A0A087YII9_POEFO Loading...

Small ubiquitin-related modifier

Ubiquitin-like protein that can be covalently attached to proteins as a monomer or a lysine-linked polymer. Covalent attachment via an isopeptide bond to its substrates requires prior activation by the E1 complex sae1-sae2 and linkage to the E2 enzyme ube2i. This post-translational modification on lysine residues of proteins plays a crucial role in a number of cellular processes such as nuclear transport, DNA replication and repair, mitosis and signal transduction. Polymeric sumo1 chains are also susceptible to polyubiquitination which functions as a signal for proteasomal degradation of modified proteins.

AlphaFold DB (A0A3B3VX47), UniProt , Accession A0A087YII9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 101 aa.

						>A0A087YII9_POEFO|A0A087YII9
MSDTETKPSGQDGGDKKDGEYIKLKVIGQDSSEIHFKVKMTTHLKKLKESYSQRQGVPASTLRFLFEGQRIADNQTPKELGMEDEDVIEVYQEQTGGLWTD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.9	Very low	50.6	Low	227 Å²	227	147.8 Å²	147.8	100%	1.118	84%	0.836	S	S	*	*				0	110.7	0	-67.5	170.9	176.3	0	0	104.5
2	S	52.8	Low	52	Low	120 Å²	120	148.4 Å²	148.4	84%	0.839	84%	0.835	S	S	*	*			trans	-102.8	83	-169.6	-57.5	0	0	0	0	108.5	T4	S2-T4 PolarHBondContact O-N 3.03Å
3	D	51.1	Low	51.7	Low	152 Å²	152	141.7 Å²	141.7	81%	0.813	82%	0.819	S	S	*	*			trans	-87.5	98.1	175	-62.1	-93.9	0	0	0	107.3
4	T	53	Low	52.4	Low	139 Å²	139	135.4 Å²	135.4	85%	0.853	80%	0.8	S	S	*	*			trans	-94.5	103.4	173.1	-27.6	0	0	0	0	107.5	S2	S2-T4 PolarHBondContact O-N 3.03Å
5	E	49.1	Very low	52.1	Low	188 Å²	188	133.5 Å²	133.5	88%	0.879	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-60.5	134.8	-175.5	-167.4	168.9	74.2	0	0	112.6
6	T	49.2	Very low	51.9	Low	127 Å²	127	135.4 Å²	135.4	78%	0.779	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-47.7	129.1	178.2	-55.1	0	0	0	0	113.6
7	K	56.9	Low	51.9	Low	183 Å²	183	137.4 Å²	137.4	80%	0.796	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-51.1	124.6	169.9	-76.9	176.2	172.1	173.3	0	111.3	S9	K7-S9 PolarHBondContact O-N 3.2Å
8	P	52.2	Low	51.9	Low	128 Å²	128	137.5 Å²	137.5	83%	0.831	78%	0.776	S	S	*	*			trans	-82	101.2	166.1	31.9	-27.6	0	0	0	108.2	G10	P8-G10 VanDerWaalsContact C-N 3.35Å; P8-G10 PolarHBondContact O-N 3.41Å
9	S	47.4	Very low	52.2	Low	104 Å²	104	134.5 Å²	134.5	73%	0.727	78%	0.779	S	S	*	*			trans	-95.8	70.7	166.4	-62.2	0	0	0	0	109.1	K7	K7-S9 PolarHBondContact O-N 3.2Å
10	G	61.1	Low	53.5	Low	63 Å²	63	131.8 Å²	131.8	65%	0.649	76%	0.759	S	S	*	*			trans	-103.6	111.2	167.1	0	0	0	0	0	109.7	P8	P8-G10 VanDerWaalsContact C-N 3.35Å; P8-G10 PolarHBondContact O-N 3.41Å
11	Q	44.4	Very low	55.1	Low	195 Å²	195	130.1 Å²	130.1	91%	0.911	74%	0.74	S	S	*	*			trans	-162.3	103.3	133.8	-121.3	172.5	-44.7	0	0	111.3	G13	Q11-G13 PolarHBondContact O-N 3.34Å
12	D	66.8	Low	57.6	Low	155 Å²	155	119.9 Å²	119.9	83%	0.829	69%	0.69	S	S	*	*			trans	-49.7	119.5	153.4	-172.3	-103.9	0	0	0	109.7
13	G	48.2	Very low	59.4	Low	61 Å²	61	119.4 Å²	119.4	63%	0.629	67%	0.673	S	S	*	*			trans	-125.7	88	174.8	0	0	0	0	0	108.6	Q11	Q11-G13 PolarHBondContact O-N 3.34Å
14	G	61.5	Low	61.4	Low	53 Å²	53	112.2 Å²	112.2	55%	0.546	63%	0.634	S	S	.	*			trans	-61.6	144.8	174.2	0	0	0	0	0	112.3
15	D	47.7	Very low	63.4	Low	108 Å²	108	107.9 Å²	107.9	58%	0.578	60%	0.604	S	S	*	*			trans	-176.4	105.8	141.5	-106.5	-66.2	0	0	0	109.9
16	K	48.7	Very low	65.5	Low	163 Å²	163	98.9 Å²	98.9	71%	0.709	56%	0.562	S	S	*	*	S	Bend	trans	53.3	110	141.2	-59	-179.7	-174.3	99.1	0	118.2
17	K	51.8	Low	67.5	Low	170 Å²	170	95.7 Å²	95.7	74%	0.739	54%	0.539	S	S	*	.			trans	94.2	56.9	176.1	-57.7	-173.3	-178.6	177.3	0	114.2	G19 E20 Y21	K17-G19 PolarHBondContact O-N 2.71Å; K17-E20 PolarHBondContact O-N 2.99Å; K17-Y21 WeakPolarHBondContact O-CD2 3.25Å
18	D	52.4	Low	69	Low	139 Å²	139	87.3 Å²	87.3	74%	0.743	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-12.4	173.8	-80.1	-101.2	0	0	0	116.1	E20	D18-E20 VanDerWaalsContact C-N 3.29Å; D18-E20 PolarHBondContact O-N 3.39Å
19	G	57	Low	70.6	Confident	80 Å²	80	87 Å²	87	83%	0.825	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.5	178.1	0	0	0	0	0	115.6	K17	K17-G19 PolarHBondContact O-N 2.71Å
20	E	79.9	Confident	72.2	Confident	81 Å²	81	88.5 Å²	88.5	38%	0.379	49%	0.493	S	S	.	.	S	Bend	trans	-135.6	-2.9	-171	-148.5	158.6	52.6	0	0	115.5	K17 D18 K39 M40	K17-E20 PolarHBondContact O-N 2.99Å; D18-E20 VanDerWaalsContact C-N 3.29Å; D18-E20 PolarHBondContact O-N 3.39Å; E20-K39 HydrophobicContact CB-CG 4.38Å; E20-K39 HydrophobicContact CG-CD 4.38Å; E20-K39 HydrophobicContact CG-CG 3.96Å; E20-K39 CarbonylContact O-C 3.51Å; E20-K39 VanDerWaalsContact O-CA 3.32Å; E20-K39 WeakPolarHBondContact O-CA 3.46Å; E20-K39 VanDerWaalsContact O-CG 3.23Å; E20-K39 WeakPolarHBondContact O-CG 3.43Å; E20-K39 WeakPolarHBondContact OE1-CE 3.49Å; E20-K39 IonicContact OE1-NZ 3.97Å; E20-K39 PolarHBondContact OE1-NZ 3.1Å; E20-M40 PolarHBondContact O-N 3.21Å
21	Y	87.1	Confident	73	Confident	96 Å²	96	90.6 Å²	90.6	38%	0.376	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.2	176.4	-59.1	-91	0	0	0	110.6	K17 V38 K39	K17-Y21 WeakPolarHBondContact O-CD2 3.25Å; Y21-V38 CarbonylContact C-O 3.6Å; Y21-V38 VanDerWaalsContact CA-O 3.26Å; Y21-V38 WeakPolarHBondContact CA-O 3.28Å; Y21-K39 HydrophobicContact CD1-CB 3.75Å; Y21-K39 HydrophobicContact CD1-CG 4.15Å; Y21-K39 HydrophobicContact CE1-CB 3.71Å; Y21-K39 HydrophobicContact CE1-CD 4.3Å; Y21-K39 HydrophobicContact CE1-CG 3.98Å
22	I	91	Very high	74.8	Confident	13 Å²	13	83.2 Å²	83.2	7%	0.067	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.7	174.7	62	172.9	0	0	0	109.3	L24 V38 M40 P77 M82	I22-L24 HydrophobicContact CD1-CD1 4.37Å; I22-L24 HydrophobicContact CD1-CD2 3.78Å; I22-L24 HydrophobicContact CD1-CG 4.15Å; I22-L24 HydrophobicContact CG1-CD2 4.32Å; I22-L24 HydrophobicContact CG1-CG 4.28Å; I22-V38 HydrophobicContact CG1-CG2 3.98Å; I22-V38 PolarHBondContact N-O 3.36Å; I22-V38 PolarHBondContact O-N 3.28Å; I22-M40 HydrophobicContact CG2-CE 4.29Å; I22-M40 HydrophobicContact CG2-CG 3.84Å; I22-M40 HydrophobicContact CG2-SD 4.38Å; I22-P77 HydrophobicContact CD1-CB 3.44Å; I22-P77 VanDerWaalsContact CD1-CB 3.44Å; I22-P77 HydrophobicContact CD1-CG 4.15Å; I22-P77 HydrophobicContact CG1-CB 4.44Å; I22-M82 HydrophobicContact CD1-CB 3.86Å
23	K	91.9	Very high	75.8	Confident	110 Å²	110	80.8 Å²	80.8	48%	0.478	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125	171.6	-61	171.2	-154.5	151.2	0	109	F36 D84 E85	K23-F36 CarbonylContact C-O 3.5Å; K23-F36 WeakPolarHBondContact CA-O 3.46Å; K23-D84 WeakPolarHBondContact CB-OD2 3.27Å; K23-D84 WeakPolarHBondContact CG-OD2 3.37Å; K23-D84 PolarHBondContact N-OD2 3.43Å; K23-D84 IonicContact NZ-OD1 3.05Å; K23-E85 WeakPolarHBondContact O-CA 3.37Å; K23-E85 PolarHBondContact O-N 3.39Å
24	L	92.9	Very high	77.8	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.6	175.1	-61	175.8	0	0	0	109.7	I22 H35 F36 V38 L44 L47 M82 D86 I88	I22-L24 HydrophobicContact CD1-CD1 4.37Å; I22-L24 HydrophobicContact CD1-CD2 3.78Å; I22-L24 HydrophobicContact CD1-CG 4.15Å; I22-L24 HydrophobicContact CG1-CD2 4.32Å; I22-L24 HydrophobicContact CG1-CG 4.28Å; L24-H35 WeakPolarHBondContact O-CA 3.43Å; L24-F36 PolarHBondContact N-O 3.15Å; L24-F36 PolarHBondContact O-N 2.77Å; L24-V38 HydrophobicContact CD1-CG2 3.47Å; L24-V38 VanDerWaalsContact CD1-CG2 3.47Å; L24-V38 HydrophobicContact CG-CG2 4.01Å; L24-L44 HydrophobicContact CD1-CD2 4.1Å; L24-L47 HydrophobicContact CB-CD1 4.44Å; L24-L47 HydrophobicContact CD1-CD1 4.03Å; L24-M82 HydrophobicContact CD1-SD 3.93Å; L24-M82 HydrophobicContact CD2-CB 4.18Å; L24-M82 HydrophobicContact CD2-SD 4.16Å; L24-D86 CarbonylContact C-O 3.52Å; L24-D86 HydrophobicContact CD2-CB 3.72Å; L24-I88 HydrophobicContact CB-CD1 4.39Å; L24-I88 HydrophobicContact CD1-CD1 3.88Å
25	K	93.8	Very high	79.2	Confident	48 Å²	48	80.5 Å²	80.5	21%	0.209	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.2	174.7	-69	173.4	-171.8	163.7	0	108.3	H35 E85 D86 V87 I88	K25-H35 VanDerWaalsContact CG-CD2 3.5Å; K25-H35 WeakPolarHBondContact CG-CD2 3.35Å; K25-E85 IonicContact NZ-OE1 3.54Å; K25-E85 PolarHBondContact NZ-OE1 3.16Å; K25-D86 PolarHBondContact N-O 3.43Å; K25-V87 HydrophobicContact CB-CG2 4.1Å; K25-V87 HydrophobicContact CD-CG2 4.31Å; K25-V87 CarbonylContact O-C 3.47Å; K25-V87 WeakPolarHBondContact O-CA 3.5Å; K25-I88 PolarHBondContact O-N 2.92Å
26	V	93	Very high	81.3	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	112.9	178.2	-173.4	0	0	0	0	108.4	E33 I34 F36 L47 Y51 F64 I88 V90	V26-E33 WeakPolarHBondContact O-CA 3.38Å; V26-I34 PolarHBondContact N-O 3.09Å; V26-I34 PolarHBondContact O-N 3.33Å; V26-F36 HydrophobicContact CB-CD2 4.2Å; V26-F36 HydrophobicContact CB-CE2 4.25Å; V26-F36 HydrophobicContact CG2-CD2 3.5Å; V26-F36 VanDerWaalsContact CG2-CD2 3.5Å; V26-F36 HydrophobicContact CG2-CE2 3.91Å; V26-L47 HydrophobicContact CG2-CD1 4.13Å; V26-L47 HydrophobicContact CG2-CD2 3.96Å; V26-L47 HydrophobicContact CG2-CG 4.34Å; V26-Y51 HydrophobicContact CB-CD2 4.21Å; V26-Y51 HydrophobicContact CB-CE2 4.31Å; V26-Y51 HydrophobicContact CG1-CD2 3.49Å; V26-Y51 VanDerWaalsContact CG1-CD2 3.49Å; V26-Y51 HydrophobicContact CG1-CE2 3.51Å; V26-Y51 HydrophobicContact CG1-CG 4.29Å; V26-F64 HydrophobicContact CG1-CE1 4.46Å; V26-I88 CarbonylContact C-O 3.55Å; V26-I88 WeakPolarHBondContact CA-O 3.41Å; V26-I88 HydrophobicContact CG2-CB 4.29Å; V26-V90 HydrophobicContact CG1-CG2 3.3Å
27	I	92.3	Very high	83.3	Confident	59 Å²	59	74 Å²	74	30%	0.303	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.7	-176.1	-55.4	-176.6	0	0	0	109.2	S32 E33 V87 I88 V90	I27-S32 WeakPolarHBondContact CA-O 3.22Å; I27-E33 HydrophobicContact CG1-CG 4.37Å; I27-V87 HydrophobicContact CD1-CG1 3.68Å; I27-V87 HydrophobicContact CG1-CG1 4Å; I27-I88 PolarHBondContact N-O 3.42Å; I27-V90 PolarHBondContact O-N 3.2Å
28	G	89.1	Confident	85.1	Confident	8 Å²	8	66.9 Å²	66.9	8%	0.082	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	166.4	172.1	0	0	0	0	0	113.1	D30 S31 S32 Y51	G28-D30 PolarHBondContact O-N 3.01Å; G28-S31 PolarHBondContact O-N 2.87Å; G28-S32 PolarHBondContact N-O 3.47Å; G28-Y51 WeakPolarHBondContact CA-OH 3.25Å
29	Q	84.3	Confident	86.9	Confident	120 Å²	120	63 Å²	63	56%	0.561	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-30.7	177.1	-75	175.7	-42.9	0	0	114.4	S31 V90 Y91 Q92	Q29-S31 PolarHBondContact O-N 3.47Å; Q29-S31 VanDerWaalsContact O-N 3.16Å; Q29-V90 PolarHBondContact N-O 2.99Å; Q29-Y91 HydrophobicContact CG-CD1 4.13Å; Q29-Q92 VanDerWaalsContact OE1-N 3.16Å
30	D	80.9	Confident	88.4	Confident	137 Å²	137	61.8 Å²	61.8	73%	0.733	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	18	178	-162.7	-114.6	0	0	0	113	G28 S32	G28-D30 PolarHBondContact O-N 3.01Å; D30-S32 PolarHBondContact O-N 2.92Å; D30-S32 VanDerWaalsContact O-N 3.09Å
31	S	78.4	Confident	88.8	Confident	107 Å²	107	61.1 Å²	61.1	75%	0.748	31%	0.308	S	S	*	.	S	Bend	trans	57.8	20.7	-170.2	-49.3	0	0	0	0	113.6	G28 Q29 E33	G28-S31 PolarHBondContact O-N 2.87Å; Q29-S31 PolarHBondContact O-N 3.47Å; Q29-S31 VanDerWaalsContact O-N 3.16Å; S31-E33 PolarHBondContact O-N 2.73Å
32	S	82.2	Confident	88.9	Confident	40 Å²	40	58.8 Å²	58.8	28%	0.28	30%	0.304	S	S	.	.			trans	-74.9	110.2	174.5	-79.2	0	0	0	0	109.9	I27 G28 D30	I27-S32 WeakPolarHBondContact CA-O 3.22Å; G28-S32 PolarHBondContact N-O 3.47Å; D30-S32 PolarHBondContact O-N 2.92Å; D30-S32 VanDerWaalsContact O-N 3.09Å
33	E	88.8	Confident	89	Confident	103 Å²	103	63.3 Å²	63.3	48%	0.481	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.1	177.9	-174.2	-178.8	80.7	0	0	111.3	V26 I27 S31 H35	V26-E33 WeakPolarHBondContact O-CA 3.38Å; I27-E33 HydrophobicContact CG1-CG 4.37Å; S31-E33 PolarHBondContact O-N 2.73Å; E33-H35 IonicContact OE1-CE1 2.84Å; E33-H35 PolarHBondContact OE1-CE1 3.36Å; E33-H35 IonicContact OE1-NE2 3.92Å
34	I	90	Very high	88.9	Confident	10 Å²	10	58.2 Å²	58.2	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.9	176.4	-55.4	177.5	0	0	0	109.4	V26 F36 Y51	V26-I34 PolarHBondContact N-O 3.09Å; V26-I34 PolarHBondContact O-N 3.33Å; I34-F36 HydrophobicContact CB-CD2 4.43Å; I34-F36 HydrophobicContact CB-CE2 3.92Å; I34-F36 HydrophobicContact CG2-CD2 3.81Å; I34-F36 HydrophobicContact CG2-CE2 3.28Å; I34-F36 HydrophobicContact CG2-CZ 3.79Å; I34-Y51 HydrophobicContact CD1-CD2 3.73Å; I34-Y51 HydrophobicContact CD1-CE2 3.7Å; I34-Y51 HydrophobicContact CG1-CE2 4.37Å
35	H	91.1	Very high	88.9	Confident	98 Å²	98	63 Å²	63	45%	0.454	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.8	174.2	-63.2	106.1	0	0	0	111	L24 K25 E33	L24-H35 WeakPolarHBondContact O-CA 3.43Å; K25-H35 VanDerWaalsContact CG-CD2 3.5Å; K25-H35 WeakPolarHBondContact CG-CD2 3.35Å; E33-H35 IonicContact OE1-CE1 2.84Å; E33-H35 PolarHBondContact OE1-CE1 3.36Å; E33-H35 IonicContact OE1-NE2 3.92Å
36	F	90.7	Very high	88.7	Confident	30 Å²	30	67.9 Å²	67.9	13%	0.132	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.6	174.4	-76.7	-87.7	0	0	0	110.7	K23 L24 V26 I34 V38 L47 Y51	K23-F36 CarbonylContact C-O 3.5Å; K23-F36 WeakPolarHBondContact CA-O 3.46Å; L24-F36 PolarHBondContact N-O 3.15Å; L24-F36 PolarHBondContact O-N 2.77Å; V26-F36 HydrophobicContact CB-CD2 4.2Å; V26-F36 HydrophobicContact CB-CE2 4.25Å; V26-F36 HydrophobicContact CG2-CD2 3.5Å; V26-F36 VanDerWaalsContact CG2-CD2 3.5Å; V26-F36 HydrophobicContact CG2-CE2 3.91Å; I34-F36 HydrophobicContact CB-CD2 4.43Å; I34-F36 HydrophobicContact CB-CE2 3.92Å; I34-F36 HydrophobicContact CG2-CD2 3.81Å; I34-F36 HydrophobicContact CG2-CE2 3.28Å; I34-F36 HydrophobicContact CG2-CZ 3.79Å; F36-V38 HydrophobicContact CB-CG1 4.25Å; F36-L47 HydrophobicContact CB-CD1 3.8Å; F36-L47 HydrophobicContact CB-CG 4.4Å; F36-L47 HydrophobicContact CD1-CG 4.32Å; F36-L47 HydrophobicContact CD2-CD1 4.18Å; F36-L47 HydrophobicContact CD2-CG 4.11Å; F36-L47 HydrophobicContact CE2-CG 4.43Å; F36-L47 HydrophobicContact CG-CD1 3.95Å; F36-L47 HydrophobicContact CG-CG 4.02Å; F36-Y51 HydrophobicContact CE2-CD2 4.28Å
37	K	90.9	Very high	88.6	Confident	106 Å²	106	68.1 Å²	68.1	46%	0.461	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	110.8	167.6	-170.2	176.2	-176.5	177.5	0	108.5
38	V	90.1	Very high	88.6	Confident	20 Å²	20	66 Å²	66	12%	0.121	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.3	-179	-61.9	0	0	0	0	111.1	Y21 I22 L24 F36 L47 P77	Y21-V38 CarbonylContact C-O 3.6Å; Y21-V38 VanDerWaalsContact CA-O 3.26Å; Y21-V38 WeakPolarHBondContact CA-O 3.28Å; I22-V38 HydrophobicContact CG1-CG2 3.98Å; I22-V38 PolarHBondContact N-O 3.36Å; I22-V38 PolarHBondContact O-N 3.28Å; L24-V38 HydrophobicContact CD1-CG2 3.47Å; L24-V38 VanDerWaalsContact CD1-CG2 3.47Å; L24-V38 HydrophobicContact CG-CG2 4.01Å; F36-V38 HydrophobicContact CB-CG1 4.25Å; V38-L47 HydrophobicContact CG1-CD1 4.09Å; V38-P77 HydrophobicContact CG2-CG 3.96Å
39	K	90.2	Very high	88.6	Confident	57 Å²	57	70.1 Å²	70.1	25%	0.248	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140	175	-162.8	-179.1	174.1	176.5	0	109.7	E20 Y21 T41 T42	E20-K39 HydrophobicContact CB-CG 4.38Å; E20-K39 HydrophobicContact CG-CD 4.38Å; E20-K39 HydrophobicContact CG-CG 3.96Å; E20-K39 CarbonylContact O-C 3.51Å; E20-K39 VanDerWaalsContact O-CA 3.32Å; E20-K39 WeakPolarHBondContact O-CA 3.46Å; E20-K39 VanDerWaalsContact O-CG 3.23Å; E20-K39 WeakPolarHBondContact O-CG 3.43Å; E20-K39 WeakPolarHBondContact OE1-CE 3.49Å; E20-K39 IonicContact OE1-NZ 3.97Å; E20-K39 PolarHBondContact OE1-NZ 3.1Å; Y21-K39 HydrophobicContact CD1-CB 3.75Å; Y21-K39 HydrophobicContact CD1-CG 4.15Å; Y21-K39 HydrophobicContact CE1-CB 3.71Å; Y21-K39 HydrophobicContact CE1-CD 4.3Å; Y21-K39 HydrophobicContact CE1-CG 3.98Å; K39-T41 WeakPolarHBondContact CD-OG1 3.45Å; K39-T41 WeakPolarHBondContact CE-OG1 3.37Å; K39-T41 PolarHBondContact O-N 3.18Å; K39-T41 VanDerWaalsContact O-N 3.07Å; K39-T42 WeakPolarHBondContact CB-OG1 3.14Å; K39-T42 WeakPolarHBondContact O-CB 3.42Å; K39-T42 PolarHBondContact O-N 3.38Å
40	M	88.4	Confident	88.9	Confident	55 Å²	55	67.1 Å²	67.1	27%	0.271	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.6	179.1	-73.5	-163	111.5	0	0	113.6	E20 I22 T76 P77 K78 M82	E20-M40 PolarHBondContact O-N 3.21Å; I22-M40 HydrophobicContact CG2-CE 4.29Å; I22-M40 HydrophobicContact CG2-CG 3.84Å; I22-M40 HydrophobicContact CG2-SD 4.38Å; M40-T76 WeakPolarHBondContact O-CB 3.34Å; M40-P77 WeakPolarHBondContact O-CD 3.38Å; M40-K78 HydrophobicContact CB-CB 4.2Å; M40-K78 VanDerWaalsContact O-CB 3.25Å; M40-K78 WeakPolarHBondContact O-CB 3.32Å; M40-K78 PolarHBondContact O-N 3.5Å; M40-M82 VanDerWaalsContact CE-O 3.22Å; M40-M82 WeakPolarHBondContact CE-O 3.38Å
41	T	87.8	Confident	89.4	Confident	66 Å²	66	61 Å²	61	41%	0.405	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-0.8	179.4	65.7	0	0	0	0	113.9	K39	K39-T41 WeakPolarHBondContact CD-OG1 3.45Å; K39-T41 WeakPolarHBondContact CE-OG1 3.37Å; K39-T41 PolarHBondContact O-N 3.18Å; K39-T41 VanDerWaalsContact O-N 3.07Å
42	T	89.1	Confident	89.9	Confident	48 Å²	48	56.9 Å²	56.9	29%	0.294	28%	0.281	S	S	.	.	S	Bend	trans	-92.1	138.2	-176.3	-68.9	0	0	0	0	110.4	K39 K46 P77	K39-T42 WeakPolarHBondContact CB-OG1 3.14Å; K39-T42 WeakPolarHBondContact O-CB 3.42Å; K39-T42 PolarHBondContact O-N 3.38Å; T42-K46 HydrophobicContact CG2-CD 4.4Å; T42-P77 WeakPolarHBondContact O-CD 3.47Å
43	H	92.2	Very high	90.2	Very high	108 Å²	108	62.9 Å²	62.9	50%	0.5	31%	0.305	S	S	.	.			trans	-60.8	134.4	174.3	-57.7	98.6	0	0	0	112.1	K45 K46 N74	H43-K45 PolarHBondContact O-N 3.34Å; H43-K46 PolarHBondContact O-N 3.12Å; H43-N74 PolarHBondContact CD2-O 2.99Å
44	L	91.4	Very high	90.1	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.01	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-11.4	179.4	-70.8	169.9	0	0	0	113.3	L24 K46 L47 K48 I71 Q75 P77 L80 M82	L24-L44 HydrophobicContact CD1-CD2 4.1Å; L44-K46 PolarHBondContact O-N 2.9Å; L44-L47 HydrophobicContact CD2-CD1 4.33Å; L44-L47 WeakPolarHBondContact O-CB 3.42Å; L44-L47 PolarHBondContact O-N 3.07Å; L44-K48 PolarHBondContact O-N 3.17Å; L44-K48 VanDerWaalsContact O-N 3.13Å; L44-I71 HydrophobicContact CB-CG2 3.88Å; L44-I71 HydrophobicContact CD1-CD1 4.45Å; L44-I71 HydrophobicContact CD1-CG2 3.42Å; L44-I71 VanDerWaalsContact CD1-CG2 3.42Å; L44-I71 HydrophobicContact CG-CG2 4.28Å; L44-Q75 PolarHBondContact N-O 2.54Å; L44-P77 HydrophobicContact CD2-CG 3.92Å; L44-P77 HydrophobicContact CG-CG 4.36Å; L44-L80 HydrophobicContact CD1-CD1 3.45Å; L44-L80 VanDerWaalsContact CD1-CD1 3.45Å; L44-M82 HydrophobicContact CD1-CE 4.09Å; L44-M82 HydrophobicContact CD1-SD 4.08Å
45	K	91.6	Very high	89.8	Confident	102 Å²	102	69.4 Å²	69.4	44%	0.443	33%	0.327	S	S	.	.	H	α-helix	trans	-45.8	-47	170.6	-171.3	-179.6	175.8	-171.8	0	112.8	H43 L47 K48 E49 D73	H43-K45 PolarHBondContact O-N 3.34Å; K45-L47 VanDerWaalsContact C-N 3.32Å; K45-L47 PolarHBondContact O-N 2.88Å; K45-K48 PolarHBondContact O-N 3.49Å; K45-E49 WeakPolarHBondContact CE-OE1 3.32Å; K45-E49 HydrophobicContact CG-CG 4.33Å; K45-E49 IonicContact NZ-OE1 2.69Å; K45-E49 WeakPolarHBondContact O-CG 2.75Å; K45-E49 PolarHBondContact O-N 2.94Å; K45-D73 HydrophobicContact CB-CB 3.95Å; K45-D73 WeakPolarHBondContact CB-O 3.44Å; K45-D73 HydrophobicContact CD-CB 4.47Å; K45-D73 HydrophobicContact CG-CB 4.1Å; K45-D73 PolarHBondContact N-O 3.06Å; K45-D73 VanDerWaalsContact N-O 3.12Å
46	K	90.1	Very high	89.5	Confident	149 Å²	149	68 Å²	68	65%	0.648	34%	0.34	S	S	*	.	H	α-helix	trans	-62.2	-38.8	-178.6	-81.9	-174.2	161.4	-176	0	112.7	T42 H43 L44 S50	T42-K46 HydrophobicContact CG2-CD 4.4Å; H43-K46 PolarHBondContact O-N 3.12Å; L44-K46 PolarHBondContact O-N 2.9Å; K46-S50 VanDerWaalsContact O-CB 3.27Å; K46-S50 WeakPolarHBondContact O-CB 3.38Å; K46-S50 PolarHBondContact O-N 2.81Å
47	L	91.6	Very high	89.3	Confident	6 Å²	6	68.1 Å²	68.1	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-44.8	176.9	177.1	153.2	0	0	0	110	L24 V26 F36 V38 L44 K45 S50 Y51 F64 I88	L24-L47 HydrophobicContact CB-CD1 4.44Å; L24-L47 HydrophobicContact CD1-CD1 4.03Å; V26-L47 HydrophobicContact CG2-CD1 4.13Å; V26-L47 HydrophobicContact CG2-CD2 3.96Å; V26-L47 HydrophobicContact CG2-CG 4.34Å; F36-L47 HydrophobicContact CB-CD1 3.8Å; F36-L47 HydrophobicContact CB-CG 4.4Å; F36-L47 HydrophobicContact CD1-CG 4.32Å; F36-L47 HydrophobicContact CD2-CD1 4.18Å; F36-L47 HydrophobicContact CD2-CG 4.11Å; F36-L47 HydrophobicContact CE2-CG 4.43Å; F36-L47 HydrophobicContact CG-CD1 3.95Å; F36-L47 HydrophobicContact CG-CG 4.02Å; V38-L47 HydrophobicContact CG1-CD1 4.09Å; L44-L47 HydrophobicContact CD2-CD1 4.33Å; L44-L47 WeakPolarHBondContact O-CB 3.42Å; L44-L47 PolarHBondContact O-N 3.07Å; K45-L47 VanDerWaalsContact C-N 3.32Å; K45-L47 PolarHBondContact O-N 2.88Å; L47-S50 PolarHBondContact O-N 2.69Å; L47-Y51 WeakPolarHBondContact O-CB 3.39Å; L47-Y51 PolarHBondContact O-N 3.42Å; L47-F64 HydrophobicContact CD2-CD1 4.28Å; L47-F64 HydrophobicContact CD2-CE1 4.2Å; L47-I88 HydrophobicContact CD1-CD1 4.28Å; L47-I88 HydrophobicContact CD2-CD1 4.44Å
48	K	90.8	Very high	89	Confident	14 Å²	14	66.8 Å²	66.8	6%	0.061	35%	0.345	C	S	.	.	H	α-helix	trans	-63.8	-45.7	177.8	-60.1	-173.6	-170.8	174.2	0	112.8	L44 K45 S50 Y51 S52 F64 I71 D73	L44-K48 PolarHBondContact O-N 3.17Å; L44-K48 VanDerWaalsContact O-N 3.13Å; K45-K48 PolarHBondContact O-N 3.49Å; K48-S50 VanDerWaalsContact C-N 3.33Å; K48-S50 PolarHBondContact O-N 2.72Å; K48-Y51 PolarHBondContact O-N 2.85Å; K48-S52 WeakPolarHBondContact O-CB 3.48Å; K48-S52 PolarHBondContact O-N 2.74Å; K48-F64 HydrophobicContact CB-CD2 4.17Å; K48-F64 HydrophobicContact CB-CE1 4.29Å; K48-F64 HydrophobicContact CB-CE2 3.65Å; K48-F64 HydrophobicContact CB-CZ 3.72Å; K48-F64 HydrophobicContact CD-CD2 3.55Å; K48-F64 HydrophobicContact CD-CE2 3.84Å; K48-F64 HydrophobicContact CD-CG 4.06Å; K48-F64 HydrophobicContact CG-CD1 4.01Å; K48-F64 HydrophobicContact CG-CD2 3.57Å; K48-F64 HydrophobicContact CG-CE1 4.02Å; K48-F64 HydrophobicContact CG-CE2 3.58Å; K48-F64 HydrophobicContact CG-CG 3.8Å; K48-F64 HydrophobicContact CG-CZ 3.82Å; K48-I71 WeakPolarHBondContact CE-O 3.33Å; K48-I71 PolarHBondContact NZ-O 2.89Å; K48-D73 WeakPolarHBondContact CD-OD1 3.37Å; K48-D73 IonicContact NZ-OD1 3.94Å; K48-D73 PolarHBondContact NZ-OD1 3.22Å; K48-D73 IonicContact NZ-OD2 2.85Å
49	E	90.8	Very high	88.7	Confident	95 Å²	95	67.7 Å²	67.7	44%	0.444	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-44.2	177	-73.2	-179.8	126.5	0	0	110.8	K45 S52 Q53	K45-E49 WeakPolarHBondContact CE-OE1 3.32Å; K45-E49 HydrophobicContact CG-CG 4.33Å; K45-E49 IonicContact NZ-OE1 2.69Å; K45-E49 WeakPolarHBondContact O-CG 2.75Å; K45-E49 PolarHBondContact O-N 2.94Å; E49-S52 PolarHBondContact O-N 2.82Å; E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 PolarHBondContact O-N 3.03Å
50	S	90.8	Very high	88.4	Confident	57 Å²	57	70.3 Å²	70.3	40%	0.399	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-41.3	177.8	-170.9	0	0	0	0	112.3	K46 L47 K48 Q53 R54	K46-S50 VanDerWaalsContact O-CB 3.27Å; K46-S50 WeakPolarHBondContact O-CB 3.38Å; K46-S50 PolarHBondContact O-N 2.81Å; L47-S50 PolarHBondContact O-N 2.69Å; K48-S50 VanDerWaalsContact C-N 3.33Å; K48-S50 PolarHBondContact O-N 2.72Å; S50-Q53 PolarHBondContact O-N 2.85Å; S50-R54 WeakPolarHBondContact O-CB 3.47Å; S50-R54 PolarHBondContact O-N 3.04Å
51	Y	90	Very high	88.4	Confident	9 Å²	9	68.5 Å²	68.5	4%	0.035	37%	0.372	C	S	.	.	H	α-helix	trans	-64.1	-47.8	175	-175.8	-85.7	0	0	0	111.6	V26 G28 I34 F36 L47 K48 Q53 R54 Q55 L62 F64 V90	V26-Y51 HydrophobicContact CB-CD2 4.21Å; V26-Y51 HydrophobicContact CB-CE2 4.31Å; V26-Y51 HydrophobicContact CG1-CD2 3.49Å; V26-Y51 VanDerWaalsContact CG1-CD2 3.49Å; V26-Y51 HydrophobicContact CG1-CE2 3.51Å; V26-Y51 HydrophobicContact CG1-CG 4.29Å; G28-Y51 WeakPolarHBondContact CA-OH 3.25Å; I34-Y51 HydrophobicContact CD1-CD2 3.73Å; I34-Y51 HydrophobicContact CD1-CE2 3.7Å; I34-Y51 HydrophobicContact CG1-CE2 4.37Å; F36-Y51 HydrophobicContact CE2-CD2 4.28Å; L47-Y51 WeakPolarHBondContact O-CB 3.39Å; L47-Y51 PolarHBondContact O-N 3.42Å; K48-Y51 PolarHBondContact O-N 2.85Å; Y51-Q53 VanDerWaalsContact C-N 3.33Å; Y51-Q53 PolarHBondContact O-N 2.92Å; Y51-R54 PolarHBondContact O-N 2.91Å; Y51-Q55 HydrophobicContact CD1-CG 3.94Å; Y51-Q55 HydrophobicContact CE1-CB 4.5Å; Y51-Q55 HydrophobicContact CE1-CG 3.53Å; Y51-Q55 HydrophobicContact CE2-CG 4.32Å; Y51-Q55 HydrophobicContact CG-CG 4.48Å; Y51-Q55 WeakPolarHBondContact O-CB 3.26Å; Y51-Q55 WeakPolarHBondContact O-CG 3.34Å; Y51-Q55 PolarHBondContact O-N 3.18Å; Y51-L62 HydrophobicContact CD1-CD1 3.64Å; Y51-L62 HydrophobicContact CE1-CD1 3.88Å; Y51-F64 AromaticContact CD1-CE1 3.95Å; Y51-F64 HydrophobicContact CD1-CE1 3.95Å; Y51-F64 AromaticContact CD1-CZ 3.81Å; Y51-F64 HydrophobicContact CD1-CZ 3.81Å; Y51-F64 AromaticContact CG-CE1 3.98Å; Y51-F64 HydrophobicContact CG-CE1 3.98Å; Y51-F64 HydrophobicContact CG-CZ 4.16Å; Y51-V90 HydrophobicContact CD1-CG1 4.31Å; Y51-V90 HydrophobicContact CE1-CB 4.1Å; Y51-V90 HydrophobicContact CE1-CG1 3.67Å; Y51-V90 HydrophobicContact CE1-CG2 4.17Å; Y51-V90 HydrophobicContact CE2-CG2 4.31Å
52	S	89.4	Confident	88.4	Confident	19 Å²	19	66 Å²	66	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-54.7	-47.3	175.6	166.2	0	0	0	0	111.7	K48 E49 Q55 G56 V57 A59	K48-S52 WeakPolarHBondContact O-CB 3.48Å; K48-S52 PolarHBondContact O-N 2.74Å; E49-S52 PolarHBondContact O-N 2.82Å; S52-Q55 PolarHBondContact O-N 3.13Å; S52-G56 PolarHBondContact O-N 2.99Å; S52-V57 CarbonylContact C-O 3.57Å; S52-V57 WeakPolarHBondContact CA-O 3.45Å; S52-V57 VanDerWaalsContact CB-O 3.29Å; S52-V57 WeakPolarHBondContact CB-O 3.37Å; S52-V57 PolarHBondContact O-N 2.71Å; S52-V57 VanDerWaalsContact O-N 3.16Å; S52-V57 VanDerWaalsContact O-O 3.1Å; S52-V57 PolarHBondContact OG-O 3.38Å; S52-A59 PolarHBondContact OG-N 3.18Å
53	Q	88.9	Confident	88.5	Confident	167 Å²	167	68.4 Å²	68.4	78%	0.78	36%	0.36	S	S	*	.	H	α-helix	trans	-68.1	-36	179.3	-170.3	159.3	34.7	0	0	112.7	E49 S50 Y51 G56	E49-Q53 WeakPolarHBondContact O-CB 3.23Å; E49-Q53 PolarHBondContact O-N 3.03Å; S50-Q53 PolarHBondContact O-N 2.85Å; Y51-Q53 VanDerWaalsContact C-N 3.33Å; Y51-Q53 PolarHBondContact O-N 2.92Å; Q53-G56 PolarHBondContact O-N 3.2Å
54	R	85.7	Confident	88.5	Confident	175 Å²	175	63.4 Å²	63.4	66%	0.66	34%	0.337	S	S	*	.	H	α-helix	trans	-70.4	-36	177.6	-153.4	-169.1	-147.3	-153.9	6.1	112.5	S50 Y51	S50-R54 WeakPolarHBondContact O-CB 3.47Å; S50-R54 PolarHBondContact O-N 3.04Å; Y51-R54 PolarHBondContact O-N 2.91Å
55	Q	84.4	Confident	88.6	Confident	74 Å²	74	64.8 Å²	64.8	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-82.5	-15.2	176.8	-68.8	-63.8	-10.1	0	0	113	Y51 S52 V57	Y51-Q55 HydrophobicContact CD1-CG 3.94Å; Y51-Q55 HydrophobicContact CE1-CB 4.5Å; Y51-Q55 HydrophobicContact CE1-CG 3.53Å; Y51-Q55 HydrophobicContact CE2-CG 4.32Å; Y51-Q55 HydrophobicContact CG-CG 4.48Å; Y51-Q55 WeakPolarHBondContact O-CB 3.26Å; Y51-Q55 WeakPolarHBondContact O-CG 3.34Å; Y51-Q55 PolarHBondContact O-N 3.18Å; S52-Q55 PolarHBondContact O-N 3.13Å; Q55-V57 HydrophobicContact CB-CG2 3.77Å; Q55-V57 PolarHBondContact O-N 2.84Å
56	G	85.8	Confident	88.7	Confident	69 Å²	69	60.1 Å²	60.1	71%	0.711	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	19.9	-176.1	0	0	0	0	0	113.7	S52 Q53	S52-G56 PolarHBondContact O-N 2.99Å; Q53-G56 PolarHBondContact O-N 3.2Å
57	V	84.8	Confident	88.8	Confident	33 Å²	33	60 Å²	60	20%	0.2	33%	0.326	C	S	.	.	S	Bend	trans	-119.1	139.7	-179.6	-58.7	0	0	0	0	109.6	S52 Q55 L62	S52-V57 CarbonylContact C-O 3.57Å; S52-V57 WeakPolarHBondContact CA-O 3.45Å; S52-V57 VanDerWaalsContact CB-O 3.29Å; S52-V57 WeakPolarHBondContact CB-O 3.37Å; S52-V57 PolarHBondContact O-N 2.71Å; S52-V57 VanDerWaalsContact O-N 3.16Å; S52-V57 VanDerWaalsContact O-O 3.1Å; S52-V57 PolarHBondContact OG-O 3.38Å; Q55-V57 HydrophobicContact CB-CG2 3.77Å; Q55-V57 PolarHBondContact O-N 2.84Å; V57-L62 HydrophobicContact CG2-CD1 3.62Å; V57-L62 HydrophobicContact CG2-CD2 3.71Å; V57-L62 HydrophobicContact CG2-CG 3.78Å
58	P	85.1	Confident	88.6	Confident	78 Å²	78	62.2 Å²	62.2	51%	0.506	35%	0.35	S	S	.	.			trans	-64.9	138.3	-176.4	25.3	-33.2	0	0	0	111.8	S60 T61	P58-S60 PolarHBondContact O-N 3.4Å; P58-T61 HydrophobicContact CG-CG2 3.76Å; P58-T61 PolarHBondContact O-N 2.79Å; P58-T61 PolarHBondContact O-OG1 2.81Å
59	A	83.8	Confident	88.6	Confident	38 Å²	38	67.4 Å²	67.4	31%	0.314	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-57.6	-26.1	179.5	0	0	0	0	0	113.2	S52 T61 L62	S52-A59 PolarHBondContact OG-N 3.18Å; A59-T61 PolarHBondContact O-N 2.9Å; A59-L62 PolarHBondContact O-N 2.86Å; A59-L62 VanDerWaalsContact O-N 3.1Å; A59-L62 VanDerWaalsContact O-O 3.12Å
60	S	84.9	Confident	88.7	Confident	112 Å²	112	70.9 Å²	70.9	78%	0.783	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-64.5	-25.7	175.7	-52.8	0	0	0	0	113.8	P58 L62	P58-S60 PolarHBondContact O-N 3.4Å; S60-L62 VanDerWaalsContact C-N 3.33Å
61	T	86.8	Confident	88.8	Confident	17 Å²	17	68.3 Å²	68.3	10%	0.104	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-94.7	6.8	175.9	65.1	0	0	0	0	111.7	P58 A59 Q92 E93 T95	P58-T61 HydrophobicContact CG-CG2 3.76Å; P58-T61 PolarHBondContact O-N 2.79Å; P58-T61 PolarHBondContact O-OG1 2.81Å; A59-T61 PolarHBondContact O-N 2.9Å; T61-Q92 CarbonylContact O-C 3.51Å; T61-Q92 WeakPolarHBondContact O-CA 3.44Å; T61-E93 PolarHBondContact O-N 3.29Å; T61-T95 HydrophobicContact CG2-CG2 3.97Å; T61-T95 WeakPolarHBondContact CG2-OG1 3.37Å
62	L	89	Confident	88.8	Confident	14 Å²	14	69.7 Å²	69.7	7%	0.073	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.8	-179.4	-67.4	-179.9	0	0	0	110.1	Y51 V57 A59 S60 F64 V90 Q92	Y51-L62 HydrophobicContact CD1-CD1 3.64Å; Y51-L62 HydrophobicContact CE1-CD1 3.88Å; V57-L62 HydrophobicContact CG2-CD1 3.62Å; V57-L62 HydrophobicContact CG2-CD2 3.71Å; V57-L62 HydrophobicContact CG2-CG 3.78Å; A59-L62 PolarHBondContact O-N 2.86Å; A59-L62 VanDerWaalsContact O-N 3.1Å; A59-L62 VanDerWaalsContact O-O 3.12Å; S60-L62 VanDerWaalsContact C-N 3.33Å; L62-F64 HydrophobicContact CB-CD2 4.33Å; L62-F64 HydrophobicContact CB-CE2 3.63Å; L62-F64 HydrophobicContact CB-CZ 4.21Å; L62-F64 HydrophobicContact CD1-CE2 4.21Å; L62-F64 HydrophobicContact CD1-CZ 4.02Å; L62-V90 HydrophobicContact CB-CG1 4.16Å; L62-V90 HydrophobicContact CD1-CG1 4.45Å; L62-V90 HydrophobicContact CD2-CG1 3.92Å; L62-V90 HydrophobicContact CG-CG1 4.42Å; L62-Q92 HydrophobicContact CD2-CB 4.45Å; L62-Q92 HydrophobicContact CD2-CG 4.48Å
63	R	91.3	Very high	88.9	Confident	98 Å²	98	72.6 Å²	72.6	37%	0.37	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.5	174.3	-165.2	175.2	-69	176.3	-3.2	109.1	L65 V90 Y91 E93	R63-L65 HydrophobicContact CB-CD1 4.28Å; R63-L65 HydrophobicContact CG-CD1 3.84Å; R63-L65 HydrophobicContact CG-CG 4.47Å; R63-V90 WeakPolarHBondContact O-CA 3.44Å; R63-Y91 PolarHBondContact N-O 3.49Å; R63-Y91 PolarHBondContact O-N 3.4Å; R63-E93 HydrophobicContact CB-CG 4.18Å; R63-E93 IonicContact CZ-OE1 3.53Å; R63-E93 IonicContact CZ-OE2 3.22Å; R63-E93 IonicContact NE-OE1 3.03Å; R63-E93 IonicContact NE-OE2 3.67Å; R63-E93 PolarHBondContact NE-OE2 2.75Å; R63-E93 IonicContact NH2-OE1 3.98Å; R63-E93 PolarHBondContact NH2-OE1 2.76Å; R63-E93 IonicContact NH2-OE2 2.74Å; R63-E93 PolarHBondContact NH2-OE2 2.8Å
64	F	92.3	Very high	89	Confident	4 Å²	4	70 Å²	70	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.5	176.8	-62.4	-101.5	0	0	0	108.7	V26 L47 K48 Y51 L62 I71 I88 E89 V90	V26-F64 HydrophobicContact CG1-CE1 4.46Å; L47-F64 HydrophobicContact CD2-CD1 4.28Å; L47-F64 HydrophobicContact CD2-CE1 4.2Å; K48-F64 HydrophobicContact CB-CD2 4.17Å; K48-F64 HydrophobicContact CB-CE1 4.29Å; K48-F64 HydrophobicContact CB-CE2 3.65Å; K48-F64 HydrophobicContact CB-CZ 3.72Å; K48-F64 HydrophobicContact CD-CD2 3.55Å; K48-F64 HydrophobicContact CD-CE2 3.84Å; K48-F64 HydrophobicContact CD-CG 4.06Å; K48-F64 HydrophobicContact CG-CD1 4.01Å; K48-F64 HydrophobicContact CG-CD2 3.57Å; K48-F64 HydrophobicContact CG-CE1 4.02Å; K48-F64 HydrophobicContact CG-CE2 3.58Å; K48-F64 HydrophobicContact CG-CG 3.8Å; K48-F64 HydrophobicContact CG-CZ 3.82Å; Y51-F64 AromaticContact CD1-CE1 3.95Å; Y51-F64 HydrophobicContact CD1-CE1 3.95Å; Y51-F64 AromaticContact CD1-CZ 3.81Å; Y51-F64 HydrophobicContact CD1-CZ 3.81Å; Y51-F64 AromaticContact CG-CE1 3.98Å; Y51-F64 HydrophobicContact CG-CE1 3.98Å; Y51-F64 HydrophobicContact CG-CZ 4.16Å; L62-F64 HydrophobicContact CB-CD2 4.33Å; L62-F64 HydrophobicContact CB-CE2 3.63Å; L62-F64 HydrophobicContact CB-CZ 4.21Å; L62-F64 HydrophobicContact CD1-CE2 4.21Å; L62-F64 HydrophobicContact CD1-CZ 4.02Å; F64-I71 HydrophobicContact CB-CB 4.35Å; F64-I71 HydrophobicContact CB-CD1 4.18Å; F64-I71 PolarHBondContact O-N 2.83Å; F64-I88 HydrophobicContact CB-CG2 4.17Å; F64-I88 HydrophobicContact CD1-CG2 4.08Å; F64-E89 WeakPolarHBondContact CA-O 3.34Å; F64-V90 HydrophobicContact CD1-CG1 4.34Å; F64-V90 HydrophobicContact CD1-CG2 3.48Å; F64-V90 VanDerWaalsContact CD1-CG2 3.48Å; F64-V90 HydrophobicContact CE1-CG1 4.15Å; F64-V90 HydrophobicContact CE1-CG2 3.59Å; F64-V90 HydrophobicContact CG-CG2 4.29Å; F64-V90 HydrophobicContact CZ-CG1 4.25Å; F64-V90 HydrophobicContact CZ-CG2 4.47Å
65	L	93.3	Very high	89.3	Confident	31 Å²	31	64.1 Å²	64.1	16%	0.162	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.3	177.6	-63	97	0	0	0	110.4	R63 Q69 I88 E89 Y91	R63-L65 HydrophobicContact CB-CD1 4.28Å; R63-L65 HydrophobicContact CG-CD1 3.84Å; R63-L65 HydrophobicContact CG-CG 4.47Å; L65-Q69 CarbonylContact C-O 3.54Å; L65-Q69 VanDerWaalsContact CA-O 3.25Å; L65-Q69 WeakPolarHBondContact CA-O 3.35Å; L65-I88 CarbonylContact O-C 3.55Å; L65-I88 WeakPolarHBondContact O-CA 3.4Å; L65-I88 WeakPolarHBondContact O-CG2 3.44Å; L65-E89 PolarHBondContact N-O 2.75Å; L65-E89 PolarHBondContact O-N 2.76Å; L65-Y91 HydrophobicContact CD1-CD2 3.3Å; L65-Y91 HydrophobicContact CD1-CE2 3.76Å; L65-Y91 HydrophobicContact CD1-CG 4.25Å
66	F	93.4	Very high	89.7	Confident	3 Å²	3	61.3 Å²	61.3	1%	0.013	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.8	170.4	175.5	-111.7	0	0	0	107.5	G68 Q69 I71 L80 M82 D86 V87 I88	F66-G68 PolarHBondContact O-N 3.12Å; F66-G68 VanDerWaalsContact O-N 3.09Å; F66-Q69 PolarHBondContact N-O 3.1Å; F66-Q69 WeakPolarHBondContact O-CA 3.37Å; F66-Q69 WeakPolarHBondContact O-CB 3.47Å; F66-Q69 PolarHBondContact O-N 2.74Å; F66-I71 HydrophobicContact CB-CD1 3.86Å; F66-I71 HydrophobicContact CB-CG1 3.88Å; F66-L80 HydrophobicContact CD1-CB 4.39Å; F66-M82 HydrophobicContact CB-CE 3.5Å; F66-M82 VanDerWaalsContact CB-CE 3.5Å; F66-M82 HydrophobicContact CD1-CE 3.74Å; F66-M82 HydrophobicContact CD1-CG 4.13Å; F66-M82 HydrophobicContact CD2-CE 3.51Å; F66-M82 HydrophobicContact CD2-CG 4.14Å; F66-M82 HydrophobicContact CE1-CE 4.34Å; F66-M82 HydrophobicContact CE1-CG 3.78Å; F66-M82 HydrophobicContact CE2-CE 4.15Å; F66-M82 HydrophobicContact CE2-CG 3.82Å; F66-M82 HydrophobicContact CG-CE 3.27Å; F66-M82 HydrophobicContact CG-CG 4.29Å; F66-M82 HydrophobicContact CZ-CB 4.39Å; F66-M82 HydrophobicContact CZ-CG 3.62Å; F66-D86 HydrophobicContact CE2-CB 3.88Å; F66-D86 VanDerWaalsContact CE2-CG 3.46Å; F66-D86 WeakPolarHBondContact CE2-OD1 3.49Å; F66-V87 WeakPolarHBondContact CD2-O 3.47Å; F66-I88 HydrophobicContact CD2-CG1 4.45Å
67	E	91.4	Very high	89.9	Confident	148 Å²	148	58 Å²	58	69%	0.692	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	36.4	-174.5	-57.6	-169.6	98.5	0	0	113.2	Q69	E67-Q69 PolarHBondContact O-N 2.75Å
68	G	88.8	Confident	90.2	Very high	52 Å²	52	63.3 Å²	63.3	54%	0.536	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-1.2	-175.4	0	0	0	0	0	115.6	F66	F66-G68 PolarHBondContact O-N 3.12Å; F66-G68 VanDerWaalsContact O-N 3.09Å
69	Q	90.9	Very high	90.5	Very high	123 Å²	123	65.8 Å²	65.8	58%	0.575	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	135.8	174.7	-58.9	-168.3	-76.4	0	0	111.9	L65 F66 E67 I71	L65-Q69 CarbonylContact C-O 3.54Å; L65-Q69 VanDerWaalsContact CA-O 3.25Å; L65-Q69 WeakPolarHBondContact CA-O 3.35Å; F66-Q69 PolarHBondContact N-O 3.1Å; F66-Q69 WeakPolarHBondContact O-CA 3.37Å; F66-Q69 WeakPolarHBondContact O-CB 3.47Å; F66-Q69 PolarHBondContact O-N 2.74Å; E67-Q69 PolarHBondContact O-N 2.75Å; Q69-I71 PolarHBondContact O-N 2.78Å
70	R	91.3	Very high	90.8	Very high	167 Å²	167	65.2 Å²	65.2	63%	0.63	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	123.8	177	-172.7	-179.4	-176.3	179.7	5.3	110.6
71	I	92.8	Very high	91	Very high	4 Å²	4	62.2 Å²	62.2	2%	0.021	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-77.4	126.7	174.2	-59.6	170.5	0	0	0	109.2	L44 K48 F64 F66 Q69 L80 M82 I88	L44-I71 HydrophobicContact CB-CG2 3.88Å; L44-I71 HydrophobicContact CD1-CD1 4.45Å; L44-I71 HydrophobicContact CD1-CG2 3.42Å; L44-I71 VanDerWaalsContact CD1-CG2 3.42Å; L44-I71 HydrophobicContact CG-CG2 4.28Å; K48-I71 WeakPolarHBondContact CE-O 3.33Å; K48-I71 PolarHBondContact NZ-O 2.89Å; F64-I71 HydrophobicContact CB-CB 4.35Å; F64-I71 HydrophobicContact CB-CD1 4.18Å; F64-I71 PolarHBondContact O-N 2.83Å; F66-I71 HydrophobicContact CB-CD1 3.86Å; F66-I71 HydrophobicContact CB-CG1 3.88Å; Q69-I71 PolarHBondContact O-N 2.78Å; I71-L80 HydrophobicContact CG1-CD1 4.16Å; I71-L80 HydrophobicContact CG2-CD1 4.12Å; I71-M82 HydrophobicContact CD1-CE 3.75Å; I71-M82 HydrophobicContact CG1-CE 4.28Å; I71-I88 HydrophobicContact CD1-CB 4.49Å; I71-I88 HydrophobicContact CD1-CD1 3.79Å; I71-I88 HydrophobicContact CD1-CG1 3.95Å; I71-I88 HydrophobicContact CD1-CG2 3.76Å
72	A	91.7	Very high	91.2	Very high	37 Å²	37	61.4 Å²	61.4	31%	0.306	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-88.7	157.8	169.9	0	0	0	0	0	111.3	N74 Q75	A72-N74 VanDerWaalsContact C-N 3.27Å; A72-N74 WeakPolarHBondContact CB-OD1 3.35Å; A72-N74 PolarHBondContact O-N 3.35Å; A72-Q75 HydrophobicContact CB-CG 3.87Å; A72-Q75 PolarHBondContact O-N 2.95Å; A72-Q75 VanDerWaalsContact O-N 3.15Å
73	D	90.6	Very high	91.3	Very high	80 Å²	80	67.5 Å²	67.5	43%	0.428	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.7	-173.7	-51.3	-67.4	0	0	0	112.8	K45 K48	K45-D73 HydrophobicContact CB-CB 3.95Å; K45-D73 WeakPolarHBondContact CB-O 3.44Å; K45-D73 HydrophobicContact CD-CB 4.47Å; K45-D73 HydrophobicContact CG-CB 4.1Å; K45-D73 PolarHBondContact N-O 3.06Å; K45-D73 VanDerWaalsContact N-O 3.12Å; K48-D73 WeakPolarHBondContact CD-OD1 3.37Å; K48-D73 IonicContact NZ-OD1 3.94Å; K48-D73 PolarHBondContact NZ-OD1 3.22Å; K48-D73 IonicContact NZ-OD2 2.85Å
74	N	91.1	Very high	91.3	Very high	114 Å²	114	66.2 Å²	66.2	61%	0.61	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.2	176.7	63.5	-55.4	0	0	0	113.7	H43 A72	H43-N74 PolarHBondContact CD2-O 2.99Å; A72-N74 VanDerWaalsContact C-N 3.27Å; A72-N74 WeakPolarHBondContact CB-OD1 3.35Å; A72-N74 PolarHBondContact O-N 3.35Å
75	Q	92.4	Very high	91.1	Very high	50 Å²	50	71.5 Å²	71.5	23%	0.234	37%	0.37	C	S	.	.			trans	-76.5	146.8	175.4	-66.7	-133	63.5	0	0	110.8	L44 A72 L80	L44-Q75 PolarHBondContact N-O 2.54Å; A72-Q75 HydrophobicContact CB-CG 3.87Å; A72-Q75 PolarHBondContact O-N 2.95Å; A72-Q75 VanDerWaalsContact O-N 3.15Å; Q75-L80 HydrophobicContact CB-CD1 3.88Å; Q75-L80 HydrophobicContact CB-CG 4.34Å
76	T	91.6	Very high	91.2	Very high	16 Å²	16	72 Å²	72	10%	0.098	37%	0.372	C	S	.	.			trans	-106.8	153.6	171.4	62.4	0	0	0	0	110.7	M40 K78 E79 L80	M40-T76 WeakPolarHBondContact O-CB 3.34Å; T76-K78 PolarHBondContact O-N 3.36Å; T76-E79 WeakPolarHBondContact CB-OE2 3.21Å; T76-E79 PolarHBondContact N-OE2 2.95Å; T76-E79 PolarHBondContact O-N 2.84Å; T76-E79 VanDerWaalsContact O-N 3.1Å; T76-E79 VanDerWaalsContact OG1-CG 3.28Å; T76-E79 WeakPolarHBondContact OG1-CG 3.29Å; T76-E79 PolarHBondContact OG1-N 3.38Å; T76-E79 PolarHBondContact OG1-OE2 2.91Å; T76-L80 PolarHBondContact O-N 3.37Å
77	P	91.2	Very high	91.2	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-56.6	-34	175.1	-14.9	20.6	0	0	0	112.7	I22 V38 M40 T42 L44 E79 L80 G81 M82	I22-P77 HydrophobicContact CD1-CB 3.44Å; I22-P77 VanDerWaalsContact CD1-CB 3.44Å; I22-P77 HydrophobicContact CD1-CG 4.15Å; I22-P77 HydrophobicContact CG1-CB 4.44Å; V38-P77 HydrophobicContact CG2-CG 3.96Å; M40-P77 WeakPolarHBondContact O-CD 3.38Å; T42-P77 WeakPolarHBondContact O-CD 3.47Å; L44-P77 HydrophobicContact CD2-CG 3.92Å; L44-P77 HydrophobicContact CG-CG 4.36Å; P77-E79 PolarHBondContact O-N 2.89Å; P77-L80 PolarHBondContact O-N 3.05Å; P77-G81 PolarHBondContact O-N 2.88Å; P77-M82 HydrophobicContact CB-CB 3.88Å; P77-M82 HydrophobicContact CB-CG 4.38Å; P77-M82 HydrophobicContact CB-SD 3.88Å; P77-M82 PolarHBondContact O-N 3.05Å
78	K	90.3	Very high	91.3	Very high	143 Å²	143	67.7 Å²	67.7	62%	0.622	36%	0.356	S	S	*	.	H	α-helix	trans	-62	-40	176.2	-170.9	175.3	-180	178.9	0	113.4	M40 T76 G81	M40-K78 HydrophobicContact CB-CB 4.2Å; M40-K78 VanDerWaalsContact O-CB 3.25Å; M40-K78 WeakPolarHBondContact O-CB 3.32Å; M40-K78 PolarHBondContact O-N 3.5Å; T76-K78 PolarHBondContact O-N 3.36Å; K78-G81 PolarHBondContact O-N 2.85Å
79	E	91.2	Very high	91.5	Very high	131 Å²	131	68.5 Å²	68.5	61%	0.612	35%	0.346	S	S	*	.	H	α-helix	trans	-71.8	-34.1	179	-72.9	168.9	113.1	0	0	112.1	T76 P77 G81	T76-E79 WeakPolarHBondContact CB-OE2 3.21Å; T76-E79 PolarHBondContact N-OE2 2.95Å; T76-E79 PolarHBondContact O-N 2.84Å; T76-E79 VanDerWaalsContact O-N 3.1Å; T76-E79 VanDerWaalsContact OG1-CG 3.28Å; T76-E79 WeakPolarHBondContact OG1-CG 3.29Å; T76-E79 PolarHBondContact OG1-N 3.38Å; T76-E79 PolarHBondContact OG1-OE2 2.91Å; P77-E79 PolarHBondContact O-N 2.89Å; E79-G81 VanDerWaalsContact C-N 3.26Å
80	L	89.7	Confident	91.5	Very high	25 Å²	25	62.9 Å²	62.9	13%	0.131	32%	0.32	C	S	.	.	H	α-helix	trans	-79.4	-7.4	176	-75.3	163	0	0	0	113.2	L44 F66 I71 Q75 T76 P77 M82	L44-L80 HydrophobicContact CD1-CD1 3.45Å; L44-L80 VanDerWaalsContact CD1-CD1 3.45Å; F66-L80 HydrophobicContact CD1-CB 4.39Å; I71-L80 HydrophobicContact CG1-CD1 4.16Å; I71-L80 HydrophobicContact CG2-CD1 4.12Å; Q75-L80 HydrophobicContact CB-CD1 3.88Å; Q75-L80 HydrophobicContact CB-CG 4.34Å; T76-L80 PolarHBondContact O-N 3.37Å; P77-L80 PolarHBondContact O-N 3.05Å; L80-M82 VanDerWaalsContact C-N 3.28Å; L80-M82 HydrophobicContact CB-CE 4.25Å; L80-M82 HydrophobicContact CB-CG 4.01Å; L80-M82 HydrophobicContact CB-SD 4.37Å; L80-M82 HydrophobicContact CD1-CE 3.73Å; L80-M82 HydrophobicContact CD1-SD 4.35Å; L80-M82 PolarHBondContact O-N 3.18Å
81	G	90.1	Very high	91.4	Very high	50 Å²	50	59.5 Å²	59.5	52%	0.515	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	23.7	-177.1	0	0	0	0	0	113.9	P77 K78 E79	P77-G81 PolarHBondContact O-N 2.88Å; K78-G81 PolarHBondContact O-N 2.85Å; E79-G81 VanDerWaalsContact C-N 3.26Å
82	M	91.5	Very high	91	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.			trans	-69.7	140.2	178.8	-67.6	172.6	168.8	0	0	111.7	I22 L24 M40 L44 F66 I71 P77 L80 D86 I88	I22-M82 HydrophobicContact CD1-CB 3.86Å; L24-M82 HydrophobicContact CD1-SD 3.93Å; L24-M82 HydrophobicContact CD2-CB 4.18Å; L24-M82 HydrophobicContact CD2-SD 4.16Å; M40-M82 VanDerWaalsContact CE-O 3.22Å; M40-M82 WeakPolarHBondContact CE-O 3.38Å; L44-M82 HydrophobicContact CD1-CE 4.09Å; L44-M82 HydrophobicContact CD1-SD 4.08Å; F66-M82 HydrophobicContact CB-CE 3.5Å; F66-M82 VanDerWaalsContact CB-CE 3.5Å; F66-M82 HydrophobicContact CD1-CE 3.74Å; F66-M82 HydrophobicContact CD1-CG 4.13Å; F66-M82 HydrophobicContact CD2-CE 3.51Å; F66-M82 HydrophobicContact CD2-CG 4.14Å; F66-M82 HydrophobicContact CE1-CE 4.34Å; F66-M82 HydrophobicContact CE1-CG 3.78Å; F66-M82 HydrophobicContact CE2-CE 4.15Å; F66-M82 HydrophobicContact CE2-CG 3.82Å; F66-M82 HydrophobicContact CG-CE 3.27Å; F66-M82 HydrophobicContact CG-CG 4.29Å; F66-M82 HydrophobicContact CZ-CB 4.39Å; F66-M82 HydrophobicContact CZ-CG 3.62Å; I71-M82 HydrophobicContact CD1-CE 3.75Å; I71-M82 HydrophobicContact CG1-CE 4.28Å; P77-M82 HydrophobicContact CB-CB 3.88Å; P77-M82 HydrophobicContact CB-CG 4.38Å; P77-M82 HydrophobicContact CB-SD 3.88Å; P77-M82 PolarHBondContact O-N 3.05Å; L80-M82 VanDerWaalsContact C-N 3.28Å; L80-M82 HydrophobicContact CB-CE 4.25Å; L80-M82 HydrophobicContact CB-CG 4.01Å; L80-M82 HydrophobicContact CB-SD 4.37Å; L80-M82 HydrophobicContact CD1-CE 3.73Å; L80-M82 HydrophobicContact CD1-SD 4.35Å; L80-M82 PolarHBondContact O-N 3.18Å; M82-D86 WeakPolarHBondContact CA-OD2 3.48Å; M82-I88 HydrophobicContact CE-CD1 3.89Å; M82-I88 HydrophobicContact CE-CG1 4.02Å; M82-I88 HydrophobicContact SD-CD1 4.41Å
83	E	91.3	Very high	90.3	Very high	142 Å²	142	65.2 Å²	65.2	66%	0.664	33%	0.328	S	S	*	.			trans	-111.9	-179.9	179.3	-61.2	-168.9	83.1	0	0	111.8	D86	E83-D86 PolarHBondContact N-OD2 2.91Å
84	D	89.8	Confident	89.1	Confident	71 Å²	71	70.3 Å²	70.3	38%	0.38	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	140	172.7	-160.3	-116	0	0	0	109.7	K23 D86	K23-D84 WeakPolarHBondContact CB-OD2 3.27Å; K23-D84 WeakPolarHBondContact CG-OD2 3.37Å; K23-D84 PolarHBondContact N-OD2 3.43Å; K23-D84 IonicContact NZ-OD1 3.05Å; D84-D86 VanDerWaalsContact C-N 3.27Å; D84-D86 PolarHBondContact O-N 3.21Å
85	E	89.6	Confident	87.5	Confident	115 Å²	115	69.6 Å²	69.6	54%	0.537	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	9.3	-179.4	-52.2	-160.5	67.5	0	0	116.6	K23 K25	K23-E85 WeakPolarHBondContact O-CA 3.37Å; K23-E85 PolarHBondContact O-N 3.39Å; K25-E85 IonicContact NZ-OE1 3.54Å; K25-E85 PolarHBondContact NZ-OE1 3.16Å
86	D	94.1	Very high	85.8	Confident	41 Å²	41	70.3 Å²	70.3	22%	0.219	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	152.1	177.9	-107.7	-44.2	0	0	0	113.7	L24 K25 F66 M82 E83 D84	L24-D86 CarbonylContact C-O 3.52Å; L24-D86 HydrophobicContact CD2-CB 3.72Å; K25-D86 PolarHBondContact N-O 3.43Å; F66-D86 HydrophobicContact CE2-CB 3.88Å; F66-D86 VanDerWaalsContact CE2-CG 3.46Å; F66-D86 WeakPolarHBondContact CE2-OD1 3.49Å; M82-D86 WeakPolarHBondContact CA-OD2 3.48Å; E83-D86 PolarHBondContact N-OD2 2.91Å; D84-D86 VanDerWaalsContact C-N 3.27Å; D84-D86 PolarHBondContact O-N 3.21Å
87	V	92.9	Very high	84	Confident	60 Å²	60	72.5 Å²	72.5	36%	0.364	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.8	-174.2	-177.5	0	0	0	0	111.5	K25 I27 F66	K25-V87 HydrophobicContact CB-CG2 4.1Å; K25-V87 HydrophobicContact CD-CG2 4.31Å; K25-V87 CarbonylContact O-C 3.47Å; K25-V87 WeakPolarHBondContact O-CA 3.5Å; I27-V87 HydrophobicContact CD1-CG1 3.68Å; I27-V87 HydrophobicContact CG1-CG1 4Å; F66-V87 WeakPolarHBondContact CD2-O 3.47Å
88	I	93.9	Very high	82	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.3	170	-63.5	174.9	0	0	0	108.2	L24 K25 V26 I27 L47 F64 L65 F66 I71 M82 V90	L24-I88 HydrophobicContact CB-CD1 4.39Å; L24-I88 HydrophobicContact CD1-CD1 3.88Å; K25-I88 PolarHBondContact O-N 2.92Å; V26-I88 CarbonylContact C-O 3.55Å; V26-I88 WeakPolarHBondContact CA-O 3.41Å; V26-I88 HydrophobicContact CG2-CB 4.29Å; I27-I88 PolarHBondContact N-O 3.42Å; L47-I88 HydrophobicContact CD1-CD1 4.28Å; L47-I88 HydrophobicContact CD2-CD1 4.44Å; F64-I88 HydrophobicContact CB-CG2 4.17Å; F64-I88 HydrophobicContact CD1-CG2 4.08Å; L65-I88 CarbonylContact O-C 3.55Å; L65-I88 WeakPolarHBondContact O-CA 3.4Å; L65-I88 WeakPolarHBondContact O-CG2 3.44Å; F66-I88 HydrophobicContact CD2-CG1 4.45Å; I71-I88 HydrophobicContact CD1-CB 4.49Å; I71-I88 HydrophobicContact CD1-CD1 3.79Å; I71-I88 HydrophobicContact CD1-CG1 3.95Å; I71-I88 HydrophobicContact CD1-CG2 3.76Å; M82-I88 HydrophobicContact CE-CD1 3.89Å; M82-I88 HydrophobicContact CE-CG1 4.02Å; M82-I88 HydrophobicContact SD-CD1 4.41Å; I88-V90 HydrophobicContact CG2-CG2 4.48Å
89	E	92.9	Very high	80.2	Confident	69 Å²	69	84.9 Å²	84.9	32%	0.322	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135.9	175.3	-58.3	172.6	76.2	0	0	110.2	F64 L65 Y91	F64-E89 WeakPolarHBondContact CA-O 3.34Å; L65-E89 PolarHBondContact N-O 2.75Å; L65-E89 PolarHBondContact O-N 2.76Å; E89-Y91 HydrophobicContact CB-CD2 4.29Å; E89-Y91 HydrophobicContact CB-CE2 3.6Å; E89-Y91 PolarHBondContact OE1-OH 3.09Å
90	V	91.4	Very high	78.2	Confident	5 Å²	5	84.2 Å²	84.2	3%	0.03	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.2	177.5	-169.2	0	0	0	0	110.3	V26 I27 Q29 Y51 L62 R63 F64 I88	V26-V90 HydrophobicContact CG1-CG2 3.3Å; I27-V90 PolarHBondContact O-N 3.2Å; Q29-V90 PolarHBondContact N-O 2.99Å; Y51-V90 HydrophobicContact CD1-CG1 4.31Å; Y51-V90 HydrophobicContact CE1-CB 4.1Å; Y51-V90 HydrophobicContact CE1-CG1 3.67Å; Y51-V90 HydrophobicContact CE1-CG2 4.17Å; Y51-V90 HydrophobicContact CE2-CG2 4.31Å; L62-V90 HydrophobicContact CB-CG1 4.16Å; L62-V90 HydrophobicContact CD1-CG1 4.45Å; L62-V90 HydrophobicContact CD2-CG1 3.92Å; L62-V90 HydrophobicContact CG-CG1 4.42Å; R63-V90 WeakPolarHBondContact O-CA 3.44Å; F64-V90 HydrophobicContact CD1-CG1 4.34Å; F64-V90 HydrophobicContact CD1-CG2 3.48Å; F64-V90 VanDerWaalsContact CD1-CG2 3.48Å; F64-V90 HydrophobicContact CE1-CG1 4.15Å; F64-V90 HydrophobicContact CE1-CG2 3.59Å; F64-V90 HydrophobicContact CG-CG2 4.29Å; F64-V90 HydrophobicContact CZ-CG1 4.25Å; F64-V90 HydrophobicContact CZ-CG2 4.47Å; I88-V90 HydrophobicContact CG2-CG2 4.48Å
91	Y	88.9	Confident	76	Confident	97 Å²	97	94 Å²	94	38%	0.38	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.8	176.3	-65.4	-101.6	0	0	0	109	Q29 R63 L65 E89 E93	Q29-Y91 HydrophobicContact CG-CD1 4.13Å; R63-Y91 PolarHBondContact N-O 3.49Å; R63-Y91 PolarHBondContact O-N 3.4Å; L65-Y91 HydrophobicContact CD1-CD2 3.3Å; L65-Y91 HydrophobicContact CD1-CE2 3.76Å; L65-Y91 HydrophobicContact CD1-CG 4.25Å; E89-Y91 HydrophobicContact CB-CD2 4.29Å; E89-Y91 HydrophobicContact CB-CE2 3.6Å; E89-Y91 PolarHBondContact OE1-OH 3.09Å; Y91-E93 PolarHBondContact O-N 3.16Å
92	Q	85.5	Confident	75.3	Confident	98 Å²	98	96.3 Å²	96.3	46%	0.458	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118.7	168.8	-165.4	173.3	53.1	0	0	108	Q29 T61 L62 Q94	Q29-Q92 VanDerWaalsContact OE1-N 3.16Å; T61-Q92 CarbonylContact O-C 3.51Å; T61-Q92 WeakPolarHBondContact O-CA 3.44Å; L62-Q92 HydrophobicContact CD2-CB 4.45Å; L62-Q92 HydrophobicContact CD2-CG 4.48Å; Q92-Q94 PolarHBondContact O-N 3.12Å
93	E	77.3	Confident	74.4	Confident	63 Å²	63	101.3 Å²	101.3	29%	0.294	53%	0.534	S	S	.	.			trans	-63.1	118.8	164.6	-65.3	-166.5	58.3	0	0	106.6	T61 R63 Y91 T95	T61-E93 PolarHBondContact O-N 3.29Å; R63-E93 HydrophobicContact CB-CG 4.18Å; R63-E93 IonicContact CZ-OE1 3.53Å; R63-E93 IonicContact CZ-OE2 3.22Å; R63-E93 IonicContact NE-OE1 3.03Å; R63-E93 IonicContact NE-OE2 3.67Å; R63-E93 PolarHBondContact NE-OE2 2.75Å; R63-E93 IonicContact NH2-OE1 3.98Å; R63-E93 PolarHBondContact NH2-OE1 2.76Å; R63-E93 IonicContact NH2-OE2 2.74Å; R63-E93 PolarHBondContact NH2-OE2 2.8Å; Y91-E93 PolarHBondContact O-N 3.16Å; E93-T95 PolarHBondContact O-N 3.48Å
94	Q	64.2	Low	73.5	Confident	186 Å²	186	99.1 Å²	99.1	87%	0.869	53%	0.527	S	S	*	.			trans	-65.4	85.9	-179.7	-171.6	-179.5	5.3	0	0	109.1	Q92 G96	Q92-Q94 PolarHBondContact O-N 3.12Å; Q94-G96 PolarHBondContact O-N 3.41Å; Q94-G96 VanDerWaalsContact O-N 3.12Å
95	T	58.2	Low	72.5	Confident	99 Å²	99	100.7 Å²	100.7	61%	0.607	54%	0.535	S	S	*	.			trans	-66.4	103.6	155.1	22	0	0	0	0	106	T61 E93 G97	T61-T95 HydrophobicContact CG2-CG2 3.97Å; T61-T95 WeakPolarHBondContact CG2-OG1 3.37Å; E93-T95 PolarHBondContact O-N 3.48Å; T95-G97 PolarHBondContact O-N 3.44Å
96	G	55.3	Low	71.5	Confident	66 Å²	66	99.8 Å²	99.8	68%	0.68	54%	0.535	S	S	*	.			trans	-42.6	125.2	176.9	0	0	0	0	0	110.5	Q94 L98	Q94-G96 PolarHBondContact O-N 3.41Å; Q94-G96 VanDerWaalsContact O-N 3.12Å; G96-L98 PolarHBondContact O-N 3.09Å
97	G	54.1	Low	70	Confident	61 Å²	61	103.7 Å²	103.7	63%	0.629	56%	0.556	S	S	*	*			trans	-50	132.9	-165.7	0	0	0	0	0	113.2	T95 W99	T95-G97 PolarHBondContact O-N 3.44Å; G97-W99 PolarHBondContact O-N 3.26Å; G97-W99 VanDerWaalsContact O-N 3.12Å
98	L	49.7	Very low	68.3	Low	155 Å²	155	106.9 Å²	106.9	81%	0.812	57%	0.57	S	S	*	*			trans	-74	98.3	163.8	-168.4	74	0	0	0	106.9	G96 T100	G96-L98 PolarHBondContact O-N 3.09Å; L98-T100 PolarHBondContact O-N 3.42Å; L98-T100 VanDerWaalsContact O-N 3.09Å; L98-T100 PolarHBondContact O-OG1 3.4Å
99	W	51.8	Low	66.3	Low	248 Å²	248	115.1 Å²	115.1	94%	0.939	61%	0.614	S	S	*	*			trans	-60.7	110.2	163.9	-69.3	60.4	0	0	0	106.2	G97	G97-W99 PolarHBondContact O-N 3.26Å; G97-W99 VanDerWaalsContact O-N 3.12Å
100	T	49.8	Very low	64.1	Low	117 Å²	117	118.9 Å²	118.9	72%	0.718	64%	0.638	S	S	*	*			trans	-119.4	108.3	166	-17	0	0	0	0	105.5	L98	L98-T100 PolarHBondContact O-N 3.42Å; L98-T100 VanDerWaalsContact O-N 3.09Å; L98-T100 PolarHBondContact O-OG1 3.4Å
101	D	43.5	Very low	61.6	Low	232 Å²	232	129.3 Å²	129.3	100%	1.241	69%	0.693	S	S	*	*			trans	-50.6	0	167.8	174.1	-113.3	0	0	0	111.8

Retrieved 101 of 101 residues in 229.2 ms (Link to these results)

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