A0A087YBD0_POEFO Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase 48 kDa subunit

Subunit of the oligosaccharyl transferase (OST) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). All subunits are required for a maximal enzyme activity. Required for the assembly of both SST3A- and SS3B-containing OST complexes.

AlphaFold DB (A0A3B3TX77), UniProt , Accession A0A087YBD0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 465 aa.

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	39.5	Very low	28.5	Very low	243 Å²	243	132.3 Å²	132.3	100%	1.197	81%	0.812	S	S	*	*				0	83.3	0	-63.2	-170.3	-139.2	0	0	106.3
2	A	31.5	Very low	28.5	Very low	103 Å²	103	139 Å²	139	85%	0.851	81%	0.811	S	S	*	*				63.5	125.9	98.5	0	0	0	0	0	112
3	A	29	Very low	28.3	Very low	82 Å²	82	143.9 Å²	143.9	68%	0.678	82%	0.817	S	S	*	*			cis	-174.2	145.8	-6.3	0	0	0	0	0	107.3
4	F	27	Very low	28.1	Very low	188 Å²	188	138.9 Å²	138.9	83%	0.825	81%	0.813	S	S	*	*			trans	54.3	115	135.7	-77.2	-102.7	0	0	0	120.2
5	T	29.5	Very low	27.9	Very low	122 Å²	122	136.5 Å²	136.5	75%	0.748	81%	0.807	S	S	*	*				54.3	143.4	92.6	67.9	0	0	0	0	113.9
6	A	28.5	Very low	27.8	Very low	83 Å²	83	137.3 Å²	137.3	69%	0.686	81%	0.805	S	S	*	*			cis	-167.1	148.8	28.1	0	0	0	0	0	107.4
7	V	26.5	Very low	27.8	Very low	148 Å²	148	138.5 Å²	138.5	90%	0.897	81%	0.807	S	S	*	*				55.4	130.8	94.3	-172.4	0	0	0	0	116.8
8	G	25.3	Very low	27.7	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	80%	0.795	S	S	*	*			trans	130.2	95.1	156.5	0	0	0	0	0	112.9
9	Q	25.1	Very low	27.8	Very low	189 Å²	189	138.4 Å²	138.4	88%	0.883	80%	0.796	S	S	*	*				84.5	124.7	62.9	-160.3	-179.4	5.1	0	0	114.1
10	A	26.8	Very low	27.8	Very low	83 Å²	83	141.1 Å²	141.1	69%	0.686	80%	0.798	S	S	*	*			trans	68.9	146.4	161.4	0	0	0	0	0	116.7
11	D	25	Very low	27.9	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.804	S	S	*	*			cis	-165.8	175.8	36.9	-134.2	-24.3	0	0	0	113.7
12	R	27.9	Very low	27.5	Very low	213 Å²	213	141.1 Å²	141.1	80%	0.804	79%	0.788	S	S	*	*			trans	-67.7	179.6	-166.8	-64.8	169.8	-176.2	-153	-0.1	119.4
13	F	26.1	Very low	27.5	Very low	203 Å²	203	140 Å²	140	89%	0.89	79%	0.787	S	S	*	*			trans	112.3	112	158.7	-79.9	-92.1	0	0	0	112.7
14	G	25.1	Very low	27.4	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	80%	0.796	S	S	*	*				88.2	126.9	60.1	0	0	0	0	0	107
15	S	25.9	Very low	27.6	Very low	103 Å²	103	145.1 Å²	145.1	72%	0.72	80%	0.798	S	S	*	*			cis	178.8	168.4	24.8	55.5	0	0	0	0	108.7
16	L	26.9	Very low	27.6	Very low	148 Å²	148	145.8 Å²	145.8	78%	0.775	80%	0.802	S	S	*	*			trans	82.2	135	141.1	-81	158.2	0	0	0	124.1
17	L	27.5	Very low	27.8	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	81%	0.805	S	S	*	*			trans	85.1	144.8	153	-63.9	144.2	0	0	0	117.9
18	S	26.2	Very low	28.4	Very low	85 Å²	85	151.5 Å²	151.5	59%	0.594	80%	0.804	S	S	*	*			cis	167	142.6	-22.3	168.2	0	0	0	0	105.8
19	K	28.5	Very low	28.8	Very low	189 Å²	189	154 Å²	154	82%	0.822	81%	0.809	S	S	*	*			trans	68.6	136.8	168	-77.5	168.5	177.4	173.5	0	115.5
20	K	28.4	Very low	29.5	Very low	192 Å²	192	155.6 Å²	155.6	84%	0.835	81%	0.807	S	S	*	*			cis	-164	136.7	43.9	-135.8	167.9	-175.5	-178.8	0	109.7
21	R	30.6	Very low	30.4	Very low	246 Å²	246	156.7 Å²	156.7	93%	0.928	81%	0.805	S	S	*	*			trans	-67	133.6	161.2	-86.8	176.3	169.6	172.6	-3.5	109.4
22	T	30.4	Very low	31.3	Very low	139 Å²	139	156.4 Å²	156.4	85%	0.853	80%	0.803	S	S	*	*			trans	-135	112.8	147.6	36.4	0	0	0	0	107
23	G	30.6	Very low	32.1	Very low	80 Å²	80	153.2 Å²	153.2	83%	0.825	80%	0.801	S	S	*	*			trans	-78.4	145.1	174	0	0	0	0	0	110.6
24	M	27.3	Very low	33.3	Very low	177 Å²	177	148 Å²	148	87%	0.872	78%	0.782	S	S	*	*			trans	-138.1	115.6	155.4	-146.8	154.1	70.7	0	0	107.1
25	K	31.3	Very low	34.4	Very low	201 Å²	201	148 Å²	148	87%	0.874	77%	0.77	S	S	*	*			trans	-75	121.5	170.5	-71.1	178.6	175.8	179.9	0	107.2
26	T	30	Very low	35.6	Very low	135 Å²	135	146.3 Å²	146.3	83%	0.828	76%	0.758	S	S	*	*			trans	-127.3	112.5	158.2	21.4	0	0	0	0	108
27	T	33	Very low	37.1	Very low	121 Å²	121	143 Å²	143	74%	0.742	74%	0.744	S	S	*	*			trans	-85.4	126.9	-175.6	-43.5	0	0	0	0	109.3
28	R	37.8	Very low	38.3	Very low	231 Å²	231	141.4 Å²	141.4	87%	0.872	74%	0.736	S	S	*	*			trans	32.7	119.7	147.5	-66.8	177.3	162.6	179.4	-6.1	119.6
29	C	34.5	Very low	39.8	Very low	118 Å²	118	141.2 Å²	141.2	80%	0.797	73%	0.731	S	S	*	*			trans	-163	50.9	138.7	-162.9	0	0	0	0	113
30	W	39.2	Very low	41	Very low	223 Å²	223	138 Å²	138	85%	0.845	72%	0.722	S	S	*	*			trans	-147.6	72.9	176.4	-76.8	75.7	0	0	0	110.2
31	T	46.2	Very low	42.1	Very low	107 Å²	107	134.5 Å²	134.5	66%	0.656	71%	0.712	S	S	*	*	S	Bend	trans	-151.9	9.5	173	53.9	0	0	0	0	115.2
32	L	44.7	Very low	43.2	Very low	140 Å²	140	125.1 Å²	125.1	73%	0.733	68%	0.684	S	S	*	*	S	Bend	trans	-109.9	-35.5	178.9	-81.4	165.5	0	0	0	113.7	S36	L32-S36 PolarHBondContact O-N 3.38Å; L32-S36 PolarHBondContact O-OG 3.5Å; L32-S36 VanDerWaalsContact O-OG 3.09Å
33	L	44.8	Very low	44	Very low	147 Å²	147	123.1 Å²	123.1	77%	0.77	67%	0.667	S	S	*	*	H	α-helix	trans	-71.4	-40.1	177.2	-108.4	94.2	0	0	0	112.9	C35 S36 V37	L33-C35 PolarHBondContact O-N 3.3Å; L33-S36 PolarHBondContact O-N 3.29Å; L33-V37 WeakPolarHBondContact O-CG2 3.27Å; L33-V37 PolarHBondContact O-N 2.94Å; L33-V37 VanDerWaalsContact O-N 3.15Å
34	D	50.5	Low	44.8	Very low	92 Å²	92	122.3 Å²	122.3	49%	0.492	65%	0.653	S	S	.	*	H	α-helix	trans	-68.4	-36	-177.1	-71.2	-32.7	0	0	0	112.5	V37 L38	D34-V37 PolarHBondContact O-N 3.11Å; D34-L38 WeakPolarHBondContact O-CB 3.34Å; D34-L38 PolarHBondContact O-N 3.39Å
35	C	48.6	Very low	45.6	Very low	76 Å²	76	117.6 Å²	117.6	51%	0.514	64%	0.638	S	S	.	*	H	α-helix	trans	-67.9	-36.2	175.2	-79	0	0	0	0	112.1	L33 V39	L33-C35 PolarHBondContact O-N 3.3Å; C35-V39 VanDerWaalsContact O-CB 3.31Å; C35-V39 WeakPolarHBondContact O-CB 3.45Å; C35-V39 WeakPolarHBondContact O-CG2 3.35Å; C35-V39 PolarHBondContact O-N 3.48Å
36	S	50.9	Low	45.9	Very low	67 Å²	67	115.6 Å²	115.6	47%	0.469	63%	0.633	S	S	.	*	H	α-helix	trans	-67.6	-38.4	176.9	-57	0	0	0	0	112.1	L32 L33 L40	L32-S36 PolarHBondContact O-N 3.38Å; L32-S36 PolarHBondContact O-OG 3.5Å; L32-S36 VanDerWaalsContact O-OG 3.09Å; L33-S36 PolarHBondContact O-N 3.29Å; S36-L40 WeakPolarHBondContact O-CB 3.04Å; S36-L40 PolarHBondContact O-N 2.86Å
37	V	57.2	Low	46.1	Very low	79 Å²	79	115.7 Å²	115.7	48%	0.479	63%	0.628	S	S	.	*	H	α-helix	trans	-71.6	-39.6	177.2	176.2	0	0	0	0	111.4	L33 D34 L40 L41	L33-V37 WeakPolarHBondContact O-CG2 3.27Å; L33-V37 PolarHBondContact O-N 2.94Å; L33-V37 VanDerWaalsContact O-N 3.15Å; D34-V37 PolarHBondContact O-N 3.11Å; V37-L40 PolarHBondContact O-N 3.31Å; V37-L41 HydrophobicContact CG1-CD1 4.09Å; V37-L41 WeakPolarHBondContact O-CB 3.28Å; V37-L41 PolarHBondContact O-N 2.93Å
38	L	53.9	Low	46.2	Very low	124 Å²	124	118 Å²	118	65%	0.649	63%	0.63	S	S	*	*	H	α-helix	trans	-66.4	-37.3	173.5	-93.2	146.2	0	0	0	112.6	D34 S42	D34-L38 WeakPolarHBondContact O-CB 3.34Å; D34-L38 PolarHBondContact O-N 3.39Å; L38-S42 WeakPolarHBondContact O-CB 3.39Å; L38-S42 PolarHBondContact O-N 3.15Å; L38-S42 PolarHBondContact O-OG 2.78Å
39	V	56.8	Low	46.2	Very low	82 Å²	82	111.8 Å²	111.8	50%	0.497	62%	0.621	S	S	.	*	H	α-helix	trans	-69	-40.6	174.8	170.2	0	0	0	0	110.8	C35 S42 L43	C35-V39 VanDerWaalsContact O-CB 3.31Å; C35-V39 WeakPolarHBondContact O-CB 3.45Å; C35-V39 WeakPolarHBondContact O-CG2 3.35Å; C35-V39 PolarHBondContact O-N 3.48Å; V39-S42 WeakPolarHBondContact CA-OG 3.46Å; V39-S42 PolarHBondContact O-N 3.24Å; V39-S42 PolarHBondContact O-OG 3.43Å; V39-L43 HydrophobicContact CG1-CD1 4.04Å; V39-L43 WeakPolarHBondContact O-CB 3.41Å; V39-L43 PolarHBondContact O-N 3.42Å
40	L	54.1	Low	46.4	Very low	121 Å²	121	108.3 Å²	108.3	63%	0.634	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-38.4	174.1	-89.8	153.8	0	0	0	113	S36 V37 L43 A44	S36-L40 WeakPolarHBondContact O-CB 3.04Å; S36-L40 PolarHBondContact O-N 2.86Å; V37-L40 PolarHBondContact O-N 3.31Å; L40-L43 PolarHBondContact O-N 2.92Å; L40-A44 VanDerWaalsContact O-CB 3.31Å; L40-A44 WeakPolarHBondContact O-CB 3.37Å; L40-A44 PolarHBondContact O-N 3.35Å
41	L	51.7	Low	46.7	Very low	118 Å²	118	105.6 Å²	105.6	62%	0.618	60%	0.595	S	S	*	*	H	α-helix	trans	-67	-37.1	172	-108.3	91.5	0	0	0	111.9	V37 A44 S45	V37-L41 HydrophobicContact CG1-CD1 4.09Å; V37-L41 WeakPolarHBondContact O-CB 3.28Å; V37-L41 PolarHBondContact O-N 2.93Å; L41-A44 PolarHBondContact O-N 3.46Å; L41-S45 PolarHBondContact O-N 3.12Å; L41-S45 PolarHBondContact O-OG 2.82Å
42	S	53.9	Low	47.1	Very low	50 Å²	50	101.3 Å²	101.3	35%	0.35	57%	0.57	S	S	.	*	H	α-helix	trans	-69.2	-38.1	175.7	75.3	0	0	0	0	112.1	L38 V39 S45 M46	L38-S42 WeakPolarHBondContact O-CB 3.39Å; L38-S42 PolarHBondContact O-N 3.15Å; L38-S42 PolarHBondContact O-OG 2.78Å; V39-S42 WeakPolarHBondContact CA-OG 3.46Å; V39-S42 PolarHBondContact O-N 3.24Å; V39-S42 PolarHBondContact O-OG 3.43Å; S42-S45 WeakPolarHBondContact CA-OG 3.41Å; S42-S45 PolarHBondContact O-N 3.22Å; S42-S45 PolarHBondContact O-OG 3.28Å; S42-M46 WeakPolarHBondContact O-CG 3.19Å; S42-M46 PolarHBondContact O-N 2.98Å; S42-M46 VanDerWaalsContact O-N 3.15Å
43	L	47.1	Very low	47.9	Very low	96 Å²	96	102.3 Å²	102.3	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-67.4	-38.3	172.6	-109.3	90.5	0	0	0	111.8	V39 L40 S45 M46 L47	V39-L43 HydrophobicContact CG1-CD1 4.04Å; V39-L43 WeakPolarHBondContact O-CB 3.41Å; V39-L43 PolarHBondContact O-N 3.42Å; L40-L43 PolarHBondContact O-N 2.92Å; L43-S45 VanDerWaalsContact C-N 3.31Å; L43-S45 PolarHBondContact O-N 3.08Å; L43-M46 PolarHBondContact O-N 3.28Å; L43-L47 PolarHBondContact O-N 2.99Å
44	A	47.8	Very low	49.5	Very low	63 Å²	63	95.5 Å²	95.5	52%	0.521	54%	0.541	S	S	.	.	H	α-helix	trans	-66.4	-32.8	174.6	0	0	0	0	0	112	L40 L41 M46 L47	L40-A44 VanDerWaalsContact O-CB 3.31Å; L40-A44 WeakPolarHBondContact O-CB 3.37Å; L40-A44 PolarHBondContact O-N 3.35Å; L41-A44 PolarHBondContact O-N 3.46Å; A44-M46 VanDerWaalsContact C-N 3.32Å; A44-L47 PolarHBondContact O-N 3.06Å
45	S	43	Very low	51.6	Low	79 Å²	79	96.5 Å²	96.5	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-72.8	-22	173.7	70.4	0	0	0	0	113.8	L41 S42 L43 L47	L41-S45 PolarHBondContact O-N 3.12Å; L41-S45 PolarHBondContact O-OG 2.82Å; S42-S45 WeakPolarHBondContact CA-OG 3.41Å; S42-S45 PolarHBondContact O-N 3.22Å; S42-S45 PolarHBondContact O-OG 3.28Å; L43-S45 VanDerWaalsContact C-N 3.31Å; L43-S45 PolarHBondContact O-N 3.08Å; S45-L47 VanDerWaalsContact C-N 3.33Å
46	M	37.8	Very low	53.8	Low	159 Å²	159	92.9 Å²	92.9	78%	0.783	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-3.5	173.4	-67	-141.7	-88.5	0	0	113.7	S42 L43 A44	S42-M46 WeakPolarHBondContact O-CG 3.19Å; S42-M46 PolarHBondContact O-N 2.98Å; S42-M46 VanDerWaalsContact O-N 3.15Å; L43-M46 PolarHBondContact O-N 3.28Å; A44-M46 VanDerWaalsContact C-N 3.32Å
47	L	34.5	Very low	56	Low	137 Å²	137	89.8 Å²	89.8	72%	0.717	50%	0.495	S	S	*	.			trans	-100.8	42.4	170	-86.4	148.7	0	0	0	111.1	L43 A44 S45 C49	L43-L47 PolarHBondContact O-N 2.99Å; A44-L47 PolarHBondContact O-N 3.06Å; S45-L47 VanDerWaalsContact C-N 3.33Å; L47-C49 PolarHBondContact O-N 3.48Å; L47-C49 VanDerWaalsContact O-N 3.13Å
48	H	35	Very low	58	Low	170 Å²	170	86 Å²	86	79%	0.787	47%	0.472	S	S	*	.			trans	-78.3	83.3	149.5	-92	73.5	0	0	0	106.9	A50	H48-A50 PolarHBondContact O-N 3.46Å; H48-A50 VanDerWaalsContact O-N 3.12Å
49	C	36.9	Very low	60	Low	100 Å²	100	80.1 Å²	80.1	68%	0.676	44%	0.441	S	S	*	.			trans	-57.4	116.8	154.6	-168.7	0	0	0	0	105	L47 K51	L47-C49 PolarHBondContact O-N 3.48Å; L47-C49 VanDerWaalsContact O-N 3.13Å; C49-K51 VanDerWaalsContact C-N 3.33Å; C49-K51 PolarHBondContact O-N 2.87Å
50	A	40.5	Very low	61.9	Low	44 Å²	44	76.2 Å²	76.2	36%	0.364	42%	0.418	S	S	.	.			trans	-57.8	100.4	176.2	0	0	0	0	0	108.3	H48 A52 E351	H48-A50 PolarHBondContact O-N 3.46Å; H48-A50 VanDerWaalsContact O-N 3.12Å; A50-A52 PolarHBondContact O-N 3.46Å; A50-E351 WeakPolarHBondContact CB-O 3.18Å
51	K	44.9	Very low	63.7	Low	167 Å²	167	72.7 Å²	72.7	73%	0.726	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-72.7	126.9	173.7	-70.7	-173.6	177.3	-178.9	0	107	C49 D53	C49-K51 VanDerWaalsContact C-N 3.33Å; C49-K51 PolarHBondContact O-N 2.87Å; K51-D53 PolarHBondContact O-N 2.82Å
52	A	53.5	Low	65.7	Low	17 Å²	17	71.3 Å²	71.3	14%	0.14	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-58	118.9	156.3	0	0	0	0	0	106.7	A50 R79 G80 F81 E311	A50-A52 PolarHBondContact O-N 3.46Å; A52-R79 HydrophobicContact CB-CB 4.48Å; A52-R79 WeakPolarHBondContact CB-O 3.43Å; A52-R79 PolarHBondContact N-O 2.89Å; A52-G80 CarbonylContact O-C 3.3Å; A52-G80 VanDerWaalsContact O-C 3.24Å; A52-G80 VanDerWaalsContact O-O 3.12Å; A52-F81 HydrophobicContact CB-CD1 4.22Å; A52-F81 HydrophobicContact CB-CD2 4.06Å; A52-F81 HydrophobicContact CB-CE1 3.77Å; A52-F81 HydrophobicContact CB-CE2 3.61Å; A52-F81 HydrophobicContact CB-CG 4.35Å; A52-F81 HydrophobicContact CB-CZ 3.44Å; A52-F81 VanDerWaalsContact CB-CZ 3.44Å; A52-E311 HydrophobicContact CB-CG 4.34Å; A52-E311 WeakPolarHBondContact CB-OE1 3.34Å
53	D	62.3	Low	67.5	Low	160 Å²	160	73.7 Å²	73.7	86%	0.856	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-98	123.6	-179.7	-167.5	19.7	0	0	0	107.2	K51	K51-D53 PolarHBondContact O-N 2.82Å
54	G	79.3	Confident	69.8	Low	4 Å²	4	74.6 Å²	74.6	4%	0.041	41%	0.406	C	S	.	.			trans	165.5	124.3	178.6	0	0	0	0	0	113.4	T56 D82 D104	G54-T56 PolarHBondContact O-N 3.42Å; G54-D82 PolarHBondContact O-N 2.71Å; G54-D104 WeakPolarHBondContact CA-OD2 3.15Å
55	K	93.1	Very high	72	Confident	114 Å²	114	72.4 Å²	72.4	50%	0.496	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.2	171	-71.6	180	-179.2	175.9	0	108.9	Y103 D104 H105	K55-Y103 HydrophobicContact CB-CD1 3.99Å; K55-D104 PolarHBondContact N-OD2 3.48Å; K55-D104 PolarHBondContact O-N 3.21Å; K55-H105 PolarHBondContact O-N 3.32Å
56	T	96.2	Very high	74.4	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.4	-175.5	-54.7	0	0	0	0	110	G54 V58 D82 L83 A84 H105 I107	G54-T56 PolarHBondContact O-N 3.42Å; T56-V58 HydrophobicContact CG2-CG2 4.33Å; T56-D82 PolarHBondContact N-O 2.94Å; T56-L83 HydrophobicContact CG2-CD2 3.93Å; T56-A84 PolarHBondContact O-N 3.28Å; T56-H105 WeakPolarHBondContact CA-O 3.31Å; T56-H105 HydrophobicContact CG2-CB 3.91Å; T56-I107 HydrophobicContact CG2-CD1 3.89Å; T56-I107 HydrophobicContact CG2-CG1 4Å
57	L	96.9	Very high	77.2	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.005	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.7	171.5	-180	62.5	0	0	0	109.2	L59 A84 K86 L93 L95 Y103 H105 L106 I107 I120	L57-L59 HydrophobicContact CD1-CD2 4.27Å; L57-L59 HydrophobicContact CD2-CD2 4.04Å; L57-L59 HydrophobicContact CG-CD2 4Å; L57-L59 HydrophobicContact CG-CG 4.46Å; L57-A84 HydrophobicContact CD1-CB 4.42Å; L57-K86 HydrophobicContact CD1-CB 4.42Å; L57-K86 HydrophobicContact CD1-CD 3.98Å; L57-K86 HydrophobicContact CD1-CG 4.27Å; L57-L93 HydrophobicContact CD1-CD2 4.24Å; L57-L93 HydrophobicContact CD2-CD2 4.13Å; L57-L95 HydrophobicContact CD2-CD2 3.73Å; L57-Y103 HydrophobicContact CB-CD1 3.79Å; L57-Y103 HydrophobicContact CB-CD2 3.93Å; L57-Y103 HydrophobicContact CB-CE1 4.01Å; L57-Y103 HydrophobicContact CB-CE2 4.14Å; L57-Y103 HydrophobicContact CB-CG 3.75Å; L57-Y103 HydrophobicContact CD1-CE1 4.38Å; L57-Y103 HydrophobicContact CD1-CE2 4.3Å; L57-Y103 HydrophobicContact CD2-CD2 4.11Å; L57-Y103 HydrophobicContact CD2-CE2 3.99Å; L57-Y103 HydrophobicContact CG-CE2 4.38Å; L57-H105 PolarHBondContact N-O 2.86Å; L57-L106 HydrophobicContact CB-CD1 4.09Å; L57-L106 HydrophobicContact CD2-CD1 3.99Å; L57-L106 HydrophobicContact CG-CD1 4.09Å; L57-I107 PolarHBondContact O-N 3.24Å; L57-I120 HydrophobicContact CD2-CD1 4.22Å
58	V	97.6	Very high	80.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	113	175.7	-174	0	0	0	0	108.6	T56 L60 F73 L83 A84 F85 K86 I107	T56-V58 HydrophobicContact CG2-CG2 4.33Å; V58-L60 HydrophobicContact CG1-CD2 3.68Å; V58-L60 HydrophobicContact CG1-CG 4.18Å; V58-F73 HydrophobicContact CG1-CE1 3.64Å; V58-F73 HydrophobicContact CG1-CZ 3.75Å; V58-F73 HydrophobicContact CG2-CE1 4.21Å; V58-L83 HydrophobicContact CG2-CD2 4.23Å; V58-A84 PolarHBondContact N-O 2.97Å; V58-F85 HydrophobicContact CB-CD1 3.88Å; V58-F85 HydrophobicContact CB-CE1 4.2Å; V58-F85 HydrophobicContact CG1-CD1 3.91Å; V58-F85 HydrophobicContact CG1-CE1 4.09Å; V58-F85 HydrophobicContact CG2-CD1 4.34Å; V58-F85 HydrophobicContact CG2-CE1 4.23Å; V58-K86 PolarHBondContact O-N 3.29Å; V58-I107 WeakPolarHBondContact CA-O 3.43Å; V58-I107 HydrophobicContact CG1-CB 4.3Å; V58-I107 HydrophobicContact CG1-CG2 4.23Å; V58-I107 HydrophobicContact CG2-CB 4.26Å; V58-I107 HydrophobicContact CG2-CD1 4.26Å
59	L	97.3	Very high	83.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.7	172.8	-57.4	-176.3	0	0	0	109	L57 K86 A88 L93 L106 I107 I108 F109 F116 I120	L57-L59 HydrophobicContact CD1-CD2 4.27Å; L57-L59 HydrophobicContact CD2-CD2 4.04Å; L57-L59 HydrophobicContact CG-CD2 4Å; L57-L59 HydrophobicContact CG-CG 4.46Å; L59-K86 WeakPolarHBondContact CA-O 3.39Å; L59-K86 HydrophobicContact CD2-CB 4.46Å; L59-A88 HydrophobicContact CB-CB 4.43Å; L59-L93 HydrophobicContact CD2-CD1 3.91Å; L59-L93 HydrophobicContact CD2-CD2 3.59Å; L59-L93 HydrophobicContact CD2-CG 4.44Å; L59-L106 HydrophobicContact CD1-CD1 4.14Å; L59-L106 HydrophobicContact CG-CD1 4.13Å; L59-I107 PolarHBondContact N-O 2.8Å; L59-I108 HydrophobicContact CD1-CG1 4.44Å; L59-F109 CarbonylContact O-C 3.59Å; L59-F109 WeakPolarHBondContact O-CA 3.33Å; L59-F109 PolarHBondContact O-N 3.07Å; L59-F116 HydrophobicContact CD1-CD1 3.96Å; L59-F116 HydrophobicContact CD1-CE1 3.86Å; L59-I120 HydrophobicContact CD1-CD1 4.34Å
60	L	96.7	Very high	86	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.5	178.4	-57.3	179.6	0	0	0	109.4	V58 I65 K66 F73 F85 K86 T87 A88 F109	V58-L60 HydrophobicContact CG1-CD2 3.68Å; V58-L60 HydrophobicContact CG1-CG 4.18Å; L60-I65 HydrophobicContact CD2-CB 4.15Å; L60-I65 HydrophobicContact CD2-CG2 3.88Å; L60-K66 HydrophobicContact CD1-CB 4.17Å; L60-F73 HydrophobicContact CD2-CE2 4.49Å; L60-F73 HydrophobicContact CD2-CZ 4.11Å; L60-F85 HydrophobicContact CD1-CD1 3.95Å; L60-K86 PolarHBondContact N-O 3.09Å; L60-T87 CarbonylContact O-C 3.59Å; L60-T87 VanDerWaalsContact O-CA 3.3Å; L60-T87 WeakPolarHBondContact O-CA 3.23Å; L60-A88 PolarHBondContact O-N 2.81Å; L60-F109 WeakPolarHBondContact CA-O 3.47Å; L60-F109 HydrophobicContact CD2-CB 4Å
61	D	92.4	Very high	88.7	Confident	48 Å²	48	56.5 Å²	56.5	26%	0.257	29%	0.291	S	S	.	.	S	Bend	trans	-67.9	-44	168	170.8	62.8	0	0	0	110.5	I65 T87 F109 A110 S112	D61-I65 HydrophobicContact CB-CD1 4.02Å; D61-T87 WeakPolarHBondContact O-CG2 3.43Å; D61-F109 PolarHBondContact N-O 2.88Å; D61-A110 HydrophobicContact CB-CB 4.01Å; D61-S112 PolarHBondContact OD1-OG 3.47Å; D61-S112 PolarHBondContact OD2-OG 3.04Å
62	N	92.9	Very high	91.2	Very high	88 Å²	88	48.7 Å²	48.7	47%	0.471	26%	0.257	S	S	.	.	S	Bend	trans	-135.3	142.6	175.5	-77.5	-72.2	0	0	0	111	N64 I65	N62-N64 PolarHBondContact O-N 3.42Å; N62-N64 VanDerWaalsContact O-N 3.08Å; N62-I65 WeakPolarHBondContact O-CB 3.37Å; N62-I65 WeakPolarHBondContact O-CG1 3.38Å; N62-I65 PolarHBondContact O-N 3.47Å
63	L	92.7	Very high	93.2	Very high	100 Å²	100	48.3 Å²	48.3	52%	0.524	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.3	-179.7	-68.6	177.4	0	0	0	113.4	I65 K66	L63-I65 PolarHBondContact O-N 3.44Å; L63-K66 VanDerWaalsContact O-CB 3.24Å; L63-K66 WeakPolarHBondContact O-CB 3.3Å; L63-K66 PolarHBondContact O-N 3.33Å
64	N	94.2	Very high	94.9	Very high	115 Å²	115	48.4 Å²	48.4	62%	0.615	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.9	175.8	-62.5	-21.7	0	0	0	112.9	N62 K66 D67 T68	N62-N64 PolarHBondContact O-N 3.42Å; N62-N64 VanDerWaalsContact O-N 3.08Å; N64-K66 PolarHBondContact O-N 3.47Å; N64-D67 PolarHBondContact O-N 3.29Å; N64-T68 PolarHBondContact O-N 2.81Å
65	I	94.4	Very high	95.6	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-30.1	178.1	-64.3	172.6	0	0	0	110.8	L60 D61 N62 L63 D67 T68 H69 F109 L270	L60-I65 HydrophobicContact CD2-CB 4.15Å; L60-I65 HydrophobicContact CD2-CG2 3.88Å; D61-I65 HydrophobicContact CB-CD1 4.02Å; N62-I65 WeakPolarHBondContact O-CB 3.37Å; N62-I65 WeakPolarHBondContact O-CG1 3.38Å; N62-I65 PolarHBondContact O-N 3.47Å; L63-I65 PolarHBondContact O-N 3.44Å; I65-D67 VanDerWaalsContact C-N 3.26Å; I65-D67 PolarHBondContact O-N 3.36Å; I65-T68 WeakPolarHBondContact CA-OG1 3.48Å; I65-T68 PolarHBondContact O-N 2.91Å; I65-T68 PolarHBondContact O-OG1 3.07Å; I65-H69 WeakPolarHBondContact O-CB 3.44Å; I65-H69 PolarHBondContact O-N 3.29Å; I65-H69 PolarHBondContact O-ND1 3.46Å; I65-F109 HydrophobicContact CG2-CB 4.44Å; I65-L270 HydrophobicContact CD1-CD2 4.15Å
66	K	94.1	Very high	95.7	Very high	95 Å²	95	43.7 Å²	43.7	41%	0.413	22%	0.221	S	C	.	.	H	α-helix	trans	-59	-37.7	175.3	-173	-179	177.4	-177.9	0	112.6	L60 L63 N64 S70 F85	L60-K66 HydrophobicContact CD1-CB 4.17Å; L63-K66 VanDerWaalsContact O-CB 3.24Å; L63-K66 WeakPolarHBondContact O-CB 3.3Å; L63-K66 PolarHBondContact O-N 3.33Å; N64-K66 PolarHBondContact O-N 3.47Å; K66-S70 PolarHBondContact O-N 2.9Å; K66-F85 HydrophobicContact CD-CD1 4.36Å; K66-F85 HydrophobicContact CD-CD2 4.28Å; K66-F85 HydrophobicContact CD-CE1 4.48Å; K66-F85 HydrophobicContact CD-CE2 4.41Å; K66-F85 HydrophobicContact CD-CG 4.25Å; K66-F85 HydrophobicContact CD-CZ 4.5Å; K66-F85 HydrophobicContact CG-CD1 4.36Å; K66-F85 HydrophobicContact CG-CE1 4.15Å; K66-F85 HydrophobicContact CG-CZ 4.33Å
67	D	95.3	Very high	95.6	Very high	119 Å²	119	46.1 Å²	46.1	64%	0.636	24%	0.241	S	C	*	.	H	α-helix	trans	-82.1	-33.9	-179.1	-65.8	-31.5	0	0	0	111.6	N64 I65	N64-D67 PolarHBondContact O-N 3.29Å; I65-D67 VanDerWaalsContact C-N 3.26Å; I65-D67 PolarHBondContact O-N 3.36Å
68	T	96.6	Very high	95.5	Very high	74 Å²	74	52.5 Å²	52.5	45%	0.454	28%	0.276	S	S	.	.	H	α-helix	trans	-78.5	-19.8	179	61.4	0	0	0	0	114	N64 I65 D275	N64-T68 PolarHBondContact O-N 2.81Å; I65-T68 WeakPolarHBondContact CA-OG1 3.48Å; I65-T68 PolarHBondContact O-N 2.91Å; I65-T68 PolarHBondContact O-OG1 3.07Å; T68-D275 VanDerWaalsContact O-CB 3.28Å; T68-D275 WeakPolarHBondContact O-CB 3.46Å; T68-D275 PolarHBondContact O-N 3.09Å
69	H	97.3	Very high	95.2	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.019	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	29.5	178.2	-62.7	66.3	0	0	0	111.3	I65 I71 F72 F73 L270 F273 D275	I65-H69 WeakPolarHBondContact O-CB 3.44Å; I65-H69 PolarHBondContact O-N 3.29Å; I65-H69 PolarHBondContact O-ND1 3.46Å; H69-I71 VanDerWaalsContact C-N 3.29Å; H69-I71 PolarHBondContact O-N 3.15Å; H69-F72 PolarHBondContact O-N 2.97Å; H69-F73 HydrophobicContact CB-CD2 3.98Å; H69-F73 HydrophobicContact CB-CE2 3.72Å; H69-F73 WeakPolarHBondContact O-CD2 3.23Å; H69-F73 PolarHBondContact O-N 3.41Å; H69-L270 PolarHBondContact NE2-O 3.17Å; H69-F273 PolarHBondContact CD2-O 3.31Å; H69-F273 VanDerWaalsContact CD2-O 3.25Å; H69-D275 VanDerWaalsContact C-OD1 3.31Å
70	S	97	Very high	94.9	Very high	21 Å²	21	55.6 Å²	55.6	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-33.3	-170.4	77.1	0	0	0	0	112.6	K66 R74 D275	K66-S70 PolarHBondContact O-N 2.9Å; S70-R74 WeakPolarHBondContact O-CB 3.31Å; S70-R74 WeakPolarHBondContact O-CD 3.33Å; S70-R74 WeakPolarHBondContact O-CG 3.43Å; S70-R74 PolarHBondContact O-N 2.89Å; S70-D275 WeakPolarHBondContact CB-OD2 3.34Å; S70-D275 PolarHBondContact N-OD1 3.48Å; S70-D275 VanDerWaalsContact N-OD1 3.14Å; S70-D275 PolarHBondContact N-OD2 2.72Å; S70-D275 PolarHBondContact OG-OD2 2.83Å
71	I	97.1	Very high	94.8	Very high	41 Å²	41	56.1 Å²	56.1	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-42.9	179.5	-62.7	169.5	0	0	0	110.2	H69 S75 D275 F278 N279 M298	H69-I71 VanDerWaalsContact C-N 3.29Å; H69-I71 PolarHBondContact O-N 3.15Å; I71-S75 WeakPolarHBondContact O-CB 3.41Å; I71-S75 PolarHBondContact O-N 3.14Å; I71-D275 WeakPolarHBondContact CB-OD1 3.44Å; I71-D275 HydrophobicContact CD1-CB 3.87Å; I71-D275 HydrophobicContact CG1-CB 4.31Å; I71-D275 VanDerWaalsContact CG1-OD1 3.31Å; I71-D275 WeakPolarHBondContact CG1-OD1 3.37Å; I71-D275 PolarHBondContact N-OD1 2.71Å; I71-D275 PolarHBondContact N-OD2 3.14Å; I71-F278 HydrophobicContact CB-CD2 3.97Å; I71-F278 HydrophobicContact CB-CE2 4.38Å; I71-F278 HydrophobicContact CD1-CD2 4.47Å; I71-F278 HydrophobicContact CG2-CD2 3.82Å; I71-F278 HydrophobicContact CG2-CE2 4.25Å; I71-N279 WeakPolarHBondContact CD1-ND2 3.49Å; I71-M298 HydrophobicContact CG2-CE 4.03Å
72	F	97.4	Very high	94.9	Very high	4 Å²	4	58.9 Å²	58.9	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-51.1	177.9	179.4	-105.9	0	0	0	111.3	H69 R74 S75 L76 I107 F109 L136 F273 F278	H69-F72 PolarHBondContact O-N 2.97Å; F72-R74 PolarHBondContact O-N 3.02Å; F72-S75 WeakPolarHBondContact O-CB 3.39Å; F72-S75 PolarHBondContact O-N 3.13Å; F72-L76 HydrophobicContact CD1-CD1 3.98Å; F72-L76 HydrophobicContact CE1-CD1 3.46Å; F72-L76 VanDerWaalsContact CE1-CD1 3.46Å; F72-L76 HydrophobicContact CZ-CD1 3.78Å; F72-L76 PolarHBondContact O-N 3.49Å; F72-L76 VanDerWaalsContact O-N 3.15Å; F72-I107 HydrophobicContact CE1-CD1 4.46Å; F72-F109 AromaticContact CD1-CE2 3.84Å; F72-F109 HydrophobicContact CD1-CE2 3.84Å; F72-F109 HydrophobicContact CD1-CZ 4.02Å; F72-F109 AromaticContact CE1-CE2 3.85Å; F72-F109 HydrophobicContact CE1-CE2 3.85Å; F72-F109 AromaticContact CE1-CZ 3.62Å; F72-F109 HydrophobicContact CE1-CZ 3.62Å; F72-F109 HydrophobicContact CZ-CZ 4.28Å; F72-L136 HydrophobicContact CE1-CD2 4.27Å; F72-L136 HydrophobicContact CZ-CD2 3.88Å; F72-F273 AromaticContact CD2-CD1 3.96Å; F72-F273 HydrophobicContact CD2-CD1 3.96Å; F72-F273 AromaticContact CE2-CD1 3.79Å; F72-F273 HydrophobicContact CE2-CD1 3.79Å; F72-F273 HydrophobicContact CE2-CE1 4.08Å; F72-F273 HydrophobicContact CG-CD1 4.47Å; F72-F273 HydrophobicContact CZ-CD1 4.17Å; F72-F273 HydrophobicContact CZ-CE1 4.36Å; F72-F278 HydrophobicContact CB-CE2 4.06Å; F72-F278 HydrophobicContact CB-CZ 4.45Å
73	F	97.1	Very high	95	Very high	8 Å²	8	55.9 Å²	55.9	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-67.5	-36.9	-179.3	-67.6	-54.9	0	0	0	113.1	V58 L60 H69 S75 L76 A77 L83 F85 F109	V58-F73 HydrophobicContact CG1-CE1 3.64Å; V58-F73 HydrophobicContact CG1-CZ 3.75Å; V58-F73 HydrophobicContact CG2-CE1 4.21Å; L60-F73 HydrophobicContact CD2-CE2 4.49Å; L60-F73 HydrophobicContact CD2-CZ 4.11Å; H69-F73 HydrophobicContact CB-CD2 3.98Å; H69-F73 HydrophobicContact CB-CE2 3.72Å; H69-F73 WeakPolarHBondContact O-CD2 3.23Å; H69-F73 PolarHBondContact O-N 3.41Å; F73-S75 VanDerWaalsContact C-N 3.32Å; F73-S75 PolarHBondContact O-N 2.86Å; F73-L76 HydrophobicContact CD1-CD1 4.31Å; F73-L76 PolarHBondContact O-N 3.46Å; F73-A77 PolarHBondContact O-N 2.96Å; F73-L83 HydrophobicContact CB-CD1 4.14Å; F73-L83 HydrophobicContact CD1-CD1 4.17Å; F73-L83 WeakPolarHBondContact O-CD1 3.32Å; F73-F85 HydrophobicContact CB-CE1 4.49Å; F73-F85 HydrophobicContact CB-CZ 4.14Å; F73-F85 AromaticContact CD1-CE1 3.8Å; F73-F85 HydrophobicContact CD1-CE1 3.8Å; F73-F85 HydrophobicContact CD1-CZ 4.09Å; F73-F85 AromaticContact CD2-CE1 3.97Å; F73-F85 HydrophobicContact CD2-CE1 3.97Å; F73-F85 HydrophobicContact CD2-CZ 4.42Å; F73-F85 AromaticContact CE1-CE1 3.92Å; F73-F85 HydrophobicContact CE1-CE1 3.92Å; F73-F85 HydrophobicContact CE2-CE1 4.07Å; F73-F85 AromaticContact CG-CE1 3.83Å; F73-F85 HydrophobicContact CG-CE1 3.83Å; F73-F85 AromaticContact CG-CZ 3.97Å; F73-F85 HydrophobicContact CG-CZ 3.97Å; F73-F85 HydrophobicContact CZ-CE1 4.05Å; F73-F109 HydrophobicContact CE1-CD2 4.26Å; F73-F109 HydrophobicContact CE1-CE2 4.12Å; F73-F109 HydrophobicContact CE2-CD2 4.29Å; F73-F109 HydrophobicContact CE2-CE2 4.45Å; F73-F109 AromaticContact CZ-CD2 3.52Å; F73-F109 HydrophobicContact CZ-CD2 3.52Å; F73-F109 AromaticContact CZ-CE2 3.71Å; F73-F109 HydrophobicContact CZ-CE2 3.71Å
74	R	96.3	Very high	95.2	Very high	162 Å²	162	52.6 Å²	52.6	61%	0.611	29%	0.285	S	S	*	.	H	α-helix	trans	-61	-42.6	172	-76.9	173.1	-174.9	171.7	6.4	111	S70 F72 L76 A77 D78	S70-R74 WeakPolarHBondContact O-CB 3.31Å; S70-R74 WeakPolarHBondContact O-CD 3.33Å; S70-R74 WeakPolarHBondContact O-CG 3.43Å; S70-R74 PolarHBondContact O-N 2.89Å; F72-R74 PolarHBondContact O-N 3.02Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 3.42Å; R74-A77 PolarHBondContact O-N 3.49Å; R74-D78 WeakPolarHBondContact O-CB 3.42Å; R74-D78 PolarHBondContact O-N 2.83Å
75	S	95.4	Very high	95.3	Very high	19 Å²	19	49.8 Å²	49.8	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-37.6	176.3	-172.6	0	0	0	0	112.9	I71 F72 F73 R79	I71-S75 WeakPolarHBondContact O-CB 3.41Å; I71-S75 PolarHBondContact O-N 3.14Å; F72-S75 WeakPolarHBondContact O-CB 3.39Å; F72-S75 PolarHBondContact O-N 3.13Å; F73-S75 VanDerWaalsContact C-N 3.32Å; F73-S75 PolarHBondContact O-N 2.86Å; S75-R79 WeakPolarHBondContact O-CG 3.44Å; S75-R79 PolarHBondContact O-N 2.76Å; S75-R79 PolarHBondContact OG-NH1 3.38Å
76	L	94.8	Very high	95.3	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.1	-47.2	174.2	-76.1	162.8	0	0	0	111.7	F72 F73 R74 D78 R79 G80 F81 L83 I107 F309	F72-L76 HydrophobicContact CD1-CD1 3.98Å; F72-L76 HydrophobicContact CE1-CD1 3.46Å; F72-L76 VanDerWaalsContact CE1-CD1 3.46Å; F72-L76 HydrophobicContact CZ-CD1 3.78Å; F72-L76 PolarHBondContact O-N 3.49Å; F72-L76 VanDerWaalsContact O-N 3.15Å; F73-L76 HydrophobicContact CD1-CD1 4.31Å; F73-L76 PolarHBondContact O-N 3.46Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 3.42Å; L76-D78 VanDerWaalsContact C-N 3.34Å; L76-D78 PolarHBondContact O-N 3.29Å; L76-R79 VanDerWaalsContact CD2-NH2 3.26Å; L76-R79 PolarHBondContact O-N 3.35Å; L76-G80 PolarHBondContact O-N 3.46Å; L76-F81 HydrophobicContact CB-CD2 4.22Å; L76-F81 HydrophobicContact CD2-CD2 3.63Å; L76-F81 HydrophobicContact CD2-CE2 3.78Å; L76-F81 HydrophobicContact CD2-CG 4.48Å; L76-F81 WeakPolarHBondContact O-CD2 3.49Å; L76-F81 PolarHBondContact O-N 3.47Å; L76-L83 HydrophobicContact CB-CD1 4.09Å; L76-L83 HydrophobicContact CB-CD2 4.28Å; L76-I107 HydrophobicContact CD1-CD1 3.84Å; L76-F309 HydrophobicContact CD2-CD2 3.78Å; L76-F309 HydrophobicContact CD2-CE2 3.65Å
77	A	94.3	Very high	95.4	Very high	52 Å²	52	48.3 Å²	48.3	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-40.9	178.5	0	0	0	0	0	112.2	F73 R74 R79 G80 L83	F73-A77 PolarHBondContact O-N 2.96Å; R74-A77 PolarHBondContact O-N 3.49Å; A77-R79 PolarHBondContact O-N 2.9Å; A77-G80 PolarHBondContact O-N 2.94Å; A77-L83 HydrophobicContact CB-CD1 4.46Å
78	D	94	Very high	95.4	Very high	135 Å²	135	42.9 Å²	42.9	72%	0.722	24%	0.235	S	C	*	.	H	α-helix	trans	-63.9	-28.6	177.7	-71.3	-19	0	0	0	112.3	R74 L76 G80	R74-D78 WeakPolarHBondContact O-CB 3.42Å; R74-D78 PolarHBondContact O-N 2.83Å; L76-D78 VanDerWaalsContact C-N 3.34Å; L76-D78 PolarHBondContact O-N 3.29Å; D78-G80 VanDerWaalsContact C-N 3.32Å
79	R	91.2	Very high	95.1	Very high	35 Å²	35	44.5 Å²	44.5	13%	0.132	24%	0.241	C	C	.	.	H	α-helix	trans	-79.5	-12.3	173.4	-69.7	-166.8	-52.1	-106.9	10.7	113.6	A52 S75 L76 A77 F81 S305 E311	A52-R79 HydrophobicContact CB-CB 4.48Å; A52-R79 WeakPolarHBondContact CB-O 3.43Å; A52-R79 PolarHBondContact N-O 2.89Å; S75-R79 WeakPolarHBondContact O-CG 3.44Å; S75-R79 PolarHBondContact O-N 2.76Å; S75-R79 PolarHBondContact OG-NH1 3.38Å; L76-R79 VanDerWaalsContact CD2-NH2 3.26Å; L76-R79 PolarHBondContact O-N 3.35Å; A77-R79 PolarHBondContact O-N 2.9Å; R79-F81 HydrophobicContact CB-CD2 4.39Å; R79-F81 HydrophobicContact CB-CE2 4.39Å; R79-S305 PolarHBondContact NH2-OG 3.34Å; R79-E311 WeakPolarHBondContact CD-OE2 3.14Å; R79-E311 IonicContact NE-OE1 3.13Å; R79-E311 PolarHBondContact NE-OE1 3.34Å; R79-E311 IonicContact NE-OE2 2.68Å; R79-E311 PolarHBondContact NE-OE2 3.26Å
80	G	91.3	Very high	95	Very high	30 Å²	30	46.1 Å²	46.1	31%	0.309	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	111.4	2.4	172.4	0	0	0	0	0	116.1	A52 L76 A77 D78	A52-G80 CarbonylContact O-C 3.3Å; A52-G80 VanDerWaalsContact O-C 3.24Å; A52-G80 VanDerWaalsContact O-O 3.12Å; L76-G80 PolarHBondContact O-N 3.46Å; A77-G80 PolarHBondContact O-N 2.94Å; D78-G80 VanDerWaalsContact C-N 3.32Å
81	F	94.1	Very high	94.7	Very high	10 Å²	10	50.3 Å²	50.3	4%	0.044	28%	0.276	C	S	.	.			trans	-68.2	138.1	177	-66.2	-75	0	0	0	112.2	A52 L76 R79 L83 H105 F309 E311	A52-F81 HydrophobicContact CB-CD1 4.22Å; A52-F81 HydrophobicContact CB-CD2 4.06Å; A52-F81 HydrophobicContact CB-CE1 3.77Å; A52-F81 HydrophobicContact CB-CE2 3.61Å; A52-F81 HydrophobicContact CB-CG 4.35Å; A52-F81 HydrophobicContact CB-CZ 3.44Å; A52-F81 VanDerWaalsContact CB-CZ 3.44Å; L76-F81 HydrophobicContact CB-CD2 4.22Å; L76-F81 HydrophobicContact CD2-CD2 3.63Å; L76-F81 HydrophobicContact CD2-CE2 3.78Å; L76-F81 HydrophobicContact CD2-CG 4.48Å; L76-F81 WeakPolarHBondContact O-CD2 3.49Å; L76-F81 PolarHBondContact O-N 3.47Å; R79-F81 HydrophobicContact CB-CD2 4.39Å; R79-F81 HydrophobicContact CB-CE2 4.39Å; F81-L83 HydrophobicContact CB-CD2 4.08Å; F81-L83 PolarHBondContact O-N 3.42Å; F81-H105 AromaticContact CD1-CD2 3.86Å; F81-H105 AromaticContact CE1-CD2 3.5Å; F81-H105 VanDerWaalsContact CE1-CD2 3.5Å; F81-H105 WeakPolarHBondContact CE1-CD2 3.11Å; F81-H105 AromaticContact CE1-NE2 3.57Å; F81-F309 HydrophobicContact CE1-CB 3.91Å; F81-F309 HydrophobicContact CE1-CG 4.34Å; F81-F309 HydrophobicContact CE2-CB 4.45Å; F81-F309 HydrophobicContact CE2-CD2 4.3Å; F81-F309 HydrophobicContact CZ-CB 3.52Å; F81-F309 HydrophobicContact CZ-CD2 4.09Å; F81-F309 HydrophobicContact CZ-CG 4.08Å; F81-E311 WeakPolarHBondContact CE2-OE1 3.48Å; F81-E311 HydrophobicContact CZ-CG 4.26Å; F81-E311 WeakPolarHBondContact CZ-OE1 3.47Å
82	D	95.1	Very high	94.5	Very high	106 Å²	106	51.9 Å²	51.9	57%	0.567	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	101.4	173.4	-173.8	18	0	0	0	109.7	G54 T56	G54-D82 PolarHBondContact O-N 2.71Å; T56-D82 PolarHBondContact N-O 2.94Å
83	L	95.7	Very high	94.2	Very high	26 Å²	26	51.9 Å²	51.9	14%	0.136	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	111.8	-174.3	-57.7	-177.8	0	0	0	111.4	T56 V58 F73 L76 A77 F81 F85	T56-L83 HydrophobicContact CG2-CD2 3.93Å; V58-L83 HydrophobicContact CG2-CD2 4.23Å; F73-L83 HydrophobicContact CB-CD1 4.14Å; F73-L83 HydrophobicContact CD1-CD1 4.17Å; F73-L83 WeakPolarHBondContact O-CD1 3.32Å; L76-L83 HydrophobicContact CB-CD1 4.09Å; L76-L83 HydrophobicContact CB-CD2 4.28Å; A77-L83 HydrophobicContact CB-CD1 4.46Å; F81-L83 HydrophobicContact CB-CD2 4.08Å; F81-L83 PolarHBondContact O-N 3.42Å; L83-F85 HydrophobicContact CB-CD2 4.43Å; L83-F85 HydrophobicContact CB-CE2 3.72Å; L83-F85 HydrophobicContact CB-CZ 3.92Å; L83-F85 HydrophobicContact CD1-CE2 4.31Å; L83-F85 HydrophobicContact CD1-CZ 3.82Å
84	A	95.7	Very high	94	Very high	31 Å²	31	53 Å²	53	26%	0.256	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	106.8	170.6	0	0	0	0	0	110.1	T56 L57 V58 Y103	T56-A84 PolarHBondContact O-N 3.28Å; L57-A84 HydrophobicContact CD1-CB 4.42Å; V58-A84 PolarHBondContact N-O 2.97Å; A84-Y103 HydrophobicContact CB-CE1 4Å
85	F	96.4	Very high	93.7	Very high	55 Å²	55	45.2 Å²	45.2	24%	0.241	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.1	177.9	-60.7	-86.1	0	0	0	111	V58 L60 K66 F73 L83	V58-F85 HydrophobicContact CB-CD1 3.88Å; V58-F85 HydrophobicContact CB-CE1 4.2Å; V58-F85 HydrophobicContact CG1-CD1 3.91Å; V58-F85 HydrophobicContact CG1-CE1 4.09Å; V58-F85 HydrophobicContact CG2-CD1 4.34Å; V58-F85 HydrophobicContact CG2-CE1 4.23Å; L60-F85 HydrophobicContact CD1-CD1 3.95Å; K66-F85 HydrophobicContact CD-CD1 4.36Å; K66-F85 HydrophobicContact CD-CD2 4.28Å; K66-F85 HydrophobicContact CD-CE1 4.48Å; K66-F85 HydrophobicContact CD-CE2 4.41Å; K66-F85 HydrophobicContact CD-CG 4.25Å; K66-F85 HydrophobicContact CD-CZ 4.5Å; K66-F85 HydrophobicContact CG-CD1 4.36Å; K66-F85 HydrophobicContact CG-CE1 4.15Å; K66-F85 HydrophobicContact CG-CZ 4.33Å; F73-F85 HydrophobicContact CB-CE1 4.49Å; F73-F85 HydrophobicContact CB-CZ 4.14Å; F73-F85 AromaticContact CD1-CE1 3.8Å; F73-F85 HydrophobicContact CD1-CE1 3.8Å; F73-F85 HydrophobicContact CD1-CZ 4.09Å; F73-F85 AromaticContact CD2-CE1 3.97Å; F73-F85 HydrophobicContact CD2-CE1 3.97Å; F73-F85 HydrophobicContact CD2-CZ 4.42Å; F73-F85 AromaticContact CE1-CE1 3.92Å; F73-F85 HydrophobicContact CE1-CE1 3.92Å; F73-F85 HydrophobicContact CE2-CE1 4.07Å; F73-F85 AromaticContact CG-CE1 3.83Å; F73-F85 HydrophobicContact CG-CE1 3.83Å; F73-F85 AromaticContact CG-CZ 3.97Å; F73-F85 HydrophobicContact CG-CZ 3.97Å; F73-F85 HydrophobicContact CZ-CE1 4.05Å; L83-F85 HydrophobicContact CB-CD2 4.43Å; L83-F85 HydrophobicContact CB-CE2 3.72Å; L83-F85 HydrophobicContact CB-CZ 3.92Å; L83-F85 HydrophobicContact CD1-CE2 4.31Å; L83-F85 HydrophobicContact CD1-CZ 3.82Å
86	K	96.1	Very high	93.5	Very high	45 Å²	45	46.5 Å²	46.5	20%	0.196	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	153	175.1	-71.1	-172.7	159.4	-129.6	0	110.5	L57 V58 L59 L60 D90 S92 L93	L57-K86 HydrophobicContact CD1-CB 4.42Å; L57-K86 HydrophobicContact CD1-CD 3.98Å; L57-K86 HydrophobicContact CD1-CG 4.27Å; V58-K86 PolarHBondContact O-N 3.29Å; L59-K86 WeakPolarHBondContact CA-O 3.39Å; L59-K86 HydrophobicContact CD2-CB 4.46Å; L60-K86 PolarHBondContact N-O 3.09Å; K86-D90 IonicContact NZ-OD2 3.29Å; K86-D90 PolarHBondContact NZ-OD2 3.3Å; K86-S92 PolarHBondContact NZ-OG 3.43Å; K86-L93 HydrophobicContact CB-CD2 3.93Å; K86-L93 HydrophobicContact CD-CD2 3.3Å; K86-L93 HydrophobicContact CD-CG 4.18Å; K86-L93 HydrophobicContact CG-CD2 4.26Å
87	T	95.9	Very high	93.2	Very high	38 Å²	38	51.7 Å²	51.7	23%	0.233	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	144	170.1	-40.2	0	0	0	0	109.3	L60 D61 D89 D90 L93	L60-T87 CarbonylContact O-C 3.59Å; L60-T87 VanDerWaalsContact O-CA 3.3Å; L60-T87 WeakPolarHBondContact O-CA 3.23Å; D61-T87 WeakPolarHBondContact O-CG2 3.43Å; T87-D89 WeakPolarHBondContact CB-OD1 3.3Å; T87-D89 WeakPolarHBondContact CG2-OD1 3.24Å; T87-D89 PolarHBondContact O-N 3.44Å; T87-D90 WeakPolarHBondContact O-CB 3.49Å; T87-D90 PolarHBondContact O-N 2.82Å; T87-L93 WeakPolarHBondContact O-CD1 3.45Å
88	A	93.9	Very high	93	Very high	4 Å²	4	59.5 Å²	59.5	3%	0.033	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.8	-175.6	0	0	0	0	0	114.1	L59 L60 L93 A110 V113 F116 G117	L59-A88 HydrophobicContact CB-CB 4.43Å; L60-A88 PolarHBondContact O-N 2.81Å; A88-L93 WeakPolarHBondContact O-CD1 3.43Å; A88-A110 HydrophobicContact CB-CB 3.63Å; A88-V113 HydrophobicContact CB-CB 4.34Å; A88-V113 HydrophobicContact CB-CG2 3.89Å; A88-F116 HydrophobicContact CB-CD1 4.32Å; A88-F116 HydrophobicContact CB-CE1 4.48Å; A88-G117 PolarHBondContact O-N 2.63Å
89	D	91.8	Very high	92.6	Very high	109 Å²	109	56.3 Å²	56.3	58%	0.583	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	2.2	-179.9	67.7	-21.8	0	0	0	114.2	T87 P91	T87-D89 WeakPolarHBondContact CB-OD1 3.3Å; T87-D89 WeakPolarHBondContact CG2-OD1 3.24Å; T87-D89 PolarHBondContact O-N 3.44Å; D89-P91 WeakPolarHBondContact O-CD 3.42Å
90	D	93.5	Very high	92.5	Very high	37 Å²	37	61.6 Å²	61.6	20%	0.198	34%	0.343	C	S	.	.			trans	-64.6	119	-175.9	170	14.1	0	0	0	111.6	K86 T87 S92 L93 G117	K86-D90 IonicContact NZ-OD2 3.29Å; K86-D90 PolarHBondContact NZ-OD2 3.3Å; T87-D90 WeakPolarHBondContact O-CB 3.49Å; T87-D90 PolarHBondContact O-N 2.82Å; D90-S92 PolarHBondContact O-N 3.41Å; D90-S92 VanDerWaalsContact O-N 3.09Å; D90-S92 WeakPolarHBondContact OD1-CB 3.46Å; D90-S92 PolarHBondContact OD1-N 2.95Å; D90-S92 PolarHBondContact OD1-OG 3.19Å; D90-S92 PolarHBondContact OD2-OG 3.25Å; D90-L93 HydrophobicContact CB-CD1 4.04Å; D90-L93 HydrophobicContact CB-CG 3.94Å; D90-L93 VanDerWaalsContact O-CB 3.26Å; D90-L93 WeakPolarHBondContact O-CB 3.37Å; D90-L93 WeakPolarHBondContact O-CD1 3.49Å; D90-L93 VanDerWaalsContact O-CG 3.25Å; D90-L93 WeakPolarHBondContact O-CG 3.44Å; D90-L93 PolarHBondContact O-N 2.9Å; D90-L93 VanDerWaalsContact O-N 3.11Å; D90-G117 CarbonylContact O-C 3.52Å; D90-G117 WeakPolarHBondContact O-CA 3.37Å
91	P	92.1	Very high	92.5	Very high	110 Å²	110	64.3 Å²	64.3	71%	0.714	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-14	-177.6	28.2	-36.1	0	0	0	113.8	D89 L93 G118	D89-P91 WeakPolarHBondContact O-CD 3.42Å; P91-L93 VanDerWaalsContact C-N 3.29Å; P91-G118 VanDerWaalsContact O-CA 3.26Å; P91-G118 WeakPolarHBondContact O-CA 3.5Å
92	S	91.7	Very high	92.5	Very high	73 Å²	73	67 Å²	67	51%	0.51	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.8	176.9	76.2	0	0	0	0	113.8	K86 D90	K86-S92 PolarHBondContact NZ-OG 3.43Å; D90-S92 PolarHBondContact O-N 3.41Å; D90-S92 VanDerWaalsContact O-N 3.09Å; D90-S92 WeakPolarHBondContact OD1-CB 3.46Å; D90-S92 PolarHBondContact OD1-N 2.95Å; D90-S92 PolarHBondContact OD1-OG 3.19Å; D90-S92 PolarHBondContact OD2-OG 3.25Å
93	L	92.6	Very high	92.5	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.021	34%	0.342	C	S	.	.			trans	-66.6	131.3	178.5	-79.8	170	0	0	0	112.2	L57 L59 K86 T87 A88 D90 P91 G117 N119 I120	L57-L93 HydrophobicContact CD1-CD2 4.24Å; L57-L93 HydrophobicContact CD2-CD2 4.13Å; L59-L93 HydrophobicContact CD2-CD1 3.91Å; L59-L93 HydrophobicContact CD2-CD2 3.59Å; L59-L93 HydrophobicContact CD2-CG 4.44Å; K86-L93 HydrophobicContact CB-CD2 3.93Å; K86-L93 HydrophobicContact CD-CD2 3.3Å; K86-L93 HydrophobicContact CD-CG 4.18Å; K86-L93 HydrophobicContact CG-CD2 4.26Å; T87-L93 WeakPolarHBondContact O-CD1 3.45Å; A88-L93 WeakPolarHBondContact O-CD1 3.43Å; D90-L93 HydrophobicContact CB-CD1 4.04Å; D90-L93 HydrophobicContact CB-CG 3.94Å; D90-L93 VanDerWaalsContact O-CB 3.26Å; D90-L93 WeakPolarHBondContact O-CB 3.37Å; D90-L93 WeakPolarHBondContact O-CD1 3.49Å; D90-L93 VanDerWaalsContact O-CG 3.25Å; D90-L93 WeakPolarHBondContact O-CG 3.44Å; D90-L93 PolarHBondContact O-N 2.9Å; D90-L93 VanDerWaalsContact O-N 3.11Å; P91-L93 VanDerWaalsContact C-N 3.29Å; L93-G117 WeakPolarHBondContact CB-O 2.97Å; L93-N119 PolarHBondContact O-N 3.34Å; L93-N119 PolarHBondContact O-OD1 3.29Å; L93-I120 HydrophobicContact CB-CD1 3.81Å; L93-I120 HydrophobicContact CB-CG1 4.14Å; L93-I120 HydrophobicContact CD1-CD1 4.29Å; L93-I120 HydrophobicContact CD2-CD1 4.09Å; L93-I120 HydrophobicContact CG-CD1 4.31Å
94	S	92.3	Very high	92.4	Very high	31 Å²	31	66.7 Å²	66.7	22%	0.217	36%	0.357	C	S	.	.			trans	-152.3	135.5	166.5	53.3	0	0	0	0	114	Y103 N119	S94-Y103 WeakPolarHBondContact O-CE2 3.49Å; S94-N119 WeakPolarHBondContact CA-OD1 3.38Å; S94-N119 WeakPolarHBondContact CB-OD1 2.99Å
95	L	90.6	Very high	92.5	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.347	C	S	.	.	S	Bend	trans	-91.2	-39.2	174.5	-70.5	172.5	0	0	0	111.7	L57 L102 Y103 L106 I120 T124 I125	L57-L95 HydrophobicContact CD2-CD2 3.73Å; L95-L102 PolarHBondContact O-N 3.33Å; L95-Y103 HydrophobicContact CD2-CD2 4.29Å; L95-L106 HydrophobicContact CD1-CD2 4.2Å; L95-L106 HydrophobicContact CD2-CD1 4.25Å; L95-L106 HydrophobicContact CD2-CD2 4.48Å; L95-I120 HydrophobicContact CD1-CD1 4.24Å; L95-I120 HydrophobicContact CD1-CG1 4.23Å; L95-I120 HydrophobicContact CD1-CG2 4.28Å; L95-I120 HydrophobicContact CD2-CD1 4.45Å; L95-I120 HydrophobicContact CG-CD1 3.89Å; L95-I120 HydrophobicContact CG-CG1 4.04Å; L95-T124 HydrophobicContact CB-CG2 4.22Å; L95-T124 HydrophobicContact CD1-CG2 4.18Å; L95-I125 HydrophobicContact CD1-CG1 4.21Å
96	I	89.9	Confident	92.5	Very high	46 Å²	46	63.1 Å²	63.1	24%	0.236	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.7	-176.2	-50.5	176.3	0	0	0	108.9	Q100 F101 N119 T124	I96-Q100 WeakPolarHBondContact CA-O 3.27Å; I96-F101 HydrophobicContact CD1-CD1 4.16Å; I96-F101 HydrophobicContact CD1-CE1 3.55Å; I96-F101 HydrophobicContact CD1-CZ 4.37Å; I96-F101 HydrophobicContact CG1-CD1 3.64Å; I96-F101 HydrophobicContact CG1-CE1 3.57Å; I96-N119 PolarHBondContact O-ND2 3.32Å; I96-T124 HydrophobicContact CD1-CG2 4.21Å; I96-T124 HydrophobicContact CG1-CG2 4.41Å
97	K	89.7	Confident	92.6	Very high	109 Å²	109	61 Å²	61	47%	0.474	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	124.7	172.7	-164.6	175.7	-175.9	173.7	0	109.8	G99 Q100 L102	K97-G99 PolarHBondContact O-N 2.78Å; K97-Q100 PolarHBondContact N-O 3.35Å; K97-Q100 PolarHBondContact O-N 2.95Å; K97-Q100 VanDerWaalsContact O-N 3.07Å; K97-L102 HydrophobicContact CB-CD1 3.99Å; K97-L102 HydrophobicContact CB-CD2 4.14Å; K97-L102 HydrophobicContact CB-CG 4.17Å
98	Y	89	Confident	92.7	Very high	215 Å²	215	59.2 Å²	59.2	84%	0.843	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	35.4	-176.3	-49.7	-61.5	0	0	0	114	Q100	Y98-Q100 VanDerWaalsContact C-N 3.29Å; Y98-Q100 PolarHBondContact O-N 3.01Å
99	G	85.4	Confident	92.9	Very high	69 Å²	69	59 Å²	59	71%	0.711	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	9.6	180	0	0	0	0	0	115.2	K97	K97-G99 PolarHBondContact O-N 2.78Å
100	Q	89.1	Confident	93.1	Very high	145 Å²	145	53.8 Å²	53.8	68%	0.678	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.2	172.1	-66.3	-174.3	-7.8	0	0	110.7	I96 K97 Y98	I96-Q100 WeakPolarHBondContact CA-O 3.27Å; K97-Q100 PolarHBondContact N-O 3.35Å; K97-Q100 PolarHBondContact O-N 2.95Å; K97-Q100 VanDerWaalsContact O-N 3.07Å; Y98-Q100 VanDerWaalsContact C-N 3.29Å; Y98-Q100 PolarHBondContact O-N 3.01Å
101	F	92.3	Very high	93.2	Very high	88 Å²	88	52.4 Å²	52.4	39%	0.386	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.5	170.9	-63.4	-66.4	0	0	0	109.7	I96 F128	I96-F101 HydrophobicContact CD1-CD1 4.16Å; I96-F101 HydrophobicContact CD1-CE1 3.55Å; I96-F101 HydrophobicContact CD1-CZ 4.37Å; I96-F101 HydrophobicContact CG1-CD1 3.64Å; I96-F101 HydrophobicContact CG1-CE1 3.57Å; F101-F128 AromaticContact CD1-CD2 3.59Å; F101-F128 HydrophobicContact CD1-CD2 3.59Å; F101-F128 HydrophobicContact CD1-CE2 4.23Å; F101-F128 HydrophobicContact CE1-CB 4.22Å; F101-F128 AromaticContact CE1-CD2 3.87Å; F101-F128 HydrophobicContact CE1-CD2 3.87Å; F101-F128 HydrophobicContact CG-CD2 4.31Å
102	L	93	Very high	93.3	Very high	67 Å²	67	49.3 Å²	49.3	35%	0.351	26%	0.259	S	S	.	.	S	Bend	trans	-83.1	-22.3	-179.4	-65.3	179.4	0	0	0	113	L95 K97	L95-L102 PolarHBondContact O-N 3.33Å; K97-L102 HydrophobicContact CB-CD1 3.99Å; K97-L102 HydrophobicContact CB-CD2 4.14Å; K97-L102 HydrophobicContact CB-CG 4.17Å
103	Y	94.9	Very high	93.5	Very high	40 Å²	40	46.3 Å²	46.3	16%	0.157	24%	0.238	C	C	.	.			trans	-130	152.3	-177	-57.8	-81.1	0	0	0	109.2	K55 L57 A84 S94 L95 F128	K55-Y103 HydrophobicContact CB-CD1 3.99Å; L57-Y103 HydrophobicContact CB-CD1 3.79Å; L57-Y103 HydrophobicContact CB-CD2 3.93Å; L57-Y103 HydrophobicContact CB-CE1 4.01Å; L57-Y103 HydrophobicContact CB-CE2 4.14Å; L57-Y103 HydrophobicContact CB-CG 3.75Å; L57-Y103 HydrophobicContact CD1-CE1 4.38Å; L57-Y103 HydrophobicContact CD1-CE2 4.3Å; L57-Y103 HydrophobicContact CD2-CD2 4.11Å; L57-Y103 HydrophobicContact CD2-CE2 3.99Å; L57-Y103 HydrophobicContact CG-CE2 4.38Å; A84-Y103 HydrophobicContact CB-CE1 4Å; S94-Y103 WeakPolarHBondContact O-CE2 3.49Å; L95-Y103 HydrophobicContact CD2-CD2 4.29Å; Y103-F128 VanDerWaalsContact O-CE2 3.31Å; Y103-F128 WeakPolarHBondContact O-CE2 3.48Å
104	D	94.4	Very high	93.4	Very high	84 Å²	84	51.4 Å²	51.4	45%	0.449	26%	0.262	S	S	.	.	S	Bend	trans	-96.8	-26.4	177	-55.6	-64.7	0	0	0	111.3	G54 K55 N134	G54-D104 WeakPolarHBondContact CA-OD2 3.15Å; K55-D104 PolarHBondContact N-OD2 3.48Å; K55-D104 PolarHBondContact O-N 3.21Å; D104-N134 PolarHBondContact O-N 3.15Å
105	H	96.8	Very high	93.4	Very high	12 Å²	12	56.3 Å²	56.3	6%	0.056	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	146.5	-176.3	-56.2	-30	0	0	0	111.3	K55 T56 L57 F81 N134 F309	K55-H105 PolarHBondContact O-N 3.32Å; T56-H105 WeakPolarHBondContact CA-O 3.31Å; T56-H105 HydrophobicContact CG2-CB 3.91Å; L57-H105 PolarHBondContact N-O 2.86Å; F81-H105 AromaticContact CD1-CD2 3.86Å; F81-H105 AromaticContact CE1-CD2 3.5Å; F81-H105 VanDerWaalsContact CE1-CD2 3.5Å; F81-H105 WeakPolarHBondContact CE1-CD2 3.11Å; F81-H105 AromaticContact CE1-NE2 3.57Å; H105-N134 WeakPolarHBondContact CA-O 3.16Å; H105-N134 PolarHBondContact CE1-ND2 2.7Å; H105-N134 PolarHBondContact ND1-ND2 2.68Å; H105-F309 HydrophobicContact CB-CD1 3.73Å; H105-F309 HydrophobicContact CB-CE1 3.7Å; H105-F309 AromaticContact CD2-CD1 3.63Å; H105-F309 AromaticContact CD2-CG 3.92Å; H105-F309 AromaticContact CG-CD1 3.39Å; H105-F309 AromaticContact CG-CE1 3.92Å; H105-F309 AromaticContact ND1-CD1 3.79Å
106	L	97.5	Very high	93.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.3	177.2	179.3	61.6	0	0	0	109.7	L57 L59 L95 I108 I125 F128 N134 V135 L136	L57-L106 HydrophobicContact CB-CD1 4.09Å; L57-L106 HydrophobicContact CD2-CD1 3.99Å; L57-L106 HydrophobicContact CG-CD1 4.09Å; L59-L106 HydrophobicContact CD1-CD1 4.14Å; L59-L106 HydrophobicContact CG-CD1 4.13Å; L95-L106 HydrophobicContact CD1-CD2 4.2Å; L95-L106 HydrophobicContact CD2-CD1 4.25Å; L95-L106 HydrophobicContact CD2-CD2 4.48Å; L106-I108 HydrophobicContact CD1-CG1 4.39Å; L106-I108 HydrophobicContact CD2-CD1 4.02Å; L106-I108 HydrophobicContact CD2-CG1 4.18Å; L106-I108 HydrophobicContact CG-CD1 4.34Å; L106-I108 HydrophobicContact CG-CG1 3.94Å; L106-I125 HydrophobicContact CD2-CG1 4.36Å; L106-I125 HydrophobicContact CD2-CG2 4.26Å; L106-F128 HydrophobicContact CB-CD1 4.48Å; L106-F128 HydrophobicContact CB-CE1 3.84Å; L106-F128 HydrophobicContact CB-CZ 4.44Å; L106-N134 PolarHBondContact N-O 2.94Å; L106-V135 HydrophobicContact CB-CG1 4.38Å; L106-V135 HydrophobicContact CB-CG2 4.25Å; L106-V135 HydrophobicContact CD2-CG1 4.25Å; L106-V135 HydrophobicContact CD2-CG2 4.43Å; L106-V135 HydrophobicContact CG-CG1 4.34Å; L106-V135 CarbonylContact O-C 3.55Å; L106-V135 VanDerWaalsContact O-CA 3.3Å; L106-V135 WeakPolarHBondContact O-CA 3.21Å; L106-L136 PolarHBondContact O-N 2.86Å
107	I	98.3	Very high	93.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	126.3	171.7	-61.1	178.9	0	0	0	107.8	T56 L57 V58 L59 F72 L76 F109 L136 F309	T56-I107 HydrophobicContact CG2-CD1 3.89Å; T56-I107 HydrophobicContact CG2-CG1 4Å; L57-I107 PolarHBondContact O-N 3.24Å; V58-I107 WeakPolarHBondContact CA-O 3.43Å; V58-I107 HydrophobicContact CG1-CB 4.3Å; V58-I107 HydrophobicContact CG1-CG2 4.23Å; V58-I107 HydrophobicContact CG2-CB 4.26Å; V58-I107 HydrophobicContact CG2-CD1 4.26Å; L59-I107 PolarHBondContact N-O 2.8Å; F72-I107 HydrophobicContact CE1-CD1 4.46Å; L76-I107 HydrophobicContact CD1-CD1 3.84Å; I107-F109 HydrophobicContact CG2-CD1 3.6Å; I107-F109 HydrophobicContact CG2-CD2 4.33Å; I107-F109 HydrophobicContact CG2-CE1 3.63Å; I107-F109 HydrophobicContact CG2-CE2 4.34Å; I107-F109 HydrophobicContact CG2-CG 3.97Å; I107-F109 HydrophobicContact CG2-CZ 4.01Å; I107-L136 CarbonylContact C-O 3.24Å; I107-L136 WeakPolarHBondContact CA-O 3.25Å; I107-L136 HydrophobicContact CG1-CB 4.25Å; I107-L136 HydrophobicContact CG1-CD2 4.39Å; I107-L136 HydrophobicContact CG2-CD2 4.09Å; I107-F309 HydrophobicContact CD1-CE2 4.08Å; I107-F309 HydrophobicContact CD1-CZ 3.68Å; I107-F309 HydrophobicContact CG1-CE1 4.42Å; I107-F309 HydrophobicContact CG1-CZ 3.67Å
108	I	97.9	Very high	93.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	95.6	178.4	-46.8	-179.2	0	0	0	108.5	L59 L106 A110 F116 I125 V135 L136 V137 A138 L147 L150	L59-I108 HydrophobicContact CD1-CG1 4.44Å; L106-I108 HydrophobicContact CD1-CG1 4.39Å; L106-I108 HydrophobicContact CD2-CD1 4.02Å; L106-I108 HydrophobicContact CD2-CG1 4.18Å; L106-I108 HydrophobicContact CG-CD1 4.34Å; L106-I108 HydrophobicContact CG-CG1 3.94Å; I108-A110 HydrophobicContact CG2-CB 4.24Å; I108-F116 HydrophobicContact CD1-CZ 4.24Å; I108-F116 HydrophobicContact CG2-CE1 4.07Å; I108-F116 HydrophobicContact CG2-CZ 4.13Å; I108-I125 HydrophobicContact CD1-CD1 4.18Å; I108-V135 HydrophobicContact CD1-CG1 4.32Å; I108-L136 PolarHBondContact N-O 3.01Å; I108-V137 HydrophobicContact CB-CG2 4.45Å; I108-V137 HydrophobicContact CD1-CG2 4.18Å; I108-V137 HydrophobicContact CG1-CG2 4.49Å; I108-A138 PolarHBondContact O-N 2.99Å; I108-L147 HydrophobicContact CG2-CD2 3.95Å; I108-L150 HydrophobicContact CD1-CD2 4.25Å
109	F	97.8	Very high	93.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	53.6	171.6	-74.3	3.2	0	0	0	108.7	L59 L60 D61 I65 F72 F73 I107 L136 A138 L270 F273	L59-F109 CarbonylContact O-C 3.59Å; L59-F109 WeakPolarHBondContact O-CA 3.33Å; L59-F109 PolarHBondContact O-N 3.07Å; L60-F109 WeakPolarHBondContact CA-O 3.47Å; L60-F109 HydrophobicContact CD2-CB 4Å; D61-F109 PolarHBondContact N-O 2.88Å; I65-F109 HydrophobicContact CG2-CB 4.44Å; F72-F109 AromaticContact CD1-CE2 3.84Å; F72-F109 HydrophobicContact CD1-CE2 3.84Å; F72-F109 HydrophobicContact CD1-CZ 4.02Å; F72-F109 AromaticContact CE1-CE2 3.85Å; F72-F109 HydrophobicContact CE1-CE2 3.85Å; F72-F109 AromaticContact CE1-CZ 3.62Å; F72-F109 HydrophobicContact CE1-CZ 3.62Å; F72-F109 HydrophobicContact CZ-CZ 4.28Å; F73-F109 HydrophobicContact CE1-CD2 4.26Å; F73-F109 HydrophobicContact CE1-CE2 4.12Å; F73-F109 HydrophobicContact CE2-CD2 4.29Å; F73-F109 HydrophobicContact CE2-CE2 4.45Å; F73-F109 AromaticContact CZ-CD2 3.52Å; F73-F109 HydrophobicContact CZ-CD2 3.52Å; F73-F109 AromaticContact CZ-CE2 3.71Å; F73-F109 HydrophobicContact CZ-CE2 3.71Å; I107-F109 HydrophobicContact CG2-CD1 3.6Å; I107-F109 HydrophobicContact CG2-CD2 4.33Å; I107-F109 HydrophobicContact CG2-CE1 3.63Å; I107-F109 HydrophobicContact CG2-CE2 4.34Å; I107-F109 HydrophobicContact CG2-CG 3.97Å; I107-F109 HydrophobicContact CG2-CZ 4.01Å; F109-L136 HydrophobicContact CE1-CD2 3.67Å; F109-L136 HydrophobicContact CE1-CG 4.46Å; F109-L136 HydrophobicContact CZ-CD2 3.88Å; F109-A138 HydrophobicContact CD1-CB 3.55Å; F109-A138 HydrophobicContact CE1-CB 3.62Å; F109-L270 HydrophobicContact CB-CD1 3.64Å; F109-L270 HydrophobicContact CD1-CD1 3.98Å; F109-L270 HydrophobicContact CD2-CD1 3.82Å; F109-L270 HydrophobicContact CE2-CD1 4.47Å; F109-L270 HydrophobicContact CG-CD1 3.56Å; F109-F273 HydrophobicContact CE1-CD2 4.14Å; F109-F273 HydrophobicContact CE1-CE2 4.38Å; F109-F273 HydrophobicContact CE2-CB 4.28Å; F109-F273 HydrophobicContact CZ-CB 4.08Å; F109-F273 HydrophobicContact CZ-CD1 4.35Å; F109-F273 AromaticContact CZ-CD2 3.93Å; F109-F273 HydrophobicContact CZ-CD2 3.93Å; F109-F273 HydrophobicContact CZ-CE2 4.46Å; F109-F273 AromaticContact CZ-CG 3.87Å; F109-F273 HydrophobicContact CZ-CG 3.87Å
110	A	96.4	Very high	94	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.			trans	-135.1	73	-178.8	0	0	0	0	0	109.9	D61 A88 I108 S112 V113	D61-A110 HydrophobicContact CB-CB 4.01Å; A88-A110 HydrophobicContact CB-CB 3.63Å; I108-A110 HydrophobicContact CG2-CB 4.24Å; A110-S112 PolarHBondContact O-N 3.38Å; A110-V113 HydrophobicContact CB-CB 4.35Å; A110-V113 WeakPolarHBondContact O-CG1 3.41Å
111	P	95.7	Very high	94.1	Very high	8 Å²	8	40.2 Å²	40.2	5%	0.052	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-39.8	-170.7	25.6	-34.3	0	0	0	113.1	V113 S140 D142 I143 G144 L270	P111-V113 VanDerWaalsContact C-N 3.29Å; P111-V113 PolarHBondContact O-N 2.86Å; P111-S140 VanDerWaalsContact CB-OG 3.3Å; P111-S140 WeakPolarHBondContact CB-OG 3.32Å; P111-S140 WeakPolarHBondContact CG-OG 3.44Å; P111-D142 CarbonylContact C-O 3.57Å; P111-D142 VanDerWaalsContact C-O 3.32Å; P111-I143 CarbonylContact O-C 3.59Å; P111-I143 WeakPolarHBondContact O-CA 3.41Å; P111-G144 PolarHBondContact O-N 2.9Å; P111-L270 HydrophobicContact CG-CD2 4.17Å
112	S	94.8	Very high	94.1	Very high	44 Å²	44	37.9 Å²	37.9	31%	0.308	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	21.6	-175.4	47.3	0	0	0	0	114.5	D61 A110 E114 D142	D61-S112 PolarHBondContact OD1-OG 3.47Å; D61-S112 PolarHBondContact OD2-OG 3.04Å; A110-S112 PolarHBondContact O-N 3.38Å; S112-E114 PolarHBondContact O-N 2.88Å; S112-D142 WeakPolarHBondContact CA-O 3.43Å; S112-D142 PolarHBondContact N-O 2.98Å
113	V	94.3	Very high	94.2	Very high	10 Å²	10	41.7 Å²	41.7	6%	0.061	23%	0.228	C	C	.	.			trans	-76.1	121.8	178.9	67.6	0	0	0	0	110.2	A88 A110 P111 D115 F116 P146 L147	A88-V113 HydrophobicContact CB-CB 4.34Å; A88-V113 HydrophobicContact CB-CG2 3.89Å; A110-V113 HydrophobicContact CB-CB 4.35Å; A110-V113 WeakPolarHBondContact O-CG1 3.41Å; P111-V113 VanDerWaalsContact C-N 3.29Å; P111-V113 PolarHBondContact O-N 2.86Å; V113-D115 VanDerWaalsContact CG2-O 3.27Å; V113-D115 WeakPolarHBondContact CG2-O 2.88Å; V113-F116 HydrophobicContact CG1-CD1 4.46Å; V113-F116 HydrophobicContact CG1-CE1 3.81Å; V113-F116 HydrophobicContact CG1-CE2 4.3Å; V113-F116 HydrophobicContact CG1-CZ 3.71Å; V113-F116 HydrophobicContact CG2-CD1 4.01Å; V113-F116 HydrophobicContact CG2-CE1 4.15Å; V113-F116 HydrophobicContact CG2-CG 4.4Å; V113-P146 WeakPolarHBondContact O-CD 3.42Å; V113-L147 HydrophobicContact CG1-CG 4.24Å
114	E	91.8	Very high	94.1	Very high	112 Å²	112	41.1 Å²	41.1	52%	0.523	23%	0.228	S	C	.	.	S	Bend	trans	-88.5	-36.4	173.6	-62	-62.4	168	0	0	111.8	S112 P146	S112-E114 PolarHBondContact O-N 2.88Å; E114-P146 WeakPolarHBondContact O-CD 2.99Å; E114-P146 WeakPolarHBondContact O-CG 3.26Å
115	D	91.5	Very high	94.2	Very high	134 Å²	134	37.1 Å²	37.1	72%	0.717	21%	0.207	S	C	*	.	S	Bend	trans	-142.7	133.9	177.9	-76	-52.7	0	0	0	109.5	V113	V113-D115 VanDerWaalsContact CG2-O 3.27Å; V113-D115 WeakPolarHBondContact CG2-O 2.88Å
116	F	93.8	Very high	94.1	Very high	24 Å²	24	38 Å²	38	11%	0.105	21%	0.213	C	C	.	.			trans	-79.4	144.5	172.1	-71.7	-70.5	0	0	0	110.9	L59 A88 I108 V113 I120 I125 P146 L147	L59-F116 HydrophobicContact CD1-CD1 3.96Å; L59-F116 HydrophobicContact CD1-CE1 3.86Å; A88-F116 HydrophobicContact CB-CD1 4.32Å; A88-F116 HydrophobicContact CB-CE1 4.48Å; I108-F116 HydrophobicContact CD1-CZ 4.24Å; I108-F116 HydrophobicContact CG2-CE1 4.07Å; I108-F116 HydrophobicContact CG2-CZ 4.13Å; V113-F116 HydrophobicContact CG1-CD1 4.46Å; V113-F116 HydrophobicContact CG1-CE1 3.81Å; V113-F116 HydrophobicContact CG1-CE2 4.3Å; V113-F116 HydrophobicContact CG1-CZ 3.71Å; V113-F116 HydrophobicContact CG2-CD1 4.01Å; V113-F116 HydrophobicContact CG2-CE1 4.15Å; V113-F116 HydrophobicContact CG2-CG 4.4Å; F116-I120 HydrophobicContact CB-CB 4.02Å; F116-I120 HydrophobicContact CB-CG2 3.91Å; F116-I120 WeakPolarHBondContact CB-O 3.29Å; F116-I120 HydrophobicContact CD1-CG2 4.4Å; F116-I120 HydrophobicContact CD2-CG2 4.36Å; F116-I120 HydrophobicContact CG-CG2 3.99Å; F116-I125 HydrophobicContact CD2-CD1 4.36Å; F116-I125 HydrophobicContact CE2-CD1 3.98Å; F116-I125 HydrophobicContact CZ-CD1 4.36Å; F116-P146 HydrophobicContact CD2-CB 4.08Å; F116-P146 HydrophobicContact CE2-CB 3.67Å; F116-L147 HydrophobicContact CZ-CD2 4.04Å
117	G	91	Very high	94	Very high	8 Å²	8	40.8 Å²	40.8	8%	0.082	23%	0.232	C	C	.	.	S	Bend	trans	-74.3	155.8	178.8	0	0	0	0	0	113.9	A88 D90 L93 N119 I120	A88-G117 PolarHBondContact O-N 2.63Å; D90-G117 CarbonylContact O-C 3.52Å; D90-G117 WeakPolarHBondContact O-CA 3.37Å; L93-G117 WeakPolarHBondContact CB-O 2.97Å; G117-N119 PolarHBondContact O-N 2.88Å; G117-I120 PolarHBondContact O-N 3.18Å
118	G	90.3	Very high	93.9	Very high	47 Å²	47	40.9 Å²	40.9	49%	0.485	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	-121.5	169.8	0	0	0	0	0	113.1	P91	P91-G118 VanDerWaalsContact O-CA 3.26Å; P91-G118 WeakPolarHBondContact O-CA 3.5Å
119	N	88.3	Confident	93.8	Very high	70 Å²	70	41.2 Å²	41.2	37%	0.374	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	14.8	178.2	76.9	-3.7	0	0	0	113.5	L93 S94 I96 G117 N121 T124	L93-N119 PolarHBondContact O-N 3.34Å; L93-N119 PolarHBondContact O-OD1 3.29Å; S94-N119 WeakPolarHBondContact CA-OD1 3.38Å; S94-N119 WeakPolarHBondContact CB-OD1 2.99Å; I96-N119 PolarHBondContact O-ND2 3.32Å; G117-N119 PolarHBondContact O-N 2.88Å; N119-N121 PolarHBondContact O-N 3.16Å; N119-T124 PolarHBondContact O-OG1 3.25Å
120	I	93.1	Very high	93.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.266	C	S	.	.			trans	-85	110.3	177.4	-60.2	-172.5	0	0	0	107.6	L57 L59 L93 L95 F116 G117 I125	L57-I120 HydrophobicContact CD2-CD1 4.22Å; L59-I120 HydrophobicContact CD1-CD1 4.34Å; L93-I120 HydrophobicContact CB-CD1 3.81Å; L93-I120 HydrophobicContact CB-CG1 4.14Å; L93-I120 HydrophobicContact CD1-CD1 4.29Å; L93-I120 HydrophobicContact CD2-CD1 4.09Å; L93-I120 HydrophobicContact CG-CD1 4.31Å; L95-I120 HydrophobicContact CD1-CD1 4.24Å; L95-I120 HydrophobicContact CD1-CG1 4.23Å; L95-I120 HydrophobicContact CD1-CG2 4.28Å; L95-I120 HydrophobicContact CD2-CD1 4.45Å; L95-I120 HydrophobicContact CG-CD1 3.89Å; L95-I120 HydrophobicContact CG-CG1 4.04Å; F116-I120 HydrophobicContact CB-CB 4.02Å; F116-I120 HydrophobicContact CB-CG2 3.91Å; F116-I120 WeakPolarHBondContact CB-O 3.29Å; F116-I120 HydrophobicContact CD1-CG2 4.4Å; F116-I120 HydrophobicContact CD2-CG2 4.36Å; F116-I120 HydrophobicContact CG-CG2 3.99Å; G117-I120 PolarHBondContact O-N 3.18Å; I120-I125 HydrophobicContact CG2-CD1 3.93Å; I120-I125 HydrophobicContact CG2-CG1 3.95Å
121	N	92.1	Very high	93.7	Very high	96 Å²	96	49.2 Å²	49.2	51%	0.513	29%	0.288	S	S	.	.			trans	-124.5	171.2	170.3	-64	-10.6	0	0	0	109.1	N119 E123 T124 I125	N119-N121 PolarHBondContact O-N 3.16Å; N121-E123 VanDerWaalsContact C-N 3.31Å; N121-E123 PolarHBondContact O-N 2.81Å; N121-T124 WeakPolarHBondContact O-CA 3.39Å; N121-T124 WeakPolarHBondContact O-CB 3.48Å; N121-T124 PolarHBondContact O-N 2.84Å; N121-I125 PolarHBondContact O-N 2.82Å; N121-I125 VanDerWaalsContact O-N 3.08Å
122	L	93.4	Very high	93.6	Very high	40 Å²	40	49.9 Å²	49.9	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-46.9	-52.7	173.3	178.8	64.8	0	0	0	112.2	T124 I125 T126 E149 L150 E153	L122-T124 PolarHBondContact O-N 3.06Å; L122-I125 PolarHBondContact O-N 3.07Å; L122-I125 VanDerWaalsContact O-N 3.08Å; L122-T126 HydrophobicContact CD1-CG2 4.37Å; L122-T126 PolarHBondContact O-N 3.21Å; L122-T126 PolarHBondContact O-OG1 2.92Å; L122-E149 HydrophobicContact CD1-CB 4.37Å; L122-E149 HydrophobicContact CD2-CB 3.88Å; L122-L150 VanDerWaalsContact CD1-CA 3.42Å; L122-L150 HydrophobicContact CD1-CB 3.77Å; L122-L150 HydrophobicContact CD1-CD1 3.95Å; L122-L150 HydrophobicContact CD1-CG 4.49Å; L122-E153 HydrophobicContact CD1-CG 4.15Å; L122-E153 HydrophobicContact CD2-CG 4.03Å; L122-E153 HydrophobicContact CG-CG 4.32Å
123	E	93.2	Very high	93.6	Very high	147 Å²	147	48.1 Å²	48.1	69%	0.687	28%	0.284	S	S	*	.	H	α-helix	trans	-58.1	-31.3	178.5	-64.7	-177.3	175.7	0	0	113.6	N121 T126 S127	N121-E123 VanDerWaalsContact C-N 3.31Å; N121-E123 PolarHBondContact O-N 2.81Å; E123-T126 VanDerWaalsContact CA-OG1 3.3Å; E123-T126 WeakPolarHBondContact CA-OG1 3.28Å; E123-T126 PolarHBondContact O-OG1 3.13Å; E123-S127 WeakPolarHBondContact O-CB 3.22Å; E123-S127 PolarHBondContact O-N 3.12Å; E123-S127 PolarHBondContact O-OG 3.08Å
124	T	94.4	Very high	93.7	Very high	27 Å²	27	47.8 Å²	47.8	17%	0.166	28%	0.282	C	S	.	.	H	α-helix	trans	-75.9	-37.6	179.6	-55.4	0	0	0	0	110.7	L95 I96 N119 N121 L122 F128	L95-T124 HydrophobicContact CB-CG2 4.22Å; L95-T124 HydrophobicContact CD1-CG2 4.18Å; I96-T124 HydrophobicContact CD1-CG2 4.21Å; I96-T124 HydrophobicContact CG1-CG2 4.41Å; N119-T124 PolarHBondContact O-OG1 3.25Å; N121-T124 WeakPolarHBondContact O-CA 3.39Å; N121-T124 WeakPolarHBondContact O-CB 3.48Å; N121-T124 PolarHBondContact O-N 2.84Å; L122-T124 PolarHBondContact O-N 3.06Å; T124-F128 WeakPolarHBondContact O-CB 3.42Å; T124-F128 PolarHBondContact O-N 2.96Å
125	I	95.8	Very high	94	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-70.7	-42	176.2	-59.7	172	0	0	0	110.2	L95 L106 I108 F116 I120 N121 L122 F128 I129 L150	L95-I125 HydrophobicContact CD1-CG1 4.21Å; L106-I125 HydrophobicContact CD2-CG1 4.36Å; L106-I125 HydrophobicContact CD2-CG2 4.26Å; I108-I125 HydrophobicContact CD1-CD1 4.18Å; F116-I125 HydrophobicContact CD2-CD1 4.36Å; F116-I125 HydrophobicContact CE2-CD1 3.98Å; F116-I125 HydrophobicContact CZ-CD1 4.36Å; I120-I125 HydrophobicContact CG2-CD1 3.93Å; I120-I125 HydrophobicContact CG2-CG1 3.95Å; N121-I125 PolarHBondContact O-N 2.82Å; N121-I125 VanDerWaalsContact O-N 3.08Å; L122-I125 PolarHBondContact O-N 3.07Å; L122-I125 VanDerWaalsContact O-N 3.08Å; I125-F128 WeakPolarHBondContact O-CB 3.39Å; I125-F128 PolarHBondContact O-N 2.87Å; I125-F128 VanDerWaalsContact O-N 3.15Å; I125-I129 HydrophobicContact CG2-CD1 4.24Å; I125-I129 WeakPolarHBondContact O-CG1 3.28Å; I125-I129 PolarHBondContact O-N 3.36Å; I125-L150 HydrophobicContact CB-CD1 4.24Å; I125-L150 HydrophobicContact CD1-CD2 4.49Å; I125-L150 HydrophobicContact CG2-CD1 3.68Å; I125-L150 HydrophobicContact CG2-CD2 3.99Å
126	T	95.4	Very high	94.3	Very high	32 Å²	32	36.1 Å²	36.1	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-43.9	174.9	56.4	0	0	0	0	111.2	L122 E123 F128 I129 D130 L150 E153	L122-T126 HydrophobicContact CD1-CG2 4.37Å; L122-T126 PolarHBondContact O-N 3.21Å; L122-T126 PolarHBondContact O-OG1 2.92Å; E123-T126 VanDerWaalsContact CA-OG1 3.3Å; E123-T126 WeakPolarHBondContact CA-OG1 3.28Å; E123-T126 PolarHBondContact O-OG1 3.13Å; T126-F128 PolarHBondContact O-N 2.9Å; T126-I129 WeakPolarHBondContact O-CB 3.43Å; T126-I129 PolarHBondContact O-N 3.45Å; T126-I129 VanDerWaalsContact O-N 3.11Å; T126-D130 PolarHBondContact O-N 2.81Å; T126-L150 HydrophobicContact CG2-CD1 4.37Å; T126-E153 HydrophobicContact CG2-CB 4.1Å; T126-E153 HydrophobicContact CG2-CG 4.28Å
127	S	94.9	Very high	94.5	Very high	57 Å²	57	35 Å²	35	40%	0.399	22%	0.218	S	C	.	.	H	α-helix	trans	-60.4	-32.7	172.6	-63.4	0	0	0	0	113	E123 G131	E123-S127 WeakPolarHBondContact O-CB 3.22Å; E123-S127 PolarHBondContact O-N 3.12Å; E123-S127 PolarHBondContact O-OG 3.08Å; S127-G131 PolarHBondContact O-N 2.84Å
128	F	96.1	Very high	94.9	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-41.7	174.5	175.3	-103.3	0	0	0	112.1	F101 Y103 L106 T124 I125 T126 G131 G132 G133 V135	F101-F128 AromaticContact CD1-CD2 3.59Å; F101-F128 HydrophobicContact CD1-CD2 3.59Å; F101-F128 HydrophobicContact CD1-CE2 4.23Å; F101-F128 HydrophobicContact CE1-CB 4.22Å; F101-F128 AromaticContact CE1-CD2 3.87Å; F101-F128 HydrophobicContact CE1-CD2 3.87Å; F101-F128 HydrophobicContact CG-CD2 4.31Å; Y103-F128 VanDerWaalsContact O-CE2 3.31Å; Y103-F128 WeakPolarHBondContact O-CE2 3.48Å; L106-F128 HydrophobicContact CB-CD1 4.48Å; L106-F128 HydrophobicContact CB-CE1 3.84Å; L106-F128 HydrophobicContact CB-CZ 4.44Å; T124-F128 WeakPolarHBondContact O-CB 3.42Å; T124-F128 PolarHBondContact O-N 2.96Å; I125-F128 WeakPolarHBondContact O-CB 3.39Å; I125-F128 PolarHBondContact O-N 2.87Å; I125-F128 VanDerWaalsContact O-N 3.15Å; T126-F128 PolarHBondContact O-N 2.9Å; F128-G131 PolarHBondContact O-N 2.82Å; F128-G132 PolarHBondContact O-N 3.29Å; F128-G133 PolarHBondContact O-N 2.86Å; F128-V135 HydrophobicContact CD1-CG2 3.85Å; F128-V135 HydrophobicContact CE1-CG2 3.93Å
129	I	96.6	Very high	95.1	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-44.7	173.9	-65.5	162.3	0	0	0	110.2	I125 T126 G131 G132 V135 L150 N260 A262 V264	I125-I129 HydrophobicContact CG2-CD1 4.24Å; I125-I129 WeakPolarHBondContact O-CG1 3.28Å; I125-I129 PolarHBondContact O-N 3.36Å; T126-I129 WeakPolarHBondContact O-CB 3.43Å; T126-I129 PolarHBondContact O-N 3.45Å; T126-I129 VanDerWaalsContact O-N 3.11Å; I129-G131 PolarHBondContact O-N 3.21Å; I129-G132 PolarHBondContact O-N 2.98Å; I129-V135 HydrophobicContact CD1-CG2 4.11Å; I129-V135 HydrophobicContact CG1-CG2 3.65Å; I129-L150 HydrophobicContact CD1-CD1 4.4Å; I129-N260 PolarHBondContact O-ND2 2.94Å; I129-A262 HydrophobicContact CG2-CB 3.97Å; I129-A262 VanDerWaalsContact O-CB 3.32Å; I129-A262 WeakPolarHBondContact O-CB 3.3Å; I129-V264 HydrophobicContact CD1-CG2 3.9Å; I129-V264 HydrophobicContact CG1-CG2 3.98Å; I129-V264 HydrophobicContact CG2-CG2 4.03Å
130	D	95.9	Very high	95.5	Very high	124 Å²	124	30 Å²	30	66%	0.663	18%	0.18	S	C	*	.	H	α-helix	trans	-62.1	-32.8	175.3	-76.3	-18.7	0	0	0	112.4	T126 G132 N260	T126-D130 PolarHBondContact O-N 2.81Å; D130-G132 PolarHBondContact O-N 2.86Å; D130-N260 VanDerWaalsContact C-ND2 3.28Å; D130-N260 PolarHBondContact O-ND2 3.32Å
131	G	94.4	Very high	95.6	Very high	44 Å²	44	31.3 Å²	31.3	45%	0.454	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.6	171.5	0	0	0	0	0	115	S127 F128 I129	S127-G131 PolarHBondContact O-N 2.84Å; F128-G131 PolarHBondContact O-N 2.82Å; I129-G131 PolarHBondContact O-N 3.21Å
132	G	93.8	Very high	95.8	Very high	22 Å²	22	31.1 Å²	31.1	23%	0.227	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	5.3	179.4	0	0	0	0	0	114.7	F128 I129 D130 N260 K310	F128-G132 PolarHBondContact O-N 3.29Å; I129-G132 PolarHBondContact O-N 2.98Å; D130-G132 PolarHBondContact O-N 2.86Å; G132-N260 PolarHBondContact N-ND2 3.11Å; G132-K310 PolarHBondContact O-NZ 3.49Å
133	G	95.3	Very high	95.9	Very high	6 Å²	6	29.3 Å²	29.3	6%	0.062	18%	0.179	C	C	.	.			trans	-66.1	148.3	174.6	0	0	0	0	0	111.9	F128 A262	F128-G133 PolarHBondContact O-N 2.86Å; G133-A262 WeakPolarHBondContact O-CB 3.45Å
134	N	97.1	Very high	95.9	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.6	178.8	-51.3	-55	0	0	0	110	D104 H105 L106 R263 V308 F309 K310	D104-N134 PolarHBondContact O-N 3.15Å; H105-N134 WeakPolarHBondContact CA-O 3.16Å; H105-N134 PolarHBondContact CE1-ND2 2.7Å; H105-N134 PolarHBondContact ND1-ND2 2.68Å; L106-N134 PolarHBondContact N-O 2.94Å; N134-R263 WeakPolarHBondContact CA-O 3.43Å; N134-R263 WeakPolarHBondContact CB-O 3.39Å; N134-R263 PolarHBondContact OD1-N 3.44Å; N134-V308 HydrophobicContact CB-CG1 4.07Å; N134-V308 WeakPolarHBondContact CB-O 3.33Å; N134-V308 PolarHBondContact ND2-O 2.86Å; N134-F309 HydrophobicContact CB-CD1 4.28Å; N134-K310 VanDerWaalsContact OD1-CE 3.26Å; N134-K310 WeakPolarHBondContact OD1-CE 3.11Å
135	V	97.9	Very high	95.9	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.2	-174.6	-171.7	0	0	0	0	110.6	L106 I108 F128 I129 V137 R263 V264 V265	L106-V135 HydrophobicContact CB-CG1 4.38Å; L106-V135 HydrophobicContact CB-CG2 4.25Å; L106-V135 HydrophobicContact CD2-CG1 4.25Å; L106-V135 HydrophobicContact CD2-CG2 4.43Å; L106-V135 HydrophobicContact CG-CG1 4.34Å; L106-V135 CarbonylContact O-C 3.55Å; L106-V135 VanDerWaalsContact O-CA 3.3Å; L106-V135 WeakPolarHBondContact O-CA 3.21Å; I108-V135 HydrophobicContact CD1-CG1 4.32Å; F128-V135 HydrophobicContact CD1-CG2 3.85Å; F128-V135 HydrophobicContact CE1-CG2 3.93Å; I129-V135 HydrophobicContact CD1-CG2 4.11Å; I129-V135 HydrophobicContact CG1-CG2 3.65Å; V135-V137 HydrophobicContact CG1-CG2 3.77Å; V135-R263 PolarHBondContact N-O 3.42Å; V135-R263 VanDerWaalsContact N-O 3.12Å; V135-V264 HydrophobicContact CB-CG1 4.12Å; V135-V264 HydrophobicContact CB-CG2 4.3Å; V135-V264 VanDerWaalsContact O-CA 3.25Å; V135-V264 WeakPolarHBondContact O-CA 3.35Å; V135-V265 PolarHBondContact O-N 2.95Å
136	L	98.4	Very high	95.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	117.4	170.7	-176.4	89.6	0	0	0	108.1	F72 L106 I107 I108 F109 V265 F273 V308 F309	F72-L136 HydrophobicContact CE1-CD2 4.27Å; F72-L136 HydrophobicContact CZ-CD2 3.88Å; L106-L136 PolarHBondContact O-N 2.86Å; I107-L136 CarbonylContact C-O 3.24Å; I107-L136 WeakPolarHBondContact CA-O 3.25Å; I107-L136 HydrophobicContact CG1-CB 4.25Å; I107-L136 HydrophobicContact CG1-CD2 4.39Å; I107-L136 HydrophobicContact CG2-CD2 4.09Å; I108-L136 PolarHBondContact N-O 3.01Å; F109-L136 HydrophobicContact CE1-CD2 3.67Å; F109-L136 HydrophobicContact CE1-CG 4.46Å; F109-L136 HydrophobicContact CZ-CD2 3.88Å; L136-V265 HydrophobicContact CD1-CB 4.02Å; L136-V265 HydrophobicContact CD1-CG1 4.02Å; L136-F273 HydrophobicContact CD1-CZ 4.34Å; L136-F273 HydrophobicContact CD2-CZ 4.43Å; L136-V308 HydrophobicContact CD1-CG2 4.3Å; L136-F309 HydrophobicContact CB-CZ 4.28Å
137	V	98.1	Very high	95.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131	178.8	-175.1	0	0	0	0	109.1	I108 V135 L147 L150 V265 F266 S267	I108-V137 HydrophobicContact CB-CG2 4.45Å; I108-V137 HydrophobicContact CD1-CG2 4.18Å; I108-V137 HydrophobicContact CG1-CG2 4.49Å; V135-V137 HydrophobicContact CG1-CG2 3.77Å; V137-L147 HydrophobicContact CG1-CD1 4.26Å; V137-L147 HydrophobicContact CG1-CD2 3.85Å; V137-L150 HydrophobicContact CG2-CD2 4.05Å; V137-V265 PolarHBondContact N-O 3.29Å; V137-F266 HydrophobicContact CB-CD1 3.87Å; V137-F266 HydrophobicContact CB-CE1 4.27Å; V137-F266 HydrophobicContact CG1-CD1 4.31Å; V137-F266 HydrophobicContact CG2-CD1 4.08Å; V137-F266 HydrophobicContact CG2-CE1 3.97Å; V137-S267 PolarHBondContact O-N 2.8Å
138	A	97.6	Very high	96	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.1	169.4	0	0	0	0	0	109.9	I108 F109 S267 L270 F273	I108-A138 PolarHBondContact O-N 2.99Å; F109-A138 HydrophobicContact CD1-CB 3.55Å; F109-A138 HydrophobicContact CE1-CB 3.62Å; A138-S267 CarbonylContact C-O 3.38Å; A138-S267 WeakPolarHBondContact CA-O 3.34Å; A138-L270 HydrophobicContact CB-CB 4.41Å; A138-L270 HydrophobicContact CB-CD1 4.02Å; A138-F273 HydrophobicContact CB-CD2 4.09Å; A138-F273 HydrophobicContact CB-CE2 4.04Å
139	A	96.4	Very high	96	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.			trans	-95.8	175.4	175.9	0	0	0	0	0	111.1	I143 F158 V209 S267 G268 S269 L270	A139-I143 HydrophobicContact CB-CB 4.49Å; A139-I143 HydrophobicContact CB-CD1 3.82Å; A139-I143 HydrophobicContact CB-CG1 4.15Å; A139-F158 HydrophobicContact CB-CD1 4.49Å; A139-F158 HydrophobicContact CB-CE1 3.89Å; A139-F158 HydrophobicContact CB-CZ 4.42Å; A139-V209 HydrophobicContact CB-CG1 3.91Å; A139-S267 PolarHBondContact N-O 3.03Å; A139-G268 CarbonylContact C-O 3.51Å; A139-G268 CarbonylContact O-C 3.57Å; A139-G268 VanDerWaalsContact O-C 3.3Å; A139-S269 CarbonylContact O-C 3.56Å; A139-S269 WeakPolarHBondContact O-CA 3.36Å; A139-S269 PolarHBondContact O-N 3.07Å; A139-L270 PolarHBondContact O-N 2.87Å
140	S	96	Very high	96	Very high	20 Å²	20	30 Å²	30	14%	0.14	17%	0.174	C	C	.	.			trans	-142.1	-172.4	169.1	69.8	0	0	0	0	108.3	P111 D142 I143 V209	P111-S140 VanDerWaalsContact CB-OG 3.3Å; P111-S140 WeakPolarHBondContact CB-OG 3.32Å; P111-S140 WeakPolarHBondContact CG-OG 3.44Å; S140-D142 PolarHBondContact O-N 2.93Å; S140-D142 PolarHBondContact OG-N 2.94Å; S140-I143 PolarHBondContact O-N 3Å; S140-V209 WeakPolarHBondContact O-CG1 3.41Å
141	S	95.3	Very high	96.1	Very high	29 Å²	29	24.1 Å²	24.1	20%	0.203	14%	0.142	C	C	.	.	S	Bend	trans	-62.8	-17.6	171	-66.4	0	0	0	0	113.4	I143 K162 T163	S141-I143 VanDerWaalsContact C-N 3.3Å; S141-I143 PolarHBondContact O-N 2.91Å; S141-K162 WeakPolarHBondContact O-CA 3.16Å; S141-K162 PolarHBondContact O-N 2.9Å; S141-T163 VanDerWaalsContact CB-O 3.25Å; S141-T163 WeakPolarHBondContact CB-O 3.5Å; S141-T163 PolarHBondContact OG-O 3.47Å
142	D	95.2	Very high	96.1	Very high	91 Å²	91	25.9 Å²	25.9	49%	0.487	15%	0.147	S	C	.	.	S	Bend	trans	-96.3	45.3	176.1	-53.6	-51.2	0	0	0	110.5	P111 S112 S140 G144	P111-D142 CarbonylContact C-O 3.57Å; P111-D142 VanDerWaalsContact C-O 3.32Å; S112-D142 WeakPolarHBondContact CA-O 3.43Å; S112-D142 PolarHBondContact N-O 2.98Å; S140-D142 PolarHBondContact O-N 2.93Å; S140-D142 PolarHBondContact OG-N 2.94Å; D142-G144 PolarHBondContact O-N 2.78Å
143	I	95.5	Very high	96.2	Very high	3 Å²	3	31 Å²	31	2%	0.015	17%	0.165	C	C	.	.			trans	-71	125.3	-176.7	-170.7	174.1	0	0	0	111.5	P111 A139 S140 S141 L147 R148 F158 V209	P111-I143 CarbonylContact O-C 3.59Å; P111-I143 WeakPolarHBondContact O-CA 3.41Å; A139-I143 HydrophobicContact CB-CB 4.49Å; A139-I143 HydrophobicContact CB-CD1 3.82Å; A139-I143 HydrophobicContact CB-CG1 4.15Å; S140-I143 PolarHBondContact O-N 3Å; S141-I143 VanDerWaalsContact C-N 3.3Å; S141-I143 PolarHBondContact O-N 2.91Å; I143-L147 HydrophobicContact CD1-CB 4.19Å; I143-L147 HydrophobicContact CG1-CB 4Å; I143-R148 HydrophobicContact CD1-CG 3.62Å; I143-R148 HydrophobicContact CG1-CG 3.86Å; I143-R148 HydrophobicContact CG2-CG 4.27Å; I143-F158 HydrophobicContact CD1-CB 3.7Å; I143-F158 HydrophobicContact CD1-CD1 3.53Å; I143-F158 HydrophobicContact CD1-CD2 3.96Å; I143-F158 HydrophobicContact CD1-CE1 4.03Å; I143-F158 HydrophobicContact CD1-CE2 4.42Å; I143-F158 HydrophobicContact CD1-CG 3.47Å; I143-F158 VanDerWaalsContact CD1-CG 3.47Å; I143-F158 HydrophobicContact CD1-CZ 4.45Å; I143-V209 HydrophobicContact CD1-CG1 4.41Å; I143-V209 HydrophobicContact CG2-CG2 4.49Å
144	G	94.4	Very high	96.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.01	17%	0.166	C	C	.	.			trans	-83	159.8	174.2	0	0	0	0	0	113.6	P111 D142 L147 R148	P111-G144 PolarHBondContact O-N 2.9Å; D142-G144 PolarHBondContact O-N 2.78Å; G144-L147 PolarHBondContact O-N 3.32Å; G144-R148 PolarHBondContact O-N 3.26Å
145	D	94.6	Very high	96.2	Very high	82 Å²	82	31.9 Å²	31.9	44%	0.439	17%	0.174	S	C	.	.	H	α-helix	trans	-58.4	-41.8	-175.5	-77	-27.4	0	0	0	114.6	L147 R148 E149	D145-L147 PolarHBondContact O-N 3.5Å; D145-L147 VanDerWaalsContact O-N 3.17Å; D145-R148 WeakPolarHBondContact O-CB 3.45Å; D145-R148 PolarHBondContact O-N 2.8Å; D145-R148 IonicContact OD1-NH1 3.34Å; D145-R148 PolarHBondContact OD1-NH1 2.97Å; D145-E149 WeakPolarHBondContact O-CG 3.42Å; D145-E149 PolarHBondContact O-N 3.34Å
146	P	95.3	Very high	96.1	Very high	20 Å²	20	31.9 Å²	31.9	13%	0.13	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-32.9	178.8	-25.8	33.2	0	0	0	114.4	V113 E114 F116 L150	V113-P146 WeakPolarHBondContact O-CD 3.42Å; E114-P146 WeakPolarHBondContact O-CD 2.99Å; E114-P146 WeakPolarHBondContact O-CG 3.26Å; F116-P146 HydrophobicContact CD2-CB 4.08Å; F116-P146 HydrophobicContact CE2-CB 3.67Å; P146-L150 VanDerWaalsContact O-CB 3.29Å; P146-L150 WeakPolarHBondContact O-CB 3.39Å; P146-L150 PolarHBondContact O-N 3.42Å
147	L	96.2	Very high	96.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-75.2	-36	177.3	-66.8	-170.7	0	0	0	112	I108 V113 F116 V137 I143 G144 D145 L150 G151	I108-L147 HydrophobicContact CG2-CD2 3.95Å; V113-L147 HydrophobicContact CG1-CG 4.24Å; F116-L147 HydrophobicContact CZ-CD2 4.04Å; V137-L147 HydrophobicContact CG1-CD1 4.26Å; V137-L147 HydrophobicContact CG1-CD2 3.85Å; I143-L147 HydrophobicContact CD1-CB 4.19Å; I143-L147 HydrophobicContact CG1-CB 4Å; G144-L147 PolarHBondContact O-N 3.32Å; D145-L147 PolarHBondContact O-N 3.5Å; D145-L147 VanDerWaalsContact O-N 3.17Å; L147-L150 PolarHBondContact O-N 3.47Å; L147-G151 PolarHBondContact O-N 2.94Å
148	R	96.4	Very high	96	Very high	78 Å²	78	37.2 Å²	37.2	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-65.6	-45.5	175.2	-63.7	175.7	63.2	-126.4	-4.3	110.6	I143 G144 D145 G151 S152 F158	I143-R148 HydrophobicContact CD1-CG 3.62Å; I143-R148 HydrophobicContact CG1-CG 3.86Å; I143-R148 HydrophobicContact CG2-CG 4.27Å; G144-R148 PolarHBondContact O-N 3.26Å; D145-R148 WeakPolarHBondContact O-CB 3.45Å; D145-R148 PolarHBondContact O-N 2.8Å; D145-R148 IonicContact OD1-NH1 3.34Å; D145-R148 PolarHBondContact OD1-NH1 2.97Å; R148-G151 PolarHBondContact O-N 3Å; R148-S152 PolarHBondContact O-N 3.33Å; R148-F158 HydrophobicContact CG-CB 4.07Å
149	E	96.3	Very high	95.9	Very high	106 Å²	106	37.9 Å²	37.9	50%	0.495	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-42.8	175.5	-67.6	-178.4	172.3	0	0	111.7	L122 D145 G151 S152 E153	L122-E149 HydrophobicContact CD1-CB 4.37Å; L122-E149 HydrophobicContact CD2-CB 3.88Å; D145-E149 WeakPolarHBondContact O-CG 3.42Å; D145-E149 PolarHBondContact O-N 3.34Å; E149-G151 VanDerWaalsContact C-N 3.32Å; E149-G151 PolarHBondContact O-N 2.88Å; E149-S152 WeakPolarHBondContact O-CB 3.5Å; E149-S152 PolarHBondContact O-N 3.37Å; E149-S152 VanDerWaalsContact O-N 3.12Å; E149-E153 PolarHBondContact O-N 2.58Å
150	L	96.8	Very high	95.8	Very high	1 Å²	1	43 Å²	43	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-39.8	174.8	-179.8	64.4	0	0	0	112.8	I108 L122 I125 T126 I129 V137 P146 L147 C154 F266	I108-L150 HydrophobicContact CD1-CD2 4.25Å; L122-L150 VanDerWaalsContact CD1-CA 3.42Å; L122-L150 HydrophobicContact CD1-CB 3.77Å; L122-L150 HydrophobicContact CD1-CD1 3.95Å; L122-L150 HydrophobicContact CD1-CG 4.49Å; I125-L150 HydrophobicContact CB-CD1 4.24Å; I125-L150 HydrophobicContact CD1-CD2 4.49Å; I125-L150 HydrophobicContact CG2-CD1 3.68Å; I125-L150 HydrophobicContact CG2-CD2 3.99Å; T126-L150 HydrophobicContact CG2-CD1 4.37Å; I129-L150 HydrophobicContact CD1-CD1 4.4Å; V137-L150 HydrophobicContact CG2-CD2 4.05Å; P146-L150 VanDerWaalsContact O-CB 3.29Å; P146-L150 WeakPolarHBondContact O-CB 3.39Å; P146-L150 PolarHBondContact O-N 3.42Å; L147-L150 PolarHBondContact O-N 3.47Å; L150-C154 PolarHBondContact O-N 2.85Å; L150-C154 PolarHBondContact O-SG 2.85Å; L150-C154 VanDerWaalsContact O-SG 3.37Å; L150-F266 HydrophobicContact CD2-CE1 4.42Å; L150-F266 HydrophobicContact CG-CE1 4.2Å; L150-F266 HydrophobicContact CG-CZ 4.41Å
151	G	96.2	Very high	95.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.5	-48.8	171.1	0	0	0	0	0	111.4	L147 R148 E149 E153 C154 G155 I156	L147-G151 PolarHBondContact O-N 2.94Å; R148-G151 PolarHBondContact O-N 3Å; E149-G151 VanDerWaalsContact C-N 3.32Å; E149-G151 PolarHBondContact O-N 2.88Å; G151-E153 PolarHBondContact O-N 2.98Å; G151-C154 CarbonylContact O-C 3.54Å; G151-C154 WeakPolarHBondContact O-CA 3.5Å; G151-C154 WeakPolarHBondContact O-CB 3.31Å; G151-C154 PolarHBondContact O-N 2.86Å; G151-G155 PolarHBondContact O-N 2.98Å; G151-G155 VanDerWaalsContact O-N 3.11Å; G151-I156 CarbonylContact C-O 3.49Å; G151-I156 VanDerWaalsContact CA-O 3.27Å; G151-I156 WeakPolarHBondContact CA-O 3.37Å; G151-I156 PolarHBondContact O-N 3.35Å
152	S	96.3	Very high	95.7	Very high	80 Å²	80	49.9 Å²	49.9	56%	0.559	25%	0.251	S	S	*	.	H	α-helix	trans	-60.2	-43.1	-177.9	-166.8	0	0	0	0	112.3	R148 E149 C154 G155 I156	R148-S152 PolarHBondContact O-N 3.33Å; E149-S152 WeakPolarHBondContact O-CB 3.5Å; E149-S152 PolarHBondContact O-N 3.37Å; E149-S152 VanDerWaalsContact O-N 3.12Å; S152-C154 PolarHBondContact O-N 2.92Å; S152-G155 PolarHBondContact O-N 2.84Å; S152-I156 PolarHBondContact N-O 3.02Å
153	E	95.6	Very high	95.7	Very high	129 Å²	129	45.6 Å²	45.6	60%	0.603	23%	0.228	S	C	*	.	H	α-helix	trans	-60.5	-26.6	173.2	-72.1	-62.4	143.2	0	0	112.9	L122 T126 E149 G151	L122-E153 HydrophobicContact CD1-CG 4.15Å; L122-E153 HydrophobicContact CD2-CG 4.03Å; L122-E153 HydrophobicContact CG-CG 4.32Å; T126-E153 HydrophobicContact CG2-CB 4.1Å; T126-E153 HydrophobicContact CG2-CG 4.28Å; E149-E153 PolarHBondContact O-N 2.58Å; G151-E153 PolarHBondContact O-N 2.98Å
154	C	95.9	Very high	95.8	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.074	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	0.6	175.9	-66	0	0	0	0	113.7	L150 G151 S152 L256 F266	L150-C154 PolarHBondContact O-N 2.85Å; L150-C154 PolarHBondContact O-SG 2.85Å; L150-C154 VanDerWaalsContact O-SG 3.37Å; G151-C154 CarbonylContact O-C 3.54Å; G151-C154 WeakPolarHBondContact O-CA 3.5Å; G151-C154 WeakPolarHBondContact O-CB 3.31Å; G151-C154 PolarHBondContact O-N 2.86Å; S152-C154 PolarHBondContact O-N 2.92Å; C154-L256 HydrophobicContact CB-CD2 4.07Å; C154-F266 HydrophobicContact CB-CE2 3.66Å; C154-F266 HydrophobicContact CB-CZ 3.76Å
155	G	95.6	Very high	95.9	Very high	18 Å²	18	45.6 Å²	45.6	19%	0.186	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	25	-177.9	0	0	0	0	0	114.6	G151 S152 D214	G151-G155 PolarHBondContact O-N 2.98Å; G151-G155 VanDerWaalsContact O-N 3.11Å; S152-G155 PolarHBondContact O-N 2.84Å; G155-D214 PolarHBondContact O-N 3.15Å; G155-D214 VanDerWaalsContact O-N 3.12Å
156	I	96.9	Very high	96	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.7	175.9	-65.5	160.4	0	0	0	108.5	G151 S152 M211 V220 A254 F266	G151-I156 CarbonylContact C-O 3.49Å; G151-I156 VanDerWaalsContact CA-O 3.27Å; G151-I156 WeakPolarHBondContact CA-O 3.37Å; G151-I156 PolarHBondContact O-N 3.35Å; S152-I156 PolarHBondContact N-O 3.02Å; I156-M211 HydrophobicContact CG2-CB 3.85Å; I156-M211 HydrophobicContact CG2-CG 3.79Å; I156-M211 HydrophobicContact CG2-SD 3.6Å; I156-M211 VanDerWaalsContact CG2-SD 3.6Å; I156-V220 HydrophobicContact CD1-CG1 4.25Å; I156-V220 HydrophobicContact CG1-CG1 4.04Å; I156-V220 HydrophobicContact CG1-CG2 4.31Å; I156-A254 HydrophobicContact CD1-CB 3.62Å; I156-A254 HydrophobicContact CG1-CB 4.22Å; I156-A254 HydrophobicContact CG2-CB 4.43Å; I156-F266 HydrophobicContact CD1-CD2 3.33Å; I156-F266 HydrophobicContact CD1-CE2 3.78Å; I156-F266 HydrophobicContact CD1-CG 4.19Å
157	E	97.1	Very high	96.1	Very high	110 Å²	110	41.1 Å²	41.1	51%	0.514	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	118	180	-163.6	175.9	172.5	0	0	109.9	M211 V212 H244	E157-M211 CarbonylContact O-C 3.21Å; E157-M211 WeakPolarHBondContact O-CA 3.45Å; E157-M211 VanDerWaalsContact O-CB 3.3Å; E157-M211 WeakPolarHBondContact O-CB 3.25Å; E157-V212 PolarHBondContact N-O 2.87Å; E157-V212 PolarHBondContact O-N 3.24Å; E157-H244 IonicContact OE1-CE1 3.04Å; E157-H244 PolarHBondContact OE1-CE1 3.35Å; E157-H244 IonicContact OE2-CE1 3.41Å; E157-H244 PolarHBondContact OE2-CE1 3.18Å
158	F	96.9	Very high	96.1	Very high	3 Å²	3	45.4 Å²	45.4	1%	0.013	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	145.8	169.6	-75.6	-84.3	0	0	0	110.5	A139 I143 R148 V209 M211 F266	A139-F158 HydrophobicContact CB-CD1 4.49Å; A139-F158 HydrophobicContact CB-CE1 3.89Å; A139-F158 HydrophobicContact CB-CZ 4.42Å; I143-F158 HydrophobicContact CD1-CB 3.7Å; I143-F158 HydrophobicContact CD1-CD1 3.53Å; I143-F158 HydrophobicContact CD1-CD2 3.96Å; I143-F158 HydrophobicContact CD1-CE1 4.03Å; I143-F158 HydrophobicContact CD1-CE2 4.42Å; I143-F158 HydrophobicContact CD1-CG 3.47Å; I143-F158 VanDerWaalsContact CD1-CG 3.47Å; I143-F158 HydrophobicContact CD1-CZ 4.45Å; R148-F158 HydrophobicContact CG-CB 4.07Å; F158-V209 HydrophobicContact CD1-CG1 3.85Å; F158-V209 HydrophobicContact CE1-CG1 4.26Å; F158-M211 HydrophobicContact CD1-CB 4.12Å; F158-M211 HydrophobicContact CD1-CE 4.09Å; F158-M211 HydrophobicContact CE1-CB 4.49Å; F158-M211 HydrophobicContact CE1-CE 3.41Å; F158-M211 VanDerWaalsContact CE1-CE 3.41Å; F158-M211 HydrophobicContact CE1-SD 4.23Å; F158-M211 HydrophobicContact CG-CB 4.5Å; F158-M211 HydrophobicContact CZ-CE 4.03Å; F158-M211 HydrophobicContact CZ-SD 4.44Å; F158-F266 AromaticContact CE2-CD1 3.8Å; F158-F266 HydrophobicContact CE2-CD1 3.8Å; F158-F266 HydrophobicContact CE2-CE1 4.39Å; F158-F266 HydrophobicContact CE2-CG 4.43Å; F158-F266 HydrophobicContact CZ-CB 3.97Å; F158-F266 AromaticContact CZ-CD1 3.83Å; F158-F266 HydrophobicContact CZ-CD1 3.83Å; F158-F266 HydrophobicContact CZ-CG 4.28Å
159	D	95.6	Very high	96	Very high	14 Å²	14	47.4 Å²	47.4	8%	0.075	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-67.7	173.6	171.9	-155.3	-3.7	0	0	0	111.8	T163 V209 G210 S232 H244	D159-T163 WeakPolarHBondContact CB-OG1 3.04Å; D159-V209 HydrophobicContact CB-CG2 3.78Å; D159-G210 PolarHBondContact N-O 2.94Å; D159-G210 VanDerWaalsContact N-O 3.12Å; D159-S232 WeakPolarHBondContact OD2-CB 3.19Å; D159-S232 PolarHBondContact OD2-OG 2.96Å; D159-H244 WeakPolarHBondContact OD1-CB 3.24Å; D159-H244 IonicContact OD1-CG 2.66Å
160	E	93.1	Very high	95.9	Very high	108 Å²	108	43.5 Å²	43.5	51%	0.505	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-67.1	157.2	-177.2	-66	-175.4	-172.3	0	0	113	T163 F234	E160-T163 HydrophobicContact CB-CG2 3.98Å; E160-T163 WeakPolarHBondContact O-CB 3.35Å; E160-T163 WeakPolarHBondContact O-CG2 3.2Å; E160-T163 PolarHBondContact O-N 2.85Å; E160-T163 PolarHBondContact O-OG1 3.35Å; E160-F234 HydrophobicContact CB-CZ 4.09Å; E160-F234 WeakPolarHBondContact OE2-CZ 3.44Å
161	E	95	Very high	95.9	Very high	80 Å²	80	46.3 Å²	46.3	37%	0.374	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	144.4	169.5	-166.9	-140.7	149.2	0	0	110.4	T163 F234	E161-T163 PolarHBondContact O-N 3.44Å; E161-F234 VanDerWaalsContact O-CE1 3.27Å; E161-F234 WeakPolarHBondContact O-CE1 3.42Å
162	K	95.1	Very high	95.9	Very high	113 Å²	113	46.4 Å²	46.4	49%	0.491	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	6	-174.6	-48	179.9	171.2	61.2	0	115.5	S141 F234	S141-K162 WeakPolarHBondContact O-CA 3.16Å; S141-K162 PolarHBondContact O-N 2.9Å; K162-F234 HydrophobicContact CB-CD1 4.12Å; K162-F234 HydrophobicContact CB-CE1 4.11Å
163	T	95.9	Very high	95.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	23%	0.227	C	C	.	.			trans	-82.8	155.6	167.5	67	0	0	0	0	110.6	S141 D159 E160 E161 V209 F234	S141-T163 VanDerWaalsContact CB-O 3.25Å; S141-T163 WeakPolarHBondContact CB-O 3.5Å; S141-T163 PolarHBondContact OG-O 3.47Å; D159-T163 WeakPolarHBondContact CB-OG1 3.04Å; E160-T163 HydrophobicContact CB-CG2 3.98Å; E160-T163 WeakPolarHBondContact O-CB 3.35Å; E160-T163 WeakPolarHBondContact O-CG2 3.2Å; E160-T163 PolarHBondContact O-N 2.85Å; E160-T163 PolarHBondContact O-OG1 3.35Å; E161-T163 PolarHBondContact O-N 3.44Å; T163-V209 WeakPolarHBondContact OG1-CG2 3.4Å; T163-F234 HydrophobicContact CG2-CD1 4.03Å; T163-F234 HydrophobicContact CG2-CD2 4.23Å; T163-F234 HydrophobicContact CG2-CE1 3.82Å; T163-F234 HydrophobicContact CG2-CE2 4Å; T163-F234 HydrophobicContact CG2-CG 4.23Å; T163-F234 HydrophobicContact CG2-CZ 3.79Å
164	A	96.8	Very high	95.7	Very high	4 Å²	4	44.4 Å²	44.4	3%	0.033	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	153.9	172.6	0	0	0	0	0	109.6	I166 T180 G208 S232 Y233 P235	A164-I166 PolarHBondContact O-N 2.82Å; A164-T180 HydrophobicContact CB-CG2 4.01Å; A164-G208 WeakPolarHBondContact CA-O 3.24Å; A164-S232 WeakPolarHBondContact O-CA 3.26Å; A164-Y233 PolarHBondContact N-O 3.44Å; A164-Y233 PolarHBondContact O-N 3.41Å; A164-P235 HydrophobicContact CB-CG 4.05Å
165	V	97.3	Very high	95.6	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	117	168.2	-174.2	0	0	0	0	108.8	I182 F206 G208 G210 T250 L252	V165-I182 HydrophobicContact CB-CD1 4.14Å; V165-I182 HydrophobicContact CG1-CD1 3.77Å; V165-I182 HydrophobicContact CG1-CG2 4.43Å; V165-F206 HydrophobicContact CG2-CE1 4.18Å; V165-G208 PolarHBondContact N-O 3.32Å; V165-G210 VanDerWaalsContact CG2-CA 3.41Å; V165-G210 VanDerWaalsContact CG2-N 3.34Å; V165-T250 HydrophobicContact CG1-CG2 4.13Å; V165-T250 HydrophobicContact CG2-CG2 4.05Å; V165-L252 HydrophobicContact CB-CD2 4.32Å; V165-L252 HydrophobicContact CG1-CD2 4.05Å; V165-L252 HydrophobicContact CG2-CD2 3.88Å
166	I	96.9	Very high	95.2	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.1	-177.7	-59.1	162.5	0	0	0	108.6	A164 H168 T180 S230 Y231 P235	A164-I166 PolarHBondContact O-N 2.82Å; I166-H168 WeakPolarHBondContact CG2-CE1 3.34Å; I166-T180 HydrophobicContact CG1-CG2 4.2Å; I166-S230 WeakPolarHBondContact O-CA 3.22Å; I166-Y231 HydrophobicContact CB-CE1 4.11Å; I166-Y231 HydrophobicContact CB-CE2 4.28Å; I166-Y231 HydrophobicContact CD1-CE2 4.1Å; I166-Y231 HydrophobicContact CG2-CE1 3.99Å; I166-Y231 PolarHBondContact N-O 2.9Å; I166-Y231 PolarHBondContact O-N 3.31Å; I166-P235 HydrophobicContact CD1-CB 4.27Å; I166-P235 HydrophobicContact CD1-CG 4.14Å
167	D	96.8	Very high	94.9	Very high	3 Å²	3	51 Å²	51	2%	0.016	27%	0.274	C	S	.	.			trans	-142.5	106	171.2	-171.6	-4.9	0	0	0	111.5	H169 N170 H179 I182 S227 T229	D167-H169 PolarHBondContact O-N 2.85Å; D167-H169 PolarHBondContact OD1-N 3.19Å; D167-H169 IonicContact OD1-ND1 3.81Å; D167-N170 PolarHBondContact OD1-N 3.11Å; D167-N170 WeakPolarHBondContact OD2-CB 3.35Å; D167-N170 PolarHBondContact OD2-ND2 3.15Å; D167-H179 PolarHBondContact N-O 3.39Å; D167-H179 VanDerWaalsContact N-O 3.14Å; D167-I182 HydrophobicContact CB-CG2 4.02Å; D167-S227 WeakPolarHBondContact OD2-CB 3.5Å; D167-S227 PolarHBondContact OD2-OG 3.39Å; D167-T229 VanDerWaalsContact CG-OG1 3.32Å; D167-T229 PolarHBondContact OD1-OG1 3.23Å; D167-T229 PolarHBondContact OD2-OG1 3.41Å
168	H	95.6	Very high	94.7	Very high	90 Å²	90	50.4 Å²	50.4	42%	0.417	27%	0.271	S	S	.	.	S	Bend	trans	-74.5	-4.5	-179.4	-50.6	-63.5	0	0	0	114.3	I166 Y171 H179 Y231	I166-H168 WeakPolarHBondContact CG2-CE1 3.34Å; H168-Y171 WeakPolarHBondContact O-CE1 3.37Å; H168-H179 WeakPolarHBondContact CA-ND1 3.42Å; H168-H179 AromaticContact CG-ND1 3.55Å; H168-H179 AromaticContact ND1-CE1 3.96Å; H168-H179 AromaticContact ND1-CG 3.54Å; H168-H179 AromaticContact ND1-ND1 2.93Å; H168-H179 PolarHBondContact ND1-ND1 2.87Å; H168-Y231 AromaticContact NE2-CE1 3.83Å; H168-Y231 AromaticContact NE2-CZ 3.84Å; H168-Y231 PolarHBondContact NE2-OH 3.27Å
169	H	94.6	Very high	94.6	Very high	119 Å²	119	52.3 Å²	52.3	55%	0.551	28%	0.28	S	S	*	.	S	Bend	trans	-103.9	-34.3	179	-62	82.3	0	0	0	113	D167	D167-H169 PolarHBondContact O-N 2.85Å; D167-H169 PolarHBondContact OD1-N 3.19Å; D167-H169 IonicContact OD1-ND1 3.81Å
170	N	95	Very high	94.7	Very high	24 Å²	24	51.8 Å²	51.8	13%	0.128	28%	0.278	C	S	.	.	S	Bend	trans	-121	44.9	-174.5	-53	-74.1	0	0	0	112.3	D167 V183 T229 K284	D167-N170 PolarHBondContact OD1-N 3.11Å; D167-N170 WeakPolarHBondContact OD2-CB 3.35Å; D167-N170 PolarHBondContact OD2-ND2 3.15Å; N170-V183 WeakPolarHBondContact O-CB 3.48Å; N170-V183 PolarHBondContact O-N 2.82Å; N170-T229 PolarHBondContact ND2-OG1 2.95Å; N170-K284 HydrophobicContact CB-CD 4.46Å; N170-K284 PolarHBondContact OD1-NZ 3.19Å
171	Y	95.9	Very high	94.8	Very high	61 Å²	61	47.2 Å²	47.2	24%	0.239	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-92.2	154.5	171	69	-81.2	0	0	0	111.7	H168 D175 H179 L181 K284 A285	H168-Y171 WeakPolarHBondContact O-CE1 3.37Å; Y171-D175 HydrophobicContact CD2-CB 3.94Å; Y171-H179 HydrophobicContact CD1-CB 4.22Å; Y171-H179 AromaticContact CD1-CG 3.83Å; Y171-H179 AromaticContact CD1-ND1 3.9Å; Y171-H179 AromaticContact CD2-CD2 3.91Å; Y171-H179 AromaticContact CE1-CE1 3.69Å; Y171-H179 AromaticContact CE1-ND1 3.8Å; Y171-H179 AromaticContact CE1-NE2 3.82Å; Y171-H179 AromaticContact CE2-CD2 3.84Å; Y171-H179 AromaticContact CE2-NE2 3.87Å; Y171-H179 HydrophobicContact CG-CB 4.15Å; Y171-H179 AromaticContact CG-CG 3.99Å; Y171-H179 AromaticContact CZ-CD2 3.9Å; Y171-H179 AromaticContact CZ-CE1 3.85Å; Y171-H179 AromaticContact CZ-NE2 3.55Å; Y171-L181 VanDerWaalsContact CA-O 3.28Å; Y171-L181 WeakPolarHBondContact CA-O 3.43Å; Y171-K284 WeakPolarHBondContact O-CA 3.49Å; Y171-A285 HydrophobicContact CD1-CB 4.39Å; Y171-A285 HydrophobicContact CD2-CB 3.82Å; Y171-A285 HydrophobicContact CE1-CB 3.87Å; Y171-A285 HydrophobicContact CE2-CB 3.23Å; Y171-A285 HydrophobicContact CG-CB 4.36Å; Y171-A285 PolarHBondContact O-N 2.87Å; Y171-A285 WeakPolarHBondContact OH-CB 3.41Å
172	D	96.2	Very high	94.9	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.011	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-78.8	149.7	176.8	-170.3	77.6	0	0	0	111.7	S174 D175 L181 V183 L205 Q283	D172-S174 PolarHBondContact O-N 2.79Å; D172-S174 VanDerWaalsContact O-N 3.15Å; D172-S174 VanDerWaalsContact OD2-CB 3.25Å; D172-S174 WeakPolarHBondContact OD2-CB 3.32Å; D172-S174 PolarHBondContact OD2-N 2.82Å; D172-S174 PolarHBondContact OD2-OG 3.45Å; D172-D175 WeakPolarHBondContact O-CB 3.43Å; D172-D175 PolarHBondContact O-N 2.86Å; D172-L181 HydrophobicContact CB-CD2 3.82Å; D172-L181 HydrophobicContact CB-CG 3.98Å; D172-L181 PolarHBondContact N-O 2.83Å; D172-L181 VanDerWaalsContact N-O 3.08Å; D172-V183 HydrophobicContact CB-CG2 3.77Å; D172-L205 HydrophobicContact CB-CD2 3.98Å; D172-Q283 WeakPolarHBondContact CA-O 3.48Å; D172-Q283 PolarHBondContact OD1-N 2.8Å; D172-Q283 VanDerWaalsContact OD1-O 3.05Å
173	V	94.4	Very high	95	Very high	84 Å²	84	38.5 Å²	38.5	51%	0.509	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21	176.4	-68.7	0	0	0	0	114.3	D175 Q283 A285	V173-D175 VanDerWaalsContact C-N 3.3Å; V173-Q283 HydrophobicContact CG1-CG 4.44Å; V173-Q283 HydrophobicContact CG2-CB 4.12Å; V173-Q283 PolarHBondContact N-O 3.12Å; V173-A285 HydrophobicContact CG1-CB 4.15Å
174	S	92.9	Very high	95	Very high	82 Å²	82	38.8 Å²	38.8	57%	0.573	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	0.8	176.9	65.2	0	0	0	0	114.2	D172 L181	D172-S174 PolarHBondContact O-N 2.79Å; D172-S174 VanDerWaalsContact O-N 3.15Å; D172-S174 VanDerWaalsContact OD2-CB 3.25Å; D172-S174 WeakPolarHBondContact OD2-CB 3.32Å; D172-S174 PolarHBondContact OD2-N 2.82Å; D172-S174 PolarHBondContact OD2-OG 3.45Å; S174-L181 WeakPolarHBondContact OG-CD2 3.2Å
175	D	93.4	Very high	94.8	Very high	18 Å²	18	40.7 Å²	40.7	10%	0.096	23%	0.23	C	C	.	.	S	Bend	trans	-60.8	141.4	176.4	-174.1	85.9	0	0	0	112	Y171 D172 V173 G177 E178 H179 T180 L181	Y171-D175 HydrophobicContact CD2-CB 3.94Å; D172-D175 WeakPolarHBondContact O-CB 3.43Å; D172-D175 PolarHBondContact O-N 2.86Å; V173-D175 VanDerWaalsContact C-N 3.3Å; D175-G177 PolarHBondContact O-N 2.89Å; D175-G177 WeakPolarHBondContact OD2-CA 2.97Å; D175-G177 PolarHBondContact OD2-N 3.25Å; D175-E178 PolarHBondContact OD2-N 3.39Å; D175-E178 VanDerWaalsContact OD2-N 3.09Å; D175-H179 WeakPolarHBondContact OD2-CA 3.22Å; D175-H179 IonicContact OD2-CD2 3.97Å; D175-H179 PolarHBondContact OD2-N 3.45Å; D175-T180 PolarHBondContact OD1-N 3Å; D175-L181 HydrophobicContact CB-CB 4.08Å; D175-L181 VanDerWaalsContact OD1-CB 3.29Å; D175-L181 WeakPolarHBondContact OD1-CB 3.5Å; D175-L181 PolarHBondContact OD1-N 2.94Å
176	P	88.9	Confident	94.5	Very high	96 Å²	96	43 Å²	43	62%	0.623	25%	0.245	S	C	*	.			trans	-69.4	-7.3	-179	28	-36.6	0	0	0	114.9
177	G	90.3	Very high	94.3	Very high	54 Å²	54	50.6 Å²	50.6	56%	0.557	28%	0.281	S	S	*	.	S	Bend	trans	118.4	-2.6	177.5	0	0	0	0	0	114.6	D175	D175-G177 PolarHBondContact O-N 2.89Å; D175-G177 WeakPolarHBondContact OD2-CA 2.97Å; D175-G177 PolarHBondContact OD2-N 3.25Å
178	E	91.9	Very high	94.1	Very high	97 Å²	97	51.7 Å²	51.7	45%	0.453	29%	0.286	S	S	.	.	S	Bend	trans	-90.1	-9.5	177.9	-66.9	169.1	-168.2	0	0	112.5	D175 T180	D175-E178 PolarHBondContact OD2-N 3.39Å; D175-E178 VanDerWaalsContact OD2-N 3.09Å; E178-T180 VanDerWaalsContact C-N 3.32Å; E178-T180 HydrophobicContact CB-CG2 3.85Å
179	H	95.9	Very high	94	Very high	43 Å²	43	49.2 Å²	49.2	20%	0.199	28%	0.276	C	S	.	.	S	Bend	trans	59.4	40	-176.6	-53.8	179.4	0	0	0	112.5	D167 H168 Y171 D175	D167-H179 PolarHBondContact N-O 3.39Å; D167-H179 VanDerWaalsContact N-O 3.14Å; H168-H179 WeakPolarHBondContact CA-ND1 3.42Å; H168-H179 AromaticContact CG-ND1 3.55Å; H168-H179 AromaticContact ND1-CE1 3.96Å; H168-H179 AromaticContact ND1-CG 3.54Å; H168-H179 AromaticContact ND1-ND1 2.93Å; H168-H179 PolarHBondContact ND1-ND1 2.87Å; Y171-H179 HydrophobicContact CD1-CB 4.22Å; Y171-H179 AromaticContact CD1-CG 3.83Å; Y171-H179 AromaticContact CD1-ND1 3.9Å; Y171-H179 AromaticContact CD2-CD2 3.91Å; Y171-H179 AromaticContact CE1-CE1 3.69Å; Y171-H179 AromaticContact CE1-ND1 3.8Å; Y171-H179 AromaticContact CE1-NE2 3.82Å; Y171-H179 AromaticContact CE2-CD2 3.84Å; Y171-H179 AromaticContact CE2-NE2 3.87Å; Y171-H179 HydrophobicContact CG-CB 4.15Å; Y171-H179 AromaticContact CG-CG 3.99Å; Y171-H179 AromaticContact CZ-CD2 3.9Å; Y171-H179 AromaticContact CZ-CE1 3.85Å; Y171-H179 AromaticContact CZ-NE2 3.55Å; D175-H179 WeakPolarHBondContact OD2-CA 3.22Å; D175-H179 IonicContact OD2-CD2 3.97Å; D175-H179 PolarHBondContact OD2-N 3.45Å
180	T	95.9	Very high	94	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.025	26%	0.259	C	S	.	.			trans	-100.6	-18.6	-178.8	56.1	0	0	0	0	112.9	A164 I166 D175 E178 I182 P235	A164-T180 HydrophobicContact CB-CG2 4.01Å; I166-T180 HydrophobicContact CG1-CG2 4.2Å; D175-T180 PolarHBondContact OD1-N 3Å; E178-T180 VanDerWaalsContact C-N 3.32Å; E178-T180 HydrophobicContact CB-CG2 3.85Å; T180-I182 PolarHBondContact O-N 2.72Å; T180-P235 HydrophobicContact CG2-CB 4.45Å; T180-P235 HydrophobicContact CG2-CG 4.05Å
181	L	97.1	Very high	93.9	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.063	29%	0.294	C	S	.	.	S	Bend	trans	-83.2	91.8	170.5	-178.9	59.2	0	0	0	109.6	Y171 D172 S174 D175 L205 K207 F277	Y171-L181 VanDerWaalsContact CA-O 3.28Å; Y171-L181 WeakPolarHBondContact CA-O 3.43Å; D172-L181 HydrophobicContact CB-CD2 3.82Å; D172-L181 HydrophobicContact CB-CG 3.98Å; D172-L181 PolarHBondContact N-O 2.83Å; D172-L181 VanDerWaalsContact N-O 3.08Å; S174-L181 WeakPolarHBondContact OG-CD2 3.2Å; D175-L181 HydrophobicContact CB-CB 4.08Å; D175-L181 VanDerWaalsContact OD1-CB 3.29Å; D175-L181 WeakPolarHBondContact OD1-CB 3.5Å; D175-L181 PolarHBondContact OD1-N 2.94Å; L181-L205 HydrophobicContact CD1-CB 4.34Å; L181-L205 HydrophobicContact CD1-CD2 4.33Å; L181-L205 HydrophobicContact CG-CD2 4.43Å; L181-K207 HydrophobicContact CD1-CB 4.21Å; L181-F277 HydrophobicContact CD1-CE1 4.14Å; L181-F277 HydrophobicContact CD1-CE2 4.06Å; L181-F277 HydrophobicContact CD1-CZ 3.53Å
182	I	96.9	Very high	93.8	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	142.5	-175.6	69.4	176.9	0	0	0	111.6	V165 D167 T180 F206 L252	V165-I182 HydrophobicContact CB-CD1 4.14Å; V165-I182 HydrophobicContact CG1-CD1 3.77Å; V165-I182 HydrophobicContact CG1-CG2 4.43Å; D167-I182 HydrophobicContact CB-CG2 4.02Å; T180-I182 PolarHBondContact O-N 2.72Å; I182-F206 HydrophobicContact CD1-CB 4.07Å; I182-F206 HydrophobicContact CD1-CD1 3.5Å; I182-F206 HydrophobicContact CD1-CE1 4.3Å; I182-F206 HydrophobicContact CD1-CG 4.11Å; I182-F206 HydrophobicContact CG1-CB 3.71Å; I182-F206 HydrophobicContact CG1-CD1 3.79Å; I182-F206 HydrophobicContact CG1-CG 4.2Å; I182-F206 WeakPolarHBondContact CG1-O 3.19Å; I182-F206 PolarHBondContact N-O 3.17Å; I182-F206 PolarHBondContact O-N 3.32Å; I182-L252 HydrophobicContact CD1-CD1 3.55Å; I182-L252 HydrophobicContact CD1-CD2 3.62Å; I182-L252 HydrophobicContact CD1-CG 4.25Å
183	V	96.8	Very high	93.6	Very high	5 Å²	5	54.3 Å²	54.3	3%	0.03	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	100.4	172.5	-177.7	0	0	0	0	108.1	N170 D172 P203 V204 L205 V282 K284	N170-V183 WeakPolarHBondContact O-CB 3.48Å; N170-V183 PolarHBondContact O-N 2.82Å; D172-V183 HydrophobicContact CB-CG2 3.77Å; V183-P203 HydrophobicContact CG1-CB 3.55Å; V183-P203 HydrophobicContact CG1-CG 4.43Å; V183-V204 CarbonylContact C-O 3.41Å; V183-V204 WeakPolarHBondContact CA-O 3.32Å; V183-L205 HydrophobicContact CG2-CD2 3.9Å; V183-V282 HydrophobicContact CB-CG1 4.34Å; V183-V282 HydrophobicContact CG1-CG1 3.58Å; V183-V282 HydrophobicContact CG2-CG1 3.78Å; V183-K284 HydrophobicContact CB-CG 3.96Å; V183-K284 HydrophobicContact CG1-CD 4.44Å; V183-K284 HydrophobicContact CG1-CG 3.87Å; V183-K284 HydrophobicContact CG2-CG 4.14Å
184	A	95.5	Very high	93.6	Very high	6 Å²	6	51.6 Å²	51.6	5%	0.05	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.4	176.5	0	0	0	0	0	110.6	V204 L224 L252	A184-V204 HydrophobicContact CB-CB 4.43Å; A184-V204 PolarHBondContact N-O 3.19Å; A184-V204 PolarHBondContact O-N 3.43Å; A184-L224 HydrophobicContact CB-CD1 4.16Å; A184-L224 HydrophobicContact CB-CD2 4.1Å; A184-L224 HydrophobicContact CB-CG 4.42Å; A184-L252 HydrophobicContact CB-CD1 4.03Å
185	D	93.1	Very high	93.7	Very high	45 Å²	45	47.7 Å²	47.7	24%	0.241	27%	0.269	C	S	.	.			trans	-76.7	147.9	178.2	-67.6	-45.1	0	0	0	111.6	E187 N188 K284	D185-E187 PolarHBondContact O-N 3.09Å; D185-N188 PolarHBondContact O-N 3.24Å; D185-N188 VanDerWaalsContact O-N 3.09Å; D185-K284 WeakPolarHBondContact OD1-CE 2.99Å; D185-K284 IonicContact OD1-NZ 3.94Å; D185-K284 PolarHBondContact OD1-NZ 3.11Å; D185-K284 IonicContact OD2-NZ 3.58Å; D185-K284 PolarHBondContact OD2-NZ 3.19Å
186	P	91.1	Very high	93.7	Very high	49 Å²	49	47.5 Å²	47.5	32%	0.318	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-59.7	-16.3	175.9	-24	34.5	0	0	0	114.6	N188 L189 K202	P186-N188 VanDerWaalsContact C-N 3.29Å; P186-L189 WeakPolarHBondContact O-CB 3.4Å; P186-K202 WeakPolarHBondContact CG-O 3.29Å
187	E	92.3	Very high	93.8	Very high	164 Å²	164	43.7 Å²	43.7	77%	0.766	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-70.5	-25.3	177.7	-62.4	-172.3	176.3	0	0	113.1	D185 L189	D185-E187 PolarHBondContact O-N 3.09Å; E187-L189 VanDerWaalsContact C-N 3.26Å; E187-L189 PolarHBondContact O-N 2.87Å
188	N	92.6	Very high	93.6	Very high	25 Å²	25	50 Å²	50	13%	0.134	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-85.9	-0.3	-178.7	-67.6	-18.2	0	0	0	113.4	D185 P186 T225 G226	D185-N188 PolarHBondContact O-N 3.24Å; D185-N188 VanDerWaalsContact O-N 3.09Å; P186-N188 VanDerWaalsContact C-N 3.29Å; N188-T225 VanDerWaalsContact CB-O 3.31Å; N188-T225 WeakPolarHBondContact CB-O 3.37Å; N188-T225 WeakPolarHBondContact CB-OG1 3.48Å; N188-T225 PolarHBondContact O-N 3.19Å; N188-T225 PolarHBondContact O-OG1 3.14Å; N188-G226 PolarHBondContact ND2-O 3.28Å
189	L	94.3	Very high	93.1	Very high	39 Å²	39	51.4 Å²	51.4	20%	0.204	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-93.5	144.7	-174.1	178.7	147.6	0	0	0	110.5	P186 E187 K191 V196 I223 L224 L300	P186-L189 WeakPolarHBondContact O-CB 3.4Å; E187-L189 VanDerWaalsContact C-N 3.26Å; E187-L189 PolarHBondContact O-N 2.87Å; L189-K191 PolarHBondContact O-N 2.92Å; L189-V196 HydrophobicContact CD1-CB 4.44Å; L189-V196 HydrophobicContact CD1-CG1 4.27Å; L189-V196 HydrophobicContact CD2-CB 3.55Å; L189-V196 HydrophobicContact CD2-CG1 3.57Å; L189-V196 HydrophobicContact CD2-CG2 3.5Å; L189-V196 HydrophobicContact CG-CB 4.25Å; L189-V196 HydrophobicContact CG-CG1 3.83Å; L189-I223 WeakPolarHBondContact CA-O 3.49Å; L189-L224 HydrophobicContact CB-CD1 3.99Å; L189-L224 HydrophobicContact CD1-CD1 4.41Å; L189-L300 HydrophobicContact CD1-CD1 3.88Å; L189-L300 HydrophobicContact CD1-CD2 3.78Å; L189-L300 HydrophobicContact CD1-CG 4.46Å
190	L	94.6	Very high	92.4	Very high	36 Å²	36	52.7 Å²	52.7	19%	0.188	29%	0.287	C	S	.	.			trans	-59.3	127.8	-175.8	-173.7	63.2	0	0	0	111.3	A192 I195 V196 D222 I223 L406	L190-A192 HydrophobicContact CD2-CB 4.23Å; L190-A192 HydrophobicContact CG-CB 4.1Å; L190-A192 PolarHBondContact O-N 3.26Å; L190-I195 HydrophobicContact CD2-CD1 3.71Å; L190-V196 WeakPolarHBondContact O-CG2 3.46Å; L190-D222 WeakPolarHBondContact CB-O 3.38Å; L190-I223 WeakPolarHBondContact CB-O 3.13Å; L190-I223 PolarHBondContact N-O 3.11Å; L190-L406 HydrophobicContact CD1-CD2 3.91Å; L190-L406 HydrophobicContact CD2-CD1 4.22Å; L190-L406 HydrophobicContact CD2-CD2 4.19Å; L190-L406 HydrophobicContact CD2-CG 4.44Å; L190-L406 HydrophobicContact CG-CD2 4.09Å
191	K	92.5	Very high	91.8	Very high	199 Å²	199	55 Å²	55	87%	0.865	31%	0.311	S	S	*	.	S	Bend	trans	-77.7	61.9	-178.6	-62.7	-179	-178	177.3	0	111.9	L189	L189-K191 PolarHBondContact O-N 2.92Å
192	A	93.3	Very high	91.6	Very high	9 Å²	9	56.7 Å²	56.7	7%	0.074	32%	0.318	C	S	.	.			trans	-138.6	94.6	-179.3	0	0	0	0	0	111.2	L190 T194 I195 V196 L406	L190-A192 HydrophobicContact CD2-CB 4.23Å; L190-A192 HydrophobicContact CG-CB 4.1Å; L190-A192 PolarHBondContact O-N 3.26Å; A192-T194 PolarHBondContact O-N 3.34Å; A192-I195 HydrophobicContact CB-CB 4.44Å; A192-I195 HydrophobicContact CB-CD1 4.07Å; A192-I195 HydrophobicContact CB-CG1 4.26Å; A192-I195 PolarHBondContact O-N 2.81Å; A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 2.81Å; A192-V196 VanDerWaalsContact O-N 3.11Å; A192-L406 HydrophobicContact CB-CD2 3.77Å; A192-L406 HydrophobicContact CB-CG 3.88Å
193	A	92.5	Very high	91.4	Very high	69 Å²	69	57 Å²	57	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-57.8	-24.4	-175	0	0	0	0	0	114.2	I195 G197	A193-I195 VanDerWaalsContact C-N 3.33Å; A193-G197 WeakPolarHBondContact CA-O 3.32Å; A193-G197 CarbonylContact O-C 3.51Å; A193-G197 WeakPolarHBondContact O-CA 3.35Å; A193-G197 PolarHBondContact O-N 3.33Å
194	T	93.4	Very high	91.4	Very high	26 Å²	26	57.2 Å²	57.2	16%	0.16	32%	0.321	C	S	.	.	H	α-helix	trans	-67.6	-31.5	175.9	-46.3	0	0	0	0	113.1	A192 G407 Y408	A192-T194 PolarHBondContact O-N 3.34Å; T194-G407 WeakPolarHBondContact CG2-O 3.45Å; T194-Y408 HydrophobicContact CG2-CE1 4.34Å
195	I	95.2	Very high	91.5	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-91.7	-53.2	-178.5	-58.7	175.1	0	0	0	109.8	L190 A192 A193 L221 I223 S303 L304 W307 L406	L190-I195 HydrophobicContact CD2-CD1 3.71Å; A192-I195 HydrophobicContact CB-CB 4.44Å; A192-I195 HydrophobicContact CB-CD1 4.07Å; A192-I195 HydrophobicContact CB-CG1 4.26Å; A192-I195 PolarHBondContact O-N 2.81Å; A193-I195 VanDerWaalsContact C-N 3.33Å; I195-L221 HydrophobicContact CD1-CD1 3.95Å; I195-I223 HydrophobicContact CG2-CD1 4.1Å; I195-I223 HydrophobicContact CG2-CG1 4.35Å; I195-S303 CarbonylContact O-C 3.32Å; I195-L304 HydrophobicContact CG2-CD2 3.93Å; I195-W307 HydrophobicContact CB-CG 4.38Å; I195-W307 HydrophobicContact CD1-CZ2 4.3Å; I195-W307 HydrophobicContact CG1-CD2 4.08Å; I195-W307 HydrophobicContact CG1-CG 4.12Å; I195-W307 HydrophobicContact CG1-CZ2 4.38Å; I195-W307 HydrophobicContact CG2-CD2 4.16Å; I195-W307 HydrophobicContact CG2-CE3 4.27Å; I195-W307 HydrophobicContact CG2-CG 4.34Å; I195-L406 HydrophobicContact CD1-CD1 4.39Å; I195-L406 HydrophobicContact CD1-CG 4.47Å
196	V	93.5	Very high	91.7	Very high	15 Å²	15	54.9 Å²	54.9	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-95.9	-5.9	-169.2	-64.4	0	0	0	0	114	L189 L190 A192 I223 L300 S303	L189-V196 HydrophobicContact CD1-CB 4.44Å; L189-V196 HydrophobicContact CD1-CG1 4.27Å; L189-V196 HydrophobicContact CD2-CB 3.55Å; L189-V196 HydrophobicContact CD2-CG1 3.57Å; L189-V196 HydrophobicContact CD2-CG2 3.5Å; L189-V196 HydrophobicContact CG-CB 4.25Å; L189-V196 HydrophobicContact CG-CG1 3.83Å; L190-V196 WeakPolarHBondContact O-CG2 3.46Å; A192-V196 WeakPolarHBondContact O-CG2 3.48Å; A192-V196 PolarHBondContact O-N 2.81Å; A192-V196 VanDerWaalsContact O-N 3.11Å; V196-I223 HydrophobicContact CG1-CG2 4.14Å; V196-L300 HydrophobicContact CB-CD1 4.01Å; V196-L300 HydrophobicContact CG1-CD1 4.04Å; V196-S303 VanDerWaalsContact C-CB 3.5Å; V196-S303 PolarHBondContact O-OG 2.97Å
197	G	90.9	Very high	92	Very high	15 Å²	15	56 Å²	56	16%	0.155	31%	0.308	C	S	.	.			trans	78.3	-168.8	-173.9	0	0	0	0	0	113.3	A193	A193-G197 WeakPolarHBondContact CA-O 3.32Å; A193-G197 CarbonylContact O-C 3.51Å; A193-G197 WeakPolarHBondContact O-CA 3.35Å; A193-G197 PolarHBondContact O-N 3.33Å
198	K	87.3	Confident	92.1	Very high	186 Å²	186	48.3 Å²	48.3	81%	0.809	27%	0.273	S	S	*	.	S	Bend	trans	-74	133.6	177.2	-68.4	-179.4	-178.7	176.8	0	109.2	T200	K198-T200 WeakPolarHBondContact O-CG2 3.5Å; K198-T200 PolarHBondContact O-N 2.73Å
199	P	80.3	Confident	92.3	Very high	127 Å²	127	47.1 Å²	47.1	83%	0.825	27%	0.266	S	S	*	.			trans	-59.5	124.7	179.7	-21.2	31.2	0	0	0	111
200	T	80.6	Confident	92.4	Very high	71 Å²	71	45.3 Å²	45.3	44%	0.436	26%	0.257	S	S	.	.			trans	-100.1	-11	178.7	61.2	0	0	0	0	113.2	K198 K202 E299	K198-T200 WeakPolarHBondContact O-CG2 3.5Å; K198-T200 PolarHBondContact O-N 2.73Å; T200-K202 PolarHBondContact O-N 2.81Å; T200-E299 WeakPolarHBondContact CB-OE2 3.44Å; T200-E299 WeakPolarHBondContact CG2-OE2 3.32Å; T200-E299 PolarHBondContact OG1-OE2 2.85Å
201	G	84.6	Confident	92.5	Very high	51 Å²	51	43.6 Å²	43.6	53%	0.526	25%	0.248	S	C	.	.			trans	70.7	6.4	178.2	0	0	0	0	0	114.2
202	K	91.3	Very high	92.8	Very high	49 Å²	49	35.9 Å²	35.9	21%	0.213	22%	0.217	C	C	.	.			trans	-88.8	132.6	177.5	-62.4	174.5	-175.5	169.2	0	110.3	P186 T200 E299	P186-K202 WeakPolarHBondContact CG-O 3.29Å; T200-K202 PolarHBondContact O-N 2.81Å; K202-E299 IonicContact NZ-OE1 3.44Å; K202-E299 PolarHBondContact NZ-OE1 2.8Å; K202-E299 IonicContact NZ-OE2 2.86Å
203	P	94.6	Very high	92.9	Very high	11 Å²	11	36.2 Å²	36.2	7%	0.071	22%	0.22	C	C	.	.			trans	-62.2	155.9	173	-21.2	32.8	0	0	0	112.9	V183 V282 G296	V183-P203 HydrophobicContact CG1-CB 3.55Å; V183-P203 HydrophobicContact CG1-CG 4.43Å; P203-V282 HydrophobicContact CB-CG1 4.22Å; P203-G296 PolarHBondContact O-N 2.62Å
204	V	95.6	Very high	93	Very high	9 Å²	9	36.7 Å²	36.7	6%	0.055	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	135.8	-179.3	163.2	0	0	0	0	109.4	V183 A184 L224 F272 N297 L300	V183-V204 CarbonylContact C-O 3.41Å; V183-V204 WeakPolarHBondContact CA-O 3.32Å; A184-V204 HydrophobicContact CB-CB 4.43Å; A184-V204 PolarHBondContact N-O 3.19Å; A184-V204 PolarHBondContact O-N 3.43Å; V204-L224 HydrophobicContact CG1-CD2 4.2Å; V204-F272 HydrophobicContact CG1-CD2 3.91Å; V204-F272 HydrophobicContact CG1-CE2 3.51Å; V204-N297 VanDerWaalsContact CA-OD1 3.3Å; V204-N297 WeakPolarHBondContact CA-OD1 3.21Å; V204-N297 WeakPolarHBondContact CG1-OD1 3.37Å; V204-L300 HydrophobicContact CG2-CD2 4.02Å
205	L	96.9	Very high	92.9	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.2	170.6	-67.9	179.5	0	0	0	110.2	D172 L181 V183 F277 S280 V282 T295 N297	D172-L205 HydrophobicContact CB-CD2 3.98Å; L181-L205 HydrophobicContact CD1-CB 4.34Å; L181-L205 HydrophobicContact CD1-CD2 4.33Å; L181-L205 HydrophobicContact CG-CD2 4.43Å; V183-L205 HydrophobicContact CG2-CD2 3.9Å; L205-F277 HydrophobicContact CB-CD2 3.95Å; L205-F277 HydrophobicContact CB-CE2 4.25Å; L205-F277 HydrophobicContact CB-CG 4.27Å; L205-F277 HydrophobicContact CD1-CD1 4.47Å; L205-S280 WeakPolarHBondContact CD1-OG 3.34Å; L205-V282 HydrophobicContact CD1-CG2 4.07Å; L205-V282 HydrophobicContact CD2-CB 4.46Å; L205-V282 HydrophobicContact CD2-CG1 3.79Å; L205-V282 HydrophobicContact CD2-CG2 4.04Å; L205-V282 HydrophobicContact CG-CG1 4.41Å; L205-V282 HydrophobicContact CG-CG2 3.74Å; L205-T295 HydrophobicContact CD1-CG2 3.92Å; L205-T295 HydrophobicContact CG-CG2 4.21Å; L205-N297 PolarHBondContact N-OD1 3.14Å; L205-N297 PolarHBondContact O-ND2 3.46Å
206	F	97.5	Very high	92.9	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.2	175.8	177.8	-81.3	0	0	0	109.6	V165 I182 L252 S269	V165-F206 HydrophobicContact CG2-CE1 4.18Å; I182-F206 HydrophobicContact CD1-CB 4.07Å; I182-F206 HydrophobicContact CD1-CD1 3.5Å; I182-F206 HydrophobicContact CD1-CE1 4.3Å; I182-F206 HydrophobicContact CD1-CG 4.11Å; I182-F206 HydrophobicContact CG1-CB 3.71Å; I182-F206 HydrophobicContact CG1-CD1 3.79Å; I182-F206 HydrophobicContact CG1-CG 4.2Å; I182-F206 WeakPolarHBondContact CG1-O 3.19Å; I182-F206 PolarHBondContact N-O 3.17Å; I182-F206 PolarHBondContact O-N 3.32Å; F206-L252 HydrophobicContact CB-CD1 4.5Å; F206-L252 HydrophobicContact CD1-CD1 4.46Å; F206-L252 HydrophobicContact CD1-CD2 4.02Å; F206-L252 HydrophobicContact CD2-CB 3.97Å; F206-L252 HydrophobicContact CE1-CB 4.4Å; F206-L252 HydrophobicContact CE1-CD2 3.77Å; F206-L252 HydrophobicContact CE2-CB 3.76Å; F206-L252 VanDerWaalsContact CE2-O 3.32Å; F206-L252 WeakPolarHBondContact CE2-O 3.47Å; F206-L252 HydrophobicContact CG-CB 4.37Å; F206-L252 HydrophobicContact CG-CD1 4.3Å; F206-L252 HydrophobicContact CZ-CB 3.98Å; F206-L252 HydrophobicContact CZ-CD2 4.09Å; F206-S269 VanDerWaalsContact CD2-CB 3.49Å
207	K	97.1	Very high	92.9	Very high	73 Å²	73	49.4 Å²	49.4	32%	0.317	29%	0.287	S	S	.	.			trans	-147.8	113.7	172.5	-175	-177.5	-179.3	-176.5	0	109.1	L181 S269 F277	L181-K207 HydrophobicContact CD1-CB 4.21Å; K207-S269 PolarHBondContact N-OG 3.33Å; K207-S269 WeakPolarHBondContact O-CB 3.15Å; K207-S269 PolarHBondContact O-OG 3.5Å; K207-F277 HydrophobicContact CB-CE2 4.21Å; K207-F277 HydrophobicContact CB-CZ 4.09Å
208	G	96.3	Very high	93.1	Very high	2 Å²	2	54.1 Å²	54.1	2%	0.021	31%	0.314	C	S	.	.	S	Bend	trans	165.7	-159	-178.3	0	0	0	0	0	113	A164 V165 G268	A164-G208 WeakPolarHBondContact CA-O 3.24Å; V165-G208 PolarHBondContact N-O 3.32Å; G208-G268 CarbonylContact C-O 3.57Å; G208-G268 VanDerWaalsContact CA-O 3.28Å; G208-G268 WeakPolarHBondContact CA-O 3.46Å
209	V	96.9	Very high	93.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.289	C	S	.	.			trans	-85.7	145.5	-174.2	67.2	0	0	0	0	111.4	A139 S140 I143 F158 D159 T163 G268	A139-V209 HydrophobicContact CB-CG1 3.91Å; S140-V209 WeakPolarHBondContact O-CG1 3.41Å; I143-V209 HydrophobicContact CD1-CG1 4.41Å; I143-V209 HydrophobicContact CG2-CG2 4.49Å; F158-V209 HydrophobicContact CD1-CG1 3.85Å; F158-V209 HydrophobicContact CE1-CG1 4.26Å; D159-V209 HydrophobicContact CB-CG2 3.78Å; T163-V209 WeakPolarHBondContact OG1-CG2 3.4Å; V209-G268 PolarHBondContact N-O 3.08Å; V209-G268 WeakPolarHBondContact O-CA 3.2Å
210	G	96.3	Very high	94.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.255	C	S	.	.			trans	-83.7	154.8	172.8	0	0	0	0	0	111.5	D159 V165	D159-G210 PolarHBondContact N-O 2.94Å; D159-G210 VanDerWaalsContact N-O 3.12Å; V165-G210 VanDerWaalsContact CG2-CA 3.41Å; V165-G210 VanDerWaalsContact CG2-N 3.34Å
211	M	96.8	Very high	95	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	161.7	170.7	69.2	-163.2	72.5	0	0	111.1	I156 E157 F158 L251 A254 F266 G268	I156-M211 HydrophobicContact CG2-CB 3.85Å; I156-M211 HydrophobicContact CG2-CG 3.79Å; I156-M211 HydrophobicContact CG2-SD 3.6Å; I156-M211 VanDerWaalsContact CG2-SD 3.6Å; E157-M211 CarbonylContact O-C 3.21Å; E157-M211 WeakPolarHBondContact O-CA 3.45Å; E157-M211 VanDerWaalsContact O-CB 3.3Å; E157-M211 WeakPolarHBondContact O-CB 3.25Å; F158-M211 HydrophobicContact CD1-CB 4.12Å; F158-M211 HydrophobicContact CD1-CE 4.09Å; F158-M211 HydrophobicContact CE1-CB 4.49Å; F158-M211 HydrophobicContact CE1-CE 3.41Å; F158-M211 VanDerWaalsContact CE1-CE 3.41Å; F158-M211 HydrophobicContact CE1-SD 4.23Å; F158-M211 HydrophobicContact CG-CB 4.5Å; F158-M211 HydrophobicContact CZ-CE 4.03Å; F158-M211 HydrophobicContact CZ-SD 4.44Å; M211-L251 HydrophobicContact CG-CB 3.6Å; M211-L251 WeakPolarHBondContact CG-O 3.31Å; M211-L251 PolarHBondContact N-O 3.49Å; M211-L251 WeakPolarHBondContact O-CA 3.3Å; M211-L251 VanDerWaalsContact O-CB 3.32Å; M211-L251 WeakPolarHBondContact O-CB 3.25Å; M211-L251 PolarHBondContact O-N 3.01Å; M211-A254 HydrophobicContact SD-CB 3.68Å; M211-F266 HydrophobicContact CE-CB 4.42Å; M211-F266 HydrophobicContact SD-CB 3.98Å; M211-G268 VanDerWaalsContact CE-N 3.32Å
212	V	97.3	Very high	95.5	Very high	37 Å²	37	41.6 Å²	41.6	22%	0.224	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.8	174.8	-179.3	0	0	0	0	108.5	E157 A245	E157-V212 PolarHBondContact N-O 2.87Å; E157-V212 PolarHBondContact O-N 3.24Å; V212-A245 HydrophobicContact CG2-CB 3.61Å
213	A	95.9	Very high	95.8	Very high	17 Å²	17	39.2 Å²	39.2	14%	0.14	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	146	172.3	0	0	0	0	0	110.7	P215 V220 L251	A213-P215 VanDerWaalsContact O-CD 3.29Å; A213-P215 WeakPolarHBondContact O-CD 3.26Å; A213-V220 HydrophobicContact CB-CB 4.41Å; A213-V220 HydrophobicContact CB-CG1 3.57Å; A213-L251 HydrophobicContact CB-CD1 3.5Å
214	D	94.1	Very high	95.9	Very high	79 Å²	79	38.8 Å²	38.8	42%	0.422	22%	0.221	S	C	.	.			trans	-66.9	117.9	168.7	-176	-3.2	0	0	0	110.2	G155 D216 N217	G155-D214 PolarHBondContact O-N 3.15Å; G155-D214 VanDerWaalsContact O-N 3.12Å; D214-D216 PolarHBondContact O-N 3.41Å; D214-D216 VanDerWaalsContact O-N 3.16Å; D214-D216 PolarHBondContact OD1-N 3.04Å; D214-N217 HydrophobicContact CB-CB 4.28Å; D214-N217 PolarHBondContact O-N 3.08Å; D214-N217 VanDerWaalsContact O-N 3.08Å
215	P	92.3	Very high	96	Very high	124 Å²	124	39 Å²	39	81%	0.805	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.1	178.9	-22.4	34.2	0	0	0	114.1	A213 N217	A213-P215 VanDerWaalsContact O-CD 3.29Å; A213-P215 WeakPolarHBondContact O-CD 3.26Å; P215-N217 VanDerWaalsContact C-N 3.29Å
216	D	93.8	Very high	95.9	Very high	145 Å²	145	39 Å²	39	78%	0.775	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-12	179.9	-72.1	-22.8	0	0	0	112.4	D214 P218	D214-D216 PolarHBondContact O-N 3.41Å; D214-D216 VanDerWaalsContact O-N 3.16Å; D214-D216 PolarHBondContact OD1-N 3.04Å; D216-P218 WeakPolarHBondContact O-CD 3.43Å
217	N	94.4	Very high	95.8	Very high	39 Å²	39	39.6 Å²	39.6	21%	0.209	23%	0.227	C	C	.	.			trans	-89	107.3	-179.8	-170	-14.5	0	0	0	111.9	D214 P215 L219 V220	D214-N217 HydrophobicContact CB-CB 4.28Å; D214-N217 PolarHBondContact O-N 3.08Å; D214-N217 VanDerWaalsContact O-N 3.08Å; P215-N217 VanDerWaalsContact C-N 3.29Å; N217-L219 PolarHBondContact O-N 3.08Å; N217-L219 WeakPolarHBondContact OD1-CB 3.45Å; N217-L219 PolarHBondContact OD1-N 3.06Å; N217-V220 HydrophobicContact CB-CG2 4.09Å; N217-V220 WeakPolarHBondContact ND2-CG2 3.38Å
218	P	94.3	Very high	95.7	Very high	113 Å²	113	40.9 Å²	40.9	73%	0.734	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.7	-177.3	34.3	-38.1	0	0	0	113.9	D216	D216-P218 WeakPolarHBondContact O-CD 3.43Å
219	L	95.9	Very high	95.7	Very high	52 Å²	52	43.3 Å²	43.3	27%	0.272	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-14.4	-175.6	-57	-179.6	0	0	0	113.1	N217 L256 Q257 R259	N217-L219 PolarHBondContact O-N 3.08Å; N217-L219 WeakPolarHBondContact OD1-CB 3.45Å; N217-L219 PolarHBondContact OD1-N 3.06Å; L219-L256 HydrophobicContact CB-CD1 3.94Å; L219-Q257 PolarHBondContact O-N 2.96Å; L219-R259 HydrophobicContact CD1-CG 4.19Å
220	V	96.3	Very high	95.7	Very high	19 Å²	19	43.4 Å²	43.4	12%	0.115	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	142.2	179.7	178.7	0	0	0	0	109.9	I156 A213 N217 G255 L256	I156-V220 HydrophobicContact CD1-CG1 4.25Å; I156-V220 HydrophobicContact CG1-CG1 4.04Å; I156-V220 HydrophobicContact CG1-CG2 4.31Å; A213-V220 HydrophobicContact CB-CB 4.41Å; A213-V220 HydrophobicContact CB-CG1 3.57Å; N217-V220 HydrophobicContact CB-CG2 4.09Å; N217-V220 WeakPolarHBondContact ND2-CG2 3.38Å; V220-G255 CarbonylContact C-O 3.43Å; V220-G255 WeakPolarHBondContact CA-O 3.17Å; V220-L256 HydrophobicContact CG2-CD1 3.74Å
221	L	96.2	Very high	95.7	Very high	26 Å²	26	45.4 Å²	45.4	14%	0.136	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.1	-177.3	-56.8	-179.8	0	0	0	109.5	I195 I223 A254 G255 W307 L406	I195-L221 HydrophobicContact CD1-CD1 3.95Å; L221-I223 PolarHBondContact O-N 3.37Å; L221-I223 VanDerWaalsContact O-N 3.12Å; L221-A254 WeakPolarHBondContact O-CA 2.96Å; L221-G255 PolarHBondContact N-O 3.36Å; L221-G255 PolarHBondContact O-N 3.15Å; L221-W307 HydrophobicContact CD1-CH2 4Å; L221-W307 HydrophobicContact CD1-CZ2 4.03Å; L221-L406 HydrophobicContact CD1-CD1 4.12Å; L221-L406 HydrophobicContact CD2-CD1 3.38Å; L221-L406 HydrophobicContact CG-CD1 4.33Å
222	D	96.3	Very high	95.6	Very high	75 Å²	75	45.4 Å²	45.4	40%	0.401	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	91.5	176.1	-55.2	-23.4	0	0	0	109.4	L190 T225 L251	L190-D222 WeakPolarHBondContact CB-O 3.38Å; D222-T225 HydrophobicContact CB-CG2 4.12Å; D222-L251 HydrophobicContact CB-CD2 3.72Å; D222-L251 VanDerWaalsContact OD1-CD1 3.31Å; D222-L251 WeakPolarHBondContact OD1-CD1 3.32Å
223	I	96.9	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-49.6	-173.5	-63.6	179.6	0	0	0	110.9	L189 L190 I195 V196 L221 I253 V265 L304	L189-I223 WeakPolarHBondContact CA-O 3.49Å; L190-I223 WeakPolarHBondContact CB-O 3.13Å; L190-I223 PolarHBondContact N-O 3.11Å; I195-I223 HydrophobicContact CG2-CD1 4.1Å; I195-I223 HydrophobicContact CG2-CG1 4.35Å; V196-I223 HydrophobicContact CG1-CG2 4.14Å; L221-I223 PolarHBondContact O-N 3.37Å; L221-I223 VanDerWaalsContact O-N 3.12Å; I223-I253 HydrophobicContact CB-CB 4.22Å; I223-I253 HydrophobicContact CB-CG2 3.98Å; I223-I253 WeakPolarHBondContact CB-O 3.32Å; I223-I253 HydrophobicContact CD1-CG2 4.18Å; I223-I253 HydrophobicContact CG2-CB 4.35Å; I223-I253 HydrophobicContact CG2-CG2 4.04Å; I223-I253 PolarHBondContact N-O 3.27Å; I223-I253 VanDerWaalsContact N-O 3.08Å; I223-V265 HydrophobicContact CD1-CG2 3.95Å; I223-L304 HydrophobicContact CD1-CD2 3.94Å; I223-L304 HydrophobicContact CG2-CD2 3.76Å
224	L	96.8	Very high	95.6	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	117.8	178.4	-177.2	66	0	0	0	109.6	A184 L189 V204 L252 I253	A184-L224 HydrophobicContact CB-CD1 4.16Å; A184-L224 HydrophobicContact CB-CD2 4.1Å; A184-L224 HydrophobicContact CB-CG 4.42Å; L189-L224 HydrophobicContact CB-CD1 3.99Å; L189-L224 HydrophobicContact CD1-CD1 4.41Å; V204-L224 HydrophobicContact CG1-CD2 4.2Å; L224-L252 HydrophobicContact CB-CB 4.46Å; L224-L252 HydrophobicContact CD2-CB 4.15Å; L224-L252 HydrophobicContact CD2-CD1 4.03Å; L224-L252 HydrophobicContact CG-CB 4.22Å; L224-L252 HydrophobicContact CG-CD1 4.1Å; L224-L252 PolarHBondContact O-N 2.84Å; L224-I253 HydrophobicContact CB-CB 3.94Å; L224-I253 HydrophobicContact CB-CD1 4.19Å; L224-I253 HydrophobicContact CB-CG1 4.06Å; L224-I253 HydrophobicContact CD2-CD1 4.02Å; L224-I253 HydrophobicContact CD2-CG1 4.27Å; L224-I253 PolarHBondContact N-O 2.92Å; L224-I253 PolarHBondContact O-N 3.42Å
225	T	97.1	Very high	95.6	Very high	14 Å²	14	43.8 Å²	43.8	9%	0.086	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	153.8	177.2	59.9	0	0	0	0	111.4	N188 D222 T250 L251	N188-T225 VanDerWaalsContact CB-O 3.31Å; N188-T225 WeakPolarHBondContact CB-O 3.37Å; N188-T225 WeakPolarHBondContact CB-OG1 3.48Å; N188-T225 PolarHBondContact O-N 3.19Å; N188-T225 PolarHBondContact O-OG1 3.14Å; D222-T225 HydrophobicContact CB-CG2 4.12Å; T225-T250 CarbonylContact C-O 3.56Å; T225-L251 HydrophobicContact CG2-CD2 3.73Å
226	G	95.3	Very high	95.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.01	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-66.7	171.3	169.9	0	0	0	0	0	112.3	N188 S230 T250	N188-G226 PolarHBondContact ND2-O 3.28Å; G226-S230 WeakPolarHBondContact CA-OG 3.3Å; G226-T250 PolarHBondContact N-O 2.81Å
227	S	95.6	Very high	95.7	Very high	14 Å²	14	45 Å²	45	10%	0.098	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-72.5	170	174.2	77.9	0	0	0	0	110.7	D167 T229 S230 G247	D167-S227 WeakPolarHBondContact OD2-CB 3.5Å; D167-S227 PolarHBondContact OD2-OG 3.39Å; S227-T229 PolarHBondContact O-N 2.73Å; S227-T229 VanDerWaalsContact O-N 3.15Å; S227-T229 PolarHBondContact OG-N 3.35Å; S227-T229 VanDerWaalsContact OG-N 3.15Å; S227-T229 PolarHBondContact OG-OG1 2.9Å; S227-T229 VanDerWaalsContact OG-OG1 3.08Å; S227-S230 PolarHBondContact N-OG 2.69Å; S227-S230 VanDerWaalsContact N-OG 3.15Å; S227-S230 PolarHBondContact O-N 3.27Å; S227-S230 PolarHBondContact O-OG 2.86Å; S227-S230 PolarHBondContact OG-N 3.03Å; S227-S230 VanDerWaalsContact OG-N 3.1Å; S227-G247 CarbonylContact O-C 3.57Å
228	S	95.9	Very high	95.7	Very high	100 Å²	100	48.5 Å²	48.5	70%	0.699	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.8	172.4	57.2	0	0	0	0	113.7
229	T	95.6	Very high	95.7	Very high	53 Å²	53	47.6 Å²	47.6	33%	0.325	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-5.3	-177.2	53.7	0	0	0	0	113.5	D167 N170 S227	D167-T229 VanDerWaalsContact CG-OG1 3.32Å; D167-T229 PolarHBondContact OD1-OG1 3.23Å; D167-T229 PolarHBondContact OD2-OG1 3.41Å; N170-T229 PolarHBondContact ND2-OG1 2.95Å; S227-T229 PolarHBondContact O-N 2.73Å; S227-T229 VanDerWaalsContact O-N 3.15Å; S227-T229 PolarHBondContact OG-N 3.35Å; S227-T229 VanDerWaalsContact OG-N 3.15Å; S227-T229 PolarHBondContact OG-OG1 2.9Å; S227-T229 VanDerWaalsContact OG-OG1 3.08Å
230	S	96.1	Very high	95.5	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.014	28%	0.276	C	S	.	.			trans	-76.2	147.9	177.2	56.4	0	0	0	0	111.9	I166 G226 S227 G247	I166-S230 WeakPolarHBondContact O-CA 3.22Å; G226-S230 WeakPolarHBondContact CA-OG 3.3Å; S227-S230 PolarHBondContact N-OG 2.69Å; S227-S230 VanDerWaalsContact N-OG 3.15Å; S227-S230 PolarHBondContact O-N 3.27Å; S227-S230 PolarHBondContact O-OG 2.86Å; S227-S230 PolarHBondContact OG-N 3.03Å; S227-S230 VanDerWaalsContact OG-N 3.1Å; S230-G247 WeakPolarHBondContact O-CA 3.12Å; S230-G247 PolarHBondContact O-N 3.41Å
231	Y	96.4	Very high	95.4	Very high	43 Å²	43	55.9 Å²	55.9	17%	0.169	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	153.2	169.7	65	-80.1	0	0	0	109.2	I166 H168 I239 P243 A245	I166-Y231 HydrophobicContact CB-CE1 4.11Å; I166-Y231 HydrophobicContact CB-CE2 4.28Å; I166-Y231 HydrophobicContact CD1-CE2 4.1Å; I166-Y231 HydrophobicContact CG2-CE1 3.99Å; I166-Y231 PolarHBondContact N-O 2.9Å; I166-Y231 PolarHBondContact O-N 3.31Å; H168-Y231 AromaticContact NE2-CE1 3.83Å; H168-Y231 AromaticContact NE2-CZ 3.84Å; H168-Y231 PolarHBondContact NE2-OH 3.27Å; Y231-I239 HydrophobicContact CD2-CD1 4.2Å; Y231-I239 HydrophobicContact CE2-CD1 3.64Å; Y231-I239 HydrophobicContact CE2-CG1 4.47Å; Y231-P243 HydrophobicContact CD2-CG 4.43Å; Y231-A245 CarbonylContact C-O 3.59Å; Y231-A245 WeakPolarHBondContact CA-O 3.24Å
232	S	95.9	Very high	95.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.7	177	-168.4	0	0	0	0	109.8	D159 A164 P243 A245	D159-S232 WeakPolarHBondContact OD2-CB 3.19Å; D159-S232 PolarHBondContact OD2-OG 2.96Å; A164-S232 WeakPolarHBondContact O-CA 3.26Å; S232-P243 WeakPolarHBondContact O-CB 3.39Å; S232-A245 PolarHBondContact N-O 3.41Å
233	Y	96.4	Very high	95.1	Very high	27 Å²	27	60.8 Å²	60.8	11%	0.106	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	176.5	177.6	-156.1	-109.9	0	0	0	111.1	A164 P235 R237 I239 S240 P243	A164-Y233 PolarHBondContact N-O 3.44Å; A164-Y233 PolarHBondContact O-N 3.41Å; Y233-P235 WeakPolarHBondContact O-CD 3.31Å; Y233-R237 HydrophobicContact CE1-CB 4.47Å; Y233-I239 HydrophobicContact CD1-CG1 3.79Å; Y233-I239 HydrophobicContact CE1-CB 4.28Å; Y233-I239 HydrophobicContact CE1-CG1 4Å; Y233-I239 HydrophobicContact CG-CG1 4.24Å; Y233-S240 PolarHBondContact OH-N 2.99Å; Y233-S240 PolarHBondContact OH-OG 2.94Å; Y233-P243 HydrophobicContact CD2-CB 4.26Å; Y233-P243 HydrophobicContact CD2-CG 4.38Å
234	F	96.5	Very high	94.8	Very high	27 Å²	27	63.9 Å²	63.9	12%	0.118	33%	0.332	C	S	.	.			trans	-69.4	119.1	170.8	-62.3	-79	0	0	0	111.1	E160 E161 K162 T163 D236 R237	E160-F234 HydrophobicContact CB-CZ 4.09Å; E160-F234 WeakPolarHBondContact OE2-CZ 3.44Å; E161-F234 VanDerWaalsContact O-CE1 3.27Å; E161-F234 WeakPolarHBondContact O-CE1 3.42Å; K162-F234 HydrophobicContact CB-CD1 4.12Å; K162-F234 HydrophobicContact CB-CE1 4.11Å; T163-F234 HydrophobicContact CG2-CD1 4.03Å; T163-F234 HydrophobicContact CG2-CD2 4.23Å; T163-F234 HydrophobicContact CG2-CE1 3.82Å; T163-F234 HydrophobicContact CG2-CE2 4Å; T163-F234 HydrophobicContact CG2-CG 4.23Å; T163-F234 HydrophobicContact CG2-CZ 3.79Å; F234-D236 VanDerWaalsContact C-N 3.3Å; F234-D236 PolarHBondContact O-N 2.86Å; F234-R237 HydrophobicContact CB-CB 3.9Å; F234-R237 HydrophobicContact CB-CG 4.04Å; F234-R237 PolarHBondContact O-N 2.95Å
235	P	93.6	Very high	94.5	Very high	45 Å²	45	63.9 Å²	63.9	29%	0.292	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-35.8	-178.5	-24.7	34.6	0	0	0	114	A164 I166 T180 Y233	A164-P235 HydrophobicContact CB-CG 4.05Å; I166-P235 HydrophobicContact CD1-CB 4.27Å; I166-P235 HydrophobicContact CD1-CG 4.14Å; T180-P235 HydrophobicContact CG2-CB 4.45Å; T180-P235 HydrophobicContact CG2-CG 4.05Å; Y233-P235 WeakPolarHBondContact O-CD 3.31Å
236	D	93.3	Very high	94.4	Very high	145 Å²	145	66 Å²	66	78%	0.775	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.4	-174.1	-63.9	-40.2	0	0	0	114.4	F234	F234-D236 VanDerWaalsContact C-N 3.3Å; F234-D236 PolarHBondContact O-N 2.86Å
237	R	94.3	Very high	94.3	Very high	150 Å²	150	66.5 Å²	66.5	57%	0.566	35%	0.351	S	S	*	.	S	Bend	trans	-116	141.5	-172	-60.8	-177.6	179.1	173.5	1.1	111.4	Y233 F234	Y233-R237 HydrophobicContact CE1-CB 4.47Å; F234-R237 HydrophobicContact CB-CB 3.9Å; F234-R237 HydrophobicContact CB-CG 4.04Å; F234-R237 PolarHBondContact O-N 2.95Å
238	P	94.3	Very high	94.2	Very high	112 Å²	112	71.2 Å²	71.2	73%	0.727	37%	0.37	S	S	*	.			trans	-66.1	140.3	172.5	29.2	-34.2	0	0	0	110.4	S240	P238-S240 PolarHBondContact O-N 2.85Å; P238-S240 VanDerWaalsContact O-N 3.14Å
239	I	94.3	Very high	94.1	Very high	93 Å²	93	72.4 Å²	72.4	48%	0.477	37%	0.368	S	S	.	.			trans	-65.3	114.2	177.3	-56.5	174.5	0	0	0	109	Y231 Y233 Q241 P243	Y231-I239 HydrophobicContact CD2-CD1 4.2Å; Y231-I239 HydrophobicContact CE2-CD1 3.64Å; Y231-I239 HydrophobicContact CE2-CG1 4.47Å; Y233-I239 HydrophobicContact CD1-CG1 3.79Å; Y233-I239 HydrophobicContact CE1-CB 4.28Å; Y233-I239 HydrophobicContact CE1-CG1 4Å; Y233-I239 HydrophobicContact CG-CG1 4.24Å; I239-Q241 WeakPolarHBondContact CG2-O 3.36Å; I239-P243 HydrophobicContact CG2-CG 4.14Å
240	S	92.3	Very high	94.1	Very high	97 Å²	97	69.9 Å²	69.9	68%	0.678	35%	0.353	S	S	*	.			trans	-109.7	-27.3	179.4	57	0	0	0	0	113.2	Y233 P238	Y233-S240 PolarHBondContact OH-N 2.99Å; Y233-S240 PolarHBondContact OH-OG 2.94Å; P238-S240 PolarHBondContact O-N 2.85Å; P238-S240 VanDerWaalsContact O-N 3.14Å
241	Q	93.2	Very high	94.2	Very high	148 Å²	148	70 Å²	70	69%	0.692	35%	0.353	S	S	*	.	S	Bend	trans	-123.4	164.7	-179.2	-60.8	-178.5	16.8	0	0	109.3	I239 P243	I239-Q241 WeakPolarHBondContact CG2-O 3.36Å; Q241-P243 WeakPolarHBondContact O-CD 3.4Å
242	Y	93.3	Very high	94.2	Very high	189 Å²	189	68 Å²	68	74%	0.741	35%	0.345	S	S	*	.			trans	-62.6	122.8	172.7	-171.2	-101.7	0	0	0	109	V246	Y242-V246 HydrophobicContact CE1-CG1 3.89Å; Y242-V246 HydrophobicContact CE2-CG1 4.15Å; Y242-V246 VanDerWaalsContact CZ-CG1 3.43Å; Y242-V246 WeakPolarHBondContact OH-CG1 3.33Å
243	P	93.5	Very high	94.4	Very high	15 Å²	15	68 Å²	68	10%	0.097	35%	0.345	C	S	.	.			trans	-57.9	148.1	179.7	-24.7	34.6	0	0	0	112	Y231 S232 Y233 I239 Q241 A245	Y231-P243 HydrophobicContact CD2-CG 4.43Å; S232-P243 WeakPolarHBondContact O-CB 3.39Å; Y233-P243 HydrophobicContact CD2-CB 4.26Å; Y233-P243 HydrophobicContact CD2-CG 4.38Å; I239-P243 HydrophobicContact CG2-CG 4.14Å; Q241-P243 WeakPolarHBondContact O-CD 3.4Å; P243-A245 PolarHBondContact O-N 2.85Å
244	H	91.7	Very high	94.4	Very high	65 Å²	65	66.7 Å²	66.7	30%	0.301	34%	0.34	S	S	.	.	S	Bend	trans	-59.5	-49.4	-177.1	-179.8	69.8	0	0	0	111.8	E157 D159	E157-H244 IonicContact OE1-CE1 3.04Å; E157-H244 PolarHBondContact OE1-CE1 3.35Å; E157-H244 IonicContact OE2-CE1 3.41Å; E157-H244 PolarHBondContact OE2-CE1 3.18Å; D159-H244 WeakPolarHBondContact OD1-CB 3.24Å; D159-H244 IonicContact OD1-CG 2.66Å
245	A	90.8	Very high	94.5	Very high	2 Å²	2	65.4 Å²	65.4	2%	0.017	33%	0.334	C	S	.	.	S	Bend	trans	-117.7	127.8	175	0	0	0	0	0	110.6	V212 Y231 S232 P243 T250	V212-A245 HydrophobicContact CG2-CB 3.61Å; Y231-A245 CarbonylContact C-O 3.59Å; Y231-A245 WeakPolarHBondContact CA-O 3.24Å; S232-A245 PolarHBondContact N-O 3.41Å; P243-A245 PolarHBondContact O-N 2.85Å; A245-T250 HydrophobicContact CB-CG2 3.88Å
246	V	94.6	Very high	94.6	Very high	57 Å²	57	63.9 Å²	63.9	35%	0.345	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-139.9	141	177.5	64.8	0	0	0	0	112.4	Y242	Y242-V246 HydrophobicContact CE1-CG1 3.89Å; Y242-V246 HydrophobicContact CE2-CG1 4.15Å; Y242-V246 VanDerWaalsContact CZ-CG1 3.43Å; Y242-V246 WeakPolarHBondContact OH-CG1 3.33Å
247	G	93.3	Very high	94.8	Very high	12 Å²	12	57.9 Å²	57.9	12%	0.124	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	65.2	-145.9	-177.5	0	0	0	0	0	111.9	S227 S230 N249 T250	S227-G247 CarbonylContact O-C 3.57Å; S230-G247 WeakPolarHBondContact O-CA 3.12Å; S230-G247 PolarHBondContact O-N 3.41Å; G247-N249 PolarHBondContact O-N 3.29Å; G247-T250 WeakPolarHBondContact O-CB 3.39Å; G247-T250 PolarHBondContact O-N 3.04Å; G247-T250 VanDerWaalsContact O-N 3.16Å; G247-T250 PolarHBondContact O-OG1 2.72Å
248	K	93.3	Very high	94.9	Very high	114 Å²	114	51.4 Å²	51.4	50%	0.496	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-70	-16.7	-173	-168.4	165.8	-177.5	165.6	0	114.2	T250	K248-T250 PolarHBondContact O-N 2.68Å
249	N	93.1	Very high	94.9	Very high	125 Å²	125	56.1 Å²	56.1	67%	0.668	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-74.4	-10.4	176	-66.2	9.9	0	0	0	112.2	G247 L251	G247-N249 PolarHBondContact O-N 3.29Å; N249-L251 PolarHBondContact O-N 2.99Å
250	T	96.6	Very high	95	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.266	C	S	.	.			trans	-66.9	114.5	171.9	-47.7	0	0	0	0	109	V165 T225 G226 A245 G247 K248 L252	V165-T250 HydrophobicContact CG1-CG2 4.13Å; V165-T250 HydrophobicContact CG2-CG2 4.05Å; T225-T250 CarbonylContact C-O 3.56Å; G226-T250 PolarHBondContact N-O 2.81Å; A245-T250 HydrophobicContact CB-CG2 3.88Å; G247-T250 WeakPolarHBondContact O-CB 3.39Å; G247-T250 PolarHBondContact O-N 3.04Å; G247-T250 VanDerWaalsContact O-N 3.16Å; G247-T250 PolarHBondContact O-OG1 2.72Å; K248-T250 PolarHBondContact O-N 2.68Å; T250-L252 HydrophobicContact CG2-CD2 4.41Å
251	L	97.4	Very high	95.2	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.021	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.3	174.5	-56	-177.6	0	0	0	109.4	M211 A213 D222 T225 N249 A254	M211-L251 HydrophobicContact CG-CB 3.6Å; M211-L251 WeakPolarHBondContact CG-O 3.31Å; M211-L251 PolarHBondContact N-O 3.49Å; M211-L251 WeakPolarHBondContact O-CA 3.3Å; M211-L251 VanDerWaalsContact O-CB 3.32Å; M211-L251 WeakPolarHBondContact O-CB 3.25Å; M211-L251 PolarHBondContact O-N 3.01Å; A213-L251 HydrophobicContact CB-CD1 3.5Å; D222-L251 HydrophobicContact CB-CD2 3.72Å; D222-L251 VanDerWaalsContact OD1-CD1 3.31Å; D222-L251 WeakPolarHBondContact OD1-CD1 3.32Å; T225-L251 HydrophobicContact CG2-CD2 3.73Å; N249-L251 PolarHBondContact O-N 2.99Å; L251-A254 HydrophobicContact CD1-CB 4.24Å
252	L	97.5	Very high	95.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-39	175.2	-53.2	-178.1	0	0	0	110.3	V165 I182 A184 F206 L224 T250 G268	V165-L252 HydrophobicContact CB-CD2 4.32Å; V165-L252 HydrophobicContact CG1-CD2 4.05Å; V165-L252 HydrophobicContact CG2-CD2 3.88Å; I182-L252 HydrophobicContact CD1-CD1 3.55Å; I182-L252 HydrophobicContact CD1-CD2 3.62Å; I182-L252 HydrophobicContact CD1-CG 4.25Å; A184-L252 HydrophobicContact CB-CD1 4.03Å; F206-L252 HydrophobicContact CB-CD1 4.5Å; F206-L252 HydrophobicContact CD1-CD1 4.46Å; F206-L252 HydrophobicContact CD1-CD2 4.02Å; F206-L252 HydrophobicContact CD2-CB 3.97Å; F206-L252 HydrophobicContact CE1-CB 4.4Å; F206-L252 HydrophobicContact CE1-CD2 3.77Å; F206-L252 HydrophobicContact CE2-CB 3.76Å; F206-L252 VanDerWaalsContact CE2-O 3.32Å; F206-L252 WeakPolarHBondContact CE2-O 3.47Å; F206-L252 HydrophobicContact CG-CB 4.37Å; F206-L252 HydrophobicContact CG-CD1 4.3Å; F206-L252 HydrophobicContact CZ-CB 3.98Å; F206-L252 HydrophobicContact CZ-CD2 4.09Å; L224-L252 HydrophobicContact CB-CB 4.46Å; L224-L252 HydrophobicContact CD2-CB 4.15Å; L224-L252 HydrophobicContact CD2-CD1 4.03Å; L224-L252 HydrophobicContact CG-CB 4.22Å; L224-L252 HydrophobicContact CG-CD1 4.1Å; L224-L252 PolarHBondContact O-N 2.84Å; T250-L252 HydrophobicContact CG2-CD2 4.41Å; L252-G268 PolarHBondContact O-N 3.29Å
253	I	98.2	Very high	95.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	124.9	174.7	-52.6	177.5	0	0	0	107.6	I223 L224 V265 F266 F272 L300 L304	I223-I253 HydrophobicContact CB-CB 4.22Å; I223-I253 HydrophobicContact CB-CG2 3.98Å; I223-I253 WeakPolarHBondContact CB-O 3.32Å; I223-I253 HydrophobicContact CD1-CG2 4.18Å; I223-I253 HydrophobicContact CG2-CB 4.35Å; I223-I253 HydrophobicContact CG2-CG2 4.04Å; I223-I253 PolarHBondContact N-O 3.27Å; I223-I253 VanDerWaalsContact N-O 3.08Å; L224-I253 HydrophobicContact CB-CB 3.94Å; L224-I253 HydrophobicContact CB-CD1 4.19Å; L224-I253 HydrophobicContact CB-CG1 4.06Å; L224-I253 HydrophobicContact CD2-CD1 4.02Å; L224-I253 HydrophobicContact CD2-CG1 4.27Å; L224-I253 PolarHBondContact N-O 2.92Å; L224-I253 PolarHBondContact O-N 3.42Å; I253-V265 HydrophobicContact CG2-CG1 3.9Å; I253-F266 WeakPolarHBondContact CA-O 3.21Å; I253-F272 HydrophobicContact CD1-CD1 4.42Å; I253-F272 HydrophobicContact CD1-CE1 4Å; I253-F272 HydrophobicContact CD1-CE2 4.15Å; I253-F272 HydrophobicContact CD1-CZ 3.87Å; I253-L300 HydrophobicContact CD1-CD2 4.48Å; I253-L304 HydrophobicContact CD1-CD1 4.02Å; I253-L304 HydrophobicContact CG2-CD1 4.2Å
254	A	97.8	Very high	95.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.8	175	0	0	0	0	0	110.2	I156 M211 L221 L251 V265 F266	I156-A254 HydrophobicContact CD1-CB 3.62Å; I156-A254 HydrophobicContact CG1-CB 4.22Å; I156-A254 HydrophobicContact CG2-CB 4.43Å; M211-A254 HydrophobicContact SD-CB 3.68Å; L221-A254 WeakPolarHBondContact O-CA 2.96Å; L251-A254 HydrophobicContact CD1-CB 4.24Å; A254-V265 WeakPolarHBondContact O-CA 3.31Å; A254-F266 PolarHBondContact N-O 2.98Å; A254-F266 PolarHBondContact O-N 3.08Å
255	G	97.2	Very high	96.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	152.2	173.2	0	0	0	0	0	110.8	V220 L221 V264	V220-G255 CarbonylContact C-O 3.43Å; V220-G255 WeakPolarHBondContact CA-O 3.17Å; L221-G255 PolarHBondContact N-O 3.36Å; L221-G255 PolarHBondContact O-N 3.15Å; G255-V264 CarbonylContact C-O 3.57Å; G255-V264 VanDerWaalsContact CA-O 3.31Å; G255-V264 WeakPolarHBondContact CA-O 3.36Å
256	L	97.3	Very high	96.4	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.068	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.4	169.8	-177.5	84	0	0	0	108.1	C154 L219 V220 V264	C154-L256 HydrophobicContact CB-CD2 4.07Å; L219-L256 HydrophobicContact CB-CD1 3.94Å; V220-L256 HydrophobicContact CG2-CD1 3.74Å; L256-V264 HydrophobicContact CB-CB 4.24Å; L256-V264 PolarHBondContact N-O 3.17Å; L256-V264 PolarHBondContact O-N 2.93Å
257	Q	96.5	Very high	96.6	Very high	19 Å²	19	28.8 Å²	28.8	9%	0.089	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	103.3	166.3	-176.7	167.4	-28.7	0	0	109.4	L219 N261 Y408	L219-Q257 PolarHBondContact O-N 2.96Å; Q257-N261 PolarHBondContact NE2-OD1 2.88Å; Q257-Y408 PolarHBondContact NE2-O 3.23Å; Q257-Y408 PolarHBondContact OE1-O 3.4Å
258	A	96	Very high	96.8	Very high	15 Å²	15	28.2 Å²	28.2	12%	0.124	13%	0.131	C	C	.	.			trans	-71	163.9	-179.1	0	0	0	0	0	112.1	N260 N261 A262	A258-N260 WeakPolarHBondContact CB-OD1 3.41Å; A258-N260 PolarHBondContact O-N 3.11Å; A258-N261 VanDerWaalsContact O-CA 3.32Å; A258-N261 WeakPolarHBondContact O-CA 3.38Å; A258-N261 PolarHBondContact O-N 3.28Å; A258-A262 HydrophobicContact CB-CB 4.14Å; A258-A262 PolarHBondContact N-O 3.26Å
259	R	95.6	Very high	97	Very high	210 Å²	210	22.8 Å²	22.8	79%	0.792	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.5	-178.4	-64.9	-174.2	178.2	115	0.9	113.8	L219 N261	L219-R259 HydrophobicContact CD1-CG 4.19Å; R259-N261 PolarHBondContact O-N 2.91Å
260	N	95.6	Very high	97.2	Very high	62 Å²	62	17.6 Å²	17.6	33%	0.332	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	7.1	172	67.2	-11.5	0	0	0	112.6	I129 D130 G132 A258 A262	I129-N260 PolarHBondContact O-ND2 2.94Å; D130-N260 VanDerWaalsContact C-ND2 3.28Å; D130-N260 PolarHBondContact O-ND2 3.32Å; G132-N260 PolarHBondContact N-ND2 3.11Å; A258-N260 WeakPolarHBondContact CB-OD1 3.41Å; A258-N260 PolarHBondContact O-N 3.11Å; N260-A262 VanDerWaalsContact C-N 3.27Å; N260-A262 PolarHBondContact O-N 3.15Å; N260-A262 VanDerWaalsContact OD1-CB 3.29Å; N260-A262 WeakPolarHBondContact OD1-CB 3.39Å; N260-A262 PolarHBondContact OD1-N 3.45Å
261	N	96.3	Very high	97.3	Very high	29 Å²	29	20.7 Å²	20.7	16%	0.155	10%	0.096	C	C	.	.			trans	60.9	26.6	-173.9	-62.2	-66.4	0	0	0	114.5	Q257 A258 R259 K310 T409 H410	Q257-N261 PolarHBondContact NE2-OD1 2.88Å; A258-N261 VanDerWaalsContact O-CA 3.32Å; A258-N261 WeakPolarHBondContact O-CA 3.38Å; A258-N261 PolarHBondContact O-N 3.28Å; R259-N261 PolarHBondContact O-N 2.91Å; N261-K310 WeakPolarHBondContact O-CE 3.36Å; N261-K310 PolarHBondContact O-NZ 2.75Å; N261-K310 VanDerWaalsContact O-NZ 3.11Å; N261-T409 HydrophobicContact CB-CG2 4.01Å; N261-T409 VanDerWaalsContact CG-CG2 3.45Å; N261-T409 WeakPolarHBondContact ND2-CG2 3.5Å; N261-H410 PolarHBondContact ND2-O 3.38Å; N261-H410 VanDerWaalsContact ND2-O 3.15Å; N261-H410 WeakPolarHBondContact OD1-CB 3.25Å; N261-H410 PolarHBondContact OD1-N 3.22Å
262	A	96.6	Very high	97.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.			trans	-68	141.9	161.7	0	0	0	0	0	109.8	I129 G133 A258 N260	I129-A262 HydrophobicContact CG2-CB 3.97Å; I129-A262 VanDerWaalsContact O-CB 3.32Å; I129-A262 WeakPolarHBondContact O-CB 3.3Å; G133-A262 WeakPolarHBondContact O-CB 3.45Å; A258-A262 HydrophobicContact CB-CB 4.14Å; A258-A262 PolarHBondContact N-O 3.26Å; N260-A262 VanDerWaalsContact C-N 3.27Å; N260-A262 PolarHBondContact O-N 3.15Å; N260-A262 VanDerWaalsContact OD1-CB 3.29Å; N260-A262 WeakPolarHBondContact OD1-CB 3.39Å; N260-A262 PolarHBondContact OD1-N 3.45Å
263	R	97.6	Very high	97.3	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.2	179.8	-67	177	178.8	168.6	-2	109.3	N134 V135 W307 A312 G313	N134-R263 WeakPolarHBondContact CA-O 3.43Å; N134-R263 WeakPolarHBondContact CB-O 3.39Å; N134-R263 PolarHBondContact OD1-N 3.44Å; V135-R263 PolarHBondContact N-O 3.42Å; V135-R263 VanDerWaalsContact N-O 3.12Å; R263-W307 HydrophobicContact CB-CH2 4.46Å; R263-W307 HydrophobicContact CB-CZ3 4.42Å; R263-W307 WeakPolarHBondContact CD-O 3.38Å; R263-W307 HydrophobicContact CG-CH2 4.31Å; R263-W307 HydrophobicContact CG-CZ2 4.22Å; R263-W307 PolarHBondContact NH1-O 2.85Å; R263-A312 PolarHBondContact NH1-O 2.98Å; R263-G313 PolarHBondContact NH2-O 3.28Å
264	V	98.2	Very high	97.2	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.2	175.3	-174	0	0	0	0	108.5	I129 V135 G255 L256 F266	I129-V264 HydrophobicContact CD1-CG2 3.9Å; I129-V264 HydrophobicContact CG1-CG2 3.98Å; I129-V264 HydrophobicContact CG2-CG2 4.03Å; V135-V264 HydrophobicContact CB-CG1 4.12Å; V135-V264 HydrophobicContact CB-CG2 4.3Å; V135-V264 VanDerWaalsContact O-CA 3.25Å; V135-V264 WeakPolarHBondContact O-CA 3.35Å; G255-V264 CarbonylContact C-O 3.57Å; G255-V264 VanDerWaalsContact CA-O 3.31Å; G255-V264 WeakPolarHBondContact CA-O 3.36Å; L256-V264 HydrophobicContact CB-CB 4.24Å; L256-V264 PolarHBondContact N-O 3.17Å; L256-V264 PolarHBondContact O-N 2.93Å; V264-F266 HydrophobicContact CB-CE2 4.25Å; V264-F266 HydrophobicContact CG1-CD2 3.97Å; V264-F266 HydrophobicContact CG1-CE1 4.33Å; V264-F266 HydrophobicContact CG1-CE2 3.37Å; V264-F266 HydrophobicContact CG1-CZ 3.59Å
265	V	98.4	Very high	97.2	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.5	171.4	164.6	0	0	0	0	109.1	V135 L136 V137 I223 I253 A254 W307 V308	V135-V265 PolarHBondContact O-N 2.95Å; L136-V265 HydrophobicContact CD1-CB 4.02Å; L136-V265 HydrophobicContact CD1-CG1 4.02Å; V137-V265 PolarHBondContact N-O 3.29Å; I223-V265 HydrophobicContact CD1-CG2 3.95Å; I253-V265 HydrophobicContact CG2-CG1 3.9Å; A254-V265 WeakPolarHBondContact O-CA 3.31Å; V265-W307 HydrophobicContact CG2-CE3 3.98Å; V265-W307 HydrophobicContact CG2-CZ3 3.62Å; V265-V308 HydrophobicContact CB-CG2 3.71Å; V265-V308 HydrophobicContact CG2-CG2 3.24Å
266	F	98.4	Very high	97.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.5	173.2	-64.2	-83.9	0	0	0	108	V137 L150 C154 I156 F158 M211 I253 A254 V264	V137-F266 HydrophobicContact CB-CD1 3.87Å; V137-F266 HydrophobicContact CB-CE1 4.27Å; V137-F266 HydrophobicContact CG1-CD1 4.31Å; V137-F266 HydrophobicContact CG2-CD1 4.08Å; V137-F266 HydrophobicContact CG2-CE1 3.97Å; L150-F266 HydrophobicContact CD2-CE1 4.42Å; L150-F266 HydrophobicContact CG-CE1 4.2Å; L150-F266 HydrophobicContact CG-CZ 4.41Å; C154-F266 HydrophobicContact CB-CE2 3.66Å; C154-F266 HydrophobicContact CB-CZ 3.76Å; I156-F266 HydrophobicContact CD1-CD2 3.33Å; I156-F266 HydrophobicContact CD1-CE2 3.78Å; I156-F266 HydrophobicContact CD1-CG 4.19Å; F158-F266 AromaticContact CE2-CD1 3.8Å; F158-F266 HydrophobicContact CE2-CD1 3.8Å; F158-F266 HydrophobicContact CE2-CE1 4.39Å; F158-F266 HydrophobicContact CE2-CG 4.43Å; F158-F266 HydrophobicContact CZ-CB 3.97Å; F158-F266 AromaticContact CZ-CD1 3.83Å; F158-F266 HydrophobicContact CZ-CD1 3.83Å; F158-F266 HydrophobicContact CZ-CG 4.28Å; M211-F266 HydrophobicContact CE-CB 4.42Å; M211-F266 HydrophobicContact SD-CB 3.98Å; I253-F266 WeakPolarHBondContact CA-O 3.21Å; A254-F266 PolarHBondContact N-O 2.98Å; A254-F266 PolarHBondContact O-N 3.08Å; V264-F266 HydrophobicContact CB-CE2 4.25Å; V264-F266 HydrophobicContact CG1-CD2 3.97Å; V264-F266 HydrophobicContact CG1-CE1 4.33Å; V264-F266 HydrophobicContact CG1-CE2 3.37Å; V264-F266 HydrophobicContact CG1-CZ 3.59Å
267	S	98.2	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.6	171.2	-174.7	0	0	0	0	108.6	V137 A138 A139 S269	V137-S267 PolarHBondContact O-N 2.8Å; A138-S267 CarbonylContact C-O 3.38Å; A138-S267 WeakPolarHBondContact CA-O 3.34Å; A139-S267 PolarHBondContact N-O 3.03Å; S267-S269 PolarHBondContact O-N 3.2Å; S267-S269 PolarHBondContact OG-O 3.02Å
268	G	97.3	Very high	97.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-75.1	-0.2	178.3	0	0	0	0	0	114.1	A139 G208 V209 M211 L252	A139-G268 CarbonylContact C-O 3.51Å; A139-G268 CarbonylContact O-C 3.57Å; A139-G268 VanDerWaalsContact O-C 3.3Å; G208-G268 CarbonylContact C-O 3.57Å; G208-G268 VanDerWaalsContact CA-O 3.28Å; G208-G268 WeakPolarHBondContact CA-O 3.46Å; V209-G268 PolarHBondContact N-O 3.08Å; V209-G268 WeakPolarHBondContact O-CA 3.2Å; M211-G268 VanDerWaalsContact CE-N 3.32Å; L252-G268 PolarHBondContact O-N 3.29Å
269	S	97.7	Very high	97	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.			trans	-137.2	118.4	-175.2	178.6	0	0	0	0	111.5	A139 F206 K207 S267 D271 F272	A139-S269 CarbonylContact O-C 3.56Å; A139-S269 WeakPolarHBondContact O-CA 3.36Å; A139-S269 PolarHBondContact O-N 3.07Å; F206-S269 VanDerWaalsContact CD2-CB 3.49Å; K207-S269 PolarHBondContact N-OG 3.33Å; K207-S269 WeakPolarHBondContact O-CB 3.15Å; K207-S269 PolarHBondContact O-OG 3.5Å; S267-S269 PolarHBondContact O-N 3.2Å; S267-S269 PolarHBondContact OG-O 3.02Å; S269-D271 PolarHBondContact OG-N 3.28Å; S269-F272 WeakPolarHBondContact O-CB 3.41Å; S269-F272 PolarHBondContact OG-N 2.79Å; S269-F272 VanDerWaalsContact OG-N 3.09Å
270	L	97.7	Very high	96.9	Very high	16 Å²	16	21 Å²	21	8%	0.084	12%	0.123	C	C	.	.	S	Bend	trans	-67.4	-43.7	168	179.4	62.9	0	0	0	110.2	I65 H69 F109 P111 A138 A139 F272 F273	I65-L270 HydrophobicContact CD1-CD2 4.15Å; H69-L270 PolarHBondContact NE2-O 3.17Å; F109-L270 HydrophobicContact CB-CD1 3.64Å; F109-L270 HydrophobicContact CD1-CD1 3.98Å; F109-L270 HydrophobicContact CD2-CD1 3.82Å; F109-L270 HydrophobicContact CE2-CD1 4.47Å; F109-L270 HydrophobicContact CG-CD1 3.56Å; P111-L270 HydrophobicContact CG-CD2 4.17Å; A138-L270 HydrophobicContact CB-CB 4.41Å; A138-L270 HydrophobicContact CB-CD1 4.02Å; A139-L270 PolarHBondContact O-N 2.87Å; L270-F272 PolarHBondContact O-N 3.01Å; L270-F273 PolarHBondContact O-N 3.36Å
271	D	97	Very high	96.9	Very high	64 Å²	64	19.4 Å²	19.4	34%	0.342	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-57.8	-25.9	179.8	-67.5	-23	0	0	0	113	S269 F273 S274 F277	S269-D271 PolarHBondContact OG-N 3.28Å; D271-F273 PolarHBondContact O-N 2.74Å; D271-S274 VanDerWaalsContact O-CB 3.23Å; D271-S274 WeakPolarHBondContact O-CB 3.2Å; D271-S274 PolarHBondContact O-N 3.24Å; D271-S274 PolarHBondContact O-OG 2.98Å; D271-F277 HydrophobicContact CB-CD2 4.1Å; D271-F277 HydrophobicContact CB-CE1 4.48Å; D271-F277 HydrophobicContact CB-CE2 3.58Å; D271-F277 HydrophobicContact CB-CZ 3.8Å; D271-F277 WeakPolarHBondContact O-CD2 3.41Å; D271-F277 WeakPolarHBondContact O-CG 3.17Å
272	F	97.4	Very high	96.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-53	-33.9	172.6	172.8	-97.9	0	0	0	113	V204 I253 S269 L270 F278 N297 L300 A301 L304	V204-F272 HydrophobicContact CG1-CD2 3.91Å; V204-F272 HydrophobicContact CG1-CE2 3.51Å; I253-F272 HydrophobicContact CD1-CD1 4.42Å; I253-F272 HydrophobicContact CD1-CE1 4Å; I253-F272 HydrophobicContact CD1-CE2 4.15Å; I253-F272 HydrophobicContact CD1-CZ 3.87Å; S269-F272 WeakPolarHBondContact O-CB 3.41Å; S269-F272 PolarHBondContact OG-N 2.79Å; S269-F272 VanDerWaalsContact OG-N 3.09Å; L270-F272 PolarHBondContact O-N 3.01Å; F272-F278 WeakPolarHBondContact O-CE1 3.36Å; F272-N297 VanDerWaalsContact CD2-ND2 3.35Å; F272-N297 WeakPolarHBondContact CD2-ND2 3.35Å; F272-N297 HydrophobicContact CE2-CB 4.3Å; F272-N297 PolarHBondContact O-ND2 3.48Å; F272-L300 HydrophobicContact CE2-CD2 4.1Å; F272-L300 HydrophobicContact CZ-CB 4.21Å; F272-L300 HydrophobicContact CZ-CD2 3.81Å; F272-L300 HydrophobicContact CZ-CG 3.94Å; F272-A301 HydrophobicContact CE1-CB 3.97Å; F272-A301 HydrophobicContact CZ-CB 4.38Å; F272-L304 HydrophobicContact CE1-CD1 4.31Å
273	F	97.9	Very high	96.6	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-93.4	1.7	178.7	-62.6	-80	0	0	0	113.9	H69 F72 F109 L136 A138 L270 D271 F278 A301	H69-F273 PolarHBondContact CD2-O 3.31Å; H69-F273 VanDerWaalsContact CD2-O 3.25Å; F72-F273 AromaticContact CD2-CD1 3.96Å; F72-F273 HydrophobicContact CD2-CD1 3.96Å; F72-F273 AromaticContact CE2-CD1 3.79Å; F72-F273 HydrophobicContact CE2-CD1 3.79Å; F72-F273 HydrophobicContact CE2-CE1 4.08Å; F72-F273 HydrophobicContact CG-CD1 4.47Å; F72-F273 HydrophobicContact CZ-CD1 4.17Å; F72-F273 HydrophobicContact CZ-CE1 4.36Å; F109-F273 HydrophobicContact CE1-CD2 4.14Å; F109-F273 HydrophobicContact CE1-CE2 4.38Å; F109-F273 HydrophobicContact CE2-CB 4.28Å; F109-F273 HydrophobicContact CZ-CB 4.08Å; F109-F273 HydrophobicContact CZ-CD1 4.35Å; F109-F273 AromaticContact CZ-CD2 3.93Å; F109-F273 HydrophobicContact CZ-CD2 3.93Å; F109-F273 HydrophobicContact CZ-CE2 4.46Å; F109-F273 AromaticContact CZ-CG 3.87Å; F109-F273 HydrophobicContact CZ-CG 3.87Å; L136-F273 HydrophobicContact CD1-CZ 4.34Å; L136-F273 HydrophobicContact CD2-CZ 4.43Å; A138-F273 HydrophobicContact CB-CD2 4.09Å; A138-F273 HydrophobicContact CB-CE2 4.04Å; L270-F273 PolarHBondContact O-N 3.36Å; D271-F273 PolarHBondContact O-N 2.74Å; F273-F278 WeakPolarHBondContact O-CZ 3.48Å; F273-A301 HydrophobicContact CD1-CB 3.77Å; F273-A301 HydrophobicContact CE1-CB 3.89Å
274	S	97.5	Very high	96.5	Very high	8 Å²	8	22.7 Å²	22.7	6%	0.056	13%	0.132	C	C	.	.	S	Bend	trans	-76.5	152.4	-174.2	72.7	0	0	0	0	113.1	D271 A276 F277 F278	D271-S274 VanDerWaalsContact O-CB 3.23Å; D271-S274 WeakPolarHBondContact O-CB 3.2Å; D271-S274 PolarHBondContact O-N 3.24Å; D271-S274 PolarHBondContact O-OG 2.98Å; S274-A276 PolarHBondContact O-N 3.08Å; S274-F277 PolarHBondContact O-N 3.43Å; S274-F277 PolarHBondContact OG-N 3.42Å; S274-F278 WeakPolarHBondContact O-CG 3.19Å; S274-F278 PolarHBondContact O-N 3.05Å; S274-F278 VanDerWaalsContact O-N 3.12Å
275	D	97.3	Very high	96.2	Very high	25 Å²	25	24.1 Å²	24.1	13%	0.134	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-27.2	175	-64.6	-7.3	0	0	0	111.5	T68 H69 S70 I71 N279	T68-D275 VanDerWaalsContact O-CB 3.28Å; T68-D275 WeakPolarHBondContact O-CB 3.46Å; T68-D275 PolarHBondContact O-N 3.09Å; H69-D275 VanDerWaalsContact C-OD1 3.31Å; S70-D275 WeakPolarHBondContact CB-OD2 3.34Å; S70-D275 PolarHBondContact N-OD1 3.48Å; S70-D275 VanDerWaalsContact N-OD1 3.14Å; S70-D275 PolarHBondContact N-OD2 2.72Å; S70-D275 PolarHBondContact OG-OD2 2.83Å; I71-D275 WeakPolarHBondContact CB-OD1 3.44Å; I71-D275 HydrophobicContact CD1-CB 3.87Å; I71-D275 HydrophobicContact CG1-CB 4.31Å; I71-D275 VanDerWaalsContact CG1-OD1 3.31Å; I71-D275 WeakPolarHBondContact CG1-OD1 3.37Å; I71-D275 PolarHBondContact N-OD1 2.71Å; I71-D275 PolarHBondContact N-OD2 3.14Å; D275-N279 PolarHBondContact O-N 3.25Å; D275-N279 PolarHBondContact O-ND2 3.24Å
276	A	96.1	Very high	95.8	Very high	66 Å²	66	32.9 Å²	32.9	55%	0.545	18%	0.178	S	C	.	.	H	α-helix	trans	-64.8	-48.3	176.6	0	0	0	0	0	111.4	S274 F278 N279 S280	S274-A276 PolarHBondContact O-N 3.08Å; A276-F278 VanDerWaalsContact C-N 3.35Å; A276-N279 PolarHBondContact O-N 3.08Å; A276-S280 WeakPolarHBondContact O-CB 3.4Å; A276-S280 PolarHBondContact O-N 2.82Å; A276-S280 VanDerWaalsContact O-N 3.1Å; A276-S280 PolarHBondContact O-OG 2.91Å
277	F	96.3	Very high	95.3	Very high	25 Å²	25	38.8 Å²	38.8	11%	0.11	22%	0.216	C	C	.	.	H	α-helix	trans	-75.8	-22.2	179.7	-75.9	11.3	0	0	0	113	L181 L205 K207 D271 S274 S280 T295	L181-F277 HydrophobicContact CD1-CE1 4.14Å; L181-F277 HydrophobicContact CD1-CE2 4.06Å; L181-F277 HydrophobicContact CD1-CZ 3.53Å; L205-F277 HydrophobicContact CB-CD2 3.95Å; L205-F277 HydrophobicContact CB-CE2 4.25Å; L205-F277 HydrophobicContact CB-CG 4.27Å; L205-F277 HydrophobicContact CD1-CD1 4.47Å; K207-F277 HydrophobicContact CB-CE2 4.21Å; K207-F277 HydrophobicContact CB-CZ 4.09Å; D271-F277 HydrophobicContact CB-CD2 4.1Å; D271-F277 HydrophobicContact CB-CE1 4.48Å; D271-F277 HydrophobicContact CB-CE2 3.58Å; D271-F277 HydrophobicContact CB-CZ 3.8Å; D271-F277 WeakPolarHBondContact O-CD2 3.41Å; D271-F277 WeakPolarHBondContact O-CG 3.17Å; S274-F277 PolarHBondContact O-N 3.43Å; S274-F277 PolarHBondContact OG-N 3.42Å; F277-S280 PolarHBondContact O-OG 3.02Å; F277-T295 WeakPolarHBondContact O-CB 3.27Å; F277-T295 WeakPolarHBondContact O-CG2 3.38Å; F277-T295 PolarHBondContact O-OG1 3.49Å
278	F	96.1	Very high	94.6	Very high	2 Å²	2	43 Å²	43	1%	0.009	26%	0.259	C	S	.	.	H	α-helix	trans	-72.2	-30.2	173.3	-69.5	-8.7	0	0	0	113.3	I71 F72 F272 F273 S274 A276 N297 M298 A301	I71-F278 HydrophobicContact CB-CD2 3.97Å; I71-F278 HydrophobicContact CB-CE2 4.38Å; I71-F278 HydrophobicContact CD1-CD2 4.47Å; I71-F278 HydrophobicContact CG2-CD2 3.82Å; I71-F278 HydrophobicContact CG2-CE2 4.25Å; F72-F278 HydrophobicContact CB-CE2 4.06Å; F72-F278 HydrophobicContact CB-CZ 4.45Å; F272-F278 WeakPolarHBondContact O-CE1 3.36Å; F273-F278 WeakPolarHBondContact O-CZ 3.48Å; S274-F278 WeakPolarHBondContact O-CG 3.19Å; S274-F278 PolarHBondContact O-N 3.05Å; S274-F278 VanDerWaalsContact O-N 3.12Å; A276-F278 VanDerWaalsContact C-N 3.35Å; F278-N297 HydrophobicContact CD1-CB 3.66Å; F278-N297 HydrophobicContact CE1-CB 3.88Å; F278-M298 HydrophobicContact CB-CB 4.22Å; F278-M298 HydrophobicContact CD1-CB 3.92Å; F278-M298 HydrophobicContact CD2-CB 4.33Å; F278-M298 HydrophobicContact CD2-CG 4.33Å; F278-M298 HydrophobicContact CE1-CB 4.36Å; F278-M298 HydrophobicContact CG-CB 3.9Å; F278-M298 HydrophobicContact CG-CG 4.37Å; F278-A301 HydrophobicContact CE1-CB 3.95Å; F278-A301 HydrophobicContact CZ-CB 3.76Å
279	N	94.8	Very high	94.3	Very high	113 Å²	113	44.4 Å²	44.4	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-104.7	-3.9	-175.8	-65	-59.8	0	0	0	113.9	I71 D275 A276	I71-N279 WeakPolarHBondContact CD1-ND2 3.49Å; D275-N279 PolarHBondContact O-N 3.25Å; D275-N279 PolarHBondContact O-ND2 3.24Å; A276-N279 PolarHBondContact O-N 3.08Å
280	S	93.8	Very high	93.9	Very high	30 Å²	30	51.4 Å²	51.4	21%	0.21	30%	0.302	C	S	.	.			trans	-75.5	154.2	179.3	59.2	0	0	0	0	112.3	L205 A276 F277 T295	L205-S280 WeakPolarHBondContact CD1-OG 3.34Å; A276-S280 WeakPolarHBondContact O-CB 3.4Å; A276-S280 PolarHBondContact O-N 2.82Å; A276-S280 VanDerWaalsContact O-N 3.1Å; A276-S280 PolarHBondContact O-OG 2.91Å; F277-S280 PolarHBondContact O-OG 3.02Å; S280-T295 WeakPolarHBondContact O-CG2 3.27Å; S280-T295 PolarHBondContact O-N 3.49Å; S280-T295 WeakPolarHBondContact OG-CG2 3.34Å
281	A	94.1	Very high	93.7	Very high	28 Å²	28	56.9 Å²	56.9	23%	0.231	32%	0.321	C	S	.	.			trans	-85.2	151.6	163.7	0	0	0	0	0	109	H292	A281-H292 CarbonylContact C-O 3.54Å; A281-H292 VanDerWaalsContact CA-O 3.28Å; A281-H292 WeakPolarHBondContact CA-O 3.41Å; A281-H292 WeakPolarHBondContact CB-O 3.48Å
282	V	93.9	Very high	93.4	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-115.8	131.5	176.7	-171.1	0	0	0	0	110.2	V183 P203 L205 H292 T295	V183-V282 HydrophobicContact CB-CG1 4.34Å; V183-V282 HydrophobicContact CG1-CG1 3.58Å; V183-V282 HydrophobicContact CG2-CG1 3.78Å; P203-V282 HydrophobicContact CB-CG1 4.22Å; L205-V282 HydrophobicContact CD1-CG2 4.07Å; L205-V282 HydrophobicContact CD2-CB 4.46Å; L205-V282 HydrophobicContact CD2-CG1 3.79Å; L205-V282 HydrophobicContact CD2-CG2 4.04Å; L205-V282 HydrophobicContact CG-CG1 4.41Å; L205-V282 HydrophobicContact CG-CG2 3.74Å; V282-H292 PolarHBondContact N-O 3.37Å; V282-H292 PolarHBondContact O-N 2.82Å; V282-T295 HydrophobicContact CG2-CG2 3.31Å
283	Q	93.9	Very high	93.1	Very high	62 Å²	62	62.6 Å²	62.6	29%	0.29	35%	0.346	S	S	.	.			trans	-149	118.7	169.5	-175.3	176.9	0.3	0	0	109.9	D172 V173 S289 R291	D172-Q283 WeakPolarHBondContact CA-O 3.48Å; D172-Q283 PolarHBondContact OD1-N 2.8Å; D172-Q283 VanDerWaalsContact OD1-O 3.05Å; V173-Q283 HydrophobicContact CG1-CG 4.44Å; V173-Q283 HydrophobicContact CG2-CB 4.12Å; V173-Q283 PolarHBondContact N-O 3.12Å; Q283-S289 WeakPolarHBondContact CG-OG 3.37Å; Q283-R291 HydrophobicContact CB-CB 4.22Å; Q283-R291 HydrophobicContact CB-CG 4.17Å; Q283-R291 HydrophobicContact CG-CB 4.22Å
284	K	94.1	Very high	92.8	Very high	35 Å²	35	66.4 Å²	66.4	15%	0.152	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-60.9	140.2	173	-64	-175.3	177.1	-172.6	0	110.2	N170 Y171 V183 D185 R286 S289	N170-K284 HydrophobicContact CB-CD 4.46Å; N170-K284 PolarHBondContact OD1-NZ 3.19Å; Y171-K284 WeakPolarHBondContact O-CA 3.49Å; V183-K284 HydrophobicContact CB-CG 3.96Å; V183-K284 HydrophobicContact CG1-CD 4.44Å; V183-K284 HydrophobicContact CG1-CG 3.87Å; V183-K284 HydrophobicContact CG2-CG 4.14Å; D185-K284 WeakPolarHBondContact OD1-CE 2.99Å; D185-K284 IonicContact OD1-NZ 3.94Å; D185-K284 PolarHBondContact OD1-NZ 3.11Å; D185-K284 IonicContact OD2-NZ 3.58Å; D185-K284 PolarHBondContact OD2-NZ 3.19Å; K284-R286 PolarHBondContact O-N 2.9Å; K284-R286 VanDerWaalsContact O-N 3.07Å; K284-S289 WeakPolarHBondContact O-CB 3.21Å; K284-S289 PolarHBondContact O-OG 3.01Å
285	A	92.2	Very high	92.6	Very high	32 Å²	32	66 Å²	66	26%	0.264	36%	0.361	S	S	.	.	S	Bend	trans	-66.4	-11.2	179	0	0	0	0	0	114.6	Y171 V173	Y171-A285 HydrophobicContact CD1-CB 4.39Å; Y171-A285 HydrophobicContact CD2-CB 3.82Å; Y171-A285 HydrophobicContact CE1-CB 3.87Å; Y171-A285 HydrophobicContact CE2-CB 3.23Å; Y171-A285 HydrophobicContact CG-CB 4.36Å; Y171-A285 PolarHBondContact O-N 2.87Å; Y171-A285 WeakPolarHBondContact OH-CB 3.41Å; V173-A285 HydrophobicContact CG1-CB 4.15Å
286	R	90.9	Very high	92.4	Very high	183 Å²	183	65 Å²	65	69%	0.691	36%	0.356	S	S	*	.	S	Bend	trans	-62.2	134.8	176.4	-171.2	176.5	179.6	179.8	0.6	111.5	K284 G288 S289	K284-R286 PolarHBondContact O-N 2.9Å; K284-R286 VanDerWaalsContact O-N 3.07Å; R286-G288 PolarHBondContact O-N 2.92Å; R286-S289 WeakPolarHBondContact O-CB 3.46Å; R286-S289 PolarHBondContact O-N 2.83Å; R286-S289 PolarHBondContact O-OG 3.18Å
287	P	86.6	Confident	92.4	Very high	124 Å²	124	61.9 Å²	61.9	81%	0.805	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	131.4	176.3	-24.7	33.1	0	0	0	112.5
288	G	85.2	Confident	92.3	Very high	88 Å²	88	63.3 Å²	63.3	91%	0.907	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	8.1	179	0	0	0	0	0	115.2	R286	R286-G288 PolarHBondContact O-N 2.92Å
289	S	89.1	Confident	92.3	Very high	30 Å²	30	66.2 Å²	66.2	21%	0.21	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-64.4	141.8	172.3	63.7	0	0	0	0	111.8	Q283 K284 R286	Q283-S289 WeakPolarHBondContact CG-OG 3.37Å; K284-S289 WeakPolarHBondContact O-CB 3.21Å; K284-S289 PolarHBondContact O-OG 3.01Å; R286-S289 WeakPolarHBondContact O-CB 3.46Å; R286-S289 PolarHBondContact O-N 2.83Å; R286-S289 PolarHBondContact O-OG 3.18Å
290	Q	90.6	Very high	92.3	Very high	147 Å²	147	61.2 Å²	61.2	69%	0.687	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-73.6	131.7	173.1	-175.4	172.6	4.7	0	0	109.6
291	R	92.2	Very high	92.5	Very high	132 Å²	132	59.8 Å²	59.8	50%	0.498	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-83.8	128.5	169.6	-175.7	172.1	-173.7	-107.7	3.5	109.3	Q283 E293	Q283-R291 HydrophobicContact CB-CB 4.22Å; Q283-R291 HydrophobicContact CB-CG 4.17Å; Q283-R291 HydrophobicContact CG-CB 4.22Å; R291-E293 IonicContact CZ-OE1 2.83Å; R291-E293 IonicContact NH1-OE1 2.81Å; R291-E293 PolarHBondContact NH1-OE1 3.08Å; R291-E293 IonicContact NH1-OE2 3.85Å; R291-E293 PolarHBondContact NH1-OE2 2.82Å
292	H	91.7	Very high	92.6	Very high	47 Å²	47	60.3 Å²	60.3	22%	0.218	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-105.7	126.2	172.6	-64.7	-94.4	0	0	0	108.6	A281 V282 Q294	A281-H292 CarbonylContact C-O 3.54Å; A281-H292 VanDerWaalsContact CA-O 3.28Å; A281-H292 WeakPolarHBondContact CA-O 3.41Å; A281-H292 WeakPolarHBondContact CB-O 3.48Å; V282-H292 PolarHBondContact N-O 3.37Å; V282-H292 PolarHBondContact O-N 2.82Å; H292-Q294 PolarHBondContact O-N 3.46Å
293	E	91.2	Very high	92.6	Very high	137 Å²	137	61.3 Å²	61.3	64%	0.64	32%	0.32	S	S	*	.	S	Bend	trans	-66.9	-21.1	-178.9	-64.2	-60.2	141.8	0	0	113.1	R291	R291-E293 IonicContact CZ-OE1 2.83Å; R291-E293 IonicContact NH1-OE1 2.81Å; R291-E293 PolarHBondContact NH1-OE1 3.08Å; R291-E293 IonicContact NH1-OE2 3.85Å; R291-E293 PolarHBondContact NH1-OE2 2.82Å
294	Q	90.5	Very high	92.8	Very high	79 Å²	79	58.3 Å²	58.3	37%	0.369	31%	0.306	S	S	.	.	S	Bend	trans	-138.7	140.8	179.6	-164.5	-175.4	10.3	0	0	110.6	H292	H292-Q294 PolarHBondContact O-N 3.46Å
295	T	93.8	Very high	92.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	30%	0.3	C	S	.	.			trans	-72.9	160.9	174.2	78.1	0	0	0	0	112.4	L205 F277 S280 V282 N297	L205-T295 HydrophobicContact CD1-CG2 3.92Å; L205-T295 HydrophobicContact CG-CG2 4.21Å; F277-T295 WeakPolarHBondContact O-CB 3.27Å; F277-T295 WeakPolarHBondContact O-CG2 3.38Å; F277-T295 PolarHBondContact O-OG1 3.49Å; S280-T295 WeakPolarHBondContact O-CG2 3.27Å; S280-T295 PolarHBondContact O-N 3.49Å; S280-T295 WeakPolarHBondContact OG-CG2 3.34Å; V282-T295 HydrophobicContact CG2-CG2 3.31Å; T295-N297 VanDerWaalsContact C-N 3.29Å; T295-N297 WeakPolarHBondContact OG1-CB 3.29Å; T295-N297 PolarHBondContact OG1-N 2.99Å
296	G	94.1	Very high	93	Very high	3 Å²	3	60.8 Å²	60.8	3%	0.031	31%	0.308	C	S	.	.	S	Bend	trans	-81	-2	168.2	0	0	0	0	0	114.4	P203 M298 E299 L300	P203-G296 PolarHBondContact O-N 2.62Å; G296-M298 PolarHBondContact O-N 2.85Å; G296-E299 PolarHBondContact O-N 3.31Å; G296-L300 WeakPolarHBondContact O-CB 3.42Å; G296-L300 PolarHBondContact O-N 3.04Å; G296-L300 VanDerWaalsContact O-N 3.13Å
297	N	95.7	Very high	93.3	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-45.9	-170	-74.7	42.9	0	0	0	112.6	V204 L205 F272 F278 T295 E299 L300 A301	V204-N297 VanDerWaalsContact CA-OD1 3.3Å; V204-N297 WeakPolarHBondContact CA-OD1 3.21Å; V204-N297 WeakPolarHBondContact CG1-OD1 3.37Å; L205-N297 PolarHBondContact N-OD1 3.14Å; L205-N297 PolarHBondContact O-ND2 3.46Å; F272-N297 VanDerWaalsContact CD2-ND2 3.35Å; F272-N297 WeakPolarHBondContact CD2-ND2 3.35Å; F272-N297 HydrophobicContact CE2-CB 4.3Å; F272-N297 PolarHBondContact O-ND2 3.48Å; F278-N297 HydrophobicContact CD1-CB 3.66Å; F278-N297 HydrophobicContact CE1-CB 3.88Å; T295-N297 VanDerWaalsContact C-N 3.29Å; T295-N297 WeakPolarHBondContact OG1-CB 3.29Å; T295-N297 PolarHBondContact OG1-N 2.99Å; N297-E299 PolarHBondContact O-N 3.07Å; N297-L300 PolarHBondContact O-N 3.5Å; N297-A301 WeakPolarHBondContact O-CB 3.42Å; N297-A301 PolarHBondContact O-N 3.11Å
298	M	94.9	Very high	93.8	Very high	56 Å²	56	46.1 Å²	46.1	28%	0.276	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-46.5	-176.6	-176.5	-178.6	178	0	0	111.8	I71 F278 G296 L300 M302	I71-M298 HydrophobicContact CG2-CE 4.03Å; F278-M298 HydrophobicContact CB-CB 4.22Å; F278-M298 HydrophobicContact CD1-CB 3.92Å; F278-M298 HydrophobicContact CD2-CB 4.33Å; F278-M298 HydrophobicContact CD2-CG 4.33Å; F278-M298 HydrophobicContact CE1-CB 4.36Å; F278-M298 HydrophobicContact CG-CB 3.9Å; F278-M298 HydrophobicContact CG-CG 4.37Å; G296-M298 PolarHBondContact O-N 2.85Å; M298-L300 PolarHBondContact O-N 3.25Å; M298-M302 HydrophobicContact CE-CE 3.21Å; M298-M302 HydrophobicContact CE-SD 4.31Å; M298-M302 HydrophobicContact CG-CE 3.72Å; M298-M302 HydrophobicContact CG-SD 4.26Å; M298-M302 WeakPolarHBondContact O-CB 2.99Å; M298-M302 WeakPolarHBondContact O-CG 3.03Å; M298-M302 PolarHBondContact O-N 3.27Å; M298-M302 HydrophobicContact SD-CE 4.3Å
299	E	94.6	Very high	94.3	Very high	63 Å²	63	42.2 Å²	42.2	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-64.4	-41.1	-179.8	-66	161.7	177.8	0	0	111.1	T200 K202 G296 N297 S303	T200-E299 WeakPolarHBondContact CB-OE2 3.44Å; T200-E299 WeakPolarHBondContact CG2-OE2 3.32Å; T200-E299 PolarHBondContact OG1-OE2 2.85Å; K202-E299 IonicContact NZ-OE1 3.44Å; K202-E299 PolarHBondContact NZ-OE1 2.8Å; K202-E299 IonicContact NZ-OE2 2.86Å; G296-E299 PolarHBondContact O-N 3.31Å; N297-E299 PolarHBondContact O-N 3.07Å; E299-S303 WeakPolarHBondContact O-CB 3.43Å; E299-S303 PolarHBondContact O-N 3.33Å; E299-S303 VanDerWaalsContact O-N 3.08Å; E299-S303 PolarHBondContact O-OG 2.97Å
300	L	96	Very high	94.5	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-49.7	177.4	-178.3	56.8	0	0	0	111.8	L189 V196 V204 I253 F272 G296 N297 M298 M302 S303 L304	L189-L300 HydrophobicContact CD1-CD1 3.88Å; L189-L300 HydrophobicContact CD1-CD2 3.78Å; L189-L300 HydrophobicContact CD1-CG 4.46Å; V196-L300 HydrophobicContact CB-CD1 4.01Å; V196-L300 HydrophobicContact CG1-CD1 4.04Å; V204-L300 HydrophobicContact CG2-CD2 4.02Å; I253-L300 HydrophobicContact CD1-CD2 4.48Å; F272-L300 HydrophobicContact CE2-CD2 4.1Å; F272-L300 HydrophobicContact CZ-CB 4.21Å; F272-L300 HydrophobicContact CZ-CD2 3.81Å; F272-L300 HydrophobicContact CZ-CG 3.94Å; G296-L300 WeakPolarHBondContact O-CB 3.42Å; G296-L300 PolarHBondContact O-N 3.04Å; G296-L300 VanDerWaalsContact O-N 3.13Å; N297-L300 PolarHBondContact O-N 3.5Å; M298-L300 PolarHBondContact O-N 3.25Å; L300-M302 VanDerWaalsContact C-N 3.28Å; L300-M302 PolarHBondContact O-N 3.01Å; L300-S303 PolarHBondContact O-N 3.18Å; L300-S303 VanDerWaalsContact O-N 3.07Å; L300-L304 HydrophobicContact CD1-CD1 4.3Å; L300-L304 HydrophobicContact CD1-CD2 4.5Å; L300-L304 HydrophobicContact CD1-CG 4.12Å; L300-L304 HydrophobicContact CG-CD1 4.11Å; L300-L304 HydrophobicContact CG-CG 4.37Å; L300-L304 WeakPolarHBondContact O-CG 3.44Å; L300-L304 PolarHBondContact O-N 3Å
301	A	96.8	Very high	94.6	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-40.9	178.4	0	0	0	0	0	111.9	F272 F273 F278 N297 S305	F272-A301 HydrophobicContact CE1-CB 3.97Å; F272-A301 HydrophobicContact CZ-CB 4.38Å; F273-A301 HydrophobicContact CD1-CB 3.77Å; F273-A301 HydrophobicContact CE1-CB 3.89Å; F278-A301 HydrophobicContact CE1-CB 3.95Å; F278-A301 HydrophobicContact CZ-CB 3.76Å; N297-A301 WeakPolarHBondContact O-CB 3.42Å; N297-A301 PolarHBondContact O-N 3.11Å; A301-S305 WeakPolarHBondContact O-CB 2.91Å; A301-S305 PolarHBondContact O-N 2.93Å; A301-S305 PolarHBondContact O-OG 3.34Å
302	M	95.6	Very high	94.6	Very high	39 Å²	39	34 Å²	34	19%	0.192	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-48.5	173.2	-73.6	-178.7	-179.8	0	0	111.3	M298 L300 L304 S305 R306	M298-M302 HydrophobicContact CE-CE 3.21Å; M298-M302 HydrophobicContact CE-SD 4.31Å; M298-M302 HydrophobicContact CG-CE 3.72Å; M298-M302 HydrophobicContact CG-SD 4.26Å; M298-M302 WeakPolarHBondContact O-CB 2.99Å; M298-M302 WeakPolarHBondContact O-CG 3.03Å; M298-M302 PolarHBondContact O-N 3.27Å; M298-M302 HydrophobicContact SD-CE 4.3Å; L300-M302 VanDerWaalsContact C-N 3.28Å; L300-M302 PolarHBondContact O-N 3.01Å; M302-L304 VanDerWaalsContact C-N 3.35Å; M302-L304 PolarHBondContact O-N 3.23Å; M302-S305 PolarHBondContact O-N 2.99Å; M302-S305 PolarHBondContact O-OG 3.18Å; M302-R306 VanDerWaalsContact O-CG 3.31Å; M302-R306 WeakPolarHBondContact O-CG 3.28Å; M302-R306 PolarHBondContact O-N 3.2Å
303	S	95.8	Very high	94.6	Very high	22 Å²	22	32.1 Å²	32.1	15%	0.154	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-42.6	179.8	-58	0	0	0	0	112.2	I195 V196 E299 L300 R306 W307	I195-S303 CarbonylContact O-C 3.32Å; V196-S303 VanDerWaalsContact C-CB 3.5Å; V196-S303 PolarHBondContact O-OG 2.97Å; E299-S303 WeakPolarHBondContact O-CB 3.43Å; E299-S303 PolarHBondContact O-N 3.33Å; E299-S303 VanDerWaalsContact O-N 3.08Å; E299-S303 PolarHBondContact O-OG 2.97Å; L300-S303 PolarHBondContact O-N 3.18Å; L300-S303 VanDerWaalsContact O-N 3.07Å; S303-R306 PolarHBondContact O-N 3.08Å; S303-W307 PolarHBondContact O-N 3.22Å
304	L	96.9	Very high	94.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-47.1	174.5	-67.6	176.3	0	0	0	111.7	I195 I223 I253 F272 L300 M302 R306 W307 V308	I195-L304 HydrophobicContact CG2-CD2 3.93Å; I223-L304 HydrophobicContact CD1-CD2 3.94Å; I223-L304 HydrophobicContact CG2-CD2 3.76Å; I253-L304 HydrophobicContact CD1-CD1 4.02Å; I253-L304 HydrophobicContact CG2-CD1 4.2Å; F272-L304 HydrophobicContact CE1-CD1 4.31Å; L300-L304 HydrophobicContact CD1-CD1 4.3Å; L300-L304 HydrophobicContact CD1-CD2 4.5Å; L300-L304 HydrophobicContact CD1-CG 4.12Å; L300-L304 HydrophobicContact CG-CD1 4.11Å; L300-L304 HydrophobicContact CG-CG 4.37Å; L300-L304 WeakPolarHBondContact O-CG 3.44Å; L300-L304 PolarHBondContact O-N 3Å; M302-L304 VanDerWaalsContact C-N 3.35Å; M302-L304 PolarHBondContact O-N 3.23Å; L304-R306 VanDerWaalsContact C-N 3.31Å; L304-R306 PolarHBondContact O-N 3.02Å; L304-W307 PolarHBondContact O-N 3.19Å; L304-W307 VanDerWaalsContact O-N 3.14Å; L304-V308 WeakPolarHBondContact O-CG2 3.48Å; L304-V308 PolarHBondContact O-N 2.97Å
305	S	96.3	Very high	95.1	Very high	2 Å²	2	23 Å²	23	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-37.3	178.3	68.2	0	0	0	0	112.7	R79 A301 M302 W307 F309	R79-S305 PolarHBondContact NH2-OG 3.34Å; A301-S305 WeakPolarHBondContact O-CB 2.91Å; A301-S305 PolarHBondContact O-N 2.93Å; A301-S305 PolarHBondContact O-OG 3.34Å; M302-S305 PolarHBondContact O-N 2.99Å; M302-S305 PolarHBondContact O-OG 3.18Å; S305-W307 VanDerWaalsContact C-N 3.35Å; S305-F309 WeakPolarHBondContact O-CB 3.33Å; S305-F309 WeakPolarHBondContact O-CD2 3.37Å; S305-F309 PolarHBondContact O-N 2.87Å
306	R	95.4	Very high	95.1	Very high	116 Å²	116	27.9 Å²	27.9	44%	0.438	13%	0.132	S	C	.	.	H	α-helix	trans	-65.8	-38.4	174.5	-66	-175.7	176.2	168.9	0.2	112	M302 S303 L304 E311 A312	M302-R306 VanDerWaalsContact O-CG 3.31Å; M302-R306 WeakPolarHBondContact O-CG 3.28Å; M302-R306 PolarHBondContact O-N 3.2Å; S303-R306 PolarHBondContact O-N 3.08Å; L304-R306 VanDerWaalsContact C-N 3.31Å; L304-R306 PolarHBondContact O-N 3.02Å; R306-E311 HydrophobicContact CB-CB 4.22Å; R306-E311 WeakPolarHBondContact CG-OE2 3.45Å; R306-E311 WeakPolarHBondContact O-CA 3.41Å; R306-E311 WeakPolarHBondContact O-CB 3.49Å; R306-E311 PolarHBondContact O-N 3.02Å; R306-A312 HydrophobicContact CB-CB 4.28Å; R306-A312 PolarHBondContact O-N 3.17Å; R306-A312 VanDerWaalsContact O-N 3.08Å
307	W	96.2	Very high	95.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69	-52.5	176.3	-177.7	74.1	0	0	0	111	I195 L221 R263 V265 S303 L304 S305 F309 K310 G407	I195-W307 HydrophobicContact CB-CG 4.38Å; I195-W307 HydrophobicContact CD1-CZ2 4.3Å; I195-W307 HydrophobicContact CG1-CD2 4.08Å; I195-W307 HydrophobicContact CG1-CG 4.12Å; I195-W307 HydrophobicContact CG1-CZ2 4.38Å; I195-W307 HydrophobicContact CG2-CD2 4.16Å; I195-W307 HydrophobicContact CG2-CE3 4.27Å; I195-W307 HydrophobicContact CG2-CG 4.34Å; L221-W307 HydrophobicContact CD1-CH2 4Å; L221-W307 HydrophobicContact CD1-CZ2 4.03Å; R263-W307 HydrophobicContact CB-CH2 4.46Å; R263-W307 HydrophobicContact CB-CZ3 4.42Å; R263-W307 WeakPolarHBondContact CD-O 3.38Å; R263-W307 HydrophobicContact CG-CH2 4.31Å; R263-W307 HydrophobicContact CG-CZ2 4.22Å; R263-W307 PolarHBondContact NH1-O 2.85Å; V265-W307 HydrophobicContact CG2-CE3 3.98Å; V265-W307 HydrophobicContact CG2-CZ3 3.62Å; S303-W307 PolarHBondContact O-N 3.22Å; L304-W307 PolarHBondContact O-N 3.19Å; L304-W307 VanDerWaalsContact O-N 3.14Å; S305-W307 VanDerWaalsContact C-N 3.35Å; W307-F309 PolarHBondContact O-N 2.84Å; W307-K310 PolarHBondContact O-N 2.83Å; W307-G407 PolarHBondContact NE1-O 2.93Å; W307-G407 VanDerWaalsContact NE1-O 3.08Å
308	V	96.7	Very high	95.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-46.4	-178	175.9	0	0	0	0	111.8	N134 L136 V265 L304 K310	N134-V308 HydrophobicContact CB-CG1 4.07Å; N134-V308 WeakPolarHBondContact CB-O 3.33Å; N134-V308 PolarHBondContact ND2-O 2.86Å; L136-V308 HydrophobicContact CD1-CG2 4.3Å; V265-V308 HydrophobicContact CB-CG2 3.71Å; V265-V308 HydrophobicContact CG2-CG2 3.24Å; L304-V308 WeakPolarHBondContact O-CG2 3.48Å; L304-V308 PolarHBondContact O-N 2.97Å; V308-K310 PolarHBondContact O-N 2.94Å; V308-K310 VanDerWaalsContact O-N 3.14Å
309	F	95.5	Very high	95.2	Very high	6 Å²	6	31.8 Å²	31.8	3%	0.026	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	25.2	-177.9	-54.7	-45.3	0	0	0	114.2	L76 F81 H105 I107 N134 L136 S305 W307 E311	L76-F309 HydrophobicContact CD2-CD2 3.78Å; L76-F309 HydrophobicContact CD2-CE2 3.65Å; F81-F309 HydrophobicContact CE1-CB 3.91Å; F81-F309 HydrophobicContact CE1-CG 4.34Å; F81-F309 HydrophobicContact CE2-CB 4.45Å; F81-F309 HydrophobicContact CE2-CD2 4.3Å; F81-F309 HydrophobicContact CZ-CB 3.52Å; F81-F309 HydrophobicContact CZ-CD2 4.09Å; F81-F309 HydrophobicContact CZ-CG 4.08Å; H105-F309 HydrophobicContact CB-CD1 3.73Å; H105-F309 HydrophobicContact CB-CE1 3.7Å; H105-F309 AromaticContact CD2-CD1 3.63Å; H105-F309 AromaticContact CD2-CG 3.92Å; H105-F309 AromaticContact CG-CD1 3.39Å; H105-F309 AromaticContact CG-CE1 3.92Å; H105-F309 AromaticContact ND1-CD1 3.79Å; I107-F309 HydrophobicContact CD1-CE2 4.08Å; I107-F309 HydrophobicContact CD1-CZ 3.68Å; I107-F309 HydrophobicContact CG1-CE1 4.42Å; I107-F309 HydrophobicContact CG1-CZ 3.67Å; N134-F309 HydrophobicContact CB-CD1 4.28Å; L136-F309 HydrophobicContact CB-CZ 4.28Å; S305-F309 WeakPolarHBondContact O-CB 3.33Å; S305-F309 WeakPolarHBondContact O-CD2 3.37Å; S305-F309 PolarHBondContact O-N 2.87Å; W307-F309 PolarHBondContact O-N 2.84Å; F309-E311 PolarHBondContact O-N 3.22Å; F309-E311 VanDerWaalsContact O-N 3.11Å
310	K	94.3	Very high	95.3	Very high	63 Å²	63	30.7 Å²	30.7	27%	0.274	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	29.2	170.9	-67.8	-179.6	176.6	167.2	0	114.2	G132 N134 N261 W307 V308 V314	G132-K310 PolarHBondContact O-NZ 3.49Å; N134-K310 VanDerWaalsContact OD1-CE 3.26Å; N134-K310 WeakPolarHBondContact OD1-CE 3.11Å; N261-K310 WeakPolarHBondContact O-CE 3.36Å; N261-K310 PolarHBondContact O-NZ 2.75Å; N261-K310 VanDerWaalsContact O-NZ 3.11Å; W307-K310 PolarHBondContact O-N 2.83Å; V308-K310 PolarHBondContact O-N 2.94Å; V308-K310 VanDerWaalsContact O-N 3.14Å; K310-V314 HydrophobicContact CB-CG2 3.76Å; K310-V314 HydrophobicContact CG-CG2 4.27Å; K310-V314 WeakPolarHBondContact O-CG2 3.23Å
311	E	91.6	Very high	95.3	Very high	47 Å²	47	33 Å²	33	22%	0.22	18%	0.183	C	C	.	.	S	Bend	trans	-84	-32.8	170	-62.6	-177.6	-173.5	0	0	111.8	A52 R79 F81 R306 F309	A52-E311 HydrophobicContact CB-CG 4.34Å; A52-E311 WeakPolarHBondContact CB-OE1 3.34Å; R79-E311 WeakPolarHBondContact CD-OE2 3.14Å; R79-E311 IonicContact NE-OE1 3.13Å; R79-E311 PolarHBondContact NE-OE1 3.34Å; R79-E311 IonicContact NE-OE2 2.68Å; R79-E311 PolarHBondContact NE-OE2 3.26Å; F81-E311 WeakPolarHBondContact CE2-OE1 3.48Å; F81-E311 HydrophobicContact CZ-CG 4.26Å; F81-E311 WeakPolarHBondContact CZ-OE1 3.47Å; R306-E311 HydrophobicContact CB-CB 4.22Å; R306-E311 WeakPolarHBondContact CG-OE2 3.45Å; R306-E311 WeakPolarHBondContact O-CA 3.41Å; R306-E311 WeakPolarHBondContact O-CB 3.49Å; R306-E311 PolarHBondContact O-N 3.02Å; F309-E311 PolarHBondContact O-N 3.22Å; F309-E311 VanDerWaalsContact O-N 3.11Å
312	A	92.5	Very high	95.3	Very high	27 Å²	27	34.6 Å²	34.6	22%	0.223	19%	0.191	C	C	.	.	S	Bend	trans	-115.5	145.7	-178.2	0	0	0	0	0	112.2	R263 R306 V314	R263-A312 PolarHBondContact NH1-O 2.98Å; R306-A312 HydrophobicContact CB-CB 4.28Å; R306-A312 PolarHBondContact O-N 3.17Å; R306-A312 VanDerWaalsContact O-N 3.08Å; A312-V314 VanDerWaalsContact C-N 3.31Å; A312-V314 PolarHBondContact O-N 3.35Å
313	G	92.6	Very high	95.3	Very high	6 Å²	6	34.1 Å²	34.1	6%	0.062	19%	0.188	C	C	.	.	S	Bend	trans	68.3	25.6	172.9	0	0	0	0	0	114.7	R263 Y408 T409	R263-G313 PolarHBondContact NH2-O 3.28Å; G313-Y408 WeakPolarHBondContact O-CA 3.39Å; G313-T409 PolarHBondContact O-N 3.42Å; G313-T409 PolarHBondContact O-OG1 2.82Å
314	V	95.8	Very high	95.4	Very high	19 Å²	19	33.9 Å²	33.9	12%	0.115	19%	0.186	C	C	.	.			trans	-94	123.3	176.8	-177.9	0	0	0	0	109.7	K310 A312 M348 L349 W354 T409	K310-V314 HydrophobicContact CB-CG2 3.76Å; K310-V314 HydrophobicContact CG-CG2 4.27Å; K310-V314 WeakPolarHBondContact O-CG2 3.23Å; A312-V314 VanDerWaalsContact C-N 3.31Å; A312-V314 PolarHBondContact O-N 3.35Å; V314-M348 WeakPolarHBondContact O-CA 3.49Å; V314-L349 HydrophobicContact CB-CB 3.97Å; V314-L349 HydrophobicContact CB-CD2 4.44Å; V314-L349 HydrophobicContact CG1-CB 4.48Å; V314-L349 PolarHBondContact O-N 3.07Å; V314-W354 HydrophobicContact CG1-CH2 3.92Å; V314-W354 HydrophobicContact CG1-CZ3 4.46Å; V314-T409 WeakPolarHBondContact CA-OG1 3.32Å
315	L	95.9	Very high	95.3	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.037	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	151	176.1	-56.6	177.8	0	0	0	110.4	E347 M348 F357 Y403 Y408 T409 L411	L315-E347 CarbonylContact C-O 3.51Å; L315-E347 WeakPolarHBondContact CA-O 3.35Å; L315-M348 HydrophobicContact CD2-CB 3.76Å; L315-M348 HydrophobicContact CD2-CG 3.87Å; L315-M348 HydrophobicContact CD2-SD 4.4Å; L315-F357 HydrophobicContact CD1-CE1 4.38Å; L315-F357 HydrophobicContact CD1-CE2 4.4Å; L315-F357 HydrophobicContact CD1-CZ 4.2Å; L315-F357 HydrophobicContact CD2-CD1 4.48Å; L315-F357 HydrophobicContact CD2-CD2 3.5Å; L315-F357 VanDerWaalsContact CD2-CD2 3.5Å; L315-F357 HydrophobicContact CD2-CE2 3.71Å; L315-F357 HydrophobicContact CD2-CG 3.92Å; L315-F357 HydrophobicContact CD2-CZ 4.29Å; L315-Y403 HydrophobicContact CD1-CD1 3.77Å; L315-Y403 HydrophobicContact CD1-CE1 3.87Å; L315-Y408 HydrophobicContact CD1-CD1 3.97Å; L315-Y408 HydrophobicContact CD1-CG 4.19Å; L315-Y408 HydrophobicContact CD2-CD1 4.07Å; L315-Y408 HydrophobicContact CG-CD1 3.97Å; L315-T409 PolarHBondContact N-OG1 3.47Å; L315-L411 HydrophobicContact CB-CD1 3.79Å; L315-L411 HydrophobicContact CB-CD2 3.75Å; L315-L411 HydrophobicContact CB-CG 3.89Å; L315-L411 HydrophobicContact CD1-CD1 4.08Å; L315-L411 HydrophobicContact CD1-CG 4.31Å
316	R	94.8	Very high	95.2	Very high	103 Å²	103	40.4 Å²	40.4	39%	0.389	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.8	173.5	-179.7	176.2	69.8	-168.8	0.3	110.6	E347 W354	R316-E347 IonicContact CZ-OE2 2.72Å; R316-E347 PolarHBondContact N-O 3.17Å; R316-E347 IonicContact NE-OE2 3.76Å; R316-E347 PolarHBondContact NE-OE2 2.95Å; R316-E347 IonicContact NH2-OE2 2.68Å; R316-E347 PolarHBondContact NH2-OE2 3.11Å; R316-E347 PolarHBondContact O-N 3.5Å; R316-W354 HydrophobicContact CB-CE3 4.1Å; R316-W354 HydrophobicContact CB-CH2 3.7Å; R316-W354 HydrophobicContact CB-CZ3 3.43Å; R316-W354 VanDerWaalsContact CB-CZ3 3.43Å
317	V	96.1	Very high	95.2	Very high	43 Å²	43	40 Å²	40	26%	0.261	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.6	167.9	176.7	0	0	0	0	109.1	V320 I344 L411	V317-V320 HydrophobicContact CG1-CG2 4.13Å; V317-I344 HydrophobicContact CG1-CD1 3.77Å; V317-I344 HydrophobicContact CG1-CG1 4.06Å; V317-I344 HydrophobicContact CG2-CD1 4.4Å; V317-L411 HydrophobicContact CG2-CB 4.14Å; V317-L411 HydrophobicContact CG2-CD1 4.05Å; V317-L411 HydrophobicContact CG2-CD2 4.14Å; V317-L411 HydrophobicContact CG2-CG 4.36Å
318	G	94.8	Very high	95	Very high	30 Å²	30	46.5 Å²	46.5	31%	0.309	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-145	172.9	0	0	0	0	0	112.1	V345	G318-V345 PolarHBondContact N-O 3.17Å
319	A	94.5	Very high	94.8	Very high	67 Å²	67	49.1 Å²	49.1	55%	0.554	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	135	179	0	0	0	0	0	111.9	V345	A319-V345 PolarHBondContact O-N 2.96Å; A319-V345 VanDerWaalsContact O-N 3.11Å
320	V	96.5	Very high	94.8	Very high	40 Å²	40	52.8 Å²	52.8	24%	0.242	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	134.3	171.6	178.4	0	0	0	0	108.2	V317 Y342 S343 I344 T415	V317-V320 HydrophobicContact CG1-CG2 4.13Å; V320-Y342 HydrophobicContact CG1-CE2 3.59Å; V320-Y342 WeakPolarHBondContact CG1-OH 3.48Å; V320-S343 WeakPolarHBondContact CA-O 3.4Å; V320-I344 HydrophobicContact CG2-CB 4.37Å; V320-I344 HydrophobicContact CG2-CD1 4.05Å; V320-I344 HydrophobicContact CG2-CG1 3.89Å; V320-T415 HydrophobicContact CG1-CG2 3.98Å
321	T	96.1	Very high	94.8	Very high	55 Å²	55	51.7 Å²	51.7	34%	0.337	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	143.9	175.2	67.1	0	0	0	0	110.5	S343	T321-S343 PolarHBondContact N-O 3.33Å; T321-S343 PolarHBondContact O-N 2.95Å; T321-S343 PolarHBondContact OG1-OG 2.67Å
322	H	96.6	Very high	94.9	Very high	35 Å²	35	54.5 Å²	54.5	16%	0.162	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	140.5	172.9	56.3	83.9	0	0	0	109.8	P330 Y334 E341 Y342 F399	H322-P330 WeakPolarHBondContact O-CA 3.31Å; H322-P330 WeakPolarHBondContact O-CB 3.45Å; H322-Y334 AromaticContact ND1-CE2 3.97Å; H322-Y334 AromaticContact ND1-CZ 3.83Å; H322-Y334 PolarHBondContact ND1-OH 3.2Å; H322-Y334 PolarHBondContact O-OH 2.93Å; H322-E341 VanDerWaalsContact CA-O 3.24Å; H322-E341 WeakPolarHBondContact CA-O 3.3Å; H322-Y342 HydrophobicContact CB-CD2 4.19Å; H322-F399 HydrophobicContact CB-CD2 4.4Å; H322-F399 HydrophobicContact CB-CE2 3.79Å; H322-F399 HydrophobicContact CB-CZ 4.39Å; H322-F399 AromaticContact CG-CE2 3.79Å
323	H	97.3	Very high	95	Very high	29 Å²	29	54.7 Å²	54.7	13%	0.134	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	160	179.4	52.6	77.1	0	0	0	110.5	E327 A329 Y334 E341	H323-E327 PolarHBondContact CE1-O 2.95Å; H323-E327 VanDerWaalsContact CE1-O 3.28Å; H323-E327 PolarHBondContact ND1-O 3.12Å; H323-A329 WeakPolarHBondContact CB-O 3.19Å; H323-Y334 WeakPolarHBondContact CA-OH 3.16Å; H323-Y334 PolarHBondContact N-OH 2.92Å; H323-E341 IonicContact CE1-OE2 3.29Å; H323-E341 PolarHBondContact CE1-OE2 3.42Å; H323-E341 VanDerWaalsContact CE1-OE2 3.29Å; H323-E341 PolarHBondContact N-O 2.79Å; H323-E341 PolarHBondContact O-N 3.37Å
324	P	97	Very high	95.2	Very high	17 Å²	17	54.5 Å²	54.5	11%	0.11	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	147.3	167	-23.9	33.1	0	0	0	110.5	G326 E327 P331 Y334 L339	P324-G326 PolarHBondContact O-N 3.02Å; P324-E327 HydrophobicContact CB-CB 4.32Å; P324-E327 HydrophobicContact CB-CG 4.22Å; P324-E327 PolarHBondContact O-N 2.95Å; P324-E327 VanDerWaalsContact O-N 3.09Å; P324-P331 HydrophobicContact CG-CG 3.87Å; P324-Y334 HydrophobicContact CG-CD1 4.34Å; P324-Y334 HydrophobicContact CG-CE1 3.97Å; P324-L339 WeakPolarHBondContact CA-O 3.47Å
325	V	95.9	Very high	95.2	Very high	57 Å²	57	54.1 Å²	54.1	35%	0.345	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	126.6	176.6	176.7	0	0	0	0	109.6	L339 E341 Q387	V325-L339 HydrophobicContact CB-CB 4.43Å; V325-L339 HydrophobicContact CB-CD2 3.77Å; V325-L339 HydrophobicContact CB-CG 4.37Å; V325-L339 HydrophobicContact CG1-CD2 4.03Å; V325-L339 HydrophobicContact CG2-CB 4.2Å; V325-L339 HydrophobicContact CG2-CD2 3.53Å; V325-L339 HydrophobicContact CG2-CG 3.83Å; V325-L339 PolarHBondContact N-O 3.24Å; V325-E341 HydrophobicContact CG2-CB 4.23Å; V325-Q387 HydrophobicContact CG2-CG 4.22Å
326	G	93.4	Very high	95.2	Very high	81 Å²	81	54.6 Å²	54.6	84%	0.835	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	-10.4	-175	0	0	0	0	0	114.4	P324	P324-G326 PolarHBondContact O-N 3.02Å
327	E	94.4	Very high	95.3	Very high	108 Å²	108	52.1 Å²	52.1	51%	0.505	36%	0.358	S	S	.	.			trans	-103.4	171.1	172.2	-63.3	-173.3	-165.7	0	0	111.2	H323 P324	H323-E327 PolarHBondContact CE1-O 2.95Å; H323-E327 VanDerWaalsContact CE1-O 3.28Å; H323-E327 PolarHBondContact ND1-O 3.12Å; P324-E327 HydrophobicContact CB-CB 4.32Å; P324-E327 HydrophobicContact CB-CG 4.22Å; P324-E327 PolarHBondContact O-N 2.95Å; P324-E327 VanDerWaalsContact O-N 3.09Å
328	T	92.1	Very high	95.2	Very high	137 Å²	137	52.2 Å²	52.2	84%	0.84	36%	0.357	S	S	*	.	S	Bend	trans	-120.6	-18.8	179.9	50.6	0	0	0	0	113.6
329	A	93.6	Very high	95.3	Very high	55 Å²	55	55 Å²	55	46%	0.455	36%	0.364	S	S	.	.	S	Bend	trans	-111.2	146.2	-177.7	0	0	0	0	0	110.7	H323	H323-A329 WeakPolarHBondContact CB-O 3.19Å
330	P	95.3	Very high	95.5	Very high	83 Å²	83	51.9 Å²	51.9	54%	0.539	34%	0.338	S	S	.	.			trans	-67.4	130.3	172.4	25.8	-31.8	0	0	0	110.5	H322	H322-P330 WeakPolarHBondContact O-CA 3.31Å; H322-P330 WeakPolarHBondContact O-CB 3.45Å
331	P	94.4	Very high	95.5	Very high	40 Å²	40	52 Å²	52	26%	0.26	34%	0.336	S	S	.	.			trans	-73.6	159.9	171.7	31.6	-36.7	0	0	0	110.3	P324 A333 Y334	P324-P331 HydrophobicContact CG-CG 3.87Å; P331-A333 VanDerWaalsContact C-N 3.31Å; P331-A333 PolarHBondContact O-N 2.83Å; P331-Y334 HydrophobicContact CG-CD1 3.88Å; P331-Y334 HydrophobicContact CG-CD2 4.07Å; P331-Y334 HydrophobicContact CG-CE1 3.65Å; P331-Y334 HydrophobicContact CG-CE2 3.84Å; P331-Y334 HydrophobicContact CG-CG 4.11Å
332	A	92.9	Very high	95.6	Very high	106 Å²	106	49.4 Å²	49.4	88%	0.876	32%	0.32	S	S	*	.	S	Bend	trans	-64.9	-35.3	176	0	0	0	0	0	112.8	S418	A332-S418 PolarHBondContact O-OG 2.79Å
333	A	94.7	Very high	95.6	Very high	31 Å²	31	48.3 Å²	48.3	26%	0.256	32%	0.316	S	S	.	.	S	Bend	trans	-150	135.7	176.4	0	0	0	0	0	109.6	P331 S418 R420	P331-A333 VanDerWaalsContact C-N 3.31Å; P331-A333 PolarHBondContact O-N 2.83Å; A333-S418 VanDerWaalsContact CB-OG 3.3Å; A333-S418 WeakPolarHBondContact CB-OG 3.2Å; A333-R420 HydrophobicContact CB-CG 4.16Å
334	Y	96.9	Very high	95.6	Very high	1 Å²	1	47 Å²	47	0%	0.004	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	154.8	174.7	-67.6	-95.9	0	0	0	110.5	H322 H323 P324 P331 V340 L390 V417 S418 V419 R420	H322-Y334 AromaticContact ND1-CE2 3.97Å; H322-Y334 AromaticContact ND1-CZ 3.83Å; H322-Y334 PolarHBondContact ND1-OH 3.2Å; H322-Y334 PolarHBondContact O-OH 2.93Å; H323-Y334 WeakPolarHBondContact CA-OH 3.16Å; H323-Y334 PolarHBondContact N-OH 2.92Å; P324-Y334 HydrophobicContact CG-CD1 4.34Å; P324-Y334 HydrophobicContact CG-CE1 3.97Å; P331-Y334 HydrophobicContact CG-CD1 3.88Å; P331-Y334 HydrophobicContact CG-CD2 4.07Å; P331-Y334 HydrophobicContact CG-CE1 3.65Å; P331-Y334 HydrophobicContact CG-CE2 3.84Å; P331-Y334 HydrophobicContact CG-CG 4.11Å; Y334-V340 HydrophobicContact CD1-CG2 3.47Å; Y334-V340 VanDerWaalsContact CD1-CG2 3.47Å; Y334-V340 HydrophobicContact CE1-CB 4.31Å; Y334-V340 HydrophobicContact CE1-CG1 3.8Å; Y334-V340 HydrophobicContact CE1-CG2 3.5Å; Y334-V340 VanDerWaalsContact CE1-CG2 3.5Å; Y334-V340 HydrophobicContact CG-CG2 4.43Å; Y334-L390 VanDerWaalsContact CB-CD1 3.5Å; Y334-L390 HydrophobicContact CD1-CD1 4.21Å; Y334-L390 HydrophobicContact CG-CD1 3.99Å; Y334-V417 HydrophobicContact CD2-CG1 3.15Å; Y334-V417 HydrophobicContact CE2-CG1 3.26Å; Y334-V417 HydrophobicContact CG-CG1 4.35Å; Y334-S418 PolarHBondContact N-O 3.28Å; Y334-V419 CarbonylContact O-C 3.51Å; Y334-V419 WeakPolarHBondContact O-CA 3.39Å; Y334-R420 VanDerWaalsContact O-CG 3.23Å; Y334-R420 WeakPolarHBondContact O-CG 3.47Å; Y334-R420 PolarHBondContact O-N 3.43Å
335	T	95.9	Very high	95.6	Very high	12 Å²	12	47.3 Å²	47.3	7%	0.074	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	152.3	167.6	26.9	0	0	0	0	112.2	D338 R420 L422	T335-D338 WeakPolarHBondContact CB-OD1 3.37Å; T335-D338 PolarHBondContact N-OD2 2.9Å; T335-D338 WeakPolarHBondContact O-CB 3.38Å; T335-D338 VanDerWaalsContact O-CG 3.25Å; T335-D338 PolarHBondContact O-N 2.71Å; T335-D338 PolarHBondContact OG1-OD1 3.41Å; T335-D338 PolarHBondContact OG1-OD2 3.12Å; T335-R420 WeakPolarHBondContact CA-O 3.5Å; T335-R420 HydrophobicContact CG2-CG 4.06Å; T335-L422 HydrophobicContact CG2-CD2 4.38Å
336	V	96.5	Very high	95.6	Very high	16 Å²	16	44.7 Å²	44.7	10%	0.097	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	144.6	166.5	-67.4	0	0	0	0	109.5	D338 D392 V419 R420 L422	V336-D338 PolarHBondContact O-N 3.13Å; V336-D338 VanDerWaalsContact O-N 3.16Å; V336-D392 WeakPolarHBondContact CG1-O 3.06Å; V336-V419 HydrophobicContact CG1-CG1 4.03Å; V336-R420 PolarHBondContact N-O 2.93Å; V336-L422 HydrophobicContact CG2-CD2 4.4Å; V336-L422 HydrophobicContact CG2-CG 4.05Å
337	T	95.6	Very high	95.7	Very high	52 Å²	52	43.1 Å²	43.1	32%	0.319	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	6.8	-179.7	65.1	0	0	0	0	117.3	K389 L390 D392	T337-K389 WeakPolarHBondContact O-CE 3.09Å; T337-K389 VanDerWaalsContact O-CG 3.32Å; T337-K389 WeakPolarHBondContact O-CG 3.47Å; T337-L390 WeakPolarHBondContact CA-O 3.2Å; T337-L390 PolarHBondContact N-O 2.84Å; T337-D392 WeakPolarHBondContact CG2-OD1 3.48Å
338	D	95.1	Very high	95.7	Very high	44 Å²	44	40.2 Å²	40.2	24%	0.235	25%	0.254	C	S	.	.			trans	-64.7	147.2	174.9	-76.6	-1.4	0	0	0	112.1	T335 V336 V340 K389 L390	T335-D338 WeakPolarHBondContact CB-OD1 3.37Å; T335-D338 PolarHBondContact N-OD2 2.9Å; T335-D338 WeakPolarHBondContact O-CB 3.38Å; T335-D338 VanDerWaalsContact O-CG 3.25Å; T335-D338 PolarHBondContact O-N 2.71Å; T335-D338 PolarHBondContact OG1-OD1 3.41Å; T335-D338 PolarHBondContact OG1-OD2 3.12Å; V336-D338 PolarHBondContact O-N 3.13Å; V336-D338 VanDerWaalsContact O-N 3.16Å; D338-V340 HydrophobicContact CB-CG2 4.3Å; D338-K389 WeakPolarHBondContact O-CA 3.48Å; D338-L390 HydrophobicContact CB-CD1 4.28Å; D338-L390 PolarHBondContact O-N 3.23Å
339	L	97.3	Very high	95.7	Very high	90 Å²	90	35.5 Å²	35.5	47%	0.471	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	118.5	169.8	-155.7	86.4	0	0	0	108.9	P324 V325 K389	P324-L339 WeakPolarHBondContact CA-O 3.47Å; V325-L339 HydrophobicContact CB-CB 4.43Å; V325-L339 HydrophobicContact CB-CD2 3.77Å; V325-L339 HydrophobicContact CB-CG 4.37Å; V325-L339 HydrophobicContact CG1-CD2 4.03Å; V325-L339 HydrophobicContact CG2-CB 4.2Å; V325-L339 HydrophobicContact CG2-CD2 3.53Å; V325-L339 HydrophobicContact CG2-CG 3.83Å; V325-L339 PolarHBondContact N-O 3.24Å; L339-K389 HydrophobicContact CD1-CB 4.42Å
340	V	97.4	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.4	-174.7	-178.4	0	0	0	0	110.4	Y334 D338 Q387 F388 L390 F399	Y334-V340 HydrophobicContact CD1-CG2 3.47Å; Y334-V340 VanDerWaalsContact CD1-CG2 3.47Å; Y334-V340 HydrophobicContact CE1-CB 4.31Å; Y334-V340 HydrophobicContact CE1-CG1 3.8Å; Y334-V340 HydrophobicContact CE1-CG2 3.5Å; Y334-V340 VanDerWaalsContact CE1-CG2 3.5Å; Y334-V340 HydrophobicContact CG-CG2 4.43Å; D338-V340 HydrophobicContact CB-CG2 4.3Å; V340-Q387 WeakPolarHBondContact O-CA 3.34Å; V340-F388 PolarHBondContact N-O 3.26Å; V340-F388 PolarHBondContact O-N 2.86Å; V340-L390 HydrophobicContact CB-CD2 4.47Å; V340-L390 HydrophobicContact CG2-CD1 3.81Å; V340-L390 HydrophobicContact CG2-CD2 4.03Å; V340-L390 HydrophobicContact CG2-CG 3.71Å; V340-F399 HydrophobicContact CG1-CZ 3.98Å
341	E	97.1	Very high	95.1	Very high	44 Å²	44	38.2 Å²	38.2	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.6	169.5	-174.3	159.5	-141.2	0	0	109.8	H322 H323 V325 V386 Q387	H322-E341 VanDerWaalsContact CA-O 3.24Å; H322-E341 WeakPolarHBondContact CA-O 3.3Å; H323-E341 IonicContact CE1-OE2 3.29Å; H323-E341 PolarHBondContact CE1-OE2 3.42Å; H323-E341 VanDerWaalsContact CE1-OE2 3.29Å; H323-E341 PolarHBondContact N-O 2.79Å; H323-E341 PolarHBondContact O-N 3.37Å; V325-E341 HydrophobicContact CG2-CB 4.23Å; E341-V386 WeakPolarHBondContact CA-O 3.28Å; E341-Q387 HydrophobicContact CB-CG 3.95Å; E341-Q387 HydrophobicContact CG-CG 3.87Å; E341-Q387 PolarHBondContact OE1-NE2 3.26Å
342	Y	97.6	Very high	94.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	136.8	172	179.8	-88.5	0	0	0	108.9	V320 H322 I344 L364 L377 S385 V386 F399 V401	V320-Y342 HydrophobicContact CG1-CE2 3.59Å; V320-Y342 WeakPolarHBondContact CG1-OH 3.48Å; H322-Y342 HydrophobicContact CB-CD2 4.19Å; Y342-I344 HydrophobicContact CE1-CB 3.89Å; Y342-I344 HydrophobicContact CE1-CG2 3.92Å; Y342-L364 HydrophobicContact CD1-CD1 3.81Å; Y342-L364 HydrophobicContact CD1-CD2 3.85Å; Y342-L364 HydrophobicContact CD1-CG 4.41Å; Y342-L364 HydrophobicContact CD2-CD1 4.31Å; Y342-L364 HydrophobicContact CE1-CD1 3.71Å; Y342-L364 HydrophobicContact CE2-CD1 4.22Å; Y342-L364 HydrophobicContact CG-CD1 4.12Å; Y342-L364 HydrophobicContact CG-CD2 3.82Å; Y342-L377 HydrophobicContact CD1-CD2 4.14Å; Y342-S385 CarbonylContact O-C 2.79Å; Y342-S385 WeakPolarHBondContact O-CA 3.29Å; Y342-S385 WeakPolarHBondContact O-CB 3.33Å; Y342-V386 PolarHBondContact N-O 2.93Å; Y342-V386 PolarHBondContact O-N 3.35Å; Y342-F399 HydrophobicContact CD2-CB 3.89Å; Y342-F399 AromaticContact CD2-CD1 3.88Å; Y342-F399 HydrophobicContact CD2-CD1 3.88Å; Y342-F399 AromaticContact CD2-CD2 3.82Å; Y342-F399 HydrophobicContact CD2-CD2 3.82Å; Y342-F399 HydrophobicContact CD2-CE1 4.35Å; Y342-F399 HydrophobicContact CD2-CE2 4.26Å; Y342-F399 AromaticContact CD2-CG 3.62Å; Y342-F399 HydrophobicContact CD2-CG 3.62Å; Y342-F399 HydrophobicContact CE2-CB 3.55Å; Y342-F399 HydrophobicContact CE2-CD1 4.42Å; Y342-F399 HydrophobicContact CE2-CD2 4.05Å; Y342-F399 AromaticContact CE2-CG 3.8Å; Y342-F399 HydrophobicContact CE2-CG 3.8Å; Y342-F399 HydrophobicContact CG-CD1 4.5Å; Y342-V401 HydrophobicContact CE1-CG2 3.89Å
343	S	96.9	Very high	94.5	Very high	12 Å²	12	41.8 Å²	41.8	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	142.1	173.5	99.5	0	0	0	0	112.8	V320 T321 Y384	V320-S343 WeakPolarHBondContact CA-O 3.4Å; T321-S343 PolarHBondContact N-O 3.33Å; T321-S343 PolarHBondContact O-N 2.95Å; T321-S343 PolarHBondContact OG1-OG 2.67Å; S343-Y384 CarbonylContact C-O 3.54Å; S343-Y384 WeakPolarHBondContact CA-O 3.17Å
344	I	97.2	Very high	94.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.9	178.8	-176.9	168.2	0	0	0	110	V317 V320 Y342 I346 L377 Y384 V401	V317-I344 HydrophobicContact CG1-CD1 3.77Å; V317-I344 HydrophobicContact CG1-CG1 4.06Å; V317-I344 HydrophobicContact CG2-CD1 4.4Å; V320-I344 HydrophobicContact CG2-CB 4.37Å; V320-I344 HydrophobicContact CG2-CD1 4.05Å; V320-I344 HydrophobicContact CG2-CG1 3.89Å; Y342-I344 HydrophobicContact CE1-CB 3.89Å; Y342-I344 HydrophobicContact CE1-CG2 3.92Å; I344-I346 HydrophobicContact CD1-CG1 4.35Å; I344-I346 HydrophobicContact CG1-CG1 4.11Å; I344-I346 HydrophobicContact CG2-CD1 4.43Å; I344-L377 HydrophobicContact CG2-CD1 3.59Å; I344-Y384 PolarHBondContact N-O 3.33Å; I344-Y384 PolarHBondContact O-N 3.47Å; I344-V401 HydrophobicContact CD1-CB 4.28Å; I344-V401 HydrophobicContact CD1-CG1 4.3Å; I344-V401 HydrophobicContact CD1-CG2 4.26Å
345	V	96.9	Very high	94.3	Very high	25 Å²	25	47.2 Å²	47.2	15%	0.152	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.7	170	178.3	0	0	0	0	108.3	G318 A319 E347 K383	G318-V345 PolarHBondContact N-O 3.17Å; A319-V345 PolarHBondContact O-N 2.96Å; A319-V345 VanDerWaalsContact O-N 3.11Å; V345-E347 HydrophobicContact CG1-CG 4Å; V345-K383 HydrophobicContact CG2-CD 4.32Å; V345-K383 HydrophobicContact CG2-CG 3.77Å
346	I	96.4	Very high	94.2	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.4	173.2	-58.1	172.1	0	0	0	108	I344 F357 I362 Y384 L411	I344-I346 HydrophobicContact CD1-CG1 4.35Å; I344-I346 HydrophobicContact CG1-CG1 4.11Å; I344-I346 HydrophobicContact CG2-CD1 4.43Å; I346-F357 HydrophobicContact CB-CB 4.23Å; I346-F357 HydrophobicContact CG2-CB 3.76Å; I346-F357 HydrophobicContact CG2-CD1 3.85Å; I346-F357 HydrophobicContact CG2-CG 4.08Å; I346-F357 WeakPolarHBondContact O-CB 3.3Å; I346-F357 PolarHBondContact O-N 2.83Å; I346-I362 HydrophobicContact CD1-CD1 3.64Å; I346-I362 HydrophobicContact CD1-CG2 4.14Å; I346-Y384 HydrophobicContact CB-CD2 4.32Å; I346-Y384 HydrophobicContact CB-CE2 4.33Å; I346-Y384 HydrophobicContact CD1-CD2 4.2Å; I346-Y384 HydrophobicContact CG1-CD2 4.35Å; I346-L411 HydrophobicContact CG2-CD1 3.74Å
347	E	95.3	Very high	94.1	Very high	48 Å²	48	49.8 Å²	49.8	22%	0.224	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.6	-178.1	-60.9	173.3	141.2	0	0	109.8	L315 R316 V345 W354 V355	L315-E347 CarbonylContact C-O 3.51Å; L315-E347 WeakPolarHBondContact CA-O 3.35Å; R316-E347 IonicContact CZ-OE2 2.72Å; R316-E347 PolarHBondContact N-O 3.17Å; R316-E347 IonicContact NE-OE2 3.76Å; R316-E347 PolarHBondContact NE-OE2 2.95Å; R316-E347 IonicContact NH2-OE2 2.68Å; R316-E347 PolarHBondContact NH2-OE2 3.11Å; R316-E347 PolarHBondContact O-N 3.5Å; V345-E347 HydrophobicContact CG1-CG 4Å; E347-W354 HydrophobicContact CB-CB 4.29Å; E347-W354 HydrophobicContact CB-CE3 3.84Å; E347-V355 CarbonylContact C-O 3.58Å; E347-V355 VanDerWaalsContact CA-O 3.28Å; E347-V355 WeakPolarHBondContact CA-O 3.47Å
348	M	94.8	Very high	93.8	Very high	47 Å²	47	53.5 Å²	53.5	23%	0.232	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	139.3	174.3	-177.3	174.6	66.6	0	0	109.3	V314 L315 V355 F357 Y408	V314-M348 WeakPolarHBondContact O-CA 3.49Å; L315-M348 HydrophobicContact CD2-CB 3.76Å; L315-M348 HydrophobicContact CD2-CG 3.87Å; L315-M348 HydrophobicContact CD2-SD 4.4Å; M348-V355 HydrophobicContact CB-CG2 4.48Å; M348-V355 HydrophobicContact CE-CG2 4.44Å; M348-V355 PolarHBondContact N-O 3.23Å; M348-V355 WeakPolarHBondContact O-CG2 3.48Å; M348-V355 PolarHBondContact O-N 3.32Å; M348-F357 HydrophobicContact CB-CB 4.43Å; M348-F357 HydrophobicContact CB-CD2 4.12Å; M348-F357 HydrophobicContact SD-CD2 4.14Å; M348-F357 HydrophobicContact SD-CE2 4.39Å; M348-Y408 HydrophobicContact SD-CE1 4.13Å
349	L	93.1	Very high	93.4	Very high	37 Å²	37	51.9 Å²	51.9	19%	0.194	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.5	171.6	-169.3	67.3	0	0	0	109.2	V314 W354	V314-L349 HydrophobicContact CB-CB 3.97Å; V314-L349 HydrophobicContact CB-CD2 4.44Å; V314-L349 HydrophobicContact CG1-CB 4.48Å; V314-L349 PolarHBondContact O-N 3.07Å; L349-W354 HydrophobicContact CB-CE3 4.27Å; L349-W354 HydrophobicContact CB-CH2 4.14Å; L349-W354 HydrophobicContact CB-CZ2 4.49Å; L349-W354 HydrophobicContact CB-CZ3 4.01Å; L349-W354 HydrophobicContact CD1-CD2 4.16Å; L349-W354 HydrophobicContact CD1-CZ2 4.13Å
350	S	89.3	Confident	93.1	Very high	52 Å²	52	54.9 Å²	54.9	36%	0.364	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	119.4	174.9	-171.1	0	0	0	0	109	G352 R353	S350-G352 VanDerWaalsContact C-N 3.29Å; S350-G352 PolarHBondContact O-N 3.09Å; S350-R353 PolarHBondContact N-O 2.74Å; S350-R353 PolarHBondContact O-N 3.03Å; S350-R353 VanDerWaalsContact O-O 3.08Å
351	E	85.3	Confident	92.9	Very high	143 Å²	143	57.5 Å²	57.5	67%	0.668	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	50.9	-179.2	-58.8	178.8	179.7	0	0	112	A50 R353	A50-E351 WeakPolarHBondContact CB-O 3.18Å; E351-R353 PolarHBondContact O-N 2.86Å; E351-R353 VanDerWaalsContact O-N 3.08Å
352	G	83.4	Confident	92.8	Very high	51 Å²	51	55.4 Å²	55.4	53%	0.526	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	4.9	179.7	0	0	0	0	0	116.1	S350	S350-G352 VanDerWaalsContact C-N 3.29Å; S350-G352 PolarHBondContact O-N 3.09Å
353	R	91.4	Very high	92.8	Very high	171 Å²	171	58 Å²	58	65%	0.645	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.3	177.5	-70.3	179.9	-78.4	-176	-3.6	110.8	S350 E351	S350-R353 PolarHBondContact N-O 2.74Å; S350-R353 PolarHBondContact O-N 3.03Å; S350-R353 VanDerWaalsContact O-O 3.08Å; E351-R353 PolarHBondContact O-N 2.86Å; E351-R353 VanDerWaalsContact O-N 3.08Å
354	W	93.2	Very high	92.9	Very high	93 Å²	93	57.4 Å²	57.4	35%	0.352	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.1	173.4	-67.1	97.4	0	0	0	109.1	V314 R316 E347 L349	V314-W354 HydrophobicContact CG1-CH2 3.92Å; V314-W354 HydrophobicContact CG1-CZ3 4.46Å; R316-W354 HydrophobicContact CB-CE3 4.1Å; R316-W354 HydrophobicContact CB-CH2 3.7Å; R316-W354 HydrophobicContact CB-CZ3 3.43Å; R316-W354 VanDerWaalsContact CB-CZ3 3.43Å; E347-W354 HydrophobicContact CB-CB 4.29Å; E347-W354 HydrophobicContact CB-CE3 3.84Å; L349-W354 HydrophobicContact CB-CE3 4.27Å; L349-W354 HydrophobicContact CB-CH2 4.14Å; L349-W354 HydrophobicContact CB-CZ2 4.49Å; L349-W354 HydrophobicContact CB-CZ3 4.01Å; L349-W354 HydrophobicContact CD1-CD2 4.16Å; L349-W354 HydrophobicContact CD1-CZ2 4.13Å
355	V	93.9	Very high	92.9	Very high	53 Å²	53	58.9 Å²	58.9	32%	0.321	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	152.2	178.2	-62.1	0	0	0	0	110.1	E347 M348 F357	E347-V355 CarbonylContact C-O 3.58Å; E347-V355 VanDerWaalsContact CA-O 3.28Å; E347-V355 WeakPolarHBondContact CA-O 3.47Å; M348-V355 HydrophobicContact CB-CG2 4.48Å; M348-V355 HydrophobicContact CE-CG2 4.44Å; M348-V355 PolarHBondContact N-O 3.23Å; M348-V355 WeakPolarHBondContact O-CG2 3.48Å; M348-V355 PolarHBondContact O-N 3.32Å; V355-F357 PolarHBondContact O-N 3.25Å
356	P	94.4	Very high	93	Very high	74 Å²	74	57.7 Å²	57.7	48%	0.481	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	132.5	176	-23.7	34	0	0	0	111.5
357	F	94.1	Very high	93	Very high	7 Å²	7	58.6 Å²	58.6	3%	0.031	31%	0.308	C	S	.	.			trans	-73.1	150.5	178.8	-178.7	-122.5	0	0	0	111.8	L315 I346 M348 V355 I362 K379 Y384 Y403 Y408	L315-F357 HydrophobicContact CD1-CE1 4.38Å; L315-F357 HydrophobicContact CD1-CE2 4.4Å; L315-F357 HydrophobicContact CD1-CZ 4.2Å; L315-F357 HydrophobicContact CD2-CD1 4.48Å; L315-F357 HydrophobicContact CD2-CD2 3.5Å; L315-F357 VanDerWaalsContact CD2-CD2 3.5Å; L315-F357 HydrophobicContact CD2-CE2 3.71Å; L315-F357 HydrophobicContact CD2-CG 3.92Å; L315-F357 HydrophobicContact CD2-CZ 4.29Å; I346-F357 HydrophobicContact CB-CB 4.23Å; I346-F357 HydrophobicContact CG2-CB 3.76Å; I346-F357 HydrophobicContact CG2-CD1 3.85Å; I346-F357 HydrophobicContact CG2-CG 4.08Å; I346-F357 WeakPolarHBondContact O-CB 3.3Å; I346-F357 PolarHBondContact O-N 2.83Å; M348-F357 HydrophobicContact CB-CB 4.43Å; M348-F357 HydrophobicContact CB-CD2 4.12Å; M348-F357 HydrophobicContact SD-CD2 4.14Å; M348-F357 HydrophobicContact SD-CE2 4.39Å; V355-F357 PolarHBondContact O-N 3.25Å; F357-I362 HydrophobicContact CD1-CD1 3.93Å; F357-I362 HydrophobicContact CE1-CD1 4Å; F357-K379 PolarHBondContact O-NZ 3.08Å; F357-Y384 PolarHBondContact O-OH 2.98Å; F357-Y403 AromaticContact CE1-CE1 3.78Å; F357-Y403 HydrophobicContact CE1-CE1 3.78Å; F357-Y403 AromaticContact CE1-CZ 3.82Å; F357-Y403 AromaticContact CZ-CE1 3.8Å; F357-Y403 HydrophobicContact CZ-CE1 3.8Å; F357-Y403 AromaticContact CZ-CZ 3.94Å; F357-Y408 HydrophobicContact CE2-CE1 4.06Å
358	D	89.1	Confident	92.9	Very high	130 Å²	130	61.5 Å²	61.5	70%	0.695	32%	0.317	S	S	*	.			trans	-117.5	70.7	177.1	-79.6	-42.7	0	0	0	110	K379	D358-K379 IonicContact OD1-NZ 3.4Å; D358-K379 PolarHBondContact OD1-NZ 3.16Å
359	G	87.9	Confident	92.8	Very high	10 Å²	10	65.8 Å²	65.8	10%	0.103	34%	0.34	C	S	.	.			trans	-97.9	132.5	167.2	0	0	0	0	0	111.9	Y384	G359-Y384 PolarHBondContact N-OH 3.1Å; G359-Y384 VanDerWaalsContact O-CE1 3.25Å; G359-Y384 WeakPolarHBondContact O-CE1 3.41Å; G359-Y384 PolarHBondContact O-OH 2.71Å
360	D	89.6	Confident	92.9	Very high	154 Å²	154	69.4 Å²	69.4	82%	0.824	36%	0.359	S	S	*	.	S	Bend	trans	-91.6	-24.1	176.1	-168.5	26.4	0	0	0	112
361	D	93.9	Very high	93.3	Very high	54 Å²	54	69.8 Å²	69.8	29%	0.289	36%	0.361	S	S	.	.			trans	-113.2	26.1	-165.5	64.6	-21	0	0	0	113.7	Y403 R405	D361-Y403 WeakPolarHBondContact OD1-CE2 3.13Å; D361-Y403 PolarHBondContact OD1-OH 2.9Å; D361-Y403 VanDerWaalsContact OD1-OH 3.08Å; D361-R405 IonicContact OD2-CZ 3.96Å; D361-R405 IonicContact OD2-NE 3.47Å; D361-R405 PolarHBondContact OD2-NE 2.89Å; D361-R405 IonicContact OD2-NH2 2.95Å; D361-R405 PolarHBondContact OD2-NH2 3.08Å
362	I	96.1	Very high	93.8	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	35%	0.347	C	S	.	.			trans	-76.5	125.7	178.9	-45.5	-173.9	0	0	0	109.3	I346 F357 Y376 L377 Y384 V401 Y403	I346-I362 HydrophobicContact CD1-CD1 3.64Å; I346-I362 HydrophobicContact CD1-CG2 4.14Å; F357-I362 HydrophobicContact CD1-CD1 3.93Å; F357-I362 HydrophobicContact CE1-CD1 4Å; I362-Y376 WeakPolarHBondContact O-CA 3.32Å; I362-L377 HydrophobicContact CG2-CD1 3.89Å; I362-L377 PolarHBondContact O-N 3.17Å; I362-Y384 HydrophobicContact CD1-CD1 3.94Å; I362-Y384 HydrophobicContact CD1-CD2 4.13Å; I362-Y384 HydrophobicContact CD1-CE1 3.6Å; I362-Y384 HydrophobicContact CD1-CE2 3.81Å; I362-Y384 HydrophobicContact CD1-CG 4.18Å; I362-Y384 HydrophobicContact CG1-CE1 4.3Å; I362-V401 HydrophobicContact CG2-CG1 4.03Å; I362-Y403 HydrophobicContact CB-CD2 4.45Å; I362-Y403 HydrophobicContact CG1-CD2 4.07Å; I362-Y403 HydrophobicContact CG1-CE2 3.86Å; I362-Y403 HydrophobicContact CG2-CD2 4.35Å
363	Q	97.1	Very high	94.4	Very high	53 Å²	53	66.2 Å²	66.2	25%	0.248	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.1	-177.3	-66.1	178.9	-2.4	0	0	111.5	T375 Y376	Q363-T375 CarbonylContact C-O 3.44Å; Q363-T375 WeakPolarHBondContact CA-O 3.5Å; Q363-Y376 HydrophobicContact CG-CD1 3.68Å; Q363-Y376 HydrophobicContact CG-CE1 3.59Å; Q363-Y376 HydrophobicContact CG-CG 4.42Å; Q363-Y376 PolarHBondContact NE2-OH 2.81Å; Q363-Y376 VanDerWaalsContact NE2-OH 3.08Å
364	L	97.9	Very high	94.7	Very high	1 Å²	1	65 Å²	65	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.1	165.9	178.7	70.5	0	0	0	109	Y342 R374 T375 L377 V386 F388 F399 V401	Y342-L364 HydrophobicContact CD1-CD1 3.81Å; Y342-L364 HydrophobicContact CD1-CD2 3.85Å; Y342-L364 HydrophobicContact CD1-CG 4.41Å; Y342-L364 HydrophobicContact CD2-CD1 4.31Å; Y342-L364 HydrophobicContact CE1-CD1 3.71Å; Y342-L364 HydrophobicContact CE2-CD1 4.22Å; Y342-L364 HydrophobicContact CG-CD1 4.12Å; Y342-L364 HydrophobicContact CG-CD2 3.82Å; L364-R374 WeakPolarHBondContact O-CA 3.28Å; L364-T375 PolarHBondContact N-O 3.23Å; L364-T375 PolarHBondContact O-N 3.05Å; L364-L377 HydrophobicContact CB-CD2 3.79Å; L364-L377 HydrophobicContact CB-CG 4.08Å; L364-L377 HydrophobicContact CD2-CD2 4.33Å; L364-V386 HydrophobicContact CD2-CG1 3.47Å; L364-V386 VanDerWaalsContact CD2-CG1 3.47Å; L364-F388 HydrophobicContact CD2-CD1 4.43Å; L364-F388 HydrophobicContact CD2-CE1 3.71Å; L364-F388 HydrophobicContact CD2-CZ 4.41Å; L364-F399 HydrophobicContact CD1-CB 4.04Å; L364-F399 HydrophobicContact CD1-CD1 4.33Å; L364-F399 HydrophobicContact CD2-CD1 4.26Å; L364-V401 HydrophobicContact CD1-CG2 3.63Å
365	E	98.3	Very high	94.9	Very high	30 Å²	30	62.4 Å²	62.4	14%	0.14	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.7	170.5	-53.9	-170.5	140.7	0	0	110	V367 V373 R374 K400	E365-V367 HydrophobicContact CB-CG2 3.58Å; E365-V373 CarbonylContact C-O 3.59Å; E365-V373 WeakPolarHBondContact CA-O 3.48Å; E365-R374 HydrophobicContact CG-CG 4.28Å; E365-R374 IonicContact OE1-CZ 2.71Å; E365-R374 IonicContact OE1-NE 2.72Å; E365-R374 PolarHBondContact OE1-NE 3.12Å; E365-R374 IonicContact OE1-NH2 3.14Å; E365-R374 PolarHBondContact OE1-NH2 3.31Å; E365-K400 HydrophobicContact CB-CB 4.31Å; E365-K400 PolarHBondContact N-O 3.38Å; E365-K400 PolarHBondContact O-N 3.01Å
366	F	98.1	Very high	95.1	Very high	1 Å²	1	66.5 Å²	66.5	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	106	168.9	-167.1	-111.9	0	0	0	108.6	F372 V373 F388 L390 P391 F397 Q398 F399 V419	F366-F372 PolarHBondContact O-N 3.44Å; F366-V373 HydrophobicContact CB-CB 4.03Å; F366-V373 PolarHBondContact N-O 3.42Å; F366-V373 PolarHBondContact O-N 3.34Å; F366-F388 HydrophobicContact CB-CE2 4.06Å; F366-F388 HydrophobicContact CB-CZ 3.96Å; F366-F388 HydrophobicContact CD1-CE2 4.46Å; F366-F388 HydrophobicContact CD2-CZ 4.07Å; F366-F388 HydrophobicContact CG-CE2 4.11Å; F366-F388 HydrophobicContact CG-CZ 4.04Å; F366-L390 HydrophobicContact CE1-CD2 3.88Å; F366-L390 HydrophobicContact CE2-CD2 4.08Å; F366-L390 HydrophobicContact CZ-CD2 3.62Å; F366-P391 HydrophobicContact CD1-CG 4.28Å; F366-P391 HydrophobicContact CE1-CG 4.06Å; F366-F397 HydrophobicContact CD1-CB 4.32Å; F366-F397 AromaticContact CD1-CD1 3.58Å; F366-F397 HydrophobicContact CD1-CD1 3.58Å; F366-F397 HydrophobicContact CD1-CE1 4.1Å; F366-F397 HydrophobicContact CD1-CG 4.08Å; F366-F397 HydrophobicContact CD2-CB 4.29Å; F366-F397 HydrophobicContact CE1-CB 3.6Å; F366-F397 AromaticContact CE1-CD1 3.24Å; F366-F397 HydrophobicContact CE1-CD1 3.24Å; F366-F397 AromaticContact CE1-CD2 3.9Å; F366-F397 HydrophobicContact CE1-CD2 3.9Å; F366-F397 AromaticContact CE1-CE1 3.79Å; F366-F397 HydrophobicContact CE1-CE1 3.79Å; F366-F397 HydrophobicContact CE1-CE2 4.37Å; F366-F397 AromaticContact CE1-CG 3.3Å; F366-F397 HydrophobicContact CE1-CG 3.3Å; F366-F397 HydrophobicContact CE1-CZ 4.32Å; F366-F397 HydrophobicContact CE2-CB 3.59Å; F366-F397 HydrophobicContact CE2-CG 4.26Å; F366-F397 HydrophobicContact CG-CD1 4.42Å; F366-F397 HydrophobicContact CZ-CB 3.19Å; F366-F397 AromaticContact CZ-CD1 3.85Å; F366-F397 HydrophobicContact CZ-CD1 3.85Å; F366-F397 HydrophobicContact CZ-CD2 4Å; F366-F397 AromaticContact CZ-CG 3.43Å; F366-F397 HydrophobicContact CZ-CG 3.43Å; F366-F397 VanDerWaalsContact CZ-CG 3.43Å; F366-Q398 WeakPolarHBondContact CA-O 3.42Å; F366-F399 AromaticContact CD2-CD1 3.49Å; F366-F399 HydrophobicContact CD2-CD1 3.49Å; F366-F399 VanDerWaalsContact CD2-CD1 3.49Å; F366-F399 AromaticContact CD2-CE1 3.49Å; F366-F399 HydrophobicContact CD2-CE1 3.49Å; F366-F399 VanDerWaalsContact CD2-CE1 3.49Å; F366-F399 HydrophobicContact CD2-CG 4.25Å; F366-F399 HydrophobicContact CD2-CZ 4.27Å; F366-F399 AromaticContact CE2-CD1 3.96Å; F366-F399 HydrophobicContact CE2-CD1 3.96Å; F366-F399 AromaticContact CE2-CE1 3.64Å; F366-F399 HydrophobicContact CE2-CE1 3.64Å; F366-F399 AromaticContact CE2-CZ 3.96Å; F366-F399 HydrophobicContact CE2-CZ 3.96Å; F366-V419 HydrophobicContact CE1-CG2 4.49Å; F366-V419 HydrophobicContact CZ-CG2 3.93Å
367	V	97.1	Very high	95.1	Very high	20 Å²	20	63.3 Å²	63.3	12%	0.121	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.8	-162.4	-173.4	0	0	0	0	110.6	E365 P371 F397 Q398 K400	E365-V367 HydrophobicContact CB-CG2 3.58Å; V367-P371 HydrophobicContact CG2-CB 4.14Å; V367-F397 CarbonylContact O-C 3.59Å; V367-F397 VanDerWaalsContact O-CA 3.24Å; V367-F397 WeakPolarHBondContact O-CA 3.48Å; V367-Q398 PolarHBondContact N-O 3.49Å; V367-Q398 PolarHBondContact O-N 3.09Å; V367-K400 HydrophobicContact CG2-CB 4.32Å
368	R	93.3	Very high	95.2	Very high	109 Å²	109	70.2 Å²	70.2	41%	0.411	34%	0.341	S	S	.	.	S	Bend	trans	-119.7	-62.5	164.4	179.6	176.6	75.5	-179.7	2.7	111.2	D370 F372 Y394 V396 F397	R368-D370 PolarHBondContact N-O 3.46Å; R368-F372 HydrophobicContact CB-CE2 4.47Å; R368-Y394 PolarHBondContact NH1-O 2.95Å; R368-V396 WeakPolarHBondContact CG-O 3.29Å; R368-F397 HydrophobicContact CB-CD1 3.82Å; R368-F397 HydrophobicContact CB-CE1 3.81Å; R368-F397 HydrophobicContact CB-CG 4.44Å; R368-F397 HydrophobicContact CB-CZ 4.44Å
369	I	93.1	Very high	95.4	Very high	138 Å²	138	67.9 Å²	67.9	71%	0.708	32%	0.324	S	S	*	.	S	Bend	trans	-116.4	-56.3	166	-63.5	172.9	0	0	0	105.4
370	D	94.7	Very high	95.5	Very high	112 Å²	112	72.3 Å²	72.3	60%	0.599	35%	0.346	S	S	*	.	S	Bend	trans	-104.9	159.1	172.3	-53.1	-45.9	0	0	0	111	R368 F372	R368-D370 PolarHBondContact N-O 3.46Å; D370-F372 WeakPolarHBondContact O-CD2 3.47Å; D370-F372 PolarHBondContact O-N 2.85Å
371	P	96.8	Very high	95.4	Very high	61 Å²	61	68 Å²	68	40%	0.396	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	120.2	177.1	27.2	-33.7	0	0	0	111.4	V367	V367-P371 HydrophobicContact CG2-CB 4.14Å
372	F	96.6	Very high	95.1	Very high	86 Å²	86	67.3 Å²	67.3	38%	0.377	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-38.5	175.2	-86.5	-116.8	0	0	0	111.7	F366 R368 D370 P391 V393 F397	F366-F372 PolarHBondContact O-N 3.44Å; R368-F372 HydrophobicContact CB-CE2 4.47Å; D370-F372 WeakPolarHBondContact O-CD2 3.47Å; D370-F372 PolarHBondContact O-N 2.85Å; F372-P391 HydrophobicContact CB-CG 4.45Å; F372-P391 HydrophobicContact CD1-CB 3.91Å; F372-P391 HydrophobicContact CD1-CG 4.03Å; F372-V393 HydrophobicContact CE1-CB 3.87Å; F372-V393 HydrophobicContact CE1-CG1 4.33Å; F372-V393 HydrophobicContact CE1-CG2 3.82Å; F372-V393 HydrophobicContact CZ-CB 4.43Å; F372-V393 HydrophobicContact CZ-CG1 4.4Å; F372-F397 HydrophobicContact CB-CE1 4.49Å; F372-F397 HydrophobicContact CD1-CE1 4.36Å; F372-F397 HydrophobicContact CD2-CE1 4.01Å; F372-F397 HydrophobicContact CE2-CE1 4.35Å; F372-F397 HydrophobicContact CG-CE1 4.02Å
373	V	96.9	Very high	95	Very high	33 Å²	33	71.9 Å²	71.9	20%	0.2	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.5	178.4	-178.6	0	0	0	0	107.9	E365 F366 T375 F388	E365-V373 CarbonylContact C-O 3.59Å; E365-V373 WeakPolarHBondContact CA-O 3.48Å; F366-V373 HydrophobicContact CB-CB 4.03Å; F366-V373 PolarHBondContact N-O 3.42Å; F366-V373 PolarHBondContact O-N 3.34Å; V373-T375 HydrophobicContact CG1-CG2 3.81Å; V373-F388 HydrophobicContact CB-CD2 4.37Å; V373-F388 HydrophobicContact CB-CE2 4.18Å; V373-F388 HydrophobicContact CG1-CD2 3.9Å; V373-F388 HydrophobicContact CG1-CE2 4.13Å; V373-F388 HydrophobicContact CG1-CG 4.5Å; V373-F388 HydrophobicContact CG2-CD2 4.28Å; V373-F388 HydrophobicContact CG2-CE2 4.22Å
374	R	97.7	Very high	94.9	Very high	144 Å²	144	69.5 Å²	69.5	54%	0.543	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	122.1	169.8	-176.5	-178.5	-73.2	158.9	-1.4	108.2	L364 E365	L364-R374 WeakPolarHBondContact O-CA 3.28Å; E365-R374 HydrophobicContact CG-CG 4.28Å; E365-R374 IonicContact OE1-CZ 2.71Å; E365-R374 IonicContact OE1-NE 2.72Å; E365-R374 PolarHBondContact OE1-NE 3.12Å; E365-R374 IonicContact OE1-NH2 3.14Å; E365-R374 PolarHBondContact OE1-NH2 3.31Å
375	T	96.9	Very high	94.9	Very high	40 Å²	40	69.9 Å²	69.9	25%	0.245	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.5	-176.5	53	0	0	0	0	111.1	Q363 L364 V373	Q363-T375 CarbonylContact C-O 3.44Å; Q363-T375 WeakPolarHBondContact CA-O 3.5Å; L364-T375 PolarHBondContact N-O 3.23Å; L364-T375 PolarHBondContact O-N 3.05Å; V373-T375 HydrophobicContact CG1-CG2 3.81Å
376	Y	97.3	Very high	94.8	Very high	138 Å²	138	69.5 Å²	69.5	54%	0.541	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	137.6	172.9	-68.5	-82.1	0	0	0	110.6	I362 Q363	I362-Y376 WeakPolarHBondContact O-CA 3.32Å; Q363-Y376 HydrophobicContact CG-CD1 3.68Å; Q363-Y376 HydrophobicContact CG-CE1 3.59Å; Q363-Y376 HydrophobicContact CG-CG 4.42Å; Q363-Y376 PolarHBondContact NE2-OH 2.81Å; Q363-Y376 VanDerWaalsContact NE2-OH 3.08Å
377	L	95.9	Very high	94.8	Very high	7 Å²	7	74.5 Å²	74.5	4%	0.037	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-80.7	132.2	173.1	-65.3	177.1	0	0	0	109.9	Y342 I344 I362 L364 Y384 V386 V401	Y342-L377 HydrophobicContact CD1-CD2 4.14Å; I344-L377 HydrophobicContact CG2-CD1 3.59Å; I362-L377 HydrophobicContact CG2-CD1 3.89Å; I362-L377 PolarHBondContact O-N 3.17Å; L364-L377 HydrophobicContact CB-CD2 3.79Å; L364-L377 HydrophobicContact CB-CG 4.08Å; L364-L377 HydrophobicContact CD2-CD2 4.33Å; L377-Y384 HydrophobicContact CB-CD1 4.11Å; L377-Y384 HydrophobicContact CB-CG 4.48Å; L377-V386 HydrophobicContact CD2-CB 3.83Å; L377-V386 HydrophobicContact CD2-CG1 3.44Å; L377-V386 VanDerWaalsContact CD2-CG1 3.44Å; L377-V401 HydrophobicContact CD1-CG2 4.32Å
378	K	94.9	Very high	94.8	Very high	153 Å²	153	74.4 Å²	74.4	67%	0.665	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95	135	177	-65.1	-175.7	-179.9	-179.3	0	110	N380 S385	K378-N380 PolarHBondContact O-N 3Å; K378-S385 PolarHBondContact N-O 3.27Å; K378-S385 PolarHBondContact O-N 3.12Å
379	K	93.8	Very high	95	Very high	80 Å²	80	75 Å²	75	35%	0.348	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.8	174.9	-172.3	168.9	179.3	156.7	0	110.2	F357 D358 G381 Y384	F357-K379 PolarHBondContact O-NZ 3.08Å; D358-K379 IonicContact OD1-NZ 3.4Å; D358-K379 PolarHBondContact OD1-NZ 3.16Å; K379-G381 VanDerWaalsContact CE-O 3.27Å; K379-G381 WeakPolarHBondContact CE-O 3.3Å; K379-Y384 HydrophobicContact CB-CD1 4.32Å; K379-Y384 HydrophobicContact CB-CE1 3.94Å; K379-Y384 HydrophobicContact CG-CE1 4.45Å
380	N	89	Confident	95.2	Very high	103 Å²	103	68.7 Å²	68.7	55%	0.551	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	93.7	175.5	-76	-21.7	0	0	0	108.3	K378 G382 K383 S385	K378-N380 PolarHBondContact O-N 3Å; N380-G382 PolarHBondContact O-N 2.9Å; N380-K383 PolarHBondContact N-O 3.24Å; N380-K383 PolarHBondContact O-N 3.27Å; N380-S385 PolarHBondContact ND2-OG 2.95Å
381	G	87.6	Confident	95.3	Very high	63 Å²	63	64.4 Å²	64.4	65%	0.649	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	-126.7	-172.1	0	0	0	0	0	111.7	K379 K383	K379-G381 VanDerWaalsContact CE-O 3.27Å; K379-G381 WeakPolarHBondContact CE-O 3.3Å; G381-K383 VanDerWaalsContact C-N 3.32Å
382	G	87.6	Confident	95.2	Very high	41 Å²	41	67.4 Å²	67.4	42%	0.423	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	8.1	177.7	0	0	0	0	0	115	N380	N380-G382 PolarHBondContact O-N 2.9Å
383	K	94	Very high	95.2	Very high	96 Å²	96	66.1 Å²	66.1	42%	0.417	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.2	-176.1	-65.6	-177	-179.3	-175.4	0	111.2	V345 N380 G381	V345-K383 HydrophobicContact CG2-CD 4.32Å; V345-K383 HydrophobicContact CG2-CG 3.77Å; N380-K383 PolarHBondContact N-O 3.24Å; N380-K383 PolarHBondContact O-N 3.27Å; G381-K383 VanDerWaalsContact C-N 3.32Å
384	Y	96.5	Very high	95.1	Very high	3 Å²	3	71.6 Å²	71.6	1%	0.012	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	121.2	169.4	-76.5	-83.3	0	0	0	108.5	S343 I344 I346 F357 G359 I362 L377 K379	S343-Y384 CarbonylContact C-O 3.54Å; S343-Y384 WeakPolarHBondContact CA-O 3.17Å; I344-Y384 PolarHBondContact N-O 3.33Å; I344-Y384 PolarHBondContact O-N 3.47Å; I346-Y384 HydrophobicContact CB-CD2 4.32Å; I346-Y384 HydrophobicContact CB-CE2 4.33Å; I346-Y384 HydrophobicContact CD1-CD2 4.2Å; I346-Y384 HydrophobicContact CG1-CD2 4.35Å; F357-Y384 PolarHBondContact O-OH 2.98Å; G359-Y384 PolarHBondContact N-OH 3.1Å; G359-Y384 VanDerWaalsContact O-CE1 3.25Å; G359-Y384 WeakPolarHBondContact O-CE1 3.41Å; G359-Y384 PolarHBondContact O-OH 2.71Å; I362-Y384 HydrophobicContact CD1-CD1 3.94Å; I362-Y384 HydrophobicContact CD1-CD2 4.13Å; I362-Y384 HydrophobicContact CD1-CE1 3.6Å; I362-Y384 HydrophobicContact CD1-CE2 3.81Å; I362-Y384 HydrophobicContact CD1-CG 4.18Å; I362-Y384 HydrophobicContact CG1-CE1 4.3Å; L377-Y384 HydrophobicContact CB-CD1 4.11Å; L377-Y384 HydrophobicContact CB-CG 4.48Å; K379-Y384 HydrophobicContact CB-CD1 4.32Å; K379-Y384 HydrophobicContact CB-CE1 3.94Å; K379-Y384 HydrophobicContact CG-CE1 4.45Å
385	S	96.1	Very high	95	Very high	10 Å²	10	65.9 Å²	65.9	7%	0.07	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.8	-175.5	58.7	0	0	0	0	112.9	Y342 K378 N380	Y342-S385 CarbonylContact O-C 2.79Å; Y342-S385 WeakPolarHBondContact O-CA 3.29Å; Y342-S385 WeakPolarHBondContact O-CB 3.33Å; K378-S385 PolarHBondContact N-O 3.27Å; K378-S385 PolarHBondContact O-N 3.12Å; N380-S385 PolarHBondContact ND2-OG 2.95Å
386	V	97.3	Very high	95.1	Very high	21 Å²	21	67.6 Å²	67.6	13%	0.127	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	144.7	173.1	67.9	0	0	0	0	109.7	E341 Y342 L364 L377 F388	E341-V386 WeakPolarHBondContact CA-O 3.28Å; Y342-V386 PolarHBondContact N-O 2.93Å; Y342-V386 PolarHBondContact O-N 3.35Å; L364-V386 HydrophobicContact CD2-CG1 3.47Å; L364-V386 VanDerWaalsContact CD2-CG1 3.47Å; L377-V386 HydrophobicContact CD2-CB 3.83Å; L377-V386 HydrophobicContact CD2-CG1 3.44Å; L377-V386 VanDerWaalsContact CD2-CG1 3.44Å; V386-F388 HydrophobicContact CG1-CD1 4.2Å
387	Q	97.2	Very high	95.1	Very high	106 Å²	106	61 Å²	61	50%	0.495	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.3	172	-64.6	178.6	7.5	0	0	108.4	V325 V340 E341	V325-Q387 HydrophobicContact CG2-CG 4.22Å; V340-Q387 WeakPolarHBondContact O-CA 3.34Å; E341-Q387 HydrophobicContact CB-CG 3.95Å; E341-Q387 HydrophobicContact CG-CG 3.87Å; E341-Q387 PolarHBondContact OE1-NE2 3.26Å
388	F	97.4	Very high	95.2	Very high	18 Å²	18	64 Å²	64	8%	0.079	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	165.6	178.4	73.5	-81.1	0	0	0	111.4	V340 L364 F366 V373 V386 L390 F399	V340-F388 PolarHBondContact N-O 3.26Å; V340-F388 PolarHBondContact O-N 2.86Å; L364-F388 HydrophobicContact CD2-CD1 4.43Å; L364-F388 HydrophobicContact CD2-CE1 3.71Å; L364-F388 HydrophobicContact CD2-CZ 4.41Å; F366-F388 HydrophobicContact CB-CE2 4.06Å; F366-F388 HydrophobicContact CB-CZ 3.96Å; F366-F388 HydrophobicContact CD1-CE2 4.46Å; F366-F388 HydrophobicContact CD2-CZ 4.07Å; F366-F388 HydrophobicContact CG-CE2 4.11Å; F366-F388 HydrophobicContact CG-CZ 4.04Å; V373-F388 HydrophobicContact CB-CD2 4.37Å; V373-F388 HydrophobicContact CB-CE2 4.18Å; V373-F388 HydrophobicContact CG1-CD2 3.9Å; V373-F388 HydrophobicContact CG1-CE2 4.13Å; V373-F388 HydrophobicContact CG1-CG 4.5Å; V373-F388 HydrophobicContact CG2-CD2 4.28Å; V373-F388 HydrophobicContact CG2-CE2 4.22Å; V386-F388 HydrophobicContact CG1-CD1 4.2Å; F388-L390 HydrophobicContact CE2-CD2 4.1Å; F388-L390 HydrophobicContact CZ-CD2 4.42Å; F388-F399 HydrophobicContact CE1-CD1 4.42Å; F388-F399 AromaticContact CE1-CE1 3.83Å; F388-F399 HydrophobicContact CE1-CE1 3.83Å; F388-F399 HydrophobicContact CZ-CD1 4.2Å; F388-F399 AromaticContact CZ-CE1 3.6Å; F388-F399 HydrophobicContact CZ-CE1 3.6Å
389	K	97.6	Very high	95.3	Very high	122 Å²	122	56.8 Å²	56.8	53%	0.53	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	133.4	-179.4	-165.9	179.8	179.5	-172.9	0	110.3	T337 D338 L339	T337-K389 WeakPolarHBondContact O-CE 3.09Å; T337-K389 VanDerWaalsContact O-CG 3.32Å; T337-K389 WeakPolarHBondContact O-CG 3.47Å; D338-K389 WeakPolarHBondContact O-CA 3.48Å; L339-K389 HydrophobicContact CD1-CB 4.42Å
390	L	96.9	Very high	95.5	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.026	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-67	148.3	175.5	-63.6	-173.9	0	0	0	111.6	Y334 T337 D338 V340 F366 F388 V419	Y334-L390 VanDerWaalsContact CB-CD1 3.5Å; Y334-L390 HydrophobicContact CD1-CD1 4.21Å; Y334-L390 HydrophobicContact CG-CD1 3.99Å; T337-L390 WeakPolarHBondContact CA-O 3.2Å; T337-L390 PolarHBondContact N-O 2.84Å; D338-L390 HydrophobicContact CB-CD1 4.28Å; D338-L390 PolarHBondContact O-N 3.23Å; V340-L390 HydrophobicContact CB-CD2 4.47Å; V340-L390 HydrophobicContact CG2-CD1 3.81Å; V340-L390 HydrophobicContact CG2-CD2 4.03Å; V340-L390 HydrophobicContact CG2-CG 3.71Å; F366-L390 HydrophobicContact CE1-CD2 3.88Å; F366-L390 HydrophobicContact CE2-CD2 4.08Å; F366-L390 HydrophobicContact CZ-CD2 3.62Å; F388-L390 HydrophobicContact CE2-CD2 4.1Å; F388-L390 HydrophobicContact CZ-CD2 4.42Å; L390-V419 HydrophobicContact CD1-CG1 4.25Å; L390-V419 HydrophobicContact CD1-CG2 3.93Å
391	P	96.7	Very high	95.9	Very high	23 Å²	23	50.5 Å²	50.5	15%	0.149	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-68.2	163.3	178.5	29.9	-35.7	0	0	0	112.3	F366 F372 V393 F397	F366-P391 HydrophobicContact CD1-CG 4.28Å; F366-P391 HydrophobicContact CE1-CG 4.06Å; F372-P391 HydrophobicContact CB-CG 4.45Å; F372-P391 HydrophobicContact CD1-CB 3.91Å; F372-P391 HydrophobicContact CD1-CG 4.03Å; P391-V393 PolarHBondContact O-N 3.32Å; P391-F397 HydrophobicContact CG-CE1 4.11Å; P391-F397 HydrophobicContact CG-CZ 3.94Å
392	D	95.4	Very high	96.4	Very high	123 Å²	123	50.3 Å²	50.3	66%	0.658	26%	0.262	S	S	*	.	S	Bend	trans	-72	-16.2	177.5	-62.5	-18	0	0	0	112.9	V336 T337	V336-D392 WeakPolarHBondContact CG1-O 3.06Å; T337-D392 WeakPolarHBondContact CG2-OD1 3.48Å
393	V	96	Very high	96.8	Very high	59 Å²	59	48.9 Å²	48.9	36%	0.358	24%	0.244	S	C	.	.			trans	-81.9	120.7	179.3	-177.8	0	0	0	0	109.4	F372 P391 F397	F372-V393 HydrophobicContact CE1-CB 3.87Å; F372-V393 HydrophobicContact CE1-CG1 4.33Å; F372-V393 HydrophobicContact CE1-CG2 3.82Å; F372-V393 HydrophobicContact CZ-CB 4.43Å; F372-V393 HydrophobicContact CZ-CG1 4.4Å; P391-V393 PolarHBondContact O-N 3.32Å; V393-F397 WeakPolarHBondContact O-CE2 3.35Å; V393-F397 VanDerWaalsContact O-CZ 3.28Å; V393-F397 WeakPolarHBondContact O-CZ 3.31Å
394	Y	95.8	Very high	96.9	Very high	149 Å²	149	49.1 Å²	49.1	58%	0.584	25%	0.25	S	S	*	.			trans	-83	164.2	176	62.1	-91.9	0	0	0	112.2	R368 V419 P421	R368-Y394 PolarHBondContact NH1-O 2.95Å; Y394-V419 WeakPolarHBondContact CB-O 3.36Å; Y394-P421 HydrophobicContact CD1-CB 4.38Å
395	G	96.1	Very high	96.8	Very high	24 Å²	24	53.2 Å²	53.2	25%	0.247	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	141.2	-164.1	179.1	0	0	0	0	0	112.2	V419	G395-V419 PolarHBondContact N-O 2.81Å; G395-V419 PolarHBondContact O-N 2.81Å
396	V	97.3	Very high	96.7	Very high	76 Å²	76	56.6 Å²	56.6	46%	0.461	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.6	175.7	-173	0	0	0	0	108.6	R368 Q416	R368-V396 WeakPolarHBondContact CG-O 3.29Å; V396-Q416 HydrophobicContact CG1-CG 3.49Å; V396-Q416 VanDerWaalsContact CG1-CG 3.49Å
397	F	97.8	Very high	96.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	169.7	-179.8	-72.8	-95.6	0	0	0	110.4	F366 V367 R368 F372 P391 V393 Q416 V417 V419	F366-F397 HydrophobicContact CD1-CB 4.32Å; F366-F397 AromaticContact CD1-CD1 3.58Å; F366-F397 HydrophobicContact CD1-CD1 3.58Å; F366-F397 HydrophobicContact CD1-CE1 4.1Å; F366-F397 HydrophobicContact CD1-CG 4.08Å; F366-F397 HydrophobicContact CD2-CB 4.29Å; F366-F397 HydrophobicContact CE1-CB 3.6Å; F366-F397 AromaticContact CE1-CD1 3.24Å; F366-F397 HydrophobicContact CE1-CD1 3.24Å; F366-F397 AromaticContact CE1-CD2 3.9Å; F366-F397 HydrophobicContact CE1-CD2 3.9Å; F366-F397 AromaticContact CE1-CE1 3.79Å; F366-F397 HydrophobicContact CE1-CE1 3.79Å; F366-F397 HydrophobicContact CE1-CE2 4.37Å; F366-F397 AromaticContact CE1-CG 3.3Å; F366-F397 HydrophobicContact CE1-CG 3.3Å; F366-F397 HydrophobicContact CE1-CZ 4.32Å; F366-F397 HydrophobicContact CE2-CB 3.59Å; F366-F397 HydrophobicContact CE2-CG 4.26Å; F366-F397 HydrophobicContact CG-CD1 4.42Å; F366-F397 HydrophobicContact CZ-CB 3.19Å; F366-F397 AromaticContact CZ-CD1 3.85Å; F366-F397 HydrophobicContact CZ-CD1 3.85Å; F366-F397 HydrophobicContact CZ-CD2 4Å; F366-F397 AromaticContact CZ-CG 3.43Å; F366-F397 HydrophobicContact CZ-CG 3.43Å; F366-F397 VanDerWaalsContact CZ-CG 3.43Å; V367-F397 CarbonylContact O-C 3.59Å; V367-F397 VanDerWaalsContact O-CA 3.24Å; V367-F397 WeakPolarHBondContact O-CA 3.48Å; R368-F397 HydrophobicContact CB-CD1 3.82Å; R368-F397 HydrophobicContact CB-CE1 3.81Å; R368-F397 HydrophobicContact CB-CG 4.44Å; R368-F397 HydrophobicContact CB-CZ 4.44Å; F372-F397 HydrophobicContact CB-CE1 4.49Å; F372-F397 HydrophobicContact CD1-CE1 4.36Å; F372-F397 HydrophobicContact CD2-CE1 4.01Å; F372-F397 HydrophobicContact CE2-CE1 4.35Å; F372-F397 HydrophobicContact CG-CE1 4.02Å; P391-F397 HydrophobicContact CG-CE1 4.11Å; P391-F397 HydrophobicContact CG-CZ 3.94Å; V393-F397 WeakPolarHBondContact O-CE2 3.35Å; V393-F397 VanDerWaalsContact O-CZ 3.28Å; V393-F397 WeakPolarHBondContact O-CZ 3.31Å; F397-Q416 WeakPolarHBondContact O-CA 3.34Å; F397-V417 PolarHBondContact N-O 2.55Å; F397-V417 PolarHBondContact O-N 2.88Å; F397-V417 VanDerWaalsContact O-O 3.09Å; F397-V419 HydrophobicContact CD2-CB 4.01Å; F397-V419 HydrophobicContact CD2-CG2 3.63Å; F397-V419 HydrophobicContact CE2-CB 4.16Å; F397-V419 HydrophobicContact CE2-CG2 4.16Å; F397-V419 HydrophobicContact CG-CG2 4.43Å
398	Q	97.6	Very high	96.3	Very high	70 Å²	70	53.3 Å²	53.3	33%	0.327	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.9	174.3	-63	-180	4.1	0	0	109.1	F366 V367 S414 T415 Q416	F366-Q398 WeakPolarHBondContact CA-O 3.42Å; V367-Q398 PolarHBondContact N-O 3.49Å; V367-Q398 PolarHBondContact O-N 3.09Å; Q398-S414 PolarHBondContact OE1-OG 3.34Å; Q398-T415 WeakPolarHBondContact CA-O 3.34Å; Q398-Q416 HydrophobicContact CG-CB 4.3Å; Q398-Q416 HydrophobicContact CG-CG 4.34Å
399	F	97.9	Very high	96.3	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.2	158.8	-62.1	-68	0	0	0	107.4	H322 V340 Y342 L364 F366 F388 S414 T415 V417	H322-F399 HydrophobicContact CB-CD2 4.4Å; H322-F399 HydrophobicContact CB-CE2 3.79Å; H322-F399 HydrophobicContact CB-CZ 4.39Å; H322-F399 AromaticContact CG-CE2 3.79Å; V340-F399 HydrophobicContact CG1-CZ 3.98Å; Y342-F399 HydrophobicContact CD2-CB 3.89Å; Y342-F399 AromaticContact CD2-CD1 3.88Å; Y342-F399 HydrophobicContact CD2-CD1 3.88Å; Y342-F399 AromaticContact CD2-CD2 3.82Å; Y342-F399 HydrophobicContact CD2-CD2 3.82Å; Y342-F399 HydrophobicContact CD2-CE1 4.35Å; Y342-F399 HydrophobicContact CD2-CE2 4.26Å; Y342-F399 AromaticContact CD2-CG 3.62Å; Y342-F399 HydrophobicContact CD2-CG 3.62Å; Y342-F399 HydrophobicContact CE2-CB 3.55Å; Y342-F399 HydrophobicContact CE2-CD1 4.42Å; Y342-F399 HydrophobicContact CE2-CD2 4.05Å; Y342-F399 AromaticContact CE2-CG 3.8Å; Y342-F399 HydrophobicContact CE2-CG 3.8Å; Y342-F399 HydrophobicContact CG-CD1 4.5Å; L364-F399 HydrophobicContact CD1-CB 4.04Å; L364-F399 HydrophobicContact CD1-CD1 4.33Å; L364-F399 HydrophobicContact CD2-CD1 4.26Å; F366-F399 AromaticContact CD2-CD1 3.49Å; F366-F399 HydrophobicContact CD2-CD1 3.49Å; F366-F399 VanDerWaalsContact CD2-CD1 3.49Å; F366-F399 AromaticContact CD2-CE1 3.49Å; F366-F399 HydrophobicContact CD2-CE1 3.49Å; F366-F399 VanDerWaalsContact CD2-CE1 3.49Å; F366-F399 HydrophobicContact CD2-CG 4.25Å; F366-F399 HydrophobicContact CD2-CZ 4.27Å; F366-F399 AromaticContact CE2-CD1 3.96Å; F366-F399 HydrophobicContact CE2-CD1 3.96Å; F366-F399 AromaticContact CE2-CE1 3.64Å; F366-F399 HydrophobicContact CE2-CE1 3.64Å; F366-F399 AromaticContact CE2-CZ 3.96Å; F366-F399 HydrophobicContact CE2-CZ 3.96Å; F388-F399 HydrophobicContact CE1-CD1 4.42Å; F388-F399 AromaticContact CE1-CE1 3.83Å; F388-F399 HydrophobicContact CE1-CE1 3.83Å; F388-F399 HydrophobicContact CZ-CD1 4.2Å; F388-F399 AromaticContact CZ-CE1 3.6Å; F388-F399 HydrophobicContact CZ-CE1 3.6Å; F399-S414 CarbonylContact O-C 3.17Å; F399-S414 VanDerWaalsContact O-CA 3.29Å; F399-S414 WeakPolarHBondContact O-CA 3.41Å; F399-T415 WeakPolarHBondContact CB-OG1 3.36Å; F399-T415 WeakPolarHBondContact CD2-OG1 3.44Å; F399-T415 PolarHBondContact N-O 2.94Å; F399-T415 PolarHBondContact O-N 2.83Å; F399-V417 HydrophobicContact CD2-CG2 3.64Å; F399-V417 HydrophobicContact CE2-CB 4.44Å; F399-V417 HydrophobicContact CE2-CG2 3.52Å
400	K	98.2	Very high	96.2	Very high	47 Å²	47	49.9 Å²	49.9	20%	0.204	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	124.4	179.9	178.5	-178.5	164.4	-178.5	0	109.2	E365 V367 D402 Y412 S413	E365-K400 HydrophobicContact CB-CB 4.31Å; E365-K400 PolarHBondContact N-O 3.38Å; E365-K400 PolarHBondContact O-N 3.01Å; V367-K400 HydrophobicContact CG2-CB 4.32Å; K400-D402 VanDerWaalsContact CE-OD2 3.24Å; K400-D402 WeakPolarHBondContact CE-OD2 3.35Å; K400-D402 IonicContact NZ-OD2 2.83Å; K400-D402 PolarHBondContact NZ-OD2 3.17Å; K400-D402 VanDerWaalsContact NZ-OD2 3.15Å; K400-Y412 HydrophobicContact CD-CE2 4.09Å; K400-Y412 HydrophobicContact CG-CE2 4.24Å; K400-S413 WeakPolarHBondContact CA-O 3.27Å
401	V	97.8	Very high	96.1	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.1	168.5	-179.5	0	0	0	0	107	Y342 I344 I362 L364 L377 Y412 S413	Y342-V401 HydrophobicContact CE1-CG2 3.89Å; I344-V401 HydrophobicContact CD1-CB 4.28Å; I344-V401 HydrophobicContact CD1-CG1 4.3Å; I344-V401 HydrophobicContact CD1-CG2 4.26Å; I362-V401 HydrophobicContact CG2-CG1 4.03Å; L364-V401 HydrophobicContact CD1-CG2 3.63Å; L377-V401 HydrophobicContact CD1-CG2 4.32Å; V401-Y412 WeakPolarHBondContact O-CA 3.13Å; V401-S413 PolarHBondContact N-O 2.86Å; V401-S413 PolarHBondContact O-N 3.44Å
402	D	97	Very high	96.1	Very high	59 Å²	59	55.2 Å²	55.2	32%	0.316	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	101.6	-176	-168.5	-14.9	0	0	0	108.1	K400 H410 L411	K400-D402 VanDerWaalsContact CE-OD2 3.24Å; K400-D402 WeakPolarHBondContact CE-OD2 3.35Å; K400-D402 IonicContact NZ-OD2 2.83Å; K400-D402 PolarHBondContact NZ-OD2 3.17Å; K400-D402 VanDerWaalsContact NZ-OD2 3.15Å; D402-H410 IonicContact OD1-CD2 2.58Å; D402-H410 IonicContact OD1-CE1 3.15Å; D402-H410 IonicContact OD1-NE2 2.81Å; D402-H410 PolarHBondContact OD1-NE2 2.97Å; D402-L411 WeakPolarHBondContact CA-O 3.47Å
403	Y	96.9	Very high	96.2	Very high	12 Å²	12	50.2 Å²	50.2	5%	0.047	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	95.4	-178	-164.3	-104.4	0	0	0	109.6	L315 F357 D361 I362 R405 L411	L315-Y403 HydrophobicContact CD1-CD1 3.77Å; L315-Y403 HydrophobicContact CD1-CE1 3.87Å; F357-Y403 AromaticContact CE1-CE1 3.78Å; F357-Y403 HydrophobicContact CE1-CE1 3.78Å; F357-Y403 AromaticContact CE1-CZ 3.82Å; F357-Y403 AromaticContact CZ-CE1 3.8Å; F357-Y403 HydrophobicContact CZ-CE1 3.8Å; F357-Y403 AromaticContact CZ-CZ 3.94Å; D361-Y403 WeakPolarHBondContact OD1-CE2 3.13Å; D361-Y403 PolarHBondContact OD1-OH 2.9Å; D361-Y403 VanDerWaalsContact OD1-OH 3.08Å; I362-Y403 HydrophobicContact CB-CD2 4.45Å; I362-Y403 HydrophobicContact CG1-CD2 4.07Å; I362-Y403 HydrophobicContact CG1-CE2 3.86Å; I362-Y403 HydrophobicContact CG2-CD2 4.35Å; Y403-R405 HydrophobicContact CD1-CG 4.3Å; Y403-R405 HydrophobicContact CE1-CB 4.05Å; Y403-R405 HydrophobicContact CE1-CG 3.67Å; Y403-R405 HydrophobicContact CE2-CG 3.9Å; Y403-R405 VanDerWaalsContact CZ-CG 3.45Å; Y403-L411 PolarHBondContact N-O 3.47Å; Y403-L411 PolarHBondContact O-N 2.75Å
404	N	95.4	Very high	96.2	Very high	101 Å²	101	49.4 Å²	49.4	54%	0.54	24%	0.241	S	C	.	.			trans	-111.6	107.7	174.6	-168	3.8	0	0	0	109.7
405	R	94.4	Very high	96.3	Very high	88 Å²	88	43.8 Å²	43.8	33%	0.332	22%	0.222	S	C	.	.			trans	-135.3	143.5	178	-70.4	-62.3	179.6	-86.6	-2.1	110.4	D361 Y403 G407 Y408	D361-R405 IonicContact OD2-CZ 3.96Å; D361-R405 IonicContact OD2-NE 3.47Å; D361-R405 PolarHBondContact OD2-NE 2.89Å; D361-R405 IonicContact OD2-NH2 2.95Å; D361-R405 PolarHBondContact OD2-NH2 3.08Å; Y403-R405 HydrophobicContact CD1-CG 4.3Å; Y403-R405 HydrophobicContact CE1-CB 4.05Å; Y403-R405 HydrophobicContact CE1-CG 3.67Å; Y403-R405 HydrophobicContact CE2-CG 3.9Å; Y403-R405 VanDerWaalsContact CZ-CG 3.45Å; R405-G407 PolarHBondContact O-N 2.61Å; R405-Y408 HydrophobicContact CB-CD2 4.06Å; R405-Y408 PolarHBondContact O-N 2.87Å
406	L	93.8	Very high	96.4	Very high	81 Å²	81	49.1 Å²	49.1	42%	0.424	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	123.3	-177.5	-174.5	62.2	0	0	0	111.7	L190 A192 I195 L221 Y408	L190-L406 HydrophobicContact CD1-CD2 3.91Å; L190-L406 HydrophobicContact CD2-CD1 4.22Å; L190-L406 HydrophobicContact CD2-CD2 4.19Å; L190-L406 HydrophobicContact CD2-CG 4.44Å; L190-L406 HydrophobicContact CG-CD2 4.09Å; A192-L406 HydrophobicContact CB-CD2 3.77Å; A192-L406 HydrophobicContact CB-CG 3.88Å; I195-L406 HydrophobicContact CD1-CD1 4.39Å; I195-L406 HydrophobicContact CD1-CG 4.47Å; L221-L406 HydrophobicContact CD1-CD1 4.12Å; L221-L406 HydrophobicContact CD2-CD1 3.38Å; L221-L406 HydrophobicContact CG-CD1 4.33Å; L406-Y408 VanDerWaalsContact C-N 3.29Å; L406-Y408 PolarHBondContact O-N 3.18Å
407	G	92	Very high	96.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	-8.8	178.9	0	0	0	0	0	115.7	T194 W307 R405	T194-G407 WeakPolarHBondContact CG2-O 3.45Å; W307-G407 PolarHBondContact NE1-O 2.93Å; W307-G407 VanDerWaalsContact NE1-O 3.08Å; R405-G407 PolarHBondContact O-N 2.61Å
408	Y	95.6	Very high	96.3	Very high	58 Å²	58	48.3 Å²	48.3	23%	0.227	24%	0.238	C	C	.	.	S	Bend	trans	-99.8	152.1	175.1	-69.4	-82.4	0	0	0	111.5	T194 Q257 G313 L315 M348 F357 R405 L406 H410	T194-Y408 HydrophobicContact CG2-CE1 4.34Å; Q257-Y408 PolarHBondContact NE2-O 3.23Å; Q257-Y408 PolarHBondContact OE1-O 3.4Å; G313-Y408 WeakPolarHBondContact O-CA 3.39Å; L315-Y408 HydrophobicContact CD1-CD1 3.97Å; L315-Y408 HydrophobicContact CD1-CG 4.19Å; L315-Y408 HydrophobicContact CD2-CD1 4.07Å; L315-Y408 HydrophobicContact CG-CD1 3.97Å; M348-Y408 HydrophobicContact SD-CE1 4.13Å; F357-Y408 HydrophobicContact CE2-CE1 4.06Å; R405-Y408 HydrophobicContact CB-CD2 4.06Å; R405-Y408 PolarHBondContact O-N 2.87Å; L406-Y408 VanDerWaalsContact C-N 3.29Å; L406-Y408 PolarHBondContact O-N 3.18Å; Y408-H410 PolarHBondContact O-N 3.02Å
409	T	96.1	Very high	96.3	Very high	15 Å²	15	45.2 Å²	45.2	9%	0.092	22%	0.224	C	C	.	.			trans	-53.2	133.8	168	-59.3	0	0	0	0	110.7	N261 G313 V314 L315 L411	N261-T409 HydrophobicContact CB-CG2 4.01Å; N261-T409 VanDerWaalsContact CG-CG2 3.45Å; N261-T409 WeakPolarHBondContact ND2-CG2 3.5Å; G313-T409 PolarHBondContact O-N 3.42Å; G313-T409 PolarHBondContact O-OG1 2.82Å; V314-T409 WeakPolarHBondContact CA-OG1 3.32Å; L315-T409 PolarHBondContact N-OG1 3.47Å; T409-L411 HydrophobicContact CG2-CD2 4.33Å; T409-L411 PolarHBondContact O-N 3.12Å
410	H	96.6	Very high	96.3	Very high	54 Å²	54	48.3 Å²	48.3	25%	0.25	24%	0.235	C	C	.	.			trans	-70.1	115.9	172.5	179.1	-133.1	0	0	0	109	N261 D402 Y408	N261-H410 PolarHBondContact ND2-O 3.38Å; N261-H410 VanDerWaalsContact ND2-O 3.15Å; N261-H410 WeakPolarHBondContact OD1-CB 3.25Å; N261-H410 PolarHBondContact OD1-N 3.22Å; D402-H410 IonicContact OD1-CD2 2.58Å; D402-H410 IonicContact OD1-CE1 3.15Å; D402-H410 IonicContact OD1-NE2 2.81Å; D402-H410 PolarHBondContact OD1-NE2 2.97Å; Y408-H410 PolarHBondContact O-N 3.02Å
411	L	95.1	Very high	96.2	Very high	11 Å²	11	49.1 Å²	49.1	6%	0.058	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.7	175.5	-58.9	-177.4	0	0	0	110.1	L315 V317 I346 D402 Y403 T409	L315-L411 HydrophobicContact CB-CD1 3.79Å; L315-L411 HydrophobicContact CB-CD2 3.75Å; L315-L411 HydrophobicContact CB-CG 3.89Å; L315-L411 HydrophobicContact CD1-CD1 4.08Å; L315-L411 HydrophobicContact CD1-CG 4.31Å; V317-L411 HydrophobicContact CG2-CB 4.14Å; V317-L411 HydrophobicContact CG2-CD1 4.05Å; V317-L411 HydrophobicContact CG2-CD2 4.14Å; V317-L411 HydrophobicContact CG2-CG 4.36Å; I346-L411 HydrophobicContact CG2-CD1 3.74Å; D402-L411 WeakPolarHBondContact CA-O 3.47Å; Y403-L411 PolarHBondContact N-O 3.47Å; Y403-L411 PolarHBondContact O-N 2.75Å; T409-L411 HydrophobicContact CG2-CD2 4.33Å; T409-L411 PolarHBondContact O-N 3.12Å
412	Y	96.3	Very high	96.1	Very high	128 Å²	128	51.9 Å²	51.9	50%	0.502	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	120.1	172.7	-178.7	-88.6	0	0	0	109.4	K400 V401	K400-Y412 HydrophobicContact CD-CE2 4.09Å; K400-Y412 HydrophobicContact CG-CE2 4.24Å; V401-Y412 WeakPolarHBondContact O-CA 3.13Å
413	S	96.8	Very high	96	Very high	18 Å²	18	53.7 Å²	53.7	13%	0.126	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.5	174.2	174.3	0	0	0	0	109.3	K400 V401	K400-S413 WeakPolarHBondContact CA-O 3.27Å; V401-S413 PolarHBondContact N-O 2.86Å; V401-S413 PolarHBondContact O-N 3.44Å
414	S	96.9	Very high	96	Very high	43 Å²	43	60.9 Å²	60.9	30%	0.301	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.6	175.2	-176.6	0	0	0	0	110.2	Q398 F399	Q398-S414 PolarHBondContact OE1-OG 3.34Å; F399-S414 CarbonylContact O-C 3.17Å; F399-S414 VanDerWaalsContact O-CA 3.29Å; F399-S414 WeakPolarHBondContact O-CA 3.41Å
415	T	97.1	Very high	96	Very high	31 Å²	31	60.4 Å²	60.4	19%	0.19	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.6	173.8	56.6	0	0	0	0	109.5	V320 Q398 F399	V320-T415 HydrophobicContact CG1-CG2 3.98Å; Q398-T415 WeakPolarHBondContact CA-O 3.34Å; F399-T415 WeakPolarHBondContact CB-OG1 3.36Å; F399-T415 WeakPolarHBondContact CD2-OG1 3.44Å; F399-T415 PolarHBondContact N-O 2.94Å; F399-T415 PolarHBondContact O-N 2.83Å
416	Q	97.1	Very high	96	Very high	136 Å²	136	59.9 Å²	59.9	64%	0.636	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.8	-177	-172	177.5	33	0	0	111.7	V396 F397 Q398	V396-Q416 HydrophobicContact CG1-CG 3.49Å; V396-Q416 VanDerWaalsContact CG1-CG 3.49Å; F397-Q416 WeakPolarHBondContact O-CA 3.34Å; Q398-Q416 HydrophobicContact CG-CB 4.3Å; Q398-Q416 HydrophobicContact CG-CG 4.34Å
417	V	97.2	Very high	96	Very high	11 Å²	11	62.7 Å²	62.7	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.7	-174.9	-173.1	0	0	0	0	110.3	Y334 F397 F399	Y334-V417 HydrophobicContact CD2-CG1 3.15Å; Y334-V417 HydrophobicContact CE2-CG1 3.26Å; Y334-V417 HydrophobicContact CG-CG1 4.35Å; F397-V417 PolarHBondContact N-O 2.55Å; F397-V417 PolarHBondContact O-N 2.88Å; F397-V417 VanDerWaalsContact O-O 3.09Å; F399-V417 HydrophobicContact CD2-CG2 3.64Å; F399-V417 HydrophobicContact CE2-CB 4.44Å; F399-V417 HydrophobicContact CE2-CG2 3.52Å
418	S	97.2	Very high	96.1	Very high	48 Å²	48	70 Å²	70	34%	0.336	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130	174.1	68	0	0	0	0	111.2	A332 A333 Y334	A332-S418 PolarHBondContact O-OG 2.79Å; A333-S418 VanDerWaalsContact CB-OG 3.3Å; A333-S418 WeakPolarHBondContact CB-OG 3.2Å; Y334-S418 PolarHBondContact N-O 3.28Å
419	V	97.8	Very high	96	Very high	4 Å²	4	76 Å²	76	2%	0.024	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	110.2	173.2	-175.3	0	0	0	0	107.6	Y334 V336 F366 L390 Y394 G395 F397	Y334-V419 CarbonylContact O-C 3.51Å; Y334-V419 WeakPolarHBondContact O-CA 3.39Å; V336-V419 HydrophobicContact CG1-CG1 4.03Å; F366-V419 HydrophobicContact CE1-CG2 4.49Å; F366-V419 HydrophobicContact CZ-CG2 3.93Å; L390-V419 HydrophobicContact CD1-CG1 4.25Å; L390-V419 HydrophobicContact CD1-CG2 3.93Å; Y394-V419 WeakPolarHBondContact CB-O 3.36Å; G395-V419 PolarHBondContact N-O 2.81Å; G395-V419 PolarHBondContact O-N 2.81Å; F397-V419 HydrophobicContact CD2-CB 4.01Å; F397-V419 HydrophobicContact CD2-CG2 3.63Å; F397-V419 HydrophobicContact CE2-CB 4.16Å; F397-V419 HydrophobicContact CE2-CG2 4.16Å; F397-V419 HydrophobicContact CG-CG2 4.43Å
420	R	96.7	Very high	95.9	Very high	66 Å²	66	82.3 Å²	82.3	25%	0.249	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	151.6	179.3	62.4	168.8	-174.4	88.4	-6.3	111.2	A333 Y334 T335 V336	A333-R420 HydrophobicContact CB-CG 4.16Å; Y334-R420 VanDerWaalsContact O-CG 3.23Å; Y334-R420 WeakPolarHBondContact O-CG 3.47Å; Y334-R420 PolarHBondContact O-N 3.43Å; T335-R420 WeakPolarHBondContact CA-O 3.5Å; T335-R420 HydrophobicContact CG2-CG 4.06Å; V336-R420 PolarHBondContact N-O 2.93Å
421	P	97.2	Very high	95.9	Very high	65 Å²	65	82.7 Å²	82.7	42%	0.422	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-64.7	169.9	166.7	30.1	-35.4	0	0	0	111.4	Y394	Y394-P421 HydrophobicContact CD1-CB 4.38Å
422	L	96	Very high	95.9	Very high	61 Å²	61	86.4 Å²	86.4	32%	0.319	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-60.2	139.6	173.7	-63.4	174.2	0	0	0	110.7	T335 V336 Q426 Y427	T335-L422 HydrophobicContact CG2-CD2 4.38Å; V336-L422 HydrophobicContact CG2-CD2 4.4Å; V336-L422 HydrophobicContact CG2-CG 4.05Å; L422-Q426 HydrophobicContact CB-CB 4.38Å; L422-Q426 HydrophobicContact CD2-CB 4.24Å; L422-Y427 HydrophobicContact CD1-CD1 4.49Å; L422-Y427 HydrophobicContact CD1-CE1 4.39Å
423	Q	94.9	Very high	96	Very high	96 Å²	96	85.4 Å²	85.4	45%	0.449	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-75.1	158.4	168.9	-79.4	166.2	0.9	0	0	110.4	T425 Q426 Y427	Q423-T425 PolarHBondContact O-N 3.24Å; Q423-Q426 HydrophobicContact CB-CG 4.13Å; Q423-Q426 PolarHBondContact O-N 2.79Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.25Å
424	H	95.6	Very high	95.9	Very high	163 Å²	163	85.1 Å²	85.1	76%	0.755	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-23.3	179.3	71.2	83.9	0	0	0	113.8
425	T	95.8	Very high	95.9	Very high	91 Å²	91	88.8 Å²	88.8	56%	0.558	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-15.9	176.7	53.4	0	0	0	0	114	Q423	Q423-T425 PolarHBondContact O-N 3.24Å
426	Q	93.5	Very high	95.9	Very high	78 Å²	78	91.5 Å²	91.5	36%	0.364	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-6.6	-172.7	-62.7	179.7	-56.7	0	0	113.2	L422 Q423	L422-Q426 HydrophobicContact CB-CB 4.38Å; L422-Q426 HydrophobicContact CD2-CB 4.24Å; Q423-Q426 HydrophobicContact CB-CG 4.13Å; Q423-Q426 PolarHBondContact O-N 2.79Å
427	Y	94.4	Very high	95.9	Very high	139 Å²	139	93.4 Å²	93.4	55%	0.545	46%	0.461	S	S	.	.	S	Bend	trans	-66	147.5	173.1	-71.1	-78	0	0	0	111.2	L422 Q423 R429	L422-Y427 HydrophobicContact CD1-CD1 4.49Å; L422-Y427 HydrophobicContact CD1-CE1 4.39Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.25Å; Y427-R429 PolarHBondContact O-N 3.15Å
428	E	94.6	Very high	95.9	Very high	153 Å²	153	96.6 Å²	96.6	72%	0.715	47%	0.472	S	S	*	.			trans	-59.5	132.6	173.4	-169.1	-177.1	170.3	0	0	110.3	I431	E428-I431 HydrophobicContact CB-CG2 4.29Å; E428-I431 HydrophobicContact CG-CG2 3.86Å
429	R	93.3	Very high	95.9	Very high	184 Å²	184	97.3 Å²	97.3	69%	0.694	48%	0.481	S	S	*	.			trans	-119.5	153.5	179.6	-64.9	177.7	68.6	-175.1	1.6	109.3	Y427	Y427-R429 PolarHBondContact O-N 3.15Å
430	F	93.9	Very high	95.9	Very high	148 Å²	148	100.2 Å²	100.2	65%	0.649	50%	0.502	S	S	*	.	S	Bend	trans	62.8	46.1	-178.7	-50.5	-76	0	0	0	112.8
431	I	96.4	Very high	95.9	Very high	63 Å²	63	99.5 Å²	99.5	32%	0.323	51%	0.51	S	S	.	.			trans	-66	132.1	179.4	60.1	-178.4	0	0	0	110.5	E428 S433 A434	E428-I431 HydrophobicContact CB-CG2 4.29Å; E428-I431 HydrophobicContact CG-CG2 3.86Å; I431-S433 PolarHBondContact O-N 3.37Å; I431-A434 HydrophobicContact CD1-CB 3.86Å; I431-A434 HydrophobicContact CG1-CB 3.41Å; I431-A434 VanDerWaalsContact CG1-CB 3.41Å; I431-A434 PolarHBondContact O-N 2.96Å
432	P	95.9	Very high	95.9	Very high	88 Å²	88	103.1 Å²	103.1	57%	0.571	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-58.4	-33.9	-177.8	-27.8	34.8	0	0	0	113.8	A434 F435	P432-A434 PolarHBondContact O-N 2.75Å; P432-F435 HydrophobicContact CB-CD2 4.15Å; P432-F435 HydrophobicContact CB-CE2 3.85Å; P432-F435 HydrophobicContact CG-CE2 4.44Å; P432-F435 WeakPolarHBondContact O-CD2 3.22Å; P432-F435 PolarHBondContact O-N 2.87Å
433	S	96.9	Very high	96	Very high	107 Å²	107	104 Å²	104	75%	0.748	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-63.9	-19.6	177.1	-170.9	0	0	0	0	113.4	I431	I431-S433 PolarHBondContact O-N 3.37Å
434	A	96.3	Very high	96.1	Very high	12 Å²	12	106.1 Å²	106.1	10%	0.099	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-100.7	5.6	-179	0	0	0	0	0	114.1	I431 P432 P436 Y437 Y438	I431-A434 HydrophobicContact CD1-CB 3.86Å; I431-A434 HydrophobicContact CG1-CB 3.41Å; I431-A434 VanDerWaalsContact CG1-CB 3.41Å; I431-A434 PolarHBondContact O-N 2.96Å; P432-A434 PolarHBondContact O-N 2.75Å; A434-P436 VanDerWaalsContact C-N 3.29Å; A434-Y437 HydrophobicContact CB-CD2 3.97Å; A434-Y437 PolarHBondContact O-N 2.86Å; A434-Y438 HydrophobicContact CB-CD2 4.48Å; A434-Y438 HydrophobicContact CB-CE1 4.09Å; A434-Y438 HydrophobicContact CB-CE2 3.8Å; A434-Y438 WeakPolarHBondContact O-CD2 3.39Å; A434-Y438 PolarHBondContact O-N 2.58Å; A434-Y438 VanDerWaalsContact O-N 3.14Å
435	F	96.4	Very high	96.2	Very high	120 Å²	120	104.2 Å²	104.2	53%	0.526	54%	0.535	S	S	.	.	H	α-helix	trans	-51.8	-38.9	175.8	-79	-48.5	0	0	0	114.6	P432 Y437 Y438 A439	P432-F435 HydrophobicContact CB-CD2 4.15Å; P432-F435 HydrophobicContact CB-CE2 3.85Å; P432-F435 HydrophobicContact CG-CE2 4.44Å; P432-F435 WeakPolarHBondContact O-CD2 3.22Å; P432-F435 PolarHBondContact O-N 2.87Å; F435-Y437 VanDerWaalsContact C-N 3.29Å; F435-Y437 PolarHBondContact O-N 3.16Å; F435-Y438 AromaticContact CD1-CD2 3.99Å; F435-Y438 HydrophobicContact CD1-CD2 3.99Å; F435-Y438 PolarHBondContact O-N 3.25Å; F435-A439 WeakPolarHBondContact O-CB 3.41Å; F435-A439 PolarHBondContact O-N 3.35Å
436	P	97.6	Very high	96.2	Very high	89 Å²	89	103.8 Å²	103.8	58%	0.578	53%	0.533	S	S	*	.	H	α-helix	trans	-58.8	-38.8	175.8	-26.6	36.2	0	0	0	113.3	A434 S440	A434-P436 VanDerWaalsContact C-N 3.29Å; P436-S440 VanDerWaalsContact O-CB 3.3Å; P436-S440 WeakPolarHBondContact O-CB 3.28Å; P436-S440 PolarHBondContact O-N 3.21Å
437	Y	97	Very high	96.4	Very high	175 Å²	175	101.9 Å²	101.9	69%	0.686	53%	0.534	S	S	*	.	H	α-helix	trans	-71.5	-41.7	179	-54.4	-69.5	0	0	0	111.6	A434 F435 S440 A441	A434-Y437 HydrophobicContact CB-CD2 3.97Å; A434-Y437 PolarHBondContact O-N 2.86Å; F435-Y437 VanDerWaalsContact C-N 3.29Å; F435-Y437 PolarHBondContact O-N 3.16Å; Y437-S440 PolarHBondContact O-N 3.19Å; Y437-A441 PolarHBondContact O-N 3.03Å; Y437-A441 VanDerWaalsContact O-N 3.13Å
438	Y	96.8	Very high	96.5	Very high	78 Å²	78	101 Å²	101	31%	0.306	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-47.1	175.9	-55.1	-31.3	0	0	0	110.9	A434 F435 S440 A441 F442	A434-Y438 HydrophobicContact CB-CD2 4.48Å; A434-Y438 HydrophobicContact CB-CE1 4.09Å; A434-Y438 HydrophobicContact CB-CE2 3.8Å; A434-Y438 WeakPolarHBondContact O-CD2 3.39Å; A434-Y438 PolarHBondContact O-N 2.58Å; A434-Y438 VanDerWaalsContact O-N 3.14Å; F435-Y438 AromaticContact CD1-CD2 3.99Å; F435-Y438 HydrophobicContact CD1-CD2 3.99Å; F435-Y438 PolarHBondContact O-N 3.25Å; Y438-S440 PolarHBondContact O-N 3.34Å; Y438-A441 PolarHBondContact O-N 2.62Å; Y438-F442 WeakPolarHBondContact O-CD2 3.46Å; Y438-F442 PolarHBondContact O-N 2.8Å
439	A	96.9	Very high	96.6	Very high	63 Å²	63	100.8 Å²	100.8	52%	0.521	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-40.9	177.6	0	0	0	0	0	112.5	F435 A441 F442 S443	F435-A439 WeakPolarHBondContact O-CB 3.41Å; F435-A439 PolarHBondContact O-N 3.35Å; A439-A441 PolarHBondContact O-N 3.48Å; A439-F442 PolarHBondContact O-N 3.07Å; A439-S443 VanDerWaalsContact O-CB 3.23Å; A439-S443 WeakPolarHBondContact O-CB 3.38Å; A439-S443 PolarHBondContact O-N 3.08Å
440	S	97.5	Very high	96.7	Very high	66 Å²	66	96.7 Å²	96.7	46%	0.462	53%	0.526	S	S	.	.	H	α-helix	trans	-58.6	-47.5	177.2	-177.7	0	0	0	0	112.1	P436 Y437 Y438 F442 S443 M444	P436-S440 VanDerWaalsContact O-CB 3.3Å; P436-S440 WeakPolarHBondContact O-CB 3.28Å; P436-S440 PolarHBondContact O-N 3.21Å; Y437-S440 PolarHBondContact O-N 3.19Å; Y438-S440 PolarHBondContact O-N 3.34Å; S440-F442 PolarHBondContact O-N 2.85Å; S440-S443 WeakPolarHBondContact O-CB 3.4Å; S440-S443 PolarHBondContact O-N 2.94Å; S440-M444 WeakPolarHBondContact O-CG 3.33Å; S440-M444 PolarHBondContact O-N 3.09Å
441	A	96.9	Very high	96.8	Very high	51 Å²	51	95.4 Å²	95.4	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-60.4	-47.7	179.1	0	0	0	0	0	112.2	Y437 Y438 A439 S443 M444 M445	Y437-A441 PolarHBondContact O-N 3.03Å; Y437-A441 VanDerWaalsContact O-N 3.13Å; Y438-A441 PolarHBondContact O-N 2.62Å; A439-A441 PolarHBondContact O-N 3.48Å; A441-S443 VanDerWaalsContact C-N 3.34Å; A441-S443 PolarHBondContact O-N 2.66Å; A441-M444 PolarHBondContact O-N 3Å; A441-M445 WeakPolarHBondContact O-CG 3.36Å; A441-M445 PolarHBondContact O-N 2.78Å
442	F	97.2	Very high	96.8	Very high	140 Å²	140	95 Å²	95	61%	0.614	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-33.8	177.3	-74.7	-66.8	0	0	0	112.9	Y438 A439 S440 M445 T446	Y438-F442 WeakPolarHBondContact O-CD2 3.46Å; Y438-F442 PolarHBondContact O-N 2.8Å; A439-F442 PolarHBondContact O-N 3.07Å; S440-F442 PolarHBondContact O-N 2.85Å; F442-M445 HydrophobicContact CD1-SD 4.19Å; F442-M445 PolarHBondContact O-N 3.15Å; F442-T446 WeakPolarHBondContact O-CB 3.38Å; F442-T446 PolarHBondContact O-N 2.98Å; F442-T446 PolarHBondContact O-OG1 2.93Å
443	S	97.8	Very high	96.8	Very high	81 Å²	81	94.1 Å²	94.1	57%	0.566	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-46.1	173.5	-178.2	0	0	0	0	111.3	A439 S440 A441 M445 T446 G447	A439-S443 VanDerWaalsContact O-CB 3.23Å; A439-S443 WeakPolarHBondContact O-CB 3.38Å; A439-S443 PolarHBondContact O-N 3.08Å; S440-S443 WeakPolarHBondContact O-CB 3.4Å; S440-S443 PolarHBondContact O-N 2.94Å; A441-S443 VanDerWaalsContact C-N 3.34Å; A441-S443 PolarHBondContact O-N 2.66Å; S443-M445 PolarHBondContact O-N 2.96Å; S443-T446 PolarHBondContact O-N 2.81Å; S443-G447 PolarHBondContact O-N 2.82Å
444	M	97.2	Very high	96.6	Very high	139 Å²	139	92.7 Å²	92.7	69%	0.685	50%	0.502	S	S	*	.	H	α-helix	trans	-62	-42	176	-70.9	-178.2	67.4	0	0	112.5	S440 A441 G447 L448	S440-M444 WeakPolarHBondContact O-CG 3.33Å; S440-M444 PolarHBondContact O-N 3.09Å; A441-M444 PolarHBondContact O-N 3Å; M444-G447 PolarHBondContact O-N 2.8Å; M444-L448 WeakPolarHBondContact O-CB 3.38Å; M444-L448 PolarHBondContact O-N 3.2Å
445	M	97.3	Very high	96.5	Very high	123 Å²	123	98.9 Å²	98.9	61%	0.606	53%	0.527	S	S	*	.	H	α-helix	trans	-61.5	-44.3	175.9	-68.6	172.2	71.4	0	0	111.6	A441 F442 S443 L448 F449	A441-M445 WeakPolarHBondContact O-CG 3.36Å; A441-M445 PolarHBondContact O-N 2.78Å; F442-M445 HydrophobicContact CD1-SD 4.19Å; F442-M445 PolarHBondContact O-N 3.15Å; S443-M445 PolarHBondContact O-N 2.96Å; M445-L448 PolarHBondContact O-N 2.57Å; M445-F449 PolarHBondContact O-N 3.1Å
446	T	97.2	Very high	96.4	Very high	83 Å²	83	99.1 Å²	99.1	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-42.8	177.4	-53.8	0	0	0	0	111.1	F442 S443 F449 I450	F442-T446 WeakPolarHBondContact O-CB 3.38Å; F442-T446 PolarHBondContact O-N 2.98Å; F442-T446 PolarHBondContact O-OG1 2.93Å; S443-T446 PolarHBondContact O-N 2.81Å; T446-F449 PolarHBondContact O-N 3.18Å; T446-I450 HydrophobicContact CG2-CD1 4.08Å; T446-I450 WeakPolarHBondContact O-CG1 3.36Å; T446-I450 PolarHBondContact O-N 3.44Å
447	G	96.9	Very high	96.1	Very high	37 Å²	37	102.1 Å²	102.1	38%	0.381	54%	0.539	S	S	.	.	H	α-helix	trans	-61.4	-43.8	176.3	0	0	0	0	0	112.4	S443 M444 F449 I450 F451	S443-G447 PolarHBondContact O-N 2.82Å; M444-G447 PolarHBondContact O-N 2.8Å; G447-F449 VanDerWaalsContact C-N 3.34Å; G447-F449 PolarHBondContact O-N 3.15Å; G447-I450 PolarHBondContact O-N 3.14Å; G447-F451 WeakPolarHBondContact O-CB 3.35Å; G447-F451 PolarHBondContact O-N 3.03Å
448	L	97.4	Very high	95.6	Very high	120 Å²	120	100.1 Å²	100.1	63%	0.628	54%	0.538	S	S	*	.	H	α-helix	trans	-62.4	-41.3	175.6	-179.4	65.1	0	0	0	111.7	M444 M445 F451 S452	M444-L448 WeakPolarHBondContact O-CB 3.38Å; M444-L448 PolarHBondContact O-N 3.2Å; M445-L448 PolarHBondContact O-N 2.57Å; L448-F451 PolarHBondContact O-N 3.08Å; L448-S452 WeakPolarHBondContact O-CB 3.01Å; L448-S452 PolarHBondContact O-N 3.32Å
449	F	96.3	Very high	95	Very high	150 Å²	150	106.6 Å²	106.6	66%	0.658	56%	0.562	S	S	*	*	H	α-helix	trans	-62.8	-49.2	177.1	-178.7	-101.8	0	0	0	111.7	M445 T446 G447 F451 S452 V453	M445-F449 PolarHBondContact O-N 3.1Å; T446-F449 PolarHBondContact O-N 3.18Å; G447-F449 VanDerWaalsContact C-N 3.34Å; G447-F449 PolarHBondContact O-N 3.15Å; F449-F451 PolarHBondContact O-N 2.83Å; F449-S452 PolarHBondContact O-N 3.41Å; F449-V453 HydrophobicContact CE1-CG2 4.42Å; F449-V453 HydrophobicContact CZ-CG2 4.4Å; F449-V453 WeakPolarHBondContact O-CG2 3.38Å; F449-V453 PolarHBondContact O-N 3.14Å; F449-V453 VanDerWaalsContact O-N 3.11Å
450	I	96.1	Very high	94.2	Very high	98 Å²	98	111.9 Å²	111.9	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-62	-45.6	176.7	-66	170.5	0	0	0	110.5	T446 G447 S452 V453 V454	T446-I450 HydrophobicContact CG2-CD1 4.08Å; T446-I450 WeakPolarHBondContact O-CG1 3.36Å; T446-I450 PolarHBondContact O-N 3.44Å; G447-I450 PolarHBondContact O-N 3.14Å; I450-S452 VanDerWaalsContact C-N 3.33Å; I450-S452 PolarHBondContact O-N 2.94Å; I450-V453 PolarHBondContact O-N 2.77Å; I450-V454 HydrophobicContact CG2-CG2 4.17Å; I450-V454 WeakPolarHBondContact O-CG2 3.34Å; I450-V454 PolarHBondContact O-N 2.87Å
451	F	95.9	Very high	93.2	Very high	121 Å²	121	118.4 Å²	118.4	53%	0.531	60%	0.596	S	S	.	*	H	α-helix	trans	-57.3	-46.2	177.1	174.1	-101.1	0	0	0	111.3	G447 L448 F449 V453 V454 F455	G447-F451 WeakPolarHBondContact O-CB 3.35Å; G447-F451 PolarHBondContact O-N 3.03Å; L448-F451 PolarHBondContact O-N 3.08Å; F449-F451 PolarHBondContact O-N 2.83Å; F451-V453 PolarHBondContact O-N 3.43Å; F451-V454 PolarHBondContact O-N 3.37Å; F451-F455 HydrophobicContact CE1-CB 4.33Å; F451-F455 HydrophobicContact CE1-CG 4.35Å; F451-F455 HydrophobicContact CE2-CB 4.29Å; F451-F455 HydrophobicContact CE2-CD2 4.1Å; F451-F455 HydrophobicContact CE2-CG 4.45Å; F451-F455 HydrophobicContact CZ-CB 4.15Å; F451-F455 AromaticContact CZ-CD2 3.79Å; F451-F455 HydrophobicContact CZ-CD2 3.79Å; F451-F455 HydrophobicContact CZ-CE2 4.4Å; F451-F455 AromaticContact CZ-CG 4Å; F451-F455 HydrophobicContact CZ-CG 4Å; F451-F455 WeakPolarHBondContact O-CB 3.47Å; F451-F455 PolarHBondContact O-N 2.81Å
452	S	96.2	Very high	91.7	Very high	55 Å²	55	124 Å²	124	39%	0.385	61%	0.613	S	S	.	*	H	α-helix	trans	-60.5	-43	178.2	-179.4	0	0	0	0	112.2	L448 F449 I450 L456	L448-S452 WeakPolarHBondContact O-CB 3.01Å; L448-S452 PolarHBondContact O-N 3.32Å; F449-S452 PolarHBondContact O-N 3.41Å; I450-S452 VanDerWaalsContact C-N 3.33Å; I450-S452 PolarHBondContact O-N 2.94Å; S452-L456 WeakPolarHBondContact O-CB 3.39Å; S452-L456 VanDerWaalsContact O-CG 3.27Å; S452-L456 WeakPolarHBondContact O-CG 3.22Å; S452-L456 PolarHBondContact O-N 3.21Å; S452-L456 VanDerWaalsContact O-N 3.12Å
453	V	94.8	Very high	89.7	Confident	69 Å²	69	126.6 Å²	126.6	42%	0.418	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-49.3	177.8	173.3	0	0	0	0	111.2	F449 I450 F451 H457	F449-V453 HydrophobicContact CE1-CG2 4.42Å; F449-V453 HydrophobicContact CZ-CG2 4.4Å; F449-V453 WeakPolarHBondContact O-CG2 3.38Å; F449-V453 PolarHBondContact O-N 3.14Å; F449-V453 VanDerWaalsContact O-N 3.11Å; I450-V453 PolarHBondContact O-N 2.77Å; F451-V453 PolarHBondContact O-N 3.43Å; V453-H457 PolarHBondContact O-N 3.15Å; V453-H457 VanDerWaalsContact O-N 3.15Å; V453-H457 PolarHBondContact O-ND1 2.93Å
454	V	94.1	Very high	87.9	Confident	77 Å²	77	128.3 Å²	128.3	47%	0.467	64%	0.636	S	S	.	*	H	α-helix	trans	-67.3	-45.6	-177.8	174.6	0	0	0	0	110.8	I450 F451 L456 H457 M458	I450-V454 HydrophobicContact CG2-CG2 4.17Å; I450-V454 WeakPolarHBondContact O-CG2 3.34Å; I450-V454 PolarHBondContact O-N 2.87Å; F451-V454 PolarHBondContact O-N 3.37Å; V454-L456 PolarHBondContact O-N 3.35Å; V454-H457 CarbonylContact O-C 3.4Å; V454-H457 PolarHBondContact O-N 3.16Å; V454-M458 HydrophobicContact CG1-SD 3.88Å; V454-M458 WeakPolarHBondContact O-CA 3.35Å; V454-M458 VanDerWaalsContact O-CB 3.28Å; V454-M458 WeakPolarHBondContact O-CB 3.47Å; V454-M458 PolarHBondContact O-N 2.59Å
455	F	93.8	Very high	85.7	Confident	141 Å²	141	132.5 Å²	132.5	62%	0.618	66%	0.661	S	S	*	*	H	α-helix	trans	-62.9	-41.4	-178.4	-174.1	-98.1	0	0	0	112.1	F451	F451-F455 HydrophobicContact CE1-CB 4.33Å; F451-F455 HydrophobicContact CE1-CG 4.35Å; F451-F455 HydrophobicContact CE2-CB 4.29Å; F451-F455 HydrophobicContact CE2-CD2 4.1Å; F451-F455 HydrophobicContact CE2-CG 4.45Å; F451-F455 HydrophobicContact CZ-CB 4.15Å; F451-F455 AromaticContact CZ-CD2 3.79Å; F451-F455 HydrophobicContact CZ-CD2 3.79Å; F451-F455 HydrophobicContact CZ-CE2 4.4Å; F451-F455 AromaticContact CZ-CG 4Å; F451-F455 HydrophobicContact CZ-CG 4Å; F451-F455 WeakPolarHBondContact O-CB 3.47Å; F451-F455 PolarHBondContact O-N 2.81Å
456	L	93	Very high	85.1	Confident	125 Å²	125	133 Å²	133	65%	0.654	66%	0.664	S	S	*	*	H	α-helix	trans	-72.7	-32.6	178.4	-71.5	172.8	0	0	0	113.4	S452 V454	S452-L456 WeakPolarHBondContact O-CB 3.39Å; S452-L456 VanDerWaalsContact O-CG 3.27Å; S452-L456 WeakPolarHBondContact O-CG 3.22Å; S452-L456 PolarHBondContact O-N 3.21Å; S452-L456 VanDerWaalsContact O-N 3.12Å; V454-L456 PolarHBondContact O-N 3.35Å
457	H	91.1	Very high	84.5	Confident	152 Å²	152	135.6 Å²	135.6	70%	0.704	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	19.9	-177.3	-56.7	83.4	0	0	0	112.7	V453 V454 R459	V453-H457 PolarHBondContact O-N 3.15Å; V453-H457 VanDerWaalsContact O-N 3.15Å; V453-H457 PolarHBondContact O-ND1 2.93Å; V454-H457 CarbonylContact O-C 3.4Å; V454-H457 PolarHBondContact O-N 3.16Å; H457-R459 PolarHBondContact O-N 3.07Å
458	M	87.7	Confident	83.8	Confident	134 Å²	134	141.1 Å²	141.1	66%	0.66	69%	0.688	S	S	*	*			trans	-73.4	115.4	179.3	-162.8	78.2	176.1	0	0	109.2	V454 E460	V454-M458 HydrophobicContact CG1-SD 3.88Å; V454-M458 WeakPolarHBondContact O-CA 3.35Å; V454-M458 VanDerWaalsContact O-CB 3.28Å; V454-M458 WeakPolarHBondContact O-CB 3.47Å; V454-M458 PolarHBondContact O-N 2.59Å; M458-E460 PolarHBondContact O-N 2.96Å
459	R	83.1	Confident	83	Confident	213 Å²	213	142.3 Å²	142.3	80%	0.804	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-79.5	118.4	168.5	-174.5	176.7	176.8	178.9	-0.9	108.5	H457	H457-R459 PolarHBondContact O-N 3.07Å
460	E	81.6	Confident	82.1	Confident	175 Å²	175	141.8 Å²	141.8	82%	0.818	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-60.7	140.7	173.1	-70.2	-164.6	168.5	0	0	110.6	M458 E462	M458-E460 PolarHBondContact O-N 2.96Å; E460-E462 PolarHBondContact O-N 3.31Å
461	K	74.8	Confident	81.2	Confident	203 Å²	203	144.7 Å²	144.7	88%	0.883	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-77.7	116.4	175.1	-159.8	176.6	-175.7	-178.9	0	107.3	K463	K461-K463 PolarHBondContact O-N 3.14Å
462	E	67.2	Low	80.2	Confident	167 Å²	167	146.4 Å²	146.4	78%	0.78	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-53.5	126.1	172.5	-77.6	174	179.5	0	0	108.8	E460 S464	E460-E462 PolarHBondContact O-N 3.31Å; E462-S464 PolarHBondContact O-N 3.26Å; E462-S464 VanDerWaalsContact O-N 3.08Å
463	K	55.3	Low	78.9	Confident	195 Å²	195	153.5 Å²	153.5	85%	0.848	75%	0.745	S	S	*	*			trans	-61.7	112.5	171.6	-85.1	-178.3	175.8	177.5	0	107.4	K461 D465	K461-K463 PolarHBondContact O-N 3.14Å; K463-D465 PolarHBondContact O-N 3.33Å
464	S	59.7	Low	77.6	Confident	118 Å²	118	160.5 Å²	160.5	83%	0.825	77%	0.772	S	S	*	*			trans	-72.8	106.8	161.5	51.4	0	0	0	0	107.3	E462	E462-S464 PolarHBondContact O-N 3.26Å; E462-S464 VanDerWaalsContact O-N 3.08Å
465	D	50	Low	76.1	Confident	226 Å²	226	168.1 Å²	168.1	100%	1.209	80%	0.8	S	S	*	*			trans	-58.5	0	170.2	-79.3	-25.8	0	0	0	112.6	K463	K463-D465 PolarHBondContact O-N 3.33Å

Retrieved 465 of 465 residues in 149.4 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).