G4VT25_SCHMA Loading...

P53 and DNA damage-regulated protein 1

AlphaFold DB , UniProt , Accession G4VT25, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 121 aa.

						>G4VT25_SCHMA|G4VT25
MTEMDLSTQNKVIRHLEEIEEAGEMVLAKKQECIVYDRNRQKSREAVRQLMQLDSENKQWACLSDQFFLFPSVGLRKAIEEDIKVYDSEIQKLNHQLKEDIKWLHELEGKEPLKGFDLLPL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.4	Very low	80.5	Confident	241 Å²	241	118 Å²	118	100%	1.187	61%	0.61	S	S	*	*				0	96.4	0	-160.3	164.7	80.3	0	0	105.5	E3	M1-E3 PolarHBondContact O-N 3.35Å
2	T	62.2	Low	81.7	Confident	142 Å²	142	113.7 Å²	113.7	87%	0.871	59%	0.593	S	S	*	*			trans	-72.6	117.2	-171.2	-36.4	0	0	0	0	108.2	M4	T2-M4 PolarHBondContact O-N 3.16Å; T2-M4 VanDerWaalsContact O-N 3.16Å
3	E	69.5	Low	82.8	Confident	190 Å²	190	111.6 Å²	111.6	89%	0.888	58%	0.581	S	S	*	*			trans	-57.3	119.2	169	-82	178.3	164	0	0	108.2	M1 D5	M1-E3 PolarHBondContact O-N 3.35Å; E3-D5 PolarHBondContact O-N 2.67Å
4	M	73.4	Confident	83.7	Confident	91 Å²	91	115.6 Å²	115.6	45%	0.448	59%	0.585	S	S	.	*			trans	-67.2	114.7	173.3	-179.1	164	61.9	0	0	107.7	T2 T8 Q9 V12	T2-M4 PolarHBondContact O-N 3.16Å; T2-M4 VanDerWaalsContact O-N 3.16Å; M4-T8 HydrophobicContact CG-CG2 3.68Å; M4-T8 HydrophobicContact SD-CG2 3.82Å; M4-Q9 HydrophobicContact CB-CG 4.2Å; M4-Q9 HydrophobicContact CE-CB 4.22Å; M4-Q9 HydrophobicContact CE-CG 3.63Å; M4-Q9 HydrophobicContact CG-CG 3.76Å; M4-Q9 PolarHBondContact O-NE2 3.33Å; M4-Q9 HydrophobicContact SD-CG 4.3Å; M4-V12 HydrophobicContact SD-CG2 4.39Å
5	D	85.6	Confident	84.5	Confident	99 Å²	99	113.3 Å²	113.3	53%	0.529	57%	0.571	S	S	.	*			trans	-52.6	142.5	176.4	172.3	37.7	0	0	0	110.6	E3 S7 T8 Q9	E3-D5 PolarHBondContact O-N 2.67Å; D5-S7 PolarHBondContact O-N 3.23Å; D5-S7 VanDerWaalsContact O-N 3.07Å; D5-S7 VanDerWaalsContact OD2-CB 3.3Å; D5-S7 WeakPolarHBondContact OD2-CB 3.21Å; D5-S7 PolarHBondContact OD2-OG 2.86Å; D5-T8 WeakPolarHBondContact O-CA 3.21Å; D5-T8 WeakPolarHBondContact O-CB 3.33Å; D5-T8 PolarHBondContact O-N 3.15Å; D5-Q9 PolarHBondContact O-N 3.21Å; D5-Q9 VanDerWaalsContact O-N 3.08Å
6	L	87	Confident	85.3	Confident	112 Å²	112	112.6 Å²	112.6	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-52.2	-34.4	-177.6	-176	67.6	0	0	0	112	T8 Q9 N10	L6-T8 VanDerWaalsContact C-N 3.31Å; L6-T8 PolarHBondContact O-N 3.38Å; L6-Q9 PolarHBondContact O-N 3.09Å; L6-N10 PolarHBondContact O-N 2.66Å; L6-N10 PolarHBondContact O-ND2 3.04Å
7	S	90.2	Very high	86	Confident	57 Å²	57	112.4 Å²	112.4	40%	0.399	57%	0.565	S	S	.	*	H	α-helix	trans	-63.5	-36.7	175.8	77.4	0	0	0	0	112.9	D5 K11	D5-S7 PolarHBondContact O-N 3.23Å; D5-S7 VanDerWaalsContact O-N 3.07Å; D5-S7 VanDerWaalsContact OD2-CB 3.3Å; D5-S7 WeakPolarHBondContact OD2-CB 3.21Å; D5-S7 PolarHBondContact OD2-OG 2.86Å; S7-K11 WeakPolarHBondContact O-CG 3.36Å; S7-K11 PolarHBondContact O-N 3.37Å
8	T	92.1	Very high	86.6	Confident	61 Å²	61	111.4 Å²	111.4	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-74.6	-39.9	177.8	-56.1	0	0	0	0	110.2	M4 D5 L6 N10 K11 V12	M4-T8 HydrophobicContact CG-CG2 3.68Å; M4-T8 HydrophobicContact SD-CG2 3.82Å; D5-T8 WeakPolarHBondContact O-CA 3.21Å; D5-T8 WeakPolarHBondContact O-CB 3.33Å; D5-T8 PolarHBondContact O-N 3.15Å; L6-T8 VanDerWaalsContact C-N 3.31Å; L6-T8 PolarHBondContact O-N 3.38Å; T8-N10 VanDerWaalsContact C-N 3.35Å; T8-N10 PolarHBondContact O-N 2.81Å; T8-K11 PolarHBondContact O-N 2.82Å; T8-V12 WeakPolarHBondContact O-CG2 3.42Å; T8-V12 PolarHBondContact O-N 2.96Å
9	Q	91.3	Very high	87.2	Confident	77 Å²	77	107.3 Å²	107.3	36%	0.36	54%	0.538	S	S	.	.	H	α-helix	trans	-56.9	-48.3	174.5	-54.4	-171.5	-8.6	0	0	111.3	M4 D5 L6 K11 V12 I13	M4-Q9 HydrophobicContact CB-CG 4.2Å; M4-Q9 HydrophobicContact CE-CB 4.22Å; M4-Q9 HydrophobicContact CE-CG 3.63Å; M4-Q9 HydrophobicContact CG-CG 3.76Å; M4-Q9 PolarHBondContact O-NE2 3.33Å; M4-Q9 HydrophobicContact SD-CG 4.3Å; D5-Q9 PolarHBondContact O-N 3.21Å; D5-Q9 VanDerWaalsContact O-N 3.08Å; L6-Q9 PolarHBondContact O-N 3.09Å; Q9-K11 VanDerWaalsContact C-N 3.3Å; Q9-K11 PolarHBondContact O-N 3.07Å; Q9-V12 PolarHBondContact O-N 3.42Å; Q9-I13 WeakPolarHBondContact O-CG1 3.46Å; Q9-I13 PolarHBondContact O-N 3.27Å
10	N	94.1	Very high	87.7	Confident	79 Å²	79	108.1 Å²	108.1	42%	0.422	54%	0.54	S	S	.	.	H	α-helix	trans	-62.8	-34.8	178.8	-73.2	-27.6	0	0	0	113	L6 T8 R14	L6-N10 PolarHBondContact O-N 2.66Å; L6-N10 PolarHBondContact O-ND2 3.04Å; T8-N10 VanDerWaalsContact C-N 3.35Å; T8-N10 PolarHBondContact O-N 2.81Å; N10-R14 WeakPolarHBondContact O-CG 3.4Å; N10-R14 PolarHBondContact O-N 3.08Å; N10-R14 VanDerWaalsContact O-N 3.08Å
11	K	94.1	Very high	88.1	Confident	149 Å²	149	109 Å²	109	65%	0.648	54%	0.543	S	S	*	.	H	α-helix	trans	-67.2	-42.5	175	-74	174.7	-177.8	179.4	0	111.8	S7 T8 Q9 H15	S7-K11 WeakPolarHBondContact O-CG 3.36Å; S7-K11 PolarHBondContact O-N 3.37Å; T8-K11 PolarHBondContact O-N 2.82Å; Q9-K11 VanDerWaalsContact C-N 3.3Å; Q9-K11 PolarHBondContact O-N 3.07Å; K11-H15 WeakPolarHBondContact O-CB 3.44Å; K11-H15 PolarHBondContact O-N 3.16Å
12	V	94.5	Very high	90.6	Very high	66 Å²	66	97.8 Å²	97.8	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-44.9	177.2	173.4	0	0	0	0	110.6	M4 T8 Q9 H15 L16	M4-V12 HydrophobicContact SD-CG2 4.39Å; T8-V12 WeakPolarHBondContact O-CG2 3.42Å; T8-V12 PolarHBondContact O-N 2.96Å; Q9-V12 PolarHBondContact O-N 3.42Å; V12-H15 PolarHBondContact O-N 2.87Å; V12-L16 HydrophobicContact CG1-CD1 4.12Å; V12-L16 HydrophobicContact CG1-CG 4.5Å; V12-L16 WeakPolarHBondContact O-CG 3.49Å; V12-L16 PolarHBondContact O-N 3.5Å
13	I	95.9	Very high	92.3	Very high	87 Å²	87	91.9 Å²	91.9	45%	0.446	46%	0.455	S	S	.	.	H	α-helix	trans	-59.7	-50.3	178	-68.6	168.2	0	0	0	110.6	Q9 H15 L16 E17	Q9-I13 WeakPolarHBondContact O-CG1 3.46Å; Q9-I13 PolarHBondContact O-N 3.27Å; I13-H15 VanDerWaalsContact C-N 3.29Å; I13-H15 PolarHBondContact O-N 3.36Å; I13-L16 WeakPolarHBondContact O-CB 3.48Å; I13-L16 PolarHBondContact O-N 3.18Å; I13-L16 VanDerWaalsContact O-N 3.08Å; I13-E17 HydrophobicContact CG2-CG 4.31Å; I13-E17 WeakPolarHBondContact O-CG 3.3Å; I13-E17 PolarHBondContact O-N 2.95Å
14	R	95.9	Very high	93.6	Very high	167 Å²	167	88.7 Å²	88.7	63%	0.63	44%	0.441	S	S	*	.	H	α-helix	trans	-58.2	-41.3	177.9	-75	178.6	-176.2	-173.7	-1.3	113	N10 L16 E17 E18	N10-R14 WeakPolarHBondContact O-CG 3.4Å; N10-R14 PolarHBondContact O-N 3.08Å; N10-R14 VanDerWaalsContact O-N 3.08Å; R14-L16 VanDerWaalsContact C-N 3.32Å; R14-L16 PolarHBondContact O-N 3.44Å; R14-E17 WeakPolarHBondContact O-CB 3.45Å; R14-E17 PolarHBondContact O-N 3.21Å; R14-E18 WeakPolarHBondContact O-CG 3.45Å; R14-E18 PolarHBondContact O-N 3.14Å
15	H	95.8	Very high	94.7	Very high	82 Å²	82	87.9 Å²	87.9	38%	0.38	44%	0.437	S	S	.	.	H	α-helix	trans	-65.8	-37.3	177.6	-176.1	53.3	0	0	0	112.2	K11 V12 I13 E18 I19 L107	K11-H15 WeakPolarHBondContact O-CB 3.44Å; K11-H15 PolarHBondContact O-N 3.16Å; V12-H15 PolarHBondContact O-N 2.87Å; I13-H15 VanDerWaalsContact C-N 3.29Å; I13-H15 PolarHBondContact O-N 3.36Å; H15-E18 IonicContact ND1-OE2 3.97Å; H15-E18 PolarHBondContact O-N 2.97Å; H15-I19 WeakPolarHBondContact O-CG1 3.3Å; H15-I19 PolarHBondContact O-N 3.27Å; H15-I19 VanDerWaalsContact O-N 3.1Å; H15-L107 PolarHBondContact CE1-O 3.29Å; H15-L107 PolarHBondContact NE2-O 2.61Å
16	L	96.8	Very high	95.3	Very high	102 Å²	102	84 Å²	84	53%	0.534	42%	0.417	S	S	.	.	H	α-helix	trans	-67.6	-39.2	173.3	-71	173.9	0	0	0	112.2	V12 I13 R14 E18 I19 E20	V12-L16 HydrophobicContact CG1-CD1 4.12Å; V12-L16 HydrophobicContact CG1-CG 4.5Å; V12-L16 WeakPolarHBondContact O-CG 3.49Å; V12-L16 PolarHBondContact O-N 3.5Å; I13-L16 WeakPolarHBondContact O-CB 3.48Å; I13-L16 PolarHBondContact O-N 3.18Å; I13-L16 VanDerWaalsContact O-N 3.08Å; R14-L16 VanDerWaalsContact C-N 3.32Å; R14-L16 PolarHBondContact O-N 3.44Å; L16-E18 VanDerWaalsContact C-N 3.35Å; L16-I19 PolarHBondContact O-N 3.38Å; L16-E20 WeakPolarHBondContact O-CB 3.21Å; L16-E20 PolarHBondContact O-N 2.9Å
17	E	97.5	Very high	95.8	Very high	108 Å²	108	84.2 Å²	84.2	51%	0.505	42%	0.418	S	S	.	.	H	α-helix	trans	-60.3	-43.3	173.7	-70.4	169.9	164.1	0	0	111.1	I13 R14 I19 E20 E21	I13-E17 HydrophobicContact CG2-CG 4.31Å; I13-E17 WeakPolarHBondContact O-CG 3.3Å; I13-E17 PolarHBondContact O-N 2.95Å; R14-E17 WeakPolarHBondContact O-CB 3.45Å; R14-E17 PolarHBondContact O-N 3.21Å; E17-I19 PolarHBondContact O-N 2.56Å; E17-E20 PolarHBondContact O-N 3.29Å; E17-E21 WeakPolarHBondContact O-CB 3.38Å; E17-E21 PolarHBondContact O-N 2.9Å
18	E	96.8	Very high	96.1	Very high	95 Å²	95	84.5 Å²	84.5	44%	0.444	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-41.2	175.6	-73.3	169.9	-175.4	0	0	112.2	R14 H15 L16 A22 L107	R14-E18 WeakPolarHBondContact O-CG 3.45Å; R14-E18 PolarHBondContact O-N 3.14Å; H15-E18 IonicContact ND1-OE2 3.97Å; H15-E18 PolarHBondContact O-N 2.97Å; L16-E18 VanDerWaalsContact C-N 3.35Å; E18-A22 WeakPolarHBondContact O-CB 3.41Å; E18-A22 PolarHBondContact O-N 3.1Å; E18-L107 HydrophobicContact CB-CD1 4.26Å; E18-L107 HydrophobicContact CB-CD2 4.43Å
19	I	97.4	Very high	96.4	Very high	34 Å²	34	83.4 Å²	83.4	17%	0.174	41%	0.413	C	S	.	.	H	α-helix	trans	-64	-43.5	175	-70	165.2	0	0	0	110.6	H15 L16 E17 A22 G23 L104 L107 E108	H15-I19 WeakPolarHBondContact O-CG1 3.3Å; H15-I19 PolarHBondContact O-N 3.27Å; H15-I19 VanDerWaalsContact O-N 3.1Å; L16-I19 PolarHBondContact O-N 3.38Å; E17-I19 PolarHBondContact O-N 2.56Å; I19-A22 PolarHBondContact O-N 3.47Å; I19-G23 PolarHBondContact O-N 3.32Å; I19-L104 HydrophobicContact CG2-CD1 4.1Å; I19-L107 HydrophobicContact CG1-CB 3.74Å; I19-E108 HydrophobicContact CG2-CG 4.15Å
20	E	97.5	Very high	96.7	Very high	123 Å²	123	85.3 Å²	85.3	58%	0.575	42%	0.42	S	S	*	.	H	α-helix	trans	-61.9	-49.3	178.6	-177.5	171.1	-155.9	0	0	111.2	L16 E17 A22 G23 E24	L16-E20 WeakPolarHBondContact O-CB 3.21Å; L16-E20 PolarHBondContact O-N 2.9Å; E17-E20 PolarHBondContact O-N 3.29Å; E20-A22 VanDerWaalsContact C-N 3.35Å; E20-A22 PolarHBondContact O-N 3.08Å; E20-G23 WeakPolarHBondContact O-CA 3.38Å; E20-G23 PolarHBondContact O-N 3.3Å; E20-G23 VanDerWaalsContact O-N 3.11Å; E20-E24 WeakPolarHBondContact O-CG 3.33Å; E20-E24 PolarHBondContact O-N 3.19Å
21	E	97.3	Very high	96.9	Very high	127 Å²	127	86.2 Å²	86.2	59%	0.593	42%	0.422	S	S	*	.	H	α-helix	trans	-58.7	-45.2	177.7	-175.5	178.7	-179	0	0	111.7	E17 G23 E24 M25	E17-E21 WeakPolarHBondContact O-CB 3.38Å; E17-E21 PolarHBondContact O-N 2.9Å; E21-G23 VanDerWaalsContact C-N 3.34Å; E21-G23 PolarHBondContact O-N 3.04Å; E21-E24 PolarHBondContact O-N 3.02Å; E21-M25 WeakPolarHBondContact O-CB 3.47Å; E21-M25 PolarHBondContact O-N 3.35Å
22	A	97.2	Very high	97	Very high	5 Å²	5	82.6 Å²	82.6	4%	0.041	41%	0.407	C	S	.	.	H	α-helix	trans	-62.9	-40.8	175.7	0	0	0	0	0	111.8	E18 I19 E20 M25 V26 L104 L107	E18-A22 WeakPolarHBondContact O-CB 3.41Å; E18-A22 PolarHBondContact O-N 3.1Å; I19-A22 PolarHBondContact O-N 3.47Å; E20-A22 VanDerWaalsContact C-N 3.35Å; E20-A22 PolarHBondContact O-N 3.08Å; A22-M25 PolarHBondContact O-N 2.96Å; A22-V26 WeakPolarHBondContact O-CG2 3.47Å; A22-V26 PolarHBondContact O-N 3.49Å; A22-V26 VanDerWaalsContact O-N 3.11Å; A22-L104 HydrophobicContact CB-CB 4.31Å; A22-L104 HydrophobicContact CB-CD1 3.93Å; A22-L107 HydrophobicContact CB-CD1 3.85Å
23	G	97.6	Very high	97.1	Very high	18 Å²	18	80.4 Å²	80.4	19%	0.186	40%	0.395	C	S	.	.	H	α-helix	trans	-62.5	-46.8	176	0	0	0	0	0	112.9	I19 E20 E21 M25 V26 L27	I19-G23 PolarHBondContact O-N 3.32Å; E20-G23 WeakPolarHBondContact O-CA 3.38Å; E20-G23 PolarHBondContact O-N 3.3Å; E20-G23 VanDerWaalsContact O-N 3.11Å; E21-G23 VanDerWaalsContact C-N 3.34Å; E21-G23 PolarHBondContact O-N 3.04Å; G23-M25 VanDerWaalsContact C-N 3.34Å; G23-M25 PolarHBondContact O-N 2.87Å; G23-V26 PolarHBondContact O-N 2.93Å; G23-L27 WeakPolarHBondContact O-CG 3.38Å; G23-L27 PolarHBondContact O-N 3.08Å
24	E	98	Very high	97.2	Very high	124 Å²	124	79.2 Å²	79.2	58%	0.579	39%	0.389	S	S	*	.	H	α-helix	trans	-61.2	-42.5	176.6	-73	-167.4	158.4	0	0	111.7	E20 E21 V26 L27 A28	E20-E24 WeakPolarHBondContact O-CG 3.33Å; E20-E24 PolarHBondContact O-N 3.19Å; E21-E24 PolarHBondContact O-N 3.02Å; E24-V26 PolarHBondContact O-N 3.19Å; E24-L27 PolarHBondContact O-N 3.43Å; E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.44Å
25	M	96.7	Very high	97.3	Very high	74 Å²	74	74 Å²	74	37%	0.365	38%	0.376	S	S	.	.	H	α-helix	trans	-60.1	-46	177.4	-170.3	-173	-51.7	0	0	112.1	E21 A22 G23 L27 A28 K29	E21-M25 WeakPolarHBondContact O-CB 3.47Å; E21-M25 PolarHBondContact O-N 3.35Å; A22-M25 PolarHBondContact O-N 2.96Å; G23-M25 VanDerWaalsContact C-N 3.34Å; G23-M25 PolarHBondContact O-N 2.87Å; M25-L27 VanDerWaalsContact C-N 3.34Å; M25-L27 PolarHBondContact O-N 3.03Å; M25-A28 PolarHBondContact O-N 3.33Å; M25-K29 HydrophobicContact CG-CD 4.14Å; M25-K29 WeakPolarHBondContact O-CB 3.4Å; M25-K29 PolarHBondContact O-N 2.96Å; M25-K29 PolarHBondContact SD-NZ 3.32Å
26	V	97.2	Very high	97.4	Very high	18 Å²	18	72.9 Å²	72.9	11%	0.109	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-44.8	176.3	167.8	0	0	0	0	110.8	A22 G23 E24 K30 L97 D100 I101 L104	A22-V26 WeakPolarHBondContact O-CG2 3.47Å; A22-V26 PolarHBondContact O-N 3.49Å; A22-V26 VanDerWaalsContact O-N 3.11Å; G23-V26 PolarHBondContact O-N 2.93Å; E24-V26 PolarHBondContact O-N 3.19Å; V26-K30 VanDerWaalsContact O-CB 3.26Å; V26-K30 WeakPolarHBondContact O-CB 3.41Å; V26-K30 PolarHBondContact O-N 3.27Å; V26-L97 HydrophobicContact CB-CD1 4.4Å; V26-L97 HydrophobicContact CG1-CD1 3.89Å; V26-L97 WeakPolarHBondContact O-CD1 3.49Å; V26-D100 HydrophobicContact CG2-CB 3.64Å; V26-I101 HydrophobicContact CG1-CD1 4.41Å; V26-I101 HydrophobicContact CG1-CG1 3.8Å; V26-I101 HydrophobicContact CG2-CG1 4Å; V26-L104 HydrophobicContact CG2-CD2 4.32Å
27	L	97.8	Very high	97.4	Very high	116 Å²	116	70.7 Å²	70.7	61%	0.607	36%	0.357	S	S	*	.	H	α-helix	trans	-65.1	-43.1	178.9	-70.6	175.5	0	0	0	112.1	G23 E24 M25 K30 Q31	G23-L27 WeakPolarHBondContact O-CG 3.38Å; G23-L27 PolarHBondContact O-N 3.08Å; E24-L27 PolarHBondContact O-N 3.43Å; M25-L27 VanDerWaalsContact C-N 3.34Å; M25-L27 PolarHBondContact O-N 3.03Å; L27-K30 PolarHBondContact O-N 3.02Å; L27-Q31 WeakPolarHBondContact O-CB 3.39Å; L27-Q31 PolarHBondContact O-N 3.12Å
28	A	97.6	Very high	97.5	Very high	62 Å²	62	73 Å²	73	51%	0.512	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-50.5	178.4	0	0	0	0	0	111.6	E24 M25 K30 Q31 E32	E24-A28 WeakPolarHBondContact O-CB 3.33Å; E24-A28 PolarHBondContact O-N 3.44Å; M25-A28 PolarHBondContact O-N 3.33Å; A28-K30 VanDerWaalsContact C-N 3.33Å; A28-K30 PolarHBondContact O-N 3.2Å; A28-Q31 WeakPolarHBondContact O-CB 3.38Å; A28-Q31 PolarHBondContact O-N 3.35Å; A28-Q31 VanDerWaalsContact O-N 3.12Å; A28-E32 PolarHBondContact O-N 3.25Å
29	K	97.4	Very high	97.4	Very high	38 Å²	38	71 Å²	71	17%	0.165	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-38.4	178	-75.4	170.6	172.4	167	0	112.3	M25 Q31 E32 C33 L93 L97 D100	M25-K29 HydrophobicContact CG-CD 4.14Å; M25-K29 WeakPolarHBondContact O-CB 3.4Å; M25-K29 PolarHBondContact O-N 2.96Å; M25-K29 PolarHBondContact SD-NZ 3.32Å; K29-Q31 VanDerWaalsContact C-N 3.33Å; K29-Q31 PolarHBondContact O-N 2.88Å; K29-E32 PolarHBondContact O-N 2.85Å; K29-C33 PolarHBondContact O-N 2.96Å; K29-L93 HydrophobicContact CB-CD2 4.49Å; K29-L93 HydrophobicContact CG-CD2 4.31Å; K29-L97 HydrophobicContact CB-CD1 4.18Å; K29-D100 WeakPolarHBondContact CD-OD2 3.36Å; K29-D100 VanDerWaalsContact CE-OD2 3.29Å; K29-D100 WeakPolarHBondContact CE-OD2 3.33Å; K29-D100 IonicContact NZ-OD1 3.37Å; K29-D100 PolarHBondContact NZ-OD1 3.23Å; K29-D100 IonicContact NZ-OD2 3.71Å; K29-D100 PolarHBondContact NZ-OD2 2.91Å
30	K	97.3	Very high	97.5	Very high	118 Å²	118	71.3 Å²	71.3	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-60.6	-43.6	173.1	-179.8	178.1	178.3	180	0	111.4	V26 L27 A28 C33 I34	V26-K30 VanDerWaalsContact O-CB 3.26Å; V26-K30 WeakPolarHBondContact O-CB 3.41Å; V26-K30 PolarHBondContact O-N 3.27Å; L27-K30 PolarHBondContact O-N 3.02Å; A28-K30 VanDerWaalsContact C-N 3.33Å; A28-K30 PolarHBondContact O-N 3.2Å; K30-C33 PolarHBondContact O-N 2.84Å; K30-I34 HydrophobicContact CG-CD1 4.5Å; K30-I34 WeakPolarHBondContact O-CG1 3.41Å; K30-I34 PolarHBondContact O-N 3.04Å
31	Q	97.8	Very high	97.5	Very high	98 Å²	98	69.1 Å²	69.1	46%	0.458	34%	0.342	S	S	.	.	H	α-helix	trans	-65.6	-40.2	177.6	-177.7	56.1	35.2	0	0	111.7	L27 A28 K29 I34 V35	L27-Q31 WeakPolarHBondContact O-CB 3.39Å; L27-Q31 PolarHBondContact O-N 3.12Å; A28-Q31 WeakPolarHBondContact O-CB 3.38Å; A28-Q31 PolarHBondContact O-N 3.35Å; A28-Q31 VanDerWaalsContact O-N 3.12Å; K29-Q31 VanDerWaalsContact C-N 3.33Å; K29-Q31 PolarHBondContact O-N 2.88Å; Q31-I34 WeakPolarHBondContact O-CB 3.5Å; Q31-I34 PolarHBondContact O-N 2.99Å; Q31-V35 WeakPolarHBondContact O-CG2 3.46Å; Q31-V35 PolarHBondContact O-N 3.34Å
32	E	97.5	Very high	97.4	Very high	72 Å²	72	69.5 Å²	69.5	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-45.6	174.8	-168.1	-178.1	174.4	0	0	111.8	A28 K29 I34 V35 Y36 L93	A28-E32 PolarHBondContact O-N 3.25Å; K29-E32 PolarHBondContact O-N 2.85Å; E32-I34 VanDerWaalsContact C-N 3.28Å; E32-I34 PolarHBondContact O-N 3.43Å; E32-V35 PolarHBondContact O-N 3.43Å; E32-Y36 HydrophobicContact CG-CD2 4.24Å; E32-Y36 HydrophobicContact CG-CE2 3.74Å; E32-Y36 PolarHBondContact O-N 2.84Å; E32-Y36 VanDerWaalsContact OE1-CE2 3.24Å; E32-Y36 WeakPolarHBondContact OE1-CE2 3.14Å; E32-Y36 VanDerWaalsContact OE1-CZ 3.23Å; E32-Y36 PolarHBondContact OE1-OH 3.47Å; E32-L93 HydrophobicContact CB-CD1 4.06Å; E32-L93 HydrophobicContact CG-CD1 3.74Å; E32-L93 WeakPolarHBondContact OE2-CD2 3.3Å
33	C	96.7	Very high	97.4	Very high	21 Å²	21	70 Å²	70	14%	0.142	35%	0.345	C	S	.	.	H	α-helix	trans	-57.3	-40.7	175.8	-173.6	0	0	0	0	112	K29 K30 Y36 D37 L93	K29-C33 PolarHBondContact O-N 2.96Å; K30-C33 PolarHBondContact O-N 2.84Å; C33-Y36 PolarHBondContact O-N 3.48Å; C33-D37 WeakPolarHBondContact O-CB 3.4Å; C33-D37 PolarHBondContact O-N 3.24Å; C33-L93 HydrophobicContact CB-CD1 4.38Å
34	I	97.4	Very high	97.4	Very high	62 Å²	62	72.8 Å²	72.8	32%	0.318	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.2	-66.4	166.4	0	0	0	111.4	K30 Q31 E32 D37 R38	K30-I34 HydrophobicContact CG-CD1 4.5Å; K30-I34 WeakPolarHBondContact O-CG1 3.41Å; K30-I34 PolarHBondContact O-N 3.04Å; Q31-I34 WeakPolarHBondContact O-CB 3.5Å; Q31-I34 PolarHBondContact O-N 2.99Å; E32-I34 VanDerWaalsContact C-N 3.28Å; E32-I34 PolarHBondContact O-N 3.43Å; I34-D37 PolarHBondContact O-N 3.11Å; I34-R38 WeakPolarHBondContact O-CB 3.45Å; I34-R38 VanDerWaalsContact O-CG 3.3Å; I34-R38 WeakPolarHBondContact O-CG 3.47Å; I34-R38 PolarHBondContact O-N 3.11Å
35	V	97.8	Very high	97.3	Very high	58 Å²	58	72.5 Å²	72.5	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-46.6	178.7	171.9	0	0	0	0	110.7	Q31 E32 R38 N39	Q31-V35 WeakPolarHBondContact O-CG2 3.46Å; Q31-V35 PolarHBondContact O-N 3.34Å; E32-V35 PolarHBondContact O-N 3.43Å; V35-R38 PolarHBondContact O-N 2.9Å; V35-N39 PolarHBondContact O-N 3.41Å
36	Y	98.1	Very high	97.3	Very high	58 Å²	58	70.8 Å²	70.8	23%	0.227	35%	0.346	C	S	.	.	H	α-helix	trans	-63.3	-41	176.1	-70.4	-21.6	0	0	0	112.6	E32 C33 R38 N39 R40 Y86 E89 L93	E32-Y36 HydrophobicContact CG-CD2 4.24Å; E32-Y36 HydrophobicContact CG-CE2 3.74Å; E32-Y36 PolarHBondContact O-N 2.84Å; E32-Y36 VanDerWaalsContact OE1-CE2 3.24Å; E32-Y36 WeakPolarHBondContact OE1-CE2 3.14Å; E32-Y36 VanDerWaalsContact OE1-CZ 3.23Å; E32-Y36 PolarHBondContact OE1-OH 3.47Å; C33-Y36 PolarHBondContact O-N 3.48Å; Y36-R38 PolarHBondContact O-N 3.47Å; Y36-N39 PolarHBondContact O-N 3.35Å; Y36-R40 VanDerWaalsContact O-CB 3.27Å; Y36-R40 WeakPolarHBondContact O-CB 3.38Å; Y36-R40 PolarHBondContact O-N 3.06Å; Y36-Y86 AromaticContact CD1-CD1 3.97Å; Y36-Y86 HydrophobicContact CD1-CD1 3.97Å; Y36-Y86 AromaticContact CD1-CE1 3.96Å; Y36-Y86 HydrophobicContact CD1-CE1 3.96Å; Y36-Y86 HydrophobicContact CG-CD1 4.2Å; Y36-E89 HydrophobicContact CD2-CB 3.89Å; Y36-E89 HydrophobicContact CE2-CB 3.79Å; Y36-L93 HydrophobicContact CD2-CD1 3.51Å; Y36-L93 HydrophobicContact CE2-CD1 3.55Å
37	D	97.7	Very high	97.2	Very high	55 Å²	55	70.5 Å²	70.5	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-45.6	176.1	-175.3	57.6	0	0	0	111.5	C33 I34 N39 R40 Q41 I90	C33-D37 WeakPolarHBondContact O-CB 3.4Å; C33-D37 PolarHBondContact O-N 3.24Å; I34-D37 PolarHBondContact O-N 3.11Å; D37-N39 VanDerWaalsContact C-N 3.34Å; D37-N39 PolarHBondContact O-N 3.44Å; D37-R40 WeakPolarHBondContact O-CB 3.36Å; D37-R40 PolarHBondContact O-N 2.9Å; D37-R40 IonicContact OD1-CZ 2.85Å; D37-R40 IonicContact OD1-NE 3.47Å; D37-R40 PolarHBondContact OD1-NE 2.96Å; D37-R40 IonicContact OD1-NH2 2.64Å; D37-R40 PolarHBondContact OD1-NH2 3.31Å; D37-Q41 VanDerWaalsContact O-CG 3.31Å; D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 3.13Å; D37-I90 HydrophobicContact CB-CD1 4.33Å
38	R	97.8	Very high	97.1	Very high	157 Å²	157	72.7 Å²	72.7	59%	0.592	34%	0.344	S	S	*	.	H	α-helix	trans	-58.4	-45	176	-74.8	174.3	177.7	179	1	112.2	I34 V35 Y36 Q41 K42	I34-R38 WeakPolarHBondContact O-CB 3.45Å; I34-R38 VanDerWaalsContact O-CG 3.3Å; I34-R38 WeakPolarHBondContact O-CG 3.47Å; I34-R38 PolarHBondContact O-N 3.11Å; V35-R38 PolarHBondContact O-N 2.9Å; Y36-R38 PolarHBondContact O-N 3.47Å; R38-Q41 PolarHBondContact O-N 3.06Å; R38-K42 WeakPolarHBondContact O-CG 3.26Å; R38-K42 PolarHBondContact O-N 3.39Å; R38-K42 VanDerWaalsContact O-N 3.07Å
39	N	96.7	Very high	96.9	Very high	52 Å²	52	75 Å²	75	28%	0.278	35%	0.345	S	S	.	.	H	α-helix	trans	-66.6	-41.8	178.9	-69.7	-14.8	0	0	0	111.4	V35 Y36 D37 Q41 K42 S43 Y86	V35-N39 PolarHBondContact O-N 3.41Å; Y36-N39 PolarHBondContact O-N 3.35Å; D37-N39 VanDerWaalsContact C-N 3.34Å; D37-N39 PolarHBondContact O-N 3.44Å; N39-Q41 VanDerWaalsContact C-N 3.33Å; N39-Q41 PolarHBondContact O-N 3.42Å; N39-K42 PolarHBondContact O-N 3.47Å; N39-S43 PolarHBondContact O-N 2.64Å; N39-S43 PolarHBondContact O-OG 2.95Å; N39-Y86 HydrophobicContact CB-CD1 4.48Å; N39-Y86 HydrophobicContact CB-CE1 3.78Å; N39-Y86 HydrophobicContact CB-CE2 4.03Å
40	R	97.7	Very high	96.8	Very high	41 Å²	41	73.7 Å²	73.7	16%	0.155	34%	0.339	C	S	.	.	H	α-helix	trans	-57.1	-44.4	173.4	-176.8	-179.9	65.1	179.6	-1.8	112.2	Y36 D37 S43 R44 Y86 D87	Y36-R40 VanDerWaalsContact O-CB 3.27Å; Y36-R40 WeakPolarHBondContact O-CB 3.38Å; Y36-R40 PolarHBondContact O-N 3.06Å; D37-R40 WeakPolarHBondContact O-CB 3.36Å; D37-R40 PolarHBondContact O-N 2.9Å; D37-R40 IonicContact OD1-CZ 2.85Å; D37-R40 IonicContact OD1-NE 3.47Å; D37-R40 PolarHBondContact OD1-NE 2.96Å; D37-R40 IonicContact OD1-NH2 2.64Å; D37-R40 PolarHBondContact OD1-NH2 3.31Å; R40-S43 PolarHBondContact O-N 3.26Å; R40-R44 WeakPolarHBondContact O-CG 3.48Å; R40-R44 PolarHBondContact O-N 3.48Å; R40-Y86 HydrophobicContact CB-CD2 4.19Å; R40-Y86 HydrophobicContact CB-CG 4.15Å; R40-D87 WeakPolarHBondContact CD-OD1 3.47Å; R40-D87 IonicContact CZ-OD1 3.42Å; R40-D87 IonicContact NE-OD1 3.81Å; R40-D87 IonicContact NH1-OD1 3.8Å; R40-D87 PolarHBondContact NH1-OD1 3.49Å
41	Q	97.7	Very high	96.5	Very high	77 Å²	77	73 Å²	73	36%	0.36	34%	0.34	S	S	.	.	H	α-helix	trans	-65.8	-43	178.4	-62.5	-63.4	19.7	0	0	111.7	D37 R38 N39 S43 R44 E45	D37-Q41 VanDerWaalsContact O-CG 3.31Å; D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 3.13Å; R38-Q41 PolarHBondContact O-N 3.06Å; N39-Q41 VanDerWaalsContact C-N 3.33Å; N39-Q41 PolarHBondContact O-N 3.42Å; Q41-S43 VanDerWaalsContact C-N 3.32Å; Q41-S43 PolarHBondContact O-N 3.39Å; Q41-R44 WeakPolarHBondContact O-CB 3.48Å; Q41-R44 PolarHBondContact O-N 2.81Å; Q41-R44 VanDerWaalsContact O-N 3.17Å; Q41-E45 WeakPolarHBondContact O-CG 3.38Å; Q41-E45 PolarHBondContact O-N 2.95Å
42	K	96.6	Very high	96.2	Very high	135 Å²	135	75.5 Å²	75.5	59%	0.587	35%	0.351	S	S	*	.	H	α-helix	trans	-58.6	-42.7	173.2	-71.2	176.2	179.9	179.9	0	112	R38 N39 E45 A46	R38-K42 WeakPolarHBondContact O-CG 3.26Å; R38-K42 PolarHBondContact O-N 3.39Å; R38-K42 VanDerWaalsContact O-N 3.07Å; N39-K42 PolarHBondContact O-N 3.47Å; K42-E45 PolarHBondContact O-N 2.85Å; K42-A46 WeakPolarHBondContact O-CB 3.5Å; K42-A46 PolarHBondContact O-N 2.92Å
43	S	96.4	Very high	95.8	Very high	15 Å²	15	76 Å²	76	11%	0.105	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-41.8	175.5	-64.6	0	0	0	0	111.9	N39 R40 Q41 E45 A46 V47 I79	N39-S43 PolarHBondContact O-N 2.64Å; N39-S43 PolarHBondContact O-OG 2.95Å; R40-S43 PolarHBondContact O-N 3.26Å; Q41-S43 VanDerWaalsContact C-N 3.32Å; Q41-S43 PolarHBondContact O-N 3.39Å; S43-E45 PolarHBondContact O-N 3.32Å; S43-A46 PolarHBondContact O-N 2.96Å; S43-V47 WeakPolarHBondContact O-CG2 3.36Å; S43-V47 PolarHBondContact O-N 3.5Å; S43-I79 WeakPolarHBondContact O-CG2 3.49Å
44	R	97.7	Very high	95.1	Very high	77 Å²	77	78.9 Å²	78.9	29%	0.291	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-41.2	174.8	-75	172.8	174.3	170.3	1.1	112.2	R40 Q41 R48 I83 D87	R40-R44 WeakPolarHBondContact O-CG 3.48Å; R40-R44 PolarHBondContact O-N 3.48Å; Q41-R44 WeakPolarHBondContact O-CB 3.48Å; Q41-R44 PolarHBondContact O-N 2.81Å; Q41-R44 VanDerWaalsContact O-N 3.17Å; R44-R48 VanDerWaalsContact O-CG 3.3Å; R44-R48 WeakPolarHBondContact O-CG 3.34Å; R44-R48 PolarHBondContact O-N 3.42Å; R44-I83 HydrophobicContact CG-CD1 3.88Å; R44-I83 HydrophobicContact CG-CG1 4.31Å; R44-I83 HydrophobicContact CG-CG2 4.49Å; R44-D87 IonicContact NH2-OD1 2.62Å; R44-D87 PolarHBondContact NH2-OD1 2.62Å; R44-D87 IonicContact NH2-OD2 2.72Å
45	E	96.7	Very high	94.2	Very high	119 Å²	119	79 Å²	79	56%	0.556	38%	0.376	S	S	*	.	H	α-helix	trans	-62.6	-45.1	173.5	-72.7	175.5	-174.6	0	0	111.4	Q41 K42 S43 V47 R48 Q49	Q41-E45 WeakPolarHBondContact O-CG 3.38Å; Q41-E45 PolarHBondContact O-N 2.95Å; K42-E45 PolarHBondContact O-N 2.85Å; S43-E45 PolarHBondContact O-N 3.32Å; E45-V47 PolarHBondContact O-N 3.18Å; E45-R48 WeakPolarHBondContact O-CB 3.45Å; E45-R48 PolarHBondContact O-N 2.96Å; E45-Q49 WeakPolarHBondContact O-CG 3.4Å; E45-Q49 PolarHBondContact O-N 3.12Å
46	A	95.5	Very high	93.4	Very high	38 Å²	38	84.4 Å²	84.4	31%	0.314	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-44.7	177.1	0	0	0	0	0	112.1	K42 S43 R48 Q49 L50 I79	K42-A46 WeakPolarHBondContact O-CB 3.5Å; K42-A46 PolarHBondContact O-N 2.92Å; S43-A46 PolarHBondContact O-N 2.96Å; A46-R48 PolarHBondContact O-N 3.33Å; A46-Q49 PolarHBondContact O-N 2.98Å; A46-L50 VanDerWaalsContact O-CG 3.32Å; A46-L50 WeakPolarHBondContact O-CG 3.38Å; A46-L50 PolarHBondContact O-N 3.41Å; A46-I79 HydrophobicContact CB-CD1 4.05Å; A46-I79 HydrophobicContact CB-CG2 4.49Å
47	V	95.9	Very high	92.9	Very high	11 Å²	11	86 Å²	86	7%	0.067	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-44.9	174.9	170.8	0	0	0	0	111.3	S43 E45 Q49 L50 M51 R76 I79 E80 I83	S43-V47 WeakPolarHBondContact O-CG2 3.36Å; S43-V47 PolarHBondContact O-N 3.5Å; E45-V47 PolarHBondContact O-N 3.18Å; V47-Q49 VanDerWaalsContact C-N 3.3Å; V47-Q49 PolarHBondContact O-N 3.3Å; V47-L50 PolarHBondContact O-N 3.24Å; V47-M51 HydrophobicContact CG1-CE 3.65Å; V47-M51 HydrophobicContact CG1-SD 4.25Å; V47-M51 WeakPolarHBondContact O-CG 3.19Å; V47-M51 PolarHBondContact O-N 2.99Å; V47-R76 HydrophobicContact CG1-CG 4.42Å; V47-I79 HydrophobicContact CG2-CB 3.91Å; V47-I79 HydrophobicContact CG2-CG2 3.55Å; V47-E80 HydrophobicContact CG1-CG 4.36Å; V47-E80 HydrophobicContact CG2-CG 4.07Å; V47-I83 HydrophobicContact CG2-CD1 3.86Å
48	R	95.8	Very high	92.7	Very high	162 Å²	162	89.6 Å²	89.6	61%	0.611	42%	0.423	S	S	*	.	H	α-helix	trans	-59.6	-40.5	177.3	-74.9	172.7	179.5	170.9	0.5	112	R44 E45 A46 M51 Q52	R44-R48 VanDerWaalsContact O-CG 3.3Å; R44-R48 WeakPolarHBondContact O-CG 3.34Å; R44-R48 PolarHBondContact O-N 3.42Å; E45-R48 WeakPolarHBondContact O-CB 3.45Å; E45-R48 PolarHBondContact O-N 2.96Å; A46-R48 PolarHBondContact O-N 3.33Å; R48-M51 PolarHBondContact O-N 2.91Å; R48-Q52 PolarHBondContact O-N 3.48Å
49	Q	93.8	Very high	92.5	Very high	110 Å²	110	83.7 Å²	83.7	51%	0.514	40%	0.402	S	S	.	.	H	α-helix	trans	-68.3	-44.1	176.4	-66.9	-62.9	-4.1	0	0	111.7	E45 A46 V47 M51 Q52 L53	E45-Q49 WeakPolarHBondContact O-CG 3.4Å; E45-Q49 PolarHBondContact O-N 3.12Å; A46-Q49 PolarHBondContact O-N 2.98Å; V47-Q49 VanDerWaalsContact C-N 3.3Å; V47-Q49 PolarHBondContact O-N 3.3Å; Q49-M51 PolarHBondContact O-N 3.37Å; Q49-Q52 WeakPolarHBondContact O-CB 2.9Å; Q49-Q52 PolarHBondContact O-N 2.85Å; Q49-L53 WeakPolarHBondContact O-CG 3.29Å; Q49-L53 PolarHBondContact O-N 3.47Å
50	L	93.5	Very high	92.4	Very high	11 Å²	11	89.9 Å²	89.9	6%	0.058	42%	0.422	C	S	.	.	H	α-helix	trans	-61.6	-26.7	175.7	-71.3	173.4	0	0	0	113.2	A46 V47 Q52 L53 Q59 L75 R76 I79	A46-L50 VanDerWaalsContact O-CG 3.32Å; A46-L50 WeakPolarHBondContact O-CG 3.38Å; A46-L50 PolarHBondContact O-N 3.41Å; V47-L50 PolarHBondContact O-N 3.24Å; L50-Q52 VanDerWaalsContact C-N 3.32Å; L50-L53 HydrophobicContact CD2-CD1 4.37Å; L50-Q59 HydrophobicContact CD2-CB 4.03Å; L50-Q59 HydrophobicContact CD2-CG 3.74Å; L50-L75 HydrophobicContact CD1-CD2 4.03Å; L50-L75 HydrophobicContact CD1-CG 3.92Å; L50-L75 HydrophobicContact CD2-CD2 4.01Å; L50-R76 HydrophobicContact CD1-CB 4.26Å; L50-R76 PolarHBondContact O-NH2 3.43Å; L50-I79 HydrophobicContact CD1-CD1 3.7Å
51	M	91.5	Very high	92.2	Very high	105 Å²	105	88.9 Å²	88.9	52%	0.517	42%	0.422	S	S	.	.	H	α-helix	trans	-71.7	-25.1	173.3	-73.6	176.4	174.4	0	0	113.3	V47 R48 Q49	V47-M51 HydrophobicContact CG1-CE 3.65Å; V47-M51 HydrophobicContact CG1-SD 4.25Å; V47-M51 WeakPolarHBondContact O-CG 3.19Å; V47-M51 PolarHBondContact O-N 2.99Å; R48-M51 PolarHBondContact O-N 2.91Å; Q49-M51 PolarHBondContact O-N 3.37Å
52	Q	91.4	Very high	92	Very high	150 Å²	150	88.8 Å²	88.8	70%	0.701	43%	0.429	S	S	*	.	H	α-helix	trans	-86.2	-20.6	177.2	-63.6	177.6	13.1	0	0	112.6	R48 Q49 L50	R48-Q52 PolarHBondContact O-N 3.48Å; Q49-Q52 WeakPolarHBondContact O-CB 2.9Å; Q49-Q52 PolarHBondContact O-N 2.85Å; L50-Q52 VanDerWaalsContact C-N 3.32Å
53	L	89.5	Confident	91.7	Very high	82 Å²	82	88.2 Å²	88.2	43%	0.429	43%	0.432	S	S	.	.	S	Bend	trans	-84.8	153.7	178.6	-63.8	171.1	0	0	0	111.5	Q49 L50 S55	Q49-L53 WeakPolarHBondContact O-CG 3.29Å; Q49-L53 PolarHBondContact O-N 3.47Å; L50-L53 HydrophobicContact CD2-CD1 4.37Å; L53-S55 PolarHBondContact O-N 3.35Å
54	D	81.1	Confident	91.3	Very high	81 Å²	81	92.7 Å²	92.7	43%	0.433	46%	0.463	S	S	.	.			trans	-62.6	124.2	176	-175.7	-0.8	0	0	0	111.1	E56 N57 S72	D54-E56 PolarHBondContact O-N 3.4Å; D54-E56 PolarHBondContact OD1-N 3.05Å; D54-N57 PolarHBondContact O-N 3.01Å; D54-N57 PolarHBondContact OD2-ND2 3.1Å; D54-S72 PolarHBondContact O-OG 2.89Å
55	S	80	Confident	91	Very high	65 Å²	65	95 Å²	95	46%	0.455	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.5	-179.2	49.9	0	0	0	0	114	L53 N57	L53-S55 PolarHBondContact O-N 3.35Å; S55-N57 VanDerWaalsContact C-N 3.35Å
56	E	79.9	Confident	91	Very high	172 Å²	172	94.7 Å²	94.7	80%	0.804	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.8	-178.6	-63.1	-170.5	175.8	0	0	112.3	D54	D54-E56 PolarHBondContact O-N 3.4Å; D54-E56 PolarHBondContact OD1-N 3.05Å
57	N	87.8	Confident	91	Very high	92 Å²	92	99.6 Å²	99.6	49%	0.492	49%	0.494	S	S	.	.	S	Bend	trans	-85.1	152.9	-177.5	-71.2	-47.3	0	0	0	112.3	D54 S55 S72	D54-N57 PolarHBondContact O-N 3.01Å; D54-N57 PolarHBondContact OD2-ND2 3.1Å; S55-N57 VanDerWaalsContact C-N 3.35Å; N57-S72 WeakPolarHBondContact O-CB 3.36Å; N57-S72 PolarHBondContact O-N 3.38Å; N57-S72 PolarHBondContact O-OG 3.17Å
58	K	94.1	Very high	91	Very high	130 Å²	130	102.7 Å²	102.7	57%	0.565	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	147.9	167.7	-62.3	-178.5	-179.5	178.7	0	109.9	L69 F70	K58-L69 HydrophobicContact CB-CD1 3.55Å; K58-L69 HydrophobicContact CB-CD2 4.01Å; K58-L69 HydrophobicContact CB-CG 3.56Å; K58-L69 HydrophobicContact CD-CD2 3.69Å; K58-L69 HydrophobicContact CD-CG 3.81Å; K58-L69 HydrophobicContact CG-CG 4.33Å; K58-F70 CarbonylContact C-O 3.47Å; K58-F70 WeakPolarHBondContact CA-O 3.44Å; K58-F70 WeakPolarHBondContact CB-O 3.49Å
59	Q	94	Very high	91	Very high	33 Å²	33	98.7 Å²	98.7	15%	0.154	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.8	-177.7	-52.2	-58.3	-23.6	0	0	110.6	L50 F70 S72 L75	L50-Q59 HydrophobicContact CD2-CB 4.03Å; L50-Q59 HydrophobicContact CD2-CG 3.74Å; Q59-F70 PolarHBondContact N-O 2.89Å; Q59-F70 PolarHBondContact O-N 3.41Å; Q59-S72 WeakPolarHBondContact CG-OG 3.43Å; Q59-S72 PolarHBondContact NE2-OG 3.41Å; Q59-S72 VanDerWaalsContact NE2-OG 3.11Å; Q59-L75 HydrophobicContact CB-CD2 4.02Å
60	W	94.4	Very high	91.1	Very high	181 Å²	181	97.5 Å²	97.5	69%	0.686	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	125.7	172.1	-69.2	100.8	0	0	0	109.6	F67 F68 L69	W60-F67 HydrophobicContact CE3-CB 4.03Å; W60-F67 HydrophobicContact CZ3-CB 4.33Å; W60-F68 CarbonylContact C-O 3.6Å; W60-F68 WeakPolarHBondContact CA-O 3.39Å; W60-L69 HydrophobicContact CD2-CD1 4.04Å; W60-L69 HydrophobicContact CE3-CB 4.25Å; W60-L69 HydrophobicContact CG-CD1 4.2Å; W60-L69 HydrophobicContact CH2-CB 4.43Å; W60-L69 HydrophobicContact CZ2-CD1 4.46Å; W60-L69 HydrophobicContact CZ3-CB 4.21Å
61	A	92.9	Very high	91.1	Very high	20 Å²	20	100.6 Å²	100.6	17%	0.165	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.1	170.3	0	0	0	0	0	109.2	F67 F68 F70 L75	A61-F67 WeakPolarHBondContact O-CA 3.49Å; A61-F68 PolarHBondContact N-O 3.01Å; A61-F68 PolarHBondContact O-N 3.3Å; A61-F70 HydrophobicContact CB-CD2 3.82Å; A61-F70 HydrophobicContact CB-CE2 4.12Å; A61-L75 HydrophobicContact CB-CD1 3.83Å; A61-L75 HydrophobicContact CB-CD2 4Å
62	C	93.1	Very high	91.2	Very high	76 Å²	76	95.6 Å²	95.6	51%	0.514	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.4	171.1	-173.8	0	0	0	0	109.1	S64 Q66 F67	C62-S64 PolarHBondContact SG-O 3.39Å; C62-Q66 CarbonylContact C-O 3.6Å; C62-Q66 WeakPolarHBondContact CA-O 3.45Å; C62-F67 HydrophobicContact CB-CD1 3.93Å; C62-F67 HydrophobicContact CB-CE1 3.71Å; C62-F67 HydrophobicContact CB-CZ 4.34Å
63	L	90.4	Very high	91.2	Very high	122 Å²	122	93 Å²	93	64%	0.639	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	117	170.1	-176.5	70	0	0	0	107.6	D65 Q66 F68	L63-D65 PolarHBondContact O-N 3.47Å; L63-Q66 PolarHBondContact N-O 3.42Å; L63-Q66 PolarHBondContact O-N 2.72Å; L63-F68 HydrophobicContact CB-CD2 4.14Å; L63-F68 HydrophobicContact CB-CE2 4.03Å; L63-F68 HydrophobicContact CD2-CE2 4.46Å
64	S	88	Confident	91.4	Very high	110 Å²	110	91.1 Å²	91.1	77%	0.769	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	-105.6	-170.2	-178.4	0	0	0	0	111.5	C62	C62-S64 PolarHBondContact SG-O 3.39Å
65	D	92.6	Very high	92.1	Very high	125 Å²	125	88.3 Å²	88.3	67%	0.668	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	9.5	-175.9	58.4	-36.2	0	0	0	111.4	L63	L63-D65 PolarHBondContact O-N 3.47Å
66	Q	96.4	Very high	92.8	Very high	113 Å²	113	87.7 Å²	87.7	53%	0.528	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.3	-175.4	-63.4	-176.1	-24.2	0	0	111.6	C62 L63 F68	C62-Q66 CarbonylContact C-O 3.6Å; C62-Q66 WeakPolarHBondContact CA-O 3.45Å; L63-Q66 PolarHBondContact N-O 3.42Å; L63-Q66 PolarHBondContact O-N 2.72Å; Q66-F68 HydrophobicContact CB-CD2 4.38Å; Q66-F68 HydrophobicContact CB-CE2 3.52Å; Q66-F68 HydrophobicContact CB-CZ 3.86Å
67	F	96.2	Very high	93.6	Very high	140 Å²	140	85.6 Å²	85.6	61%	0.614	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.8	178.3	-65.9	-91.3	0	0	0	110.8	W60 A61 C62	W60-F67 HydrophobicContact CE3-CB 4.03Å; W60-F67 HydrophobicContact CZ3-CB 4.33Å; A61-F67 WeakPolarHBondContact O-CA 3.49Å; C62-F67 HydrophobicContact CB-CD1 3.93Å; C62-F67 HydrophobicContact CB-CE1 3.71Å; C62-F67 HydrophobicContact CB-CZ 4.34Å
68	F	95.5	Very high	94	Very high	76 Å²	76	83.3 Å²	83.3	33%	0.333	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	146.9	-178.3	-62.1	-86.1	0	0	0	110.4	W60 A61 L63 Q66 F70	W60-F68 CarbonylContact C-O 3.6Å; W60-F68 WeakPolarHBondContact CA-O 3.39Å; A61-F68 PolarHBondContact N-O 3.01Å; A61-F68 PolarHBondContact O-N 3.3Å; L63-F68 HydrophobicContact CB-CD2 4.14Å; L63-F68 HydrophobicContact CB-CE2 4.03Å; L63-F68 HydrophobicContact CD2-CE2 4.46Å; Q66-F68 HydrophobicContact CB-CD2 4.38Å; Q66-F68 HydrophobicContact CB-CE2 3.52Å; Q66-F68 HydrophobicContact CB-CZ 3.86Å; F68-F70 HydrophobicContact CB-CD2 3.97Å; F68-F70 HydrophobicContact CB-CE2 3.31Å; F68-F70 HydrophobicContact CB-CZ 3.7Å; F68-F70 HydrophobicContact CG-CE2 4.17Å; F68-F70 HydrophobicContact CG-CZ 4.24Å
69	L	95.6	Very high	94.1	Very high	78 Å²	78	78.2 Å²	78.2	41%	0.408	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.1	179.1	-172.9	67.8	0	0	0	109.9	K58 W60	K58-L69 HydrophobicContact CB-CD1 3.55Å; K58-L69 HydrophobicContact CB-CD2 4.01Å; K58-L69 HydrophobicContact CB-CG 3.56Å; K58-L69 HydrophobicContact CD-CD2 3.69Å; K58-L69 HydrophobicContact CD-CG 3.81Å; K58-L69 HydrophobicContact CG-CG 4.33Å; W60-L69 HydrophobicContact CD2-CD1 4.04Å; W60-L69 HydrophobicContact CE3-CB 4.25Å; W60-L69 HydrophobicContact CG-CD1 4.2Å; W60-L69 HydrophobicContact CH2-CB 4.43Å; W60-L69 HydrophobicContact CZ2-CD1 4.46Å; W60-L69 HydrophobicContact CZ3-CB 4.21Å
70	F	94.4	Very high	94.2	Very high	85 Å²	85	80 Å²	80	37%	0.373	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.5	-177.3	-67.7	-72.9	0	0	0	112.3	K58 Q59 A61 F68 S72 L75	K58-F70 CarbonylContact C-O 3.47Å; K58-F70 WeakPolarHBondContact CA-O 3.44Å; K58-F70 WeakPolarHBondContact CB-O 3.49Å; Q59-F70 PolarHBondContact N-O 2.89Å; Q59-F70 PolarHBondContact O-N 3.41Å; A61-F70 HydrophobicContact CB-CD2 3.82Å; A61-F70 HydrophobicContact CB-CE2 4.12Å; F68-F70 HydrophobicContact CB-CD2 3.97Å; F68-F70 HydrophobicContact CB-CE2 3.31Å; F68-F70 HydrophobicContact CB-CZ 3.7Å; F68-F70 HydrophobicContact CG-CE2 4.17Å; F68-F70 HydrophobicContact CG-CZ 4.24Å; F70-S72 PolarHBondContact O-N 2.86Å; F70-L75 HydrophobicContact CB-CB 3.93Å; F70-L75 HydrophobicContact CB-CD1 4.41Å; F70-L75 HydrophobicContact CB-CD2 4.42Å; F70-L75 HydrophobicContact CB-CG 4.48Å; F70-L75 HydrophobicContact CD2-CD1 4.07Å; F70-L75 HydrophobicContact CG-CD1 4.47Å
71	P	94.2	Very high	94.4	Very high	77 Å²	77	76 Å²	76	50%	0.5	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	133.3	166.6	-21.4	33.1	0	0	0	111.2	V73 G74 L75	P71-V73 VanDerWaalsContact C-N 3.28Å; P71-V73 PolarHBondContact O-N 2.93Å; P71-G74 PolarHBondContact O-N 3.4Å; P71-G74 VanDerWaalsContact O-N 3.15Å; P71-L75 PolarHBondContact O-N 3.38Å
72	S	93.5	Very high	94.6	Very high	0 Å²	0	78.8 Å²	78.8	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-51.6	-43.9	-175.6	-71.2	0	0	0	0	113.7	D54 N57 Q59 F70 R76	D54-S72 PolarHBondContact O-OG 2.89Å; N57-S72 WeakPolarHBondContact O-CB 3.36Å; N57-S72 PolarHBondContact O-N 3.38Å; N57-S72 PolarHBondContact O-OG 3.17Å; Q59-S72 WeakPolarHBondContact CG-OG 3.43Å; Q59-S72 PolarHBondContact NE2-OG 3.41Å; Q59-S72 VanDerWaalsContact NE2-OG 3.11Å; F70-S72 PolarHBondContact O-N 2.86Å; S72-R76 VanDerWaalsContact O-CB 3.3Å; S72-R76 WeakPolarHBondContact O-CB 3.3Å; S72-R76 PolarHBondContact O-N 3.25Å
73	V	92.8	Very high	94.8	Very high	94 Å²	94	76.2 Å²	76.2	57%	0.57	41%	0.406	S	S	*	.	H	α-helix	trans	-67	-44.7	-177.5	-179.6	0	0	0	0	111.4	P71 R76 K77	P71-V73 VanDerWaalsContact C-N 3.28Å; P71-V73 PolarHBondContact O-N 2.93Å; V73-R76 PolarHBondContact O-N 3.35Å; V73-K77 PolarHBondContact O-N 2.91Å; V73-K77 VanDerWaalsContact O-N 3.1Å
74	G	93.4	Very high	95.2	Very high	44 Å²	44	77.3 Å²	77.3	45%	0.454	41%	0.405	S	S	.	.	H	α-helix	trans	-66.7	-43.5	179	0	0	0	0	0	112.1	P71 R76 K77 A78	P71-G74 PolarHBondContact O-N 3.4Å; P71-G74 VanDerWaalsContact O-N 3.15Å; G74-R76 PolarHBondContact O-N 2.83Å; G74-K77 PolarHBondContact O-N 3.48Å; G74-A78 PolarHBondContact O-N 3.48Å
75	L	95.3	Very high	95.6	Very high	21 Å²	21	75.9 Å²	75.9	11%	0.11	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-45.1	176.6	-178.9	60.3	0	0	0	111.6	L50 Q59 A61 F70 P71 K77 A78 I79	L50-L75 HydrophobicContact CD1-CD2 4.03Å; L50-L75 HydrophobicContact CD1-CG 3.92Å; L50-L75 HydrophobicContact CD2-CD2 4.01Å; Q59-L75 HydrophobicContact CB-CD2 4.02Å; A61-L75 HydrophobicContact CB-CD1 3.83Å; A61-L75 HydrophobicContact CB-CD2 4Å; F70-L75 HydrophobicContact CB-CB 3.93Å; F70-L75 HydrophobicContact CB-CD1 4.41Å; F70-L75 HydrophobicContact CB-CD2 4.42Å; F70-L75 HydrophobicContact CB-CG 4.48Å; F70-L75 HydrophobicContact CD2-CD1 4.07Å; F70-L75 HydrophobicContact CG-CD1 4.47Å; P71-L75 PolarHBondContact O-N 3.38Å; L75-K77 PolarHBondContact O-N 3.39Å; L75-A78 PolarHBondContact O-N 3.31Å; L75-I79 HydrophobicContact CD1-CD1 4.04Å; L75-I79 HydrophobicContact CD1-CG1 4.34Å; L75-I79 HydrophobicContact CG-CD1 4Å; L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 2.9Å
76	R	95	Very high	95.9	Very high	53 Å²	53	72.3 Å²	72.3	20%	0.2	37%	0.369	C	S	.	.	H	α-helix	trans	-58.9	-48.4	177.4	-173.7	-172.3	-44.8	-154.1	-2.1	111.6	V47 L50 S72 V73 G74 A78 I79 E80	V47-R76 HydrophobicContact CG1-CG 4.42Å; L50-R76 HydrophobicContact CD1-CB 4.26Å; L50-R76 PolarHBondContact O-NH2 3.43Å; S72-R76 VanDerWaalsContact O-CB 3.3Å; S72-R76 WeakPolarHBondContact O-CB 3.3Å; S72-R76 PolarHBondContact O-N 3.25Å; V73-R76 PolarHBondContact O-N 3.35Å; G74-R76 PolarHBondContact O-N 2.83Å; R76-A78 VanDerWaalsContact C-N 3.32Å; R76-A78 PolarHBondContact O-N 3.34Å; R76-I79 PolarHBondContact O-N 3.01Å; R76-E80 WeakPolarHBondContact CG-OE1 3.42Å; R76-E80 WeakPolarHBondContact O-CG 3.02Å; R76-E80 PolarHBondContact O-N 3.07Å
77	K	95.7	Very high	96	Very high	127 Å²	127	69.1 Å²	69.1	55%	0.552	36%	0.356	S	S	*	.	H	α-helix	trans	-60.1	-42.4	178.7	-174.3	-178.7	174.4	-171.5	0	111.8	V73 G74 L75 E80 E81	V73-K77 PolarHBondContact O-N 2.91Å; V73-K77 VanDerWaalsContact O-N 3.1Å; G74-K77 PolarHBondContact O-N 3.48Å; L75-K77 PolarHBondContact O-N 3.39Å; K77-E80 PolarHBondContact O-N 2.99Å; K77-E81 VanDerWaalsContact CE-OE1 3.23Å; K77-E81 WeakPolarHBondContact CE-OE1 3.48Å; K77-E81 WeakPolarHBondContact O-CG 3.5Å; K77-E81 PolarHBondContact O-N 3.02Å
78	A	95.9	Very high	96	Very high	44 Å²	44	64.5 Å²	64.5	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176.9	0	0	0	0	0	111.8	G74 L75 R76 E80 E81 D82	G74-A78 PolarHBondContact O-N 3.48Å; L75-A78 PolarHBondContact O-N 3.31Å; R76-A78 VanDerWaalsContact C-N 3.32Å; R76-A78 PolarHBondContact O-N 3.34Å; A78-E80 VanDerWaalsContact C-N 3.32Å; A78-E80 PolarHBondContact O-N 2.75Å; A78-E81 WeakPolarHBondContact O-CB 3.43Å; A78-E81 PolarHBondContact O-N 3.09Å; A78-E81 VanDerWaalsContact O-N 3.16Å; A78-D82 PolarHBondContact O-N 3.42Å
79	I	96.5	Very high	96.1	Very high	24 Å²	24	63.6 Å²	63.6	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-66.8	-35	178.4	-59.1	168.5	0	0	0	111.3	S43 A46 V47 L50 L75 R76 E81 D82 I83	S43-I79 WeakPolarHBondContact O-CG2 3.49Å; A46-I79 HydrophobicContact CB-CD1 4.05Å; A46-I79 HydrophobicContact CB-CG2 4.49Å; V47-I79 HydrophobicContact CG2-CB 3.91Å; V47-I79 HydrophobicContact CG2-CG2 3.55Å; L50-I79 HydrophobicContact CD1-CD1 3.7Å; L75-I79 HydrophobicContact CD1-CD1 4.04Å; L75-I79 HydrophobicContact CD1-CG1 4.34Å; L75-I79 HydrophobicContact CG-CD1 4Å; L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 2.9Å; R76-I79 PolarHBondContact O-N 3.01Å; I79-E81 VanDerWaalsContact C-N 3.32Å; I79-D82 WeakPolarHBondContact O-CB 3.28Å; I79-D82 PolarHBondContact O-N 3.04Å; I79-I83 HydrophobicContact CG2-CD1 4.47Å; I79-I83 VanDerWaalsContact O-CG1 3.3Å; I79-I83 WeakPolarHBondContact O-CG1 3.4Å; I79-I83 PolarHBondContact O-N 3.36Å
80	E	97.3	Very high	96.2	Very high	71 Å²	71	60.4 Å²	60.4	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-35	173.3	-74.7	171.9	-178	0	0	112.7	V47 R76 K77 A78 K84	V47-E80 HydrophobicContact CG1-CG 4.36Å; V47-E80 HydrophobicContact CG2-CG 4.07Å; R76-E80 WeakPolarHBondContact CG-OE1 3.42Å; R76-E80 WeakPolarHBondContact O-CG 3.02Å; R76-E80 PolarHBondContact O-N 3.07Å; K77-E80 PolarHBondContact O-N 2.99Å; A78-E80 VanDerWaalsContact C-N 3.32Å; A78-E80 PolarHBondContact O-N 2.75Å; E80-K84 WeakPolarHBondContact O-CG 3.47Å; E80-K84 PolarHBondContact O-N 3.39Å
81	E	97.8	Very high	96.3	Very high	96 Å²	96	63.1 Å²	63.1	45%	0.449	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-43.6	171.9	-73.1	171.3	-174.3	0	0	111.1	K77 A78 I79 I83 K84 V85	K77-E81 VanDerWaalsContact CE-OE1 3.23Å; K77-E81 WeakPolarHBondContact CE-OE1 3.48Å; K77-E81 WeakPolarHBondContact O-CG 3.5Å; K77-E81 PolarHBondContact O-N 3.02Å; A78-E81 WeakPolarHBondContact O-CB 3.43Å; A78-E81 PolarHBondContact O-N 3.09Å; A78-E81 VanDerWaalsContact O-N 3.16Å; I79-E81 VanDerWaalsContact C-N 3.32Å; E81-I83 VanDerWaalsContact C-N 3.31Å; E81-I83 PolarHBondContact O-N 3.09Å; E81-K84 WeakPolarHBondContact O-CB 3.4Å; E81-K84 PolarHBondContact O-N 3.36Å; E81-K84 VanDerWaalsContact O-N 3.09Å; E81-V85 WeakPolarHBondContact O-CG2 3.17Å; E81-V85 PolarHBondContact O-N 2.89Å
82	D	96.6	Very high	96.4	Very high	78 Å²	78	64.6 Å²	64.6	42%	0.417	33%	0.333	S	S	.	.	H	α-helix	trans	-57.9	-42.2	174	-69.4	-18.8	0	0	0	111.9	A78 I79 K84 V85 Y86	A78-D82 PolarHBondContact O-N 3.42Å; I79-D82 WeakPolarHBondContact O-CB 3.28Å; I79-D82 PolarHBondContact O-N 3.04Å; D82-K84 VanDerWaalsContact C-N 3.29Å; D82-K84 PolarHBondContact O-N 2.98Å; D82-V85 PolarHBondContact O-N 3.4Å; D82-V85 VanDerWaalsContact O-N 3.17Å; D82-Y86 HydrophobicContact CB-CD2 4.47Å; D82-Y86 HydrophobicContact CB-CE2 4.13Å; D82-Y86 WeakPolarHBondContact O-CD2 3.31Å; D82-Y86 PolarHBondContact O-N 2.72Å
83	I	97.9	Very high	96.6	Very high	23 Å²	23	64.9 Å²	64.9	12%	0.118	34%	0.335	C	S	.	.	H	α-helix	trans	-57.8	-43.1	176.5	-69	165.6	0	0	0	110.9	R44 V47 I79 E81 Y86 D87	R44-I83 HydrophobicContact CG-CD1 3.88Å; R44-I83 HydrophobicContact CG-CG1 4.31Å; R44-I83 HydrophobicContact CG-CG2 4.49Å; V47-I83 HydrophobicContact CG2-CD1 3.86Å; I79-I83 HydrophobicContact CG2-CD1 4.47Å; I79-I83 VanDerWaalsContact O-CG1 3.3Å; I79-I83 WeakPolarHBondContact O-CG1 3.4Å; I79-I83 PolarHBondContact O-N 3.36Å; E81-I83 VanDerWaalsContact C-N 3.31Å; E81-I83 PolarHBondContact O-N 3.09Å; I83-Y86 PolarHBondContact O-N 3.3Å; I83-D87 PolarHBondContact O-N 2.92Å
84	K	98.1	Very high	96.7	Very high	144 Å²	144	63.6 Å²	63.6	63%	0.626	33%	0.325	S	S	*	.	H	α-helix	trans	-65.3	-39.7	177.7	-66.9	171.8	-173.5	172.8	0	111.8	E80 E81 D82 D87 S88	E80-K84 WeakPolarHBondContact O-CG 3.47Å; E80-K84 PolarHBondContact O-N 3.39Å; E81-K84 WeakPolarHBondContact O-CB 3.4Å; E81-K84 PolarHBondContact O-N 3.36Å; E81-K84 VanDerWaalsContact O-N 3.09Å; D82-K84 VanDerWaalsContact C-N 3.29Å; D82-K84 PolarHBondContact O-N 2.98Å; K84-D87 PolarHBondContact O-N 3.17Å; K84-S88 PolarHBondContact O-N 3.4Å
85	V	97.9	Very high	96.7	Very high	80 Å²	80	67 Å²	67	49%	0.485	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-51.9	175.2	174.7	0	0	0	0	109.6	E81 D82 D87 S88 E89	E81-V85 WeakPolarHBondContact O-CG2 3.17Å; E81-V85 PolarHBondContact O-N 2.89Å; D82-V85 PolarHBondContact O-N 3.4Å; D82-V85 VanDerWaalsContact O-N 3.17Å; V85-D87 VanDerWaalsContact C-N 3.32Å; V85-D87 PolarHBondContact O-N 3.33Å; V85-S88 PolarHBondContact O-N 3.04Å; V85-S88 VanDerWaalsContact O-N 3.09Å; V85-S88 PolarHBondContact O-OG 3.21Å; V85-E89 HydrophobicContact CG1-CG 4.24Å; V85-E89 WeakPolarHBondContact O-CG 3.36Å; V85-E89 PolarHBondContact O-N 3.46Å
86	Y	98	Very high	96.7	Very high	50 Å²	50	69.7 Å²	69.7	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-42.5	177	-69.3	-55.1	0	0	0	112.8	Y36 N39 R40 D82 I83 S88 E89 I90	Y36-Y86 AromaticContact CD1-CD1 3.97Å; Y36-Y86 HydrophobicContact CD1-CD1 3.97Å; Y36-Y86 AromaticContact CD1-CE1 3.96Å; Y36-Y86 HydrophobicContact CD1-CE1 3.96Å; Y36-Y86 HydrophobicContact CG-CD1 4.2Å; N39-Y86 HydrophobicContact CB-CD1 4.48Å; N39-Y86 HydrophobicContact CB-CE1 3.78Å; N39-Y86 HydrophobicContact CB-CE2 4.03Å; R40-Y86 HydrophobicContact CB-CD2 4.19Å; R40-Y86 HydrophobicContact CB-CG 4.15Å; D82-Y86 HydrophobicContact CB-CD2 4.47Å; D82-Y86 HydrophobicContact CB-CE2 4.13Å; D82-Y86 WeakPolarHBondContact O-CD2 3.31Å; D82-Y86 PolarHBondContact O-N 2.72Å; I83-Y86 PolarHBondContact O-N 3.3Å; Y86-S88 VanDerWaalsContact C-N 3.3Å; Y86-S88 PolarHBondContact O-N 3.48Å; Y86-E89 PolarHBondContact O-N 2.91Å; Y86-I90 VanDerWaalsContact O-CB 3.31Å; Y86-I90 WeakPolarHBondContact O-CB 3.44Å; Y86-I90 WeakPolarHBondContact O-CD1 3.43Å; Y86-I90 WeakPolarHBondContact O-CG1 3.31Å; Y86-I90 PolarHBondContact O-N 2.94Å
87	D	97.7	Very high	96.7	Very high	46 Å²	46	68.5 Å²	68.5	25%	0.246	34%	0.338	C	S	.	.	H	α-helix	trans	-59.4	-43.3	176.7	-79.3	-30	0	0	0	111.3	R40 R44 I83 K84 V85 Q91	R40-D87 WeakPolarHBondContact CD-OD1 3.47Å; R40-D87 IonicContact CZ-OD1 3.42Å; R40-D87 IonicContact NE-OD1 3.81Å; R40-D87 IonicContact NH1-OD1 3.8Å; R40-D87 PolarHBondContact NH1-OD1 3.49Å; R44-D87 IonicContact NH2-OD1 2.62Å; R44-D87 PolarHBondContact NH2-OD1 2.62Å; R44-D87 IonicContact NH2-OD2 2.72Å; I83-D87 PolarHBondContact O-N 2.92Å; K84-D87 PolarHBondContact O-N 3.17Å; V85-D87 VanDerWaalsContact C-N 3.32Å; V85-D87 PolarHBondContact O-N 3.33Å; D87-Q91 VanDerWaalsContact O-CG 3.28Å; D87-Q91 WeakPolarHBondContact O-CG 3.27Å; D87-Q91 PolarHBondContact O-N 3.49Å; D87-Q91 VanDerWaalsContact O-N 3.1Å
88	S	97.7	Very high	96.5	Very high	43 Å²	43	67 Å²	67	30%	0.301	33%	0.332	S	S	.	.	H	α-helix	trans	-68	-41.5	178.3	76.9	0	0	0	0	113	K84 V85 Y86 Q91 K92	K84-S88 PolarHBondContact O-N 3.4Å; V85-S88 PolarHBondContact O-N 3.04Å; V85-S88 VanDerWaalsContact O-N 3.09Å; V85-S88 PolarHBondContact O-OG 3.21Å; Y86-S88 VanDerWaalsContact C-N 3.3Å; Y86-S88 PolarHBondContact O-N 3.48Å; S88-Q91 PolarHBondContact O-N 3.32Å; S88-K92 WeakPolarHBondContact O-CG 3.33Å; S88-K92 PolarHBondContact O-N 3.19Å
89	E	97.6	Very high	96.4	Very high	57 Å²	57	70.1 Å²	70.1	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-70.3	-39.8	179.4	-65.9	-51.8	137.1	0	0	111.8	Y36 V85 Y86 Q91 K92 L93	Y36-E89 HydrophobicContact CD2-CB 3.89Å; Y36-E89 HydrophobicContact CE2-CB 3.79Å; V85-E89 HydrophobicContact CG1-CG 4.24Å; V85-E89 WeakPolarHBondContact O-CG 3.36Å; V85-E89 PolarHBondContact O-N 3.46Å; Y86-E89 PolarHBondContact O-N 2.91Å; E89-Q91 VanDerWaalsContact C-N 3.3Å; E89-Q91 PolarHBondContact O-N 3.27Å; E89-K92 PolarHBondContact O-N 3.25Å; E89-K92 IonicContact OE1-NZ 2.72Å; E89-K92 PolarHBondContact OE1-NZ 3.27Å; E89-K92 IonicContact OE2-NZ 3.59Å; E89-L93 WeakPolarHBondContact O-CB 3.3Å; E89-L93 WeakPolarHBondContact O-CG 3.45Å; E89-L93 PolarHBondContact O-N 2.95Å
90	I	97.4	Very high	96.3	Very high	11 Å²	11	70 Å²	70	6%	0.056	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-41.1	173.2	-70.3	166.3	0	0	0	110.7	D37 Y86 N94	D37-I90 HydrophobicContact CB-CD1 4.33Å; Y86-I90 VanDerWaalsContact O-CB 3.31Å; Y86-I90 WeakPolarHBondContact O-CB 3.44Å; Y86-I90 WeakPolarHBondContact O-CD1 3.43Å; Y86-I90 WeakPolarHBondContact O-CG1 3.31Å; Y86-I90 PolarHBondContact O-N 2.94Å; I90-N94 WeakPolarHBondContact CG2-ND2 3.4Å; I90-N94 WeakPolarHBondContact O-CB 3.48Å; I90-N94 VanDerWaalsContact O-CG 3.23Å; I90-N94 PolarHBondContact O-N 2.88Å; I90-N94 PolarHBondContact O-ND2 2.99Å
91	Q	96.5	Very high	96.2	Very high	143 Å²	143	68.8 Å²	68.8	67%	0.668	33%	0.333	S	S	*	.	H	α-helix	trans	-63.9	-46.1	176.7	-77.2	176.2	-4.3	0	0	112	D87 S88 E89 N94 H95	D87-Q91 VanDerWaalsContact O-CG 3.28Å; D87-Q91 WeakPolarHBondContact O-CG 3.27Å; D87-Q91 PolarHBondContact O-N 3.49Å; D87-Q91 VanDerWaalsContact O-N 3.1Å; S88-Q91 PolarHBondContact O-N 3.32Å; E89-Q91 VanDerWaalsContact C-N 3.3Å; E89-Q91 PolarHBondContact O-N 3.27Å; Q91-N94 PolarHBondContact O-N 2.9Å; Q91-H95 PolarHBondContact O-N 3.16Å
92	K	96.7	Very high	96	Very high	107 Å²	107	69.3 Å²	69.3	47%	0.465	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-49.4	176.1	-71	171.2	-171.8	169.4	0	111.6	S88 E89 N94 H95 Q96	S88-K92 WeakPolarHBondContact O-CG 3.33Å; S88-K92 PolarHBondContact O-N 3.19Å; E89-K92 PolarHBondContact O-N 3.25Å; E89-K92 IonicContact OE1-NZ 2.72Å; E89-K92 PolarHBondContact OE1-NZ 3.27Å; E89-K92 IonicContact OE2-NZ 3.59Å; K92-N94 VanDerWaalsContact C-N 3.33Å; K92-N94 PolarHBondContact O-N 2.7Å; K92-H95 WeakPolarHBondContact O-CB 3.44Å; K92-H95 PolarHBondContact O-N 2.91Å; K92-H95 VanDerWaalsContact O-N 3.13Å; K92-Q96 WeakPolarHBondContact O-CG 3.42Å; K92-Q96 PolarHBondContact O-N 3.42Å
93	L	96.5	Very high	95.8	Very high	7 Å²	7	71.7 Å²	71.7	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-41.8	178.4	-77.5	174.8	0	0	0	112.1	K29 E32 C33 Y36 E89 H95 Q96 L97	K29-L93 HydrophobicContact CB-CD2 4.49Å; K29-L93 HydrophobicContact CG-CD2 4.31Å; E32-L93 HydrophobicContact CB-CD1 4.06Å; E32-L93 HydrophobicContact CG-CD1 3.74Å; E32-L93 WeakPolarHBondContact OE2-CD2 3.3Å; C33-L93 HydrophobicContact CB-CD1 4.38Å; Y36-L93 HydrophobicContact CD2-CD1 3.51Å; Y36-L93 HydrophobicContact CE2-CD1 3.55Å; E89-L93 WeakPolarHBondContact O-CB 3.3Å; E89-L93 WeakPolarHBondContact O-CG 3.45Å; E89-L93 PolarHBondContact O-N 2.95Å; L93-H95 VanDerWaalsContact C-N 3.29Å; L93-H95 PolarHBondContact O-N 3.32Å; L93-Q96 PolarHBondContact O-N 3.31Å; L93-L97 WeakPolarHBondContact O-CB 3.07Å; L93-L97 PolarHBondContact O-N 3.42Å
94	N	94.8	Very high	95.7	Very high	67 Å²	67	71.7 Å²	71.7	36%	0.358	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-33.9	176.9	-77.2	-39.9	0	0	0	112.5	I90 Q91 K92 K98	I90-N94 WeakPolarHBondContact CG2-ND2 3.4Å; I90-N94 WeakPolarHBondContact O-CB 3.48Å; I90-N94 VanDerWaalsContact O-CG 3.23Å; I90-N94 PolarHBondContact O-N 2.88Å; I90-N94 PolarHBondContact O-ND2 2.99Å; Q91-N94 PolarHBondContact O-N 2.9Å; K92-N94 VanDerWaalsContact C-N 3.33Å; K92-N94 PolarHBondContact O-N 2.7Å; N94-K98 WeakPolarHBondContact O-CG 3.46Å; N94-K98 PolarHBondContact O-N 3Å
95	H	93.7	Very high	95.6	Very high	114 Å²	114	66.8 Å²	66.8	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-67.5	-50.7	174.3	-175.3	65.2	0	0	0	110.9	Q91 K92 L93 L97 K98 E99	Q91-H95 PolarHBondContact O-N 3.16Å; K92-H95 WeakPolarHBondContact O-CB 3.44Å; K92-H95 PolarHBondContact O-N 2.91Å; K92-H95 VanDerWaalsContact O-N 3.13Å; L93-H95 VanDerWaalsContact C-N 3.29Å; L93-H95 PolarHBondContact O-N 3.32Å; H95-L97 VanDerWaalsContact C-N 3.33Å; H95-L97 PolarHBondContact O-N 3.27Å; H95-K98 WeakPolarHBondContact O-CB 3.38Å; H95-K98 PolarHBondContact O-N 2.96Å; H95-K98 VanDerWaalsContact O-N 3.12Å; H95-E99 IonicContact NE2-OE1 3.61Å; H95-E99 PolarHBondContact O-N 2.91Å
96	Q	95.1	Very high	95.4	Very high	79 Å²	79	68.1 Å²	68.1	37%	0.369	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-45.1	177	-70.3	171.5	-7.6	0	0	111.6	K92 L93 K98 E99 D100	K92-Q96 WeakPolarHBondContact O-CG 3.42Å; K92-Q96 PolarHBondContact O-N 3.42Å; L93-Q96 PolarHBondContact O-N 3.31Å; Q96-K98 PolarHBondContact O-N 3.21Å; Q96-E99 CarbonylContact O-C 3.57Å; Q96-E99 WeakPolarHBondContact O-CA 3.43Å; Q96-E99 WeakPolarHBondContact O-CB 3.24Å; Q96-E99 PolarHBondContact O-N 3.24Å; Q96-D100 VanDerWaalsContact C-OD2 3.3Å; Q96-D100 PolarHBondContact O-N 3.38Å
97	L	95.3	Very high	95.2	Very high	27 Å²	27	66.4 Å²	66.4	14%	0.141	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-35	178.9	-171.5	68.6	0	0	0	112.3	V26 K29 L93 H95 I101	V26-L97 HydrophobicContact CB-CD1 4.4Å; V26-L97 HydrophobicContact CG1-CD1 3.89Å; V26-L97 WeakPolarHBondContact O-CD1 3.49Å; K29-L97 HydrophobicContact CB-CD1 4.18Å; L93-L97 WeakPolarHBondContact O-CB 3.07Å; L93-L97 PolarHBondContact O-N 3.42Å; H95-L97 VanDerWaalsContact C-N 3.33Å; H95-L97 PolarHBondContact O-N 3.27Å; L97-I101 HydrophobicContact CD1-CD1 4.29Å; L97-I101 HydrophobicContact CD1-CG1 4.47Å; L97-I101 HydrophobicContact CD2-CD1 4.47Å; L97-I101 HydrophobicContact CG-CD1 3.86Å; L97-I101 HydrophobicContact CG-CG1 4.42Å; L97-I101 WeakPolarHBondContact O-CB 3.47Å; L97-I101 WeakPolarHBondContact O-CD1 3.45Å; L97-I101 WeakPolarHBondContact O-CG1 3.49Å; L97-I101 PolarHBondContact O-N 3.03Å
98	K	92.4	Very high	95	Very high	97 Å²	97	67.8 Å²	67.8	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-66	-41.9	174.5	-71.2	174.2	-179.1	-171.6	0	111.6	N94 H95 Q96 K102	N94-K98 WeakPolarHBondContact O-CG 3.46Å; N94-K98 PolarHBondContact O-N 3Å; H95-K98 WeakPolarHBondContact O-CB 3.38Å; H95-K98 PolarHBondContact O-N 2.96Å; H95-K98 VanDerWaalsContact O-N 3.12Å; Q96-K98 PolarHBondContact O-N 3.21Å; K98-K102 WeakPolarHBondContact O-CB 3.46Å; K98-K102 PolarHBondContact O-N 2.96Å
99	E	93.1	Very high	94.8	Very high	109 Å²	109	69 Å²	69	51%	0.509	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-44.6	177.2	-61.3	-176.8	143.7	0	0	111	H95 Q96 K102 W103	H95-E99 IonicContact NE2-OE1 3.61Å; H95-E99 PolarHBondContact O-N 2.91Å; Q96-E99 CarbonylContact O-C 3.57Å; Q96-E99 WeakPolarHBondContact O-CA 3.43Å; Q96-E99 WeakPolarHBondContact O-CB 3.24Å; Q96-E99 PolarHBondContact O-N 3.24Å; E99-K102 WeakPolarHBondContact O-CB 3.33Å; E99-K102 PolarHBondContact O-N 3.3Å; E99-W103 WeakPolarHBondContact O-CB 3.49Å; E99-W103 PolarHBondContact O-N 3.37Å
100	D	94.8	Very high	94.4	Very high	22 Å²	22	71.5 Å²	71.5	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-66.5	-40.3	179.6	-53.8	-47.8	0	0	0	112.2	V26 K29 Q96 K102 W103 L104	V26-D100 HydrophobicContact CG2-CB 3.64Å; K29-D100 WeakPolarHBondContact CD-OD2 3.36Å; K29-D100 VanDerWaalsContact CE-OD2 3.29Å; K29-D100 WeakPolarHBondContact CE-OD2 3.33Å; K29-D100 IonicContact NZ-OD1 3.37Å; K29-D100 PolarHBondContact NZ-OD1 3.23Å; K29-D100 IonicContact NZ-OD2 3.71Å; K29-D100 PolarHBondContact NZ-OD2 2.91Å; Q96-D100 VanDerWaalsContact C-OD2 3.3Å; Q96-D100 PolarHBondContact O-N 3.38Å; D100-K102 VanDerWaalsContact C-N 3.33Å; D100-W103 PolarHBondContact O-N 3.32Å; D100-L104 WeakPolarHBondContact O-CB 3.46Å; D100-L104 PolarHBondContact O-N 3.04Å
101	I	94.8	Very high	93.8	Very high	44 Å²	44	77.1 Å²	77.1	23%	0.226	37%	0.373	C	S	.	.	H	α-helix	trans	-67	-39.2	175.8	-66.4	166.3	0	0	0	110	V26 L97 W103 L104 H105 L113	V26-I101 HydrophobicContact CG1-CD1 4.41Å; V26-I101 HydrophobicContact CG1-CG1 3.8Å; V26-I101 HydrophobicContact CG2-CG1 4Å; L97-I101 HydrophobicContact CD1-CD1 4.29Å; L97-I101 HydrophobicContact CD1-CG1 4.47Å; L97-I101 HydrophobicContact CD2-CD1 4.47Å; L97-I101 HydrophobicContact CG-CD1 3.86Å; L97-I101 HydrophobicContact CG-CG1 4.42Å; L97-I101 WeakPolarHBondContact O-CB 3.47Å; L97-I101 WeakPolarHBondContact O-CD1 3.45Å; L97-I101 WeakPolarHBondContact O-CG1 3.49Å; L97-I101 PolarHBondContact O-N 3.03Å; I101-W103 VanDerWaalsContact C-N 3.33Å; I101-L104 PolarHBondContact O-N 3.49Å; I101-H105 WeakPolarHBondContact O-CB 3.32Å; I101-H105 PolarHBondContact O-CD2 3.1Å; I101-H105 PolarHBondContact O-N 3.49Å; I101-L113 HydrophobicContact CB-CD1 4.1Å; I101-L113 HydrophobicContact CG2-CD1 3.66Å; I101-L113 HydrophobicContact CG2-CD2 4.03Å; I101-L113 HydrophobicContact CG2-CG 4.16Å
102	K	92.6	Very high	92.9	Very high	107 Å²	107	74.7 Å²	74.7	47%	0.465	37%	0.369	S	S	.	.	H	α-helix	trans	-60.8	-45.4	174.6	-177.8	-177.1	172.9	-173.6	0	110.7	K98 E99 D100 H105 E106	K98-K102 WeakPolarHBondContact O-CB 3.46Å; K98-K102 PolarHBondContact O-N 2.96Å; E99-K102 WeakPolarHBondContact O-CB 3.33Å; E99-K102 PolarHBondContact O-N 3.3Å; D100-K102 VanDerWaalsContact C-N 3.33Å; K102-H105 WeakPolarHBondContact O-CB 3.23Å; K102-H105 PolarHBondContact O-N 3.02Å; K102-E106 WeakPolarHBondContact CE-OE1 3.45Å; K102-E106 WeakPolarHBondContact O-CG 3.33Å; K102-E106 PolarHBondContact O-N 3.48Å
103	W	94	Very high	91.9	Very high	129 Å²	129	71.8 Å²	71.8	49%	0.489	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-45.5	175.6	174.5	-122.5	0	0	0	112.3	E99 D100 I101 H105 E106 L107	E99-W103 WeakPolarHBondContact O-CB 3.49Å; E99-W103 PolarHBondContact O-N 3.37Å; D100-W103 PolarHBondContact O-N 3.32Å; I101-W103 VanDerWaalsContact C-N 3.33Å; W103-H105 VanDerWaalsContact C-N 3.34Å; W103-H105 PolarHBondContact O-N 3.03Å; W103-E106 HydrophobicContact CE3-CB 4.35Å; W103-E106 WeakPolarHBondContact O-CB 3.44Å; W103-E106 PolarHBondContact O-N 3.5Å; W103-L107 HydrophobicContact CD2-CD1 4.3Å; W103-L107 HydrophobicContact CD2-CG 4.21Å; W103-L107 HydrophobicContact CH2-CD2 3.72Å; W103-L107 HydrophobicContact CH2-CG 4.09Å; W103-L107 HydrophobicContact CZ2-CD1 3.8Å; W103-L107 HydrophobicContact CZ2-CD2 3.6Å; W103-L107 HydrophobicContact CZ2-CG 3.76Å; W103-L107 HydrophobicContact CZ3-CD2 4.39Å; W103-L107 HydrophobicContact CZ3-CG 4.45Å; W103-L107 PolarHBondContact O-N 3.23Å
104	L	96.1	Very high	91	Very high	23 Å²	23	79 Å²	79	12%	0.12	39%	0.389	C	S	.	.	H	α-helix	trans	-59.4	-44.2	174.8	178.5	61.6	0	0	0	111.7	I19 A22 V26 D100 I101 E106 L107 E108	I19-L104 HydrophobicContact CG2-CD1 4.1Å; A22-L104 HydrophobicContact CB-CB 4.31Å; A22-L104 HydrophobicContact CB-CD1 3.93Å; V26-L104 HydrophobicContact CG2-CD2 4.32Å; D100-L104 WeakPolarHBondContact O-CB 3.46Å; D100-L104 PolarHBondContact O-N 3.04Å; I101-L104 PolarHBondContact O-N 3.49Å; L104-E106 VanDerWaalsContact C-N 3.32Å; L104-E106 PolarHBondContact O-N 2.97Å; L104-L107 PolarHBondContact O-N 3.11Å; L104-E108 HydrophobicContact CD1-CG 4.16Å; L104-E108 HydrophobicContact CG-CG 4.47Å; L104-E108 WeakPolarHBondContact O-CB 3.3Å; L104-E108 VanDerWaalsContact O-CG 3.3Å; L104-E108 WeakPolarHBondContact O-CG 3.12Å; L104-E108 PolarHBondContact O-N 3.38Å
105	H	94.1	Very high	90.1	Very high	40 Å²	40	78.2 Å²	78.2	19%	0.185	40%	0.397	C	S	.	.	H	α-helix	trans	-61.6	-40	175.9	-86.4	-129.3	0	0	0	112.3	I101 K102 W103 E108 G109 K110 E111	I101-H105 WeakPolarHBondContact O-CB 3.32Å; I101-H105 PolarHBondContact O-CD2 3.1Å; I101-H105 PolarHBondContact O-N 3.49Å; K102-H105 WeakPolarHBondContact O-CB 3.23Å; K102-H105 PolarHBondContact O-N 3.02Å; W103-H105 VanDerWaalsContact C-N 3.34Å; W103-H105 PolarHBondContact O-N 3.03Å; H105-E108 PolarHBondContact O-N 2.99Å; H105-G109 PolarHBondContact O-N 2.93Å; H105-G109 VanDerWaalsContact O-N 3.09Å; H105-K110 HydrophobicContact CB-CB 4.17Å; H105-K110 PolarHBondContact O-N 2.86Å; H105-E111 PolarHBondContact ND1-O 3.15Å
106	E	93.6	Very high	89.1	Confident	108 Å²	108	78 Å²	78	51%	0.505	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-45.2	175.5	-73.8	172.2	-170.8	0	0	111.1	K102 W103 L104 E108 G109	K102-E106 WeakPolarHBondContact CE-OE1 3.45Å; K102-E106 WeakPolarHBondContact O-CG 3.33Å; K102-E106 PolarHBondContact O-N 3.48Å; W103-E106 HydrophobicContact CE3-CB 4.35Å; W103-E106 WeakPolarHBondContact O-CB 3.44Å; W103-E106 PolarHBondContact O-N 3.5Å; L104-E106 VanDerWaalsContact C-N 3.32Å; L104-E106 PolarHBondContact O-N 2.97Å; E106-E108 PolarHBondContact O-N 3.19Å; E106-G109 PolarHBondContact O-N 2.86Å
107	L	94.5	Very high	88	Confident	14 Å²	14	81.4 Å²	81.4	7%	0.073	42%	0.416	C	S	.	.	H	α-helix	trans	-63.3	-39.8	175.5	-71.6	176.2	0	0	0	112.4	H15 E18 I19 A22 W103 L104 G109	H15-L107 PolarHBondContact CE1-O 3.29Å; H15-L107 PolarHBondContact NE2-O 2.61Å; E18-L107 HydrophobicContact CB-CD1 4.26Å; E18-L107 HydrophobicContact CB-CD2 4.43Å; I19-L107 HydrophobicContact CG1-CB 3.74Å; A22-L107 HydrophobicContact CB-CD1 3.85Å; W103-L107 HydrophobicContact CD2-CD1 4.3Å; W103-L107 HydrophobicContact CD2-CG 4.21Å; W103-L107 HydrophobicContact CH2-CD2 3.72Å; W103-L107 HydrophobicContact CH2-CG 4.09Å; W103-L107 HydrophobicContact CZ2-CD1 3.8Å; W103-L107 HydrophobicContact CZ2-CD2 3.6Å; W103-L107 HydrophobicContact CZ2-CG 3.76Å; W103-L107 HydrophobicContact CZ3-CD2 4.39Å; W103-L107 HydrophobicContact CZ3-CG 4.45Å; W103-L107 PolarHBondContact O-N 3.23Å; L104-L107 PolarHBondContact O-N 3.11Å; L107-G109 PolarHBondContact O-N 2.83Å
108	E	94	Very high	87.2	Confident	75 Å²	75	86.9 Å²	86.9	35%	0.35	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-4.8	178.2	-67.8	177.7	119.5	0	0	113.6	I19 L104 H105 E106 K110	I19-E108 HydrophobicContact CG2-CG 4.15Å; L104-E108 HydrophobicContact CD1-CG 4.16Å; L104-E108 HydrophobicContact CG-CG 4.47Å; L104-E108 WeakPolarHBondContact O-CB 3.3Å; L104-E108 VanDerWaalsContact O-CG 3.3Å; L104-E108 WeakPolarHBondContact O-CG 3.12Å; L104-E108 PolarHBondContact O-N 3.38Å; H105-E108 PolarHBondContact O-N 2.99Å; E106-E108 PolarHBondContact O-N 3.19Å; E108-K110 HydrophobicContact CB-CD 4.14Å; E108-K110 HydrophobicContact CB-CG 3.99Å; E108-K110 PolarHBondContact O-N 3.04Å; E108-K110 IonicContact OE1-NZ 2.81Å; E108-K110 PolarHBondContact OE1-NZ 3.06Å; E108-K110 WeakPolarHBondContact OE2-CD 3.38Å; E108-K110 WeakPolarHBondContact OE2-CE 3.39Å; E108-K110 IonicContact OE2-NZ 2.66Å; E108-K110 PolarHBondContact OE2-NZ 3.31Å
109	G	92.3	Very high	86.4	Confident	70 Å²	70	89.8 Å²	89.8	72%	0.722	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	25	-174.9	0	0	0	0	0	113.7	H105 E106 L107	H105-G109 PolarHBondContact O-N 2.93Å; H105-G109 VanDerWaalsContact O-N 3.09Å; E106-G109 PolarHBondContact O-N 2.86Å; L107-G109 PolarHBondContact O-N 2.83Å
110	K	90.6	Very high	85.6	Confident	109 Å²	109	90.4 Å²	90.4	47%	0.474	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-84	158.5	176.8	-68.8	179	-172.3	158.5	0	110.9	H105 E108	H105-K110 HydrophobicContact CB-CB 4.17Å; H105-K110 PolarHBondContact O-N 2.86Å; E108-K110 HydrophobicContact CB-CD 4.14Å; E108-K110 HydrophobicContact CB-CG 3.99Å; E108-K110 PolarHBondContact O-N 3.04Å; E108-K110 IonicContact OE1-NZ 2.81Å; E108-K110 PolarHBondContact OE1-NZ 3.06Å; E108-K110 WeakPolarHBondContact OE2-CD 3.38Å; E108-K110 WeakPolarHBondContact OE2-CE 3.39Å; E108-K110 IonicContact OE2-NZ 2.66Å; E108-K110 PolarHBondContact OE2-NZ 3.31Å
111	E	84.1	Confident	84.5	Confident	129 Å²	129	101.3 Å²	101.3	60%	0.603	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-61.1	147.8	171.5	-69.5	-170.6	179.9	0	0	111.1	H105 K114	H105-E111 PolarHBondContact ND1-O 3.15Å; E111-K114 WeakPolarHBondContact OE2-CE 3.38Å; E111-K114 IonicContact OE2-NZ 2.67Å; E111-K114 PolarHBondContact OE2-NZ 3.42Å
112	P	77.8	Confident	84	Confident	91 Å²	91	104.2 Å²	104.2	59%	0.591	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-60.8	150.1	175.9	26.5	-35	0	0	0	110.9	K114	P112-K114 PolarHBondContact O-N 3.43Å; P112-K114 VanDerWaalsContact O-N 3.15Å
113	L	75.2	Confident	83.6	Confident	47 Å²	47	104.1 Å²	104.1	25%	0.246	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-57.7	118.1	177.7	-68.6	174.2	0	0	0	111	I101 F116	I101-L113 HydrophobicContact CB-CD1 4.1Å; I101-L113 HydrophobicContact CG2-CD1 3.66Å; I101-L113 HydrophobicContact CG2-CD2 4.03Å; I101-L113 HydrophobicContact CG2-CG 4.16Å; L113-F116 HydrophobicContact CB-CD2 3.65Å; L113-F116 HydrophobicContact CB-CE2 3.91Å; L113-F116 HydrophobicContact CD1-CD2 4.25Å; L113-F116 HydrophobicContact CD1-CE2 4.18Å; L113-F116 HydrophobicContact CD2-CE2 4.12Å; L113-F116 HydrophobicContact CG-CD2 4.45Å; L113-F116 HydrophobicContact CG-CE2 4.32Å
114	K	77.7	Confident	83	Confident	157 Å²	157	102.7 Å²	102.7	68%	0.683	56%	0.558	S	S	*	*	S	Bend	trans	-87	141.9	176.6	-62.4	178.8	-172.8	167.4	0	110.4	E111 P112	E111-K114 WeakPolarHBondContact OE2-CE 3.38Å; E111-K114 IonicContact OE2-NZ 2.67Å; E111-K114 PolarHBondContact OE2-NZ 3.42Å; P112-K114 PolarHBondContact O-N 3.43Å; P112-K114 VanDerWaalsContact O-N 3.15Å
115	G	77.3	Confident	82.2	Confident	51 Å²	51	107.4 Å²	107.4	53%	0.526	58%	0.584	S	S	.	*	S	Bend	trans	88.8	2.4	170	0	0	0	0	0	116.6	L118	G115-L118 WeakPolarHBondContact O-CD1 3.44Å; G115-L118 WeakPolarHBondContact O-CG 3.21Å
116	F	72.2	Confident	81.5	Confident	111 Å²	111	111.6 Å²	111.6	49%	0.487	61%	0.609	S	S	.	*	S	Bend	trans	-90	-15.4	176	-67.9	-87	0	0	0	114.1	L113	L113-F116 HydrophobicContact CB-CD2 3.65Å; L113-F116 HydrophobicContact CB-CE2 3.91Å; L113-F116 HydrophobicContact CD1-CD2 4.25Å; L113-F116 HydrophobicContact CD1-CE2 4.18Å; L113-F116 HydrophobicContact CD2-CE2 4.12Å; L113-F116 HydrophobicContact CG-CD2 4.45Å; L113-F116 HydrophobicContact CG-CE2 4.32Å
117	D	72	Confident	80.7	Confident	149 Å²	149	111.8 Å²	111.8	80%	0.797	62%	0.616	S	S	*	*	S	Bend	trans	-106.7	33.1	-178.6	-57.8	-36.8	0	0	0	112.1	L119	D117-L119 PolarHBondContact O-N 2.8Å
118	L	77	Confident	79.7	Confident	143 Å²	143	118.8 Å²	118.8	75%	0.749	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-71.4	126.6	178	-63.7	174.1	0	0	0	110	G115	G115-L118 WeakPolarHBondContact O-CD1 3.44Å; G115-L118 WeakPolarHBondContact O-CG 3.21Å
119	L	75.6	Confident	78.6	Confident	158 Å²	158	122.2 Å²	122.2	83%	0.827	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-77.1	143.1	166.7	-65.8	170.6	0	0	0	109.2	D117	D117-L119 PolarHBondContact O-N 2.8Å
120	P	76.8	Confident	77.5	Confident	122 Å²	122	126.5 Å²	126.5	79%	0.792	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-57.9	143.4	170.8	25.3	-32.1	0	0	0	110
121	L	73.1	Confident	76.3	Confident	251 Å²	251	128.1 Å²	128.1	100%	1.314	69%	0.692	S	S	*	*			trans	-60.8	0	173.9	-72.9	171.8	0	0	0	111.9

Retrieved 121 of 121 residues in 30.9 ms (Link to these results)

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