A0A077Z3U8_TRITR Loading...

Zf-RING 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3U8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 116 aa.

						>A0A077Z3U8_TRITR|A0A077Z3U8
METGRGGPTPQCSSGTQRKEEEIKAARCLGILQHLPVEEYVKENNNAKECVICMIEFNEGDKIRYLPCMHTYHMECIDDWLMRSFTCPSCLEPVDSALFSTFGQMYDSNELWPSSS
					

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(Predicted Aligned Error values between residue pairs)

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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	47.9	Very low	59.1	Low	239 Å²	239	147.2 Å²	147.2	100%	1.177	87%	0.866	S	S	*	*				0	126.9	0	-78	162.3	168.5	0	0	107
2	E	56.1	Low	59.2	Low	195 Å²	195	143.5 Å²	143.5	91%	0.911	85%	0.852	S	S	*	*			trans	66.7	91.3	168.1	-59.8	178.8	102.7	0	0	118.2
3	T	61	Low	59.5	Low	140 Å²	140	138.8 Å²	138.8	86%	0.859	83%	0.83	S	S	*	*			trans	-80.6	115.5	163.2	44	0	0	0	0	109.8	R5	T3-R5 PolarHBondContact O-N 3.48Å
4	G	53.6	Low	59.8	Low	82 Å²	82	134.1 Å²	134.1	85%	0.845	81%	0.807	S	S	*	*			trans	-73.6	117.6	172	0	0	0	0	0	111.2	G6	G4-G6 PolarHBondContact O-N 3.44Å
5	R	61.4	Low	60.6	Low	249 Å²	249	128.7 Å²	128.7	94%	0.94	79%	0.79	S	S	*	*			trans	-79	107.2	169.8	-77.8	-175.6	-173.4	-145.5	0.6	109.4	T3 G7	T3-R5 PolarHBondContact O-N 3.48Å; R5-G7 PolarHBondContact O-N 3.39Å
6	G	57.2	Low	61.4	Low	75 Å²	75	125.9 Å²	125.9	77%	0.773	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.4	126.9	159.1	0	0	0	0	0	109.7	G4	G4-G6 PolarHBondContact O-N 3.44Å
7	G	60.5	Low	62.3	Low	67 Å²	67	125.1 Å²	125.1	69%	0.691	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-72.6	148.8	174.4	0	0	0	0	0	111.5	R5 T9	R5-G7 PolarHBondContact O-N 3.39Å; G7-T9 PolarHBondContact O-N 3.49Å
8	P	67.2	Low	63.5	Low	134 Å²	134	127.4 Å²	127.4	87%	0.87	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-69.8	130.1	177.6	-10.5	25.4	0	0	0	111.2
9	T	59.3	Low	64.7	Low	121 Å²	121	127.9 Å²	127.9	74%	0.742	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-67	141.4	167.2	29.8	0	0	0	0	111.4	G7 Q11	G7-T9 PolarHBondContact O-N 3.49Å; T9-Q11 PolarHBondContact O-N 3.13Å
10	P	63.6	Low	65.6	Low	129 Å²	129	127.5 Å²	127.5	84%	0.838	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-66.7	118.6	175.7	27.2	-31.4	0	0	0	109.9
11	Q	62.8	Low	66.5	Low	188 Å²	188	127.8 Å²	127.8	88%	0.879	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-75.2	131.2	176.8	-69.5	-178.8	-24.5	0	0	110.1	T9 S13	T9-Q11 PolarHBondContact O-N 3.13Å; Q11-S13 PolarHBondContact O-N 3.27Å
12	C	60	Low	68.3	Low	103 Å²	103	121.1 Å²	121.1	70%	0.696	70%	0.695	S	S	*	*			trans	-68.1	108.8	178.9	-171.6	0	0	0	0	110.5	S14	C12-S14 PolarHBondContact SG-OG 3.25Å
13	S	62.9	Low	69.7	Low	82 Å²	82	117 Å²	117	57%	0.573	68%	0.677	S	S	*	*			trans	-78.7	-12.2	-176.9	46	0	0	0	0	114.9	Q11	Q11-S13 PolarHBondContact O-N 3.27Å
14	S	64.5	Low	70.7	Confident	73 Å²	73	115.2 Å²	115.2	51%	0.51	66%	0.658	S	S	.	*	H	α-helix	trans	-75.3	-28.6	-171.7	50.4	0	0	0	0	114.4	C12 R18	C12-S14 PolarHBondContact SG-OG 3.25Å; S14-R18 PolarHBondContact O-N 3.46Å
15	G	71.1	Confident	72.2	Confident	53 Å²	53	112.9 Å²	112.9	55%	0.546	63%	0.63	S	S	.	*	H	α-helix	trans	-68.7	-36.1	178.9	0	0	0	0	0	113.4
16	T	73.5	Confident	73.4	Confident	84 Å²	84	104 Å²	104	52%	0.515	61%	0.611	S	S	.	*	H	α-helix	trans	-71	-45.3	-179.8	-52.5	0	0	0	0	111.3	R18 K19 E20	T16-R18 PolarHBondContact O-N 3.41Å; T16-K19 PolarHBondContact O-N 3.18Å; T16-E20 HydrophobicContact CG2-CG 4.47Å; T16-E20 WeakPolarHBondContact CG2-OE1 3.27Å; T16-E20 WeakPolarHBondContact O-CG 3.46Å; T16-E20 PolarHBondContact O-N 2.92Å
17	Q	76.4	Confident	74.6	Confident	113 Å²	113	106.5 Å²	106.5	53%	0.528	60%	0.597	S	S	.	*	H	α-helix	trans	-58.6	-47.2	-178.7	-71.4	178.5	-12.5	0	0	112.2	K19 E20 E21	Q17-K19 VanDerWaalsContact C-N 3.29Å; Q17-K19 PolarHBondContact O-N 3.42Å; Q17-E20 PolarHBondContact O-N 2.98Å; Q17-E21 WeakPolarHBondContact O-CG 3.09Å; Q17-E21 PolarHBondContact O-N 2.84Å
18	R	84.3	Confident	75.7	Confident	167 Å²	167	103.4 Å²	103.4	63%	0.63	57%	0.565	S	S	*	*	H	α-helix	trans	-59.1	-41.4	178.7	-178.9	178.1	170.6	166.8	4.8	112.2	S14 T16 E21 E22	S14-R18 PolarHBondContact O-N 3.46Å; T16-R18 PolarHBondContact O-N 3.41Å; R18-E21 PolarHBondContact O-N 2.98Å; R18-E22 WeakPolarHBondContact CG-OE1 3.48Å; R18-E22 IonicContact CZ-OE1 3.74Å; R18-E22 IonicContact NE-OE1 2.92Å; R18-E22 PolarHBondContact NE-OE1 3.32Å; R18-E22 IonicContact NH2-OE1 3.68Å; R18-E22 WeakPolarHBondContact O-CB 3.45Å; R18-E22 VanDerWaalsContact O-CG 3.27Å; R18-E22 WeakPolarHBondContact O-CG 3.3Å; R18-E22 PolarHBondContact O-N 3.4Å
19	K	86.2	Confident	76.7	Confident	137 Å²	137	100.8 Å²	100.8	60%	0.596	54%	0.543	S	S	*	.	H	α-helix	trans	-68.4	-39.3	179.7	-171.4	174.9	-179.2	179.3	0	111.8	T16 Q17 E22 I23	T16-K19 PolarHBondContact O-N 3.18Å; Q17-K19 VanDerWaalsContact C-N 3.29Å; Q17-K19 PolarHBondContact O-N 3.42Å; K19-E22 PolarHBondContact O-N 2.96Å; K19-I23 HydrophobicContact CG-CD1 4.16Å; K19-I23 VanDerWaalsContact O-CG1 3.26Å; K19-I23 WeakPolarHBondContact O-CG1 3.26Å; K19-I23 PolarHBondContact O-N 3.02Å
20	E	83.1	Confident	78	Confident	119 Å²	119	96.5 Å²	96.5	56%	0.556	52%	0.523	S	S	*	.	H	α-helix	trans	-63.4	-42.3	175	-71.3	173.1	177.7	0	0	111.6	T16 Q17 I23 K24	T16-E20 HydrophobicContact CG2-CG 4.47Å; T16-E20 WeakPolarHBondContact CG2-OE1 3.27Å; T16-E20 WeakPolarHBondContact O-CG 3.46Å; T16-E20 PolarHBondContact O-N 2.92Å; Q17-E20 PolarHBondContact O-N 2.98Å; E20-I23 PolarHBondContact O-N 3.23Å; E20-K24 WeakPolarHBondContact O-CB 3.44Å; E20-K24 PolarHBondContact O-N 2.84Å
21	E	83.9	Confident	79.1	Confident	133 Å²	133	91.5 Å²	91.5	62%	0.621	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-43	174.6	-71.2	174.1	164.9	0	0	112.1	Q17 R18 K24 A25	Q17-E21 WeakPolarHBondContact O-CG 3.09Å; Q17-E21 PolarHBondContact O-N 2.84Å; R18-E21 PolarHBondContact O-N 2.98Å; E21-K24 PolarHBondContact O-N 3.36Å; E21-A25 VanDerWaalsContact O-CB 3.3Å; E21-A25 WeakPolarHBondContact O-CB 3.44Å; E21-A25 PolarHBondContact O-N 2.94Å
22	E	86.9	Confident	80.3	Confident	100 Å²	100	83 Å²	83	47%	0.467	45%	0.449	S	S	.	.	H	α-helix	trans	-62.7	-43.1	176.2	-74.7	169.3	-176	0	0	111.8	R18 K19 A25 A26	R18-E22 WeakPolarHBondContact CG-OE1 3.48Å; R18-E22 IonicContact CZ-OE1 3.74Å; R18-E22 IonicContact NE-OE1 2.92Å; R18-E22 PolarHBondContact NE-OE1 3.32Å; R18-E22 IonicContact NH2-OE1 3.68Å; R18-E22 WeakPolarHBondContact O-CB 3.45Å; R18-E22 VanDerWaalsContact O-CG 3.27Å; R18-E22 WeakPolarHBondContact O-CG 3.3Å; R18-E22 PolarHBondContact O-N 3.4Å; K19-E22 PolarHBondContact O-N 2.96Å; E22-A25 PolarHBondContact O-N 2.91Å; E22-A26 WeakPolarHBondContact O-CB 3.35Å; E22-A26 PolarHBondContact O-N 3.03Å
23	I	85.4	Confident	81.7	Confident	107 Å²	107	85 Å²	85	55%	0.549	45%	0.449	S	S	.	.	H	α-helix	trans	-64.2	-44.9	175.8	-69.2	165	0	0	0	110.8	K19 E20 A26 R27	K19-I23 HydrophobicContact CG-CD1 4.16Å; K19-I23 VanDerWaalsContact O-CG1 3.26Å; K19-I23 WeakPolarHBondContact O-CG1 3.26Å; K19-I23 PolarHBondContact O-N 3.02Å; E20-I23 PolarHBondContact O-N 3.23Å; I23-A26 PolarHBondContact O-N 3.45Å; I23-R27 PolarHBondContact O-N 3.39Å
24	K	81.6	Confident	82.9	Confident	104 Å²	104	88.7 Å²	88.7	45%	0.452	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-47.1	177.6	-176.2	-176.6	172.6	-167.3	0	110.6	E20 E21 A26 R27 C28 R83	E20-K24 WeakPolarHBondContact O-CB 3.44Å; E20-K24 PolarHBondContact O-N 2.84Å; E21-K24 PolarHBondContact O-N 3.36Å; K24-A26 PolarHBondContact O-N 2.97Å; K24-R27 PolarHBondContact O-N 3.21Å; K24-C28 PolarHBondContact O-N 3.35Å; K24-C28 PolarHBondContact O-SG 3.44Å; K24-R83 PolarHBondContact NZ-O 2.79Å
25	A	83.7	Confident	84.2	Confident	32 Å²	32	86 Å²	86	26%	0.264	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-43.6	177.8	0	0	0	0	0	111.7	E21 E22 R27 C28 L29 M82	E21-A25 VanDerWaalsContact O-CB 3.3Å; E21-A25 WeakPolarHBondContact O-CB 3.44Å; E21-A25 PolarHBondContact O-N 2.94Å; E22-A25 PolarHBondContact O-N 2.91Å; A25-R27 VanDerWaalsContact C-N 3.35Å; A25-R27 PolarHBondContact O-N 2.94Å; A25-C28 PolarHBondContact O-N 3.46Å; A25-L29 WeakPolarHBondContact O-CB 3.38Å; A25-L29 VanDerWaalsContact O-CG 3.26Å; A25-L29 WeakPolarHBondContact O-CG 3.32Å; A25-L29 PolarHBondContact O-N 3.26Å; A25-M82 HydrophobicContact CB-CE 4.48Å
26	A	87.4	Confident	85.3	Confident	64 Å²	64	86.8 Å²	86.8	53%	0.529	43%	0.432	S	S	.	.	H	α-helix	trans	-60.9	-42.5	177	0	0	0	0	0	112.2	E22 I23 K24 G30	E22-A26 WeakPolarHBondContact O-CB 3.35Å; E22-A26 PolarHBondContact O-N 3.03Å; I23-A26 PolarHBondContact O-N 3.45Å; K24-A26 PolarHBondContact O-N 2.97Å; A26-G30 PolarHBondContact O-N 3.49Å
27	R	82.3	Confident	86.4	Confident	126 Å²	126	85.7 Å²	85.7	48%	0.475	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-46.9	174.8	178	173.9	162.9	-161.8	-6	111.7	I23 K24 A25 L29 G30 I31 D95	I23-R27 PolarHBondContact O-N 3.39Å; K24-R27 PolarHBondContact O-N 3.21Å; A25-R27 VanDerWaalsContact C-N 3.35Å; A25-R27 PolarHBondContact O-N 2.94Å; R27-L29 PolarHBondContact O-N 3.1Å; R27-G30 PolarHBondContact O-N 3.36Å; R27-I31 HydrophobicContact CG-CD1 4.1Å; R27-I31 PolarHBondContact O-N 3.2Å; R27-D95 IonicContact CZ-OD2 3.13Å; R27-D95 IonicContact NE-OD2 2.9Å; R27-D95 PolarHBondContact NE-OD2 2.87Å; R27-D95 IonicContact NH2-OD1 3.45Å; R27-D95 PolarHBondContact NH2-OD1 3.26Å; R27-D95 IonicContact NH2-OD2 2.6Å; R27-D95 PolarHBondContact NH2-OD2 3.5Å
28	C	84	Confident	87.3	Confident	3 Å²	3	85.3 Å²	85.3	2%	0.02	42%	0.423	C	S	.	.	H	α-helix	trans	-58.1	-49.7	177.3	-67.6	0	0	0	0	111	K24 A25 G30 I31 L32 L81 F85	K24-C28 PolarHBondContact O-N 3.35Å; K24-C28 PolarHBondContact O-SG 3.44Å; A25-C28 PolarHBondContact O-N 3.46Å; C28-G30 PolarHBondContact O-N 3.24Å; C28-I31 PolarHBondContact O-N 3.44Å; C28-L32 WeakPolarHBondContact O-CB 3.36Å; C28-L32 VanDerWaalsContact O-CG 3.25Å; C28-L32 WeakPolarHBondContact O-CG 3.41Å; C28-L32 PolarHBondContact O-N 3.29Å; C28-L81 PolarHBondContact SG-O 2.91Å; C28-F85 HydrophobicContact CB-CD2 3.92Å; C28-F85 HydrophobicContact CB-CE2 4.11Å; C28-F85 WeakPolarHBondContact SG-CD2 3.26Å
29	L	87.1	Confident	87.9	Confident	78 Å²	78	83.9 Å²	83.9	41%	0.408	42%	0.424	S	S	.	.	H	α-helix	trans	-60.8	-43	179.9	-73.5	171.4	0	0	0	112.2	A25 R27 I31 L32 Q33 M82	A25-L29 WeakPolarHBondContact O-CB 3.38Å; A25-L29 VanDerWaalsContact O-CG 3.26Å; A25-L29 WeakPolarHBondContact O-CG 3.32Å; A25-L29 PolarHBondContact O-N 3.26Å; R27-L29 PolarHBondContact O-N 3.1Å; L29-I31 VanDerWaalsContact C-N 3.27Å; L29-I31 PolarHBondContact O-N 3.36Å; L29-L32 PolarHBondContact O-N 3.21Å; L29-Q33 VanDerWaalsContact O-CG 3.27Å; L29-Q33 WeakPolarHBondContact O-CG 3.27Å; L29-Q33 PolarHBondContact O-N 2.6Å; L29-Q33 VanDerWaalsContact O-N 3.1Å; L29-M82 HydrophobicContact CD2-SD 4Å; L29-M82 HydrophobicContact CG-SD 4.29Å
30	G	88.2	Confident	88.4	Confident	32 Å²	32	78.1 Å²	78.1	33%	0.33	40%	0.398	S	S	.	.	H	α-helix	trans	-58.4	-40.9	177.8	0	0	0	0	0	112.1	A26 R27 C28 H34	A26-G30 PolarHBondContact O-N 3.49Å; R27-G30 PolarHBondContact O-N 3.36Å; C28-G30 PolarHBondContact O-N 3.24Å; G30-H34 PolarHBondContact O-CD2 3.12Å
31	I	86.5	Confident	89	Confident	23 Å²	23	76.8 Å²	76.8	12%	0.118	40%	0.398	C	S	.	.	H	α-helix	trans	-77	-44.7	179.7	-62.9	160.8	0	0	0	111.1	R27 C28 L29 Q33 H34 L35 F85 V94 D95 L98	R27-I31 HydrophobicContact CG-CD1 4.1Å; R27-I31 PolarHBondContact O-N 3.2Å; C28-I31 PolarHBondContact O-N 3.44Å; L29-I31 VanDerWaalsContact C-N 3.27Å; L29-I31 PolarHBondContact O-N 3.36Å; I31-Q33 PolarHBondContact O-N 3.45Å; I31-H34 PolarHBondContact O-N 2.9Å; I31-L35 HydrophobicContact CG2-CD1 4.49Å; I31-L35 HydrophobicContact CG2-CD2 4.3Å; I31-L35 HydrophobicContact CG2-CG 4.25Å; I31-L35 WeakPolarHBondContact O-CG 3.25Å; I31-L35 PolarHBondContact O-N 2.7Å; I31-F85 HydrophobicContact CB-CE2 4.28Å; I31-F85 HydrophobicContact CB-CZ 3.65Å; I31-F85 HydrophobicContact CD1-CE1 3.42Å; I31-F85 VanDerWaalsContact CD1-CE1 3.42Å; I31-F85 HydrophobicContact CD1-CE2 4.35Å; I31-F85 HydrophobicContact CD1-CZ 3.27Å; I31-F85 HydrophobicContact CG1-CZ 4.05Å; I31-F85 HydrophobicContact CG2-CE2 4.48Å; I31-F85 HydrophobicContact CG2-CZ 3.69Å; I31-V94 HydrophobicContact CG2-CG1 4.26Å; I31-D95 HydrophobicContact CD1-CB 3.78Å; I31-L98 HydrophobicContact CD1-CD1 4.05Å; I31-L98 HydrophobicContact CG1-CD1 3.94Å
32	L	88.1	Confident	89.3	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.052	39%	0.389	C	S	.	.	H	α-helix	trans	-53.3	-39.7	178.7	-77.8	175.3	0	0	0	112.9	C28 L29 H34 L35 R64 L81 M82	C28-L32 WeakPolarHBondContact O-CB 3.36Å; C28-L32 VanDerWaalsContact O-CG 3.25Å; C28-L32 WeakPolarHBondContact O-CG 3.41Å; C28-L32 PolarHBondContact O-N 3.29Å; L29-L32 PolarHBondContact O-N 3.21Å; L32-H34 PolarHBondContact O-N 3.41Å; L32-L35 HydrophobicContact CD2-CD1 4.2Å; L32-L35 PolarHBondContact O-N 2.9Å; L32-R64 PolarHBondContact O-NH1 3.14Å; L32-L81 HydrophobicContact CD1-CB 4.32Å; L32-L81 HydrophobicContact CD2-CB 3.91Å; L32-L81 HydrophobicContact CD2-CD1 3.36Å; L32-L81 HydrophobicContact CD2-CG 4.24Å; L32-L81 HydrophobicContact CG-CB 4.43Å; L32-L81 HydrophobicContact CG-CD1 4.45Å; L32-M82 HydrophobicContact CD1-SD 4.18Å
33	Q	87.8	Confident	89.3	Confident	146 Å²	146	77.3 Å²	77.3	68%	0.682	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.6	178.9	-73.6	174.3	24.9	0	0	113.9	L29 I31	L29-Q33 VanDerWaalsContact O-CG 3.27Å; L29-Q33 WeakPolarHBondContact O-CG 3.27Å; L29-Q33 PolarHBondContact O-N 2.6Å; L29-Q33 VanDerWaalsContact O-N 3.1Å; I31-Q33 PolarHBondContact O-N 3.45Å
34	H	89	Confident	88.9	Confident	158 Å²	158	80.1 Å²	80.1	73%	0.731	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-4.2	-177.6	-67.4	-57	0	0	0	113.9	G30 I31 L32	G30-H34 PolarHBondContact O-CD2 3.12Å; I31-H34 PolarHBondContact O-N 2.9Å; L32-H34 PolarHBondContact O-N 3.41Å
35	L	91.3	Very high	88.6	Confident	16 Å²	16	83 Å²	83	8%	0.084	44%	0.435	C	S	.	.	S	Bend	trans	-72.4	136.1	175.2	-68.7	178.1	0	0	0	110.7	I31 L32 V37 R64 L66 P67 L81 V94	I31-L35 HydrophobicContact CG2-CD1 4.49Å; I31-L35 HydrophobicContact CG2-CD2 4.3Å; I31-L35 HydrophobicContact CG2-CG 4.25Å; I31-L35 WeakPolarHBondContact O-CG 3.25Å; I31-L35 PolarHBondContact O-N 2.7Å; L32-L35 HydrophobicContact CD2-CD1 4.2Å; L32-L35 PolarHBondContact O-N 2.9Å; L35-V37 PolarHBondContact O-N 3.48Å; L35-R64 HydrophobicContact CB-CG 4.02Å; L35-R64 PolarHBondContact O-NH1 3.38Å; L35-L66 HydrophobicContact CD1-CD2 3.68Å; L35-P67 HydrophobicContact CD2-CG 3.84Å; L35-L81 HydrophobicContact CD1-CD1 4.28Å; L35-V94 HydrophobicContact CD1-CG1 4.08Å; L35-V94 HydrophobicContact CD2-CG1 4.42Å
36	P	94.4	Very high	88.4	Confident	71 Å²	71	86.4 Å²	86.4	46%	0.461	45%	0.449	S	S	.	.			trans	-58.4	133.3	180	-23	32.6	0	0	0	112.2	R64 Y65	P36-R64 WeakPolarHBondContact O-CA 3.27Å; P36-R64 WeakPolarHBondContact O-CG 3.45Å; P36-Y65 HydrophobicContact CB-CD2 4.48Å; P36-Y65 PolarHBondContact O-N 3.38Å; P36-Y65 VanDerWaalsContact O-N 3.1Å
37	V	96.7	Very high	88.2	Confident	61 Å²	61	85.5 Å²	85.5	37%	0.37	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.3	170.1	-179	0	0	0	0	107.9	L35 K62 I63 R64 M74	L35-V37 PolarHBondContact O-N 3.48Å; V37-K62 HydrophobicContact CG1-CB 4.34Å; V37-I63 VanDerWaalsContact CA-O 3.31Å; V37-I63 WeakPolarHBondContact CA-O 3.44Å; V37-R64 HydrophobicContact CG2-CB 4.39Å; V37-R64 HydrophobicContact CG2-CG 4.42Å; V37-M74 HydrophobicContact CG1-CG 4.43Å; V37-M74 HydrophobicContact CG1-SD 3.81Å; V37-M74 HydrophobicContact CG2-CG 4.31Å; V37-M74 HydrophobicContact CG2-SD 4.12Å
38	E	95.9	Very high	88.7	Confident	105 Å²	105	84.4 Å²	84.4	49%	0.491	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	161.1	178.6	-61.5	-177.8	166.7	0	0	109.9	I63 Y65	E38-I63 PolarHBondContact N-O 3.07Å; E38-I63 WeakPolarHBondContact O-CG1 3.41Å; E38-I63 PolarHBondContact O-N 3.1Å; E38-Y65 HydrophobicContact CB-CE2 4.15Å; E38-Y65 HydrophobicContact CG-CE2 4.08Å; E38-Y65 VanDerWaalsContact OE2-CE2 3.25Å; E38-Y65 WeakPolarHBondContact OE2-CE2 3.39Å; E38-Y65 PolarHBondContact OE2-OH 3.02Å
39	E	97.4	Very high	89.2	Confident	137 Å²	137	89.3 Å²	89.3	64%	0.64	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	129.2	165.9	-70.6	179.1	-177	0	0	108.5	V41 D61	E39-V41 PolarHBondContact O-N 3.42Å; E39-D61 CarbonylContact C-O 3.59Å; E39-D61 WeakPolarHBondContact CA-O 3.33Å
40	Y	96.4	Very high	89.8	Confident	16 Å²	16	85.6 Å²	85.6	6%	0.063	44%	0.444	C	S	.	.			trans	-67.6	126.1	179	177.9	-108.6	0	0	0	110.3	K42 N46 K48 F57 N58 E59 G60 D61 I63	Y40-K42 HydrophobicContact CE1-CB 3.99Å; Y40-K42 HydrophobicContact CE1-CG 4.35Å; Y40-N46 PolarHBondContact OH-O 2.89Å; Y40-K48 HydrophobicContact CE2-CB 4.43Å; Y40-K48 HydrophobicContact CE2-CD 4.41Å; Y40-F57 HydrophobicContact CD1-CB 3.44Å; Y40-F57 VanDerWaalsContact CD1-CB 3.44Å; Y40-F57 HydrophobicContact CD2-CB 4.12Å; Y40-F57 HydrophobicContact CD2-CD2 4.48Å; Y40-F57 HydrophobicContact CD2-CG 4.47Å; Y40-F57 HydrophobicContact CE1-CB 3.5Å; Y40-F57 HydrophobicContact CE2-CB 4.2Å; Y40-F57 HydrophobicContact CE2-CD2 4.35Å; Y40-F57 HydrophobicContact CG-CB 3.74Å; Y40-F57 HydrophobicContact CG-CG 4.42Å; Y40-N58 WeakPolarHBondContact CD1-O 3.32Å; Y40-E59 WeakPolarHBondContact O-CA 3.4Å; Y40-G60 PolarHBondContact O-N 3.41Å; Y40-D61 PolarHBondContact N-O 2.95Å; Y40-I63 HydrophobicContact CD2-CD1 3.94Å; Y40-I63 HydrophobicContact CG-CD1 4.48Å
41	V	93.9	Very high	90.2	Very high	91 Å²	91	87.2 Å²	87.2	55%	0.552	45%	0.447	S	S	*	.			trans	-106	120.9	172.9	-178.8	0	0	0	0	108.2	E39 E43	E39-V41 PolarHBondContact O-N 3.42Å; V41-E43 PolarHBondContact O-N 2.86Å
42	K	90.2	Very high	90.7	Very high	97 Å²	97	88.7 Å²	88.7	42%	0.422	46%	0.455	S	S	.	.			trans	-78.8	106.3	-176.8	-171.2	169.5	-174.4	160.9	0	110.5	Y40 E59	Y40-K42 HydrophobicContact CE1-CB 3.99Å; Y40-K42 HydrophobicContact CE1-CG 4.35Å; K42-E59 VanDerWaalsContact CB-OE2 3.26Å; K42-E59 WeakPolarHBondContact CB-OE2 3.4Å; K42-E59 PolarHBondContact N-OE2 3.17Å
43	E	87.8	Confident	91.2	Very high	147 Å²	147	90.3 Å²	90.3	69%	0.687	47%	0.467	S	S	*	.			trans	-90.4	124.1	177	-63.3	-177.2	168	0	0	112	V41 N45 N46	V41-E43 PolarHBondContact O-N 2.86Å; E43-N45 PolarHBondContact O-N 3.16Å; E43-N46 PolarHBondContact O-N 3.31Å
44	N	76.5	Confident	91.7	Very high	166 Å²	166	90.6 Å²	90.6	89%	0.888	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	25.3	74.7	162.6	-71	-19.8	0	0	0	117.1	N46	N44-N46 PolarHBondContact O-N 3.13Å
45	N	75.9	Confident	92.1	Very high	164 Å²	164	87.8 Å²	87.8	88%	0.877	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	10.3	174.6	-77.8	1.9	0	0	0	116.6	E43 A47	E43-N45 PolarHBondContact O-N 3.16Å; N45-A47 PolarHBondContact O-N 2.9Å
46	N	79.1	Confident	92.3	Very high	103 Å²	103	91.8 Å²	91.8	55%	0.551	48%	0.477	S	S	*	.			trans	-93	83.6	173.5	-162.6	2.1	0	0	0	109.8	Y40 E43 N44 K48	Y40-N46 PolarHBondContact OH-O 2.89Å; E43-N46 PolarHBondContact O-N 3.31Å; N44-N46 PolarHBondContact O-N 3.13Å; N46-K48 PolarHBondContact O-N 3.06Å
47	A	82.7	Confident	92.4	Very high	46 Å²	46	88.6 Å²	88.6	38%	0.38	46%	0.456	S	S	.	.			trans	-66.9	116.4	172.7	0	0	0	0	0	109.1	N45 E56	N45-A47 PolarHBondContact O-N 2.9Å; A47-E56 HydrophobicContact CB-CG 4.47Å
48	K	93.3	Very high	92.3	Very high	103 Å²	103	89.8 Å²	89.8	45%	0.448	46%	0.461	S	S	.	.			trans	-97.7	150.5	167.7	-71.1	-176.6	-177.9	178	0	108.3	Y40 N46 E56 F57	Y40-K48 HydrophobicContact CE2-CB 4.43Å; Y40-K48 HydrophobicContact CE2-CD 4.41Å; N46-K48 PolarHBondContact O-N 3.06Å; K48-E56 WeakPolarHBondContact O-CA 3.01Å; K48-F57 VanDerWaalsContact C-CD2 3.49Å; K48-F57 HydrophobicContact CB-CD2 3.58Å; K48-F57 HydrophobicContact CB-CE2 3.99Å; K48-F57 VanDerWaalsContact O-CD2 3.3Å; K48-F57 WeakPolarHBondContact O-CD2 3.4Å; K48-F57 PolarHBondContact O-N 2.96Å
49	E	95.7	Very high	92.3	Very high	105 Å²	105	90.5 Å²	90.5	49%	0.491	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.8	178.1	65.3	176.4	-165.8	0	0	111.8	V51 I55 F57	E49-V51 PolarHBondContact O-N 2.93Å; E49-I55 WeakPolarHBondContact CA-O 3.35Å; E49-F57 VanDerWaalsContact C-CE2 3.48Å; E49-F57 WeakPolarHBondContact O-CE2 3.4Å
50	C	98.2	Very high	92.2	Very high	0 Å²	0	85.6 Å²	85.6	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.3	169.4	-178.3	0	0	0	0	109.6	I52 C53 M54 I55 F57 H73	C50-I52 PolarHBondContact O-N 3.41Å; C50-I52 VanDerWaalsContact O-N 3.09Å; C50-C53 VanDerWaalsContact CB-SG 3.54Å; C50-C53 PolarHBondContact O-N 2.8Å; C50-M54 VanDerWaalsContact O-CA 3.29Å; C50-M54 WeakPolarHBondContact O-CA 3.15Å; C50-M54 PolarHBondContact O-N 3Å; C50-I55 PolarHBondContact N-O 3.3Å; C50-F57 HydrophobicContact CB-CE1 3.59Å; C50-F57 HydrophobicContact CB-CZ 3.73Å; C50-H73 WeakPolarHBondContact CB-ND1 3.44Å
51	V	97	Very high	92.3	Very high	67 Å²	67	86.8 Å²	86.8	41%	0.406	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.5	-179.3	-58.6	0	0	0	0	114.4	E49 Y72	E49-V51 PolarHBondContact O-N 2.93Å; V51-Y72 HydrophobicContact CG2-CD1 4.06Å; V51-Y72 HydrophobicContact CG2-CE1 3.47Å; V51-Y72 VanDerWaalsContact CG2-CE1 3.47Å
52	I	97.9	Very high	92.5	Very high	53 Å²	53	88.6 Å²	88.6	27%	0.272	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-47.7	176.8	-62.5	170.8	0	0	0	110.4	C50 Y72 C76 I77 W80 P88	C50-I52 PolarHBondContact O-N 3.41Å; C50-I52 VanDerWaalsContact O-N 3.09Å; I52-Y72 HydrophobicContact CD1-CD1 3.57Å; I52-Y72 HydrophobicContact CD1-CE1 4.19Å; I52-Y72 HydrophobicContact CD1-CG 4.03Å; I52-Y72 HydrophobicContact CG1-CD1 3.74Å; I52-Y72 HydrophobicContact CG1-CE1 4.14Å; I52-C76 HydrophobicContact CB-CB 4.01Å; I52-C76 HydrophobicContact CD1-CB 3.98Å; I52-C76 HydrophobicContact CG2-CB 3.92Å; I52-I77 HydrophobicContact CD1-CB 4.11Å; I52-I77 HydrophobicContact CD1-CD1 3.94Å; I52-W80 HydrophobicContact CD1-CB 4.23Å; I52-P88 HydrophobicContact CD1-CG 4.02Å; I52-P88 HydrophobicContact CG1-CB 4.47Å; I52-P88 HydrophobicContact CG1-CG 4.07Å
53	C	98.1	Very high	92.8	Very high	45 Å²	45	84.1 Å²	84.1	30%	0.304	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-9.7	-179.2	63.7	0	0	0	0	113.6	C50 I55	C50-C53 VanDerWaalsContact CB-SG 3.54Å; C50-C53 PolarHBondContact O-N 2.8Å; C53-I55 VanDerWaalsContact C-N 3.29Å; C53-I55 HydrophobicContact CB-CD1 4.23Å; C53-I55 HydrophobicContact CB-CG1 4.33Å; C53-I55 PolarHBondContact O-N 2.66Å
54	M	97.3	Very high	93.3	Very high	152 Å²	152	77.7 Å²	77.7	75%	0.749	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	37	-175.7	-51.8	178.3	-175.1	0	0	112.9	C50	C50-M54 VanDerWaalsContact O-CA 3.29Å; C50-M54 WeakPolarHBondContact O-CA 3.15Å; C50-M54 PolarHBondContact O-N 3Å
55	I	97.4	Very high	94.2	Very high	98 Å²	98	72.7 Å²	72.7	50%	0.503	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.2	179.7	-59.6	172	0	0	0	109.4	E49 C50 C53	E49-I55 WeakPolarHBondContact CA-O 3.35Å; C50-I55 PolarHBondContact N-O 3.3Å; C53-I55 VanDerWaalsContact C-N 3.29Å; C53-I55 HydrophobicContact CB-CD1 4.23Å; C53-I55 HydrophobicContact CB-CG1 4.33Å; C53-I55 PolarHBondContact O-N 2.66Å
56	E	96.5	Very high	95.1	Very high	101 Å²	101	65 Å²	65	47%	0.472	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	140.4	172.3	-68.9	-174.3	-173.5	0	0	111.8	A47 K48 N58	A47-E56 HydrophobicContact CB-CG 4.47Å; K48-E56 WeakPolarHBondContact O-CA 3.01Å; E56-N58 PolarHBondContact O-ND2 3.39Å
57	F	96.7	Very high	95.7	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.018	33%	0.326	C	S	.	.			trans	-70.1	138.5	172	-61.1	-59.2	0	0	0	111	Y40 K48 E49 C50 I63 T71 H73	Y40-F57 HydrophobicContact CD1-CB 3.44Å; Y40-F57 VanDerWaalsContact CD1-CB 3.44Å; Y40-F57 HydrophobicContact CD2-CB 4.12Å; Y40-F57 HydrophobicContact CD2-CD2 4.48Å; Y40-F57 HydrophobicContact CD2-CG 4.47Å; Y40-F57 HydrophobicContact CE1-CB 3.5Å; Y40-F57 HydrophobicContact CE2-CB 4.2Å; Y40-F57 HydrophobicContact CE2-CD2 4.35Å; Y40-F57 HydrophobicContact CG-CB 3.74Å; Y40-F57 HydrophobicContact CG-CG 4.42Å; K48-F57 VanDerWaalsContact C-CD2 3.49Å; K48-F57 HydrophobicContact CB-CD2 3.58Å; K48-F57 HydrophobicContact CB-CE2 3.99Å; K48-F57 VanDerWaalsContact O-CD2 3.3Å; K48-F57 WeakPolarHBondContact O-CD2 3.4Å; K48-F57 PolarHBondContact O-N 2.96Å; E49-F57 VanDerWaalsContact C-CE2 3.48Å; E49-F57 WeakPolarHBondContact O-CE2 3.4Å; C50-F57 HydrophobicContact CB-CE1 3.59Å; C50-F57 HydrophobicContact CB-CZ 3.73Å; F57-I63 HydrophobicContact CD1-CG2 3.6Å; F57-I63 HydrophobicContact CE1-CG2 3.61Å; F57-I63 HydrophobicContact CG-CG2 4.18Å; F57-I63 HydrophobicContact CZ-CG2 4.2Å; F57-T71 HydrophobicContact CE2-CG2 4.43Å; F57-T71 HydrophobicContact CZ-CG2 4.35Å; F57-H73 AromaticContact CD1-CD2 3.83Å; F57-H73 AromaticContact CD1-CE1 3.61Å; F57-H73 AromaticContact CD1-NE2 3.46Å; F57-H73 WeakPolarHBondContact CD1-NE2 3.44Å; F57-H73 AromaticContact CE1-CD2 3.96Å; F57-H73 AromaticContact CE1-CE1 3.78Å; F57-H73 AromaticContact CE1-CG 3.86Å; F57-H73 AromaticContact CE1-ND1 3.76Å; F57-H73 AromaticContact CE1-NE2 3.92Å
58	N	95.3	Very high	96.2	Very high	86 Å²	86	62.8 Å²	62.8	46%	0.46	32%	0.324	S	S	.	.			trans	-106.9	154.6	174.5	-61.6	-74	0	0	0	111.1	Y40 E56 G60 D61	Y40-N58 WeakPolarHBondContact CD1-O 3.32Å; E56-N58 PolarHBondContact O-ND2 3.39Å; N58-G60 PolarHBondContact O-N 2.95Å; N58-D61 PolarHBondContact N-OD2 3.22Å; N58-D61 VanDerWaalsContact O-CB 3.25Å; N58-D61 WeakPolarHBondContact O-CB 3.5Å; N58-D61 PolarHBondContact O-N 3.23Å
59	E	95	Very high	96.2	Very high	120 Å²	120	64.9 Å²	64.9	56%	0.561	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	125.4	174.7	-169.8	72.7	-165.5	0	0	110.4	Y40 K42	Y40-E59 WeakPolarHBondContact O-CA 3.4Å; K42-E59 VanDerWaalsContact CB-OE2 3.26Å; K42-E59 WeakPolarHBondContact CB-OE2 3.4Å; K42-E59 PolarHBondContact N-OE2 3.17Å
60	G	96	Very high	96.2	Very high	34 Å²	34	63 Å²	63	35%	0.351	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-2.5	-178.7	0	0	0	0	0	115.3	Y40 N58 K62	Y40-G60 PolarHBondContact O-N 3.41Å; N58-G60 PolarHBondContact O-N 2.95Å; G60-K62 PolarHBondContact O-N 3.07Å
61	D	97.5	Very high	96.1	Very high	40 Å²	40	64.3 Å²	64.3	21%	0.214	34%	0.336	C	S	.	.			trans	-59.6	132.8	174.2	-82.9	-7.2	0	0	0	110.2	E39 Y40 N58 I63 H73	E39-D61 CarbonylContact C-O 3.59Å; E39-D61 WeakPolarHBondContact CA-O 3.33Å; Y40-D61 PolarHBondContact N-O 2.95Å; N58-D61 PolarHBondContact N-OD2 3.22Å; N58-D61 VanDerWaalsContact O-CB 3.25Å; N58-D61 WeakPolarHBondContact O-CB 3.5Å; N58-D61 PolarHBondContact O-N 3.23Å; D61-I63 PolarHBondContact O-N 2.81Å; D61-I63 VanDerWaalsContact O-N 3.16Å; D61-H73 IonicContact OD2-CD2 3.82Å; D61-H73 IonicContact OD2-CE1 2.8Å; D61-H73 IonicContact OD2-NE2 3.73Å; D61-H73 PolarHBondContact OD2-NE2 2.94Å
62	K	98.1	Very high	96.2	Very high	130 Å²	130	61.1 Å²	61.1	57%	0.565	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	112.8	172.2	-69.1	-177.2	-178.4	177.4	0	109.5	V37 G60 M74	V37-K62 HydrophobicContact CG1-CB 4.34Å; G60-K62 PolarHBondContact O-N 3.07Å; K62-M74 HydrophobicContact CB-CB 4.05Å; K62-M74 HydrophobicContact CB-SD 4.45Å; K62-M74 HydrophobicContact CD-SD 4.24Å; K62-M74 PolarHBondContact O-N 2.79Å
63	I	97.5	Very high	96.2	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.6	177.4	55.3	162.9	0	0	0	110.3	V37 E38 Y40 F57 D61 Y65 T71 Y72	V37-I63 VanDerWaalsContact CA-O 3.31Å; V37-I63 WeakPolarHBondContact CA-O 3.44Å; E38-I63 PolarHBondContact N-O 3.07Å; E38-I63 WeakPolarHBondContact O-CG1 3.41Å; E38-I63 PolarHBondContact O-N 3.1Å; Y40-I63 HydrophobicContact CD2-CD1 3.94Å; Y40-I63 HydrophobicContact CG-CD1 4.48Å; F57-I63 HydrophobicContact CD1-CG2 3.6Å; F57-I63 HydrophobicContact CE1-CG2 3.61Å; F57-I63 HydrophobicContact CG-CG2 4.18Å; F57-I63 HydrophobicContact CZ-CG2 4.2Å; D61-I63 PolarHBondContact O-N 2.81Å; D61-I63 VanDerWaalsContact O-N 3.16Å; I63-Y65 HydrophobicContact CD1-CE2 3.85Å; I63-Y65 WeakPolarHBondContact CD1-OH 3.4Å; I63-Y65 HydrophobicContact CG1-CE2 4.3Å; I63-T71 HydrophobicContact CB-CG2 3.78Å; I63-T71 HydrophobicContact CD1-CG2 3.67Å; I63-T71 HydrophobicContact CG1-CG2 4.25Å; I63-T71 HydrophobicContact CG2-CG2 4.29Å; I63-Y72 CarbonylContact C-O 3.53Å; I63-Y72 WeakPolarHBondContact CA-O 3.47Å
64	R	97.2	Very high	96.2	Very high	12 Å²	12	60.4 Å²	60.4	5%	0.045	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.1	175.8	-179.4	-176.7	-58.7	-84.5	15.9	109.9	L32 L35 P36 V37 T71 Y72 M74 I77 D78	L32-R64 PolarHBondContact O-NH1 3.14Å; L35-R64 HydrophobicContact CB-CG 4.02Å; L35-R64 PolarHBondContact O-NH1 3.38Å; P36-R64 WeakPolarHBondContact O-CA 3.27Å; P36-R64 WeakPolarHBondContact O-CG 3.45Å; V37-R64 HydrophobicContact CG2-CB 4.39Å; V37-R64 HydrophobicContact CG2-CG 4.42Å; R64-T71 WeakPolarHBondContact O-CA 3.43Å; R64-Y72 PolarHBondContact N-O 3.22Å; R64-Y72 PolarHBondContact O-N 3.48Å; R64-M74 HydrophobicContact CB-CB 4.5Å; R64-I77 HydrophobicContact CB-CG2 3.77Å; R64-I77 HydrophobicContact CG-CG2 4.17Å; R64-D78 IonicContact CZ-OD1 2.85Å; R64-D78 IonicContact CZ-OD2 3.17Å; R64-D78 IonicContact NE-OD1 3.64Å; R64-D78 PolarHBondContact NE-OD1 3.06Å; R64-D78 IonicContact NE-OD2 2.66Å; R64-D78 VanDerWaalsContact NH2-CG 3.31Å; R64-D78 IonicContact NH2-OD1 3.95Å; R64-D78 PolarHBondContact NH2-OD1 2.98Å; R64-D78 IonicContact NH2-OD2 3Å; R64-D78 PolarHBondContact NH2-OD2 3.33Å
65	Y	95.4	Very high	96.2	Very high	61 Å²	61	60.8 Å²	60.8	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	132.7	172.8	-62.2	-91.5	0	0	0	110.2	P36 E38 I63 T71	P36-Y65 HydrophobicContact CB-CD2 4.48Å; P36-Y65 PolarHBondContact O-N 3.38Å; P36-Y65 VanDerWaalsContact O-N 3.1Å; E38-Y65 HydrophobicContact CB-CE2 4.15Å; E38-Y65 HydrophobicContact CG-CE2 4.08Å; E38-Y65 VanDerWaalsContact OE2-CE2 3.25Å; E38-Y65 WeakPolarHBondContact OE2-CE2 3.39Å; E38-Y65 PolarHBondContact OE2-OH 3.02Å; I63-Y65 HydrophobicContact CD1-CE2 3.85Å; I63-Y65 WeakPolarHBondContact CD1-OH 3.4Å; I63-Y65 HydrophobicContact CG1-CE2 4.3Å; Y65-T71 HydrophobicContact CD1-CG2 4.25Å; Y65-T71 WeakPolarHBondContact CD1-OG1 3.45Å; Y65-T71 HydrophobicContact CE1-CG2 4.02Å; Y65-T71 WeakPolarHBondContact CE1-OG1 3.46Å
66	L	94.8	Very high	96.2	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.016	30%	0.295	C	S	.	.			trans	-86.3	161.7	167.7	-58.8	-170.4	0	0	0	110.5	L35 C68 M69 H70 Y72 I77 L81 C87 V94	L35-L66 HydrophobicContact CD1-CD2 3.68Å; L66-C68 PolarHBondContact O-N 3.43Å; L66-C68 VanDerWaalsContact O-N 3.11Å; L66-M69 WeakPolarHBondContact O-CA 3.16Å; L66-M69 PolarHBondContact O-N 3.31Å; L66-H70 PolarHBondContact N-O 3.45Å; L66-Y72 HydrophobicContact CD1-CD2 4.33Å; L66-Y72 HydrophobicContact CD1-CE2 3.64Å; L66-Y72 HydrophobicContact CG-CD2 4.28Å; L66-Y72 HydrophobicContact CG-CE2 3.94Å; L66-I77 HydrophobicContact CD1-CD1 4.12Å; L66-I77 HydrophobicContact CD1-CG1 4.38Å; L66-I77 HydrophobicContact CD2-CG1 3.97Å; L66-I77 HydrophobicContact CG-CG1 4.46Å; L66-L81 HydrophobicContact CD2-CD1 3.98Å; L66-C87 HydrophobicContact CD1-CB 3.9Å; L66-V94 HydrophobicContact CD1-CG2 4.05Å; L66-V94 HydrophobicContact CD2-CG1 4.25Å; L66-V94 HydrophobicContact CD2-CG2 4.46Å
67	P	92.2	Very high	96.2	Very high	54 Å²	54	52.8 Å²	52.8	35%	0.351	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-22.8	178.1	-26.5	39.3	0	0	0	113.7	L35 M69 V94 A97	L35-P67 HydrophobicContact CD2-CG 3.84Å; P67-M69 PolarHBondContact O-N 3.13Å; P67-V94 HydrophobicContact CG-CG1 4.39Å; P67-V94 WeakPolarHBondContact CG-O 3.46Å; P67-A97 HydrophobicContact CB-CB 4.09Å
68	C	93.7	Very high	96.1	Very high	49 Å²	49	54.1 Å²	54.1	33%	0.331	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	10.3	172.3	61.5	0	0	0	0	114	L66 H70	L66-C68 PolarHBondContact O-N 3.43Å; L66-C68 VanDerWaalsContact O-N 3.11Å; C68-H70 PolarHBondContact O-N 3.49Å; C68-H70 PolarHBondContact SG-ND1 3.42Å; C68-H70 VanDerWaalsContact SG-ND1 3.37Å
69	M	92.8	Very high	96.1	Very high	147 Å²	147	54.8 Å²	54.8	72%	0.724	28%	0.283	S	S	*	.	S	Bend	trans	66.8	10.8	177	-56.3	-65	149.2	0	0	116.2	L66 P67	L66-M69 WeakPolarHBondContact O-CA 3.16Å; L66-M69 PolarHBondContact O-N 3.31Å; P67-M69 PolarHBondContact O-N 3.13Å
70	H	95.7	Very high	96.1	Very high	65 Å²	65	53.7 Å²	53.7	30%	0.301	27%	0.274	S	S	.	.			trans	-78.5	144.8	168.4	-65.7	100.5	0	0	0	111.1	L66 C68 Y72 C87 S89	L66-H70 PolarHBondContact N-O 3.45Å; C68-H70 PolarHBondContact O-N 3.49Å; C68-H70 PolarHBondContact SG-ND1 3.42Å; C68-H70 VanDerWaalsContact SG-ND1 3.37Å; H70-Y72 HydrophobicContact CB-CE2 3.71Å; H70-Y72 WeakPolarHBondContact CB-OH 3.45Å; H70-C87 PolarHBondContact ND1-SG 3.37Å; H70-S89 WeakPolarHBondContact CD2-CB 3.32Å; H70-S89 WeakPolarHBondContact NE2-CB 3.47Å
71	T	96.7	Very high	96	Very high	27 Å²	27	52 Å²	52	17%	0.166	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140	-172.5	-50.6	0	0	0	0	110.8	F57 I63 R64 Y65	F57-T71 HydrophobicContact CE2-CG2 4.43Å; F57-T71 HydrophobicContact CZ-CG2 4.35Å; I63-T71 HydrophobicContact CB-CG2 3.78Å; I63-T71 HydrophobicContact CD1-CG2 3.67Å; I63-T71 HydrophobicContact CG1-CG2 4.25Å; I63-T71 HydrophobicContact CG2-CG2 4.29Å; R64-T71 WeakPolarHBondContact O-CA 3.43Å; Y65-T71 HydrophobicContact CD1-CG2 4.25Å; Y65-T71 WeakPolarHBondContact CD1-OG1 3.45Å; Y65-T71 HydrophobicContact CE1-CG2 4.02Å; Y65-T71 WeakPolarHBondContact CE1-OG1 3.46Å
72	Y	98.3	Very high	95.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	165	-179	-52.1	-88	0	0	0	109.7	V51 I52 I63 R64 L66 H70 M74 I77 C87 P88 S89	V51-Y72 HydrophobicContact CG2-CD1 4.06Å; V51-Y72 HydrophobicContact CG2-CE1 3.47Å; V51-Y72 VanDerWaalsContact CG2-CE1 3.47Å; I52-Y72 HydrophobicContact CD1-CD1 3.57Å; I52-Y72 HydrophobicContact CD1-CE1 4.19Å; I52-Y72 HydrophobicContact CD1-CG 4.03Å; I52-Y72 HydrophobicContact CG1-CD1 3.74Å; I52-Y72 HydrophobicContact CG1-CE1 4.14Å; I63-Y72 CarbonylContact C-O 3.53Å; I63-Y72 WeakPolarHBondContact CA-O 3.47Å; R64-Y72 PolarHBondContact N-O 3.22Å; R64-Y72 PolarHBondContact O-N 3.48Å; L66-Y72 HydrophobicContact CD1-CD2 4.33Å; L66-Y72 HydrophobicContact CD1-CE2 3.64Å; L66-Y72 HydrophobicContact CG-CD2 4.28Å; L66-Y72 HydrophobicContact CG-CE2 3.94Å; H70-Y72 HydrophobicContact CB-CE2 3.71Å; H70-Y72 WeakPolarHBondContact CB-OH 3.45Å; Y72-M74 PolarHBondContact O-N 3.49Å; Y72-I77 HydrophobicContact CD2-CB 4.02Å; Y72-I77 HydrophobicContact CD2-CD1 3.77Å; Y72-I77 HydrophobicContact CD2-CG1 3.75Å; Y72-I77 HydrophobicContact CE2-CD1 3.96Å; Y72-I77 HydrophobicContact CE2-CG1 4.35Å; Y72-I77 HydrophobicContact CG-CB 3.95Å; Y72-I77 HydrophobicContact CG-CD1 4.1Å; Y72-I77 HydrophobicContact CG-CG1 4.15Å; Y72-C87 PolarHBondContact OH-SG 3.28Å; Y72-P88 HydrophobicContact CE1-CB 3.98Å; Y72-P88 HydrophobicContact CE1-CG 3.76Å; Y72-P88 WeakPolarHBondContact OH-CD 3.5Å; Y72-S89 VanDerWaalsContact OH-CB 3.26Å; Y72-S89 WeakPolarHBondContact OH-CB 3.24Å; Y72-S89 PolarHBondContact OH-N 3Å; Y72-S89 PolarHBondContact OH-OG 3.4Å
73	H	98.5	Very high	95.2	Very high	28 Å²	28	56.6 Å²	56.6	13%	0.13	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	136.5	162.6	-71.9	109.4	0	0	0	108.9	C50 F57 D61 E75 C76 I77	C50-H73 WeakPolarHBondContact CB-ND1 3.44Å; F57-H73 AromaticContact CD1-CD2 3.83Å; F57-H73 AromaticContact CD1-CE1 3.61Å; F57-H73 AromaticContact CD1-NE2 3.46Å; F57-H73 WeakPolarHBondContact CD1-NE2 3.44Å; F57-H73 AromaticContact CE1-CD2 3.96Å; F57-H73 AromaticContact CE1-CE1 3.78Å; F57-H73 AromaticContact CE1-CG 3.86Å; F57-H73 AromaticContact CE1-ND1 3.76Å; F57-H73 AromaticContact CE1-NE2 3.92Å; D61-H73 IonicContact OD2-CD2 3.82Å; D61-H73 IonicContact OD2-CE1 2.8Å; D61-H73 IonicContact OD2-NE2 3.73Å; D61-H73 PolarHBondContact OD2-NE2 2.94Å; H73-E75 VanDerWaalsContact C-N 3.29Å; H73-E75 PolarHBondContact O-N 3.29Å; H73-C76 HydrophobicContact CB-CB 4.03Å; H73-C76 PolarHBondContact O-N 2.87Å; H73-C76 VanDerWaalsContact O-N 3.13Å; H73-I77 WeakPolarHBondContact O-CG2 3.49Å; H73-I77 PolarHBondContact O-N 2.86Å; H73-I77 VanDerWaalsContact O-N 3.07Å
74	M	97.4	Very high	94.9	Very high	56 Å²	56	58.6 Å²	58.6	28%	0.276	29%	0.286	S	S	.	.	H	α-helix	trans	-50.9	-49.8	-178.7	176.4	-174.2	164.8	0	0	111.2	V37 K62 R64 Y72 C76 I77 D78	V37-M74 HydrophobicContact CG1-CG 4.43Å; V37-M74 HydrophobicContact CG1-SD 3.81Å; V37-M74 HydrophobicContact CG2-CG 4.31Å; V37-M74 HydrophobicContact CG2-SD 4.12Å; K62-M74 HydrophobicContact CB-CB 4.05Å; K62-M74 HydrophobicContact CB-SD 4.45Å; K62-M74 HydrophobicContact CD-SD 4.24Å; K62-M74 PolarHBondContact O-N 2.79Å; R64-M74 HydrophobicContact CB-CB 4.5Å; Y72-M74 PolarHBondContact O-N 3.49Å; M74-C76 PolarHBondContact O-N 2.9Å; M74-I77 WeakPolarHBondContact O-CG2 3.46Å; M74-I77 PolarHBondContact O-N 2.89Å; M74-D78 VanDerWaalsContact O-CB 3.32Å; M74-D78 WeakPolarHBondContact O-CB 3.44Å; M74-D78 PolarHBondContact O-N 3.07Å
75	E	97.1	Very high	94.7	Very high	159 Å²	159	59.1 Å²	59.1	74%	0.743	29%	0.289	S	S	*	.	H	α-helix	trans	-63.3	-43.6	-179.2	-61.2	-176.6	172.6	0	0	112.1	H73 I77 D78 D79	H73-E75 VanDerWaalsContact C-N 3.29Å; H73-E75 PolarHBondContact O-N 3.29Å; E75-I77 PolarHBondContact O-N 2.99Å; E75-D78 PolarHBondContact O-N 3.43Å; E75-D79 WeakPolarHBondContact O-CB 3.43Å; E75-D79 PolarHBondContact O-N 3.37Å; E75-D79 VanDerWaalsContact O-N 3.13Å
76	C	98.1	Very high	94.6	Very high	32 Å²	32	58 Å²	58	22%	0.216	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-43.9	-178.7	-65.4	0	0	0	0	112.3	I52 H73 M74 W80	I52-C76 HydrophobicContact CB-CB 4.01Å; I52-C76 HydrophobicContact CD1-CB 3.98Å; I52-C76 HydrophobicContact CG2-CB 3.92Å; H73-C76 HydrophobicContact CB-CB 4.03Å; H73-C76 PolarHBondContact O-N 2.87Å; H73-C76 VanDerWaalsContact O-N 3.13Å; M74-C76 PolarHBondContact O-N 2.9Å; C76-W80 WeakPolarHBondContact O-CB 3.37Å; C76-W80 PolarHBondContact O-N 2.87Å
77	I	96.7	Very high	94.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-79.3	-31.9	-178.3	-169.2	61.2	0	0	0	112.6	I52 R64 L66 Y72 H73 M74 E75 W80 L81 P88	I52-I77 HydrophobicContact CD1-CB 4.11Å; I52-I77 HydrophobicContact CD1-CD1 3.94Å; R64-I77 HydrophobicContact CB-CG2 3.77Å; R64-I77 HydrophobicContact CG-CG2 4.17Å; L66-I77 HydrophobicContact CD1-CD1 4.12Å; L66-I77 HydrophobicContact CD1-CG1 4.38Å; L66-I77 HydrophobicContact CD2-CG1 3.97Å; L66-I77 HydrophobicContact CG-CG1 4.46Å; Y72-I77 HydrophobicContact CD2-CB 4.02Å; Y72-I77 HydrophobicContact CD2-CD1 3.77Å; Y72-I77 HydrophobicContact CD2-CG1 3.75Å; Y72-I77 HydrophobicContact CE2-CD1 3.96Å; Y72-I77 HydrophobicContact CE2-CG1 4.35Å; Y72-I77 HydrophobicContact CG-CB 3.95Å; Y72-I77 HydrophobicContact CG-CD1 4.1Å; Y72-I77 HydrophobicContact CG-CG1 4.15Å; H73-I77 WeakPolarHBondContact O-CG2 3.49Å; H73-I77 PolarHBondContact O-N 2.86Å; H73-I77 VanDerWaalsContact O-N 3.07Å; M74-I77 WeakPolarHBondContact O-CG2 3.46Å; M74-I77 PolarHBondContact O-N 2.89Å; E75-I77 PolarHBondContact O-N 2.99Å; I77-W80 HydrophobicContact CD1-CB 4.29Å; I77-W80 HydrophobicContact CD1-CG 4.38Å; I77-W80 PolarHBondContact O-N 3.18Å; I77-L81 HydrophobicContact CD1-CD1 4.25Å; I77-L81 HydrophobicContact CD1-CD2 4.39Å; I77-L81 HydrophobicContact CD1-CG 4.01Å; I77-L81 HydrophobicContact CG1-CD1 3.83Å; I77-L81 HydrophobicContact CG1-CG 4.04Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.24Å; I77-L81 WeakPolarHBondContact O-CG 3.25Å; I77-L81 PolarHBondContact O-N 2.72Å; I77-P88 HydrophobicContact CD1-CG 3.87Å
78	D	95.1	Very high	94.9	Very high	32 Å²	32	56.6 Å²	56.6	17%	0.171	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-46.8	175.6	-72.6	1	0	0	0	110.4	R64 M74 E75 W80 L81 M82	R64-D78 IonicContact CZ-OD1 2.85Å; R64-D78 IonicContact CZ-OD2 3.17Å; R64-D78 IonicContact NE-OD1 3.64Å; R64-D78 PolarHBondContact NE-OD1 3.06Å; R64-D78 IonicContact NE-OD2 2.66Å; R64-D78 VanDerWaalsContact NH2-CG 3.31Å; R64-D78 IonicContact NH2-OD1 3.95Å; R64-D78 PolarHBondContact NH2-OD1 2.98Å; R64-D78 IonicContact NH2-OD2 3Å; R64-D78 PolarHBondContact NH2-OD2 3.33Å; M74-D78 VanDerWaalsContact O-CB 3.32Å; M74-D78 WeakPolarHBondContact O-CB 3.44Å; M74-D78 PolarHBondContact O-N 3.07Å; E75-D78 PolarHBondContact O-N 3.43Å; D78-W80 VanDerWaalsContact C-N 3.31Å; D78-W80 PolarHBondContact O-N 3.41Å; D78-L81 PolarHBondContact O-N 3.21Å; D78-M82 WeakPolarHBondContact O-CG 3.2Å; D78-M82 PolarHBondContact O-N 3.19Å; D78-M82 VanDerWaalsContact O-N 3.16Å
79	D	94.6	Very high	95	Very high	99 Å²	99	56.9 Å²	56.9	53%	0.529	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-35.9	175.7	-89	6.2	0	0	0	113.3	E75 R83	E75-D79 WeakPolarHBondContact O-CB 3.43Å; E75-D79 PolarHBondContact O-N 3.37Å; E75-D79 VanDerWaalsContact O-N 3.13Å; D79-R83 PolarHBondContact O-NH1 3.21Å
80	W	95.2	Very high	95.2	Very high	97 Å²	97	52 Å²	52	37%	0.367	26%	0.262	S	S	.	.	H	α-helix	trans	-66.2	-48.6	175.5	177.8	-83.7	0	0	0	111.2	I52 C76 I77 D78 M82 R83 S84 T86 P88	I52-W80 HydrophobicContact CD1-CB 4.23Å; C76-W80 WeakPolarHBondContact O-CB 3.37Å; C76-W80 PolarHBondContact O-N 2.87Å; I77-W80 HydrophobicContact CD1-CB 4.29Å; I77-W80 HydrophobicContact CD1-CG 4.38Å; I77-W80 PolarHBondContact O-N 3.18Å; D78-W80 VanDerWaalsContact C-N 3.31Å; D78-W80 PolarHBondContact O-N 3.41Å; W80-M82 VanDerWaalsContact C-N 3.27Å; W80-M82 PolarHBondContact O-N 2.86Å; W80-R83 PolarHBondContact O-N 3.16Å; W80-S84 PolarHBondContact O-N 3.1Å; W80-T86 PolarHBondContact NE1-O 3.2Å; W80-P88 HydrophobicContact CD2-CG 3.93Å; W80-P88 HydrophobicContact CG-CG 4.07Å; W80-P88 HydrophobicContact CZ2-CB 4.2Å; W80-P88 HydrophobicContact CZ2-CG 4.18Å
81	L	93.5	Very high	95.1	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-69.7	-22.1	-174.2	-69.5	178.9	0	0	0	113.8	C28 L32 L35 L66 I77 D78 R83 S84 F85 V94	C28-L81 PolarHBondContact SG-O 2.91Å; L32-L81 HydrophobicContact CD1-CB 4.32Å; L32-L81 HydrophobicContact CD2-CB 3.91Å; L32-L81 HydrophobicContact CD2-CD1 3.36Å; L32-L81 HydrophobicContact CD2-CG 4.24Å; L32-L81 HydrophobicContact CG-CB 4.43Å; L32-L81 HydrophobicContact CG-CD1 4.45Å; L35-L81 HydrophobicContact CD1-CD1 4.28Å; L66-L81 HydrophobicContact CD2-CD1 3.98Å; I77-L81 HydrophobicContact CD1-CD1 4.25Å; I77-L81 HydrophobicContact CD1-CD2 4.39Å; I77-L81 HydrophobicContact CD1-CG 4.01Å; I77-L81 HydrophobicContact CG1-CD1 3.83Å; I77-L81 HydrophobicContact CG1-CG 4.04Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.24Å; I77-L81 WeakPolarHBondContact O-CG 3.25Å; I77-L81 PolarHBondContact O-N 2.72Å; D78-L81 PolarHBondContact O-N 3.21Å; L81-R83 PolarHBondContact O-N 2.86Å; L81-S84 WeakPolarHBondContact CA-O 3.34Å; L81-S84 WeakPolarHBondContact CD2-O 3.21Å; L81-F85 HydrophobicContact CB-CD2 4.3Å; L81-F85 HydrophobicContact CD2-CD2 4.25Å; L81-V94 HydrophobicContact CD1-CG2 4.24Å; L81-V94 HydrophobicContact CD2-CG2 3.45Å; L81-V94 VanDerWaalsContact CD2-CG2 3.45Å
82	M	89.4	Confident	95	Very high	86 Å²	86	59 Å²	59	42%	0.424	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.8	168.3	-71.3	-57.8	-63.6	0	0	112.9	A25 L29 L32 D78 W80	A25-M82 HydrophobicContact CB-CE 4.48Å; L29-M82 HydrophobicContact CD2-SD 4Å; L29-M82 HydrophobicContact CG-SD 4.29Å; L32-M82 HydrophobicContact CD1-SD 4.18Å; D78-M82 WeakPolarHBondContact O-CG 3.2Å; D78-M82 PolarHBondContact O-N 3.19Å; D78-M82 VanDerWaalsContact O-N 3.16Å; W80-M82 VanDerWaalsContact C-N 3.27Å; W80-M82 PolarHBondContact O-N 2.86Å
83	R	89.7	Confident	94.7	Very high	180 Å²	180	61.6 Å²	61.6	68%	0.679	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-50.9	179.8	-61.4	174.2	177.5	100	-7.2	111.5	K24 D79 W80 L81	K24-R83 PolarHBondContact NZ-O 2.79Å; D79-R83 PolarHBondContact O-NH1 3.21Å; W80-R83 PolarHBondContact O-N 3.16Å; L81-R83 PolarHBondContact O-N 2.86Å
84	S	91.8	Very high	94.4	Very high	44 Å²	44	60.5 Å²	60.5	31%	0.308	31%	0.308	S	S	.	.			trans	-130.5	115.4	-178.4	-169.9	0	0	0	0	110.3	W80 L81 T86	W80-S84 PolarHBondContact O-N 3.1Å; L81-S84 WeakPolarHBondContact CA-O 3.34Å; L81-S84 WeakPolarHBondContact CD2-O 3.21Å; S84-T86 PolarHBondContact O-N 2.97Å; S84-T86 PolarHBondContact OG-OG1 3Å
85	F	91.8	Very high	93.9	Very high	22 Å²	22	58 Å²	58	10%	0.096	30%	0.296	C	S	.	.			trans	-81.3	44.1	-178	-157.5	-109.7	0	0	0	113	C28 I31 L81 P93 V94 D95	C28-F85 HydrophobicContact CB-CD2 3.92Å; C28-F85 HydrophobicContact CB-CE2 4.11Å; C28-F85 WeakPolarHBondContact SG-CD2 3.26Å; I31-F85 HydrophobicContact CB-CE2 4.28Å; I31-F85 HydrophobicContact CB-CZ 3.65Å; I31-F85 HydrophobicContact CD1-CE1 3.42Å; I31-F85 VanDerWaalsContact CD1-CE1 3.42Å; I31-F85 HydrophobicContact CD1-CE2 4.35Å; I31-F85 HydrophobicContact CD1-CZ 3.27Å; I31-F85 HydrophobicContact CG1-CZ 4.05Å; I31-F85 HydrophobicContact CG2-CE2 4.48Å; I31-F85 HydrophobicContact CG2-CZ 3.69Å; L81-F85 HydrophobicContact CB-CD2 4.3Å; L81-F85 HydrophobicContact CD2-CD2 4.25Å; F85-P93 WeakPolarHBondContact O-CA 3.42Å; F85-V94 HydrophobicContact CD1-CB 4.28Å; F85-V94 HydrophobicContact CE1-CB 3.78Å; F85-V94 HydrophobicContact CE1-CG1 4.41Å; F85-V94 HydrophobicContact CE2-CB 4.3Å; F85-V94 HydrophobicContact CZ-CB 3.76Å; F85-V94 HydrophobicContact CZ-CG1 3.98Å; F85-V94 PolarHBondContact O-N 3.23Å; F85-D95 HydrophobicContact CE1-CB 3.92Å; F85-D95 WeakPolarHBondContact CE1-OD2 3.26Å
86	T	93.9	Very high	93.1	Very high	38 Å²	38	53 Å²	53	23%	0.233	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-131.5	144.9	-175.9	55.4	0	0	0	0	110	W80 S84 P88 E92	W80-T86 PolarHBondContact NE1-O 3.2Å; S84-T86 PolarHBondContact O-N 2.97Å; S84-T86 PolarHBondContact OG-OG1 3Å; T86-P88 WeakPolarHBondContact O-CD 3.2Å; T86-E92 WeakPolarHBondContact CA-O 3.43Å
87	C	95.7	Very high	91.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.29	C	S	.	.			trans	-65	125.3	176	175.5	0	0	0	0	110.7	L66 H70 Y72 S89 C90 L91 E92	L66-C87 HydrophobicContact CD1-CB 3.9Å; H70-C87 PolarHBondContact ND1-SG 3.37Å; Y72-C87 PolarHBondContact OH-SG 3.28Å; C87-S89 PolarHBondContact O-N 3.36Å; C87-S89 PolarHBondContact SG-N 3.45Å; C87-S89 VanDerWaalsContact SG-N 3.41Å; C87-C90 VanDerWaalsContact CB-SG 3.51Å; C87-L91 WeakPolarHBondContact O-CA 3.31Å; C87-L91 PolarHBondContact O-N 2.85Å; C87-E92 PolarHBondContact N-O 3.49Å
88	P	96.8	Very high	90.4	Very high	28 Å²	28	58 Å²	58	18%	0.182	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.8	176	-21.9	27.1	0	0	0	114.4	I52 Y72 I77 W80 T86	I52-P88 HydrophobicContact CD1-CG 4.02Å; I52-P88 HydrophobicContact CG1-CB 4.47Å; I52-P88 HydrophobicContact CG1-CG 4.07Å; Y72-P88 HydrophobicContact CE1-CB 3.98Å; Y72-P88 HydrophobicContact CE1-CG 3.76Å; Y72-P88 WeakPolarHBondContact OH-CD 3.5Å; I77-P88 HydrophobicContact CD1-CG 3.87Å; W80-P88 HydrophobicContact CD2-CG 3.93Å; W80-P88 HydrophobicContact CG-CG 4.07Å; W80-P88 HydrophobicContact CZ2-CB 4.2Å; W80-P88 HydrophobicContact CZ2-CG 4.18Å; T86-P88 WeakPolarHBondContact O-CD 3.2Å
89	S	96.8	Very high	88.8	Confident	54 Å²	54	60.6 Å²	60.6	38%	0.378	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-36.4	-172.2	-61.4	0	0	0	0	114	H70 Y72 C87	H70-S89 WeakPolarHBondContact CD2-CB 3.32Å; H70-S89 WeakPolarHBondContact NE2-CB 3.47Å; Y72-S89 VanDerWaalsContact OH-CB 3.26Å; Y72-S89 WeakPolarHBondContact OH-CB 3.24Å; Y72-S89 PolarHBondContact OH-N 3Å; Y72-S89 PolarHBondContact OH-OG 3.4Å; C87-S89 PolarHBondContact O-N 3.36Å; C87-S89 PolarHBondContact SG-N 3.45Å; C87-S89 VanDerWaalsContact SG-N 3.41Å
90	C	96.2	Very high	87.1	Confident	44 Å²	44	59.2 Å²	59.2	30%	0.297	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-3.3	-178.9	67.8	0	0	0	0	114.4	C87 E92	C87-C90 VanDerWaalsContact CB-SG 3.51Å; C90-E92 PolarHBondContact O-N 3.11Å
91	L	94.9	Very high	85.2	Confident	130 Å²	130	58.5 Å²	58.5	68%	0.681	33%	0.325	S	S	*	.			trans	63.5	1.1	179.4	-49.9	178.7	0	0	0	115.6	C87	C87-L91 WeakPolarHBondContact O-CA 3.31Å; C87-L91 PolarHBondContact O-N 2.85Å
92	E	93.5	Very high	83.6	Confident	109 Å²	109	64.6 Å²	64.6	51%	0.509	35%	0.352	S	S	.	.			trans	-74.1	146.1	175.4	-67.5	-59.3	141.1	0	0	112.3	T86 C87 C90	T86-E92 WeakPolarHBondContact CA-O 3.43Å; C87-E92 PolarHBondContact N-O 3.49Å; C90-E92 PolarHBondContact O-N 3.11Å
93	P	91.9	Very high	81.9	Confident	56 Å²	56	61.3 Å²	61.3	36%	0.364	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-57.4	137.4	171.3	-22.3	33.4	0	0	0	111.7	F85 D95 S96	F85-P93 WeakPolarHBondContact O-CA 3.42Å; P93-D95 PolarHBondContact O-N 3.47Å; P93-D95 VanDerWaalsContact O-N 3.17Å; P93-S96 WeakPolarHBondContact O-CB 3.25Å; P93-S96 PolarHBondContact O-N 3.4Å
94	V	91.7	Very high	79.9	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.024	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.1	-177.1	174.7	0	0	0	0	112.4	I31 L35 L66 P67 L81 F85	I31-V94 HydrophobicContact CG2-CG1 4.26Å; L35-V94 HydrophobicContact CD1-CG1 4.08Å; L35-V94 HydrophobicContact CD2-CG1 4.42Å; L66-V94 HydrophobicContact CD1-CG2 4.05Å; L66-V94 HydrophobicContact CD2-CG1 4.25Å; L66-V94 HydrophobicContact CD2-CG2 4.46Å; P67-V94 HydrophobicContact CG-CG1 4.39Å; P67-V94 WeakPolarHBondContact CG-O 3.46Å; L81-V94 HydrophobicContact CD1-CG2 4.24Å; L81-V94 HydrophobicContact CD2-CG2 3.45Å; L81-V94 VanDerWaalsContact CD2-CG2 3.45Å; F85-V94 HydrophobicContact CD1-CB 4.28Å; F85-V94 HydrophobicContact CE1-CB 3.78Å; F85-V94 HydrophobicContact CE1-CG1 4.41Å; F85-V94 HydrophobicContact CE2-CB 4.3Å; F85-V94 HydrophobicContact CZ-CB 3.76Å; F85-V94 HydrophobicContact CZ-CG1 3.98Å; F85-V94 PolarHBondContact O-N 3.23Å
95	D	86.8	Confident	78	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	12.9	177.3	53.7	12.4	0	0	0	114.9	R27 I31 F85 P93 A97 L98 F99	R27-D95 IonicContact CZ-OD2 3.13Å; R27-D95 IonicContact NE-OD2 2.9Å; R27-D95 PolarHBondContact NE-OD2 2.87Å; R27-D95 IonicContact NH2-OD1 3.45Å; R27-D95 PolarHBondContact NH2-OD1 3.26Å; R27-D95 IonicContact NH2-OD2 2.6Å; R27-D95 PolarHBondContact NH2-OD2 3.5Å; I31-D95 HydrophobicContact CD1-CB 3.78Å; F85-D95 HydrophobicContact CE1-CB 3.92Å; F85-D95 WeakPolarHBondContact CE1-OD2 3.26Å; P93-D95 PolarHBondContact O-N 3.47Å; P93-D95 VanDerWaalsContact O-N 3.17Å; D95-A97 PolarHBondContact O-N 3.43Å; D95-L98 HydrophobicContact CB-CB 4.13Å; D95-L98 HydrophobicContact CB-CD1 3.81Å; D95-L98 HydrophobicContact CB-CG 4.11Å; D95-L98 WeakPolarHBondContact O-CA 3.4Å; D95-L98 WeakPolarHBondContact O-CB 3.46Å; D95-L98 PolarHBondContact O-N 2.91Å; D95-F99 HydrophobicContact CB-CD2 4.34Å; D95-F99 HydrophobicContact CB-CE2 4.06Å; D95-F99 VanDerWaalsContact O-CD2 3.27Å; D95-F99 WeakPolarHBondContact O-CD2 3.47Å; D95-F99 PolarHBondContact O-N 2.77Å; D95-F99 VanDerWaalsContact O-N 3.1Å; D95-F99 WeakPolarHBondContact OD1-CE2 3.29Å; D95-F99 WeakPolarHBondContact OD2-CE2 3.37Å
96	S	81.4	Confident	75.9	Confident	54 Å²	54	70.8 Å²	70.8	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-54.4	-31.1	174.5	-165.8	0	0	0	0	112.1	P93 S100	P93-S96 WeakPolarHBondContact O-CB 3.25Å; P93-S96 PolarHBondContact O-N 3.4Å; S96-S100 PolarHBondContact O-N 3.32Å; S96-S100 PolarHBondContact O-OG 3.09Å
97	A	69.4	Low	73.9	Confident	54 Å²	54	75.1 Å²	75.1	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-70.9	-33.2	173.3	0	0	0	0	0	113.3	P67 D95 S100	P67-A97 HydrophobicContact CB-CB 4.09Å; D95-A97 PolarHBondContact O-N 3.43Å; A97-S100 PolarHBondContact O-N 3.22Å
98	L	68.1	Low	71.7	Confident	82 Å²	82	79.8 Å²	79.8	43%	0.429	44%	0.438	S	S	.	.	H	α-helix	trans	-72.1	-40.6	179.2	-58.2	-179.7	0	0	0	111.4	I31 D95 S100 T101 F102	I31-L98 HydrophobicContact CD1-CD1 4.05Å; I31-L98 HydrophobicContact CG1-CD1 3.94Å; D95-L98 HydrophobicContact CB-CB 4.13Å; D95-L98 HydrophobicContact CB-CD1 3.81Å; D95-L98 HydrophobicContact CB-CG 4.11Å; D95-L98 WeakPolarHBondContact O-CA 3.4Å; D95-L98 WeakPolarHBondContact O-CB 3.46Å; D95-L98 PolarHBondContact O-N 2.91Å; L98-S100 PolarHBondContact O-N 2.94Å; L98-T101 PolarHBondContact O-N 2.85Å; L98-T101 VanDerWaalsContact O-N 3.14Å; L98-F102 WeakPolarHBondContact O-CD2 3.44Å; L98-F102 PolarHBondContact O-N 3.48Å
99	F	61	Low	69.3	Low	87 Å²	87	84.8 Å²	84.8	38%	0.382	46%	0.463	S	S	.	.	H	α-helix	trans	-69.4	-23.3	175.5	-68	-69.6	0	0	0	113.1	D95 T101 G103	D95-F99 HydrophobicContact CB-CD2 4.34Å; D95-F99 HydrophobicContact CB-CE2 4.06Å; D95-F99 VanDerWaalsContact O-CD2 3.27Å; D95-F99 WeakPolarHBondContact O-CD2 3.47Å; D95-F99 PolarHBondContact O-N 2.77Å; D95-F99 VanDerWaalsContact O-N 3.1Å; D95-F99 WeakPolarHBondContact OD1-CE2 3.29Å; D95-F99 WeakPolarHBondContact OD2-CE2 3.37Å; F99-T101 PolarHBondContact O-N 2.83Å; F99-G103 WeakPolarHBondContact O-CA 3.23Å; F99-G103 PolarHBondContact O-N 3.3Å
100	S	58.8	Low	67	Low	71 Å²	71	90.1 Å²	90.1	50%	0.497	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-31.9	172.7	-60.8	0	0	0	0	111.2	S96 A97 L98 Q104	S96-S100 PolarHBondContact O-N 3.32Å; S96-S100 PolarHBondContact O-OG 3.09Å; A97-S100 PolarHBondContact O-N 3.22Å; L98-S100 PolarHBondContact O-N 2.94Å; S100-Q104 WeakPolarHBondContact O-CG 3.5Å
101	T	57	Low	64.8	Low	81 Å²	81	95.7 Å²	95.7	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-80.2	-44.9	176.1	-46.8	0	0	0	0	112	L98 F99 M105	L98-T101 PolarHBondContact O-N 2.85Å; L98-T101 VanDerWaalsContact O-N 3.14Å; F99-T101 PolarHBondContact O-N 2.83Å; T101-M105 HydrophobicContact CG2-CE 3.85Å; T101-M105 WeakPolarHBondContact O-CE 3.13Å; T101-M105 WeakPolarHBondContact O-CG 3.41Å
102	F	58.6	Low	62.3	Low	128 Å²	128	99.7 Å²	99.7	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-83.3	-26.4	-177.9	-71.5	-75.2	0	0	0	114.1	L98 Q104 M105 Y106	L98-F102 WeakPolarHBondContact O-CD2 3.44Å; L98-F102 PolarHBondContact O-N 3.48Å; F102-Q104 VanDerWaalsContact C-N 3.33Å; F102-Q104 PolarHBondContact O-N 2.87Å; F102-M105 HydrophobicContact CD1-CE 4.09Å; F102-M105 HydrophobicContact CD1-SD 4.18Å; F102-M105 HydrophobicContact CE1-CE 4.36Å; F102-M105 WeakPolarHBondContact O-CB 3.3Å; F102-M105 PolarHBondContact O-N 2.84Å; F102-Y106 WeakPolarHBondContact O-CD1 3.16Å; F102-Y106 PolarHBondContact O-N 2.76Å
103	G	54.3	Low	60.3	Low	18 Å²	18	99 Å²	99	19%	0.186	52%	0.519	C	S	.	.	H	α-helix	trans	-69.4	-24.6	177.3	0	0	0	0	0	115	F99 M105 D107	F99-G103 WeakPolarHBondContact O-CA 3.23Å; F99-G103 PolarHBondContact O-N 3.3Å; G103-M105 PolarHBondContact O-N 3.23Å; G103-D107 PolarHBondContact O-N 3.24Å
104	Q	47.9	Very low	57.9	Low	169 Å²	169	101.3 Å²	101.3	79%	0.79	54%	0.537	S	S	*	.	H	α-helix	trans	-77.7	-6.8	169.1	-66.5	-177.7	9.2	0	0	112.7	S100 F102	S100-Q104 WeakPolarHBondContact O-CG 3.5Å; F102-Q104 VanDerWaalsContact C-N 3.33Å; F102-Q104 PolarHBondContact O-N 2.87Å
105	M	51.4	Low	56	Low	118 Å²	118	105.5 Å²	105.5	58%	0.581	57%	0.566	S	S	*	*	H	α-helix	trans	-101.8	-15.2	178	-38.2	-168.6	-164	0	0	112.8	T101 F102 G103	T101-M105 HydrophobicContact CG2-CE 3.85Å; T101-M105 WeakPolarHBondContact O-CE 3.13Å; T101-M105 WeakPolarHBondContact O-CG 3.41Å; F102-M105 HydrophobicContact CD1-CE 4.09Å; F102-M105 HydrophobicContact CD1-SD 4.18Å; F102-M105 HydrophobicContact CE1-CE 4.36Å; F102-M105 WeakPolarHBondContact O-CB 3.3Å; F102-M105 PolarHBondContact O-N 2.84Å; G103-M105 PolarHBondContact O-N 3.23Å
106	Y	48.4	Very low	54	Low	157 Å²	157	115 Å²	115	62%	0.616	63%	0.632	S	S	*	*	H	α-helix	trans	-116.6	7.9	176.7	74.2	-105.7	0	0	0	114.3	F102 S108	F102-Y106 WeakPolarHBondContact O-CD1 3.16Å; F102-Y106 PolarHBondContact O-N 2.76Å; Y106-S108 PolarHBondContact O-N 3.29Å
107	D	51.4	Low	52.6	Low	130 Å²	130	118 Å²	118	70%	0.695	65%	0.645	S	S	*	*			trans	-76	63.8	155.5	-156.7	7.8	0	0	0	109.3	G103	G103-D107 PolarHBondContact O-N 3.24Å
108	S	49.2	Very low	51.8	Low	97 Å²	97	121.4 Å²	121.4	68%	0.678	66%	0.656	S	S	*	*			trans	-134.1	51.5	168.8	-68	0	0	0	0	107	Y106	Y106-S108 PolarHBondContact O-N 3.29Å
109	N	47.6	Very low	50.9	Low	133 Å²	133	123.6 Å²	123.6	71%	0.711	67%	0.668	S	S	*	*			trans	-120.5	31.6	155.1	-152	39.3	0	0	0	110.8
110	E	48.1	Very low	50.3	Low	167 Å²	167	125.7 Å²	125.7	78%	0.78	69%	0.685	S	S	*	*			trans	-71.2	142.3	135.9	-70.9	-166.4	111.4	0	0	107.6
111	L	48.9	Very low	49.7	Very low	161 Å²	161	129.1 Å²	129.1	84%	0.843	70%	0.697	S	S	*	*			trans	87.9	57.6	-171.7	-46	178.6	0	0	0	114.9	P113	L111-P113 WeakPolarHBondContact O-CD 3.5Å
112	W	43.2	Very low	49.2	Very low	214 Å²	214	132.3 Å²	132.3	81%	0.811	71%	0.71	S	S	*	*			trans	-74.2	104.4	143.5	179.7	-94.5	0	0	0	108.5	S114	W112-S114 PolarHBondContact O-N 3.03Å
113	P	51	Low	48.6	Very low	93 Å²	93	132.6 Å²	132.6	60%	0.604	72%	0.721	S	S	*	*			trans	-81.4	102.6	164.2	34.5	-31.7	0	0	0	107.1	L111 S115	L111-P113 WeakPolarHBondContact O-CD 3.5Å; P113-S115 WeakPolarHBondContact CB-OG 3.26Å; P113-S115 PolarHBondContact O-N 3Å; P113-S115 PolarHBondContact O-OG 3.2Å
114	S	41	Very low	48.1	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	76%	0.762	S	S	*	*			trans	-51.8	99.2	152.2	42.5	0	0	0	0	107.4	W112	W112-S114 PolarHBondContact O-N 3.03Å
115	S	51.9	Low	48.2	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	76%	0.76	S	S	*	*			trans	-118.2	113.4	-178.3	-47.7	0	0	0	0	108.1	P113	P113-S115 WeakPolarHBondContact CB-OG 3.26Å; P113-S115 PolarHBondContact O-N 3Å; P113-S115 PolarHBondContact O-OG 3.2Å
116	S	45.8	Very low	47.9	Very low	203 Å²	203	141.1 Å²	141.1	100%	1.42	78%	0.776	S	S	*	*			trans	84.8	0	178.8	-52.3	0	0	0	0	116.3

Retrieved 116 of 116 residues in 34.5 ms (Link to these results)

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