A0A077YWD8_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YWD8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 113 aa.

						>A0A077YWD8_TRITR|A0A077YWD8
MPQLAFDVGSGDEPPIIGCHLGDHEECDELCKRSNWLYGHCRHLDSFTLKCQCYPYKATLDPTVCTQEQHAFCEHSCINQRGLSGGYCYPHASRKKHRSTARCACFNRIPVYV
					

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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	36.4	Very low	36.7	Very low	230 Å²	230	138.2 Å²	138.2	100%	1.133	82%	0.824	S	S	*	*				0	117.2	0	-66.9	-173.2	163.3	0	0	107.1	Q3	M1-Q3 PolarHBondContact O-N 3.08Å
2	P	35.2	Very low	37.9	Very low	131 Å²	131	141.5 Å²	141.5	85%	0.851	84%	0.835	S	S	*	*			trans	-71.6	125.6	178.4	-8.2	24.5	0	0	0	108.9	L4	P2-L4 PolarHBondContact O-N 3.27Å
3	Q	34	Very low	39.1	Very low	191 Å²	191	142.5 Å²	142.5	89%	0.893	83%	0.826	S	S	*	*			trans	-75.2	118.1	169.1	-67.9	-176.8	-32.8	0	0	107.4	M1 A5	M1-Q3 PolarHBondContact O-N 3.08Å; Q3-A5 PolarHBondContact O-N 2.95Å
4	L	33.4	Very low	40.3	Very low	152 Å²	152	139.4 Å²	139.4	80%	0.796	81%	0.813	S	S	*	*			trans	-66.2	96.6	169.7	-82.5	152.4	0	0	0	107.5	P2 F6	P2-L4 PolarHBondContact O-N 3.27Å; L4-F6 HydrophobicContact CB-CD2 4.4Å; L4-F6 HydrophobicContact CB-CE2 4.15Å; L4-F6 PolarHBondContact O-N 3.02Å
5	A	34.1	Very low	41.5	Very low	85 Å²	85	136.1 Å²	136.1	70%	0.702	80%	0.797	S	S	*	*			trans	-75.6	108.1	164.3	0	0	0	0	0	106.8	Q3 D7	Q3-A5 PolarHBondContact O-N 2.95Å; A5-D7 PolarHBondContact O-N 3.28Å
6	F	34.2	Very low	42.4	Very low	176 Å²	176	132.9 Å²	132.9	77%	0.772	78%	0.775	S	S	*	*			trans	-78.1	111.6	166.1	-82	-93.5	0	0	0	107.3	L4 V8	L4-F6 HydrophobicContact CB-CD2 4.4Å; L4-F6 HydrophobicContact CB-CE2 4.15Å; L4-F6 PolarHBondContact O-N 3.02Å; F6-V8 PolarHBondContact O-N 3.02Å; F6-V8 VanDerWaalsContact O-N 3.12Å
7	D	33.8	Very low	43.8	Very low	159 Å²	159	133.9 Å²	133.9	85%	0.85	78%	0.775	S	S	*	*			trans	-61	107.8	170.5	-71	-48	0	0	0	109	A5 G9	A5-D7 PolarHBondContact O-N 3.28Å; D7-G9 PolarHBondContact O-N 3.21Å
8	V	41	Very low	45.5	Very low	137 Å²	137	128 Å²	128	83%	0.83	75%	0.747	S	S	*	*			trans	-73.3	109.6	171.6	171.4	0	0	0	0	107.6	F6 S10	F6-V8 PolarHBondContact O-N 3.02Å; F6-V8 VanDerWaalsContact O-N 3.12Å; V8-S10 PolarHBondContact O-N 3.41Å
9	G	38.7	Very low	47.3	Very low	69 Å²	69	123.2 Å²	123.2	71%	0.711	72%	0.721	S	S	*	*			trans	-53.2	124.2	174.4	0	0	0	0	0	111.1	D7 G11	D7-G9 PolarHBondContact O-N 3.21Å; G9-G11 PolarHBondContact O-N 3.43Å
10	S	38.9	Very low	49.2	Very low	131 Å²	131	121 Å²	121	92%	0.916	70%	0.703	S	S	*	*			trans	-77.1	95.5	168.2	23.3	0	0	0	0	108.1	V8	V8-S10 PolarHBondContact O-N 3.41Å
11	G	44.4	Very low	50.7	Low	59 Å²	59	121.1 Å²	121.1	61%	0.608	70%	0.701	S	S	*	*			trans	-147.5	135.9	169.8	0	0	0	0	0	108.5	G9 E13	G9-G11 PolarHBondContact O-N 3.43Å; G11-E13 PolarHBondContact O-N 3.19Å
12	D	50.6	Low	53	Low	178 Å²	178	112.1 Å²	112.1	95%	0.952	67%	0.667	S	S	*	*			trans	-62.6	43.1	-179.4	-76.4	-52.3	0	0	0	114
13	E	54	Low	55.4	Low	155 Å²	155	107.2 Å²	107.2	72%	0.724	63%	0.633	S	S	*	*			trans	-78.6	127.9	167.8	-111.1	178.4	112.6	0	0	108.8	G11	G11-E13 PolarHBondContact O-N 3.19Å
14	P	55.2	Low	57.8	Low	99 Å²	99	101.5 Å²	101.5	64%	0.643	61%	0.607	S	S	*	*			trans	-56	139.4	174.8	22.8	-31.3	0	0	0	108.8	I16	P14-I16 PolarHBondContact O-N 3.03Å
15	P	58.1	Low	60.4	Low	89 Å²	89	99.7 Å²	99.7	58%	0.578	59%	0.594	S	S	*	*			trans	-57.5	113.3	178.6	21.4	-30.7	0	0	0	108.8	I17	P15-I17 PolarHBondContact O-N 2.86Å
16	I	55.9	Low	63	Low	85 Å²	85	100.8 Å²	100.8	44%	0.436	58%	0.584	S	S	.	*			trans	-71.5	103.1	176.3	-62.6	171.5	0	0	0	106.5	P14 G18 H20	P14-I16 PolarHBondContact O-N 3.03Å; I16-G18 PolarHBondContact O-N 2.9Å; I16-H20 VanDerWaalsContact CB-NE2 3.25Å; I16-H20 WeakPolarHBondContact CB-NE2 3.37Å; I16-H20 VanDerWaalsContact CD1-NE2 3.27Å; I16-H20 WeakPolarHBondContact CD1-NE2 3.45Å; I16-H20 VanDerWaalsContact CG2-NE2 3.35Å; I16-H20 WeakPolarHBondContact CG2-NE2 3.25Å
17	I	66.2	Low	65.5	Low	151 Å²	151	92.4 Å²	92.4	77%	0.774	55%	0.548	S	S	*	.			trans	-74.7	97.7	171.7	-63.1	163.1	0	0	0	107	P15	P15-I17 PolarHBondContact O-N 2.86Å
18	G	74.4	Confident	68.1	Low	27 Å²	27	86.5 Å²	86.5	28%	0.278	52%	0.516	S	S	.	.	S	Bend	trans	151.2	177.5	-175.8	0	0	0	0	0	110.7	I16 H43	I16-G18 PolarHBondContact O-N 2.9Å; G18-H43 PolarHBondContact O-CD2 3.16Å
19	C	81.3	Confident	70.2	Confident	37 Å²	37	84.5 Å²	84.5	25%	0.25	50%	0.498	C	S	.	.			trans	-93.4	142.9	177.6	-71.3	0	0	0	0	112.3	D23 H24 C41	C19-D23 HydrophobicContact CB-CB 4.34Å; C19-H24 WeakPolarHBondContact CB-NE2 3.26Å; C19-C41 HydrophobicContact CB-CB 4.15Å; C19-C41 WeakPolarHBondContact CB-SG 3.46Å; C19-C41 WeakPolarHBondContact SG-CB 3.04Å; C19-C41 PolarHBondContact SG-O 3.25Å; C19-C41 CovalentContact SG-SG 2.01Å; C19-C41 PolarHBondContact SG-SG 3.31Å
20	H	83.5	Confident	72.6	Confident	79 Å²	79	84.9 Å²	84.9	37%	0.366	48%	0.483	S	S	.	.			trans	-93.4	166.3	167.2	-45.5	85.9	0	0	0	110.2	I16 G22 D23 H24	I16-H20 VanDerWaalsContact CB-NE2 3.25Å; I16-H20 WeakPolarHBondContact CB-NE2 3.37Å; I16-H20 VanDerWaalsContact CD1-NE2 3.27Å; I16-H20 WeakPolarHBondContact CD1-NE2 3.45Å; I16-H20 VanDerWaalsContact CG2-NE2 3.35Å; I16-H20 WeakPolarHBondContact CG2-NE2 3.25Å; H20-G22 PolarHBondContact O-N 3.47Å; H20-D23 IonicContact CE1-OD2 3.96Å; H20-D23 IonicContact CG-OD2 3.76Å; H20-D23 PolarHBondContact N-OD2 2.95Å; H20-D23 IonicContact ND1-OD2 2.94Å; H20-D23 PolarHBondContact ND1-OD2 3.46Å; H20-D23 WeakPolarHBondContact O-CB 3.4Å; H20-D23 PolarHBondContact O-N 3.33Å; H20-D23 VanDerWaalsContact O-N 3.12Å; H20-H24 PolarHBondContact O-CD2 2.98Å; H20-H24 PolarHBondContact O-N 3.46Å; H20-H24 VanDerWaalsContact O-N 3.08Å
21	L	80.8	Confident	74.9	Confident	124 Å²	124	78.6 Å²	78.6	65%	0.649	44%	0.439	S	S	*	.	H	α-helix	trans	-54.4	-41.5	175.7	-178.3	62	0	0	0	111.9	D23 H24 E25	L21-D23 PolarHBondContact O-N 3.2Å; L21-H24 WeakPolarHBondContact O-CB 3.42Å; L21-H24 PolarHBondContact O-N 3Å; L21-E25 HydrophobicContact CD1-CG 4.36Å; L21-E25 HydrophobicContact CG-CG 4.44Å; L21-E25 WeakPolarHBondContact O-CG 3.47Å; L21-E25 PolarHBondContact O-N 3.38Å
22	G	85.2	Confident	76.9	Confident	41 Å²	41	79.7 Å²	79.7	42%	0.423	43%	0.427	S	S	.	.	H	α-helix	trans	-61.3	-42.3	176.8	0	0	0	0	0	113.5	H20 H24 E25 E26	H20-G22 PolarHBondContact O-N 3.47Å; G22-H24 VanDerWaalsContact C-N 3.29Å; G22-H24 PolarHBondContact O-N 3.2Å; G22-E25 PolarHBondContact O-N 2.83Å; G22-E26 WeakPolarHBondContact O-CB 3.48Å; G22-E26 PolarHBondContact O-N 2.85Å
23	D	85.8	Confident	78.5	Confident	28 Å²	28	81 Å²	81	15%	0.15	42%	0.419	C	S	.	.	H	α-helix	trans	-62.1	-39.3	175.5	-62.1	-35.5	0	0	0	111.4	C19 H20 L21 C27 C41 H43 L49	C19-D23 HydrophobicContact CB-CB 4.34Å; H20-D23 IonicContact CE1-OD2 3.96Å; H20-D23 IonicContact CG-OD2 3.76Å; H20-D23 PolarHBondContact N-OD2 2.95Å; H20-D23 IonicContact ND1-OD2 2.94Å; H20-D23 PolarHBondContact ND1-OD2 3.46Å; H20-D23 WeakPolarHBondContact O-CB 3.4Å; H20-D23 PolarHBondContact O-N 3.33Å; H20-D23 VanDerWaalsContact O-N 3.12Å; L21-D23 PolarHBondContact O-N 3.2Å; D23-C27 WeakPolarHBondContact O-CB 3.47Å; D23-C27 PolarHBondContact O-N 3.48Å; D23-C27 PolarHBondContact O-SG 2.91Å; D23-C41 HydrophobicContact CB-CB 3.96Å; D23-H43 IonicContact OD2-CD2 3.83Å; D23-H43 IonicContact OD2-NE2 2.97Å; D23-H43 PolarHBondContact OD2-NE2 2.92Å; D23-L49 HydrophobicContact CB-CD1 3.85Å; D23-L49 HydrophobicContact CB-CD2 4.38Å
24	H	85	Confident	79.8	Confident	71 Å²	71	77.5 Å²	77.5	33%	0.329	41%	0.411	S	S	.	.	H	α-helix	trans	-64.5	-49.5	176.4	-73.7	-70.1	0	0	0	111.3	C19 H20 L21 G22 C27 D28 C41	C19-H24 WeakPolarHBondContact CB-NE2 3.26Å; H20-H24 PolarHBondContact O-CD2 2.98Å; H20-H24 PolarHBondContact O-N 3.46Å; H20-H24 VanDerWaalsContact O-N 3.08Å; L21-H24 WeakPolarHBondContact O-CB 3.42Å; L21-H24 PolarHBondContact O-N 3Å; G22-H24 VanDerWaalsContact C-N 3.29Å; G22-H24 PolarHBondContact O-N 3.2Å; H24-C27 PolarHBondContact O-N 3.14Å; H24-D28 VanDerWaalsContact O-CB 3.27Å; H24-D28 WeakPolarHBondContact O-CB 3.13Å; H24-D28 PolarHBondContact O-N 2.98Å; H24-C41 PolarHBondContact CE1-SG 3.1Å; H24-C41 VanDerWaalsContact CG-SG 3.54Å; H24-C41 PolarHBondContact ND1-SG 3.48Å
25	E	88.5	Confident	80.8	Confident	114 Å²	114	78.5 Å²	78.5	53%	0.533	41%	0.411	S	S	.	.	H	α-helix	trans	-61.9	-44	178.8	-71.4	174.5	171.7	0	0	111.4	L21 G22 D28 E29	L21-E25 HydrophobicContact CD1-CG 4.36Å; L21-E25 HydrophobicContact CG-CG 4.44Å; L21-E25 WeakPolarHBondContact O-CG 3.47Å; L21-E25 PolarHBondContact O-N 3.38Å; G22-E25 PolarHBondContact O-N 2.83Å; E25-D28 PolarHBondContact O-N 3.38Å; E25-E29 WeakPolarHBondContact O-CG 3.48Å; E25-E29 PolarHBondContact O-N 2.99Å
26	E	88.1	Confident	82	Confident	107 Å²	107	79.1 Å²	79.1	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-49.8	177.3	-176.3	177	171.7	0	0	111.5	G22 D28 E29 L30	G22-E26 WeakPolarHBondContact O-CB 3.48Å; G22-E26 PolarHBondContact O-N 2.85Å; E26-D28 VanDerWaalsContact C-N 3.27Å; E26-D28 PolarHBondContact O-N 3.32Å; E26-E29 PolarHBondContact O-N 3.47Å; E26-L30 HydrophobicContact CG-CD1 4.02Å; E26-L30 HydrophobicContact CG-CG 4.42Å; E26-L30 WeakPolarHBondContact O-CB 3.44Å; E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.34Å; E26-L30 PolarHBondContact O-N 2.85Å
27	C	87.5	Confident	83	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-62.7	-35.8	177.3	-77.7	0	0	0	0	112.5	D23 H24 C31 C41 C51	D23-C27 WeakPolarHBondContact O-CB 3.47Å; D23-C27 PolarHBondContact O-N 3.48Å; D23-C27 PolarHBondContact O-SG 2.91Å; H24-C27 PolarHBondContact O-N 3.14Å; C27-C31 WeakPolarHBondContact O-CB 3.5Å; C27-C31 PolarHBondContact O-N 3.36Å; C27-C31 PolarHBondContact O-SG 3.22Å; C27-C41 HydrophobicContact CB-CB 4.22Å; C27-C41 VanDerWaalsContact SG-CA 3.53Å; C27-C41 VanDerWaalsContact SG-CB 3.55Å; C27-C51 WeakPolarHBondContact CA-SG 3.04Å; C27-C51 HydrophobicContact CB-CB 3.65Å; C27-C51 WeakPolarHBondContact CB-SG 3.43Å; C27-C51 WeakPolarHBondContact SG-CA 3.33Å; C27-C51 WeakPolarHBondContact SG-CB 3.26Å; C27-C51 CovalentContact SG-SG 2.04Å; C27-C51 PolarHBondContact SG-SG 2.89Å
28	D	87	Confident	83.8	Confident	36 Å²	36	74.8 Å²	74.8	19%	0.193	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-48.1	177.4	-162.7	42.1	0	0	0	111.3	H24 E25 E26 C31 K32 Y38 G39	H24-D28 VanDerWaalsContact O-CB 3.27Å; H24-D28 WeakPolarHBondContact O-CB 3.13Å; H24-D28 PolarHBondContact O-N 2.98Å; E25-D28 PolarHBondContact O-N 3.38Å; E26-D28 VanDerWaalsContact C-N 3.27Å; E26-D28 PolarHBondContact O-N 3.32Å; D28-C31 PolarHBondContact O-N 3.43Å; D28-K32 WeakPolarHBondContact O-CB 3.41Å; D28-K32 VanDerWaalsContact O-CG 3.26Å; D28-K32 WeakPolarHBondContact O-CG 3.35Å; D28-K32 PolarHBondContact O-N 3.25Å; D28-K32 WeakPolarHBondContact OD2-CE 3.11Å; D28-K32 IonicContact OD2-NZ 2.64Å; D28-K32 PolarHBondContact OD2-NZ 3.12Å; D28-Y38 WeakPolarHBondContact OD1-CA 3.42Å; D28-Y38 WeakPolarHBondContact OD1-CB 3.4Å; D28-G39 PolarHBondContact OD1-N 3.37Å
29	E	86.4	Confident	84.2	Confident	95 Å²	95	73.8 Å²	73.8	44%	0.444	37%	0.366	S	S	.	.	H	α-helix	trans	-66.7	-39.3	178.1	-68.7	-54.4	126.4	0	0	112.8	E25 E26 C31 K32 R33	E25-E29 WeakPolarHBondContact O-CG 3.48Å; E25-E29 PolarHBondContact O-N 2.99Å; E26-E29 PolarHBondContact O-N 3.47Å; E29-C31 VanDerWaalsContact C-N 3.34Å; E29-C31 PolarHBondContact O-N 2.03Å; E29-K32 PolarHBondContact O-N 3.28Å; E29-K32 WeakPolarHBondContact OE1-CD 3.26Å; E29-K32 IonicContact OE1-NZ 2.83Å; E29-K32 PolarHBondContact OE1-NZ 3.21Å; E29-R33 VanDerWaalsContact O-CG 3.31Å; E29-R33 WeakPolarHBondContact O-CG 3.29Å; E29-R33 PolarHBondContact O-N 3.02Å
30	L	88.5	Confident	84.3	Confident	76 Å²	76	75.7 Å²	75.7	40%	0.398	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-42.5	174	-73.7	174	0	0	0	112	E26	E26-L30 HydrophobicContact CG-CD1 4.02Å; E26-L30 HydrophobicContact CG-CG 4.42Å; E26-L30 WeakPolarHBondContact O-CB 3.44Å; E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.34Å; E26-L30 PolarHBondContact O-N 2.85Å
31	C	87.4	Confident	84.5	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-70	-42.5	178.3	-71.4	0	0	0	0	112	C27 D28 E29 R33 S34 N35 W36 G39 C53	C27-C31 WeakPolarHBondContact O-CB 3.5Å; C27-C31 PolarHBondContact O-N 3.36Å; C27-C31 PolarHBondContact O-SG 3.22Å; D28-C31 PolarHBondContact O-N 3.43Å; E29-C31 VanDerWaalsContact C-N 3.34Å; E29-C31 PolarHBondContact O-N 2.03Å; C31-R33 VanDerWaalsContact C-N 3.33Å; C31-R33 PolarHBondContact O-N 2.96Å; C31-S34 CarbonylContact O-C 3.49Å; C31-S34 WeakPolarHBondContact O-CA 3.45Å; C31-S34 PolarHBondContact O-N 2.04Å; C31-N35 PolarHBondContact O-N 3.13Å; C31-W36 HydrophobicContact CB-CB 4.1Å; C31-W36 WeakPolarHBondContact O-CB 3.03Å; C31-W36 PolarHBondContact O-N 3.27Å; C31-W36 VanDerWaalsContact O-N 3.08Å; C31-G39 WeakPolarHBondContact SG-CA 3.13Å; C31-C53 WeakPolarHBondContact CA-SG 3.31Å; C31-C53 HydrophobicContact CB-CB 3.68Å; C31-C53 WeakPolarHBondContact CB-SG 3.1Å; C31-C53 WeakPolarHBondContact SG-CA 3.03Å; C31-C53 WeakPolarHBondContact SG-CB 3.06Å; C31-C53 CovalentContact SG-SG 2.03Å; C31-C53 PolarHBondContact SG-SG 2.84Å
32	K	85.3	Confident	84.6	Confident	81 Å²	81	72.8 Å²	72.8	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-60	-39.1	175.8	-75.9	165.5	175.7	166.4	0	112.7	D28 E29 S34 N35	D28-K32 WeakPolarHBondContact O-CB 3.41Å; D28-K32 VanDerWaalsContact O-CG 3.26Å; D28-K32 WeakPolarHBondContact O-CG 3.35Å; D28-K32 PolarHBondContact O-N 3.25Å; D28-K32 WeakPolarHBondContact OD2-CE 3.11Å; D28-K32 IonicContact OD2-NZ 2.64Å; D28-K32 PolarHBondContact OD2-NZ 3.12Å; E29-K32 PolarHBondContact O-N 3.28Å; E29-K32 WeakPolarHBondContact OE1-CD 3.26Å; E29-K32 IonicContact OE1-NZ 2.83Å; E29-K32 PolarHBondContact OE1-NZ 3.21Å; K32-S34 PolarHBondContact O-N 3.42Å; K32-N35 WeakPolarHBondContact O-CA 3.24Å; K32-N35 PolarHBondContact O-N 2.67Å
33	R	84	Confident	84.3	Confident	207 Å²	207	73 Å²	73	78%	0.781	34%	0.339	S	S	*	.	H	α-helix	trans	-57.9	-29.3	173.9	-76	175.5	-174.7	-168.5	3.7	113.2	E29 C31 N35	E29-R33 VanDerWaalsContact O-CG 3.31Å; E29-R33 WeakPolarHBondContact O-CG 3.29Å; E29-R33 PolarHBondContact O-N 3.02Å; C31-R33 VanDerWaalsContact C-N 3.33Å; C31-R33 PolarHBondContact O-N 2.96Å; R33-N35 VanDerWaalsContact C-N 3.31Å
34	S	81.3	Confident	83.5	Confident	80 Å²	80	77.5 Å²	77.5	56%	0.559	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	17.5	176.6	-59.9	0	0	0	0	112.9	C31 K32 W36	C31-S34 CarbonylContact O-C 3.49Å; C31-S34 WeakPolarHBondContact O-CA 3.45Å; C31-S34 PolarHBondContact O-N 2.04Å; K32-S34 PolarHBondContact O-N 3.42Å; S34-W36 PolarHBondContact O-N 3.48Å; S34-W36 PolarHBondContact O-NE1 2.04Å
35	N	77.8	Confident	83	Confident	121 Å²	121	77.8 Å²	77.8	65%	0.647	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	36.9	179.8	-160.4	34.4	0	0	0	114.6	C31 K32 R33 Y56	C31-N35 PolarHBondContact O-N 3.13Å; K32-N35 WeakPolarHBondContact O-CA 3.24Å; K32-N35 PolarHBondContact O-N 2.67Å; R33-N35 VanDerWaalsContact C-N 3.31Å; N35-Y56 VanDerWaalsContact O-CE2 3.27Å; N35-Y56 WeakPolarHBondContact O-CE2 3.32Å
36	W	82.8	Confident	82	Confident	102 Å²	102	74.9 Å²	74.9	39%	0.386	36%	0.359	S	S	.	.			trans	-97	158.1	167.5	-61.1	84.2	0	0	0	110.3	C31 S34 C53 Y54 P55	C31-W36 HydrophobicContact CB-CB 4.1Å; C31-W36 WeakPolarHBondContact O-CB 3.03Å; C31-W36 PolarHBondContact O-N 3.27Å; C31-W36 VanDerWaalsContact O-N 3.08Å; S34-W36 PolarHBondContact O-N 3.48Å; S34-W36 PolarHBondContact O-NE1 2.04Å; W36-C53 HydrophobicContact CB-CB 3.87Å; W36-C53 HydrophobicContact CD2-CB 3.75Å; W36-C53 HydrophobicContact CE3-CB 4.15Å; W36-C53 HydrophobicContact CG-CB 3.56Å; W36-Y54 VanDerWaalsContact CE3-C 3.41Å; W36-P55 HydrophobicContact CE3-CB 3.8Å; W36-P55 HydrophobicContact CE3-CG 4.43Å; W36-P55 HydrophobicContact CZ3-CB 3.53Å; W36-P55 HydrophobicContact CZ3-CG 3.93Å
37	L	76.6	Confident	81.3	Confident	73 Å²	73	78.6 Å²	78.6	38%	0.382	37%	0.374	S	S	.	.	S	Bend	trans	-69.9	-43.8	-175.9	173.9	67.8	0	0	0	111.7	Y54 Y56	L37-Y54 PolarHBondContact N-O 3.38Å; L37-Y56 HydrophobicContact CB-CD1 3.77Å; L37-Y56 HydrophobicContact CB-CD2 4.49Å; L37-Y56 HydrophobicContact CB-CE1 3.95Å; L37-Y56 HydrophobicContact CB-CG 4.05Å; L37-Y56 HydrophobicContact CD1-CD1 3.59Å; L37-Y56 HydrophobicContact CD1-CE1 3.49Å; L37-Y56 VanDerWaalsContact CD1-CE1 3.49Å; L37-Y56 HydrophobicContact CG-CD1 4.19Å; L37-Y56 HydrophobicContact CG-CE1 4.32Å
38	Y	82.8	Confident	80.9	Confident	71 Å²	71	80.9 Å²	80.9	28%	0.278	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	160.8	179.7	69.2	-69	0	0	0	111.4	D28 H40 Y54	D28-Y38 WeakPolarHBondContact OD1-CA 3.42Å; D28-Y38 WeakPolarHBondContact OD1-CB 3.4Å; Y38-H40 AromaticContact CD2-CD2 3.82Å; Y38-H40 AromaticContact CE2-CD2 3.3Å; Y38-H40 WeakPolarHBondContact CE2-CD2 3.37Å; Y38-H40 AromaticContact CE2-NE2 3.43Å; Y38-H40 WeakPolarHBondContact CE2-NE2 3.34Å; Y38-Y54 HydrophobicContact CD2-CD2 4.38Å; Y38-Y54 HydrophobicContact CE1-CD2 4.31Å; Y38-Y54 HydrophobicContact CE1-CG 4.02Å; Y38-Y54 AromaticContact CE2-CD2 3.87Å; Y38-Y54 HydrophobicContact CE2-CD2 3.87Å; Y38-Y54 HydrophobicContact CE2-CE2 4.49Å; Y38-Y54 HydrophobicContact CE2-CG 4.34Å; Y38-Y54 AromaticContact CZ-CD2 3.79Å; Y38-Y54 AromaticContact CZ-CG 3.78Å; Y38-Y54 PolarHBondContact O-N 2.98Å
39	G	82.9	Confident	80.6	Confident	7 Å²	7	81.9 Å²	81.9	7%	0.072	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.6	174.6	0	0	0	0	0	112.4	D28 C31	D28-G39 PolarHBondContact OD1-N 3.37Å; C31-G39 WeakPolarHBondContact SG-CA 3.13Å
40	H	84.2	Confident	80.6	Confident	76 Å²	76	83 Å²	83	35%	0.352	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.4	161.9	-90.6	-92.4	0	0	0	109.8	Y38 C51 Q52 Y54	Y38-H40 AromaticContact CD2-CD2 3.82Å; Y38-H40 AromaticContact CE2-CD2 3.3Å; Y38-H40 WeakPolarHBondContact CE2-CD2 3.37Å; Y38-H40 AromaticContact CE2-NE2 3.43Å; Y38-H40 WeakPolarHBondContact CE2-NE2 3.34Å; H40-C51 CarbonylContact O-C 3.57Å; H40-C51 WeakPolarHBondContact O-CA 3.03Å; H40-Q52 PolarHBondContact N-O 2.83Å; H40-Q52 PolarHBondContact O-N 3.19Å; H40-Y54 HydrophobicContact CB-CE2 3.97Å; H40-Y54 AromaticContact CD2-CD2 3.97Å; H40-Y54 AromaticContact CD2-CE2 3.54Å
41	C	85.9	Confident	80.5	Confident	5 Å²	5	81.8 Å²	81.8	3%	0.034	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	152.8	161.9	63.5	0	0	0	0	110.8	C19 D23 H24 C27 L49 K50	C19-C41 HydrophobicContact CB-CB 4.15Å; C19-C41 WeakPolarHBondContact CB-SG 3.46Å; C19-C41 WeakPolarHBondContact SG-CB 3.04Å; C19-C41 PolarHBondContact SG-O 3.25Å; C19-C41 CovalentContact SG-SG 2.01Å; C19-C41 PolarHBondContact SG-SG 3.31Å; D23-C41 HydrophobicContact CB-CB 3.96Å; H24-C41 PolarHBondContact CE1-SG 3.1Å; H24-C41 VanDerWaalsContact CG-SG 3.54Å; H24-C41 PolarHBondContact ND1-SG 3.48Å; C27-C41 HydrophobicContact CB-CB 4.22Å; C27-C41 VanDerWaalsContact SG-CA 3.53Å; C27-C41 VanDerWaalsContact SG-CB 3.55Å; C41-L49 HydrophobicContact CB-CD1 3.53Å; C41-K50 CarbonylContact C-O 3.57Å; C41-K50 WeakPolarHBondContact CA-O 3.44Å
42	R	83	Confident	80.6	Confident	137 Å²	137	85.4 Å²	85.4	52%	0.517	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	136.6	165.3	-63.6	-174.4	178	-177.2	-0.2	107.7	K50 Q52	R42-K50 PolarHBondContact N-O 3.19Å; R42-K50 PolarHBondContact O-N 3.22Å; R42-Q52 VanDerWaalsContact NH2-OE1 3.09Å
43	H	78.9	Confident	80.6	Confident	45 Å²	45	83.7 Å²	83.7	21%	0.208	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.6	167.7	-79.5	-84.3	0	0	0	109.5	G18 D23 D45 T48	G18-H43 PolarHBondContact O-CD2 3.16Å; D23-H43 IonicContact OD2-CD2 3.83Å; D23-H43 IonicContact OD2-NE2 2.97Å; D23-H43 PolarHBondContact OD2-NE2 2.92Å; H43-D45 WeakPolarHBondContact CB-O 3.45Å; H43-T48 VanDerWaalsContact CA-O 3.32Å; H43-T48 WeakPolarHBondContact CA-O 3.3Å; H43-T48 PolarHBondContact ND1-O 2.79Å
44	L	69.9	Low	80.4	Confident	123 Å²	123	76.6 Å²	76.6	64%	0.644	38%	0.382	S	S	*	.	S	Bend	trans	-90.1	-27.5	170.1	-69	179.2	0	0	0	111.7	T48 K50	L44-T48 PolarHBondContact N-O 3.48Å; L44-K50 HydrophobicContact CD1-CD 3.56Å; L44-K50 HydrophobicContact CG-CD 4.11Å
45	D	73.6	Confident	80.2	Confident	77 Å²	77	76.2 Å²	76.2	41%	0.412	38%	0.377	S	S	.	.	S	Bend	trans	-150.6	-174.9	172.1	56.5	41.7	0	0	0	108.5	H43 F47 T48	H43-D45 WeakPolarHBondContact CB-O 3.45Å; D45-F47 PolarHBondContact O-N 2.97Å; D45-F47 VanDerWaalsContact O-N 3.14Å; D45-F47 WeakPolarHBondContact OD1-CA 3.49Å; D45-F47 PolarHBondContact OD1-N 3.33Å; D45-T48 PolarHBondContact N-OG1 3.24Å; D45-T48 WeakPolarHBondContact OD1-CB 3.23Å; D45-T48 VanDerWaalsContact OD1-CG2 3.31Å; D45-T48 WeakPolarHBondContact OD1-CG2 3.43Å; D45-T48 PolarHBondContact OD1-N 2.62Å; D45-T48 PolarHBondContact OD1-OG1 2.81Å; D45-T48 PolarHBondContact OD2-OG1 3.18Å
46	S	69.1	Low	79.8	Confident	54 Å²	54	76.5 Å²	76.5	38%	0.378	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-4.9	-178.5	53	0	0	0	0	115.3
47	F	72.3	Confident	79.1	Confident	185 Å²	185	79 Å²	79	81%	0.811	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-10	-174.5	-56.7	-74.1	0	0	0	113.3	D45	D45-F47 PolarHBondContact O-N 2.97Å; D45-F47 VanDerWaalsContact O-N 3.14Å; D45-F47 WeakPolarHBondContact OD1-CA 3.49Å; D45-F47 PolarHBondContact OD1-N 3.33Å
48	T	78.4	Confident	78.7	Confident	48 Å²	48	78.6 Å²	78.6	29%	0.294	39%	0.391	S	S	.	.			trans	-114.3	97.9	-171.3	54.2	0	0	0	0	112.3	H43 L44 D45	H43-T48 VanDerWaalsContact CA-O 3.32Å; H43-T48 WeakPolarHBondContact CA-O 3.3Å; H43-T48 PolarHBondContact ND1-O 2.79Å; L44-T48 PolarHBondContact N-O 3.48Å; D45-T48 PolarHBondContact N-OG1 3.24Å; D45-T48 WeakPolarHBondContact OD1-CB 3.23Å; D45-T48 VanDerWaalsContact OD1-CG2 3.31Å; D45-T48 WeakPolarHBondContact OD1-CG2 3.43Å; D45-T48 PolarHBondContact OD1-N 2.62Å; D45-T48 PolarHBondContact OD1-OG1 2.81Å; D45-T48 PolarHBondContact OD2-OG1 3.18Å
49	L	81.3	Confident	78.1	Confident	57 Å²	57	81 Å²	81	30%	0.298	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	123.6	166.2	-179.6	61.6	0	0	0	110.4	D23 C41	D23-L49 HydrophobicContact CB-CD1 3.85Å; D23-L49 HydrophobicContact CB-CD2 4.38Å; C41-L49 HydrophobicContact CB-CD1 3.53Å
50	K	86.3	Confident	77.9	Confident	119 Å²	119	84.1 Å²	84.1	52%	0.517	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.7	168.9	-72.1	-168.8	176.1	179.2	0	110.8	C41 R42 L44	C41-K50 CarbonylContact C-O 3.57Å; C41-K50 WeakPolarHBondContact CA-O 3.44Å; R42-K50 PolarHBondContact N-O 3.19Å; R42-K50 PolarHBondContact O-N 3.22Å; L44-K50 HydrophobicContact CD1-CD 3.56Å; L44-K50 HydrophobicContact CG-CD 4.11Å
51	C	87.2	Confident	78	Confident	50 Å²	50	83.4 Å²	83.4	34%	0.338	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	130.8	173.4	-54.7	0	0	0	0	111	C27 H40	C27-C51 WeakPolarHBondContact CA-SG 3.04Å; C27-C51 HydrophobicContact CB-CB 3.65Å; C27-C51 WeakPolarHBondContact CB-SG 3.43Å; C27-C51 WeakPolarHBondContact SG-CA 3.33Å; C27-C51 WeakPolarHBondContact SG-CB 3.26Å; C27-C51 CovalentContact SG-SG 2.04Å; C27-C51 PolarHBondContact SG-SG 2.89Å; H40-C51 CarbonylContact O-C 3.57Å; H40-C51 WeakPolarHBondContact O-CA 3.03Å
52	Q	88.2	Confident	77.7	Confident	76 Å²	76	87.6 Å²	87.6	36%	0.355	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	113.5	169.3	-176.8	169.6	16.9	0	0	109.3	H40 R42 Y54	H40-Q52 PolarHBondContact N-O 2.83Å; H40-Q52 PolarHBondContact O-N 3.19Å; R42-Q52 VanDerWaalsContact NH2-OE1 3.09Å; Q52-Y54 HydrophobicContact CB-CE2 4.33Å; Q52-Y54 VanDerWaalsContact CD-OH 3.31Å; Q52-Y54 HydrophobicContact CG-CE2 3.95Å; Q52-Y54 WeakPolarHBondContact O-CD2 3.37Å; Q52-Y54 PolarHBondContact OE1-OH 3.18Å; Q52-Y54 VanDerWaalsContact OE1-OH 3.1Å
53	C	85.4	Confident	78	Confident	44 Å²	44	85.9 Å²	85.9	30%	0.297	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	138.7	178.3	-54	0	0	0	0	111.6	C31 W36	C31-C53 WeakPolarHBondContact CA-SG 3.31Å; C31-C53 HydrophobicContact CB-CB 3.68Å; C31-C53 WeakPolarHBondContact CB-SG 3.1Å; C31-C53 WeakPolarHBondContact SG-CA 3.03Å; C31-C53 WeakPolarHBondContact SG-CB 3.06Å; C31-C53 CovalentContact SG-SG 2.03Å; C31-C53 PolarHBondContact SG-SG 2.84Å; W36-C53 HydrophobicContact CB-CB 3.87Å; W36-C53 HydrophobicContact CD2-CB 3.75Å; W36-C53 HydrophobicContact CE3-CB 4.15Å; W36-C53 HydrophobicContact CG-CB 3.56Å
54	Y	81	Confident	78.5	Confident	59 Å²	59	85.6 Å²	85.6	23%	0.231	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.6	178.9	-70.8	-84.7	0	0	0	111.3	W36 L37 Y38 H40 Q52	W36-Y54 VanDerWaalsContact CE3-C 3.41Å; L37-Y54 PolarHBondContact N-O 3.38Å; Y38-Y54 HydrophobicContact CD2-CD2 4.38Å; Y38-Y54 HydrophobicContact CE1-CD2 4.31Å; Y38-Y54 HydrophobicContact CE1-CG 4.02Å; Y38-Y54 AromaticContact CE2-CD2 3.87Å; Y38-Y54 HydrophobicContact CE2-CD2 3.87Å; Y38-Y54 HydrophobicContact CE2-CE2 4.49Å; Y38-Y54 HydrophobicContact CE2-CG 4.34Å; Y38-Y54 AromaticContact CZ-CD2 3.79Å; Y38-Y54 AromaticContact CZ-CG 3.78Å; Y38-Y54 PolarHBondContact O-N 2.98Å; H40-Y54 HydrophobicContact CB-CE2 3.97Å; H40-Y54 AromaticContact CD2-CD2 3.97Å; H40-Y54 AromaticContact CD2-CE2 3.54Å; Q52-Y54 HydrophobicContact CB-CE2 4.33Å; Q52-Y54 VanDerWaalsContact CD-OH 3.31Å; Q52-Y54 HydrophobicContact CG-CE2 3.95Å; Q52-Y54 WeakPolarHBondContact O-CD2 3.37Å; Q52-Y54 PolarHBondContact OE1-OH 3.18Å; Q52-Y54 VanDerWaalsContact OE1-OH 3.1Å
55	P	76.1	Confident	79.6	Confident	72 Å²	72	80.6 Å²	80.6	47%	0.468	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-68.1	157.4	-175.2	24.6	-28.4	0	0	0	108.9	W36 K57	W36-P55 HydrophobicContact CE3-CB 3.8Å; W36-P55 HydrophobicContact CE3-CG 4.43Å; W36-P55 HydrophobicContact CZ3-CB 3.53Å; W36-P55 HydrophobicContact CZ3-CG 3.93Å; P55-K57 PolarHBondContact O-N 3.09Å
56	Y	69	Low	80.6	Confident	127 Å²	127	79.9 Å²	79.9	50%	0.498	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-49.2	117.2	156.9	-68	-81.6	0	0	0	107.9	N35 L37 A58	N35-Y56 VanDerWaalsContact O-CE2 3.27Å; N35-Y56 WeakPolarHBondContact O-CE2 3.32Å; L37-Y56 HydrophobicContact CB-CD1 3.77Å; L37-Y56 HydrophobicContact CB-CD2 4.49Å; L37-Y56 HydrophobicContact CB-CE1 3.95Å; L37-Y56 HydrophobicContact CB-CG 4.05Å; L37-Y56 HydrophobicContact CD1-CD1 3.59Å; L37-Y56 HydrophobicContact CD1-CE1 3.49Å; L37-Y56 VanDerWaalsContact CD1-CE1 3.49Å; L37-Y56 HydrophobicContact CG-CD1 4.19Å; L37-Y56 HydrophobicContact CG-CE1 4.32Å; Y56-A58 PolarHBondContact O-N 3.06Å
57	K	68.6	Low	81.9	Confident	155 Å²	155	85.1 Å²	85.1	67%	0.674	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-64	134	169.1	-69.1	-177.3	-178	173	0	106.1	P55 T59	P55-K57 PolarHBondContact O-N 3.09Å; K57-T59 PolarHBondContact O-N 3.31Å
58	A	68.1	Low	83	Confident	64 Å²	64	82.7 Å²	82.7	53%	0.529	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-49.5	137.2	171.8	0	0	0	0	0	108.5	Y56 L60	Y56-A58 PolarHBondContact O-N 3.06Å; A58-L60 PolarHBondContact O-N 3.28Å
59	T	69.9	Low	83.8	Confident	120 Å²	120	83.2 Å²	83.2	74%	0.736	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-52.1	133	177.3	51	0	0	0	0	108.9	K57 D61	K57-T59 PolarHBondContact O-N 3.31Å; T59-D61 PolarHBondContact O-N 3.49Å
60	L	80.4	Confident	84.5	Confident	74 Å²	74	84 Å²	84	39%	0.387	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-60.8	140.5	174.2	-61.5	176.1	0	0	0	108.4	A58 P62 P90 A92 S99	A58-L60 PolarHBondContact O-N 3.28Å; L60-P62 VanDerWaalsContact O-CD 3.23Å; L60-P62 WeakPolarHBondContact O-CD 3.33Å; L60-P90 HydrophobicContact CB-CB 3.82Å; L60-P90 HydrophobicContact CD1-CB 4.31Å; L60-P90 WeakPolarHBondContact CD1-O 3.27Å; L60-A92 HydrophobicContact CD2-CB 3.96Å; L60-S99 WeakPolarHBondContact CA-OG 2.98Å; L60-S99 VanDerWaalsContact CB-OG 3.32Å; L60-S99 WeakPolarHBondContact CB-OG 3.49Å; L60-S99 WeakPolarHBondContact CD2-OG 3.46Å
61	D	84.7	Confident	85.1	Confident	61 Å²	61	80.8 Å²	80.8	33%	0.326	44%	0.44	S	S	.	.			trans	-77	110.3	177.4	-178.4	-5.5	0	0	0	108.4	T59 T63 V64 S99	T59-D61 PolarHBondContact O-N 3.49Å; D61-T63 PolarHBondContact O-N 2.64Å; D61-T63 WeakPolarHBondContact OD1-CB 3.17Å; D61-T63 WeakPolarHBondContact OD1-CG2 3.37Å; D61-T63 PolarHBondContact OD1-N 2.83Å; D61-T63 PolarHBondContact OD1-OG1 3.12Å; D61-T63 PolarHBondContact OD2-OG1 3.27Å; D61-V64 HydrophobicContact CB-CG1 4.26Å; D61-V64 VanDerWaalsContact O-CG2 3.3Å; D61-V64 WeakPolarHBondContact O-CG2 3.47Å; D61-S99 PolarHBondContact N-OG 3.14Å
62	P	81.2	Confident	85.5	Confident	93 Å²	93	83.8 Å²	83.8	60%	0.604	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-69.5	-20.3	-178.3	30.6	-35.3	0	0	0	112.5	L60 V64 C65	L60-P62 VanDerWaalsContact O-CD 3.23Å; L60-P62 WeakPolarHBondContact O-CD 3.33Å; P62-V64 PolarHBondContact O-N 3.19Å; P62-V64 VanDerWaalsContact O-N 3.16Å; P62-C65 PolarHBondContact O-N 3.48Å
63	T	89.4	Confident	85.9	Confident	101 Å²	101	80.2 Å²	80.2	62%	0.62	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-69.9	-13	-175.1	70	0	0	0	0	113.3	D61 C65	D61-T63 PolarHBondContact O-N 2.64Å; D61-T63 WeakPolarHBondContact OD1-CB 3.17Å; D61-T63 WeakPolarHBondContact OD1-CG2 3.37Å; D61-T63 PolarHBondContact OD1-N 2.83Å; D61-T63 PolarHBondContact OD1-OG1 3.12Å; D61-T63 PolarHBondContact OD2-OG1 3.27Å; T63-C65 PolarHBondContact O-N 2.92Å
64	V	88.6	Confident	86.4	Confident	38 Å²	38	82.7 Å²	82.7	23%	0.23	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-65.7	-23.3	174	-54.8	0	0	0	0	112.7	D61 P62 T66 P90 A101	D61-V64 HydrophobicContact CB-CG1 4.26Å; D61-V64 VanDerWaalsContact O-CG2 3.3Å; D61-V64 WeakPolarHBondContact O-CG2 3.47Å; P62-V64 PolarHBondContact O-N 3.19Å; P62-V64 VanDerWaalsContact O-N 3.16Å; V64-T66 PolarHBondContact O-N 3.08Å; V64-P90 HydrophobicContact CG2-CB 3.81Å; V64-P90 HydrophobicContact CG2-CG 4.03Å; V64-A101 HydrophobicContact CG2-CB 4.39Å; V64-A101 WeakPolarHBondContact O-CB 3.47Å
65	C	92.2	Very high	87.2	Confident	19 Å²	19	85.4 Å²	85.4	13%	0.128	45%	0.452	C	S	.	.	S	Bend	trans	-95.4	87.9	173.9	-75.1	0	0	0	0	110	P62 T63 C88 Y89	P62-C65 PolarHBondContact O-N 3.48Å; T63-C65 PolarHBondContact O-N 2.92Å; C65-C88 WeakPolarHBondContact CA-SG 3.28Å; C65-C88 HydrophobicContact CB-CB 3.67Å; C65-C88 WeakPolarHBondContact CB-SG 3.02Å; C65-C88 WeakPolarHBondContact SG-CB 3.43Å; C65-C88 CovalentContact SG-SG 2.04Å; C65-C88 PolarHBondContact SG-SG 2.91Å; C65-Y89 WeakPolarHBondContact SG-CA 3.06Å; C65-Y89 PolarHBondContact SG-N 3.42Å
66	T	94.9	Very high	88.1	Confident	62 Å²	62	82.7 Å²	82.7	38%	0.38	44%	0.435	S	S	.	.			trans	-75.2	168.5	173.1	75.8	0	0	0	0	111.1	V64 E68 Q69 H70	V64-T66 PolarHBondContact O-N 3.08Å; T66-E68 VanDerWaalsContact C-N 3.25Å; T66-E68 WeakPolarHBondContact CB-OE2 3.11Å; T66-E68 PolarHBondContact O-N 3.03Å; T66-E68 PolarHBondContact OG1-N 3.05Å; T66-E68 PolarHBondContact OG1-OE2 3.16Å; T66-Q69 PolarHBondContact O-N 3.12Å; T66-Q69 VanDerWaalsContact O-N 3.13Å; T66-Q69 PolarHBondContact OG1-N 3.07Å; T66-H70 PolarHBondContact O-CD2 3.34Å; T66-H70 PolarHBondContact O-N 2.99Å
67	Q	95.8	Very high	89.3	Confident	163 Å²	163	76.7 Å²	76.7	76%	0.762	41%	0.412	S	S	*	.	H	α-helix	trans	-59.3	-38.9	175.2	-172.6	173.8	7.4	0	0	111.6	Q69 H70 A71	Q67-Q69 VanDerWaalsContact C-N 3.32Å; Q67-Q69 PolarHBondContact O-N 3.33Å; Q67-H70 PolarHBondContact O-N 3.37Å; Q67-A71 PolarHBondContact O-N 3.41Å
68	E	96.7	Very high	90.5	Very high	135 Å²	135	72.6 Å²	72.6	63%	0.631	40%	0.396	S	S	*	.	H	α-helix	trans	-64	-39.1	175.8	-56.3	77.4	-166.3	0	0	111.4	T66 A71 F72	T66-E68 VanDerWaalsContact C-N 3.25Å; T66-E68 WeakPolarHBondContact CB-OE2 3.11Å; T66-E68 PolarHBondContact O-N 3.03Å; T66-E68 PolarHBondContact OG1-N 3.05Å; T66-E68 PolarHBondContact OG1-OE2 3.16Å; E68-A71 PolarHBondContact O-N 3.46Å; E68-F72 WeakPolarHBondContact O-CB 3.38Å; E68-F72 PolarHBondContact O-N 2.86Å
69	Q	95.3	Very high	91.7	Very high	59 Å²	59	74.4 Å²	74.4	28%	0.276	40%	0.397	S	S	.	.	H	α-helix	trans	-69.3	-35.8	178.3	-166.5	62.3	47.3	0	0	111.9	T66 Q67 C73 C88 A101	T66-Q69 PolarHBondContact O-N 3.12Å; T66-Q69 VanDerWaalsContact O-N 3.13Å; T66-Q69 PolarHBondContact OG1-N 3.07Å; Q67-Q69 VanDerWaalsContact C-N 3.32Å; Q67-Q69 PolarHBondContact O-N 3.33Å; Q69-C73 PolarHBondContact O-N 2.9Å; Q69-C73 PolarHBondContact O-SG 3.09Å; Q69-C88 HydrophobicContact CB-CB 4.39Å; Q69-C88 HydrophobicContact CG-CB 3.98Å; Q69-C88 WeakPolarHBondContact CG-SG 3.34Å; Q69-A101 HydrophobicContact CG-CB 3.76Å
70	H	96.4	Very high	92.7	Very high	74 Å²	74	75.5 Å²	75.5	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-50.9	170.3	-87.3	-74.7	0	0	0	111.5	T66 Q67 F72 C73 E74 C88	T66-H70 PolarHBondContact O-CD2 3.34Å; T66-H70 PolarHBondContact O-N 2.99Å; Q67-H70 PolarHBondContact O-N 3.37Å; H70-F72 VanDerWaalsContact C-N 3.29Å; H70-F72 PolarHBondContact O-N 3.1Å; H70-C73 PolarHBondContact O-N 3.28Å; H70-C73 VanDerWaalsContact O-N 3.14Å; H70-E74 WeakPolarHBondContact O-CB 3.03Å; H70-E74 PolarHBondContact O-N 2.97Å; H70-C88 PolarHBondContact CE1-O 3.02Å; H70-C88 PolarHBondContact ND1-N 3.43Å
71	A	97.3	Very high	93	Very high	51 Å²	51	80.4 Å²	80.4	42%	0.421	41%	0.407	S	S	.	.	H	α-helix	trans	-60.2	-39.1	177.9	0	0	0	0	0	112.1	Q67 E68 E74 H75	Q67-A71 PolarHBondContact O-N 3.41Å; E68-A71 PolarHBondContact O-N 3.46Å; A71-E74 PolarHBondContact O-N 3.01Å; A71-H75 VanDerWaalsContact O-CB 3.26Å; A71-H75 WeakPolarHBondContact O-CB 3.27Å; A71-H75 PolarHBondContact O-N 3.37Å
72	F	96.7	Very high	93.1	Very high	113 Å²	113	80.7 Å²	80.7	50%	0.496	43%	0.425	S	S	.	.	H	α-helix	trans	-60.5	-48	173.5	171.2	-94.2	0	0	0	112	E68 H70 H75 S76	E68-F72 WeakPolarHBondContact O-CB 3.38Å; E68-F72 PolarHBondContact O-N 2.86Å; H70-F72 VanDerWaalsContact C-N 3.29Å; H70-F72 PolarHBondContact O-N 3.1Å; F72-H75 PolarHBondContact O-N 3.44Å; F72-S76 VanDerWaalsContact O-CB 3.24Å; F72-S76 WeakPolarHBondContact O-CB 3.03Å; F72-S76 PolarHBondContact O-N 2.9Å
73	C	96.8	Very high	93.4	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-65.6	-39.9	179.4	-67.8	0	0	0	0	112	Q69 H70 S76 C77 C103	Q69-C73 PolarHBondContact O-N 2.9Å; Q69-C73 PolarHBondContact O-SG 3.09Å; H70-C73 PolarHBondContact O-N 3.28Å; H70-C73 VanDerWaalsContact O-N 3.14Å; C73-S76 PolarHBondContact O-N 3.21Å; C73-C77 WeakPolarHBondContact O-CB 2.74Å; C73-C77 PolarHBondContact O-N 3.32Å; C73-C77 PolarHBondContact O-SG 3.46Å; C73-C103 WeakPolarHBondContact CA-SG 3.4Å; C73-C103 HydrophobicContact CB-CB 3.57Å; C73-C103 WeakPolarHBondContact CB-SG 3.47Å; C73-C103 WeakPolarHBondContact SG-CA 3.32Å; C73-C103 WeakPolarHBondContact SG-CB 3.31Å; C73-C103 CovalentContact SG-SG 2.04Å; C73-C103 PolarHBondContact SG-SG 3.2Å
74	E	96.2	Very high	93.4	Very high	96 Å²	96	76.2 Å²	76.2	45%	0.449	40%	0.396	S	S	.	.	H	α-helix	trans	-58.9	-55	174.2	-178.2	173.4	-152.4	0	0	111.1	H70 A71 S76 C77 I78 G86	H70-E74 WeakPolarHBondContact O-CB 3.03Å; H70-E74 PolarHBondContact O-N 2.97Å; A71-E74 PolarHBondContact O-N 3.01Å; E74-S76 VanDerWaalsContact C-N 3.34Å; E74-S76 PolarHBondContact O-N 2.03Å; E74-C77 PolarHBondContact O-N 3.04Å; E74-I78 HydrophobicContact CG-CD1 3.85Å; E74-I78 WeakPolarHBondContact O-CG1 3.43Å; E74-I78 PolarHBondContact O-N 3.08Å; E74-G86 WeakPolarHBondContact CA-O 3.14Å
75	H	96.6	Very high	93.6	Very high	117 Å²	117	74.4 Å²	74.4	54%	0.542	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-41.9	178.2	179.1	-82.4	0	0	0	112.3	A71 F72 I78 N79	A71-H75 VanDerWaalsContact O-CB 3.26Å; A71-H75 WeakPolarHBondContact O-CB 3.27Å; A71-H75 PolarHBondContact O-N 3.37Å; F72-H75 PolarHBondContact O-N 3.44Å; H75-I78 PolarHBondContact O-N 2.72Å; H75-N79 PolarHBondContact CD2-ND2 2.95Å; H75-N79 PolarHBondContact CE1-ND2 2.01Å; H75-N79 PolarHBondContact NE2-ND2 3.23Å; H75-N79 WeakPolarHBondContact O-CB 3.18Å; H75-N79 PolarHBondContact O-N 2.94Å; H75-N79 PolarHBondContact O-ND2 2.97Å
76	S	95.6	Very high	93.6	Very high	15 Å²	15	73.9 Å²	73.9	11%	0.105	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-44.5	177	180	0	0	0	0	111.4	F72 C73 E74 Q80	F72-S76 VanDerWaalsContact O-CB 3.24Å; F72-S76 WeakPolarHBondContact O-CB 3.03Å; F72-S76 PolarHBondContact O-N 2.9Å; C73-S76 PolarHBondContact O-N 3.21Å; E74-S76 VanDerWaalsContact C-N 3.34Å; E74-S76 PolarHBondContact O-N 2.03Å; S76-Q80 WeakPolarHBondContact O-CA 3.3Å; S76-Q80 WeakPolarHBondContact O-CB 3.42Å; S76-Q80 WeakPolarHBondContact O-CG 3.41Å; S76-Q80 PolarHBondContact O-N 2.77Å; S76-Q80 PolarHBondContact OG-NE2 2.04Å; S76-Q80 PolarHBondContact OG-OE1 2.88Å
77	C	93.9	Very high	93.6	Very high	1 Å²	1	75.6 Å²	75.6	1%	0.007	38%	0.383	C	S	.	.	H	α-helix	trans	-68.5	-39.7	179.2	-71.1	0	0	0	0	112.9	C73 E74 R81 G82 L83 G85 C105	C73-C77 WeakPolarHBondContact O-CB 2.74Å; C73-C77 PolarHBondContact O-N 3.32Å; C73-C77 PolarHBondContact O-SG 3.46Å; E74-C77 PolarHBondContact O-N 3.04Å; C77-R81 WeakPolarHBondContact O-CB 3.26Å; C77-R81 PolarHBondContact O-N 3.02Å; C77-G82 PolarHBondContact O-N 2.93Å; C77-L83 PolarHBondContact O-N 3.06Å; C77-G85 VanDerWaalsContact CB-O 3.26Å; C77-G85 WeakPolarHBondContact CB-O 3.36Å; C77-C105 HydrophobicContact CB-CB 3.69Å; C77-C105 WeakPolarHBondContact CB-SG 3.48Å; C77-C105 WeakPolarHBondContact SG-CA 3.44Å; C77-C105 WeakPolarHBondContact SG-CB 3.48Å; C77-C105 CovalentContact SG-SG 2.03Å; C77-C105 PolarHBondContact SG-SG 3.4Å
78	I	93.5	Very high	93.5	Very high	68 Å²	68	68.1 Å²	68.1	35%	0.349	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-54.2	177.1	-64.8	168.7	0	0	0	110.1	E74 H75 G82 L83	E74-I78 HydrophobicContact CG-CD1 3.85Å; E74-I78 WeakPolarHBondContact O-CG1 3.43Å; E74-I78 PolarHBondContact O-N 3.08Å; H75-I78 PolarHBondContact O-N 2.72Å; I78-G82 VanDerWaalsContact O-CA 3.25Å; I78-G82 WeakPolarHBondContact O-CA 3.43Å; I78-G82 PolarHBondContact O-N 3.01Å; I78-L83 WeakPolarHBondContact CA-O 3.35Å
79	N	93.4	Very high	93.2	Very high	103 Å²	103	65.5 Å²	65.5	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-85.4	-27.8	-167.5	-67.3	-38.8	0	0	0	114.2	H75	H75-N79 PolarHBondContact CD2-ND2 2.95Å; H75-N79 PolarHBondContact CE1-ND2 2.01Å; H75-N79 PolarHBondContact NE2-ND2 3.23Å; H75-N79 WeakPolarHBondContact O-CB 3.18Å; H75-N79 PolarHBondContact O-N 2.94Å; H75-N79 PolarHBondContact O-ND2 2.97Å
80	Q	91.1	Very high	93	Very high	143 Å²	143	64.3 Å²	64.3	67%	0.668	33%	0.33	S	S	*	.	H	α-helix	trans	-95.4	-24.9	-179.3	-53.7	179.2	3.9	0	0	112.9	S76	S76-Q80 WeakPolarHBondContact O-CA 3.3Å; S76-Q80 WeakPolarHBondContact O-CB 3.42Å; S76-Q80 WeakPolarHBondContact O-CG 3.41Å; S76-Q80 PolarHBondContact O-N 2.77Å; S76-Q80 PolarHBondContact OG-NE2 2.04Å; S76-Q80 PolarHBondContact OG-OE1 2.88Å
81	R	86.2	Confident	92.5	Very high	177 Å²	177	63.8 Å²	63.8	67%	0.668	33%	0.328	S	S	*	.	H	α-helix	trans	-121	-6.5	-174.8	-56.8	-171.5	-179.1	-139.9	-2.5	114.1	C77 L83	C77-R81 WeakPolarHBondContact O-CB 3.26Å; C77-R81 PolarHBondContact O-N 3.02Å; R81-L83 HydrophobicContact CB-CD1 3.88Å; R81-L83 HydrophobicContact CB-CG 3.89Å; R81-L83 PolarHBondContact O-N 2.95Å
82	G	87	Confident	91.6	Very high	67 Å²	67	63.7 Å²	63.7	69%	0.691	33%	0.327	S	S	*	.			trans	63.1	24.9	-177.1	0	0	0	0	0	113.1	C77 I78	C77-G82 PolarHBondContact O-N 2.93Å; I78-G82 VanDerWaalsContact O-CA 3.25Å; I78-G82 WeakPolarHBondContact O-CA 3.43Å; I78-G82 PolarHBondContact O-N 3.01Å
83	L	88.5	Confident	90.4	Very high	43 Å²	43	59.8 Å²	59.8	23%	0.225	31%	0.314	C	S	.	.			trans	-93.1	165	-179.9	-65.1	174.6	0	0	0	110.6	C77 I78 R81 G85 C105	C77-L83 PolarHBondContact O-N 3.06Å; I78-L83 WeakPolarHBondContact CA-O 3.35Å; R81-L83 HydrophobicContact CB-CD1 3.88Å; R81-L83 HydrophobicContact CB-CG 3.89Å; R81-L83 PolarHBondContact O-N 2.95Å; L83-G85 PolarHBondContact O-N 3.22Å; L83-C105 HydrophobicContact CB-CB 4.46Å; L83-C105 HydrophobicContact CD1-CB 3.37Å
84	S	89	Confident	89.1	Confident	57 Å²	57	72.1 Å²	72.1	40%	0.399	36%	0.361	S	S	.	.	S	Bend	trans	-68.8	-5	-174.1	-51.2	0	0	0	0	115.2	P110	S84-P110 WeakPolarHBondContact OG-CD 3.48Å
85	G	92.1	Very high	87.6	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.374	C	S	.	.			trans	147.5	-178.5	-175.3	0	0	0	0	0	112.1	C77 L83 C105 F106	C77-G85 VanDerWaalsContact CB-O 3.26Å; C77-G85 WeakPolarHBondContact CB-O 3.36Å; L83-G85 PolarHBondContact O-N 3.22Å; G85-C105 WeakPolarHBondContact O-CA 3.27Å; G85-F106 WeakPolarHBondContact O-CD2 3.49Å; G85-F106 PolarHBondContact O-N 2.92Å
86	G	92.9	Very high	85.7	Confident	7 Å²	7	80.1 Å²	80.1	7%	0.072	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	172.2	178.7	0	0	0	0	0	111.6	E74 A104	E74-G86 WeakPolarHBondContact CA-O 3.14Å; G86-A104 CarbonylContact C-O 3.45Å; G86-A104 WeakPolarHBondContact CA-O 3.46Å
87	Y	94.2	Very high	83.9	Confident	99 Å²	99	86.1 Å²	86.1	39%	0.388	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152	-175.9	60.9	-81.5	0	0	0	110.8	Y89 C103 A104 F106	Y87-Y89 HydrophobicContact CE2-CD1 4.41Å; Y87-C103 WeakPolarHBondContact O-CA 3.06Å; Y87-A104 HydrophobicContact CD1-CB 4.39Å; Y87-A104 WeakPolarHBondContact CD1-O 3.29Å; Y87-A104 HydrophobicContact CE1-CB 3.79Å; Y87-A104 HydrophobicContact CE2-CB 4.05Å; Y87-A104 PolarHBondContact N-O 3.32Å; Y87-A104 PolarHBondContact O-N 3.47Å; Y87-F106 AromaticContact CD1-CD1 3.95Å; Y87-F106 HydrophobicContact CD1-CD1 3.95Å; Y87-F106 AromaticContact CD1-CE1 3.37Å; Y87-F106 HydrophobicContact CD1-CE1 3.37Å; Y87-F106 AromaticContact CD1-CZ 3.94Å; Y87-F106 HydrophobicContact CD1-CZ 3.94Å; Y87-F106 HydrophobicContact CE1-CD1 4.04Å; Y87-F106 AromaticContact CE1-CE1 3.81Å; Y87-F106 HydrophobicContact CE1-CE1 3.81Å; Y87-F106 HydrophobicContact CG-CE1 4.36Å
88	C	94.3	Very high	82.8	Confident	5 Å²	5	94.7 Å²	94.7	3%	0.034	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	142.7	167.4	-177	0	0	0	0	110	C65 Q69 H70 A101 R102	C65-C88 WeakPolarHBondContact CA-SG 3.28Å; C65-C88 HydrophobicContact CB-CB 3.67Å; C65-C88 WeakPolarHBondContact CB-SG 3.02Å; C65-C88 WeakPolarHBondContact SG-CB 3.43Å; C65-C88 CovalentContact SG-SG 2.04Å; C65-C88 PolarHBondContact SG-SG 2.91Å; Q69-C88 HydrophobicContact CB-CB 4.39Å; Q69-C88 HydrophobicContact CG-CB 3.98Å; Q69-C88 WeakPolarHBondContact CG-SG 3.34Å; H70-C88 PolarHBondContact CE1-O 3.02Å; H70-C88 PolarHBondContact ND1-N 3.43Å; C88-A101 VanDerWaalsContact SG-CB 3.54Å; C88-R102 CarbonylContact C-O 3.51Å; C88-R102 VanDerWaalsContact CA-O 3.29Å; C88-R102 WeakPolarHBondContact CA-O 3.35Å
89	Y	91	Very high	82.3	Confident	80 Å²	80	91.7 Å²	91.7	31%	0.314	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	144.1	165.6	68.2	-78.4	0	0	0	111.1	C65 Y87 H91 R102 A104	C65-Y89 WeakPolarHBondContact SG-CA 3.06Å; C65-Y89 PolarHBondContact SG-N 3.42Å; Y87-Y89 HydrophobicContact CE2-CD1 4.41Å; Y89-H91 HydrophobicContact CE2-CB 4.08Å; Y89-H91 AromaticContact CE2-CD2 3.96Å; Y89-H91 PolarHBondContact O-N 3.04Å; Y89-R102 HydrophobicContact CD1-CB 4.26Å; Y89-R102 VanDerWaalsContact CD1-O 3.26Å; Y89-R102 WeakPolarHBondContact CD1-O 3.4Å; Y89-R102 HydrophobicContact CE1-CB 3.64Å; Y89-R102 HydrophobicContact CE2-CB 4.26Å; Y89-R102 PolarHBondContact N-O 3.19Å; Y89-R102 PolarHBondContact O-N 3.41Å; Y89-A104 HydrophobicContact CD1-CB 3.9Å; Y89-A104 HydrophobicContact CE1-CB 3.75Å
90	P	89.6	Confident	82.1	Confident	34 Å²	34	89.2 Å²	89.2	22%	0.221	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	128.9	169.9	-19.9	32.2	0	0	0	109.5	L60 V64	L60-P90 HydrophobicContact CB-CB 3.82Å; L60-P90 HydrophobicContact CD1-CB 4.31Å; L60-P90 WeakPolarHBondContact CD1-O 3.27Å; V64-P90 HydrophobicContact CG2-CB 3.81Å; V64-P90 HydrophobicContact CG2-CG 4.03Å
91	H	86.2	Confident	82.1	Confident	64 Å²	64	84 Å²	84	30%	0.296	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.2	173.7	-175.6	-82.9	0	0	0	109.3	Y89 S93 S99 T100 R102	Y89-H91 HydrophobicContact CE2-CB 4.08Å; Y89-H91 AromaticContact CE2-CD2 3.96Å; Y89-H91 PolarHBondContact O-N 3.04Å; H91-S93 PolarHBondContact O-N 3.41Å; H91-S99 CarbonylContact O-C 3.51Å; H91-S99 WeakPolarHBondContact O-CA 3.35Å; H91-T100 WeakPolarHBondContact CB-O 3.06Å; H91-T100 PolarHBondContact N-O 3.34Å; H91-T100 PolarHBondContact O-N 2.67Å; H91-T100 PolarHBondContact O-OG1 3.26Å; H91-R102 HydrophobicContact CB-CB 4.24Å; H91-R102 HydrophobicContact CB-CG 3.86Å; H91-R102 PolarHBondContact CE1-NH1 3.25Å; H91-R102 PolarHBondContact NE2-NH1 3.3Å; H91-R102 VanDerWaalsContact NE2-NH1 3.18Å
92	A	79.6	Confident	82.4	Confident	48 Å²	48	81.6 Å²	81.6	40%	0.397	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	123	175.5	0	0	0	0	0	110.1	L60	L60-A92 HydrophobicContact CD2-CB 3.96Å
93	S	71.4	Confident	82.7	Confident	32 Å²	32	80.7 Å²	80.7	22%	0.224	38%	0.38	C	S	.	.			trans	-85	147.6	172.7	-164.1	0	0	0	0	109.8	H91 K95 H97 T100	H91-S93 PolarHBondContact O-N 3.41Å; S93-K95 PolarHBondContact OG-N 2.81Å; S93-K95 VanDerWaalsContact OG-N 3.09Å; S93-H97 WeakPolarHBondContact CB-O 3.25Å; S93-T100 WeakPolarHBondContact OG-CG2 3.43Å
94	R	68.3	Low	82.9	Confident	259 Å²	259	79.8 Å²	79.8	98%	0.977	38%	0.378	S	S	*	.	S	Bend	trans	-76.8	-14.1	163	-65.1	-172.4	-178.9	-178.7	0.4	112.2
95	K	64.6	Low	83.1	Confident	168 Å²	168	78 Å²	78	73%	0.73	37%	0.365	S	S	*	.	S	Bend	trans	-94	175.7	-176	-59.8	-175.7	179.4	-178.9	0	111.2	S93 H97	S93-K95 PolarHBondContact OG-N 2.81Å; S93-K95 VanDerWaalsContact OG-N 3.09Å; K95-H97 PolarHBondContact O-N 2.82Å; K95-H97 VanDerWaalsContact O-N 3.12Å
96	K	57.5	Low	83	Confident	213 Å²	213	82.4 Å²	82.4	93%	0.926	39%	0.385	S	S	*	.	S	Bend	trans	-55.1	-27.7	-176.9	-164.6	176.7	-178.6	-178.5	0	114.8	R98	K96-R98 PolarHBondContact O-N 2.85Å
97	H	58.3	Low	82.2	Confident	140 Å²	140	89.4 Å²	89.4	65%	0.648	42%	0.42	S	S	*	.	S	Bend	trans	-71.1	126.8	174.4	-60.8	-72.1	0	0	0	109.9	S93 K95 S99	S93-H97 WeakPolarHBondContact CB-O 3.25Å; K95-H97 PolarHBondContact O-N 2.82Å; K95-H97 VanDerWaalsContact O-N 3.12Å; H97-S99 PolarHBondContact O-N 2.88Å
98	R	70.9	Confident	80.9	Confident	181 Å²	181	95 Å²	95	68%	0.683	44%	0.441	S	S	*	.	S	Bend	trans	-59.3	-24	-177.1	-66.7	-175.1	178.6	-170.2	0.3	112.6	K96	K96-R98 PolarHBondContact O-N 2.85Å
99	S	82.7	Confident	79.3	Confident	6 Å²	6	100.4 Å²	100.4	4%	0.042	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.9	178	-61.2	0	0	0	0	112.3	L60 D61 H91 H97	L60-S99 WeakPolarHBondContact CA-OG 2.98Å; L60-S99 VanDerWaalsContact CB-OG 3.32Å; L60-S99 WeakPolarHBondContact CB-OG 3.49Å; L60-S99 WeakPolarHBondContact CD2-OG 3.46Å; D61-S99 PolarHBondContact N-OG 3.14Å; H91-S99 CarbonylContact O-C 3.51Å; H91-S99 WeakPolarHBondContact O-CA 3.35Å; H97-S99 PolarHBondContact O-N 2.88Å
100	T	88.7	Confident	77.6	Confident	50 Å²	50	99.3 Å²	99.3	31%	0.307	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134	170.9	46.6	0	0	0	0	108.3	H91 S93	H91-T100 WeakPolarHBondContact CB-O 3.06Å; H91-T100 PolarHBondContact N-O 3.34Å; H91-T100 PolarHBondContact O-N 2.67Å; H91-T100 PolarHBondContact O-OG1 3.26Å; S93-T100 WeakPolarHBondContact OG-CG2 3.43Å
101	A	90.5	Very high	76	Confident	35 Å²	35	103.6 Å²	103.6	29%	0.289	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.1	172	0	0	0	0	0	111.6	V64 Q69 C88	V64-A101 HydrophobicContact CG2-CB 4.39Å; V64-A101 WeakPolarHBondContact O-CB 3.47Å; Q69-A101 HydrophobicContact CG-CB 3.76Å; C88-A101 VanDerWaalsContact SG-CB 3.54Å
102	R	93.4	Very high	74.8	Confident	126 Å²	126	110.5 Å²	110.5	48%	0.475	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	157.6	170.3	-75.9	-165.3	160.9	174.4	-12.8	110.7	C88 Y89 H91	C88-R102 CarbonylContact C-O 3.51Å; C88-R102 VanDerWaalsContact CA-O 3.29Å; C88-R102 WeakPolarHBondContact CA-O 3.35Å; Y89-R102 HydrophobicContact CD1-CB 4.26Å; Y89-R102 VanDerWaalsContact CD1-O 3.26Å; Y89-R102 WeakPolarHBondContact CD1-O 3.4Å; Y89-R102 HydrophobicContact CE1-CB 3.64Å; Y89-R102 HydrophobicContact CE2-CB 4.26Å; Y89-R102 PolarHBondContact N-O 3.19Å; Y89-R102 PolarHBondContact O-N 3.41Å; H91-R102 HydrophobicContact CB-CB 4.24Å; H91-R102 HydrophobicContact CB-CG 3.86Å; H91-R102 PolarHBondContact CE1-NH1 3.25Å; H91-R102 PolarHBondContact NE2-NH1 3.3Å; H91-R102 VanDerWaalsContact NE2-NH1 3.18Å
103	C	93.8	Very high	73.4	Confident	48 Å²	48	117.8 Å²	117.8	32%	0.324	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	136.9	177.1	-58.8	0	0	0	0	111.4	C73 Y87	C73-C103 WeakPolarHBondContact CA-SG 3.4Å; C73-C103 HydrophobicContact CB-CB 3.57Å; C73-C103 WeakPolarHBondContact CB-SG 3.47Å; C73-C103 WeakPolarHBondContact SG-CA 3.32Å; C73-C103 WeakPolarHBondContact SG-CB 3.31Å; C73-C103 CovalentContact SG-SG 2.04Å; C73-C103 PolarHBondContact SG-SG 3.2Å; Y87-C103 WeakPolarHBondContact O-CA 3.06Å
104	A	92.4	Very high	73.5	Confident	23 Å²	23	122.1 Å²	122.1	19%	0.19	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.4	143.3	165.4	0	0	0	0	0	109	G86 Y87 Y89	G86-A104 CarbonylContact C-O 3.45Å; G86-A104 WeakPolarHBondContact CA-O 3.46Å; Y87-A104 HydrophobicContact CD1-CB 4.39Å; Y87-A104 WeakPolarHBondContact CD1-O 3.29Å; Y87-A104 HydrophobicContact CE1-CB 3.79Å; Y87-A104 HydrophobicContact CE2-CB 4.05Å; Y87-A104 PolarHBondContact N-O 3.32Å; Y87-A104 PolarHBondContact O-N 3.47Å; Y89-A104 HydrophobicContact CD1-CB 3.9Å; Y89-A104 HydrophobicContact CE1-CB 3.75Å
105	C	93.3	Very high	73.8	Confident	20 Å²	20	114.9 Å²	114.9	14%	0.135	56%	0.556	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.1	152.8	177	-53.2	0	0	0	0	110.4	C77 L83 G85 N107	C77-C105 HydrophobicContact CB-CB 3.69Å; C77-C105 WeakPolarHBondContact CB-SG 3.48Å; C77-C105 WeakPolarHBondContact SG-CA 3.44Å; C77-C105 WeakPolarHBondContact SG-CB 3.48Å; C77-C105 CovalentContact SG-SG 2.03Å; C77-C105 PolarHBondContact SG-SG 3.4Å; L83-C105 HydrophobicContact CB-CB 4.46Å; L83-C105 HydrophobicContact CD1-CB 3.37Å; G85-C105 WeakPolarHBondContact O-CA 3.27Å; C105-N107 PolarHBondContact O-N 3.38Å; C105-N107 VanDerWaalsContact O-N 3.1Å
106	F	88.9	Confident	74.3	Confident	93 Å²	93	111.9 Å²	111.9	41%	0.408	55%	0.546	S	S	.	.			trans	-68.8	110.7	170.9	-56.7	-52.6	0	0	0	108.8	G85 Y87 R108	G85-F106 WeakPolarHBondContact O-CD2 3.49Å; G85-F106 PolarHBondContact O-N 2.92Å; Y87-F106 AromaticContact CD1-CD1 3.95Å; Y87-F106 HydrophobicContact CD1-CD1 3.95Å; Y87-F106 AromaticContact CD1-CE1 3.37Å; Y87-F106 HydrophobicContact CD1-CE1 3.37Å; Y87-F106 AromaticContact CD1-CZ 3.94Å; Y87-F106 HydrophobicContact CD1-CZ 3.94Å; Y87-F106 HydrophobicContact CE1-CD1 4.04Å; Y87-F106 AromaticContact CE1-CE1 3.81Å; Y87-F106 HydrophobicContact CE1-CE1 3.81Å; Y87-F106 HydrophobicContact CG-CE1 4.36Å; F106-R108 PolarHBondContact O-N 3.12Å
107	N	76.9	Confident	75.3	Confident	153 Å²	153	106 Å²	106	82%	0.818	52%	0.524	S	S	*	.			trans	-71.1	-9.8	179.3	-69.2	-23.1	0	0	0	113	C105	C105-N107 PolarHBondContact O-N 3.38Å; C105-N107 VanDerWaalsContact O-N 3.1Å
108	R	66.3	Low	76.4	Confident	218 Å²	218	103.9 Å²	103.9	82%	0.823	52%	0.516	S	S	*	.			trans	-103.6	117.3	178.4	-65.2	-175	-177.7	-175.8	0.8	108.3	F106 P110	F106-R108 PolarHBondContact O-N 3.12Å; R108-P110 WeakPolarHBondContact O-CD 3.31Å
109	I	60.3	Low	76.8	Confident	118 Å²	118	98.7 Å²	98.7	61%	0.605	51%	0.505	S	S	*	.			trans	-70.4	121.1	158.3	-50.4	172.9	0	0	0	104.8	V111	I109-V111 PolarHBondContact O-N 3.46Å
110	P	56.2	Low	76.3	Confident	57 Å²	57	105.4 Å²	105.4	37%	0.37	54%	0.538	S	S	.	.			trans	-61.6	108.3	169.5	21.1	-22.1	0	0	0	106.9	S84 R108 Y112	S84-P110 WeakPolarHBondContact OG-CD 3.48Å; R108-P110 WeakPolarHBondContact O-CD 3.31Å; P110-Y112 VanDerWaalsContact C-N 3.32Å; P110-Y112 HydrophobicContact CB-CD2 4.32Å; P110-Y112 HydrophobicContact CB-CE2 3.83Å; P110-Y112 HydrophobicContact CG-CD2 4.49Å; P110-Y112 HydrophobicContact CG-CE2 3.71Å; P110-Y112 WeakPolarHBondContact O-CD2 3.32Å; P110-Y112 PolarHBondContact O-N 2.99Å; P110-Y112 VanDerWaalsContact O-N 3.08Å
111	V	55.3	Low	75.4	Confident	124 Å²	124	109.6 Å²	109.6	75%	0.752	56%	0.556	S	S	*	*			trans	-74.5	96.1	167.3	-170.8	0	0	0	0	104.9	I109 V113	I109-V111 PolarHBondContact O-N 3.46Å; V111-V113 HydrophobicContact CG1-CG2 3.87Å; V111-V113 PolarHBondContact O-N 3.43Å
112	Y	60.9	Low	74.1	Confident	209 Å²	209	115.8 Å²	115.8	82%	0.82	58%	0.578	S	S	*	*			trans	-72.2	109	166	-61.5	-80.1	0	0	0	106.5	P110	P110-Y112 VanDerWaalsContact C-N 3.32Å; P110-Y112 HydrophobicContact CB-CD2 4.32Å; P110-Y112 HydrophobicContact CB-CE2 3.83Å; P110-Y112 HydrophobicContact CG-CD2 4.49Å; P110-Y112 HydrophobicContact CG-CE2 3.71Å; P110-Y112 WeakPolarHBondContact O-CD2 3.32Å; P110-Y112 PolarHBondContact O-N 2.99Å; P110-Y112 VanDerWaalsContact O-N 3.08Å
113	V	51.7	Low	72.4	Confident	201 Å²	201	114.9 Å²	114.9	100%	1.218	59%	0.588	S	S	*	*			trans	-100.3	0	167.1	-163.1	0	0	0	0	107.6	V111	V111-V113 HydrophobicContact CG1-CG2 3.87Å; V111-V113 PolarHBondContact O-N 3.43Å

Retrieved 113 of 113 residues in 306.2 ms (Link to these results)

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