A0A077ZLV3_TRITR Loading...

aspartyl aminopeptidase

AlphaFold DB , UniProt , Accession A0A077ZLV3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 101 aa.

						>A0A077ZLV3_TRITR|A0A077ZLV3
MANKMLPAADVRSYADHFVDFLNKAVSPMHAVKACRESLISAGFEELEESDVWKLSPRGKYFVTKNGTALIAFVLGGNFTPGRPVHMVGTHVDSPCLRART
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	75.8	Confident	244 Å²	244	122.5 Å²	122.5	100%	1.202	70%	0.702	S	S	*	*				0	125.6	0	-63.8	-174.2	-163.8	0	0	107.3	N3	M1-N3 PolarHBondContact O-N 3.17Å
2	A	52.1	Low	77.4	Confident	100 Å²	100	126 Å²	126	83%	0.826	70%	0.695	S	S	*	*			trans	-69.7	121.5	-179.1	0	0	0	0	0	109.4	K4	A2-K4 PolarHBondContact O-N 3.36Å
3	N	60.4	Low	78.8	Confident	166 Å²	166	120.2 Å²	120.2	89%	0.888	67%	0.669	S	S	*	*			trans	-72.4	85.2	174	-164.3	21.5	0	0	0	107.9	M1 M5	M1-N3 PolarHBondContact O-N 3.17Å; N3-M5 PolarHBondContact O-N 3.15Å; N3-M5 VanDerWaalsContact O-N 3.15Å
4	K	72	Confident	80	Confident	193 Å²	193	122.4 Å²	122.4	84%	0.839	66%	0.663	S	S	*	*			trans	-74.9	105.9	179.2	-155.6	177.3	-174.7	-176.6	0	107	A2 L6	A2-K4 PolarHBondContact O-N 3.36Å; K4-L6 PolarHBondContact O-N 3.33Å
5	M	78.2	Confident	81.1	Confident	172 Å²	172	117.5 Å²	117.5	85%	0.847	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-55.9	131	177.1	-139.6	170.1	82.3	0	0	108.8	N3	N3-M5 PolarHBondContact O-N 3.15Å; N3-M5 VanDerWaalsContact O-N 3.15Å
6	L	81.8	Confident	82.2	Confident	92 Å²	92	114.1 Å²	114.1	48%	0.482	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-59.2	144.3	173.9	-73.9	167.4	0	0	0	109.2	K4 A8 V11 Y14	K4-L6 PolarHBondContact O-N 3.33Å; L6-A8 PolarHBondContact O-N 3.45Å; L6-V11 HydrophobicContact CB-CG2 3.85Å; L6-Y14 HydrophobicContact CD1-CE2 4.25Å
7	P	86.8	Confident	83	Confident	76 Å²	76	114.2 Å²	114.2	49%	0.494	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-48.8	139.3	170.1	-25.9	33.3	0	0	0	111.2	A9 D10 V11	P7-A9 PolarHBondContact O-N 2.89Å; P7-A9 VanDerWaalsContact O-N 3.13Å; P7-D10 HydrophobicContact CB-CB 4.49Å; P7-D10 VanDerWaalsContact CD-OD2 3.24Å; P7-D10 WeakPolarHBondContact CD-OD2 3.42Å; P7-D10 VanDerWaalsContact CG-OD2 3.29Å; P7-D10 WeakPolarHBondContact CG-OD2 3.29Å; P7-D10 WeakPolarHBondContact O-CB 3.24Å; P7-D10 PolarHBondContact O-N 3.35Å; P7-V11 PolarHBondContact O-N 3.3Å; P7-V11 VanDerWaalsContact O-N 3.12Å
8	A	85.4	Confident	83.8	Confident	83 Å²	83	114.7 Å²	114.7	69%	0.686	62%	0.617	S	S	*	*	H	α-helix	trans	-57	-33.4	-177.2	0	0	0	0	0	112.9	L6 V11 R12	L6-A8 PolarHBondContact O-N 3.45Å; A8-V11 PolarHBondContact O-N 2.96Å; A8-R12 PolarHBondContact O-N 3.01Å
9	A	87.4	Confident	84.5	Confident	74 Å²	74	112.4 Å²	112.4	61%	0.612	61%	0.607	S	S	*	*	H	α-helix	trans	-61.6	-42.1	174.4	0	0	0	0	0	112.3	P7 R12 S13	P7-A9 PolarHBondContact O-N 2.89Å; P7-A9 VanDerWaalsContact O-N 3.13Å; A9-R12 PolarHBondContact O-N 3.03Å; A9-S13 PolarHBondContact O-N 3.16Å
10	D	92.7	Very high	85.2	Confident	69 Å²	69	111.2 Å²	111.2	37%	0.369	60%	0.6	S	S	.	*	H	α-helix	trans	-67.6	-44	178.9	-62.3	-15.8	0	0	0	110.5	P7 R12 S13 Y14	P7-D10 HydrophobicContact CB-CB 4.49Å; P7-D10 VanDerWaalsContact CD-OD2 3.24Å; P7-D10 WeakPolarHBondContact CD-OD2 3.42Å; P7-D10 VanDerWaalsContact CG-OD2 3.29Å; P7-D10 WeakPolarHBondContact CG-OD2 3.29Å; P7-D10 WeakPolarHBondContact O-CB 3.24Å; P7-D10 PolarHBondContact O-N 3.35Å; D10-R12 VanDerWaalsContact C-N 3.28Å; D10-R12 PolarHBondContact O-N 2.97Å; D10-S13 PolarHBondContact O-N 2.98Å; D10-Y14 HydrophobicContact CB-CE2 4.24Å; D10-Y14 WeakPolarHBondContact O-CD2 3.36Å; D10-Y14 PolarHBondContact O-N 3.46Å
11	V	93.8	Very high	85.8	Confident	79 Å²	79	108.9 Å²	108.9	48%	0.479	59%	0.585	S	S	.	*	H	α-helix	trans	-56.2	-45.6	176	178.2	0	0	0	0	110.8	L6 P7 A8 A15	L6-V11 HydrophobicContact CB-CG2 3.85Å; P7-V11 PolarHBondContact O-N 3.3Å; P7-V11 VanDerWaalsContact O-N 3.12Å; A8-V11 PolarHBondContact O-N 2.96Å; V11-A15 PolarHBondContact O-N 3.38Å; V11-A15 VanDerWaalsContact O-N 3.13Å
12	R	94.6	Very high	88.4	Confident	164 Å²	164	101.5 Å²	101.5	62%	0.619	55%	0.55	S	S	*	.	H	α-helix	trans	-64.4	-45.7	178.3	179.7	63.2	-160.7	-131.7	10.5	111.8	A8 A9 D10 Y14 A15 D16	A8-R12 PolarHBondContact O-N 3.01Å; A9-R12 PolarHBondContact O-N 3.03Å; D10-R12 VanDerWaalsContact C-N 3.28Å; D10-R12 PolarHBondContact O-N 2.97Å; R12-Y14 VanDerWaalsContact C-N 3.35Å; R12-Y14 PolarHBondContact O-N 3.24Å; R12-A15 WeakPolarHBondContact O-CB 3.12Å; R12-A15 PolarHBondContact O-N 3.05Å; R12-A15 VanDerWaalsContact O-N 3.16Å; R12-D16 WeakPolarHBondContact CG-OD2 3.09Å; R12-D16 IonicContact CZ-OD1 2.78Å; R12-D16 VanDerWaalsContact CZ-OD1 3.27Å; R12-D16 IonicContact CZ-OD2 2.9Å; R12-D16 VanDerWaalsContact NE-CG 3.29Å; R12-D16 IonicContact NE-OD1 2.94Å; R12-D16 PolarHBondContact NE-OD1 2.93Å; R12-D16 IonicContact NE-OD2 3.76Å; R12-D16 PolarHBondContact NE-OD2 2.9Å; R12-D16 IonicContact NH2-OD1 2.92Å; R12-D16 PolarHBondContact NH2-OD1 2.93Å; R12-D16 IonicContact NH2-OD2 3.27Å; R12-D16 PolarHBondContact O-N 3.12Å
13	S	96.2	Very high	90.5	Very high	50 Å²	50	102.1 Å²	102.1	35%	0.35	54%	0.539	S	S	.	.	H	α-helix	trans	-60.3	-42.2	178.9	177.7	0	0	0	0	112.5	A9 D10 A15 D16 H17	A9-S13 PolarHBondContact O-N 3.16Å; D10-S13 PolarHBondContact O-N 2.98Å; S13-A15 VanDerWaalsContact C-N 3.35Å; S13-A15 PolarHBondContact O-N 3.45Å; S13-D16 PolarHBondContact O-N 3.21Å; S13-H17 PolarHBondContact O-N 2.88Å; S13-H17 PolarHBondContact O-ND1 3.13Å; S13-H17 PolarHBondContact OG-CE1 3.22Å
14	Y	95.5	Very high	92.3	Very high	151 Å²	151	100.4 Å²	100.4	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-41.2	174.8	-72.9	-59.1	0	0	0	112.4	L6 D10 R12 F18	L6-Y14 HydrophobicContact CD1-CE2 4.25Å; D10-Y14 HydrophobicContact CB-CE2 4.24Å; D10-Y14 WeakPolarHBondContact O-CD2 3.36Å; D10-Y14 PolarHBondContact O-N 3.46Å; R12-Y14 VanDerWaalsContact C-N 3.35Å; R12-Y14 PolarHBondContact O-N 3.24Å; Y14-F18 WeakPolarHBondContact O-CB 3.21Å; Y14-F18 PolarHBondContact O-N 2.98Å
15	A	96.7	Very high	93.5	Very high	49 Å²	49	92.4 Å²	92.4	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-63.9	-43.9	176.9	0	0	0	0	0	111.8	V11 R12 S13 F18 V19	V11-A15 PolarHBondContact O-N 3.38Å; V11-A15 VanDerWaalsContact O-N 3.13Å; R12-A15 WeakPolarHBondContact O-CB 3.12Å; R12-A15 PolarHBondContact O-N 3.05Å; R12-A15 VanDerWaalsContact O-N 3.16Å; S13-A15 VanDerWaalsContact C-N 3.35Å; S13-A15 PolarHBondContact O-N 3.45Å; A15-F18 PolarHBondContact O-N 2.95Å; A15-V19 WeakPolarHBondContact O-CG2 3.44Å; A15-V19 PolarHBondContact O-N 3.5Å
16	D	97.8	Very high	94.3	Very high	63 Å²	63	89.3 Å²	89.3	34%	0.337	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-46.6	178.1	-68.4	-32.9	0	0	0	111.1	R12 S13 F18 V19 D20	R12-D16 WeakPolarHBondContact CG-OD2 3.09Å; R12-D16 IonicContact CZ-OD1 2.78Å; R12-D16 VanDerWaalsContact CZ-OD1 3.27Å; R12-D16 IonicContact CZ-OD2 2.9Å; R12-D16 VanDerWaalsContact NE-CG 3.29Å; R12-D16 IonicContact NE-OD1 2.94Å; R12-D16 PolarHBondContact NE-OD1 2.93Å; R12-D16 IonicContact NE-OD2 3.76Å; R12-D16 PolarHBondContact NE-OD2 2.9Å; R12-D16 IonicContact NH2-OD1 2.92Å; R12-D16 PolarHBondContact NH2-OD1 2.93Å; R12-D16 IonicContact NH2-OD2 3.27Å; R12-D16 PolarHBondContact O-N 3.12Å; S13-D16 PolarHBondContact O-N 3.21Å; D16-F18 VanDerWaalsContact C-N 3.28Å; D16-F18 PolarHBondContact O-N 3.35Å; D16-V19 PolarHBondContact O-N 3.16Å; D16-D20 PolarHBondContact O-N 3.41Å
17	H	96.4	Very high	95.1	Very high	116 Å²	116	86.8 Å²	86.8	54%	0.537	47%	0.474	S	S	.	.	H	α-helix	trans	-61.4	-36.1	175	-69.4	150.8	0	0	0	113	S13 D20 F21	S13-H17 PolarHBondContact O-N 2.88Å; S13-H17 PolarHBondContact O-ND1 3.13Å; S13-H17 PolarHBondContact OG-CE1 3.22Å; H17-D20 PolarHBondContact O-N 2.97Å; H17-F21 PolarHBondContact O-N 3.24Å
18	F	97	Very high	95.6	Very high	123 Å²	123	84.2 Å²	84.2	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-67.6	-42	176.2	-179.2	-120.3	0	0	0	111.5	Y14 A15 D16 D20 F21 L22	Y14-F18 WeakPolarHBondContact O-CB 3.21Å; Y14-F18 PolarHBondContact O-N 2.98Å; A15-F18 PolarHBondContact O-N 2.95Å; D16-F18 VanDerWaalsContact C-N 3.28Å; D16-F18 PolarHBondContact O-N 3.35Å; F18-D20 VanDerWaalsContact C-N 3.33Å; F18-D20 PolarHBondContact O-N 3.02Å; F18-F21 WeakPolarHBondContact O-CB 3.41Å; F18-F21 PolarHBondContact O-N 3.43Å; F18-L22 HydrophobicContact CD1-CD1 4.02Å; F18-L22 HydrophobicContact CD1-CG 4.5Å; F18-L22 HydrophobicContact CE1-CD1 3.6Å; F18-L22 HydrophobicContact CE1-CG 4.17Å; F18-L22 HydrophobicContact CE2-CD1 4.48Å; F18-L22 HydrophobicContact CE2-CD2 4.13Å; F18-L22 HydrophobicContact CE2-CG 4.16Å; F18-L22 HydrophobicContact CZ-CD1 3.86Å; F18-L22 HydrophobicContact CZ-CD2 3.92Å; F18-L22 HydrophobicContact CZ-CG 3.99Å; F18-L22 WeakPolarHBondContact O-CG 3.47Å; F18-L22 PolarHBondContact O-N 2.97Å
19	V	97.9	Very high	96.2	Very high	72 Å²	72	84.8 Å²	84.8	44%	0.436	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-42.1	173.6	170.8	0	0	0	0	110.9	A15 D16 F21 L22 N23	A15-V19 WeakPolarHBondContact O-CG2 3.44Å; A15-V19 PolarHBondContact O-N 3.5Å; D16-V19 PolarHBondContact O-N 3.16Å; V19-F21 VanDerWaalsContact C-N 3.31Å; V19-F21 PolarHBondContact O-N 3.13Å; V19-L22 PolarHBondContact O-N 3.49Å; V19-N23 VanDerWaalsContact O-CG 3.32Å; V19-N23 PolarHBondContact O-N 3.42Å; V19-N23 PolarHBondContact O-ND2 2.91Å
20	D	97.9	Very high	96.7	Very high	88 Å²	88	85.5 Å²	85.5	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-61.2	-39.1	174.8	-74	-19.4	0	0	0	112.5	D16 H17 F18 K24	D16-D20 PolarHBondContact O-N 3.41Å; H17-D20 PolarHBondContact O-N 2.97Å; F18-D20 VanDerWaalsContact C-N 3.33Å; F18-D20 PolarHBondContact O-N 3.02Å; D20-K24 WeakPolarHBondContact O-CG 3.03Å; D20-K24 PolarHBondContact O-N 2.94Å
21	F	97.9	Very high	96.9	Very high	63 Å²	63	82.5 Å²	82.5	28%	0.276	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-47.4	173.2	175.8	-92.4	0	0	0	111.5	H17 F18 V19 N23 K24 A25 A34	H17-F21 PolarHBondContact O-N 3.24Å; F18-F21 WeakPolarHBondContact O-CB 3.41Å; F18-F21 PolarHBondContact O-N 3.43Å; V19-F21 VanDerWaalsContact C-N 3.31Å; V19-F21 PolarHBondContact O-N 3.13Å; F21-N23 VanDerWaalsContact C-N 3.3Å; F21-N23 PolarHBondContact O-N 2.9Å; F21-K24 WeakPolarHBondContact O-CB 3.45Å; F21-K24 PolarHBondContact O-N 2.99Å; F21-A25 HydrophobicContact CD1-CB 4.28Å; F21-A25 HydrophobicContact CE1-CB 3.91Å; F21-A25 HydrophobicContact CZ-CB 4.22Å; F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.44Å; F21-A25 PolarHBondContact O-N 2.97Å; F21-A34 HydrophobicContact CD2-CB 4.14Å; F21-A34 HydrophobicContact CE2-CB 3.82Å
22	L	97.4	Very high	97.1	Very high	89 Å²	89	79 Å²	79	47%	0.466	40%	0.401	S	S	.	.	H	α-helix	trans	-59.7	-40.6	178.8	-70.2	177.4	0	0	0	112.1	F18 V19 K24 A25	F18-L22 HydrophobicContact CD1-CD1 4.02Å; F18-L22 HydrophobicContact CD1-CG 4.5Å; F18-L22 HydrophobicContact CE1-CD1 3.6Å; F18-L22 HydrophobicContact CE1-CG 4.17Å; F18-L22 HydrophobicContact CE2-CD1 4.48Å; F18-L22 HydrophobicContact CE2-CD2 4.13Å; F18-L22 HydrophobicContact CE2-CG 4.16Å; F18-L22 HydrophobicContact CZ-CD1 3.86Å; F18-L22 HydrophobicContact CZ-CD2 3.92Å; F18-L22 HydrophobicContact CZ-CG 3.99Å; F18-L22 WeakPolarHBondContact O-CG 3.47Å; F18-L22 PolarHBondContact O-N 2.97Å; V19-L22 PolarHBondContact O-N 3.49Å; L22-K24 PolarHBondContact O-N 3.38Å; L22-A25 PolarHBondContact O-N 2.85Å; L22-A25 VanDerWaalsContact O-N 3.14Å
23	N	97.7	Very high	97.3	Very high	113 Å²	113	76.7 Å²	76.7	60%	0.604	40%	0.395	S	S	*	.	H	α-helix	trans	-64.1	-26	177	-72.9	-30.7	0	0	0	113.1	V19 F21	V19-N23 VanDerWaalsContact O-CG 3.32Å; V19-N23 PolarHBondContact O-N 3.42Å; V19-N23 PolarHBondContact O-ND2 2.91Å; F21-N23 VanDerWaalsContact C-N 3.3Å; F21-N23 PolarHBondContact O-N 2.9Å
24	K	97.3	Very high	97.4	Very high	130 Å²	130	74.6 Å²	74.6	57%	0.565	38%	0.381	S	S	*	.	H	α-helix	trans	-84.2	-35.1	172.4	-65.3	169.5	-173.9	175.3	0	111.8	D20 F21 L22 V26 H30 A34	D20-K24 WeakPolarHBondContact O-CG 3.03Å; D20-K24 PolarHBondContact O-N 2.94Å; F21-K24 WeakPolarHBondContact O-CB 3.45Å; F21-K24 PolarHBondContact O-N 2.99Å; L22-K24 PolarHBondContact O-N 3.38Å; K24-V26 VanDerWaalsContact C-N 3.26Å; K24-V26 PolarHBondContact O-N 3.32Å; K24-H30 VanDerWaalsContact O-CB 3.3Å; K24-H30 WeakPolarHBondContact O-CB 3.43Å; K24-A34 HydrophobicContact CB-CB 4.31Å
25	A	96.9	Very high	97.5	Very high	24 Å²	24	69.1 Å²	69.1	20%	0.198	37%	0.365	C	S	.	.			trans	-82.4	47.4	-171.9	0	0	0	0	0	114.2	F21 L22 S27 A31	F21-A25 HydrophobicContact CD1-CB 4.28Å; F21-A25 HydrophobicContact CE1-CB 3.91Å; F21-A25 HydrophobicContact CZ-CB 4.22Å; F21-A25 VanDerWaalsContact O-CB 3.3Å; F21-A25 WeakPolarHBondContact O-CB 3.44Å; F21-A25 PolarHBondContact O-N 2.97Å; L22-A25 PolarHBondContact O-N 2.85Å; L22-A25 VanDerWaalsContact O-N 3.14Å; A25-S27 PolarHBondContact O-N 2.85Å; A25-A31 HydrophobicContact CB-CB 3.79Å
26	V	96.4	Very high	97.6	Very high	108 Å²	108	71.1 Å²	71.1	66%	0.655	36%	0.362	S	S	*	.	S	Bend	trans	-71	-10.4	-173.9	-60.3	0	0	0	0	115.1	K24 H30	K24-V26 VanDerWaalsContact C-N 3.26Å; K24-V26 PolarHBondContact O-N 3.32Å; V26-H30 HydrophobicContact CG2-CB 4.21Å
27	S	96.9	Very high	97.6	Very high	39 Å²	39	72.6 Å²	72.6	27%	0.273	37%	0.367	S	S	.	.	S	Bend	trans	-151.1	165.2	170.3	79.6	0	0	0	0	109.5	A25 M29 H30 A31	A25-S27 PolarHBondContact O-N 2.85Å; S27-M29 PolarHBondContact O-N 2.88Å; S27-M29 VanDerWaalsContact O-N 3.17Å; S27-H30 PolarHBondContact O-N 3.25Å; S27-H30 PolarHBondContact OG-N 3.44Å; S27-H30 PolarHBondContact OG-ND1 3.04Å; S27-A31 PolarHBondContact O-N 2.92Å
28	P	97.5	Very high	97.7	Very high	21 Å²	21	70.7 Å²	70.7	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-53.3	-38.8	177.4	-27.5	35	0	0	0	113.2	A31 V32 T68 V92 D93	P28-A31 PolarHBondContact O-N 3.41Å; P28-V32 WeakPolarHBondContact O-CG2 3.5Å; P28-V32 PolarHBondContact O-N 2.78Å; P28-T68 HydrophobicContact CB-CG2 4.49Å; P28-V92 HydrophobicContact CB-CG2 4.16Å; P28-D93 HydrophobicContact CG-CB 4Å
29	M	97.5	Very high	97.7	Very high	96 Å²	96	66.1 Å²	66.1	47%	0.473	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-43	176.2	-62.7	-68.3	-80.2	0	0	111.9	S27 K33 N66 G67 T68	S27-M29 PolarHBondContact O-N 2.88Å; S27-M29 VanDerWaalsContact O-N 3.17Å; M29-K33 WeakPolarHBondContact O-CB 3.36Å; M29-K33 PolarHBondContact O-N 3.18Å; M29-N66 VanDerWaalsContact SD-O 3.4Å; M29-G67 WeakPolarHBondContact CA-O 3.47Å; M29-T68 HydrophobicContact CG-CG2 4.06Å; M29-T68 HydrophobicContact SD-CG2 3.28Å; M29-T68 WeakPolarHBondContact SD-CG2 3.19Å
30	H	98.1	Very high	97.8	Very high	89 Å²	89	66.3 Å²	66.3	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-71.4	-35	177.6	-68.3	95.5	0	0	0	112.3	K24 V26 S27 K33 A34	K24-H30 VanDerWaalsContact O-CB 3.3Å; K24-H30 WeakPolarHBondContact O-CB 3.43Å; V26-H30 HydrophobicContact CG2-CB 4.21Å; S27-H30 PolarHBondContact O-N 3.25Å; S27-H30 PolarHBondContact OG-N 3.44Å; S27-H30 PolarHBondContact OG-ND1 3.04Å; H30-K33 PolarHBondContact O-N 2.92Å; H30-A34 WeakPolarHBondContact O-CB 3.42Å; H30-A34 PolarHBondContact O-N 3Å
31	A	98.1	Very high	97.8	Very high	5 Å²	5	67.2 Å²	67.2	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-60.9	-49.8	174.3	0	0	0	0	0	110.9	A25 S27 P28 K33 A34 C35 V92	A25-A31 HydrophobicContact CB-CB 3.79Å; S27-A31 PolarHBondContact O-N 2.92Å; P28-A31 PolarHBondContact O-N 3.41Å; A31-K33 VanDerWaalsContact C-N 3.33Å; A31-K33 PolarHBondContact O-N 2.8Å; A31-A34 PolarHBondContact O-N 3.28Å; A31-C35 PolarHBondContact O-N 2.91Å; A31-C35 PolarHBondContact O-SG 3.48Å; A31-C35 VanDerWaalsContact O-SG 3.34Å; A31-V92 HydrophobicContact CB-CB 4.17Å
32	V	98.4	Very high	97.8	Very high	5 Å²	5	66.7 Å²	66.7	3%	0.03	37%	0.365	C	S	.	.	H	α-helix	trans	-61.6	-41.3	175.3	168.5	0	0	0	0	111.4	P28 C35 R36 T64 G67 L70 V92	P28-V32 WeakPolarHBondContact O-CG2 3.5Å; P28-V32 PolarHBondContact O-N 2.78Å; V32-C35 WeakPolarHBondContact O-CB 3.49Å; V32-C35 PolarHBondContact O-N 3.33Å; V32-R36 WeakPolarHBondContact O-CB 3.47Å; V32-R36 PolarHBondContact O-N 2.97Å; V32-T64 HydrophobicContact CG1-CG2 3.88Å; V32-G67 WeakPolarHBondContact CB-O 3.45Å; V32-G67 WeakPolarHBondContact CG1-O 3.4Å; V32-G67 WeakPolarHBondContact CG2-O 3.49Å; V32-L70 HydrophobicContact CG1-CB 4.21Å; V32-L70 HydrophobicContact CG1-CD1 4.27Å; V32-L70 HydrophobicContact CG2-CB 4.38Å; V32-V92 HydrophobicContact CG2-CG2 4.27Å
33	K	98.1	Very high	97.8	Very high	116 Å²	116	65 Å²	65	50%	0.504	37%	0.37	S	S	.	.	H	α-helix	trans	-59.2	-47	175.4	-175.7	-176.8	174.8	-172.1	0	112.1	M29 H30 A31 C35 R36 E37	M29-K33 WeakPolarHBondContact O-CB 3.36Å; M29-K33 PolarHBondContact O-N 3.18Å; H30-K33 PolarHBondContact O-N 2.92Å; A31-K33 VanDerWaalsContact C-N 3.33Å; A31-K33 PolarHBondContact O-N 2.8Å; K33-C35 VanDerWaalsContact C-N 3.34Å; K33-C35 PolarHBondContact O-N 3.26Å; K33-R36 WeakPolarHBondContact O-CB 3.27Å; K33-R36 PolarHBondContact O-N 3.43Å; K33-E37 WeakPolarHBondContact CE-OE1 3.37Å; K33-E37 WeakPolarHBondContact O-CG 3.34Å; K33-E37 PolarHBondContact O-N 3.35Å
34	A	98	Very high	97.9	Very high	6 Å²	6	61.4 Å²	61.4	5%	0.05	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-39.3	177.7	0	0	0	0	0	112.1	F21 K24 H30 A31 S38	F21-A34 HydrophobicContact CD2-CB 4.14Å; F21-A34 HydrophobicContact CE2-CB 3.82Å; K24-A34 HydrophobicContact CB-CB 4.31Å; H30-A34 WeakPolarHBondContact O-CB 3.42Å; H30-A34 PolarHBondContact O-N 3Å; A31-A34 PolarHBondContact O-N 3.28Å; A34-S38 WeakPolarHBondContact O-CB 3.12Å; A34-S38 PolarHBondContact O-N 2.94Å; A34-S38 VanDerWaalsContact O-N 3.09Å; A34-S38 PolarHBondContact O-OG 3.34Å
35	C	98.1	Very high	97.9	Very high	37 Å²	37	60.6 Å²	60.6	25%	0.25	35%	0.347	C	S	.	.	H	α-helix	trans	-62.5	-46.1	172.4	-70.6	0	0	0	0	111.8	A31 V32 K33 E37 S38 L39 L70	A31-C35 PolarHBondContact O-N 2.91Å; A31-C35 PolarHBondContact O-SG 3.48Å; A31-C35 VanDerWaalsContact O-SG 3.34Å; V32-C35 WeakPolarHBondContact O-CB 3.49Å; V32-C35 PolarHBondContact O-N 3.33Å; K33-C35 VanDerWaalsContact C-N 3.34Å; K33-C35 PolarHBondContact O-N 3.26Å; C35-E37 PolarHBondContact O-N 2.91Å; C35-S38 PolarHBondContact O-N 3.2Å; C35-L39 WeakPolarHBondContact O-CB 3.27Å; C35-L39 VanDerWaalsContact O-CG 3.27Å; C35-L39 WeakPolarHBondContact O-CG 3.31Å; C35-L39 PolarHBondContact O-N 3.49Å; C35-L70 HydrophobicContact CB-CD1 3.97Å
36	R	98.2	Very high	98	Very high	91 Å²	91	62.1 Å²	62.1	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-56.6	-49.6	176.6	169.6	172.5	-172.6	-77.4	-1	111.7	V32 K33 S38 L39 I40 E46 F62 L70	V32-R36 WeakPolarHBondContact O-CB 3.47Å; V32-R36 PolarHBondContact O-N 2.97Å; K33-R36 WeakPolarHBondContact O-CB 3.27Å; K33-R36 PolarHBondContact O-N 3.43Å; R36-S38 VanDerWaalsContact C-N 3.31Å; R36-S38 PolarHBondContact O-N 3.09Å; R36-L39 PolarHBondContact O-N 3.23Å; R36-I40 HydrophobicContact CG-CD1 3.79Å; R36-I40 VanDerWaalsContact O-CG1 3.31Å; R36-I40 WeakPolarHBondContact O-CG1 3.44Å; R36-I40 PolarHBondContact O-N 3.47Å; R36-E46 WeakPolarHBondContact CD-OE1 3.45Å; R36-E46 IonicContact CZ-OE1 2.79Å; R36-E46 IonicContact CZ-OE2 3.09Å; R36-E46 IonicContact NE-OE1 3.93Å; R36-E46 PolarHBondContact NE-OE1 3.41Å; R36-E46 IonicContact NE-OE2 3.79Å; R36-E46 PolarHBondContact NE-OE2 2.94Å; R36-E46 IonicContact NH2-OE2 2.63Å; R36-E46 PolarHBondContact NH2-OE2 3.24Å; R36-F62 HydrophobicContact CB-CE2 4.05Å; R36-F62 HydrophobicContact CB-CZ 4.38Å; R36-F62 HydrophobicContact CG-CE2 3.71Å; R36-F62 HydrophobicContact CG-CZ 3.69Å; R36-L70 HydrophobicContact CB-CD1 4.46Å
37	E	97.9	Very high	98.1	Very high	94 Å²	94	57.8 Å²	57.8	44%	0.439	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-43.4	177.2	-71.8	170	-177.7	0	0	111.8	K33 C35 S41	K33-E37 WeakPolarHBondContact CE-OE1 3.37Å; K33-E37 WeakPolarHBondContact O-CG 3.34Å; K33-E37 PolarHBondContact O-N 3.35Å; C35-E37 PolarHBondContact O-N 2.91Å; E37-S41 WeakPolarHBondContact O-CB 3.42Å; E37-S41 PolarHBondContact O-N 2.9Å
38	S	97.7	Very high	98	Very high	75 Å²	75	61.5 Å²	61.5	52%	0.524	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-41.2	177.8	-56.9	0	0	0	0	112.2	A34 C35 R36 S41 A42	A34-S38 WeakPolarHBondContact O-CB 3.12Å; A34-S38 PolarHBondContact O-N 2.94Å; A34-S38 VanDerWaalsContact O-N 3.09Å; A34-S38 PolarHBondContact O-OG 3.34Å; C35-S38 PolarHBondContact O-N 3.2Å; R36-S38 VanDerWaalsContact C-N 3.31Å; R36-S38 PolarHBondContact O-N 3.09Å; S38-S41 PolarHBondContact O-N 2.82Å; S38-A42 WeakPolarHBondContact O-CB 3.38Å; S38-A42 PolarHBondContact O-N 3.24Å
39	L	98.5	Very high	97.9	Very high	27 Å²	27	65.2 Å²	65.2	14%	0.141	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-45.3	178.4	-74	164.2	0	0	0	111.9	C35 R36 S41 A42 G43 F44 F62 L70 A72	C35-L39 WeakPolarHBondContact O-CB 3.27Å; C35-L39 VanDerWaalsContact O-CG 3.27Å; C35-L39 WeakPolarHBondContact O-CG 3.31Å; C35-L39 PolarHBondContact O-N 3.49Å; R36-L39 PolarHBondContact O-N 3.23Å; L39-S41 VanDerWaalsContact C-N 3.31Å; L39-S41 PolarHBondContact O-N 3.3Å; L39-A42 CarbonylContact O-C 3.59Å; L39-A42 WeakPolarHBondContact O-CA 3.45Å; L39-A42 PolarHBondContact O-N 2.96Å; L39-G43 PolarHBondContact O-N 2.79Å; L39-F44 HydrophobicContact CB-CB 4.04Å; L39-F44 HydrophobicContact CB-CD2 4.39Å; L39-F44 HydrophobicContact CB-CG 4.19Å; L39-F44 HydrophobicContact CD2-CD1 3.9Å; L39-F44 HydrophobicContact CD2-CD2 3.81Å; L39-F44 HydrophobicContact CD2-CE1 3.99Å; L39-F44 HydrophobicContact CD2-CE2 3.87Å; L39-F44 HydrophobicContact CD2-CG 3.84Å; L39-F44 HydrophobicContact CD2-CZ 3.97Å; L39-F44 WeakPolarHBondContact O-CB 3.43Å; L39-F44 WeakPolarHBondContact O-CD2 3.42Å; L39-F44 PolarHBondContact O-N 2.98Å; L39-F62 HydrophobicContact CB-CD1 4.12Å; L39-F62 HydrophobicContact CB-CE1 4.32Å; L39-F62 HydrophobicContact CB-CG 4.5Å; L39-F62 HydrophobicContact CD1-CB 4.01Å; L39-F62 HydrophobicContact CD1-CD1 4.39Å; L39-F62 HydrophobicContact CD1-CD2 4.26Å; L39-F62 HydrophobicContact CD1-CG 3.95Å; L39-L70 HydrophobicContact CD1-CD1 3.79Å; L39-L70 HydrophobicContact CD1-CD2 3.64Å; L39-L70 HydrophobicContact CD1-CG 4.3Å; L39-A72 HydrophobicContact CD1-CB 3.87Å; L39-A72 HydrophobicContact CD2-CB 3.83Å
40	I	98.5	Very high	97.9	Very high	76 Å²	76	65.8 Å²	65.8	39%	0.39	37%	0.365	S	S	.	.	H	α-helix	trans	-58.2	-46.4	174.6	-69.3	168.5	0	0	0	109.8	R36 A42 G43 F62	R36-I40 HydrophobicContact CG-CD1 3.79Å; R36-I40 VanDerWaalsContact O-CG1 3.31Å; R36-I40 WeakPolarHBondContact O-CG1 3.44Å; R36-I40 PolarHBondContact O-N 3.47Å; I40-A42 PolarHBondContact O-N 2.92Å; I40-G43 PolarHBondContact O-N 2.85Å; I40-F62 HydrophobicContact CD1-CZ 4.24Å; I40-F62 HydrophobicContact CG1-CE1 3.93Å; I40-F62 HydrophobicContact CG1-CZ 3.97Å
41	S	98.2	Very high	97.8	Very high	108 Å²	108	66.2 Å²	66.2	76%	0.755	37%	0.37	S	S	*	.	H	α-helix	trans	-62.9	-25.3	176.5	-172.6	0	0	0	0	113.3	E37 S38 L39 G43	E37-S41 WeakPolarHBondContact O-CB 3.42Å; E37-S41 PolarHBondContact O-N 2.9Å; S38-S41 PolarHBondContact O-N 2.82Å; L39-S41 VanDerWaalsContact C-N 3.31Å; L39-S41 PolarHBondContact O-N 3.3Å; S41-G43 VanDerWaalsContact C-N 3.28Å
42	A	98.2	Very high	97.7	Very high	51 Å²	51	72.5 Å²	72.5	42%	0.421	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	5	175.4	0	0	0	0	0	113.6	S38 L39 I40 F44 K60	S38-A42 WeakPolarHBondContact O-CB 3.38Å; S38-A42 PolarHBondContact O-N 3.24Å; L39-A42 CarbonylContact O-C 3.59Å; L39-A42 WeakPolarHBondContact O-CA 3.45Å; L39-A42 PolarHBondContact O-N 2.96Å; I40-A42 PolarHBondContact O-N 2.92Å; A42-F44 HydrophobicContact CB-CD2 4.02Å; A42-F44 HydrophobicContact CB-CE2 4.19Å; A42-K60 PolarHBondContact O-NZ 3.36Å
43	G	98.3	Very high	97.7	Very high	54 Å²	54	77 Å²	77	56%	0.557	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	29.4	178.2	0	0	0	0	0	114	L39 I40 S41	L39-G43 PolarHBondContact O-N 2.79Å; I40-G43 PolarHBondContact O-N 2.85Å; S41-G43 VanDerWaalsContact C-N 3.28Å
44	F	98.6	Very high	97.5	Very high	37 Å²	37	80.5 Å²	80.5	16%	0.162	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-83.8	141.9	167.9	-73.3	-114.7	0	0	0	110.7	L39 A42 K60 Y61 F62 A72 V74	L39-F44 HydrophobicContact CB-CB 4.04Å; L39-F44 HydrophobicContact CB-CD2 4.39Å; L39-F44 HydrophobicContact CB-CG 4.19Å; L39-F44 HydrophobicContact CD2-CD1 3.9Å; L39-F44 HydrophobicContact CD2-CD2 3.81Å; L39-F44 HydrophobicContact CD2-CE1 3.99Å; L39-F44 HydrophobicContact CD2-CE2 3.87Å; L39-F44 HydrophobicContact CD2-CG 3.84Å; L39-F44 HydrophobicContact CD2-CZ 3.97Å; L39-F44 WeakPolarHBondContact O-CB 3.43Å; L39-F44 WeakPolarHBondContact O-CD2 3.42Å; L39-F44 PolarHBondContact O-N 2.98Å; A42-F44 HydrophobicContact CB-CD2 4.02Å; A42-F44 HydrophobicContact CB-CE2 4.19Å; F44-K60 WeakPolarHBondContact CA-O 3.48Å; F44-K60 HydrophobicContact CB-CB 4.28Å; F44-K60 HydrophobicContact CD1-CB 3.66Å; F44-K60 HydrophobicContact CD2-CB 4.01Å; F44-K60 HydrophobicContact CD2-CD 3.93Å; F44-K60 HydrophobicContact CE1-CB 3.88Å; F44-K60 HydrophobicContact CE2-CB 4.23Å; F44-K60 HydrophobicContact CE2-CD 3.8Å; F44-K60 HydrophobicContact CE2-CG 4.41Å; F44-K60 HydrophobicContact CG-CB 3.71Å; F44-K60 HydrophobicContact CG-CD 4.47Å; F44-K60 HydrophobicContact CZ-CB 4.15Å; F44-K60 HydrophobicContact CZ-CD 4.23Å; F44-K60 HydrophobicContact CZ-CG 4.39Å; F44-Y61 WeakPolarHBondContact CD1-O 3.36Å; F44-F62 HydrophobicContact CB-CD1 3.81Å; F44-F62 HydrophobicContact CB-CE1 4.33Å; F44-A72 HydrophobicContact CD1-CB 4.46Å; F44-A72 HydrophobicContact CE1-CB 4.21Å; F44-V74 HydrophobicContact CE1-CG2 3.76Å; F44-V74 HydrophobicContact CZ-CG2 3.65Å
45	E	98.3	Very high	97.3	Very high	113 Å²	113	83.5 Å²	83.5	53%	0.528	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.4	171.4	-177	-179.6	161.2	0	0	110	K60 Y61 F62	E45-K60 PolarHBondContact N-O 2.85Å; E45-Y61 HydrophobicContact CB-CD1 3.94Å; E45-Y61 HydrophobicContact CB-CE1 4.23Å; E45-Y61 HydrophobicContact CG-CD1 4.39Å; E45-Y61 CarbonylContact O-C 3.55Å; E45-Y61 VanDerWaalsContact O-CA 3.27Å; E45-Y61 WeakPolarHBondContact O-CA 3.46Å; E45-Y61 WeakPolarHBondContact OE2-CE1 3.16Å; E45-F62 WeakPolarHBondContact O-CD1 3.45Å; E45-F62 PolarHBondContact O-N 2.88Å
46	E	98.1	Very high	97.1	Very high	56 Å²	56	84.9 Å²	84.9	26%	0.262	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131.9	171.5	-168.7	164.6	-148.7	0	0	109.9	R36 F62	R36-E46 WeakPolarHBondContact CD-OE1 3.45Å; R36-E46 IonicContact CZ-OE1 2.79Å; R36-E46 IonicContact CZ-OE2 3.09Å; R36-E46 IonicContact NE-OE1 3.93Å; R36-E46 PolarHBondContact NE-OE1 3.41Å; R36-E46 IonicContact NE-OE2 3.79Å; R36-E46 PolarHBondContact NE-OE2 2.94Å; R36-E46 IonicContact NH2-OE2 2.63Å; R36-E46 PolarHBondContact NH2-OE2 3.24Å; E46-F62 CarbonylContact C-O 3.49Å; E46-F62 WeakPolarHBondContact CA-O 3.3Å; E46-F62 HydrophobicContact CB-CD1 4.38Å; E46-F62 HydrophobicContact CB-CE1 3.6Å; E46-F62 HydrophobicContact CB-CE2 4Å; E46-F62 HydrophobicContact CB-CZ 3.37Å; E46-F62 HydrophobicContact CG-CD2 4.34Å; E46-F62 HydrophobicContact CG-CE1 4.17Å; E46-F62 HydrophobicContact CG-CE2 3.61Å; E46-F62 HydrophobicContact CG-CZ 3.52Å; E46-F62 WeakPolarHBondContact OE1-CE2 3.47Å
47	L	98.2	Very high	96.9	Very high	17 Å²	17	84.6 Å²	84.6	9%	0.089	48%	0.475	C	S	.	.			trans	-105.2	139.4	174.4	-60.2	178.6	0	0	0	110	W53 L55 Y61 F62 F73	L47-W53 HydrophobicContact CD1-CD2 3.8Å; L47-W53 HydrophobicContact CD1-CE3 4.04Å; L47-W53 HydrophobicContact CD1-CG 4.04Å; L47-L55 HydrophobicContact CD1-CD2 3.8Å; L47-Y61 HydrophobicContact CD1-CD1 4.02Å; L47-Y61 HydrophobicContact CD1-CG 4.01Å; L47-Y61 HydrophobicContact CD2-CD1 3.78Å; L47-Y61 HydrophobicContact CD2-CE1 4.36Å; L47-Y61 HydrophobicContact CG-CD1 3.99Å; L47-Y61 HydrophobicContact CG-CG 4.38Å; L47-F62 PolarHBondContact N-O 3.33Å; L47-F73 HydrophobicContact CD1-CE1 4.42Å; L47-F73 HydrophobicContact CD1-CZ 3.84Å
48	E	96.5	Very high	96.7	Very high	118 Å²	118	89.9 Å²	89.9	55%	0.551	49%	0.49	S	S	*	.			trans	-80.4	129.8	168.4	-69.9	-60.5	158.3	0	0	110.3	S50 D51 W53	E48-S50 PolarHBondContact O-N 3.17Å; E48-D51 HydrophobicContact CB-CB 4.2Å; E48-D51 PolarHBondContact O-N 3.5Å; E48-D51 VanDerWaalsContact O-N 3.17Å; E48-W53 PolarHBondContact O-NE1 3.21Å
49	E	95.3	Very high	96.7	Very high	99 Å²	99	86.9 Å²	86.9	46%	0.463	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.4	-176	-168.7	-169.9	176.9	0	0	112.6	D51 V63 K65	E49-D51 VanDerWaalsContact C-N 3.31Å; E49-D51 PolarHBondContact O-N 2.93Å; E49-V63 HydrophobicContact CB-CG2 3.95Å; E49-V63 HydrophobicContact CG-CG2 4.45Å; E49-K65 WeakPolarHBondContact OE1-CD 3.5Å; E49-K65 IonicContact OE1-NZ 2.68Å; E49-K65 PolarHBondContact OE1-NZ 2.63Å; E49-K65 WeakPolarHBondContact OE2-CD 3.42Å; E49-K65 WeakPolarHBondContact OE2-CE 3.41Å; E49-K65 IonicContact OE2-NZ 2.66Å; E49-K65 PolarHBondContact OE2-NZ 3.25Å
50	S	95.9	Very high	96.7	Very high	107 Å²	107	89.9 Å²	89.9	75%	0.748	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.7	-179.5	52.1	0	0	0	0	114.3	E48	E48-S50 PolarHBondContact O-N 3.17Å
51	D	96.2	Very high	96.7	Very high	99 Å²	99	86.7 Å²	86.7	53%	0.529	47%	0.467	S	S	.	.	S	Bend	trans	-90	157.1	-168.7	-74	4.1	0	0	0	112.5	E48 E49 W53	E48-D51 HydrophobicContact CB-CB 4.2Å; E48-D51 PolarHBondContact O-N 3.5Å; E48-D51 VanDerWaalsContact O-N 3.17Å; E49-D51 VanDerWaalsContact C-N 3.31Å; E49-D51 PolarHBondContact O-N 2.93Å; D51-W53 PolarHBondContact O-N 3.41Å; D51-W53 PolarHBondContact O-NE1 3.14Å
52	V	97.3	Very high	96.7	Very high	136 Å²	136	81.5 Å²	81.5	82%	0.824	43%	0.431	S	S	*	.			trans	-76.7	110.9	168.5	179.3	0	0	0	0	108.8	K54	V52-K54 PolarHBondContact O-N 2.9Å
53	W	96.9	Very high	96.7	Very high	101 Å²	101	79.8 Å²	79.8	38%	0.383	42%	0.415	S	S	.	.			trans	-74.8	128.1	-176.3	-57.9	-11.6	0	0	0	112.5	L47 E48 D51 L55 V63 F73	L47-W53 HydrophobicContact CD1-CD2 3.8Å; L47-W53 HydrophobicContact CD1-CE3 4.04Å; L47-W53 HydrophobicContact CD1-CG 4.04Å; E48-W53 PolarHBondContact O-NE1 3.21Å; D51-W53 PolarHBondContact O-N 3.41Å; D51-W53 PolarHBondContact O-NE1 3.14Å; W53-L55 HydrophobicContact CB-CD2 4.01Å; W53-L55 HydrophobicContact CB-CG 4.14Å; W53-V63 HydrophobicContact CH2-CG1 4.2Å; W53-V63 HydrophobicContact CZ2-CB 4.37Å; W53-V63 HydrophobicContact CZ2-CG1 4.47Å; W53-V63 HydrophobicContact CZ2-CG2 4.28Å; W53-F73 HydrophobicContact CE3-CZ 4.44Å; W53-F73 HydrophobicContact CZ3-CE1 4.45Å; W53-F73 HydrophobicContact CZ3-CZ 4.24Å
54	K	94.7	Very high	96.7	Very high	188 Å²	188	79 Å²	79	82%	0.817	40%	0.399	S	S	*	.			trans	-106.8	90	170.9	-67.9	-178.2	-176.7	174.5	0	109.5	V52	V52-K54 PolarHBondContact O-N 2.9Å
55	L	94.4	Very high	96.6	Very high	69 Å²	69	81.6 Å²	81.6	36%	0.361	41%	0.41	S	S	.	.			trans	-89	139.5	-174.9	-53.7	178.6	0	0	0	111.2	L47 W53 Y61 F73 L75	L47-L55 HydrophobicContact CD1-CD2 3.8Å; W53-L55 HydrophobicContact CB-CD2 4.01Å; W53-L55 HydrophobicContact CB-CG 4.14Å; L55-Y61 HydrophobicContact CB-CE2 4.28Å; L55-Y61 HydrophobicContact CD2-CD1 4.17Å; L55-Y61 HydrophobicContact CD2-CD2 3.84Å; L55-Y61 HydrophobicContact CD2-CE1 4.19Å; L55-Y61 HydrophobicContact CD2-CE2 3.87Å; L55-Y61 HydrophobicContact CD2-CG 3.99Å; L55-F73 HydrophobicContact CD1-CE2 4.09Å; L55-F73 HydrophobicContact CD1-CZ 4.47Å; L55-F73 HydrophobicContact CD2-CE2 4.27Å; L55-F73 HydrophobicContact CD2-CZ 4.35Å; L55-L75 HydrophobicContact CB-CD1 3.88Å; L55-L75 HydrophobicContact CD1-CD1 4.31Å; L55-L75 HydrophobicContact CG-CD1 4.5Å
56	S	93.5	Very high	96.4	Very high	67 Å²	67	82.2 Å²	82.2	47%	0.469	42%	0.417	S	S	.	.			trans	-111.1	146.6	176.6	-64.7	0	0	0	0	111.7	G59 Y61	S56-G59 WeakPolarHBondContact O-CA 3.44Å; S56-G59 PolarHBondContact O-N 3.06Å; S56-Y61 PolarHBondContact N-OH 3.29Å
57	P	93.2	Very high	96.2	Very high	85 Å²	85	80.5 Å²	80.5	55%	0.552	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	142.6	169.2	-23.7	33.7	0	0	0	111.3	G59	P57-G59 PolarHBondContact O-N 3.38Å; P57-G59 VanDerWaalsContact O-N 3.16Å
58	R	95.3	Very high	96.2	Very high	204 Å²	204	82.7 Å²	82.7	77%	0.77	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	2.1	-171.9	-53.3	179.1	167.3	-109.9	0.4	115.1	L75	R58-L75 WeakPolarHBondContact CA-O 2.94Å; R58-L75 PolarHBondContact N-O 3.3Å
59	G	96.7	Very high	96.2	Very high	13 Å²	13	79.2 Å²	79.2	13%	0.134	42%	0.42	C	S	.	.			trans	-68.7	149.4	175	0	0	0	0	0	112.2	S56 P57 Y61 V74 L75	S56-G59 WeakPolarHBondContact O-CA 3.44Å; S56-G59 PolarHBondContact O-N 3.06Å; P57-G59 PolarHBondContact O-N 3.38Å; P57-G59 VanDerWaalsContact O-N 3.16Å; G59-Y61 VanDerWaalsContact C-CE2 3.49Å; G59-V74 WeakPolarHBondContact O-CA 3.38Å; G59-L75 PolarHBondContact O-N 2.93Å
60	K	98.4	Very high	96.4	Very high	89 Å²	89	76.8 Å²	76.8	39%	0.387	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.3	179	-61.5	-178.5	-177.5	178.3	0	107.9	A42 F44 E45 V74	A42-K60 PolarHBondContact O-NZ 3.36Å; F44-K60 WeakPolarHBondContact CA-O 3.48Å; F44-K60 HydrophobicContact CB-CB 4.28Å; F44-K60 HydrophobicContact CD1-CB 3.66Å; F44-K60 HydrophobicContact CD2-CB 4.01Å; F44-K60 HydrophobicContact CD2-CD 3.93Å; F44-K60 HydrophobicContact CE1-CB 3.88Å; F44-K60 HydrophobicContact CE2-CB 4.23Å; F44-K60 HydrophobicContact CE2-CD 3.8Å; F44-K60 HydrophobicContact CE2-CG 4.41Å; F44-K60 HydrophobicContact CG-CB 3.71Å; F44-K60 HydrophobicContact CG-CD 4.47Å; F44-K60 HydrophobicContact CZ-CB 4.15Å; F44-K60 HydrophobicContact CZ-CD 4.23Å; F44-K60 HydrophobicContact CZ-CG 4.39Å; E45-K60 PolarHBondContact N-O 2.85Å; K60-V74 HydrophobicContact CB-CG2 4.38Å; K60-V74 HydrophobicContact CG-CG1 4.11Å; K60-V74 HydrophobicContact CG-CG2 3.98Å
61	Y	98.6	Very high	96.5	Very high	9 Å²	9	77.1 Å²	77.1	4%	0.035	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	151.6	-171.1	-56.1	-78.5	0	0	0	111.1	F44 E45 L47 L55 S56 G59 A72 F73 L75	F44-Y61 WeakPolarHBondContact CD1-O 3.36Å; E45-Y61 HydrophobicContact CB-CD1 3.94Å; E45-Y61 HydrophobicContact CB-CE1 4.23Å; E45-Y61 HydrophobicContact CG-CD1 4.39Å; E45-Y61 CarbonylContact O-C 3.55Å; E45-Y61 VanDerWaalsContact O-CA 3.27Å; E45-Y61 WeakPolarHBondContact O-CA 3.46Å; E45-Y61 WeakPolarHBondContact OE2-CE1 3.16Å; L47-Y61 HydrophobicContact CD1-CD1 4.02Å; L47-Y61 HydrophobicContact CD1-CG 4.01Å; L47-Y61 HydrophobicContact CD2-CD1 3.78Å; L47-Y61 HydrophobicContact CD2-CE1 4.36Å; L47-Y61 HydrophobicContact CG-CD1 3.99Å; L47-Y61 HydrophobicContact CG-CG 4.38Å; L55-Y61 HydrophobicContact CB-CE2 4.28Å; L55-Y61 HydrophobicContact CD2-CD1 4.17Å; L55-Y61 HydrophobicContact CD2-CD2 3.84Å; L55-Y61 HydrophobicContact CD2-CE1 4.19Å; L55-Y61 HydrophobicContact CD2-CE2 3.87Å; L55-Y61 HydrophobicContact CD2-CG 3.99Å; S56-Y61 PolarHBondContact N-OH 3.29Å; G59-Y61 VanDerWaalsContact C-CE2 3.49Å; Y61-A72 CarbonylContact O-C 3.49Å; Y61-A72 WeakPolarHBondContact O-CA 3.4Å; Y61-F73 HydrophobicContact CD2-CD2 4.36Å; Y61-F73 AromaticContact CD2-CE2 3.81Å; Y61-F73 HydrophobicContact CD2-CE2 3.81Å; Y61-F73 HydrophobicContact CD2-CZ 4.42Å; Y61-F73 HydrophobicContact CG-CE2 4.12Å; Y61-F73 HydrophobicContact CG-CZ 4.29Å; Y61-F73 PolarHBondContact N-O 2.96Å; Y61-F73 PolarHBondContact O-N 2.68Å; Y61-F73 VanDerWaalsContact O-O 3.09Å; Y61-L75 HydrophobicContact CD2-CD1 3.53Å; Y61-L75 HydrophobicContact CE2-CD1 3.32Å
62	F	98.6	Very high	96.6	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.8	165.6	75	-78.8	0	0	0	111	R36 L39 I40 F44 E45 E46 L47 T64 L70 I71 A72	R36-F62 HydrophobicContact CB-CE2 4.05Å; R36-F62 HydrophobicContact CB-CZ 4.38Å; R36-F62 HydrophobicContact CG-CE2 3.71Å; R36-F62 HydrophobicContact CG-CZ 3.69Å; L39-F62 HydrophobicContact CB-CD1 4.12Å; L39-F62 HydrophobicContact CB-CE1 4.32Å; L39-F62 HydrophobicContact CB-CG 4.5Å; L39-F62 HydrophobicContact CD1-CB 4.01Å; L39-F62 HydrophobicContact CD1-CD1 4.39Å; L39-F62 HydrophobicContact CD1-CD2 4.26Å; L39-F62 HydrophobicContact CD1-CG 3.95Å; I40-F62 HydrophobicContact CD1-CZ 4.24Å; I40-F62 HydrophobicContact CG1-CE1 3.93Å; I40-F62 HydrophobicContact CG1-CZ 3.97Å; F44-F62 HydrophobicContact CB-CD1 3.81Å; F44-F62 HydrophobicContact CB-CE1 4.33Å; E45-F62 WeakPolarHBondContact O-CD1 3.45Å; E45-F62 PolarHBondContact O-N 2.88Å; E46-F62 CarbonylContact C-O 3.49Å; E46-F62 WeakPolarHBondContact CA-O 3.3Å; E46-F62 HydrophobicContact CB-CD1 4.38Å; E46-F62 HydrophobicContact CB-CE1 3.6Å; E46-F62 HydrophobicContact CB-CE2 4Å; E46-F62 HydrophobicContact CB-CZ 3.37Å; E46-F62 HydrophobicContact CG-CD2 4.34Å; E46-F62 HydrophobicContact CG-CE1 4.17Å; E46-F62 HydrophobicContact CG-CE2 3.61Å; E46-F62 HydrophobicContact CG-CZ 3.52Å; E46-F62 WeakPolarHBondContact OE1-CE2 3.47Å; L47-F62 PolarHBondContact N-O 3.33Å; F62-T64 HydrophobicContact CD2-CG2 4.14Å; F62-T64 HydrophobicContact CE2-CG2 4.06Å; F62-L70 HydrophobicContact CD2-CD1 3.91Å; F62-L70 HydrophobicContact CD2-CG 4.3Å; F62-L70 HydrophobicContact CE2-CD1 4.43Å; F62-I71 CarbonylContact C-O 3.6Å; F62-I71 WeakPolarHBondContact CA-O 3.49Å; F62-I71 WeakPolarHBondContact CB-O 3.3Å; F62-A72 HydrophobicContact CB-CB 3.85Å
63	V	98.4	Very high	96.6	Very high	15 Å²	15	70.7 Å²	70.7	9%	0.091	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.8	173.9	60.2	0	0	0	0	108.3	E49 W53 L70 I71	E49-V63 HydrophobicContact CB-CG2 3.95Å; E49-V63 HydrophobicContact CG-CG2 4.45Å; W53-V63 HydrophobicContact CH2-CG1 4.2Å; W53-V63 HydrophobicContact CZ2-CB 4.37Å; W53-V63 HydrophobicContact CZ2-CG1 4.47Å; W53-V63 HydrophobicContact CZ2-CG2 4.28Å; V63-L70 WeakPolarHBondContact O-CA 3.36Å; V63-I71 HydrophobicContact CG1-CB 4.08Å; V63-I71 PolarHBondContact N-O 2.66Å; V63-I71 PolarHBondContact O-N 3.14Å
64	T	97.8	Very high	96.6	Very high	36 Å²	36	69.9 Å²	69.9	22%	0.221	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.2	171.5	71.8	0	0	0	0	110.5	V32 F62 A69 L70	V32-T64 HydrophobicContact CG1-CG2 3.88Å; F62-T64 HydrophobicContact CD2-CG2 4.14Å; F62-T64 HydrophobicContact CE2-CG2 4.06Å; T64-A69 CarbonylContact C-O 3.52Å; T64-A69 VanDerWaalsContact CA-O 3.26Å; T64-A69 WeakPolarHBondContact CA-O 3.26Å; T64-L70 HydrophobicContact CG2-CB 4.46Å; T64-L70 HydrophobicContact CG2-CD1 3.97Å; T64-L70 HydrophobicContact CG2-CG 4.28Å
65	K	96.1	Very high	96.7	Very high	92 Å²	92	61.7 Å²	61.7	40%	0.4	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.5	174.3	-175.8	71.2	178.9	-174.7	0	108.9	E49 G67 T68 A69	E49-K65 WeakPolarHBondContact OE1-CD 3.5Å; E49-K65 IonicContact OE1-NZ 2.68Å; E49-K65 PolarHBondContact OE1-NZ 2.63Å; E49-K65 WeakPolarHBondContact OE2-CD 3.42Å; E49-K65 WeakPolarHBondContact OE2-CE 3.41Å; E49-K65 IonicContact OE2-NZ 2.66Å; E49-K65 PolarHBondContact OE2-NZ 3.25Å; K65-G67 PolarHBondContact O-N 3.01Å; K65-T68 PolarHBondContact O-N 2.99Å; K65-A69 HydrophobicContact CB-CB 4.27Å; K65-A69 PolarHBondContact N-O 2.89Å; K65-A69 PolarHBondContact O-N 3.29Å; K65-A69 VanDerWaalsContact O-N 3.14Å
66	N	94	Very high	96.6	Very high	127 Å²	127	60.5 Å²	60.5	68%	0.679	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	17.9	179.7	-56.9	-22	0	0	0	114.4	M29 T68	M29-N66 VanDerWaalsContact SD-O 3.4Å; N66-T68 PolarHBondContact O-N 3.45Å; N66-T68 VanDerWaalsContact O-N 3.16Å
67	G	94.6	Very high	96.6	Very high	20 Å²	20	58.8 Å²	58.8	21%	0.206	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	0.6	-170.1	0	0	0	0	0	115.7	M29 V32 K65	M29-G67 WeakPolarHBondContact CA-O 3.47Å; V32-G67 WeakPolarHBondContact CB-O 3.45Å; V32-G67 WeakPolarHBondContact CG1-O 3.4Å; V32-G67 WeakPolarHBondContact CG2-O 3.49Å; K65-G67 PolarHBondContact O-N 3.01Å
68	T	96.9	Very high	96.5	Very high	62 Å²	62	61.8 Å²	61.8	38%	0.38	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-9	-177.8	55.3	0	0	0	0	114.1	P28 M29 K65 N66 V92	P28-T68 HydrophobicContact CB-CG2 4.49Å; M29-T68 HydrophobicContact CG-CG2 4.06Å; M29-T68 HydrophobicContact SD-CG2 3.28Å; M29-T68 WeakPolarHBondContact SD-CG2 3.19Å; K65-T68 PolarHBondContact O-N 2.99Å; N66-T68 PolarHBondContact O-N 3.45Å; N66-T68 VanDerWaalsContact O-N 3.16Å; T68-V92 WeakPolarHBondContact O-CG2 3.28Å
69	A	97.8	Very high	96.2	Very high	46 Å²	46	56.5 Å²	56.5	38%	0.38	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.2	171	0	0	0	0	0	110.5	T64 K65	T64-A69 CarbonylContact C-O 3.52Å; T64-A69 VanDerWaalsContact CA-O 3.26Å; T64-A69 WeakPolarHBondContact CA-O 3.26Å; K65-A69 HydrophobicContact CB-CB 4.27Å; K65-A69 PolarHBondContact N-O 2.89Å; K65-A69 PolarHBondContact O-N 3.29Å; K65-A69 VanDerWaalsContact O-N 3.14Å
70	L	98.2	Very high	95.9	Very high	48 Å²	48	58.9 Å²	58.9	25%	0.251	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	137.6	-178.4	-177.6	148.9	0	0	0	109.8	V32 C35 R36 L39 F62 V63 T64 A72	V32-L70 HydrophobicContact CG1-CB 4.21Å; V32-L70 HydrophobicContact CG1-CD1 4.27Å; V32-L70 HydrophobicContact CG2-CB 4.38Å; C35-L70 HydrophobicContact CB-CD1 3.97Å; R36-L70 HydrophobicContact CB-CD1 4.46Å; L39-L70 HydrophobicContact CD1-CD1 3.79Å; L39-L70 HydrophobicContact CD1-CD2 3.64Å; L39-L70 HydrophobicContact CD1-CG 4.3Å; F62-L70 HydrophobicContact CD2-CD1 3.91Å; F62-L70 HydrophobicContact CD2-CG 4.3Å; F62-L70 HydrophobicContact CE2-CD1 4.43Å; V63-L70 WeakPolarHBondContact O-CA 3.36Å; T64-L70 HydrophobicContact CG2-CB 4.46Å; T64-L70 HydrophobicContact CG2-CD1 3.97Å; T64-L70 HydrophobicContact CG2-CG 4.28Å; L70-A72 HydrophobicContact CD2-CB 4.03Å
71	I	98.4	Very high	95.5	Very high	113 Å²	113	60.4 Å²	60.4	58%	0.579	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	123.2	170	-59.2	173.9	0	0	0	107.2	F62 V63 F73	F62-I71 CarbonylContact C-O 3.6Å; F62-I71 WeakPolarHBondContact CA-O 3.49Å; F62-I71 WeakPolarHBondContact CB-O 3.3Å; V63-I71 HydrophobicContact CG1-CB 4.08Å; V63-I71 PolarHBondContact N-O 2.66Å; V63-I71 PolarHBondContact O-N 3.14Å; I71-F73 HydrophobicContact CG2-CD1 4.32Å
72	A	98.5	Very high	95.2	Very high	45 Å²	45	64.1 Å²	64.1	37%	0.372	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.2	172.8	0	0	0	0	0	110	L39 F44 Y61 F62 L70	L39-A72 HydrophobicContact CD1-CB 3.87Å; L39-A72 HydrophobicContact CD2-CB 3.83Å; F44-A72 HydrophobicContact CD1-CB 4.46Å; F44-A72 HydrophobicContact CE1-CB 4.21Å; Y61-A72 CarbonylContact O-C 3.49Å; Y61-A72 WeakPolarHBondContact O-CA 3.4Å; F62-A72 HydrophobicContact CB-CB 3.85Å; L70-A72 HydrophobicContact CD2-CB 4.03Å
73	F	97.9	Very high	94.8	Very high	55 Å²	55	71.3 Å²	71.3	24%	0.241	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	153.5	-178.6	59.3	-86	0	0	0	111.8	L47 W53 L55 Y61 I71 L75	L47-F73 HydrophobicContact CD1-CE1 4.42Å; L47-F73 HydrophobicContact CD1-CZ 3.84Å; W53-F73 HydrophobicContact CE3-CZ 4.44Å; W53-F73 HydrophobicContact CZ3-CE1 4.45Å; W53-F73 HydrophobicContact CZ3-CZ 4.24Å; L55-F73 HydrophobicContact CD1-CE2 4.09Å; L55-F73 HydrophobicContact CD1-CZ 4.47Å; L55-F73 HydrophobicContact CD2-CE2 4.27Å; L55-F73 HydrophobicContact CD2-CZ 4.35Å; Y61-F73 HydrophobicContact CD2-CD2 4.36Å; Y61-F73 AromaticContact CD2-CE2 3.81Å; Y61-F73 HydrophobicContact CD2-CE2 3.81Å; Y61-F73 HydrophobicContact CD2-CZ 4.42Å; Y61-F73 HydrophobicContact CG-CE2 4.12Å; Y61-F73 HydrophobicContact CG-CZ 4.29Å; Y61-F73 PolarHBondContact N-O 2.96Å; Y61-F73 PolarHBondContact O-N 2.68Å; Y61-F73 VanDerWaalsContact O-O 3.09Å; I71-F73 HydrophobicContact CG2-CD1 4.32Å; F73-L75 HydrophobicContact CD2-CD1 4.38Å; F73-L75 HydrophobicContact CE2-CD1 4.19Å
74	V	97.1	Very high	94.5	Very high	84 Å²	84	75.9 Å²	75.9	51%	0.509	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.1	176.7	-177.5	0	0	0	0	108.2	F44 G59 K60	F44-V74 HydrophobicContact CE1-CG2 3.76Å; F44-V74 HydrophobicContact CZ-CG2 3.65Å; G59-V74 WeakPolarHBondContact O-CA 3.38Å; K60-V74 HydrophobicContact CB-CG2 4.38Å; K60-V74 HydrophobicContact CG-CG1 4.11Å; K60-V74 HydrophobicContact CG-CG2 3.98Å
75	L	95.4	Very high	94.3	Very high	17 Å²	17	79.5 Å²	79.5	9%	0.089	48%	0.481	C	S	.	.			trans	-83.9	127	174.3	-71.1	116.1	0	0	0	110.3	L55 R58 G59 Y61 F73 F79	L55-L75 HydrophobicContact CB-CD1 3.88Å; L55-L75 HydrophobicContact CD1-CD1 4.31Å; L55-L75 HydrophobicContact CG-CD1 4.5Å; R58-L75 WeakPolarHBondContact CA-O 2.94Å; R58-L75 PolarHBondContact N-O 3.3Å; G59-L75 PolarHBondContact O-N 2.93Å; Y61-L75 HydrophobicContact CD2-CD1 3.53Å; Y61-L75 HydrophobicContact CE2-CD1 3.32Å; F73-L75 HydrophobicContact CD2-CD1 4.38Å; F73-L75 HydrophobicContact CE2-CD1 4.19Å; L75-F79 HydrophobicContact CD2-CB 4.39Å; L75-F79 HydrophobicContact CD2-CD1 3.39Å; L75-F79 HydrophobicContact CD2-CE1 3.67Å; L75-F79 HydrophobicContact CD2-CG 3.85Å; L75-F79 HydrophobicContact CD2-CZ 4.35Å
76	G	93.8	Very high	94.3	Very high	43 Å²	43	84 Å²	84	44%	0.443	50%	0.503	S	S	.	.			trans	-59.8	149.3	170.5	0	0	0	0	0	111.4	N78 F79	G76-N78 PolarHBondContact O-N 3.04Å; G76-F79 WeakPolarHBondContact O-CB 3.45Å; G76-F79 PolarHBondContact O-N 3.47Å
77	G	93.3	Very high	94.4	Very high	31 Å²	31	85.7 Å²	85.7	32%	0.32	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.1	-179.1	0	0	0	0	0	114.6
78	N	91.5	Very high	94.6	Very high	149 Å²	149	91.7 Å²	91.7	80%	0.797	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	24.8	175.9	-60.5	-21.8	0	0	0	111.6	G76 T80	G76-N78 PolarHBondContact O-N 3.04Å; N78-T80 PolarHBondContact O-N 2.88Å
79	F	89.3	Confident	94.6	Very high	92 Å²	92	92.1 Å²	92.1	40%	0.404	56%	0.558	S	S	.	*			trans	-60.9	131.3	178.6	173.5	-97.6	0	0	0	110.4	L75 G76	L75-F79 HydrophobicContact CD2-CB 4.39Å; L75-F79 HydrophobicContact CD2-CD1 3.39Å; L75-F79 HydrophobicContact CD2-CE1 3.67Å; L75-F79 HydrophobicContact CD2-CG 3.85Å; L75-F79 HydrophobicContact CD2-CZ 4.35Å; G76-F79 WeakPolarHBondContact O-CB 3.45Å; G76-F79 PolarHBondContact O-N 3.47Å
80	T	89.8	Confident	94.6	Very high	64 Å²	64	96.3 Å²	96.3	39%	0.393	58%	0.579	S	S	.	*			trans	-133.8	146.6	169.2	57.5	0	0	0	0	107.7	N78 G82 R83	N78-T80 PolarHBondContact O-N 2.88Å; T80-G82 PolarHBondContact O-N 2.96Å; T80-R83 WeakPolarHBondContact O-CB 3.35Å; T80-R83 WeakPolarHBondContact O-CG 3.12Å; T80-R83 PolarHBondContact O-N 3.17Å; T80-R83 WeakPolarHBondContact OG1-CG 3.45Å; T80-R83 PolarHBondContact OG1-NE 3.18Å
81	P	90.1	Very high	94.5	Very high	121 Å²	121	100.2 Å²	100.2	79%	0.786	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	140	173.9	-28.3	35.9	0	0	0	112.2
82	G	91.1	Very high	94.4	Very high	87 Å²	87	97.4 Å²	97.4	90%	0.897	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	88.7	-3	-177.2	0	0	0	0	0	115.7	T80	T80-G82 PolarHBondContact O-N 2.96Å
83	R	90.2	Very high	94.3	Very high	150 Å²	150	99 Å²	99	57%	0.566	59%	0.586	S	S	*	*			trans	-72.1	154	172.4	-68.2	-77.3	-175	169.2	0.1	111.6	T80	T80-R83 WeakPolarHBondContact O-CB 3.35Å; T80-R83 WeakPolarHBondContact O-CG 3.12Å; T80-R83 PolarHBondContact O-N 3.17Å; T80-R83 WeakPolarHBondContact OG1-CG 3.45Å; T80-R83 PolarHBondContact OG1-NE 3.18Å
84	P	92.2	Very high	94.3	Very high	112 Å²	112	100.4 Å²	100.4	73%	0.727	60%	0.602	S	S	*	*			trans	-61	153.9	175.3	-21.4	32.9	0	0	0	112.9
85	V	94	Very high	94.3	Very high	111 Å²	111	103 Å²	103	67%	0.673	62%	0.621	S	S	*	*			trans	-114.2	135.4	175.7	179.4	0	0	0	0	108.9	M87	V85-M87 HydrophobicContact CG1-CB 4.37Å; V85-M87 HydrophobicContact CG1-CE 4.47Å
86	H	95.3	Very high	94.3	Very high	187 Å²	187	106 Å²	106	87%	0.866	64%	0.642	S	S	*	*			trans	-97.2	116.5	166.9	-63.7	-86.9	0	0	0	108
87	M	96.8	Very high	94.5	Very high	163 Å²	163	112.6 Å²	112.6	80%	0.803	67%	0.666	S	S	*	*			trans	-127.1	139.7	-173.6	-175.4	177.9	-75.3	0	0	110.6	V85	V85-M87 HydrophobicContact CG1-CB 4.37Å; V85-M87 HydrophobicContact CG1-CE 4.47Å
88	V	98.3	Very high	94.5	Very high	145 Å²	145	119.9 Å²	119.9	88%	0.879	68%	0.684	S	S	*	*			trans	-123.4	129.3	167.6	179.8	0	0	0	0	106.9
89	G	97.5	Very high	94.6	Very high	72 Å²	72	117.7 Å²	117.7	74%	0.742	69%	0.687	S	S	*	*			trans	-115.6	142.5	178.3	0	0	0	0	0	111.3
90	T	97.4	Very high	94.6	Very high	133 Å²	133	125 Å²	125	82%	0.816	71%	0.711	S	S	*	*			trans	-148.9	174.7	170.3	-170.3	0	0	0	0	108.8
91	H	97.2	Very high	94.4	Very high	131 Å²	131	131.5 Å²	131.5	61%	0.606	75%	0.752	S	S	*	*			trans	-115.4	157.2	171.7	67.2	98.5	0	0	0	110.3	D93	H91-D93 PolarHBondContact CE1-O 2.98Å; H91-D93 VanDerWaalsContact CE1-O 3.3Å; H91-D93 IonicContact CG-OD1 3.56Å; H91-D93 PolarHBondContact ND1-O 3.16Å; H91-D93 IonicContact ND1-OD1 2.93Å; H91-D93 PolarHBondContact ND1-OD1 2.93Å
92	V	96.4	Very high	94.6	Very high	54 Å²	54	132.1 Å²	132.1	33%	0.327	75%	0.75	S	S	.	*			trans	-108.9	-7.1	-176.8	-64.7	0	0	0	0	113.4	P28 A31 V32 T68	P28-V92 HydrophobicContact CB-CG2 4.16Å; A31-V92 HydrophobicContact CB-CB 4.17Å; V32-V92 HydrophobicContact CG2-CG2 4.27Å; T68-V92 WeakPolarHBondContact O-CG2 3.28Å
93	D	96.6	Very high	94.8	Very high	79 Å²	79	134.4 Å²	134.4	42%	0.422	74%	0.742	S	S	.	*			trans	-91.2	161.4	179.1	70.2	-42.6	0	0	0	112.3	P28 H91	P28-D93 HydrophobicContact CG-CB 4Å; H91-D93 PolarHBondContact CE1-O 2.98Å; H91-D93 VanDerWaalsContact CE1-O 3.3Å; H91-D93 IonicContact CG-OD1 3.56Å; H91-D93 PolarHBondContact ND1-O 3.16Å; H91-D93 IonicContact ND1-OD1 2.93Å; H91-D93 PolarHBondContact ND1-OD1 2.93Å
94	S	96.1	Very high	95	Very high	84 Å²	84	133.6 Å²	133.6	59%	0.587	75%	0.752	S	S	*	*			trans	-147.3	151.7	175.7	-66.7	0	0	0	0	109.1	C96	S94-C96 PolarHBondContact O-N 3.4Å; S94-C96 PolarHBondContact O-SG 3.22Å; S94-C96 VanDerWaalsContact O-SG 3.4Å
95	P	97.5	Very high	95.2	Very high	138 Å²	138	134.8 Å²	134.8	90%	0.896	75%	0.754	S	S	*	*			trans	-53.6	125.8	173.1	-25.3	34.7	0	0	0	110.8
96	C	96.1	Very high	95.2	Very high	80 Å²	80	136.3 Å²	136.3	54%	0.541	76%	0.759	S	S	.	*			trans	-153.3	158.7	-177.9	55.9	0	0	0	0	110.7	S94	S94-C96 PolarHBondContact O-N 3.4Å; S94-C96 PolarHBondContact O-SG 3.22Å; S94-C96 VanDerWaalsContact O-SG 3.4Å
97	L	97	Very high	95.2	Very high	181 Å²	181	132.9 Å²	132.9	95%	0.948	75%	0.752	S	S	*	*			trans	-75.5	134.3	166.1	-60	176.8	0	0	0	108.7
98	R	93.7	Very high	95.1	Very high	185 Å²	185	130.8 Å²	130.8	70%	0.698	75%	0.748	S	S	*	*			trans	-120.2	143.5	172.7	-69.6	-172.7	-176.4	165.3	3.2	109.9	R100	R98-R100 PolarHBondContact O-N 3.47Å
99	A	93.4	Very high	94.9	Very high	102 Å²	102	129.7 Å²	129.7	84%	0.843	74%	0.738	S	S	*	*			trans	-60.6	136.1	171.2	0	0	0	0	0	109.5
100	R	90.1	Very high	94.7	Very high	245 Å²	245	134.5 Å²	134.5	93%	0.925	74%	0.737	S	S	*	*			trans	-82.6	123.4	172.4	-175.6	177.7	177.6	179.3	1	108.2	R98	R98-R100 PolarHBondContact O-N 3.47Å
101	T	84.3	Confident	94.4	Very high	202 Å²	202	134.6 Å²	134.6	100%	1.239	73%	0.73	S	S	*	*			trans	-74.1	0	164	33.5	0	0	0	0	111.6

Retrieved 101 of 101 residues in 102.7 ms (Link to these results)

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