A0A060X1T7_ONCMY Loading...

E3 ubiquitin-protein ligase

E3 ubiquitin-protein ligase that mediates ubiquitination and subsequent proteasomal degradation of target proteins. E3 ubiquitin ligases accept ubiquitin from an E2 ubiquitin-conjugating enzyme in the form of a thioester and then directly transfers the ubiquitin to targeted substrates.

AlphaFold DB , UniProt , Accession A0A060X1T7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 282 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	40	Very low	37.2	Very low	232 Å²	232	153.6 Å²	153.6	100%	1.143	88%	0.88	S	S	*	*				0	92.8	0	-66.4	-168.1	169.8	0	0	106.6
2	S	34	Very low	37	Very low	114 Å²	114	147.3 Å²	147.3	80%	0.797	87%	0.872	S	S	*	*				73.5	118.8	90.8	-59.9	0	0	0	0	109.8
3	R	33.6	Very low	37.1	Very low	238 Å²	238	145.4 Å²	145.4	90%	0.898	86%	0.863	S	S	*	*			cis	-160.2	147.3	18.7	-99.9	167.4	176.6	-164	-1.3	109.5
4	Q	36.4	Very low	37.4	Very low	189 Å²	189	143.3 Å²	143.3	88%	0.883	86%	0.86	S	S	*	*			trans	-68.8	147.9	160.4	-69.2	163.3	-22.5	0	0	110.6
5	T	37.7	Very low	37.6	Very low	141 Å²	141	146.5 Å²	146.5	87%	0.865	86%	0.858	S	S	*	*			trans	-143.5	119.9	146.3	33.9	0	0	0	0	109.2
6	A	37.1	Very low	37.4	Very low	103 Å²	103	145.1 Å²	145.1	85%	0.851	86%	0.857	S	S	*	*			trans	-80.8	146.8	172.1	0	0	0	0	0	110.4
7	T	38.2	Very low	37.7	Very low	145 Å²	145	141.9 Å²	141.9	89%	0.89	85%	0.85	S	S	*	*			trans	-135.2	129.4	167.5	-7.8	0	0	0	0	109.2
8	A	37.6	Very low	37.9	Very low	99 Å²	99	140.6 Å²	140.6	82%	0.818	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-76.3	152.5	-164.2	0	0	0	0	0	114.5
9	L	36.2	Very low	38.3	Very low	163 Å²	163	139.5 Å²	139.5	85%	0.853	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-70.6	141.9	165.2	-80.3	98.2	0	0	0	111
10	P	39.9	Very low	38.7	Very low	123 Å²	123	141.8 Å²	141.8	80%	0.799	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-86.5	121.2	160.7	29.1	-22.8	0	0	0	110.9	G12	P10-G12 PolarHBondContact O-N 3.37Å
11	T	38.7	Very low	38.9	Very low	143 Å²	143	146.5 Å²	146.5	88%	0.877	85%	0.849	S	S	*	*			trans	-72.6	106.6	163.8	42.3	0	0	0	0	109.8
12	G	34.1	Very low	39.2	Very low	77 Å²	77	141.5 Å²	141.5	79%	0.794	83%	0.832	S	S	*	*			trans	-105	109	173.1	0	0	0	0	0	111.1	P10 S14	P10-G12 PolarHBondContact O-N 3.37Å; G12-S14 PolarHBondContact O-N 2.98Å
13	T	38.5	Very low	39.8	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	83%	0.828	S	S	*	*			trans	-62.2	124.3	178.1	48.5	0	0	0	0	112.4	K15	T13-K15 PolarHBondContact O-N 2.9Å
14	S	41.8	Very low	40.2	Very low	116 Å²	116	136.7 Å²	136.7	81%	0.811	83%	0.826	S	S	*	*			trans	-68.8	112.6	167.9	-175.4	0	0	0	0	109.9	G12	G12-S14 PolarHBondContact O-N 2.98Å
15	K	40.3	Very low	41	Very low	191 Å²	191	135.6 Å²	135.6	83%	0.83	83%	0.825	S	S	*	*			trans	-109	102.6	165.9	-75.5	-174.7	178.1	-179.4	0	107.8	T13 A17	T13-K15 PolarHBondContact O-N 2.9Å; K15-A17 PolarHBondContact O-N 3.09Å
16	C	35	Very low	41.5	Very low	125 Å²	125	133.7 Å²	133.7	85%	0.845	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-60.3	118.7	165.6	-84.3	0	0	0	0	109.4
17	A	42.7	Very low	42.3	Very low	90 Å²	90	132.6 Å²	132.6	74%	0.744	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-79.6	149.5	167.5	0	0	0	0	0	110.2	K15	K15-A17 PolarHBondContact O-N 3.09Å
18	P	40.8	Very low	43.1	Very low	118 Å²	118	132.1 Å²	132.1	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-72.6	144.3	-172.9	29.6	-33.4	0	0	0	112.1	Q20	P18-Q20 PolarHBondContact O-N 3.27Å; P18-Q20 VanDerWaalsContact O-N 3.15Å
19	S	45.5	Very low	44.4	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	81%	0.814	S	S	*	*			trans	-50.6	111.4	176.5	-174.3	0	0	0	0	111.5
20	Q	45.2	Very low	46.1	Very low	184 Å²	184	128.7 Å²	128.7	86%	0.86	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.6	123.8	168.2	-72.1	-172.7	-17.1	0	0	108.7	P18 V22	P18-Q20 PolarHBondContact O-N 3.27Å; P18-Q20 VanDerWaalsContact O-N 3.15Å; Q20-V22 PolarHBondContact O-N 3.45Å
21	R	43.4	Very low	48.3	Very low	241 Å²	241	125.3 Å²	125.3	91%	0.909	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-59.2	121.4	171.9	-77.3	-177.6	-175.8	-158.9	0.1	109.1
22	V	47.5	Very low	50.8	Low	128 Å²	128	121.1 Å²	121.1	78%	0.776	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58.2	126.9	166.6	-176.5	0	0	0	0	107.7	Q20 T24	Q20-V22 PolarHBondContact O-N 3.45Å; V22-T24 PolarHBondContact O-N 3.03Å
23	P	45.7	Very low	53.4	Low	112 Å²	112	121.6 Å²	121.6	73%	0.727	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.8	119.4	171.5	-6.4	20.6	0	0	0	107.7	L25	P23-L25 PolarHBondContact O-N 2.9Å
24	T	42.9	Very low	55.8	Low	138 Å²	138	120 Å²	120	85%	0.847	73%	0.725	S	S	*	*			trans	-61.3	102	165.8	33.5	0	0	0	0	108.2	V22 S26	V22-T24 PolarHBondContact O-N 3.03Å; T24-S26 PolarHBondContact O-N 3.33Å
25	L	51.4	Low	58.3	Low	166 Å²	166	117.1 Å²	117.1	87%	0.869	70%	0.7	S	S	*	*			trans	-59.7	105.9	165.9	-81.2	153.6	0	0	0	107.3	P23 G27	P23-L25 PolarHBondContact O-N 2.9Å; L25-G27 PolarHBondContact O-N 3.4Å
26	S	49.1	Very low	60.8	Low	102 Å²	102	108.1 Å²	108.1	71%	0.713	66%	0.662	S	S	*	*			trans	-50.9	119	165.5	34.2	0	0	0	0	108.3	T24 T28	T24-S26 PolarHBondContact O-N 3.33Å; S26-T28 PolarHBondContact O-N 2.88Å; S26-T28 PolarHBondContact O-OG1 2.8Å
27	G	53.7	Low	63.6	Low	80 Å²	80	104.8 Å²	104.8	83%	0.825	64%	0.64	S	S	*	*			trans	-63.2	92	-171.2	0	0	0	0	0	112.7	L25 T29	L25-G27 PolarHBondContact O-N 3.4Å; G27-T29 PolarHBondContact O-N 3.08Å
28	T	56	Low	66.1	Low	135 Å²	135	105.6 Å²	105.6	83%	0.828	63%	0.631	S	S	*	*			trans	-82	95.6	160.6	-11.1	0	0	0	0	106.8	S26 A30	S26-T28 PolarHBondContact O-N 2.88Å; S26-T28 PolarHBondContact O-OG1 2.8Å; T28-A30 PolarHBondContact O-N 2.92Å
29	T	63.5	Low	68.7	Low	133 Å²	133	100 Å²	100	82%	0.816	60%	0.595	S	S	*	*			trans	-65.8	113.5	164	49	0	0	0	0	106.9	G27 S31	G27-T29 PolarHBondContact O-N 3.08Å; T29-S31 PolarHBondContact O-N 2.84Å
30	A	72.3	Confident	71.1	Confident	57 Å²	57	98.1 Å²	98.1	47%	0.471	57%	0.572	S	S	.	*			trans	-52.9	131.3	173.4	0	0	0	0	0	108.9	T28 L35	T28-A30 PolarHBondContact O-N 2.92Å; A30-L35 HydrophobicContact CB-CD2 4.03Å; A30-L35 HydrophobicContact CB-CG 4.11Å
31	S	87.4	Confident	73.5	Confident	52 Å²	52	89.3 Å²	89.3	36%	0.364	53%	0.531	S	S	.	.			trans	-69.3	157.1	176.9	75.3	0	0	0	0	109.6	T29 S33 D34 L35	T29-S31 PolarHBondContact O-N 2.84Å; S31-S33 PolarHBondContact O-N 2.97Å; S31-D34 WeakPolarHBondContact CB-OD2 3.22Å; S31-D34 PolarHBondContact N-OD2 2.92Å; S31-D34 WeakPolarHBondContact O-CB 3.21Å; S31-D34 PolarHBondContact O-N 2.85Å; S31-D34 PolarHBondContact OG-N 3.02Å; S31-D34 PolarHBondContact OG-OD2 2.75Å; S31-L35 PolarHBondContact O-N 2.91Å
32	N	90.3	Very high	76	Confident	55 Å²	55	80.6 Å²	80.6	29%	0.294	51%	0.506	S	S	.	.	H	α-helix	trans	-58.1	-33.1	176.2	-179.2	68.3	0	0	0	112.1	L35 A36 L95	N32-L35 PolarHBondContact O-N 3.34Å; N32-A36 WeakPolarHBondContact O-CB 3.42Å; N32-A36 PolarHBondContact O-N 3.18Å; N32-L95 WeakPolarHBondContact ND2-CB 3.34Å; N32-L95 PolarHBondContact ND2-O 2.87Å; N32-L95 PolarHBondContact OD1-N 3.01Å
33	S	88	Confident	78.3	Confident	87 Å²	87	77.5 Å²	77.5	61%	0.608	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-43	174.1	-171.2	0	0	0	0	111.9	S31 L35 A36 S37	S31-S33 PolarHBondContact O-N 2.97Å; S33-L35 VanDerWaalsContact C-N 3.28Å; S33-L35 PolarHBondContact O-N 3.12Å; S33-A36 PolarHBondContact O-N 3.35Å; S33-S37 PolarHBondContact O-N 3.12Å; S33-S37 VanDerWaalsContact O-N 3.07Å
34	D	90.5	Very high	80.6	Confident	88 Å²	88	74.9 Å²	74.9	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-40.8	177.5	-58	-41.2	0	0	0	110.2	S31 S37	S31-D34 WeakPolarHBondContact CB-OD2 3.22Å; S31-D34 PolarHBondContact N-OD2 2.92Å; S31-D34 WeakPolarHBondContact O-CB 3.21Å; S31-D34 PolarHBondContact O-N 2.85Å; S31-D34 PolarHBondContact OG-N 3.02Å; S31-D34 PolarHBondContact OG-OD2 2.75Å; D34-S37 PolarHBondContact O-OG 3.03Å
35	L	92.9	Very high	82.9	Confident	56 Å²	56	75.6 Å²	75.6	29%	0.293	46%	0.463	S	S	.	.	H	α-helix	trans	-68.7	-42	177.3	-65.8	176.2	0	0	0	112.6	A30 S31 N32 S33 S37 L38 F39 V94	A30-L35 HydrophobicContact CB-CD2 4.03Å; A30-L35 HydrophobicContact CB-CG 4.11Å; S31-L35 PolarHBondContact O-N 2.91Å; N32-L35 PolarHBondContact O-N 3.34Å; S33-L35 VanDerWaalsContact C-N 3.28Å; S33-L35 PolarHBondContact O-N 3.12Å; L35-S37 VanDerWaalsContact C-N 3.32Å; L35-S37 PolarHBondContact O-N 2.88Å; L35-L38 HydrophobicContact CD2-CD1 4.25Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 2.84Å; L35-F39 VanDerWaalsContact O-CD2 3.23Å; L35-F39 WeakPolarHBondContact O-CD2 3.33Å; L35-F39 WeakPolarHBondContact O-CE2 3.33Å; L35-V94 HydrophobicContact CB-CG1 4.29Å; L35-V94 HydrophobicContact CB-CG2 3.76Å; L35-V94 HydrophobicContact CD1-CG2 4.23Å
36	A	93.6	Very high	84.9	Confident	3 Å²	3	70.2 Å²	70.2	3%	0.025	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-38.6	178.5	0	0	0	0	0	112.1	N32 S33 L38 F39 Y47 V94 F96	N32-A36 WeakPolarHBondContact O-CB 3.42Å; N32-A36 PolarHBondContact O-N 3.18Å; S33-A36 PolarHBondContact O-N 3.35Å; A36-L38 PolarHBondContact O-N 3.02Å; A36-F39 WeakPolarHBondContact O-CB 3.27Å; A36-F39 PolarHBondContact O-N 3.03Å; A36-Y47 HydrophobicContact CB-CE1 4.15Å; A36-Y47 WeakPolarHBondContact O-CD1 3.45Å; A36-Y47 WeakPolarHBondContact O-CE1 3.26Å; A36-V94 HydrophobicContact CB-CG1 3.93Å; A36-F96 HydrophobicContact CB-CD1 4.32Å
37	S	93.8	Very high	87.1	Confident	55 Å²	55	67.3 Å²	67.3	39%	0.385	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-25	179.2	69	0	0	0	0	113.7	S33 D34 L35 F39 E40	S33-S37 PolarHBondContact O-N 3.12Å; S33-S37 VanDerWaalsContact O-N 3.07Å; D34-S37 PolarHBondContact O-OG 3.03Å; L35-S37 VanDerWaalsContact C-N 3.32Å; L35-S37 PolarHBondContact O-N 2.88Å; S37-F39 PolarHBondContact O-N 2.81Å; S37-F39 VanDerWaalsContact O-N 3.15Å; S37-E40 PolarHBondContact O-N 3.3Å; S37-E40 VanDerWaalsContact O-N 3.13Å
38	L	94.4	Very high	89.1	Confident	107 Å²	107	63.6 Å²	63.6	56%	0.56	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.9	173.6	-58.5	176.3	0	0	0	113.3	L35 A36 M87	L35-L38 HydrophobicContact CD2-CD1 4.25Å; L35-L38 WeakPolarHBondContact O-CB 3.34Å; L35-L38 PolarHBondContact O-N 2.84Å; A36-L38 PolarHBondContact O-N 3.02Å; L38-M87 HydrophobicContact CB-CE 4.48Å
39	F	96.3	Very high	90.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	3.3	178.8	-63	-98	0	0	0	112.5	L35 A36 S37 C41 Y47 V48 I52 M87 V90 A91 V94 F96	L35-F39 VanDerWaalsContact O-CD2 3.23Å; L35-F39 WeakPolarHBondContact O-CD2 3.33Å; L35-F39 WeakPolarHBondContact O-CE2 3.33Å; A36-F39 WeakPolarHBondContact O-CB 3.27Å; A36-F39 PolarHBondContact O-N 3.03Å; S37-F39 PolarHBondContact O-N 2.81Å; S37-F39 VanDerWaalsContact O-N 3.15Å; F39-C41 PolarHBondContact O-N 2.99Å; F39-Y47 HydrophobicContact CB-CD1 4.29Å; F39-Y47 CarbonylContact O-C 3.58Å; F39-Y47 WeakPolarHBondContact O-CA 3.25Å; F39-V48 WeakPolarHBondContact CD1-O 3.3Å; F39-V48 WeakPolarHBondContact O-CB 3.34Å; F39-V48 VanDerWaalsContact O-CG2 3.31Å; F39-V48 WeakPolarHBondContact O-CG2 3.35Å; F39-V48 PolarHBondContact O-N 2.63Å; F39-I52 HydrophobicContact CD1-CD1 3.65Å; F39-I52 HydrophobicContact CE1-CD1 3.43Å; F39-I52 VanDerWaalsContact CE1-CD1 3.43Å; F39-M87 HydrophobicContact CD1-CE 4.07Å; F39-M87 HydrophobicContact CD2-CE 4.34Å; F39-M87 HydrophobicContact CE1-CB 4.27Å; F39-M87 HydrophobicContact CE1-CE 3.54Å; F39-M87 WeakPolarHBondContact CE1-O 3.28Å; F39-M87 HydrophobicContact CE2-CE 3.84Å; F39-M87 HydrophobicContact CG-CE 4.44Å; F39-M87 HydrophobicContact CZ-CE 3.41Å; F39-M87 VanDerWaalsContact CZ-CE 3.41Å; F39-V90 HydrophobicContact CE2-CG1 4.16Å; F39-V90 HydrophobicContact CZ-CB 4.09Å; F39-V90 HydrophobicContact CZ-CG1 3.85Å; F39-A91 HydrophobicContact CE1-CB 3.74Å; F39-A91 HydrophobicContact CZ-CB 4.03Å; F39-V94 HydrophobicContact CE2-CG2 4.23Å; F39-F96 HydrophobicContact CB-CE1 3.82Å; F39-F96 HydrophobicContact CD1-CE1 4.39Å; F39-F96 HydrophobicContact CD1-CZ 4.29Å; F39-F96 AromaticContact CD2-CE1 3.86Å; F39-F96 HydrophobicContact CD2-CE1 3.86Å; F39-F96 HydrophobicContact CD2-CZ 4.1Å; F39-F96 HydrophobicContact CE2-CZ 4.39Å; F39-F96 AromaticContact CG-CE1 3.77Å; F39-F96 HydrophobicContact CG-CE1 3.77Å; F39-F96 HydrophobicContact CG-CZ 4.06Å
40	E	95.5	Very high	92.4	Very high	81 Å²	81	55.1 Å²	55.1	38%	0.379	32%	0.316	S	S	.	.	B	Isolated β-bridge	trans	-68.8	132	-178.7	-74.2	175.7	-162.8	0	0	112.1	S37 Y47	S37-E40 PolarHBondContact O-N 3.3Å; S37-E40 VanDerWaalsContact O-N 3.13Å; E40-Y47 HydrophobicContact CG-CD1 3.97Å; E40-Y47 HydrophobicContact CG-CE1 3.6Å
41	C	95.6	Very high	93.4	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.318	C	S	.	.			trans	-76.5	125.6	173.8	-177.8	0	0	0	0	109.6	F39 V43 F45 D46 V48 C62	F39-C41 PolarHBondContact O-N 2.99Å; C41-V43 PolarHBondContact O-N 3.47Å; C41-F45 VanDerWaalsContact O-CA 3.27Å; C41-F45 WeakPolarHBondContact O-CA 3.45Å; C41-F45 PolarHBondContact O-N 2.85Å; C41-D46 WeakPolarHBondContact CB-O 3.47Å; C41-D46 PolarHBondContact N-O 2.8Å; C41-V48 HydrophobicContact CB-CG2 3.93Å; C41-C62 HydrophobicContact CB-CB 4Å; C41-C62 PolarHBondContact SG-N 3.05Å; C41-C62 VanDerWaalsContact SG-SG 3.68Å
42	P	95.3	Very high	93.8	Very high	57 Å²	57	53.6 Å²	53.6	37%	0.37	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	0.9	-177.1	29.9	-38	0	0	0	114.4	L60 P73	P42-L60 WeakPolarHBondContact CD-O 3.24Å; P42-P73 HydrophobicContact CG-CG 3.72Å
43	V	95.6	Very high	94.1	Very high	63 Å²	63	52.6 Å²	52.6	38%	0.382	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-50.9	-176.5	-178.1	0	0	0	0	111.5	C41 C65 L69 P73	C41-V43 PolarHBondContact O-N 3.47Å; V43-C65 HydrophobicContact CB-CB 4.09Å; V43-C65 HydrophobicContact CG1-CB 4.17Å; V43-C65 HydrophobicContact CG2-CB 4.43Å; V43-L69 HydrophobicContact CG2-CD1 4.05Å; V43-P73 HydrophobicContact CG2-CB 4.22Å; V43-P73 HydrophobicContact CG2-CG 3.93Å
44	C	94.1	Very high	94.4	Very high	58 Å²	58	50.2 Å²	50.2	39%	0.392	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-5	-177.4	65.6	0	0	0	0	113.7	D46 C62	C44-D46 PolarHBondContact O-N 2.88Å; C44-D46 VanDerWaalsContact O-N 3.13Å; C44-D46 VanDerWaalsContact SG-CB 3.57Å; C44-C62 VanDerWaalsContact SG-SG 3.63Å
45	F	92.2	Very high	94.7	Very high	153 Å²	153	46.1 Å²	46.1	67%	0.671	25%	0.252	S	S	*	.			trans	58.1	19.6	-175.6	-52.6	-79.7	0	0	0	114.3	C41	C41-F45 VanDerWaalsContact O-CA 3.27Å; C41-F45 WeakPolarHBondContact O-CA 3.45Å; C41-F45 PolarHBondContact O-N 2.85Å
46	D	92.8	Very high	94.8	Very high	53 Å²	53	50.2 Å²	50.2	28%	0.283	27%	0.27	S	S	.	.			trans	-96.3	163.4	170.8	-160.2	-3.8	0	0	0	109.8	C41 C44	C41-D46 WeakPolarHBondContact CB-O 3.47Å; C41-D46 PolarHBondContact N-O 2.8Å; C44-D46 PolarHBondContact O-N 2.88Å; C44-D46 VanDerWaalsContact O-N 3.13Å; C44-D46 VanDerWaalsContact SG-CB 3.57Å
47	Y	94.7	Very high	94.9	Very high	40 Å²	40	53.8 Å²	53.8	16%	0.157	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-79.6	137.2	-174.6	-60.4	-76.8	0	0	0	112.5	A36 F39 E40 L49 F96 P97	A36-Y47 HydrophobicContact CB-CE1 4.15Å; A36-Y47 WeakPolarHBondContact O-CD1 3.45Å; A36-Y47 WeakPolarHBondContact O-CE1 3.26Å; F39-Y47 HydrophobicContact CB-CD1 4.29Å; F39-Y47 CarbonylContact O-C 3.58Å; F39-Y47 WeakPolarHBondContact O-CA 3.25Å; E40-Y47 HydrophobicContact CG-CD1 3.97Å; E40-Y47 HydrophobicContact CG-CE1 3.6Å; Y47-L49 PolarHBondContact O-N 2.85Å; Y47-F96 AromaticContact CD1-CD1 3.78Å; Y47-F96 HydrophobicContact CD1-CD1 3.78Å; Y47-F96 HydrophobicContact CD1-CE1 4.25Å; Y47-F96 HydrophobicContact CD2-CD1 4.35Å; Y47-F96 HydrophobicContact CE1-CD1 4.45Å; Y47-F96 AromaticContact CG-CD1 3.72Å; Y47-F96 HydrophobicContact CG-CD1 3.72Å; Y47-F96 HydrophobicContact CG-CE1 4.42Å; Y47-P97 HydrophobicContact CE2-CG 3.61Å; Y47-P97 WeakPolarHBondContact OH-CG 3.24Å
48	V	95.8	Very high	94.9	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.012	29%	0.292	C	S	.	.			trans	-80.4	94.8	173.2	-175.4	0	0	0	0	108.5	F39 C41 I52 L60 C62	F39-V48 WeakPolarHBondContact CD1-O 3.3Å; F39-V48 WeakPolarHBondContact O-CB 3.34Å; F39-V48 VanDerWaalsContact O-CG2 3.31Å; F39-V48 WeakPolarHBondContact O-CG2 3.35Å; F39-V48 PolarHBondContact O-N 2.63Å; C41-V48 HydrophobicContact CB-CG2 3.93Å; V48-I52 HydrophobicContact CG1-CB 4.48Å; V48-I52 HydrophobicContact CG1-CG1 4.34Å; V48-I52 HydrophobicContact CG1-CG2 3.97Å; V48-I52 WeakPolarHBondContact O-CD1 3.27Å; V48-L60 HydrophobicContact CB-CB 4.37Å; V48-L60 HydrophobicContact CG1-CB 4.31Å; V48-L60 HydrophobicContact CG2-CB 4.04Å; V48-C62 HydrophobicContact CG2-CB 4.06Å
49	L	94.8	Very high	95	Very high	50 Å²	50	50.6 Å²	50.6	26%	0.262	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-89.6	159.3	178.7	-52.9	-177.4	0	0	0	111.9	Y47 P51 F96 H111 K114	Y47-L49 PolarHBondContact O-N 2.85Å; L49-P51 CarbonylContact O-C 3.58Å; L49-F96 HydrophobicContact CD2-CD1 4.12Å; L49-F96 HydrophobicContact CD2-CD2 4.04Å; L49-F96 HydrophobicContact CD2-CE1 4.13Å; L49-F96 HydrophobicContact CD2-CE2 4.06Å; L49-F96 HydrophobicContact CD2-CG 4.07Å; L49-F96 HydrophobicContact CD2-CZ 4.1Å; L49-H111 HydrophobicContact CB-CB 4.49Å; L49-H111 HydrophobicContact CD1-CB 4.35Å; L49-H111 HydrophobicContact CD2-CB 3.86Å; L49-H111 HydrophobicContact CG-CB 4.44Å; L49-K114 HydrophobicContact CD1-CD 3.98Å
50	P	94.4	Very high	95	Very high	41 Å²	41	51.5 Å²	51.5	27%	0.266	28%	0.284	S	S	.	.	S	Bend	trans	-53	139.9	174.6	-28.7	37.6	0	0	0	113.8	I52 E88 A91	P50-I52 HydrophobicContact CG-CD1 4.35Å; P50-I52 HydrophobicContact CG-CG1 4.24Å; P50-E88 HydrophobicContact CB-CG 4.14Å; P50-E88 HydrophobicContact CG-CB 4.4Å; P50-E88 HydrophobicContact CG-CG 4.25Å; P50-A91 HydrophobicContact CG-CB 4.08Å
51	P	94.6	Very high	95	Very high	77 Å²	77	47.7 Å²	47.7	50%	0.5	27%	0.266	S	S	.	.	S	Bend	cis	-71	126.1	-2.3	29.3	-34.8	0	0	0	112.8	L49 E88	L49-P51 CarbonylContact O-C 3.58Å; P51-E88 WeakPolarHBondContact CA-OE1 3.46Å
52	I	96	Very high	95	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-89.5	120.7	-174.2	-62	-176.4	0	0	0	109.1	F39 V48 P50 L60 R83 N84 M87 E88 A91	F39-I52 HydrophobicContact CD1-CD1 3.65Å; F39-I52 HydrophobicContact CE1-CD1 3.43Å; F39-I52 VanDerWaalsContact CE1-CD1 3.43Å; V48-I52 HydrophobicContact CG1-CB 4.48Å; V48-I52 HydrophobicContact CG1-CG1 4.34Å; V48-I52 HydrophobicContact CG1-CG2 3.97Å; V48-I52 WeakPolarHBondContact O-CD1 3.27Å; P50-I52 HydrophobicContact CG-CD1 4.35Å; P50-I52 HydrophobicContact CG-CG1 4.24Å; I52-L60 HydrophobicContact CG2-CD1 4.06Å; I52-L60 HydrophobicContact CG2-CD2 3.69Å; I52-L60 HydrophobicContact CG2-CG 4.42Å; I52-R83 CarbonylContact O-C 3.41Å; I52-R83 WeakPolarHBondContact O-CA 3.47Å; I52-N84 HydrophobicContact CG2-CB 4.19Å; I52-N84 PolarHBondContact O-N 2.99Å; I52-M87 HydrophobicContact CD1-CB 4.03Å; I52-M87 HydrophobicContact CG2-CB 4.11Å; I52-E88 HydrophobicContact CB-CG 3.87Å; I52-E88 HydrophobicContact CD1-CG 4.31Å; I52-E88 HydrophobicContact CG1-CG 3.92Å; I52-E88 PolarHBondContact N-OE1 2.78Å; I52-A91 HydrophobicContact CD1-CB 4.2Å
53	L	94.9	Very high	94.9	Very high	33 Å²	33	49.2 Å²	49.2	17%	0.173	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.9	179.4	-61	170.5	0	0	0	110.9	R66 I82 R83	L53-R66 VanDerWaalsContact CB-CZ 3.45Å; L53-R66 PolarHBondContact O-NH1 3.19Å; L53-I82 CarbonylContact C-O 3.55Å; L53-I82 WeakPolarHBondContact CA-O 3.48Å; L53-R83 HydrophobicContact CD2-CB 4.36Å; L53-R83 HydrophobicContact CD2-CG 3.44Å; L53-R83 VanDerWaalsContact CD2-CG 3.44Å
54	Q	95.6	Very high	94.7	Very high	38 Å²	38	51.4 Å²	51.4	18%	0.178	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	161.3	177.2	63.9	-173.6	-31.1	0	0	111.7	H59 L60 R66 I82 N84	Q54-H59 CarbonylContact C-O 3.6Å; Q54-H59 VanDerWaalsContact CA-O 3.26Å; Q54-H59 WeakPolarHBondContact CA-O 3.5Å; Q54-L60 HydrophobicContact CB-CD2 3.91Å; Q54-R66 PolarHBondContact O-NH2 3.05Å; Q54-I82 HydrophobicContact CG-CB 4.01Å; Q54-I82 HydrophobicContact CG-CG2 3.83Å; Q54-I82 PolarHBondContact N-O 3.21Å; Q54-N84 HydrophobicContact CB-CB 4.45Å; Q54-N84 HydrophobicContact CG-CB 4.17Å; Q54-N84 PolarHBondContact OE1-ND2 2.98Å; Q54-N84 VanDerWaalsContact OE1-ND2 3.13Å
55	C	96.2	Very high	94.8	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.007	27%	0.272	C	S	.	.			trans	-81.5	175.6	162.9	77.3	0	0	0	0	111.1	S57 G58 H59 C72 C75 L79	C55-S57 PolarHBondContact O-N 3.27Å; C55-S57 VanDerWaalsContact O-N 3.12Å; C55-S57 PolarHBondContact SG-N 2.86Å; C55-S57 VanDerWaalsContact SG-N 3.4Å; C55-G58 PolarHBondContact O-N 3.11Å; C55-H59 PolarHBondContact N-O 3.42Å; C55-H59 PolarHBondContact SG-N 3.16Å; C55-H59 VanDerWaalsContact SG-N 3.44Å; C55-C72 HydrophobicContact CB-CB 3.98Å; C55-C72 VanDerWaalsContact SG-SG 3.66Å; C55-C75 VanDerWaalsContact SG-SG 3.65Å; C55-L79 WeakPolarHBondContact CA-O 3.13Å
56	Q	94.9	Very high	94.9	Very high	142 Å²	142	43 Å²	43	66%	0.664	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-24.5	177.8	-69.2	-180	-2	0	0	113.8	P78 I82	Q56-P78 VanDerWaalsContact CD-CG 3.49Å; Q56-P78 HydrophobicContact CG-CG 4.24Å; Q56-I82 HydrophobicContact CG-CD1 4.03Å
57	S	95.4	Very high	94.9	Very high	78 Å²	78	45.7 Å²	45.7	55%	0.545	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	3.3	177.3	-45.6	0	0	0	0	113.9	C55 C75	C55-S57 PolarHBondContact O-N 3.27Å; C55-S57 VanDerWaalsContact O-N 3.12Å; C55-S57 PolarHBondContact SG-N 2.86Å; C55-S57 VanDerWaalsContact SG-N 3.4Å; S57-C75 PolarHBondContact OG-SG 3.31Å
58	G	94.5	Very high	95	Very high	32 Å²	32	51.8 Å²	51.8	33%	0.33	29%	0.292	S	S	.	.			trans	92.1	0.4	176	0	0	0	0	0	117	C55	C55-G58 PolarHBondContact O-N 3.11Å
59	H	96.5	Very high	94.9	Very high	64 Å²	64	54.2 Å²	54.2	30%	0.296	31%	0.305	S	S	.	.			trans	-75.7	138.8	179.1	-58.2	108.2	0	0	0	112.3	Q54 C55 T74	Q54-H59 CarbonylContact C-O 3.6Å; Q54-H59 VanDerWaalsContact CA-O 3.26Å; Q54-H59 WeakPolarHBondContact CA-O 3.5Å; C55-H59 PolarHBondContact N-O 3.42Å; C55-H59 PolarHBondContact SG-N 3.16Å; C55-H59 VanDerWaalsContact SG-N 3.44Å; H59-T74 VanDerWaalsContact CD2-CG2 3.49Å; H59-T74 WeakPolarHBondContact CD2-CG2 3.41Å; H59-T74 WeakPolarHBondContact NE2-CG2 3.44Å
60	L	96.6	Very high	94.9	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-92.7	142.3	-178.1	-52.2	-173.3	0	0	0	111.4	P42 V48 I52 Q54 M87	P42-L60 WeakPolarHBondContact CD-O 3.24Å; V48-L60 HydrophobicContact CB-CB 4.37Å; V48-L60 HydrophobicContact CG1-CB 4.31Å; V48-L60 HydrophobicContact CG2-CB 4.04Å; I52-L60 HydrophobicContact CG2-CD1 4.06Å; I52-L60 HydrophobicContact CG2-CD2 3.69Å; I52-L60 HydrophobicContact CG2-CG 4.42Å; Q54-L60 HydrophobicContact CB-CD2 3.91Å; L60-M87 HydrophobicContact CD1-CE 4.05Å
61	V	95.9	Very high	95	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	34%	0.338	C	S	.	.			trans	-141.9	134	171.2	-179.4	0	0	0	0	107.7	C65 R66 L69 P73 L79	V61-C65 HydrophobicContact CG1-CB 3.81Å; V61-R66 HydrophobicContact CG1-CB 4.19Å; V61-L69 HydrophobicContact CG1-CD1 3.83Å; V61-P73 HydrophobicContact CG2-CG 3.99Å; V61-L79 HydrophobicContact CG2-CD2 4.16Å
62	C	94.6	Very high	95.1	Very high	8 Å²	8	55.5 Å²	55.5	5%	0.054	31%	0.314	C	S	.	.			trans	-65.7	158.1	-177.3	73.1	0	0	0	0	111.8	C41 C44 V48 N64 C65 R66	C41-C62 HydrophobicContact CB-CB 4Å; C41-C62 PolarHBondContact SG-N 3.05Å; C41-C62 VanDerWaalsContact SG-SG 3.68Å; C44-C62 VanDerWaalsContact SG-SG 3.63Å; V48-C62 HydrophobicContact CG2-CB 4.06Å; C62-N64 PolarHBondContact O-N 2.99Å; C62-C65 PolarHBondContact O-N 3.26Å; C62-C65 PolarHBondContact SG-N 2.89Å; C62-C65 VanDerWaalsContact SG-N 3.42Å; C62-R66 WeakPolarHBondContact O-CB 3.02Å; C62-R66 PolarHBondContact O-N 3.33Å
63	S	92.6	Very high	95	Very high	81 Å²	81	58.1 Å²	58.1	57%	0.566	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.9	178.9	52.1	0	0	0	0	113.3	P67	S63-P67 WeakPolarHBondContact O-CD 3.38Å; S63-P67 WeakPolarHBondContact O-CG 3.28Å
64	N	92.7	Very high	95.1	Very high	110 Å²	110	60.2 Å²	60.2	59%	0.588	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-32.7	-179.9	-70	-20.1	0	0	0	113.6	C62 K68	C62-N64 PolarHBondContact O-N 2.99Å; N64-K68 WeakPolarHBondContact O-CE 3.34Å
65	C	95.2	Very high	95.2	Very high	10 Å²	10	60.5 Å²	60.5	7%	0.068	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-36.3	-178.8	-72.3	0	0	0	0	111.8	V43 V61 C62 P67 K68 L69	V43-C65 HydrophobicContact CB-CB 4.09Å; V43-C65 HydrophobicContact CG1-CB 4.17Å; V43-C65 HydrophobicContact CG2-CB 4.43Å; V61-C65 HydrophobicContact CG1-CB 3.81Å; C62-C65 PolarHBondContact O-N 3.26Å; C62-C65 PolarHBondContact SG-N 2.89Å; C62-C65 VanDerWaalsContact SG-N 3.42Å; C65-P67 VanDerWaalsContact C-CD 3.5Å; C65-K68 WeakPolarHBondContact O-CB 3.37Å; C65-K68 PolarHBondContact O-N 2.79Å; C65-L69 WeakPolarHBondContact O-CG 3.44Å
66	R	94.3	Very high	95.2	Very high	25 Å²	25	70.7 Å²	70.7	9%	0.094	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-52.7	-44.1	-174	-166.6	-175.5	-167.1	104.8	-8.4	114.3	L53 Q54 V61 C62 K68 L69 L79 G80	L53-R66 VanDerWaalsContact CB-CZ 3.45Å; L53-R66 PolarHBondContact O-NH1 3.19Å; Q54-R66 PolarHBondContact O-NH2 3.05Å; V61-R66 HydrophobicContact CG1-CB 4.19Å; C62-R66 WeakPolarHBondContact O-CB 3.02Å; C62-R66 PolarHBondContact O-N 3.33Å; R66-K68 PolarHBondContact O-N 2.96Å; R66-L69 PolarHBondContact O-N 2.98Å; R66-L79 HydrophobicContact CG-CD1 4.31Å; R66-L79 PolarHBondContact NH2-O 3.3Å; R66-G80 PolarHBondContact NE-O 3.29Å; R66-G80 PolarHBondContact NH2-O 3.49Å
67	P	93.9	Very high	95.2	Very high	109 Å²	109	64.8 Å²	64.8	71%	0.708	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-66.1	-18.5	179.2	-21.3	33.7	0	0	0	114.3	S63 C65 L69	S63-P67 WeakPolarHBondContact O-CD 3.38Å; S63-P67 WeakPolarHBondContact O-CG 3.28Å; C65-P67 VanDerWaalsContact C-CD 3.5Å; P67-L69 VanDerWaalsContact C-N 3.33Å
68	K	95.3	Very high	95.1	Very high	168 Å²	168	64.4 Å²	64.4	73%	0.73	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-90.2	-0.9	-178.6	-55.5	173.1	-174.7	169.5	0	112.4	N64 C65 R66	N64-K68 WeakPolarHBondContact O-CE 3.34Å; C65-K68 WeakPolarHBondContact O-CB 3.37Å; C65-K68 PolarHBondContact O-N 2.79Å; R66-K68 PolarHBondContact O-N 2.96Å
69	L	94.3	Very high	94.9	Very high	53 Å²	53	63.6 Å²	63.6	28%	0.277	35%	0.351	S	S	.	.			trans	-118.9	140.3	-172.3	-60.1	173.2	0	0	0	110.9	V43 V61 C65 R66 P67 P73 L79	V43-L69 HydrophobicContact CG2-CD1 4.05Å; V61-L69 HydrophobicContact CG1-CD1 3.83Å; C65-L69 WeakPolarHBondContact O-CG 3.44Å; R66-L69 PolarHBondContact O-N 2.98Å; P67-L69 VanDerWaalsContact C-N 3.33Å; L69-P73 HydrophobicContact CD1-CG 4.34Å; L69-L79 HydrophobicContact CB-CD1 3.72Å
70	T	94.6	Very high	94.4	Very high	144 Å²	144	62.8 Å²	62.8	88%	0.883	36%	0.36	S	S	*	.	S	Bend	trans	-92.5	-24.5	174.7	52.9	0	0	0	0	112.6
71	C	95.6	Very high	94.1	Very high	50 Å²	50	66.8 Å²	66.8	34%	0.338	39%	0.389	S	S	.	.	S	Bend	trans	-144.3	167.4	178	66	0	0	0	0	111.8
72	C	96.7	Very high	94	Very high	0 Å²	0	70 Å²	70	0%	0	41%	0.406	C	S	.	.			trans	-64.2	126.4	177.8	177.6	0	0	0	0	110.5	C55 T74 R76 G77 L79	C55-C72 HydrophobicContact CB-CB 3.98Å; C55-C72 VanDerWaalsContact SG-SG 3.66Å; C72-T74 PolarHBondContact O-N 3.47Å; C72-R76 WeakPolarHBondContact O-CA 3.31Å; C72-R76 PolarHBondContact O-N 3.5Å; C72-G77 WeakPolarHBondContact CB-O 3.27Å; C72-G77 PolarHBondContact N-O 3.14Å; C72-L79 HydrophobicContact CB-CD2 4.09Å
73	P	95.8	Very high	94.1	Very high	55 Å²	55	75.9 Å²	75.9	36%	0.357	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-24.6	-177.8	27.5	-34.4	0	0	0	112.5	P42 V43 V61 L69	P42-P73 HydrophobicContact CG-CG 3.72Å; V43-P73 HydrophobicContact CG2-CB 4.22Å; V43-P73 HydrophobicContact CG2-CG 3.93Å; V61-P73 HydrophobicContact CG2-CG 3.99Å; L69-P73 HydrophobicContact CD1-CG 4.34Å
74	T	95.9	Very high	94.2	Very high	77 Å²	77	73.1 Å²	73.1	47%	0.472	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-51.3	-177.8	-42.3	0	0	0	0	112.8	H59 C72	H59-T74 VanDerWaalsContact CD2-CG2 3.49Å; H59-T74 WeakPolarHBondContact CD2-CG2 3.41Å; H59-T74 WeakPolarHBondContact NE2-CG2 3.44Å; C72-T74 PolarHBondContact O-N 3.47Å
75	C	97.1	Very high	94.4	Very high	45 Å²	45	73 Å²	73	30%	0.304	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-2.2	-175.7	68.6	0	0	0	0	115.2	C55 S57 G77	C55-C75 VanDerWaalsContact SG-SG 3.65Å; S57-C75 PolarHBondContact OG-SG 3.31Å; C75-G77 PolarHBondContact O-N 3.02Å
76	R	96.4	Very high	94.4	Very high	214 Å²	214	75.6 Å²	75.6	81%	0.808	43%	0.427	S	S	*	.			trans	60.5	5.5	-175.9	-53	179.4	-179.1	-177.7	-0.7	115.3	C72	C72-R76 WeakPolarHBondContact O-CA 3.31Å; C72-R76 PolarHBondContact O-N 3.5Å
77	G	94.8	Very high	94.5	Very high	19 Å²	19	76.1 Å²	76.1	20%	0.196	43%	0.431	C	S	.	.	S	Bend	trans	-75.3	173.3	174.7	0	0	0	0	0	113.5	C72 C75 L79	C72-G77 WeakPolarHBondContact CB-O 3.27Å; C72-G77 PolarHBondContact N-O 3.14Å; C75-G77 PolarHBondContact O-N 3.02Å; G77-L79 PolarHBondContact O-N 2.86Å
78	P	94.2	Very high	94.6	Very high	70 Å²	70	72.1 Å²	72.1	46%	0.455	40%	0.402	S	S	.	.			trans	-64.2	133.2	177.2	27.8	-34.9	0	0	0	111.1	Q56	Q56-P78 VanDerWaalsContact CD-CG 3.49Å; Q56-P78 HydrophobicContact CG-CG 4.24Å
79	L	90.5	Very high	94.6	Very high	15 Å²	15	71.5 Å²	71.5	8%	0.079	40%	0.4	C	S	.	.			trans	-67	-40.9	177.3	-76.6	165.2	0	0	0	111.5	C55 V61 R66 L69 C72 G77	C55-L79 WeakPolarHBondContact CA-O 3.13Å; V61-L79 HydrophobicContact CG2-CD2 4.16Å; R66-L79 HydrophobicContact CG-CD1 4.31Å; R66-L79 PolarHBondContact NH2-O 3.3Å; L69-L79 HydrophobicContact CB-CD1 3.72Å; C72-L79 HydrophobicContact CB-CD2 4.09Å; G77-L79 PolarHBondContact O-N 2.86Å
80	G	86.1	Confident	94.7	Very high	47 Å²	47	71.7 Å²	71.7	49%	0.485	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	-160.5	-175	0	0	0	0	0	112.8	R66	R66-G80 PolarHBondContact NE-O 3.29Å; R66-G80 PolarHBondContact NH2-O 3.49Å
81	S	89.4	Confident	94.7	Very high	101 Å²	101	64.8 Å²	64.8	71%	0.706	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	57.3	173.8	-163.7	0	0	0	0	110.2
82	I	94.5	Very high	94.6	Very high	70 Å²	70	67.4 Å²	67.4	36%	0.359	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.7	-176.7	-55.1	173.3	0	0	0	108.2	L53 Q54 Q56	L53-I82 CarbonylContact C-O 3.55Å; L53-I82 WeakPolarHBondContact CA-O 3.48Å; Q54-I82 HydrophobicContact CG-CB 4.01Å; Q54-I82 HydrophobicContact CG-CG2 3.83Å; Q54-I82 PolarHBondContact N-O 3.21Å; Q56-I82 HydrophobicContact CG-CD1 4.03Å
83	R	95.9	Very high	94.5	Very high	131 Å²	131	72.3 Å²	72.3	49%	0.494	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	135.8	171	-78.2	-174.4	73.2	178.7	1.1	111	I52 L53 L85 E88	I52-R83 CarbonylContact O-C 3.41Å; I52-R83 WeakPolarHBondContact O-CA 3.47Å; L53-R83 HydrophobicContact CD2-CB 4.36Å; L53-R83 HydrophobicContact CD2-CG 3.44Å; L53-R83 VanDerWaalsContact CD2-CG 3.44Å; R83-L85 HydrophobicContact CB-CD2 4.47Å; R83-E88 IonicContact CZ-OE1 3.31Å; R83-E88 VanDerWaalsContact CZ-OE1 3.31Å; R83-E88 IonicContact CZ-OE2 3.72Å; R83-E88 IonicContact NE-OE1 2.93Å; R83-E88 PolarHBondContact NE-OE1 2.84Å; R83-E88 IonicContact NE-OE2 3.96Å; R83-E88 IonicContact NH2-OE1 2.84Å; R83-E88 PolarHBondContact NH2-OE1 2.71Å; R83-E88 IonicContact NH2-OE2 2.8Å; R83-E88 PolarHBondContact NH2-OE2 2.84Å
84	N	96	Very high	94.4	Very high	23 Å²	23	69.8 Å²	69.8	12%	0.123	39%	0.389	C	S	.	.			trans	-100.4	82.6	175.3	-167.7	-26.9	0	0	0	110	I52 Q54 A86 M87 E88	I52-N84 HydrophobicContact CG2-CB 4.19Å; I52-N84 PolarHBondContact O-N 2.99Å; Q54-N84 HydrophobicContact CB-CB 4.45Å; Q54-N84 HydrophobicContact CG-CB 4.17Å; Q54-N84 PolarHBondContact OE1-ND2 2.98Å; Q54-N84 VanDerWaalsContact OE1-ND2 3.13Å; N84-A86 PolarHBondContact O-N 3.29Å; N84-A86 PolarHBondContact OD1-N 2.95Å; N84-M87 HydrophobicContact CB-CB 4.12Å; N84-M87 HydrophobicContact CB-CG 4.35Å; N84-M87 VanDerWaalsContact CG-CG 3.45Å; N84-M87 VanDerWaalsContact ND2-CG 3.26Å; N84-M87 WeakPolarHBondContact ND2-CG 3.43Å; N84-M87 PolarHBondContact O-N 3.24Å; N84-M87 PolarHBondContact OD1-N 3.49Å; N84-E88 WeakPolarHBondContact O-CG 3.48Å; N84-E88 PolarHBondContact O-N 3.02Å
85	L	96.6	Very high	94.5	Very high	107 Å²	107	69.4 Å²	69.4	56%	0.56	38%	0.384	S	S	*	.	H	α-helix	trans	-61.3	-27.1	-179.5	-58.2	178.6	0	0	0	113.1	R83 K89	R83-L85 HydrophobicContact CB-CD2 4.47Å; L85-K89 WeakPolarHBondContact O-CG 3.37Å; L85-K89 PolarHBondContact O-N 3.34Å
86	A	95.7	Very high	94.4	Very high	64 Å²	64	67.3 Å²	67.3	53%	0.529	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-47.7	176.1	0	0	0	0	0	110.6	N84 E88 K89 V90	N84-A86 PolarHBondContact O-N 3.29Å; N84-A86 PolarHBondContact OD1-N 2.95Å; A86-E88 VanDerWaalsContact C-N 3.29Å; A86-E88 PolarHBondContact O-N 3.29Å; A86-K89 WeakPolarHBondContact O-CB 3.4Å; A86-K89 PolarHBondContact O-N 3.19Å; A86-K89 VanDerWaalsContact O-N 3.1Å; A86-V90 WeakPolarHBondContact O-CG2 3.49Å; A86-V90 PolarHBondContact O-N 3.27Å
87	M	95.8	Very high	94.4	Very high	37 Å²	37	58.5 Å²	58.5	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-65	-32.6	176	-71.1	-58.8	-72.1	0	0	112.4	L38 F39 I52 L60 N84 K89 V90 A91	L38-M87 HydrophobicContact CB-CE 4.48Å; F39-M87 HydrophobicContact CD1-CE 4.07Å; F39-M87 HydrophobicContact CD2-CE 4.34Å; F39-M87 HydrophobicContact CE1-CB 4.27Å; F39-M87 HydrophobicContact CE1-CE 3.54Å; F39-M87 WeakPolarHBondContact CE1-O 3.28Å; F39-M87 HydrophobicContact CE2-CE 3.84Å; F39-M87 HydrophobicContact CG-CE 4.44Å; F39-M87 HydrophobicContact CZ-CE 3.41Å; F39-M87 VanDerWaalsContact CZ-CE 3.41Å; I52-M87 HydrophobicContact CD1-CB 4.03Å; I52-M87 HydrophobicContact CG2-CB 4.11Å; L60-M87 HydrophobicContact CD1-CE 4.05Å; N84-M87 HydrophobicContact CB-CB 4.12Å; N84-M87 HydrophobicContact CB-CG 4.35Å; N84-M87 VanDerWaalsContact CG-CG 3.45Å; N84-M87 VanDerWaalsContact ND2-CG 3.26Å; N84-M87 WeakPolarHBondContact ND2-CG 3.43Å; N84-M87 PolarHBondContact O-N 3.24Å; N84-M87 PolarHBondContact OD1-N 3.49Å; M87-K89 VanDerWaalsContact C-N 3.32Å; M87-K89 PolarHBondContact O-N 3.02Å; M87-V90 PolarHBondContact O-N 3.02Å; M87-A91 WeakPolarHBondContact O-CB 3.24Å; M87-A91 PolarHBondContact O-N 2.98Å
88	E	96.3	Very high	94.4	Very high	24 Å²	24	57.8 Å²	57.8	11%	0.112	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-40	171.8	-68.4	177.7	-173.8	0	0	111.8	P50 P51 I52 R83 N84 A86 A91 N92	P50-E88 HydrophobicContact CB-CG 4.14Å; P50-E88 HydrophobicContact CG-CB 4.4Å; P50-E88 HydrophobicContact CG-CG 4.25Å; P51-E88 WeakPolarHBondContact CA-OE1 3.46Å; I52-E88 HydrophobicContact CB-CG 3.87Å; I52-E88 HydrophobicContact CD1-CG 4.31Å; I52-E88 HydrophobicContact CG1-CG 3.92Å; I52-E88 PolarHBondContact N-OE1 2.78Å; R83-E88 IonicContact CZ-OE1 3.31Å; R83-E88 VanDerWaalsContact CZ-OE1 3.31Å; R83-E88 IonicContact CZ-OE2 3.72Å; R83-E88 IonicContact NE-OE1 2.93Å; R83-E88 PolarHBondContact NE-OE1 2.84Å; R83-E88 IonicContact NE-OE2 3.96Å; R83-E88 IonicContact NH2-OE1 2.84Å; R83-E88 PolarHBondContact NH2-OE1 2.71Å; R83-E88 IonicContact NH2-OE2 2.8Å; R83-E88 PolarHBondContact NH2-OE2 2.84Å; N84-E88 WeakPolarHBondContact O-CG 3.48Å; N84-E88 PolarHBondContact O-N 3.02Å; A86-E88 VanDerWaalsContact C-N 3.29Å; A86-E88 PolarHBondContact O-N 3.29Å; E88-A91 PolarHBondContact O-N 2.92Å; E88-N92 PolarHBondContact O-N 3.13Å
89	K	95.3	Very high	94.3	Very high	155 Å²	155	58.7 Å²	58.7	67%	0.674	33%	0.329	S	S	*	.	H	α-helix	trans	-66.7	-39.2	174.4	-71.3	177.8	-178.8	-175.9	0	112.3	L85 A86 M87 A91 N92	L85-K89 WeakPolarHBondContact O-CG 3.37Å; L85-K89 PolarHBondContact O-N 3.34Å; A86-K89 WeakPolarHBondContact O-CB 3.4Å; A86-K89 PolarHBondContact O-N 3.19Å; A86-K89 VanDerWaalsContact O-N 3.1Å; M87-K89 VanDerWaalsContact C-N 3.32Å; M87-K89 PolarHBondContact O-N 3.02Å; K89-A91 VanDerWaalsContact C-N 3.35Å; K89-N92 WeakPolarHBondContact O-CB 3.48Å; K89-N92 PolarHBondContact O-N 2.95Å
90	V	94.8	Very high	94.4	Very high	57 Å²	57	59.5 Å²	59.5	35%	0.345	33%	0.331	S	S	.	.	H	α-helix	trans	-64.1	-42.7	175.8	177.2	0	0	0	0	110.3	F39 A86 M87 N92 S93 V94	F39-V90 HydrophobicContact CE2-CG1 4.16Å; F39-V90 HydrophobicContact CZ-CB 4.09Å; F39-V90 HydrophobicContact CZ-CG1 3.85Å; A86-V90 WeakPolarHBondContact O-CG2 3.49Å; A86-V90 PolarHBondContact O-N 3.27Å; M87-V90 PolarHBondContact O-N 3.02Å; V90-N92 PolarHBondContact O-N 2.84Å; V90-N92 VanDerWaalsContact O-N 3.13Å; V90-S93 PolarHBondContact O-N 2.86Å; V90-V94 HydrophobicContact CG1-CG2 4.15Å; V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 2.89Å
91	A	95.1	Very high	94.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-56.7	-30.3	178.3	0	0	0	0	0	113.1	F39 P50 I52 M87 E88 K89 S93 V94 F96	F39-A91 HydrophobicContact CE1-CB 3.74Å; F39-A91 HydrophobicContact CZ-CB 4.03Å; P50-A91 HydrophobicContact CG-CB 4.08Å; I52-A91 HydrophobicContact CD1-CB 4.2Å; M87-A91 WeakPolarHBondContact O-CB 3.24Å; M87-A91 PolarHBondContact O-N 2.98Å; E88-A91 PolarHBondContact O-N 2.92Å; K89-A91 VanDerWaalsContact C-N 3.35Å; A91-S93 PolarHBondContact O-N 2.85Å; A91-V94 PolarHBondContact O-N 3.16Å; A91-F96 HydrophobicContact CB-CE2 4.31Å; A91-F96 HydrophobicContact CB-CZ 4.12Å
92	N	94.2	Very high	94.7	Very high	104 Å²	104	60.4 Å²	60.4	56%	0.556	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.3	175.4	-66.3	-30.1	0	0	0	113.9	E88 K89 V90 H111	E88-N92 PolarHBondContact O-N 3.13Å; K89-N92 WeakPolarHBondContact O-CB 3.48Å; K89-N92 PolarHBondContact O-N 2.95Å; V90-N92 PolarHBondContact O-N 2.84Å; V90-N92 VanDerWaalsContact O-N 3.13Å; N92-H111 PolarHBondContact OD1-NE2 2.87Å
93	S	93.5	Very high	94.5	Very high	104 Å²	104	60 Å²	60	73%	0.727	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	4.1	-179.9	-53.8	0	0	0	0	112.9	V90 A91	V90-S93 PolarHBondContact O-N 2.86Å; A91-S93 PolarHBondContact O-N 2.85Å
94	V	95.6	Very high	94.3	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	33%	0.331	C	S	.	.			trans	-112.7	134.4	-178	177.3	0	0	0	0	108.9	L35 A36 F39 V90 A91 F96	L35-V94 HydrophobicContact CB-CG1 4.29Å; L35-V94 HydrophobicContact CB-CG2 3.76Å; L35-V94 HydrophobicContact CD1-CG2 4.23Å; A36-V94 HydrophobicContact CB-CG1 3.93Å; F39-V94 HydrophobicContact CE2-CG2 4.23Å; V90-V94 HydrophobicContact CG1-CG2 4.15Å; V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 2.89Å; A91-V94 PolarHBondContact O-N 3.16Å; V94-F96 HydrophobicContact CB-CE2 4.14Å; V94-F96 HydrophobicContact CB-CZ 4.04Å; V94-F96 HydrophobicContact CG1-CD1 4.44Å; V94-F96 HydrophobicContact CG1-CE1 4.03Å; V94-F96 HydrophobicContact CG1-CE2 4.19Å; V94-F96 HydrophobicContact CG1-CZ 3.91Å; V94-F96 WeakPolarHBondContact O-CE2 3.45Å
95	L	96.1	Very high	94.3	Very high	69 Å²	69	54.6 Å²	54.6	36%	0.361	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-92.3	128.7	169.4	-54	174.5	0	0	0	108.8	N32 L109 P110	N32-L95 WeakPolarHBondContact ND2-CB 3.34Å; N32-L95 PolarHBondContact ND2-O 2.87Å; N32-L95 PolarHBondContact OD1-N 3.01Å; L95-L109 CarbonylContact C-O 3.54Å; L95-L109 WeakPolarHBondContact CA-O 3.46Å; L95-P110 HydrophobicContact CD2-CG 3.84Å
96	F	95.9	Very high	94.2	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.3	179.7	-62.1	-84.8	0	0	0	109.4	A36 F39 Y47 L49 A91 V94 T108 L109 H111 K114	A36-F96 HydrophobicContact CB-CD1 4.32Å; F39-F96 HydrophobicContact CB-CE1 3.82Å; F39-F96 HydrophobicContact CD1-CE1 4.39Å; F39-F96 HydrophobicContact CD1-CZ 4.29Å; F39-F96 AromaticContact CD2-CE1 3.86Å; F39-F96 HydrophobicContact CD2-CE1 3.86Å; F39-F96 HydrophobicContact CD2-CZ 4.1Å; F39-F96 HydrophobicContact CE2-CZ 4.39Å; F39-F96 AromaticContact CG-CE1 3.77Å; F39-F96 HydrophobicContact CG-CE1 3.77Å; F39-F96 HydrophobicContact CG-CZ 4.06Å; Y47-F96 AromaticContact CD1-CD1 3.78Å; Y47-F96 HydrophobicContact CD1-CD1 3.78Å; Y47-F96 HydrophobicContact CD1-CE1 4.25Å; Y47-F96 HydrophobicContact CD2-CD1 4.35Å; Y47-F96 HydrophobicContact CE1-CD1 4.45Å; Y47-F96 AromaticContact CG-CD1 3.72Å; Y47-F96 HydrophobicContact CG-CD1 3.72Å; Y47-F96 HydrophobicContact CG-CE1 4.42Å; L49-F96 HydrophobicContact CD2-CD1 4.12Å; L49-F96 HydrophobicContact CD2-CD2 4.04Å; L49-F96 HydrophobicContact CD2-CE1 4.13Å; L49-F96 HydrophobicContact CD2-CE2 4.06Å; L49-F96 HydrophobicContact CD2-CG 4.07Å; L49-F96 HydrophobicContact CD2-CZ 4.1Å; A91-F96 HydrophobicContact CB-CE2 4.31Å; A91-F96 HydrophobicContact CB-CZ 4.12Å; V94-F96 HydrophobicContact CB-CE2 4.14Å; V94-F96 HydrophobicContact CB-CZ 4.04Å; V94-F96 HydrophobicContact CG1-CD1 4.44Å; V94-F96 HydrophobicContact CG1-CE1 4.03Å; V94-F96 HydrophobicContact CG1-CE2 4.19Å; V94-F96 HydrophobicContact CG1-CZ 3.91Å; V94-F96 WeakPolarHBondContact O-CE2 3.45Å; F96-T108 WeakPolarHBondContact O-CA 3.37Å; F96-L109 PolarHBondContact N-O 2.95Å; F96-L109 PolarHBondContact O-N 2.91Å; F96-H111 HydrophobicContact CD2-CB 3.99Å; F96-H111 HydrophobicContact CE2-CB 3.88Å; F96-K114 HydrophobicContact CB-CD 3.79Å
97	P	95.6	Very high	94.2	Very high	29 Å²	29	58.1 Å²	58.1	19%	0.188	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	149.8	172.9	27.7	-31.7	0	0	0	110.6	Y47 A101 T108 K114	Y47-P97 HydrophobicContact CE2-CG 3.61Å; Y47-P97 WeakPolarHBondContact OH-CG 3.24Å; P97-A101 HydrophobicContact CB-CB 4.49Å; P97-T108 HydrophobicContact CB-CG2 4.07Å; P97-K114 PolarHBondContact O-NZ 3.24Å
98	C	95.1	Very high	94.3	Very high	4 Å²	4	59.7 Å²	59.7	3%	0.027	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-56.2	141.8	172.1	179.4	0	0	0	0	111.1	Y100 A101 C105 V107 H117	C98-Y100 PolarHBondContact O-N 3.01Å; C98-Y100 VanDerWaalsContact O-N 3.07Å; C98-Y100 VanDerWaalsContact SG-CD2 3.59Å; C98-Y100 PolarHBondContact SG-N 3.29Å; C98-Y100 VanDerWaalsContact SG-N 3.43Å; C98-A101 VanDerWaalsContact O-CB 3.26Å; C98-A101 WeakPolarHBondContact O-CB 3.38Å; C98-A101 PolarHBondContact O-N 3.45Å; C98-C105 HydrophobicContact CB-CB 4Å; C98-C105 VanDerWaalsContact CB-SG 3.56Å; C98-V107 PolarHBondContact N-O 2.61Å; C98-H117 PolarHBondContact SG-NE2 3.05Å; C98-H117 VanDerWaalsContact SG-NE2 3.4Å
99	K	91.9	Very high	94.3	Very high	88 Å²	88	60.4 Å²	60.4	38%	0.383	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.3	176.7	72.6	-175.4	169.9	-136.2	0	113.6	A101 E118	K99-A101 VanDerWaalsContact C-N 3.32Å; K99-E118 WeakPolarHBondContact CB-OE1 3.21Å; K99-E118 HydrophobicContact CD-CG 4.37Å; K99-E118 VanDerWaalsContact CD-OE2 3.22Å; K99-E118 WeakPolarHBondContact CD-OE2 3.37Å; K99-E118 VanDerWaalsContact CE-OE2 3.26Å; K99-E118 WeakPolarHBondContact CE-OE2 3.42Å; K99-E118 HydrophobicContact CG-CG 4.07Å; K99-E118 WeakPolarHBondContact CG-OE1 3.38Å; K99-E118 PolarHBondContact N-OE1 3.08Å; K99-E118 IonicContact NZ-OE2 2.75Å; K99-E118 PolarHBondContact NZ-OE2 3.46Å
100	Y	92.5	Very high	94.3	Very high	33 Å²	33	55 Å²	55	13%	0.129	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	18	175.6	-49.1	-61.7	0	0	0	113	C98 S102 S103 G104 C105 E118 C121 R124 P125	C98-Y100 PolarHBondContact O-N 3.01Å; C98-Y100 VanDerWaalsContact O-N 3.07Å; C98-Y100 VanDerWaalsContact SG-CD2 3.59Å; C98-Y100 PolarHBondContact SG-N 3.29Å; C98-Y100 VanDerWaalsContact SG-N 3.43Å; Y100-S102 PolarHBondContact O-N 3Å; Y100-S103 CarbonylContact O-C 3.55Å; Y100-S103 WeakPolarHBondContact O-CA 3.49Å; Y100-S103 WeakPolarHBondContact O-CB 3.48Å; Y100-S103 PolarHBondContact O-N 3.27Å; Y100-G104 PolarHBondContact O-N 2.81Å; Y100-C105 WeakPolarHBondContact O-CB 3.21Å; Y100-C105 PolarHBondContact O-N 2.72Å; Y100-E118 HydrophobicContact CE2-CB 4.15Å; Y100-E118 HydrophobicContact CE2-CG 4.39Å; Y100-E118 WeakPolarHBondContact CE2-O 3.41Å; Y100-C121 HydrophobicContact CD2-CB 3.7Å; Y100-C121 HydrophobicContact CE2-CB 4.04Å; Y100-R124 HydrophobicContact CD2-CB 4.01Å; Y100-R124 HydrophobicContact CE1-CB 4.23Å; Y100-R124 HydrophobicContact CE1-CG 4.23Å; Y100-R124 HydrophobicContact CE2-CB 3.56Å; Y100-R124 HydrophobicContact CE2-CG 3.98Å; Y100-R124 WeakPolarHBondContact OH-CG 3.29Å; Y100-P125 HydrophobicContact CE1-CG 4.42Å
101	A	93.1	Very high	94.3	Very high	46 Å²	46	53.8 Å²	53.8	38%	0.38	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-58	-35.3	175.1	0	0	0	0	0	112.7	P97 C98 K99 S103 G104 C105	P97-A101 HydrophobicContact CB-CB 4.49Å; C98-A101 VanDerWaalsContact O-CB 3.26Å; C98-A101 WeakPolarHBondContact O-CB 3.38Å; C98-A101 PolarHBondContact O-N 3.45Å; K99-A101 VanDerWaalsContact C-N 3.32Å; A101-S103 PolarHBondContact O-N 2.84Å; A101-G104 PolarHBondContact O-N 3.44Å; A101-C105 VanDerWaalsContact CA-O 3.24Å; A101-C105 WeakPolarHBondContact CA-O 3.34Å; A101-C105 WeakPolarHBondContact CB-O 3.36Å
102	S	90.3	Very high	94.3	Very high	120 Å²	120	58.1 Å²	58.1	84%	0.839	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.7	-22.7	173	54.3	0	0	0	0	113.7	Y100	Y100-S102 PolarHBondContact O-N 3Å
103	S	89.3	Confident	94.4	Very high	63 Å²	63	56.5 Å²	56.5	44%	0.441	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-89.9	-2.5	174.3	-58.7	0	0	0	0	113.1	Y100 A101 F123	Y100-S103 CarbonylContact O-C 3.55Å; Y100-S103 WeakPolarHBondContact O-CA 3.49Å; Y100-S103 WeakPolarHBondContact O-CB 3.48Å; Y100-S103 PolarHBondContact O-N 3.27Å; A101-S103 PolarHBondContact O-N 2.84Å; S103-F123 WeakPolarHBondContact CB-O 3.49Å; S103-F123 WeakPolarHBondContact O-CD1 3.41Å
104	G	92.4	Very high	94.4	Very high	36 Å²	36	51.7 Å²	51.7	37%	0.371	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	113.3	3	178	0	0	0	0	0	115.6	Y100 A101 E106 F123	Y100-G104 PolarHBondContact O-N 2.81Å; A101-G104 PolarHBondContact O-N 3.44Å; G104-E106 PolarHBondContact O-N 2.95Å; G104-F123 VanDerWaalsContact O-CZ 3.28Å; G104-F123 WeakPolarHBondContact O-CZ 3.3Å
105	C	94.4	Very high	94.3	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.027	33%	0.326	C	S	.	.			trans	-75.5	110.7	176.5	-167.9	0	0	0	0	112.1	C98 Y100 A101 V107 H117 F123	C98-C105 HydrophobicContact CB-CB 4Å; C98-C105 VanDerWaalsContact CB-SG 3.56Å; Y100-C105 WeakPolarHBondContact O-CB 3.21Å; Y100-C105 PolarHBondContact O-N 2.72Å; A101-C105 VanDerWaalsContact CA-O 3.24Å; A101-C105 WeakPolarHBondContact CA-O 3.34Å; A101-C105 WeakPolarHBondContact CB-O 3.36Å; C105-V107 VanDerWaalsContact C-N 3.31Å; C105-V107 PolarHBondContact O-N 3.14Å; C105-H117 PolarHBondContact SG-NE2 2.94Å; C105-H117 VanDerWaalsContact SG-NE2 3.38Å; C105-F123 VanDerWaalsContact CA-CD2 3.47Å; C105-F123 HydrophobicContact CB-CB 3.99Å; C105-F123 HydrophobicContact CB-CD2 3.51Å; C105-F123 HydrophobicContact CB-CE2 4.22Å; C105-F123 HydrophobicContact CB-CG 3.92Å
106	E	95.9	Very high	94.1	Very high	186 Å²	186	57.3 Å²	57.3	87%	0.869	34%	0.338	S	S	*	.			trans	-86.8	0.9	-179.9	-60.5	-176.2	166.5	0	0	113.8	G104	G104-E106 PolarHBondContact O-N 2.95Å
107	V	96.1	Very high	94	Very high	58 Å²	58	59.4 Å²	59.4	35%	0.352	35%	0.348	S	S	.	.			trans	-72.8	132.3	-174.1	176.4	0	0	0	0	111.1	C98 C105 L109	C98-V107 PolarHBondContact N-O 2.61Å; C105-V107 VanDerWaalsContact C-N 3.31Å; C105-V107 PolarHBondContact O-N 3.14Å; V107-L109 HydrophobicContact CG1-CD1 3.53Å; V107-L109 HydrophobicContact CG1-CD2 4.12Å; V107-L109 HydrophobicContact CG1-CG 3.57Å
108	T	96.3	Very high	93.9	Very high	70 Å²	70	58.8 Å²	58.8	43%	0.429	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.4	172.5	54.9	0	0	0	0	109.5	F96 P97	F96-T108 WeakPolarHBondContact O-CA 3.37Å; P97-T108 HydrophobicContact CB-CG2 4.07Å
109	L	96.3	Very high	93.5	Very high	40 Å²	40	64.8 Å²	64.8	21%	0.209	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.4	-167.5	-69.7	159.7	0	0	0	112	L95 F96 V107 H117	L95-L109 CarbonylContact C-O 3.54Å; L95-L109 WeakPolarHBondContact CA-O 3.46Å; F96-L109 PolarHBondContact N-O 2.95Å; F96-L109 PolarHBondContact O-N 2.91Å; V107-L109 HydrophobicContact CG1-CD1 3.53Å; V107-L109 HydrophobicContact CG1-CD2 4.12Å; V107-L109 HydrophobicContact CG1-CG 3.57Å; L109-H117 HydrophobicContact CD1-CB 3.27Å
110	P	96.8	Very high	93.3	Very high	40 Å²	40	66.6 Å²	66.6	26%	0.26	38%	0.383	S	S	.	.			trans	-56.5	152.7	165.1	-20.2	33.2	0	0	0	111.2	L95 T112 D113 K114	L95-P110 HydrophobicContact CD2-CG 3.84Å; P110-T112 PolarHBondContact O-N 2.88Å; P110-T112 VanDerWaalsContact O-N 3.13Å; P110-D113 PolarHBondContact O-N 2.78Å; P110-D113 VanDerWaalsContact O-N 3.1Å; P110-K114 PolarHBondContact O-N 3.07Å; P110-K114 VanDerWaalsContact O-N 3.15Å
111	H	94.6	Very high	93.1	Very high	32 Å²	32	65.1 Å²	65.1	15%	0.148	38%	0.378	C	S	.	.	H	α-helix	trans	-60.1	-26.1	179.7	71.6	90	0	0	0	113.6	L49 N92 F96 D113	L49-H111 HydrophobicContact CB-CB 4.49Å; L49-H111 HydrophobicContact CD1-CB 4.35Å; L49-H111 HydrophobicContact CD2-CB 3.86Å; L49-H111 HydrophobicContact CG-CB 4.44Å; N92-H111 PolarHBondContact OD1-NE2 2.87Å; F96-H111 HydrophobicContact CD2-CB 3.99Å; F96-H111 HydrophobicContact CE2-CB 3.88Å; H111-D113 VanDerWaalsContact C-N 3.32Å; H111-D113 PolarHBondContact O-N 2.85Å
112	T	95.3	Very high	92.8	Very high	91 Å²	91	71 Å²	71	56%	0.558	40%	0.397	S	S	*	.	H	α-helix	trans	-66	-34	177.4	50.9	0	0	0	0	112.9	P110	P110-T112 PolarHBondContact O-N 2.88Å; P110-T112 VanDerWaalsContact O-N 3.13Å
113	D	95.6	Very high	92.8	Very high	70 Å²	70	69.5 Å²	69.5	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-102.6	-15.1	-170.4	-49.2	-14.7	0	0	0	111.2	P110 H111 A115 E116 H117	P110-D113 PolarHBondContact O-N 2.78Å; P110-D113 VanDerWaalsContact O-N 3.1Å; H111-D113 VanDerWaalsContact C-N 3.32Å; H111-D113 PolarHBondContact O-N 2.85Å; D113-A115 VanDerWaalsContact C-N 3.35Å; D113-A115 PolarHBondContact O-N 3.36Å; D113-E116 PolarHBondContact O-N 3.01Å; D113-H117 PolarHBondContact O-N 3.14Å
114	K	94.3	Very high	92.9	Very high	3 Å²	3	70.4 Å²	70.4	1%	0.013	37%	0.369	C	S	.	.	H	α-helix	trans	-58.7	-41.7	-177.3	177	168.8	161.9	70.8	0	112.8	L49 F96 P97 P110 E118	L49-K114 HydrophobicContact CD1-CD 3.98Å; F96-K114 HydrophobicContact CB-CD 3.79Å; P97-K114 PolarHBondContact O-NZ 3.24Å; P110-K114 PolarHBondContact O-N 3.07Å; P110-K114 VanDerWaalsContact O-N 3.15Å; K114-E118 WeakPolarHBondContact CE-OE1 3.38Å; K114-E118 HydrophobicContact CG-CG 4.39Å; K114-E118 IonicContact NZ-OE1 2.63Å; K114-E118 PolarHBondContact NZ-OE1 2.81Å; K114-E118 WeakPolarHBondContact O-CB 3.39Å; K114-E118 VanDerWaalsContact O-CG 3.23Å; K114-E118 WeakPolarHBondContact O-CG 3.43Å; K114-E118 PolarHBondContact O-N 2.94Å
115	A	92.3	Very high	92.9	Very high	58 Å²	58	70.4 Å²	70.4	48%	0.479	36%	0.363	S	S	.	.	H	α-helix	trans	-64.4	-47.8	-178.9	0	0	0	0	0	111.8	D113 H117 E118 E119	D113-A115 VanDerWaalsContact C-N 3.35Å; D113-A115 PolarHBondContact O-N 3.36Å; A115-H117 PolarHBondContact O-N 2.71Å; A115-E118 PolarHBondContact O-N 3.33Å; A115-E119 PolarHBondContact O-N 3.16Å; A115-E119 VanDerWaalsContact O-N 3.12Å
116	E	93.2	Very high	92.8	Very high	132 Å²	132	71.4 Å²	71.4	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-60.7	-45.9	177.9	-177.4	179.7	-179.7	0	0	111.4	D113 E118 E119 L120	D113-E116 PolarHBondContact O-N 3.01Å; E116-E118 PolarHBondContact O-N 2.85Å; E116-E119 PolarHBondContact O-N 3.18Å; E116-L120 PolarHBondContact O-N 3.12Å
117	H	93.8	Very high	92.6	Very high	45 Å²	45	65 Å²	65	21%	0.208	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-46.4	175.4	169.1	76.3	0	0	0	112.3	C98 C105 L109 D113 A115 E119 L120 C121	C98-H117 PolarHBondContact SG-NE2 3.05Å; C98-H117 VanDerWaalsContact SG-NE2 3.4Å; C105-H117 PolarHBondContact SG-NE2 2.94Å; C105-H117 VanDerWaalsContact SG-NE2 3.38Å; L109-H117 HydrophobicContact CD1-CB 3.27Å; D113-H117 PolarHBondContact O-N 3.14Å; A115-H117 PolarHBondContact O-N 2.71Å; H117-E119 VanDerWaalsContact C-N 3.26Å; H117-E119 PolarHBondContact O-N 2.79Å; H117-L120 CarbonylContact O-C 3.54Å; H117-L120 PolarHBondContact O-N 2.88Å; H117-L120 VanDerWaalsContact O-N 3.09Å; H117-C121 WeakPolarHBondContact O-CA 3.28Å; H117-C121 WeakPolarHBondContact O-CB 3.33Å; H117-C121 PolarHBondContact O-N 2.94Å
118	E	92.6	Very high	92.5	Very high	15 Å²	15	63.2 Å²	63.2	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-27.1	-177.3	-76.1	178.7	174.6	0	0	113.4	K99 Y100 K114 A115 E116 L120	K99-E118 WeakPolarHBondContact CB-OE1 3.21Å; K99-E118 HydrophobicContact CD-CG 4.37Å; K99-E118 VanDerWaalsContact CD-OE2 3.22Å; K99-E118 WeakPolarHBondContact CD-OE2 3.37Å; K99-E118 VanDerWaalsContact CE-OE2 3.26Å; K99-E118 WeakPolarHBondContact CE-OE2 3.42Å; K99-E118 HydrophobicContact CG-CG 4.07Å; K99-E118 WeakPolarHBondContact CG-OE1 3.38Å; K99-E118 PolarHBondContact N-OE1 3.08Å; K99-E118 IonicContact NZ-OE2 2.75Å; K99-E118 PolarHBondContact NZ-OE2 3.46Å; Y100-E118 HydrophobicContact CE2-CB 4.15Å; Y100-E118 HydrophobicContact CE2-CG 4.39Å; Y100-E118 WeakPolarHBondContact CE2-O 3.41Å; K114-E118 WeakPolarHBondContact CE-OE1 3.38Å; K114-E118 HydrophobicContact CG-CG 4.39Å; K114-E118 IonicContact NZ-OE1 2.63Å; K114-E118 PolarHBondContact NZ-OE1 2.81Å; K114-E118 WeakPolarHBondContact O-CB 3.39Å; K114-E118 VanDerWaalsContact O-CG 3.23Å; K114-E118 WeakPolarHBondContact O-CG 3.43Å; K114-E118 PolarHBondContact O-N 2.94Å; A115-E118 PolarHBondContact O-N 3.33Å; E116-E118 PolarHBondContact O-N 2.85Å; E118-L120 VanDerWaalsContact C-N 3.28Å
119	E	87.7	Confident	92.4	Very high	131 Å²	131	60.7 Å²	60.7	61%	0.612	32%	0.317	S	S	*	.	H	α-helix	trans	-67	-33.6	173.1	-73.4	-179.2	-178.9	0	0	112	A115 E116 H117 R124	A115-E119 PolarHBondContact O-N 3.16Å; A115-E119 VanDerWaalsContact O-N 3.12Å; E116-E119 PolarHBondContact O-N 3.18Å; H117-E119 VanDerWaalsContact C-N 3.26Å; H117-E119 PolarHBondContact O-N 2.79Å; E119-R124 PolarHBondContact O-NH1 3.32Å
120	L	85.8	Confident	92	Very high	125 Å²	125	59.9 Å²	59.9	65%	0.654	31%	0.314	S	S	*	.	S	Bend	trans	-106.6	6	-174.6	-56.8	175.1	0	0	0	113.7	E116 H117 E118 E122	E116-L120 PolarHBondContact O-N 3.12Å; H117-L120 CarbonylContact O-C 3.54Å; H117-L120 PolarHBondContact O-N 2.88Å; H117-L120 VanDerWaalsContact O-N 3.09Å; E118-L120 VanDerWaalsContact C-N 3.28Å; L120-E122 PolarHBondContact O-N 3.18Å
121	C	90.3	Very high	91.2	Very high	3 Å²	3	59 Å²	59	2%	0.02	31%	0.309	C	S	.	.			trans	-69.8	124.3	-172.1	-174.9	0	0	0	0	110.9	Y100 H117 F123 R124 H244	Y100-C121 HydrophobicContact CD2-CB 3.7Å; Y100-C121 HydrophobicContact CE2-CB 4.04Å; H117-C121 WeakPolarHBondContact O-CA 3.28Å; H117-C121 WeakPolarHBondContact O-CB 3.33Å; H117-C121 PolarHBondContact O-N 2.94Å; C121-F123 PolarHBondContact O-N 2.94Å; C121-F123 VanDerWaalsContact O-N 3.09Å; C121-R124 HydrophobicContact CB-CB 4.4Å; C121-R124 WeakPolarHBondContact O-CB 3.46Å; C121-R124 PolarHBondContact O-N 3.19Å; C121-H244 PolarHBondContact O-CE1 2.72Å; C121-H244 VanDerWaalsContact O-CE1 3.23Å; C121-H244 PolarHBondContact O-NE2 2.85Å
122	E	86.6	Confident	90	Very high	168 Å²	168	60.9 Å²	60.9	79%	0.785	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.1	179.6	-61.4	-173.5	154.1	0	0	113.6	L120 R124	L120-E122 PolarHBondContact O-N 3.18Å; E122-R124 VanDerWaalsContact C-N 3.31Å
123	F	89.9	Confident	88.5	Confident	90 Å²	90	58.4 Å²	58.4	40%	0.395	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	0.6	177.8	-61.1	-82.6	0	0	0	113.6	S103 G104 C105 C121	S103-F123 WeakPolarHBondContact CB-O 3.49Å; S103-F123 WeakPolarHBondContact O-CD1 3.41Å; G104-F123 VanDerWaalsContact O-CZ 3.28Å; G104-F123 WeakPolarHBondContact O-CZ 3.3Å; C105-F123 VanDerWaalsContact CA-CD2 3.47Å; C105-F123 HydrophobicContact CB-CB 3.99Å; C105-F123 HydrophobicContact CB-CD2 3.51Å; C105-F123 HydrophobicContact CB-CE2 4.22Å; C105-F123 HydrophobicContact CB-CG 3.92Å; C121-F123 PolarHBondContact O-N 2.94Å; C121-F123 VanDerWaalsContact O-N 3.09Å
124	R	91.5	Very high	87.6	Confident	81 Å²	81	60.9 Å²	60.9	31%	0.306	35%	0.349	S	S	.	.	S	Bend	trans	-63.9	129.1	174.8	169.6	173.2	172.2	-162	-2	109.9	Y100 E119 C121 E122	Y100-R124 HydrophobicContact CD2-CB 4.01Å; Y100-R124 HydrophobicContact CE1-CB 4.23Å; Y100-R124 HydrophobicContact CE1-CG 4.23Å; Y100-R124 HydrophobicContact CE2-CB 3.56Å; Y100-R124 HydrophobicContact CE2-CG 3.98Å; Y100-R124 WeakPolarHBondContact OH-CG 3.29Å; E119-R124 PolarHBondContact O-NH1 3.32Å; C121-R124 HydrophobicContact CB-CB 4.4Å; C121-R124 WeakPolarHBondContact O-CB 3.46Å; C121-R124 PolarHBondContact O-N 3.19Å; E122-R124 VanDerWaalsContact C-N 3.31Å
125	P	92.6	Very high	87.4	Confident	37 Å²	37	62.9 Å²	62.9	24%	0.24	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-59.5	142.6	172.1	-23.4	33.8	0	0	0	112	Y100 Q138 G139	Y100-P125 HydrophobicContact CE1-CG 4.42Å; P125-Q138 HydrophobicContact CB-CB 4.35Å; P125-G139 CarbonylContact C-O 3.57Å
126	Y	92.1	Very high	87.4	Confident	24 Å²	24	69.5 Å²	69.5	9%	0.094	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.2	174.1	-68.9	-91	0	0	0	109.8	Q138 G139 L141 V144 I243 H244	Y126-Q138 CarbonylContact O-C 3.45Å; Y126-Q138 WeakPolarHBondContact O-CA 3.5Å; Y126-G139 PolarHBondContact N-O 3.35Å; Y126-G139 PolarHBondContact O-N 3.33Å; Y126-L141 HydrophobicContact CD2-CB 4.01Å; Y126-L141 HydrophobicContact CE1-CD1 4.31Å; Y126-L141 HydrophobicContact CE2-CB 3.65Å; Y126-L141 HydrophobicContact CE2-CD1 4.24Å; Y126-L141 HydrophobicContact CE2-CG 4.41Å; Y126-V144 HydrophobicContact CG-CG2 4.35Å; Y126-I243 HydrophobicContact CD1-CB 4.29Å; Y126-I243 HydrophobicContact CD1-CD1 3.43Å; Y126-I243 VanDerWaalsContact CD1-CD1 3.43Å; Y126-I243 HydrophobicContact CD1-CG1 3.59Å; Y126-I243 HydrophobicContact CE1-CD1 3.83Å; Y126-I243 HydrophobicContact CE1-CG1 3.63Å; Y126-I243 HydrophobicContact CG-CD1 4.08Å; Y126-H244 HydrophobicContact CE1-CB 3.7Å; Y126-H244 AromaticContact CE1-ND1 3.75Å; Y126-H244 AromaticContact CZ-ND1 3.86Å
127	S	91.9	Very high	87.5	Confident	53 Å²	53	66.3 Å²	66.3	37%	0.371	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	161.2	166	-62.6	0	0	0	0	110.4	P129 W137	S127-P129 WeakPolarHBondContact O-CD 3.23Å; S127-W137 WeakPolarHBondContact CA-O 3.36Å
128	C	93.8	Very high	87.5	Confident	20 Å²	20	70.1 Å²	70.1	14%	0.135	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-51.9	124.7	169.7	179	0	0	0	0	110.4	C130 C135 W137 H147 H152	C128-C130 VanDerWaalsContact C-N 3.28Å; C128-C130 PolarHBondContact O-N 2.88Å; C128-C130 VanDerWaalsContact SG-CB 3.59Å; C128-C135 HydrophobicContact CB-CB 3.97Å; C128-W137 HydrophobicContact CB-CB 4.46Å; C128-W137 HydrophobicContact CB-CE3 4.39Å; C128-W137 PolarHBondContact N-O 3.01Å; C128-H147 PolarHBondContact SG-NE2 3.21Å; C128-H152 PolarHBondContact SG-NE2 3.06Å
129	P	92.9	Very high	87.5	Confident	17 Å²	17	70.3 Å²	70.3	11%	0.11	39%	0.386	C	S	.	.			trans	-81	-4.8	-178.3	31.9	-35.7	0	0	0	113.8	S127 P131 V144 L148 M190 I212 I243	S127-P129 WeakPolarHBondContact O-CD 3.23Å; P129-P131 WeakPolarHBondContact O-CD 3.4Å; P129-V144 HydrophobicContact CG-CG1 3.87Å; P129-L148 HydrophobicContact CG-CD1 3.98Å; P129-L148 HydrophobicContact CG-CD2 4.15Å; P129-L148 HydrophobicContact CG-CG 4.45Å; P129-M190 HydrophobicContact CB-CE 4.23Å; P129-M190 HydrophobicContact CB-SD 4.2Å; P129-M190 HydrophobicContact CG-CE 3.82Å; P129-M190 HydrophobicContact CG-SD 4.45Å; P129-I212 HydrophobicContact CB-CD1 4.45Å; P129-I212 HydrophobicContact CG-CD1 3.98Å; P129-I243 HydrophobicContact CB-CB 4.33Å; P129-I243 HydrophobicContact CB-CG2 3.58Å; P129-I243 HydrophobicContact CG-CG2 4.19Å
130	C	87.9	Confident	87.7	Confident	22 Å²	22	67.5 Å²	67.5	15%	0.149	38%	0.381	C	S	.	.			trans	-68.4	120.9	-177.3	-171	0	0	0	0	111.1	C128 A133 L148	C128-C130 VanDerWaalsContact C-N 3.28Å; C128-C130 PolarHBondContact O-N 2.88Å; C128-C130 VanDerWaalsContact SG-CB 3.59Å; C130-A133 HydrophobicContact CB-CB 4.12Å; C130-L148 HydrophobicContact CB-CD2 4.47Å
131	P	81.6	Confident	88	Confident	22 Å²	22	63.5 Å²	63.5	14%	0.143	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	155	173.4	29.1	-35.4	0	0	0	111	P129 A133 D177 V179 V192	P129-P131 WeakPolarHBondContact O-CD 3.4Å; P131-A133 PolarHBondContact O-N 2.62Å; P131-D177 HydrophobicContact CG-CB 4.47Å; P131-V179 HydrophobicContact CG-CG2 3.38Å; P131-V192 HydrophobicContact CB-CG1 4.39Å; P131-V192 HydrophobicContact CG-CG1 3.83Å; P131-V192 HydrophobicContact CG-CG2 4.04Å
132	G	69.1	Low	88.1	Confident	72 Å²	72	70 Å²	70	74%	0.742	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	-9.9	176	0	0	0	0	0	116.2	D177	G132-D177 WeakPolarHBondContact CA-OD2 3.24Å
133	A	62.7	Low	88.5	Confident	39 Å²	39	63.6 Å²	63.6	32%	0.322	37%	0.371	S	S	.	.			trans	-80.2	132.3	-177.7	0	0	0	0	0	111.2	C130 P131 C135	C130-A133 HydrophobicContact CB-CB 4.12Å; P131-A133 PolarHBondContact O-N 2.62Å; A133-C135 HydrophobicContact CB-CB 3.94Å; A133-C135 PolarHBondContact O-N 2.89Å
134	S	77.7	Confident	88.8	Confident	122 Å²	122	59.3 Å²	59.3	85%	0.853	35%	0.352	S	S	*	.			trans	-69.2	20.8	166.6	55.8	0	0	0	0	113.2	K136	S134-K136 PolarHBondContact O-N 3.11Å
135	C	90.4	Very high	89	Confident	44 Å²	44	56.7 Å²	56.7	30%	0.297	34%	0.343	S	S	.	.			trans	-74	119.4	-176.5	-172.1	0	0	0	0	110.3	C128 A133 W137 H147	C128-C135 HydrophobicContact CB-CB 3.97Å; A133-C135 HydrophobicContact CB-CB 3.94Å; A133-C135 PolarHBondContact O-N 2.89Å; C135-W137 VanDerWaalsContact SG-CB 3.59Å; C135-H147 PolarHBondContact SG-CE1 2.85Å
136	K	91.5	Very high	89.1	Confident	197 Å²	197	57.9 Å²	57.9	86%	0.857	35%	0.351	S	S	*	.			trans	-100.3	16.1	178.5	-60.2	-175.7	-179.3	179.5	0	112.9	S134	S134-K136 PolarHBondContact O-N 3.11Å
137	W	94.8	Very high	89.3	Confident	65 Å²	65	57.3 Å²	57.3	25%	0.246	35%	0.349	C	S	.	.			trans	-65.5	139.3	-179.2	178.7	88.5	0	0	0	110.7	S127 C128 C135 A143 V144 H147	S127-W137 WeakPolarHBondContact CA-O 3.36Å; C128-W137 HydrophobicContact CB-CB 4.46Å; C128-W137 HydrophobicContact CB-CE3 4.39Å; C128-W137 PolarHBondContact N-O 3.01Å; C135-W137 VanDerWaalsContact SG-CB 3.59Å; W137-A143 HydrophobicContact CH2-CB 4.09Å; W137-A143 HydrophobicContact CZ2-CB 3.69Å; W137-A143 WeakPolarHBondContact CZ2-O 3.34Å; W137-V144 HydrophobicContact CH2-CB 4.29Å; W137-V144 HydrophobicContact CH2-CG2 3.79Å; W137-V144 HydrophobicContact CZ3-CB 4.43Å; W137-V144 HydrophobicContact CZ3-CG2 3.88Å; W137-H147 VanDerWaalsContact CB-CE1 3.42Å; W137-H147 WeakPolarHBondContact CB-CE1 3.4Å; W137-H147 AromaticContact CD1-ND1 3.6Å; W137-H147 HydrophobicContact CD2-CB 3.89Å; W137-H147 AromaticContact CD2-CD2 3.65Å; W137-H147 AromaticContact CD2-CG 3.41Å; W137-H147 VanDerWaalsContact CD2-CG 3.41Å; W137-H147 AromaticContact CD2-ND1 3.67Å; W137-H147 AromaticContact CE2-CG 3.7Å; W137-H147 HydrophobicContact CE3-CB 4.26Å; W137-H147 AromaticContact CE3-CD2 3.53Å; W137-H147 AromaticContact CE3-CG 3.76Å; W137-H147 HydrophobicContact CG-CB 4.44Å; W137-H147 AromaticContact CG-CE1 3.56Å; W137-H147 AromaticContact CG-CG 3.68Å; W137-H147 AromaticContact CG-ND1 3.37Å; W137-H147 AromaticContact CG-NE2 3.95Å; W137-H147 HydrophobicContact CH2-CB 4.2Å; W137-H147 HydrophobicContact CZ2-CB 3.79Å; W137-H147 HydrophobicContact CZ3-CB 4.41Å; W137-H147 AromaticContact NE1-ND1 3.98Å
138	Q	93.5	Very high	89.4	Confident	126 Å²	126	55 Å²	55	59%	0.589	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.5	171.9	-66.7	-177.3	-0.5	0	0	109.4	P125 Y126	P125-Q138 HydrophobicContact CB-CB 4.35Å; Y126-Q138 CarbonylContact O-C 3.45Å; Y126-Q138 WeakPolarHBondContact O-CA 3.5Å
139	G	92.9	Very high	89.3	Confident	18 Å²	18	60.3 Å²	60.3	19%	0.186	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	-172.1	179.4	0	0	0	0	0	114.2	P125 Y126	P125-G139 CarbonylContact C-O 3.57Å; Y126-G139 PolarHBondContact N-O 3.35Å; Y126-G139 PolarHBondContact O-N 3.33Å
140	S	92.1	Very high	89.3	Confident	73 Å²	73	65.5 Å²	65.5	51%	0.51	38%	0.38	S	S	.	.			trans	-72.5	163	170.9	60.3	0	0	0	0	111.2	D142 A143 V144	S140-D142 VanDerWaalsContact C-N 3.31Å; S140-D142 PolarHBondContact O-N 3.48Å; S140-A143 WeakPolarHBondContact O-CB 3.24Å; S140-A143 PolarHBondContact O-N 3.38Å; S140-V144 PolarHBondContact O-N 3.33Å
141	L	91.9	Very high	89.6	Confident	40 Å²	40	71.2 Å²	71.2	21%	0.209	40%	0.404	C	S	.	.	H	α-helix	trans	-54	-47.2	178.3	-179.2	56.3	0	0	0	112.2	Y126 A143 V144 I212 T214 I243	Y126-L141 HydrophobicContact CD2-CB 4.01Å; Y126-L141 HydrophobicContact CE1-CD1 4.31Å; Y126-L141 HydrophobicContact CE2-CB 3.65Å; Y126-L141 HydrophobicContact CE2-CD1 4.24Å; Y126-L141 HydrophobicContact CE2-CG 4.41Å; L141-A143 PolarHBondContact O-N 3.09Å; L141-A143 VanDerWaalsContact O-N 3.13Å; L141-V144 WeakPolarHBondContact O-CB 3.43Å; L141-V144 WeakPolarHBondContact O-CG2 3.45Å; L141-V144 PolarHBondContact O-N 3.36Å; L141-I212 HydrophobicContact CD1-CG2 4.39Å; L141-T214 HydrophobicContact CD2-CG2 4.24Å; L141-I243 HydrophobicContact CD1-CD1 3.68Å; L141-I243 HydrophobicContact CD1-CG1 4.36Å
142	D	92.8	Very high	90.1	Very high	141 Å²	141	71.2 Å²	71.2	75%	0.754	40%	0.402	S	S	*	.	H	α-helix	trans	-64	-20.8	-178.9	-59	-26.1	0	0	0	113.2	S140 P146	S140-D142 VanDerWaalsContact C-N 3.31Å; S140-D142 PolarHBondContact O-N 3.48Å; D142-P146 WeakPolarHBondContact O-CD 3.4Å; D142-P146 WeakPolarHBondContact O-CG 3.34Å
143	A	95.4	Very high	90.9	Very high	33 Å²	33	76.1 Å²	76.1	27%	0.273	40%	0.403	S	S	.	.	H	α-helix	trans	-87.1	-11.2	178.2	0	0	0	0	0	113.2	W137 S140 L141 H147	W137-A143 HydrophobicContact CH2-CB 4.09Å; W137-A143 HydrophobicContact CZ2-CB 3.69Å; W137-A143 WeakPolarHBondContact CZ2-O 3.34Å; S140-A143 WeakPolarHBondContact O-CB 3.24Å; S140-A143 PolarHBondContact O-N 3.38Å; L141-A143 PolarHBondContact O-N 3.09Å; L141-A143 VanDerWaalsContact O-N 3.13Å; A143-H147 VanDerWaalsContact O-CB 3.24Å; A143-H147 WeakPolarHBondContact O-CB 3.36Å; A143-H147 PolarHBondContact O-N 3.03Å
144	V	95.7	Very high	92.1	Very high	0 Å²	0	79.5 Å²	79.5	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-65.9	-52.7	-176.6	178.5	0	0	0	0	111.7	Y126 P129 W137 S140 L141 H147 L148 I212 I243	Y126-V144 HydrophobicContact CG-CG2 4.35Å; P129-V144 HydrophobicContact CG-CG1 3.87Å; W137-V144 HydrophobicContact CH2-CB 4.29Å; W137-V144 HydrophobicContact CH2-CG2 3.79Å; W137-V144 HydrophobicContact CZ3-CB 4.43Å; W137-V144 HydrophobicContact CZ3-CG2 3.88Å; S140-V144 PolarHBondContact O-N 3.33Å; L141-V144 WeakPolarHBondContact O-CB 3.43Å; L141-V144 WeakPolarHBondContact O-CG2 3.45Å; L141-V144 PolarHBondContact O-N 3.36Å; V144-H147 WeakPolarHBondContact O-CB 2.94Å; V144-H147 PolarHBondContact O-N 3.4Å; V144-H147 VanDerWaalsContact O-N 3.17Å; V144-L148 HydrophobicContact CG1-CD1 4.17Å; V144-L148 HydrophobicContact CG1-CG 4.47Å; V144-L148 WeakPolarHBondContact O-CG 3.39Å; V144-L148 PolarHBondContact O-N 2.93Å; V144-I212 HydrophobicContact CB-CG2 4.09Å; V144-I212 HydrophobicContact CG1-CD1 4.44Å; V144-I212 HydrophobicContact CG1-CG2 3.86Å; V144-I243 HydrophobicContact CB-CD1 4.36Å; V144-I243 HydrophobicContact CG1-CD1 4.05Å; V144-I243 HydrophobicContact CG2-CD1 3.85Å
145	M	95.1	Very high	92.8	Very high	26 Å²	26	74.7 Å²	74.7	13%	0.128	39%	0.389	C	S	.	.	H	α-helix	trans	-62.8	-47	179.9	-76	-57.6	-60.9	0	0	112.8	H147 L148 M149 M181 H188 I212	M145-H147 VanDerWaalsContact C-N 3.27Å; M145-H147 PolarHBondContact O-N 3.37Å; M145-L148 PolarHBondContact O-N 3.37Å; M145-L148 HydrophobicContact SD-CD1 4.09Å; M145-M149 WeakPolarHBondContact O-CG 3.38Å; M145-M149 PolarHBondContact O-N 3.45Å; M145-M181 HydrophobicContact CE-CE 4.37Å; M145-M181 HydrophobicContact SD-CE 3.96Å; M145-H188 HydrophobicContact CE-CB 3.96Å; M145-H188 HydrophobicContact CG-CB 4.36Å; M145-H188 HydrophobicContact SD-CB 3.63Å; M145-I212 HydrophobicContact CG-CG2 3.96Å; M145-I212 HydrophobicContact SD-CB 4.38Å; M145-I212 HydrophobicContact SD-CG1 3.9Å; M145-I212 HydrophobicContact SD-CG2 4.17Å
146	P	95.8	Very high	92.9	Very high	61 Å²	61	76.4 Å²	76.4	40%	0.396	40%	0.398	S	S	.	.	H	α-helix	trans	-53	-45.3	170.2	-27.9	34.8	0	0	0	112.3	D142 L148 M149 H150	D142-P146 WeakPolarHBondContact O-CD 3.4Å; D142-P146 WeakPolarHBondContact O-CG 3.34Å; P146-L148 PolarHBondContact O-N 3.39Å; P146-M149 PolarHBondContact O-N 3.26Å; P146-H150 PolarHBondContact O-N 3.09Å; P146-H150 VanDerWaalsContact O-N 3.14Å; P146-H150 PolarHBondContact O-ND1 3.47Å
147	H	95.6	Very high	93.1	Very high	12 Å²	12	70 Å²	70	6%	0.056	38%	0.376	C	S	.	.	H	α-helix	trans	-57.5	-49.7	177.1	162	65.7	0	0	0	112.3	C128 C135 W137 A143 V144 M145 M149 H150 Q151 H152	C128-H147 PolarHBondContact SG-NE2 3.21Å; C135-H147 PolarHBondContact SG-CE1 2.85Å; W137-H147 VanDerWaalsContact CB-CE1 3.42Å; W137-H147 WeakPolarHBondContact CB-CE1 3.4Å; W137-H147 AromaticContact CD1-ND1 3.6Å; W137-H147 HydrophobicContact CD2-CB 3.89Å; W137-H147 AromaticContact CD2-CD2 3.65Å; W137-H147 AromaticContact CD2-CG 3.41Å; W137-H147 VanDerWaalsContact CD2-CG 3.41Å; W137-H147 AromaticContact CD2-ND1 3.67Å; W137-H147 AromaticContact CE2-CG 3.7Å; W137-H147 HydrophobicContact CE3-CB 4.26Å; W137-H147 AromaticContact CE3-CD2 3.53Å; W137-H147 AromaticContact CE3-CG 3.76Å; W137-H147 HydrophobicContact CG-CB 4.44Å; W137-H147 AromaticContact CG-CE1 3.56Å; W137-H147 AromaticContact CG-CG 3.68Å; W137-H147 AromaticContact CG-ND1 3.37Å; W137-H147 AromaticContact CG-NE2 3.95Å; W137-H147 HydrophobicContact CH2-CB 4.2Å; W137-H147 HydrophobicContact CZ2-CB 3.79Å; W137-H147 HydrophobicContact CZ3-CB 4.41Å; W137-H147 AromaticContact NE1-ND1 3.98Å; A143-H147 VanDerWaalsContact O-CB 3.24Å; A143-H147 WeakPolarHBondContact O-CB 3.36Å; A143-H147 PolarHBondContact O-N 3.03Å; V144-H147 WeakPolarHBondContact O-CB 2.94Å; V144-H147 PolarHBondContact O-N 3.4Å; V144-H147 VanDerWaalsContact O-N 3.17Å; M145-H147 VanDerWaalsContact C-N 3.27Å; M145-H147 PolarHBondContact O-N 3.37Å; H147-M149 PolarHBondContact O-N 2.98Å; H147-H150 PolarHBondContact O-N 3.34Å; H147-Q151 WeakPolarHBondContact O-CB 3.48Å; H147-Q151 PolarHBondContact O-N 3.23Å; H147-H152 AromaticContact CE1-CD2 3.91Å; H147-H152 AromaticContact CE1-NE2 3.65Å; H147-H152 AromaticContact NE2-CD2 3.62Å; H147-H152 AromaticContact NE2-NE2 3.34Å; H147-H152 PolarHBondContact NE2-NE2 3.15Å
148	L	94.3	Very high	93.2	Very high	6 Å²	6	69.9 Å²	69.9	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-46.1	179.4	-68.9	174.3	0	0	0	111.8	P129 C130 V144 M145 P146 H150 H152 I155 M181 M190 I212	P129-L148 HydrophobicContact CG-CD1 3.98Å; P129-L148 HydrophobicContact CG-CD2 4.15Å; P129-L148 HydrophobicContact CG-CG 4.45Å; C130-L148 HydrophobicContact CB-CD2 4.47Å; V144-L148 HydrophobicContact CG1-CD1 4.17Å; V144-L148 HydrophobicContact CG1-CG 4.47Å; V144-L148 WeakPolarHBondContact O-CG 3.39Å; V144-L148 PolarHBondContact O-N 2.93Å; M145-L148 PolarHBondContact O-N 3.37Å; M145-L148 HydrophobicContact SD-CD1 4.09Å; P146-L148 PolarHBondContact O-N 3.39Å; L148-H150 VanDerWaalsContact C-N 3.27Å; L148-H150 PolarHBondContact O-N 3.49Å; L148-H152 HydrophobicContact CD2-CB 4.5Å; L148-H152 CarbonylContact O-C 3.53Å; L148-H152 VanDerWaalsContact O-CA 3.28Å; L148-H152 WeakPolarHBondContact O-CA 3.28Å; L148-H152 WeakPolarHBondContact O-CB 3.32Å; L148-H152 PolarHBondContact O-N 3.06Å; L148-I155 HydrophobicContact CD2-CD1 4.31Å; L148-M181 HydrophobicContact CD1-SD 4.42Å; L148-M190 HydrophobicContact CD1-CE 3.72Å; L148-M190 HydrophobicContact CD2-CE 4.08Å; L148-I212 HydrophobicContact CD1-CD1 4.32Å
149	M	92.3	Very high	93.4	Very high	130 Å²	130	70.6 Å²	70.6	64%	0.64	38%	0.382	S	S	*	.	H	α-helix	trans	-62.9	-32.6	179.8	-67.8	176.1	71.3	0	0	113.2	M145 P146 H147	M145-M149 WeakPolarHBondContact O-CG 3.38Å; M145-M149 PolarHBondContact O-N 3.45Å; P146-M149 PolarHBondContact O-N 3.26Å; H147-M149 PolarHBondContact O-N 2.98Å
150	H	92.6	Very high	93.7	Very high	127 Å²	127	71.2 Å²	71.2	59%	0.588	39%	0.389	S	S	*	.	H	α-helix	trans	-89.3	-41.6	-176.5	-71	87	0	0	0	113.2	P146 H147 L148 K153	P146-H150 PolarHBondContact O-N 3.09Å; P146-H150 VanDerWaalsContact O-N 3.14Å; P146-H150 PolarHBondContact O-ND1 3.47Å; H147-H150 PolarHBondContact O-N 3.34Å; L148-H150 VanDerWaalsContact C-N 3.27Å; L148-H150 PolarHBondContact O-N 3.49Å; H150-K153 WeakPolarHBondContact O-CE 3.34Å
151	Q	93.2	Very high	93.9	Very high	142 Å²	142	72.9 Å²	72.9	66%	0.664	39%	0.389	S	S	*	.	H	α-helix	trans	-98.8	-20.9	-172.6	-61.1	-63.2	-31	0	0	113.1	H147	H147-Q151 WeakPolarHBondContact O-CB 3.48Å; H147-Q151 PolarHBondContact O-N 3.23Å
152	H	92	Very high	94.2	Very high	22 Å²	22	76 Å²	76	10%	0.102	41%	0.406	C	S	.	.			trans	-123	53.4	-177.1	-59.2	-93.5	0	0	0	111.7	C128 H147 L148 S154 I155	C128-H152 PolarHBondContact SG-NE2 3.06Å; H147-H152 AromaticContact CE1-CD2 3.91Å; H147-H152 AromaticContact CE1-NE2 3.65Å; H147-H152 AromaticContact NE2-CD2 3.62Å; H147-H152 AromaticContact NE2-NE2 3.34Å; H147-H152 PolarHBondContact NE2-NE2 3.15Å; L148-H152 HydrophobicContact CD2-CB 4.5Å; L148-H152 CarbonylContact O-C 3.53Å; L148-H152 VanDerWaalsContact O-CA 3.28Å; L148-H152 WeakPolarHBondContact O-CA 3.28Å; L148-H152 WeakPolarHBondContact O-CB 3.32Å; L148-H152 PolarHBondContact O-N 3.06Å; H152-S154 PolarHBondContact O-N 3.34Å; H152-I155 HydrophobicContact CB-CD1 3.51Å; H152-I155 HydrophobicContact CB-CG1 3.94Å; H152-I155 WeakPolarHBondContact O-CB 3.06Å; H152-I155 WeakPolarHBondContact O-CG1 3.36Å; H152-I155 PolarHBondContact O-N 3.12Å
153	K	87.7	Confident	94.5	Very high	174 Å²	174	70.1 Å²	70.1	76%	0.757	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.3	-174.8	-62.5	-178.2	-178.6	179.3	0	115.1	H150	H150-K153 WeakPolarHBondContact O-CE 3.34Å
154	S	87.8	Confident	94.6	Very high	110 Å²	110	72.3 Å²	72.3	77%	0.769	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-15.1	176.1	54.3	0	0	0	0	113.1	H152 T156	H152-S154 PolarHBondContact O-N 3.34Å; S154-T156 PolarHBondContact O-N 2.84Å
155	I	91.3	Very high	94.7	Very high	22 Å²	22	72.6 Å²	72.6	11%	0.113	39%	0.385	C	S	.	.			trans	-77.9	107.9	179.5	-55.4	177.2	0	0	0	108.9	L148 H152 V179 M181	L148-I155 HydrophobicContact CD2-CD1 4.31Å; H152-I155 HydrophobicContact CB-CD1 3.51Å; H152-I155 HydrophobicContact CB-CG1 3.94Å; H152-I155 WeakPolarHBondContact O-CB 3.06Å; H152-I155 WeakPolarHBondContact O-CG1 3.36Å; H152-I155 PolarHBondContact O-N 3.12Å; I155-V179 HydrophobicContact CD1-CG1 4.19Å; I155-V179 HydrophobicContact CG1-CG1 4.47Å; I155-V179 HydrophobicContact CG2-CG1 4.23Å; I155-M181 HydrophobicContact CG2-CB 4.43Å; I155-M181 HydrophobicContact CG2-CG 3.64Å
156	T	93.6	Very high	94.8	Very high	80 Å²	80	75.7 Å²	75.7	49%	0.491	40%	0.401	S	S	.	.			trans	-67.5	139	174.1	-56.4	0	0	0	0	110.4	S154 L158 M181	S154-T156 PolarHBondContact O-N 2.84Å; T156-L158 HydrophobicContact CG2-CD2 4.28Å; T156-M181 PolarHBondContact O-N 3.31Å
157	T	95.4	Very high	94.8	Very high	63 Å²	63	72.8 Å²	72.8	39%	0.387	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.7	172.7	-55.7	0	0	0	0	110.2	M181	T157-M181 CarbonylContact C-O 3.53Å; T157-M181 VanDerWaalsContact CA-O 3.28Å; T157-M181 WeakPolarHBondContact CA-O 3.47Å; T157-M181 HydrophobicContact CG2-CB 4.02Å
158	L	97	Very high	94.8	Very high	61 Å²	61	75.2 Å²	75.2	32%	0.319	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	146.5	173	-63.2	-175.8	0	0	0	110.8	T156 I163 M180 M181 Q182 S183	T156-L158 HydrophobicContact CG2-CD2 4.28Å; L158-I163 HydrophobicContact CB-CD1 4.07Å; L158-I163 HydrophobicContact CB-CG2 4.36Å; L158-I163 HydrophobicContact CD1-CD1 4.15Å; L158-M180 HydrophobicContact CD1-CE 4.19Å; L158-M180 HydrophobicContact CD1-SD 3.61Å; L158-M180 HydrophobicContact CG-SD 4.03Å; L158-M181 PolarHBondContact N-O 2.93Å; L158-Q182 CarbonylContact O-C 3.59Å; L158-Q182 WeakPolarHBondContact O-CA 3.18Å; L158-S183 PolarHBondContact O-N 3.17Å
159	Q	97.8	Very high	94.8	Very high	141 Å²	141	79.3 Å²	79.3	66%	0.659	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	142.3	177.4	-65.1	-68.3	-26.6	0	0	109.8	S183	Q159-S183 WeakPolarHBondContact CA-O 3.47Å; Q159-S183 VanDerWaalsContact NE2-CB 3.32Å; Q159-S183 PolarHBondContact NE2-OG 3.24Å; Q159-S183 VanDerWaalsContact NE2-OG 3.14Å; Q159-S183 VanDerWaalsContact OE1-CB 3.31Å; Q159-S183 PolarHBondContact OE1-O 2.98Å; Q159-S183 PolarHBondContact OE1-OG 3.44Å
160	G	97.7	Very high	94.9	Very high	31 Å²	31	73.1 Å²	73.1	32%	0.32	39%	0.39	S	S	.	.	S	Bend	trans	121.9	154.3	176.7	0	0	0	0	0	112.9	Q182 S183	G160-Q182 WeakPolarHBondContact O-CG 3.43Å; G160-Q182 PolarHBondContact O-NE2 2.94Å; G160-S183 PolarHBondContact N-O 3.29Å
161	E	97.2	Very high	94.9	Very high	109 Å²	109	71.1 Å²	71.1	51%	0.509	38%	0.383	S	S	.	.	S	Bend	trans	-79.7	-22.2	179.1	65.8	-173.6	-151.9	0	0	113.1	Q182 C184 F185 T278 I279	E161-Q182 PolarHBondContact O-NE2 2.94Å; E161-Q182 VanDerWaalsContact O-NE2 3.12Å; E161-C184 HydrophobicContact CB-CB 4.29Å; E161-F185 HydrophobicContact CB-CE2 4Å; E161-F185 HydrophobicContact CB-CZ 3.94Å; E161-F185 WeakPolarHBondContact OE2-CZ 3.47Å; E161-T278 CarbonylContact O-C 3.48Å; E161-T278 VanDerWaalsContact O-CA 3.27Å; E161-T278 WeakPolarHBondContact O-CA 3.45Å; E161-I279 PolarHBondContact O-N 3.5Å
162	D	97.8	Very high	94.8	Very high	105 Å²	105	68.4 Å²	68.4	56%	0.561	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	115.4	177.4	-164.8	25.8	0	0	0	110	V277 T278	D162-V277 WeakPolarHBondContact CA-O 3.48Å; D162-T278 HydrophobicContact CB-CG2 4.45Å; D162-T278 PolarHBondContact OD1-OG1 3.24Å
163	I	98.4	Very high	94.7	Very high	17 Å²	17	72.7 Å²	72.7	9%	0.087	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	168.9	-175.9	67	166.1	0	0	0	111.2	L158 M180 Q182 L191 V277	L158-I163 HydrophobicContact CB-CD1 4.07Å; L158-I163 HydrophobicContact CB-CG2 4.36Å; L158-I163 HydrophobicContact CD1-CD1 4.15Å; I163-M180 HydrophobicContact CD1-SD 4.35Å; I163-Q182 HydrophobicContact CD1-CB 3.78Å; I163-Q182 HydrophobicContact CD1-CG 3.68Å; I163-Q182 HydrophobicContact CG1-CG 4.22Å; I163-L191 HydrophobicContact CD1-CD1 3.9Å; I163-V277 HydrophobicContact CG1-CB 4.12Å; I163-V277 PolarHBondContact N-O 3.45Å; I163-V277 PolarHBondContact O-N 3.12Å
164	V	97.9	Very high	94.7	Very high	79 Å²	79	65.6 Å²	65.6	48%	0.479	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	117.3	170.1	-173.8	0	0	0	0	109.4
165	F	97.8	Very high	94.8	Very high	7 Å²	7	64.1 Å²	64.1	3%	0.031	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	108.6	169.3	173.7	-153.4	0	0	0	109.3	W178 M180 L191 L193 I275 V277	F165-W178 HydrophobicContact CE2-CB 4.11Å; F165-W178 HydrophobicContact CZ-CB 3.6Å; F165-M180 HydrophobicContact CB-SD 4.39Å; F165-M180 HydrophobicContact CD2-CB 3.94Å; F165-M180 HydrophobicContact CD2-CE 3.94Å; F165-M180 HydrophobicContact CD2-SD 3.99Å; F165-M180 HydrophobicContact CE2-CB 3.96Å; F165-L191 HydrophobicContact CB-CD1 4.06Å; F165-L191 HydrophobicContact CD1-CB 4.1Å; F165-L191 HydrophobicContact CD1-CD1 4.45Å; F165-L191 HydrophobicContact CE1-CB 4.25Å; F165-L191 HydrophobicContact CG-CD1 4.34Å; F165-L193 HydrophobicContact CE1-CB 3.84Å; F165-L193 HydrophobicContact CZ-CB 4.17Å; F165-I275 HydrophobicContact CB-CB 4.37Å; F165-I275 HydrophobicContact CD1-CD1 4.25Å; F165-I275 PolarHBondContact N-O 3.44Å; F165-I275 PolarHBondContact O-N 2.97Å; F165-V277 HydrophobicContact CB-CG2 3.97Å
166	L	96.9	Very high	94.8	Very high	90 Å²	90	64.7 Å²	64.7	47%	0.471	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	108	179	-171.9	67.9	0	0	0	110.7	T168 N272	L166-T168 HydrophobicContact CD2-CG2 4.36Å; L166-T168 HydrophobicContact CG-CG2 4.35Å; L166-N272 HydrophobicContact CD1-CB 3.87Å; L166-N272 HydrophobicContact CG-CB 4.42Å
167	A	96.8	Very high	94.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.1	170.2	0	0	0	0	0	109.7	I170 W178 L193 N272 L273	A167-I170 HydrophobicContact CB-CG2 3.99Å; A167-W178 HydrophobicContact CB-CB 4.4Å; A167-W178 HydrophobicContact CB-CD2 4.12Å; A167-W178 HydrophobicContact CB-CG 3.91Å; A167-L193 HydrophobicContact CB-CD2 3.42Å; A167-L193 VanDerWaalsContact CB-CD2 3.42Å; A167-N272 CarbonylContact O-C 3.34Å; A167-N272 WeakPolarHBondContact O-CA 3.41Å; A167-L273 HydrophobicContact CB-CB 4.41Å; A167-L273 PolarHBondContact N-O 3.26Å; A167-L273 PolarHBondContact O-N 3.15Å
168	T	95.6	Very high	94.8	Very high	64 Å²	64	62 Å²	62	39%	0.393	36%	0.356	S	S	.	.			trans	-87.3	145.4	-177.8	56.7	0	0	0	0	112	L166 I170 W178 N272	L166-T168 HydrophobicContact CD2-CG2 4.36Å; L166-T168 HydrophobicContact CG-CG2 4.35Å; T168-I170 PolarHBondContact O-N 3.33Å; T168-W178 WeakPolarHBondContact O-CZ2 3.4Å; T168-W178 PolarHBondContact O-NE1 2.97Å; T168-N272 VanDerWaalsContact CA-OD1 3.24Å; T168-N272 WeakPolarHBondContact CA-OD1 3.26Å
169	D	94.4	Very high	94.7	Very high	92 Å²	92	60.6 Å²	60.6	49%	0.492	35%	0.35	S	S	.	.			trans	55	49	175.2	-58.1	-56.3	0	0	0	114.2	N171 L172 G271 N272	D169-N171 PolarHBondContact O-N 3.13Å; D169-L172 HydrophobicContact CB-CD1 3.91Å; D169-L172 HydrophobicContact CB-CG 3.91Å; D169-L172 WeakPolarHBondContact O-CG 3.43Å; D169-L172 PolarHBondContact O-N 3.04Å; D169-G271 WeakPolarHBondContact CA-O 3.33Å; D169-G271 PolarHBondContact N-O 3.27Å; D169-N272 PolarHBondContact N-OD1 3.21Å
170	I	94.8	Very high	94.6	Very high	0 Å²	0	55 Å²	55	0%	0	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.7	-177.5	60	155.7	0	0	0	114.3	A167 T168 W178 K195 F205 A264 A268 G271 L273	A167-I170 HydrophobicContact CB-CG2 3.99Å; T168-I170 PolarHBondContact O-N 3.33Å; I170-W178 HydrophobicContact CG2-CZ2 4.34Å; I170-K195 PolarHBondContact O-NZ 3.06Å; I170-F205 HydrophobicContact CB-CE1 4.17Å; I170-F205 HydrophobicContact CB-CZ 4.23Å; I170-A264 HydrophobicContact CD1-CB 3.82Å; I170-A268 HydrophobicContact CD1-CB 3.76Å; I170-G271 WeakPolarHBondContact CG1-O 3.29Å; I170-G271 PolarHBondContact N-O 3.33Å; I170-L273 HydrophobicContact CD1-CB 4.31Å; I170-L273 HydrophobicContact CG2-CB 3.77Å
171	N	92.1	Very high	94.6	Very high	84 Å²	84	53.7 Å²	53.7	45%	0.449	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.9	-179.1	-63.5	-31.9	0	0	0	113.9	D169 Q265	D169-N171 PolarHBondContact O-N 3.13Å; N171-Q265 PolarHBondContact OD1-NE2 3.13Å
172	L	91.4	Very high	94.7	Very high	86 Å²	86	48.5 Å²	48.5	45%	0.45	29%	0.285	S	S	.	.			trans	-53.7	134.3	177.2	-79.2	171.1	0	0	0	111.4	D169 V176 K195	D169-L172 HydrophobicContact CB-CD1 3.91Å; D169-L172 HydrophobicContact CB-CG 3.91Å; D169-L172 WeakPolarHBondContact O-CG 3.43Å; D169-L172 PolarHBondContact O-N 3.04Å; L172-V176 HydrophobicContact CB-CG2 4.18Å; L172-K195 WeakPolarHBondContact O-CE 3.33Å; L172-K195 PolarHBondContact O-NZ 2.87Å
173	P	89.2	Confident	94.7	Very high	112 Å²	112	44 Å²	44	73%	0.727	26%	0.262	S	S	*	.	S	Bend	trans	-66.6	148.8	-177.7	27.9	-34.6	0	0	0	112.1
174	G	87.9	Confident	94.7	Very high	24 Å²	24	43.8 Å²	43.8	25%	0.247	26%	0.262	C	S	.	.	S	Bend	trans	83.2	-170.2	177.3	0	0	0	0	0	114.6	K195	G174-K195 WeakPolarHBondContact O-CE 3.28Å
175	A	89.6	Confident	94.7	Very high	80 Å²	80	43.4 Å²	43.4	66%	0.661	25%	0.254	S	S	*	.			trans	-77.8	131.5	177	0	0	0	0	0	110.9	K195	A175-K195 VanDerWaalsContact CA-O 3.24Å; A175-K195 WeakPolarHBondContact CA-O 3.44Å; A175-K195 WeakPolarHBondContact CB-O 3.48Å
176	V	91.9	Very high	94.6	Very high	33 Å²	33	46.7 Å²	46.7	20%	0.2	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	138.9	-175.9	-176.4	0	0	0	0	109.2	L172 W178 K195	L172-V176 HydrophobicContact CB-CG2 4.18Å; V176-W178 HydrophobicContact CB-CH2 3.64Å; V176-W178 HydrophobicContact CB-CZ2 4.29Å; V176-W178 HydrophobicContact CB-CZ3 3.77Å; V176-W178 HydrophobicContact CG1-CD2 4.27Å; V176-W178 HydrophobicContact CG1-CE3 4.13Å; V176-W178 HydrophobicContact CG1-CH2 3.52Å; V176-W178 HydrophobicContact CG1-CZ2 3.66Å; V176-W178 HydrophobicContact CG1-CZ3 3.76Å; V176-W178 WeakPolarHBondContact O-CZ3 3.15Å; V176-K195 PolarHBondContact N-O 3.34Å; V176-K195 PolarHBondContact O-N 2.89Å
177	D	92.8	Very high	94.7	Very high	59 Å²	59	45.1 Å²	45.1	32%	0.316	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133	177.8	-58.6	-43.5	0	0	0	110.5	P131 G132 E194	P131-D177 HydrophobicContact CG-CB 4.47Å; G132-D177 WeakPolarHBondContact CA-OD2 3.24Å; D177-E194 VanDerWaalsContact OD1-CG 3.29Å; D177-E194 WeakPolarHBondContact OD1-CG 3.48Å
178	W	95.2	Very high	94.8	Very high	27 Å²	27	47.9 Å²	47.9	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.3	166.9	-62.6	-102.2	0	0	0	109.2	F165 A167 T168 I170 V176 V192 L193 K195 F205	F165-W178 HydrophobicContact CE2-CB 4.11Å; F165-W178 HydrophobicContact CZ-CB 3.6Å; A167-W178 HydrophobicContact CB-CB 4.4Å; A167-W178 HydrophobicContact CB-CD2 4.12Å; A167-W178 HydrophobicContact CB-CG 3.91Å; T168-W178 WeakPolarHBondContact O-CZ2 3.4Å; T168-W178 PolarHBondContact O-NE1 2.97Å; I170-W178 HydrophobicContact CG2-CZ2 4.34Å; V176-W178 HydrophobicContact CB-CH2 3.64Å; V176-W178 HydrophobicContact CB-CZ2 4.29Å; V176-W178 HydrophobicContact CB-CZ3 3.77Å; V176-W178 HydrophobicContact CG1-CD2 4.27Å; V176-W178 HydrophobicContact CG1-CE3 4.13Å; V176-W178 HydrophobicContact CG1-CH2 3.52Å; V176-W178 HydrophobicContact CG1-CZ2 3.66Å; V176-W178 HydrophobicContact CG1-CZ3 3.76Å; V176-W178 WeakPolarHBondContact O-CZ3 3.15Å; W178-V192 WeakPolarHBondContact O-CA 3.35Å; W178-L193 HydrophobicContact CB-CB 4.28Å; W178-L193 HydrophobicContact CD2-CD2 4.33Å; W178-L193 HydrophobicContact CE3-CB 4.46Å; W178-L193 HydrophobicContact CE3-CD2 3.93Å; W178-L193 HydrophobicContact CE3-CG 4.1Å; W178-L193 HydrophobicContact CZ3-CD2 4.46Å; W178-L193 PolarHBondContact N-O 3.21Å; W178-L193 PolarHBondContact O-N 3.18Å; W178-K195 HydrophobicContact CZ3-CB 3.99Å; W178-F205 HydrophobicContact CZ3-CE1 4.38Å
179	V	95.7	Very high	94.9	Very high	33 Å²	33	44.8 Å²	44.8	20%	0.2	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.8	-176.9	-172.7	0	0	0	0	110	P131 I155 M190 L191	P131-V179 HydrophobicContact CG-CG2 3.38Å; I155-V179 HydrophobicContact CD1-CG1 4.19Å; I155-V179 HydrophobicContact CG1-CG1 4.47Å; I155-V179 HydrophobicContact CG2-CG1 4.23Å; V179-M190 HydrophobicContact CG1-CE 4.31Å; V179-M190 HydrophobicContact CG1-CG 3.75Å; V179-M190 HydrophobicContact CG1-SD 3.91Å; V179-L191 WeakPolarHBondContact CA-O 3.46Å
180	M	96.3	Very high	95	Very high	22 Å²	22	40.4 Å²	40.4	11%	0.108	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.4	174.4	-179	174.2	-74.8	0	0	109.9	L158 I163 F165 L191	L158-M180 HydrophobicContact CD1-CE 4.19Å; L158-M180 HydrophobicContact CD1-SD 3.61Å; L158-M180 HydrophobicContact CG-SD 4.03Å; I163-M180 HydrophobicContact CD1-SD 4.35Å; F165-M180 HydrophobicContact CB-SD 4.39Å; F165-M180 HydrophobicContact CD2-CB 3.94Å; F165-M180 HydrophobicContact CD2-CE 3.94Å; F165-M180 HydrophobicContact CD2-SD 3.99Å; F165-M180 HydrophobicContact CE2-CB 3.96Å; M180-L191 HydrophobicContact CB-CB 4.41Å; M180-L191 HydrophobicContact CB-CD1 4.48Å; M180-L191 PolarHBondContact N-O 3.47Å; M180-L191 PolarHBondContact O-N 2.88Å
181	M	97.4	Very high	95.2	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.02	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	133.4	169.3	-65.9	-54.4	-59.4	0	0	110.5	M145 L148 I155 T156 T157 L158 H188 F189 M190 I212	M145-M181 HydrophobicContact CE-CE 4.37Å; M145-M181 HydrophobicContact SD-CE 3.96Å; L148-M181 HydrophobicContact CD1-SD 4.42Å; I155-M181 HydrophobicContact CG2-CB 4.43Å; I155-M181 HydrophobicContact CG2-CG 3.64Å; T156-M181 PolarHBondContact O-N 3.31Å; T157-M181 CarbonylContact C-O 3.53Å; T157-M181 VanDerWaalsContact CA-O 3.28Å; T157-M181 WeakPolarHBondContact CA-O 3.47Å; T157-M181 HydrophobicContact CG2-CB 4.02Å; L158-M181 PolarHBondContact N-O 2.93Å; M181-H188 HydrophobicContact CE-CB 3.69Å; M181-F189 CarbonylContact C-O 3.57Å; M181-F189 WeakPolarHBondContact CA-O 3.42Å; M181-M190 HydrophobicContact CE-CB 4.19Å; M181-M190 HydrophobicContact SD-CB 3.65Å; M181-M190 HydrophobicContact SD-CE 3.6Å; M181-M190 HydrophobicContact SD-CG 3.91Å; M181-I212 HydrophobicContact CE-CD1 4.21Å; M181-I212 HydrophobicContact CE-CG1 3.69Å
182	Q	98.3	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	136	167.8	-177.8	173.9	4.4	0	0	109.3	L158 G160 E161 I163 H188 F189 L191 V277 I279	L158-Q182 CarbonylContact O-C 3.59Å; L158-Q182 WeakPolarHBondContact O-CA 3.18Å; G160-Q182 WeakPolarHBondContact O-CG 3.43Å; G160-Q182 PolarHBondContact O-NE2 2.94Å; E161-Q182 PolarHBondContact O-NE2 2.94Å; E161-Q182 VanDerWaalsContact O-NE2 3.12Å; I163-Q182 HydrophobicContact CD1-CB 3.78Å; I163-Q182 HydrophobicContact CD1-CG 3.68Å; I163-Q182 HydrophobicContact CG1-CG 4.22Å; Q182-H188 CarbonylContact O-C 3.59Å; Q182-H188 WeakPolarHBondContact O-CA 3.43Å; Q182-F189 HydrophobicContact CB-CB 4.46Å; Q182-F189 PolarHBondContact N-O 3.49Å; Q182-F189 PolarHBondContact O-N 2.82Å; Q182-L191 HydrophobicContact CB-CD1 4.26Å; Q182-L191 HydrophobicContact CB-CG 4.4Å; Q182-V277 VanDerWaalsContact OE1-CG1 3.23Å; Q182-I279 HydrophobicContact CG-CD1 4.16Å
183	S	98.3	Very high	95.7	Very high	11 Å²	11	32.5 Å²	32.5	8%	0.077	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.6	-178.5	176	0	0	0	0	110	L158 Q159 G160 F187	L158-S183 PolarHBondContact O-N 3.17Å; Q159-S183 WeakPolarHBondContact CA-O 3.47Å; Q159-S183 VanDerWaalsContact NE2-CB 3.32Å; Q159-S183 PolarHBondContact NE2-OG 3.24Å; Q159-S183 VanDerWaalsContact NE2-OG 3.14Å; Q159-S183 VanDerWaalsContact OE1-CB 3.31Å; Q159-S183 PolarHBondContact OE1-O 2.98Å; Q159-S183 PolarHBondContact OE1-OG 3.44Å; G160-S183 PolarHBondContact N-O 3.29Å; S183-F187 WeakPolarHBondContact CA-O 3.46Å
184	C	98.4	Very high	96	Very high	12 Å²	12	29.1 Å²	29.1	8%	0.081	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	158.8	179.4	56.5	0	0	0	0	110.3	E161 G186 F187 F189	E161-C184 HydrophobicContact CB-CB 4.29Å; C184-G186 PolarHBondContact O-N 3.45Å; C184-F187 PolarHBondContact N-O 3.01Å; C184-F187 VanDerWaalsContact N-O 3.14Å; C184-F187 PolarHBondContact O-N 3.4Å; C184-F187 VanDerWaalsContact O-O 3.08Å; C184-F189 VanDerWaalsContact SG-CE2 3.58Å
185	F	97.9	Very high	96.3	Very high	71 Å²	71	28 Å²	28	31%	0.311	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	21.7	-179.2	-50	-69.3	0	0	0	115.6	E161 F187 F221 I279 M281	E161-F185 HydrophobicContact CB-CE2 4Å; E161-F185 HydrophobicContact CB-CZ 3.94Å; E161-F185 WeakPolarHBondContact OE2-CZ 3.47Å; F185-F187 VanDerWaalsContact C-N 3.27Å; F185-F187 HydrophobicContact CB-CD2 4.45Å; F185-F187 VanDerWaalsContact O-CD2 3.24Å; F185-F187 WeakPolarHBondContact O-CD2 3.38Å; F185-F187 PolarHBondContact O-N 3.14Å; F185-F221 HydrophobicContact CB-CE1 3.82Å; F185-F221 HydrophobicContact CB-CZ 4.18Å; F185-F221 HydrophobicContact CD2-CD1 4.24Å; F185-F221 AromaticContact CD2-CE1 3.77Å; F185-F221 HydrophobicContact CD2-CE1 3.77Å; F185-F221 AromaticContact CG-CE1 3.93Å; F185-F221 HydrophobicContact CG-CE1 3.93Å; F185-I279 HydrophobicContact CD2-CG2 4.25Å; F185-I279 HydrophobicContact CE2-CB 4.48Å; F185-I279 HydrophobicContact CE2-CG2 4.06Å; F185-I279 WeakPolarHBondContact CE2-O 3.24Å; F185-M281 HydrophobicContact CD1-CE 3.91Å; F185-M281 HydrophobicContact CD1-CG 4.08Å; F185-M281 HydrophobicContact CD1-SD 3.9Å; F185-M281 HydrophobicContact CE1-CE 3.84Å; F185-M281 HydrophobicContact CE1-CG 4.22Å; F185-M281 HydrophobicContact CE1-SD 4.31Å; F185-M281 HydrophobicContact CG-CG 4.26Å; F185-M281 HydrophobicContact CG-SD 4.4Å; F185-M281 HydrophobicContact CZ-CG 4.49Å
186	G	96.8	Very high	96.4	Very high	76 Å²	76	27 Å²	27	78%	0.784	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.8	10.1	-174.4	0	0	0	0	0	114.6	C184	C184-G186 PolarHBondContact O-N 3.45Å
187	F	97.9	Very high	96.3	Very high	58 Å²	58	30.9 Å²	30.9	25%	0.254	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	164.8	178.1	-69.4	-83.8	0	0	0	111.7	S183 C184 F185 F189 L211 Q217 F221	S183-F187 WeakPolarHBondContact CA-O 3.46Å; C184-F187 PolarHBondContact N-O 3.01Å; C184-F187 VanDerWaalsContact N-O 3.14Å; C184-F187 PolarHBondContact O-N 3.4Å; C184-F187 VanDerWaalsContact O-O 3.08Å; F185-F187 VanDerWaalsContact C-N 3.27Å; F185-F187 HydrophobicContact CB-CD2 4.45Å; F185-F187 VanDerWaalsContact O-CD2 3.24Å; F185-F187 WeakPolarHBondContact O-CD2 3.38Å; F185-F187 PolarHBondContact O-N 3.14Å; F187-F189 HydrophobicContact CB-CD2 4.48Å; F187-F189 HydrophobicContact CB-CE2 3.73Å; F187-F189 HydrophobicContact CB-CZ 4.04Å; F187-L211 HydrophobicContact CB-CD1 3.76Å; F187-L211 HydrophobicContact CD1-CD1 3.91Å; F187-L211 HydrophobicContact CG-CD1 4.08Å; F187-Q217 HydrophobicContact CE1-CB 4.44Å; F187-Q217 HydrophobicContact CE1-CG 4.27Å; F187-Q217 HydrophobicContact CZ-CG 4.46Å; F187-F221 AromaticContact CD2-CE2 3.87Å; F187-F221 HydrophobicContact CD2-CE2 3.87Å; F187-F221 AromaticContact CD2-CZ 3.5Å; F187-F221 HydrophobicContact CD2-CZ 3.5Å; F187-F221 HydrophobicContact CE2-CE2 4.01Å; F187-F221 AromaticContact CE2-CZ 3.75Å; F187-F221 HydrophobicContact CE2-CZ 3.75Å; F187-F221 HydrophobicContact CG-CE2 4.33Å; F187-F221 HydrophobicContact CG-CZ 4.3Å
188	H	98.2	Very high	95.6	Very high	57 Å²	57	32.8 Å²	32.8	26%	0.264	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.5	176.1	-58.8	-69	0	0	0	110.1	M145 M181 Q182 I212	M145-H188 HydrophobicContact CE-CB 3.96Å; M145-H188 HydrophobicContact CG-CB 4.36Å; M145-H188 HydrophobicContact SD-CB 3.63Å; M181-H188 HydrophobicContact CE-CB 3.69Å; Q182-H188 CarbonylContact O-C 3.59Å; Q182-H188 WeakPolarHBondContact O-CA 3.43Å; H188-I212 HydrophobicContact CB-CB 4.25Å; H188-I212 HydrophobicContact CB-CG1 4.03Å; H188-I212 WeakPolarHBondContact O-CB 3.47Å; H188-I212 WeakPolarHBondContact O-CG1 3.2Å; H188-I212 PolarHBondContact O-N 2.89Å
189	F	98.4	Very high	94.3	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.9	-179.2	-58.6	-97	0	0	0	108.7	M181 Q182 C184 F187 V209 Q210 L211 F221 P240 I279	M181-F189 CarbonylContact C-O 3.57Å; M181-F189 WeakPolarHBondContact CA-O 3.42Å; Q182-F189 HydrophobicContact CB-CB 4.46Å; Q182-F189 PolarHBondContact N-O 3.49Å; Q182-F189 PolarHBondContact O-N 2.82Å; C184-F189 VanDerWaalsContact SG-CE2 3.58Å; F187-F189 HydrophobicContact CB-CD2 4.48Å; F187-F189 HydrophobicContact CB-CE2 3.73Å; F187-F189 HydrophobicContact CB-CZ 4.04Å; F189-V209 HydrophobicContact CB-CG1 3.99Å; F189-V209 HydrophobicContact CD1-CG1 4.23Å; F189-Q210 CarbonylContact C-O 3.56Å; F189-Q210 VanDerWaalsContact CA-O 3.3Å; F189-Q210 WeakPolarHBondContact CA-O 3.35Å; F189-L211 HydrophobicContact CD1-CB 4.04Å; F189-L211 HydrophobicContact CD1-CD1 3.9Å; F189-L211 HydrophobicContact CE1-CB 4.08Å; F189-L211 HydrophobicContact CE1-CD1 3.58Å; F189-L211 HydrophobicContact CE1-CG 4.3Å; F189-L211 HydrophobicContact CE2-CD1 4.35Å; F189-L211 HydrophobicContact CG-CD1 4.43Å; F189-L211 HydrophobicContact CZ-CD1 3.83Å; F189-F221 HydrophobicContact CE1-CB 4.31Å; F189-F221 HydrophobicContact CE1-CD2 4.23Å; F189-F221 HydrophobicContact CE1-CG 4.15Å; F189-F221 HydrophobicContact CZ-CB 4.48Å; F189-F221 HydrophobicContact CZ-CD1 4.01Å; F189-F221 HydrophobicContact CZ-CD2 4.01Å; F189-F221 HydrophobicContact CZ-CE1 4.22Å; F189-F221 HydrophobicContact CZ-CE2 4.23Å; F189-F221 AromaticContact CZ-CG 3.9Å; F189-F221 HydrophobicContact CZ-CG 3.9Å; F189-F221 HydrophobicContact CZ-CZ 4.34Å; F189-P240 HydrophobicContact CD1-CB 4.3Å; F189-P240 HydrophobicContact CD1-CG 4.19Å; F189-P240 HydrophobicContact CE1-CB 4.39Å; F189-P240 HydrophobicContact CE1-CG 3.98Å; F189-I279 HydrophobicContact CB-CD1 3.57Å; F189-I279 HydrophobicContact CD1-CD1 3.75Å; F189-I279 HydrophobicContact CD2-CD1 3.39Å; F189-I279 HydrophobicContact CE1-CD1 4.23Å; F189-I279 HydrophobicContact CE1-CG2 4.13Å; F189-I279 HydrophobicContact CE2-CD1 3.94Å; F189-I279 HydrophobicContact CE2-CG2 4.01Å; F189-I279 HydrophobicContact CG-CD1 3.29Å; F189-I279 HydrophobicContact CZ-CD1 4.32Å; F189-I279 HydrophobicContact CZ-CG2 3.79Å
190	M	97.7	Very high	93.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.1	173.5	-174.3	171.6	-73.9	0	0	109.2	P129 L148 V179 M181 V192 Q210 I212	P129-M190 HydrophobicContact CB-CE 4.23Å; P129-M190 HydrophobicContact CB-SD 4.2Å; P129-M190 HydrophobicContact CG-CE 3.82Å; P129-M190 HydrophobicContact CG-SD 4.45Å; L148-M190 HydrophobicContact CD1-CE 3.72Å; L148-M190 HydrophobicContact CD2-CE 4.08Å; V179-M190 HydrophobicContact CG1-CE 4.31Å; V179-M190 HydrophobicContact CG1-CG 3.75Å; V179-M190 HydrophobicContact CG1-SD 3.91Å; M181-M190 HydrophobicContact CE-CB 4.19Å; M181-M190 HydrophobicContact SD-CB 3.65Å; M181-M190 HydrophobicContact SD-CE 3.6Å; M181-M190 HydrophobicContact SD-CG 3.91Å; M190-V192 HydrophobicContact CG-CG2 3.96Å; M190-V192 HydrophobicContact SD-CG2 4.33Å; M190-Q210 HydrophobicContact CB-CB 4.45Å; M190-Q210 PolarHBondContact N-O 3.31Å; M190-Q210 PolarHBondContact O-N 3.47Å; M190-I212 HydrophobicContact CB-CD1 4.39Å
191	L	97.9	Very high	92.2	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.9	173.4	-48.7	-179.4	0	0	0	107.8	I163 F165 V179 M180 Q182 V209 V277	I163-L191 HydrophobicContact CD1-CD1 3.9Å; F165-L191 HydrophobicContact CB-CD1 4.06Å; F165-L191 HydrophobicContact CD1-CB 4.1Å; F165-L191 HydrophobicContact CD1-CD1 4.45Å; F165-L191 HydrophobicContact CE1-CB 4.25Å; F165-L191 HydrophobicContact CG-CD1 4.34Å; V179-L191 WeakPolarHBondContact CA-O 3.46Å; M180-L191 HydrophobicContact CB-CB 4.41Å; M180-L191 HydrophobicContact CB-CD1 4.48Å; M180-L191 PolarHBondContact N-O 3.47Å; M180-L191 PolarHBondContact O-N 2.88Å; Q182-L191 HydrophobicContact CB-CD1 4.26Å; Q182-L191 HydrophobicContact CB-CG 4.4Å; L191-V209 HydrophobicContact CD2-CB 4.2Å; L191-V209 HydrophobicContact CD2-CG1 3.84Å; L191-V209 HydrophobicContact CD2-CG2 3.54Å; L191-V277 HydrophobicContact CD1-CB 4.23Å; L191-V277 HydrophobicContact CD1-CG1 4.14Å; L191-V277 HydrophobicContact CD1-CG2 3.91Å; L191-V277 HydrophobicContact CD2-CG1 3.73Å
192	V	97.1	Very high	91.5	Very high	2 Å²	2	55 Å²	55	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.3	179.9	179.3	0	0	0	0	108.6	P131 W178 M190 E194 A207 I208 I247	P131-V192 HydrophobicContact CB-CG1 4.39Å; P131-V192 HydrophobicContact CG-CG1 3.83Å; P131-V192 HydrophobicContact CG-CG2 4.04Å; W178-V192 WeakPolarHBondContact O-CA 3.35Å; M190-V192 HydrophobicContact CG-CG2 3.96Å; M190-V192 HydrophobicContact SD-CG2 4.33Å; V192-E194 HydrophobicContact CG1-CB 4.41Å; V192-A207 VanDerWaalsContact O-CA 3.29Å; V192-A207 WeakPolarHBondContact O-CA 3.36Å; V192-I208 HydrophobicContact CB-CG2 4.1Å; V192-I208 PolarHBondContact N-O 3.03Å; V192-I208 PolarHBondContact O-N 2.98Å; V192-I247 HydrophobicContact CB-CD1 4.1Å; V192-I247 HydrophobicContact CG1-CD1 3.89Å; V192-I247 HydrophobicContact CG2-CD1 3.98Å
193	L	97.2	Very high	91.2	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	113	162.2	176.1	72.6	0	0	0	107.1	F165 A167 W178 F205 F206 A207 F259 L273 I275	F165-L193 HydrophobicContact CE1-CB 3.84Å; F165-L193 HydrophobicContact CZ-CB 4.17Å; A167-L193 HydrophobicContact CB-CD2 3.42Å; A167-L193 VanDerWaalsContact CB-CD2 3.42Å; W178-L193 HydrophobicContact CB-CB 4.28Å; W178-L193 HydrophobicContact CD2-CD2 4.33Å; W178-L193 HydrophobicContact CE3-CB 4.46Å; W178-L193 HydrophobicContact CE3-CD2 3.93Å; W178-L193 HydrophobicContact CE3-CG 4.1Å; W178-L193 HydrophobicContact CZ3-CD2 4.46Å; W178-L193 PolarHBondContact N-O 3.21Å; W178-L193 PolarHBondContact O-N 3.18Å; L193-F205 HydrophobicContact CD1-CB 4.06Å; L193-F205 HydrophobicContact CD1-CD1 4.08Å; L193-F205 HydrophobicContact CD2-CD1 4.32Å; L193-F205 HydrophobicContact CG-CD1 4.28Å; L193-F206 CarbonylContact C-O 3.37Å; L193-F206 WeakPolarHBondContact CA-O 3.4Å; L193-A207 HydrophobicContact CD1-CB 3.87Å; L193-F259 HydrophobicContact CD1-CE1 4.38Å; L193-F259 HydrophobicContact CD1-CZ 3.94Å; L193-L273 HydrophobicContact CD2-CD2 4.47Å; L193-I275 HydrophobicContact CD1-CD1 4.3Å; L193-I275 HydrophobicContact CD2-CD1 4.37Å
194	E	95.4	Very high	91	Very high	40 Å²	40	58.6 Å²	58.6	19%	0.187	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.9	178.2	174.3	169.8	166.8	0	0	109.2	D177 V192 Q196 F205 F206 I251	D177-E194 VanDerWaalsContact OD1-CG 3.29Å; D177-E194 WeakPolarHBondContact OD1-CG 3.48Å; V192-E194 HydrophobicContact CG1-CB 4.41Å; E194-Q196 HydrophobicContact CG-CG 3.89Å; E194-Q196 WeakPolarHBondContact OE1-CG 3.36Å; E194-Q196 PolarHBondContact OE1-NE2 2.79Å; E194-F205 CarbonylContact O-C 3.53Å; E194-F205 WeakPolarHBondContact O-CA 3.38Å; E194-F206 PolarHBondContact N-O 3.32Å; E194-F206 PolarHBondContact O-N 3.34Å; E194-I251 VanDerWaalsContact OE2-CD1 3.23Å; E194-I251 WeakPolarHBondContact OE2-CD1 3.31Å
195	K	94.7	Very high	91	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.2	169.9	-172.2	173	85.1	166.3	0	109.9	I170 L172 G174 A175 V176 W178 Q204 F205	I170-K195 PolarHBondContact O-NZ 3.06Å; L172-K195 WeakPolarHBondContact O-CE 3.33Å; L172-K195 PolarHBondContact O-NZ 2.87Å; G174-K195 WeakPolarHBondContact O-CE 3.28Å; A175-K195 VanDerWaalsContact CA-O 3.24Å; A175-K195 WeakPolarHBondContact CA-O 3.44Å; A175-K195 WeakPolarHBondContact CB-O 3.48Å; V176-K195 PolarHBondContact N-O 3.34Å; V176-K195 PolarHBondContact O-N 2.89Å; W178-K195 HydrophobicContact CZ3-CB 3.99Å; K195-Q204 WeakPolarHBondContact CA-O 3.24Å; K195-F205 HydrophobicContact CB-CD1 4.04Å; K195-F205 HydrophobicContact CB-CE1 3.95Å; K195-F205 HydrophobicContact CD-CD1 4.33Å; K195-F205 HydrophobicContact CD-CE1 3.55Å; K195-F205 HydrophobicContact CD-CE2 4.07Å; K195-F205 HydrophobicContact CD-CZ 3.4Å; K195-F205 HydrophobicContact CG-CD1 4.18Å; K195-F205 HydrophobicContact CG-CE1 3.89Å; K195-F205 HydrophobicContact CG-CE2 4.45Å; K195-F205 HydrophobicContact CG-CZ 4.04Å
196	Q	92	Very high	90.9	Very high	61 Å²	61	54.9 Å²	54.9	29%	0.285	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	146.1	174.9	-59.3	-172.9	-3.8	0	0	111.3	E194 Q203 Q204 F206	E194-Q196 HydrophobicContact CG-CG 3.89Å; E194-Q196 WeakPolarHBondContact OE1-CG 3.36Å; E194-Q196 PolarHBondContact OE1-NE2 2.79Å; Q196-Q203 WeakPolarHBondContact O-CA 3.45Å; Q196-Q204 PolarHBondContact N-O 2.93Å; Q196-Q204 PolarHBondContact O-N 3.07Å; Q196-F206 HydrophobicContact CB-CE2 4.08Å; Q196-F206 HydrophobicContact CG-CD2 4.13Å; Q196-F206 HydrophobicContact CG-CE2 4.04Å
197	E	87.8	Confident	91	Very high	114 Å²	114	51.3 Å²	51.3	53%	0.533	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.7	171.1	-171.9	165.9	-153.6	0	0	109	Q203	E197-Q203 HydrophobicContact CG-CG 4.49Å
198	K	79.8	Confident	91	Very high	98 Å²	98	48.7 Å²	48.7	43%	0.426	24%	0.236	S	C	.	.			trans	-80.9	161	174.5	-73.1	-171.8	162.6	175.6	0	110.8	D200 G201 H202	K198-D200 PolarHBondContact O-N 2.94Å; K198-G201 PolarHBondContact O-N 2.77Å; K198-G201 VanDerWaalsContact O-N 3.11Å; K198-H202 WeakPolarHBondContact CB-O 3.49Å; K198-H202 PolarHBondContact N-O 2.72Å
199	Y	66.7	Low	91	Very high	220 Å²	220	46 Å²	46	86%	0.863	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	131.3	165.7	-51.4	-76.1	0	0	0	108.3
200	D	72.4	Confident	91	Very high	153 Å²	153	46.2 Å²	46.2	82%	0.818	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	8.3	-172.7	-48.9	-27.7	0	0	0	117	K198 H202	K198-D200 PolarHBondContact O-N 2.94Å; D200-H202 PolarHBondContact O-N 3.01Å
201	G	75.2	Confident	91	Very high	46 Å²	46	46.2 Å²	46.2	47%	0.474	22%	0.224	S	C	.	.	S	Bend	trans	78.5	6.2	172.4	0	0	0	0	0	114.3	K198 Q203	K198-G201 PolarHBondContact O-N 2.77Å; K198-G201 VanDerWaalsContact O-N 3.11Å; G201-Q203 PolarHBondContact O-N 3.43Å
202	H	84	Confident	90.9	Very high	134 Å²	134	46.8 Å²	46.8	62%	0.62	23%	0.227	S	C	*	.			trans	-72.4	116.7	170.1	-72.1	-71.1	0	0	0	109.9	K198 D200	K198-H202 WeakPolarHBondContact CB-O 3.49Å; K198-H202 PolarHBondContact N-O 2.72Å; D200-H202 PolarHBondContact O-N 3.01Å
203	Q	91.2	Very high	90.8	Very high	42 Å²	42	46.7 Å²	46.7	20%	0.196	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	138	175.4	-67	176.3	4.6	0	0	110.4	Q196 E197 G201 T261	Q196-Q203 WeakPolarHBondContact O-CA 3.45Å; E197-Q203 HydrophobicContact CG-CG 4.49Å; G201-Q203 PolarHBondContact O-N 3.43Å; Q203-T261 WeakPolarHBondContact CB-OG1 3.03Å
204	Q	94.7	Very high	90.6	Very high	45 Å²	45	49 Å²	49	21%	0.21	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.3	174.6	-71	-168.2	-45	0	0	110.6	K195 Q196 F206	K195-Q204 WeakPolarHBondContact CA-O 3.24Å; Q196-Q204 PolarHBondContact N-O 2.93Å; Q196-Q204 PolarHBondContact O-N 3.07Å; Q204-F206 HydrophobicContact CB-CE2 3.67Å; Q204-F206 HydrophobicContact CB-CZ 4.01Å
205	F	97.1	Very high	90.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	137.7	175.3	-67.1	-92.7	0	0	0	109.4	I170 W178 L193 E194 K195 V258 F259 A264	I170-F205 HydrophobicContact CB-CE1 4.17Å; I170-F205 HydrophobicContact CB-CZ 4.23Å; W178-F205 HydrophobicContact CZ3-CE1 4.38Å; L193-F205 HydrophobicContact CD1-CB 4.06Å; L193-F205 HydrophobicContact CD1-CD1 4.08Å; L193-F205 HydrophobicContact CD2-CD1 4.32Å; L193-F205 HydrophobicContact CG-CD1 4.28Å; E194-F205 CarbonylContact O-C 3.53Å; E194-F205 WeakPolarHBondContact O-CA 3.38Å; K195-F205 HydrophobicContact CB-CD1 4.04Å; K195-F205 HydrophobicContact CB-CE1 3.95Å; K195-F205 HydrophobicContact CD-CD1 4.33Å; K195-F205 HydrophobicContact CD-CE1 3.55Å; K195-F205 HydrophobicContact CD-CE2 4.07Å; K195-F205 HydrophobicContact CD-CZ 3.4Å; K195-F205 HydrophobicContact CG-CD1 4.18Å; K195-F205 HydrophobicContact CG-CE1 3.89Å; K195-F205 HydrophobicContact CG-CE2 4.45Å; K195-F205 HydrophobicContact CG-CZ 4.04Å; F205-V258 WeakPolarHBondContact O-CA 3.44Å; F205-F259 HydrophobicContact CB-CD1 4.27Å; F205-F259 HydrophobicContact CB-CD2 3.76Å; F205-F259 HydrophobicContact CB-CE1 3.94Å; F205-F259 HydrophobicContact CB-CE2 3.39Å; F205-F259 HydrophobicContact CB-CG 4.18Å; F205-F259 HydrophobicContact CB-CZ 3.49Å; F205-F259 VanDerWaalsContact CB-CZ 3.49Å; F205-F259 HydrophobicContact CD1-CE2 4.27Å; F205-F259 AromaticContact CD2-CD2 3.99Å; F205-F259 HydrophobicContact CD2-CD2 3.99Å; F205-F259 AromaticContact CD2-CE2 3.81Å; F205-F259 HydrophobicContact CD2-CE2 3.81Å; F205-F259 HydrophobicContact CG-CD2 4.09Å; F205-F259 AromaticContact CG-CE2 3.57Å; F205-F259 HydrophobicContact CG-CE2 3.57Å; F205-F259 HydrophobicContact CG-CZ 4.03Å; F205-F259 PolarHBondContact N-O 3.23Å; F205-F259 PolarHBondContact O-N 3.32Å; F205-F259 VanDerWaalsContact O-N 3.11Å; F205-A264 HydrophobicContact CD2-CB 4.19Å; F205-A264 HydrophobicContact CE2-CB 3.88Å; F205-A264 HydrophobicContact CZ-CB 4.38Å
206	F	97.6	Very high	90.3	Very high	4 Å²	4	62 Å²	62	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	114.2	177.9	-61.4	-94.3	0	0	0	108.2	L193 E194 Q196 Q204 I251 V258	L193-F206 CarbonylContact C-O 3.37Å; L193-F206 WeakPolarHBondContact CA-O 3.4Å; E194-F206 PolarHBondContact N-O 3.32Å; E194-F206 PolarHBondContact O-N 3.34Å; Q196-F206 HydrophobicContact CB-CE2 4.08Å; Q196-F206 HydrophobicContact CG-CD2 4.13Å; Q196-F206 HydrophobicContact CG-CE2 4.04Å; Q204-F206 HydrophobicContact CB-CE2 3.67Å; Q204-F206 HydrophobicContact CB-CZ 4.01Å; F206-I251 HydrophobicContact CB-CD1 4.47Å; F206-I251 HydrophobicContact CB-CG1 4.22Å; F206-I251 HydrophobicContact CB-CG2 4.28Å; F206-I251 HydrophobicContact CD1-CB 4.5Å; F206-I251 HydrophobicContact CD1-CG2 3.8Å; F206-I251 HydrophobicContact CD2-CG2 4.25Å; F206-I251 HydrophobicContact CE1-CG2 4.17Å; F206-I251 HydrophobicContact CG-CG2 3.85Å; F206-V258 HydrophobicContact CD1-CB 4.44Å; F206-V258 HydrophobicContact CD1-CG1 4.15Å; F206-V258 HydrophobicContact CD1-CG2 3.58Å; F206-V258 HydrophobicContact CE1-CB 4.47Å; F206-V258 HydrophobicContact CE1-CG1 3.83Å; F206-V258 HydrophobicContact CE1-CG2 3.77Å; F206-V258 HydrophobicContact CZ-CG1 4.25Å
207	A	98.3	Very high	90.4	Very high	2 Å²	2	62 Å²	62	2%	0.017	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.5	178.3	0	0	0	0	0	110.7	V192 L193 L225 C256 L257 I275	V192-A207 VanDerWaalsContact O-CA 3.29Å; V192-A207 WeakPolarHBondContact O-CA 3.36Å; L193-A207 HydrophobicContact CD1-CB 3.87Å; A207-L225 HydrophobicContact CB-CD1 3.74Å; A207-L225 WeakPolarHBondContact O-CD1 3.14Å; A207-C256 WeakPolarHBondContact O-CB 3.26Å; A207-L257 HydrophobicContact CB-CB 4.14Å; A207-L257 HydrophobicContact CB-CD2 4.29Å; A207-L257 HydrophobicContact CB-CG 4.43Å; A207-L257 PolarHBondContact N-O 3.05Å; A207-L257 PolarHBondContact O-N 3.18Å; A207-I275 HydrophobicContact CB-CD1 4.39Å
208	I	98.2	Very high	90.9	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.9	-174.8	-163.8	169.5	0	0	0	111.2	V192 R241 I247 A250 C256	V192-I208 HydrophobicContact CB-CG2 4.1Å; V192-I208 PolarHBondContact N-O 3.03Å; V192-I208 PolarHBondContact O-N 2.98Å; I208-R241 HydrophobicContact CD1-CG 3.89Å; I208-I247 HydrophobicContact CD1-CB 4.27Å; I208-I247 HydrophobicContact CD1-CG2 4.12Å; I208-I247 HydrophobicContact CG2-CB 4.1Å; I208-I247 HydrophobicContact CG2-CD1 4.07Å; I208-I247 HydrophobicContact CG2-CG2 3.92Å; I208-A250 HydrophobicContact CD1-CB 3.54Å; I208-C256 HydrophobicContact CB-CB 3.87Å; I208-C256 HydrophobicContact CD1-CB 3.98Å; I208-C256 HydrophobicContact CG1-CB 4Å
209	V	98.3	Very high	91.7	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.9	176.3	-178.5	0	0	0	0	109.9	F189 L191 Y223 L225 P240 R241 V277	F189-V209 HydrophobicContact CB-CG1 3.99Å; F189-V209 HydrophobicContact CD1-CG1 4.23Å; L191-V209 HydrophobicContact CD2-CB 4.2Å; L191-V209 HydrophobicContact CD2-CG1 3.84Å; L191-V209 HydrophobicContact CD2-CG2 3.54Å; V209-Y223 HydrophobicContact CB-CD1 3.71Å; V209-Y223 HydrophobicContact CB-CD2 3.86Å; V209-Y223 HydrophobicContact CB-CE1 3.98Å; V209-Y223 HydrophobicContact CB-CE2 4.13Å; V209-Y223 HydrophobicContact CB-CG 3.62Å; V209-Y223 HydrophobicContact CG1-CD1 4.4Å; V209-Y223 HydrophobicContact CG1-CG 4.28Å; V209-Y223 HydrophobicContact CG2-CD1 4.17Å; V209-Y223 HydrophobicContact CG2-CD2 3.35Å; V209-Y223 HydrophobicContact CG2-CE1 4.47Å; V209-Y223 HydrophobicContact CG2-CE2 3.72Å; V209-Y223 HydrophobicContact CG2-CG 3.59Å; V209-L225 HydrophobicContact CG2-CD2 3.89Å; V209-L225 HydrophobicContact CG2-CG 4.41Å; V209-P240 HydrophobicContact CG1-CB 4.38Å; V209-P240 WeakPolarHBondContact O-CA 3.46Å; V209-R241 PolarHBondContact O-N 2.93Å; V209-V277 HydrophobicContact CG2-CG1 4.45Å
210	Q	97.1	Very high	93.1	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.019	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127	-179.8	-168.3	176.6	35.5	0	0	111	F189 M190 R241 S242 I243 G246 I247	F189-Q210 CarbonylContact C-O 3.56Å; F189-Q210 VanDerWaalsContact CA-O 3.3Å; F189-Q210 WeakPolarHBondContact CA-O 3.35Å; M190-Q210 HydrophobicContact CB-CB 4.45Å; M190-Q210 PolarHBondContact N-O 3.31Å; M190-Q210 PolarHBondContact O-N 3.47Å; Q210-R241 CarbonylContact C-O 3.58Å; Q210-R241 WeakPolarHBondContact CA-O 3.37Å; Q210-R241 HydrophobicContact CG-CB 4.32Å; Q210-R241 VanDerWaalsContact CG-O 3.24Å; Q210-R241 WeakPolarHBondContact CG-O 3.46Å; Q210-S242 PolarHBondContact NE2-O 3.19Å; Q210-I243 HydrophobicContact CG-CG2 3.76Å; Q210-I243 VanDerWaalsContact NE2-CA 3.29Å; Q210-G246 VanDerWaalsContact NE2-CA 3.29Å; Q210-I247 HydrophobicContact CB-CG2 4.1Å; Q210-I247 HydrophobicContact CG-CG2 4.2Å
211	L	98.1	Very high	94.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.8	173.1	173.5	65.7	0	0	0	110.8	F187 F189 G213 Q217 A218 F221 P240 R241 I243	F187-L211 HydrophobicContact CB-CD1 3.76Å; F187-L211 HydrophobicContact CD1-CD1 3.91Å; F187-L211 HydrophobicContact CG-CD1 4.08Å; F189-L211 HydrophobicContact CD1-CB 4.04Å; F189-L211 HydrophobicContact CD1-CD1 3.9Å; F189-L211 HydrophobicContact CE1-CB 4.08Å; F189-L211 HydrophobicContact CE1-CD1 3.58Å; F189-L211 HydrophobicContact CE1-CG 4.3Å; F189-L211 HydrophobicContact CE2-CD1 4.35Å; F189-L211 HydrophobicContact CG-CD1 4.43Å; F189-L211 HydrophobicContact CZ-CD1 3.83Å; L211-G213 PolarHBondContact O-N 3.26Å; L211-Q217 HydrophobicContact CD2-CB 3.77Å; L211-A218 HydrophobicContact CB-CB 4.3Å; L211-A218 VanDerWaalsContact CD2-CA 3.48Å; L211-A218 HydrophobicContact CD2-CB 3.82Å; L211-A218 VanDerWaalsContact CD2-N 3.34Å; L211-F221 HydrophobicContact CD2-CD2 4.47Å; L211-P240 HydrophobicContact CB-CB 4.17Å; L211-R241 PolarHBondContact N-O 2.84Å; L211-I243 WeakPolarHBondContact O-CG2 3.36Å; L211-I243 PolarHBondContact O-N 3.04Å
212	I	97.1	Very high	95.5	Very high	15 Å²	15	42.6 Å²	42.6	8%	0.077	20%	0.201	C	C	.	.	S	Bend	trans	-73.4	78.3	163.5	-49	-56.5	0	0	0	108.4	P129 L141 V144 M145 L148 M181 H188 M190 I243	P129-I212 HydrophobicContact CB-CD1 4.45Å; P129-I212 HydrophobicContact CG-CD1 3.98Å; L141-I212 HydrophobicContact CD1-CG2 4.39Å; V144-I212 HydrophobicContact CB-CG2 4.09Å; V144-I212 HydrophobicContact CG1-CD1 4.44Å; V144-I212 HydrophobicContact CG1-CG2 3.86Å; M145-I212 HydrophobicContact CG-CG2 3.96Å; M145-I212 HydrophobicContact SD-CB 4.38Å; M145-I212 HydrophobicContact SD-CG1 3.9Å; M145-I212 HydrophobicContact SD-CG2 4.17Å; L148-I212 HydrophobicContact CD1-CD1 4.32Å; M181-I212 HydrophobicContact CE-CD1 4.21Å; M181-I212 HydrophobicContact CE-CG1 3.69Å; H188-I212 HydrophobicContact CB-CB 4.25Å; H188-I212 HydrophobicContact CB-CG1 4.03Å; H188-I212 WeakPolarHBondContact O-CB 3.47Å; H188-I212 WeakPolarHBondContact O-CG1 3.2Å; H188-I212 PolarHBondContact O-N 2.89Å; M190-I212 HydrophobicContact CB-CD1 4.39Å; I212-I243 HydrophobicContact CD1-CG2 3.51Å; I212-I243 HydrophobicContact CG2-CD1 3.96Å
213	G	94.3	Very high	96.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-178.8	-178.9	-171.9	0	0	0	0	0	112.1	L211 S242	L211-G213 PolarHBondContact O-N 3.26Å; G213-S242 PolarHBondContact O-OG 3.13Å
214	T	92.2	Very high	96.6	Very high	48 Å²	48	38.7 Å²	38.7	29%	0.294	18%	0.179	S	C	.	.			trans	-75.6	163.3	176.5	64.4	0	0	0	0	111.9	L141 K216 Q217 A218	L141-T214 HydrophobicContact CD2-CG2 4.24Å; T214-K216 PolarHBondContact O-N 2.63Å; T214-Q217 PolarHBondContact O-N 2.76Å; T214-Q217 WeakPolarHBondContact OG1-CB 3.45Å; T214-Q217 VanDerWaalsContact OG1-CG 3.28Å; T214-Q217 WeakPolarHBondContact OG1-CG 3.46Å; T214-Q217 PolarHBondContact OG1-N 3.13Å; T214-Q217 PolarHBondContact OG1-OE1 3.42Å; T214-A218 PolarHBondContact O-N 2.84Å
215	R	91.9	Very high	96.8	Very high	148 Å²	148	36.7 Å²	36.7	56%	0.558	17%	0.17	S	C	*	.	H	α-helix	trans	-58.2	-46	172.9	178.4	179	169.3	161.1	-5.8	112.3	Q217 A218 E219 E245	R215-Q217 PolarHBondContact O-N 3.35Å; R215-A218 WeakPolarHBondContact O-CA 3.22Å; R215-A218 WeakPolarHBondContact O-CB 3.26Å; R215-A218 PolarHBondContact O-N 3.1Å; R215-E219 IonicContact NE-OE1 3.34Å; R215-E219 PolarHBondContact NE-OE1 3.32Å; R215-E219 WeakPolarHBondContact O-CG 3.33Å; R215-E219 PolarHBondContact O-N 2.7Å; R215-E245 WeakPolarHBondContact CD-OE1 3.23Å; R215-E245 IonicContact CZ-OE1 3.3Å; R215-E245 IonicContact NE-OE1 2.63Å; R215-E245 IonicContact NH1-OE1 3.85Å; R215-E245 PolarHBondContact NH1-OE1 2.75Å
216	K	92.1	Very high	96.8	Very high	165 Å²	165	38 Å²	38	72%	0.717	18%	0.176	S	C	*	.	H	α-helix	trans	-60.2	-35	177.9	-173.9	178.7	-180	-179.9	0	112.5	T214 N220	T214-K216 PolarHBondContact O-N 2.63Å; K216-N220 PolarHBondContact O-ND2 3.19Å
217	Q	95.3	Very high	96.9	Very high	62 Å²	62	37.9 Å²	37.9	29%	0.29	18%	0.176	S	C	.	.	H	α-helix	trans	-68.9	-42.6	173.4	-75.3	164.7	-41.6	0	0	111.1	F187 L211 T214 R215 E219 N220 F221	F187-Q217 HydrophobicContact CE1-CB 4.44Å; F187-Q217 HydrophobicContact CE1-CG 4.27Å; F187-Q217 HydrophobicContact CZ-CG 4.46Å; L211-Q217 HydrophobicContact CD2-CB 3.77Å; T214-Q217 PolarHBondContact O-N 2.76Å; T214-Q217 WeakPolarHBondContact OG1-CB 3.45Å; T214-Q217 VanDerWaalsContact OG1-CG 3.28Å; T214-Q217 WeakPolarHBondContact OG1-CG 3.46Å; T214-Q217 PolarHBondContact OG1-N 3.13Å; T214-Q217 PolarHBondContact OG1-OE1 3.42Å; R215-Q217 PolarHBondContact O-N 3.35Å; Q217-E219 VanDerWaalsContact C-N 3.27Å; Q217-E219 PolarHBondContact O-N 3.37Å; Q217-N220 WeakPolarHBondContact CA-ND2 3.26Å; Q217-N220 PolarHBondContact O-N 3Å; Q217-N220 PolarHBondContact O-ND2 2.65Å; Q217-F221 VanDerWaalsContact O-CD2 3.3Å; Q217-F221 WeakPolarHBondContact O-CD2 3.39Å
218	A	96.7	Very high	96.8	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-35.6	-179.9	0	0	0	0	0	112.8	L211 T214 R215 N220 F221 T239 P240	L211-A218 HydrophobicContact CB-CB 4.3Å; L211-A218 VanDerWaalsContact CD2-CA 3.48Å; L211-A218 HydrophobicContact CD2-CB 3.82Å; L211-A218 VanDerWaalsContact CD2-N 3.34Å; T214-A218 PolarHBondContact O-N 2.84Å; R215-A218 WeakPolarHBondContact O-CA 3.22Å; R215-A218 WeakPolarHBondContact O-CB 3.26Å; R215-A218 PolarHBondContact O-N 3.1Å; A218-N220 PolarHBondContact O-N 3.22Å; A218-N220 VanDerWaalsContact O-N 3.12Å; A218-F221 PolarHBondContact O-N 3.28Å; A218-T239 VanDerWaalsContact O-CG2 3.25Å; A218-T239 WeakPolarHBondContact O-CG2 3.32Å; A218-P240 WeakPolarHBondContact CB-O 3.46Å
219	E	96.5	Very high	96.6	Very high	102 Å²	102	42.1 Å²	42.1	48%	0.477	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.2	177.2	-72.8	169.6	-177	0	0	114.4	R215 Q217 F221	R215-E219 IonicContact NE-OE1 3.34Å; R215-E219 PolarHBondContact NE-OE1 3.32Å; R215-E219 WeakPolarHBondContact O-CG 3.33Å; R215-E219 PolarHBondContact O-N 2.7Å; Q217-E219 VanDerWaalsContact C-N 3.27Å; Q217-E219 PolarHBondContact O-N 3.37Å; E219-F221 VanDerWaalsContact C-N 3.3Å
220	N	98	Very high	96.4	Very high	84 Å²	84	49.5 Å²	49.5	45%	0.449	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	5.3	176.2	-45.1	-76.3	0	0	0	113.3	K216 Q217 A218 M281 C282	K216-N220 PolarHBondContact O-ND2 3.19Å; Q217-N220 WeakPolarHBondContact CA-ND2 3.26Å; Q217-N220 PolarHBondContact O-N 3Å; Q217-N220 PolarHBondContact O-ND2 2.65Å; A218-N220 PolarHBondContact O-N 3.22Å; A218-N220 VanDerWaalsContact O-N 3.12Å; N220-M281 WeakPolarHBondContact O-CA 3.43Å; N220-C282 PolarHBondContact O-N 3.48Å
221	F	98.6	Very high	96.3	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.035	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.8	-178.6	-61	-77.6	0	0	0	111.8	F185 F187 F189 L211 Q217 A218 E219 P240 I279 S280 M281 C282	F185-F221 HydrophobicContact CB-CE1 3.82Å; F185-F221 HydrophobicContact CB-CZ 4.18Å; F185-F221 HydrophobicContact CD2-CD1 4.24Å; F185-F221 AromaticContact CD2-CE1 3.77Å; F185-F221 HydrophobicContact CD2-CE1 3.77Å; F185-F221 AromaticContact CG-CE1 3.93Å; F185-F221 HydrophobicContact CG-CE1 3.93Å; F187-F221 AromaticContact CD2-CE2 3.87Å; F187-F221 HydrophobicContact CD2-CE2 3.87Å; F187-F221 AromaticContact CD2-CZ 3.5Å; F187-F221 HydrophobicContact CD2-CZ 3.5Å; F187-F221 HydrophobicContact CE2-CE2 4.01Å; F187-F221 AromaticContact CE2-CZ 3.75Å; F187-F221 HydrophobicContact CE2-CZ 3.75Å; F187-F221 HydrophobicContact CG-CE2 4.33Å; F187-F221 HydrophobicContact CG-CZ 4.3Å; F189-F221 HydrophobicContact CE1-CB 4.31Å; F189-F221 HydrophobicContact CE1-CD2 4.23Å; F189-F221 HydrophobicContact CE1-CG 4.15Å; F189-F221 HydrophobicContact CZ-CB 4.48Å; F189-F221 HydrophobicContact CZ-CD1 4.01Å; F189-F221 HydrophobicContact CZ-CD2 4.01Å; F189-F221 HydrophobicContact CZ-CE1 4.22Å; F189-F221 HydrophobicContact CZ-CE2 4.23Å; F189-F221 AromaticContact CZ-CG 3.9Å; F189-F221 HydrophobicContact CZ-CG 3.9Å; F189-F221 HydrophobicContact CZ-CZ 4.34Å; L211-F221 HydrophobicContact CD2-CD2 4.47Å; Q217-F221 VanDerWaalsContact O-CD2 3.3Å; Q217-F221 WeakPolarHBondContact O-CD2 3.39Å; A218-F221 PolarHBondContact O-N 3.28Å; E219-F221 VanDerWaalsContact C-N 3.3Å; F221-P240 HydrophobicContact CB-CG 4Å; F221-P240 WeakPolarHBondContact O-CD 3.42Å; F221-I279 HydrophobicContact CD1-CG2 4.24Å; F221-S280 CarbonylContact C-O 3.58Å; F221-S280 VanDerWaalsContact CA-O 3.27Å; F221-S280 WeakPolarHBondContact CA-O 3.14Å; F221-M281 HydrophobicContact CD1-CG 4.01Å; F221-M281 HydrophobicContact CE1-CG 3.66Å; F221-C282 VanDerWaalsContact C-SG 3.53Å; F221-C282 PolarHBondContact N-SG 3.4Å; F221-C282 VanDerWaalsContact N-SG 3.45Å
222	A	98.6	Very high	96.3	Very high	25 Å²	25	67.2 Å²	67.2	21%	0.207	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.4	164.9	0	0	0	0	0	109.1	A238 S280	A222-A238 WeakPolarHBondContact CA-O 3.35Å; A222-S280 PolarHBondContact N-O 3.31Å; A222-S280 PolarHBondContact O-N 3.28Å; A222-S280 PolarHBondContact O-OG 3Å
223	Y	98.7	Very high	96.3	Very high	5 Å²	5	74.5 Å²	74.5	2%	0.02	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	150.2	172.4	75.9	-91.7	0	0	0	110.4	V209 L225 W236 E237 A238 P240 T278	V209-Y223 HydrophobicContact CB-CD1 3.71Å; V209-Y223 HydrophobicContact CB-CD2 3.86Å; V209-Y223 HydrophobicContact CB-CE1 3.98Å; V209-Y223 HydrophobicContact CB-CE2 4.13Å; V209-Y223 HydrophobicContact CB-CG 3.62Å; V209-Y223 HydrophobicContact CG1-CD1 4.4Å; V209-Y223 HydrophobicContact CG1-CG 4.28Å; V209-Y223 HydrophobicContact CG2-CD1 4.17Å; V209-Y223 HydrophobicContact CG2-CD2 3.35Å; V209-Y223 HydrophobicContact CG2-CE1 4.47Å; V209-Y223 HydrophobicContact CG2-CE2 3.72Å; V209-Y223 HydrophobicContact CG2-CG 3.59Å; Y223-L225 HydrophobicContact CD2-CD1 4.28Å; Y223-L225 HydrophobicContact CD2-CD2 4.21Å; Y223-L225 HydrophobicContact CD2-CG 3.74Å; Y223-L225 HydrophobicContact CE2-CD1 3.68Å; Y223-L225 HydrophobicContact CE2-CD2 4.44Å; Y223-L225 HydrophobicContact CE2-CG 3.62Å; Y223-W236 AromaticContact CE2-CD1 3.67Å; Y223-W236 AromaticContact CE2-NE1 3.99Å; Y223-W236 AromaticContact CZ-CD1 3.89Å; Y223-W236 AromaticContact CZ-NE1 3.7Å; Y223-W236 PolarHBondContact OH-NE1 2.88Å; Y223-E237 VanDerWaalsContact O-CA 3.26Å; Y223-E237 WeakPolarHBondContact O-CA 3.45Å; Y223-A238 HydrophobicContact CD1-CB 4.49Å; Y223-A238 WeakPolarHBondContact CD1-O 3.35Å; Y223-A238 HydrophobicContact CE1-CB 3.72Å; Y223-A238 WeakPolarHBondContact CE1-O 3.46Å; Y223-A238 PolarHBondContact N-O 2.97Å; Y223-A238 PolarHBondContact O-N 2.8Å; Y223-A238 VanDerWaalsContact O-N 3.08Å; Y223-P240 HydrophobicContact CD1-CB 4.36Å; Y223-P240 HydrophobicContact CD1-CG 3.97Å; Y223-T278 CarbonylContact C-O 3.49Å; Y223-T278 VanDerWaalsContact CA-O 3.28Å; Y223-T278 WeakPolarHBondContact CA-O 3.49Å
224	R	98.8	Very high	96.5	Very high	89 Å²	89	77.2 Å²	77.2	34%	0.336	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.5	170.6	-179.2	168.4	57.9	-131.4	-4.3	109.5	T235 W236 E237 V277 T278	R224-T235 HydrophobicContact CG-CG2 3.57Å; R224-W236 CarbonylContact C-O 3.56Å; R224-W236 WeakPolarHBondContact CA-O 3.46Å; R224-E237 HydrophobicContact CB-CG 3.81Å; R224-E237 VanDerWaalsContact CD-OE1 3.22Å; R224-E237 WeakPolarHBondContact CD-OE1 3.45Å; R224-E237 HydrophobicContact CG-CG 3.7Å; R224-E237 IonicContact NH1-OE1 3.62Å; R224-V277 WeakPolarHBondContact O-CA 3.47Å; R224-T278 PolarHBondContact N-O 3.34Å; R224-T278 PolarHBondContact NH2-OG1 2.86Å; R224-T278 PolarHBondContact O-N 2.84Å
225	L	98.8	Very high	96.8	Very high	4 Å²	4	77.5 Å²	77.5	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.9	168.5	-60.1	176.7	0	0	0	108.9	A207 V209 Y223 T235 W236 L257 I275 N276 V277	A207-L225 HydrophobicContact CB-CD1 3.74Å; A207-L225 WeakPolarHBondContact O-CD1 3.14Å; V209-L225 HydrophobicContact CG2-CD2 3.89Å; V209-L225 HydrophobicContact CG2-CG 4.41Å; Y223-L225 HydrophobicContact CD2-CD1 4.28Å; Y223-L225 HydrophobicContact CD2-CD2 4.21Å; Y223-L225 HydrophobicContact CD2-CG 3.74Å; Y223-L225 HydrophobicContact CE2-CD1 3.68Å; Y223-L225 HydrophobicContact CE2-CD2 4.44Å; Y223-L225 HydrophobicContact CE2-CG 3.62Å; L225-T235 CarbonylContact O-C 3.6Å; L225-T235 WeakPolarHBondContact O-CA 3.41Å; L225-W236 PolarHBondContact N-O 3.04Å; L225-W236 PolarHBondContact O-N 3.35Å; L225-L257 HydrophobicContact CB-CD2 3.76Å; L225-L257 HydrophobicContact CD1-CB 4.05Å; L225-L257 HydrophobicContact CD1-CD2 4.3Å; L225-I275 HydrophobicContact CB-CG2 4.12Å; L225-I275 HydrophobicContact CD2-CG2 4.09Å; L225-N276 WeakPolarHBondContact CA-O 3.44Å; L225-V277 HydrophobicContact CD2-CB 4.26Å; L225-V277 HydrophobicContact CD2-CG1 3.93Å; L225-V277 HydrophobicContact CD2-CG2 3.63Å
226	E	98.7	Very high	97.1	Very high	28 Å²	28	73.9 Å²	73.9	13%	0.131	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.3	-177.6	-175.7	177.1	109.4	0	0	111.9	N228 R233 L234 T235 N276	E226-N228 PolarHBondContact OE1-ND2 2.86Å; E226-N228 PolarHBondContact OE1-OD1 3.39Å; E226-R233 VanDerWaalsContact CD-CD 3.41Å; E226-R233 HydrophobicContact CG-CG 3.71Å; E226-R233 WeakPolarHBondContact OE2-CD 3.33Å; E226-R233 IonicContact OE2-NH1 3.67Å; E226-L234 CarbonylContact C-O 3.59Å; E226-L234 WeakPolarHBondContact CA-O 3.38Å; E226-T235 PolarHBondContact OE2-OG1 3.42Å; E226-N276 HydrophobicContact CB-CB 4.19Å; E226-N276 PolarHBondContact N-O 3.06Å; E226-N276 PolarHBondContact O-N 2.99Å
227	L	98.5	Very high	97.4	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.9	168.6	-55.6	-178.7	0	0	0	108.7	R233 L234 F259 F267 L273 I275	L227-R233 WeakPolarHBondContact O-CA 3.47Å; L227-L234 HydrophobicContact CB-CB 4.35Å; L227-L234 HydrophobicContact CD1-CD2 4.23Å; L227-L234 PolarHBondContact N-O 3.19Å; L227-L234 PolarHBondContact O-N 3.47Å; L227-F259 HydrophobicContact CD1-CD1 4.14Å; L227-F259 HydrophobicContact CD1-CD2 4.43Å; L227-F259 HydrophobicContact CD1-CE1 4.03Å; L227-F259 HydrophobicContact CD1-CE2 4.31Å; L227-F259 HydrophobicContact CD1-CG 4.35Å; L227-F259 HydrophobicContact CD1-CZ 4.11Å; L227-F267 HydrophobicContact CB-CB 4.11Å; L227-F267 HydrophobicContact CB-CD1 3.71Å; L227-F267 HydrophobicContact CB-CD2 3.91Å; L227-F267 HydrophobicContact CB-CE1 4.03Å; L227-F267 HydrophobicContact CB-CE2 4.21Å; L227-F267 HydrophobicContact CB-CG 3.65Å; L227-F267 HydrophobicContact CB-CZ 4.27Å; L227-F267 HydrophobicContact CD1-CB 4.46Å; L227-F267 HydrophobicContact CD1-CD2 3.82Å; L227-F267 HydrophobicContact CD1-CE2 4.32Å; L227-F267 HydrophobicContact CD1-CG 4.22Å; L227-F267 WeakPolarHBondContact O-CE1 3.42Å; L227-L273 HydrophobicContact CD2-CD1 4.05Å; L227-L273 HydrophobicContact CD2-CD2 4.18Å; L227-L273 HydrophobicContact CD2-CG 4.1Å; L227-I275 HydrophobicContact CD2-CB 4.25Å; L227-I275 HydrophobicContact CD2-CD1 4.27Å; L227-I275 HydrophobicContact CD2-CG1 3.68Å; L227-I275 HydrophobicContact CD2-CG2 4.21Å
228	N	96.6	Very high	97.6	Very high	70 Å²	70	70.1 Å²	70.1	37%	0.374	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.2	179.7	-78	-63.9	0	0	0	110.7	E226 F267 N276	E226-N228 PolarHBondContact OE1-ND2 2.86Å; E226-N228 PolarHBondContact OE1-OD1 3.39Å; N228-F267 VanDerWaalsContact C-CD1 3.44Å; N228-N276 PolarHBondContact ND2-ND2 3.4Å
229	G	94.1	Very high	97.7	Very high	25 Å²	25	73.4 Å²	73.4	26%	0.258	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	176.7	178.7	0	0	0	0	0	110.2	R231 R232	G229-R231 PolarHBondContact O-N 3.41Å; G229-R232 PolarHBondContact N-O 3.01Å; G229-R232 PolarHBondContact O-N 2.86Å; G229-R232 VanDerWaalsContact O-N 3.09Å
230	H	93.3	Very high	97.7	Very high	155 Å²	155	68.8 Å²	68.8	72%	0.718	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	109.1	-176.8	-176.8	-102.8	0	0	0	111.7	R232	H230-R232 PolarHBondContact O-N 3.27Å
231	R	95.8	Very high	97.6	Very high	233 Å²	233	68 Å²	68	88%	0.879	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	26.8	-177.1	-55.4	-179.6	67.4	-179	1.6	114.1	G229	G229-R231 PolarHBondContact O-N 3.41Å
232	R	96.9	Very high	97.4	Very high	142 Å²	142	67.7 Å²	67.7	54%	0.536	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	147.6	-178.7	-62.4	-179.2	-176.7	104.9	-4.2	110.2	G229 H230 F267	G229-R232 PolarHBondContact N-O 3.01Å; G229-R232 PolarHBondContact O-N 2.86Å; G229-R232 VanDerWaalsContact O-N 3.09Å; H230-R232 PolarHBondContact O-N 3.27Å; R232-F267 HydrophobicContact CB-CE1 4.11Å; R232-F267 HydrophobicContact CB-CZ 4.28Å
233	R	98	Very high	97.2	Very high	169 Å²	169	67.2 Å²	67.2	64%	0.638	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.6	135.2	178.4	-172.8	169.7	68.2	164.7	-1.7	109.5	E226 L227	E226-R233 VanDerWaalsContact CD-CD 3.41Å; E226-R233 HydrophobicContact CG-CG 3.71Å; E226-R233 WeakPolarHBondContact OE2-CD 3.33Å; E226-R233 IonicContact OE2-NH1 3.67Å; L227-R233 WeakPolarHBondContact O-CA 3.47Å
234	L	98.4	Very high	96.7	Very high	56 Å²	56	68.8 Å²	68.8	29%	0.293	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.5	171.3	178.7	63.4	0	0	0	107.9	E226 L227 L257 F259 I263 F267	E226-L234 CarbonylContact C-O 3.59Å; E226-L234 WeakPolarHBondContact CA-O 3.38Å; L227-L234 HydrophobicContact CB-CB 4.35Å; L227-L234 HydrophobicContact CD1-CD2 4.23Å; L227-L234 PolarHBondContact N-O 3.19Å; L227-L234 PolarHBondContact O-N 3.47Å; L234-L257 HydrophobicContact CD2-CD1 3.9Å; L234-L257 HydrophobicContact CG-CD1 4.05Å; L234-F259 HydrophobicContact CD2-CB 4.46Å; L234-I263 HydrophobicContact CD2-CG2 4.19Å; L234-F267 HydrophobicContact CB-CE2 4.06Å; L234-F267 HydrophobicContact CB-CZ 3.88Å
235	T	98.6	Very high	96.1	Very high	54 Å²	54	67.8 Å²	67.8	33%	0.331	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.8	-173.8	-51.4	0	0	0	0	109.9	R224 L225 E226 E237	R224-T235 HydrophobicContact CG-CG2 3.57Å; L225-T235 CarbonylContact O-C 3.6Å; L225-T235 WeakPolarHBondContact O-CA 3.41Å; E226-T235 PolarHBondContact OE2-OG1 3.42Å; T235-E237 HydrophobicContact CG2-CG 4.36Å
236	W	98.7	Very high	95.7	Very high	73 Å²	73	68.8 Å²	68.8	28%	0.277	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.3	170.4	171.4	-88.9	0	0	0	109.3	Y223 R224 L225 A238 L257	Y223-W236 AromaticContact CE2-CD1 3.67Å; Y223-W236 AromaticContact CE2-NE1 3.99Å; Y223-W236 AromaticContact CZ-CD1 3.89Å; Y223-W236 AromaticContact CZ-NE1 3.7Å; Y223-W236 PolarHBondContact OH-NE1 2.88Å; R224-W236 CarbonylContact C-O 3.56Å; R224-W236 WeakPolarHBondContact CA-O 3.46Å; L225-W236 PolarHBondContact N-O 3.04Å; L225-W236 PolarHBondContact O-N 3.35Å; W236-A238 HydrophobicContact CZ2-CB 4.1Å; W236-L257 HydrophobicContact CB-CB 3.74Å; W236-L257 HydrophobicContact CB-CD1 3.95Å; W236-L257 HydrophobicContact CB-CG 4.27Å; W236-L257 HydrophobicContact CG-CB 3.94Å
237	E	98.6	Very high	95.3	Very high	121 Å²	121	68.3 Å²	68.3	57%	0.565	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.1	176.2	-65.4	-177.4	-161.1	0	0	109.5	Y223 R224 T235	Y223-E237 VanDerWaalsContact O-CA 3.26Å; Y223-E237 WeakPolarHBondContact O-CA 3.45Å; R224-E237 HydrophobicContact CB-CG 3.81Å; R224-E237 VanDerWaalsContact CD-OE1 3.22Å; R224-E237 WeakPolarHBondContact CD-OE1 3.45Å; R224-E237 HydrophobicContact CG-CG 3.7Å; R224-E237 IonicContact NH1-OE1 3.62Å; T235-E237 HydrophobicContact CG2-CG 4.36Å
238	A	98.3	Very high	95	Very high	26 Å²	26	71.9 Å²	71.9	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	171.6	176.2	0	0	0	0	0	111.3	A222 Y223 W236	A222-A238 WeakPolarHBondContact CA-O 3.35Å; Y223-A238 HydrophobicContact CD1-CB 4.49Å; Y223-A238 WeakPolarHBondContact CD1-O 3.35Å; Y223-A238 HydrophobicContact CE1-CB 3.72Å; Y223-A238 WeakPolarHBondContact CE1-O 3.46Å; Y223-A238 PolarHBondContact N-O 2.97Å; Y223-A238 PolarHBondContact O-N 2.8Å; Y223-A238 VanDerWaalsContact O-N 3.08Å; W236-A238 HydrophobicContact CZ2-CB 4.1Å
239	T	98.2	Very high	94.7	Very high	72 Å²	72	72.2 Å²	72.2	44%	0.442	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-75.4	135.5	168.2	-58.2	0	0	0	0	109.7	A218	A218-T239 VanDerWaalsContact O-CG2 3.25Å; A218-T239 WeakPolarHBondContact O-CG2 3.32Å
240	P	97.9	Very high	94.7	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.032	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-56.8	145.1	175.4	-23.8	33.4	0	0	0	111.8	F189 V209 L211 A218 F221 Y223	F189-P240 HydrophobicContact CD1-CB 4.3Å; F189-P240 HydrophobicContact CD1-CG 4.19Å; F189-P240 HydrophobicContact CE1-CB 4.39Å; F189-P240 HydrophobicContact CE1-CG 3.98Å; V209-P240 HydrophobicContact CG1-CB 4.38Å; V209-P240 WeakPolarHBondContact O-CA 3.46Å; L211-P240 HydrophobicContact CB-CB 4.17Å; A218-P240 WeakPolarHBondContact CB-O 3.46Å; F221-P240 HydrophobicContact CB-CG 4Å; F221-P240 WeakPolarHBondContact O-CD 3.42Å; Y223-P240 HydrophobicContact CD1-CB 4.36Å; Y223-P240 HydrophobicContact CD1-CG 3.97Å
241	R	95.7	Very high	94.7	Very high	69 Å²	69	64 Å²	64	26%	0.26	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	147.1	170.4	-69.3	-61.8	-174.1	170.5	-3.9	110.6	I208 V209 Q210 L211 E245 I247 A250 D255	I208-R241 HydrophobicContact CD1-CG 3.89Å; V209-R241 PolarHBondContact O-N 2.93Å; Q210-R241 CarbonylContact C-O 3.58Å; Q210-R241 WeakPolarHBondContact CA-O 3.37Å; Q210-R241 HydrophobicContact CG-CB 4.32Å; Q210-R241 VanDerWaalsContact CG-O 3.24Å; Q210-R241 WeakPolarHBondContact CG-O 3.46Å; L211-R241 PolarHBondContact N-O 2.84Å; R241-E245 IonicContact NH1-OE2 3.71Å; R241-E245 PolarHBondContact NH1-OE2 3.42Å; R241-I247 HydrophobicContact CB-CG2 4.5Å; R241-A250 HydrophobicContact CG-CB 4.45Å; R241-D255 IonicContact CZ-OD2 3.86Å; R241-D255 IonicContact NH2-OD2 3.27Å; R241-D255 PolarHBondContact NH2-OD2 3.21Å
242	S	95.1	Very high	94.6	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	147.7	169	168.7	0	0	0	0	110.4	Q210 G213 H244 E245 G246	Q210-S242 PolarHBondContact NE2-O 3.19Å; G213-S242 PolarHBondContact O-OG 3.13Å; S242-H244 PolarHBondContact O-N 3.18Å; S242-H244 VanDerWaalsContact O-N 3.14Å; S242-H244 WeakPolarHBondContact OG-CB 3.23Å; S242-H244 PolarHBondContact OG-N 3.04Å; S242-E245 PolarHBondContact O-N 3.37Å; S242-E245 VanDerWaalsContact O-N 3.12Å; S242-G246 PolarHBondContact O-N 2.86Å; S242-G246 VanDerWaalsContact O-N 3.16Å
243	I	93.5	Very high	94.5	Very high	15 Å²	15	58.5 Å²	58.5	8%	0.077	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.5	166.1	54.4	160.7	0	0	0	114.7	Y126 P129 L141 V144 Q210 L211 I212	Y126-I243 HydrophobicContact CD1-CB 4.29Å; Y126-I243 HydrophobicContact CD1-CD1 3.43Å; Y126-I243 VanDerWaalsContact CD1-CD1 3.43Å; Y126-I243 HydrophobicContact CD1-CG1 3.59Å; Y126-I243 HydrophobicContact CE1-CD1 3.83Å; Y126-I243 HydrophobicContact CE1-CG1 3.63Å; Y126-I243 HydrophobicContact CG-CD1 4.08Å; P129-I243 HydrophobicContact CB-CB 4.33Å; P129-I243 HydrophobicContact CB-CG2 3.58Å; P129-I243 HydrophobicContact CG-CG2 4.19Å; L141-I243 HydrophobicContact CD1-CD1 3.68Å; L141-I243 HydrophobicContact CD1-CG1 4.36Å; V144-I243 HydrophobicContact CB-CD1 4.36Å; V144-I243 HydrophobicContact CG1-CD1 4.05Å; V144-I243 HydrophobicContact CG2-CD1 3.85Å; Q210-I243 HydrophobicContact CG-CG2 3.76Å; Q210-I243 VanDerWaalsContact NE2-CA 3.29Å; L211-I243 WeakPolarHBondContact O-CG2 3.36Å; L211-I243 PolarHBondContact O-N 3.04Å; I212-I243 HydrophobicContact CD1-CG2 3.51Å; I212-I243 HydrophobicContact CG2-CD1 3.96Å
244	H	87.9	Confident	94.4	Very high	39 Å²	39	53.5 Å²	53.5	18%	0.181	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-40.8	173.3	-160.1	76.5	0	0	0	112.1	C121 Y126 S242	C121-H244 PolarHBondContact O-CE1 2.72Å; C121-H244 VanDerWaalsContact O-CE1 3.23Å; C121-H244 PolarHBondContact O-NE2 2.85Å; Y126-H244 HydrophobicContact CE1-CB 3.7Å; Y126-H244 AromaticContact CE1-ND1 3.75Å; Y126-H244 AromaticContact CZ-ND1 3.86Å; S242-H244 PolarHBondContact O-N 3.18Å; S242-H244 VanDerWaalsContact O-N 3.14Å; S242-H244 WeakPolarHBondContact OG-CB 3.23Å; S242-H244 PolarHBondContact OG-N 3.04Å
245	E	86.4	Confident	94.3	Very high	68 Å²	68	53.9 Å²	53.9	32%	0.318	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-28.5	179.8	-62	-175.2	143	0	0	111.8	R215 R241 S242	R215-E245 WeakPolarHBondContact CD-OE1 3.23Å; R215-E245 IonicContact CZ-OE1 3.3Å; R215-E245 IonicContact NE-OE1 2.63Å; R215-E245 IonicContact NH1-OE1 3.85Å; R215-E245 PolarHBondContact NH1-OE1 2.75Å; R241-E245 IonicContact NH1-OE2 3.71Å; R241-E245 PolarHBondContact NH1-OE2 3.42Å; S242-E245 PolarHBondContact O-N 3.37Å; S242-E245 VanDerWaalsContact O-N 3.12Å
246	G	89.4	Confident	94.3	Very high	24 Å²	24	51.4 Å²	51.4	25%	0.247	29%	0.285	C	S	.	.			trans	75.6	-173.6	-171.3	0	0	0	0	0	112.2	Q210 S242	Q210-G246 VanDerWaalsContact NE2-CA 3.29Å; S242-G246 PolarHBondContact O-N 2.86Å; S242-G246 VanDerWaalsContact O-N 3.16Å
247	I	92.3	Very high	94.3	Very high	18 Å²	18	48.2 Å²	48.2	9%	0.092	27%	0.273	C	S	.	.	S	Bend	trans	-118.6	-13.7	179	61.1	175.3	0	0	0	113.7	V192 I208 Q210 R241 T249 A250 I251	V192-I247 HydrophobicContact CB-CD1 4.1Å; V192-I247 HydrophobicContact CG1-CD1 3.89Å; V192-I247 HydrophobicContact CG2-CD1 3.98Å; I208-I247 HydrophobicContact CD1-CB 4.27Å; I208-I247 HydrophobicContact CD1-CG2 4.12Å; I208-I247 HydrophobicContact CG2-CB 4.1Å; I208-I247 HydrophobicContact CG2-CD1 4.07Å; I208-I247 HydrophobicContact CG2-CG2 3.92Å; Q210-I247 HydrophobicContact CB-CG2 4.1Å; Q210-I247 HydrophobicContact CG-CG2 4.2Å; R241-I247 HydrophobicContact CB-CG2 4.5Å; I247-T249 PolarHBondContact O-N 2.78Å; I247-A250 WeakPolarHBondContact O-CB 3.2Å; I247-A250 PolarHBondContact O-N 3.27Å; I247-A250 VanDerWaalsContact O-N 3.13Å; I247-I251 HydrophobicContact CB-CD1 4.44Å; I247-I251 HydrophobicContact CD1-CD1 4.1Å; I247-I251 HydrophobicContact CG1-CD1 4.18Å; I247-I251 WeakPolarHBondContact O-CG1 3.48Å; I247-I251 PolarHBondContact O-N 3.07Å
248	A	91	Very high	94.3	Very high	76 Å²	76	44.6 Å²	44.6	63%	0.628	26%	0.259	S	S	*	.	H	α-helix	trans	-60.1	-42.5	-173.7	0	0	0	0	0	112.8	M252	A248-M252 WeakPolarHBondContact O-CB 3.42Å; A248-M252 PolarHBondContact O-N 3.44Å
249	T	91.3	Very high	94.2	Very high	77 Å²	77	43.6 Å²	43.6	47%	0.472	25%	0.25	S	C	.	.	H	α-helix	trans	-68	-38.2	176.9	49.7	0	0	0	0	112	I247 M252 N253	I247-T249 PolarHBondContact O-N 2.78Å; T249-M252 PolarHBondContact O-N 3.2Å; T249-N253 WeakPolarHBondContact O-CB 3.45Å; T249-N253 VanDerWaalsContact O-CG 3.23Å; T249-N253 PolarHBondContact O-N 2.98Å; T249-N253 PolarHBondContact O-ND2 3.2Å
250	A	93.8	Very high	94.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-45.4	175.9	0	0	0	0	0	111.3	I208 R241 I247 N253 S254 D255	I208-A250 HydrophobicContact CD1-CB 3.54Å; R241-A250 HydrophobicContact CG-CB 4.45Å; I247-A250 WeakPolarHBondContact O-CB 3.2Å; I247-A250 PolarHBondContact O-N 3.27Å; I247-A250 VanDerWaalsContact O-N 3.13Å; A250-N253 CarbonylContact O-C 3.54Å; A250-N253 PolarHBondContact O-N 3.13Å; A250-S254 PolarHBondContact O-N 2.78Å; A250-S254 VanDerWaalsContact O-N 3.08Å; A250-D255 PolarHBondContact O-N 3.1Å
251	I	93.3	Very high	93.9	Very high	7 Å²	7	45 Å²	45	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-47.1	175.4	-68.8	175	0	0	0	111	E194 F206 I247 N253 S254	E194-I251 VanDerWaalsContact OE2-CD1 3.23Å; E194-I251 WeakPolarHBondContact OE2-CD1 3.31Å; F206-I251 HydrophobicContact CB-CD1 4.47Å; F206-I251 HydrophobicContact CB-CG1 4.22Å; F206-I251 HydrophobicContact CB-CG2 4.28Å; F206-I251 HydrophobicContact CD1-CB 4.5Å; F206-I251 HydrophobicContact CD1-CG2 3.8Å; F206-I251 HydrophobicContact CD2-CG2 4.25Å; F206-I251 HydrophobicContact CE1-CG2 4.17Å; F206-I251 HydrophobicContact CG-CG2 3.85Å; I247-I251 HydrophobicContact CB-CD1 4.44Å; I247-I251 HydrophobicContact CD1-CD1 4.1Å; I247-I251 HydrophobicContact CG1-CD1 4.18Å; I247-I251 WeakPolarHBondContact O-CG1 3.48Å; I247-I251 PolarHBondContact O-N 3.07Å; I251-N253 PolarHBondContact O-N 2.72Å; I251-S254 PolarHBondContact O-N 3.43Å
252	M	92.4	Very high	93.8	Very high	143 Å²	143	45.9 Å²	45.9	70%	0.704	27%	0.272	S	S	*	.	H	α-helix	trans	-58.5	-36.9	177.7	-174.4	179.1	70.4	0	0	112.3	A248 T249 S254	A248-M252 WeakPolarHBondContact O-CB 3.42Å; A248-M252 PolarHBondContact O-N 3.44Å; T249-M252 PolarHBondContact O-N 3.2Å; M252-S254 VanDerWaalsContact C-N 3.32Å
253	N	95.5	Very high	93.8	Very high	115 Å²	115	48.5 Å²	48.5	62%	0.615	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	0.5	179	-66.8	-22.5	0	0	0	113.6	T249 A250 I251 D255	T249-N253 WeakPolarHBondContact O-CB 3.45Å; T249-N253 VanDerWaalsContact O-CG 3.23Å; T249-N253 PolarHBondContact O-N 2.98Å; T249-N253 PolarHBondContact O-ND2 3.2Å; A250-N253 CarbonylContact O-C 3.54Å; A250-N253 PolarHBondContact O-N 3.13Å; I251-N253 PolarHBondContact O-N 2.72Å; N253-D255 PolarHBondContact O-N 3.4Å
254	S	95.6	Very high	94	Very high	64 Å²	64	47.8 Å²	47.8	45%	0.448	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	32.1	-172.1	-53.2	0	0	0	0	113.5	A250 I251 M252 C256	A250-S254 PolarHBondContact O-N 2.78Å; A250-S254 VanDerWaalsContact O-N 3.08Å; I251-S254 PolarHBondContact O-N 3.43Å; M252-S254 VanDerWaalsContact C-N 3.32Å; S254-C256 PolarHBondContact O-N 3.42Å
255	D	97.4	Very high	94.3	Very high	64 Å²	64	50.1 Å²	50.1	34%	0.342	29%	0.293	S	S	.	.			trans	-91	59.1	175.8	-174.6	27.2	0	0	0	110.5	R241 A250 N253	R241-D255 IonicContact CZ-OD2 3.86Å; R241-D255 IonicContact NH2-OD2 3.27Å; R241-D255 PolarHBondContact NH2-OD2 3.21Å; A250-D255 PolarHBondContact O-N 3.1Å; N253-D255 PolarHBondContact O-N 3.4Å
256	C	98.1	Very high	94.8	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.02	30%	0.301	C	S	.	.	S	Bend	trans	-164.9	-178.5	177.2	63.7	0	0	0	0	109.8	A207 I208 S254 V258	A207-C256 WeakPolarHBondContact O-CB 3.26Å; I208-C256 HydrophobicContact CB-CB 3.87Å; I208-C256 HydrophobicContact CD1-CB 3.98Å; I208-C256 HydrophobicContact CG1-CB 4Å; S254-C256 PolarHBondContact O-N 3.42Å; C256-V258 PolarHBondContact O-N 2.97Å
257	L	98.5	Very high	95.2	Very high	6 Å²	6	51.2 Å²	51.2	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	112.4	173.4	174	60.2	0	0	0	109.3	A207 L225 L234 W236 F259	A207-L257 HydrophobicContact CB-CB 4.14Å; A207-L257 HydrophobicContact CB-CD2 4.29Å; A207-L257 HydrophobicContact CB-CG 4.43Å; A207-L257 PolarHBondContact N-O 3.05Å; A207-L257 PolarHBondContact O-N 3.18Å; L225-L257 HydrophobicContact CB-CD2 3.76Å; L225-L257 HydrophobicContact CD1-CB 4.05Å; L225-L257 HydrophobicContact CD1-CD2 4.3Å; L234-L257 HydrophobicContact CD2-CD1 3.9Å; L234-L257 HydrophobicContact CG-CD1 4.05Å; W236-L257 HydrophobicContact CB-CB 3.74Å; W236-L257 HydrophobicContact CB-CD1 3.95Å; W236-L257 HydrophobicContact CB-CG 4.27Å; W236-L257 HydrophobicContact CG-CB 3.94Å; L257-F259 HydrophobicContact CD1-CD1 4.36Å; L257-F259 HydrophobicContact CD2-CD1 4.45Å; L257-F259 HydrophobicContact CD2-CE1 4.21Å; L257-F259 HydrophobicContact CG-CD1 3.97Å; L257-F259 HydrophobicContact CG-CE1 4.1Å
258	V	97.9	Very high	95.4	Very high	44 Å²	44	51.3 Å²	51.3	27%	0.267	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.6	179.7	-172.3	0	0	0	0	110.8	F205 F206 C256	F205-V258 WeakPolarHBondContact O-CA 3.44Å; F206-V258 HydrophobicContact CD1-CB 4.44Å; F206-V258 HydrophobicContact CD1-CG1 4.15Å; F206-V258 HydrophobicContact CD1-CG2 3.58Å; F206-V258 HydrophobicContact CE1-CB 4.47Å; F206-V258 HydrophobicContact CE1-CG1 3.83Å; F206-V258 HydrophobicContact CE1-CG2 3.77Å; F206-V258 HydrophobicContact CZ-CG1 4.25Å; C256-V258 PolarHBondContact O-N 2.97Å
259	F	97.2	Very high	95.5	Very high	5 Å²	5	55.1 Å²	55.1	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	155.5	174.4	54.1	-84.6	0	0	0	111.6	L193 F205 L227 L234 L257 I263 A264 L273	L193-F259 HydrophobicContact CD1-CE1 4.38Å; L193-F259 HydrophobicContact CD1-CZ 3.94Å; F205-F259 HydrophobicContact CB-CD1 4.27Å; F205-F259 HydrophobicContact CB-CD2 3.76Å; F205-F259 HydrophobicContact CB-CE1 3.94Å; F205-F259 HydrophobicContact CB-CE2 3.39Å; F205-F259 HydrophobicContact CB-CG 4.18Å; F205-F259 HydrophobicContact CB-CZ 3.49Å; F205-F259 VanDerWaalsContact CB-CZ 3.49Å; F205-F259 HydrophobicContact CD1-CE2 4.27Å; F205-F259 AromaticContact CD2-CD2 3.99Å; F205-F259 HydrophobicContact CD2-CD2 3.99Å; F205-F259 AromaticContact CD2-CE2 3.81Å; F205-F259 HydrophobicContact CD2-CE2 3.81Å; F205-F259 HydrophobicContact CG-CD2 4.09Å; F205-F259 AromaticContact CG-CE2 3.57Å; F205-F259 HydrophobicContact CG-CE2 3.57Å; F205-F259 HydrophobicContact CG-CZ 4.03Å; F205-F259 PolarHBondContact N-O 3.23Å; F205-F259 PolarHBondContact O-N 3.32Å; F205-F259 VanDerWaalsContact O-N 3.11Å; L227-F259 HydrophobicContact CD1-CD1 4.14Å; L227-F259 HydrophobicContact CD1-CD2 4.43Å; L227-F259 HydrophobicContact CD1-CE1 4.03Å; L227-F259 HydrophobicContact CD1-CE2 4.31Å; L227-F259 HydrophobicContact CD1-CG 4.35Å; L227-F259 HydrophobicContact CD1-CZ 4.11Å; L234-F259 HydrophobicContact CD2-CB 4.46Å; L257-F259 HydrophobicContact CD1-CD1 4.36Å; L257-F259 HydrophobicContact CD2-CD1 4.45Å; L257-F259 HydrophobicContact CD2-CE1 4.21Å; L257-F259 HydrophobicContact CG-CD1 3.97Å; L257-F259 HydrophobicContact CG-CE1 4.1Å; F259-I263 HydrophobicContact CB-CB 3.94Å; F259-I263 HydrophobicContact CB-CD1 4.07Å; F259-I263 HydrophobicContact CB-CG2 3.67Å; F259-I263 HydrophobicContact CD2-CG2 4.33Å; F259-I263 HydrophobicContact CG-CG2 4.25Å; F259-A264 HydrophobicContact CD2-CB 3.98Å; F259-A264 HydrophobicContact CE2-CB 3.85Å; F259-L273 HydrophobicContact CE2-CD2 3.73Å; F259-L273 HydrophobicContact CZ-CD2 3.61Å
260	D	95.3	Very high	95.6	Very high	68 Å²	68	59.1 Å²	59.1	36%	0.364	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	174.1	176.8	64.5	31.7	0	0	0	112	S262 I263 A264	D260-S262 PolarHBondContact O-N 3.22Å; D260-S262 WeakPolarHBondContact OD1-CA 3.48Å; D260-S262 VanDerWaalsContact OD1-CB 3.31Å; D260-S262 WeakPolarHBondContact OD1-CB 3.49Å; D260-S262 PolarHBondContact OD1-N 3.19Å; D260-I263 PolarHBondContact O-N 2.79Å; D260-I263 WeakPolarHBondContact OD1-CG1 3.27Å; D260-I263 PolarHBondContact OD1-N 3.13Å; D260-A264 PolarHBondContact O-N 2.97Å
261	T	93.5	Very high	95.5	Very high	38 Å²	38	59.9 Å²	59.9	23%	0.233	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-32.7	177.1	-50.2	0	0	0	0	112.9	Q203 A264 Q265	Q203-T261 WeakPolarHBondContact CB-OG1 3.03Å; T261-A264 PolarHBondContact O-N 2.93Å; T261-Q265 WeakPolarHBondContact O-CG 3.35Å; T261-Q265 PolarHBondContact O-N 3Å
262	S	93.9	Very high	95.6	Very high	88 Å²	88	61.7 Å²	61.7	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-66.3	-43.1	179.4	-61.4	0	0	0	0	111.3	D260 Q265 L266	D260-S262 PolarHBondContact O-N 3.22Å; D260-S262 WeakPolarHBondContact OD1-CA 3.48Å; D260-S262 VanDerWaalsContact OD1-CB 3.31Å; D260-S262 WeakPolarHBondContact OD1-CB 3.49Å; D260-S262 PolarHBondContact OD1-N 3.19Å; S262-Q265 PolarHBondContact O-N 2.96Å; S262-L266 PolarHBondContact O-N 2.99Å
263	I	96	Very high	95.9	Very high	55 Å²	55	54.9 Å²	54.9	28%	0.282	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-45.9	172.3	-67.7	172.5	0	0	0	110	L234 F259 D260 Q265 L266 F267	L234-I263 HydrophobicContact CD2-CG2 4.19Å; F259-I263 HydrophobicContact CB-CB 3.94Å; F259-I263 HydrophobicContact CB-CD1 4.07Å; F259-I263 HydrophobicContact CB-CG2 3.67Å; F259-I263 HydrophobicContact CD2-CG2 4.33Å; F259-I263 HydrophobicContact CG-CG2 4.25Å; D260-I263 PolarHBondContact O-N 2.79Å; D260-I263 WeakPolarHBondContact OD1-CG1 3.27Å; D260-I263 PolarHBondContact OD1-N 3.13Å; I263-Q265 VanDerWaalsContact C-N 3.28Å; I263-Q265 PolarHBondContact O-N 3.15Å; I263-L266 WeakPolarHBondContact O-CB 3.49Å; I263-L266 PolarHBondContact O-N 2.9Å; I263-F267 HydrophobicContact CG2-CD2 3.82Å; I263-F267 HydrophobicContact CG2-CE2 3.71Å; I263-F267 VanDerWaalsContact O-CD2 3.24Å; I263-F267 WeakPolarHBondContact O-CD2 3.43Å
264	A	96.3	Very high	96	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-55.5	-41.8	179.3	0	0	0	0	0	112.2	I170 F205 F259 D260 T261 L266 F267 A268	I170-A264 HydrophobicContact CD1-CB 3.82Å; F205-A264 HydrophobicContact CD2-CB 4.19Å; F205-A264 HydrophobicContact CE2-CB 3.88Å; F205-A264 HydrophobicContact CZ-CB 4.38Å; F259-A264 HydrophobicContact CD2-CB 3.98Å; F259-A264 HydrophobicContact CE2-CB 3.85Å; D260-A264 PolarHBondContact O-N 2.97Å; T261-A264 PolarHBondContact O-N 2.93Å; A264-L266 VanDerWaalsContact C-N 3.28Å; A264-L266 PolarHBondContact O-N 3.46Å; A264-F267 PolarHBondContact O-N 2.85Å; A264-F267 VanDerWaalsContact O-N 3.16Å; A264-A268 VanDerWaalsContact O-CB 3.27Å; A264-A268 WeakPolarHBondContact O-CB 3.37Å; A264-A268 PolarHBondContact O-N 3.22Å
265	Q	94.6	Very high	96.1	Very high	89 Å²	89	47.6 Å²	47.6	42%	0.416	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-27.4	176.9	-64.5	-46	-45.8	0	0	114.1	N171 T261 S262 I263 F267	N171-Q265 PolarHBondContact OD1-NE2 3.13Å; T261-Q265 WeakPolarHBondContact O-CG 3.35Å; T261-Q265 PolarHBondContact O-N 3Å; S262-Q265 PolarHBondContact O-N 2.96Å; I263-Q265 VanDerWaalsContact C-N 3.28Å; I263-Q265 PolarHBondContact O-N 3.15Å; Q265-F267 PolarHBondContact O-N 3.33Å
266	L	96.9	Very high	96.2	Very high	93 Å²	93	47 Å²	47	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-72.2	-20.1	177.5	-66.3	173.4	0	0	0	112.7	S262 I263 A264	S262-L266 PolarHBondContact O-N 2.99Å; I263-L266 WeakPolarHBondContact O-CB 3.49Å; I263-L266 PolarHBondContact O-N 2.9Å; A264-L266 VanDerWaalsContact C-N 3.28Å; A264-L266 PolarHBondContact O-N 3.46Å
267	F	97.5	Very high	96.2	Very high	22 Å²	22	46.9 Å²	46.9	10%	0.096	26%	0.263	C	S	.	.	H	α-helix	trans	-113.2	-13.9	-175.8	-67.5	-68.2	0	0	0	113.4	L227 N228 R232 L234 I263 A264 Q265 L273	L227-F267 HydrophobicContact CB-CB 4.11Å; L227-F267 HydrophobicContact CB-CD1 3.71Å; L227-F267 HydrophobicContact CB-CD2 3.91Å; L227-F267 HydrophobicContact CB-CE1 4.03Å; L227-F267 HydrophobicContact CB-CE2 4.21Å; L227-F267 HydrophobicContact CB-CG 3.65Å; L227-F267 HydrophobicContact CB-CZ 4.27Å; L227-F267 HydrophobicContact CD1-CB 4.46Å; L227-F267 HydrophobicContact CD1-CD2 3.82Å; L227-F267 HydrophobicContact CD1-CE2 4.32Å; L227-F267 HydrophobicContact CD1-CG 4.22Å; L227-F267 WeakPolarHBondContact O-CE1 3.42Å; N228-F267 VanDerWaalsContact C-CD1 3.44Å; R232-F267 HydrophobicContact CB-CE1 4.11Å; R232-F267 HydrophobicContact CB-CZ 4.28Å; L234-F267 HydrophobicContact CB-CE2 4.06Å; L234-F267 HydrophobicContact CB-CZ 3.88Å; I263-F267 HydrophobicContact CG2-CD2 3.82Å; I263-F267 HydrophobicContact CG2-CE2 3.71Å; I263-F267 VanDerWaalsContact O-CD2 3.24Å; I263-F267 WeakPolarHBondContact O-CD2 3.43Å; A264-F267 PolarHBondContact O-N 2.85Å; A264-F267 VanDerWaalsContact O-N 3.16Å; Q265-F267 PolarHBondContact O-N 3.33Å; F267-L273 HydrophobicContact CB-CD1 3.68Å
268	A	96.8	Very high	96.2	Very high	20 Å²	20	47.8 Å²	47.8	17%	0.165	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	144.4	-179.8	0	0	0	0	0	112.6	I170 A264 N272 L273	I170-A268 HydrophobicContact CD1-CB 3.76Å; A264-A268 VanDerWaalsContact O-CB 3.27Å; A264-A268 WeakPolarHBondContact O-CB 3.37Å; A264-A268 PolarHBondContact O-N 3.22Å; A268-N272 CarbonylContact C-O 3.6Å; A268-N272 WeakPolarHBondContact CA-O 3.43Å; A268-N272 WeakPolarHBondContact CB-O 3.35Å; A268-L273 HydrophobicContact CB-CD1 4.38Å
269	E	94.8	Very high	96.3	Very high	155 Å²	155	45.7 Å²	45.7	72%	0.724	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.6	171.8	-68.1	-173.1	175.7	0	0	109.3	G271 N272	E269-G271 PolarHBondContact O-N 2.73Å; E269-G271 VanDerWaalsContact O-N 3.16Å; E269-N272 PolarHBondContact N-O 3.23Å; E269-N272 PolarHBondContact O-N 2.79Å
270	N	92.2	Very high	96.3	Very high	161 Å²	161	48.1 Å²	48.1	86%	0.861	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	34.5	-178.4	-56.4	-37.6	0	0	0	114	N272	N270-N272 VanDerWaalsContact C-N 3.27Å; N270-N272 PolarHBondContact O-N 3.41Å
271	G	91.8	Very high	96.4	Very high	17 Å²	17	51 Å²	51	18%	0.175	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	5.6	-178.5	0	0	0	0	0	114.9	D169 I170 E269	D169-G271 WeakPolarHBondContact CA-O 3.33Å; D169-G271 PolarHBondContact N-O 3.27Å; I170-G271 WeakPolarHBondContact CG1-O 3.29Å; I170-G271 PolarHBondContact N-O 3.33Å; E269-G271 PolarHBondContact O-N 2.73Å; E269-G271 VanDerWaalsContact O-N 3.16Å
272	N	96.4	Very high	96.3	Very high	45 Å²	45	55.4 Å²	55.4	24%	0.241	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.4	175.5	-53	-49.5	0	0	0	110.3	L166 A167 T168 D169 A268 E269 N270	L166-N272 HydrophobicContact CD1-CB 3.87Å; L166-N272 HydrophobicContact CG-CB 4.42Å; A167-N272 CarbonylContact O-C 3.34Å; A167-N272 WeakPolarHBondContact O-CA 3.41Å; T168-N272 VanDerWaalsContact CA-OD1 3.24Å; T168-N272 WeakPolarHBondContact CA-OD1 3.26Å; D169-N272 PolarHBondContact N-OD1 3.21Å; A268-N272 CarbonylContact C-O 3.6Å; A268-N272 WeakPolarHBondContact CA-O 3.43Å; A268-N272 WeakPolarHBondContact CB-O 3.35Å; E269-N272 PolarHBondContact N-O 3.23Å; E269-N272 PolarHBondContact O-N 2.79Å; N270-N272 VanDerWaalsContact C-N 3.27Å; N270-N272 PolarHBondContact O-N 3.41Å
273	L	97.8	Very high	96.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116	177.6	-174.1	68.3	0	0	0	109.8	A167 I170 L193 L227 F259 F267 A268 I275	A167-L273 HydrophobicContact CB-CB 4.41Å; A167-L273 PolarHBondContact N-O 3.26Å; A167-L273 PolarHBondContact O-N 3.15Å; I170-L273 HydrophobicContact CD1-CB 4.31Å; I170-L273 HydrophobicContact CG2-CB 3.77Å; L193-L273 HydrophobicContact CD2-CD2 4.47Å; L227-L273 HydrophobicContact CD2-CD1 4.05Å; L227-L273 HydrophobicContact CD2-CD2 4.18Å; L227-L273 HydrophobicContact CD2-CG 4.1Å; F259-L273 HydrophobicContact CE2-CD2 3.73Å; F259-L273 HydrophobicContact CZ-CD2 3.61Å; F267-L273 HydrophobicContact CB-CD1 3.68Å; A268-L273 HydrophobicContact CB-CD1 4.38Å; L273-I275 HydrophobicContact CD2-CD1 4.4Å; L273-I275 HydrophobicContact CD2-CG1 4.44Å; L273-I275 HydrophobicContact CG-CG1 4.33Å
274	G	97.7	Very high	96.5	Very high	25 Å²	25	53.7 Å²	53.7	26%	0.258	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.6	172.2	0	0	0	0	0	110.8
275	I	98.6	Very high	96.5	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.9	174.8	-45.4	-172.7	0	0	0	107.6	F165 L193 A207 L225 L227 L273 V277	F165-I275 HydrophobicContact CB-CB 4.37Å; F165-I275 HydrophobicContact CD1-CD1 4.25Å; F165-I275 PolarHBondContact N-O 3.44Å; F165-I275 PolarHBondContact O-N 2.97Å; L193-I275 HydrophobicContact CD1-CD1 4.3Å; L193-I275 HydrophobicContact CD2-CD1 4.37Å; A207-I275 HydrophobicContact CB-CD1 4.39Å; L225-I275 HydrophobicContact CB-CG2 4.12Å; L225-I275 HydrophobicContact CD2-CG2 4.09Å; L227-I275 HydrophobicContact CD2-CB 4.25Å; L227-I275 HydrophobicContact CD2-CD1 4.27Å; L227-I275 HydrophobicContact CD2-CG1 3.68Å; L227-I275 HydrophobicContact CD2-CG2 4.21Å; L273-I275 HydrophobicContact CD2-CD1 4.4Å; L273-I275 HydrophobicContact CD2-CG1 4.44Å; L273-I275 HydrophobicContact CG-CG1 4.33Å; I275-V277 HydrophobicContact CG2-CG2 4.24Å; I275-V277 PolarHBondContact O-N 3.47Å
276	N	98.6	Very high	96.6	Very high	52 Å²	52	54.8 Å²	54.8	28%	0.278	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	128.9	170.8	-67.3	-10.3	0	0	0	108.1	L225 E226 N228	L225-N276 WeakPolarHBondContact CA-O 3.44Å; E226-N276 HydrophobicContact CB-CB 4.19Å; E226-N276 PolarHBondContact N-O 3.06Å; E226-N276 PolarHBondContact O-N 2.99Å; N228-N276 PolarHBondContact ND2-ND2 3.4Å
277	V	98.8	Very high	96.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	112.4	-178.5	-172	0	0	0	0	109	D162 I163 F165 Q182 L191 V209 R224 L225 I275	D162-V277 WeakPolarHBondContact CA-O 3.48Å; I163-V277 HydrophobicContact CG1-CB 4.12Å; I163-V277 PolarHBondContact N-O 3.45Å; I163-V277 PolarHBondContact O-N 3.12Å; F165-V277 HydrophobicContact CB-CG2 3.97Å; Q182-V277 VanDerWaalsContact OE1-CG1 3.23Å; L191-V277 HydrophobicContact CD1-CB 4.23Å; L191-V277 HydrophobicContact CD1-CG1 4.14Å; L191-V277 HydrophobicContact CD1-CG2 3.91Å; L191-V277 HydrophobicContact CD2-CG1 3.73Å; V209-V277 HydrophobicContact CG2-CG1 4.45Å; R224-V277 WeakPolarHBondContact O-CA 3.47Å; L225-V277 HydrophobicContact CD2-CB 4.26Å; L225-V277 HydrophobicContact CD2-CG1 3.93Å; L225-V277 HydrophobicContact CD2-CG2 3.63Å; I275-V277 HydrophobicContact CG2-CG2 4.24Å; I275-V277 PolarHBondContact O-N 3.47Å
278	T	98.8	Very high	96.5	Very high	25 Å²	25	54.4 Å²	54.4	15%	0.153	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.5	174.4	-44.3	0	0	0	0	109.5	E161 D162 Y223 R224	E161-T278 CarbonylContact O-C 3.48Å; E161-T278 VanDerWaalsContact O-CA 3.27Å; E161-T278 WeakPolarHBondContact O-CA 3.45Å; D162-T278 HydrophobicContact CB-CG2 4.45Å; D162-T278 PolarHBondContact OD1-OG1 3.24Å; Y223-T278 CarbonylContact C-O 3.49Å; Y223-T278 VanDerWaalsContact CA-O 3.28Å; Y223-T278 WeakPolarHBondContact CA-O 3.49Å; R224-T278 PolarHBondContact N-O 3.34Å; R224-T278 PolarHBondContact NH2-OG1 2.86Å; R224-T278 PolarHBondContact O-N 2.84Å
279	I	98.8	Very high	96.5	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.8	172.3	-59.9	-176.2	0	0	0	108.4	E161 Q182 F185 F189 F221	E161-I279 PolarHBondContact O-N 3.5Å; Q182-I279 HydrophobicContact CG-CD1 4.16Å; F185-I279 HydrophobicContact CD2-CG2 4.25Å; F185-I279 HydrophobicContact CE2-CB 4.48Å; F185-I279 HydrophobicContact CE2-CG2 4.06Å; F185-I279 WeakPolarHBondContact CE2-O 3.24Å; F189-I279 HydrophobicContact CB-CD1 3.57Å; F189-I279 HydrophobicContact CD1-CD1 3.75Å; F189-I279 HydrophobicContact CD2-CD1 3.39Å; F189-I279 HydrophobicContact CE1-CD1 4.23Å; F189-I279 HydrophobicContact CE1-CG2 4.13Å; F189-I279 HydrophobicContact CE2-CD1 3.94Å; F189-I279 HydrophobicContact CE2-CG2 4.01Å; F189-I279 HydrophobicContact CG-CD1 3.29Å; F189-I279 HydrophobicContact CZ-CD1 4.32Å; F189-I279 HydrophobicContact CZ-CG2 3.79Å; F221-I279 HydrophobicContact CD1-CG2 4.24Å
280	S	98.3	Very high	96.7	Very high	56 Å²	56	49.3 Å²	49.3	39%	0.392	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.4	-179.5	56.6	0	0	0	0	110.7	F221 A222	F221-S280 CarbonylContact C-O 3.58Å; F221-S280 VanDerWaalsContact CA-O 3.27Å; F221-S280 WeakPolarHBondContact CA-O 3.14Å; A222-S280 PolarHBondContact N-O 3.31Å; A222-S280 PolarHBondContact O-N 3.28Å; A222-S280 PolarHBondContact O-OG 3Å
281	M	97	Very high	97	Very high	129 Å²	129	40 Å²	40	64%	0.635	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	143.1	169.6	-64.6	-178.8	-67.1	0	0	109.7	F185 N220 F221	F185-M281 HydrophobicContact CD1-CE 3.91Å; F185-M281 HydrophobicContact CD1-CG 4.08Å; F185-M281 HydrophobicContact CD1-SD 3.9Å; F185-M281 HydrophobicContact CE1-CE 3.84Å; F185-M281 HydrophobicContact CE1-CG 4.22Å; F185-M281 HydrophobicContact CE1-SD 4.31Å; F185-M281 HydrophobicContact CG-CG 4.26Å; F185-M281 HydrophobicContact CG-SD 4.4Å; F185-M281 HydrophobicContact CZ-CG 4.49Å; N220-M281 WeakPolarHBondContact O-CA 3.43Å; F221-M281 HydrophobicContact CD1-CG 4.01Å; F221-M281 HydrophobicContact CE1-CG 3.66Å
282	C	91.9	Very high	97.5	Very high	129 Å²	129	42.1 Å²	42.1	87%	0.872	26%	0.258	S	S	*	.			trans	-124.6	0	177.1	53.1	0	0	0	0	113.2	N220 F221	N220-C282 PolarHBondContact O-N 3.48Å; F221-C282 VanDerWaalsContact C-SG 3.53Å; F221-C282 PolarHBondContact N-SG 3.4Å; F221-C282 VanDerWaalsContact N-SG 3.45Å

Retrieved 282 of 282 residues in 396.8 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).