-F1092 HydrophobicContact CB-CZ 4.03Å; V1046-F1092 HydrophobicContact CG1-CZ 4.38Å; V1046-F1092 HydrophobicContact CG2-CE2 4.35Å; V1046-F1092 HydrophobicContact CG2-CZ 4.07Å; L1051-F1092 HydrophobicContact CD1-CE1 4.41Å; L1051-F1092 HydrophobicContact CD1-CZ 3.77Å; L1051-F1092 HydrophobicContact CD2-CE2 3.47Å; L1051-F1092 VanDerWaalsContact CD2-CE2 3.47Å; L1051-F1092 HydrophobicContact CD2-CZ 3.47Å; L1051-F1092 VanDerWaalsContact CD2-CZ 3.47Å; L1051-F1092 HydrophobicContact CG-CZ 4.27Å; L1065-F1092 HydrophobicContact CD2-CG 4.42Å; I1067-F1092 HydrophobicContact CD1-CD2 3.78Å; I1067-F1092 HydrophobicContact CD1-CE2 4.36Å; I1067-F1092 HydrophobicContact CG1-CD2 4.25Å; I1067-F1092 HydrophobicContact CG1-CE2 4.43Å; I1088-F1092 HydrophobicContact CG2-CD2 3.81Å; I1088-F1092 HydrophobicContact CG2-CE2 3.44Å; I1088-F1092 VanDerWaalsContact CG2-CE2 3.44Å; I1088-F1092 WeakPolarHBondContact O-CD2 3.34Å; I1088-F1092 PolarHBondContact O-N 3.3Å; I1088-F1092 VanDerWaalsContact O-N 3.14Å; S1089-F1092 PolarHBondContact O-N 2.81Å; S1089-F1092 VanDerWaalsContact O-N 3.1Å; F1092-T1094 VanDerWaalsContact C-N 3.26Å; F1092-T1094 PolarHBondContact O-N 3.15Å; F1092-A1095 PolarHBondContact O-N 2.88Å; F1092-L1096 VanDerWaalsContact O-CB 3.31Å; F1092-L1096 WeakPolarHBondContact O-CB 3.35Å; F1092-L1096 WeakPolarHBondContact O-CD1 3.32Å; F1092-L1096 VanDerWaalsContact O-CG 3.3Å; F1092-L1096 WeakPolarHBondContact O-CG 3.16Å; F1092-L1096 PolarHBondContact O-N 2.94Å
1093	I	81.8	Confident	81	Confident	28 Å²	28	52.7 Å²	52.7	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-55.5	-45.9	173.4	-69.4	164.1	0	0	0	109.9	L1010 S1089 N1097 M1115	L1010-I1093 HydrophobicContact CD1-CG1 4.4Å; L1010-I1093 HydrophobicContact CD2-CD1 4.38Å; L1010-I1093 HydrophobicContact CD2-CG1 4.25Å; S1089-I1093 WeakPolarHBondContact O-CB 3.07Å; S1089-I1093 WeakPolarHBondContact O-CD1 3.47Å; S1089-I1093 WeakPolarHBondContact O-CG1 3.33Å; S1089-I1093 PolarHBondContact O-N 2.8Å; S1089-I1093 WeakPolarHBondContact OG-CD1 3.38Å; I1093-N1097 WeakPolarHBondContact CG2-ND2 3.24Å; I1093-N1097 VanDerWaalsContact O-CB 3.25Å; I1093-N1097 WeakPolarHBondContact O-CB 3.43Å; I1093-N1097 PolarHBondContact O-N 2.91Å; I1093-N1097 PolarHBondContact O-ND2 3.47Å; I1093-N1097 VanDerWaalsContact O-ND2 3.11Å; I1093-M1115 HydrophobicContact CB-SD 4.37Å; I1093-M1115 HydrophobicContact CD1-CE 4.49Å; I1093-M1115 HydrophobicContact CG1-CE 4.15Å; I1093-M1115 HydrophobicContact CG1-SD 3.63Å; I1093-M1115 HydrophobicContact CG2-SD 4.43Å
1094	T	82.3	Confident	82	Confident	70 Å²	70	51.7 Å²	51.7	43%	0.429	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-47.1	178.4	-57.7	0	0	0	0	111.6	D1090 I1091 F1092 Q1098	D1090-T1094 WeakPolarHBondContact O-CB 3.37Å; D1090-T1094 PolarHBondContact O-N 2.75Å; D1090-T1094 PolarHBondContact O-OG1 3.02Å; I1091-T1094 PolarHBondContact O-N 3.35Å; F1092-T1094 VanDerWaalsContact C-N 3.26Å; F1092-T1094 PolarHBondContact O-N 3.15Å; T1094-Q1098 WeakPolarHBondContact O-CB 3.4Å; T1094-Q1098 VanDerWaalsContact O-CG 3.25Å; T1094-Q1098 WeakPolarHBondContact O-CG 3.46Å; T1094-Q1098 PolarHBondContact O-N 2.64Å; T1094-Q1098 VanDerWaalsContact O-N 3.07Å
1095	A	82.8	Confident	82.7	Confident	7 Å²	7	51.8 Å²	51.8	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-40.9	-179.1	0	0	0	0	0	113.7	V1043 I1091 F1092 G1099 L1100	V1043-A1095 HydrophobicContact CG1-CB 3.74Å; I1091-A1095 PolarHBondContact O-N 3.15Å; F1092-A1095 PolarHBondContact O-N 2.88Å; A1095-G1099 PolarHBondContact O-N 3.04Å; A1095-L1100 PolarHBondContact O-N 2.63Å; A1095-L1100 VanDerWaalsContact O-N 3.09Å
1096	L	85.6	Confident	82.9	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-43.7	177.8	-73.1	162.7	0	0	0	111.5	L1012 L1040 F1092 Q1098 G1099 V1101 V1113 M1115	L1012-L1096 HydrophobicContact CD2-CD1 3.52Å; L1012-L1096 HydrophobicContact CD2-CD2 4.07Å; L1012-L1096 HydrophobicContact CD2-CG 4.47Å; L1040-L1096 HydrophobicContact CD2-CD2 4.39Å; F1092-L1096 VanDerWaalsContact O-CB 3.31Å; F1092-L1096 WeakPolarHBondContact O-CB 3.35Å; F1092-L1096 WeakPolarHBondContact O-CD1 3.32Å; F1092-L1096 VanDerWaalsContact O-CG 3.3Å; F1092-L1096 WeakPolarHBondContact O-CG 3.16Å; F1092-L1096 PolarHBondContact O-N 2.94Å; L1096-Q1098 VanDerWaalsContact C-N 3.26Å; L1096-Q1098 PolarHBondContact O-N 2.92Å; L1096-G1099 PolarHBondContact O-N 3.47Å; L1096-V1101 HydrophobicContact CD2-CB 3.97Å; L1096-V1101 HydrophobicContact CD2-CG1 4.4Å; L1096-V1101 HydrophobicContact CD2-CG2 3.89Å; L1096-V1101 HydrophobicContact CG-CG2 4.31Å; L1096-V1113 HydrophobicContact CD2-CB 4.14Å; L1096-V1113 HydrophobicContact CD2-CG1 3.92Å; L1096-M1115 HydrophobicContact CB-CB 4.33Å; L1096-M1115 HydrophobicContact CD1-CB 4.37Å
1097	N	81.3	Confident	83	Confident	109 Å²	109	58.6 Å²	58.6	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-69.5	-23.7	177.9	-71.3	-26.9	0	0	0	113.2	I1093 G1099	I1093-N1097 WeakPolarHBondContact CG2-ND2 3.24Å; I1093-N1097 VanDerWaalsContact O-CB 3.25Å; I1093-N1097 WeakPolarHBondContact O-CB 3.43Å; I1093-N1097 PolarHBondContact O-N 2.91Å; I1093-N1097 PolarHBondContact O-ND2 3.47Å; I1093-N1097 VanDerWaalsContact O-ND2 3.11Å; N1097-G1099 VanDerWaalsContact C-N 3.3Å
1098	Q	81.1	Confident	83.1	Confident	128 Å²	128	61.9 Å²	61.9	60%	0.598	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-1.4	171.3	-70.8	176	10	0	0	113.3	T1094 L1096 L1100	T1094-Q1098 WeakPolarHBondContact O-CB 3.4Å; T1094-Q1098 VanDerWaalsContact O-CG 3.25Å; T1094-Q1098 WeakPolarHBondContact O-CG 3.46Å; T1094-Q1098 PolarHBondContact O-N 2.64Å; T1094-Q1098 VanDerWaalsContact O-N 3.07Å; L1096-Q1098 VanDerWaalsContact C-N 3.26Å; L1096-Q1098 PolarHBondContact O-N 2.92Å; Q1098-L1100 HydrophobicContact CB-CD1 4.28Å; Q1098-L1100 HydrophobicContact CB-CG 3.92Å; Q1098-L1100 PolarHBondContact O-N 2.89Å
1099	G	80	Confident	83.3	Confident	30 Å²	30	61.9 Å²	61.9	31%	0.309	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	16.8	179.6	0	0	0	0	0	114.4	A1095 L1096 N1097 V1101	A1095-G1099 PolarHBondContact O-N 3.04Å; L1096-G1099 PolarHBondContact O-N 3.47Å; N1097-G1099 VanDerWaalsContact C-N 3.3Å; G1099-V1101 VanDerWaalsContact C-N 3.27Å; G1099-V1101 PolarHBondContact O-N 2.85Å
1100	L	80.5	Confident	83.4	Confident	82 Å²	82	67.4 Å²	67.4	43%	0.429	36%	0.359	S	S	.	.			trans	-68.5	-28.5	-176.8	-60.9	179.1	0	0	0	112	V1043 A1095 Q1098 H1102	V1043-L1100 HydrophobicContact CG1-CB 3.88Å; V1043-L1100 HydrophobicContact CG1-CD1 4.15Å; A1095-L1100 PolarHBondContact O-N 2.63Å; A1095-L1100 VanDerWaalsContact O-N 3.09Å; Q1098-L1100 HydrophobicContact CB-CD1 4.28Å; Q1098-L1100 HydrophobicContact CB-CG 3.92Å; Q1098-L1100 PolarHBondContact O-N 2.89Å; L1100-H1102 PolarHBondContact O-N 2.58Å; L1100-H1102 PolarHBondContact O-ND1 2.79Å
1101	V	84.9	Confident	83.9	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.006	34%	0.337	C	S	.	.			trans	-84.3	97.8	179	-171	0	0	0	0	109.8	A1039 L1040 L1096 G1099 V1113	A1039-V1101 HydrophobicContact CB-CG1 4.06Å; L1040-V1101 HydrophobicContact CD2-CG1 4.23Å; L1040-V1101 HydrophobicContact CD2-CG2 3.87Å; L1040-V1101 HydrophobicContact CG-CG1 4.21Å; L1096-V1101 HydrophobicContact CD2-CB 3.97Å; L1096-V1101 HydrophobicContact CD2-CG1 4.4Å; L1096-V1101 HydrophobicContact CD2-CG2 3.89Å; L1096-V1101 HydrophobicContact CG-CG2 4.31Å; G1099-V1101 VanDerWaalsContact C-N 3.27Å; G1099-V1101 PolarHBondContact O-N 2.85Å; V1101-V1113 HydrophobicContact CB-CB 4.24Å; V1101-V1113 HydrophobicContact CG1-CB 3.92Å; V1101-V1113 HydrophobicContact CG1-CG2 3.93Å; V1101-V1113 PolarHBondContact O-N 3.36Å
1102	H	87.3	Confident	84	Confident	109 Å²	109	62 Å²	62	51%	0.505	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.5	178.8	64.4	-72.1	0	0	0	111	L1100 I1111 V1112	L1100-H1102 PolarHBondContact O-N 2.58Å; L1100-H1102 PolarHBondContact O-ND1 2.79Å; H1102-I1111 CarbonylContact C-O 3.51Å; H1102-I1111 WeakPolarHBondContact CA-O 3.42Å; H1102-I1111 WeakPolarHBondContact CB-O 3.46Å; H1102-V1112 HydrophobicContact CB-CG2 4.33Å
1103	F	89.2	Confident	84.2	Confident	21 Å²	21	62 Å²	62	9%	0.092	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	154	176.5	65.5	-88.5	0	0	0	111.7	F1014 I1032 V1035 V1036 L1105 I1111 V1113	F1014-F1103 HydrophobicContact CE1-CE1 4.4Å; I1032-F1103 HydrophobicContact CD1-CE2 4.11Å; I1032-F1103 HydrophobicContact CD1-CZ 4.3Å; I1032-F1103 HydrophobicContact CG2-CZ 4.09Å; V1035-F1103 HydrophobicContact CG1-CB 3.76Å; V1035-F1103 HydrophobicContact CG1-CD1 4.07Å; V1035-F1103 HydrophobicContact CG1-CD2 3.82Å; V1035-F1103 HydrophobicContact CG1-CE2 4.41Å; V1035-F1103 HydrophobicContact CG1-CG 3.63Å; V1036-F1103 HydrophobicContact CG2-CD1 4.48Å; V1036-F1103 HydrophobicContact CG2-CE1 3.93Å; F1103-L1105 HydrophobicContact CE2-CB 4.3Å; F1103-L1105 HydrophobicContact CE2-CD1 4.26Å; F1103-I1111 HydrophobicContact CD1-CB 4.19Å; F1103-I1111 HydrophobicContact CD1-CG2 4.4Å; F1103-I1111 HydrophobicContact CD2-CB 4.32Å; F1103-I1111 HydrophobicContact CD2-CG1 4.47Å; F1103-I1111 HydrophobicContact CE1-CB 3.81Å; F1103-I1111 HydrophobicContact CE1-CG2 3.65Å; F1103-I1111 HydrophobicContact CE2-CB 3.96Å; F1103-I1111 HydrophobicContact CE2-CG1 3.9Å; F1103-I1111 HydrophobicContact CE2-CG2 4.43Å; F1103-I1111 HydrophobicContact CG-CB 4.43Å; F1103-I1111 HydrophobicContact CZ-CB 3.69Å; F1103-I1111 HydrophobicContact CZ-CG1 3.96Å; F1103-I1111 HydrophobicContact CZ-CG2 3.67Å; F1103-I1111 PolarHBondContact N-O 3.19Å; F1103-I1111 PolarHBondContact O-N 3.44Å; F1103-V1113 HydrophobicContact CD1-CG2 4.37Å; F1103-V1113 HydrophobicContact CE1-CG2 4.18Å
1104	E	88.3	Confident	84.3	Confident	108 Å²	108	62.7 Å²	62.7	51%	0.505	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.5	172.1	-173.7	168	-137	0	0	110.1	K1106 A1107 N1108 H1110	E1104-K1106 WeakPolarHBondContact CG-O 3.46Å; E1104-A1107 VanDerWaalsContact OE1-CA 3.32Å; E1104-A1107 WeakPolarHBondContact OE1-CA 3.41Å; E1104-N1108 PolarHBondContact OE1-N 2.91Å; E1104-H1110 IonicContact OE1-CE1 3.42Å; E1104-H1110 PolarHBondContact OE1-CE1 2.93Å; E1104-H1110 VanDerWaalsContact OE1-CE1 3.28Å; E1104-H1110 IonicContact OE1-ND1 3.65Å
1105	L	85.4	Confident	84.3	Confident	43 Å²	43	61 Å²	61	23%	0.225	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-37.9	-180	-179.4	68.2	0	0	0	111.9	L1018 H1021 I1032 F1103 V1109 I1111	L1018-L1105 HydrophobicContact CD1-CD2 3.94Å; H1021-L1105 HydrophobicContact CB-CD2 3.63Å; I1032-L1105 HydrophobicContact CD1-CD1 3.71Å; F1103-L1105 HydrophobicContact CE2-CB 4.3Å; F1103-L1105 HydrophobicContact CE2-CD1 4.26Å; L1105-V1109 HydrophobicContact CB-CG1 4.24Å; L1105-V1109 HydrophobicContact CD2-CG1 4.37Å; L1105-V1109 PolarHBondContact N-O 2.93Å; L1105-I1111 HydrophobicContact CB-CG1 3.99Å; L1105-I1111 HydrophobicContact CD2-CD1 4.49Å; L1105-I1111 HydrophobicContact CD2-CG1 4.47Å
1106	K	81.2	Confident	83.7	Confident	121 Å²	121	64.4 Å²	64.4	53%	0.526	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	161.1	175.6	-65	-179.7	-172.7	165.7	0	107.2	H1021 E1104 N1108 V1109	H1021-K1106 PolarHBondContact CD2-NZ 3.09Å; H1021-K1106 VanDerWaalsContact CD2-NZ 3.31Å; H1021-K1106 PolarHBondContact NE2-NZ 2.76Å; E1104-K1106 WeakPolarHBondContact CG-O 3.46Å; K1106-N1108 PolarHBondContact O-N 2.82Å; K1106-V1109 HydrophobicContact CB-CB 4.36Å; K1106-V1109 HydrophobicContact CB-CG2 4.27Å; K1106-V1109 WeakPolarHBondContact O-CA 3.38Å; K1106-V1109 WeakPolarHBondContact O-CB 3.21Å; K1106-V1109 PolarHBondContact O-N 3.41Å
1107	A	79.9	Confident	82.6	Confident	80 Å²	80	70.7 Å²	70.7	66%	0.661	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	122.2	176.6	0	0	0	0	0	112.5	E1104 V1109	E1104-A1107 VanDerWaalsContact OE1-CA 3.32Å; E1104-A1107 WeakPolarHBondContact OE1-CA 3.41Å; A1107-V1109 VanDerWaalsContact C-N 3.31Å; A1107-V1109 PolarHBondContact O-N 2.99Å
1108	N	79.9	Confident	81.2	Confident	154 Å²	154	70.6 Å²	70.6	82%	0.824	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	11.5	-174.9	-47.8	-51.9	0	0	0	116.2	E1104 K1106	E1104-N1108 PolarHBondContact OE1-N 2.91Å; K1106-N1108 PolarHBondContact O-N 2.82Å
1109	V	85.1	Confident	79.7	Confident	32 Å²	32	65.4 Å²	65.4	19%	0.194	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	87.6	175.6	-174.9	0	0	0	0	109.1	A1017 L1105 K1106 A1107 I1111	A1017-V1109 HydrophobicContact CB-CG1 4.45Å; L1105-V1109 HydrophobicContact CB-CG1 4.24Å; L1105-V1109 HydrophobicContact CD2-CG1 4.37Å; L1105-V1109 PolarHBondContact N-O 2.93Å; K1106-V1109 HydrophobicContact CB-CB 4.36Å; K1106-V1109 HydrophobicContact CB-CG2 4.27Å; K1106-V1109 WeakPolarHBondContact O-CA 3.38Å; K1106-V1109 WeakPolarHBondContact O-CB 3.21Å; K1106-V1109 PolarHBondContact O-N 3.41Å; A1107-V1109 VanDerWaalsContact C-N 3.31Å; A1107-V1109 PolarHBondContact O-N 2.99Å; V1109-I1111 HydrophobicContact CG1-CD1 4.09Å
1110	H	85.6	Confident	78.1	Confident	116 Å²	116	70.7 Å²	70.7	54%	0.537	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.9	176.4	-63.8	3.5	0	0	0	110.5	E1104	E1104-H1110 IonicContact OE1-CE1 3.42Å; E1104-H1110 PolarHBondContact OE1-CE1 2.93Å; E1104-H1110 VanDerWaalsContact OE1-CE1 3.28Å; E1104-H1110 IonicContact OE1-ND1 3.65Å
1111	I	90.1	Very high	76.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	127	176.5	-54.4	-54.7	0	0	0	108.7	F1014 S1015 A1017 L1018 H1102 F1103 L1105 V1109	F1014-I1111 HydrophobicContact CB-CG2 4.24Å; F1014-I1111 HydrophobicContact CD1-CG2 3.93Å; S1015-I1111 WeakPolarHBondContact OG-CA 3.5Å; A1017-I1111 HydrophobicContact CB-CD1 4.01Å; L1018-I1111 HydrophobicContact CB-CD1 3.91Å; L1018-I1111 HydrophobicContact CB-CG1 4.49Å; L1018-I1111 HydrophobicContact CB-CG2 4.28Å; L1018-I1111 HydrophobicContact CG-CD1 4.09Å; L1018-I1111 HydrophobicContact CG-CG1 4.15Å; L1018-I1111 HydrophobicContact CG-CG2 3.99Å; H1102-I1111 CarbonylContact C-O 3.51Å; H1102-I1111 WeakPolarHBondContact CA-O 3.42Å; H1102-I1111 WeakPolarHBondContact CB-O 3.46Å; F1103-I1111 HydrophobicContact CD1-CB 4.19Å; F1103-I1111 HydrophobicContact CD1-CG2 4.4Å; F1103-I1111 HydrophobicContact CD2-CB 4.32Å; F1103-I1111 HydrophobicContact CD2-CG1 4.47Å; F1103-I1111 HydrophobicContact CE1-CB 3.81Å; F1103-I1111 HydrophobicContact CE1-CG2 3.65Å; F1103-I1111 HydrophobicContact CE2-CB 3.96Å; F1103-I1111 HydrophobicContact CE2-CG1 3.9Å; F1103-I1111 HydrophobicContact CE2-CG2 4.43Å; F1103-I1111 HydrophobicContact CG-CB 4.43Å; F1103-I1111 HydrophobicContact CZ-CB 3.69Å; F1103-I1111 HydrophobicContact CZ-CG1 3.96Å; F1103-I1111 HydrophobicContact CZ-CG2 3.67Å; F1103-I1111 PolarHBondContact N-O 3.19Å; F1103-I1111 PolarHBondContact O-N 3.44Å; L1105-I1111 HydrophobicContact CB-CG1 3.99Å; L1105-I1111 HydrophobicContact CD2-CD1 4.49Å; L1105-I1111 HydrophobicContact CD2-CG1 4.47Å; V1109-I1111 HydrophobicContact CG1-CD1 4.09Å
1112	V	87.1	Confident	74.1	Confident	60 Å²	60	70.5 Å²	70.5	36%	0.364	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.1	171.9	-176.8	0	0	0	0	108.9	S1015 H1102	S1015-V1112 PolarHBondContact N-O 2.85Å; S1015-V1112 PolarHBondContact OG-N 3.29Å; H1102-V1112 HydrophobicContact CB-CG2 4.33Å
1113	V	89	Confident	72.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.8	175.9	-166.1	0	0	0	0	108.8	L1012 F1014 V1036 L1096 V1101 F1103	L1012-V1113 HydrophobicContact CB-CG1 4.13Å; L1012-V1113 HydrophobicContact CD1-CG1 4Å; L1012-V1113 HydrophobicContact CD2-CG1 4.43Å; L1012-V1113 HydrophobicContact CG-CG1 4.43Å; F1014-V1113 HydrophobicContact CD1-CB 4.48Å; F1014-V1113 HydrophobicContact CD1-CG1 4.29Å; F1014-V1113 HydrophobicContact CD1-CG2 3.91Å; F1014-V1113 HydrophobicContact CE1-CB 4.44Å; F1014-V1113 HydrophobicContact CE1-CG1 3.97Å; F1014-V1113 HydrophobicContact CE1-CG2 3.77Å; V1036-V1113 HydrophobicContact CG1-CG1 4.39Å; V1036-V1113 HydrophobicContact CG1-CG2 4.48Å; V1036-V1113 HydrophobicContact CG2-CG2 4.26Å; L1096-V1113 HydrophobicContact CD2-CB 4.14Å; L1096-V1113 HydrophobicContact CD2-CG1 3.92Å; V1101-V1113 HydrophobicContact CB-CB 4.24Å; V1101-V1113 HydrophobicContact CG1-CB 3.92Å; V1101-V1113 HydrophobicContact CG1-CG2 3.93Å; V1101-V1113 PolarHBondContact O-N 3.36Å; F1103-V1113 HydrophobicContact CD1-CG2 4.37Å; F1103-V1113 HydrophobicContact CE1-CG2 4.18Å
1114	S	84	Confident	69.9	Low	43 Å²	43	71.6 Å²	71.6	30%	0.301	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	157.6	-177.8	54.2	0	0	0	0	111.3	L1012 S1013	L1012-S1114 CarbonylContact C-O 3.59Å; L1012-S1114 WeakPolarHBondContact CA-O 3.34Å; S1013-S1114 PolarHBondContact N-O 3Å; S1013-S1114 PolarHBondContact O-N 2.88Å; S1013-S1114 PolarHBondContact O-OG 3.04Å; S1013-S1114 PolarHBondContact OG-O 2.83Å; S1013-S1114 PolarHBondContact OG-OG 3.16Å
1115	M	82.8	Confident	67	Low	34 Å²	34	72.4 Å²	72.4	17%	0.167	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.9	177.1	-176.1	176	168.6	0	0	111.6	L1010 I1093 L1096 Q1117 Q1118	L1010-M1115 HydrophobicContact CD2-CE 3.66Å; L1010-M1115 HydrophobicContact CD2-SD 4.17Å; I1093-M1115 HydrophobicContact CB-SD 4.37Å; I1093-M1115 HydrophobicContact CD1-CE 4.49Å; I1093-M1115 HydrophobicContact CG1-CE 4.15Å; I1093-M1115 HydrophobicContact CG1-SD 3.63Å; I1093-M1115 HydrophobicContact CG2-SD 4.43Å; L1096-M1115 HydrophobicContact CB-CB 4.33Å; L1096-M1115 HydrophobicContact CD1-CB 4.37Å; M1115-Q1117 VanDerWaalsContact CE-C 3.41Å; M1115-Q1117 WeakPolarHBondContact CE-O 3.46Å; M1115-Q1118 HydrophobicContact CE-CB 3.57Å; M1115-Q1118 HydrophobicContact CE-CG 4.03Å; M1115-Q1118 VanDerWaalsContact CE-N 3.34Å
1116	T	69.3	Low	64.4	Low	78 Å²	78	75 Å²	75	48%	0.479	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-47.3	175.8	55.9	0	0	0	0	113	L1011 S1013	L1011-T1116 WeakPolarHBondContact CB-OG1 3.48Å; L1011-T1116 WeakPolarHBondContact CD2-OG1 3.07Å; L1011-T1116 WeakPolarHBondContact CG-OG1 3.38Å; L1011-T1116 PolarHBondContact O-N 3.4Å; L1011-T1116 PolarHBondContact O-OG1 2.93Å; S1013-T1116 VanDerWaalsContact OG-CG2 3.29Å; S1013-T1116 WeakPolarHBondContact OG-CG2 3.21Å
1117	Q	63.3	Low	61.8	Low	135 Å²	135	75.3 Å²	75.3	63%	0.631	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.2	151.6	-179.7	-158.4	165.8	1.7	0	0	111.8	L1011 M1115	L1011-Q1117 PolarHBondContact N-O 3.32Å; L1011-Q1117 VanDerWaalsContact N-O 3.12Å; M1115-Q1117 VanDerWaalsContact CE-C 3.41Å; M1115-Q1117 WeakPolarHBondContact CE-O 3.46Å
1118	Q	51.5	Low	59.4	Low	107 Å²	107	75.9 Å²	75.9	50%	0.5	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126	174.9	-154.9	174.8	13.9	0	0	108.6	L1010 S1089 M1115	L1010-Q1118 HydrophobicContact CD2-CG 3.81Å; S1089-Q1118 PolarHBondContact OG-NE2 2.69Å; M1115-Q1118 HydrophobicContact CE-CB 3.57Å; M1115-Q1118 HydrophobicContact CE-CG 4.03Å; M1115-Q1118 VanDerWaalsContact CE-N 3.34Å
1119	T	49.8	Very low	57.2	Low	19 Å²	19	76 Å²	76	12%	0.117	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	145	-175.6	54.3	0	0	0	0	111.3	S1009 E1064 L1123	S1009-T1119 WeakPolarHBondContact CB-OG1 3.43Å; S1009-T1119 PolarHBondContact O-N 2.96Å; S1009-T1119 VanDerWaalsContact O-N 3.13Å; S1009-T1119 VanDerWaalsContact O-O 3.12Å; S1009-T1119 PolarHBondContact O-OG1 2.92Å; S1009-T1119 PolarHBondContact OG-O 3.18Å; S1009-T1119 PolarHBondContact OG-OG1 2.73Å; E1064-T1119 PolarHBondContact OE1-OG1 2.88Å; T1119-L1123 HydrophobicContact CG2-CD1 4.26Å
1120	L	45.4	Very low	54.6	Low	141 Å²	141	81.7 Å²	81.7	74%	0.738	45%	0.45	S	S	*	.	S	Bend	trans	-106.3	9.8	176.3	-73.1	167.9	0	0	0	112.6
1121	A	39.9	Very low	52.3	Low	44 Å²	44	80.1 Å²	80.1	36%	0.364	45%	0.452	S	S	.	.	S	Bend	trans	-162.6	147.6	175.1	0	0	0	0	0	109.6
1122	P	41.4	Very low	50.2	Low	36 Å²	36	82.2 Å²	82.2	23%	0.234	47%	0.474	C	S	.	.			trans	-70	135	178.4	28.2	-33.9	0	0	0	111.4	F1007 E1064 F1066 V1124	F1007-P1122 HydrophobicContact CZ-CG 4.43Å; E1064-P1122 WeakPolarHBondContact OE2-CA 3.43Å; F1066-P1122 HydrophobicContact CE1-CB 4.08Å; F1066-P1122 HydrophobicContact CZ-CB 4.39Å; P1122-V1124 VanDerWaalsContact C-N 3.3Å; P1122-V1124 PolarHBondContact O-N 2.84Å
1123	L	46.5	Very low	48.7	Very low	101 Å²	101	83.4 Å²	83.4	53%	0.529	48%	0.483	S	S	.	.			trans	-82.4	66.8	-178.6	-85.4	162.2	0	0	0	112.4	T1119 D1125	T1119-L1123 HydrophobicContact CG2-CD1 4.26Å; L1123-D1125 PolarHBondContact O-N 2.87Å
1124	V	43	Very low	46.6	Very low	52 Å²	52	85.8 Å²	85.8	32%	0.315	50%	0.502	S	S	.	.			trans	-93.6	49.6	169.4	-165	0	0	0	0	111.3	P929 P1122	P929-V1124 HydrophobicContact CB-CG2 4.28Å; P1122-V1124 VanDerWaalsContact C-N 3.3Å; P1122-V1124 PolarHBondContact O-N 2.84Å
1125	D	27.1	Very low	44.6	Very low	125 Å²	125	89.8 Å²	89.8	67%	0.668	52%	0.518	S	S	*	.			trans	-110.8	71	156.2	-99.2	-38.3	0	0	0	107.6	L1123 N1127	L1123-D1125 PolarHBondContact O-N 2.87Å; D1125-N1127 PolarHBondContact O-N 3.31Å
1126	S	30.4	Very low	43.2	Very low	98 Å²	98	93.8 Å²	93.8	69%	0.685	54%	0.539	S	S	*	.			trans	-72.8	52.5	167.9	63.2	0	0	0	0	110.9	S1128	S1126-S1128 PolarHBondContact O-N 3Å
1127	N	27.3	Very low	42.6	Very low	126 Å²	126	95.9 Å²	95.9	67%	0.674	55%	0.545	S	S	*	.			trans	-52.8	119.5	158.2	-85.6	-60.5	0	0	0	106.7	D1125 I1129	D1125-N1127 PolarHBondContact O-N 3.31Å; N1127-I1129 PolarHBondContact O-N 3.13Å
1128	S	29.3	Very low	42	Very low	93 Å²	93	95.2 Å²	95.2	65%	0.65	55%	0.545	S	S	*	.			trans	-50.1	118.2	-179.2	55.9	0	0	0	0	109.7	S1126 H1130	S1126-S1128 PolarHBondContact O-N 3Å; S1128-H1130 PolarHBondContact O-N 3.45Å
1129	I	33.3	Very low	42.6	Very low	156 Å²	156	93.8 Å²	93.8	80%	0.8	54%	0.54	S	S	*	.			trans	-50.3	114	174.8	-65.6	176.4	0	0	0	106.7	N1127 S1131	N1127-I1129 PolarHBondContact O-N 3.13Å; I1129-S1131 PolarHBondContact O-N 2.9Å
1130	H	31.1	Very low	43.4	Very low	151 Å²	151	95 Å²	95	70%	0.699	55%	0.549	S	S	*	.			trans	-59.6	119.9	-164.8	-88.1	-59.8	0	0	0	110.1	S1128 G1132	S1128-H1130 PolarHBondContact O-N 3.45Å; H1130-G1132 PolarHBondContact O-N 3.2Å; H1130-G1132 VanDerWaalsContact O-N 3.09Å
1131	S	36.5	Very low	44.6	Very low	84 Å²	84	92.6 Å²	92.6	59%	0.587	54%	0.54	S	S	*	.			trans	-44.9	119	176.1	-169.6	0	0	0	0	109.8	I1129 P1133 A1134	I1129-S1131 PolarHBondContact O-N 2.9Å; S1131-P1133 VanDerWaalsContact C-N 3.25Å; S1131-P1133 WeakPolarHBondContact O-CD 3.34Å; S1131-A1134 WeakPolarHBondContact O-CB 3.31Å; S1131-A1134 PolarHBondContact O-N 3.37Å
1132	G	46.3	Very low	46.1	Very low	43 Å²	43	94.4 Å²	94.4	44%	0.443	55%	0.547	S	S	.	.	H	α-helix	trans	-46.4	-35.6	-171.4	0	0	0	0	0	116.3	H1130 A1134 M1135 L1136	H1130-G1132 PolarHBondContact O-N 3.2Å; H1130-G1132 VanDerWaalsContact O-N 3.09Å; G1132-A1134 VanDerWaalsContact C-N 3.25Å; G1132-A1134 PolarHBondContact O-N 2.79Å; G1132-M1135 PolarHBondContact O-N 3.4Å; G1132-L1136 WeakPolarHBondContact O-CG 3.5Å; G1132-L1136 PolarHBondContact O-N 2.82Å; G1132-L1136 VanDerWaalsContact O-N 3.08Å
1133	P	55.5	Low	47.5	Very low	86 Å²	86	99.3 Å²	99.3	56%	0.558	56%	0.564	S	S	*	*	H	α-helix	trans	-57.7	-31	173.3	-27.2	36.7	0	0	0	114.6	S1131 M1137	S1131-P1133 VanDerWaalsContact C-N 3.25Å; S1131-P1133 WeakPolarHBondContact O-CD 3.34Å; P1133-M1137 VanDerWaalsContact O-CB 3.23Å; P1133-M1137 WeakPolarHBondContact O-CB 3.49Å; P1133-M1137 WeakPolarHBondContact O-CG 3.32Å; P1133-M1137 PolarHBondContact O-N 3.05Å
1134	A	44.8	Very low	48.8	Very low	49 Å²	49	100 Å²	100	41%	0.405	57%	0.568	S	S	.	*	H	α-helix	trans	-71.2	-42.2	-178.8	0	0	0	0	0	112.2	S1131 G1132 M1137 L1138	S1131-A1134 WeakPolarHBondContact O-CB 3.31Å; S1131-A1134 PolarHBondContact O-N 3.37Å; G1132-A1134 VanDerWaalsContact C-N 3.25Å; G1132-A1134 PolarHBondContact O-N 2.79Å; A1134-M1137 PolarHBondContact O-N 3.49Å; A1134-L1138 PolarHBondContact O-N 3.02Å
1135	M	43.3	Very low	50.2	Low	128 Å²	128	99.4 Å²	99.4	63%	0.631	57%	0.572	S	S	*	*	H	α-helix	trans	-69.7	-38.6	175	-162.3	178.3	-169.8	0	0	110.9	G1132 M1137 L1138 I1139	G1132-M1135 PolarHBondContact O-N 3.4Å; M1135-M1137 VanDerWaalsContact C-N 3.33Å; M1135-M1137 PolarHBondContact O-N 3.21Å; M1135-L1138 PolarHBondContact O-N 2.87Å; M1135-I1139 HydrophobicContact CG-CD1 4.07Å; M1135-I1139 WeakPolarHBondContact O-CB 3.41Å; M1135-I1139 WeakPolarHBondContact O-CD1 3.34Å; M1135-I1139 VanDerWaalsContact O-CG1 3.23Å; M1135-I1139 WeakPolarHBondContact O-CG1 3.07Å; M1135-I1139 PolarHBondContact O-N 3Å
1136	L	53.1	Low	52.3	Low	117 Å²	117	97.1 Å²	97.1	61%	0.613	56%	0.559	S	S	*	*	H	α-helix	trans	-64.9	-33.1	172.4	-73.9	169.4	0	0	0	113	G1132 S1140	G1132-L1136 WeakPolarHBondContact O-CG 3.5Å; G1132-L1136 PolarHBondContact O-N 2.82Å; G1132-L1136 VanDerWaalsContact O-N 3.08Å; L1136-S1140 VanDerWaalsContact O-CB 3.27Å; L1136-S1140 WeakPolarHBondContact O-CB 3.33Å; L1136-S1140 PolarHBondContact O-N 3.01Å; L1136-S1140 PolarHBondContact O-OG 3.23Å
1137	M	55.2	Low	53.8	Low	123 Å²	123	94.6 Å²	94.6	61%	0.606	54%	0.544	S	S	*	.	H	α-helix	trans	-71.8	-38.7	173.1	-78.3	-80.7	-79.1	0	0	112.4	P1133 A1134 M1135 S1140 V1141	P1133-M1137 VanDerWaalsContact O-CB 3.23Å; P1133-M1137 WeakPolarHBondContact O-CB 3.49Å; P1133-M1137 WeakPolarHBondContact O-CG 3.32Å; P1133-M1137 PolarHBondContact O-N 3.05Å; A1134-M1137 PolarHBondContact O-N 3.49Å; M1135-M1137 VanDerWaalsContact C-N 3.33Å; M1135-M1137 PolarHBondContact O-N 3.21Å; M1137-S1140 WeakPolarHBondContact CA-OG 3.22Å; M1137-S1140 PolarHBondContact O-N 3.31Å; M1137-S1140 PolarHBondContact O-OG 2.74Å; M1137-S1140 VanDerWaalsContact O-OG 3.09Å; M1137-V1141 WeakPolarHBondContact O-CB 3.33Å; M1137-V1141 VanDerWaalsContact O-CG2 3.25Å; M1137-V1141 WeakPolarHBondContact O-CG2 3.43Å; M1137-V1141 PolarHBondContact O-N 2.84Å
1138	L	52.4	Low	55.6	Low	121 Å²	121	91 Å²	91	63%	0.634	53%	0.532	S	S	*	.	H	α-helix	trans	-65.9	-42.9	171.9	-93	161.2	0	0	0	111.5	A1134 M1135 V1141 V1142	A1134-L1138 PolarHBondContact O-N 3.02Å; M1135-L1138 PolarHBondContact O-N 2.87Å; L1138-V1141 PolarHBondContact O-N 2.81Å; L1138-V1142 WeakPolarHBondContact O-CB 3.43Å; L1138-V1142 VanDerWaalsContact O-CG2 3.28Å; L1138-V1142 WeakPolarHBondContact O-CG2 3.48Å; L1138-V1142 PolarHBondContact O-N 2.84Å
1139	I	62.8	Low	57.3	Low	76 Å²	76	92.3 Å²	92.3	39%	0.39	53%	0.526	S	S	.	.	H	α-helix	trans	-63.3	-42	174.4	-70.4	165.8	0	0	0	110.6	M1135 V1142 F1143	M1135-I1139 HydrophobicContact CG-CD1 4.07Å; M1135-I1139 WeakPolarHBondContact O-CB 3.41Å; M1135-I1139 WeakPolarHBondContact O-CD1 3.34Å; M1135-I1139 VanDerWaalsContact O-CG1 3.23Å; M1135-I1139 WeakPolarHBondContact O-CG1 3.07Å; M1135-I1139 PolarHBondContact O-N 3Å; I1139-V1142 PolarHBondContact O-N 3.42Å; I1139-F1143 HydrophobicContact CG2-CD2 3.72Å; I1139-F1143 HydrophobicContact CG2-CE2 3.86Å; I1139-F1143 WeakPolarHBondContact O-CD2 3.08Å; I1139-F1143 PolarHBondContact O-N 2.89Å
1140	S	66.9	Low	58.6	Low	45 Å²	45	90.5 Å²	90.5	32%	0.315	51%	0.513	S	S	.	.	H	α-helix	trans	-69.4	-38.4	177.8	76.2	0	0	0	0	112.4	L1136 M1137 V1142 F1143 I1144	L1136-S1140 VanDerWaalsContact O-CB 3.27Å; L1136-S1140 WeakPolarHBondContact O-CB 3.33Å; L1136-S1140 PolarHBondContact O-N 3.01Å; L1136-S1140 PolarHBondContact O-OG 3.23Å; M1137-S1140 WeakPolarHBondContact CA-OG 3.22Å; M1137-S1140 PolarHBondContact O-N 3.31Å; M1137-S1140 PolarHBondContact O-OG 2.74Å; M1137-S1140 VanDerWaalsContact O-OG 3.09Å; S1140-V1142 VanDerWaalsContact C-N 3.34Å; S1140-F1143 PolarHBondContact O-N 2.97Å; S1140-I1144 WeakPolarHBondContact O-CB 3.42Å; S1140-I1144 WeakPolarHBondContact O-CD1 3.38Å; S1140-I1144 WeakPolarHBondContact O-CG1 3.43Å; S1140-I1144 PolarHBondContact O-N 2.97Å
1141	V	69.7	Low	59.9	Low	90 Å²	90	88.8 Å²	88.8	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-37	172	168.5	0	0	0	0	111.4	M1137 L1138 I1144 G1145	M1137-V1141 WeakPolarHBondContact O-CB 3.33Å; M1137-V1141 VanDerWaalsContact O-CG2 3.25Å; M1137-V1141 WeakPolarHBondContact O-CG2 3.43Å; M1137-V1141 PolarHBondContact O-N 2.84Å; L1138-V1141 PolarHBondContact O-N 2.81Å; V1141-I1144 PolarHBondContact O-N 2.87Å; V1141-G1145 PolarHBondContact O-N 3.17Å
1142	V	73.1	Confident	60.8	Low	82 Å²	82	92.6 Å²	92.6	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-66.5	-43.7	171.9	166.8	0	0	0	0	111.2	L1138 I1139 S1140 G1145 I1146	L1138-V1142 WeakPolarHBondContact O-CB 3.43Å; L1138-V1142 VanDerWaalsContact O-CG2 3.28Å; L1138-V1142 WeakPolarHBondContact O-CG2 3.48Å; L1138-V1142 PolarHBondContact O-N 2.84Å; I1139-V1142 PolarHBondContact O-N 3.42Å; S1140-V1142 VanDerWaalsContact C-N 3.34Å; V1142-G1145 PolarHBondContact O-N 2.95Å; V1142-I1146 HydrophobicContact CG1-CD1 3.66Å; V1142-I1146 HydrophobicContact CG1-CG1 4.4Å; V1142-I1146 WeakPolarHBondContact O-CB 3.37Å; V1142-I1146 VanDerWaalsContact O-CG1 3.22Å; V1142-I1146 WeakPolarHBondContact O-CG1 3.38Å; V1142-I1146 PolarHBondContact O-N 2.64Å
1143	F	70.1	Confident	60.8	Low	139 Å²	139	97.2 Å²	97.2	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-65.1	-37.3	174.5	-92.1	-74.3	0	0	0	112.8	I1139 S1140 I1146 A1147	I1139-F1143 HydrophobicContact CG2-CD2 3.72Å; I1139-F1143 HydrophobicContact CG2-CE2 3.86Å; I1139-F1143 WeakPolarHBondContact O-CD2 3.08Å; I1139-F1143 PolarHBondContact O-N 2.89Å; S1140-F1143 PolarHBondContact O-N 2.97Å; F1143-I1146 PolarHBondContact O-N 3.34Å; F1143-A1147 WeakPolarHBondContact O-CB 3.3Å; F1143-A1147 PolarHBondContact O-N 3.22Å
1144	I	74.7	Confident	60.4	Low	116 Å²	116	101.7 Å²	101.7	60%	0.595	53%	0.529	S	S	*	.	H	α-helix	trans	-68.5	-40.2	174.1	-70.8	163.2	0	0	0	110.4	S1140 V1141 A1147 A1148	S1140-I1144 WeakPolarHBondContact O-CB 3.42Å; S1140-I1144 WeakPolarHBondContact O-CD1 3.38Å; S1140-I1144 WeakPolarHBondContact O-CG1 3.43Å; S1140-I1144 PolarHBondContact O-N 2.97Å; V1141-I1144 PolarHBondContact O-N 2.87Å; I1144-A1147 PolarHBondContact O-N 2.89Å; I1144-A1148 WeakPolarHBondContact O-CB 3.3Å; I1144-A1148 PolarHBondContact O-N 3.25Å
1145	G	70.6	Confident	60.2	Low	40 Å²	40	108 Å²	108	41%	0.412	55%	0.547	S	S	.	.	H	α-helix	trans	-64.6	-41.6	174	0	0	0	0	0	112.6	V1141 V1142 A1148 F1149	V1141-G1145 PolarHBondContact O-N 3.17Å; V1142-G1145 PolarHBondContact O-N 2.95Å; G1145-A1148 PolarHBondContact O-N 2.98Å; G1145-F1149 VanDerWaalsContact O-CB 3.28Å; G1145-F1149 WeakPolarHBondContact O-CB 3.21Å; G1145-F1149 PolarHBondContact O-N 3.11Å
1146	I	71.8	Confident	60.2	Low	76 Å²	76	112 Å²	112	39%	0.39	56%	0.555	S	S	.	*	H	α-helix	trans	-66.9	-43.2	174.1	-71.8	168.1	0	0	0	110.7	V1142 F1143 F1149 F1150	V1142-I1146 HydrophobicContact CG1-CD1 3.66Å; V1142-I1146 HydrophobicContact CG1-CG1 4.4Å; V1142-I1146 WeakPolarHBondContact O-CB 3.37Å; V1142-I1146 VanDerWaalsContact O-CG1 3.22Å; V1142-I1146 WeakPolarHBondContact O-CG1 3.38Å; V1142-I1146 PolarHBondContact O-N 2.64Å; F1143-I1146 PolarHBondContact O-N 3.34Å; I1146-F1149 WeakPolarHBondContact O-CB 3.35Å; I1146-F1149 PolarHBondContact O-N 3.1Å; I1146-F1150 HydrophobicContact CG2-CD2 3.66Å; I1146-F1150 HydrophobicContact CG2-CE2 3.58Å; I1146-F1150 VanDerWaalsContact O-CD2 3.23Å; I1146-F1150 WeakPolarHBondContact O-CD2 3.43Å; I1146-F1150 PolarHBondContact O-N 3.37Å
1147	A	62.7	Low	59.2	Low	46 Å²	46	115.8 Å²	115.8	38%	0.38	57%	0.567	S	S	.	*	H	α-helix	trans	-63.3	-44.1	175	0	0	0	0	0	111.6	F1143 I1144 F1149 F1150 I1151	F1143-A1147 WeakPolarHBondContact O-CB 3.3Å; F1143-A1147 PolarHBondContact O-N 3.22Å; I1144-A1147 PolarHBondContact O-N 2.89Å; A1147-F1149 VanDerWaalsContact C-N 3.33Å; A1147-F1149 PolarHBondContact O-N 3.4Å; A1147-F1150 PolarHBondContact O-N 3.14Å; A1147-I1151 WeakPolarHBondContact O-CB 3.44Å; A1147-I1151 WeakPolarHBondContact O-CD1 3.45Å; A1147-I1151 WeakPolarHBondContact O-CG1 3.44Å; A1147-I1151 PolarHBondContact O-N 2.62Å
1148	A	64.9	Low	58.4	Low	51 Å²	51	118.1 Å²	118.1	42%	0.421	58%	0.58	S	S	.	*	H	α-helix	trans	-61.8	-39.7	173.7	0	0	0	0	0	111.7	I1144 G1145 I1151 Y1152	I1144-A1148 WeakPolarHBondContact O-CB 3.3Å; I1144-A1148 PolarHBondContact O-N 3.25Å; G1145-A1148 PolarHBondContact O-N 2.98Å; A1148-I1151 PolarHBondContact O-N 3.3Å; A1148-Y1152 WeakPolarHBondContact O-CB 3.35Å; A1148-Y1152 PolarHBondContact O-N 3.34Å
1149	F	65.6	Low	57.7	Low	119 Å²	119	117.5 Å²	117.5	52%	0.522	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-42.5	174.1	-178.1	-102	0	0	0	112.2	G1145 I1146 A1147 Y1152 K1153	G1145-F1149 VanDerWaalsContact O-CB 3.28Å; G1145-F1149 WeakPolarHBondContact O-CB 3.21Å; G1145-F1149 PolarHBondContact O-N 3.11Å; I1146-F1149 WeakPolarHBondContact O-CB 3.35Å; I1146-F1149 PolarHBondContact O-N 3.1Å; A1147-F1149 VanDerWaalsContact C-N 3.33Å; A1147-F1149 PolarHBondContact O-N 3.4Å; F1149-Y1152 PolarHBondContact O-N 3.42Å; F1149-K1153 HydrophobicContact CE1-CD 4.1Å; F1149-K1153 HydrophobicContact CZ-CD 4.36Å; F1149-K1153 WeakPolarHBondContact O-CB 3.33Å; F1149-K1153 PolarHBondContact O-N 3.2Å
1150	F	59.6	Low	56.1	Low	119 Å²	119	124.1 Å²	124.1	52%	0.522	60%	0.604	S	S	.	*	H	α-helix	trans	-66.3	-42.9	174.3	-83.6	-66	0	0	0	112.4	I1146 A1147 K1153 F1154	I1146-F1150 HydrophobicContact CG2-CD2 3.66Å; I1146-F1150 HydrophobicContact CG2-CE2 3.58Å; I1146-F1150 VanDerWaalsContact O-CD2 3.23Å; I1146-F1150 WeakPolarHBondContact O-CD2 3.43Å; I1146-F1150 PolarHBondContact O-N 3.37Å; A1147-F1150 PolarHBondContact O-N 3.14Å; F1150-K1153 PolarHBondContact O-N 3.21Å; F1150-F1154 PolarHBondContact O-N 3.09Å
1151	I	58.6	Low	54.5	Low	115 Å²	115	128.6 Å²	128.6	59%	0.59	62%	0.623	S	S	*	*	H	α-helix	trans	-60.3	-46.7	174.5	-70.7	164.4	0	0	0	110.3	A1147 A1148 F1154 K1155	A1147-I1151 WeakPolarHBondContact O-CB 3.44Å; A1147-I1151 WeakPolarHBondContact O-CD1 3.45Å; A1147-I1151 WeakPolarHBondContact O-CG1 3.44Å; A1147-I1151 PolarHBondContact O-N 2.62Å; A1148-I1151 PolarHBondContact O-N 3.3Å; I1151-F1154 PolarHBondContact O-N 2.81Å; I1151-K1155 WeakPolarHBondContact O-CB 3.36Å; I1151-K1155 PolarHBondContact O-N 3Å; I1151-K1155 VanDerWaalsContact O-N 3.12Å
1152	Y	55.6	Low	52.4	Low	164 Å²	164	131.2 Å²	131.2	64%	0.643	63%	0.629	S	S	*	*	H	α-helix	trans	-61.1	-44.3	176.3	-176.5	-103.8	0	0	0	111.9	A1148 F1149 F1154 K1155	A1148-Y1152 WeakPolarHBondContact O-CB 3.35Å; A1148-Y1152 PolarHBondContact O-N 3.34Å; F1149-Y1152 PolarHBondContact O-N 3.42Å; Y1152-F1154 PolarHBondContact O-N 2.9Å; Y1152-K1155 PolarHBondContact O-N 2.95Å
1153	K	46.3	Very low	50.3	Low	140 Å²	140	133.4 Å²	133.4	61%	0.609	64%	0.642	S	S	*	*	H	α-helix	trans	-71.1	-26.7	-178.5	-165.6	171.7	-175.5	178.7	0	113.5	F1149 F1150	F1149-K1153 HydrophobicContact CE1-CD 4.1Å; F1149-K1153 HydrophobicContact CZ-CD 4.36Å; F1149-K1153 WeakPolarHBondContact O-CB 3.33Å; F1149-K1153 PolarHBondContact O-N 3.2Å; F1150-K1153 PolarHBondContact O-N 3.21Å
1154	F	46.4	Very low	48.3	Very low	179 Å²	179	133.6 Å²	133.6	79%	0.785	65%	0.645	S	S	*	*	H	α-helix	trans	-87.8	-20.2	174.5	-100.3	-88.5	0	0	0	114.6	F1150 I1151 Y1152 R1156	F1150-F1154 PolarHBondContact O-N 3.09Å; I1151-F1154 PolarHBondContact O-N 2.81Å; Y1152-F1154 PolarHBondContact O-N 2.9Å; F1154-R1156 VanDerWaalsContact C-N 3.25Å; F1154-R1156 PolarHBondContact O-N 2.83Å
1155	K	41.3	Very low	46.3	Very low	181 Å²	181	133.5 Å²	133.5	79%	0.787	65%	0.65	S	S	*	*	S	Bend	trans	-81.6	14.5	-174.7	-139.2	179.5	-173.9	-176.9	0	115.6	I1151 Y1152	I1151-K1155 WeakPolarHBondContact O-CB 3.36Å; I1151-K1155 PolarHBondContact O-N 3Å; I1151-K1155 VanDerWaalsContact O-N 3.12Å; Y1152-K1155 PolarHBondContact O-N 2.95Å
1156	R	42.7	Very low	44.3	Very low	212 Å²	212	138.9 Å²	138.9	80%	0.8	66%	0.664	S	S	*	*			trans	-134.2	82.7	176.2	-77.1	-169	171.8	-169.8	-1.6	113.4	F1154	F1154-R1156 VanDerWaalsContact C-N 3.25Å; F1154-R1156 PolarHBondContact O-N 2.83Å
1157	K	33.1	Very low	42.3	Very low	198 Å²	198	140.2 Å²	140.2	86%	0.861	67%	0.672	S	S	*	*			trans	-136.2	146.6	149.2	-90.6	-169.1	172.3	-176.1	0	109.1
1158	I	36.6	Very low	40.7	Very low	171 Å²	171	146 Å²	146	88%	0.877	68%	0.684	S	S	*	*			trans	85.7	136	-177.6	-54.8	175.1	0	0	0	113.9
1159	P	39.2	Very low	39	Very low	109 Å²	109	150.6 Å²	150.6	71%	0.708	70%	0.696	S	S	*	*			trans	-135.8	-157.8	-149.9	38.3	-14.6	0	0	0	115.8
1160	W	28.6	Very low	37.3	Very low	215 Å²	215	151 Å²	151	81%	0.814	70%	0.7	S	S	*	*			trans	83.5	141.9	178.8	-76.7	38.6	0	0	0	115
1161	I	32.6	Very low	35.8	Very low	138 Å²	138	153.1 Å²	153.1	71%	0.708	71%	0.709	S	S	*	*			cis	-137.1	174.7	17.3	-123	152.5	0	0	0	113.6
1162	H	26.3	Very low	34.7	Very low	146 Å²	146	155 Å²	155	68%	0.676	72%	0.72	S	S	*	*			trans	-63.9	178.6	-176.8	-55	-29.1	0	0	0	116.3
1163	V	28.6	Very low	34	Very low	128 Å²	128	153.6 Å²	153.6	78%	0.776	73%	0.731	S	S	*	*				-150.6	159	54.1	169.6	0	0	0	0	114.3
1164	E	28.1	Very low	33.1	Very low	143 Å²	143	155.3 Å²	155.3	67%	0.668	74%	0.741	S	S	*	*			trans	-38.7	146.6	172.2	-77.5	103.1	152.7	0	0	117.6
1165	T	33	Very low	32.3	Very low	113 Å²	113	152.8 Å²	152.8	69%	0.693	74%	0.74	S	S	*	*				61.4	151.5	73.2	86.9	0	0	0	0	115
1166	E	29	Very low	31.6	Very low	153 Å²	153	151.6 Å²	151.6	72%	0.715	74%	0.741	S	S	*	*			cis	-153.2	179.3	13	-137.4	147.3	100.7	0	0	107
1167	D	29.6	Very low	30.7	Very low	104 Å²	104	145.6 Å²	145.6	56%	0.556	73%	0.732	S	S	*	*			cis	-168.9	-156.8	9.3	-154.9	-9.7	0	0	0	106.7
1168	R	28.4	Very low	30.5	Very low	168 Å²	168	142.5 Å²	142.5	63%	0.634	73%	0.729	S	S	*	*			cis	-165.4	147.4	-6.4	-159.7	175.9	-87.2	-119.8	-20.6	112.4
1169	H	29.5	Very low	30.1	Very low	147 Å²	147	140.5 Å²	140.5	68%	0.681	73%	0.725	S	S	*	*			trans	61.8	160.9	155.3	-73.3	-16.1	0	0	0	120.1
1170	E	30.2	Very low	29.5	Very low	127 Å²	127	138.2 Å²	138.2	59%	0.593	72%	0.721	S	S	*	*			cis	-158.5	155.1	-9.7	-120.3	-172.2	171	0	0	113.9
1171	K	29.1	Very low	29.4	Very low	165 Å²	165	136.4 Å²	136.4	72%	0.717	72%	0.721	S	S	*	*			trans	51	140.9	145	-71.2	169.4	-171.1	145	0	125.3
1172	D	35.4	Very low	29.2	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	72%	0.72	S	S	*	*			trans	-80.3	167.8	154.9	-46.2	-80.7	0	0	0	112.9
1173	P	39.7	Very low	29.2	Very low	134 Å²	134	136 Å²	136	87%	0.87	73%	0.726	S	S	*	*				-153	-164.2	98.4	41.7	-22.6	0	0	0	116.4
1174	E	28.8	Very low	29.2	Very low	177 Å²	177	134.1 Å²	134.1	83%	0.827	72%	0.724	S	S	*	*			trans	-111.2	150.4	-160.4	-67.7	-174	124	0	0	118.3
1175	V	29.1	Very low	29.1	Very low	126 Å²	126	135 Å²	135	76%	0.764	73%	0.73	S	S	*	*			trans	69.1	167.6	132.9	174.7	0	0	0	0	121.3
1176	I	25.8	Very low	28.7	Very low	156 Å²	156	135 Å²	135	80%	0.8	73%	0.734	S	S	*	*			trans	92.2	147.1	174.8	-51.8	179.9	0	0	0	116
1177	S	23.4	Very low	28.7	Very low	86 Å²	86	136.8 Å²	136.8	60%	0.601	74%	0.739	S	S	*	*				178.7	167.6	-76.1	61.8	0	0	0	0	111.9
1178	T	30	Very low	28.6	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	75%	0.751	S	S	*	*			trans	71	153.1	172.7	77.8	0	0	0	0	116.4
1179	V	27.6	Very low	28.6	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	76%	0.76	S	S	*	*			cis	-137.7	162.9	5	178.9	0	0	0	0	106.9
1180	G	26	Very low	28.6	Very low	60 Å²	60	139.3 Å²	139.3	62%	0.619	77%	0.765	S	S	*	*			cis	-147.5	-158.6	7.9	0	0	0	0	0	111.2
1181	Q	27.4	Very low	28.7	Very low	177 Å²	177	139.8 Å²	139.8	83%	0.827	77%	0.772	S	S	*	*			cis	85.9	120.4	17.9	-68.2	-166.8	-59.2	0	0	115.9
1182	N	27.8	Very low	29	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	78%	0.777	S	S	*	*			cis	-135	178.9	5.6	-77.1	-28	0	0	0	110.3
1183	D	27.2	Very low	28.9	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	78%	0.776	S	S	*	*			cis	-148.8	-176.7	15.5	-139.8	-44.7	0	0	0	113.5
1184	A	27.5	Very low	28.7	Very low	88 Å²	88	140 Å²	140	73%	0.727	76%	0.764	S	S	*	*			trans	-93.3	163.1	-150.2	0	0	0	0	0	119.5
1185	M	26.9	Very low	29.3	Very low	162 Å²	162	135.2 Å²	135.2	80%	0.798	75%	0.75	S	S	*	*			trans	-72.6	156.5	167.6	-66.1	161.6	47.2	0	0	113.3	K1187	M1185-K1187 HydrophobicContact CE-CG 4.22Å
1186	S	25.1	Very low	29.8	Very low	111 Å²	111	137 Å²	137	78%	0.776	75%	0.75	S	S	*	*			trans	-127.6	129.2	148.5	65.5	0	0	0	0	111
1187	K	29.2	Very low	30.5	Very low	192 Å²	192	136.8 Å²	136.8	84%	0.835	74%	0.744	S	S	*	*			trans	-80.5	129.5	173.4	-71.4	177.4	176.9	176.3	0	109.3	M1185	M1185-K1187 HydrophobicContact CE-CG 4.22Å
1188	V	27.3	Very low	31.3	Very low	132 Å²	132	139 Å²	139	80%	0.8	75%	0.745	S	S	*	*			trans	-115.5	139.5	164.5	-179.4	0	0	0	0	108.6
1189	K	28.7	Very low	31.8	Very low	190 Å²	190	139 Å²	139	83%	0.826	74%	0.739	S	S	*	*			trans	-75.6	145	177.8	-60.6	173.9	-179.3	176.3	0	109.8
1190	L	28.1	Very low	32.4	Very low	149 Å²	149	138 Å²	138	78%	0.78	73%	0.727	S	S	*	*			trans	-118.9	85.2	162.8	-160.1	76.6	0	0	0	109.7
1191	N	32.4	Very low	33	Very low	137 Å²	137	142.2 Å²	142.2	73%	0.733	73%	0.731	S	S	*	*			trans	-83.7	174.3	150.3	-83.2	18	0	0	0	108.2
1192	E	36	Very low	33.4	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	73%	0.731	S	S	*	*			trans	72	67.7	170.4	-58.3	-179.1	178.3	0	0	115.9
1193	F	32.7	Very low	33.7	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.803	73%	0.733	S	S	*	*	S	Bend	trans	-122.6	147.6	131.2	-83.4	-82	0	0	0	108.5
1194	P	36.7	Very low	34	Very low	95 Å²	95	143.4 Å²	143.4	62%	0.617	73%	0.728	S	S	*	*			trans	-72.4	156.9	-163.4	28.4	-35.8	0	0	0	113.5
1195	S	39.6	Very low	34.1	Very low	76 Å²	76	147.6 Å²	147.6	53%	0.531	73%	0.732	S	S	.	*			trans	-74.6	153.1	179.4	83	0	0	0	0	112	K1197 E1198	S1195-K1197 PolarHBondContact O-N 3.31Å; S1195-E1198 PolarHBondContact O-N 2.87Å
1196	Q	41	Very low	34.3	Very low	164 Å²	164	143.5 Å²	143.5	77%	0.766	73%	0.732	S	S	*	*	H	α-helix	trans	-61.9	-12.7	-177.1	-166.1	168	-18.4	0	0	114.3
1197	K	40.3	Very low	34.7	Very low	152 Å²	152	149.2 Å²	149.2	66%	0.661	74%	0.736	S	S	*	*	H	α-helix	trans	-74.4	-37.2	175.2	-94.7	-178.1	171.5	175.4	0	114.1	S1195 L1199 M1200 E1201	S1195-K1197 PolarHBondContact O-N 3.31Å; K1197-L1199 VanDerWaalsContact C-N 3.25Å; K1197-L1199 PolarHBondContact O-N 2.82Å; K1197-M1200 PolarHBondContact O-N 3.39Å; K1197-E1201 PolarHBondContact O-N 3.01Å
1198	E	39.9	Very low	34.7	Very low	132 Å²	132	145.2 Å²	145.2	62%	0.617	73%	0.732	S	S	*	*	H	α-helix	trans	-71.2	-20.4	179.5	-71.8	-177.7	111.5	0	0	113.2	S1195	S1195-E1198 PolarHBondContact O-N 2.87Å
1199	L	40.2	Very low	34.8	Very low	132 Å²	132	151.1 Å²	151.1	69%	0.691	74%	0.74	S	S	*	*	H	α-helix	trans	-78	-34	174	-138.3	87.2	0	0	0	112.1	K1197	K1197-L1199 VanDerWaalsContact C-N 3.25Å; K1197-L1199 PolarHBondContact O-N 2.82Å
1200	M	39.6	Very low	34.7	Very low	110 Å²	110	145.2 Å²	145.2	54%	0.542	73%	0.733	S	S	.	*	H	α-helix	trans	-80	-32.7	-175.2	-71.5	-174.8	67	0	0	113.7	K1197 K1202 E1203 L1204	K1197-M1200 PolarHBondContact O-N 3.39Å; M1200-K1202 PolarHBondContact O-N 2.85Å; M1200-E1203 PolarHBondContact O-N 3.09Å; M1200-E1203 VanDerWaalsContact O-N 3.1Å; M1200-L1204 PolarHBondContact O-N 2.67Å
1201	E	39.1	Very low	34.5	Very low	148 Å²	148	141.9 Å²	141.9	69%	0.692	74%	0.735	S	S	*	*	H	α-helix	trans	-64	-26.2	176.2	-77.1	-174.6	137.1	0	0	112.6	K1197	K1197-E1201 PolarHBondContact O-N 3.01Å
1202	K	35.4	Very low	34.1	Very low	191 Å²	191	145.4 Å²	145.4	83%	0.83	74%	0.744	S	S	*	*	H	α-helix	trans	-79.5	-10.2	173.6	-94.5	-179.1	176.9	171.7	0	115.7	M1200	M1200-K1202 PolarHBondContact O-N 2.85Å
1203	E	35	Very low	33.6	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	73%	0.734	S	S	*	*	H	α-helix	trans	-96.7	-16.3	171	-73.1	-161.1	116.5	0	0	113.4	M1200	M1200-E1203 PolarHBondContact O-N 3.09Å; M1200-E1203 VanDerWaalsContact O-N 3.1Å
1204	L	33.9	Very low	33.3	Very low	132 Å²	132	143.1 Å²	143.1	69%	0.691	74%	0.741	S	S	*	*	H	α-helix	trans	-84.6	-36.2	-174.1	-122.1	72.3	0	0	0	114.7	M1200 G1206	M1200-L1204 PolarHBondContact O-N 2.67Å; L1204-G1206 PolarHBondContact O-N 3.3Å
1205	E	30.1	Very low	32.7	Very low	177 Å²	177	145.5 Å²	145.5	83%	0.827	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-71	-17.3	178.2	-71.4	-157	122.4	0	0	113.7	R1207	E1205-R1207 PolarHBondContact O-N 2.85Å
1206	G	30.9	Very low	31.9	Very low	76 Å²	76	151 Å²	151	78%	0.784	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-71.4	-5.1	178.8	0	0	0	0	0	115.4	L1204	L1204-G1206 PolarHBondContact O-N 3.3Å
1207	R	32.6	Very low	31.1	Very low	231 Å²	231	151.4 Å²	151.4	87%	0.872	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-123.3	5.5	-160.8	-129.3	172.1	-173.3	155.8	2.9	117.3	E1205	E1205-R1207 PolarHBondContact O-N 2.85Å
1208	S	28.6	Very low	30.3	Very low	107 Å²	107	151.9 Å²	151.9	75%	0.748	77%	0.768	S	S	*	*	S	Bend	trans	-111.5	16.1	-176	64.2	0	0	0	0	115.6
1209	R	30.4	Very low	29.5	Very low	256 Å²	256	152.9 Å²	152.9	97%	0.966	78%	0.776	S	S	*	*			trans	-124.9	68.4	175.7	-127	178.1	-177.4	-172.9	-0.8	113.1
1210	G	26	Very low	28.6	Very low	66 Å²	66	150.4 Å²	150.4	68%	0.68	77%	0.766	S	S	*	*			trans	-162.7	58	-178.8	0	0	0	0	0	112.4	F1212	G1210-F1212 PolarHBondContact O-N 2.93Å
1211	G	24	Very low	27.9	Very low	79 Å²	79	149.4 Å²	149.4	81%	0.814	77%	0.767	S	S	*	*			trans	-67.8	117.8	178.8	0	0	0	0	0	111.6	G1213	G1211-G1213 PolarHBondContact O-N 2.88Å
1212	F	25.3	Very low	27.2	Very low	211 Å²	211	152.9 Å²	152.9	93%	0.925	77%	0.773	S	S	*	*			trans	-68.8	88.3	175.7	-100.1	-91.6	0	0	0	111.1	G1210	G1210-F1212 PolarHBondContact O-N 2.93Å
1213	G	24.3	Very low	27	Very low	61 Å²	61	148.1 Å²	148.1	63%	0.629	75%	0.754	S	S	*	*			trans	-63.8	130.8	161.1	0	0	0	0	0	109.8	G1211 N1215	G1211-G1213 PolarHBondContact O-N 2.88Å; G1213-N1215 PolarHBondContact O-N 2.88Å
1214	R	27.5	Very low	26.4	Very low	254 Å²	254	148.2 Å²	148.2	96%	0.958	75%	0.752	S	S	*	*			trans	-75.7	70.7	173	-78	-176.8	168.7	-177.9	-3.1	111.1
1215	N	22.8	Very low	25.9	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	74%	0.74	S	S	*	*			trans	-113	113.6	159.3	-85.8	-2.1	0	0	0	108.2	G1213 E1217	G1213-N1215 PolarHBondContact O-N 2.88Å; N1215-E1217 PolarHBondContact O-N 2.7Å
1216	M	24.1	Very low	25.7	Very low	193 Å²	193	141.1 Å²	141.1	95%	0.951	73%	0.725	S	S	*	*			trans	-90.5	82.5	176.9	-176.7	157.9	155.4	0	0	107.9	R1218	M1216-R1218 PolarHBondContact O-N 2.81Å; M1216-R1218 VanDerWaalsContact O-N 3.12Å
1217	E	22.7	Very low	25.3	Very low	171 Å²	171	142.3 Å²	142.3	80%	0.799	72%	0.72	S	S	*	*			trans	-60.3	115.3	178.1	-67.7	-176.5	150.8	0	0	109.6	N1215 I1219	N1215-E1217 PolarHBondContact O-N 2.7Å; E1217-I1219 PolarHBondContact O-N 3.43Å
1218	R	23.8	Very low	24.7	Very low	163 Å²	163	136.7 Å²	136.7	62%	0.615	71%	0.711	S	S	*	*			trans	-56.7	120.1	168.2	-91.3	179.2	158.5	179.5	-9.6	106.9	M229 E280 M1216 V1220	M229-R1218 PolarHBondContact O-NH1 3.33Å; E280-R1218 IonicContact OE1-CZ 2.88Å; E280-R1218 IonicContact OE1-NH2 3.63Å; E280-R1218 PolarHBondContact OE1-NH2 3.15Å; M1216-R1218 PolarHBondContact O-N 2.81Å; M1216-R1218 VanDerWaalsContact O-N 3.12Å; R1218-V1220 PolarHBondContact O-N 3.31Å
1219	I	23.5	Very low	24.4	Very low	153 Å²	153	138.2 Å²	138.2	79%	0.785	71%	0.711	S	S	*	*			trans	-68.2	98.2	173.5	-55.7	176.6	0	0	0	107.1	E1217 T1221	E1217-I1219 PolarHBondContact O-N 3.43Å; I1219-T1221 HydrophobicContact CG2-CG2 3.84Å; I1219-T1221 PolarHBondContact O-N 2.98Å
1220	V	22.2	Very low	24	Very low	79 Å²	79	132.1 Å²	132.1	48%	0.479	70%	0.702	S	S	.	*			trans	-72.6	83.1	171.7	-178.2	0	0	0	0	107.7	R1218 R1222	R1218-V1220 PolarHBondContact O-N 3.31Å; V1220-R1222 PolarHBondContact O-N 3.2Å
1221	T	24.6	Very low	23.9	Very low	90 Å²	90	135.5 Å²	135.5	55%	0.552	70%	0.703	S	S	*	*			trans	-65.4	99.4	172.5	48.9	0	0	0	0	108.8	I1219	I1219-T1221 HydrophobicContact CG2-CG2 3.84Å; I1219-T1221 PolarHBondContact O-N 2.98Å
1222	R	23.3	Very low	23.9	Very low	220 Å²	220	138.4 Å²	138.4	83%	0.83	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.3	150.2	165.4	-79.5	-174.4	166.5	-175.5	-5.3	110	V1220	V1220-R1222 PolarHBondContact O-N 3.2Å
1223	E	31	Very low	23.8	Very low	92 Å²	92	134.4 Å²	134.4	43%	0.43	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-77.8	133.2	-151	-54.2	173.1	150.1	0	0	112	M207 K223 Y262 P1225	M207-E1223 VanDerWaalsContact CE-OE1 3.23Å; M207-E1223 WeakPolarHBondContact CE-OE1 3.35Å; M207-E1223 WeakPolarHBondContact CE-OE2 3.38Å; K223-E1223 IonicContact NZ-OE1 3.49Å; K223-E1223 PolarHBondContact NZ-OE1 2.91Å; Y262-E1223 HydrophobicContact CE1-CG 3.92Å; Y262-E1223 VanDerWaalsContact CE1-OE1 3.26Å; Y262-E1223 WeakPolarHBondContact CE1-OE1 3.26Å; E1223-P1225 WeakPolarHBondContact O-CD 3.15Å
1224	F	23	Very low	23.8	Very low	156 Å²	156	138.7 Å²	138.7	68%	0.684	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-88.6	116.2	172.6	-72.5	-89.4	0	0	0	110.7	N1226	F1224-N1226 PolarHBondContact O-N 3.04Å
1225	P	23.1	Very low	23.5	Very low	68 Å²	68	131.5 Å²	131.5	44%	0.442	67%	0.671	S	S	.	*			trans	-71.8	93.5	162.1	30.1	-32.1	0	0	0	108.6	P565 E1223 C1227	P565-P1225 HydrophobicContact CG-CB 4.45Å; E1223-P1225 WeakPolarHBondContact O-CD 3.15Å; P1225-C1227 PolarHBondContact O-N 3.17Å
1226	N	26.4	Very low	23.6	Very low	93 Å²	93	130.6 Å²	130.6	50%	0.497	66%	0.664	S	S	.	*			trans	-76.3	54.5	-171.1	-153.9	13.1	0	0	0	112.9	L307 F1224	L307-N1226 PolarHBondContact O-ND2 3.32Å; L307-N1226 VanDerWaalsContact O-ND2 3.14Å; F1224-N1226 PolarHBondContact O-N 3.04Å
1227	C	22.6	Very low	23.6	Very low	101 Å²	101	126.1 Å²	126.1	68%	0.682	64%	0.643	S	S	*	*			trans	-159.1	58.8	-178.3	-96.3	0	0	0	0	113.5	P1225	P1225-C1227 PolarHBondContact O-N 3.17Å
1228	T	20.4	Very low	23.6	Very low	113 Å²	113	122.7 Å²	122.7	69%	0.693	63%	0.631	S	S	*	*	S	Bend	trans	-149.5	147.9	158	12.9	0	0	0	0	109.6
1229	N	21.8	Very low	23.6	Very low	138 Å²	138	119.3 Å²	119.3	74%	0.738	63%	0.633	S	S	*	*			trans	-63.2	135.4	177.5	-69.6	17.9	0	0	0	111.3
1230	V	21.7	Very low	23.6	Very low	129 Å²	129	116.3 Å²	116.3	78%	0.782	62%	0.619	S	S	*	*			trans	-128	0	153.5	179.5	0	0	0	0	105.9	Q404	Q404-V1230 VanDerWaalsContact CD-O 3.29Å; Q404-V1230 PolarHBondContact NE2-O 3.48Å; Q404-V1230 PolarHBondContact NE2-OXT 2.79Å

Retrieved 1,230 of 1,230 residues in 336 ms (Link to these results)

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