A0A087XQS0_POEFO Loading...

Protein archease

Component of the tRNA-splicing ligase complex required to facilitate the enzymatic turnover of catalytic subunit RTCB. Together with DDX1, acts by facilitating the guanylylation of RTCB, a key intermediate step in tRNA ligation.

AlphaFold DB , UniProt , Accession A0A087XQS0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 172 aa.

Structure Viewer

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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	F	36.1	Very low	38.7	Very low	268 Å²	268	165.6 Å²	165.6	100%	1.175	84%	0.841	S	S	*	*				0	86.6	0	-98.1	-100.5	0	0	0	108.6
2	L	33.4	Very low	39.9	Very low	182 Å²	182	159.7 Å²	159.7	95%	0.953	81%	0.812	S	S	*	*			trans	-135.9	99	172.7	-88.4	159.9	0	0	0	107.3
3	R	32.3	Very low	41.2	Very low	229 Å²	229	153.6 Å²	153.6	86%	0.864	78%	0.783	S	S	*	*			trans	-111.7	145.5	158.3	-84.2	-170.7	-176.1	-164	5.5	103.8
4	L	38	Very low	42.5	Very low	142 Å²	142	153.1 Å²	153.1	74%	0.743	77%	0.767	S	S	*	*			cis	-167.5	143	7.3	-107.7	158.2	0	0	0	104.8
5	N	44	Very low	43.7	Very low	138 Å²	138	155.9 Å²	155.9	74%	0.738	78%	0.776	S	S	*	*			trans	-51.3	139.2	167.2	-69.2	-22	0	0	0	112.4
6	Q	35.1	Very low	45.4	Very low	200 Å²	200	154.1 Å²	154.1	94%	0.935	77%	0.77	S	S	*	*			trans	-124	102.1	143.1	-78.2	-171.9	-10.6	0	0	108.3
7	L	35.4	Very low	47.2	Very low	150 Å²	150	154.3 Å²	154.3	79%	0.785	77%	0.774	S	S	*	*			trans	-84.7	167.6	164.9	-89.5	169	0	0	0	109
8	P	37.4	Very low	48.8	Very low	107 Å²	107	147.8 Å²	147.8	70%	0.695	74%	0.742	S	S	*	*			trans	-79.5	162.5	-137.4	35	-36.2	0	0	0	114.3	S10	P8-S10 PolarHBondContact O-N 3.12Å
9	V	43.4	Very low	51	Low	128 Å²	128	144.2 Å²	144.2	78%	0.776	73%	0.728	S	S	*	*			trans	-71.2	104.8	167.8	-178.9	0	0	0	0	108.3	M11	V9-M11 HydrophobicContact CG1-CG 3.93Å; V9-M11 HydrophobicContact CG1-SD 4.37Å
10	S	40.9	Very low	52.8	Low	103 Å²	103	143.8 Å²	143.8	72%	0.72	72%	0.723	S	S	*	*			trans	-106.7	103	159.6	64.1	0	0	0	0	108.2	P8	P8-S10 PolarHBondContact O-N 3.12Å
11	M	49.8	Very low	54.6	Low	175 Å²	175	144.4 Å²	144.4	86%	0.862	72%	0.724	S	S	*	*			trans	-88.5	104.6	172	-80.2	173.8	163.9	0	0	108.6	V9	V9-M11 HydrophobicContact CG1-CG 3.93Å; V9-M11 HydrophobicContact CG1-SD 4.37Å
12	D	53.5	Low	56.8	Low	94 Å²	94	136 Å²	136	50%	0.503	69%	0.689	S	S	.	*			trans	-136.2	75.6	152.9	-172	28.3	0	0	0	108.7
13	D	55.7	Low	59.3	Low	81 Å²	81	131.8 Å²	131.8	43%	0.433	66%	0.662	S	S	.	*			trans	-88.9	111	169.5	-89.6	4.9	0	0	0	107.4	E15 K34	D13-E15 PolarHBondContact O-N 2.71Å; D13-K34 WeakPolarHBondContact OD1-CD 3.46Å; D13-K34 WeakPolarHBondContact OD1-CE 3.31Å; D13-K34 IonicContact OD1-NZ 3.83Å; D13-K34 PolarHBondContact OD1-NZ 2.89Å; D13-K34 WeakPolarHBondContact OD2-CD 3.26Å; D13-K34 IonicContact OD2-NZ 3.62Å; D13-K34 PolarHBondContact OD2-NZ 2.94Å
14	R	59.9	Low	62.1	Low	146 Å²	146	123.5 Å²	123.5	55%	0.551	64%	0.643	S	S	*	*			trans	-48.7	111	162.8	-73.2	-175	-156.7	177.3	4.1	108.3	L16 Y38	R14-L16 PolarHBondContact O-N 3.12Å; R14-Y38 HydrophobicContact CG-CD2 4.32Å; R14-Y38 HydrophobicContact CG-CE2 3.58Å; R14-Y38 PolarHBondContact NE-OH 2.92Å; R14-Y38 VanDerWaalsContact NE-OH 3.14Å; R14-Y38 VanDerWaalsContact NH2-CZ 3.34Å
15	E	61	Low	64.4	Low	195 Å²	195	121.8 Å²	121.8	91%	0.911	63%	0.633	S	S	*	*			trans	-75.9	102.9	172	-70.1	-167.6	161.2	0	0	107.5	D13	D13-E15 PolarHBondContact O-N 2.71Å
16	L	70	Confident	66.3	Low	128 Å²	128	122.1 Å²	122.1	67%	0.67	63%	0.628	S	S	*	*			trans	-85.9	139.9	172.6	-60.8	174.7	0	0	0	108.8	R14 L18	R14-L16 PolarHBondContact O-N 3.12Å; L16-L18 HydrophobicContact CB-CD2 4.1Å; L16-L18 PolarHBondContact O-N 2.99Å
17	D	76.2	Confident	68.7	Low	157 Å²	157	117 Å²	117	84%	0.84	62%	0.615	S	S	*	*			trans	-76.2	115	171.7	-164.5	8.6	0	0	0	109.5
18	L	76.3	Confident	71.5	Confident	38 Å²	38	117.1 Å²	117.1	20%	0.199	61%	0.609	C	S	.	*			trans	-110.4	134.2	-172.8	-61	-178.8	0	0	0	109.4	L16 Q22 K23 K26	L16-L18 HydrophobicContact CB-CD2 4.1Å; L16-L18 PolarHBondContact O-N 2.99Å; L18-Q22 HydrophobicContact CB-CB 3.95Å; L18-Q22 HydrophobicContact CD2-CB 4.25Å; L18-K23 HydrophobicContact CB-CG 3.93Å; L18-K23 WeakPolarHBondContact O-CE 3.49Å; L18-K26 HydrophobicContact CD1-CD 3.7Å
19	T	91.1	Very high	74	Confident	79 Å²	79	118.7 Å²	118.7	49%	0.485	60%	0.602	S	S	.	*			trans	-60.2	159.8	165.6	62.6	0	0	0	0	111.3	E21 Q22 K23	T19-E21 PolarHBondContact O-N 3.09Å; T19-Q22 WeakPolarHBondContact O-CB 3.42Å; T19-Q22 PolarHBondContact O-N 2.97Å; T19-Q22 WeakPolarHBondContact OG1-CB 3.49Å; T19-Q22 VanDerWaalsContact OG1-CG 3.23Å; T19-Q22 WeakPolarHBondContact OG1-CG 3.25Å; T19-Q22 PolarHBondContact OG1-N 2.91Å; T19-Q22 PolarHBondContact OG1-OE1 3.37Å; T19-K23 PolarHBondContact O-N 3.47Å
20	E	87.2	Confident	76.3	Confident	135 Å²	135	118 Å²	118	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-60.5	-34	-179.9	-66.7	-54.9	118.6	0	0	112.9	K23 A24	E20-K23 PolarHBondContact O-N 2.8Å; E20-K23 IonicContact OE1-NZ 2.71Å; E20-K23 PolarHBondContact OE1-NZ 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.33Å; E20-A24 PolarHBondContact O-N 3.13Å
21	E	89.7	Confident	78.5	Confident	158 Å²	158	119 Å²	119	74%	0.738	61%	0.605	S	S	*	*	H	α-helix	trans	-65.7	-41.6	173.5	-63.8	-179.6	178.5	0	0	111.4	T19 A24 I25	T19-E21 PolarHBondContact O-N 3.09Å; E21-A24 PolarHBondContact O-N 2.66Å; E21-I25 WeakPolarHBondContact O-CD1 3.32Å; E21-I25 VanDerWaalsContact O-CG1 3.25Å; E21-I25 WeakPolarHBondContact O-CG1 3.33Å; E21-I25 PolarHBondContact O-N 2.75Å
22	Q	82.5	Confident	80.3	Confident	92 Å²	92	117.7 Å²	117.7	43%	0.43	60%	0.599	S	S	.	*	H	α-helix	trans	-67.3	-34.5	175.9	-72.4	163.6	-31.6	0	0	112.3	L18 T19 I25 K26	L18-Q22 HydrophobicContact CB-CB 3.95Å; L18-Q22 HydrophobicContact CD2-CB 4.25Å; T19-Q22 WeakPolarHBondContact O-CB 3.42Å; T19-Q22 PolarHBondContact O-N 2.97Å; T19-Q22 WeakPolarHBondContact OG1-CB 3.49Å; T19-Q22 VanDerWaalsContact OG1-CG 3.23Å; T19-Q22 WeakPolarHBondContact OG1-CG 3.25Å; T19-Q22 PolarHBondContact OG1-N 2.91Å; T19-Q22 PolarHBondContact OG1-OE1 3.37Å; Q22-I25 PolarHBondContact O-N 3.37Å; Q22-K26 WeakPolarHBondContact O-CB 3.29Å; Q22-K26 PolarHBondContact O-N 2.85Å
23	K	86.4	Confident	82	Confident	92 Å²	92	119.2 Å²	119.2	40%	0.4	61%	0.608	S	S	.	*	H	α-helix	trans	-67.9	-43.1	172.7	-69	175.1	-171.8	157.6	0	111.9	L18 T19 E20 I25 K26 S27	L18-K23 HydrophobicContact CB-CG 3.93Å; L18-K23 WeakPolarHBondContact O-CE 3.49Å; T19-K23 PolarHBondContact O-N 3.47Å; E20-K23 PolarHBondContact O-N 2.8Å; E20-K23 IonicContact OE1-NZ 2.71Å; E20-K23 PolarHBondContact OE1-NZ 3.3Å; K23-I25 VanDerWaalsContact C-N 3.27Å; K23-I25 PolarHBondContact O-N 3.3Å; K23-K26 PolarHBondContact O-N 2.93Å; K23-S27 WeakPolarHBondContact O-CB 3.3Å; K23-S27 PolarHBondContact O-N 3.22Å; K23-S27 PolarHBondContact O-OG 3.04Å
24	A	89.9	Confident	83.3	Confident	55 Å²	55	118.6 Å²	118.6	46%	0.455	60%	0.601	S	S	.	*	H	α-helix	trans	-61.4	-37.6	175.7	0	0	0	0	0	111.6	E20 E21 S27 K28	E20-A24 WeakPolarHBondContact O-CB 3.33Å; E20-A24 PolarHBondContact O-N 3.13Å; E21-A24 PolarHBondContact O-N 2.66Å; A24-S27 PolarHBondContact O-OG 3.44Å; A24-K28 VanDerWaalsContact O-CB 3.28Å; A24-K28 WeakPolarHBondContact O-CB 3.19Å; A24-K28 PolarHBondContact O-N 3.44Å
25	I	86.7	Confident	84.3	Confident	106 Å²	106	120.2 Å²	120.2	54%	0.544	61%	0.612	S	S	.	*	H	α-helix	trans	-67.2	-46.3	172.7	-68.3	164	0	0	0	110.9	E21 Q22 K23 S27 K28 Y29	E21-I25 WeakPolarHBondContact O-CD1 3.32Å; E21-I25 VanDerWaalsContact O-CG1 3.25Å; E21-I25 WeakPolarHBondContact O-CG1 3.33Å; E21-I25 PolarHBondContact O-N 2.75Å; Q22-I25 PolarHBondContact O-N 3.37Å; K23-I25 VanDerWaalsContact C-N 3.27Å; K23-I25 PolarHBondContact O-N 3.3Å; I25-S27 VanDerWaalsContact C-N 3.27Å; I25-S27 PolarHBondContact O-N 3.35Å; I25-K28 PolarHBondContact O-N 2.73Å; I25-Y29 WeakPolarHBondContact O-CD2 3.3Å
26	K	84.3	Confident	85.3	Confident	145 Å²	145	116.5 Å²	116.5	63%	0.63	59%	0.59	S	S	*	*	H	α-helix	trans	-61.6	-33.6	179.2	-171	175.6	178.2	-176.9	0	112.4	L18 Q22 K23	L18-K26 HydrophobicContact CD1-CD 3.7Å; Q22-K26 WeakPolarHBondContact O-CB 3.29Å; Q22-K26 PolarHBondContact O-N 2.85Å; K23-K26 PolarHBondContact O-N 2.93Å
27	S	86.1	Confident	85	Confident	94 Å²	94	117.2 Å²	117.2	66%	0.657	59%	0.59	S	S	*	*	H	α-helix	trans	-86.8	-22.5	-179.8	67.4	0	0	0	0	114.3	K23 A24 I25 Y29	K23-S27 WeakPolarHBondContact O-CB 3.3Å; K23-S27 PolarHBondContact O-N 3.22Å; K23-S27 PolarHBondContact O-OG 3.04Å; A24-S27 PolarHBondContact O-OG 3.44Å; I25-S27 VanDerWaalsContact C-N 3.27Å; I25-S27 PolarHBondContact O-N 3.35Å; S27-Y29 PolarHBondContact O-N 2.77Å
28	K	94.2	Very high	84.5	Confident	152 Å²	152	114.5 Å²	114.5	66%	0.661	57%	0.569	S	S	*	*	H	α-helix	trans	-62.8	-20.7	176	-177.1	175.7	178.4	-178.4	0	113.1	A24 I25	A24-K28 VanDerWaalsContact O-CB 3.28Å; A24-K28 WeakPolarHBondContact O-CB 3.19Å; A24-K28 PolarHBondContact O-N 3.44Å; I25-K28 PolarHBondContact O-N 2.73Å
29	Y	89.9	Confident	83.7	Confident	139 Å²	139	119.2 Å²	119.2	55%	0.545	59%	0.594	S	S	.	*	S	Bend	trans	-123.7	157.9	-177.1	-58.1	-73.9	0	0	0	112.2	I25 S27	I25-Y29 WeakPolarHBondContact O-CD2 3.3Å; S27-Y29 PolarHBondContact O-N 2.77Å
30	P	91.4	Very high	81.6	Confident	114 Å²	114	123.8 Å²	123.8	74%	0.74	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-60	144.8	173.7	-22.6	33.8	0	0	0	112.4
31	P	87.3	Confident	80.1	Confident	125 Å²	125	125.6 Å²	125.6	81%	0.812	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-65.3	147.5	179.1	27.7	-34.6	0	0	0	111.7
32	I	87.1	Confident	78.7	Confident	147 Å²	147	123.3 Å²	123.3	75%	0.754	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-79.7	135	176.4	-59.3	173.7	0	0	0	108.9	K34	I32-K34 PolarHBondContact O-N 2.97Å
33	N	89.8	Confident	78	Confident	126 Å²	126	120.4 Å²	120.4	67%	0.674	61%	0.612	S	S	*	*			trans	-76.7	105.6	170.8	-172.4	10.7	0	0	0	109.6	K35	N33-K35 WeakPolarHBondContact ND2-CE 3.32Å
34	K	82.8	Confident	78	Confident	67 Å²	67	119.7 Å²	119.7	29%	0.291	61%	0.612	S	S	.	*			trans	-89.7	129.2	-178.8	-66.5	170.5	172.1	-179.7	0	110.7	D13 I32 Y36	D13-K34 WeakPolarHBondContact OD1-CD 3.46Å; D13-K34 WeakPolarHBondContact OD1-CE 3.31Å; D13-K34 IonicContact OD1-NZ 3.83Å; D13-K34 PolarHBondContact OD1-NZ 2.89Å; D13-K34 WeakPolarHBondContact OD2-CD 3.26Å; D13-K34 IonicContact OD2-NZ 3.62Å; D13-K34 PolarHBondContact OD2-NZ 2.94Å; I32-K34 PolarHBondContact O-N 2.97Å; K34-Y36 HydrophobicContact CB-CD1 4.43Å; K34-Y36 HydrophobicContact CB-CE1 3.91Å; K34-Y36 HydrophobicContact CD-CE1 4.34Å; K34-Y36 WeakPolarHBondContact CD-OH 3.27Å; K34-Y36 VanDerWaalsContact CE-OH 3.31Å; K34-Y36 WeakPolarHBondContact CE-OH 3.32Å; K34-Y36 HydrophobicContact CG-CE1 3.77Å
35	K	81.7	Confident	78.1	Confident	181 Å²	181	118.6 Å²	118.6	79%	0.787	60%	0.6	S	S	*	*			trans	-139.8	51.4	-179.6	-63.4	-174.2	179.6	-176.5	0	110	N33	N33-K35 WeakPolarHBondContact ND2-CE 3.32Å
36	Y	80	Confident	78.5	Confident	116 Å²	116	118.6 Å²	118.6	46%	0.455	60%	0.598	S	S	.	*			trans	-138	157.3	176.4	56.2	-104.3	0	0	0	108.1	K34 Y38	K34-Y36 HydrophobicContact CB-CD1 4.43Å; K34-Y36 HydrophobicContact CB-CE1 3.91Å; K34-Y36 HydrophobicContact CD-CE1 4.34Å; K34-Y36 WeakPolarHBondContact CD-OH 3.27Å; K34-Y36 VanDerWaalsContact CE-OH 3.31Å; K34-Y36 WeakPolarHBondContact CE-OH 3.32Å; K34-Y36 HydrophobicContact CG-CE1 3.77Å; Y36-Y38 HydrophobicContact CE2-CE2 4.22Å; Y36-Y38 AromaticContact CE2-CZ 3.98Å
37	E	63.8	Low	79.1	Confident	143 Å²	143	112.4 Å²	112.4	67%	0.668	57%	0.571	S	S	*	*			trans	-132.7	156	170.6	66.1	-168.7	149.3	0	0	107.7	L39	E37-L39 HydrophobicContact CG-CD2 3.92Å; E37-L39 HydrophobicContact CG-CG 4.22Å
38	Y	65.7	Low	79.7	Confident	101 Å²	101	111.8 Å²	111.8	40%	0.396	56%	0.558	S	S	.	*			trans	-83.2	131.1	175.3	-63.3	-70.7	0	0	0	109.4	R14 Y36	R14-Y38 HydrophobicContact CG-CD2 4.32Å; R14-Y38 HydrophobicContact CG-CE2 3.58Å; R14-Y38 PolarHBondContact NE-OH 2.92Å; R14-Y38 VanDerWaalsContact NE-OH 3.14Å; R14-Y38 VanDerWaalsContact NH2-CZ 3.34Å; Y36-Y38 HydrophobicContact CE2-CE2 4.22Å; Y36-Y38 AromaticContact CE2-CZ 3.98Å
39	L	60.7	Low	79.9	Confident	136 Å²	136	104.7 Å²	104.7	71%	0.712	53%	0.528	S	S	*	.			trans	-124.9	143.9	178.6	-57.9	176.7	0	0	0	107.4	E37	E37-L39 HydrophobicContact CG-CD2 3.92Å; E37-L39 HydrophobicContact CG-CG 4.22Å
40	D	45.8	Very low	80.3	Confident	175 Å²	175	105.7 Å²	105.7	94%	0.936	53%	0.53	S	S	*	.			trans	-70.7	150.4	-168.7	-66.4	-30.8	0	0	0	113.6
41	H	56	Low	80.5	Confident	173 Å²	173	100.5 Å²	100.5	80%	0.801	50%	0.498	S	S	*	.			trans	-123.4	130.2	-178.7	177.6	49.2	0	0	0	109.4	A43	H41-A43 PolarHBondContact O-N 3.05Å
42	T	59.9	Low	80.9	Confident	111 Å²	111	100.9 Å²	100.9	68%	0.681	49%	0.493	S	S	*	.			trans	-74.7	113.5	176.8	49.9	0	0	0	0	110.6
43	A	69.6	Low	81.3	Confident	30 Å²	30	95.9 Å²	95.9	25%	0.248	47%	0.471	C	S	.	.			trans	-106.3	62	175.3	0	0	0	0	0	109.3	H41 D171 I172	H41-A43 PolarHBondContact O-N 3.05Å; A43-D171 CarbonylContact O-C 3.51Å; A43-D171 WeakPolarHBondContact O-CA 3.33Å; A43-I172 HydrophobicContact CB-CG1 4.31Å; A43-I172 WeakPolarHBondContact CB-O 3.32Å; A43-I172 WeakPolarHBondContact O-CG1 3.16Å; A43-I172 PolarHBondContact O-N 3.16Å
44	D	84.9	Confident	81.7	Confident	77 Å²	77	90.4 Å²	90.4	41%	0.412	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.6	-172.4	-51.1	-22.6	0	0	0	112.1	I169 I170	D44-I169 HydrophobicContact CB-CG2 3.7Å; D44-I170 CarbonylContact C-O 3.58Å; D44-I170 VanDerWaalsContact CA-O 3.23Å; D44-I170 WeakPolarHBondContact CA-O 3.3Å
45	V	91.8	Very high	82.4	Confident	32 Å²	32	90 Å²	90	19%	0.194	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	138	172.6	157.1	0	0	0	0	110.4	Y68 I169 I170 I172	V45-Y68 HydrophobicContact CG1-CD2 4.47Å; V45-Y68 HydrophobicContact CG1-CE2 4.24Å; V45-Y68 HydrophobicContact CG2-CE1 4.12Å; V45-Y68 HydrophobicContact CG2-CE2 4.17Å; V45-Y68 WeakPolarHBondContact CG2-OH 3.12Å; V45-I169 CarbonylContact O-C 3.55Å; V45-I169 VanDerWaalsContact O-CA 3.31Å; V45-I169 WeakPolarHBondContact O-CA 3.25Å; V45-I170 HydrophobicContact CB-CD1 4.47Å; V45-I170 HydrophobicContact CB-CG1 4.04Å; V45-I170 HydrophobicContact CG1-CD1 4.39Å; V45-I170 HydrophobicContact CG1-CG1 4.23Å; V45-I170 PolarHBondContact N-O 3.23Å; V45-I170 WeakPolarHBondContact O-CG1 3.41Å; V45-I170 PolarHBondContact O-N 3.14Å; V45-I172 HydrophobicContact CG2-CD1 3.87Å
46	Q	95.8	Very high	83.2	Confident	107 Å²	107	84.3 Å²	84.3	50%	0.5	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.7	171.6	-171.7	172.5	64.4	0	0	110.8	A168 I169	Q46-A168 CarbonylContact C-O 3.59Å; Q46-A168 WeakPolarHBondContact CA-O 3.28Å; Q46-I169 HydrophobicContact CB-CG1 3.98Å; Q46-I169 HydrophobicContact CG-CG1 4.02Å
47	I	97.1	Very high	84.1	Confident	15 Å²	15	78.8 Å²	78.8	8%	0.077	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.5	168.6	-61.2	168.7	0	0	0	108.2	M65 F167 A168 I170	I47-M65 HydrophobicContact CD1-CB 3.83Å; I47-F167 CarbonylContact O-C 3.59Å; I47-F167 VanDerWaalsContact O-CA 3.32Å; I47-F167 WeakPolarHBondContact O-CA 3.38Å; I47-A168 PolarHBondContact N-O 3.01Å; I47-A168 PolarHBondContact O-N 2.7Å; I47-I170 HydrophobicContact CD1-CD1 3.86Å; I47-I170 HydrophobicContact CD1-CG1 4.2Å; I47-I170 HydrophobicContact CD1-CG2 4.02Å; I47-I170 HydrophobicContact CG1-CD1 4.36Å; I47-I170 HydrophobicContact CG1-CG1 4.47Å
48	H	98.1	Very high	85.7	Confident	80 Å²	80	72 Å²	72	37%	0.37	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.6	167.3	173	-146.4	0	0	0	108.5	W50 E165 I166 F167	H48-W50 AromaticContact CE1-CE3 3.94Å; H48-W50 AromaticContact ND1-CZ3 4Å; H48-E165 IonicContact CE1-OE2 2.68Å; H48-E165 IonicContact NE2-OE2 3.65Å; H48-E165 PolarHBondContact NE2-OE2 3.35Å; H48-I166 WeakPolarHBondContact CA-O 3.31Å; H48-I166 PolarHBondContact CD2-O 3.35Å; H48-F167 HydrophobicContact CB-CD1 3.94Å; H48-F167 HydrophobicContact CB-CE1 3.91Å; H48-F167 AromaticContact CD2-CD1 3.8Å; H48-F167 AromaticContact CD2-CE1 3.29Å; H48-F167 WeakPolarHBondContact CD2-CE1 3.47Å; H48-F167 AromaticContact CD2-CE2 3.85Å; H48-F167 AromaticContact CD2-CZ 3.32Å; H48-F167 WeakPolarHBondContact CD2-CZ 2.79Å; H48-F167 AromaticContact CE1-CZ 3.95Å; H48-F167 AromaticContact CG-CD1 3.96Å; H48-F167 AromaticContact CG-CE1 3.47Å; H48-F167 VanDerWaalsContact CG-CE1 3.47Å; H48-F167 AromaticContact CG-CZ 3.94Å; H48-F167 AromaticContact ND1-CE1 3.97Å; H48-F167 AromaticContact NE2-CE1 3.7Å; H48-F167 AromaticContact NE2-CE2 3.97Å; H48-F167 AromaticContact NE2-CZ 3.33Å; H48-F167 VanDerWaalsContact NE2-CZ 3.33Å; H48-F167 WeakPolarHBondContact NE2-CZ 3.47Å
49	S	98.1	Very high	87.3	Confident	4 Å²	4	67.4 Å²	67.4	3%	0.028	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	159.6	178.1	68.4	0	0	0	0	111.4	A57 C61 E165 I166	S49-A57 PolarHBondContact OG-O 2.92Å; S49-C61 VanDerWaalsContact OG-CB 3.32Å; S49-C61 WeakPolarHBondContact OG-CB 3.48Å; S49-C61 PolarHBondContact OG-N 2.88Å; S49-E165 CarbonylContact O-C 3.55Å; S49-E165 VanDerWaalsContact O-CA 3.31Å; S49-E165 WeakPolarHBondContact O-CA 3.3Å; S49-I166 PolarHBondContact N-O 3.3Å; S49-I166 PolarHBondContact O-N 3.42Å
50	W	98.3	Very high	89.1	Confident	159 Å²	159	64.9 Å²	64.9	60%	0.602	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-153	165.1	-178.9	60.2	84.2	0	0	0	111.1	H48 P164 E165	H48-W50 AromaticContact CE1-CE3 3.94Å; H48-W50 AromaticContact ND1-CZ3 4Å; W50-P164 VanDerWaalsContact CA-O 3.25Å; W50-P164 WeakPolarHBondContact CA-O 3.4Å; W50-E165 HydrophobicContact CB-CG 3.99Å
51	G	95.8	Very high	91.6	Very high	6 Å²	6	56.6 Å²	56.6	6%	0.062	29%	0.286	C	S	.	.			trans	-161.9	174.5	176	0	0	0	0	0	113.2	E56 P164	G51-E56 WeakPolarHBondContact CA-OE2 3.36Å; G51-P164 PolarHBondContact N-O 3.39Å; G51-P164 VanDerWaalsContact N-O 3.12Å; G51-P164 WeakPolarHBondContact O-CD 3.47Å
52	D	95.8	Very high	93.6	Very high	132 Å²	132	48.3 Å²	48.3	71%	0.706	25%	0.248	S	C	*	.	S	Bend	trans	-76.6	-15.2	168.1	-70.8	-25.6	0	0	0	111.4	E56	D52-E56 WeakPolarHBondContact CB-OE2 3.31Å; D52-E56 PolarHBondContact N-OE2 3.29Å
53	S	97	Very high	95.4	Very high	43 Å²	43	44.1 Å²	44.1	30%	0.301	22%	0.221	S	C	.	.	S	Bend	trans	-137.7	168.2	169.8	90.4	0	0	0	0	112.2	E55 E56 A57	S53-E55 VanDerWaalsContact C-N 3.3Å; S53-E55 VanDerWaalsContact CB-OE2 3.26Å; S53-E55 WeakPolarHBondContact CB-OE2 3.3Å; S53-E55 PolarHBondContact OG-N 3.3Å; S53-E55 PolarHBondContact OG-OE2 2.84Å; S53-E56 PolarHBondContact O-N 3.11Å; S53-E56 PolarHBondContact OG-N 3.47Å; S53-A57 PolarHBondContact O-N 3.33Å
54	L	96.8	Very high	96.8	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.052	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-37.9	178.2	-174.4	62.9	0	0	0	110.7	E56 A57 F58 M90 I121 I158 D160 P164	L54-E56 VanDerWaalsContact C-N 3.31Å; L54-E56 PolarHBondContact O-N 3.18Å; L54-A57 PolarHBondContact O-N 2.77Å; L54-F58 HydrophobicContact CD1-CD2 4.02Å; L54-F58 HydrophobicContact CD1-CE2 3.78Å; L54-F58 HydrophobicContact CD2-CE2 4.49Å; L54-F58 HydrophobicContact CG-CD2 4.03Å; L54-F58 HydrophobicContact CG-CE2 3.93Å; L54-F58 VanDerWaalsContact O-CD2 3.27Å; L54-F58 WeakPolarHBondContact O-CD2 3.28Å; L54-F58 PolarHBondContact O-N 3.39Å; L54-M90 HydrophobicContact CD2-CE 3.82Å; L54-I121 HydrophobicContact CD2-CD1 4.44Å; L54-I121 HydrophobicContact CG-CD1 4.15Å; L54-I158 HydrophobicContact CD1-CG2 3.92Å; L54-D160 HydrophobicContact CD1-CB 4.41Å; L54-P164 HydrophobicContact CB-CB 4.39Å; L54-P164 HydrophobicContact CB-CG 4.38Å; L54-P164 HydrophobicContact CD1-CB 4.07Å
55	E	98.2	Very high	97.4	Very high	60 Å²	60	40.6 Å²	40.6	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-55.8	-45.9	172.8	-62.8	80.7	-178.6	0	0	111.4	S53 F58 E59 V118 I121	S53-E55 VanDerWaalsContact C-N 3.3Å; S53-E55 VanDerWaalsContact CB-OE2 3.26Å; S53-E55 WeakPolarHBondContact CB-OE2 3.3Å; S53-E55 PolarHBondContact OG-N 3.3Å; S53-E55 PolarHBondContact OG-OE2 2.84Å; E55-F58 PolarHBondContact O-N 3.42Å; E55-E59 PolarHBondContact O-N 2.75Å; E55-V118 HydrophobicContact CB-CB 3.87Å; E55-V118 HydrophobicContact CB-CG1 3.67Å; E55-V118 HydrophobicContact CG-CB 4.45Å; E55-V118 HydrophobicContact CG-CG1 3.72Å; E55-I121 HydrophobicContact CB-CD1 4.47Å; E55-I121 HydrophobicContact CG-CD1 4Å; E55-I121 HydrophobicContact CG-CG1 4.08Å
56	E	98.1	Very high	97.7	Very high	60 Å²	60	39 Å²	39	28%	0.28	20%	0.196	S	C	.	.	H	α-helix	trans	-66.6	-40.4	177.4	-174.8	175.5	-154.5	0	0	111.7	G51 D52 S53 L54 F58 E59 Q60	G51-E56 WeakPolarHBondContact CA-OE2 3.36Å; D52-E56 WeakPolarHBondContact CB-OE2 3.31Å; D52-E56 PolarHBondContact N-OE2 3.29Å; S53-E56 PolarHBondContact O-N 3.11Å; S53-E56 PolarHBondContact OG-N 3.47Å; L54-E56 VanDerWaalsContact C-N 3.31Å; L54-E56 PolarHBondContact O-N 3.18Å; E56-F58 VanDerWaalsContact C-N 3.31Å; E56-F58 PolarHBondContact O-N 3.01Å; E56-E59 WeakPolarHBondContact O-CG 3.41Å; E56-E59 PolarHBondContact O-N 3.06Å; E56-Q60 HydrophobicContact CG-CG 4.17Å; E56-Q60 VanDerWaalsContact O-CB 3.3Å; E56-Q60 WeakPolarHBondContact O-CB 3.44Å; E56-Q60 WeakPolarHBondContact O-CG 3.31Å; E56-Q60 PolarHBondContact O-N 2.91Å
57	A	98.3	Very high	97.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-39.3	175	0	0	0	0	0	112.5	S49 S53 L54 C61 P164 I166	S49-A57 PolarHBondContact OG-O 2.92Å; S53-A57 PolarHBondContact O-N 3.33Å; L54-A57 PolarHBondContact O-N 2.77Å; A57-C61 PolarHBondContact O-N 2.75Å; A57-P164 HydrophobicContact CB-CB 4.05Å; A57-I166 HydrophobicContact CB-CD1 3.95Å; A57-I166 HydrophobicContact CB-CG1 4.13Å
58	F	98.5	Very high	97.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-52.1	174.5	-90.4	-115.6	0	0	0	111.3	L54 E55 E56 Q60 C61 A62 M90 L93 L94 F97 V118 I121 I128 I158 I166	L54-F58 HydrophobicContact CD1-CD2 4.02Å; L54-F58 HydrophobicContact CD1-CE2 3.78Å; L54-F58 HydrophobicContact CD2-CE2 4.49Å; L54-F58 HydrophobicContact CG-CD2 4.03Å; L54-F58 HydrophobicContact CG-CE2 3.93Å; L54-F58 VanDerWaalsContact O-CD2 3.27Å; L54-F58 WeakPolarHBondContact O-CD2 3.28Å; L54-F58 PolarHBondContact O-N 3.39Å; E55-F58 PolarHBondContact O-N 3.42Å; E56-F58 VanDerWaalsContact C-N 3.31Å; E56-F58 PolarHBondContact O-N 3.01Å; F58-Q60 VanDerWaalsContact C-N 3.3Å; F58-Q60 PolarHBondContact O-N 3.04Å; F58-C61 VanDerWaalsContact O-CB 3.3Å; F58-C61 WeakPolarHBondContact O-CB 3.38Å; F58-C61 PolarHBondContact O-N 2.85Å; F58-A62 PolarHBondContact O-N 3.39Å; F58-M90 HydrophobicContact CE2-CE 3.9Å; F58-M90 HydrophobicContact CZ-CE 3.57Å; F58-L93 HydrophobicContact CE1-CG 4.35Å; F58-L94 HydrophobicContact CD1-CD1 3.84Å; F58-L94 HydrophobicContact CE1-CB 3.7Å; F58-L94 HydrophobicContact CE1-CD1 3.83Å; F58-L94 HydrophobicContact CE1-CG 4.38Å; F58-L94 HydrophobicContact CG-CD1 4.3Å; F58-L94 HydrophobicContact CZ-CB 3.82Å; F58-L94 HydrophobicContact CZ-CD1 4.23Å; F58-F97 HydrophobicContact CB-CE1 4.22Å; F58-F97 AromaticContact CD1-CD1 3.95Å; F58-F97 HydrophobicContact CD1-CD1 3.95Å; F58-F97 HydrophobicContact CD1-CE1 4.38Å; F58-F97 HydrophobicContact CD1-CG 4.28Å; F58-F97 VanDerWaalsContact O-CE1 3.28Å; F58-F97 WeakPolarHBondContact O-CE1 3.45Å; F58-V118 HydrophobicContact CB-CG2 4.08Å; F58-I121 HydrophobicContact CB-CD1 4.44Å; F58-I121 HydrophobicContact CD1-CD1 4.38Å; F58-I121 HydrophobicContact CD2-CD1 3.98Å; F58-I121 HydrophobicContact CE2-CD1 4.36Å; F58-I121 HydrophobicContact CG-CD1 4.02Å; F58-I128 HydrophobicContact CB-CD1 4.27Å; F58-I128 HydrophobicContact CD1-CD1 3.47Å; F58-I128 VanDerWaalsContact CD1-CD1 3.47Å; F58-I128 HydrophobicContact CE1-CD1 4.13Å; F58-I128 HydrophobicContact CG-CD1 4.12Å; F58-I158 HydrophobicContact CE2-CD1 4.32Å; F58-I158 HydrophobicContact CZ-CD1 4.06Å; F58-I166 HydrophobicContact CD2-CD1 3.28Å; F58-I166 HydrophobicContact CE2-CD1 3.52Å; F58-I166 HydrophobicContact CG-CD1 4Å; F58-I166 HydrophobicContact CZ-CD1 4.43Å
59	E	98.2	Very high	97.4	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-39.2	-178.1	88.1	-162.1	-178.3	0	0	111.4	E55 E56 C61 A62 M63 I116 K117 V118	E55-E59 PolarHBondContact O-N 2.75Å; E56-E59 WeakPolarHBondContact O-CG 3.41Å; E56-E59 PolarHBondContact O-N 3.06Å; E59-C61 VanDerWaalsContact C-N 3.31Å; E59-C61 PolarHBondContact O-N 2.88Å; E59-A62 PolarHBondContact O-N 3.47Å; E59-M63 WeakPolarHBondContact O-CG 3.31Å; E59-M63 PolarHBondContact O-N 3.03Å; E59-I116 HydrophobicContact CB-CG2 4.29Å; E59-I116 WeakPolarHBondContact CB-O 3.14Å; E59-I116 WeakPolarHBondContact CG-O 3.44Å; E59-K117 VanDerWaalsContact CD-NZ 3.28Å; E59-K117 IonicContact OE1-NZ 3.65Å; E59-K117 PolarHBondContact OE1-NZ 2.91Å; E59-K117 VanDerWaalsContact OE2-CA 3.31Å; E59-K117 WeakPolarHBondContact OE2-CA 3.41Å; E59-K117 VanDerWaalsContact OE2-CD 3.3Å; E59-K117 WeakPolarHBondContact OE2-CD 3.3Å; E59-K117 VanDerWaalsContact OE2-CE 3.28Å; E59-K117 WeakPolarHBondContact OE2-CE 3.38Å; E59-K117 IonicContact OE2-NZ 2.99Å; E59-K117 PolarHBondContact OE2-NZ 3.41Å; E59-V118 HydrophobicContact CB-CB 4.31Å; E59-V118 HydrophobicContact CB-CG2 3.75Å; E59-V118 PolarHBondContact OE2-N 3.38Å
60	Q	98.6	Very high	97.3	Very high	83 Å²	83	35.9 Å²	35.9	39%	0.388	19%	0.189	S	C	.	.	H	α-helix	trans	-66.9	-29.5	174	-68	-58.5	-41.7	0	0	112.9	E56 F58 M63 G64	E56-Q60 HydrophobicContact CG-CG 4.17Å; E56-Q60 VanDerWaalsContact O-CB 3.3Å; E56-Q60 WeakPolarHBondContact O-CB 3.44Å; E56-Q60 WeakPolarHBondContact O-CG 3.31Å; E56-Q60 PolarHBondContact O-N 2.91Å; F58-Q60 VanDerWaalsContact C-N 3.3Å; F58-Q60 PolarHBondContact O-N 3.04Å; Q60-M63 PolarHBondContact O-N 2.87Å; Q60-G64 PolarHBondContact O-N 2.79Å
61	C	98.4	Very high	97.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-44.4	174.3	-162.8	0	0	0	0	111	S49 A57 F58 E59 G64 M65 L94 L98 I166	S49-C61 VanDerWaalsContact OG-CB 3.32Å; S49-C61 WeakPolarHBondContact OG-CB 3.48Å; S49-C61 PolarHBondContact OG-N 2.88Å; A57-C61 PolarHBondContact O-N 2.75Å; F58-C61 VanDerWaalsContact O-CB 3.3Å; F58-C61 WeakPolarHBondContact O-CB 3.38Å; F58-C61 PolarHBondContact O-N 2.85Å; E59-C61 VanDerWaalsContact C-N 3.31Å; E59-C61 PolarHBondContact O-N 2.88Å; C61-G64 PolarHBondContact O-N 3.45Å; C61-M65 PolarHBondContact O-N 2.84Å; C61-M65 VanDerWaalsContact O-N 3.11Å; C61-L94 HydrophobicContact CB-CD1 4.43Å; C61-L98 HydrophobicContact CB-CD2 4.23Å; C61-I166 HydrophobicContact CB-CG2 4.45Å
62	A	98.4	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.3	-41.1	174.8	0	0	0	0	0	111.7	F58 E59 G64 M65 F66 F97 L98 I116	F58-A62 PolarHBondContact O-N 3.39Å; E59-A62 PolarHBondContact O-N 3.47Å; A62-G64 VanDerWaalsContact C-N 3.29Å; A62-G64 PolarHBondContact O-N 2.89Å; A62-M65 WeakPolarHBondContact O-CB 3.46Å; A62-M65 PolarHBondContact O-N 3.13Å; A62-F66 VanDerWaalsContact O-CD2 3.3Å; A62-F66 WeakPolarHBondContact O-CD2 3.41Å; A62-F66 PolarHBondContact O-N 3.02Å; A62-F97 HydrophobicContact CB-CE1 3.65Å; A62-F97 HydrophobicContact CB-CZ 3.87Å; A62-L98 HydrophobicContact CB-CD2 3.88Å; A62-I116 HydrophobicContact CB-CD1 3.48Å; A62-I116 VanDerWaalsContact CB-CD1 3.48Å
63	M	98.5	Very high	97	Very high	23 Å²	23	33.7 Å²	33.7	11%	0.113	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-37	173.3	-70.3	-50.3	-55.9	0	0	112.3	E59 Q60 M65 F66 G67 T72 R114 I116	E59-M63 WeakPolarHBondContact O-CG 3.31Å; E59-M63 PolarHBondContact O-N 3.03Å; Q60-M63 PolarHBondContact O-N 2.87Å; M63-M65 VanDerWaalsContact C-N 3.35Å; M63-F66 PolarHBondContact O-N 3.22Å; M63-G67 PolarHBondContact O-N 2.94Å; M63-T72 HydrophobicContact CE-CG2 3.99Å; M63-R114 WeakPolarHBondContact CE-O 3.49Å; M63-I116 HydrophobicContact CG-CB 4.49Å; M63-I116 HydrophobicContact SD-CB 4.04Å; M63-I116 HydrophobicContact SD-CD1 4.09Å; M63-I116 HydrophobicContact SD-CG1 3.85Å; M63-I116 PolarHBondContact SD-N 3.04Å; M63-I116 VanDerWaalsContact SD-N 3.36Å
64	G	97.6	Very high	96.9	Very high	32 Å²	32	34 Å²	34	33%	0.33	19%	0.185	S	C	.	.	H	α-helix	trans	-62.5	-39.6	173.8	0	0	0	0	0	113	Q60 C61 A62 Y68	Q60-G64 PolarHBondContact O-N 2.79Å; C61-G64 PolarHBondContact O-N 3.45Å; A62-G64 VanDerWaalsContact C-N 3.29Å; A62-G64 PolarHBondContact O-N 2.89Å; G64-Y68 PolarHBondContact O-N 2.79Å
65	M	97.8	Very high	96.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-50.9	174	177.9	-175.4	71.7	0	0	111.5	I47 C61 A62 M63 G67 Y68 M69 W101 L102 V148 I151	I47-M65 HydrophobicContact CD1-CB 3.83Å; C61-M65 PolarHBondContact O-N 2.84Å; C61-M65 VanDerWaalsContact O-N 3.11Å; A62-M65 WeakPolarHBondContact O-CB 3.46Å; A62-M65 PolarHBondContact O-N 3.13Å; M63-M65 VanDerWaalsContact C-N 3.35Å; M65-G67 PolarHBondContact O-N 2.73Å; M65-Y68 WeakPolarHBondContact O-CB 3.24Å; M65-Y68 PolarHBondContact O-N 3.07Å; M65-Y68 VanDerWaalsContact O-N 3.14Å; M65-M69 HydrophobicContact CG-CE 3.94Å; M65-M69 PolarHBondContact O-N 3.23Å; M65-M69 HydrophobicContact SD-CE 4.38Å; M65-W101 HydrophobicContact CE-CB 4.13Å; M65-L102 HydrophobicContact CE-CB 4.11Å; M65-L102 HydrophobicContact SD-CB 4.13Å; M65-L102 HydrophobicContact SD-CD1 4.43Å; M65-V148 HydrophobicContact CG-CG1 4.41Å; M65-V148 HydrophobicContact CG-CG2 4.27Å; M65-I151 HydrophobicContact SD-CD1 3.58Å; M65-I151 VanDerWaalsContact SD-CD1 3.58Å
66	F	97.8	Very high	96.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-66.9	-36.1	179.2	-77.7	-65.8	0	0	0	113.3	A62 M63 Y68 M69 T70 T72 W101 F105 V112 P113 I116	A62-F66 VanDerWaalsContact O-CD2 3.3Å; A62-F66 WeakPolarHBondContact O-CD2 3.41Å; A62-F66 PolarHBondContact O-N 3.02Å; M63-F66 PolarHBondContact O-N 3.22Å; F66-Y68 PolarHBondContact O-N 3.1Å; F66-M69 HydrophobicContact CD1-SD 3.68Å; F66-M69 HydrophobicContact CE1-SD 3.99Å; F66-M69 WeakPolarHBondContact O-CB 3.36Å; F66-M69 PolarHBondContact O-N 3.27Å; F66-T70 PolarHBondContact O-N 2.69Å; F66-T72 HydrophobicContact CB-CG2 3.99Å; F66-W101 HydrophobicContact CE2-CB 3.97Å; F66-W101 HydrophobicContact CE2-CD2 4.46Å; F66-W101 HydrophobicContact CE2-CE3 4.19Å; F66-W101 HydrophobicContact CE2-CG 4.4Å; F66-W101 HydrophobicContact CZ-CB 4.27Å; F66-W101 HydrophobicContact CZ-CE3 4.42Å; F66-F105 HydrophobicContact CE1-CB 3.77Å; F66-F105 HydrophobicContact CE1-CD2 4.37Å; F66-F105 HydrophobicContact CE1-CG 4.14Å; F66-F105 HydrophobicContact CZ-CB 4.31Å; F66-V112 HydrophobicContact CD1-CG2 4.25Å; F66-P113 HydrophobicContact CD1-CG 4.31Å; F66-P113 HydrophobicContact CD2-CG 3.37Å; F66-P113 HydrophobicContact CE1-CG 4.36Å; F66-P113 HydrophobicContact CE2-CG 3.42Å; F66-P113 VanDerWaalsContact CE2-CG 3.42Å; F66-P113 HydrophobicContact CG-CG 3.84Å; F66-P113 HydrophobicContact CZ-CG 3.93Å; F66-I116 HydrophobicContact CD2-CD1 3.94Å; F66-I116 HydrophobicContact CE2-CD1 3.89Å
67	G	96.4	Very high	96.8	Very high	43 Å²	43	36.3 Å²	36.3	44%	0.443	20%	0.202	S	C	.	.	H	α-helix	trans	-61.9	-22.3	173.3	0	0	0	0	0	113.4	M63 M65 T70	M63-G67 PolarHBondContact O-N 2.94Å; M65-G67 PolarHBondContact O-N 2.73Å; G67-T70 CarbonylContact C-O 3.52Å; G67-T70 WeakPolarHBondContact CA-O 3.23Å
68	Y	95.2	Very high	96.7	Very high	85 Å²	85	40.4 Å²	40.4	33%	0.333	23%	0.227	S	C	.	.	H	α-helix	trans	-79.1	-31	173.2	-153.7	-101.9	0	0	0	112.5	V45 G64 M65 F66 T146 I172	V45-Y68 HydrophobicContact CG1-CD2 4.47Å; V45-Y68 HydrophobicContact CG1-CE2 4.24Å; V45-Y68 HydrophobicContact CG2-CE1 4.12Å; V45-Y68 HydrophobicContact CG2-CE2 4.17Å; V45-Y68 WeakPolarHBondContact CG2-OH 3.12Å; G64-Y68 PolarHBondContact O-N 2.79Å; M65-Y68 WeakPolarHBondContact O-CB 3.24Å; M65-Y68 PolarHBondContact O-N 3.07Å; M65-Y68 VanDerWaalsContact O-N 3.14Å; F66-Y68 PolarHBondContact O-N 3.1Å; Y68-T146 HydrophobicContact CE1-CG2 4.01Å; Y68-T146 PolarHBondContact O-N 3.18Å; Y68-I172 HydrophobicContact CD1-CG2 4.05Å; Y68-I172 HydrophobicContact CE1-CD1 3.97Å; Y68-I172 HydrophobicContact CE1-CG2 3.83Å
69	M	94.9	Very high	96.6	Very high	7 Å²	7	44.7 Å²	44.7	3%	0.034	25%	0.25	C	C	.	.	H	α-helix	trans	-77.8	-36.9	177.5	-60.6	171.8	-177.3	0	0	112.9	M65 F66 L102 F105 G145 T146 V148	M65-M69 HydrophobicContact CG-CE 3.94Å; M65-M69 PolarHBondContact O-N 3.23Å; M65-M69 HydrophobicContact SD-CE 4.38Å; F66-M69 HydrophobicContact CD1-SD 3.68Å; F66-M69 HydrophobicContact CE1-SD 3.99Å; F66-M69 WeakPolarHBondContact O-CB 3.36Å; F66-M69 PolarHBondContact O-N 3.27Å; M69-L102 HydrophobicContact CE-CD1 3.21Å; M69-F105 HydrophobicContact CE-CD1 4.18Å; M69-F105 HydrophobicContact SD-CD1 3.75Å; M69-F105 HydrophobicContact SD-CE1 3.79Å; M69-F105 HydrophobicContact SD-CG 4.16Å; M69-F105 HydrophobicContact SD-CZ 4.2Å; M69-G145 WeakPolarHBondContact O-CA 3.29Å; M69-G145 PolarHBondContact O-N 2.7Å; M69-T146 WeakPolarHBondContact CA-O 3.46Å; M69-V148 HydrophobicContact CE-CB 3.5Å; M69-V148 HydrophobicContact CE-CG1 4.44Å; M69-V148 HydrophobicContact CE-CG2 3.61Å; M69-V148 HydrophobicContact CG-CG2 3.8Å
70	T	94.4	Very high	96.6	Very high	4 Å²	4	48.7 Å²	48.7	3%	0.025	28%	0.275	C	S	.	.	S	Bend	trans	-162.4	167	-179.4	-165.2	0	0	0	0	112	F66 G67 T72 V112 F137 H142 P143	F66-T70 PolarHBondContact O-N 2.69Å; G67-T70 CarbonylContact C-O 3.52Å; G67-T70 WeakPolarHBondContact CA-O 3.23Å; T70-T72 PolarHBondContact O-N 3.14Å; T70-T72 VanDerWaalsContact O-N 3.14Å; T70-V112 HydrophobicContact CG2-CG2 3.76Å; T70-F137 HydrophobicContact CG2-CD2 4.41Å; T70-F137 HydrophobicContact CG2-CE2 4.15Å; T70-H142 WeakPolarHBondContact OG1-CB 3.47Å; T70-P143 VanDerWaalsContact CB-O 3.29Å; T70-P143 WeakPolarHBondContact CB-O 3.48Å; T70-P143 PolarHBondContact OG1-O 3.33Å
71	D	94.6	Very high	96.6	Very high	80 Å²	80	45.4 Å²	45.4	43%	0.428	26%	0.261	S	S	.	.			trans	-74.6	100.4	170.4	-175.3	-9.1	0	0	0	109.8	E73 T74 P143	D71-E73 PolarHBondContact O-N 3.49Å; D71-E73 WeakPolarHBondContact OD1-CB 3.26Å; D71-E73 PolarHBondContact OD1-N 3.3Å; D71-E73 VanDerWaalsContact OD1-N 3.07Å; D71-T74 HydrophobicContact CB-CG2 4.04Å; D71-T74 WeakPolarHBondContact O-CB 3.39Å; D71-T74 PolarHBondContact O-N 2.82Å; D71-T74 PolarHBondContact O-OG1 3.02Å; D71-P143 HydrophobicContact CB-CG 4.18Å
72	T	94.1	Very high	96.6	Very high	24 Å²	24	50 Å²	50	15%	0.147	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-64.6	-17.6	-177.1	55.3	0	0	0	0	113	M63 F66 T70 T74 V75	M63-T72 HydrophobicContact CE-CG2 3.99Å; F66-T72 HydrophobicContact CB-CG2 3.99Å; T70-T72 PolarHBondContact O-N 3.14Å; T70-T72 VanDerWaalsContact O-N 3.14Å; T72-T74 PolarHBondContact O-N 3.39Å; T72-V75 WeakPolarHBondContact O-CB 3.32Å; T72-V75 PolarHBondContact O-N 2.98Å
73	E	95.4	Very high	96.6	Very high	148 Å²	148	50.3 Å²	50.3	69%	0.692	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.1	173.5	-63.5	-168.9	170.5	0	0	112.8	D71 V75 R114	D71-E73 PolarHBondContact O-N 3.49Å; D71-E73 WeakPolarHBondContact OD1-CB 3.26Å; D71-E73 PolarHBondContact OD1-N 3.3Å; D71-E73 VanDerWaalsContact OD1-N 3.07Å; E73-V75 VanDerWaalsContact C-N 3.35Å; E73-R114 VanDerWaalsContact C-NH1 3.33Å; E73-R114 PolarHBondContact O-NH1 2.86Å
74	T	94.5	Very high	96.6	Very high	49 Å²	49	55.7 Å²	55.7	30%	0.301	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-83.3	-11.7	175	68.8	0	0	0	0	113.7	D71 T72 P143	D71-T74 HydrophobicContact CB-CG2 4.04Å; D71-T74 WeakPolarHBondContact O-CB 3.39Å; D71-T74 PolarHBondContact O-N 2.82Å; D71-T74 PolarHBondContact O-OG1 3.02Å; T72-T74 PolarHBondContact O-N 3.39Å; T74-P143 HydrophobicContact CG2-CG 4.31Å
75	V	96.9	Very high	96.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.			trans	-83.7	130	-177.2	180	0	0	0	0	110.1	T72 E73 V112 R114 E135	T72-V75 WeakPolarHBondContact O-CB 3.32Å; T72-V75 PolarHBondContact O-N 2.98Å; E73-V75 VanDerWaalsContact C-N 3.35Å; V75-V112 HydrophobicContact CG1-CG1 3.99Å; V75-V112 VanDerWaalsContact CG1-O 3.28Å; V75-V112 WeakPolarHBondContact CG1-O 3.37Å; V75-V112 HydrophobicContact CG2-CB 4.46Å; V75-V112 HydrophobicContact CG2-CG1 3.74Å; V75-V112 HydrophobicContact CG2-CG2 3.92Å; V75-R114 HydrophobicContact CB-CB 4.03Å; V75-R114 HydrophobicContact CG1-CB 3.99Å; V75-R114 VanDerWaalsContact O-CD 3.29Å; V75-R114 WeakPolarHBondContact O-CD 3.18Å; V75-R114 PolarHBondContact O-NH1 3.48Å; V75-E135 HydrophobicContact CG1-CG 3.92Å
76	E	97	Very high	96.7	Very high	98 Å²	98	60.2 Å²	60.2	46%	0.458	32%	0.322	S	S	.	.			trans	-86.1	138.3	174.9	-62.8	175.4	-138.1	0	0	110.9	T78 G134 E135 K141	E76-T78 VanDerWaalsContact C-N 3.26Å; E76-T78 HydrophobicContact CB-CG2 3.98Å; E76-T78 PolarHBondContact O-N 3Å; E76-G134 CarbonylContact O-C 3.49Å; E76-G134 VanDerWaalsContact O-CA 3.29Å; E76-G134 WeakPolarHBondContact O-CA 3.29Å; E76-E135 VanDerWaalsContact CB-OE1 3.29Å; E76-E135 WeakPolarHBondContact CB-OE1 3.24Å; E76-E135 PolarHBondContact N-OE1 3.22Å; E76-K141 IonicContact OE1-NZ 3.79Å; E76-K141 PolarHBondContact OE1-NZ 2.75Å
77	P	96.8	Very high	96.7	Very high	81 Å²	81	61 Å²	61	53%	0.526	33%	0.331	S	S	.	.			trans	-84.1	63.4	179.6	34.9	-34.7	0	0	0	111.2	W133	P77-W133 HydrophobicContact CB-CB 3.82Å
78	T	97.2	Very high	96.7	Very high	85 Å²	85	67.5 Å²	67.5	52%	0.521	35%	0.35	S	S	.	.			trans	-89	-31	-175.9	54.2	0	0	0	0	113.8	E76 G134 E135	E76-T78 VanDerWaalsContact C-N 3.26Å; E76-T78 HydrophobicContact CB-CG2 3.98Å; E76-T78 PolarHBondContact O-N 3Å; T78-G134 PolarHBondContact N-O 3.36Å; T78-G134 VanDerWaalsContact N-O 3.15Å; T78-G134 PolarHBondContact OG1-O 3.42Å; T78-E135 WeakPolarHBondContact OG1-CB 3.42Å
79	D	96.7	Very high	96.8	Very high	90 Å²	90	67 Å²	67	48%	0.481	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	162.5	178.9	-65.7	-54.3	0	0	0	111	F111 W133 G134	D79-F111 HydrophobicContact CB-CE2 4.15Å; D79-W133 WeakPolarHBondContact O-CA 3.39Å; D79-G134 WeakPolarHBondContact CA-O 3.35Å; D79-G134 PolarHBondContact N-O 2.76Å; D79-G134 PolarHBondContact O-N 3.15Å
80	T	97.9	Very high	96.9	Very high	90 Å²	90	68.3 Å²	68.3	55%	0.552	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.5	178.5	-54.6	0	0	0	0	109.4	I131 G132	T80-I131 HydrophobicContact CG2-CG2 3.38Å; T80-G132 WeakPolarHBondContact CA-O 3.26Å
81	V	97.9	Very high	97.1	Very high	15 Å²	15	72.2 Å²	72.2	9%	0.091	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.4	177.6	176.4	0	0	0	0	108.8	V83 W101 K104 L109 F111 I131 G132	V81-V83 HydrophobicContact CG1-CG2 4.17Å; V81-W101 HydrophobicContact CB-CH2 4.49Å; V81-W101 HydrophobicContact CB-CZ3 4.47Å; V81-W101 HydrophobicContact CG1-CZ3 4.38Å; V81-K104 HydrophobicContact CG1-CD 4.07Å; V81-K104 HydrophobicContact CG1-CG 4.17Å; V81-L109 HydrophobicContact CG2-CD1 3.84Å; V81-F111 HydrophobicContact CB-CD1 4.18Å; V81-F111 HydrophobicContact CB-CE1 3.95Å; V81-F111 HydrophobicContact CB-CE2 4.48Å; V81-F111 HydrophobicContact CB-CZ 4.1Å; V81-F111 HydrophobicContact CG2-CB 4.49Å; V81-F111 HydrophobicContact CG2-CD1 3.91Å; V81-F111 HydrophobicContact CG2-CD2 3.68Å; V81-F111 HydrophobicContact CG2-CE1 3.94Å; V81-F111 HydrophobicContact CG2-CE2 3.72Å; V81-F111 HydrophobicContact CG2-CG 3.77Å; V81-F111 HydrophobicContact CG2-CZ 3.84Å; V81-I131 CarbonylContact O-C 3.59Å; V81-I131 WeakPolarHBondContact O-CA 3.45Å; V81-G132 PolarHBondContact N-O 3.11Å; V81-G132 PolarHBondContact O-N 3.41Å
82	E	98.2	Very high	97.3	Very high	97 Å²	97	69 Å²	69	45%	0.453	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.8	172	-175.4	162.6	-159.5	0	0	109.3	R129 S130 I131	E82-R129 HydrophobicContact CG-CG 4.43Å; E82-R129 WeakPolarHBondContact OE1-CD 3.4Å; E82-R129 WeakPolarHBondContact OE1-CG 3.34Å; E82-R129 IonicContact OE1-CZ 2.92Å; E82-R129 IonicContact OE1-NE 3.02Å; E82-R129 IonicContact OE1-NH1 3.01Å; E82-R129 PolarHBondContact OE1-NH1 3.41Å; E82-S130 WeakPolarHBondContact CA-O 3.34Å; E82-I131 HydrophobicContact CB-CG1 4.46Å; E82-I131 HydrophobicContact CG-CG1 4.24Å
83	V	98.3	Very high	97.5	Very high	6 Å²	6	67.8 Å²	67.8	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.1	177.8	176.4	0	0	0	0	108.4	V81 D100 W101 K104 S130	V81-V83 HydrophobicContact CG1-CG2 4.17Å; V83-D100 HydrophobicContact CG1-CB 3.6Å; V83-W101 HydrophobicContact CB-CD2 4.41Å; V83-W101 HydrophobicContact CB-CH2 4.5Å; V83-W101 HydrophobicContact CB-CZ2 3.93Å; V83-W101 HydrophobicContact CG2-CD2 3.88Å; V83-W101 HydrophobicContact CG2-CE3 4.01Å; V83-W101 HydrophobicContact CG2-CH2 3.81Å; V83-W101 HydrophobicContact CG2-CZ2 3.71Å; V83-W101 HydrophobicContact CG2-CZ3 3.97Å; V83-K104 HydrophobicContact CG2-CG 3.98Å; V83-S130 PolarHBondContact N-O 3.43Å; V83-S130 PolarHBondContact O-N 3.14Å; V83-S130 PolarHBondContact O-OG 2.92Å
84	E	98.6	Very high	97.6	Very high	135 Å²	135	60.8 Å²	60.8	63%	0.631	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.4	172.8	-71.5	-173.7	175.2	0	0	109	I128 R129	E84-I128 WeakPolarHBondContact CA-O 3.41Å; E84-R129 HydrophobicContact CG-CB 4.12Å; E84-R129 HydrophobicContact CG-CG 3.74Å; E84-R129 WeakPolarHBondContact OE1-CD 3.16Å
85	S	98.6	Very high	97.8	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.063	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.2	-180	-44.6	0	0	0	0	110.3	D100 K127 I128	S85-D100 VanDerWaalsContact CB-OD2 3.24Å; S85-D100 WeakPolarHBondContact CB-OD2 3.33Å; S85-D100 PolarHBondContact OG-OD2 2.81Å; S85-K127 WeakPolarHBondContact O-CA 3.35Å; S85-I128 PolarHBondContact N-O 2.8Å; S85-I128 PolarHBondContact O-N 3.15Å
86	E	98.4	Very high	97.9	Very high	118 Å²	118	63.5 Å²	63.5	55%	0.551	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.6	149.5	175.4	60.6	-177	-165	0	0	111.2	H96 F126 K127	E86-H96 PolarHBondContact O-ND1 2.85Å; E86-F126 CarbonylContact C-O 3.56Å; E86-F126 VanDerWaalsContact CA-O 3.3Å; E86-F126 WeakPolarHBondContact CA-O 3.37Å; E86-K127 HydrophobicContact CB-CG 4.23Å; E86-K127 WeakPolarHBondContact OE2-CE 3.45Å; E86-K127 IonicContact OE2-NZ 2.7Å; E86-K127 PolarHBondContact OE2-NZ 2.79Å
87	G	97.9	Very high	98	Very high	17 Å²	17	58.8 Å²	58.8	18%	0.175	31%	0.307	C	S	.	.			trans	-134	178.4	178.9	0	0	0	0	0	111.9	F126	G87-F126 PolarHBondContact N-O 3.46Å; G87-F126 WeakPolarHBondContact O-CB 3.45Å
88	E	97.3	Very high	98.1	Very high	180 Å²	180	55 Å²	55	84%	0.841	28%	0.282	S	S	*	.	S	Bend	trans	-97.6	-18.5	173.1	-61.4	-173.8	173.3	0	0	111.8	S92 F126	E88-S92 PolarHBondContact N-OG 3.02Å; E88-F126 VanDerWaalsContact O-CD2 3.26Å; E88-F126 WeakPolarHBondContact O-CD2 3.41Å; E88-F126 VanDerWaalsContact O-CE2 3.23Å; E88-F126 WeakPolarHBondContact O-CE2 3.33Å
89	D	97.5	Very high	98.1	Very high	74 Å²	74	53.9 Å²	53.9	40%	0.396	27%	0.273	S	S	.	.	S	Bend	trans	-153.6	-173.8	174.9	59.4	28.7	0	0	0	110	E91 S92 L93 F126	D89-E91 PolarHBondContact OD1-N 3.14Å; D89-E91 VanDerWaalsContact OD1-N 3.13Å; D89-S92 PolarHBondContact N-OG 3.46Å; D89-S92 PolarHBondContact O-OG 2.79Å; D89-S92 VanDerWaalsContact O-OG 3.1Å; D89-S92 WeakPolarHBondContact OD1-CB 3.06Å; D89-S92 PolarHBondContact OD1-N 3.17Å; D89-S92 PolarHBondContact OD1-OG 3.43Å; D89-L93 VanDerWaalsContact O-CB 3.24Å; D89-L93 WeakPolarHBondContact O-CB 3.35Å; D89-L93 PolarHBondContact O-N 3.03Å; D89-F126 VanDerWaalsContact C-CD1 3.42Å
90	M	97.4	Very high	98.2	Very high	35 Å²	35	52.1 Å²	52.1	17%	0.172	26%	0.264	C	S	.	.	H	α-helix	trans	-70.2	-32.8	-178.8	-69	-57.5	-44.7	0	0	113.6	L54 F58 L93 L94 I121 F126 I158	L54-M90 HydrophobicContact CD2-CE 3.82Å; F58-M90 HydrophobicContact CE2-CE 3.9Å; F58-M90 HydrophobicContact CZ-CE 3.57Å; M90-L93 HydrophobicContact CE-CD2 4.09Å; M90-L93 HydrophobicContact SD-CD2 4.4Å; M90-L94 PolarHBondContact O-N 2.86Å; M90-I121 HydrophobicContact CE-CG2 4.29Å; M90-F126 HydrophobicContact CG-CD1 4.28Å; M90-F126 HydrophobicContact CG-CE1 4.03Å; M90-F126 HydrophobicContact SD-CD1 3.85Å; M90-F126 HydrophobicContact SD-CE1 4.02Å; M90-I158 VanDerWaalsContact C-CD1 3.48Å; M90-I158 HydrophobicContact CB-CD1 3.81Å; M90-I158 WeakPolarHBondContact O-CD1 3.25Å
91	E	97.8	Very high	98.2	Very high	86 Å²	86	47.9 Å²	47.9	40%	0.402	24%	0.238	S	C	.	.	H	α-helix	trans	-72.9	-46	-178.5	-70.8	179.8	-175.9	0	0	110.3	D89 L93 L94 F95 M156 I158	D89-E91 PolarHBondContact OD1-N 3.14Å; D89-E91 VanDerWaalsContact OD1-N 3.13Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.25Å; E91-L94 PolarHBondContact O-N 3.02Å; E91-F95 PolarHBondContact O-N 3.03Å; E91-M156 HydrophobicContact CB-SD 3.89Å; E91-M156 HydrophobicContact CG-CG 4.48Å; E91-M156 HydrophobicContact CG-SD 4.36Å; E91-M156 VanDerWaalsContact O-SD 3.32Å; E91-I158 HydrophobicContact CG-CD1 4.35Å
92	S	98.1	Very high	98.2	Very high	11 Å²	11	47.4 Å²	47.4	8%	0.077	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-35	172.7	55.6	0	0	0	0	112.8	E88 D89 F95 H96 Y153	E88-S92 PolarHBondContact N-OG 3.02Å; D89-S92 PolarHBondContact N-OG 3.46Å; D89-S92 PolarHBondContact O-OG 2.79Å; D89-S92 VanDerWaalsContact O-OG 3.1Å; D89-S92 WeakPolarHBondContact OD1-CB 3.06Å; D89-S92 PolarHBondContact OD1-N 3.17Å; D89-S92 PolarHBondContact OD1-OG 3.43Å; S92-F95 PolarHBondContact O-N 2.99Å; S92-H96 PolarHBondContact O-N 3.28Å; S92-H96 PolarHBondContact O-ND1 3.2Å; S92-Y153 WeakPolarHBondContact CA-OH 3.23Å
93	L	98.6	Very high	98.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-43.8	172.4	-177.1	60.2	0	0	0	111.9	F58 D89 M90 E91 F97 I121 F126 I128	F58-L93 HydrophobicContact CE1-CG 4.35Å; D89-L93 VanDerWaalsContact O-CB 3.24Å; D89-L93 WeakPolarHBondContact O-CB 3.35Å; D89-L93 PolarHBondContact O-N 3.03Å; M90-L93 HydrophobicContact CE-CD2 4.09Å; M90-L93 HydrophobicContact SD-CD2 4.4Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.25Å; L93-F97 WeakPolarHBondContact O-CB 3.33Å; L93-F97 PolarHBondContact O-N 3.41Å; L93-I121 HydrophobicContact CD2-CG2 4.1Å; L93-F126 WeakPolarHBondContact CD1-O 3.45Å; L93-F126 HydrophobicContact CD2-CB 4.46Å; L93-I128 HydrophobicContact CD1-CB 3.94Å; L93-I128 HydrophobicContact CD1-CG2 3.53Å; L93-I128 HydrophobicContact CD2-CB 4.34Å; L93-I128 HydrophobicContact CG-CB 4.3Å; L93-I128 HydrophobicContact CG-CG2 4.17Å
94	L	98.6	Very high	98.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-43.6	175.4	175.6	65	0	0	0	111.6	F58 C61 M90 E91 F97 L98 M156 I158 I166	F58-L94 HydrophobicContact CD1-CD1 3.84Å; F58-L94 HydrophobicContact CE1-CB 3.7Å; F58-L94 HydrophobicContact CE1-CD1 3.83Å; F58-L94 HydrophobicContact CE1-CG 4.38Å; F58-L94 HydrophobicContact CG-CD1 4.3Å; F58-L94 HydrophobicContact CZ-CB 3.82Å; F58-L94 HydrophobicContact CZ-CD1 4.23Å; C61-L94 HydrophobicContact CB-CD1 4.43Å; M90-L94 PolarHBondContact O-N 2.86Å; E91-L94 PolarHBondContact O-N 3.02Å; L94-F97 HydrophobicContact CD1-CD1 4.35Å; L94-F97 PolarHBondContact O-N 3.02Å; L94-L98 HydrophobicContact CD1-CD1 3.99Å; L94-L98 HydrophobicContact CD1-CG 4.06Å; L94-L98 HydrophobicContact CG-CD1 4.13Å; L94-L98 WeakPolarHBondContact O-CG 3.4Å; L94-L98 PolarHBondContact O-N 3.39Å; L94-M156 HydrophobicContact CB-SD 4.38Å; L94-M156 HydrophobicContact CD2-CE 4.34Å; L94-M156 HydrophobicContact CD2-CG 4.09Å; L94-M156 HydrophobicContact CD2-SD 3.93Å; L94-M156 HydrophobicContact CG-SD 4.4Å; L94-I158 HydrophobicContact CB-CD1 4.01Å; L94-I158 HydrophobicContact CD2-CD1 4.04Å; L94-I158 HydrophobicContact CD2-CG1 4.04Å; L94-I166 HydrophobicContact CD1-CD1 4.19Å; L94-I166 HydrophobicContact CD1-CG2 4.28Å; L94-I166 HydrophobicContact CD2-CD1 4.41Å; L94-I166 HydrophobicContact CD2-CG2 3.31Å; L94-I166 HydrophobicContact CG-CG2 4.43Å
95	F	98.6	Very high	97.9	Very high	36 Å²	36	45.5 Å²	45.5	16%	0.158	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-56.5	176.9	179.5	-83.7	0	0	0	111	E91 S92 F97 L98 D99 I151 Y153 M156	E91-F95 PolarHBondContact O-N 3.03Å; S92-F95 PolarHBondContact O-N 2.99Å; F95-F97 VanDerWaalsContact C-N 3.31Å; F95-F97 PolarHBondContact O-N 2.95Å; F95-L98 PolarHBondContact O-N 2.93Å; F95-D99 HydrophobicContact CE1-CB 4.37Å; F95-D99 VanDerWaalsContact O-CB 3.3Å; F95-D99 WeakPolarHBondContact O-CB 3.23Å; F95-D99 PolarHBondContact O-N 3.5Å; F95-I151 HydrophobicContact CD2-CB 4.12Å; F95-I151 HydrophobicContact CD2-CG2 3.94Å; F95-I151 HydrophobicContact CE2-CB 4.01Å; F95-I151 HydrophobicContact CE2-CG2 4.31Å; F95-I151 VanDerWaalsContact CE2-O 3.26Å; F95-I151 WeakPolarHBondContact CE2-O 3.44Å; F95-Y153 HydrophobicContact CB-CE1 3.81Å; F95-Y153 HydrophobicContact CB-CE2 4.18Å; F95-Y153 WeakPolarHBondContact CB-OH 3.5Å; F95-Y153 HydrophobicContact CD1-CE2 4.05Å; F95-Y153 AromaticContact CD2-CD2 3.71Å; F95-Y153 HydrophobicContact CD2-CD2 3.71Å; F95-Y153 HydrophobicContact CD2-CE1 4.23Å; F95-Y153 AromaticContact CD2-CE2 3.34Å; F95-Y153 HydrophobicContact CD2-CE2 3.34Å; F95-Y153 HydrophobicContact CD2-CG 4.3Å; F95-Y153 AromaticContact CD2-CZ 3.64Å; F95-Y153 HydrophobicContact CE1-CE2 4.34Å; F95-Y153 AromaticContact CE2-CD2 3.9Å; F95-Y153 HydrophobicContact CE2-CD2 3.9Å; F95-Y153 AromaticContact CE2-CE2 3.63Å; F95-Y153 HydrophobicContact CE2-CE2 3.63Å; F95-Y153 HydrophobicContact CG-CD2 4.38Å; F95-Y153 HydrophobicContact CG-CE1 4.14Å; F95-Y153 AromaticContact CG-CE2 3.58Å; F95-Y153 HydrophobicContact CG-CE2 3.58Å; F95-Y153 AromaticContact CG-CZ 3.44Å; F95-Y153 VanDerWaalsContact CG-CZ 3.44Å; F95-Y153 WeakPolarHBondContact CG-OH 3.44Å; F95-Y153 HydrophobicContact CZ-CE2 4.15Å; F95-M156 HydrophobicContact CB-CE 4.16Å; F95-M156 HydrophobicContact CD2-CE 4.42Å
96	H	98.6	Very high	97.5	Very high	70 Å²	70	47.8 Å²	47.8	32%	0.324	24%	0.235	S	C	.	.	H	α-helix	trans	-65.2	-35.1	-179	-64.4	148.5	0	0	0	112.1	E86 S92 D99 D100	E86-H96 PolarHBondContact O-ND1 2.85Å; S92-H96 PolarHBondContact O-N 3.28Å; S92-H96 PolarHBondContact O-ND1 3.2Å; H96-D99 PolarHBondContact O-N 2.8Å; H96-D100 VanDerWaalsContact O-CB 3.26Å; H96-D100 WeakPolarHBondContact O-CB 3.47Å; H96-D100 VanDerWaalsContact O-CG 3.22Å; H96-D100 PolarHBondContact O-N 2.93Å
97	F	98.8	Very high	96.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.9	-49.5	173.9	168.3	-105	0	0	0	112.5	F58 A62 L93 L94 F95 W101 I116 V118 I128 S130	F58-F97 HydrophobicContact CB-CE1 4.22Å; F58-F97 AromaticContact CD1-CD1 3.95Å; F58-F97 HydrophobicContact CD1-CD1 3.95Å; F58-F97 HydrophobicContact CD1-CE1 4.38Å; F58-F97 HydrophobicContact CD1-CG 4.28Å; F58-F97 VanDerWaalsContact O-CE1 3.28Å; F58-F97 WeakPolarHBondContact O-CE1 3.45Å; A62-F97 HydrophobicContact CB-CE1 3.65Å; A62-F97 HydrophobicContact CB-CZ 3.87Å; L93-F97 WeakPolarHBondContact O-CB 3.33Å; L93-F97 PolarHBondContact O-N 3.41Å; L94-F97 HydrophobicContact CD1-CD1 4.35Å; L94-F97 PolarHBondContact O-N 3.02Å; F95-F97 VanDerWaalsContact C-N 3.31Å; F95-F97 PolarHBondContact O-N 2.95Å; F97-W101 AromaticContact CD2-CD1 3.78Å; F97-W101 AromaticContact CD2-NE1 3.88Å; F97-W101 AromaticContact CE2-CD1 3.43Å; F97-W101 VanDerWaalsContact CE2-CD1 3.43Å; F97-W101 AromaticContact CE2-NE1 3.21Å; F97-W101 AromaticContact CZ-CD1 3.69Å; F97-W101 AromaticContact CZ-NE1 3.67Å; F97-W101 VanDerWaalsContact O-CD1 3.22Å; F97-W101 PolarHBondContact O-N 3.38Å; F97-I116 HydrophobicContact CZ-CG2 4.42Å; F97-V118 HydrophobicContact CE2-CG2 3.95Å; F97-V118 HydrophobicContact CZ-CG2 3.86Å; F97-I128 HydrophobicContact CB-CG2 4.11Å; F97-I128 HydrophobicContact CD2-CD1 3.69Å; F97-I128 HydrophobicContact CD2-CG1 4.29Å; F97-I128 HydrophobicContact CD2-CG2 4.05Å; F97-I128 HydrophobicContact CE2-CD1 3.98Å; F97-I128 HydrophobicContact CG-CD1 4.04Å; F97-I128 HydrophobicContact CG-CG2 4.45Å; F97-S130 WeakPolarHBondContact CE2-OG 3.13Å
98	L	98.5	Very high	95.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-40.2	178.4	-66.3	175.3	0	0	0	111.5	C61 A62 L94 F95 W101 L102 I151 A168	C61-L98 HydrophobicContact CB-CD2 4.23Å; A62-L98 HydrophobicContact CB-CD2 3.88Å; L94-L98 HydrophobicContact CD1-CD1 3.99Å; L94-L98 HydrophobicContact CD1-CG 4.06Å; L94-L98 HydrophobicContact CG-CD1 4.13Å; L94-L98 WeakPolarHBondContact O-CG 3.4Å; L94-L98 PolarHBondContact O-N 3.39Å; F95-L98 PolarHBondContact O-N 2.93Å; L98-W101 PolarHBondContact O-N 2.95Å; L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 2.9Å; L98-I151 HydrophobicContact CB-CD1 3.8Å; L98-I151 HydrophobicContact CB-CG1 3.76Å; L98-I151 HydrophobicContact CB-CG2 4.18Å; L98-I151 HydrophobicContact CD1-CG2 3.96Å; L98-A168 HydrophobicContact CD1-CB 4.19Å
99	D	98.1	Very high	95.2	Very high	62 Å²	62	43 Å²	43	33%	0.332	22%	0.223	S	C	.	.	H	α-helix	trans	-67.3	-41	-179.6	-164.9	50	0	0	0	112.1	F95 H96 W101 L102 Y103 I151	F95-D99 HydrophobicContact CE1-CB 4.37Å; F95-D99 VanDerWaalsContact O-CB 3.3Å; F95-D99 WeakPolarHBondContact O-CB 3.23Å; F95-D99 PolarHBondContact O-N 3.5Å; H96-D99 PolarHBondContact O-N 2.8Å; D99-W101 PolarHBondContact O-N 3.41Å; D99-L102 CarbonylContact O-C 3.6Å; D99-L102 WeakPolarHBondContact O-CB 3.14Å; D99-L102 PolarHBondContact O-N 2.79Å; D99-Y103 WeakPolarHBondContact O-CB 3.3Å; D99-Y103 PolarHBondContact O-N 2.86Å; D99-I151 HydrophobicContact CB-CG1 4.28Å
100	D	98.3	Very high	95	Very high	54 Å²	54	44.6 Å²	44.6	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-65.3	-39.4	175.5	-75.5	-30.7	0	0	0	111.4	V83 S85 H96 Y103 K104	V83-D100 HydrophobicContact CG1-CB 3.6Å; S85-D100 VanDerWaalsContact CB-OD2 3.24Å; S85-D100 WeakPolarHBondContact CB-OD2 3.33Å; S85-D100 PolarHBondContact OG-OD2 2.81Å; H96-D100 VanDerWaalsContact O-CB 3.26Å; H96-D100 WeakPolarHBondContact O-CB 3.47Å; H96-D100 VanDerWaalsContact O-CG 3.22Å; H96-D100 PolarHBondContact O-N 2.93Å; D100-Y103 WeakPolarHBondContact O-CB 3.49Å; D100-Y103 PolarHBondContact O-N 2.67Å; D100-K104 WeakPolarHBondContact O-CG 3.36Å; D100-K104 PolarHBondContact O-N 2.76Å; D100-K104 VanDerWaalsContact O-N 3.1Å
101	W	98.4	Very high	95	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-45	172	-88.2	113.4	0	0	0	112	M65 F66 V81 V83 F97 L98 D99 Y103 K104 F105 F111 I116 S130	M65-W101 HydrophobicContact CE-CB 4.13Å; F66-W101 HydrophobicContact CE2-CB 3.97Å; F66-W101 HydrophobicContact CE2-CD2 4.46Å; F66-W101 HydrophobicContact CE2-CE3 4.19Å; F66-W101 HydrophobicContact CE2-CG 4.4Å; F66-W101 HydrophobicContact CZ-CB 4.27Å; F66-W101 HydrophobicContact CZ-CE3 4.42Å; V81-W101 HydrophobicContact CB-CH2 4.49Å; V81-W101 HydrophobicContact CB-CZ3 4.47Å; V81-W101 HydrophobicContact CG1-CZ3 4.38Å; V83-W101 HydrophobicContact CB-CD2 4.41Å; V83-W101 HydrophobicContact CB-CH2 4.5Å; V83-W101 HydrophobicContact CB-CZ2 3.93Å; V83-W101 HydrophobicContact CG2-CD2 3.88Å; V83-W101 HydrophobicContact CG2-CE3 4.01Å; V83-W101 HydrophobicContact CG2-CH2 3.81Å; V83-W101 HydrophobicContact CG2-CZ2 3.71Å; V83-W101 HydrophobicContact CG2-CZ3 3.97Å; F97-W101 AromaticContact CD2-CD1 3.78Å; F97-W101 AromaticContact CD2-NE1 3.88Å; F97-W101 AromaticContact CE2-CD1 3.43Å; F97-W101 VanDerWaalsContact CE2-CD1 3.43Å; F97-W101 AromaticContact CE2-NE1 3.21Å; F97-W101 AromaticContact CZ-CD1 3.69Å; F97-W101 AromaticContact CZ-NE1 3.67Å; F97-W101 VanDerWaalsContact O-CD1 3.22Å; F97-W101 PolarHBondContact O-N 3.38Å; L98-W101 PolarHBondContact O-N 2.95Å; D99-W101 PolarHBondContact O-N 3.41Å; W101-Y103 VanDerWaalsContact C-N 3.27Å; W101-Y103 PolarHBondContact O-N 2.88Å; W101-K104 WeakPolarHBondContact O-CB 3.43Å; W101-K104 PolarHBondContact O-N 2.77Å; W101-F105 PolarHBondContact O-N 3.43Å; W101-F111 HydrophobicContact CZ3-CD1 4.09Å; W101-F111 AromaticContact CZ3-CE1 3.84Å; W101-F111 HydrophobicContact CZ3-CE1 3.84Å; W101-I116 HydrophobicContact CD2-CD1 3.78Å; W101-I116 HydrophobicContact CD2-CG1 4.4Å; W101-I116 HydrophobicContact CE3-CD1 4.13Å; W101-I116 HydrophobicContact CG-CD1 4.15Å; W101-I116 HydrophobicContact CH2-CG1 4.27Å; W101-I116 HydrophobicContact CZ2-CD1 4.31Å; W101-I116 HydrophobicContact CZ2-CG1 4.07Å; W101-I116 HydrophobicContact CZ2-CG2 3.82Å; W101-I116 HydrophobicContact CZ3-CG1 4.48Å; W101-S130 WeakPolarHBondContact CZ2-OG 3.4Å; W101-S130 PolarHBondContact NE1-OG 3.24Å
102	L	97.6	Very high	95	Very high	5 Å²	5	39 Å²	39	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-39.9	174.7	179.7	62.1	0	0	0	111.1	M65 M69 L98 D99 K104 F105 C106 V148 I151	M65-L102 HydrophobicContact CE-CB 4.11Å; M65-L102 HydrophobicContact SD-CB 4.13Å; M65-L102 HydrophobicContact SD-CD1 4.43Å; M69-L102 HydrophobicContact CE-CD1 3.21Å; L98-L102 WeakPolarHBondContact O-CB 3.36Å; L98-L102 PolarHBondContact O-N 2.9Å; D99-L102 CarbonylContact O-C 3.6Å; D99-L102 WeakPolarHBondContact O-CB 3.14Å; D99-L102 PolarHBondContact O-N 2.79Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.05Å; L102-F105 CarbonylContact O-C 3.59Å; L102-F105 WeakPolarHBondContact O-CB 3.47Å; L102-F105 PolarHBondContact O-N 3.23Å; L102-F105 VanDerWaalsContact O-N 3.1Å; L102-C106 PolarHBondContact O-N 2.89Å; L102-V148 HydrophobicContact CD1-CB 4.24Å; L102-V148 HydrophobicContact CD1-CG1 4.45Å; L102-V148 HydrophobicContact CD2-CG1 4.39Å; L102-I151 HydrophobicContact CD2-CD1 4.25Å; L102-I151 HydrophobicContact CD2-CG1 4.47Å
103	Y	96.8	Very high	95	Very high	123 Å²	123	38.5 Å²	38.5	48%	0.482	20%	0.196	S	C	.	.	H	α-helix	trans	-61.9	-39.2	176.4	178.5	-91.9	0	0	0	112.2	D99 D100 W101 F105 C106 A107 D108	D99-Y103 WeakPolarHBondContact O-CB 3.3Å; D99-Y103 PolarHBondContact O-N 2.86Å; D100-Y103 WeakPolarHBondContact O-CB 3.49Å; D100-Y103 PolarHBondContact O-N 2.67Å; W101-Y103 VanDerWaalsContact C-N 3.27Å; W101-Y103 PolarHBondContact O-N 2.88Å; Y103-F105 PolarHBondContact O-N 2.83Å; Y103-C106 PolarHBondContact O-N 2.71Å; Y103-A107 HydrophobicContact CD2-CB 3.62Å; Y103-A107 HydrophobicContact CE1-CB 4.49Å; Y103-A107 HydrophobicContact CE2-CB 3.38Å; Y103-A107 HydrophobicContact CG-CB 4.28Å; Y103-A107 PolarHBondContact O-N 3.03Å; Y103-D108 HydrophobicContact CD1-CB 4.4Å; Y103-D108 HydrophobicContact CE1-CB 3.99Å; Y103-D108 PolarHBondContact O-N 2.8Å
104	K	96.8	Very high	95	Very high	47 Å²	47	43 Å²	43	20%	0.204	21%	0.213	C	C	.	.	I	π-helix	trans	-59.7	-31.1	174.5	-66.4	-61.6	171.5	-176.4	0	112.9	V81 V83 D100 W101 L102 D108 L109 F110 F111	V81-K104 HydrophobicContact CG1-CD 4.07Å; V81-K104 HydrophobicContact CG1-CG 4.17Å; V83-K104 HydrophobicContact CG2-CG 3.98Å; D100-K104 WeakPolarHBondContact O-CG 3.36Å; D100-K104 PolarHBondContact O-N 2.76Å; D100-K104 VanDerWaalsContact O-N 3.1Å; W101-K104 WeakPolarHBondContact O-CB 3.43Å; W101-K104 PolarHBondContact O-N 2.77Å; L102-K104 VanDerWaalsContact C-N 3.34Å; L102-K104 PolarHBondContact O-N 3.05Å; K104-D108 HydrophobicContact CD-CB 4.32Å; K104-D108 IonicContact NZ-OD2 2.75Å; K104-D108 PolarHBondContact NZ-OD2 2.59Å; K104-L109 PolarHBondContact O-N 2.91Å; K104-F110 PolarHBondContact O-N 3.42Å; K104-F111 PolarHBondContact O-N 3.17Å; K104-F111 VanDerWaalsContact O-N 3.15Å
105	F	94.9	Very high	94.9	Very high	29 Å²	29	48.1 Å²	48.1	13%	0.127	24%	0.237	C	C	.	.	I	π-helix	trans	-82.9	-44.3	174.2	176.8	-100.7	0	0	0	113.3	F66 M69 W101 L102 Y103 F110 V112 F137	F66-F105 HydrophobicContact CE1-CB 3.77Å; F66-F105 HydrophobicContact CE1-CD2 4.37Å; F66-F105 HydrophobicContact CE1-CG 4.14Å; F66-F105 HydrophobicContact CZ-CB 4.31Å; M69-F105 HydrophobicContact CE-CD1 4.18Å; M69-F105 HydrophobicContact SD-CD1 3.75Å; M69-F105 HydrophobicContact SD-CE1 3.79Å; M69-F105 HydrophobicContact SD-CG 4.16Å; M69-F105 HydrophobicContact SD-CZ 4.2Å; W101-F105 PolarHBondContact O-N 3.43Å; L102-F105 CarbonylContact O-C 3.59Å; L102-F105 WeakPolarHBondContact O-CB 3.47Å; L102-F105 PolarHBondContact O-N 3.23Å; L102-F105 VanDerWaalsContact O-N 3.1Å; Y103-F105 PolarHBondContact O-N 2.83Å; F105-F110 VanDerWaalsContact O-CA 3.25Å; F105-F110 WeakPolarHBondContact O-CA 3.46Å; F105-F110 VanDerWaalsContact O-CD1 3.23Å; F105-F110 WeakPolarHBondContact O-CD1 3.04Å; F105-V112 HydrophobicContact CD2-CB 4.44Å; F105-F137 HydrophobicContact CD2-CB 4.41Å; F105-F137 HydrophobicContact CE2-CB 3.75Å; F105-F137 HydrophobicContact CE2-CD1 4.35Å; F105-F137 AromaticContact CE2-CD2 3.99Å; F105-F137 HydrophobicContact CE2-CD2 3.99Å; F105-F137 AromaticContact CE2-CG 3.77Å; F105-F137 HydrophobicContact CE2-CG 3.77Å; F105-F137 HydrophobicContact CZ-CG 4.36Å
106	C	90.1	Very high	94.9	Very high	56 Å²	56	46.5 Å²	46.5	38%	0.378	23%	0.23	S	C	.	.	I	π-helix	trans	-83.6	-30.3	-171.5	-68.8	0	0	0	0	114.3	L102 Y103	L102-C106 PolarHBondContact O-N 2.89Å; Y103-C106 PolarHBondContact O-N 2.71Å
107	A	80.9	Confident	94.9	Very high	58 Å²	58	47 Å²	47	48%	0.479	23%	0.231	S	C	.	.	I	π-helix	trans	-134.8	-13.8	-160.3	0	0	0	0	0	116.2	Y103	Y103-A107 HydrophobicContact CD2-CB 3.62Å; Y103-A107 HydrophobicContact CE1-CB 4.49Å; Y103-A107 HydrophobicContact CE2-CB 3.38Å; Y103-A107 HydrophobicContact CG-CB 4.28Å; Y103-A107 PolarHBondContact O-N 3.03Å
108	D	81.4	Confident	94.9	Very high	74 Å²	74	47.2 Å²	47.2	40%	0.396	23%	0.233	S	C	.	.	I	π-helix	trans	-113.2	-73.6	-175.2	-165.5	9.6	0	0	0	111.9	Y103 K104	Y103-D108 HydrophobicContact CD1-CB 4.4Å; Y103-D108 HydrophobicContact CE1-CB 3.99Å; Y103-D108 PolarHBondContact O-N 2.8Å; K104-D108 HydrophobicContact CD-CB 4.32Å; K104-D108 IonicContact NZ-OD2 2.75Å; K104-D108 PolarHBondContact NZ-OD2 2.59Å
109	L	82.8	Confident	94.9	Very high	84 Å²	84	50.2 Å²	50.2	44%	0.44	25%	0.251	S	S	.	.	S	Bend	trans	-114.7	-2.4	-167.9	-64.4	176.7	0	0	0	113.6	V81 K104 F111	V81-L109 HydrophobicContact CG2-CD1 3.84Å; K104-L109 PolarHBondContact O-N 2.91Å; L109-F111 HydrophobicContact CB-CB 3.78Å; L109-F111 PolarHBondContact O-N 3.39Å; L109-F111 VanDerWaalsContact O-N 3.11Å
110	F	94.3	Very high	94.9	Very high	107 Å²	107	49.8 Å²	49.8	47%	0.469	25%	0.252	S	S	.	.			trans	48.7	31.8	-161.2	-58.8	-76.5	0	0	0	112.3	K104 F105 V112 E136 F137	K104-F110 PolarHBondContact O-N 3.42Å; F105-F110 VanDerWaalsContact O-CA 3.25Å; F105-F110 WeakPolarHBondContact O-CA 3.46Å; F105-F110 VanDerWaalsContact O-CD1 3.23Å; F105-F110 WeakPolarHBondContact O-CD1 3.04Å; F110-V112 PolarHBondContact O-N 3.4Å; F110-E136 HydrophobicContact CB-CG 4.04Å; F110-F137 WeakPolarHBondContact O-CB 3.26Å; F110-F137 PolarHBondContact O-N 3.35Å
111	F	97.4	Very high	94.9	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	125.4	-171.6	179.2	-97.7	0	0	0	109.9	D79 V81 W101 K104 L109 P113 G134	D79-F111 HydrophobicContact CB-CE2 4.15Å; V81-F111 HydrophobicContact CB-CD1 4.18Å; V81-F111 HydrophobicContact CB-CE1 3.95Å; V81-F111 HydrophobicContact CB-CE2 4.48Å; V81-F111 HydrophobicContact CB-CZ 4.1Å; V81-F111 HydrophobicContact CG2-CB 4.49Å; V81-F111 HydrophobicContact CG2-CD1 3.91Å; V81-F111 HydrophobicContact CG2-CD2 3.68Å; V81-F111 HydrophobicContact CG2-CE1 3.94Å; V81-F111 HydrophobicContact CG2-CE2 3.72Å; V81-F111 HydrophobicContact CG2-CG 3.77Å; V81-F111 HydrophobicContact CG2-CZ 3.84Å; W101-F111 HydrophobicContact CZ3-CD1 4.09Å; W101-F111 AromaticContact CZ3-CE1 3.84Å; W101-F111 HydrophobicContact CZ3-CE1 3.84Å; K104-F111 PolarHBondContact O-N 3.17Å; K104-F111 VanDerWaalsContact O-N 3.15Å; L109-F111 HydrophobicContact CB-CB 3.78Å; L109-F111 PolarHBondContact O-N 3.39Å; L109-F111 VanDerWaalsContact O-N 3.11Å; F111-P113 HydrophobicContact CE1-CB 3.85Å; F111-P113 HydrophobicContact CE1-CG 4.4Å; F111-P113 HydrophobicContact CZ-CB 4.49Å; F111-G134 VanDerWaalsContact CE2-C 3.46Å
112	V	97.4	Very high	94.8	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.3	169.2	57.9	0	0	0	0	108.6	F66 T70 V75 F105 F110 G134 E135 F137	F66-V112 HydrophobicContact CD1-CG2 4.25Å; T70-V112 HydrophobicContact CG2-CG2 3.76Å; V75-V112 HydrophobicContact CG1-CG1 3.99Å; V75-V112 VanDerWaalsContact CG1-O 3.28Å; V75-V112 WeakPolarHBondContact CG1-O 3.37Å; V75-V112 HydrophobicContact CG2-CB 4.46Å; V75-V112 HydrophobicContact CG2-CG1 3.74Å; V75-V112 HydrophobicContact CG2-CG2 3.92Å; F105-V112 HydrophobicContact CD2-CB 4.44Å; F110-V112 PolarHBondContact O-N 3.4Å; V112-G134 WeakPolarHBondContact O-CA 3.49Å; V112-E135 WeakPolarHBondContact CG1-O 3.32Å; V112-E135 PolarHBondContact N-O 3.31Å; V112-E135 PolarHBondContact O-N 2.83Å; V112-F137 HydrophobicContact CB-CB 4.46Å; V112-F137 HydrophobicContact CG1-CB 4.09Å; V112-F137 HydrophobicContact CG1-CD2 4.22Å
113	P	98	Very high	94.7	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136.9	174.5	26.2	-25.5	0	0	0	110.7	F66 F111 I116	F66-P113 HydrophobicContact CD1-CG 4.31Å; F66-P113 HydrophobicContact CD2-CG 3.37Å; F66-P113 HydrophobicContact CE1-CG 4.36Å; F66-P113 HydrophobicContact CE2-CG 3.42Å; F66-P113 VanDerWaalsContact CE2-CG 3.42Å; F66-P113 HydrophobicContact CG-CG 3.84Å; F66-P113 HydrophobicContact CZ-CG 3.93Å; F111-P113 HydrophobicContact CE1-CB 3.85Å; F111-P113 HydrophobicContact CE1-CG 4.4Å; F111-P113 HydrophobicContact CZ-CB 4.49Å; P113-I116 HydrophobicContact CB-CD1 4.27Å; P113-I116 HydrophobicContact CB-CG1 3.7Å; P113-I116 HydrophobicContact CG-CD1 3.69Å; P113-I116 HydrophobicContact CG-CG1 3.71Å
114	R	97.9	Very high	94.6	Very high	95 Å²	95	58.9 Å²	58.9	36%	0.358	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-40.2	160.2	-177.7	-175.2	-175.5	75	12	110.5	M63 E73 V75 W133	M63-R114 WeakPolarHBondContact CE-O 3.49Å; E73-R114 VanDerWaalsContact C-NH1 3.33Å; E73-R114 PolarHBondContact O-NH1 2.86Å; V75-R114 HydrophobicContact CB-CB 4.03Å; V75-R114 HydrophobicContact CG1-CB 3.99Å; V75-R114 VanDerWaalsContact O-CD 3.29Å; V75-R114 WeakPolarHBondContact O-CD 3.18Å; V75-R114 PolarHBondContact O-NH1 3.48Å; R114-W133 WeakPolarHBondContact CB-O 3.23Å; R114-W133 PolarHBondContact N-O 3.26Å
115	E	97.4	Very high	94.7	Very high	107 Å²	107	62 Å²	62	50%	0.5	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.3	-178.1	-173	176.8	167.2	0	0	109.4	G132 W133	E115-G132 CarbonylContact O-C 3.54Å; E115-G132 VanDerWaalsContact O-CA 3.23Å; E115-G132 WeakPolarHBondContact O-CA 3.37Å; E115-W133 HydrophobicContact CB-CE3 4.42Å; E115-W133 PolarHBondContact N-O 3.41Å; E115-W133 PolarHBondContact O-N 3.22Å
116	I	98.6	Very high	94.8	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136.3	171.5	-63.4	167.4	0	0	0	107.9	E59 A62 M63 F66 F97 W101 P113 I131	E59-I116 HydrophobicContact CB-CG2 4.29Å; E59-I116 WeakPolarHBondContact CB-O 3.14Å; E59-I116 WeakPolarHBondContact CG-O 3.44Å; A62-I116 HydrophobicContact CB-CD1 3.48Å; A62-I116 VanDerWaalsContact CB-CD1 3.48Å; M63-I116 HydrophobicContact CG-CB 4.49Å; M63-I116 HydrophobicContact SD-CB 4.04Å; M63-I116 HydrophobicContact SD-CD1 4.09Å; M63-I116 HydrophobicContact SD-CG1 3.85Å; M63-I116 PolarHBondContact SD-N 3.04Å; M63-I116 VanDerWaalsContact SD-N 3.36Å; F66-I116 HydrophobicContact CD2-CD1 3.94Å; F66-I116 HydrophobicContact CE2-CD1 3.89Å; F97-I116 HydrophobicContact CZ-CG2 4.42Å; W101-I116 HydrophobicContact CD2-CD1 3.78Å; W101-I116 HydrophobicContact CD2-CG1 4.4Å; W101-I116 HydrophobicContact CE3-CD1 4.13Å; W101-I116 HydrophobicContact CG-CD1 4.15Å; W101-I116 HydrophobicContact CH2-CG1 4.27Å; W101-I116 HydrophobicContact CZ2-CD1 4.31Å; W101-I116 HydrophobicContact CZ2-CG1 4.07Å; W101-I116 HydrophobicContact CZ2-CG2 3.82Å; W101-I116 HydrophobicContact CZ3-CG1 4.48Å; P113-I116 HydrophobicContact CB-CD1 4.27Å; P113-I116 HydrophobicContact CB-CG1 3.7Å; P113-I116 HydrophobicContact CG-CD1 3.69Å; P113-I116 HydrophobicContact CG-CG1 3.71Å; I116-I131 CarbonylContact C-O 3.57Å; I116-I131 WeakPolarHBondContact CA-O 3.45Å
117	K	98.5	Very high	95.2	Very high	81 Å²	81	65.2 Å²	65.2	35%	0.352	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	123.8	169.5	-168	75.5	-153.8	153.8	0	110.6	E59 V119 S130 I131 W133	E59-K117 VanDerWaalsContact CD-NZ 3.28Å; E59-K117 IonicContact OE1-NZ 3.65Å; E59-K117 PolarHBondContact OE1-NZ 2.91Å; E59-K117 VanDerWaalsContact OE2-CA 3.31Å; E59-K117 WeakPolarHBondContact OE2-CA 3.41Å; E59-K117 VanDerWaalsContact OE2-CD 3.3Å; E59-K117 WeakPolarHBondContact OE2-CD 3.3Å; E59-K117 VanDerWaalsContact OE2-CE 3.28Å; E59-K117 WeakPolarHBondContact OE2-CE 3.38Å; E59-K117 IonicContact OE2-NZ 2.99Å; E59-K117 PolarHBondContact OE2-NZ 3.41Å; K117-V119 PolarHBondContact O-N 2.81Å; K117-S130 CarbonylContact O-C 3.59Å; K117-S130 VanDerWaalsContact O-CA 3.23Å; K117-S130 WeakPolarHBondContact O-CA 3.18Å; K117-S130 WeakPolarHBondContact O-CB 3.39Å; K117-I131 PolarHBondContact N-O 2.75Å; K117-I131 PolarHBondContact O-N 2.77Å; K117-W133 HydrophobicContact CB-CH2 3.72Å; K117-W133 HydrophobicContact CB-CZ3 3.71Å
118	V	98.6	Very high	96.1	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.03	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119	167.1	171.9	0	0	0	0	108.5	E55 F58 E59 F97 I121 I128	E55-V118 HydrophobicContact CB-CB 3.87Å; E55-V118 HydrophobicContact CB-CG1 3.67Å; E55-V118 HydrophobicContact CG-CB 4.45Å; E55-V118 HydrophobicContact CG-CG1 3.72Å; F58-V118 HydrophobicContact CB-CG2 4.08Å; E59-V118 HydrophobicContact CB-CB 4.31Å; E59-V118 HydrophobicContact CB-CG2 3.75Å; E59-V118 PolarHBondContact OE2-N 3.38Å; F97-V118 HydrophobicContact CE2-CG2 3.95Å; F97-V118 HydrophobicContact CZ-CG2 3.86Å; V118-I121 HydrophobicContact CG1-CD1 4.13Å; V118-I121 HydrophobicContact CG1-CG1 3.81Å; V118-I128 HydrophobicContact CG1-CD1 3.81Å; V118-I128 HydrophobicContact CG1-CG1 3.81Å; V118-I128 HydrophobicContact CG2-CD1 3.91Å; V118-I128 HydrophobicContact CG2-CG1 4.47Å
119	V	98.4	Very high	96.9	Very high	63 Å²	63	63 Å²	63	38%	0.382	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-35.4	-175.5	-170.5	0	0	0	0	111.4	K117 R129 I131	K117-V119 PolarHBondContact O-N 2.81Å; V119-R129 PolarHBondContact N-O 3.08Å; V119-I131 HydrophobicContact CG2-CB 4.44Å; V119-I131 HydrophobicContact CG2-CD1 3.73Å; V119-I131 HydrophobicContact CG2-CG1 3.79Å
120	S	97.9	Very high	97.6	Very high	52 Å²	52	59 Å²	59	36%	0.364	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	143.7	177.9	54.9	0	0	0	0	112.1	I128 R129	S120-I128 WeakPolarHBondContact O-CA 3.39Å; S120-R129 PolarHBondContact N-O 2.56Å; S120-R129 PolarHBondContact O-N 2.98Å
121	I	98.1	Very high	97.9	Very high	19 Å²	19	55.6 Å²	55.6	10%	0.097	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.8	165	-65	171.8	0	0	0	108.9	L54 E55 F58 M90 L93 V118 R123 K127 I128	L54-I121 HydrophobicContact CD2-CD1 4.44Å; L54-I121 HydrophobicContact CG-CD1 4.15Å; E55-I121 HydrophobicContact CB-CD1 4.47Å; E55-I121 HydrophobicContact CG-CD1 4Å; E55-I121 HydrophobicContact CG-CG1 4.08Å; F58-I121 HydrophobicContact CB-CD1 4.44Å; F58-I121 HydrophobicContact CD1-CD1 4.38Å; F58-I121 HydrophobicContact CD2-CD1 3.98Å; F58-I121 HydrophobicContact CE2-CD1 4.36Å; F58-I121 HydrophobicContact CG-CD1 4.02Å; M90-I121 HydrophobicContact CE-CG2 4.29Å; L93-I121 HydrophobicContact CD2-CG2 4.1Å; V118-I121 HydrophobicContact CG1-CD1 4.13Å; V118-I121 HydrophobicContact CG1-CG1 3.81Å; I121-R123 HydrophobicContact CG2-CG 4Å; I121-R123 PolarHBondContact O-N 2.68Å; I121-K127 CarbonylContact C-O 3.52Å; I121-K127 WeakPolarHBondContact CA-O 3.4Å; I121-I128 HydrophobicContact CD1-CD1 4.01Å; I121-I128 HydrophobicContact CG1-CB 4.36Å; I121-I128 HydrophobicContact CG1-CD1 3.76Å; I121-I128 HydrophobicContact CG1-CG1 3.81Å
122	D	97.6	Very high	97.9	Very high	62 Å²	62	55.4 Å²	55.4	33%	0.332	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	102.8	165.8	-174	-23.4	0	0	0	109	M124 H125 F126 K127	D122-M124 VanDerWaalsContact C-N 3.3Å; D122-M124 PolarHBondContact O-N 2.7Å; D122-M124 WeakPolarHBondContact OD1-CB 3.26Å; D122-M124 PolarHBondContact OD1-N 2.82Å; D122-H125 IonicContact OD1-CG 3.45Å; D122-H125 PolarHBondContact OD1-N 2.75Å; D122-H125 IonicContact OD1-ND1 2.75Å; D122-H125 PolarHBondContact OD1-ND1 2.65Å; D122-H125 IonicContact OD2-CE1 2.66Å; D122-H125 IonicContact OD2-CG 2.7Å; D122-H125 IonicContact OD2-ND1 2.75Å; D122-H125 PolarHBondContact OD2-ND1 3.45Å; D122-F126 CarbonylContact O-C 3.58Å; D122-F126 WeakPolarHBondContact O-CA 3.3Å; D122-F126 PolarHBondContact O-N 2.71Å; D122-K127 HydrophobicContact CB-CB 4.17Å; D122-K127 PolarHBondContact N-O 2.95Å; D122-K127 PolarHBondContact O-N 3.42Å
123	R	94.7	Very high	98	Very high	141 Å²	141	59.6 Å²	59.6	53%	0.532	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.8	-178.7	-60.3	177.3	60.3	157	9.2	114	I121 F126 D160	I121-R123 HydrophobicContact CG2-CG 4Å; I121-R123 PolarHBondContact O-N 2.68Å; R123-F126 WeakPolarHBondContact O-CE1 3.28Å; R123-D160 IonicContact CZ-OD2 2.82Å; R123-D160 IonicContact NH1-OD2 2.7Å; R123-D160 PolarHBondContact NH1-OD2 2.91Å; R123-D160 IonicContact NH2-OD2 2.65Å; R123-D160 PolarHBondContact NH2-OD2 3.18Å
124	M	95.6	Very high	98	Very high	152 Å²	152	59.6 Å²	59.6	75%	0.749	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-38	179.8	-75.2	-179.5	40.1	0	0	111.3	D122	D122-M124 VanDerWaalsContact C-N 3.3Å; D122-M124 PolarHBondContact O-N 2.7Å; D122-M124 WeakPolarHBondContact OD1-CB 3.26Å; D122-M124 PolarHBondContact OD1-N 2.82Å
125	H	97.3	Very high	98	Very high	112 Å²	112	56.1 Å²	56.1	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	4.8	-178.6	-51.2	105.1	0	0	0	113.1	D122 K127	D122-H125 IonicContact OD1-CG 3.45Å; D122-H125 PolarHBondContact OD1-N 2.75Å; D122-H125 IonicContact OD1-ND1 2.75Å; D122-H125 PolarHBondContact OD1-ND1 2.65Å; D122-H125 IonicContact OD2-CE1 2.66Å; D122-H125 IonicContact OD2-CG 2.7Å; D122-H125 IonicContact OD2-ND1 2.75Å; D122-H125 PolarHBondContact OD2-ND1 3.45Å; H125-K127 HydrophobicContact CB-CG 4.25Å; H125-K127 WeakPolarHBondContact O-CG 3.29Å; H125-K127 PolarHBondContact O-N 3Å
126	F	98.1	Very high	98	Very high	55 Å²	55	57 Å²	57	24%	0.241	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	49	60	-178.5	-54.7	-70	0	0	0	112.2	E86 G87 E88 D89 M90 L93 D122 R123	E86-F126 CarbonylContact C-O 3.56Å; E86-F126 VanDerWaalsContact CA-O 3.3Å; E86-F126 WeakPolarHBondContact CA-O 3.37Å; G87-F126 PolarHBondContact N-O 3.46Å; G87-F126 WeakPolarHBondContact O-CB 3.45Å; E88-F126 VanDerWaalsContact O-CD2 3.26Å; E88-F126 WeakPolarHBondContact O-CD2 3.41Å; E88-F126 VanDerWaalsContact O-CE2 3.23Å; E88-F126 WeakPolarHBondContact O-CE2 3.33Å; D89-F126 VanDerWaalsContact C-CD1 3.42Å; M90-F126 HydrophobicContact CG-CD1 4.28Å; M90-F126 HydrophobicContact CG-CE1 4.03Å; M90-F126 HydrophobicContact SD-CD1 3.85Å; M90-F126 HydrophobicContact SD-CE1 4.02Å; L93-F126 WeakPolarHBondContact CD1-O 3.45Å; L93-F126 HydrophobicContact CD2-CB 4.46Å; D122-F126 CarbonylContact O-C 3.58Å; D122-F126 WeakPolarHBondContact O-CA 3.3Å; D122-F126 PolarHBondContact O-N 2.71Å; R123-F126 WeakPolarHBondContact O-CE1 3.28Å
127	K	98.6	Very high	97.8	Very high	97 Å²	97	59 Å²	59	42%	0.422	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142.3	176.8	-56.7	-165.6	170.5	-128.4	0	110.6	S85 E86 I121 D122 H125	S85-K127 WeakPolarHBondContact O-CA 3.35Å; E86-K127 HydrophobicContact CB-CG 4.23Å; E86-K127 WeakPolarHBondContact OE2-CE 3.45Å; E86-K127 IonicContact OE2-NZ 2.7Å; E86-K127 PolarHBondContact OE2-NZ 2.79Å; I121-K127 CarbonylContact C-O 3.52Å; I121-K127 WeakPolarHBondContact CA-O 3.4Å; D122-K127 HydrophobicContact CB-CB 4.17Å; D122-K127 PolarHBondContact N-O 2.95Å; D122-K127 PolarHBondContact O-N 3.42Å; H125-K127 HydrophobicContact CB-CG 4.25Å; H125-K127 WeakPolarHBondContact O-CG 3.29Å; H125-K127 PolarHBondContact O-N 3Å
128	I	98.7	Very high	97.5	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140.5	177.1	-170.7	165.8	0	0	0	109.7	F58 E84 S85 L93 F97 V118 S120 I121	F58-I128 HydrophobicContact CB-CD1 4.27Å; F58-I128 HydrophobicContact CD1-CD1 3.47Å; F58-I128 VanDerWaalsContact CD1-CD1 3.47Å; F58-I128 HydrophobicContact CE1-CD1 4.13Å; F58-I128 HydrophobicContact CG-CD1 4.12Å; E84-I128 WeakPolarHBondContact CA-O 3.41Å; S85-I128 PolarHBondContact N-O 2.8Å; S85-I128 PolarHBondContact O-N 3.15Å; L93-I128 HydrophobicContact CD1-CB 3.94Å; L93-I128 HydrophobicContact CD1-CG2 3.53Å; L93-I128 HydrophobicContact CD2-CB 4.34Å; L93-I128 HydrophobicContact CG-CB 4.3Å; L93-I128 HydrophobicContact CG-CG2 4.17Å; F97-I128 HydrophobicContact CB-CG2 4.11Å; F97-I128 HydrophobicContact CD2-CD1 3.69Å; F97-I128 HydrophobicContact CD2-CG1 4.29Å; F97-I128 HydrophobicContact CD2-CG2 4.05Å; F97-I128 HydrophobicContact CE2-CD1 3.98Å; F97-I128 HydrophobicContact CG-CD1 4.04Å; F97-I128 HydrophobicContact CG-CG2 4.45Å; V118-I128 HydrophobicContact CG1-CD1 3.81Å; V118-I128 HydrophobicContact CG1-CG1 3.81Å; V118-I128 HydrophobicContact CG2-CD1 3.91Å; V118-I128 HydrophobicContact CG2-CG1 4.47Å; S120-I128 WeakPolarHBondContact O-CA 3.39Å; I121-I128 HydrophobicContact CD1-CD1 4.01Å; I121-I128 HydrophobicContact CG1-CB 4.36Å; I121-I128 HydrophobicContact CG1-CD1 3.76Å; I121-I128 HydrophobicContact CG1-CG1 3.81Å
129	R	98.8	Very high	97.2	Very high	82 Å²	82	62.8 Å²	62.8	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.4	171.8	-173.7	171.8	76.4	93.6	-2.2	108.9	E82 E84 V119 S120	E82-R129 HydrophobicContact CG-CG 4.43Å; E82-R129 WeakPolarHBondContact OE1-CD 3.4Å; E82-R129 WeakPolarHBondContact OE1-CG 3.34Å; E82-R129 IonicContact OE1-CZ 2.92Å; E82-R129 IonicContact OE1-NE 3.02Å; E82-R129 IonicContact OE1-NH1 3.01Å; E82-R129 PolarHBondContact OE1-NH1 3.41Å; E84-R129 HydrophobicContact CG-CB 4.12Å; E84-R129 HydrophobicContact CG-CG 3.74Å; E84-R129 WeakPolarHBondContact OE1-CD 3.16Å; V119-R129 PolarHBondContact N-O 3.08Å; S120-R129 PolarHBondContact N-O 2.56Å; S120-R129 PolarHBondContact O-N 2.98Å
130	S	98.8	Very high	97	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	154.8	-176.6	65.1	0	0	0	0	111.5	E82 V83 F97 W101 K117	E82-S130 WeakPolarHBondContact CA-O 3.34Å; V83-S130 PolarHBondContact N-O 3.43Å; V83-S130 PolarHBondContact O-N 3.14Å; V83-S130 PolarHBondContact O-OG 2.92Å; F97-S130 WeakPolarHBondContact CE2-OG 3.13Å; W101-S130 WeakPolarHBondContact CZ2-OG 3.4Å; W101-S130 PolarHBondContact NE1-OG 3.24Å; K117-S130 CarbonylContact O-C 3.59Å; K117-S130 VanDerWaalsContact O-CA 3.23Å; K117-S130 WeakPolarHBondContact O-CA 3.18Å; K117-S130 WeakPolarHBondContact O-CB 3.39Å
131	I	98.6	Very high	96.8	Very high	36 Å²	36	66 Å²	66	19%	0.185	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.1	179.4	-60.1	172.8	0	0	0	107.6	T80 V81 E82 I116 K117 V119 W133	T80-I131 HydrophobicContact CG2-CG2 3.38Å; V81-I131 CarbonylContact O-C 3.59Å; V81-I131 WeakPolarHBondContact O-CA 3.45Å; E82-I131 HydrophobicContact CB-CG1 4.46Å; E82-I131 HydrophobicContact CG-CG1 4.24Å; I116-I131 CarbonylContact C-O 3.57Å; I116-I131 WeakPolarHBondContact CA-O 3.45Å; K117-I131 PolarHBondContact N-O 2.75Å; K117-I131 PolarHBondContact O-N 2.77Å; V119-I131 HydrophobicContact CG2-CB 4.44Å; V119-I131 HydrophobicContact CG2-CD1 3.73Å; V119-I131 HydrophobicContact CG2-CG1 3.79Å; I131-W133 HydrophobicContact CB-CZ2 4.43Å; I131-W133 HydrophobicContact CG2-CH2 4.34Å; I131-W133 HydrophobicContact CG2-CZ2 3.82Å
132	G	98.4	Very high	96.7	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	144.1	174.2	0	0	0	0	0	111.2	T80 V81 E115	T80-G132 WeakPolarHBondContact CA-O 3.26Å; V81-G132 PolarHBondContact N-O 3.11Å; V81-G132 PolarHBondContact O-N 3.41Å; E115-G132 CarbonylContact O-C 3.54Å; E115-G132 VanDerWaalsContact O-CA 3.23Å; E115-G132 WeakPolarHBondContact O-CA 3.37Å
133	W	98.6	Very high	96.4	Very high	88 Å²	88	65.4 Å²	65.4	33%	0.333	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	132.1	175	-55.8	-88.9	0	0	0	109.5	P77 D79 R114 E115 K117 I131	P77-W133 HydrophobicContact CB-CB 3.82Å; D79-W133 WeakPolarHBondContact O-CA 3.39Å; R114-W133 WeakPolarHBondContact CB-O 3.23Å; R114-W133 PolarHBondContact N-O 3.26Å; E115-W133 HydrophobicContact CB-CE3 4.42Å; E115-W133 PolarHBondContact N-O 3.41Å; E115-W133 PolarHBondContact O-N 3.22Å; K117-W133 HydrophobicContact CB-CH2 3.72Å; K117-W133 HydrophobicContact CB-CZ3 3.71Å; I131-W133 HydrophobicContact CB-CZ2 4.43Å; I131-W133 HydrophobicContact CG2-CH2 4.34Å; I131-W133 HydrophobicContact CG2-CZ2 3.82Å
134	G	98.3	Very high	96.1	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-152.9	-172.6	0	0	0	0	0	112.2	E76 T78 D79 F111 V112	E76-G134 CarbonylContact O-C 3.49Å; E76-G134 VanDerWaalsContact O-CA 3.29Å; E76-G134 WeakPolarHBondContact O-CA 3.29Å; T78-G134 PolarHBondContact N-O 3.36Å; T78-G134 VanDerWaalsContact N-O 3.15Å; T78-G134 PolarHBondContact OG1-O 3.42Å; D79-G134 WeakPolarHBondContact CA-O 3.35Å; D79-G134 PolarHBondContact N-O 2.76Å; D79-G134 PolarHBondContact O-N 3.15Å; F111-G134 VanDerWaalsContact CE2-C 3.46Å; V112-G134 WeakPolarHBondContact O-CA 3.49Å
135	E	97.9	Very high	95.9	Very high	22 Å²	22	60.8 Å²	60.8	10%	0.103	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	176.4	-178.7	62.4	178.7	134.5	0	0	111.1	V75 E76 T78 V112 K141 H142	V75-E135 HydrophobicContact CG1-CG 3.92Å; E76-E135 VanDerWaalsContact CB-OE1 3.29Å; E76-E135 WeakPolarHBondContact CB-OE1 3.24Å; E76-E135 PolarHBondContact N-OE1 3.22Å; T78-E135 WeakPolarHBondContact OG1-CB 3.42Å; V112-E135 WeakPolarHBondContact CG1-O 3.32Å; V112-E135 PolarHBondContact N-O 3.31Å; V112-E135 PolarHBondContact O-N 2.83Å; E135-K141 WeakPolarHBondContact OE1-CE 3.12Å; E135-K141 IonicContact OE1-NZ 3.38Å; E135-K141 PolarHBondContact OE1-NZ 2.93Å; E135-K141 IonicContact OE2-NZ 3.98Å; E135-K141 PolarHBondContact OE2-NZ 3.38Å; E135-H142 IonicContact OE1-NE2 2.74Å; E135-H142 PolarHBondContact OE1-NE2 3.1Å
136	E	97.5	Very high	95.6	Very high	125 Å²	125	58.2 Å²	58.2	58%	0.584	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	134.6	172.2	-172.9	178.7	178.9	0	0	111.1	F110 S138 H142	F110-E136 HydrophobicContact CB-CG 4.04Å; E136-S138 PolarHBondContact O-N 3.25Å; E136-H142 PolarHBondContact O-CE1 3.24Å
137	F	94.9	Very high	95.3	Very high	42 Å²	42	61.9 Å²	61.9	18%	0.184	32%	0.324	C	S	.	.			trans	-67.1	129.2	179.3	-179.6	-94.4	0	0	0	111.6	T70 F105 F110 V112 L139 H142	T70-F137 HydrophobicContact CG2-CD2 4.41Å; T70-F137 HydrophobicContact CG2-CE2 4.15Å; F105-F137 HydrophobicContact CD2-CB 4.41Å; F105-F137 HydrophobicContact CE2-CB 3.75Å; F105-F137 HydrophobicContact CE2-CD1 4.35Å; F105-F137 AromaticContact CE2-CD2 3.99Å; F105-F137 HydrophobicContact CE2-CD2 3.99Å; F105-F137 AromaticContact CE2-CG 3.77Å; F105-F137 HydrophobicContact CE2-CG 3.77Å; F105-F137 HydrophobicContact CZ-CG 4.36Å; F110-F137 WeakPolarHBondContact O-CB 3.26Å; F110-F137 PolarHBondContact O-N 3.35Å; V112-F137 HydrophobicContact CB-CB 4.46Å; V112-F137 HydrophobicContact CG1-CB 4.09Å; V112-F137 HydrophobicContact CG1-CD2 4.22Å; F137-L139 HydrophobicContact CE1-CD2 3.8Å; F137-L139 HydrophobicContact CE1-CG 4.14Å; F137-L139 HydrophobicContact CZ-CD2 4.07Å; F137-H142 HydrophobicContact CD2-CB 3.87Å; F137-H142 AromaticContact CD2-ND1 3.56Å; F137-H142 HydrophobicContact CE2-CB 3.52Å; F137-H142 HydrophobicContact CZ-CB 4.27Å
138	S	93.1	Very high	95	Very high	45 Å²	45	57.3 Å²	57.3	32%	0.315	30%	0.304	S	S	.	.			trans	-133.8	124.8	177.5	175	0	0	0	0	111	E136 A140 K141 H142	E136-S138 PolarHBondContact O-N 3.25Å; S138-A140 PolarHBondContact O-N 3.22Å; S138-A140 VanDerWaalsContact O-N 3.08Å; S138-A140 PolarHBondContact OG-N 3.1Å; S138-K141 PolarHBondContact O-N 3.43Å; S138-H142 PolarHBondContact N-ND1 3.29Å; S138-H142 VanDerWaalsContact N-ND1 3.14Å; S138-H142 PolarHBondContact O-N 3.14Å
139	L	92.3	Very high	94.7	Very high	121 Å²	121	62.6 Å²	62.6	63%	0.634	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.7	174.2	-68.8	172.3	0	0	0	113.5	F137 Q144	F137-L139 HydrophobicContact CE1-CD2 3.8Å; F137-L139 HydrophobicContact CE1-CG 4.14Å; F137-L139 HydrophobicContact CZ-CD2 4.07Å; L139-Q144 HydrophobicContact CD2-CB 4.01Å; L139-Q144 HydrophobicContact CD2-CG 4.18Å
140	A	94.1	Very high	94.4	Very high	97 Å²	97	60.3 Å²	60.3	80%	0.802	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-26	176	0	0	0	0	0	112.7	S138	S138-A140 PolarHBondContact O-N 3.22Å; S138-A140 VanDerWaalsContact O-N 3.08Å; S138-A140 PolarHBondContact OG-N 3.1Å
141	K	92.6	Very high	94.3	Very high	86 Å²	86	60.8 Å²	60.8	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-44.8	-178.3	-68.6	-172.4	60.8	177.7	0	112.3	E76 E135 S138	E76-K141 IonicContact OE1-NZ 3.79Å; E76-K141 PolarHBondContact OE1-NZ 2.75Å; E135-K141 WeakPolarHBondContact OE1-CE 3.12Å; E135-K141 IonicContact OE1-NZ 3.38Å; E135-K141 PolarHBondContact OE1-NZ 2.93Å; E135-K141 IonicContact OE2-NZ 3.98Å; E135-K141 PolarHBondContact OE2-NZ 3.38Å; S138-K141 PolarHBondContact O-N 3.43Å
142	H	95.6	Very high	94.1	Very high	3 Å²	3	60.5 Å²	60.5	1%	0.014	33%	0.328	C	S	.	.	S	Bend	trans	-104.9	127.4	-167.3	-50.1	141.2	0	0	0	110.5	T70 E135 E136 F137 S138 Q144	T70-H142 WeakPolarHBondContact OG1-CB 3.47Å; E135-H142 IonicContact OE1-NE2 2.74Å; E135-H142 PolarHBondContact OE1-NE2 3.1Å; E136-H142 PolarHBondContact O-CE1 3.24Å; F137-H142 HydrophobicContact CD2-CB 3.87Å; F137-H142 AromaticContact CD2-ND1 3.56Å; F137-H142 HydrophobicContact CE2-CB 3.52Å; F137-H142 HydrophobicContact CZ-CB 4.27Å; S138-H142 PolarHBondContact N-ND1 3.29Å; S138-H142 VanDerWaalsContact N-ND1 3.14Å; S138-H142 PolarHBondContact O-N 3.14Å; H142-Q144 PolarHBondContact O-N 3.19Å
143	P	91.3	Very high	93.9	Very high	66 Å²	66	65.6 Å²	65.6	43%	0.429	35%	0.348	S	S	.	.			trans	-58.5	133.1	175.1	-23.4	33.8	0	0	0	111.5	T70 D71 T74 G145	T70-P143 VanDerWaalsContact CB-O 3.29Å; T70-P143 WeakPolarHBondContact CB-O 3.48Å; T70-P143 PolarHBondContact OG1-O 3.33Å; D71-P143 HydrophobicContact CB-CG 4.18Å; T74-P143 HydrophobicContact CG2-CG 4.31Å; P143-G145 PolarHBondContact O-N 3.39Å
144	Q	89.4	Confident	93.6	Very high	159 Å²	159	64.7 Å²	64.7	74%	0.743	36%	0.355	S	S	*	.			trans	-76.4	111.2	176.4	-170.7	175.8	-9.8	0	0	110	L139 H142	L139-Q144 HydrophobicContact CD2-CB 4.01Å; L139-Q144 HydrophobicContact CD2-CG 4.18Å; H142-Q144 PolarHBondContact O-N 3.19Å
145	G	91.6	Very high	93.2	Very high	36 Å²	36	67.2 Å²	67.2	37%	0.371	38%	0.376	S	S	.	.			trans	-85.5	-136.8	167.4	0	0	0	0	0	110.8	M69 P143	M69-G145 WeakPolarHBondContact O-CA 3.29Å; M69-G145 PolarHBondContact O-N 2.7Å; P143-G145 PolarHBondContact O-N 3.39Å
146	T	90.9	Very high	93.2	Very high	59 Å²	59	66.7 Å²	66.7	36%	0.362	37%	0.373	S	S	.	.			trans	-109	135.1	179	-53	0	0	0	0	110.3	Y68 M69 I172	Y68-T146 HydrophobicContact CE1-CG2 4.01Å; Y68-T146 PolarHBondContact O-N 3.18Å; M69-T146 WeakPolarHBondContact CA-O 3.46Å; T146-I172 HydrophobicContact CG2-CB 3.83Å; T146-I172 HydrophobicContact CG2-CD1 4.07Å; T146-I172 HydrophobicContact CG2-CG1 4.46Å; T146-I172 HydrophobicContact CG2-CG2 4.37Å
147	E	91.1	Very high	93.2	Very high	131 Å²	131	64.6 Å²	64.6	61%	0.612	36%	0.364	S	S	*	.			trans	-62	138.5	173.9	-174.4	176.4	-179.4	0	0	109.8	I172	E147-I172 VanDerWaalsContact O-CA 3.26Å; E147-I172 WeakPolarHBondContact O-CA 3.29Å; E147-I172 WeakPolarHBondContact O-CB 3.48Å; E147-I172 VanDerWaalsContact O-OXT 3.13Å
148	V	93.4	Very high	93.3	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.006	36%	0.363	C	S	.	.			trans	-104	124.8	169.3	-178.1	0	0	0	0	106.9	M65 M69 L102 I170 D171 I172	M65-V148 HydrophobicContact CG-CG1 4.41Å; M65-V148 HydrophobicContact CG-CG2 4.27Å; M69-V148 HydrophobicContact CE-CB 3.5Å; M69-V148 HydrophobicContact CE-CG1 4.44Å; M69-V148 HydrophobicContact CE-CG2 3.61Å; M69-V148 HydrophobicContact CG-CG2 3.8Å; L102-V148 HydrophobicContact CD1-CB 4.24Å; L102-V148 HydrophobicContact CD1-CG1 4.45Å; L102-V148 HydrophobicContact CD2-CG1 4.39Å; V148-I170 HydrophobicContact CB-CD1 4.43Å; V148-I170 HydrophobicContact CG1-CB 3.88Å; V148-I170 HydrophobicContact CG1-CD1 3.85Å; V148-I170 HydrophobicContact CG1-CG1 4.4Å; V148-I170 HydrophobicContact CG1-CG2 4.34Å; V148-I170 HydrophobicContact CG2-CD1 3.7Å; V148-D171 CarbonylContact C-O 3.07Å; V148-I172 HydrophobicContact CG2-CG2 4.25Å
149	K	91.9	Very high	93.5	Very high	116 Å²	116	65.4 Å²	65.4	50%	0.504	36%	0.363	S	S	.	.			trans	-90.2	-40.6	-176.5	-65.6	177.2	-174.4	131.5	0	112.6	D171 I172	K149-D171 HydrophobicContact CB-CB 4.44Å; K149-D171 PolarHBondContact N-O 3.06Å; K149-I172 WeakPolarHBondContact CE-OXT 3.45Å; K149-I172 PolarHBondContact NZ-O 3.41Å; K149-I172 PolarHBondContact NZ-OXT 2.74Å
150	A	93.1	Very high	93.5	Very high	34 Å²	34	62.6 Å²	62.6	28%	0.281	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	155.7	-174.6	0	0	0	0	0	112.8	I170 D171	A150-I170 CarbonylContact O-C 3.57Å; A150-I170 WeakPolarHBondContact O-CA 3.35Å; A150-D171 HydrophobicContact CB-CB 4.27Å; A150-D171 PolarHBondContact N-O 3.14Å; A150-D171 PolarHBondContact O-N 3.33Å
151	I	96	Very high	93.2	Very high	9 Å²	9	65.5 Å²	65.5	5%	0.046	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	146.4	165.9	-44.1	-55.1	0	0	0	108.4	M65 F95 L98 D99 L102 M156 I170	M65-I151 HydrophobicContact SD-CD1 3.58Å; M65-I151 VanDerWaalsContact SD-CD1 3.58Å; F95-I151 HydrophobicContact CD2-CB 4.12Å; F95-I151 HydrophobicContact CD2-CG2 3.94Å; F95-I151 HydrophobicContact CE2-CB 4.01Å; F95-I151 HydrophobicContact CE2-CG2 4.31Å; F95-I151 VanDerWaalsContact CE2-O 3.26Å; F95-I151 WeakPolarHBondContact CE2-O 3.44Å; L98-I151 HydrophobicContact CB-CD1 3.8Å; L98-I151 HydrophobicContact CB-CG1 3.76Å; L98-I151 HydrophobicContact CB-CG2 4.18Å; L98-I151 HydrophobicContact CD1-CG2 3.96Å; D99-I151 HydrophobicContact CB-CG1 4.28Å; L102-I151 HydrophobicContact CD2-CD1 4.25Å; L102-I151 HydrophobicContact CD2-CG1 4.47Å; I151-M156 HydrophobicContact CG2-CE 4.42Å; I151-I170 HydrophobicContact CD1-CG2 3.68Å
152	T	94.1	Very high	92.9	Very high	31 Å²	31	68.2 Å²	68.2	19%	0.19	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.3	178.1	82.4	0	0	0	0	111.4	S154 M156 I169	T152-S154 PolarHBondContact O-N 2.92Å; T152-S154 WeakPolarHBondContact OG1-CB 3.34Å; T152-S154 PolarHBondContact OG1-N 2.87Å; T152-M156 WeakPolarHBondContact O-CE 3.49Å; T152-I169 WeakPolarHBondContact CB-O 3.44Å; T152-I169 PolarHBondContact N-O 3.39Å; T152-I169 WeakPolarHBondContact OG1-CB 3.23Å; T152-I169 PolarHBondContact OG1-O 2.94Å
153	Y	94.1	Very high	92.7	Very high	107 Å²	107	74.6 Å²	74.6	42%	0.42	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-1.9	167.6	-73.2	-81.7	0	0	0	112.9	S92 F95 A155 M156	S92-Y153 WeakPolarHBondContact CA-OH 3.23Å; F95-Y153 HydrophobicContact CB-CE1 3.81Å; F95-Y153 HydrophobicContact CB-CE2 4.18Å; F95-Y153 WeakPolarHBondContact CB-OH 3.5Å; F95-Y153 HydrophobicContact CD1-CE2 4.05Å; F95-Y153 AromaticContact CD2-CD2 3.71Å; F95-Y153 HydrophobicContact CD2-CD2 3.71Å; F95-Y153 HydrophobicContact CD2-CE1 4.23Å; F95-Y153 AromaticContact CD2-CE2 3.34Å; F95-Y153 HydrophobicContact CD2-CE2 3.34Å; F95-Y153 HydrophobicContact CD2-CG 4.3Å; F95-Y153 AromaticContact CD2-CZ 3.64Å; F95-Y153 HydrophobicContact CE1-CE2 4.34Å; F95-Y153 AromaticContact CE2-CD2 3.9Å; F95-Y153 HydrophobicContact CE2-CD2 3.9Å; F95-Y153 AromaticContact CE2-CE2 3.63Å; F95-Y153 HydrophobicContact CE2-CE2 3.63Å; F95-Y153 HydrophobicContact CG-CD2 4.38Å; F95-Y153 HydrophobicContact CG-CE1 4.14Å; F95-Y153 AromaticContact CG-CE2 3.58Å; F95-Y153 HydrophobicContact CG-CE2 3.58Å; F95-Y153 AromaticContact CG-CZ 3.44Å; F95-Y153 VanDerWaalsContact CG-CZ 3.44Å; F95-Y153 WeakPolarHBondContact CG-OH 3.44Å; F95-Y153 HydrophobicContact CZ-CE2 4.15Å; Y153-A155 PolarHBondContact O-N 2.82Å; Y153-A155 VanDerWaalsContact O-N 3.14Å; Y153-M156 HydrophobicContact CD1-CE 4.35Å; Y153-M156 HydrophobicContact CD1-SD 4.13Å; Y153-M156 HydrophobicContact CE1-SD 4.42Å; Y153-M156 PolarHBondContact O-N 3.35Å
154	S	92.3	Very high	93	Very high	68 Å²	68	71.7 Å²	71.7	48%	0.476	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	118.4	-175.9	-169.6	0	0	0	0	110.2	T152 M156 I169	T152-S154 PolarHBondContact O-N 2.92Å; T152-S154 WeakPolarHBondContact OG1-CB 3.34Å; T152-S154 PolarHBondContact OG1-N 2.87Å; S154-M156 PolarHBondContact O-N 3.35Å; S154-I169 WeakPolarHBondContact O-CB 3.5Å; S154-I169 WeakPolarHBondContact O-CD1 3.28Å; S154-I169 VanDerWaalsContact O-CG1 3.31Å; S154-I169 WeakPolarHBondContact O-CG1 3.38Å
155	A	90.9	Very high	93.3	Very high	53 Å²	53	67.5 Å²	67.5	44%	0.438	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.6	30.2	-177.8	0	0	0	0	0	114.3	Y153 I169	Y153-A155 PolarHBondContact O-N 2.82Å; Y153-A155 VanDerWaalsContact O-N 3.14Å; A155-I169 HydrophobicContact CB-CD1 3.98Å
156	M	96.9	Very high	93.7	Very high	11 Å²	11	65.8 Å²	65.8	5%	0.054	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134	173.7	-174.9	176.4	-72.1	0	0	109.6	E91 L94 F95 I151 T152 Y153 S154 F167	E91-M156 HydrophobicContact CB-SD 3.89Å; E91-M156 HydrophobicContact CG-CG 4.48Å; E91-M156 HydrophobicContact CG-SD 4.36Å; E91-M156 VanDerWaalsContact O-SD 3.32Å; L94-M156 HydrophobicContact CB-SD 4.38Å; L94-M156 HydrophobicContact CD2-CE 4.34Å; L94-M156 HydrophobicContact CD2-CG 4.09Å; L94-M156 HydrophobicContact CD2-SD 3.93Å; L94-M156 HydrophobicContact CG-SD 4.4Å; F95-M156 HydrophobicContact CB-CE 4.16Å; F95-M156 HydrophobicContact CD2-CE 4.42Å; I151-M156 HydrophobicContact CG2-CE 4.42Å; T152-M156 WeakPolarHBondContact O-CE 3.49Å; Y153-M156 HydrophobicContact CD1-CE 4.35Å; Y153-M156 HydrophobicContact CD1-SD 4.13Å; Y153-M156 HydrophobicContact CE1-SD 4.42Å; Y153-M156 PolarHBondContact O-N 3.35Å; S154-M156 PolarHBondContact O-N 3.35Å; M156-F167 CarbonylContact C-O 3.6Å; M156-F167 VanDerWaalsContact CA-O 3.3Å; M156-F167 WeakPolarHBondContact CA-O 3.48Å
157	Q	97.3	Very high	94	Very high	82 Å²	82	64.9 Å²	64.9	38%	0.383	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	136.7	-179.3	-59.3	177.2	6.9	0	0	110.7	H159 I166 F167	Q157-H159 PolarHBondContact OE1-NE2 2.88Å; Q157-I166 CarbonylContact O-C 3.59Å; Q157-I166 WeakPolarHBondContact O-CA 3.47Å; Q157-F167 HydrophobicContact CB-CB 4.22Å; Q157-F167 HydrophobicContact CB-CD2 4.1Å; Q157-F167 PolarHBondContact N-O 2.93Å; Q157-F167 PolarHBondContact O-N 3.27Å
158	I	97.4	Very high	94.3	Very high	35 Å²	35	58.6 Å²	58.6	18%	0.179	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.4	173.1	-57.9	173.7	0	0	0	108.2	L54 F58 M90 E91 L94 I166	L54-I158 HydrophobicContact CD1-CG2 3.92Å; F58-I158 HydrophobicContact CE2-CD1 4.32Å; F58-I158 HydrophobicContact CZ-CD1 4.06Å; M90-I158 VanDerWaalsContact C-CD1 3.48Å; M90-I158 HydrophobicContact CB-CD1 3.81Å; M90-I158 WeakPolarHBondContact O-CD1 3.25Å; E91-I158 HydrophobicContact CG-CD1 4.35Å; L94-I158 HydrophobicContact CB-CD1 4.01Å; L94-I158 HydrophobicContact CD2-CD1 4.04Å; L94-I158 HydrophobicContact CD2-CG1 4.04Å; I158-I166 HydrophobicContact CG1-CG1 4.3Å; I158-I166 HydrophobicContact CG2-CG1 4.35Å
159	H	96.6	Very high	94.4	Very high	68 Å²	68	59.7 Å²	59.7	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	84.5	178.9	-62.4	-78.3	0	0	0	110	Q157 K161 P164 E165 F167	Q157-H159 PolarHBondContact OE1-NE2 2.88Å; H159-K161 PolarHBondContact O-N 3.48Å; H159-K161 VanDerWaalsContact O-N 3.09Å; H159-P164 VanDerWaalsContact O-CA 3.3Å; H159-P164 WeakPolarHBondContact O-CA 3.43Å; H159-E165 HydrophobicContact CB-CB 4.38Å; H159-E165 PolarHBondContact N-O 2.98Å; H159-E165 PolarHBondContact O-N 3.03Å; H159-E165 VanDerWaalsContact O-N 3.13Å; H159-F167 AromaticContact CD2-CD2 3.8Å; H159-F167 AromaticContact CD2-CE2 3.61Å; H159-F167 AromaticContact NE2-CD2 3.98Å; H159-F167 AromaticContact NE2-CE2 3.9Å
160	D	92.3	Very high	94.5	Very high	63 Å²	63	54.1 Å²	54.1	34%	0.337	28%	0.282	S	S	.	.			trans	-82.5	84	178.5	-177	28.4	0	0	0	111.5	L54 R123	L54-D160 HydrophobicContact CD1-CB 4.41Å; R123-D160 IonicContact CZ-OD2 2.82Å; R123-D160 IonicContact NH1-OD2 2.7Å; R123-D160 PolarHBondContact NH1-OD2 2.91Å; R123-D160 IonicContact NH2-OD2 2.65Å; R123-D160 PolarHBondContact NH2-OD2 3.18Å
161	K	87.9	Confident	94.5	Very high	157 Å²	157	54.9 Å²	54.9	68%	0.683	28%	0.281	S	S	*	.	S	Bend	trans	-123.6	-158.3	176.8	-65.1	-179.4	-176	164.9	0	110	H159 K163 P164	H159-K161 PolarHBondContact O-N 3.48Å; H159-K161 VanDerWaalsContact O-N 3.09Å; K161-K163 PolarHBondContact O-N 3.22Å; K161-K163 VanDerWaalsContact O-N 3.12Å; K161-P164 WeakPolarHBondContact O-CD 3.23Å
162	V	86.6	Confident	94.2	Very high	143 Å²	143	56.3 Å²	56.3	87%	0.867	29%	0.289	S	S	*	.	S	Bend	trans	-56.2	-29.6	-179.3	-177.8	0	0	0	0	112.8
163	K	91.5	Very high	94.2	Very high	137 Å²	137	57.6 Å²	57.6	60%	0.596	29%	0.294	S	S	*	.	S	Bend	trans	-128.2	103.9	168.1	-68.7	-169.2	171.7	-159.4	0	107.3	K161	K161-K163 PolarHBondContact O-N 3.22Å; K161-K163 VanDerWaalsContact O-N 3.12Å
164	P	96.7	Very high	94.2	Very high	5 Å²	5	55 Å²	55	3%	0.032	29%	0.287	C	S	.	.			trans	-62.5	137	179.3	-29.6	40.3	0	0	0	111.9	W50 G51 L54 A57 H159 K161	W50-P164 VanDerWaalsContact CA-O 3.25Å; W50-P164 WeakPolarHBondContact CA-O 3.4Å; G51-P164 PolarHBondContact N-O 3.39Å; G51-P164 VanDerWaalsContact N-O 3.12Å; G51-P164 WeakPolarHBondContact O-CD 3.47Å; L54-P164 HydrophobicContact CB-CB 4.39Å; L54-P164 HydrophobicContact CB-CG 4.38Å; L54-P164 HydrophobicContact CD1-CB 4.07Å; A57-P164 HydrophobicContact CB-CB 4.05Å; H159-P164 VanDerWaalsContact O-CA 3.3Å; H159-P164 WeakPolarHBondContact O-CA 3.43Å; K161-P164 WeakPolarHBondContact O-CD 3.23Å
165	E	97.8	Very high	94.3	Very high	71 Å²	71	54.3 Å²	54.3	33%	0.332	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.8	178.3	-58.5	-178.3	-149	0	0	110.5	H48 S49 W50 H159 F167	H48-E165 IonicContact CE1-OE2 2.68Å; H48-E165 IonicContact NE2-OE2 3.65Å; H48-E165 PolarHBondContact NE2-OE2 3.35Å; S49-E165 CarbonylContact O-C 3.55Å; S49-E165 VanDerWaalsContact O-CA 3.31Å; S49-E165 WeakPolarHBondContact O-CA 3.3Å; W50-E165 HydrophobicContact CB-CG 3.99Å; H159-E165 HydrophobicContact CB-CB 4.38Å; H159-E165 PolarHBondContact N-O 2.98Å; H159-E165 PolarHBondContact O-N 3.03Å; H159-E165 VanDerWaalsContact O-N 3.13Å; E165-F167 HydrophobicContact CB-CE2 4.38Å
166	I	98.3	Very high	94.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138	-179.3	-64.9	176.8	0	0	0	109.8	H48 S49 A57 F58 C61 L94 Q157 I158	H48-I166 WeakPolarHBondContact CA-O 3.31Å; H48-I166 PolarHBondContact CD2-O 3.35Å; S49-I166 PolarHBondContact N-O 3.3Å; S49-I166 PolarHBondContact O-N 3.42Å; A57-I166 HydrophobicContact CB-CD1 3.95Å; A57-I166 HydrophobicContact CB-CG1 4.13Å; F58-I166 HydrophobicContact CD2-CD1 3.28Å; F58-I166 HydrophobicContact CE2-CD1 3.52Å; F58-I166 HydrophobicContact CG-CD1 4Å; F58-I166 HydrophobicContact CZ-CD1 4.43Å; C61-I166 HydrophobicContact CB-CG2 4.45Å; L94-I166 HydrophobicContact CD1-CD1 4.19Å; L94-I166 HydrophobicContact CD1-CG2 4.28Å; L94-I166 HydrophobicContact CD2-CD1 4.41Å; L94-I166 HydrophobicContact CD2-CG2 3.31Å; L94-I166 HydrophobicContact CG-CG2 4.43Å; Q157-I166 CarbonylContact O-C 3.59Å; Q157-I166 WeakPolarHBondContact O-CA 3.47Å; I158-I166 HydrophobicContact CG1-CG1 4.3Å; I158-I166 HydrophobicContact CG2-CG1 4.35Å
167	F	97.8	Very high	94.4	Very high	40 Å²	40	57.1 Å²	57.1	18%	0.175	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.4	170.1	-58.3	-97.3	0	0	0	108.2	I47 H48 M156 Q157 H159 E165	I47-F167 CarbonylContact O-C 3.59Å; I47-F167 VanDerWaalsContact O-CA 3.32Å; I47-F167 WeakPolarHBondContact O-CA 3.38Å; H48-F167 HydrophobicContact CB-CD1 3.94Å; H48-F167 HydrophobicContact CB-CE1 3.91Å; H48-F167 AromaticContact CD2-CD1 3.8Å; H48-F167 AromaticContact CD2-CE1 3.29Å; H48-F167 WeakPolarHBondContact CD2-CE1 3.47Å; H48-F167 AromaticContact CD2-CE2 3.85Å; H48-F167 AromaticContact CD2-CZ 3.32Å; H48-F167 WeakPolarHBondContact CD2-CZ 2.79Å; H48-F167 AromaticContact CE1-CZ 3.95Å; H48-F167 AromaticContact CG-CD1 3.96Å; H48-F167 AromaticContact CG-CE1 3.47Å; H48-F167 VanDerWaalsContact CG-CE1 3.47Å; H48-F167 AromaticContact CG-CZ 3.94Å; H48-F167 AromaticContact ND1-CE1 3.97Å; H48-F167 AromaticContact NE2-CE1 3.7Å; H48-F167 AromaticContact NE2-CE2 3.97Å; H48-F167 AromaticContact NE2-CZ 3.33Å; H48-F167 VanDerWaalsContact NE2-CZ 3.33Å; H48-F167 WeakPolarHBondContact NE2-CZ 3.47Å; M156-F167 CarbonylContact C-O 3.6Å; M156-F167 VanDerWaalsContact CA-O 3.3Å; M156-F167 WeakPolarHBondContact CA-O 3.48Å; Q157-F167 HydrophobicContact CB-CB 4.22Å; Q157-F167 HydrophobicContact CB-CD2 4.1Å; Q157-F167 PolarHBondContact N-O 2.93Å; Q157-F167 PolarHBondContact O-N 3.27Å; H159-F167 AromaticContact CD2-CD2 3.8Å; H159-F167 AromaticContact CD2-CE2 3.61Å; H159-F167 AromaticContact NE2-CD2 3.98Å; H159-F167 AromaticContact NE2-CE2 3.9Å; E165-F167 HydrophobicContact CB-CE2 4.38Å
168	A	97	Very high	94.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	138	179.1	0	0	0	0	0	110.2	Q46 I47 L98	Q46-A168 CarbonylContact C-O 3.59Å; Q46-A168 WeakPolarHBondContact CA-O 3.28Å; I47-A168 PolarHBondContact N-O 3.01Å; I47-A168 PolarHBondContact O-N 2.7Å; L98-A168 HydrophobicContact CD1-CB 4.19Å
169	I	95.6	Very high	93.9	Very high	23 Å²	23	56.9 Å²	56.9	12%	0.118	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.6	174.7	-65.4	-177	0	0	0	109.5	D44 V45 Q46 T152 S154 A155	D44-I169 HydrophobicContact CB-CG2 3.7Å; V45-I169 CarbonylContact O-C 3.55Å; V45-I169 VanDerWaalsContact O-CA 3.31Å; V45-I169 WeakPolarHBondContact O-CA 3.25Å; Q46-I169 HydrophobicContact CB-CG1 3.98Å; Q46-I169 HydrophobicContact CG-CG1 4.02Å; T152-I169 WeakPolarHBondContact CB-O 3.44Å; T152-I169 PolarHBondContact N-O 3.39Å; T152-I169 WeakPolarHBondContact OG1-CB 3.23Å; T152-I169 PolarHBondContact OG1-O 2.94Å; S154-I169 WeakPolarHBondContact O-CB 3.5Å; S154-I169 WeakPolarHBondContact O-CD1 3.28Å; S154-I169 VanDerWaalsContact O-CG1 3.31Å; S154-I169 WeakPolarHBondContact O-CG1 3.38Å; A155-I169 HydrophobicContact CB-CD1 3.98Å
170	I	94.3	Very high	93.7	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.6	176.4	57.5	162.9	0	0	0	110.7	D44 V45 I47 V148 A150 I151 I172	D44-I170 CarbonylContact C-O 3.58Å; D44-I170 VanDerWaalsContact CA-O 3.23Å; D44-I170 WeakPolarHBondContact CA-O 3.3Å; V45-I170 HydrophobicContact CB-CD1 4.47Å; V45-I170 HydrophobicContact CB-CG1 4.04Å; V45-I170 HydrophobicContact CG1-CD1 4.39Å; V45-I170 HydrophobicContact CG1-CG1 4.23Å; V45-I170 PolarHBondContact N-O 3.23Å; V45-I170 WeakPolarHBondContact O-CG1 3.41Å; V45-I170 PolarHBondContact O-N 3.14Å; I47-I170 HydrophobicContact CD1-CD1 3.86Å; I47-I170 HydrophobicContact CD1-CG1 4.2Å; I47-I170 HydrophobicContact CD1-CG2 4.02Å; I47-I170 HydrophobicContact CG1-CD1 4.36Å; I47-I170 HydrophobicContact CG1-CG1 4.47Å; V148-I170 HydrophobicContact CB-CD1 4.43Å; V148-I170 HydrophobicContact CG1-CB 3.88Å; V148-I170 HydrophobicContact CG1-CD1 3.85Å; V148-I170 HydrophobicContact CG1-CG1 4.4Å; V148-I170 HydrophobicContact CG1-CG2 4.34Å; V148-I170 HydrophobicContact CG2-CD1 3.7Å; A150-I170 CarbonylContact O-C 3.57Å; A150-I170 WeakPolarHBondContact O-CA 3.35Å; I151-I170 HydrophobicContact CD1-CG2 3.68Å; I170-I172 HydrophobicContact CD1-CG2 4.14Å; I170-I172 HydrophobicContact CG1-CG2 4.43Å
171	D	93.3	Very high	93.9	Very high	50 Å²	50	55.4 Å²	55.4	27%	0.267	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135	172.3	-177.7	5.3	0	0	0	109	A43 V148 K149 A150	A43-D171 CarbonylContact O-C 3.51Å; A43-D171 WeakPolarHBondContact O-CA 3.33Å; V148-D171 CarbonylContact C-O 3.07Å; K149-D171 HydrophobicContact CB-CB 4.44Å; K149-D171 PolarHBondContact N-O 3.06Å; A150-D171 HydrophobicContact CB-CB 4.27Å; A150-D171 PolarHBondContact N-O 3.14Å; A150-D171 PolarHBondContact O-N 3.33Å
172	I	89.8	Confident	94.4	Very high	39 Å²	39	46.2 Å²	46.2	20%	0.2	24%	0.235	C	C	.	.			trans	-124	0	-173.6	55.4	161	0	0	0	112.3	A43 V45 Y68 T146 E147 V148 K149 I170	A43-I172 HydrophobicContact CB-CG1 4.31Å; A43-I172 WeakPolarHBondContact CB-O 3.32Å; A43-I172 WeakPolarHBondContact O-CG1 3.16Å; A43-I172 PolarHBondContact O-N 3.16Å; V45-I172 HydrophobicContact CG2-CD1 3.87Å; Y68-I172 HydrophobicContact CD1-CG2 4.05Å; Y68-I172 HydrophobicContact CE1-CD1 3.97Å; Y68-I172 HydrophobicContact CE1-CG2 3.83Å; T146-I172 HydrophobicContact CG2-CB 3.83Å; T146-I172 HydrophobicContact CG2-CD1 4.07Å; T146-I172 HydrophobicContact CG2-CG1 4.46Å; T146-I172 HydrophobicContact CG2-CG2 4.37Å; E147-I172 VanDerWaalsContact O-CA 3.26Å; E147-I172 WeakPolarHBondContact O-CA 3.29Å; E147-I172 WeakPolarHBondContact O-CB 3.48Å; E147-I172 VanDerWaalsContact O-OXT 3.13Å; V148-I172 HydrophobicContact CG2-CG2 4.25Å; K149-I172 WeakPolarHBondContact CE-OXT 3.45Å; K149-I172 PolarHBondContact NZ-O 3.41Å; K149-I172 PolarHBondContact NZ-OXT 2.74Å; I170-I172 HydrophobicContact CD1-CG2 4.14Å; I170-I172 HydrophobicContact CG1-CG2 4.43Å

Retrieved 172 of 172 residues in 123.3 ms (Link to these results)

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