G4VLF7_SCHMA Loading...

Large ribosomal subunit protein eL24 AlphaSync

AlphaFold DB , UniProt , Accession G4VLF7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 110 aa.

						>G4VLF7_SCHMA|G4VLF7
MKLEVCSYSGFKVYPGHGKRAIRIDGRGFYFINKKCERSHFLKRNPREISWTVLYRRKYKKGISEELVKKRTKRVTKSARGIAGASLAEIMAKRNQKPEVRKAMRDQAIR
					

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(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	81.1	Confident	93.4	Very high	205 Å²	205	71.5 Å²	71.5	100%	1.01	37%	0.371	S	S	*	.				0	124	0	-143.8	177.7	-150.5	0	0	109	P15	M1-P15 HydrophobicContact CE-CB 3.47Å; M1-P15 VanDerWaalsContact CE-CB 3.47Å; M1-P15 HydrophobicContact CE-CG 3.85Å; M1-P15 HydrophobicContact CG-CB 4.38Å; M1-P15 HydrophobicContact CG-CG 3.69Å; M1-P15 HydrophobicContact SD-CB 3.68Å; M1-P15 HydrophobicContact SD-CG 3.41Å; M1-P15 WeakPolarHBondContact SD-CG 3.36Å
2	K	87.7	Confident	93.6	Very high	185 Å²	185	76.9 Å²	76.9	80%	0.804	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-87.6	128	-176.9	-174.1	176	-179.7	177.6	0	110
3	L	91.9	Very high	93.7	Very high	65 Å²	65	71.2 Å²	71.2	34%	0.34	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-80.1	127.1	171.5	-63.9	174.4	0	0	0	109.4	K12 Y14	L3-K12 HydrophobicContact CD1-CD 4.07Å; L3-Y14 HydrophobicContact CD1-CE1 4.1Å; L3-Y14 HydrophobicContact CD2-CD1 3.39Å; L3-Y14 HydrophobicContact CD2-CE1 3.68Å; L3-Y14 HydrophobicContact CD2-CG 3.93Å
4	E	93.5	Very high	93.8	Very high	66 Å²	66	76.2 Å²	76.2	31%	0.308	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	162.5	173.2	-65.4	-165.9	-166.2	0	0	110.5	K12 V13 R20 Y30	E4-K12 CarbonylContact O-C 3.4Å; E4-K12 WeakPolarHBondContact O-CA 3.36Å; E4-V13 PolarHBondContact N-O 3.15Å; E4-V13 PolarHBondContact O-N 3.4Å; E4-R20 IonicContact OE1-CZ 3.84Å; E4-R20 IonicContact OE1-NH2 2.62Å; E4-R20 PolarHBondContact OE1-NH2 3.25Å; E4-R20 IonicContact OE2-CZ 3.8Å; E4-R20 IonicContact OE2-NH2 2.73Å; E4-R20 PolarHBondContact OE2-NH2 2.96Å; E4-Y30 HydrophobicContact CB-CD1 3.59Å; E4-Y30 HydrophobicContact CB-CE1 3.73Å; E4-Y30 HydrophobicContact CB-CG 4.33Å; E4-Y30 HydrophobicContact CG-CD1 4.47Å; E4-Y30 HydrophobicContact CG-CE1 4.39Å; E4-Y30 WeakPolarHBondContact OE2-CD1 3.43Å; E4-Y30 WeakPolarHBondContact OE2-CD2 3.27Å; E4-Y30 VanDerWaalsContact OE2-CG 3.29Å
5	V	95.7	Very high	93.8	Very high	84 Å²	84	74.6 Å²	74.6	51%	0.509	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.5	177.8	179.7	0	0	0	0	108.2	S7 F11	V5-S7 PolarHBondContact O-N 3.45Å; V5-F11 WeakPolarHBondContact CA-O 3.44Å
6	C	96.5	Very high	93.7	Very high	1 Å²	1	75.4 Å²	75.4	1%	0.007	41%	0.405	C	S	.	.			trans	-61.7	122.2	174.6	177.8	0	0	0	0	109.8	Y8 S9 G10 F11 V13 Y30 I32	C6-Y8 PolarHBondContact O-N 3.18Å; C6-Y8 VanDerWaalsContact O-N 3.17Å; C6-S9 VanDerWaalsContact CB-OG 3.23Å; C6-S9 WeakPolarHBondContact CB-OG 3.36Å; C6-S9 PolarHBondContact SG-N 3.43Å; C6-S9 PolarHBondContact SG-OG 2.88Å; C6-G10 WeakPolarHBondContact O-CA 3.48Å; C6-G10 PolarHBondContact O-N 3.06Å; C6-F11 PolarHBondContact N-O 3.09Å; C6-V13 HydrophobicContact CB-CG2 3.95Å; C6-Y30 CarbonylContact C-O 3.49Å; C6-Y30 VanDerWaalsContact CA-O 3.24Å; C6-Y30 WeakPolarHBondContact CA-O 3.28Å; C6-I32 HydrophobicContact CB-CB 4.12Å; C6-I32 HydrophobicContact CB-CG2 4.2Å; C6-I32 PolarHBondContact SG-N 2.99Å
7	S	96.1	Very high	93.7	Very high	56 Å²	56	78.1 Å²	78.1	39%	0.392	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-22.7	-177.5	-53	0	0	0	0	113.4	V5 F29 Y30	V5-S7 PolarHBondContact O-N 3.45Å; S7-F29 WeakPolarHBondContact OG-CA 3.36Å; S7-Y30 PolarHBondContact N-O 2.82Å; S7-Y30 PolarHBondContact OG-N 3.43Å; S7-Y30 PolarHBondContact OG-O 3.21Å
8	Y	96.8	Very high	93.7	Very high	2 Å²	2	76.1 Å²	76.1	1%	0.008	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-56.5	178.7	-172.1	-92.3	0	0	0	112.6	C6 C36 S39 H40 R44 P46 I49 W51 T52	C6-Y8 PolarHBondContact O-N 3.18Å; C6-Y8 VanDerWaalsContact O-N 3.17Å; Y8-C36 HydrophobicContact CD1-CB 4.15Å; Y8-C36 HydrophobicContact CG-CB 4.31Å; Y8-S39 VanDerWaalsContact OH-CB 3.28Å; Y8-S39 WeakPolarHBondContact OH-CB 3.15Å; Y8-H40 HydrophobicContact CD2-CB 4.05Å; Y8-R44 WeakPolarHBondContact CE2-O 3.38Å; Y8-P46 HydrophobicContact CD2-CG 3.8Å; Y8-P46 HydrophobicContact CE2-CG 3.77Å; Y8-P46 HydrophobicContact CG-CG 4.4Å; Y8-I49 WeakPolarHBondContact OH-CG1 3.47Å; Y8-W51 HydrophobicContact CD1-CH2 4.33Å; Y8-W51 HydrophobicContact CE1-CH2 4.34Å; Y8-W51 HydrophobicContact CE1-CZ2 4.13Å; Y8-T52 HydrophobicContact CD1-CG2 4.48Å; Y8-T52 HydrophobicContact CE1-CG2 4.1Å
9	S	96.3	Very high	93.7	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-25.3	-172.1	60.9	0	0	0	0	114	C6 F11 W51 V53	C6-S9 VanDerWaalsContact CB-OG 3.23Å; C6-S9 WeakPolarHBondContact CB-OG 3.36Å; C6-S9 PolarHBondContact SG-N 3.43Å; C6-S9 PolarHBondContact SG-OG 2.88Å; S9-F11 VanDerWaalsContact C-N 3.28Å; S9-F11 WeakPolarHBondContact OG-CD2 3.4Å; S9-F11 PolarHBondContact OG-N 3.44Å; S9-W51 VanDerWaalsContact CB-CZ3 3.49Å; S9-V53 WeakPolarHBondContact O-CB 3.13Å; S9-V53 WeakPolarHBondContact O-CG2 3.44Å; S9-V53 PolarHBondContact O-N 2.96Å
10	G	95.7	Very high	93.8	Very high	28 Å²	28	81 Å²	81	29%	0.289	42%	0.424	S	S	.	.			trans	78.2	6.5	-172.7	0	0	0	0	0	114.6	C6	C6-G10 WeakPolarHBondContact O-CA 3.48Å; C6-G10 PolarHBondContact O-N 3.06Å
11	F	96.1	Very high	93.8	Very high	94 Å²	94	77.9 Å²	77.9	41%	0.412	41%	0.41	S	S	.	.			trans	-76.9	150.9	173.9	-68.6	-60.5	0	0	0	111.8	V5 C6 S9 I32 W51 V53	V5-F11 WeakPolarHBondContact CA-O 3.44Å; C6-F11 PolarHBondContact N-O 3.09Å; S9-F11 VanDerWaalsContact C-N 3.28Å; S9-F11 WeakPolarHBondContact OG-CD2 3.4Å; S9-F11 PolarHBondContact OG-N 3.44Å; F11-I32 HydrophobicContact CB-CD1 4.12Å; F11-W51 HydrophobicContact CD2-CZ3 4.4Å; F11-W51 AromaticContact CE2-CE3 3.92Å; F11-W51 HydrophobicContact CE2-CE3 3.92Å; F11-W51 AromaticContact CE2-CZ3 3.92Å; F11-W51 HydrophobicContact CE2-CZ3 3.92Å; F11-V53 HydrophobicContact CD1-CG2 4.43Å; F11-V53 HydrophobicContact CE1-CG2 4.3Å
12	K	95.8	Very high	94.5	Very high	137 Å²	137	74.2 Å²	74.2	60%	0.596	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.1	172.2	-62.9	-179.4	-178.2	178.8	0	109.3	L3 E4	L3-K12 HydrophobicContact CD1-CD 4.07Å; E4-K12 CarbonylContact O-C 3.4Å; E4-K12 WeakPolarHBondContact O-CA 3.36Å
13	V	95.6	Very high	94.7	Very high	3 Å²	3	72.2 Å²	72.2	2%	0.018	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.7	177.2	-171.3	0	0	0	0	107.9	E4 C6 H17 Y30 I32	E4-V13 PolarHBondContact N-O 3.15Å; E4-V13 PolarHBondContact O-N 3.4Å; C6-V13 HydrophobicContact CB-CG2 3.95Å; V13-H17 HydrophobicContact CG1-CB 4.17Å; V13-H17 WeakPolarHBondContact CG1-O 3.46Å; V13-Y30 HydrophobicContact CB-CD1 3.88Å; V13-Y30 HydrophobicContact CB-CE1 3.59Å; V13-Y30 HydrophobicContact CG1-CD1 4.08Å; V13-Y30 HydrophobicContact CG1-CE1 3.43Å; V13-Y30 VanDerWaalsContact CG1-CE1 3.43Å; V13-Y30 HydrophobicContact CG2-CD1 3.87Å; V13-Y30 HydrophobicContact CG2-CE1 4.08Å; V13-I32 HydrophobicContact CG2-CB 3.85Å; V13-I32 HydrophobicContact CG2-CG1 4.28Å
14	Y	94.1	Very high	94.9	Very high	141 Å²	141	77.6 Å²	77.6	55%	0.553	41%	0.408	S	S	*	.			trans	-80.3	150.3	176.8	-72.6	-90.1	0	0	0	110.4	L3 H17	L3-Y14 HydrophobicContact CD1-CE1 4.1Å; L3-Y14 HydrophobicContact CD2-CD1 3.39Å; L3-Y14 HydrophobicContact CD2-CE1 3.68Å; L3-Y14 HydrophobicContact CD2-CG 3.93Å; Y14-H17 WeakPolarHBondContact O-CB 3.41Å; Y14-H17 PolarHBondContact O-N 3.06Å; Y14-H17 VanDerWaalsContact O-N 3.1Å
15	P	93.4	Very high	95	Very high	52 Å²	52	77.6 Å²	77.6	34%	0.338	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	145.3	173.8	-31.8	44.4	0	0	0	111.5	M1 H17	M1-P15 HydrophobicContact CE-CB 3.47Å; M1-P15 VanDerWaalsContact CE-CB 3.47Å; M1-P15 HydrophobicContact CE-CG 3.85Å; M1-P15 HydrophobicContact CG-CB 4.38Å; M1-P15 HydrophobicContact CG-CG 3.69Å; M1-P15 HydrophobicContact SD-CB 3.68Å; M1-P15 HydrophobicContact SD-CG 3.41Å; M1-P15 WeakPolarHBondContact SD-CG 3.36Å; P15-H17 VanDerWaalsContact C-N 3.27Å; P15-H17 PolarHBondContact O-N 3Å; P15-H17 PolarHBondContact O-ND1 3.45Å
16	G	92.3	Very high	94.9	Very high	87 Å²	87	76.5 Å²	76.5	90%	0.897	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-4.2	-170	0	0	0	0	0	114.8
17	H	93.6	Very high	94.7	Very high	122 Å²	122	84 Å²	84	57%	0.565	44%	0.444	S	S	*	.			trans	-120.6	158.7	178	-60.8	75.7	0	0	0	112.2	V13 Y14 P15 Y30	V13-H17 HydrophobicContact CG1-CB 4.17Å; V13-H17 WeakPolarHBondContact CG1-O 3.46Å; Y14-H17 WeakPolarHBondContact O-CB 3.41Å; Y14-H17 PolarHBondContact O-N 3.06Å; Y14-H17 VanDerWaalsContact O-N 3.1Å; P15-H17 VanDerWaalsContact C-N 3.27Å; P15-H17 PolarHBondContact O-N 3Å; P15-H17 PolarHBondContact O-ND1 3.45Å; H17-Y30 PolarHBondContact O-OH 3.45Å
18	G	93.8	Very high	94.6	Very high	41 Å²	41	83.6 Å²	83.6	42%	0.423	45%	0.45	S	S	.	.			trans	78.1	-174	173.9	0	0	0	0	0	114.5	F31	G18-F31 CarbonylContact C-O 3.45Å; G18-F31 WeakPolarHBondContact CA-O 3.38Å
19	K	94.6	Very high	94.6	Very high	115 Å²	115	86 Å²	86	50%	0.5	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	141.3	-176.5	-175.5	179.2	174.9	-163	0	110.2	F31 E37	K19-F31 PolarHBondContact N-O 3.09Å; K19-F31 PolarHBondContact O-N 3.19Å; K19-E37 IonicContact NZ-OE1 2.85Å; K19-E37 PolarHBondContact NZ-OE1 3.38Å
20	R	95	Very high	94.5	Very high	135 Å²	135	88 Å²	88	51%	0.509	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.8	170.5	-170.9	168.9	-75.8	161.8	-2.8	109.8	E4 I22 F29 Y30	E4-R20 IonicContact OE1-CZ 3.84Å; E4-R20 IonicContact OE1-NH2 2.62Å; E4-R20 PolarHBondContact OE1-NH2 3.25Å; E4-R20 IonicContact OE2-CZ 3.8Å; E4-R20 IonicContact OE2-NH2 2.73Å; E4-R20 PolarHBondContact OE2-NH2 2.96Å; R20-I22 HydrophobicContact CG-CG1 4.21Å; R20-F29 CarbonylContact C-O 3.54Å; R20-F29 WeakPolarHBondContact CA-O 3.46Å; R20-Y30 HydrophobicContact CB-CD2 3.73Å; R20-Y30 HydrophobicContact CB-CE2 3.95Å; R20-Y30 HydrophobicContact CG-CD2 4.24Å
21	A	94.5	Very high	94.6	Very high	17 Å²	17	86.7 Å²	86.7	14%	0.14	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.6	169.4	0	0	0	0	0	108.5	F29 F31 F41	A21-F29 PolarHBondContact N-O 2.72Å; A21-F29 PolarHBondContact O-N 3.49Å; A21-F31 HydrophobicContact CB-CD2 4.32Å; A21-F31 HydrophobicContact CB-CE2 3.81Å; A21-F41 HydrophobicContact CB-CZ 4.29Å
22	I	95.1	Very high	94.6	Very high	127 Å²	127	84.8 Å²	84.8	65%	0.651	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.4	177.1	-58.2	172.7	0	0	0	107	R20	R20-I22 HydrophobicContact CG-CG1 4.21Å
23	R	92.8	Very high	94.6	Very high	144 Å²	144	81.8 Å²	81.8	54%	0.543	44%	0.438	S	S	.	.			trans	-86.1	160.1	175.3	-178.9	178.9	-179	-144	6	109.8	D25 G26 R27 F29	R23-D25 WeakPolarHBondContact CB-OD1 3.4Å; R23-D25 VanDerWaalsContact CD-OD1 3.28Å; R23-D25 WeakPolarHBondContact CD-OD1 3.26Å; R23-D25 WeakPolarHBondContact CG-OD1 3.36Å; R23-D25 IonicContact CZ-OD2 3.52Å; R23-D25 IonicContact NE-OD2 3.79Å; R23-D25 IonicContact NH1-OD2 2.74Å; R23-D25 PolarHBondContact NH1-OD2 2.89Å; R23-D25 PolarHBondContact O-N 3.39Å; R23-D25 VanDerWaalsContact O-N 3.12Å; R23-G26 PolarHBondContact O-N 3.48Å; R23-R27 PolarHBondContact N-O 3.17Å; R23-F29 HydrophobicContact CB-CE2 4.41Å
24	I	95.2	Very high	94.6	Very high	177 Å²	177	89.8 Å²	89.8	91%	0.908	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-23.2	179.8	-156.2	164	0	0	0	114.1	G26	I24-G26 PolarHBondContact O-N 3.09Å
25	D	95.4	Very high	94.8	Very high	66 Å²	66	88.5 Å²	88.5	35%	0.353	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	8.9	175.8	62.9	-8.1	0	0	0	113.3	R23 R27	R23-D25 WeakPolarHBondContact CB-OD1 3.4Å; R23-D25 VanDerWaalsContact CD-OD1 3.28Å; R23-D25 WeakPolarHBondContact CD-OD1 3.26Å; R23-D25 WeakPolarHBondContact CG-OD1 3.36Å; R23-D25 IonicContact CZ-OD2 3.52Å; R23-D25 IonicContact NE-OD2 3.79Å; R23-D25 IonicContact NH1-OD2 2.74Å; R23-D25 PolarHBondContact NH1-OD2 2.89Å; R23-D25 PolarHBondContact O-N 3.39Å; R23-D25 VanDerWaalsContact O-N 3.12Å; D25-R27 PolarHBondContact O-N 3.08Å; D25-R27 WeakPolarHBondContact OD1-CB 3.33Å; D25-R27 PolarHBondContact OD1-N 3.36Å; D25-R27 VanDerWaalsContact OD2-CD 3.24Å; D25-R27 WeakPolarHBondContact OD2-CD 3.46Å; D25-R27 IonicContact OD2-NE 3.5Å; D25-R27 PolarHBondContact OD2-NE 3.29Å
26	G	93.7	Very high	94.9	Very high	62 Å²	62	86 Å²	86	64%	0.639	45%	0.454	S	S	*	.	S	Bend	trans	78.2	1.5	-178.1	0	0	0	0	0	114.4	R23 I24 G28	R23-G26 PolarHBondContact O-N 3.48Å; I24-G26 PolarHBondContact O-N 3.09Å; G26-G28 PolarHBondContact O-N 2.89Å
27	R	93.7	Very high	95.1	Very high	157 Å²	157	83.5 Å²	83.5	59%	0.592	42%	0.419	S	S	*	.			trans	-77.9	119.2	179	-63.2	-176.2	-176.5	179	0.3	110.7	R23 D25 F29	R23-R27 PolarHBondContact N-O 3.17Å; D25-R27 PolarHBondContact O-N 3.08Å; D25-R27 WeakPolarHBondContact OD1-CB 3.33Å; D25-R27 PolarHBondContact OD1-N 3.36Å; D25-R27 VanDerWaalsContact OD2-CD 3.24Å; D25-R27 WeakPolarHBondContact OD2-CD 3.46Å; D25-R27 IonicContact OD2-NE 3.5Å; D25-R27 PolarHBondContact OD2-NE 3.29Å; R27-F29 HydrophobicContact CB-CE2 4.01Å; R27-F29 HydrophobicContact CB-CZ 4.18Å
28	G	93.9	Very high	95.2	Very high	49 Å²	49	86.2 Å²	86.2	51%	0.505	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.8	173.3	0	0	0	0	0	112.2	G26	G26-G28 PolarHBondContact O-N 2.89Å
29	F	95.2	Very high	95.4	Very high	52 Å²	52	84.8 Å²	84.8	23%	0.228	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	136.9	171.5	-59.1	-80.2	0	0	0	109.9	S7 R20 A21 R23 R27 F31 H40	S7-F29 WeakPolarHBondContact OG-CA 3.36Å; R20-F29 CarbonylContact C-O 3.54Å; R20-F29 WeakPolarHBondContact CA-O 3.46Å; A21-F29 PolarHBondContact N-O 2.72Å; A21-F29 PolarHBondContact O-N 3.49Å; R23-F29 HydrophobicContact CB-CE2 4.41Å; R27-F29 HydrophobicContact CB-CE2 4.01Å; R27-F29 HydrophobicContact CB-CZ 4.18Å; F29-F31 HydrophobicContact CB-CE1 4.25Å; F29-F31 HydrophobicContact CB-CE2 3.93Å; F29-F31 HydrophobicContact CB-CZ 3.6Å; F29-F31 HydrophobicContact CG-CZ 4.36Å; F29-H40 AromaticContact CD1-CE1 3.82Å; F29-H40 AromaticContact CD2-NE2 3.85Å; F29-H40 AromaticContact CE1-CE1 3.79Å; F29-H40 AromaticContact CE2-NE2 3.94Å; F29-H40 AromaticContact CG-NE2 3.98Å
30	Y	95.9	Very high	95.5	Very high	42 Å²	42	82 Å²	82	17%	0.165	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.1	176.5	-151.9	-118.5	0	0	0	109.8	E4 C6 S7 V13 H17 R20	E4-Y30 HydrophobicContact CB-CD1 3.59Å; E4-Y30 HydrophobicContact CB-CE1 3.73Å; E4-Y30 HydrophobicContact CB-CG 4.33Å; E4-Y30 HydrophobicContact CG-CD1 4.47Å; E4-Y30 HydrophobicContact CG-CE1 4.39Å; E4-Y30 WeakPolarHBondContact OE2-CD1 3.43Å; E4-Y30 WeakPolarHBondContact OE2-CD2 3.27Å; E4-Y30 VanDerWaalsContact OE2-CG 3.29Å; C6-Y30 CarbonylContact C-O 3.49Å; C6-Y30 VanDerWaalsContact CA-O 3.24Å; C6-Y30 WeakPolarHBondContact CA-O 3.28Å; S7-Y30 PolarHBondContact N-O 2.82Å; S7-Y30 PolarHBondContact OG-N 3.43Å; S7-Y30 PolarHBondContact OG-O 3.21Å; V13-Y30 HydrophobicContact CB-CD1 3.88Å; V13-Y30 HydrophobicContact CB-CE1 3.59Å; V13-Y30 HydrophobicContact CG1-CD1 4.08Å; V13-Y30 HydrophobicContact CG1-CE1 3.43Å; V13-Y30 VanDerWaalsContact CG1-CE1 3.43Å; V13-Y30 HydrophobicContact CG2-CD1 3.87Å; V13-Y30 HydrophobicContact CG2-CE1 4.08Å; H17-Y30 PolarHBondContact O-OH 3.45Å; R20-Y30 HydrophobicContact CB-CD2 3.73Å; R20-Y30 HydrophobicContact CB-CE2 3.95Å; R20-Y30 HydrophobicContact CG-CD2 4.24Å
31	F	97.1	Very high	95.4	Very high	1 Å²	1	81.6 Å²	81.6	0%	0.004	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.2	-178.7	-59.6	-60.2	0	0	0	110.7	G18 K19 A21 F29 C36 E37 H40	G18-F31 CarbonylContact C-O 3.45Å; G18-F31 WeakPolarHBondContact CA-O 3.38Å; K19-F31 PolarHBondContact N-O 3.09Å; K19-F31 PolarHBondContact O-N 3.19Å; A21-F31 HydrophobicContact CB-CD2 4.32Å; A21-F31 HydrophobicContact CB-CE2 3.81Å; F29-F31 HydrophobicContact CB-CE1 4.25Å; F29-F31 HydrophobicContact CB-CE2 3.93Å; F29-F31 HydrophobicContact CB-CZ 3.6Å; F29-F31 HydrophobicContact CG-CZ 4.36Å; F31-C36 HydrophobicContact CB-CB 4.3Å; F31-C36 HydrophobicContact CD1-CB 4.05Å; F31-E37 HydrophobicContact CB-CB 4.23Å; F31-E37 HydrophobicContact CD2-CB 3.84Å; F31-E37 HydrophobicContact CD2-CG 3.93Å; F31-E37 HydrophobicContact CE2-CB 4.41Å; F31-E37 HydrophobicContact CE2-CG 4.24Å; F31-E37 HydrophobicContact CG-CB 4.01Å; F31-H40 HydrophobicContact CE1-CB 3.61Å; F31-H40 AromaticContact CE1-CG 3.73Å; F31-H40 HydrophobicContact CZ-CB 3.62Å; F31-H40 AromaticContact CZ-CD2 3.47Å; F31-H40 VanDerWaalsContact CZ-CD2 3.47Å; F31-H40 WeakPolarHBondContact CZ-CD2 3.37Å; F31-H40 AromaticContact CZ-CG 3.44Å; F31-H40 VanDerWaalsContact CZ-CG 3.44Å
32	I	96.5	Very high	95.5	Very high	53 Å²	53	85.2 Å²	85.2	27%	0.272	42%	0.415	S	S	.	.	S	Bend	trans	-67.2	-35.1	175.8	-173.7	161.4	0	0	0	112.6	C6 F11 V13 C36	C6-I32 HydrophobicContact CB-CB 4.12Å; C6-I32 HydrophobicContact CB-CG2 4.2Å; C6-I32 PolarHBondContact SG-N 2.99Å; F11-I32 HydrophobicContact CB-CD1 4.12Å; V13-I32 HydrophobicContact CG2-CB 3.85Å; V13-I32 HydrophobicContact CG2-CG1 4.28Å; I32-C36 HydrophobicContact CG2-CB 4.37Å; I32-C36 WeakPolarHBondContact CG2-SG 3.24Å
33	N	95.3	Very high	95.5	Very high	74 Å²	74	88.2 Å²	88.2	40%	0.396	42%	0.423	S	S	.	.	S	Bend	trans	-158.3	171.5	-176.6	60.9	26.7	0	0	0	111.9	K35 C36 E37	N33-K35 PolarHBondContact O-N 3.46Å; N33-K35 WeakPolarHBondContact OD1-CB 2.96Å; N33-K35 PolarHBondContact OD1-N 2.81Å; N33-C36 WeakPolarHBondContact O-CB 3.28Å; N33-C36 PolarHBondContact O-N 3.38Å; N33-C36 VanDerWaalsContact O-N 3.14Å; N33-C36 PolarHBondContact OD1-N 3.24Å; N33-C36 VanDerWaalsContact OD1-N 3.08Å; N33-C36 PolarHBondContact OD1-SG 2.9Å; N33-E37 PolarHBondContact O-N 3.31Å
34	K	96.2	Very high	95.7	Very high	171 Å²	171	87.8 Å²	87.8	74%	0.743	42%	0.422	S	S	*	.	H	α-helix	trans	-59.4	-29.3	179.2	-168.5	174	-177.2	177.1	0	113.6	E37 R38	K34-E37 PolarHBondContact O-N 3Å; K34-R38 VanDerWaalsContact O-CB 3.29Å; K34-R38 WeakPolarHBondContact O-CB 3.14Å; K34-R38 PolarHBondContact O-N 3.48Å
35	K	96.6	Very high	95.8	Very high	114 Å²	114	82.4 Å²	82.4	50%	0.496	39%	0.394	S	S	.	.	H	α-helix	trans	-61.8	-44.2	176	179	-175	-178	-176.6	0	111.2	N33 S39 W51	N33-K35 PolarHBondContact O-N 3.46Å; N33-K35 WeakPolarHBondContact OD1-CB 2.96Å; N33-K35 PolarHBondContact OD1-N 2.81Å; K35-S39 WeakPolarHBondContact O-CB 2.95Å; K35-S39 PolarHBondContact O-N 3.05Å; K35-S39 VanDerWaalsContact O-N 3.12Å; K35-S39 PolarHBondContact O-OG 2.71Å; K35-W51 HydrophobicContact CD-CH2 4.36Å; K35-W51 HydrophobicContact CD-CZ2 4Å; K35-W51 VanDerWaalsContact CE-CZ2 3.48Å; K35-W51 HydrophobicContact CG-CZ2 4.36Å
36	C	96.8	Very high	95.9	Very high	0 Å²	0	80.4 Å²	80.4	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-68.4	-45.7	177.8	-64.9	0	0	0	0	111.5	Y8 F31 I32 N33 S39 H40	Y8-C36 HydrophobicContact CD1-CB 4.15Å; Y8-C36 HydrophobicContact CG-CB 4.31Å; F31-C36 HydrophobicContact CB-CB 4.3Å; F31-C36 HydrophobicContact CD1-CB 4.05Å; I32-C36 HydrophobicContact CG2-CB 4.37Å; I32-C36 WeakPolarHBondContact CG2-SG 3.24Å; N33-C36 WeakPolarHBondContact O-CB 3.28Å; N33-C36 PolarHBondContact O-N 3.38Å; N33-C36 VanDerWaalsContact O-N 3.14Å; N33-C36 PolarHBondContact OD1-N 3.24Å; N33-C36 VanDerWaalsContact OD1-N 3.08Å; N33-C36 PolarHBondContact OD1-SG 2.9Å; C36-S39 PolarHBondContact O-N 3.23Å; C36-H40 WeakPolarHBondContact O-CB 2.93Å; C36-H40 PolarHBondContact O-N 2.99Å
37	E	96.2	Very high	96	Very high	34 Å²	34	83.6 Å²	83.6	16%	0.159	38%	0.378	C	S	.	.	H	α-helix	trans	-58.1	-52.9	177.6	-175.9	-177.7	-160.4	0	0	111.2	K19 F31 N33 K34 S39 H40 F41	K19-E37 IonicContact NZ-OE1 2.85Å; K19-E37 PolarHBondContact NZ-OE1 3.38Å; F31-E37 HydrophobicContact CB-CB 4.23Å; F31-E37 HydrophobicContact CD2-CB 3.84Å; F31-E37 HydrophobicContact CD2-CG 3.93Å; F31-E37 HydrophobicContact CE2-CB 4.41Å; F31-E37 HydrophobicContact CE2-CG 4.24Å; F31-E37 HydrophobicContact CG-CB 4.01Å; N33-E37 PolarHBondContact O-N 3.31Å; K34-E37 PolarHBondContact O-N 3Å; E37-S39 VanDerWaalsContact C-N 3.32Å; E37-S39 PolarHBondContact O-N 3.14Å; E37-H40 WeakPolarHBondContact O-CB 3.18Å; E37-H40 PolarHBondContact O-N 3.03Å; E37-F41 HydrophobicContact CG-CD2 3.76Å; E37-F41 HydrophobicContact CG-CE2 3.49Å; E37-F41 VanDerWaalsContact CG-CE2 3.49Å; E37-F41 WeakPolarHBondContact O-CD2 3.37Å; E37-F41 PolarHBondContact O-N 3.41Å
38	R	96.6	Very high	96.1	Very high	179 Å²	179	82.2 Å²	82.2	68%	0.675	38%	0.378	S	S	*	.	H	α-helix	trans	-59	-43.7	178.4	-176.8	174.7	-177.6	169.3	1.9	111.8	K34 H40 F41 L42	K34-R38 VanDerWaalsContact O-CB 3.29Å; K34-R38 WeakPolarHBondContact O-CB 3.14Å; K34-R38 PolarHBondContact O-N 3.48Å; R38-H40 VanDerWaalsContact C-N 3.3Å; R38-H40 PolarHBondContact O-N 2.9Å; R38-F41 PolarHBondContact O-N 3.44Å; R38-L42 HydrophobicContact CG-CD1 3.91Å; R38-L42 HydrophobicContact CG-CG 4.36Å; R38-L42 WeakPolarHBondContact O-CB 3.47Å; R38-L42 VanDerWaalsContact O-CG 3.26Å; R38-L42 WeakPolarHBondContact O-CG 3.32Å; R38-L42 PolarHBondContact O-N 3.22Å
39	S	96.9	Very high	96.2	Very high	11 Å²	11	82 Å²	82	8%	0.077	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-35.7	-179.6	-56.9	0	0	0	0	112.1	Y8 K35 C36 E37 K43 R44	Y8-S39 VanDerWaalsContact OH-CB 3.28Å; Y8-S39 WeakPolarHBondContact OH-CB 3.15Å; K35-S39 WeakPolarHBondContact O-CB 2.95Å; K35-S39 PolarHBondContact O-N 3.05Å; K35-S39 VanDerWaalsContact O-N 3.12Å; K35-S39 PolarHBondContact O-OG 2.71Å; C36-S39 PolarHBondContact O-N 3.23Å; E37-S39 VanDerWaalsContact C-N 3.32Å; E37-S39 PolarHBondContact O-N 3.14Å; S39-K43 PolarHBondContact O-N 2.9Å; S39-R44 WeakPolarHBondContact O-CB 3.4Å; S39-R44 PolarHBondContact O-N 2.81Å
40	H	95.8	Very high	96.2	Very high	56 Å²	56	83 Å²	83	26%	0.259	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-47	174.7	-179.2	83.4	0	0	0	112	Y8 F29 F31 C36 E37 R38 L42 K43	Y8-H40 HydrophobicContact CD2-CB 4.05Å; F29-H40 AromaticContact CD1-CE1 3.82Å; F29-H40 AromaticContact CD2-NE2 3.85Å; F29-H40 AromaticContact CE1-CE1 3.79Å; F29-H40 AromaticContact CE2-NE2 3.94Å; F29-H40 AromaticContact CG-NE2 3.98Å; F31-H40 HydrophobicContact CE1-CB 3.61Å; F31-H40 AromaticContact CE1-CG 3.73Å; F31-H40 HydrophobicContact CZ-CB 3.62Å; F31-H40 AromaticContact CZ-CD2 3.47Å; F31-H40 VanDerWaalsContact CZ-CD2 3.47Å; F31-H40 WeakPolarHBondContact CZ-CD2 3.37Å; F31-H40 AromaticContact CZ-CG 3.44Å; F31-H40 VanDerWaalsContact CZ-CG 3.44Å; C36-H40 WeakPolarHBondContact O-CB 2.93Å; C36-H40 PolarHBondContact O-N 2.99Å; E37-H40 WeakPolarHBondContact O-CB 3.18Å; E37-H40 PolarHBondContact O-N 3.03Å; R38-H40 VanDerWaalsContact C-N 3.3Å; R38-H40 PolarHBondContact O-N 2.9Å; H40-L42 VanDerWaalsContact C-N 3.31Å; H40-L42 PolarHBondContact O-N 3.1Å; H40-K43 WeakPolarHBondContact O-CA 3.42Å; H40-K43 PolarHBondContact O-N 2.96Å
41	F	94.6	Very high	96.2	Very high	128 Å²	128	84.7 Å²	84.7	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-69.2	-28.4	178.2	-72.5	-62.3	0	0	0	113.4	A21 E37 R38 K43	A21-F41 HydrophobicContact CB-CZ 4.29Å; E37-F41 HydrophobicContact CG-CD2 3.76Å; E37-F41 HydrophobicContact CG-CE2 3.49Å; E37-F41 VanDerWaalsContact CG-CE2 3.49Å; E37-F41 WeakPolarHBondContact O-CD2 3.37Å; E37-F41 PolarHBondContact O-N 3.41Å; R38-F41 PolarHBondContact O-N 3.44Å; F41-K43 PolarHBondContact O-N 3.18Å
42	L	96.3	Very high	96.2	Very high	92 Å²	92	84.6 Å²	84.6	48%	0.482	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	5.4	167.6	-69.4	175.4	0	0	0	113.4	R38 H40 R44	R38-L42 HydrophobicContact CG-CD1 3.91Å; R38-L42 HydrophobicContact CG-CG 4.36Å; R38-L42 WeakPolarHBondContact O-CB 3.47Å; R38-L42 VanDerWaalsContact O-CG 3.26Å; R38-L42 WeakPolarHBondContact O-CG 3.32Å; R38-L42 PolarHBondContact O-N 3.22Å; H40-L42 VanDerWaalsContact C-N 3.31Å; H40-L42 PolarHBondContact O-N 3.1Å; L42-R44 HydrophobicContact CB-CG 4.15Å; L42-R44 PolarHBondContact O-N 3.06Å; L42-R44 VanDerWaalsContact O-N 3.13Å
43	K	95.4	Very high	96.1	Very high	191 Å²	191	83.9 Å²	83.9	83%	0.83	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	29.2	179.1	-56.2	-180	-179.1	175.5	0	113.9	S39 H40 F41	S39-K43 PolarHBondContact O-N 2.9Å; H40-K43 WeakPolarHBondContact O-CA 3.42Å; H40-K43 PolarHBondContact O-N 2.96Å; F41-K43 PolarHBondContact O-N 3.18Å
44	R	96.9	Very high	96.1	Very high	135 Å²	135	83 Å²	83	51%	0.509	38%	0.377	S	S	.	.			trans	-70.9	133.8	176.5	-64.7	-178.9	176.6	-174.4	-4.9	109.6	Y8 S39 L42 P46	Y8-R44 WeakPolarHBondContact CE2-O 3.38Å; S39-R44 WeakPolarHBondContact O-CB 3.4Å; S39-R44 PolarHBondContact O-N 2.81Å; L42-R44 HydrophobicContact CB-CG 4.15Å; L42-R44 PolarHBondContact O-N 3.06Å; L42-R44 VanDerWaalsContact O-N 3.13Å; R44-P46 VanDerWaalsContact O-CD 3.28Å; R44-P46 WeakPolarHBondContact O-CD 3.46Å
45	N	96.2	Very high	96.1	Very high	63 Å²	63	77.4 Å²	77.4	34%	0.337	35%	0.352	S	S	.	.			trans	-75.9	117.5	179.1	-173.9	-4.3	0	0	0	110.3	R47 E48	N45-R47 PolarHBondContact O-N 2.74Å; N45-R47 WeakPolarHBondContact OD1-CB 3.28Å; N45-R47 PolarHBondContact OD1-N 3.5Å; N45-R47 VanDerWaalsContact OD1-N 3.11Å; N45-E48 HydrophobicContact CB-CG 4.36Å; N45-E48 PolarHBondContact ND2-OE1 3.36Å; N45-E48 PolarHBondContact O-N 3.12Å
46	P	97.3	Very high	96	Very high	25 Å²	25	77.8 Å²	77.8	16%	0.162	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-57.1	-27.6	178.1	-25.1	34.4	0	0	0	113.3	Y8 R44 E48 I49 T52 L54	Y8-P46 HydrophobicContact CD2-CG 3.8Å; Y8-P46 HydrophobicContact CE2-CG 3.77Å; Y8-P46 HydrophobicContact CG-CG 4.4Å; R44-P46 VanDerWaalsContact O-CD 3.28Å; R44-P46 WeakPolarHBondContact O-CD 3.46Å; P46-E48 PolarHBondContact O-N 3.19Å; P46-I49 PolarHBondContact O-N 3.25Å; P46-T52 HydrophobicContact CB-CG2 4.26Å; P46-T52 PolarHBondContact O-OG1 2.91Å; P46-L54 HydrophobicContact CB-CD1 3.96Å
47	R	95.9	Very high	95.7	Very high	129 Å²	129	86.7 Å²	86.7	49%	0.487	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-71.2	-11.5	-179.4	-60.9	176.7	-176.1	-92.4	2.6	114	N45 L54 Y55 K58	N45-R47 PolarHBondContact O-N 2.74Å; N45-R47 WeakPolarHBondContact OD1-CB 3.28Å; N45-R47 PolarHBondContact OD1-N 3.5Å; N45-R47 VanDerWaalsContact OD1-N 3.11Å; R47-L54 HydrophobicContact CG-CB 4.33Å; R47-Y55 VanDerWaalsContact O-CD2 3.32Å; R47-Y55 WeakPolarHBondContact O-CD2 3.39Å; R47-K58 HydrophobicContact CB-CD 4.35Å
48	E	96.5	Very high	95.6	Very high	127 Å²	127	90.2 Å²	90.2	59%	0.593	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-101.6	-15.2	175.1	-72.7	156.7	-144.7	0	0	112.1	N45 P46	N45-E48 HydrophobicContact CB-CG 4.36Å; N45-E48 PolarHBondContact ND2-OE1 3.36Å; N45-E48 PolarHBondContact O-N 3.12Å; P46-E48 PolarHBondContact O-N 3.19Å
49	I	96.6	Very high	95.4	Very high	44 Å²	44	86.7 Å²	86.7	23%	0.226	39%	0.386	C	S	.	.	S	Bend	trans	-91.2	112	-178.2	-59	-55.6	0	0	0	110.8	Y8 P46 W51 T52 Y55	Y8-I49 WeakPolarHBondContact OH-CG1 3.47Å; P46-I49 PolarHBondContact O-N 3.25Å; I49-W51 VanDerWaalsContact C-N 3.29Å; I49-W51 HydrophobicContact CG2-CD2 4.33Å; I49-W51 HydrophobicContact CG2-CG 4.16Å; I49-W51 HydrophobicContact CG2-CZ2 4.32Å; I49-W51 PolarHBondContact O-N 3.08Å; I49-W51 VanDerWaalsContact O-N 3.09Å; I49-T52 HydrophobicContact CB-CG2 3.85Å; I49-T52 HydrophobicContact CG2-CG2 3.86Å; I49-T52 PolarHBondContact O-N 2.98Å; I49-T52 PolarHBondContact O-OG1 3.34Å; I49-T52 VanDerWaalsContact O-OG1 3.14Å; I49-Y55 WeakPolarHBondContact O-CB 3.05Å
50	S	95.5	Very high	95	Very high	75 Å²	75	91.7 Å²	91.7	52%	0.524	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-39.4	-169.1	58.2	0	0	0	0	116.3	Y55	S50-Y55 VanDerWaalsContact CA-CD1 3.45Å; S50-Y55 VanDerWaalsContact CA-CG 3.49Å; S50-Y55 WeakPolarHBondContact O-CD1 3.37Å
51	W	94.7	Very high	94.7	Very high	76 Å²	76	95.5 Å²	95.5	29%	0.288	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-8	-173.8	63.1	-91.8	0	0	0	114.1	Y8 S9 F11 K35 I49	Y8-W51 HydrophobicContact CD1-CH2 4.33Å; Y8-W51 HydrophobicContact CE1-CH2 4.34Å; Y8-W51 HydrophobicContact CE1-CZ2 4.13Å; S9-W51 VanDerWaalsContact CB-CZ3 3.49Å; F11-W51 HydrophobicContact CD2-CZ3 4.4Å; F11-W51 AromaticContact CE2-CE3 3.92Å; F11-W51 HydrophobicContact CE2-CE3 3.92Å; F11-W51 AromaticContact CE2-CZ3 3.92Å; F11-W51 HydrophobicContact CE2-CZ3 3.92Å; K35-W51 HydrophobicContact CD-CH2 4.36Å; K35-W51 HydrophobicContact CD-CZ2 4Å; K35-W51 VanDerWaalsContact CE-CZ2 3.48Å; K35-W51 HydrophobicContact CG-CZ2 4.36Å; I49-W51 VanDerWaalsContact C-N 3.29Å; I49-W51 HydrophobicContact CG2-CD2 4.33Å; I49-W51 HydrophobicContact CG2-CG 4.16Å; I49-W51 HydrophobicContact CG2-CZ2 4.32Å; I49-W51 PolarHBondContact O-N 3.08Å; I49-W51 VanDerWaalsContact O-N 3.09Å
52	T	96.8	Very high	94.2	Very high	0 Å²	0	90.8 Å²	90.8	0%	0	41%	0.41	C	S	.	.	S	Bend	trans	-76.2	151.9	179.2	74.9	0	0	0	0	111.3	Y8 P46 I49 L54 Y55 R56	Y8-T52 HydrophobicContact CD1-CG2 4.48Å; Y8-T52 HydrophobicContact CE1-CG2 4.1Å; P46-T52 HydrophobicContact CB-CG2 4.26Å; P46-T52 PolarHBondContact O-OG1 2.91Å; I49-T52 HydrophobicContact CB-CG2 3.85Å; I49-T52 HydrophobicContact CG2-CG2 3.86Å; I49-T52 PolarHBondContact O-N 2.98Å; I49-T52 PolarHBondContact O-OG1 3.34Å; I49-T52 VanDerWaalsContact O-OG1 3.14Å; T52-L54 PolarHBondContact O-N 3.43Å; T52-Y55 PolarHBondContact O-N 3.08Å; T52-Y55 WeakPolarHBondContact OG1-CB 3.42Å; T52-Y55 PolarHBondContact OG1-N 3.27Å; T52-Y55 VanDerWaalsContact OG1-N 3.09Å; T52-R56 WeakPolarHBondContact O-CG 3.34Å; T52-R56 PolarHBondContact O-N 2.99Å; T52-R56 VanDerWaalsContact O-N 3.13Å
53	V	94.9	Very high	93.3	Very high	37 Å²	37	94.6 Å²	94.6	22%	0.224	43%	0.429	C	S	.	.	H	α-helix	trans	-61.2	-35.4	175.9	176.1	0	0	0	0	111.2	S9 F11 R56 R57	S9-V53 WeakPolarHBondContact O-CB 3.13Å; S9-V53 WeakPolarHBondContact O-CG2 3.44Å; S9-V53 PolarHBondContact O-N 2.96Å; F11-V53 HydrophobicContact CD1-CG2 4.43Å; F11-V53 HydrophobicContact CE1-CG2 4.3Å; V53-R56 PolarHBondContact O-N 2.98Å; V53-R57 WeakPolarHBondContact O-CG 3.46Å; V53-R57 PolarHBondContact O-N 3.4Å
54	L	95	Very high	92	Very high	55 Å²	55	89.8 Å²	89.8	29%	0.288	42%	0.42	S	S	.	.	H	α-helix	trans	-66.4	-42.5	179.2	-72.8	173.9	0	0	0	112.4	P46 R47 T52 R57 K58	P46-L54 HydrophobicContact CB-CD1 3.96Å; R47-L54 HydrophobicContact CG-CB 4.33Å; T52-L54 PolarHBondContact O-N 3.43Å; L54-R57 PolarHBondContact O-N 3.42Å; L54-K58 PolarHBondContact O-N 3.02Å
55	Y	96.3	Very high	90.4	Very high	55 Å²	55	86.2 Å²	86.2	22%	0.216	41%	0.409	C	S	.	.	H	α-helix	trans	-59.5	-49	172.4	178.3	-81.3	0	0	0	111	R47 I49 S50 T52 R57 K58 Y59	R47-Y55 VanDerWaalsContact O-CD2 3.32Å; R47-Y55 WeakPolarHBondContact O-CD2 3.39Å; I49-Y55 WeakPolarHBondContact O-CB 3.05Å; S50-Y55 VanDerWaalsContact CA-CD1 3.45Å; S50-Y55 VanDerWaalsContact CA-CG 3.49Å; S50-Y55 WeakPolarHBondContact O-CD1 3.37Å; T52-Y55 PolarHBondContact O-N 3.08Å; T52-Y55 WeakPolarHBondContact OG1-CB 3.42Å; T52-Y55 PolarHBondContact OG1-N 3.27Å; T52-Y55 VanDerWaalsContact OG1-N 3.09Å; Y55-R57 VanDerWaalsContact C-N 3.26Å; Y55-R57 PolarHBondContact O-N 3.26Å; Y55-K58 WeakPolarHBondContact O-CB 3.26Å; Y55-K58 PolarHBondContact O-N 2.95Å; Y55-K58 VanDerWaalsContact O-N 3.08Å; Y55-Y59 AromaticContact CD1-CD2 3.77Å; Y55-Y59 HydrophobicContact CD1-CD2 3.77Å; Y55-Y59 HydrophobicContact CD1-CE2 4.41Å; Y55-Y59 AromaticContact CD2-CD2 3.7Å; Y55-Y59 HydrophobicContact CD2-CD2 3.7Å; Y55-Y59 AromaticContact CD2-CE2 3.5Å; Y55-Y59 HydrophobicContact CD2-CE2 3.5Å; Y55-Y59 VanDerWaalsContact CD2-CE2 3.5Å; Y55-Y59 AromaticContact CE1-CD2 3.54Å; Y55-Y59 HydrophobicContact CE1-CD2 3.54Å; Y55-Y59 HydrophobicContact CE1-CE2 4.13Å; Y55-Y59 HydrophobicContact CE1-CG 4.23Å; Y55-Y59 AromaticContact CE2-CD2 3.49Å; Y55-Y59 HydrophobicContact CE2-CD2 3.49Å; Y55-Y59 VanDerWaalsContact CE2-CD2 3.49Å; Y55-Y59 AromaticContact CE2-CE2 3.16Å; Y55-Y59 HydrophobicContact CE2-CE2 3.16Å; Y55-Y59 AromaticContact CG-CD2 3.84Å; Y55-Y59 HydrophobicContact CG-CD2 3.84Å; Y55-Y59 HydrophobicContact CG-CE2 4.12Å; Y55-Y59 AromaticContact CZ-CD2 3.38Å; Y55-Y59 AromaticContact CZ-CE2 3.49Å; Y55-Y59 VanDerWaalsContact CZ-CE2 3.49Å; Y55-Y59 WeakPolarHBondContact O-CD2 3.37Å; Y55-Y59 PolarHBondContact O-N 3.45Å
56	R	94.6	Very high	88.6	Confident	121 Å²	121	91 Å²	91	46%	0.457	43%	0.429	S	S	.	.	H	α-helix	trans	-61.8	-34.1	-178.7	-64.9	-177.4	81.5	-104.7	3.1	112.5	T52 V53 K60 K61	T52-R56 WeakPolarHBondContact O-CG 3.34Å; T52-R56 PolarHBondContact O-N 2.99Å; T52-R56 VanDerWaalsContact O-N 3.13Å; V53-R56 PolarHBondContact O-N 2.98Å; R56-K60 CarbonylContact O-C 3.53Å; R56-K60 WeakPolarHBondContact O-CA 3.44Å; R56-K60 PolarHBondContact O-N 3.05Å; R56-K61 HydrophobicContact CB-CB 4.21Å; R56-K61 HydrophobicContact CG-CB 4.37Å; R56-K61 VanDerWaalsContact CZ-O 3.32Å; R56-K61 PolarHBondContact NH2-O 3.32Å; R56-K61 PolarHBondContact O-N 3.09Å
57	R	91.2	Very high	87.1	Confident	187 Å²	187	96.8 Å²	96.8	71%	0.706	46%	0.458	S	S	*	.	H	α-helix	trans	-68.9	-44	172	-73	177.5	-177.7	178.7	1.5	112.3	V53 L54 Y55 Y59 K60	V53-R57 WeakPolarHBondContact O-CG 3.46Å; V53-R57 PolarHBondContact O-N 3.4Å; L54-R57 PolarHBondContact O-N 3.42Å; Y55-R57 VanDerWaalsContact C-N 3.26Å; Y55-R57 PolarHBondContact O-N 3.26Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 3.49Å; R57-K60 PolarHBondContact O-N 3.11Å
58	K	93	Very high	85.7	Confident	108 Å²	108	96.8 Å²	96.8	47%	0.47	47%	0.472	S	S	.	.	H	α-helix	trans	-58.2	-45.9	177.5	-178.2	-175.5	175.9	-168.3	0	111.6	R47 L54 Y55	R47-K58 HydrophobicContact CB-CD 4.35Å; L54-K58 PolarHBondContact O-N 3.02Å; Y55-K58 WeakPolarHBondContact O-CB 3.26Å; Y55-K58 PolarHBondContact O-N 2.95Å; Y55-K58 VanDerWaalsContact O-N 3.08Å
59	Y	93.3	Very high	84.1	Confident	106 Å²	106	97.5 Å²	97.5	42%	0.416	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	12.8	-179.2	-64.5	-77.5	0	0	0	113.8	Y55 R57 K61	Y55-Y59 AromaticContact CD1-CD2 3.77Å; Y55-Y59 HydrophobicContact CD1-CD2 3.77Å; Y55-Y59 HydrophobicContact CD1-CE2 4.41Å; Y55-Y59 AromaticContact CD2-CD2 3.7Å; Y55-Y59 HydrophobicContact CD2-CD2 3.7Å; Y55-Y59 AromaticContact CD2-CE2 3.5Å; Y55-Y59 HydrophobicContact CD2-CE2 3.5Å; Y55-Y59 VanDerWaalsContact CD2-CE2 3.5Å; Y55-Y59 AromaticContact CE1-CD2 3.54Å; Y55-Y59 HydrophobicContact CE1-CD2 3.54Å; Y55-Y59 HydrophobicContact CE1-CE2 4.13Å; Y55-Y59 HydrophobicContact CE1-CG 4.23Å; Y55-Y59 AromaticContact CE2-CD2 3.49Å; Y55-Y59 HydrophobicContact CE2-CD2 3.49Å; Y55-Y59 VanDerWaalsContact CE2-CD2 3.49Å; Y55-Y59 AromaticContact CE2-CE2 3.16Å; Y55-Y59 HydrophobicContact CE2-CE2 3.16Å; Y55-Y59 AromaticContact CG-CD2 3.84Å; Y55-Y59 HydrophobicContact CG-CD2 3.84Å; Y55-Y59 HydrophobicContact CG-CE2 4.12Å; Y55-Y59 AromaticContact CZ-CD2 3.38Å; Y55-Y59 AromaticContact CZ-CE2 3.49Å; Y55-Y59 VanDerWaalsContact CZ-CE2 3.49Å; Y55-Y59 WeakPolarHBondContact O-CD2 3.37Å; Y55-Y59 PolarHBondContact O-N 3.45Å; R57-Y59 VanDerWaalsContact C-N 3.34Å; R57-Y59 PolarHBondContact O-N 3.49Å; Y59-K61 PolarHBondContact O-N 3.27Å; Y59-K61 VanDerWaalsContact O-N 3.08Å
60	K	89	Confident	82.8	Confident	116 Å²	116	103.9 Å²	103.9	50%	0.504	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	32.2	170.4	-52.8	175.2	145.7	-135.3	0	113.9	R56 R57 G62 E65	R56-K60 CarbonylContact O-C 3.53Å; R56-K60 WeakPolarHBondContact O-CA 3.44Å; R56-K60 PolarHBondContact O-N 3.05Å; R57-K60 PolarHBondContact O-N 3.11Å; K60-G62 PolarHBondContact O-N 3.06Å; K60-E65 HydrophobicContact CB-CG 4.08Å; K60-E65 WeakPolarHBondContact CB-OE1 3.37Å; K60-E65 WeakPolarHBondContact CD-OE1 3.35Å; K60-E65 WeakPolarHBondContact CE-OE1 3.45Å; K60-E65 WeakPolarHBondContact CG-OE1 3.28Å; K60-E65 IonicContact NZ-OE1 2.96Å; K60-E65 PolarHBondContact NZ-OE1 3.21Å; K60-E65 IonicContact NZ-OE2 2.9Å; K60-E65 PolarHBondContact NZ-OE2 2.66Å
61	K	88.6	Confident	81.6	Confident	135 Å²	135	111.8 Å²	111.8	59%	0.587	52%	0.517	S	S	*	.			trans	-78.3	24.4	-175.7	-64.9	-65.7	-173.2	177.7	0	113.4	R56 Y59	R56-K61 HydrophobicContact CB-CB 4.21Å; R56-K61 HydrophobicContact CG-CB 4.37Å; R56-K61 VanDerWaalsContact CZ-O 3.32Å; R56-K61 PolarHBondContact NH2-O 3.32Å; R56-K61 PolarHBondContact O-N 3.09Å; Y59-K61 PolarHBondContact O-N 3.27Å; Y59-K61 VanDerWaalsContact O-N 3.08Å
62	G	83.2	Confident	80.9	Confident	30 Å²	30	114.3 Å²	114.3	31%	0.309	54%	0.541	S	S	.	.	S	Bend	trans	-132.8	164.2	-177.2	0	0	0	0	0	112	K60 S64	K60-G62 PolarHBondContact O-N 3.06Å; G62-S64 PolarHBondContact O-N 3.13Å
63	I	79.4	Confident	80.1	Confident	171 Å²	171	123.5 Å²	123.5	88%	0.877	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-20	-174	-58.6	167.2	0	0	0	112	E65	I63-E65 PolarHBondContact O-N 3.04Å
64	S	66.2	Low	79.5	Confident	91 Å²	91	133.6 Å²	133.6	64%	0.636	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	7.3	-166.7	63.4	0	0	0	0	116.7	G62 E66	G62-S64 PolarHBondContact O-N 3.13Å; S64-E66 VanDerWaalsContact C-N 3.32Å; S64-E66 PolarHBondContact O-N 2.92Å
65	E	63.5	Low	79	Confident	59 Å²	59	137.2 Å²	137.2	28%	0.276	64%	0.639	S	S	.	*	H	α-helix	trans	-64.9	-32.1	-178.8	-78.4	-100.5	123.8	0	0	113.3	K60 I63 L67 K69	K60-E65 HydrophobicContact CB-CG 4.08Å; K60-E65 WeakPolarHBondContact CB-OE1 3.37Å; K60-E65 WeakPolarHBondContact CD-OE1 3.35Å; K60-E65 WeakPolarHBondContact CE-OE1 3.45Å; K60-E65 WeakPolarHBondContact CG-OE1 3.28Å; K60-E65 IonicContact NZ-OE1 2.96Å; K60-E65 PolarHBondContact NZ-OE1 3.21Å; K60-E65 IonicContact NZ-OE2 2.9Å; K60-E65 PolarHBondContact NZ-OE2 2.66Å; I63-E65 PolarHBondContact O-N 3.04Å; E65-L67 PolarHBondContact O-N 3.41Å; E65-K69 IonicContact OE2-NZ 3.18Å; E65-K69 PolarHBondContact OE2-NZ 2.94Å
66	E	59.7	Low	78.5	Confident	165 Å²	165	140.8 Å²	140.8	77%	0.771	67%	0.667	S	S	*	*	H	α-helix	trans	-72.1	-27.1	-170.6	-75.5	-173.1	145.1	0	0	113.8	S64 V68	S64-E66 VanDerWaalsContact C-N 3.32Å; S64-E66 PolarHBondContact O-N 2.92Å; E66-V68 PolarHBondContact O-N 3.23Å
67	L	64.8	Low	77.9	Confident	146 Å²	146	144.8 Å²	144.8	76%	0.764	69%	0.688	S	S	*	*	H	α-helix	trans	-72	-35.1	-171.9	-66.4	174.3	0	0	0	113.4	E65	E65-L67 PolarHBondContact O-N 3.41Å
68	V	66.1	Low	77.3	Confident	128 Å²	128	141 Å²	141	78%	0.776	69%	0.69	S	S	*	*	H	α-helix	trans	-86.2	-21.7	-172.2	-175.6	0	0	0	0	112.3	E66 K70	E66-V68 PolarHBondContact O-N 3.23Å; V68-K70 PolarHBondContact O-N 3.38Å
69	K	64.3	Low	76.7	Confident	142 Å²	142	139.2 Å²	139.2	62%	0.617	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-8	-175.8	-72.8	-178.3	-172.5	164.8	0	114.2	E65 R71	E65-K69 IonicContact OE2-NZ 3.18Å; E65-K69 PolarHBondContact OE2-NZ 2.94Å; K69-R71 PolarHBondContact O-N 3.44Å
70	K	68	Low	76	Confident	179 Å²	179	144.5 Å²	144.5	78%	0.778	72%	0.715	S	S	*	*			trans	-73	76.6	169.2	-72.2	-172.7	179.1	179.9	0	109.9	V68 T72	V68-K70 PolarHBondContact O-N 3.38Å; K70-T72 PolarHBondContact O-N 3.01Å
71	R	71.7	Confident	75.7	Confident	240 Å²	240	141 Å²	141	91%	0.906	71%	0.711	S	S	*	*			trans	-62.8	106.8	163.8	-75.9	-174	175.5	-175.2	-0.6	107.6	K69	K69-R71 PolarHBondContact O-N 3.44Å
72	T	78.9	Confident	75.4	Confident	129 Å²	129	140.4 Å²	140.4	79%	0.791	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-70.1	130.5	169.4	50.8	0	0	0	0	108.5	K70 R74	K70-T72 PolarHBondContact O-N 3.01Å; T72-R74 PolarHBondContact O-N 2.78Å
73	K	81.3	Confident	75.4	Confident	193 Å²	193	144 Å²	144	84%	0.839	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-65.9	131.9	170.7	-68.4	-177	179.2	179.5	0	107.6	V75	K73-V75 PolarHBondContact O-N 2.83Å
74	R	82	Confident	75.5	Confident	250 Å²	250	140 Å²	140	94%	0.943	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-67.6	116.9	169.6	-69.5	-176.8	-178.3	178	0.5	107.5	T72	T72-R74 PolarHBondContact O-N 2.78Å
75	V	84.7	Confident	76.4	Confident	130 Å²	130	137 Å²	137	79%	0.788	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-92	122.8	174.8	178.7	0	0	0	0	108.3	K73	K73-V75 PolarHBondContact O-N 2.83Å
76	T	85	Confident	77.5	Confident	131 Å²	131	136.6 Å²	136.6	80%	0.804	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-76.9	128	166	48.8	0	0	0	0	108.7	S78	T76-S78 PolarHBondContact O-N 3.36Å
77	K	82.3	Confident	78.7	Confident	205 Å²	205	131.7 Å²	131.7	89%	0.891	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-69.2	126.6	176.5	-65	-178	179.9	-179.7	0	109.4
78	S	79.1	Confident	79.7	Confident	108 Å²	108	128.1 Å²	128.1	76%	0.755	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-65.3	136.9	168.3	-46.9	0	0	0	0	109.7	T76	T76-S78 PolarHBondContact O-N 3.36Å
79	A	78.8	Confident	80.7	Confident	69 Å²	69	126.5 Å²	126.5	57%	0.57	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.5	172.9	0	0	0	0	0	110	L87	A79-L87 HydrophobicContact CB-CD1 4.25Å
80	R	79.8	Confident	81.7	Confident	218 Å²	218	121.3 Å²	121.3	82%	0.823	66%	0.658	S	S	*	*			trans	-112.5	161.1	176.5	-65.3	-177.2	179.5	-178.8	-2.2	109.8
81	G	83	Confident	82.6	Confident	41 Å²	41	117.3 Å²	117.3	42%	0.423	64%	0.643	S	S	.	*			trans	-60.1	157.6	166.3	0	0	0	0	0	111.3
82	I	82.4	Confident	83.3	Confident	123 Å²	123	108.9 Å²	108.9	63%	0.631	63%	0.625	S	S	*	*	B	Isolated β-bridge	trans	-104.9	152	176.3	-59.7	170.3	0	0	0	106.9	G84 A85 I90	I82-G84 PolarHBondContact O-N 3.13Å; I82-G84 VanDerWaalsContact O-N 3.1Å; I82-A85 PolarHBondContact N-O 3.14Å; I82-A85 CarbonylContact O-C 3.57Å; I82-A85 PolarHBondContact O-N 3.28Å; I82-I90 HydrophobicContact CB-CD1 4.43Å; I82-I90 HydrophobicContact CD1-CD1 4.07Å; I82-I90 HydrophobicContact CG1-CD1 4.02Å
83	A	82.4	Confident	83.6	Confident	106 Å²	106	109.5 Å²	109.5	88%	0.876	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	122.5	172.5	0	0	0	0	0	109.4
84	G	82.4	Confident	83.8	Confident	87 Å²	87	108.6 Å²	108.6	90%	0.897	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.7	1.7	-175.4	0	0	0	0	0	116.3	I82	I82-G84 PolarHBondContact O-N 3.13Å; I82-G84 VanDerWaalsContact O-N 3.1Å
85	A	83.8	Confident	84.1	Confident	29 Å²	29	102.7 Å²	102.7	24%	0.24	60%	0.595	C	S	.	*	B	Isolated β-bridge	trans	-149.2	122.7	169.8	0	0	0	0	0	112.5	I82 E89 I90	I82-A85 PolarHBondContact N-O 3.14Å; I82-A85 CarbonylContact O-C 3.57Å; I82-A85 PolarHBondContact O-N 3.28Å; A85-E89 VanDerWaalsContact CA-OE2 3.27Å; A85-E89 WeakPolarHBondContact CA-OE2 3.37Å; A85-I90 HydrophobicContact CB-CD1 4.34Å; A85-I90 HydrophobicContact CB-CG1 4.1Å
86	S	87.3	Confident	84.3	Confident	49 Å²	49	99.8 Å²	99.8	34%	0.343	57%	0.573	S	S	.	*			trans	-67.8	155.2	176.4	72.3	0	0	0	0	111.5	A88 E89 I90	S86-A88 PolarHBondContact O-N 3.31Å; S86-E89 WeakPolarHBondContact CB-OE1 3.49Å; S86-E89 PolarHBondContact N-OE2 3.35Å; S86-E89 PolarHBondContact O-N 3.12Å; S86-E89 VanDerWaalsContact O-N 3.14Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.21Å; S86-E89 PolarHBondContact OG-N 3.35Å; S86-E89 PolarHBondContact OG-OE1 3.07Å; S86-I90 WeakPolarHBondContact O-CG1 3.44Å; S86-I90 PolarHBondContact O-N 2.94Å
87	L	84.5	Confident	84.5	Confident	63 Å²	63	100.3 Å²	100.3	33%	0.33	56%	0.564	S	S	.	*	H	α-helix	trans	-57.6	-36	176.4	-179.2	63.6	0	0	0	111.3	A79 I90 M91	A79-L87 HydrophobicContact CB-CD1 4.25Å; L87-I90 PolarHBondContact O-N 2.97Å; L87-M91 HydrophobicContact CD1-CE 4Å; L87-M91 HydrophobicContact CD2-CE 3.98Å; L87-M91 HydrophobicContact CG-CE 3.88Å; L87-M91 HydrophobicContact CG-SD 4.46Å; L87-M91 WeakPolarHBondContact O-CB 3.45Å; L87-M91 WeakPolarHBondContact O-CG 3.39Å; L87-M91 PolarHBondContact O-N 2.94Å
88	A	85.9	Confident	84.8	Confident	70 Å²	70	95.4 Å²	95.4	58%	0.579	55%	0.553	S	S	*	*	H	α-helix	trans	-63.3	-44.6	176.5	0	0	0	0	0	111.8	S86 I90 M91 A92	S86-A88 PolarHBondContact O-N 3.31Å; A88-I90 PolarHBondContact O-N 3.46Å; A88-M91 PolarHBondContact O-N 3.39Å; A88-A92 WeakPolarHBondContact O-CB 3.23Å; A88-A92 PolarHBondContact O-N 3.01Å
89	E	86.1	Confident	85.3	Confident	95 Å²	95	97 Å²	97	44%	0.444	55%	0.549	S	S	.	.	H	α-helix	trans	-62.5	-41.8	175	-73.5	150.1	-136.8	0	0	112.2	A85 S86 A92 K93	A85-E89 VanDerWaalsContact CA-OE2 3.27Å; A85-E89 WeakPolarHBondContact CA-OE2 3.37Å; S86-E89 WeakPolarHBondContact CB-OE1 3.49Å; S86-E89 PolarHBondContact N-OE2 3.35Å; S86-E89 PolarHBondContact O-N 3.12Å; S86-E89 VanDerWaalsContact O-N 3.14Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.21Å; S86-E89 PolarHBondContact OG-N 3.35Å; S86-E89 PolarHBondContact OG-OE1 3.07Å; E89-A92 PolarHBondContact O-N 3.44Å; E89-K93 WeakPolarHBondContact O-CG 3.24Å; E89-K93 PolarHBondContact O-N 3.17Å
90	I	85.9	Confident	85.8	Confident	32 Å²	32	97.1 Å²	97.1	16%	0.164	54%	0.542	C	S	.	.	H	α-helix	trans	-63.5	-44.3	177	-64.1	168.8	0	0	0	110.2	I82 A85 S86 L87 A88 R94	I82-I90 HydrophobicContact CB-CD1 4.43Å; I82-I90 HydrophobicContact CD1-CD1 4.07Å; I82-I90 HydrophobicContact CG1-CD1 4.02Å; A85-I90 HydrophobicContact CB-CD1 4.34Å; A85-I90 HydrophobicContact CB-CG1 4.1Å; S86-I90 WeakPolarHBondContact O-CG1 3.44Å; S86-I90 PolarHBondContact O-N 2.94Å; L87-I90 PolarHBondContact O-N 2.97Å; A88-I90 PolarHBondContact O-N 3.46Å; I90-R94 WeakPolarHBondContact O-CB 3.29Å; I90-R94 WeakPolarHBondContact O-CG 3.49Å; I90-R94 PolarHBondContact O-N 2.77Å
91	M	86.9	Confident	86.2	Confident	96 Å²	96	91 Å²	91	47%	0.473	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-42.8	176.1	-75.5	-174	-178.3	0	0	111.8	L87 A88 K93 R94 N95	L87-M91 HydrophobicContact CD1-CE 4Å; L87-M91 HydrophobicContact CD2-CE 3.98Å; L87-M91 HydrophobicContact CG-CE 3.88Å; L87-M91 HydrophobicContact CG-SD 4.46Å; L87-M91 WeakPolarHBondContact O-CB 3.45Å; L87-M91 WeakPolarHBondContact O-CG 3.39Å; L87-M91 PolarHBondContact O-N 2.94Å; A88-M91 PolarHBondContact O-N 3.39Å; M91-K93 PolarHBondContact O-N 2.97Å; M91-R94 PolarHBondContact O-N 3.45Å; M91-N95 VanDerWaalsContact O-CB 3.26Å; M91-N95 WeakPolarHBondContact O-CB 3.49Å; M91-N95 VanDerWaalsContact O-CG 3.27Å; M91-N95 PolarHBondContact O-N 3.24Å; M91-N95 PolarHBondContact O-ND2 2.95Å
92	A	86.6	Confident	86.5	Confident	63 Å²	63	95 Å²	95	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-59.2	-46.8	177.6	0	0	0	0	0	111.4	A88 E89 N95 Q96	A88-A92 WeakPolarHBondContact O-CB 3.23Å; A88-A92 PolarHBondContact O-N 3.01Å; E89-A92 PolarHBondContact O-N 3.44Å; A92-N95 PolarHBondContact O-N 2.83Å; A92-Q96 WeakPolarHBondContact O-CG 3.38Å; A92-Q96 PolarHBondContact O-N 2.8Å
93	K	85	Confident	86.9	Confident	142 Å²	142	91.9 Å²	91.9	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-39.2	175.4	-71.8	179.8	179.4	178.1	0	112.6	E89 M91 R101	E89-K93 WeakPolarHBondContact O-CG 3.24Å; E89-K93 PolarHBondContact O-N 3.17Å; M91-K93 PolarHBondContact O-N 2.97Å; K93-R101 PolarHBondContact O-NH2 3.21Å
94	R	86	Confident	87.2	Confident	173 Å²	173	92.1 Å²	92.1	65%	0.653	50%	0.502	S	S	*	.	H	α-helix	trans	-70.3	-34.1	178.1	-79.4	-176.1	-179.3	179.3	2	113.5	I90 M91 R101	I90-R94 WeakPolarHBondContact O-CB 3.29Å; I90-R94 WeakPolarHBondContact O-CG 3.49Å; I90-R94 PolarHBondContact O-N 2.77Å; M91-R94 PolarHBondContact O-N 3.45Å; R94-R101 VanDerWaalsContact C-NH2 3.26Å; R94-R101 PolarHBondContact O-NH2 3.17Å
95	N	88.5	Confident	87.6	Confident	127 Å²	127	95.2 Å²	95.2	68%	0.679	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	8.6	-176.3	-65	-14.4	0	0	0	113.3	M91 A92 K97	M91-N95 VanDerWaalsContact O-CB 3.26Å; M91-N95 WeakPolarHBondContact O-CB 3.49Å; M91-N95 VanDerWaalsContact O-CG 3.27Å; M91-N95 PolarHBondContact O-N 3.24Å; M91-N95 PolarHBondContact O-ND2 2.95Å; A92-N95 PolarHBondContact O-N 2.83Å; N95-K97 PolarHBondContact O-N 2.62Å
96	Q	88.4	Confident	87.9	Confident	69 Å²	69	98 Å²	98	32%	0.322	50%	0.497	S	S	.	.			trans	-57	125.6	169.9	-74	176	-8.9	0	0	110.2	A92 R101	A92-Q96 WeakPolarHBondContact O-CG 3.38Å; A92-Q96 PolarHBondContact O-N 2.8Å; Q96-R101 HydrophobicContact CB-CG 4.08Å
97	K	89.7	Confident	88.1	Confident	141 Å²	141	103 Å²	103	61%	0.613	52%	0.515	S	S	*	.			trans	-54.9	146.8	176.4	-71	-175.4	177.3	-177.4	0	110.5	N95 E99 V100 R101	N95-K97 PolarHBondContact O-N 2.62Å; K97-E99 PolarHBondContact O-N 3.08Å; K97-E99 VanDerWaalsContact O-N 3.15Å; K97-V100 HydrophobicContact CB-CG2 4.36Å; K97-V100 PolarHBondContact O-N 3.44Å; K97-V100 VanDerWaalsContact O-N 3.09Å; K97-R101 PolarHBondContact O-N 3.09Å
98	P	88.9	Confident	88.3	Confident	102 Å²	102	104 Å²	104	66%	0.662	53%	0.533	S	S	*	.	H	α-helix	trans	-57.3	-31.6	-178.9	22.5	-33.1	0	0	0	112.8	R101 K102	P98-R101 PolarHBondContact O-N 2.74Å; P98-K102 WeakPolarHBondContact O-CB 3.49Å; P98-K102 PolarHBondContact O-N 3.25Å
99	E	89.3	Confident	88.5	Confident	142 Å²	142	107.4 Å²	107.4	66%	0.664	54%	0.54	S	S	*	.	H	α-helix	trans	-60.2	-49.4	174.9	-65.4	157.3	-172.2	0	0	112.3	K97 R101 K102 A103	K97-E99 PolarHBondContact O-N 3.08Å; K97-E99 VanDerWaalsContact O-N 3.15Å; E99-R101 VanDerWaalsContact C-N 3.31Å; E99-R101 PolarHBondContact O-N 3.14Å; E99-K102 PolarHBondContact O-N 3.14Å; E99-A103 PolarHBondContact O-N 2.76Å
100	V	88.2	Confident	88	Confident	72 Å²	72	116.2 Å²	116.2	44%	0.436	57%	0.569	S	S	.	*	H	α-helix	trans	-62	-42.4	178.3	179.8	0	0	0	0	110.2	K97 K102 A103 M104	K97-V100 HydrophobicContact CB-CG2 4.36Å; K97-V100 PolarHBondContact O-N 3.44Å; K97-V100 VanDerWaalsContact O-N 3.09Å; V100-K102 PolarHBondContact O-N 3.23Å; V100-A103 PolarHBondContact O-N 2.82Å; V100-M104 WeakPolarHBondContact O-CG 2.95Å; V100-M104 PolarHBondContact O-N 2.87Å; V100-M104 VanDerWaalsContact O-N 3.08Å
101	R	88.2	Confident	88.1	Confident	89 Å²	89	120.4 Å²	120.4	34%	0.336	59%	0.589	S	S	.	*	H	α-helix	trans	-64.1	-39.3	176.2	-72.7	-174.2	174.5	152.7	5.9	112.5	K93 R94 Q96 K97 P98 E99 R105	K93-R101 PolarHBondContact O-NH2 3.21Å; R94-R101 VanDerWaalsContact C-NH2 3.26Å; R94-R101 PolarHBondContact O-NH2 3.17Å; Q96-R101 HydrophobicContact CB-CG 4.08Å; K97-R101 PolarHBondContact O-N 3.09Å; P98-R101 PolarHBondContact O-N 2.74Å; E99-R101 VanDerWaalsContact C-N 3.31Å; E99-R101 PolarHBondContact O-N 3.14Å; R101-R105 WeakPolarHBondContact O-CG 3.36Å; R101-R105 PolarHBondContact O-N 3.46Å; R101-R105 VanDerWaalsContact O-N 3.09Å
102	K	89.9	Confident	88.2	Confident	124 Å²	124	121.7 Å²	121.7	54%	0.539	60%	0.595	S	S	.	*	H	α-helix	trans	-65.4	-47.2	178	-172.2	-177.4	174.3	-173.4	0	110.6	P98 E99 V100 M104 R105 D106	P98-K102 WeakPolarHBondContact O-CB 3.49Å; P98-K102 PolarHBondContact O-N 3.25Å; E99-K102 PolarHBondContact O-N 3.14Å; V100-K102 PolarHBondContact O-N 3.23Å; K102-M104 VanDerWaalsContact C-N 3.33Å; K102-M104 PolarHBondContact O-N 2.84Å; K102-R105 WeakPolarHBondContact O-CB 3.4Å; K102-R105 PolarHBondContact O-N 3.48Å; K102-D106 VanDerWaalsContact O-CG 3.32Å; K102-D106 PolarHBondContact O-N 3.25Å
103	A	90.4	Very high	88.3	Confident	59 Å²	59	124.9 Å²	124.9	49%	0.488	60%	0.599	S	S	.	*	H	α-helix	trans	-56.9	-44.2	176.2	0	0	0	0	0	112.5	E99 V100 R105 D106 Q107	E99-A103 PolarHBondContact O-N 2.76Å; V100-A103 PolarHBondContact O-N 2.82Å; A103-R105 VanDerWaalsContact C-N 3.34Å; A103-R105 PolarHBondContact O-N 2.85Å; A103-D106 PolarHBondContact O-N 3.48Å; A103-Q107 WeakPolarHBondContact O-CB 3.41Å; A103-Q107 PolarHBondContact O-N 3.1Å
104	M	88.9	Confident	88.5	Confident	110 Å²	110	123.9 Å²	123.9	54%	0.542	60%	0.598	S	S	.	*	H	α-helix	trans	-64	-35.7	175.8	-68	-176.1	85.4	0	0	113	V100 K102 A108	V100-M104 WeakPolarHBondContact O-CG 2.95Å; V100-M104 PolarHBondContact O-N 2.87Å; V100-M104 VanDerWaalsContact O-N 3.08Å; K102-M104 VanDerWaalsContact C-N 3.33Å; K102-M104 PolarHBondContact O-N 2.84Å; M104-A108 WeakPolarHBondContact O-CB 3.35Å; M104-A108 PolarHBondContact O-N 2.86Å
105	R	90.6	Very high	88.6	Confident	152 Å²	152	120.9 Å²	120.9	57%	0.574	60%	0.595	S	S	*	*	H	α-helix	trans	-69.7	-46.6	175.8	-73.5	-179.2	-151	141.7	0.2	111.8	R101 K102 A103 Q107 A108 I109	R101-R105 WeakPolarHBondContact O-CG 3.36Å; R101-R105 PolarHBondContact O-N 3.46Å; R101-R105 VanDerWaalsContact O-N 3.09Å; K102-R105 WeakPolarHBondContact O-CB 3.4Å; K102-R105 PolarHBondContact O-N 3.48Å; A103-R105 VanDerWaalsContact C-N 3.34Å; A103-R105 PolarHBondContact O-N 2.85Å; R105-Q107 VanDerWaalsContact C-N 3.27Å; R105-Q107 PolarHBondContact O-N 2.73Å; R105-A108 PolarHBondContact O-N 3.41Å; R105-A108 VanDerWaalsContact O-N 3.09Å; R105-I109 WeakPolarHBondContact O-CG1 3.39Å; R105-I109 PolarHBondContact O-N 3.29Å
106	D	91.1	Very high	88.6	Confident	87 Å²	87	120.5 Å²	120.5	47%	0.465	59%	0.589	S	S	.	*	H	α-helix	trans	-62.8	-38.2	-179	-65.4	-15.7	0	0	0	110.3	K102 A103	K102-D106 VanDerWaalsContact O-CG 3.32Å; K102-D106 PolarHBondContact O-N 3.25Å; A103-D106 PolarHBondContact O-N 3.48Å
107	Q	90.8	Very high	88.7	Confident	154 Å²	154	124.1 Å²	124.1	72%	0.72	61%	0.608	S	S	*	*	H	α-helix	trans	-64.9	-37.9	172.7	-174.8	178.6	6.9	0	0	112.9	A103 R105 I109 R110	A103-Q107 WeakPolarHBondContact O-CB 3.41Å; A103-Q107 PolarHBondContact O-N 3.1Å; R105-Q107 VanDerWaalsContact C-N 3.27Å; R105-Q107 PolarHBondContact O-N 2.73Å; Q107-I109 VanDerWaalsContact C-N 3.35Å; Q107-R110 PolarHBondContact O-N 3.39Å
108	A	90	Very high	88.6	Confident	84 Å²	84	122.8 Å²	122.8	69%	0.694	61%	0.608	S	S	*	*	H	α-helix	trans	-77.3	-18.9	-178.6	0	0	0	0	0	114.1	M104 R105	M104-A108 WeakPolarHBondContact O-CB 3.35Å; M104-A108 PolarHBondContact O-N 2.86Å; R105-A108 PolarHBondContact O-N 3.41Å; R105-A108 VanDerWaalsContact O-N 3.09Å
109	I	89.2	Confident	88.6	Confident	143 Å²	143	124.6 Å²	124.6	73%	0.733	60%	0.604	S	S	*	*	H	α-helix	trans	-78	-26.6	174	-70.6	166	0	0	0	111.1	R105 Q107	R105-I109 WeakPolarHBondContact O-CG1 3.39Å; R105-I109 PolarHBondContact O-N 3.29Å; Q107-I109 VanDerWaalsContact C-N 3.35Å
110	R	76.2	Confident	88.5	Confident	279 Å²	279	123 Å²	123	100%	1.053	60%	0.598	S	S	*	*			trans	-80.1	0	177.8	-175.1	175.7	-179.5	166.5	1.2	111.5	Q107	Q107-R110 PolarHBondContact O-N 3.39Å

Retrieved 110 of 110 residues in 25.4 ms (Link to these results)

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