A0A5K4F6D5_SCHMA Loading...

EGF-like domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F6D5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 123 aa.

						>A0A5K4F6D5_SCHMA|A0A5K4F6D5
MCQPGRTGQFCDQNIGDCVDKCKNGGTCHDLLDDFYCTCPIGFEGRYCEINRECSSKPCQNKGIGHEITGGYLCECPNGFIGQNCELTIDLCQANPRQNGEYCQHTLYPGDIQCHCPLGWSGR
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	80	Confident	85.6	Confident	242 Å²	242	99.1 Å²	99.1	100%	1.192	51%	0.512	S	S	*	.				0	134.8	0	-75.4	-175.9	169.7	0	0	107.3
2	C	82.5	Confident	85.6	Confident	50 Å²	50	98.6 Å²	98.6	34%	0.338	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-79.3	157.7	179.7	-58.5	0	0	0	0	111.5	R6 C11	C2-R6 HydrophobicContact CB-CB 4.26Å; C2-R6 WeakPolarHBondContact CB-O 3.04Å; C2-C11 WeakPolarHBondContact CA-SG 3.21Å; C2-C11 HydrophobicContact CB-CB 3.65Å; C2-C11 WeakPolarHBondContact CB-SG 3.36Å; C2-C11 VanDerWaalsContact SG-CA 3.52Å; C2-C11 WeakPolarHBondContact SG-CB 3.32Å; C2-C11 CovalentContact SG-SG 2.04Å; C2-C11 PolarHBondContact SG-SG 3.19Å
3	Q	85.4	Confident	85.5	Confident	150 Å²	150	99.7 Å²	99.7	70%	0.701	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-63.8	154.9	167.2	-72.5	-178.3	-58.2	0	0	110.1	R6	Q3-R6 PolarHBondContact O-N 3.24Å; Q3-R6 VanDerWaalsContact O-N 3.14Å
4	P	82.9	Confident	85.2	Confident	92 Å²	92	96.4 Å²	96.4	60%	0.597	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	143.3	169.1	-25.9	35.2	0	0	0	111.4	R6 D33	P4-R6 VanDerWaalsContact C-N 3.27Å; P4-R6 PolarHBondContact O-N 3.47Å; P4-D33 HydrophobicContact CB-CB 4.48Å; P4-D33 WeakPolarHBondContact CB-OD2 3.37Å
5	G	83.1	Confident	85	Confident	2 Å²	2	94.5 Å²	94.5	2%	0.021	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-1.9	-175.8	0	0	0	0	0	116.4	N14 I15 D33	G5-N14 PolarHBondContact O-OD1 2.94Å; G5-I15 PolarHBondContact O-N 2.04Å; G5-D33 WeakPolarHBondContact CA-OD1 3.03Å; G5-D33 PolarHBondContact N-OD1 3.31Å
6	R	86.9	Confident	84.6	Confident	92 Å²	92	91.7 Å²	91.7	35%	0.347	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.6	-179.1	-66.9	-132.9	173.7	-157.4	-6.3	114.3	C2 Q3 P4 C11 D12 Q13 L32	C2-R6 HydrophobicContact CB-CB 4.26Å; C2-R6 WeakPolarHBondContact CB-O 3.04Å; Q3-R6 PolarHBondContact O-N 3.24Å; Q3-R6 VanDerWaalsContact O-N 3.14Å; P4-R6 VanDerWaalsContact C-N 3.27Å; P4-R6 PolarHBondContact O-N 3.47Å; R6-C11 WeakPolarHBondContact CD-O 3.27Å; R6-C11 PolarHBondContact NH1-O 3.21Å; R6-D12 PolarHBondContact NH1-O 3.45Å; R6-Q13 CarbonylContact C-O 3.53Å; R6-Q13 VanDerWaalsContact CA-O 3.31Å; R6-Q13 WeakPolarHBondContact CA-O 3.37Å; R6-L32 HydrophobicContact CG-CD1 3.92Å
7	T	87.8	Confident	84.4	Confident	64 Å²	64	88.5 Å²	88.5	39%	0.393	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	178.3	179.9	-167.4	0	0	0	0	111.5	C11 D12 Q13 I15	T7-C11 CarbonylContact O-C 3.36Å; T7-C11 WeakPolarHBondContact O-CA 3.33Å; T7-D12 PolarHBondContact O-N 3.25Å; T7-Q13 HydrophobicContact CG2-CB 3.69Å; T7-Q13 PolarHBondContact N-O 3.14Å; T7-Q13 WeakPolarHBondContact O-CB 2.95Å; T7-Q13 PolarHBondContact O-N 3.27Å; T7-Q13 VanDerWaalsContact O-N 3.16Å; T7-I15 HydrophobicContact CG2-CG1 4.15Å
8	G	86.4	Confident	84.3	Confident	26 Å²	26	85.5 Å²	85.5	27%	0.268	46%	0.458	S	S	.	.	S	Bend	trans	93.5	165.3	-177.6	0	0	0	0	0	113.7	F10 C11	G8-F10 PolarHBondContact O-N 3.28Å; G8-C11 PolarHBondContact O-N 2.86Å
9	Q	89.2	Confident	83.9	Confident	174 Å²	174	87.4 Å²	87.4	81%	0.813	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.6	-178.6	-177.6	176.9	-16.7	0	0	112.4
10	F	90.7	Very high	83.7	Confident	157 Å²	157	89.2 Å²	89.2	69%	0.689	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	10.8	-179.9	-56.8	-70.7	0	0	0	113.2	G8 D12	G8-F10 PolarHBondContact O-N 3.28Å; F10-D12 PolarHBondContact O-N 3.32Å
11	C	86.7	Confident	83.9	Confident	41 Å²	41	88.8 Å²	88.8	28%	0.277	48%	0.476	S	S	.	.	S	Bend	trans	55.2	31.2	-177.7	-50.4	0	0	0	0	113.5	C2 R6 T7 G8	C2-C11 WeakPolarHBondContact CA-SG 3.21Å; C2-C11 HydrophobicContact CB-CB 3.65Å; C2-C11 WeakPolarHBondContact CB-SG 3.36Å; C2-C11 VanDerWaalsContact SG-CA 3.52Å; C2-C11 WeakPolarHBondContact SG-CB 3.32Å; C2-C11 CovalentContact SG-SG 2.04Å; C2-C11 PolarHBondContact SG-SG 3.19Å; R6-C11 WeakPolarHBondContact CD-O 3.27Å; R6-C11 PolarHBondContact NH1-O 3.21Å; T7-C11 CarbonylContact O-C 3.36Å; T7-C11 WeakPolarHBondContact O-CA 3.33Å; G8-C11 PolarHBondContact O-N 2.86Å
12	D	86.1	Confident	84.4	Confident	93 Å²	93	78.1 Å²	78.1	50%	0.497	43%	0.425	S	S	.	.			trans	-97	-16.3	-175.7	56.3	-33.8	0	0	0	112.7	R6 T7 F10	R6-D12 PolarHBondContact NH1-O 3.45Å; T7-D12 PolarHBondContact O-N 3.25Å; F10-D12 PolarHBondContact O-N 3.32Å
13	Q	83.5	Confident	84.7	Confident	113 Å²	113	79.9 Å²	79.9	53%	0.528	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139.4	-180	-59.2	176.6	7.7	0	0	110.7	R6 T7	R6-Q13 CarbonylContact C-O 3.53Å; R6-Q13 VanDerWaalsContact CA-O 3.31Å; R6-Q13 WeakPolarHBondContact CA-O 3.37Å; T7-Q13 HydrophobicContact CG2-CB 3.69Å; T7-Q13 PolarHBondContact N-O 3.14Å; T7-Q13 WeakPolarHBondContact O-CB 2.95Å; T7-Q13 PolarHBondContact O-N 3.27Å; T7-Q13 VanDerWaalsContact O-N 3.16Å
14	N	81.5	Confident	84.7	Confident	54 Å²	54	76.1 Å²	76.1	29%	0.289	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	141.7	171	-151.5	32.7	0	0	0	109.8	G5 G16 D30 L31 L32	G5-N14 PolarHBondContact O-OD1 2.94Å; N14-G16 PolarHBondContact O-N 2.79Å; N14-D30 PolarHBondContact ND2-OD2 2.76Å; N14-L31 VanDerWaalsContact ND2-C 3.25Å; N14-L31 PolarHBondContact ND2-O 2.75Å; N14-L32 WeakPolarHBondContact OD1-CA 3.32Å; N14-L32 VanDerWaalsContact OD1-CD1 3.27Å; N14-L32 WeakPolarHBondContact OD1-CD1 3.44Å
15	I	82.3	Confident	84.8	Confident	67 Å²	67	74.9 Å²	74.9	34%	0.344	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-70.9	126.5	169.7	-67.1	173.4	0	0	0	106.9	G5 T7 D17	G5-I15 PolarHBondContact O-N 2.04Å; T7-I15 HydrophobicContact CG2-CG1 4.15Å; I15-D17 PolarHBondContact O-N 2.81Å
16	G	79.1	Confident	85.1	Confident	50 Å²	50	75.5 Å²	75.5	52%	0.515	42%	0.421	S	S	.	.			trans	-72.1	92.1	176.4	0	0	0	0	0	110.7	N14 C18 D30	N14-G16 PolarHBondContact O-N 2.79Å; G16-C18 PolarHBondContact O-N 2.81Å; G16-D30 WeakPolarHBondContact CA-OD1 3.31Å
17	D	80.7	Confident	85.3	Confident	37 Å²	37	75.2 Å²	75.2	20%	0.198	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.6	-178.7	-72.1	-47.4	0	0	0	112.4	I15 V19 K21 D30 D34 F35	I15-D17 PolarHBondContact O-N 2.81Å; D17-V19 VanDerWaalsContact C-N 3.34Å; D17-V19 PolarHBondContact O-N 3.16Å; D17-K21 VanDerWaalsContact O-CE 3.22Å; D17-K21 WeakPolarHBondContact O-CE 3.31Å; D17-K21 WeakPolarHBondContact O-CG 3.04Å; D17-D30 PolarHBondContact N-OD1 3.43Å; D17-D34 PolarHBondContact OD2-N 2.04Å; D17-F35 HydrophobicContact CB-CB 4.02Å; D17-F35 HydrophobicContact CB-CD1 4.13Å; D17-F35 HydrophobicContact CB-CG 4.46Å
18	C	82	Confident	85.5	Confident	35 Å²	35	74 Å²	74	24%	0.236	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	5.7	-173.2	-90.4	0	0	0	0	118	G16 D20 C28 H29 D30	G16-C18 PolarHBondContact O-N 2.81Å; C18-D20 PolarHBondContact O-N 2.68Å; C18-C28 WeakPolarHBondContact CA-SG 3.31Å; C18-C28 HydrophobicContact CB-CB 3.65Å; C18-C28 WeakPolarHBondContact CB-SG 3.34Å; C18-C28 WeakPolarHBondContact SG-CB 3.47Å; C18-C28 CovalentContact SG-SG 2.03Å; C18-C28 PolarHBondContact SG-SG 2.81Å; C18-H29 PolarHBondContact SG-N 3.14Å; C18-H29 VanDerWaalsContact SG-N 3.43Å; C18-D30 PolarHBondContact SG-N 3.36Å; C18-D30 VanDerWaalsContact SG-N 3.36Å
19	V	78.4	Confident	85.7	Confident	122 Å²	122	75.7 Å²	75.7	74%	0.739	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	107.8	-176.4	-175.5	0	0	0	0	111.2	D17 K21	D17-V19 VanDerWaalsContact C-N 3.34Å; D17-V19 PolarHBondContact O-N 3.16Å; V19-K21 PolarHBondContact O-N 3.01Å; V19-K21 VanDerWaalsContact O-N 3.07Å
20	D	79.2	Confident	85.7	Confident	122 Å²	122	70.5 Å²	70.5	65%	0.652	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	25	173.8	-163.1	35.2	0	0	0	116	C18 K23	C18-D20 PolarHBondContact O-N 2.68Å; D20-K23 PolarHBondContact O-NZ 3.17Å; D20-K23 IonicContact OD1-NZ 2.73Å; D20-K23 PolarHBondContact OD1-NZ 2.73Å; D20-K23 IonicContact OD2-NZ 3.16Å; D20-K23 PolarHBondContact OD2-NZ 2.98Å; D20-K23 VanDerWaalsContact OD2-NZ 3.15Å
21	K	87	Confident	85.4	Confident	81 Å²	81	66.6 Å²	66.6	35%	0.352	39%	0.388	S	S	.	.			trans	-73.3	-50.6	-179.9	-62.5	-69.7	-174.4	-179	0	112.1	D17 V19 F35 Y47	D17-K21 VanDerWaalsContact O-CE 3.22Å; D17-K21 WeakPolarHBondContact O-CE 3.31Å; D17-K21 WeakPolarHBondContact O-CG 3.04Å; V19-K21 PolarHBondContact O-N 3.01Å; V19-K21 VanDerWaalsContact O-N 3.07Å; K21-F35 HydrophobicContact CB-CD2 3.81Å; K21-F35 HydrophobicContact CB-CE2 3.5Å; K21-F35 HydrophobicContact CB-CZ 3.99Å; K21-F35 HydrophobicContact CD-CD1 4.42Å; K21-F35 HydrophobicContact CD-CE1 3.89Å; K21-F35 HydrophobicContact CD-CE2 4.26Å; K21-F35 HydrophobicContact CD-CZ 3.85Å; K21-F35 HydrophobicContact CG-CD1 4.21Å; K21-F35 HydrophobicContact CG-CD2 3.98Å; K21-F35 HydrophobicContact CG-CE1 4.07Å; K21-F35 HydrophobicContact CG-CE2 3.84Å; K21-F35 HydrophobicContact CG-CG 4.21Å; K21-F35 HydrophobicContact CG-CZ 3.94Å; K21-Y47 HydrophobicContact CB-CD1 4.26Å; K21-Y47 HydrophobicContact CD-CE1 4.26Å; K21-Y47 WeakPolarHBondContact O-CD1 3.44Å
22	C	90.7	Very high	85.3	Confident	18 Å²	18	69.3 Å²	69.3	12%	0.122	40%	0.399	C	S	.	.			trans	-80.7	124.4	-174.5	-49.7	0	0	0	0	111.1	G26 C28 C37	C22-G26 WeakPolarHBondContact CB-O 3.29Å; C22-C28 HydrophobicContact CB-CB 4.47Å; C22-C28 WeakPolarHBondContact SG-CA 3.48Å; C22-C28 WeakPolarHBondContact SG-CB 3.31Å; C22-C28 VanDerWaalsContact SG-SG 3.67Å; C22-C37 WeakPolarHBondContact CA-SG 2.95Å; C22-C37 HydrophobicContact CB-CB 3.76Å; C22-C37 WeakPolarHBondContact CB-SG 3.25Å; C22-C37 WeakPolarHBondContact SG-CA 3.49Å; C22-C37 WeakPolarHBondContact SG-CB 3.35Å; C22-C37 CovalentContact SG-SG 2.02Å; C22-C37 PolarHBondContact SG-SG 2.03Å
23	K	89	Confident	85.2	Confident	87 Å²	87	69.3 Å²	69.3	38%	0.378	40%	0.399	S	S	.	.			trans	-94.3	172.3	178.9	-58.5	-52.4	-178.7	-162.2	0	111.1	D20 G25 G26 Y47 C48	D20-K23 PolarHBondContact O-NZ 3.17Å; D20-K23 IonicContact OD1-NZ 2.73Å; D20-K23 PolarHBondContact OD1-NZ 2.73Å; D20-K23 IonicContact OD2-NZ 3.16Å; D20-K23 PolarHBondContact OD2-NZ 2.98Å; D20-K23 VanDerWaalsContact OD2-NZ 3.15Å; K23-G25 PolarHBondContact O-N 2.85Å; K23-G26 PolarHBondContact O-N 3.45Å; K23-Y47 PolarHBondContact N-O 3.34Å; K23-C48 WeakPolarHBondContact O-CB 3.43Å
24	N	85.7	Confident	85.4	Confident	72 Å²	72	67 Å²	67	39%	0.385	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	30.3	174.2	-60.2	-47.7	0	0	0	115	P40 F43 C48	N24-P40 WeakPolarHBondContact O-CG 3.34Å; N24-F43 HydrophobicContact CB-CD1 3.61Å; N24-F43 HydrophobicContact CB-CD2 4.24Å; N24-F43 HydrophobicContact CB-CE1 3.54Å; N24-F43 HydrophobicContact CB-CE2 4.18Å; N24-F43 HydrophobicContact CB-CG 3.97Å; N24-F43 HydrophobicContact CB-CZ 3.85Å; N24-F43 VanDerWaalsContact CG-CE1 3.45Å; N24-C48 PolarHBondContact ND2-O 2.92Å
25	G	85.5	Confident	85.8	Confident	66 Å²	66	65.1 Å²	65.1	68%	0.68	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	14.3	-178.7	0	0	0	0	0	114.8	K23	K23-G25 PolarHBondContact O-N 2.85Å
26	G	89.2	Confident	86.3	Confident	14 Å²	14	67.1 Å²	67.1	14%	0.144	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-60.3	140.4	172.8	0	0	0	0	0	112.7	C22 K23 T38	C22-G26 WeakPolarHBondContact CB-O 3.29Å; K23-G26 PolarHBondContact O-N 3.45Å; G26-T38 WeakPolarHBondContact CA-O 3.18Å
27	T	91	Very high	87	Confident	86 Å²	86	65.6 Å²	65.6	53%	0.528	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.1	176	-60.1	0	0	0	0	109.4	C37 T38	T27-C37 WeakPolarHBondContact O-CA 3.48Å; T27-T38 PolarHBondContact N-O 3.35Å; T27-T38 PolarHBondContact O-N 3.26Å
28	C	92.4	Very high	87.7	Confident	39 Å²	39	67.1 Å²	67.1	26%	0.264	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.1	179.2	-164.6	0	0	0	0	112.1	C18 C22	C18-C28 WeakPolarHBondContact CA-SG 3.31Å; C18-C28 HydrophobicContact CB-CB 3.65Å; C18-C28 WeakPolarHBondContact CB-SG 3.34Å; C18-C28 WeakPolarHBondContact SG-CB 3.47Å; C18-C28 CovalentContact SG-SG 2.03Å; C18-C28 PolarHBondContact SG-SG 2.81Å; C22-C28 HydrophobicContact CB-CB 4.47Å; C22-C28 WeakPolarHBondContact SG-CA 3.48Å; C22-C28 WeakPolarHBondContact SG-CB 3.31Å; C22-C28 VanDerWaalsContact SG-SG 3.67Å
29	H	90.6	Very high	88	Confident	62 Å²	62	67.3 Å²	67.3	29%	0.287	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.1	174.2	-59.9	-80.5	0	0	0	109.8	C18 F35 Y36 T38	C18-H29 PolarHBondContact SG-N 3.14Å; C18-H29 VanDerWaalsContact SG-N 3.43Å; H29-F35 VanDerWaalsContact O-CA 3.31Å; H29-F35 WeakPolarHBondContact O-CA 2.96Å; H29-Y36 HydrophobicContact CB-CD1 3.68Å; H29-Y36 HydrophobicContact CB-CD2 4.29Å; H29-Y36 HydrophobicContact CB-CE1 3.25Å; H29-Y36 HydrophobicContact CB-CE2 3.9Å; H29-Y36 HydrophobicContact CB-CG 4.2Å; H29-Y36 AromaticContact CD2-CD2 3.93Å; H29-Y36 AromaticContact CD2-CE2 3.31Å; H29-Y36 WeakPolarHBondContact CD2-CE2 3.45Å; H29-Y36 AromaticContact CD2-CZ 3.55Å; H29-Y36 AromaticContact CG-CE1 3.91Å; H29-Y36 AromaticContact CG-CE2 3.73Å; H29-Y36 AromaticContact CG-CZ 3.43Å; H29-Y36 VanDerWaalsContact CG-CZ 3.43Å; H29-Y36 PolarHBondContact N-O 2.87Å; H29-Y36 PolarHBondContact O-N 2.02Å; H29-T38 PolarHBondContact CD2-OG1 2.95Å; H29-T38 PolarHBondContact NE2-OG1 2.84Å
30	D	87.6	Confident	88.4	Confident	64 Å²	64	63.7 Å²	63.7	34%	0.342	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	131.3	179.4	-165.5	68.3	0	0	0	110.3	N14 G16 D17 C18	N14-D30 PolarHBondContact ND2-OD2 2.76Å; G16-D30 WeakPolarHBondContact CA-OD1 3.31Å; D17-D30 PolarHBondContact N-OD1 3.43Å; C18-D30 PolarHBondContact SG-N 3.36Å; C18-D30 VanDerWaalsContact SG-N 3.36Å
31	L	85.3	Confident	88.5	Confident	76 Å²	76	66.2 Å²	66.2	40%	0.398	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	173.4	175.4	-63.6	176.3	0	0	0	109.5	N14 D33 D34 Y36	N14-L31 VanDerWaalsContact ND2-C 3.25Å; N14-L31 PolarHBondContact ND2-O 2.75Å; L31-D33 PolarHBondContact O-N 3.35Å; L31-D34 CarbonylContact C-O 3.48Å; L31-D34 VanDerWaalsContact C-O 3.31Å; L31-D34 VanDerWaalsContact CA-O 3.29Å; L31-D34 WeakPolarHBondContact CA-O 3.22Å; L31-D34 HydrophobicContact CB-CB 4.22Å; L31-D34 VanDerWaalsContact CB-O 3.31Å; L31-D34 WeakPolarHBondContact CB-O 3Å; L31-D34 PolarHBondContact N-O 3.4Å; L31-Y36 HydrophobicContact CD1-CD1 3.61Å; L31-Y36 HydrophobicContact CD1-CE1 4.24Å; L31-Y36 HydrophobicContact CD2-CD1 4.26Å; L31-Y36 HydrophobicContact CD2-CE1 4.09Å; L31-Y36 HydrophobicContact CG-CD1 3.89Å; L31-Y36 HydrophobicContact CG-CE1 4.21Å
32	L	85.7	Confident	87.9	Confident	97 Å²	97	63 Å²	63	51%	0.508	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	111.2	176.4	-166	88.9	0	0	0	110.5	R6 N14 D34	R6-L32 HydrophobicContact CG-CD1 3.92Å; N14-L32 WeakPolarHBondContact OD1-CA 3.32Å; N14-L32 VanDerWaalsContact OD1-CD1 3.27Å; N14-L32 WeakPolarHBondContact OD1-CD1 3.44Å; L32-D34 PolarHBondContact O-N 3.35Å
33	D	83.2	Confident	87.6	Confident	93 Å²	93	63.2 Å²	63.2	50%	0.497	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	22.9	-177.6	-156.9	45.2	0	0	0	113.5	P4 G5 L31	P4-D33 HydrophobicContact CB-CB 4.48Å; P4-D33 WeakPolarHBondContact CB-OD2 3.37Å; G5-D33 WeakPolarHBondContact CA-OD1 3.03Å; G5-D33 PolarHBondContact N-OD1 3.31Å; L31-D33 PolarHBondContact O-N 3.35Å
34	D	87.9	Confident	87.4	Confident	64 Å²	64	61.7 Å²	61.7	34%	0.342	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	173.5	178.4	-155.6	-2.1	0	0	0	110.5	D17 L31 L32 R46	D17-D34 PolarHBondContact OD2-N 2.04Å; L31-D34 CarbonylContact C-O 3.48Å; L31-D34 VanDerWaalsContact C-O 3.31Å; L31-D34 VanDerWaalsContact CA-O 3.29Å; L31-D34 WeakPolarHBondContact CA-O 3.22Å; L31-D34 HydrophobicContact CB-CB 4.22Å; L31-D34 VanDerWaalsContact CB-O 3.31Å; L31-D34 WeakPolarHBondContact CB-O 3Å; L31-D34 PolarHBondContact N-O 3.4Å; L32-D34 PolarHBondContact O-N 3.35Å; D34-R46 IonicContact OD1-CZ 3.9Å; D34-R46 IonicContact OD1-NH2 2.68Å; D34-R46 PolarHBondContact OD1-NH2 3.03Å; D34-R46 IonicContact OD2-NH2 3.59Å
35	F	90.2	Very high	87.4	Confident	15 Å²	15	59.8 Å²	59.8	7%	0.066	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	159.3	170.1	69.5	-77.2	0	0	0	108.9	D17 K21 H29 Y47	D17-F35 HydrophobicContact CB-CB 4.02Å; D17-F35 HydrophobicContact CB-CD1 4.13Å; D17-F35 HydrophobicContact CB-CG 4.46Å; K21-F35 HydrophobicContact CB-CD2 3.81Å; K21-F35 HydrophobicContact CB-CE2 3.5Å; K21-F35 HydrophobicContact CB-CZ 3.99Å; K21-F35 HydrophobicContact CD-CD1 4.42Å; K21-F35 HydrophobicContact CD-CE1 3.89Å; K21-F35 HydrophobicContact CD-CE2 4.26Å; K21-F35 HydrophobicContact CD-CZ 3.85Å; K21-F35 HydrophobicContact CG-CD1 4.21Å; K21-F35 HydrophobicContact CG-CD2 3.98Å; K21-F35 HydrophobicContact CG-CE1 4.07Å; K21-F35 HydrophobicContact CG-CE2 3.84Å; K21-F35 HydrophobicContact CG-CG 4.21Å; K21-F35 HydrophobicContact CG-CZ 3.94Å; H29-F35 VanDerWaalsContact O-CA 3.31Å; H29-F35 WeakPolarHBondContact O-CA 2.96Å; F35-Y47 HydrophobicContact CE1-CE1 4.33Å; F35-Y47 AromaticContact CE2-CD1 3.99Å; F35-Y47 HydrophobicContact CE2-CD1 3.99Å; F35-Y47 AromaticContact CE2-CE1 3.9Å; F35-Y47 HydrophobicContact CE2-CE1 3.9Å; F35-Y47 AromaticContact CZ-CD1 3.88Å; F35-Y47 HydrophobicContact CZ-CD1 3.88Å; F35-Y47 AromaticContact CZ-CE1 3.3Å; F35-Y47 HydrophobicContact CZ-CE1 3.3Å
36	Y	91.9	Very high	87.5	Confident	110 Å²	110	62.9 Å²	62.9	43%	0.431	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151	165.9	74.5	-84.1	0	0	0	111.1	H29 L31	H29-Y36 HydrophobicContact CB-CD1 3.68Å; H29-Y36 HydrophobicContact CB-CD2 4.29Å; H29-Y36 HydrophobicContact CB-CE1 3.25Å; H29-Y36 HydrophobicContact CB-CE2 3.9Å; H29-Y36 HydrophobicContact CB-CG 4.2Å; H29-Y36 AromaticContact CD2-CD2 3.93Å; H29-Y36 AromaticContact CD2-CE2 3.31Å; H29-Y36 WeakPolarHBondContact CD2-CE2 3.45Å; H29-Y36 AromaticContact CD2-CZ 3.55Å; H29-Y36 AromaticContact CG-CE1 3.91Å; H29-Y36 AromaticContact CG-CE2 3.73Å; H29-Y36 AromaticContact CG-CZ 3.43Å; H29-Y36 VanDerWaalsContact CG-CZ 3.43Å; H29-Y36 PolarHBondContact N-O 2.87Å; H29-Y36 PolarHBondContact O-N 2.02Å; L31-Y36 HydrophobicContact CD1-CD1 3.61Å; L31-Y36 HydrophobicContact CD1-CE1 4.24Å; L31-Y36 HydrophobicContact CD2-CD1 4.26Å; L31-Y36 HydrophobicContact CD2-CE1 4.09Å; L31-Y36 HydrophobicContact CG-CD1 3.89Å; L31-Y36 HydrophobicContact CG-CE1 4.21Å
37	C	94.2	Very high	87.6	Confident	18 Å²	18	66.4 Å²	66.4	12%	0.122	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.7	177.6	-62.3	0	0	0	0	110.3	C22 T27 R46 C48	C22-C37 WeakPolarHBondContact CA-SG 2.95Å; C22-C37 HydrophobicContact CB-CB 3.76Å; C22-C37 WeakPolarHBondContact CB-SG 3.25Å; C22-C37 WeakPolarHBondContact SG-CA 3.49Å; C22-C37 WeakPolarHBondContact SG-CB 3.35Å; C22-C37 CovalentContact SG-SG 2.02Å; C22-C37 PolarHBondContact SG-SG 2.03Å; T27-C37 WeakPolarHBondContact O-CA 3.48Å; C37-R46 WeakPolarHBondContact CB-O 3.3Å; C37-R46 PolarHBondContact SG-O 2.9Å; C37-R46 VanDerWaalsContact SG-O 3.4Å; C37-C48 WeakPolarHBondContact CB-SG 3.44Å
38	T	94.4	Very high	87.5	Confident	69 Å²	69	62.3 Å²	62.3	42%	0.423	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.3	163.9	-59.6	0	0	0	0	108	G26 T27 H29	G26-T38 WeakPolarHBondContact CA-O 3.18Å; T27-T38 PolarHBondContact N-O 3.35Å; T27-T38 PolarHBondContact O-N 3.26Å; H29-T38 PolarHBondContact CD2-OG1 2.95Å; H29-T38 PolarHBondContact NE2-OG1 2.84Å
39	C	89.4	Confident	87.2	Confident	38 Å²	38	64.3 Å²	64.3	26%	0.257	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-81.9	143.2	-175.9	-54.4	0	0	0	0	112.3	F43 C48	C39-F43 HydrophobicContact CB-CB 4.16Å; C39-F43 WeakPolarHBondContact CB-O 3.48Å; C39-C48 WeakPolarHBondContact CA-SG 3.42Å; C39-C48 HydrophobicContact CB-CB 3.7Å; C39-C48 WeakPolarHBondContact CB-SG 3.24Å; C39-C48 WeakPolarHBondContact SG-CA 3.4Å; C39-C48 WeakPolarHBondContact SG-CB 3Å; C39-C48 CovalentContact SG-SG 2.04Å; C39-C48 PolarHBondContact SG-SG 2.73Å
40	P	87.2	Confident	86.6	Confident	47 Å²	47	64.5 Å²	64.5	31%	0.305	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-63.6	161.8	169.5	-11.1	26	0	0	0	110.6	N24 G42 F43	N24-P40 WeakPolarHBondContact O-CG 3.34Å; P40-G42 PolarHBondContact O-N 3.37Å; P40-F43 HydrophobicContact CB-CD2 4.16Å; P40-F43 HydrophobicContact CG-CD2 4.23Å; P40-F43 PolarHBondContact O-N 2.75Å; P40-F43 VanDerWaalsContact O-N 3.09Å
41	I	81.5	Confident	86	Confident	174 Å²	174	61.6 Å²	61.6	89%	0.892	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	133.5	172.8	-61.9	171.8	0	0	0	109
42	G	74.2	Confident	85.1	Confident	15 Å²	15	64.7 Å²	64.7	16%	0.155	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	-4.9	-177.6	0	0	0	0	0	114.8	P40 N51 R52	P40-G42 PolarHBondContact O-N 3.37Å; G42-N51 CarbonylContact O-C 3.56Å; G42-N51 PolarHBondContact O-OD1 3.05Å; G42-N51 VanDerWaalsContact O-OD1 3.06Å; G42-R52 WeakPolarHBondContact O-CB 3.43Å; G42-R52 PolarHBondContact O-N 3.28Å
43	F	83.6	Confident	83.9	Confident	21 Å²	21	63.7 Å²	63.7	9%	0.092	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150.4	176.4	-61.2	-83.8	0	0	0	112.6	N24 C39 P40 C48 I50 N51	N24-F43 HydrophobicContact CB-CD1 3.61Å; N24-F43 HydrophobicContact CB-CD2 4.24Å; N24-F43 HydrophobicContact CB-CE1 3.54Å; N24-F43 HydrophobicContact CB-CE2 4.18Å; N24-F43 HydrophobicContact CB-CG 3.97Å; N24-F43 HydrophobicContact CB-CZ 3.85Å; N24-F43 VanDerWaalsContact CG-CE1 3.45Å; C39-F43 HydrophobicContact CB-CB 4.16Å; C39-F43 WeakPolarHBondContact CB-O 3.48Å; P40-F43 HydrophobicContact CB-CD2 4.16Å; P40-F43 HydrophobicContact CG-CD2 4.23Å; P40-F43 PolarHBondContact O-N 2.75Å; P40-F43 VanDerWaalsContact O-N 3.09Å; F43-C48 HydrophobicContact CB-CB 4.35Å; F43-I50 CarbonylContact C-O 3.56Å; F43-I50 VanDerWaalsContact CA-O 3.24Å; F43-I50 WeakPolarHBondContact CA-O 2.91Å; F43-N51 HydrophobicContact CD1-CB 4.23Å; F43-N51 HydrophobicContact CE1-CB 4.07Å
44	E	84.2	Confident	82.8	Confident	56 Å²	56	60.4 Å²	60.4	26%	0.262	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	-176.2	176.2	64.9	-176	152.9	0	0	111.3	C48 E49 I50 R52	E44-C48 CarbonylContact O-C 3.31Å; E44-C48 VanDerWaalsContact O-CA 3.3Å; E44-C48 WeakPolarHBondContact O-CA 3.17Å; E44-E49 PolarHBondContact O-N 3.28Å; E44-I50 HydrophobicContact CG-CB 3.77Å; E44-I50 HydrophobicContact CG-CD1 4.5Å; E44-I50 HydrophobicContact CG-CG2 3.74Å; E44-I50 PolarHBondContact N-O 2.93Å; E44-I50 WeakPolarHBondContact O-CB 3.35Å; E44-I50 PolarHBondContact O-N 2.78Å; E44-R52 HydrophobicContact CB-CG 4.27Å; E44-R52 HydrophobicContact CG-CG 3.72Å; E44-R52 WeakPolarHBondContact OE1-CG 3.25Å; E44-R52 IonicContact OE1-NE 3.15Å; E44-R52 PolarHBondContact OE1-NE 3.09Å; E44-R52 IonicContact OE2-CZ 3.34Å; E44-R52 IonicContact OE2-NE 3.37Å; E44-R52 PolarHBondContact OE2-NE 3.27Å; E44-R52 IonicContact OE2-NH2 2.75Å; E44-R52 PolarHBondContact OE2-NH2 3.12Å
45	G	85.9	Confident	81.5	Confident	32 Å²	32	60.8 Å²	60.8	33%	0.33	31%	0.308	S	S	.	.	S	Bend	trans	95	166.8	-170.5	0	0	0	0	0	112.4	Y47 C48 E49	G45-Y47 PolarHBondContact O-N 2.8Å; G45-C48 PolarHBondContact O-N 2.75Å; G45-E49 WeakPolarHBondContact CA-OE2 3Å
46	R	88.7	Confident	80.3	Confident	131 Å²	131	64.4 Å²	64.4	49%	0.494	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-29.4	-176.7	179.4	174.4	-174.7	153.4	2.2	111.8	D34 C37 E49	D34-R46 IonicContact OD1-CZ 3.9Å; D34-R46 IonicContact OD1-NH2 2.68Å; D34-R46 PolarHBondContact OD1-NH2 3.03Å; D34-R46 IonicContact OD2-NH2 3.59Å; C37-R46 WeakPolarHBondContact CB-O 3.3Å; C37-R46 PolarHBondContact SG-O 2.9Å; C37-R46 VanDerWaalsContact SG-O 3.4Å; R46-E49 PolarHBondContact N-OE2 3.07Å
47	Y	90	Very high	79.1	Confident	88 Å²	88	67.7 Å²	67.7	35%	0.345	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	10.4	-176.5	-53.3	-86.3	0	0	0	111.6	K21 K23 F35 G45 E49	K21-Y47 HydrophobicContact CB-CD1 4.26Å; K21-Y47 HydrophobicContact CD-CE1 4.26Å; K21-Y47 WeakPolarHBondContact O-CD1 3.44Å; K23-Y47 PolarHBondContact N-O 3.34Å; F35-Y47 HydrophobicContact CE1-CE1 4.33Å; F35-Y47 AromaticContact CE2-CD1 3.99Å; F35-Y47 HydrophobicContact CE2-CD1 3.99Å; F35-Y47 AromaticContact CE2-CE1 3.9Å; F35-Y47 HydrophobicContact CE2-CE1 3.9Å; F35-Y47 AromaticContact CZ-CD1 3.88Å; F35-Y47 HydrophobicContact CZ-CD1 3.88Å; F35-Y47 AromaticContact CZ-CE1 3.3Å; F35-Y47 HydrophobicContact CZ-CE1 3.3Å; G45-Y47 PolarHBondContact O-N 2.8Å; Y47-E49 WeakPolarHBondContact CA-OE2 3.19Å; Y47-E49 VanDerWaalsContact CB-OE2 3.25Å; Y47-E49 WeakPolarHBondContact CB-OE2 3.47Å; Y47-E49 PolarHBondContact N-OE2 3.08Å; Y47-E49 PolarHBondContact O-N 3.04Å
48	C	89.7	Confident	78.2	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.353	C	S	.	.	S	Bend	trans	57	30.1	-171.7	-47.3	0	0	0	0	113.2	K23 N24 C37 C39 F43 E44 G45	K23-C48 WeakPolarHBondContact O-CB 3.43Å; N24-C48 PolarHBondContact ND2-O 2.92Å; C37-C48 WeakPolarHBondContact CB-SG 3.44Å; C39-C48 WeakPolarHBondContact CA-SG 3.42Å; C39-C48 HydrophobicContact CB-CB 3.7Å; C39-C48 WeakPolarHBondContact CB-SG 3.24Å; C39-C48 WeakPolarHBondContact SG-CA 3.4Å; C39-C48 WeakPolarHBondContact SG-CB 3Å; C39-C48 CovalentContact SG-SG 2.04Å; C39-C48 PolarHBondContact SG-SG 2.73Å; F43-C48 HydrophobicContact CB-CB 4.35Å; E44-C48 CarbonylContact O-C 3.31Å; E44-C48 VanDerWaalsContact O-CA 3.3Å; E44-C48 WeakPolarHBondContact O-CA 3.17Å; G45-C48 PolarHBondContact O-N 2.75Å
49	E	85.3	Confident	77.5	Confident	81 Å²	81	65.5 Å²	65.5	38%	0.379	34%	0.338	S	S	.	.			trans	-82.7	-20	-175.9	72.6	-78.3	-162.7	0	0	113.1	E44 G45 R46 Y47	E44-E49 PolarHBondContact O-N 3.28Å; G45-E49 WeakPolarHBondContact CA-OE2 3Å; R46-E49 PolarHBondContact N-OE2 3.07Å; Y47-E49 WeakPolarHBondContact CA-OE2 3.19Å; Y47-E49 VanDerWaalsContact CB-OE2 3.25Å; Y47-E49 WeakPolarHBondContact CB-OE2 3.47Å; Y47-E49 PolarHBondContact N-OE2 3.08Å; Y47-E49 PolarHBondContact O-N 3.04Å
50	I	78.6	Confident	77.1	Confident	66 Å²	66	68.6 Å²	68.6	34%	0.338	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125	-177.5	-54	175.6	0	0	0	108.4	F43 E44 R52	F43-I50 CarbonylContact C-O 3.56Å; F43-I50 VanDerWaalsContact CA-O 3.24Å; F43-I50 WeakPolarHBondContact CA-O 2.91Å; E44-I50 HydrophobicContact CG-CB 3.77Å; E44-I50 HydrophobicContact CG-CD1 4.5Å; E44-I50 HydrophobicContact CG-CG2 3.74Å; E44-I50 PolarHBondContact N-O 2.93Å; E44-I50 WeakPolarHBondContact O-CB 3.35Å; E44-I50 PolarHBondContact O-N 2.78Å; I50-R52 PolarHBondContact O-N 3.24Å
51	N	74.1	Confident	76.9	Confident	3 Å²	3	69.5 Å²	69.5	2%	0.016	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114	166.9	-163.6	-35.9	0	0	0	109.9	G42 F43 E53 C54 S55 E67 G71	G42-N51 CarbonylContact O-C 3.56Å; G42-N51 PolarHBondContact O-OD1 3.05Å; G42-N51 VanDerWaalsContact O-OD1 3.06Å; F43-N51 HydrophobicContact CD1-CB 4.23Å; F43-N51 HydrophobicContact CE1-CB 4.07Å; N51-E53 PolarHBondContact O-N 3.24Å; N51-E53 WeakPolarHBondContact OD1-CB 2.88Å; N51-E53 PolarHBondContact OD1-N 3.38Å; N51-C54 PolarHBondContact O-N 3.24Å; N51-S55 PolarHBondContact O-N 2.73Å; N51-S55 PolarHBondContact O-OG 2.93Å; N51-S55 VanDerWaalsContact O-OG 3.12Å; N51-E67 HydrophobicContact CB-CG 3.79Å; N51-E67 WeakPolarHBondContact CB-OE1 3.27Å; N51-E67 PolarHBondContact N-OE1 2.74Å; N51-G71 VanDerWaalsContact ND2-C 3.26Å; N51-G71 PolarHBondContact ND2-O 2.8Å
52	R	67	Low	77	Confident	140 Å²	140	70.7 Å²	70.7	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-57.4	-37.1	175.5	-104.7	-169.8	-179.5	-135.9	-8.2	111.7	G42 E44 I50 C54 S55 S56	G42-R52 WeakPolarHBondContact O-CB 3.43Å; G42-R52 PolarHBondContact O-N 3.28Å; E44-R52 HydrophobicContact CB-CG 4.27Å; E44-R52 HydrophobicContact CG-CG 3.72Å; E44-R52 WeakPolarHBondContact OE1-CG 3.25Å; E44-R52 IonicContact OE1-NE 3.15Å; E44-R52 PolarHBondContact OE1-NE 3.09Å; E44-R52 IonicContact OE2-CZ 3.34Å; E44-R52 IonicContact OE2-NE 3.37Å; E44-R52 PolarHBondContact OE2-NE 3.27Å; E44-R52 IonicContact OE2-NH2 2.75Å; E44-R52 PolarHBondContact OE2-NH2 3.12Å; I50-R52 PolarHBondContact O-N 3.24Å; R52-C54 VanDerWaalsContact C-N 3.3Å; R52-C54 PolarHBondContact O-N 3.29Å; R52-S55 PolarHBondContact O-N 3.41Å; R52-S56 PolarHBondContact O-N 3.49Å; R52-S56 PolarHBondContact O-OG 3.06Å
53	E	61.2	Low	77.3	Confident	76 Å²	76	70.7 Å²	70.7	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-66.3	-38.4	-172.1	-54.6	-157.6	122.6	0	0	110.2	N51 P58 Y72	N51-E53 PolarHBondContact O-N 3.24Å; N51-E53 WeakPolarHBondContact OD1-CB 2.88Å; N51-E53 PolarHBondContact OD1-N 3.38Å; E53-P58 WeakPolarHBondContact O-CD 3.33Å; E53-P58 WeakPolarHBondContact O-CG 3.05Å; E53-Y72 HydrophobicContact CB-CD1 3.11Å; E53-Y72 HydrophobicContact CB-CE1 3.54Å; E53-Y72 HydrophobicContact CB-CG 3.91Å; E53-Y72 HydrophobicContact CG-CD1 3.95Å; E53-Y72 HydrophobicContact CG-CE1 4.12Å; E53-Y72 WeakPolarHBondContact OE2-CD1 3.24Å; E53-Y72 VanDerWaalsContact OE2-CE1 3.31Å; E53-Y72 WeakPolarHBondContact OE2-CE1 3.31Å
54	C	59.4	Low	77.1	Confident	25 Å²	25	74.4 Å²	74.4	17%	0.169	37%	0.369	C	S	.	.	H	α-helix	trans	-74.3	-37.3	174	-119	0	0	0	0	113.3	N51 R52 S56 K57 G65 E67	N51-C54 PolarHBondContact O-N 3.24Å; R52-C54 VanDerWaalsContact C-N 3.3Å; R52-C54 PolarHBondContact O-N 3.29Å; C54-S56 PolarHBondContact O-N 2.76Å; C54-K57 PolarHBondContact O-N 3.34Å; C54-K57 VanDerWaalsContact O-N 3.08Å; C54-G65 VanDerWaalsContact SG-C 3.59Å; C54-E67 HydrophobicContact CB-CG 3.79Å
55	S	61.8	Low	77	Confident	72 Å²	72	73.4 Å²	73.4	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-63.5	-27.3	-179.5	-61.3	0	0	0	0	113.2	N51 R52 K57	N51-S55 PolarHBondContact O-N 2.73Å; N51-S55 PolarHBondContact O-OG 2.93Å; N51-S55 VanDerWaalsContact O-OG 3.12Å; R52-S55 PolarHBondContact O-N 3.41Å; S55-K57 PolarHBondContact O-N 3.15Å
56	S	63.5	Low	76.6	Confident	90 Å²	90	75.5 Å²	75.5	63%	0.629	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.2	177.2	-53.4	0	0	0	0	113.8	R52 C54	R52-S56 PolarHBondContact O-N 3.49Å; R52-S56 PolarHBondContact O-OG 3.06Å; C54-S56 PolarHBondContact O-N 2.76Å
57	K	67.9	Low	75.8	Confident	180 Å²	180	74.6 Å²	74.6	78%	0.783	38%	0.377	S	S	*	.			trans	46.5	57.3	-169.8	-61	-175.4	-179.6	-177.6	0	112.4	C54 S55 C59	C54-K57 PolarHBondContact O-N 3.34Å; C54-K57 VanDerWaalsContact O-N 3.08Å; S55-K57 PolarHBondContact O-N 3.15Å; K57-C59 PolarHBondContact O-N 3.28Å
58	P	73.7	Confident	74.9	Confident	23 Å²	23	74.6 Å²	74.6	15%	0.149	38%	0.382	C	S	.	.			trans	-65.6	-28	-176.6	29.7	-37	0	0	0	110.9	E53 Q60 Y72 N84	E53-P58 WeakPolarHBondContact O-CD 3.33Å; E53-P58 WeakPolarHBondContact O-CG 3.05Å; P58-Q60 PolarHBondContact O-N 3.18Å; P58-Q60 VanDerWaalsContact O-N 3.17Å; P58-Y72 HydrophobicContact CB-CD2 4.28Å; P58-Y72 HydrophobicContact CB-CE2 3.55Å; P58-Y72 HydrophobicContact CG-CD2 3.39Å; P58-Y72 HydrophobicContact CG-CE1 4.36Å; P58-Y72 HydrophobicContact CG-CE2 3.16Å; P58-Y72 HydrophobicContact CG-CG 4.07Å; P58-N84 VanDerWaalsContact O-CB 3.32Å; P58-N84 WeakPolarHBondContact O-CB 3.2Å
59	C	79.7	Confident	74	Confident	17 Å²	17	81.4 Å²	81.4	12%	0.115	42%	0.423	C	S	.	.			trans	-66.7	110.3	177.3	-45.7	0	0	0	0	111.4	K57 G63 G65 C74	K57-C59 PolarHBondContact O-N 3.28Å; C59-G63 WeakPolarHBondContact CB-O 3.44Å; C59-G65 WeakPolarHBondContact SG-CA 3.46Å; C59-C74 WeakPolarHBondContact CA-SG 3.29Å; C59-C74 HydrophobicContact CB-CB 3.73Å; C59-C74 WeakPolarHBondContact CB-SG 3.01Å; C59-C74 WeakPolarHBondContact SG-CA 3.3Å; C59-C74 WeakPolarHBondContact SG-CB 3.01Å; C59-C74 CovalentContact SG-SG 2.02Å; C59-C74 PolarHBondContact SG-SG 2.92Å
60	Q	82.4	Confident	73.1	Confident	104 Å²	104	80.3 Å²	80.3	49%	0.486	43%	0.434	S	S	.	.			trans	-82.2	176.2	174.5	-56.8	-170.2	25.7	0	0	110.9	P58 K62 G63 N84	P58-Q60 PolarHBondContact O-N 3.18Å; P58-Q60 VanDerWaalsContact O-N 3.17Å; Q60-K62 PolarHBondContact O-N 3.1Å; Q60-G63 PolarHBondContact O-N 2.95Å; Q60-N84 WeakPolarHBondContact CB-O 3.32Å; Q60-N84 PolarHBondContact N-O 2.79Å
61	N	82.4	Confident	72.6	Confident	66 Å²	66	77.5 Å²	77.5	35%	0.353	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	31	172.4	-63.9	-51.9	0	0	0	115	G63 P77 F80 C85	N61-G63 VanDerWaalsContact C-N 3.29Å; N61-P77 WeakPolarHBondContact O-CG 3.29Å; N61-F80 HydrophobicContact CB-CB 4.48Å; N61-F80 HydrophobicContact CB-CD1 3.45Å; N61-F80 VanDerWaalsContact CB-CD1 3.45Å; N61-F80 HydrophobicContact CB-CD2 4.06Å; N61-F80 HydrophobicContact CB-CE1 3.49Å; N61-F80 VanDerWaalsContact CB-CE1 3.49Å; N61-F80 HydrophobicContact CB-CE2 4.12Å; N61-F80 HydrophobicContact CB-CG 3.73Å; N61-F80 HydrophobicContact CB-CZ 3.85Å; N61-F80 VanDerWaalsContact ND2-CD1 3.27Å; N61-F80 WeakPolarHBondContact ND2-CD1 3.15Å; N61-F80 WeakPolarHBondContact ND2-CE1 3.08Å; N61-F80 WeakPolarHBondContact OD1-CE1 3.29Å; N61-C85 PolarHBondContact ND2-O 2.76Å
62	K	83.2	Confident	72.7	Confident	199 Å²	199	78.6 Å²	78.6	87%	0.865	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	25	-176.2	-48.6	176.7	179.3	179.3	0	114.1	Q60	Q60-K62 PolarHBondContact O-N 3.1Å
63	G	80.6	Confident	73.1	Confident	14 Å²	14	76.4 Å²	76.4	14%	0.144	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-58.7	141.5	167	0	0	0	0	0	111.9	C59 Q60 N61 E75	C59-G63 WeakPolarHBondContact CB-O 3.44Å; Q60-G63 PolarHBondContact O-N 2.95Å; N61-G63 VanDerWaalsContact C-N 3.29Å; G63-E75 CarbonylContact C-O 3.26Å; G63-E75 VanDerWaalsContact CA-O 3.24Å; G63-E75 WeakPolarHBondContact CA-O 3.3Å
64	I	80.5	Confident	74.1	Confident	99 Å²	99	73.3 Å²	73.3	51%	0.508	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	118.2	177.3	-61.8	170.1	0	0	0	107.4	H66 E75	I64-H66 PolarHBondContact O-CD2 2.74Å; I64-E75 HydrophobicContact CB-CB 4.34Å; I64-E75 PolarHBondContact N-O 2.96Å; I64-E75 PolarHBondContact O-N 3Å
65	G	81.5	Confident	75.2	Confident	36 Å²	36	77.1 Å²	77.1	37%	0.371	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129	175.2	0	0	0	0	0	111.1	C54 C59	C54-G65 VanDerWaalsContact SG-C 3.59Å; C59-G65 WeakPolarHBondContact SG-CA 3.46Å
66	H	76.6	Confident	75.9	Confident	76 Å²	76	75.5 Å²	75.5	35%	0.352	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.1	172.3	-61.5	-78.3	0	0	0	109	I64 Y72 L73 E75	I64-H66 PolarHBondContact O-CD2 2.74Å; H66-Y72 CarbonylContact O-C 3.56Å; H66-Y72 VanDerWaalsContact O-CA 3.29Å; H66-Y72 WeakPolarHBondContact O-CA 3.36Å; H66-L73 PolarHBondContact N-O 2.85Å; H66-L73 PolarHBondContact O-N 2.8Å; H66-E75 IonicContact CD2-OE2 3.86Å; H66-E75 IonicContact CE1-OE2 3.53Å; H66-E75 WeakPolarHBondContact NE2-CB 2.99Å; H66-E75 IonicContact NE2-OE2 2.76Å; H66-E75 PolarHBondContact NE2-OE2 3.21Å
67	E	71.5	Confident	76.5	Confident	112 Å²	112	73.4 Å²	73.4	52%	0.523	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135	168.6	-80.8	-177.1	162.5	0	0	110.2	N51 C54	N51-E67 HydrophobicContact CB-CG 3.79Å; N51-E67 WeakPolarHBondContact CB-OE1 3.27Å; N51-E67 PolarHBondContact N-OE1 2.74Å; C54-E67 HydrophobicContact CB-CG 3.79Å
68	I	72.1	Confident	76.7	Confident	87 Å²	87	72.8 Å²	72.8	45%	0.446	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	162.5	172.1	60.6	170.1	0	0	0	109.4	G70 G71 L73	I68-G70 PolarHBondContact O-N 3.17Å; I68-G71 VanDerWaalsContact CG1-C 3.44Å; I68-G71 VanDerWaalsContact CG1-O 3.3Å; I68-G71 WeakPolarHBondContact CG1-O 3.42Å; I68-G71 PolarHBondContact N-O 3.49Å; I68-G71 PolarHBondContact O-N 2.93Å; I68-G71 VanDerWaalsContact O-N 3.1Å; I68-L73 HydrophobicContact CD1-CB 4.44Å; I68-L73 HydrophobicContact CG2-CB 4.15Å
69	T	71	Confident	76.5	Confident	143 Å²	143	73.2 Å²	73.2	88%	0.877	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	110.5	177	-51.2	0	0	0	0	110
70	G	65.4	Low	76.1	Confident	58 Å²	58	75 Å²	75	60%	0.598	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	10.2	179.2	0	0	0	0	0	116.1	I68	I68-G70 PolarHBondContact O-N 3.17Å
71	G	69.9	Low	75.5	Confident	7 Å²	7	73.5 Å²	73.5	7%	0.072	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.5	-157.2	179.2	0	0	0	0	0	113.9	N51 I68	N51-G71 VanDerWaalsContact ND2-C 3.26Å; N51-G71 PolarHBondContact ND2-O 2.8Å; I68-G71 VanDerWaalsContact CG1-C 3.44Å; I68-G71 VanDerWaalsContact CG1-O 3.3Å; I68-G71 WeakPolarHBondContact CG1-O 3.42Å; I68-G71 PolarHBondContact N-O 3.49Å; I68-G71 PolarHBondContact O-N 2.93Å; I68-G71 VanDerWaalsContact O-N 3.1Å
72	Y	74.3	Confident	75	Confident	27 Å²	27	71.9 Å²	71.9	11%	0.106	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	159.6	176.4	69.7	-69.5	0	0	0	110.6	E53 P58 H66 N84	E53-Y72 HydrophobicContact CB-CD1 3.11Å; E53-Y72 HydrophobicContact CB-CE1 3.54Å; E53-Y72 HydrophobicContact CB-CG 3.91Å; E53-Y72 HydrophobicContact CG-CD1 3.95Å; E53-Y72 HydrophobicContact CG-CE1 4.12Å; E53-Y72 WeakPolarHBondContact OE2-CD1 3.24Å; E53-Y72 VanDerWaalsContact OE2-CE1 3.31Å; E53-Y72 WeakPolarHBondContact OE2-CE1 3.31Å; P58-Y72 HydrophobicContact CB-CD2 4.28Å; P58-Y72 HydrophobicContact CB-CE2 3.55Å; P58-Y72 HydrophobicContact CG-CD2 3.39Å; P58-Y72 HydrophobicContact CG-CE1 4.36Å; P58-Y72 HydrophobicContact CG-CE2 3.16Å; P58-Y72 HydrophobicContact CG-CG 4.07Å; H66-Y72 CarbonylContact O-C 3.56Å; H66-Y72 VanDerWaalsContact O-CA 3.29Å; H66-Y72 WeakPolarHBondContact O-CA 3.36Å; Y72-N84 WeakPolarHBondContact CE2-OD1 3.01Å; Y72-N84 PolarHBondContact OH-OD1 2.87Å
73	L	76.7	Confident	74.7	Confident	93 Å²	93	68.9 Å²	68.9	49%	0.487	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.7	170.4	-179.5	67.2	0	0	0	108.5	H66 I68	H66-L73 PolarHBondContact N-O 2.85Å; H66-L73 PolarHBondContact O-N 2.8Å; I68-L73 HydrophobicContact CD1-CB 4.44Å; I68-L73 HydrophobicContact CG2-CB 4.15Å
74	C	81.4	Confident	74.8	Confident	11 Å²	11	69.9 Å²	69.9	7%	0.074	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.1	170.6	-65	0	0	0	0	110.6	C59 C76 Q83 C85	C59-C74 WeakPolarHBondContact CA-SG 3.29Å; C59-C74 HydrophobicContact CB-CB 3.73Å; C59-C74 WeakPolarHBondContact CB-SG 3.01Å; C59-C74 WeakPolarHBondContact SG-CA 3.3Å; C59-C74 WeakPolarHBondContact SG-CB 3.01Å; C59-C74 CovalentContact SG-SG 2.02Å; C59-C74 PolarHBondContact SG-SG 2.92Å; C74-C76 PolarHBondContact O-N 3.33Å; C74-Q83 WeakPolarHBondContact CB-O 3.41Å; C74-Q83 PolarHBondContact SG-O 3.15Å; C74-C85 VanDerWaalsContact CB-SG 3.56Å
75	E	82.8	Confident	74.8	Confident	105 Å²	105	65.2 Å²	65.2	49%	0.491	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	107.6	165.2	-176.7	-178.7	178.4	0	0	108.6	G63 I64 H66	G63-E75 CarbonylContact C-O 3.26Å; G63-E75 VanDerWaalsContact CA-O 3.24Å; G63-E75 WeakPolarHBondContact CA-O 3.3Å; I64-E75 HydrophobicContact CB-CB 4.34Å; I64-E75 PolarHBondContact N-O 2.96Å; I64-E75 PolarHBondContact O-N 3Å; H66-E75 IonicContact CD2-OE2 3.86Å; H66-E75 IonicContact CE1-OE2 3.53Å; H66-E75 WeakPolarHBondContact NE2-CB 2.99Å; H66-E75 IonicContact NE2-OE2 2.76Å; H66-E75 PolarHBondContact NE2-OE2 3.21Å
76	C	77.1	Confident	74.7	Confident	38 Å²	38	67 Å²	67	26%	0.257	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-83.9	135.3	-175.4	-56.7	0	0	0	0	112.1	C74 F80 C85	C74-C76 PolarHBondContact O-N 3.33Å; C76-F80 HydrophobicContact CB-CB 4.39Å; C76-F80 VanDerWaalsContact CB-O 3.31Å; C76-F80 WeakPolarHBondContact CB-O 3.33Å; C76-C85 WeakPolarHBondContact CA-SG 3.1Å; C76-C85 HydrophobicContact CB-CB 3.69Å; C76-C85 WeakPolarHBondContact CB-SG 3.49Å; C76-C85 WeakPolarHBondContact SG-CA 3.38Å; C76-C85 WeakPolarHBondContact SG-CB 3.42Å; C76-C85 CovalentContact SG-SG 2.03Å; C76-C85 PolarHBondContact SG-SG 3.39Å
77	P	76.2	Confident	74.6	Confident	46 Å²	46	67.9 Å²	67.9	30%	0.299	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-66.1	156.6	171	21.8	-25.4	0	0	0	110.8	N61 G79 F80	N61-P77 WeakPolarHBondContact O-CG 3.29Å; P77-G79 PolarHBondContact O-N 2.03Å; P77-F80 HydrophobicContact CG-CD2 4Å; P77-F80 PolarHBondContact O-N 2.02Å; P77-F80 VanDerWaalsContact O-N 3.12Å
78	N	72.5	Confident	74.4	Confident	168 Å²	168	67.2 Å²	67.2	90%	0.898	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	129.3	-179.8	-77.7	-27.4	0	0	0	111.8
79	G	67.9	Low	73.9	Confident	31 Å²	31	66 Å²	66	32%	0.32	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	2.4	-179	0	0	0	0	0	114.9	P77 T88 I89	P77-G79 PolarHBondContact O-N 2.03Å; G79-T88 CarbonylContact O-C 3.43Å; G79-T88 WeakPolarHBondContact O-CA 3.39Å; G79-I89 PolarHBondContact O-N 3.12Å
80	F	71.3	Confident	73.1	Confident	56 Å²	56	63.1 Å²	63.1	25%	0.246	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	144.5	175.8	-58.5	-88.8	0	0	0	112.1	N61 C76 P77 C85 L87 T88	N61-F80 HydrophobicContact CB-CB 4.48Å; N61-F80 HydrophobicContact CB-CD1 3.45Å; N61-F80 VanDerWaalsContact CB-CD1 3.45Å; N61-F80 HydrophobicContact CB-CD2 4.06Å; N61-F80 HydrophobicContact CB-CE1 3.49Å; N61-F80 VanDerWaalsContact CB-CE1 3.49Å; N61-F80 HydrophobicContact CB-CE2 4.12Å; N61-F80 HydrophobicContact CB-CG 3.73Å; N61-F80 HydrophobicContact CB-CZ 3.85Å; N61-F80 VanDerWaalsContact ND2-CD1 3.27Å; N61-F80 WeakPolarHBondContact ND2-CD1 3.15Å; N61-F80 WeakPolarHBondContact ND2-CE1 3.08Å; N61-F80 WeakPolarHBondContact OD1-CE1 3.29Å; C76-F80 HydrophobicContact CB-CB 4.39Å; C76-F80 VanDerWaalsContact CB-O 3.31Å; C76-F80 WeakPolarHBondContact CB-O 3.33Å; P77-F80 HydrophobicContact CG-CD2 4Å; P77-F80 PolarHBondContact O-N 2.02Å; P77-F80 VanDerWaalsContact O-N 3.12Å; F80-C85 HydrophobicContact CB-CB 4.22Å; F80-L87 CarbonylContact C-O 3.55Å; F80-L87 WeakPolarHBondContact CA-O 3.31Å; F80-T88 HydrophobicContact CD1-CG2 3.55Å; F80-T88 HydrophobicContact CE1-CG2 3.23Å; F80-T88 HydrophobicContact CZ-CG2 4.04Å
81	I	69.9	Low	72.2	Confident	71 Å²	71	65.9 Å²	65.9	36%	0.364	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	180	178.7	64.5	177.8	0	0	0	110.5	C85 E86 L87 I89	I81-C85 CarbonylContact O-C 3.56Å; I81-C85 VanDerWaalsContact O-C 3.26Å; I81-C85 VanDerWaalsContact O-CA 3.29Å; I81-C85 WeakPolarHBondContact O-CA 3.46Å; I81-E86 PolarHBondContact O-N 3.21Å; I81-L87 HydrophobicContact CG1-CB 3.69Å; I81-L87 HydrophobicContact CG1-CD1 4.25Å; I81-L87 PolarHBondContact N-O 3.08Å; I81-L87 WeakPolarHBondContact O-CB 3.18Å; I81-L87 PolarHBondContact O-N 3.44Å; I81-I89 HydrophobicContact CB-CG1 4.43Å; I81-I89 HydrophobicContact CD1-CG1 4.46Å; I81-I89 HydrophobicContact CG1-CG1 4.33Å; I81-I89 HydrophobicContact CG2-CD1 3.66Å; I81-I89 HydrophobicContact CG2-CG1 3.51Å
82	G	72.5	Confident	71	Confident	33 Å²	33	69.2 Å²	69.2	34%	0.34	38%	0.382	S	S	.	.	S	Bend	trans	101.1	166.4	-173.7	0	0	0	0	0	111.1	N84 C85 E86	G82-N84 PolarHBondContact O-N 3.45Å; G82-C85 PolarHBondContact O-N 2.8Å; G82-E86 WeakPolarHBondContact CA-OE2 3.4Å
83	Q	77.4	Confident	69.5	Low	135 Å²	135	75.8 Å²	75.8	63%	0.631	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.8	-179.5	-178.7	179.3	0.5	0	0	111.4	C74 E86	C74-Q83 WeakPolarHBondContact CB-O 3.41Å; C74-Q83 PolarHBondContact SG-O 3.15Å; Q83-E86 PolarHBondContact N-OE2 2.78Å
84	N	82	Confident	68	Low	36 Å²	36	75.2 Å²	75.2	19%	0.193	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	16.5	-174.2	-70.5	-22.3	0	0	0	112.1	P58 Q60 Y72 G82 E86	P58-N84 VanDerWaalsContact O-CB 3.32Å; P58-N84 WeakPolarHBondContact O-CB 3.2Å; Q60-N84 WeakPolarHBondContact CB-O 3.32Å; Q60-N84 PolarHBondContact N-O 2.79Å; Y72-N84 WeakPolarHBondContact CE2-OD1 3.01Å; Y72-N84 PolarHBondContact OH-OD1 2.87Å; G82-N84 PolarHBondContact O-N 3.45Å; N84-E86 WeakPolarHBondContact CA-OE2 3Å; N84-E86 HydrophobicContact CB-CB 4.48Å; N84-E86 VanDerWaalsContact CB-OE2 3.3Å; N84-E86 WeakPolarHBondContact CB-OE2 3.21Å; N84-E86 PolarHBondContact N-OE2 2.76Å; N84-E86 PolarHBondContact O-N 2.76Å; N84-E86 VanDerWaalsContact O-N 3.15Å
85	C	81.3	Confident	66.3	Low	0 Å²	0	79 Å²	79	0%	0	44%	0.442	C	S	.	.	S	Bend	trans	56.1	27	-174.2	-44	0	0	0	0	113.3	N61 C74 C76 F80 I81 G82	N61-C85 PolarHBondContact ND2-O 2.76Å; C74-C85 VanDerWaalsContact CB-SG 3.56Å; C76-C85 WeakPolarHBondContact CA-SG 3.1Å; C76-C85 HydrophobicContact CB-CB 3.69Å; C76-C85 WeakPolarHBondContact CB-SG 3.49Å; C76-C85 WeakPolarHBondContact SG-CA 3.38Å; C76-C85 WeakPolarHBondContact SG-CB 3.42Å; C76-C85 CovalentContact SG-SG 2.03Å; C76-C85 PolarHBondContact SG-SG 3.39Å; F80-C85 HydrophobicContact CB-CB 4.22Å; I81-C85 CarbonylContact O-C 3.56Å; I81-C85 VanDerWaalsContact O-C 3.26Å; I81-C85 VanDerWaalsContact O-CA 3.29Å; I81-C85 WeakPolarHBondContact O-CA 3.46Å; G82-C85 PolarHBondContact O-N 2.8Å
86	E	79.8	Confident	64.3	Low	75 Å²	75	78.9 Å²	78.9	35%	0.35	45%	0.45	S	S	.	.			trans	-79.6	-20.8	-172.9	72.1	-77.3	-171.6	0	0	113.1	I81 G82 Q83 N84	I81-E86 PolarHBondContact O-N 3.21Å; G82-E86 WeakPolarHBondContact CA-OE2 3.4Å; Q83-E86 PolarHBondContact N-OE2 2.78Å; N84-E86 WeakPolarHBondContact CA-OE2 3Å; N84-E86 HydrophobicContact CB-CB 4.48Å; N84-E86 VanDerWaalsContact CB-OE2 3.3Å; N84-E86 WeakPolarHBondContact CB-OE2 3.21Å; N84-E86 PolarHBondContact N-OE2 2.76Å; N84-E86 PolarHBondContact O-N 2.76Å; N84-E86 VanDerWaalsContact O-N 3.15Å
87	L	72.6	Confident	62.6	Low	93 Å²	93	87.8 Å²	87.8	49%	0.487	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135	-179.4	-55.1	176.7	0	0	0	109.7	F80 I81	F80-L87 CarbonylContact C-O 3.55Å; F80-L87 WeakPolarHBondContact CA-O 3.31Å; I81-L87 HydrophobicContact CG1-CB 3.69Å; I81-L87 HydrophobicContact CG1-CD1 4.25Å; I81-L87 PolarHBondContact N-O 3.08Å; I81-L87 WeakPolarHBondContact O-CB 3.18Å; I81-L87 PolarHBondContact O-N 3.44Å
88	T	68	Low	61	Low	99 Å²	99	93.2 Å²	93.2	61%	0.607	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	135.9	166	27.8	0	0	0	0	110.4	G79 F80 D90	G79-T88 CarbonylContact O-C 3.43Å; G79-T88 WeakPolarHBondContact O-CA 3.39Å; F80-T88 HydrophobicContact CD1-CG2 3.55Å; F80-T88 HydrophobicContact CE1-CG2 3.23Å; F80-T88 HydrophobicContact CZ-CG2 4.04Å; T88-D90 PolarHBondContact O-N 3.28Å; T88-D90 VanDerWaalsContact O-N 3.08Å
89	I	61.7	Low	59.6	Low	60 Å²	60	90.5 Å²	90.5	31%	0.308	49%	0.486	S	S	.	.			trans	-68.9	103.9	167.8	-56.9	174.3	0	0	0	107.3	G79 I81 L91	G79-I89 PolarHBondContact O-N 3.12Å; I81-I89 HydrophobicContact CB-CG1 4.43Å; I81-I89 HydrophobicContact CD1-CG1 4.46Å; I81-I89 HydrophobicContact CG1-CG1 4.33Å; I81-I89 HydrophobicContact CG2-CD1 3.66Å; I81-I89 HydrophobicContact CG2-CG1 3.51Å; I89-L91 VanDerWaalsContact C-N 3.32Å; I89-L91 HydrophobicContact CG2-CD2 3.56Å; I89-L91 HydrophobicContact CG2-CG 3.73Å; I89-L91 PolarHBondContact O-N 3.12Å; I89-L91 VanDerWaalsContact O-N 3.12Å
90	D	53.6	Low	58.7	Low	84 Å²	84	92.2 Å²	92.2	45%	0.449	50%	0.503	S	S	.	.			trans	-79.6	89.1	162.2	-164.5	-10.7	0	0	0	108.2	T88 C92 Q93	T88-D90 PolarHBondContact O-N 3.28Å; T88-D90 VanDerWaalsContact O-N 3.08Å; D90-C92 PolarHBondContact O-N 2.91Å; D90-C92 VanDerWaalsContact OD1-CB 3.24Å; D90-C92 WeakPolarHBondContact OD1-CB 3.24Å; D90-C92 PolarHBondContact OD1-N 3.04Å; D90-Q93 HydrophobicContact CB-CB 4.32Å; D90-Q93 HydrophobicContact CB-CG 4.35Å; D90-Q93 PolarHBondContact O-N 2.96Å
91	L	47.6	Very low	57.6	Low	116 Å²	116	93.6 Å²	93.6	61%	0.607	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-11.7	174.7	-70.6	171.7	0	0	0	112.3	I89	I89-L91 VanDerWaalsContact C-N 3.32Å; I89-L91 HydrophobicContact CG2-CD2 3.56Å; I89-L91 HydrophobicContact CG2-CG 3.73Å; I89-L91 PolarHBondContact O-N 3.12Å; I89-L91 VanDerWaalsContact O-N 3.12Å
92	C	43.8	Very low	56.9	Low	76 Å²	76	96.2 Å²	96.2	51%	0.514	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-19.2	172.5	-65.1	0	0	0	0	114.3	D90	D90-C92 PolarHBondContact O-N 2.91Å; D90-C92 VanDerWaalsContact OD1-CB 3.24Å; D90-C92 WeakPolarHBondContact OD1-CB 3.24Å; D90-C92 PolarHBondContact OD1-N 3.04Å
93	Q	43	Very low	55.9	Low	165 Å²	165	96.9 Å²	96.9	77%	0.771	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-28.8	-177.8	-76.5	-161.3	-28.5	0	0	114	D90 N95	D90-Q93 HydrophobicContact CB-CB 4.32Å; D90-Q93 HydrophobicContact CB-CG 4.35Å; D90-Q93 PolarHBondContact O-N 2.96Å; Q93-N95 VanDerWaalsContact C-N 3.33Å
94	A	46.5	Very low	54.6	Low	81 Å²	81	95.3 Å²	95.3	67%	0.669	51%	0.508	S	S	*	.	S	Bend	trans	-75.6	-22.6	176.7	0	0	0	0	0	113
95	N	44.8	Very low	53.1	Low	91 Å²	91	97.7 Å²	97.7	49%	0.487	52%	0.518	S	S	.	.	S	Bend	trans	-150	115.1	168.8	-112.9	-14.3	0	0	0	110	Q93 R97	Q93-N95 VanDerWaalsContact C-N 3.33Å; N95-R97 PolarHBondContact O-N 3.41Å
96	P	40.6	Very low	51.5	Low	102 Å²	102	100.1 Å²	100.1	66%	0.662	53%	0.533	S	S	*	.			trans	-67.3	106.5	177.4	27.7	-30.7	0	0	0	108.4	Q98	P96-Q98 PolarHBondContact O-N 3.16Å
97	R	41.9	Very low	49.9	Very low	225 Å²	225	104.6 Å²	104.6	85%	0.849	56%	0.558	S	S	*	*	S	Bend	trans	10	84.5	165.5	-60.1	-167.5	-157.3	-152.5	5.7	115	N95	N95-R97 PolarHBondContact O-N 3.41Å
98	Q	42.3	Very low	48.5	Very low	161 Å²	161	108.4 Å²	108.4	75%	0.752	57%	0.568	S	S	*	*			trans	-135.1	109.8	157.1	-69.3	-165	-20.3	0	0	109.2	P96	P96-Q98 PolarHBondContact O-N 3.16Å
99	N	42.6	Very low	47.5	Very low	111 Å²	111	109.4 Å²	109.4	59%	0.594	58%	0.576	S	S	*	*	S	Bend	trans	71.3	37.6	155	-61.4	-3.1	0	0	0	121	E101	N99-E101 PolarHBondContact O-N 3.4Å
100	G	49.2	Very low	47	Very low	67 Å²	67	110.1 Å²	110.1	69%	0.691	60%	0.598	S	S	*	*	S	Bend	trans	77.4	23.4	155.3	0	0	0	0	0	116.4
101	E	48.1	Very low	47	Very low	84 Å²	84	110.4 Å²	110.4	39%	0.393	60%	0.599	S	S	.	*			trans	-76.7	150.3	171.9	-56.9	-176.8	154.8	0	0	111.5	N99 C116	N99-E101 PolarHBondContact O-N 3.4Å; E101-C116 PolarHBondContact OE1-SG 3.45Å
102	Y	55	Low	47.3	Very low	127 Å²	127	109.7 Å²	109.7	50%	0.498	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.6	133.7	170.5	66.7	-81.8	0	0	0	109.7	Q104 H115	Y102-Q104 HydrophobicContact CD2-CG 3.73Å; Y102-Q104 HydrophobicContact CE2-CG 3.7Å; Y102-H115 HydrophobicContact CE1-CB 4.15Å; Y102-H115 HydrophobicContact CE2-CB 4.1Å; Y102-H115 PolarHBondContact N-O 3.42Å; Y102-H115 PolarHBondContact O-N 3.19Å
103	C	51.5	Low	47.7	Very low	47 Å²	47	111.1 Å²	111.1	32%	0.318	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	130.6	176.6	-52.2	0	0	0	0	110.1	I112 Q113 C114	C103-I112 HydrophobicContact CB-CG2 3.7Å; C103-Q113 WeakPolarHBondContact CA-O 3.5Å; C103-C114 HydrophobicContact CB-CB 4.09Å; C103-C114 WeakPolarHBondContact CB-SG 3.46Å; C103-C114 WeakPolarHBondContact SG-CB 3.48Å; C103-C114 CovalentContact SG-SG 2.06Å; C103-C114 PolarHBondContact SG-SG 3.3Å
104	Q	50.5	Low	48.2	Very low	101 Å²	101	106.1 Å²	106.1	47%	0.472	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.9	135.7	174.8	-66.5	-173	-47.3	0	0	108.7	Y102 Q113	Y102-Q104 HydrophobicContact CD2-CG 3.73Å; Y102-Q104 HydrophobicContact CE2-CG 3.7Å; Q104-Q113 PolarHBondContact N-O 3.45Å; Q104-Q113 PolarHBondContact O-N 2.84Å
105	H	51.9	Low	48.7	Very low	87 Å²	87	105.7 Å²	105.7	40%	0.403	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	142.5	174.5	-137.4	-87.2	0	0	0	109.9	Y108 D111 I112	H105-Y108 PolarHBondContact CE1-O 2.99Å; H105-Y108 PolarHBondContact ND1-O 2.86Å; H105-D111 PolarHBondContact CE1-O 3.41Å; H105-D111 PolarHBondContact ND1-O 2.97Å; H105-I112 VanDerWaalsContact CD2-CG1 3.48Å; H105-I112 WeakPolarHBondContact CD2-CG1 3.16Å; H105-I112 WeakPolarHBondContact NE2-CG1 3.13Å
106	T	47	Very low	48.6	Very low	51 Å²	51	103.8 Å²	103.8	31%	0.313	55%	0.554	S	S	.	*			trans	-90.2	169.9	164.7	61.8	0	0	0	0	109.6	Y108 D111	T106-Y108 PolarHBondContact O-N 3.02Å; T106-D111 PolarHBondContact N-O 2.91Å
107	L	45.7	Very low	48.8	Very low	169 Å²	169	101.3 Å²	101.3	89%	0.885	54%	0.538	S	S	*	.	S	Bend	trans	-62.3	3.4	-172.7	-68.9	167.3	0	0	0	115.4
108	Y	43.3	Very low	48.7	Very low	173 Å²	173	99.5 Å²	99.5	68%	0.678	54%	0.544	S	S	*	.	S	Bend	trans	-113.5	134.1	-179.5	-67.6	-76.3	0	0	0	112	H105 T106 G110 D111	H105-Y108 PolarHBondContact CE1-O 2.99Å; H105-Y108 PolarHBondContact ND1-O 2.86Å; T106-Y108 PolarHBondContact O-N 3.02Å; Y108-G110 PolarHBondContact O-N 2.06Å; Y108-D111 PolarHBondContact O-N 3.33Å
109	P	48.1	Very low	48.6	Very low	120 Å²	120	95.7 Å²	95.7	78%	0.779	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	123.8	177.1	22.1	-27.5	0	0	0	110.7
110	G	51.1	Low	48.4	Very low	75 Å²	75	98.2 Å²	98.2	77%	0.773	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.8	-7.5	178.8	0	0	0	0	0	116.1	Y108	Y108-G110 PolarHBondContact O-N 2.06Å
111	D	52.5	Low	47.9	Very low	89 Å²	89	101 Å²	101	48%	0.476	56%	0.558	S	S	.	*			trans	-107.3	98.1	-176.9	-151.8	19.9	0	0	0	111.5	H105 T106 Y108	H105-D111 PolarHBondContact CE1-O 3.41Å; H105-D111 PolarHBondContact ND1-O 2.97Å; T106-D111 PolarHBondContact N-O 2.91Å; Y108-D111 PolarHBondContact O-N 3.33Å
112	I	54.2	Low	47.6	Very low	102 Å²	102	100.3 Å²	100.3	52%	0.523	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.5	116.1	178.4	-62.6	169.9	0	0	0	108.3	C103 H105	C103-I112 HydrophobicContact CB-CG2 3.7Å; H105-I112 VanDerWaalsContact CD2-CG1 3.48Å; H105-I112 WeakPolarHBondContact CD2-CG1 3.16Å; H105-I112 WeakPolarHBondContact NE2-CG1 3.13Å
113	Q	51.6	Low	46.8	Very low	106 Å²	106	109.6 Å²	109.6	50%	0.495	61%	0.607	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.7	113.9	168.9	-80.4	-159	-51.6	0	0	111	C103 Q104	C103-Q113 WeakPolarHBondContact CA-O 3.5Å; Q104-Q113 PolarHBondContact N-O 3.45Å; Q104-Q113 PolarHBondContact O-N 2.84Å
114	C	55	Low	46.6	Very low	60 Å²	60	112.8 Å²	112.8	41%	0.405	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.9	124.8	172.3	-61.8	0	0	0	0	110.9	C103	C103-C114 HydrophobicContact CB-CB 4.09Å; C103-C114 WeakPolarHBondContact CB-SG 3.46Å; C103-C114 WeakPolarHBondContact SG-CB 3.48Å; C103-C114 CovalentContact SG-SG 2.06Å; C103-C114 PolarHBondContact SG-SG 3.3Å
115	H	55.1	Low	46.4	Very low	71 Å²	71	113.4 Å²	113.4	33%	0.329	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.2	119.4	177.5	-72.6	81.2	0	0	0	109.8	Y102	Y102-H115 HydrophobicContact CE1-CB 4.15Å; Y102-H115 HydrophobicContact CE2-CB 4.1Å; Y102-H115 PolarHBondContact N-O 3.42Å; Y102-H115 PolarHBondContact O-N 3.19Å
116	C	44.1	Very low	46.1	Very low	52 Å²	52	114.8 Å²	114.8	35%	0.351	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-79.5	142.5	171.9	-51.9	0	0	0	0	110.1	E101 W120	E101-C116 PolarHBondContact OE1-SG 3.45Å; C116-W120 HydrophobicContact CB-CB 4.29Å
117	P	44.7	Very low	46	Very low	50 Å²	50	118.6 Å²	118.6	33%	0.325	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-64	145.4	171.3	23.8	-29.7	0	0	0	111.5	G119 W120	P117-G119 PolarHBondContact O-N 3.21Å; P117-G119 VanDerWaalsContact O-N 3.11Å; P117-W120 PolarHBondContact O-N 3.11Å
118	L	39.2	Very low	46	Very low	187 Å²	187	115.4 Å²	115.4	98%	0.979	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.6	114.7	-178.3	-82.9	157.8	0	0	0	111.8
119	G	39.4	Very low	46.2	Very low	80 Å²	80	111.6 Å²	111.6	83%	0.825	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.2	-6.3	179	0	0	0	0	0	115.2	P117	P117-G119 PolarHBondContact O-N 3.21Å; P117-G119 VanDerWaalsContact O-N 3.11Å
120	W	38.8	Very low	46.1	Very low	165 Å²	165	111 Å²	111	63%	0.625	64%	0.636	S	S	*	*			trans	-110.9	123.3	174.6	-65.6	79.8	0	0	0	110.2	C116 P117	C116-W120 HydrophobicContact CB-CB 4.29Å; P117-W120 PolarHBondContact O-N 3.11Å
121	S	40.1	Very low	45.7	Very low	126 Å²	126	113.8 Å²	113.8	88%	0.881	63%	0.626	S	S	*	*			trans	-116.8	126.3	167.1	57.2	0	0	0	0	109.1
122	G	41.9	Very low	45.1	Very low	68 Å²	68	115.8 Å²	115.8	70%	0.701	64%	0.638	S	S	*	*			trans	-143.2	90.2	179.9	0	0	0	0	0	110.7
123	R	37.5	Very low	44.3	Very low	323 Å²	323	117.1 Å²	117.1	100%	1.219	65%	0.649	S	S	*	*			trans	30.2	0	165.5	-153.5	176.9	-127.7	166.6	1.2	121.2

Retrieved 123 of 123 residues in 67.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).