A0A096MSJ9_PAPAN Loading...

Ganglioside GM2 activator

The large binding pocket can accommodate several single chain phospholipids and fatty acids, GM2A also exhibits some calcium-independent phospholipase activity. Binds gangliosides and stimulates ganglioside GM2 degradation. It stimulates only the breakdown of ganglioside GM2 and glycolipid GA2 by beta-hexosaminidase A. It extracts single GM2 molecules from membranes and presents them in soluble form to beta-hexosaminidase A for cleavage of N-acetyl-D-galactosamine and conversion to GM3. Has cholesterol transfer activity.

AlphaFold DB , UniProt , Accession A0A096MSJ9, Species PAPAN (Papio anubis, Olive baboon), Gene GM2A, Length 193 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	47.7	Very low	241 Å²	241	146.8 Å²	146.8	100%	1.187	81%	0.805	S	S	*	*				0	126.5	0	-147.4	135.7	71.4	0	0	107
2	Q	44	Very low	47.9	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	79%	0.788	S	S	*	*			trans	-49	163.5	176.7	-65.5	148.3	-51	0	0	111.3
3	S	44.3	Very low	47.8	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	79%	0.785	S	S	*	*			cis	-174.6	174.1	16.2	-134.9	0	0	0	0	107.3
4	L	51.8	Low	47.9	Very low	150 Å²	150	134.9 Å²	134.9	79%	0.785	77%	0.771	S	S	*	*			trans	68	112.1	150.7	-101.5	74.5	0	0	0	117.7
5	M	48	Very low	48	Very low	171 Å²	171	135.1 Å²	135.1	84%	0.842	77%	0.767	S	S	*	*				-179.8	80.7	107.2	-90.7	-174.9	110.1	0	0	108.9
6	Q	55.1	Low	48	Very low	194 Å²	194	136 Å²	136	91%	0.907	77%	0.769	S	S	*	*			trans	-67.9	152.9	144.8	-73.7	-178.9	-39.5	0	0	107.8
7	A	51.1	Low	48	Very low	80 Å²	80	139.3 Å²	139.3	66%	0.661	77%	0.773	S	S	*	*			trans	94.1	75.2	174.4	0	0	0	0	0	116.6
8	P	47.7	Very low	48.2	Very low	103 Å²	103	136.1 Å²	136.1	67%	0.669	77%	0.767	S	S	*	*	S	Bend	trans	-124.3	-7	135.2	34.3	-26.2	0	0	0	113.9
9	V	48.1	Very low	48.4	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	76%	0.762	S	S	*	*	S	Bend	trans	-86.1	-20.1	-170.7	-177.3	0	0	0	0	113.9
10	L	46.2	Very low	48.3	Very low	162 Å²	162	132.1 Å²	132.1	85%	0.848	76%	0.76	S	S	*	*	S	Bend	trans	-87.8	-7.7	-178.5	-87.8	158.4	0	0	0	115.1
11	V	51	Low	48.3	Very low	110 Å²	110	130.3 Å²	130.3	67%	0.667	76%	0.761	S	S	*	*	S	Bend	trans	-88.9	-20.9	-178.9	-177.4	0	0	0	0	112.1
12	A	49.4	Very low	49	Very low	73 Å²	73	126.4 Å²	126.4	60%	0.603	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-13.5	-176.1	0	0	0	0	0	115
13	L	46.6	Very low	49.2	Very low	143 Å²	143	121.7 Å²	121.7	75%	0.749	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-4.4	-179.4	-126.5	79.9	0	0	0	114.5
14	G	49.4	Very low	49.5	Very low	57 Å²	57	124.9 Å²	124.9	59%	0.588	74%	0.736	S	S	*	*	S	Bend	trans	-88.7	-11.8	179	0	0	0	0	0	114.9
15	L	49.5	Very low	49.4	Very low	138 Å²	138	125.4 Å²	125.4	72%	0.723	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	2.8	-173	-76.2	161	0	0	0	114.5
16	L	47.7	Very low	49.4	Very low	150 Å²	150	125.8 Å²	125.8	79%	0.785	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	2.8	176.8	-81.3	158.3	0	0	0	114.3
17	F	49	Very low	49	Very low	192 Å²	192	123.9 Å²	123.9	84%	0.842	73%	0.725	S	S	*	*	S	Bend	trans	-117.3	16.7	170.1	-70.4	-69.9	0	0	0	113.9	A19	F17-A19 PolarHBondContact O-N 2.81Å
18	A	51.9	Low	49.2	Very low	81 Å²	81	125 Å²	125	67%	0.669	73%	0.725	S	S	*	*			trans	-82.8	62	161.3	0	0	0	0	0	109.1
19	A	51.3	Low	49.7	Very low	81 Å²	81	123.8 Å²	123.8	67%	0.669	72%	0.719	S	S	*	*			trans	-58.9	132.1	158.4	0	0	0	0	0	106.1	F17 A21	F17-A19 PolarHBondContact O-N 2.81Å; A19-A21 PolarHBondContact O-N 3.09Å
20	P	47.3	Very low	50.8	Low	112 Å²	112	124.2 Å²	124.2	73%	0.727	71%	0.713	S	S	*	*			trans	-57.8	116.4	171.1	25.4	-30.1	0	0	0	105.1	Q22	P20-Q22 PolarHBondContact O-N 3.34Å
21	A	47.7	Very low	52.3	Low	95 Å²	95	119.7 Å²	119.7	79%	0.785	69%	0.689	S	S	*	*			trans	-51.3	107.6	155.3	0	0	0	0	0	103.3	A19 A23	A19-A21 PolarHBondContact O-N 3.09Å; A21-A23 PolarHBondContact O-N 3.04Å
22	Q	52.8	Low	53.7	Low	159 Å²	159	115.9 Å²	115.9	74%	0.743	67%	0.673	S	S	*	*			trans	-57.4	96	163.8	-74	175.7	-35.1	0	0	102.4	P20 H24	P20-Q22 PolarHBondContact O-N 3.34Å; Q22-H24 PolarHBondContact O-N 3.31Å
23	A	47	Very low	55.7	Low	83 Å²	83	116.6 Å²	116.6	69%	0.686	67%	0.673	S	S	*	*			trans	-53.7	98.8	158.2	0	0	0	0	0	102	A21 L25	A21-A23 PolarHBondContact O-N 3.04Å; A23-L25 PolarHBondContact O-N 2.65Å
24	H	50.9	Low	58.1	Low	163 Å²	163	111.7 Å²	111.7	76%	0.755	65%	0.646	S	S	*	*			trans	-53.8	99.6	163.9	-80.8	-83	0	0	0	102.6	Q22 K26	Q22-H24 PolarHBondContact O-N 3.31Å; H24-K26 PolarHBondContact O-N 3.36Å
25	L	49.9	Very low	60.3	Low	162 Å²	162	111.8 Å²	111.8	85%	0.848	64%	0.638	S	S	*	*			trans	-52.5	105.3	170.4	-135.5	83.2	0	0	0	102.1	A23 K27	A23-L25 PolarHBondContact O-N 2.65Å; L25-K27 PolarHBondContact O-N 3.25Å
26	K	48.4	Very low	62.6	Low	179 Å²	179	108.7 Å²	108.7	78%	0.778	62%	0.617	S	S	*	*			trans	-58.1	102.3	175.8	-77.9	-175.1	177.1	-177.2	0	103.5	H24 P28	H24-K26 PolarHBondContact O-N 3.36Å; K26-P28 VanDerWaalsContact O-N 3.1Å
27	K	46.3	Very low	65	Low	153 Å²	153	106.4 Å²	106.4	67%	0.665	61%	0.605	S	S	*	*			trans	-53	124.1	177.1	-163.7	178	-176.9	-171.1	0	104	L25 S29	L25-K27 PolarHBondContact O-N 3.25Å; K27-S29 PolarHBondContact O-N 2.92Å; K27-S29 VanDerWaalsContact O-N 3.16Å
28	P	55.1	Low	67.4	Low	104 Å²	104	98.2 Å²	98.2	68%	0.675	57%	0.57	S	S	*	*			trans	-50	131.5	175.9	18.1	-28.4	0	0	0	106.7	K26 Q30	K26-P28 VanDerWaalsContact O-N 3.1Å; P28-Q30 VanDerWaalsContact C-N 3.34Å; P28-Q30 PolarHBondContact O-N 2.93Å
29	S	57.8	Low	69.4	Low	77 Å²	77	96 Å²	96	54%	0.538	55%	0.549	S	S	.	.			trans	-53.5	103.7	179.8	49.1	0	0	0	0	106.8	K27 L31	K27-S29 PolarHBondContact O-N 2.92Å; K27-S29 VanDerWaalsContact O-N 3.16Å; S29-L31 PolarHBondContact O-N 3.48Å
30	Q	71.7	Confident	71.3	Confident	134 Å²	134	95.2 Å²	95.2	63%	0.626	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-67.9	129.7	178.9	-67.3	-155	-53.1	0	0	106.1	P28 G32 N167	P28-Q30 VanDerWaalsContact C-N 3.34Å; P28-Q30 PolarHBondContact O-N 2.93Å; Q30-G32 PolarHBondContact O-N 2.92Å; Q30-G32 VanDerWaalsContact O-N 3.13Å; Q30-N167 PolarHBondContact O-ND2 3.09Å
31	L	78.8	Confident	73.1	Confident	67 Å²	67	97.4 Å²	97.4	35%	0.351	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-58.9	122	174.3	-66.7	175.3	0	0	0	107.2	S29 P57 T165 N167	S29-L31 PolarHBondContact O-N 3.48Å; L31-P57 HydrophobicContact CD1-CB 3.95Å; L31-P57 HydrophobicContact CD1-CG 3.77Å; L31-T165 HydrophobicContact CD2-CG2 4.26Å; L31-N167 VanDerWaalsContact CA-OD1 3.28Å; L31-N167 WeakPolarHBondContact CA-OD1 3.48Å
32	G	80.3	Confident	74.7	Confident	31 Å²	31	94 Å²	94	32%	0.32	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-70.5	163.2	178.3	0	0	0	0	0	110.6	Q30 N167 S189	Q30-G32 PolarHBondContact O-N 2.92Å; Q30-G32 VanDerWaalsContact O-N 3.13Å; G32-N167 PolarHBondContact N-OD1 3.49Å; G32-S189 PolarHBondContact N-OG 3.23Å; G32-S189 WeakPolarHBondContact O-CB 3.14Å; G32-S189 PolarHBondContact O-OG 2.93Å
33	S	90.2	Very high	76.5	Confident	88 Å²	88	94 Å²	94	62%	0.615	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-83.5	148.8	170.9	58.1	0	0	0	0	111.2	S35 D56	S33-S35 PolarHBondContact O-N 3.08Å; S33-D56 WeakPolarHBondContact CA-OD2 3.29Å
34	F	96.4	Very high	79	Confident	39 Å²	39	91.2 Å²	91.2	17%	0.171	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-52.6	132.7	168.9	172.1	-105.1	0	0	0	110.9	W36 L51 L53 D56 I186 A187 A188	F34-W36 AromaticContact CE1-CD1 3.58Å; F34-W36 HydrophobicContact CZ-CB 4.32Å; F34-W36 AromaticContact CZ-CD1 3.55Å; F34-W36 HydrophobicContact CZ-CG 4.23Å; F34-L51 HydrophobicContact CE2-CD2 4.39Å; F34-L51 HydrophobicContact CZ-CD2 3.81Å; F34-L51 HydrophobicContact CZ-CG 3.79Å; F34-L53 HydrophobicContact CD1-CB 4.08Å; F34-L53 HydrophobicContact CD2-CB 3.67Å; F34-L53 HydrophobicContact CD2-CD2 3.59Å; F34-L53 HydrophobicContact CD2-CG 4.22Å; F34-L53 HydrophobicContact CE1-CB 4.03Å; F34-L53 HydrophobicContact CE2-CB 3.61Å; F34-L53 HydrophobicContact CE2-CD2 3.6Å; F34-L53 HydrophobicContact CE2-CG 4.28Å; F34-L53 HydrophobicContact CG-CB 3.9Å; F34-L53 HydrophobicContact CG-CD2 4.5Å; F34-L53 HydrophobicContact CZ-CB 3.82Å; F34-D56 PolarHBondContact N-OD2 2.81Å; F34-I186 HydrophobicContact CD2-CG2 4.36Å; F34-I186 HydrophobicContact CE2-CG2 3.72Å; F34-A187 WeakPolarHBondContact CA-O 3.42Å; F34-A188 HydrophobicContact CD2-CB 4.28Å
35	S	97.3	Very high	81.2	Confident	60 Å²	60	85 Å²	85	42%	0.42	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	156.3	173.8	52.2	0	0	0	0	110.4	S33 I186 A187	S33-S35 PolarHBondContact O-N 3.08Å; S35-I186 CarbonylContact O-C 3.26Å; S35-I186 WeakPolarHBondContact O-CA 3.4Å; S35-A187 PolarHBondContact N-O 2.79Å; S35-A187 PolarHBondContact O-N 2.84Å
36	W	97.8	Very high	83.5	Confident	73 Å²	73	77.8 Å²	77.8	28%	0.277	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	156.5	175.6	66.7	-83.1	0	0	0	110.4	F34 I48 L51 I184 K185 I186	F34-W36 AromaticContact CE1-CD1 3.58Å; F34-W36 HydrophobicContact CZ-CB 4.32Å; F34-W36 AromaticContact CZ-CD1 3.55Å; F34-W36 HydrophobicContact CZ-CG 4.23Å; W36-I48 HydrophobicContact CD2-CG2 4.44Å; W36-I48 HydrophobicContact CE3-CB 4.19Å; W36-I48 HydrophobicContact CE3-CG2 3.86Å; W36-I48 HydrophobicContact CH2-CB 4.38Å; W36-I48 HydrophobicContact CH2-CG2 3.79Å; W36-I48 HydrophobicContact CZ2-CG2 4.37Å; W36-I48 HydrophobicContact CZ3-CB 3.73Å; W36-I48 HydrophobicContact CZ3-CG2 3.5Å; W36-I48 VanDerWaalsContact CZ3-CG2 3.5Å; W36-I48 WeakPolarHBondContact CZ3-O 3.32Å; W36-L51 HydrophobicContact CB-CD2 4.08Å; W36-L51 HydrophobicContact CD2-CB 3.89Å; W36-L51 HydrophobicContact CD2-CD2 4.46Å; W36-L51 HydrophobicContact CG-CB 3.98Å; W36-L51 HydrophobicContact CG-CD2 3.96Å; W36-L51 HydrophobicContact CG-CG 4.43Å; W36-L51 HydrophobicContact CZ2-CB 4.33Å; W36-L51 PolarHBondContact NE1-O 2.79Å; W36-I184 HydrophobicContact CB-CD1 4.49Å; W36-I184 HydrophobicContact CE3-CD1 4.05Å; W36-K185 CarbonylContact C-O 3.59Å; W36-K185 WeakPolarHBondContact CA-O 3.45Å; W36-K185 WeakPolarHBondContact CB-O 3.49Å; W36-I186 HydrophobicContact CB-CG1 4.09Å
37	D	97.9	Very high	85.9	Confident	102 Å²	102	69.7 Å²	69.7	55%	0.545	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	153.8	173	-160.3	3.3	0	0	0	111.4	I184 K185	D37-I184 WeakPolarHBondContact O-CA 3.43Å; D37-K185 PolarHBondContact N-O 3.5Å; D37-K185 PolarHBondContact O-N 2.79Å
38	N	98.1	Very high	88.3	Confident	20 Å²	20	64.3 Å²	64.3	11%	0.107	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	135.8	166.5	-60.1	-79.3	0	0	0	108.9	D40 E41 I48 C183	N38-D40 VanDerWaalsContact C-N 3.31Å; N38-D40 PolarHBondContact O-N 2.91Å; N38-E41 PolarHBondContact O-N 3.25Å; N38-I48 PolarHBondContact ND2-O 3.35Å; N38-I48 PolarHBondContact OD1-N 3.26Å; N38-C183 WeakPolarHBondContact CA-O 3.31Å
39	C	95.6	Very high	90.4	Very high	34 Å²	34	66.8 Å²	66.8	23%	0.23	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-32.9	-169.7	-50.4	0	0	0	0	114.3	C183 I184	C39-C183 HydrophobicContact CB-CB 3.55Å; C39-C183 WeakPolarHBondContact CB-SG 3.27Å; C39-C183 PolarHBondContact N-O 2.82Å; C39-C183 VanDerWaalsContact N-O 3.08Å; C39-C183 WeakPolarHBondContact SG-CB 3.38Å; C39-C183 PolarHBondContact SG-O 2.88Å; C39-C183 CovalentContact SG-SG 2.03Å; C39-C183 PolarHBondContact SG-SG 2.94Å; C39-I184 PolarHBondContact SG-N 3.35Å
40	D	89.9	Confident	92.3	Very high	64 Å²	64	65.2 Å²	65.2	34%	0.342	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	37.3	-174.1	-58.3	-32.1	0	0	0	112.4	N38 G42 K43 R180	N38-D40 VanDerWaalsContact C-N 3.31Å; N38-D40 PolarHBondContact O-N 2.91Å; D40-G42 PolarHBondContact O-N 2.69Å; D40-K43 HydrophobicContact CB-CB 4.44Å; D40-K43 WeakPolarHBondContact O-CB 3.25Å; D40-K43 WeakPolarHBondContact O-CD 3.42Å; D40-K43 VanDerWaalsContact O-CG 3.32Å; D40-K43 WeakPolarHBondContact O-CG 3.2Å; D40-K43 PolarHBondContact O-N 2.91Å; D40-K43 VanDerWaalsContact O-N 3.09Å; D40-R180 IonicContact OD1-NH2 3.31Å; D40-R180 PolarHBondContact OD1-NH2 2.88Å; D40-R180 IonicContact OD2-CZ 3.2Å; D40-R180 IonicContact OD2-NE 2.67Å; D40-R180 PolarHBondContact OD2-NE 3.39Å; D40-R180 IonicContact OD2-NH2 2.65Å; D40-R180 PolarHBondContact OD2-NH2 2.97Å
41	E	85	Confident	93.6	Very high	158 Å²	158	60.1 Å²	60.1	74%	0.738	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	24	-179.6	-54.5	171.5	158.8	0	0	113.2	N38 K43	N38-E41 PolarHBondContact O-N 3.25Å; E41-K43 IonicContact OE2-NZ 2.81Å; E41-K43 PolarHBondContact OE2-NZ 2.9Å
42	G	81.8	Confident	94.4	Very high	25 Å²	25	59 Å²	59	26%	0.258	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	24.9	-179	0	0	0	0	0	115.6	D40	D40-G42 PolarHBondContact O-N 2.69Å
43	K	91.2	Very high	95.2	Very high	157 Å²	157	59.1 Å²	59.1	68%	0.683	31%	0.312	S	S	*	.			trans	-75.1	-24.2	173.9	-70.4	167.5	-169	147.2	0	113.8	D40 E41	D40-K43 HydrophobicContact CB-CB 4.44Å; D40-K43 WeakPolarHBondContact O-CB 3.25Å; D40-K43 WeakPolarHBondContact O-CD 3.42Å; D40-K43 VanDerWaalsContact O-CG 3.32Å; D40-K43 WeakPolarHBondContact O-CG 3.2Å; D40-K43 PolarHBondContact O-N 2.91Å; D40-K43 VanDerWaalsContact O-N 3.09Å; E41-K43 IonicContact OE2-NZ 2.81Å; E41-K43 PolarHBondContact OE2-NZ 2.9Å
44	D	97.8	Very high	95.5	Very high	26 Å²	26	58.8 Å²	58.8	14%	0.139	30%	0.301	C	S	.	.	S	Bend	trans	-62.8	149.9	174.3	-79.5	-29.9	0	0	0	111	A46 V47 R180 G182 C183	D44-A46 VanDerWaalsContact C-N 3.28Å; D44-A46 PolarHBondContact O-N 2.03Å; D44-V47 VanDerWaalsContact O-CG1 3.26Å; D44-V47 WeakPolarHBondContact O-CG1 3.49Å; D44-R180 IonicContact OD1-NE 2.92Å; D44-R180 IonicContact OD2-CZ 3.75Å; D44-R180 IonicContact OD2-NE 3.25Å; D44-R180 PolarHBondContact OD2-NE 3.35Å; D44-R180 IonicContact OD2-NH2 3.72Å; D44-G182 WeakPolarHBondContact OD2-CA 3.16Å; D44-C183 PolarHBondContact OD2-N 2.88Å
45	P	97.8	Very high	95.4	Very high	31 Å²	31	59.4 Å²	59.4	20%	0.201	31%	0.309	C	S	.	.	S	Bend	trans	-66.8	-28	-178.1	26.2	-34.5	0	0	0	113.3	T72 S73 V74 L181	P45-T72 CarbonylContact O-C 3.54Å; P45-T72 VanDerWaalsContact O-CA 3.24Å; P45-T72 WeakPolarHBondContact O-CA 3.25Å; P45-S73 VanDerWaalsContact CB-OG 3.31Å; P45-S73 WeakPolarHBondContact CB-OG 3.32Å; P45-S73 PolarHBondContact O-N 3.17Å; P45-V74 HydrophobicContact CB-CG1 4.11Å; P45-V74 HydrophobicContact CB-CG2 3.89Å; P45-V74 HydrophobicContact CG-CG2 4.03Å; P45-L181 WeakPolarHBondContact CD-O 3.31Å; P45-L181 HydrophobicContact CG-CB 4.48Å; P45-L181 HydrophobicContact CG-CD2 4.06Å; P45-L181 VanDerWaalsContact CG-O 3.32Å; P45-L181 WeakPolarHBondContact CG-O 3.48Å
46	A	98.3	Very high	95.2	Very high	12 Å²	12	60 Å²	60	10%	0.099	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.1	174.3	0	0	0	0	0	110.8	D44 S71 L76 L181 G182	D44-A46 VanDerWaalsContact C-N 3.28Å; D44-A46 PolarHBondContact O-N 2.03Å; A46-S71 WeakPolarHBondContact CA-O 3.43Å; A46-L76 HydrophobicContact CB-CD2 4.23Å; A46-L181 WeakPolarHBondContact CA-O 3.27Å; A46-L181 VanDerWaalsContact CB-O 3.25Å; A46-L181 WeakPolarHBondContact CB-O 3.47Å; A46-L181 PolarHBondContact N-O 3.26Å; A46-G182 VanDerWaalsContact O-CA 3.29Å; A46-G182 WeakPolarHBondContact O-CA 3.41Å
47	V	98.3	Very high	95	Very high	8 Å²	8	58.1 Å²	58.1	5%	0.048	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	150.8	-173.3	-62.9	0	0	0	0	111.8	D44 G70 S71	D44-V47 VanDerWaalsContact O-CG1 3.26Å; D44-V47 WeakPolarHBondContact O-CG1 3.49Å; V47-G70 CarbonylContact O-C 3.57Å; V47-G70 WeakPolarHBondContact O-CA 3.32Å; V47-S71 WeakPolarHBondContact CG2-OG 3.36Å; V47-S71 PolarHBondContact N-O 3.48Å; V47-S71 PolarHBondContact O-N 3.48Å
48	I	98.2	Very high	94.8	Very high	40 Å²	40	54.2 Å²	54.2	21%	0.205	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.2	167.8	-60.1	-50.7	0	0	0	109.2	W36 N38 L51 V68 I184	W36-I48 HydrophobicContact CD2-CG2 4.44Å; W36-I48 HydrophobicContact CE3-CB 4.19Å; W36-I48 HydrophobicContact CE3-CG2 3.86Å; W36-I48 HydrophobicContact CH2-CB 4.38Å; W36-I48 HydrophobicContact CH2-CG2 3.79Å; W36-I48 HydrophobicContact CZ2-CG2 4.37Å; W36-I48 HydrophobicContact CZ3-CB 3.73Å; W36-I48 HydrophobicContact CZ3-CG2 3.5Å; W36-I48 VanDerWaalsContact CZ3-CG2 3.5Å; W36-I48 WeakPolarHBondContact CZ3-O 3.32Å; N38-I48 PolarHBondContact ND2-O 3.35Å; N38-I48 PolarHBondContact OD1-N 3.26Å; I48-L51 HydrophobicContact CG2-CB 3.96Å; I48-V68 HydrophobicContact CD1-CG2 4.14Å; I48-V68 HydrophobicContact CG2-CG2 4.31Å; I48-I184 HydrophobicContact CB-CD1 3.95Å; I48-I184 HydrophobicContact CG1-CD1 3.5Å; I48-I184 VanDerWaalsContact CG1-CD1 3.5Å; I48-I184 HydrophobicContact CG2-CD1 4.28Å
49	R	97.9	Very high	94.5	Very high	157 Å²	157	56.4 Å²	56.4	59%	0.592	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	-37	-179.8	-60.5	-62.1	-175.6	-173.9	-3.3	111.9	V69 S71	R49-V69 HydrophobicContact CB-CB 4.23Å; R49-V69 HydrophobicContact CB-CG1 4.06Å; R49-V69 WeakPolarHBondContact CB-O 3.26Å; R49-V69 HydrophobicContact CG-CG1 4.47Å; R49-V69 PolarHBondContact N-O 2.84Å; R49-S71 PolarHBondContact NE-OG 2.8Å; R49-S71 PolarHBondContact NH2-OG 2.86Å
50	S	98.1	Very high	94.1	Very high	44 Å²	44	56 Å²	56	31%	0.308	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	143	172	63	0	0	0	0	110	V68 V69	S50-V68 CarbonylContact O-C 3.58Å; S50-V68 VanDerWaalsContact O-CA 3.31Å; S50-V68 WeakPolarHBondContact O-CA 3.38Å; S50-V69 PolarHBondContact N-O 2.82Å; S50-V69 PolarHBondContact O-N 2.88Å; S50-V69 WeakPolarHBondContact OG-CB 3.24Å; S50-V69 VanDerWaalsContact OG-CG2 3.25Å; S50-V69 WeakPolarHBondContact OG-CG2 3.37Å
51	L	98.1	Very high	94.1	Very high	26 Å²	26	54.8 Å²	54.8	14%	0.136	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	130.6	171.9	177.1	67.9	0	0	0	108.6	F34 W36 I48 V66 S67 V68 I184 I186	F34-L51 HydrophobicContact CE2-CD2 4.39Å; F34-L51 HydrophobicContact CZ-CD2 3.81Å; F34-L51 HydrophobicContact CZ-CG 3.79Å; W36-L51 HydrophobicContact CB-CD2 4.08Å; W36-L51 HydrophobicContact CD2-CB 3.89Å; W36-L51 HydrophobicContact CD2-CD2 4.46Å; W36-L51 HydrophobicContact CG-CB 3.98Å; W36-L51 HydrophobicContact CG-CD2 3.96Å; W36-L51 HydrophobicContact CG-CG 4.43Å; W36-L51 HydrophobicContact CZ2-CB 4.33Å; W36-L51 PolarHBondContact NE1-O 2.79Å; I48-L51 HydrophobicContact CG2-CB 3.96Å; L51-V66 HydrophobicContact CD1-CG1 4.17Å; L51-S67 CarbonylContact C-O 3.6Å; L51-S67 WeakPolarHBondContact CA-O 3.38Å; L51-V68 HydrophobicContact CD1-CB 3.85Å; L51-V68 HydrophobicContact CD1-CG2 4.01Å; L51-I184 HydrophobicContact CD2-CD1 4.29Å; L51-I186 HydrophobicContact CD2-CD1 3.87Å; L51-I186 HydrophobicContact CD2-CG1 4.21Å
52	T	97.6	Very high	94.4	Very high	44 Å²	44	48.2 Å²	48.2	27%	0.27	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	144.8	172.3	70	0	0	0	0	109.5	V66 S67	T52-V66 WeakPolarHBondContact O-CA 3.49Å; T52-S67 PolarHBondContact N-O 2.94Å; T52-S67 PolarHBondContact O-N 2.85Å; T52-S67 VanDerWaalsContact O-N 3.17Å; T52-S67 WeakPolarHBondContact OG1-CB 3.32Å; T52-S67 PolarHBondContact OG1-N 2.82Å; T52-S67 PolarHBondContact OG1-OG 2.67Å
53	L	96.7	Very high	95	Very high	33 Å²	33	50.9 Å²	50.9	17%	0.173	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	118.3	-179.9	-169.8	59.4	0	0	0	108.6	F34 I58 V64 V66 A188	F34-L53 HydrophobicContact CD1-CB 4.08Å; F34-L53 HydrophobicContact CD2-CB 3.67Å; F34-L53 HydrophobicContact CD2-CD2 3.59Å; F34-L53 HydrophobicContact CD2-CG 4.22Å; F34-L53 HydrophobicContact CE1-CB 4.03Å; F34-L53 HydrophobicContact CE2-CB 3.61Å; F34-L53 HydrophobicContact CE2-CD2 3.6Å; F34-L53 HydrophobicContact CE2-CG 4.28Å; F34-L53 HydrophobicContact CG-CB 3.9Å; F34-L53 HydrophobicContact CG-CD2 4.5Å; F34-L53 HydrophobicContact CZ-CB 3.82Å; L53-I58 HydrophobicContact CD1-CD1 4.36Å; L53-I58 HydrophobicContact CD2-CD1 3.54Å; L53-I58 HydrophobicContact CD2-CG1 4.36Å; L53-I58 HydrophobicContact CG-CD1 3.95Å; L53-I58 HydrophobicContact CG-CG1 4.32Å; L53-V64 HydrophobicContact CD1-CG1 3.35Å; L53-V64 HydrophobicContact CG-CG1 4.4Å; L53-V66 HydrophobicContact CD1-CG2 3.72Å; L53-A188 HydrophobicContact CD2-CB 4.26Å
54	E	96.3	Very high	95.2	Very high	82 Å²	82	43.9 Å²	43.9	38%	0.383	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	145.9	-177.8	-66.2	168.1	176.7	0	0	109.2	V64 T65 K149	E54-V64 CarbonylContact O-C 3.57Å; E54-V64 WeakPolarHBondContact O-CA 3.27Å; E54-T65 PolarHBondContact N-O 3.01Å; E54-T65 PolarHBondContact O-N 2.84Å; E54-K149 IonicContact OE1-NZ 2.88Å; E54-K149 PolarHBondContact OE1-NZ 2.9Å; E54-K149 IonicContact OE2-NZ 2.82Å; E54-K149 PolarHBondContact OE2-NZ 2.95Å
55	P	95	Very high	95.1	Very high	52 Å²	52	44.3 Å²	44.3	34%	0.338	24%	0.243	S	C	.	.	S	Bend	cis	-75	166.2	-7.1	33.8	-35.2	0	0	0	112.1	P57 I58 L59 N63	P55-P57 CarbonylContact C-O 3.49Å; P55-P57 CarbonylContact O-C 3.59Å; P55-P57 VanDerWaalsContact O-C 3.26Å; P55-I58 WeakPolarHBondContact O-CA 3.22Å; P55-I58 PolarHBondContact O-N 3.23Å; P55-L59 HydrophobicContact CG-CG 4.19Å; P55-N63 WeakPolarHBondContact CD-O 3.5Å
56	D	92.9	Very high	95.1	Very high	73 Å²	73	44.3 Å²	44.3	39%	0.39	24%	0.242	S	C	.	.	S	Bend	trans	-120.2	113.5	171.2	-176.9	15.6	0	0	0	109	S33 F34	S33-D56 WeakPolarHBondContact CA-OD2 3.29Å; F34-D56 PolarHBondContact N-OD2 2.81Å
57	P	93.4	Very high	95.1	Very high	33 Å²	33	44.6 Å²	44.6	21%	0.214	24%	0.243	C	C	.	.	S	Bend	cis	-71.1	156.2	1.1	33.4	-39.2	0	0	0	113	L31 P55 L59 S189 K191	L31-P57 HydrophobicContact CD1-CB 3.95Å; L31-P57 HydrophobicContact CD1-CG 3.77Å; P55-P57 CarbonylContact C-O 3.49Å; P55-P57 CarbonylContact O-C 3.59Å; P55-P57 VanDerWaalsContact O-C 3.26Å; P57-L59 PolarHBondContact O-N 2.92Å; P57-S189 WeakPolarHBondContact CA-O 3.41Å; P57-K191 HydrophobicContact CB-CB 4.15Å; P57-K191 HydrophobicContact CG-CB 3.96Å; P57-K191 HydrophobicContact CG-CD 4.25Å
58	I	93.2	Very high	95.1	Very high	19 Å²	19	46 Å²	46	10%	0.097	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.9	172.9	-62.2	167.1	0	0	0	109.1	L53 P55 I60 V64 A188 S189 L190 K191	L53-I58 HydrophobicContact CD1-CD1 4.36Å; L53-I58 HydrophobicContact CD2-CD1 3.54Å; L53-I58 HydrophobicContact CD2-CG1 4.36Å; L53-I58 HydrophobicContact CG-CD1 3.95Å; L53-I58 HydrophobicContact CG-CG1 4.32Å; P55-I58 WeakPolarHBondContact O-CA 3.22Å; P55-I58 PolarHBondContact O-N 3.23Å; I58-I60 HydrophobicContact CG2-CG1 4.14Å; I58-V64 HydrophobicContact CG2-CG2 3.62Å; I58-A188 HydrophobicContact CD1-CB 4.26Å; I58-S189 PolarHBondContact N-O 2.69Å; I58-L190 HydrophobicContact CB-CD2 3.78Å; I58-L190 HydrophobicContact CD1-CD2 4.02Å; I58-L190 HydrophobicContact CG1-CD2 4.47Å; I58-L190 HydrophobicContact CG2-CD2 3.98Å; I58-L190 CarbonylContact O-C 3.53Å; I58-K191 PolarHBondContact O-N 3.1Å
59	L	90.8	Very high	95.1	Very high	66 Å²	66	45.8 Å²	45.8	35%	0.346	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.7	177.4	-56.4	-177.7	0	0	0	109.8	P55 P57 P61 G62 K191 V193	P55-L59 HydrophobicContact CG-CG 4.19Å; P57-L59 PolarHBondContact O-N 2.92Å; L59-P61 CarbonylContact O-C 3.55Å; L59-G62 PolarHBondContact O-N 2.75Å; L59-K191 HydrophobicContact CD2-CB 4.06Å; L59-K191 HydrophobicContact CD2-CD 4.09Å; L59-K191 HydrophobicContact CD2-CG 4.35Å; L59-V193 HydrophobicContact CB-CG2 4.05Å; L59-V193 HydrophobicContact CD2-CG2 4.21Å
60	I	87.6	Confident	95.2	Very high	27 Å²	27	39 Å²	39	14%	0.138	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.8	175.3	-56.2	-176	0	0	0	109.3	I58 V154 L159 L190 K191 G192 V193	I58-I60 HydrophobicContact CG2-CG1 4.14Å; I60-V154 HydrophobicContact CG1-CG1 4.31Å; I60-V154 HydrophobicContact CG2-CG1 4.07Å; I60-L159 HydrophobicContact CG2-CD1 3.69Å; I60-L190 HydrophobicContact CD1-CD1 4.04Å; I60-L190 HydrophobicContact CD1-CD2 3.73Å; I60-L190 HydrophobicContact CD1-CG 4.33Å; I60-L190 HydrophobicContact CG1-CD2 4.39Å; I60-K191 PolarHBondContact N-O 3.03Å; I60-G192 WeakPolarHBondContact O-CA 3.3Å; I60-V193 PolarHBondContact O-N 3.24Å; I60-V193 VanDerWaalsContact O-N 3.1Å
61	P	90.3	Very high	95.2	Very high	37 Å²	37	37.6 Å²	37.6	24%	0.24	22%	0.222	C	C	.	.	S	Bend	cis	-69.9	158.9	-9.9	27.4	-27.5	0	0	0	111.5	L59 H156	L59-P61 CarbonylContact O-C 3.55Å; P61-H156 WeakPolarHBondContact CB-ND1 3.17Å; P61-H156 WeakPolarHBondContact CG-CE1 3.07Å; P61-H156 WeakPolarHBondContact CG-ND1 3Å; P61-H156 WeakPolarHBondContact CG-NE2 3.37Å
62	G	91.8	Very high	95.2	Very high	21 Å²	21	36.8 Å²	36.8	22%	0.216	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.1	-176.2	-177.2	0	0	0	0	0	114.1	L59 V154	L59-G62 PolarHBondContact O-N 2.75Å; G62-V154 PolarHBondContact N-O 2.93Å; G62-V154 WeakPolarHBondContact O-CA 3.47Å; G62-V154 WeakPolarHBondContact O-CB 3.44Å; G62-V154 PolarHBondContact O-N 2.89Å
63	N	93.9	Very high	95.2	Very high	80 Å²	80	38.8 Å²	38.8	43%	0.428	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	142.4	178.4	-61.6	-9.6	0	0	0	110.5	P55 E151 F152	P55-N63 WeakPolarHBondContact CD-O 3.5Å; N63-E151 HydrophobicContact CB-CG 4.03Å; N63-E151 WeakPolarHBondContact CB-OE1 3.33Å; N63-E151 VanDerWaalsContact CG-OE1 3.23Å; N63-E151 PolarHBondContact ND2-OE1 3.19Å; N63-F152 WeakPolarHBondContact CA-O 3.26Å
64	V	95.1	Very high	95.3	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	127.3	178.8	-179.1	0	0	0	0	108.9	L53 E54 I58 V66 E151 F152 V154	L53-V64 HydrophobicContact CD1-CG1 3.35Å; L53-V64 HydrophobicContact CG-CG1 4.4Å; E54-V64 CarbonylContact O-C 3.57Å; E54-V64 WeakPolarHBondContact O-CA 3.27Å; I58-V64 HydrophobicContact CG2-CG2 3.62Å; V64-V66 HydrophobicContact CG1-CG2 3.97Å; V64-E151 CarbonylContact O-C 3.58Å; V64-E151 WeakPolarHBondContact O-CA 3.29Å; V64-F152 PolarHBondContact N-O 2.81Å; V64-F152 PolarHBondContact O-N 2.88Å; V64-V154 HydrophobicContact CB-CG2 4.5Å; V64-V154 HydrophobicContact CG2-CG2 3.66Å
65	T	97.1	Very high	95.4	Very high	36 Å²	36	38.4 Å²	38.4	22%	0.221	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123	172.6	-58.1	0	0	0	0	109.6	E54 K149 S150	E54-T65 PolarHBondContact N-O 3.01Å; E54-T65 PolarHBondContact O-N 2.84Å; T65-K149 HydrophobicContact CG2-CB 4.04Å; T65-K149 HydrophobicContact CG2-CD 4.36Å; T65-K149 HydrophobicContact CG2-CG 4.29Å; T65-S150 WeakPolarHBondContact CA-O 3.45Å
66	V	97.3	Very high	95.5	Very high	30 Å²	30	37 Å²	37	18%	0.182	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.7	178.3	-173.3	0	0	0	0	109.2	L51 T52 L53 V64 K149 S150 F152	L51-V66 HydrophobicContact CD1-CG1 4.17Å; T52-V66 WeakPolarHBondContact O-CA 3.49Å; L53-V66 HydrophobicContact CD1-CG2 3.72Å; V64-V66 HydrophobicContact CG1-CG2 3.97Å; V66-K149 WeakPolarHBondContact O-CA 3.33Å; V66-S150 PolarHBondContact N-O 3.09Å; V66-S150 PolarHBondContact O-N 2.72Å; V66-F152 HydrophobicContact CB-CD2 4.24Å; V66-F152 HydrophobicContact CB-CE2 4.06Å; V66-F152 HydrophobicContact CG2-CD2 4.02Å; V66-F152 HydrophobicContact CG2-CE2 4.28Å
67	S	98.1	Very high	95.7	Very high	18 Å²	18	35.5 Å²	35.5	13%	0.126	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.9	159.2	78.2	0	0	0	0	109	L51 T52 L147	L51-S67 CarbonylContact C-O 3.6Å; L51-S67 WeakPolarHBondContact CA-O 3.38Å; T52-S67 PolarHBondContact N-O 2.94Å; T52-S67 PolarHBondContact O-N 2.85Å; T52-S67 VanDerWaalsContact O-N 3.17Å; T52-S67 WeakPolarHBondContact OG1-CB 3.32Å; T52-S67 PolarHBondContact OG1-N 2.82Å; T52-S67 PolarHBondContact OG1-OG 2.67Å; S67-L147 WeakPolarHBondContact CA-O 3.49Å
68	V	98.3	Very high	95.9	Very high	38 Å²	38	37 Å²	37	23%	0.23	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	137.4	-178.2	61.1	0	0	0	0	110.8	I48 S50 L51 L147	I48-V68 HydrophobicContact CD1-CG2 4.14Å; I48-V68 HydrophobicContact CG2-CG2 4.31Å; S50-V68 CarbonylContact O-C 3.58Å; S50-V68 VanDerWaalsContact O-CA 3.31Å; S50-V68 WeakPolarHBondContact O-CA 3.38Å; L51-V68 HydrophobicContact CD1-CB 3.85Å; L51-V68 HydrophobicContact CD1-CG2 4.01Å; V68-L147 HydrophobicContact CG1-CB 3.78Å; V68-L147 HydrophobicContact CG1-CD2 4.23Å; V68-L147 PolarHBondContact N-O 2.77Å; V68-L147 PolarHBondContact O-N 2.82Å
69	V	98.6	Very high	96.1	Very high	35 Å²	35	37.9 Å²	37.9	21%	0.212	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.8	166.2	-177.9	0	0	0	0	107.2	R49 S50 T144 Y145	R49-V69 HydrophobicContact CB-CB 4.23Å; R49-V69 HydrophobicContact CB-CG1 4.06Å; R49-V69 WeakPolarHBondContact CB-O 3.26Å; R49-V69 HydrophobicContact CG-CG1 4.47Å; R49-V69 PolarHBondContact N-O 2.84Å; S50-V69 PolarHBondContact N-O 2.82Å; S50-V69 PolarHBondContact O-N 2.88Å; S50-V69 WeakPolarHBondContact OG-CB 3.24Å; S50-V69 VanDerWaalsContact OG-CG2 3.25Å; S50-V69 WeakPolarHBondContact OG-CG2 3.37Å; V69-T144 HydrophobicContact CG1-CG2 3.77Å; V69-Y145 WeakPolarHBondContact CA-O 3.42Å
70	G	98.3	Very high	96.4	Very high	14 Å²	14	35 Å²	35	14%	0.144	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152.3	174.7	0	0	0	0	0	110.3	V47 T144 Y145	V47-G70 CarbonylContact O-C 3.57Å; V47-G70 WeakPolarHBondContact O-CA 3.32Å; G70-T144 CarbonylContact O-C 3.51Å; G70-T144 WeakPolarHBondContact O-CA 3.43Å; G70-Y145 PolarHBondContact N-O 2.96Å; G70-Y145 PolarHBondContact O-N 2.9Å
71	S	98.1	Very high	96.9	Very high	16 Å²	16	36 Å²	36	11%	0.112	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.4	172.6	63.3	0	0	0	0	110.2	A46 V47 R49 G143	A46-S71 WeakPolarHBondContact CA-O 3.43Å; V47-S71 WeakPolarHBondContact CG2-OG 3.36Å; V47-S71 PolarHBondContact N-O 3.48Å; V47-S71 PolarHBondContact O-N 3.48Å; R49-S71 PolarHBondContact NE-OG 2.8Å; R49-S71 PolarHBondContact NH2-OG 2.86Å; S71-G143 CarbonylContact C-O 3.21Å; S71-G143 VanDerWaalsContact CA-O 3.29Å; S71-G143 WeakPolarHBondContact CA-O 3.25Å
72	T	98.5	Very high	97.3	Very high	8 Å²	8	35 Å²	35	5%	0.049	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.5	171.2	-178.8	0	0	0	0	110.8	P45 V74 L76 E142 G143 Y145	P45-T72 CarbonylContact O-C 3.54Å; P45-T72 VanDerWaalsContact O-CA 3.24Å; P45-T72 WeakPolarHBondContact O-CA 3.25Å; T72-V74 VanDerWaalsContact C-N 3.31Å; T72-V74 WeakPolarHBondContact CG2-O 3.34Å; T72-V74 PolarHBondContact OG1-N 2.93Å; T72-V74 PolarHBondContact OG1-O 2.9Å; T72-L76 HydrophobicContact CG2-CD1 4.18Å; T72-L76 HydrophobicContact CG2-CG 4.09Å; T72-E142 WeakPolarHBondContact O-CA 3Å; T72-G143 PolarHBondContact N-O 2.86Å; T72-G143 PolarHBondContact O-N 3.07Å; T72-Y145 HydrophobicContact CG2-CE2 4.3Å
73	S	98.2	Very high	97.6	Very high	86 Å²	86	37.6 Å²	37.6	60%	0.601	23%	0.23	S	C	*	.	S	Bend	trans	-88.5	0.9	176.8	71.9	0	0	0	0	113.5	P45	P45-S73 VanDerWaalsContact CB-OG 3.31Å; P45-S73 WeakPolarHBondContact CB-OG 3.32Å; P45-S73 PolarHBondContact O-N 3.17Å
74	V	98.3	Very high	97.9	Very high	41 Å²	41	35.6 Å²	35.6	25%	0.248	22%	0.219	C	C	.	.	S	Bend	trans	-137.2	154.6	177.9	-58.2	0	0	0	0	109.5	P45 T72 L181	P45-V74 HydrophobicContact CB-CG1 4.11Å; P45-V74 HydrophobicContact CB-CG2 3.89Å; P45-V74 HydrophobicContact CG-CG2 4.03Å; T72-V74 VanDerWaalsContact C-N 3.31Å; T72-V74 WeakPolarHBondContact CG2-O 3.34Å; T72-V74 PolarHBondContact OG1-N 2.93Å; T72-V74 PolarHBondContact OG1-O 2.9Å; V74-L181 HydrophobicContact CG2-CD2 3.93Å
75	P	98	Very high	98	Very high	66 Å²	66	37.2 Å²	37.2	43%	0.429	23%	0.229	S	C	.	.			trans	-67.4	138.9	173.6	27.8	-33.9	0	0	0	111	F140 E142	P75-F140 CarbonylContact C-O 3.49Å; P75-F140 VanDerWaalsContact CA-O 3.27Å; P75-F140 WeakPolarHBondContact CA-O 3.4Å; P75-E142 WeakPolarHBondContact CD-OE2 3.44Å
76	L	98.2	Very high	98.1	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.12	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-97.6	96.9	173.8	-46	176.2	0	0	0	108.1	A46 T72 L80 P139 F140 L174 L181	A46-L76 HydrophobicContact CB-CD2 4.23Å; T72-L76 HydrophobicContact CG2-CD1 4.18Å; T72-L76 HydrophobicContact CG2-CG 4.09Å; L76-L80 HydrophobicContact CB-CD1 4.13Å; L76-L80 HydrophobicContact CB-CD2 4.08Å; L76-P139 WeakPolarHBondContact O-CA 3.48Å; L76-F140 HydrophobicContact CB-CB 4.09Å; L76-F140 HydrophobicContact CB-CD2 4.3Å; L76-F140 HydrophobicContact CD1-CB 4.35Å; L76-F140 HydrophobicContact CG-CB 4.42Å; L76-F140 PolarHBondContact N-O 2.85Å; L76-F140 PolarHBondContact O-N 2.89Å; L76-L174 HydrophobicContact CD1-CD2 4.07Å; L76-L174 HydrophobicContact CD2-CD2 4.06Å; L76-L181 HydrophobicContact CD2-CB 4.49Å; L76-L181 HydrophobicContact CD2-CD1 3.9Å
77	S	97.2	Very high	98.1	Very high	42 Å²	42	36.9 Å²	36.9	29%	0.294	22%	0.224	S	C	.	.			trans	-116.1	158.2	-173.6	-56.3	0	0	0	0	111.4	P79 P139 N176	S77-P79 CarbonylContact O-C 3.59Å; S77-P139 WeakPolarHBondContact OG-CB 3.34Å; S77-N176 PolarHBondContact O-ND2 3.14Å
78	S	96.8	Very high	97.9	Very high	63 Å²	63	37 Å²	37	44%	0.441	22%	0.222	S	C	.	.	S	Bend	trans	-60.6	144.6	171.2	163.3	0	0	0	0	111.8	D110	S78-D110 WeakPolarHBondContact CB-OD2 3.33Å; S78-D110 PolarHBondContact OG-OD2 3.38Å
79	P	97.2	Very high	97.8	Very high	39 Å²	39	37.5 Å²	37.5	25%	0.253	22%	0.222	S	C	.	.	S	Bend	cis	-77	125	-6.8	30.1	-33.4	0	0	0	111.5	S77 D110 N176 R177	S77-P79 CarbonylContact O-C 3.59Å; P79-D110 WeakPolarHBondContact CA-OD2 3.35Å; P79-D110 HydrophobicContact CB-CB 4.3Å; P79-N176 PolarHBondContact O-ND2 2.82Å; P79-R177 HydrophobicContact CG-CG 4.04Å
80	L	98.1	Very high	97.5	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	92.3	-177.2	-168.1	66.1	0	0	0	109.9	L76 D110 F111 L174 L181	L76-L80 HydrophobicContact CB-CD1 4.13Å; L76-L80 HydrophobicContact CB-CD2 4.08Å; L80-D110 PolarHBondContact N-OD1 2.87Å; L80-F111 WeakPolarHBondContact O-CB 3.4Å; L80-F111 PolarHBondContact O-N 2.87Å; L80-L174 HydrophobicContact CD1-CD1 3.69Å; L80-L174 HydrophobicContact CD1-CD2 4.26Å; L80-L174 HydrophobicContact CD1-CG 3.96Å; L80-L174 HydrophobicContact CD2-CD1 3.99Å; L80-L174 HydrophobicContact CG-CD1 3.6Å; L80-L174 HydrophobicContact CG-CG 4.42Å; L80-L181 HydrophobicContact CD1-CD1 3.93Å
81	K	98.5	Very high	97.1	Very high	49 Å²	49	42.5 Å²	42.5	21%	0.213	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.7	-176.6	178.3	174.3	-174.9	139.6	0	111.3	E83 T107 F108 E109 L174 S175	K81-E83 WeakPolarHBondContact CE-OE2 3.5Å; K81-E83 HydrophobicContact CG-CG 4.38Å; K81-T107 VanDerWaalsContact CE-CG2 3.47Å; K81-F108 CarbonylContact C-O 3.56Å; K81-F108 VanDerWaalsContact CA-O 3.29Å; K81-F108 WeakPolarHBondContact CA-O 3.44Å; K81-E109 WeakPolarHBondContact CA-O 3.43Å; K81-E109 WeakPolarHBondContact CD-OE2 3.29Å; K81-E109 IonicContact NZ-OE1 2.84Å; K81-E109 PolarHBondContact NZ-OE1 2.9Å; K81-E109 IonicContact NZ-OE2 2.94Å; K81-E109 PolarHBondContact NZ-OE2 2.91Å; K81-L174 WeakPolarHBondContact O-CA 3.5Å; K81-S175 PolarHBondContact N-O 2.6Å; K81-S175 PolarHBondContact O-N 3.18Å
82	V	98.3	Very high	96.7	Very high	15 Å²	15	44.2 Å²	44.2	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.3	174.5	178.3	0	0	0	0	109.7	L84 T107 F108 F111 I173 L174	V82-L84 HydrophobicContact CG1-CD2 3.72Å; V82-L84 HydrophobicContact CG1-CG 4.09Å; V82-T107 WeakPolarHBondContact O-CA 3.36Å; V82-F108 HydrophobicContact CB-CB 4.46Å; V82-F108 HydrophobicContact CB-CD2 4.41Å; V82-F108 PolarHBondContact N-O 2.8Å; V82-F108 PolarHBondContact O-N 2.03Å; V82-F111 HydrophobicContact CG2-CB 3.78Å; V82-F111 HydrophobicContact CG2-CD2 4.48Å; V82-F111 HydrophobicContact CG2-CG 4.06Å; V82-I173 WeakPolarHBondContact CA-O 3.37Å; V82-L174 HydrophobicContact CG2-CD1 3.67Å
83	E	98.4	Very high	96.5	Very high	75 Å²	75	49.6 Å²	49.6	35%	0.35	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122	174.7	-68.8	174.7	76	0	0	109.7	K81 T107 S172 I173	K81-E83 WeakPolarHBondContact CE-OE2 3.5Å; K81-E83 HydrophobicContact CG-CG 4.38Å; E83-T107 HydrophobicContact CG-CG2 3.81Å; E83-S172 CarbonylContact O-C 3.6Å; E83-S172 WeakPolarHBondContact O-CA 3.46Å; E83-I173 HydrophobicContact CB-CB 4.37Å; E83-I173 PolarHBondContact N-O 2.59Å; E83-I173 PolarHBondContact O-N 2.97Å
84	L	98.4	Very high	96.4	Very high	38 Å²	38	49.5 Å²	49.5	20%	0.199	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.9	179.8	-56.6	-178.2	0	0	0	110.5	V82 S105 C106 F108 I170 E171 S172	V82-L84 HydrophobicContact CG1-CD2 3.72Å; V82-L84 HydrophobicContact CG1-CG 4.09Å; L84-S105 CarbonylContact O-C 3.51Å; L84-S105 WeakPolarHBondContact O-CA 3.36Å; L84-S105 WeakPolarHBondContact O-CB 3.35Å; L84-C106 PolarHBondContact N-O 2.83Å; L84-C106 PolarHBondContact O-N 2.9Å; L84-F108 HydrophobicContact CD1-CE2 3.89Å; L84-I170 HydrophobicContact CD1-CD1 4.44Å; L84-I170 HydrophobicContact CD2-CD1 4.22Å; L84-E171 CarbonylContact C-O 3.6Å; L84-E171 WeakPolarHBondContact CA-O 3.5Å; L84-S172 WeakPolarHBondContact CD2-OG 3.36Å
85	V	98.5	Very high	96.3	Very high	45 Å²	45	51.3 Å²	51.3	27%	0.273	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	105.8	166.3	-179.6	0	0	0	0	107.6	E87 K96 I170 E171	V85-E87 HydrophobicContact CG1-CG 4.25Å; V85-K96 HydrophobicContact CG1-CD 4.41Å; V85-K96 HydrophobicContact CG1-CG 4.47Å; V85-I170 VanDerWaalsContact O-CA 3.28Å; V85-I170 WeakPolarHBondContact O-CA 3.33Å; V85-E171 HydrophobicContact CB-CB 4.39Å; V85-E171 PolarHBondContact N-O 3.15Å; V85-E171 PolarHBondContact O-N 3.31Å
86	L	97.9	Very high	96.3	Very high	23 Å²	23	54.1 Å²	54.1	12%	0.12	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129	176.4	-179.7	65.9	0	0	0	109.6	I97 S105 W162 Y168 I170	L86-I97 HydrophobicContact CB-CB 4.44Å; L86-I97 HydrophobicContact CD2-CB 4.28Å; L86-I97 HydrophobicContact CD2-CG1 4.39Å; L86-I97 HydrophobicContact CD2-CG2 4.44Å; L86-I97 HydrophobicContact CG-CB 4.32Å; L86-I97 HydrophobicContact CG-CG1 4.26Å; L86-I97 PolarHBondContact O-N 3.07Å; L86-S105 PolarHBondContact N-OG 2.72Å; L86-S105 PolarHBondContact O-OG 2.57Å; L86-W162 HydrophobicContact CD2-CH2 3.5Å; L86-W162 VanDerWaalsContact CD2-CH2 3.5Å; L86-W162 HydrophobicContact CD2-CZ3 3.78Å; L86-Y168 HydrophobicContact CD1-CD1 4.44Å; L86-I170 HydrophobicContact CD1-CB 4.17Å
87	E	97.4	Very high	96.2	Very high	35 Å²	35	53.6 Å²	53.6	16%	0.164	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	143.3	177.1	-65.4	169.4	102.7	0	0	111	V85 W94 I95 K96 Y168 R169	V85-E87 HydrophobicContact CG1-CG 4.25Å; E87-W94 HydrophobicContact CB-CB 4.31Å; E87-W94 HydrophobicContact CB-CE3 3.99Å; E87-I95 CarbonylContact C-O 3.59Å; E87-I95 VanDerWaalsContact CA-O 3.26Å; E87-I95 WeakPolarHBondContact CA-O 3.45Å; E87-K96 HydrophobicContact CG-CB 4.27Å; E87-Y168 WeakPolarHBondContact O-CA 3.42Å; E87-R169 HydrophobicContact CB-CG 3.95Å; E87-R169 PolarHBondContact N-O 3.34Å; E87-R169 PolarHBondContact O-N 3.19Å; E87-R169 IonicContact OE1-CZ 3.68Å; E87-R169 IonicContact OE1-NE 3.79Å; E87-R169 IonicContact OE1-NH2 3.2Å; E87-R169 PolarHBondContact OE1-NH2 3.02Å; E87-R169 IonicContact OE2-CZ 3.73Å; E87-R169 IonicContact OE2-NE 2.82Å; E87-R169 PolarHBondContact OE2-NE 2.93Å; E87-R169 IonicContact OE2-NH2 2.82Å; E87-R169 PolarHBondContact OE2-NH2 3.43Å
88	K	95.4	Very high	96.1	Very high	21 Å²	21	55.6 Å²	55.6	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	137	173.4	-177.9	-170.3	175.8	92.1	0	109.5	V90 I95 I97 W162 T164 Y168	K88-V90 HydrophobicContact CD-CG2 4.14Å; K88-V90 HydrophobicContact CG-CG2 4.28Å; K88-I95 PolarHBondContact N-O 2.65Å; K88-I95 PolarHBondContact O-N 2.85Å; K88-I97 HydrophobicContact CB-CD1 3.96Å; K88-I97 HydrophobicContact CB-CG1 4.32Å; K88-W162 WeakPolarHBondContact CD-O 3.44Å; K88-W162 PolarHBondContact NZ-O 3.46Å; K88-T164 PolarHBondContact NZ-O 3.16Å; K88-T164 VanDerWaalsContact NZ-O 3.16Å; K88-T164 PolarHBondContact NZ-OG1 2.87Å; K88-Y168 HydrophobicContact CB-CD1 3.95Å; K88-Y168 HydrophobicContact CB-CE1 3.76Å; K88-Y168 HydrophobicContact CD-CE1 4.04Å; K88-Y168 HydrophobicContact CG-CD1 4.17Å; K88-Y168 HydrophobicContact CG-CE1 3.66Å; K88-Y168 PolarHBondContact NZ-OH 3.45Å
89	E	95.3	Very high	96	Very high	48 Å²	48	55.6 Å²	55.6	22%	0.224	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.8	171.6	-166.3	-178.1	-164.7	0	0	111.1	L93 W94 N167	E89-L93 CarbonylContact C-O 3.57Å; E89-L93 WeakPolarHBondContact CA-O 3.35Å; E89-W94 HydrophobicContact CB-CD2 4.37Å; E89-W94 HydrophobicContact CB-CE3 4.14Å; E89-W94 HydrophobicContact CB-CH2 4.17Å; E89-W94 HydrophobicContact CB-CZ2 4.38Å; E89-W94 HydrophobicContact CB-CZ3 4.03Å; E89-N167 HydrophobicContact CB-CB 3.95Å; E89-N167 PolarHBondContact N-O 2.89Å; E89-N167 WeakPolarHBondContact OE2-CB 3.11Å; E89-N167 PolarHBondContact OE2-ND2 3.37Å
90	V	91.9	Very high	95.7	Very high	74 Å²	74	57.4 Å²	57.4	45%	0.448	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	114.3	176.2	-177.2	0	0	0	0	108.6	K88 G92 L93 I95	K88-V90 HydrophobicContact CD-CG2 4.14Å; K88-V90 HydrophobicContact CG-CG2 4.28Å; V90-G92 PolarHBondContact O-N 3.38Å; V90-L93 PolarHBondContact N-O 2.93Å; V90-L93 PolarHBondContact O-N 2.88Å; V90-I95 HydrophobicContact CB-CG1 3.92Å; V90-I95 HydrophobicContact CG2-CG1 3.95Å
91	A	90.1	Very high	95.1	Very high	81 Å²	81	63.9 Å²	63.9	67%	0.669	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	37.4	-179.6	0	0	0	0	0	114.2	L93	A91-L93 VanDerWaalsContact C-N 3.35Å
92	G	89.9	Confident	94.6	Very high	51 Å²	51	70.4 Å²	70.4	53%	0.526	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	1.6	179.6	0	0	0	0	0	115.2	V90	V90-G92 PolarHBondContact O-N 3.38Å
93	L	94.5	Very high	94.1	Very high	121 Å²	121	73.1 Å²	73.1	63%	0.634	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.9	174	-63.2	175.5	0	0	0	110.5	E89 V90 A91 I95	E89-L93 CarbonylContact C-O 3.57Å; E89-L93 WeakPolarHBondContact CA-O 3.35Å; V90-L93 PolarHBondContact N-O 2.93Å; V90-L93 PolarHBondContact O-N 2.88Å; A91-L93 VanDerWaalsContact C-N 3.35Å; L93-I95 HydrophobicContact CB-CD1 4.14Å
94	W	96.3	Very high	93.9	Very high	85 Å²	85	69.9 Å²	69.9	32%	0.322	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.4	174.1	-69	95.1	0	0	0	109.9	E87 E89 N167 R169	E87-W94 HydrophobicContact CB-CB 4.31Å; E87-W94 HydrophobicContact CB-CE3 3.99Å; E89-W94 HydrophobicContact CB-CD2 4.37Å; E89-W94 HydrophobicContact CB-CE3 4.14Å; E89-W94 HydrophobicContact CB-CH2 4.17Å; E89-W94 HydrophobicContact CB-CZ2 4.38Å; E89-W94 HydrophobicContact CB-CZ3 4.03Å; W94-N167 HydrophobicContact CH2-CB 4.14Å; W94-R169 VanDerWaalsContact CD1-NH1 3.35Å; W94-R169 HydrophobicContact CD2-CG 4.16Å; W94-R169 HydrophobicContact CE3-CB 4.39Å; W94-R169 HydrophobicContact CE3-CG 3.59Å; W94-R169 HydrophobicContact CH2-CB 4.06Å; W94-R169 HydrophobicContact CH2-CG 4.09Å; W94-R169 HydrophobicContact CZ3-CB 3.84Å; W94-R169 HydrophobicContact CZ3-CG 3.55Å
95	I	96.5	Very high	93.8	Very high	79 Å²	79	68.9 Å²	68.9	41%	0.405	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.3	-177.5	-51.1	-56.4	0	0	0	108.8	E87 K88 V90 L93 I97	E87-I95 CarbonylContact C-O 3.59Å; E87-I95 VanDerWaalsContact CA-O 3.26Å; E87-I95 WeakPolarHBondContact CA-O 3.45Å; K88-I95 PolarHBondContact N-O 2.65Å; K88-I95 PolarHBondContact O-N 2.85Å; V90-I95 HydrophobicContact CB-CG1 3.92Å; V90-I95 HydrophobicContact CG2-CG1 3.95Å; L93-I95 HydrophobicContact CB-CD1 4.14Å; I95-I97 PolarHBondContact O-N 2.97Å
96	K	97.2	Very high	93.8	Very high	125 Å²	125	66.9 Å²	66.9	54%	0.543	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126.6	174.9	-174.4	176.3	179.3	174.4	0	110.7	V85 E87 S105	V85-K96 HydrophobicContact CG1-CD 4.41Å; V85-K96 HydrophobicContact CG1-CG 4.47Å; E87-K96 HydrophobicContact CG-CB 4.27Å; K96-S105 VanDerWaalsContact CE-OG 3.25Å; K96-S105 WeakPolarHBondContact CE-OG 2.96Å; K96-S105 WeakPolarHBondContact CG-OG 3.33Å
97	I	96.1	Very high	93.8	Very high	11 Å²	11	69.1 Å²	69.1	6%	0.056	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-89.3	121.5	176.9	-54	-56.1	0	0	0	108.5	L86 K88 I95 S105 W162	L86-I97 HydrophobicContact CB-CB 4.44Å; L86-I97 HydrophobicContact CD2-CB 4.28Å; L86-I97 HydrophobicContact CD2-CG1 4.39Å; L86-I97 HydrophobicContact CD2-CG2 4.44Å; L86-I97 HydrophobicContact CG-CB 4.32Å; L86-I97 HydrophobicContact CG-CG1 4.26Å; L86-I97 PolarHBondContact O-N 3.07Å; K88-I97 HydrophobicContact CB-CD1 3.96Å; K88-I97 HydrophobicContact CB-CG1 4.32Å; I95-I97 PolarHBondContact O-N 2.97Å; I97-S105 WeakPolarHBondContact O-CB 3.31Å; I97-S105 PolarHBondContact O-N 3.29Å; I97-S105 PolarHBondContact O-OG 3.02Å; I97-W162 HydrophobicContact CD1-CD2 4.27Å; I97-W162 HydrophobicContact CD1-CE3 4.01Å; I97-W162 HydrophobicContact CG1-CD2 4.49Å; I97-W162 HydrophobicContact CG1-CE3 4.02Å; I97-W162 HydrophobicContact CG1-CZ3 4.11Å; I97-W162 HydrophobicContact CG2-CD2 3.76Å; I97-W162 VanDerWaalsContact CG2-CE2 3.49Å; I97-W162 HydrophobicContact CG2-CE3 3.98Å; I97-W162 HydrophobicContact CG2-CG 4.46Å; I97-W162 HydrophobicContact CG2-CH2 3.82Å; I97-W162 HydrophobicContact CG2-CZ2 3.56Å; I97-W162 HydrophobicContact CG2-CZ3 3.99Å
98	P	95.6	Very high	93.7	Very high	85 Å²	85	69.1 Å²	69.1	55%	0.552	38%	0.382	S	S	*	.	B	Isolated β-bridge	trans	-65.2	158.5	177.7	29.4	-35.3	0	0	0	111.2	T100	P98-T100 PolarHBondContact O-N 2.82Å
99	C	94.7	Very high	93.8	Very high	62 Å²	62	73.8 Å²	73.8	42%	0.419	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-74.5	121.8	171.6	-172	0	0	0	0	110.2	I103 S105 C106	C99-I103 WeakPolarHBondContact CA-O 3.04Å; C99-S105 WeakPolarHBondContact CB-O 3.47Å; C99-C106 HydrophobicContact CB-CB 3.9Å; C99-C106 WeakPolarHBondContact CB-SG 3.43Å; C99-C106 VanDerWaalsContact SG-CA 3.5Å; C99-C106 WeakPolarHBondContact SG-CB 3.24Å; C99-C106 CovalentContact SG-SG 2.04Å; C99-C106 PolarHBondContact SG-SG 2.97Å
100	T	90.3	Very high	93.8	Very high	78 Å²	78	72.6 Å²	72.6	48%	0.479	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-139.7	127.1	172.7	-57.9	0	0	0	0	108	P98 Y102 I103	P98-T100 PolarHBondContact O-N 2.82Å; T100-Y102 PolarHBondContact O-N 2.79Å; T100-I103 PolarHBondContact N-O 2.82Å; T100-I103 PolarHBondContact O-N 3.04Å; T100-I103 VanDerWaalsContact O-O 3.12Å
101	D	86.3	Confident	94	Very high	140 Å²	140	72.4 Å²	72.4	75%	0.749	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	44.9	179.6	-55.1	-39.2	0	0	0	113.5	I103	D101-I103 PolarHBondContact O-N 2.83Å
102	Y	87.1	Confident	94.3	Very high	186 Å²	186	68.7 Å²	68.7	73%	0.729	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	10.8	-178.4	-47.1	-77.8	0	0	0	115.8	T100 C106 F108	T100-Y102 PolarHBondContact O-N 2.79Å; Y102-C106 VanDerWaalsContact C-SG 3.53Å; Y102-F108 AromaticContact CD1-CE1 3.88Å; Y102-F108 HydrophobicContact CD1-CE1 3.88Å
103	I	87.9	Confident	94.4	Very high	72 Å²	72	71 Å²	71	37%	0.369	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-113.3	132.2	176.1	-51.1	178	0	0	0	109.7	C99 T100 D101 P160 W162	C99-I103 WeakPolarHBondContact CA-O 3.04Å; T100-I103 PolarHBondContact N-O 2.82Å; T100-I103 PolarHBondContact O-N 3.04Å; T100-I103 VanDerWaalsContact O-O 3.12Å; D101-I103 PolarHBondContact O-N 2.83Å; I103-P160 HydrophobicContact CD1-CG 4.45Å; I103-W162 HydrophobicContact CG2-CH2 3.81Å; I103-W162 HydrophobicContact CG2-CZ2 3.58Å
104	G	93.7	Very high	94.3	Very high	7 Å²	7	67.1 Å²	67.1	7%	0.072	34%	0.343	C	S	.	.	S	Bend	trans	117.4	-149.5	177.1	0	0	0	0	0	113.1	C106	G104-C106 VanDerWaalsContact C-N 3.26Å; G104-C106 PolarHBondContact O-N 3.44Å
105	S	97.9	Very high	94.2	Very high	17 Å²	17	64.1 Å²	64.1	12%	0.119	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-79.6	73.2	177.2	-56.5	0	0	0	0	111.4	L84 L86 K96 I97 C99	L84-S105 CarbonylContact O-C 3.51Å; L84-S105 WeakPolarHBondContact O-CA 3.36Å; L84-S105 WeakPolarHBondContact O-CB 3.35Å; L86-S105 PolarHBondContact N-OG 2.72Å; L86-S105 PolarHBondContact O-OG 2.57Å; K96-S105 VanDerWaalsContact CE-OG 3.25Å; K96-S105 WeakPolarHBondContact CE-OG 2.96Å; K96-S105 WeakPolarHBondContact CG-OG 3.33Å; I97-S105 WeakPolarHBondContact O-CB 3.31Å; I97-S105 PolarHBondContact O-N 3.29Å; I97-S105 PolarHBondContact O-OG 3.02Å; C99-S105 WeakPolarHBondContact CB-O 3.47Å
106	C	96.9	Very high	94	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.02	33%	0.331	C	S	.	.			trans	-94.8	157.5	-174.9	-61.5	0	0	0	0	113.2	L84 C99 Y102 G104 F108	L84-C106 PolarHBondContact N-O 2.83Å; L84-C106 PolarHBondContact O-N 2.9Å; C99-C106 HydrophobicContact CB-CB 3.9Å; C99-C106 WeakPolarHBondContact CB-SG 3.43Å; C99-C106 VanDerWaalsContact SG-CA 3.5Å; C99-C106 WeakPolarHBondContact SG-CB 3.24Å; C99-C106 CovalentContact SG-SG 2.04Å; C99-C106 PolarHBondContact SG-SG 2.97Å; Y102-C106 VanDerWaalsContact C-SG 3.53Å; G104-C106 VanDerWaalsContact C-N 3.26Å; G104-C106 PolarHBondContact O-N 3.44Å; C106-F108 HydrophobicContact CB-CE2 3.88Å; C106-F108 HydrophobicContact CB-CZ 4.02Å
107	T	97.8	Very high	93.7	Very high	70 Å²	70	65 Å²	65	43%	0.429	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.1	169.8	-58.8	0	0	0	0	108.7	K81 V82 E83 E109	K81-T107 VanDerWaalsContact CE-CG2 3.47Å; V82-T107 WeakPolarHBondContact O-CA 3.36Å; E83-T107 HydrophobicContact CG-CG2 3.81Å; T107-E109 WeakPolarHBondContact CG2-OE1 3.5Å
108	F	96.5	Very high	93.4	Very high	36 Å²	36	70.5 Å²	70.5	16%	0.158	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.2	173.3	-56.2	-84.6	0	0	0	107.4	K81 V82 L84 Y102 C106 D110 V114	K81-F108 CarbonylContact C-O 3.56Å; K81-F108 VanDerWaalsContact CA-O 3.29Å; K81-F108 WeakPolarHBondContact CA-O 3.44Å; V82-F108 HydrophobicContact CB-CB 4.46Å; V82-F108 HydrophobicContact CB-CD2 4.41Å; V82-F108 PolarHBondContact N-O 2.8Å; V82-F108 PolarHBondContact O-N 2.03Å; L84-F108 HydrophobicContact CD1-CE2 3.89Å; Y102-F108 AromaticContact CD1-CE1 3.88Å; Y102-F108 HydrophobicContact CD1-CE1 3.88Å; C106-F108 HydrophobicContact CB-CE2 3.88Å; C106-F108 HydrophobicContact CB-CZ 4.02Å; F108-D110 VanDerWaalsContact C-N 3.3Å; F108-D110 PolarHBondContact O-N 2.72Å; F108-V114 HydrophobicContact CD1-CG2 3.99Å
109	E	96.9	Very high	93.3	Very high	119 Å²	119	67.7 Å²	67.7	56%	0.556	35%	0.35	S	S	*	.	S	Bend	trans	-68.2	-31.8	-176.8	-65.5	-61.2	153.3	0	0	112.5	K81 T107	K81-E109 WeakPolarHBondContact CA-O 3.43Å; K81-E109 WeakPolarHBondContact CD-OE2 3.29Å; K81-E109 IonicContact NZ-OE1 2.84Å; K81-E109 PolarHBondContact NZ-OE1 2.9Å; K81-E109 IonicContact NZ-OE2 2.94Å; K81-E109 PolarHBondContact NZ-OE2 2.91Å; T107-E109 WeakPolarHBondContact CG2-OE1 3.5Å
110	D	96.5	Very high	93.1	Very high	23 Å²	23	68.4 Å²	68.4	12%	0.123	35%	0.354	C	S	.	.			trans	-141	103.4	168.5	-163	-4	0	0	0	110.8	S78 P79 L80 F108 C112 D113	S78-D110 WeakPolarHBondContact CB-OD2 3.33Å; S78-D110 PolarHBondContact OG-OD2 3.38Å; P79-D110 WeakPolarHBondContact CA-OD2 3.35Å; P79-D110 HydrophobicContact CB-CB 4.3Å; L80-D110 PolarHBondContact N-OD1 2.87Å; F108-D110 VanDerWaalsContact C-N 3.3Å; F108-D110 PolarHBondContact O-N 2.72Å; D110-C112 PolarHBondContact O-N 2.96Å; D110-C112 VanDerWaalsContact OD1-CB 3.24Å; D110-C112 WeakPolarHBondContact OD1-CB 3.25Å; D110-C112 PolarHBondContact OD1-N 3.47Å; D110-D113 PolarHBondContact O-N 2.82Å
111	F	95.1	Very high	92.8	Very high	69 Å²	69	69.9 Å²	69.9	30%	0.303	36%	0.363	S	S	.	.	H	α-helix	trans	-69.3	-20.4	176.6	-173.5	-108.5	0	0	0	112.4	L80 V82 D113 V114 L115	L80-F111 WeakPolarHBondContact O-CB 3.4Å; L80-F111 PolarHBondContact O-N 2.87Å; V82-F111 HydrophobicContact CG2-CB 3.78Å; V82-F111 HydrophobicContact CG2-CD2 4.48Å; V82-F111 HydrophobicContact CG2-CG 4.06Å; F111-D113 VanDerWaalsContact C-N 3.33Å; F111-D113 PolarHBondContact O-N 3.21Å; F111-V114 HydrophobicContact CD2-CB 4.18Å; F111-V114 HydrophobicContact CD2-CG1 4.49Å; F111-V114 HydrophobicContact CE2-CB 4.48Å; F111-V114 HydrophobicContact CE2-CG1 4.35Å; F111-V114 PolarHBondContact O-N 3.39Å; F111-L115 HydrophobicContact CD1-CD1 3.96Å; F111-L115 HydrophobicContact CD1-CG 4.07Å; F111-L115 HydrophobicContact CE1-CD1 3.77Å; F111-L115 HydrophobicContact CE1-CD2 3.81Å; F111-L115 HydrophobicContact CE1-CG 3.71Å; F111-L115 HydrophobicContact CZ-CD2 3.96Å; F111-L115 HydrophobicContact CZ-CG 4.18Å; F111-L115 PolarHBondContact O-N 2.97Å
112	C	95.8	Very high	92.8	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.02	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-40.9	174.5	-59.1	0	0	0	0	111.3	D110 V114 L115 D116 C138	D110-C112 PolarHBondContact O-N 2.96Å; D110-C112 VanDerWaalsContact OD1-CB 3.24Å; D110-C112 WeakPolarHBondContact OD1-CB 3.25Å; D110-C112 PolarHBondContact OD1-N 3.47Å; C112-V114 VanDerWaalsContact C-N 3.29Å; C112-V114 PolarHBondContact O-N 2.85Å; C112-L115 WeakPolarHBondContact O-CB 3.26Å; C112-L115 PolarHBondContact O-N 3.13Å; C112-D116 PolarHBondContact O-N 2.93Å; C112-C138 VanDerWaalsContact CA-SG 3.54Å; C112-C138 HydrophobicContact CB-CB 3.62Å; C112-C138 WeakPolarHBondContact CB-SG 3.37Å; C112-C138 WeakPolarHBondContact SG-CB 3.39Å; C112-C138 CovalentContact SG-SG 2.03Å; C112-C138 PolarHBondContact SG-SG 3.5Å
113	D	93.7	Very high	92.9	Very high	99 Å²	99	64.2 Å²	64.2	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-34.9	176.1	-67.7	-15.1	0	0	0	111.9	D110 F111 D116 M117	D110-D113 PolarHBondContact O-N 2.82Å; F111-D113 VanDerWaalsContact C-N 3.33Å; F111-D113 PolarHBondContact O-N 3.21Å; D113-D116 PolarHBondContact O-N 3.4Å; D113-M117 WeakPolarHBondContact O-CB 3.08Å; D113-M117 PolarHBondContact O-N 3Å
114	V	91.8	Very high	93.2	Very high	41 Å²	41	64 Å²	64	25%	0.248	36%	0.364	C	S	.	.	H	α-helix	trans	-65.6	-42.9	175.4	-179.1	0	0	0	0	110.6	F108 F111 C112 M117 L118	F108-V114 HydrophobicContact CD1-CG2 3.99Å; F111-V114 HydrophobicContact CD2-CB 4.18Å; F111-V114 HydrophobicContact CD2-CG1 4.49Å; F111-V114 HydrophobicContact CE2-CB 4.48Å; F111-V114 HydrophobicContact CE2-CG1 4.35Å; F111-V114 PolarHBondContact O-N 3.39Å; C112-V114 VanDerWaalsContact C-N 3.29Å; C112-V114 PolarHBondContact O-N 2.85Å; V114-M117 PolarHBondContact O-N 3.05Å; V114-L118 HydrophobicContact CG1-CD1 4.02Å; V114-L118 WeakPolarHBondContact O-CG 3.13Å; V114-L118 PolarHBondContact O-N 3.25Å; V114-L118 VanDerWaalsContact O-N 3.09Å
115	L	93.1	Very high	93.2	Very high	22 Å²	22	65 Å²	65	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-62	-45.6	175.5	-69.8	173.5	0	0	0	111.4	F111 C112 M117 L118 I119 F140	F111-L115 HydrophobicContact CD1-CD1 3.96Å; F111-L115 HydrophobicContact CD1-CG 4.07Å; F111-L115 HydrophobicContact CE1-CD1 3.77Å; F111-L115 HydrophobicContact CE1-CD2 3.81Å; F111-L115 HydrophobicContact CE1-CG 3.71Å; F111-L115 HydrophobicContact CZ-CD2 3.96Å; F111-L115 HydrophobicContact CZ-CG 4.18Å; F111-L115 PolarHBondContact O-N 2.97Å; C112-L115 WeakPolarHBondContact O-CB 3.26Å; C112-L115 PolarHBondContact O-N 3.13Å; L115-M117 VanDerWaalsContact C-N 3.26Å; L115-M117 PolarHBondContact O-N 2.75Å; L115-L118 PolarHBondContact O-N 2.94Å; L115-I119 PolarHBondContact O-N 3.17Å; L115-F140 HydrophobicContact CD1-CE2 3.93Å; L115-F140 HydrophobicContact CD1-CZ 3.8Å
116	D	93.1	Very high	93	Very high	66 Å²	66	67.1 Å²	67.1	35%	0.353	38%	0.383	S	S	.	.	H	α-helix	trans	-66.7	-27.3	-179.8	-69.4	-14.2	0	0	0	112.7	C112 D113 H137	C112-D116 PolarHBondContact O-N 2.93Å; D113-D116 PolarHBondContact O-N 3.4Å; D116-H137 IonicContact OD1-CE1 3.47Å; D116-H137 PolarHBondContact OD1-CE1 3.47Å; D116-H137 IonicContact OD1-CG 3.9Å; D116-H137 IonicContact OD1-ND1 2.75Å; D116-H137 PolarHBondContact OD1-ND1 2.75Å
117	M	90.6	Very high	92.9	Very high	156 Å²	156	71.9 Å²	71.9	77%	0.768	41%	0.405	S	S	*	.	H	α-helix	trans	-72.9	-40.4	172.4	-176.1	-175.7	-67.2	0	0	112.4	D113 V114 L115	D113-M117 WeakPolarHBondContact O-CB 3.08Å; D113-M117 PolarHBondContact O-N 3Å; V114-M117 PolarHBondContact O-N 3.05Å; L115-M117 VanDerWaalsContact C-N 3.26Å; L115-M117 PolarHBondContact O-N 2.75Å
118	L	90	Very high	92.7	Very high	127 Å²	127	69.4 Å²	69.4	67%	0.665	39%	0.39	S	S	*	.	H	α-helix	trans	-82.3	-29.8	-176.7	-67.3	176.7	0	0	0	112.8	V114 L115	V114-L118 HydrophobicContact CG1-CD1 4.02Å; V114-L118 WeakPolarHBondContact O-CG 3.13Å; V114-L118 PolarHBondContact O-N 3.25Å; V114-L118 VanDerWaalsContact O-N 3.09Å; L115-L118 PolarHBondContact O-N 2.94Å
119	I	92.9	Very high	92.6	Very high	25 Å²	25	69.9 Å²	69.9	13%	0.128	39%	0.394	C	S	.	.	S	Bend	trans	-129	99.2	-176.8	-54.8	168.8	0	0	0	106	L115 T121 P126 C136 H137	L115-I119 PolarHBondContact O-N 3.17Å; I119-T121 PolarHBondContact O-N 2.03Å; I119-P126 HydrophobicContact CD1-CG 4.01Å; I119-C136 HydrophobicContact CD1-CB 3.74Å; I119-H137 PolarHBondContact O-CE1 3.25Å
120	P	90.3	Very high	92.6	Very high	77 Å²	77	71.6 Å²	71.6	50%	0.5	40%	0.395	S	S	.	.			trans	-59.5	135.8	-179.7	-26.9	35.7	0	0	0	112.3	G122 E123	P120-G122 PolarHBondContact O-N 2.88Å; P120-E123 HydrophobicContact CB-CG 4.31Å; P120-E123 WeakPolarHBondContact O-CB 3.46Å; P120-E123 PolarHBondContact O-N 2.82Å; P120-E123 VanDerWaalsContact O-N 3.15Å
121	T	85.4	Confident	92.5	Very high	109 Å²	109	75 Å²	75	67%	0.669	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	129.2	178.9	53.7	0	0	0	0	111.6	I119	I119-T121 PolarHBondContact O-N 2.03Å
122	G	85.6	Confident	92.6	Very high	82 Å²	82	76.5 Å²	76.5	85%	0.845	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-16.5	-179.3	0	0	0	0	0	113.8	P120	P120-G122 PolarHBondContact O-N 2.88Å
123	E	90.4	Very high	92.6	Very high	125 Å²	125	79.6 Å²	79.6	58%	0.584	45%	0.454	S	S	*	.	S	Bend	trans	-77.7	149.8	167.8	-67.5	-60.9	146.8	0	0	110.7	P120	P120-E123 HydrophobicContact CB-CG 4.31Å; P120-E123 WeakPolarHBondContact O-CB 3.46Å; P120-E123 PolarHBondContact O-N 2.82Å; P120-E123 VanDerWaalsContact O-N 3.15Å
124	P	92.4	Very high	92.7	Very high	69 Å²	69	75.9 Å²	75.9	45%	0.448	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-65	146.3	173.3	28.7	-33.4	0	0	0	110.2
125	C	95.6	Very high	92.9	Very high	27 Å²	27	76.4 Å²	76.4	18%	0.182	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-53.9	148.4	172.1	-64	0	0	0	0	111.4	L129 R130 C136	C125-L129 HydrophobicContact CB-CB 4.2Å; C125-R130 VanDerWaalsContact O-CB 3.31Å; C125-R130 WeakPolarHBondContact O-CB 3.46Å; C125-C136 WeakPolarHBondContact CA-SG 3.5Å; C125-C136 HydrophobicContact CB-CB 3.7Å; C125-C136 WeakPolarHBondContact CB-SG 3.14Å; C125-C136 WeakPolarHBondContact SG-CB 3.31Å; C125-C136 PolarHBondContact SG-N 3.2Å; C125-C136 CovalentContact SG-SG 2.03Å; C125-C136 PolarHBondContact SG-SG 2.91Å
126	P	93.5	Very high	93.1	Very high	61 Å²	61	75.6 Å²	75.6	40%	0.396	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-64.9	153.4	176.8	26.7	-33.9	0	0	0	111	I119 L129 R130	I119-P126 HydrophobicContact CD1-CG 4.01Å; P126-L129 WeakPolarHBondContact O-CB 3.18Å; P126-L129 PolarHBondContact O-N 2.76Å; P126-R130 PolarHBondContact O-N 2.91Å
127	E	93.8	Very high	93.2	Very high	103 Å²	103	74.4 Å²	74.4	48%	0.481	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	145.5	165.6	-66.4	-58.8	161.5	0	0	110	R130 T131	E127-R130 WeakPolarHBondContact OE1-CB 3.32Å; E127-R130 WeakPolarHBondContact OE1-CD 3.49Å; E127-T131 VanDerWaalsContact CD-OG1 3.26Å; E127-T131 PolarHBondContact OE1-OG1 3.38Å; E127-T131 VanDerWaalsContact OE2-CB 3.27Å; E127-T131 WeakPolarHBondContact OE2-CB 3.28Å; E127-T131 PolarHBondContact OE2-N 3.27Å; E127-T131 VanDerWaalsContact OE2-N 3.1Å; E127-T131 PolarHBondContact OE2-OG1 3.06Å
128	P	94.5	Very high	93.4	Very high	19 Å²	19	68.4 Å²	68.4	12%	0.123	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	cis	-86.8	1.5	4.3	35.5	-37.4	0	0	0	114.8	R130 T131 Y132 L147 F152	P128-R130 VanDerWaalsContact C-N 3.32Å; P128-R130 PolarHBondContact O-N 3.29Å; P128-T131 PolarHBondContact O-N 3.29Å; P128-Y132 HydrophobicContact CB-CD2 4.38Å; P128-Y132 HydrophobicContact CB-CE2 4.22Å; P128-Y132 WeakPolarHBondContact O-CD2 3.38Å; P128-Y132 PolarHBondContact O-N 2.92Å; P128-L147 HydrophobicContact CB-CD1 4.22Å; P128-L147 HydrophobicContact CG-CD1 3.85Å; P128-L147 HydrophobicContact CG-CD2 4.5Å; P128-F152 HydrophobicContact CG-CE1 3.87Å; P128-F152 HydrophobicContact CG-CE2 4.16Å; P128-F152 HydrophobicContact CG-CZ 3.41Å; P128-F152 VanDerWaalsContact CG-CZ 3.41Å
129	L	94.9	Very high	93.7	Very high	46 Å²	46	66.3 Å²	66.3	24%	0.241	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-41.3	-174.2	-58.3	-177.8	0	0	0	111.8	C125 P126 Y132 G133 L134 C136	C125-L129 HydrophobicContact CB-CB 4.2Å; P126-L129 WeakPolarHBondContact O-CB 3.18Å; P126-L129 PolarHBondContact O-N 2.76Å; L129-Y132 CarbonylContact O-C 3.54Å; L129-Y132 PolarHBondContact O-N 2.92Å; L129-G133 PolarHBondContact O-N 2.9Å; L129-L134 HydrophobicContact CB-CB 4.05Å; L129-L134 HydrophobicContact CD2-CB 4Å; L129-L134 HydrophobicContact CD2-CD1 3.77Å; L129-L134 PolarHBondContact O-N 3.49Å; L129-C136 HydrophobicContact CD1-CB 4.02Å
130	R	95.1	Very high	94	Very high	154 Å²	154	66.9 Å²	66.9	58%	0.581	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-47.9	177.7	176.9	-178.3	-174.1	-173.6	0.9	112.7	C125 P126 E127 P128 Y132 G133	C125-R130 VanDerWaalsContact O-CB 3.31Å; C125-R130 WeakPolarHBondContact O-CB 3.46Å; P126-R130 PolarHBondContact O-N 2.91Å; E127-R130 WeakPolarHBondContact OE1-CB 3.32Å; E127-R130 WeakPolarHBondContact OE1-CD 3.49Å; P128-R130 VanDerWaalsContact C-N 3.32Å; P128-R130 PolarHBondContact O-N 3.29Å; R130-Y132 PolarHBondContact O-N 3.24Å; R130-G133 PolarHBondContact O-N 3.36Å; R130-G133 VanDerWaalsContact O-N 3.07Å
131	T	95.8	Very high	94.4	Very high	95 Å²	95	70.8 Å²	70.8	58%	0.583	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-37	178.2	-69.8	0	0	0	0	112.5	E127 P128	E127-T131 VanDerWaalsContact CD-OG1 3.26Å; E127-T131 PolarHBondContact OE1-OG1 3.38Å; E127-T131 VanDerWaalsContact OE2-CB 3.27Å; E127-T131 WeakPolarHBondContact OE2-CB 3.28Å; E127-T131 PolarHBondContact OE2-N 3.27Å; E127-T131 VanDerWaalsContact OE2-N 3.1Å; E127-T131 PolarHBondContact OE2-OG1 3.06Å; P128-T131 PolarHBondContact O-N 3.29Å
132	Y	96.3	Very high	95	Very high	101 Å²	101	71.5 Å²	71.5	40%	0.396	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	6.2	-178.4	-61	-65.7	0	0	0	114.2	P128 L129 R130 L134 L147 P148 S150	P128-Y132 HydrophobicContact CB-CD2 4.38Å; P128-Y132 HydrophobicContact CB-CE2 4.22Å; P128-Y132 WeakPolarHBondContact O-CD2 3.38Å; P128-Y132 PolarHBondContact O-N 2.92Å; L129-Y132 CarbonylContact O-C 3.54Å; L129-Y132 PolarHBondContact O-N 2.92Å; R130-Y132 PolarHBondContact O-N 3.24Å; Y132-L134 PolarHBondContact O-N 3.07Å; Y132-L147 HydrophobicContact CD2-CD1 3.61Å; Y132-L147 HydrophobicContact CE2-CD1 3.93Å; Y132-P148 HydrophobicContact CD1-CG 3.85Å; Y132-P148 HydrophobicContact CE1-CB 4.11Å; Y132-P148 HydrophobicContact CE1-CG 3.49Å; Y132-P148 VanDerWaalsContact CE1-CG 3.49Å; Y132-P148 HydrophobicContact CE2-CG 4.39Å; Y132-P148 HydrophobicContact CG-CG 4.44Å; Y132-S150 WeakPolarHBondContact CE2-OG 3.44Å
133	G	95.7	Very high	95.6	Very high	67 Å²	67	69.1 Å²	69.1	69%	0.691	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	26.2	-179	0	0	0	0	0	113.6	L129 R130	L129-G133 PolarHBondContact O-N 2.9Å; R130-G133 PolarHBondContact O-N 3.36Å; R130-G133 VanDerWaalsContact O-N 3.07Å
134	L	97.1	Very high	96	Very high	22 Å²	22	68 Å²	68	12%	0.115	38%	0.378	C	S	.	.			trans	-81.2	133.6	178.9	-65.2	172.3	0	0	0	110.1	L129 Y132 Y145 L147	L129-L134 HydrophobicContact CB-CB 4.05Å; L129-L134 HydrophobicContact CD2-CB 4Å; L129-L134 HydrophobicContact CD2-CD1 3.77Å; L129-L134 PolarHBondContact O-N 3.49Å; Y132-L134 PolarHBondContact O-N 3.07Å; L134-Y145 HydrophobicContact CD2-CD1 3.96Å; L134-L147 HydrophobicContact CD1-CB 3.91Å; L134-L147 HydrophobicContact CD1-CD1 4.02Å
135	P	95.9	Very high	96.2	Very high	51 Å²	51	67.8 Å²	67.8	33%	0.331	37%	0.368	S	S	.	.			trans	-69.5	152	176.3	30.9	-36.2	0	0	0	111.1	F140 Y145	P135-F140 HydrophobicContact CB-CD1 4.29Å; P135-F140 HydrophobicContact CB-CE1 4.32Å; P135-F140 HydrophobicContact CG-CD1 3.71Å; P135-F140 HydrophobicContact CG-CE1 4.05Å; P135-F140 WeakPolarHBondContact O-CE1 3.42Å; P135-Y145 HydrophobicContact CG-CD1 4.31Å; P135-Y145 HydrophobicContact CG-CE1 3.6Å
136	C	95.9	Very high	96.4	Very high	5 Å²	5	69.4 Å²	69.4	3%	0.034	38%	0.379	C	S	.	.			trans	-125.9	9.5	176.5	57.9	0	0	0	0	112.9	I119 C125 L129	I119-C136 HydrophobicContact CD1-CB 3.74Å; C125-C136 WeakPolarHBondContact CA-SG 3.5Å; C125-C136 HydrophobicContact CB-CB 3.7Å; C125-C136 WeakPolarHBondContact CB-SG 3.14Å; C125-C136 WeakPolarHBondContact SG-CB 3.31Å; C125-C136 PolarHBondContact SG-N 3.2Å; C125-C136 CovalentContact SG-SG 2.03Å; C125-C136 PolarHBondContact SG-SG 2.91Å; L129-C136 HydrophobicContact CD1-CB 4.02Å
137	H	95.6	Very high	96.6	Very high	42 Å²	42	67.2 Å²	67.2	19%	0.194	36%	0.364	C	S	.	.	S	Bend	trans	-130.3	150.4	177.8	-69.7	-84.4	0	0	0	110.4	D116 I119	D116-H137 IonicContact OD1-CE1 3.47Å; D116-H137 PolarHBondContact OD1-CE1 3.47Å; D116-H137 IonicContact OD1-CG 3.9Å; D116-H137 IonicContact OD1-ND1 2.75Å; D116-H137 PolarHBondContact OD1-ND1 2.75Å; I119-H137 PolarHBondContact O-CE1 3.25Å
138	C	95.5	Very high	96.8	Very high	30 Å²	30	64.7 Å²	64.7	20%	0.203	36%	0.357	C	S	.	.	S	Bend	trans	-70.9	153.4	167.3	-63.6	0	0	0	0	111.2	C112	C112-C138 VanDerWaalsContact CA-SG 3.54Å; C112-C138 HydrophobicContact CB-CB 3.62Å; C112-C138 WeakPolarHBondContact CB-SG 3.37Å; C112-C138 WeakPolarHBondContact SG-CB 3.39Å; C112-C138 CovalentContact SG-SG 2.03Å; C112-C138 PolarHBondContact SG-SG 3.5Å
139	P	96.7	Very high	96.9	Very high	83 Å²	83	69.3 Å²	69.3	54%	0.539	38%	0.375	S	S	.	.	P	Polyproline II helix	cis	-78.7	139.6	-7.2	32.6	-34.6	0	0	0	112.4	L76 S77	L76-P139 WeakPolarHBondContact O-CA 3.48Å; S77-P139 WeakPolarHBondContact OG-CB 3.34Å
140	F	97.8	Very high	97	Very high	37 Å²	37	67.6 Å²	67.6	16%	0.162	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-80.4	120.1	166.3	-57	-93.8	0	0	0	108.2	P75 L76 L115 P135	P75-F140 CarbonylContact C-O 3.49Å; P75-F140 VanDerWaalsContact CA-O 3.27Å; P75-F140 WeakPolarHBondContact CA-O 3.4Å; L76-F140 HydrophobicContact CB-CB 4.09Å; L76-F140 HydrophobicContact CB-CD2 4.3Å; L76-F140 HydrophobicContact CD1-CB 4.35Å; L76-F140 HydrophobicContact CG-CB 4.42Å; L76-F140 PolarHBondContact N-O 2.85Å; L76-F140 PolarHBondContact O-N 2.89Å; L115-F140 HydrophobicContact CD1-CE2 3.93Å; L115-F140 HydrophobicContact CD1-CZ 3.8Å; P135-F140 HydrophobicContact CB-CD1 4.29Å; P135-F140 HydrophobicContact CB-CE1 4.32Å; P135-F140 HydrophobicContact CG-CD1 3.71Å; P135-F140 HydrophobicContact CG-CE1 4.05Å; P135-F140 WeakPolarHBondContact O-CE1 3.42Å
141	K	98.1	Very high	97	Very high	158 Å²	158	66 Å²	66	69%	0.687	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-67.4	160.1	-179.5	-64.4	-178.2	179.2	178.9	0	111.1	Y145	K141-Y145 PolarHBondContact N-OH 2.79Å; K141-Y145 VanDerWaalsContact N-OH 3.09Å; K141-Y145 WeakPolarHBondContact O-CE2 3.33Å; K141-Y145 PolarHBondContact O-OH 2.69Å
142	E	98.3	Very high	96.8	Very high	125 Å²	125	65 Å²	65	58%	0.584	35%	0.354	S	S	*	.	S	Bend	trans	-58.5	144.9	166.2	64.5	-126.6	-148.4	0	0	111.3	T72 P75	T72-E142 WeakPolarHBondContact O-CA 3Å; P75-E142 WeakPolarHBondContact CD-OE2 3.44Å
143	G	98.3	Very high	96.6	Very high	32 Å²	32	65.4 Å²	65.4	33%	0.33	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	146.2	-170.9	-179	0	0	0	0	0	113.4	S71 T72	S71-G143 CarbonylContact C-O 3.21Å; S71-G143 VanDerWaalsContact CA-O 3.29Å; S71-G143 WeakPolarHBondContact CA-O 3.25Å; T72-G143 PolarHBondContact N-O 2.86Å; T72-G143 PolarHBondContact O-N 3.07Å
144	T	98.5	Very high	96.2	Very high	102 Å²	102	64.1 Å²	64.1	63%	0.626	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	129	177	-60.3	0	0	0	0	109.2	V69 G70	V69-T144 HydrophobicContact CG1-CG2 3.77Å; G70-T144 CarbonylContact O-C 3.51Å; G70-T144 WeakPolarHBondContact O-CA 3.43Å
145	Y	98.4	Very high	95.5	Very high	64 Å²	64	66.3 Å²	66.3	25%	0.251	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131	178.3	-64.1	-84.6	0	0	0	108.7	V69 G70 T72 L134 P135 K141	V69-Y145 WeakPolarHBondContact CA-O 3.42Å; G70-Y145 PolarHBondContact N-O 2.96Å; G70-Y145 PolarHBondContact O-N 2.9Å; T72-Y145 HydrophobicContact CG2-CE2 4.3Å; L134-Y145 HydrophobicContact CD2-CD1 3.96Å; P135-Y145 HydrophobicContact CG-CD1 4.31Å; P135-Y145 HydrophobicContact CG-CE1 3.6Å; K141-Y145 PolarHBondContact N-OH 2.79Å; K141-Y145 VanDerWaalsContact N-OH 3.09Å; K141-Y145 WeakPolarHBondContact O-CE2 3.33Å; K141-Y145 PolarHBondContact O-OH 2.69Å
146	S	98.3	Very high	94.6	Very high	60 Å²	60	71.9 Å²	71.9	42%	0.42	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	118.7	-178.1	-176.2	0	0	0	0	109.5	P148	S146-P148 WeakPolarHBondContact O-CD 3.03Å
147	L	98.1	Very high	93.5	Very high	15 Å²	15	76.8 Å²	76.8	8%	0.079	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	106.9	166.3	177.9	62.9	0	0	0	107.7	S67 V68 P128 Y132 L134 S150 F152	S67-L147 WeakPolarHBondContact CA-O 3.49Å; V68-L147 HydrophobicContact CG1-CB 3.78Å; V68-L147 HydrophobicContact CG1-CD2 4.23Å; V68-L147 PolarHBondContact N-O 2.77Å; V68-L147 PolarHBondContact O-N 2.82Å; P128-L147 HydrophobicContact CB-CD1 4.22Å; P128-L147 HydrophobicContact CG-CD1 3.85Å; P128-L147 HydrophobicContact CG-CD2 4.5Å; Y132-L147 HydrophobicContact CD2-CD1 3.61Å; Y132-L147 HydrophobicContact CE2-CD1 3.93Å; L134-L147 HydrophobicContact CD1-CB 3.91Å; L134-L147 HydrophobicContact CD1-CD1 4.02Å; L147-S150 WeakPolarHBondContact CD1-OG 3.41Å; L147-F152 HydrophobicContact CD2-CE2 4.26Å; L147-F152 HydrophobicContact CD2-CZ 4.07Å
148	P	97.4	Very high	92.3	Very high	50 Å²	50	84.4 Å²	84.4	33%	0.325	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	169.3	171.8	-24.5	37.2	0	0	0	111.9	Y132 S146 S150	Y132-P148 HydrophobicContact CD1-CG 3.85Å; Y132-P148 HydrophobicContact CE1-CB 4.11Å; Y132-P148 HydrophobicContact CE1-CG 3.49Å; Y132-P148 VanDerWaalsContact CE1-CG 3.49Å; Y132-P148 HydrophobicContact CE2-CG 4.39Å; Y132-P148 HydrophobicContact CG-CG 4.44Å; S146-P148 WeakPolarHBondContact O-CD 3.03Å; P148-S150 PolarHBondContact O-N 2.71Å; P148-S150 PolarHBondContact O-OG 2.74Å
149	K	97.1	Very high	91.2	Very high	117 Å²	117	85.8 Å²	85.8	51%	0.509	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.9	111.7	176.9	-77	-164.5	170.7	-151.3	0	110.3	E54 T65 V66	E54-K149 IonicContact OE1-NZ 2.88Å; E54-K149 PolarHBondContact OE1-NZ 2.9Å; E54-K149 IonicContact OE2-NZ 2.82Å; E54-K149 PolarHBondContact OE2-NZ 2.95Å; T65-K149 HydrophobicContact CG2-CB 4.04Å; T65-K149 HydrophobicContact CG2-CD 4.36Å; T65-K149 HydrophobicContact CG2-CG 4.29Å; V66-K149 WeakPolarHBondContact O-CA 3.33Å
150	S	96.8	Very high	90.1	Very high	9 Å²	9	83.9 Å²	83.9	6%	0.063	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.5	-176.1	-58.2	0	0	0	0	109.1	T65 V66 Y132 L147 P148 F152	T65-S150 WeakPolarHBondContact CA-O 3.45Å; V66-S150 PolarHBondContact N-O 3.09Å; V66-S150 PolarHBondContact O-N 2.72Å; Y132-S150 WeakPolarHBondContact CE2-OG 3.44Å; L147-S150 WeakPolarHBondContact CD1-OG 3.41Å; P148-S150 PolarHBondContact O-N 2.71Å; P148-S150 PolarHBondContact O-OG 2.74Å; S150-F152 WeakPolarHBondContact O-CD2 3.22Å
151	E	94.8	Very high	89.2	Confident	120 Å²	120	87.8 Å²	87.8	56%	0.561	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.8	-178.1	-170.3	173.2	-167.4	0	0	110.5	N63 V64	N63-E151 HydrophobicContact CB-CG 4.03Å; N63-E151 WeakPolarHBondContact CB-OE1 3.33Å; N63-E151 VanDerWaalsContact CG-OE1 3.23Å; N63-E151 PolarHBondContact ND2-OE1 3.19Å; V64-E151 CarbonylContact O-C 3.58Å; V64-E151 WeakPolarHBondContact O-CA 3.29Å
152	F	92.4	Very high	88	Confident	76 Å²	76	83 Å²	83	33%	0.333	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.4	176.5	-65.5	-92.9	0	0	0	109.1	N63 V64 V66 P128 L147 S150	N63-F152 WeakPolarHBondContact CA-O 3.26Å; V64-F152 PolarHBondContact N-O 2.81Å; V64-F152 PolarHBondContact O-N 2.88Å; V66-F152 HydrophobicContact CB-CD2 4.24Å; V66-F152 HydrophobicContact CB-CE2 4.06Å; V66-F152 HydrophobicContact CG2-CD2 4.02Å; V66-F152 HydrophobicContact CG2-CE2 4.28Å; P128-F152 HydrophobicContact CG-CE1 3.87Å; P128-F152 HydrophobicContact CG-CE2 4.16Å; P128-F152 HydrophobicContact CG-CZ 3.41Å; P128-F152 VanDerWaalsContact CG-CZ 3.41Å; L147-F152 HydrophobicContact CD2-CE2 4.26Å; L147-F152 HydrophobicContact CD2-CZ 4.07Å; S150-F152 WeakPolarHBondContact O-CD2 3.22Å
153	V	91.3	Very high	87	Confident	108 Å²	108	78.9 Å²	78.9	66%	0.655	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	122.7	174.9	-177.3	0	0	0	0	108.4	P155	V153-P155 VanDerWaalsContact O-CD 3.3Å; V153-P155 WeakPolarHBondContact O-CD 3.05Å
154	V	87.2	Confident	86.4	Confident	41 Å²	41	80.8 Å²	80.8	25%	0.248	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	106	168.3	-176.9	0	0	0	0	107.5	I60 G62 V64	I60-V154 HydrophobicContact CG1-CG1 4.31Å; I60-V154 HydrophobicContact CG2-CG1 4.07Å; G62-V154 PolarHBondContact N-O 2.93Å; G62-V154 WeakPolarHBondContact O-CA 3.47Å; G62-V154 WeakPolarHBondContact O-CB 3.44Å; G62-V154 PolarHBondContact O-N 2.89Å; V64-V154 HydrophobicContact CB-CG2 4.5Å; V64-V154 HydrophobicContact CG2-CG2 3.66Å
155	P	82.5	Confident	86.1	Confident	68 Å²	68	79.3 Å²	79.3	44%	0.442	42%	0.423	S	S	.	.			trans	-69.9	167.4	-174.6	26.6	-30.4	0	0	0	111.9	V153 L157	V153-P155 VanDerWaalsContact O-CD 3.3Å; V153-P155 WeakPolarHBondContact O-CD 3.05Å; P155-L157 HydrophobicContact CG-CD1 4.22Å; P155-L157 HydrophobicContact CG-CD2 3.87Å; P155-L157 HydrophobicContact CG-CG 3.88Å; P155-L157 PolarHBondContact O-N 3.41Å
156	H	78.6	Confident	85.8	Confident	168 Å²	168	76.5 Å²	76.5	78%	0.778	41%	0.413	S	S	*	.			trans	-68.5	101.7	165.7	-70.8	64.7	0	0	0	107.8	P61	P61-H156 WeakPolarHBondContact CB-ND1 3.17Å; P61-H156 WeakPolarHBondContact CG-CE1 3.07Å; P61-H156 WeakPolarHBondContact CG-ND1 3Å; P61-H156 WeakPolarHBondContact CG-NE2 3.37Å
157	L	70.9	Confident	85.7	Confident	107 Å²	107	74.2 Å²	74.2	56%	0.56	40%	0.397	S	S	*	.			trans	-104.8	148.7	176	-63.9	172.9	0	0	0	109.1	P155 L159	P155-L157 HydrophobicContact CG-CD1 4.22Å; P155-L157 HydrophobicContact CG-CD2 3.87Å; P155-L157 HydrophobicContact CG-CG 3.88Å; P155-L157 PolarHBondContact O-N 3.41Å; L157-L159 HydrophobicContact CB-CD2 3.64Å; L157-L159 HydrophobicContact CB-CG 4.19Å; L157-L159 HydrophobicContact CD1-CD2 4.31Å; L157-L159 PolarHBondContact O-N 2.88Å
158	E	72.4	Confident	85.6	Confident	203 Å²	203	74.1 Å²	74.1	95%	0.949	40%	0.395	S	S	*	.			trans	-68.9	87.9	164.2	-69	-167.9	168.4	0	0	108.1
159	L	71.3	Confident	85.6	Confident	59 Å²	59	76 Å²	76	31%	0.309	40%	0.396	S	S	.	.			trans	-78.5	141.8	-177.5	-65.5	-178.5	0	0	0	110.5	I60 L157 L163	I60-L159 HydrophobicContact CG2-CD1 3.69Å; L157-L159 HydrophobicContact CB-CD2 3.64Å; L157-L159 HydrophobicContact CB-CG 4.19Å; L157-L159 HydrophobicContact CD1-CD2 4.31Å; L157-L159 PolarHBondContact O-N 2.88Å; L159-L163 HydrophobicContact CB-CB 4.3Å; L159-L163 HydrophobicContact CB-CD2 4.09Å; L159-L163 HydrophobicContact CD1-CD2 3.63Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CD2-CD2 3.6Å; L159-L163 HydrophobicContact CG-CD2 3.93Å
160	P	74	Confident	85.7	Confident	43 Å²	43	73 Å²	73	28%	0.279	39%	0.385	S	S	.	.			trans	-53.1	145.5	171.2	-26.4	34.8	0	0	0	111.1	I103 W162 L163	I103-P160 HydrophobicContact CD1-CG 4.45Å; P160-W162 VanDerWaalsContact CB-CD1 3.44Å; P160-W162 HydrophobicContact CB-CD2 4.34Å; P160-W162 HydrophobicContact CB-CG 4.17Å; P160-W162 HydrophobicContact CB-CZ2 4.29Å; P160-W162 HydrophobicContact CG-CZ2 4.18Å; P160-W162 PolarHBondContact O-N 2.89Å; P160-L163 PolarHBondContact O-N 2.04Å
161	S	77.9	Confident	85.7	Confident	119 Å²	119	75 Å²	75	83%	0.832	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-16.9	-175.7	59.1	0	0	0	0	114.9	T164	S161-T164 WeakPolarHBondContact O-CG2 3.04Å
162	W	73.4	Confident	85.9	Confident	58 Å²	58	70.8 Å²	70.8	22%	0.22	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-23.7	174.7	62.4	-101.3	0	0	0	113.5	L86 K88 I97 I103 P160 T164 Y168	L86-W162 HydrophobicContact CD2-CH2 3.5Å; L86-W162 VanDerWaalsContact CD2-CH2 3.5Å; L86-W162 HydrophobicContact CD2-CZ3 3.78Å; K88-W162 WeakPolarHBondContact CD-O 3.44Å; K88-W162 PolarHBondContact NZ-O 3.46Å; I97-W162 HydrophobicContact CD1-CD2 4.27Å; I97-W162 HydrophobicContact CD1-CE3 4.01Å; I97-W162 HydrophobicContact CG1-CD2 4.49Å; I97-W162 HydrophobicContact CG1-CE3 4.02Å; I97-W162 HydrophobicContact CG1-CZ3 4.11Å; I97-W162 HydrophobicContact CG2-CD2 3.76Å; I97-W162 VanDerWaalsContact CG2-CE2 3.49Å; I97-W162 HydrophobicContact CG2-CE3 3.98Å; I97-W162 HydrophobicContact CG2-CG 4.46Å; I97-W162 HydrophobicContact CG2-CH2 3.82Å; I97-W162 HydrophobicContact CG2-CZ2 3.56Å; I97-W162 HydrophobicContact CG2-CZ3 3.99Å; I103-W162 HydrophobicContact CG2-CH2 3.81Å; I103-W162 HydrophobicContact CG2-CZ2 3.58Å; P160-W162 VanDerWaalsContact CB-CD1 3.44Å; P160-W162 HydrophobicContact CB-CD2 4.34Å; P160-W162 HydrophobicContact CB-CG 4.17Å; P160-W162 HydrophobicContact CB-CZ2 4.29Å; P160-W162 HydrophobicContact CG-CZ2 4.18Å; P160-W162 PolarHBondContact O-N 2.89Å; W162-T164 PolarHBondContact O-N 2.78Å; W162-T164 PolarHBondContact O-OG1 2.9Å; W162-Y168 HydrophobicContact CE3-CE1 4.11Å; W162-Y168 AromaticContact CZ3-CE1 3.86Å; W162-Y168 HydrophobicContact CZ3-CE1 3.86Å; W162-Y168 PolarHBondContact O-OH 2.84Å
163	L	77.3	Confident	86.2	Confident	37 Å²	37	69.2 Å²	69.2	19%	0.194	37%	0.372	C	S	.	.			trans	-81.6	59.6	-177.4	-166.8	71.1	0	0	0	111.1	L159 P160 Y168 L190	L159-L163 HydrophobicContact CB-CB 4.3Å; L159-L163 HydrophobicContact CB-CD2 4.09Å; L159-L163 HydrophobicContact CD1-CD2 3.63Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CD2-CD2 3.6Å; L159-L163 HydrophobicContact CG-CD2 3.93Å; P160-L163 PolarHBondContact O-N 2.04Å; L163-Y168 WeakPolarHBondContact CA-OH 3.34Å; L163-Y168 HydrophobicContact CD1-CE1 3.94Å; L163-L190 HydrophobicContact CD1-CD1 3.63Å; L163-L190 HydrophobicContact CG-CD1 4.31Å
164	T	85.8	Confident	86.5	Confident	73 Å²	73	65.6 Å²	65.6	45%	0.448	35%	0.349	S	S	.	.			trans	-99.7	174.4	177.6	52.8	0	0	0	0	111.8	K88 S161 W162 G166 Y168	K88-T164 PolarHBondContact NZ-O 3.16Å; K88-T164 VanDerWaalsContact NZ-O 3.16Å; K88-T164 PolarHBondContact NZ-OG1 2.87Å; S161-T164 WeakPolarHBondContact O-CG2 3.04Å; W162-T164 PolarHBondContact O-N 2.78Å; W162-T164 PolarHBondContact O-OG1 2.9Å; T164-G166 PolarHBondContact O-N 3.34Å; T164-Y168 PolarHBondContact N-OH 3.27Å; T164-Y168 VanDerWaalsContact N-OH 3.14Å; T164-Y168 WeakPolarHBondContact O-CE2 3.28Å; T164-Y168 PolarHBondContact O-OH 2.81Å
165	T	91.3	Very high	87.1	Confident	70 Å²	70	64 Å²	64	43%	0.429	34%	0.339	S	S	.	.	S	Bend	trans	-46	132.5	170.6	-61.7	0	0	0	0	111.9	L31 L190 G192	L31-T165 HydrophobicContact CD2-CG2 4.26Å; T165-L190 CarbonylContact C-O 3.55Å; T165-L190 VanDerWaalsContact CA-O 3.27Å; T165-L190 WeakPolarHBondContact CA-O 3.45Å; T165-G192 PolarHBondContact OG1-N 2.87Å
166	G	93.1	Very high	87.8	Confident	5 Å²	5	62.5 Å²	62.5	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.9	-175.6	178.7	0	0	0	0	0	113.8	T164 Y168 L190	T164-G166 PolarHBondContact O-N 3.34Å; G166-Y168 WeakPolarHBondContact O-CD2 3.46Å; G166-Y168 WeakPolarHBondContact O-CE2 3.48Å; G166-L190 PolarHBondContact N-O 2.87Å; G166-L190 PolarHBondContact O-N 2.61Å
167	N	95.8	Very high	88.6	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.07	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.9	179.2	-59.6	-29.6	0	0	0	110.3	Q30 L31 G32 E89 W94 S189	Q30-N167 PolarHBondContact O-ND2 3.09Å; L31-N167 VanDerWaalsContact CA-OD1 3.28Å; L31-N167 WeakPolarHBondContact CA-OD1 3.48Å; G32-N167 PolarHBondContact N-OD1 3.49Å; E89-N167 HydrophobicContact CB-CB 3.95Å; E89-N167 PolarHBondContact N-O 2.89Å; E89-N167 WeakPolarHBondContact OE2-CB 3.11Å; E89-N167 PolarHBondContact OE2-ND2 3.37Å; W94-N167 HydrophobicContact CH2-CB 4.14Å; N167-S189 PolarHBondContact OD1-OG 2.89Å
168	Y	96.3	Very high	89.8	Confident	12 Å²	12	62.6 Å²	62.6	5%	0.047	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	147.8	178.9	-64.5	-96	0	0	0	109.6	L86 E87 K88 W162 L163 T164 G166 A187 A188 L190	L86-Y168 HydrophobicContact CD1-CD1 4.44Å; E87-Y168 WeakPolarHBondContact O-CA 3.42Å; K88-Y168 HydrophobicContact CB-CD1 3.95Å; K88-Y168 HydrophobicContact CB-CE1 3.76Å; K88-Y168 HydrophobicContact CD-CE1 4.04Å; K88-Y168 HydrophobicContact CG-CD1 4.17Å; K88-Y168 HydrophobicContact CG-CE1 3.66Å; K88-Y168 PolarHBondContact NZ-OH 3.45Å; W162-Y168 HydrophobicContact CE3-CE1 4.11Å; W162-Y168 AromaticContact CZ3-CE1 3.86Å; W162-Y168 HydrophobicContact CZ3-CE1 3.86Å; W162-Y168 PolarHBondContact O-OH 2.84Å; L163-Y168 WeakPolarHBondContact CA-OH 3.34Å; L163-Y168 HydrophobicContact CD1-CE1 3.94Å; T164-Y168 PolarHBondContact N-OH 3.27Å; T164-Y168 VanDerWaalsContact N-OH 3.14Å; T164-Y168 WeakPolarHBondContact O-CE2 3.28Å; T164-Y168 PolarHBondContact O-OH 2.81Å; G166-Y168 WeakPolarHBondContact O-CD2 3.46Å; G166-Y168 WeakPolarHBondContact O-CE2 3.48Å; Y168-A187 CarbonylContact O-C 3.58Å; Y168-A187 VanDerWaalsContact O-CA 3.31Å; Y168-A187 WeakPolarHBondContact O-CA 3.25Å; Y168-A188 PolarHBondContact N-O 3.01Å; Y168-A188 PolarHBondContact O-N 2.8Å; Y168-A188 VanDerWaalsContact O-O 3.13Å; Y168-L190 HydrophobicContact CD2-CB 4.16Å; Y168-L190 HydrophobicContact CD2-CD1 3.64Å; Y168-L190 HydrophobicContact CD2-CG 3.69Å; Y168-L190 HydrophobicContact CE2-CB 3.85Å; Y168-L190 HydrophobicContact CE2-CD1 3.45Å; Y168-L190 VanDerWaalsContact CE2-CD1 3.45Å; Y168-L190 HydrophobicContact CE2-CG 3.75Å; Y168-L190 HydrophobicContact CG-CD1 4.28Å
169	R	97.7	Very high	91	Very high	90 Å²	90	59.7 Å²	59.7	34%	0.34	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144.7	166.3	70.5	-173.1	-173.1	-174.6	1.1	109.8	E87 W94 I186 A187	E87-R169 HydrophobicContact CB-CG 3.95Å; E87-R169 PolarHBondContact N-O 3.34Å; E87-R169 PolarHBondContact O-N 3.19Å; E87-R169 IonicContact OE1-CZ 3.68Å; E87-R169 IonicContact OE1-NE 3.79Å; E87-R169 IonicContact OE1-NH2 3.2Å; E87-R169 PolarHBondContact OE1-NH2 3.02Å; E87-R169 IonicContact OE2-CZ 3.73Å; E87-R169 IonicContact OE2-NE 2.82Å; E87-R169 PolarHBondContact OE2-NE 2.93Å; E87-R169 IonicContact OE2-NH2 2.82Å; E87-R169 PolarHBondContact OE2-NH2 3.43Å; W94-R169 VanDerWaalsContact CD1-NH1 3.35Å; W94-R169 HydrophobicContact CD2-CG 4.16Å; W94-R169 HydrophobicContact CE3-CB 4.39Å; W94-R169 HydrophobicContact CE3-CG 3.59Å; W94-R169 HydrophobicContact CH2-CB 4.06Å; W94-R169 HydrophobicContact CH2-CG 4.09Å; W94-R169 HydrophobicContact CZ3-CB 3.84Å; W94-R169 HydrophobicContact CZ3-CG 3.55Å; R169-I186 CarbonylContact C-O 3.58Å; R169-I186 WeakPolarHBondContact CA-O 3.45Å; R169-A187 HydrophobicContact CB-CB 4.23Å
170	I	98.1	Very high	92.2	Very high	53 Å²	53	60.5 Å²	60.5	27%	0.272	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133	177.3	-171.5	168.9	0	0	0	109.2	L84 V85 L86 K185 I186	L84-I170 HydrophobicContact CD1-CD1 4.44Å; L84-I170 HydrophobicContact CD2-CD1 4.22Å; V85-I170 VanDerWaalsContact O-CA 3.28Å; V85-I170 WeakPolarHBondContact O-CA 3.33Å; L86-I170 HydrophobicContact CD1-CB 4.17Å; I170-K185 CarbonylContact O-C 3.5Å; I170-K185 WeakPolarHBondContact O-CA 3.38Å; I170-I186 HydrophobicContact CG2-CB 3.77Å; I170-I186 HydrophobicContact CG2-CD1 4.48Å; I170-I186 HydrophobicContact CG2-CG1 4.44Å; I170-I186 PolarHBondContact N-O 2.75Å; I170-I186 PolarHBondContact O-N 3.48Å
171	E	98.6	Very high	93.4	Very high	53 Å²	53	58.9 Å²	58.9	25%	0.248	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.4	165.2	-179.6	168	-166.4	0	0	108	L84 V85 I184 K185	L84-E171 CarbonylContact C-O 3.6Å; L84-E171 WeakPolarHBondContact CA-O 3.5Å; V85-E171 HydrophobicContact CB-CB 4.39Å; V85-E171 PolarHBondContact N-O 3.15Å; V85-E171 PolarHBondContact O-N 3.31Å; E171-I184 WeakPolarHBondContact CA-O 3.46Å; E171-K185 HydrophobicContact CB-CG 4.11Å; E171-K185 HydrophobicContact CG-CG 4.03Å; E171-K185 WeakPolarHBondContact OE1-CE 3.17Å; E171-K185 IonicContact OE1-NZ 3.73Å; E171-K185 WeakPolarHBondContact OE2-CE 3.35Å; E171-K185 IonicContact OE2-NZ 3.68Å
172	S	98.3	Very high	94.4	Very high	31 Å²	31	53.5 Å²	53.5	22%	0.217	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124	178	178.7	0	0	0	0	109.6	E83 L84 C183 I184	E83-S172 CarbonylContact O-C 3.6Å; E83-S172 WeakPolarHBondContact O-CA 3.46Å; L84-S172 WeakPolarHBondContact CD2-OG 3.36Å; S172-C183 VanDerWaalsContact O-CA 3.26Å; S172-C183 WeakPolarHBondContact O-CA 3.5Å; S172-I184 PolarHBondContact N-O 2.77Å; S172-I184 PolarHBondContact O-N 3.02Å
173	I	98.4	Very high	95.5	Very high	42 Å²	42	51 Å²	51	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.7	176.3	-58.2	172.5	0	0	0	108.5	V82 E83 R180 C183	V82-I173 WeakPolarHBondContact CA-O 3.37Å; E83-I173 HydrophobicContact CB-CB 4.37Å; E83-I173 PolarHBondContact N-O 2.59Å; E83-I173 PolarHBondContact O-N 2.97Å; I173-R180 HydrophobicContact CG2-CG 4.35Å; I173-C183 HydrophobicContact CG1-CB 4.43Å
174	L	98.4	Very high	96.5	Very high	33 Å²	33	50.5 Å²	50.5	17%	0.173	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.2	174.8	-171.7	70.2	0	0	0	109.5	L76 L80 K81 V82 L181 G182	L76-L174 HydrophobicContact CD1-CD2 4.07Å; L76-L174 HydrophobicContact CD2-CD2 4.06Å; L80-L174 HydrophobicContact CD1-CD1 3.69Å; L80-L174 HydrophobicContact CD1-CD2 4.26Å; L80-L174 HydrophobicContact CD1-CG 3.96Å; L80-L174 HydrophobicContact CD2-CD1 3.99Å; L80-L174 HydrophobicContact CG-CD1 3.6Å; L80-L174 HydrophobicContact CG-CG 4.42Å; K81-L174 WeakPolarHBondContact O-CA 3.5Å; V82-L174 HydrophobicContact CG2-CD1 3.67Å; L174-L181 HydrophobicContact CD2-CB 4.25Å; L174-L181 HydrophobicContact CG-CB 4.28Å; L174-L181 PolarHBondContact O-N 3.1Å; L174-G182 PolarHBondContact N-O 3.42Å; L174-G182 PolarHBondContact O-N 2.9Å
175	S	98.4	Very high	97.1	Very high	7 Å²	7	51.7 Å²	51.7	5%	0.049	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	158.7	176	68.2	0	0	0	0	112.9	K81 K179	K81-S175 PolarHBondContact N-O 2.6Å; K81-S175 PolarHBondContact O-N 3.18Å; S175-K179 CarbonylContact C-O 3.54Å; S175-K179 WeakPolarHBondContact CA-O 3.43Å; S175-K179 VanDerWaalsContact CB-O 3.25Å; S175-K179 WeakPolarHBondContact CB-O 3.38Å
176	N	98.1	Very high	97.5	Very high	37 Å²	37	50.4 Å²	50.4	20%	0.198	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.9	170.3	177.6	-85.1	0	0	0	108.3	S77 P79 G178 K179 L181	S77-N176 PolarHBondContact O-ND2 3.14Å; P79-N176 PolarHBondContact O-ND2 2.82Å; N176-G178 PolarHBondContact O-N 2.77Å; N176-K179 PolarHBondContact N-O 2.84Å; N176-K179 WeakPolarHBondContact O-CB 3.5Å; N176-K179 PolarHBondContact O-N 3.46Å; N176-L181 HydrophobicContact CB-CD1 3.68Å; N176-L181 HydrophobicContact CB-CG 4.38Å
177	R	95.9	Very high	97.7	Very high	201 Å²	201	51.4 Å²	51.4	76%	0.758	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	42.6	179.3	-58.1	177.4	-174.6	-96.3	-3.4	113.4	P79 K179	P79-R177 HydrophobicContact CG-CG 4.04Å; R177-K179 VanDerWaalsContact C-N 3.26Å; R177-K179 PolarHBondContact O-N 3.22Å
178	G	95.1	Very high	97.7	Very high	76 Å²	76	51.7 Å²	51.7	78%	0.784	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-5.6	179.9	0	0	0	0	0	115.2	N176	N176-G178 PolarHBondContact O-N 2.77Å
179	K	97.2	Very high	97.7	Very high	142 Å²	142	51.2 Å²	51.2	62%	0.617	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.7	172.1	-174.3	179.4	178	-177	0	109.7	S175 N176 R177 L181	S175-K179 CarbonylContact C-O 3.54Å; S175-K179 WeakPolarHBondContact CA-O 3.43Å; S175-K179 VanDerWaalsContact CB-O 3.25Å; S175-K179 WeakPolarHBondContact CB-O 3.38Å; N176-K179 PolarHBondContact N-O 2.84Å; N176-K179 WeakPolarHBondContact O-CB 3.5Å; N176-K179 PolarHBondContact O-N 3.46Å; R177-K179 VanDerWaalsContact C-N 3.26Å; R177-K179 PolarHBondContact O-N 3.22Å; K179-L181 PolarHBondContact O-N 3.16Å
180	R	97.8	Very high	97.4	Very high	76 Å²	76	48 Å²	48	29%	0.287	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	132.6	172.2	-175.7	174.5	173	141.3	-26.9	110.3	D40 D44 I173 C183	D40-R180 IonicContact OD1-NH2 3.31Å; D40-R180 PolarHBondContact OD1-NH2 2.88Å; D40-R180 IonicContact OD2-CZ 3.2Å; D40-R180 IonicContact OD2-NE 2.67Å; D40-R180 PolarHBondContact OD2-NE 3.39Å; D40-R180 IonicContact OD2-NH2 2.65Å; D40-R180 PolarHBondContact OD2-NH2 2.97Å; D44-R180 IonicContact OD1-NE 2.92Å; D44-R180 IonicContact OD2-CZ 3.75Å; D44-R180 IonicContact OD2-NE 3.25Å; D44-R180 PolarHBondContact OD2-NE 3.35Å; D44-R180 IonicContact OD2-NH2 3.72Å; I173-R180 HydrophobicContact CG2-CG 4.35Å; R180-C183 PolarHBondContact NH2-SG 2.86Å; R180-C183 VanDerWaalsContact NH2-SG 3.36Å
181	L	98.4	Very high	97	Very high	9 Å²	9	50.1 Å²	50.1	5%	0.047	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	-28.3	-179.9	-65.6	179.8	0	0	0	112.2	P45 A46 V74 L76 L80 L174 N176 K179	P45-L181 WeakPolarHBondContact CD-O 3.31Å; P45-L181 HydrophobicContact CG-CB 4.48Å; P45-L181 HydrophobicContact CG-CD2 4.06Å; P45-L181 VanDerWaalsContact CG-O 3.32Å; P45-L181 WeakPolarHBondContact CG-O 3.48Å; A46-L181 WeakPolarHBondContact CA-O 3.27Å; A46-L181 VanDerWaalsContact CB-O 3.25Å; A46-L181 WeakPolarHBondContact CB-O 3.47Å; A46-L181 PolarHBondContact N-O 3.26Å; V74-L181 HydrophobicContact CG2-CD2 3.93Å; L76-L181 HydrophobicContact CD2-CB 4.49Å; L76-L181 HydrophobicContact CD2-CD1 3.9Å; L80-L181 HydrophobicContact CD1-CD1 3.93Å; L174-L181 HydrophobicContact CD2-CB 4.25Å; L174-L181 HydrophobicContact CG-CB 4.28Å; L174-L181 PolarHBondContact O-N 3.1Å; N176-L181 HydrophobicContact CB-CD1 3.68Å; N176-L181 HydrophobicContact CB-CG 4.38Å; K179-L181 PolarHBondContact O-N 3.16Å
182	G	98.3	Very high	96.2	Very high	5 Å²	5	49.7 Å²	49.7	5%	0.052	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	158.4	-178.9	0	0	0	0	0	111.7	D44 A46 L174	D44-G182 WeakPolarHBondContact OD2-CA 3.16Å; A46-G182 VanDerWaalsContact O-CA 3.29Å; A46-G182 WeakPolarHBondContact O-CA 3.41Å; L174-G182 PolarHBondContact N-O 3.42Å; L174-G182 PolarHBondContact O-N 2.9Å
183	C	98.3	Very high	94.7	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.034	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	134.2	172	-178.6	0	0	0	0	111.2	N38 C39 D44 S172 I173 R180	N38-C183 WeakPolarHBondContact CA-O 3.31Å; C39-C183 HydrophobicContact CB-CB 3.55Å; C39-C183 WeakPolarHBondContact CB-SG 3.27Å; C39-C183 PolarHBondContact N-O 2.82Å; C39-C183 VanDerWaalsContact N-O 3.08Å; C39-C183 WeakPolarHBondContact SG-CB 3.38Å; C39-C183 PolarHBondContact SG-O 2.88Å; C39-C183 CovalentContact SG-SG 2.03Å; C39-C183 PolarHBondContact SG-SG 2.94Å; D44-C183 PolarHBondContact OD2-N 2.88Å; S172-C183 VanDerWaalsContact O-CA 3.26Å; S172-C183 WeakPolarHBondContact O-CA 3.5Å; I173-C183 HydrophobicContact CG1-CB 4.43Å; R180-C183 PolarHBondContact NH2-SG 2.86Å; R180-C183 VanDerWaalsContact NH2-SG 3.36Å
184	I	98.2	Very high	94.5	Very high	27 Å²	27	56 Å²	56	14%	0.138	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	141.1	176.9	-177.3	164.6	0	0	0	110.9	W36 D37 C39 I48 L51 E171 S172 I186	W36-I184 HydrophobicContact CB-CD1 4.49Å; W36-I184 HydrophobicContact CE3-CD1 4.05Å; D37-I184 WeakPolarHBondContact O-CA 3.43Å; C39-I184 PolarHBondContact SG-N 3.35Å; I48-I184 HydrophobicContact CB-CD1 3.95Å; I48-I184 HydrophobicContact CG1-CD1 3.5Å; I48-I184 VanDerWaalsContact CG1-CD1 3.5Å; I48-I184 HydrophobicContact CG2-CD1 4.28Å; L51-I184 HydrophobicContact CD2-CD1 4.29Å; E171-I184 WeakPolarHBondContact CA-O 3.46Å; S172-I184 PolarHBondContact N-O 2.77Å; S172-I184 PolarHBondContact O-N 3.02Å; I184-I186 HydrophobicContact CD1-CD1 4.11Å; I184-I186 HydrophobicContact CD1-CG1 3.93Å; I184-I186 HydrophobicContact CG1-CD1 4.43Å; I184-I186 HydrophobicContact CG1-CG1 3.91Å
185	K	98.3	Very high	94.3	Very high	99 Å²	99	57.2 Å²	57.2	43%	0.43	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.5	166.6	-72	174.4	177.8	177.1	0	109.1	W36 D37 I170 E171	W36-K185 CarbonylContact C-O 3.59Å; W36-K185 WeakPolarHBondContact CA-O 3.45Å; W36-K185 WeakPolarHBondContact CB-O 3.49Å; D37-K185 PolarHBondContact N-O 3.5Å; D37-K185 PolarHBondContact O-N 2.79Å; I170-K185 CarbonylContact O-C 3.5Å; I170-K185 WeakPolarHBondContact O-CA 3.38Å; E171-K185 HydrophobicContact CB-CG 4.11Å; E171-K185 HydrophobicContact CG-CG 4.03Å; E171-K185 WeakPolarHBondContact OE1-CE 3.17Å; E171-K185 IonicContact OE1-NZ 3.73Å; E171-K185 WeakPolarHBondContact OE2-CE 3.35Å; E171-K185 IonicContact OE2-NZ 3.68Å
186	I	98.2	Very high	94	Very high	43 Å²	43	60 Å²	60	22%	0.221	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136	175.5	-56.9	172.6	0	0	0	107.7	F34 S35 W36 L51 R169 I170 I184	F34-I186 HydrophobicContact CD2-CG2 4.36Å; F34-I186 HydrophobicContact CE2-CG2 3.72Å; S35-I186 CarbonylContact O-C 3.26Å; S35-I186 WeakPolarHBondContact O-CA 3.4Å; W36-I186 HydrophobicContact CB-CG1 4.09Å; L51-I186 HydrophobicContact CD2-CD1 3.87Å; L51-I186 HydrophobicContact CD2-CG1 4.21Å; R169-I186 CarbonylContact C-O 3.58Å; R169-I186 WeakPolarHBondContact CA-O 3.45Å; I170-I186 HydrophobicContact CG2-CB 3.77Å; I170-I186 HydrophobicContact CG2-CD1 4.48Å; I170-I186 HydrophobicContact CG2-CG1 4.44Å; I170-I186 PolarHBondContact N-O 2.75Å; I170-I186 PolarHBondContact O-N 3.48Å; I184-I186 HydrophobicContact CD1-CD1 4.11Å; I184-I186 HydrophobicContact CD1-CG1 3.93Å; I184-I186 HydrophobicContact CG1-CD1 4.43Å; I184-I186 HydrophobicContact CG1-CG1 3.91Å
187	A	97.8	Very high	93.8	Very high	26 Å²	26	61.4 Å²	61.4	22%	0.215	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	134.1	166.4	0	0	0	0	0	109.3	F34 S35 Y168 R169	F34-A187 WeakPolarHBondContact CA-O 3.42Å; S35-A187 PolarHBondContact N-O 2.79Å; S35-A187 PolarHBondContact O-N 2.84Å; Y168-A187 CarbonylContact O-C 3.58Å; Y168-A187 VanDerWaalsContact O-CA 3.31Å; Y168-A187 WeakPolarHBondContact O-CA 3.25Å; R169-A187 HydrophobicContact CB-CB 4.23Å
188	A	96.6	Very high	93.7	Very high	18 Å²	18	52.6 Å²	52.6	15%	0.149	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	154.7	-178.4	0	0	0	0	0	110.8	F34 L53 I58 Y168	F34-A188 HydrophobicContact CD2-CB 4.28Å; L53-A188 HydrophobicContact CD2-CB 4.26Å; I58-A188 HydrophobicContact CD1-CB 4.26Å; Y168-A188 PolarHBondContact N-O 3.01Å; Y168-A188 PolarHBondContact O-N 2.8Å; Y168-A188 VanDerWaalsContact O-O 3.13Å
189	S	95.4	Very high	93.6	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.014	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.8	175.7	-69.3	0	0	0	0	110.5	G32 P57 I58 N167	G32-S189 PolarHBondContact N-OG 3.23Å; G32-S189 WeakPolarHBondContact O-CB 3.14Å; G32-S189 PolarHBondContact O-OG 2.93Å; P57-S189 WeakPolarHBondContact CA-O 3.41Å; I58-S189 PolarHBondContact N-O 2.69Å; N167-S189 PolarHBondContact OD1-OG 2.89Å
190	L	92.6	Very high	93.3	Very high	24 Å²	24	44.6 Å²	44.6	13%	0.126	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142.8	171.7	-58.6	178.9	0	0	0	109.6	I58 I60 L163 T165 G166 Y168	I58-L190 HydrophobicContact CB-CD2 3.78Å; I58-L190 HydrophobicContact CD1-CD2 4.02Å; I58-L190 HydrophobicContact CG1-CD2 4.47Å; I58-L190 HydrophobicContact CG2-CD2 3.98Å; I58-L190 CarbonylContact O-C 3.53Å; I60-L190 HydrophobicContact CD1-CD1 4.04Å; I60-L190 HydrophobicContact CD1-CD2 3.73Å; I60-L190 HydrophobicContact CD1-CG 4.33Å; I60-L190 HydrophobicContact CG1-CD2 4.39Å; L163-L190 HydrophobicContact CD1-CD1 3.63Å; L163-L190 HydrophobicContact CG-CD1 4.31Å; T165-L190 CarbonylContact C-O 3.55Å; T165-L190 VanDerWaalsContact CA-O 3.27Å; T165-L190 WeakPolarHBondContact CA-O 3.45Å; G166-L190 PolarHBondContact N-O 2.87Å; G166-L190 PolarHBondContact O-N 2.61Å; Y168-L190 HydrophobicContact CD2-CB 4.16Å; Y168-L190 HydrophobicContact CD2-CD1 3.64Å; Y168-L190 HydrophobicContact CD2-CG 3.69Å; Y168-L190 HydrophobicContact CE2-CB 3.85Å; Y168-L190 HydrophobicContact CE2-CD1 3.45Å; Y168-L190 VanDerWaalsContact CE2-CD1 3.45Å; Y168-L190 HydrophobicContact CE2-CG 3.75Å; Y168-L190 HydrophobicContact CG-CD1 4.28Å
191	K	89.9	Confident	93	Very high	97 Å²	97	42.2 Å²	42.2	42%	0.422	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	109.1	170	-175.9	175.6	-179.7	-178.5	0	109	P57 I58 L59 I60	P57-K191 HydrophobicContact CB-CB 4.15Å; P57-K191 HydrophobicContact CG-CB 3.96Å; P57-K191 HydrophobicContact CG-CD 4.25Å; I58-K191 PolarHBondContact O-N 3.1Å; L59-K191 HydrophobicContact CD2-CB 4.06Å; L59-K191 HydrophobicContact CD2-CD 4.09Å; L59-K191 HydrophobicContact CD2-CG 4.35Å; I60-K191 PolarHBondContact N-O 3.03Å
192	G	81.8	Confident	92.5	Very high	43 Å²	43	44.9 Å²	44.9	44%	0.443	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.7	167	0	0	0	0	0	109.2	I60 T165	I60-G192 WeakPolarHBondContact O-CA 3.3Å; T165-G192 PolarHBondContact OG1-N 2.87Å
193	V	64.8	Low	92	Very high	150 Å²	150	48.5 Å²	48.5	91%	0.909	28%	0.282	S	S	*	.			trans	-106.2	0	-178.9	-149.6	0	0	0	0	110.7	L59 I60	L59-V193 HydrophobicContact CB-CG2 4.05Å; L59-V193 HydrophobicContact CD2-CG2 4.21Å; I60-V193 PolarHBondContact O-N 3.24Å; I60-V193 VanDerWaalsContact O-N 3.1Å

Retrieved 193 of 193 residues in 69.7 ms (Link to these results)

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