A0A077YUY4_TRITR Loading...

HEGF and EGF domain containing protein

AlphaFold DB , UniProt , Accession A0A077YUY4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 80 aa.

						>A0A077YUY4_TRITR|A0A077YUY4
MGDCSSESCKHGTCHWVRVRSWCHCEEGFTGVDCSTDINECLSSPCLNGGTCVDEKAKFTCICPKDYWGIRCEKRMQIRA
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	75.7	Confident	239 Å²	239	90.7 Å²	90.7	100%	1.177	52%	0.517	S	S	*	.				0	111.2	0	-75.5	171.1	140.5	0	0	107
2	G	62.6	Low	77.2	Confident	44 Å²	44	84.6 Å²	84.6	45%	0.454	49%	0.488	S	S	.	.			trans	58	86.9	179.4	0	0	0	0	0	113.8	W16	G2-W16 VanDerWaalsContact O-CD1 3.23Å; G2-W16 PolarHBondContact O-NE1 2.8Å
3	D	73.3	Confident	78.4	Confident	129 Å²	129	84.6 Å²	84.6	69%	0.69	49%	0.491	S	S	*	.			trans	-125.4	160.9	162	-166.8	0.7	0	0	0	106.2	S5	D3-S5 PolarHBondContact O-N 3.11Å
4	C	79.2	Confident	79.3	Confident	40 Å²	40	80.8 Å²	80.8	27%	0.27	47%	0.471	S	S	.	.			trans	-63.6	88	167	-75.9	0	0	0	0	108.8	C14	C4-C14 WeakPolarHBondContact CA-SG 3.3Å; C4-C14 HydrophobicContact CB-CB 3.54Å; C4-C14 WeakPolarHBondContact CB-SG 3.49Å; C4-C14 WeakPolarHBondContact SG-CB 3.19Å; C4-C14 PolarHBondContact SG-O 2.78Å; C4-C14 CovalentContact SG-SG 2.03Å; C4-C14 PolarHBondContact SG-SG 3.04Å
5	S	72	Confident	80.1	Confident	70 Å²	70	79.6 Å²	79.6	49%	0.49	46%	0.459	S	S	.	.			trans	-65.4	137.6	169.3	63.2	0	0	0	0	107.9	D3 E7 S8	D3-S5 PolarHBondContact O-N 3.11Å; S5-E7 PolarHBondContact O-N 3.1Å; S5-S8 WeakPolarHBondContact O-CB 3.47Å; S5-S8 PolarHBondContact O-N 3.49Å; S5-S8 PolarHBondContact O-OG 3.23Å; S5-S8 PolarHBondContact OG-OG 3.05Å
6	S	67.1	Low	80.5	Confident	119 Å²	119	82.1 Å²	82.1	83%	0.832	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-14.7	-169.4	54.5	0	0	0	0	115.4
7	E	70.8	Confident	80.7	Confident	134 Å²	134	82.1 Å²	82.1	63%	0.626	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-0.5	-175.7	-72.6	-81.6	120.9	0	0	113.5	S5 K10	S5-E7 PolarHBondContact O-N 3.1Å; E7-K10 IonicContact OE1-NZ 2.84Å; E7-K10 IonicContact OE2-NZ 2.71Å; E7-K10 PolarHBondContact OE2-NZ 2.95Å
8	S	81.9	Confident	80.6	Confident	43 Å²	43	90.2 Å²	90.2	30%	0.301	48%	0.483	S	S	.	.	S	Bend	trans	-72.8	-29.7	-172.5	-72.6	0	0	0	0	114.5	S5 D33	S5-S8 WeakPolarHBondContact O-CB 3.47Å; S5-S8 PolarHBondContact O-N 3.49Å; S5-S8 PolarHBondContact O-OG 3.23Å; S5-S8 PolarHBondContact OG-OG 3.05Å; S8-D33 WeakPolarHBondContact O-CA 3.4Å; S8-D33 WeakPolarHBondContact O-CB 3.46Å
9	C	92	Very high	80.6	Confident	20 Å²	20	92.4 Å²	92.4	14%	0.135	50%	0.5	C	S	.	.			trans	-121	117.6	178.3	-50.2	0	0	0	0	108.4	G12 C14 C23 D33	C9-G12 WeakPolarHBondContact CB-O 3.4Å; C9-C14 WeakPolarHBondContact SG-CA 3.32Å; C9-C14 WeakPolarHBondContact SG-CB 3.4Å; C9-C23 VanDerWaalsContact CA-SG 3.57Å; C9-C23 HydrophobicContact CB-CB 3.86Å; C9-C23 WeakPolarHBondContact CB-SG 2.98Å; C9-C23 VanDerWaalsContact SG-CA 3.6Å; C9-C23 WeakPolarHBondContact SG-CB 3.37Å; C9-C23 CovalentContact SG-SG 2.03Å; C9-C23 PolarHBondContact SG-SG 2.04Å; C9-D33 CarbonylContact C-O 3.46Å; C9-D33 WeakPolarHBondContact CA-O 3.31Å
10	K	92.5	Very high	80.9	Confident	104 Å²	104	96 Å²	96	45%	0.452	51%	0.506	S	S	.	.	S	Bend	trans	-80.7	-43.7	-176.5	-66.8	-67	174.7	-173.4	0	112.5	E7 D33	E7-K10 IonicContact OE1-NZ 2.84Å; E7-K10 IonicContact OE2-NZ 2.71Å; E7-K10 PolarHBondContact OE2-NZ 2.95Å; K10-D33 PolarHBondContact N-O 2.76Å
11	H	93.2	Very high	81.1	Confident	56 Å²	56	94 Å²	94	26%	0.259	50%	0.5	S	S	.	.	S	Bend	trans	-130.6	64.6	175.3	-53.9	104.3	0	0	0	109.4	E26 F29 C34	H11-E26 HydrophobicContact CB-CB 4.4Å; H11-E26 WeakPolarHBondContact O-CB 3.34Å; H11-E26 PolarHBondContact O-N 2.83Å; H11-F29 HydrophobicContact CB-CB 4.01Å; H11-F29 HydrophobicContact CB-CD1 3.89Å; H11-F29 HydrophobicContact CB-CD2 3.52Å; H11-F29 HydrophobicContact CB-CE1 4.32Å; H11-F29 HydrophobicContact CB-CE2 4.01Å; H11-F29 HydrophobicContact CB-CG 3.48Å; H11-F29 VanDerWaalsContact CB-CG 3.48Å; H11-F29 HydrophobicContact CB-CZ 4.39Å; H11-F29 AromaticContact CD2-CZ 3.98Å; H11-F29 AromaticContact CE1-CE1 3.49Å; H11-F29 VanDerWaalsContact CE1-CE1 3.49Å; H11-F29 WeakPolarHBondContact CE1-CE1 3.21Å; H11-F29 AromaticContact CE1-CZ 3.9Å; H11-F29 AromaticContact CG-CD1 3.71Å; H11-F29 AromaticContact CG-CD2 3.89Å; H11-F29 AromaticContact CG-CE1 3.73Å; H11-F29 AromaticContact CG-CE2 3.91Å; H11-F29 AromaticContact CG-CG 3.81Å; H11-F29 AromaticContact CG-CZ 3.84Å; H11-F29 AromaticContact ND1-CD1 3.3Å; H11-F29 VanDerWaalsContact ND1-CD1 3.3Å; H11-F29 WeakPolarHBondContact ND1-CD1 3.33Å; H11-F29 AromaticContact ND1-CE1 3.26Å; H11-F29 VanDerWaalsContact ND1-CE1 3.26Å; H11-F29 WeakPolarHBondContact ND1-CE1 3.01Å; H11-F29 AromaticContact ND1-CG 3.87Å; H11-F29 AromaticContact ND1-CZ 3.81Å; H11-C34 HydrophobicContact CB-CB 4.45Å; H11-C34 WeakPolarHBondContact CB-O 3.39Å; H11-C34 PolarHBondContact N-O 3.37Å; H11-C34 PolarHBondContact ND1-O 3.27Å; H11-C34 VanDerWaalsContact ND1-O 3.15Å; H11-C34 WeakPolarHBondContact O-CB 3.49Å
12	G	92.9	Very high	83.1	Confident	17 Å²	17	87.5 Å²	87.5	18%	0.175	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	164.8	-175.5	0	0	0	0	0	113.7	C9 H24 E26	C9-G12 WeakPolarHBondContact CB-O 3.4Å; G12-H24 CarbonylContact C-O 3.32Å; G12-H24 WeakPolarHBondContact CA-O 3.42Å; G12-E26 PolarHBondContact N-OE1 2.95Å
13	T	92.6	Very high	84.6	Confident	85 Å²	85	86.5 Å²	86.5	52%	0.521	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.7	175	-56.8	0	0	0	0	109.8	H15 C23 H24	T13-H15 PolarHBondContact O-CD2 2.95Å; T13-H15 VanDerWaalsContact O-CD2 3.27Å; T13-C23 WeakPolarHBondContact O-CA 3.39Å; T13-H24 PolarHBondContact N-O 2.81Å; T13-H24 PolarHBondContact O-N 3.09Å
14	C	92.3	Very high	85.6	Confident	31 Å²	31	85.7 Å²	85.7	21%	0.209	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	131.2	173.1	-177.6	0	0	0	0	110.7	C4 C9	C4-C14 WeakPolarHBondContact CA-SG 3.3Å; C4-C14 HydrophobicContact CB-CB 3.54Å; C4-C14 WeakPolarHBondContact CB-SG 3.49Å; C4-C14 WeakPolarHBondContact SG-CB 3.19Å; C4-C14 PolarHBondContact SG-O 2.78Å; C4-C14 CovalentContact SG-SG 2.03Å; C4-C14 PolarHBondContact SG-SG 3.04Å; C9-C14 WeakPolarHBondContact SG-CA 3.32Å; C9-C14 WeakPolarHBondContact SG-CB 3.4Å
15	H	90.9	Very high	86.4	Confident	63 Å²	63	85.3 Å²	85.3	29%	0.292	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.8	174	-65.6	-83	0	0	0	109.9	T13 S21 W22 H24	T13-H15 PolarHBondContact O-CD2 2.95Å; T13-H15 VanDerWaalsContact O-CD2 3.27Å; H15-S21 CarbonylContact O-C 3.44Å; H15-S21 VanDerWaalsContact O-CA 3.28Å; H15-S21 WeakPolarHBondContact O-CA 3.42Å; H15-W22 HydrophobicContact CB-CD2 4.26Å; H15-W22 HydrophobicContact CB-CG 4.5Å; H15-W22 HydrophobicContact CB-CZ2 3.98Å; H15-W22 PolarHBondContact N-O 3.28Å; H15-W22 PolarHBondContact O-N 2.02Å; H15-H24 WeakPolarHBondContact NE2-CB 3.42Å
16	W	87	Confident	87.5	Confident	119 Å²	119	86.9 Å²	86.9	45%	0.451	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	116.6	171.4	-169.2	80.9	0	0	0	110.6	G2	G2-W16 VanDerWaalsContact O-CD1 3.23Å; G2-W16 PolarHBondContact O-NE1 2.8Å
17	V	83.1	Confident	88.8	Confident	82 Å²	82	89.1 Å²	89.1	50%	0.497	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	113	-178.3	-176	0	0	0	0	108.8	V19 R20	V17-V19 PolarHBondContact O-N 2.78Å; V17-R20 PolarHBondContact N-O 3.2Å; V17-R20 PolarHBondContact O-N 2.94Å
18	R	78.8	Confident	90	Very high	228 Å²	228	83 Å²	83	86%	0.86	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	34.6	68.7	171.8	-59.9	-169.3	-170.1	173.7	4.4	112.5
19	V	81.1	Confident	90.6	Very high	133 Å²	133	81.8 Å²	81.8	81%	0.806	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-3.2	179.5	-46.2	0	0	0	0	118.5	V17	V17-V19 PolarHBondContact O-N 2.78Å
20	R	85.4	Confident	90.8	Very high	164 Å²	164	84.1 Å²	84.1	62%	0.619	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.9	173.9	-179.7	173.8	-179.1	-96.9	-1	111.2	V17	V17-R20 PolarHBondContact N-O 3.2Å; V17-R20 PolarHBondContact O-N 2.94Å
21	S	86.5	Confident	90.8	Very high	55 Å²	55	81 Å²	81	39%	0.385	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	146.3	162.2	54.4	0	0	0	0	110.6	H15	H15-S21 CarbonylContact O-C 3.44Å; H15-S21 VanDerWaalsContact O-CA 3.28Å; H15-S21 WeakPolarHBondContact O-CA 3.42Å
22	W	90.2	Very high	90.8	Very high	102 Å²	102	84.9 Å²	84.9	39%	0.386	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.9	168.3	61.3	-74.2	0	0	0	109.1	H15 H24	H15-W22 HydrophobicContact CB-CD2 4.26Å; H15-W22 HydrophobicContact CB-CG 4.5Å; H15-W22 HydrophobicContact CB-CZ2 3.98Å; H15-W22 PolarHBondContact N-O 3.28Å; H15-W22 PolarHBondContact O-N 2.02Å; W22-H24 HydrophobicContact CH2-CB 4.25Å; W22-H24 HydrophobicContact CZ3-CB 3.81Å
23	C	93.8	Very high	90.8	Very high	22 Å²	22	86.9 Å²	86.9	15%	0.149	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	132.7	176.1	-60	0	0	0	0	110	C9 T13 V32 C34	C9-C23 VanDerWaalsContact CA-SG 3.57Å; C9-C23 HydrophobicContact CB-CB 3.86Å; C9-C23 WeakPolarHBondContact CB-SG 2.98Å; C9-C23 VanDerWaalsContact SG-CA 3.6Å; C9-C23 WeakPolarHBondContact SG-CB 3.37Å; C9-C23 CovalentContact SG-SG 2.03Å; C9-C23 PolarHBondContact SG-SG 2.04Å; T13-C23 WeakPolarHBondContact O-CA 3.39Å; C23-V32 PolarHBondContact SG-O 3.21Å; C23-C34 WeakPolarHBondContact CB-SG 3.41Å
24	H	94.4	Very high	90.9	Very high	112 Å²	112	82.8 Å²	82.8	52%	0.519	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109	161.2	-178.2	-170	0	0	0	107.5	G12 T13 H15 W22	G12-H24 CarbonylContact C-O 3.32Å; G12-H24 WeakPolarHBondContact CA-O 3.42Å; T13-H24 PolarHBondContact N-O 2.81Å; T13-H24 PolarHBondContact O-N 3.09Å; H15-H24 WeakPolarHBondContact NE2-CB 3.42Å; W22-H24 HydrophobicContact CH2-CB 4.25Å; W22-H24 HydrophobicContact CZ3-CB 3.81Å
25	C	95.1	Very high	91	Very high	33 Å²	33	84 Å²	84	22%	0.223	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	145.5	-174.5	-55.2	0	0	0	0	112.6	F29 C34	C25-F29 HydrophobicContact CB-CB 4.27Å; C25-F29 VanDerWaalsContact CB-O 3.28Å; C25-F29 WeakPolarHBondContact CB-O 3.01Å; C25-C34 WeakPolarHBondContact CA-SG 3.37Å; C25-C34 HydrophobicContact CB-CB 3.65Å; C25-C34 WeakPolarHBondContact CB-SG 3.43Å; C25-C34 PolarHBondContact N-SG 2.94Å; C25-C34 VanDerWaalsContact SG-CA 3.56Å; C25-C34 WeakPolarHBondContact SG-CB 3.34Å; C25-C34 CovalentContact SG-SG 2.03Å; C25-C34 PolarHBondContact SG-SG 2.94Å
26	E	95.1	Very high	91.2	Very high	103 Å²	103	84.4 Å²	84.4	48%	0.481	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-59.7	156.4	162.8	-69.1	168.6	-143.5	0	0	109.9	H11 G12 G28 F29	H11-E26 HydrophobicContact CB-CB 4.4Å; H11-E26 WeakPolarHBondContact O-CB 3.34Å; H11-E26 PolarHBondContact O-N 2.83Å; G12-E26 PolarHBondContact N-OE1 2.95Å; E26-G28 PolarHBondContact O-N 2.85Å; E26-F29 HydrophobicContact CB-CD2 4.27Å; E26-F29 PolarHBondContact O-N 3.5Å; E26-F29 VanDerWaalsContact O-N 3.14Å
27	E	95.2	Very high	91.5	Very high	165 Å²	165	81.8 Å²	81.8	77%	0.771	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	140	175.5	-157.9	-180	169.2	0	0	110.3	F29 A57	E27-F29 VanDerWaalsContact C-N 3.33Å; E27-A57 HydrophobicContact CB-CB 4.07Å; E27-A57 HydrophobicContact CG-CB 3.96Å; E27-A57 WeakPolarHBondContact O-CB 3.44Å
28	G	95	Very high	92.2	Very high	6 Å²	6	81.1 Å²	81.1	6%	0.062	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-0.9	-175.1	0	0	0	0	0	115.5	E26 I38 A57	E26-G28 PolarHBondContact O-N 2.85Å; G28-I38 PolarHBondContact O-N 2.87Å; G28-A57 VanDerWaalsContact CA-CA 3.5Å
29	F	96.4	Very high	93	Very high	17 Å²	17	73.3 Å²	73.3	8%	0.075	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	150.1	178.8	-67.2	-82.5	0	0	0	113.5	H11 C25 E26 E27 C34 T36 D37 K56	H11-F29 HydrophobicContact CB-CB 4.01Å; H11-F29 HydrophobicContact CB-CD1 3.89Å; H11-F29 HydrophobicContact CB-CD2 3.52Å; H11-F29 HydrophobicContact CB-CE1 4.32Å; H11-F29 HydrophobicContact CB-CE2 4.01Å; H11-F29 HydrophobicContact CB-CG 3.48Å; H11-F29 VanDerWaalsContact CB-CG 3.48Å; H11-F29 HydrophobicContact CB-CZ 4.39Å; H11-F29 AromaticContact CD2-CZ 3.98Å; H11-F29 AromaticContact CE1-CE1 3.49Å; H11-F29 VanDerWaalsContact CE1-CE1 3.49Å; H11-F29 WeakPolarHBondContact CE1-CE1 3.21Å; H11-F29 AromaticContact CE1-CZ 3.9Å; H11-F29 AromaticContact CG-CD1 3.71Å; H11-F29 AromaticContact CG-CD2 3.89Å; H11-F29 AromaticContact CG-CE1 3.73Å; H11-F29 AromaticContact CG-CE2 3.91Å; H11-F29 AromaticContact CG-CG 3.81Å; H11-F29 AromaticContact CG-CZ 3.84Å; H11-F29 AromaticContact ND1-CD1 3.3Å; H11-F29 VanDerWaalsContact ND1-CD1 3.3Å; H11-F29 WeakPolarHBondContact ND1-CD1 3.33Å; H11-F29 AromaticContact ND1-CE1 3.26Å; H11-F29 VanDerWaalsContact ND1-CE1 3.26Å; H11-F29 WeakPolarHBondContact ND1-CE1 3.01Å; H11-F29 AromaticContact ND1-CG 3.87Å; H11-F29 AromaticContact ND1-CZ 3.81Å; C25-F29 HydrophobicContact CB-CB 4.27Å; C25-F29 VanDerWaalsContact CB-O 3.28Å; C25-F29 WeakPolarHBondContact CB-O 3.01Å; E26-F29 HydrophobicContact CB-CD2 4.27Å; E26-F29 PolarHBondContact O-N 3.5Å; E26-F29 VanDerWaalsContact O-N 3.14Å; E27-F29 VanDerWaalsContact C-N 3.33Å; F29-C34 HydrophobicContact CB-CB 4.3Å; F29-T36 CarbonylContact C-O 3.57Å; F29-T36 WeakPolarHBondContact CA-O 3.01Å; F29-D37 HydrophobicContact CD1-CB 4.43Å; F29-D37 HydrophobicContact CE1-CB 4.02Å; F29-K56 HydrophobicContact CE2-CD 4.18Å; F29-K56 VanDerWaalsContact CE2-CE 3.46Å; F29-K56 HydrophobicContact CE2-CG 3.92Å; F29-K56 HydrophobicContact CZ-CD 4.22Å; F29-K56 HydrophobicContact CZ-CG 3.86Å
30	T	95	Very high	93.7	Very high	70 Å²	70	68.7 Å²	68.7	43%	0.429	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	177.7	179.4	-166.6	0	0	0	0	111.6	C34 S35 T36 I38	T30-C34 CarbonylContact O-C 3.55Å; T30-C34 VanDerWaalsContact O-CA 3.29Å; T30-C34 WeakPolarHBondContact O-CA 3.02Å; T30-S35 PolarHBondContact O-N 3.3Å; T30-T36 HydrophobicContact CG2-CG2 3.87Å; T30-T36 PolarHBondContact N-O 3.3Å; T30-T36 WeakPolarHBondContact O-CB 3.25Å; T30-T36 PolarHBondContact O-N 2.84Å; T30-I38 HydrophobicContact CG2-CG1 3.81Å
31	G	93.9	Very high	94.3	Very high	38 Å²	38	61.9 Å²	61.9	39%	0.392	34%	0.343	S	S	.	.	S	Bend	trans	97	172.2	-175.3	0	0	0	0	0	113.1	D33 C34	G31-D33 PolarHBondContact O-N 2.89Å; G31-C34 PolarHBondContact O-N 3.4Å
32	V	91.7	Very high	94.7	Very high	138 Å²	138	66.2 Å²	66.2	84%	0.836	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-32.4	-176.7	170.8	0	0	0	0	112.1	C23	C23-V32 PolarHBondContact SG-O 3.21Å
33	D	93.1	Very high	95	Very high	58 Å²	58	65.8 Å²	65.8	31%	0.31	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	9.1	-178.8	66.1	-18.8	0	0	0	112.9	S8 C9 K10 G31 S35	S8-D33 WeakPolarHBondContact O-CA 3.4Å; S8-D33 WeakPolarHBondContact O-CB 3.46Å; C9-D33 CarbonylContact C-O 3.46Å; C9-D33 WeakPolarHBondContact CA-O 3.31Å; K10-D33 PolarHBondContact N-O 2.76Å; G31-D33 PolarHBondContact O-N 2.89Å; D33-S35 VanDerWaalsContact CG-OG 3.22Å; D33-S35 PolarHBondContact O-N 2.93Å; D33-S35 VanDerWaalsContact OD1-CB 3.29Å; D33-S35 WeakPolarHBondContact OD1-CB 3.16Å; D33-S35 PolarHBondContact OD1-N 3.45Å; D33-S35 PolarHBondContact OD1-OG 3.23Å; D33-S35 WeakPolarHBondContact OD2-CB 3.02Å; D33-S35 PolarHBondContact OD2-OG 3.16Å
34	C	95.1	Very high	95.1	Very high	0 Å²	0	69 Å²	69	0%	0	40%	0.396	C	S	.	.	S	Bend	trans	54.8	31.4	-176.6	-49.2	0	0	0	0	113.6	H11 C23 C25 F29 T30 G31	H11-C34 HydrophobicContact CB-CB 4.45Å; H11-C34 WeakPolarHBondContact CB-O 3.39Å; H11-C34 PolarHBondContact N-O 3.37Å; H11-C34 PolarHBondContact ND1-O 3.27Å; H11-C34 VanDerWaalsContact ND1-O 3.15Å; H11-C34 WeakPolarHBondContact O-CB 3.49Å; C23-C34 WeakPolarHBondContact CB-SG 3.41Å; C25-C34 WeakPolarHBondContact CA-SG 3.37Å; C25-C34 HydrophobicContact CB-CB 3.65Å; C25-C34 WeakPolarHBondContact CB-SG 3.43Å; C25-C34 PolarHBondContact N-SG 2.94Å; C25-C34 VanDerWaalsContact SG-CA 3.56Å; C25-C34 WeakPolarHBondContact SG-CB 3.34Å; C25-C34 CovalentContact SG-SG 2.03Å; C25-C34 PolarHBondContact SG-SG 2.94Å; F29-C34 HydrophobicContact CB-CB 4.3Å; T30-C34 CarbonylContact O-C 3.55Å; T30-C34 VanDerWaalsContact O-CA 3.29Å; T30-C34 WeakPolarHBondContact O-CA 3.02Å; G31-C34 PolarHBondContact O-N 3.4Å
35	S	94.1	Very high	95.2	Very high	55 Å²	55	64 Å²	64	39%	0.385	37%	0.374	S	S	.	.			trans	-88	-16.9	178.4	62.9	0	0	0	0	113.5	T30 D33	T30-S35 PolarHBondContact O-N 3.3Å; D33-S35 VanDerWaalsContact CG-OG 3.22Å; D33-S35 PolarHBondContact O-N 2.93Å; D33-S35 VanDerWaalsContact OD1-CB 3.29Å; D33-S35 WeakPolarHBondContact OD1-CB 3.16Å; D33-S35 PolarHBondContact OD1-N 3.45Å; D33-S35 PolarHBondContact OD1-OG 3.23Å; D33-S35 WeakPolarHBondContact OD2-CB 3.02Å; D33-S35 PolarHBondContact OD2-OG 3.16Å
36	T	94.8	Very high	95.4	Very high	73 Å²	73	63.3 Å²	63.3	45%	0.448	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.7	-175.8	-53.7	0	0	0	0	109.1	F29 T30	F29-T36 CarbonylContact C-O 3.57Å; F29-T36 WeakPolarHBondContact CA-O 3.01Å; T30-T36 HydrophobicContact CG2-CG2 3.87Å; T30-T36 PolarHBondContact N-O 3.3Å; T30-T36 WeakPolarHBondContact O-CB 3.25Å; T30-T36 PolarHBondContact O-N 2.84Å
37	D	94.5	Very high	95.5	Very high	64 Å²	64	61.7 Å²	61.7	34%	0.342	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	133.5	170.1	-169.9	-108.4	0	0	0	109.3	F29 N39	F29-D37 HydrophobicContact CD1-CB 4.43Å; F29-D37 HydrophobicContact CE1-CB 4.02Å; D37-N39 PolarHBondContact O-N 3.1Å
38	I	96.7	Very high	95.6	Very high	68 Å²	68	57.4 Å²	57.4	35%	0.349	35%	0.345	S	S	.	.			trans	-79.7	116	177.9	-63.9	171.9	0	0	0	106.8	G28 T30 E40	G28-I38 PolarHBondContact O-N 2.87Å; T30-I38 HydrophobicContact CG2-CG1 3.81Å; I38-E40 PolarHBondContact O-N 2.03Å; I38-E40 VanDerWaalsContact O-OE2 3.07Å
39	N	96.2	Very high	95.6	Very high	63 Å²	63	60.4 Å²	60.4	34%	0.337	38%	0.376	S	S	.	.			trans	-76.7	99.4	173.1	-173.6	-71.4	0	0	0	110.5	D37 C41 L42 D54	D37-N39 PolarHBondContact O-N 3.1Å; N39-C41 PolarHBondContact O-N 2.91Å; N39-C41 WeakPolarHBondContact OD1-CA 3.29Å; N39-C41 VanDerWaalsContact OD1-CB 3.25Å; N39-C41 WeakPolarHBondContact OD1-CB 3.36Å; N39-C41 PolarHBondContact OD1-N 2.88Å; N39-C41 VanDerWaalsContact OD1-N 3.1Å; N39-L42 HydrophobicContact CB-CD1 3.97Å; N39-L42 HydrophobicContact CB-CG 3.88Å; N39-L42 PolarHBondContact O-N 2.71Å; N39-L42 PolarHBondContact OD1-N 3.28Å; N39-D54 WeakPolarHBondContact CA-OD1 3.4Å; N39-D54 WeakPolarHBondContact CA-OD2 3.01Å; N39-D54 PolarHBondContact ND2-OD2 3.47Å
40	E	96	Very high	95.7	Very high	36 Å²	36	60.3 Å²	60.3	17%	0.168	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-66.6	-22.5	179.8	-70.9	86.1	-167.2	0	0	112.4	I38 L42 S43 D54 A57 K58 F59	I38-E40 PolarHBondContact O-N 2.03Å; I38-E40 VanDerWaalsContact O-OE2 3.07Å; E40-L42 VanDerWaalsContact C-N 3.28Å; E40-L42 PolarHBondContact O-N 3.42Å; E40-S43 PolarHBondContact O-OG 3.38Å; E40-D54 PolarHBondContact N-OD1 3.19Å; E40-A57 WeakPolarHBondContact OE1-CA 3.38Å; E40-K58 PolarHBondContact OE2-N 2.84Å; E40-F59 HydrophobicContact CB-CB 4.05Å; E40-F59 HydrophobicContact CB-CD1 4.06Å
41	C	97.4	Very high	95.8	Very high	22 Å²	22	61.2 Å²	61.2	15%	0.149	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-69.9	-17.7	176.9	-70.4	0	0	0	0	114.6	N39 S43 S44 C52 D54	N39-C41 PolarHBondContact O-N 2.91Å; N39-C41 WeakPolarHBondContact OD1-CA 3.29Å; N39-C41 VanDerWaalsContact OD1-CB 3.25Å; N39-C41 WeakPolarHBondContact OD1-CB 3.36Å; N39-C41 PolarHBondContact OD1-N 2.88Å; N39-C41 VanDerWaalsContact OD1-N 3.1Å; C41-S43 PolarHBondContact O-N 2.79Å; C41-S43 VanDerWaalsContact O-N 3.16Å; C41-S44 WeakPolarHBondContact O-CA 3.35Å; C41-S44 PolarHBondContact O-N 3.29Å; C41-C52 WeakPolarHBondContact CA-SG 3.29Å; C41-C52 HydrophobicContact CB-CB 3.7Å; C41-C52 WeakPolarHBondContact CB-SG 3.34Å; C41-C52 WeakPolarHBondContact SG-CB 3.43Å; C41-C52 CovalentContact SG-SG 2.03Å; C41-C52 PolarHBondContact SG-SG 2.64Å; C41-D54 PolarHBondContact SG-N 2.56Å; C41-D54 VanDerWaalsContact SG-N 3.38Å
42	L	95.8	Very high	96	Very high	146 Å²	146	61.1 Å²	61.1	76%	0.764	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-59.7	-27.3	177.4	-74.7	175.6	0	0	0	112.9	N39 E40 S44	N39-L42 HydrophobicContact CB-CD1 3.97Å; N39-L42 HydrophobicContact CB-CG 3.88Å; N39-L42 PolarHBondContact O-N 2.71Å; N39-L42 PolarHBondContact OD1-N 3.28Å; E40-L42 VanDerWaalsContact C-N 3.28Å; E40-L42 PolarHBondContact O-N 3.42Å; L42-S44 PolarHBondContact O-N 3.06Å
43	S	94.8	Very high	96.3	Very high	92 Å²	92	57.4 Å²	57.4	64%	0.643	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-75.5	-2.6	175.6	68.5	0	0	0	0	113.8	E40 C41	E40-S43 PolarHBondContact O-OG 3.38Å; C41-S43 PolarHBondContact O-N 2.79Å; C41-S43 VanDerWaalsContact O-N 3.16Å
44	S	96.2	Very high	96.4	Very high	91 Å²	91	57.1 Å²	57.1	64%	0.636	35%	0.354	S	S	*	.			trans	50	57.8	-172.8	-58.6	0	0	0	0	112.5	C41 L42 C46	C41-S44 WeakPolarHBondContact O-CA 3.35Å; C41-S44 PolarHBondContact O-N 3.29Å; L42-S44 PolarHBondContact O-N 3.06Å; S44-C46 VanDerWaalsContact C-N 3.33Å; S44-C46 PolarHBondContact O-N 2.94Å
45	P	97.2	Very high	96.3	Very high	7 Å²	7	60.1 Å²	60.1	5%	0.045	37%	0.368	C	S	.	.			trans	-70.6	-29.2	-172.3	28.7	-34.5	0	0	0	112.7	F59 R71	P45-F59 HydrophobicContact CB-CD1 4.16Å; P45-F59 HydrophobicContact CB-CD2 3.98Å; P45-F59 HydrophobicContact CB-CE1 3.79Å; P45-F59 HydrophobicContact CB-CE2 3.61Å; P45-F59 HydrophobicContact CB-CG 4.25Å; P45-F59 HydrophobicContact CB-CZ 3.51Å; P45-F59 HydrophobicContact CG-CB 4.33Å; P45-F59 HydrophobicContact CG-CD1 3.86Å; P45-F59 HydrophobicContact CG-CD2 3.54Å; P45-F59 HydrophobicContact CG-CE1 4.03Å; P45-F59 HydrophobicContact CG-CE2 3.74Å; P45-F59 HydrophobicContact CG-CG 3.62Å; P45-F59 HydrophobicContact CG-CZ 3.98Å; P45-R71 PolarHBondContact O-NE 2.03Å; P45-R71 PolarHBondContact O-NH2 2.83Å
46	C	98.3	Very high	96.1	Very high	18 Å²	18	63.5 Å²	63.5	12%	0.122	38%	0.376	C	S	.	.			trans	-74.6	131.5	-178.6	-52.4	0	0	0	0	112.1	S44 G50 C52 C61	S44-C46 VanDerWaalsContact C-N 3.33Å; S44-C46 PolarHBondContact O-N 2.94Å; C46-G50 WeakPolarHBondContact CB-O 3.18Å; C46-C52 HydrophobicContact CB-CB 4.43Å; C46-C52 WeakPolarHBondContact SG-CA 3.29Å; C46-C52 WeakPolarHBondContact SG-CB 3.29Å; C46-C61 WeakPolarHBondContact CA-SG 3.28Å; C46-C61 HydrophobicContact CB-CB 3.78Å; C46-C61 WeakPolarHBondContact CB-SG 3.35Å; C46-C61 WeakPolarHBondContact SG-CA 3.37Å; C46-C61 WeakPolarHBondContact SG-CB 3.44Å; C46-C61 CovalentContact SG-SG 2.02Å; C46-C61 PolarHBondContact SG-SG 3.19Å
47	L	97.5	Very high	96	Very high	69 Å²	69	61.4 Å²	61.4	36%	0.361	37%	0.367	S	S	.	.			trans	-101	170.6	-179.2	-56.1	-178.4	0	0	0	111.4	G49 G50 R71 E73	L47-G49 PolarHBondContact O-N 3.15Å; L47-G49 VanDerWaalsContact O-N 3.1Å; L47-G50 PolarHBondContact O-N 3.06Å; L47-R71 WeakPolarHBondContact CA-O 3.49Å; L47-R71 VanDerWaalsContact CB-O 3.3Å; L47-R71 WeakPolarHBondContact CB-O 3.26Å; L47-R71 HydrophobicContact CG-CB 4.46Å; L47-R71 PolarHBondContact N-O 3.23Å; L47-E73 HydrophobicContact CD1-CB 3.84Å
48	N	97.2	Very high	96	Very high	75 Å²	75	63.4 Å²	63.4	40%	0.401	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	30.8	171.6	-60.2	-52.6	0	0	0	114.7	P64 Y67 C72	N48-P64 WeakPolarHBondContact O-CG 3.3Å; N48-Y67 HydrophobicContact CB-CD1 3.58Å; N48-Y67 HydrophobicContact CB-CD2 3.81Å; N48-Y67 HydrophobicContact CB-CE1 3.55Å; N48-Y67 HydrophobicContact CB-CE2 3.78Å; N48-Y67 HydrophobicContact CB-CG 3.72Å; N48-Y67 VanDerWaalsContact ND2-CD1 3.34Å; N48-Y67 WeakPolarHBondContact ND2-CD1 3.09Å; N48-Y67 WeakPolarHBondContact ND2-CE1 3.03Å; N48-C72 PolarHBondContact ND2-O 2.76Å
49	G	95.9	Very high	96	Very high	68 Å²	68	62.6 Å²	62.6	70%	0.701	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	17.6	-178.7	0	0	0	0	0	114.3	L47	L47-G49 PolarHBondContact O-N 3.15Å; L47-G49 VanDerWaalsContact O-N 3.1Å
50	G	97.7	Very high	96.1	Very high	15 Å²	15	62.5 Å²	62.5	16%	0.155	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-63.9	138.2	171.5	0	0	0	0	0	112.2	C46 L47 I62	C46-G50 WeakPolarHBondContact CB-O 3.18Å; L47-G50 PolarHBondContact O-N 3.06Å; G50-I62 VanDerWaalsContact CA-O 3.32Å; G50-I62 WeakPolarHBondContact CA-O 3.46Å
51	T	98.1	Very high	96.2	Very high	90 Å²	90	61.5 Å²	61.5	55%	0.552	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.3	174.7	-59.1	0	0	0	0	108.8	I62	T51-I62 PolarHBondContact N-O 3.5Å; T51-I62 PolarHBondContact O-N 2.03Å
52	C	98.4	Very high	96.2	Very high	36 Å²	36	65.3 Å²	65.3	24%	0.243	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.2	175	-165.4	0	0	0	0	110.7	C41 C46	C41-C52 WeakPolarHBondContact CA-SG 3.29Å; C41-C52 HydrophobicContact CB-CB 3.7Å; C41-C52 WeakPolarHBondContact CB-SG 3.34Å; C41-C52 WeakPolarHBondContact SG-CB 3.43Å; C41-C52 CovalentContact SG-SG 2.03Å; C41-C52 PolarHBondContact SG-SG 2.64Å; C46-C52 HydrophobicContact CB-CB 4.43Å; C46-C52 WeakPolarHBondContact SG-CA 3.29Å; C46-C52 WeakPolarHBondContact SG-CB 3.29Å
53	V	98	Very high	96.3	Very high	60 Å²	60	60.3 Å²	60.3	36%	0.364	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.8	171.6	-177.4	0	0	0	0	107.7	E55 F59 T60 I62	V53-E55 HydrophobicContact CG1-CG 4.48Å; V53-F59 WeakPolarHBondContact O-CA 3.04Å; V53-T60 PolarHBondContact N-O 3.23Å; V53-T60 PolarHBondContact O-N 3.46Å; V53-I62 HydrophobicContact CG2-CD1 3.72Å; V53-I62 HydrophobicContact CG2-CG1 4.1Å
54	D	95.5	Very high	96.4	Very high	52 Å²	52	58.2 Å²	58.2	28%	0.278	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.2	176.1	-155.6	48.4	0	0	0	109.5	N39 E40 C41	N39-D54 WeakPolarHBondContact CA-OD1 3.4Å; N39-D54 WeakPolarHBondContact CA-OD2 3.01Å; N39-D54 PolarHBondContact ND2-OD2 3.47Å; E40-D54 PolarHBondContact N-OD1 3.19Å; C41-D54 PolarHBondContact SG-N 2.56Å; C41-D54 VanDerWaalsContact SG-N 3.38Å
55	E	92.9	Very high	96.3	Very high	63 Å²	63	62.8 Å²	62.8	29%	0.294	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	168.2	177.8	-60.7	-178.9	87.1	0	0	109.4	V53 A57 K58 T60	V53-E55 HydrophobicContact CG1-CG 4.48Å; E55-A57 PolarHBondContact O-N 3.38Å; E55-K58 CarbonylContact C-O 3.38Å; E55-K58 VanDerWaalsContact C-O 3.32Å; E55-K58 VanDerWaalsContact CA-O 3.29Å; E55-K58 WeakPolarHBondContact CA-O 3.19Å; E55-K58 HydrophobicContact CB-CG 3.84Å; E55-K58 VanDerWaalsContact CB-O 3.29Å; E55-K58 WeakPolarHBondContact CB-O 3.37Å; E55-K58 PolarHBondContact N-O 3.15Å; E55-K58 PolarHBondContact O-N 3.14Å; E55-K58 IonicContact OE1-NZ 3.96Å; E55-K58 PolarHBondContact OE1-NZ 3.48Å; E55-K58 IonicContact OE2-NZ 2.74Å; E55-K58 PolarHBondContact OE2-NZ 2.74Å; E55-T60 WeakPolarHBondContact OE2-CB 3.2Å; E55-T60 PolarHBondContact OE2-OG1 2.82Å
56	K	89.9	Confident	96.2	Very high	125 Å²	125	66 Å²	66	54%	0.543	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	111.7	179	-131	-172.7	-171.9	-161.9	0	110.6	F29 K58	F29-K56 HydrophobicContact CE2-CD 4.18Å; F29-K56 VanDerWaalsContact CE2-CE 3.46Å; F29-K56 HydrophobicContact CE2-CG 3.92Å; F29-K56 HydrophobicContact CZ-CD 4.22Å; F29-K56 HydrophobicContact CZ-CG 3.86Å; K56-K58 PolarHBondContact O-N 3.35Å
57	A	91.4	Very high	96.1	Very high	30 Å²	30	67.8 Å²	67.8	25%	0.248	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	13.4	178.5	0	0	0	0	0	116	E27 G28 E40 E55	E27-A57 HydrophobicContact CB-CB 4.07Å; E27-A57 HydrophobicContact CG-CB 3.96Å; E27-A57 WeakPolarHBondContact O-CB 3.44Å; G28-A57 VanDerWaalsContact CA-CA 3.5Å; E40-A57 WeakPolarHBondContact OE1-CA 3.38Å; E55-A57 PolarHBondContact O-N 3.38Å
58	K	95.1	Very high	96	Very high	105 Å²	105	70.3 Å²	70.3	46%	0.457	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	161.7	-176.6	69.8	-169.2	172.9	81.7	0	110.8	E40 E55 K56	E40-K58 PolarHBondContact OE2-N 2.84Å; E55-K58 CarbonylContact C-O 3.38Å; E55-K58 VanDerWaalsContact C-O 3.32Å; E55-K58 VanDerWaalsContact CA-O 3.29Å; E55-K58 WeakPolarHBondContact CA-O 3.19Å; E55-K58 HydrophobicContact CB-CG 3.84Å; E55-K58 VanDerWaalsContact CB-O 3.29Å; E55-K58 WeakPolarHBondContact CB-O 3.37Å; E55-K58 PolarHBondContact N-O 3.15Å; E55-K58 PolarHBondContact O-N 3.14Å; E55-K58 IonicContact OE1-NZ 3.96Å; E55-K58 PolarHBondContact OE1-NZ 3.48Å; E55-K58 IonicContact OE2-NZ 2.74Å; E55-K58 PolarHBondContact OE2-NZ 2.74Å; K56-K58 PolarHBondContact O-N 3.35Å
59	F	96.1	Very high	96	Very high	52 Å²	52	67.9 Å²	67.9	23%	0.228	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	153	167.4	67	-87.3	0	0	0	110.8	E40 P45 V53 R71	E40-F59 HydrophobicContact CB-CB 4.05Å; E40-F59 HydrophobicContact CB-CD1 4.06Å; P45-F59 HydrophobicContact CB-CD1 4.16Å; P45-F59 HydrophobicContact CB-CD2 3.98Å; P45-F59 HydrophobicContact CB-CE1 3.79Å; P45-F59 HydrophobicContact CB-CE2 3.61Å; P45-F59 HydrophobicContact CB-CG 4.25Å; P45-F59 HydrophobicContact CB-CZ 3.51Å; P45-F59 HydrophobicContact CG-CB 4.33Å; P45-F59 HydrophobicContact CG-CD1 3.86Å; P45-F59 HydrophobicContact CG-CD2 3.54Å; P45-F59 HydrophobicContact CG-CE1 4.03Å; P45-F59 HydrophobicContact CG-CE2 3.74Å; P45-F59 HydrophobicContact CG-CG 3.62Å; P45-F59 HydrophobicContact CG-CZ 3.98Å; V53-F59 WeakPolarHBondContact O-CA 3.04Å; F59-R71 HydrophobicContact CE2-CG 4.06Å; F59-R71 HydrophobicContact CZ-CG 4.06Å
60	T	97.9	Very high	96.1	Very high	61 Å²	61	70.6 Å²	70.6	37%	0.374	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.8	165	-72.4	0	0	0	0	109.6	V53 E55	V53-T60 PolarHBondContact N-O 3.23Å; V53-T60 PolarHBondContact O-N 3.46Å; E55-T60 WeakPolarHBondContact OE2-CB 3.2Å; E55-T60 PolarHBondContact OE2-OG1 2.82Å
61	C	98.4	Very high	96.1	Very high	15 Å²	15	75 Å²	75	10%	0.101	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.2	172.9	-62.9	0	0	0	0	111.2	C46 C63 I70 C72	C46-C61 WeakPolarHBondContact CA-SG 3.28Å; C46-C61 HydrophobicContact CB-CB 3.78Å; C46-C61 WeakPolarHBondContact CB-SG 3.35Å; C46-C61 WeakPolarHBondContact SG-CA 3.37Å; C46-C61 WeakPolarHBondContact SG-CB 3.44Å; C46-C61 CovalentContact SG-SG 2.02Å; C46-C61 PolarHBondContact SG-SG 3.19Å; C61-C63 PolarHBondContact O-N 3.3Å; C61-I70 WeakPolarHBondContact CB-O 3.49Å; C61-I70 PolarHBondContact SG-O 3.42Å; C61-C72 VanDerWaalsContact CB-SG 3.57Å
62	I	98.3	Very high	96.1	Very high	102 Å²	102	70.8 Å²	70.8	52%	0.523	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	110.1	168.6	-57.7	174.7	0	0	0	107.9	G50 T51 V53	G50-I62 VanDerWaalsContact CA-O 3.32Å; G50-I62 WeakPolarHBondContact CA-O 3.46Å; T51-I62 PolarHBondContact N-O 3.5Å; T51-I62 PolarHBondContact O-N 2.03Å; V53-I62 HydrophobicContact CG2-CD1 3.72Å; V53-I62 HydrophobicContact CG2-CG1 4.1Å
63	C	97.8	Very high	96.1	Very high	40 Å²	40	72.5 Å²	72.5	27%	0.27	36%	0.358	S	S	.	.			trans	-83.5	143.7	-174	-56.1	0	0	0	0	113.2	C61 Y67 C72	C61-C63 PolarHBondContact O-N 3.3Å; C63-Y67 VanDerWaalsContact CB-O 3.31Å; C63-Y67 WeakPolarHBondContact CB-O 3.33Å; C63-C72 WeakPolarHBondContact CA-SG 3.37Å; C63-C72 HydrophobicContact CB-CB 3.75Å; C63-C72 WeakPolarHBondContact CB-SG 3.45Å; C63-C72 WeakPolarHBondContact SG-CA 3.49Å; C63-C72 WeakPolarHBondContact SG-CB 2.95Å; C63-C72 CovalentContact SG-SG 2.04Å; C63-C72 PolarHBondContact SG-SG 2.84Å
64	P	96.4	Very high	96	Very high	49 Å²	49	74 Å²	74	32%	0.318	36%	0.36	S	S	.	.			trans	-62	159.6	166.3	-17.8	31.1	0	0	0	111.2	N48 D66 Y67	N48-P64 WeakPolarHBondContact O-CG 3.3Å; P64-D66 PolarHBondContact O-N 2.83Å; P64-Y67 HydrophobicContact CB-CD2 4.27Å; P64-Y67 HydrophobicContact CG-CD2 4.36Å; P64-Y67 PolarHBondContact O-N 3Å
65	K	93.8	Very high	96	Very high	186 Å²	186	79 Å²	79	81%	0.809	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-33.2	-173.2	-177.1	179.5	174.7	-176.2	0	115.2	M76	K65-M76 WeakPolarHBondContact O-CE 3.28Å
66	D	95	Very high	95.8	Very high	75 Å²	75	80 Å²	80	40%	0.401	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	4.6	-175.3	-59.7	-38.7	0	0	0	114.1	P64 R75 M76	P64-D66 PolarHBondContact O-N 2.83Å; D66-R75 CarbonylContact O-C 3.52Å; D66-R75 WeakPolarHBondContact O-CA 3.5Å; D66-M76 PolarHBondContact O-N 2.95Å
67	Y	96.9	Very high	95.4	Very high	56 Å²	56	81.2 Å²	81.2	22%	0.22	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.9	-177.6	-64.6	-85	0	0	0	112.4	N48 C63 P64 K74 R75	N48-Y67 HydrophobicContact CB-CD1 3.58Å; N48-Y67 HydrophobicContact CB-CD2 3.81Å; N48-Y67 HydrophobicContact CB-CE1 3.55Å; N48-Y67 HydrophobicContact CB-CE2 3.78Å; N48-Y67 HydrophobicContact CB-CG 3.72Å; N48-Y67 VanDerWaalsContact ND2-CD1 3.34Å; N48-Y67 WeakPolarHBondContact ND2-CD1 3.09Å; N48-Y67 WeakPolarHBondContact ND2-CE1 3.03Å; C63-Y67 VanDerWaalsContact CB-O 3.31Å; C63-Y67 WeakPolarHBondContact CB-O 3.33Å; P64-Y67 HydrophobicContact CB-CD2 4.27Å; P64-Y67 HydrophobicContact CG-CD2 4.36Å; P64-Y67 PolarHBondContact O-N 3Å; Y67-K74 CarbonylContact C-O 3.55Å; Y67-K74 WeakPolarHBondContact CA-O 3.46Å; Y67-R75 HydrophobicContact CD1-CB 4.28Å; Y67-R75 HydrophobicContact CD1-CG 4.42Å; Y67-R75 HydrophobicContact CE1-CB 4.11Å; Y67-R75 HydrophobicContact CE1-CG 4.05Å
68	W	96.6	Very high	94.3	Very high	122 Å²	122	87.1 Å²	87.1	46%	0.462	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	171.4	179	65.9	-79.2	0	0	0	111.3	C72 E73 K74 M76	W68-C72 CarbonylContact O-C 3.48Å; W68-C72 WeakPolarHBondContact O-CA 3.5Å; W68-E73 PolarHBondContact O-N 3.27Å; W68-K74 HydrophobicContact CD2-CB 3.81Å; W68-K74 HydrophobicContact CD2-CD 3.99Å; W68-K74 HydrophobicContact CD2-CG 4.49Å; W68-K74 VanDerWaalsContact CE2-CB 3.45Å; W68-K74 HydrophobicContact CE3-CB 4.48Å; W68-K74 HydrophobicContact CE3-CD 3.84Å; W68-K74 HydrophobicContact CG-CB 4.08Å; W68-K74 HydrophobicContact CH2-CD 3.31Å; W68-K74 HydrophobicContact CZ2-CB 3.88Å; W68-K74 HydrophobicContact CZ2-CD 3.42Å; W68-K74 VanDerWaalsContact CZ2-CD 3.42Å; W68-K74 HydrophobicContact CZ2-CG 4.27Å; W68-K74 HydrophobicContact CZ3-CD 3.52Å; W68-K74 PolarHBondContact N-O 2.03Å; W68-K74 WeakPolarHBondContact O-CB 2.94Å; W68-K74 PolarHBondContact O-N 2.79Å; W68-M76 HydrophobicContact CB-CE 4.2Å
69	G	96.7	Very high	93	Very high	24 Å²	24	92.7 Å²	92.7	25%	0.247	43%	0.432	C	S	.	.	S	Bend	trans	105.7	166.5	-171.9	0	0	0	0	0	111.7	R71 C72	G69-R71 PolarHBondContact O-N 2.86Å; G69-C72 PolarHBondContact O-N 2.82Å; G69-C72 VanDerWaalsContact O-N 3.09Å
70	I	97	Very high	91.3	Very high	125 Å²	125	98 Å²	98	64%	0.641	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.4	-175.9	-171.8	172	0	0	0	112.2	C61 E73	C61-I70 WeakPolarHBondContact CB-O 3.49Å; C61-I70 PolarHBondContact SG-O 3.42Å; I70-E73 PolarHBondContact N-OE2 2.74Å
71	R	98.1	Very high	91	Very high	108 Å²	108	99.9 Å²	99.9	41%	0.408	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	17.1	176.4	-67	173.2	66.9	-166.1	1.5	111.7	P45 L47 F59 G69 E73	P45-R71 PolarHBondContact O-NE 2.03Å; P45-R71 PolarHBondContact O-NH2 2.83Å; L47-R71 WeakPolarHBondContact CA-O 3.49Å; L47-R71 VanDerWaalsContact CB-O 3.3Å; L47-R71 WeakPolarHBondContact CB-O 3.26Å; L47-R71 HydrophobicContact CG-CB 4.46Å; L47-R71 PolarHBondContact N-O 3.23Å; F59-R71 HydrophobicContact CE2-CG 4.06Å; F59-R71 HydrophobicContact CZ-CG 4.06Å; G69-R71 PolarHBondContact O-N 2.86Å; R71-E73 WeakPolarHBondContact CA-OE2 3.12Å; R71-E73 PolarHBondContact N-OE2 3.48Å; R71-E73 PolarHBondContact O-N 2.93Å
72	C	98	Very high	90.6	Very high	0 Å²	0	104.4 Å²	104.4	0%	0	51%	0.512	C	S	.	.	S	Bend	trans	55.1	31.5	-174.2	-47.8	0	0	0	0	113.1	N48 C61 C63 W68 G69	N48-C72 PolarHBondContact ND2-O 2.76Å; C61-C72 VanDerWaalsContact CB-SG 3.57Å; C63-C72 WeakPolarHBondContact CA-SG 3.37Å; C63-C72 HydrophobicContact CB-CB 3.75Å; C63-C72 WeakPolarHBondContact CB-SG 3.45Å; C63-C72 WeakPolarHBondContact SG-CA 3.49Å; C63-C72 WeakPolarHBondContact SG-CB 2.95Å; C63-C72 CovalentContact SG-SG 2.04Å; C63-C72 PolarHBondContact SG-SG 2.84Å; W68-C72 CarbonylContact O-C 3.48Å; W68-C72 WeakPolarHBondContact O-CA 3.5Å; G69-C72 PolarHBondContact O-N 2.82Å; G69-C72 VanDerWaalsContact O-N 3.09Å
73	E	97.6	Very high	90.2	Very high	73 Å²	73	104.5 Å²	104.5	34%	0.341	51%	0.512	S	S	.	.			trans	-80.7	-15.2	-171	73.4	-72.4	172.1	0	0	113.8	L47 W68 I70 R71	L47-E73 HydrophobicContact CD1-CB 3.84Å; W68-E73 PolarHBondContact O-N 3.27Å; I70-E73 PolarHBondContact N-OE2 2.74Å; R71-E73 WeakPolarHBondContact CA-OE2 3.12Å; R71-E73 PolarHBondContact N-OE2 3.48Å; R71-E73 PolarHBondContact O-N 2.93Å
74	K	96.8	Very high	89.8	Confident	91 Å²	91	108.3 Å²	108.3	40%	0.396	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.8	-175.4	-55.5	178	-174.1	168.9	0	110.1	Y67 W68	Y67-K74 CarbonylContact C-O 3.55Å; Y67-K74 WeakPolarHBondContact CA-O 3.46Å; W68-K74 HydrophobicContact CD2-CB 3.81Å; W68-K74 HydrophobicContact CD2-CD 3.99Å; W68-K74 HydrophobicContact CD2-CG 4.49Å; W68-K74 VanDerWaalsContact CE2-CB 3.45Å; W68-K74 HydrophobicContact CE3-CB 4.48Å; W68-K74 HydrophobicContact CE3-CD 3.84Å; W68-K74 HydrophobicContact CG-CB 4.08Å; W68-K74 HydrophobicContact CH2-CD 3.31Å; W68-K74 HydrophobicContact CZ2-CB 3.88Å; W68-K74 HydrophobicContact CZ2-CD 3.42Å; W68-K74 VanDerWaalsContact CZ2-CD 3.42Å; W68-K74 HydrophobicContact CZ2-CG 4.27Å; W68-K74 HydrophobicContact CZ3-CD 3.52Å; W68-K74 PolarHBondContact N-O 2.03Å; W68-K74 WeakPolarHBondContact O-CB 2.94Å; W68-K74 PolarHBondContact O-N 2.79Å
75	R	95.2	Very high	89.3	Confident	156 Å²	156	112 Å²	112	59%	0.589	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	139.6	174.4	-160.5	179.3	-152.1	-96.7	0.9	110.3	D66 Y67 Q77	D66-R75 CarbonylContact O-C 3.52Å; D66-R75 WeakPolarHBondContact O-CA 3.5Å; Y67-R75 HydrophobicContact CD1-CB 4.28Å; Y67-R75 HydrophobicContact CD1-CG 4.42Å; Y67-R75 HydrophobicContact CE1-CB 4.11Å; Y67-R75 HydrophobicContact CE1-CG 4.05Å; R75-Q77 PolarHBondContact O-N 2.84Å
76	M	88.3	Confident	89	Confident	86 Å²	86	107.1 Å²	107.1	42%	0.424	52%	0.521	S	S	.	.			trans	-69.5	113.3	167.6	-61.8	-171.1	-169	0	0	108.2	K65 D66 W68 I78	K65-M76 WeakPolarHBondContact O-CE 3.28Å; D66-M76 PolarHBondContact O-N 2.95Å; W68-M76 HydrophobicContact CB-CE 4.2Å; M76-I78 PolarHBondContact O-N 2.74Å
77	Q	82.6	Confident	88.6	Confident	150 Å²	150	109.4 Å²	109.4	70%	0.701	53%	0.529	S	S	*	.			trans	-89.3	104	171.5	-67.1	-178	5.1	0	0	107.4	R75 R79	R75-Q77 PolarHBondContact O-N 2.84Å; Q77-R79 VanDerWaalsContact C-N 3.29Å; Q77-R79 PolarHBondContact O-N 3.45Å
78	I	68.4	Low	88	Confident	154 Å²	154	113.5 Å²	113.5	79%	0.79	55%	0.553	S	S	*	*			trans	-73	97.5	161.6	-53.7	173.4	0	0	0	104.8	M76 A80	M76-I78 PolarHBondContact O-N 2.74Å; I78-A80 PolarHBondContact O-N 3.22Å; I78-A80 VanDerWaalsContact O-N 3.11Å
79	R	67.5	Low	87.3	Confident	222 Å²	222	112.8 Å²	112.8	84%	0.838	56%	0.561	S	S	*	*			trans	-70.8	103	163.1	-71.9	-173.8	174.5	-175	-2.8	106.1	Q77	Q77-R79 VanDerWaalsContact C-N 3.29Å; Q77-R79 PolarHBondContact O-N 3.45Å
80	A	61.1	Low	86.4	Confident	164 Å²	164	120.8 Å²	120.8	100%	1.355	59%	0.589	S	S	*	*			trans	-74.7	0	159.7	0	0	0	0	0	109.2	I78	I78-A80 PolarHBondContact O-N 3.22Å; I78-A80 VanDerWaalsContact O-N 3.11Å

Retrieved 80 of 80 residues in 70.5 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).