G4M1B2_SCHMA Loading...

DNA polymerase epsilon subunit, putative

AlphaFold DB , UniProt , Accession G4M1B2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 108 aa.

						>G4M1B2_SCHMA|G4M1B2
MPRYSTTDEIMGLRIPAFRTRLMMKSSPDVDCVSSDSVVCLSKATEMFVSELVSTAIRGNRSELTYKDLSRLQCQLDRYNFLADVLPQKITAREWIEKYKSEFDASCP
					

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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	40.2	Very low	62.1	Low	221 Å²	221	118.9 Å²	118.9	100%	1.089	60%	0.597	S	S	*	*				0	118.4	0	-66.4	-66	177.5	0	0	107.7	R3	M1-R3 PolarHBondContact O-N 3.18Å; M1-R3 VanDerWaalsContact O-N 3.14Å
2	P	50.4	Low	64.2	Low	103 Å²	103	112.8 Å²	112.8	67%	0.669	59%	0.586	S	S	*	*			trans	-64.7	116.5	170.6	28.2	-28.4	0	0	0	106.4	Y4	P2-Y4 HydrophobicContact CG-CE2 4.42Å; P2-Y4 PolarHBondContact O-N 3.02Å
3	R	46.2	Very low	66.3	Low	241 Å²	241	105.1 Å²	105.1	91%	0.909	55%	0.546	S	S	*	.			trans	-69.1	101.7	173	-69.1	-170.2	-132.7	-137.3	3.5	106.3	M1 S5	M1-R3 PolarHBondContact O-N 3.18Å; M1-R3 VanDerWaalsContact O-N 3.14Å; R3-S5 PolarHBondContact O-N 2.98Å
4	Y	52.8	Low	68.1	Low	119 Å²	119	112.6 Å²	112.6	47%	0.467	56%	0.564	S	S	.	*			trans	-55.7	130.8	158.9	-72.6	-83.4	0	0	0	106.5	P2 D8 P16	P2-Y4 HydrophobicContact CG-CE2 4.42Å; P2-Y4 PolarHBondContact O-N 3.02Å; Y4-D8 HydrophobicContact CD1-CB 4.32Å; Y4-P16 HydrophobicContact CE1-CG 4.15Å
5	S	62.6	Low	69.6	Low	75 Å²	75	108.3 Å²	108.3	52%	0.524	54%	0.543	S	S	.	.			trans	-62.7	143.8	178.2	-133.8	0	0	0	0	107.2	R3 T7 D8	R3-S5 PolarHBondContact O-N 2.98Å; S5-T7 PolarHBondContact O-N 3.04Å; S5-D8 PolarHBondContact N-OD2 3.31Å; S5-D8 WeakPolarHBondContact O-CB 3.42Å; S5-D8 PolarHBondContact O-N 2.76Å
6	T	66.7	Low	70.9	Confident	101 Å²	101	104.3 Å²	104.3	62%	0.62	53%	0.527	S	S	*	.	H	α-helix	trans	-47.2	-30.9	-179.9	-52.6	0	0	0	0	112.8	I10	T6-I10 HydrophobicContact CG2-CD1 3.75Å; T6-I10 HydrophobicContact CG2-CG1 4.48Å; T6-I10 WeakPolarHBondContact O-CB 3.46Å; T6-I10 WeakPolarHBondContact O-CD1 3.35Å; T6-I10 WeakPolarHBondContact O-CG1 3.25Å; T6-I10 PolarHBondContact O-N 3.41Å; T6-I10 VanDerWaalsContact O-N 3.15Å
7	T	66.9	Low	72.1	Confident	75 Å²	75	99.2 Å²	99.2	46%	0.46	51%	0.505	S	S	.	.	H	α-helix	trans	-64.1	-38.7	173.8	-43.3	0	0	0	0	114.5	S5 M11	S5-T7 PolarHBondContact O-N 3.04Å; T7-M11 HydrophobicContact CG2-CG 4.38Å; T7-M11 WeakPolarHBondContact O-CB 3.31Å; T7-M11 WeakPolarHBondContact O-CG 3.46Å; T7-M11 PolarHBondContact O-N 3.39Å
8	D	73.3	Confident	73.2	Confident	9 Å²	9	101.8 Å²	101.8	5%	0.048	51%	0.512	C	S	.	.	H	α-helix	trans	-66.2	-41.7	-178.8	-68.6	-31	0	0	0	110.9	Y4 S5 G12 L13 A17	Y4-D8 HydrophobicContact CD1-CB 4.32Å; S5-D8 PolarHBondContact N-OD2 3.31Å; S5-D8 WeakPolarHBondContact O-CB 3.42Å; S5-D8 PolarHBondContact O-N 2.76Å; D8-G12 WeakPolarHBondContact O-CA 3.35Å; D8-G12 PolarHBondContact O-N 3.36Å; D8-L13 PolarHBondContact O-N 3.26Å; D8-A17 WeakPolarHBondContact OD1-CB 2.97Å; D8-A17 PolarHBondContact OD1-N 3.35Å
9	E	70.8	Confident	74.2	Confident	143 Å²	143	104.3 Å²	104.3	67%	0.668	52%	0.515	S	S	*	.	H	α-helix	trans	-69.1	-44.8	177.1	-72.2	-179.1	171.6	0	0	111.6	M11 G12	E9-M11 VanDerWaalsContact C-N 3.3Å; E9-M11 PolarHBondContact O-N 2.69Å; E9-G12 PolarHBondContact O-N 3.38Å
10	I	74	Confident	75.3	Confident	131 Å²	131	99.6 Å²	99.6	67%	0.672	49%	0.492	S	S	*	.	H	α-helix	trans	-61.6	-39.8	178.5	-69.9	169.4	0	0	0	111.4	T6 G12	T6-I10 HydrophobicContact CG2-CD1 3.75Å; T6-I10 HydrophobicContact CG2-CG1 4.48Å; T6-I10 WeakPolarHBondContact O-CB 3.46Å; T6-I10 WeakPolarHBondContact O-CD1 3.35Å; T6-I10 WeakPolarHBondContact O-CG1 3.25Å; T6-I10 PolarHBondContact O-N 3.41Å; T6-I10 VanDerWaalsContact O-N 3.15Å; I10-G12 VanDerWaalsContact C-N 3.35Å
11	M	79.8	Confident	76.2	Confident	90 Å²	90	98.2 Å²	98.2	44%	0.443	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.7	-179.2	-63.8	-61.5	-137.2	0	0	113.4	T7 E9 L13 V39 K43	T7-M11 HydrophobicContact CG2-CG 4.38Å; T7-M11 WeakPolarHBondContact O-CB 3.31Å; T7-M11 WeakPolarHBondContact O-CG 3.46Å; T7-M11 PolarHBondContact O-N 3.39Å; E9-M11 VanDerWaalsContact C-N 3.3Å; E9-M11 PolarHBondContact O-N 2.69Å; M11-L13 VanDerWaalsContact C-N 3.29Å; M11-L13 HydrophobicContact CB-CD1 4.34Å; M11-L13 HydrophobicContact CB-CD2 4.42Å; M11-L13 HydrophobicContact CB-CG 3.92Å; M11-L13 PolarHBondContact O-N 2.85Å; M11-V39 HydrophobicContact CB-CG1 4.47Å; M11-V39 HydrophobicContact CE-CG1 4.13Å; M11-V39 HydrophobicContact CE-CG2 4.13Å; M11-V39 HydrophobicContact CG-CG1 4.43Å; M11-V39 HydrophobicContact CG-CG2 4.29Å; M11-K43 WeakPolarHBondContact O-CE 3.4Å
12	G	87.2	Confident	78.8	Confident	45 Å²	45	91.6 Å²	91.6	46%	0.464	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	39.9	-178.2	0	0	0	0	0	113.5	D8 E9 I10 K43	D8-G12 WeakPolarHBondContact O-CA 3.35Å; D8-G12 PolarHBondContact O-N 3.36Å; E9-G12 PolarHBondContact O-N 3.38Å; I10-G12 VanDerWaalsContact C-N 3.35Å; G12-K43 PolarHBondContact O-NZ 3.19Å
13	L	90.9	Very high	81	Confident	13 Å²	13	92.4 Å²	92.4	7%	0.068	45%	0.446	C	S	.	.			trans	-76.7	128.8	-179.1	-62.9	177.6	0	0	0	110.7	D8 M11 A17 V39 K43	D8-L13 PolarHBondContact O-N 3.26Å; M11-L13 VanDerWaalsContact C-N 3.29Å; M11-L13 HydrophobicContact CB-CD1 4.34Å; M11-L13 HydrophobicContact CB-CD2 4.42Å; M11-L13 HydrophobicContact CB-CG 3.92Å; M11-L13 PolarHBondContact O-N 2.85Å; L13-A17 HydrophobicContact CD1-CB 4.17Å; L13-V39 HydrophobicContact CD1-CG2 4.38Å; L13-V39 HydrophobicContact CD2-CG1 4.31Å; L13-K43 HydrophobicContact CD2-CD 4.01Å; L13-K43 HydrophobicContact CD2-CG 4.03Å
14	R	91.7	Very high	83.4	Confident	211 Å²	211	82.7 Å²	82.7	80%	0.796	41%	0.412	S	S	*	.	S	Bend	trans	-82.1	-28.3	171.4	-57.1	-167.8	-167.2	-145.3	5	111.6	E46	R14-E46 HydrophobicContact CB-CG 4.14Å; R14-E46 WeakPolarHBondContact CB-OE1 3.32Å; R14-E46 HydrophobicContact CG-CG 4.47Å; R14-E46 PolarHBondContact N-OE1 3.35Å
15	I	90.5	Very high	85.5	Confident	47 Å²	47	82.7 Å²	82.7	24%	0.241	41%	0.414	C	S	.	.	S	Bend	trans	-98.6	118.6	175	-54.7	173.7	0	0	0	107.9	A17 T20 T45 E46	I15-A17 PolarHBondContact O-N 2.87Å; I15-T20 WeakPolarHBondContact CG2-OG1 3.19Å; I15-T45 HydrophobicContact CD1-CG2 3.53Å; I15-E46 HydrophobicContact CD1-CG 4.17Å; I15-E46 HydrophobicContact CG1-CG 4.22Å; I15-E46 PolarHBondContact N-OE1 3.5Å
16	P	91.2	Very high	87	Confident	45 Å²	45	83.3 Å²	83.3	29%	0.292	42%	0.418	S	S	.	.			trans	-56.7	130.3	-178.7	-24.1	31.9	0	0	0	112	Y4 F18 R19 T20	Y4-P16 HydrophobicContact CE1-CG 4.15Å; P16-F18 PolarHBondContact O-N 3.21Å; P16-F18 VanDerWaalsContact O-N 3.11Å; P16-R19 HydrophobicContact CB-CG 4.25Å; P16-R19 HydrophobicContact CG-CG 4.44Å; P16-R19 WeakPolarHBondContact O-CB 3.34Å; P16-R19 PolarHBondContact O-N 2.84Å; P16-T20 PolarHBondContact O-N 3.5Å
17	A	90.6	Very high	88.3	Confident	18 Å²	18	81.2 Å²	81.2	15%	0.149	41%	0.408	C	S	.	.	H	α-helix	trans	-55.9	-35.9	-173.9	0	0	0	0	0	113.5	D8 L13 I15 R19 T20 R21 V38	D8-A17 WeakPolarHBondContact OD1-CB 2.97Å; D8-A17 PolarHBondContact OD1-N 3.35Å; L13-A17 HydrophobicContact CD1-CB 4.17Å; I15-A17 PolarHBondContact O-N 2.87Å; A17-R19 VanDerWaalsContact C-N 3.31Å; A17-R19 PolarHBondContact O-N 2.92Å; A17-T20 PolarHBondContact O-N 3.34Å; A17-R21 WeakPolarHBondContact O-CB 3.49Å; A17-R21 PolarHBondContact O-N 2.98Å; A17-V38 HydrophobicContact CB-CG1 3.69Å; A17-V38 VanDerWaalsContact O-CG1 3.27Å; A17-V38 WeakPolarHBondContact O-CG1 3.26Å
18	F	91.4	Very high	89.6	Confident	145 Å²	145	83.3 Å²	83.3	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-61.8	-37.2	176.3	173.4	-98.8	0	0	0	112.8	P16 R21 L22	P16-F18 PolarHBondContact O-N 3.21Å; P16-F18 VanDerWaalsContact O-N 3.11Å; F18-R21 PolarHBondContact O-N 3.28Å; F18-L22 WeakPolarHBondContact O-CB 3.44Å; F18-L22 PolarHBondContact O-N 3.24Å
19	R	93.8	Very high	90.6	Very high	150 Å²	150	90 Å²	90	57%	0.566	46%	0.459	S	S	*	.	H	α-helix	trans	-67.5	-45.5	178.1	-70.7	-73	-170.5	161	1.4	110.7	P16 A17 R21 L22 M23	P16-R19 HydrophobicContact CB-CG 4.25Å; P16-R19 HydrophobicContact CG-CG 4.44Å; P16-R19 WeakPolarHBondContact O-CB 3.34Å; P16-R19 PolarHBondContact O-N 2.84Å; A17-R19 VanDerWaalsContact C-N 3.31Å; A17-R19 PolarHBondContact O-N 2.92Å; R19-R21 VanDerWaalsContact C-N 3.34Å; R19-R21 PolarHBondContact O-N 3.46Å; R19-L22 WeakPolarHBondContact O-CB 3.48Å; R19-L22 PolarHBondContact O-N 2.97Å; R19-M23 WeakPolarHBondContact O-CG 3.49Å; R19-M23 PolarHBondContact O-N 3.45Å
20	T	94.6	Very high	91.7	Very high	9 Å²	9	85.6 Å²	85.6	6%	0.055	44%	0.441	C	S	.	.	H	α-helix	trans	-60.6	-45.7	175.9	-56.7	0	0	0	0	110.9	I15 P16 A17 L22 M23 M24 V38 L41 S42	I15-T20 WeakPolarHBondContact CG2-OG1 3.19Å; P16-T20 PolarHBondContact O-N 3.5Å; A17-T20 PolarHBondContact O-N 3.34Å; T20-L22 VanDerWaalsContact C-N 3.32Å; T20-L22 PolarHBondContact O-N 3.42Å; T20-M23 PolarHBondContact O-N 2.91Å; T20-M24 HydrophobicContact CG2-SD 4.32Å; T20-M24 WeakPolarHBondContact O-CG 3.24Å; T20-M24 PolarHBondContact O-N 3.2Å; T20-V38 HydrophobicContact CG2-CG1 4.15Å; T20-L41 HydrophobicContact CG2-CB 3.98Å; T20-L41 HydrophobicContact CG2-CD2 3.9Å; T20-L41 HydrophobicContact CG2-CG 4.01Å; T20-S42 WeakPolarHBondContact CB-OG 3.43Å; T20-S42 PolarHBondContact OG1-OG 3.25Å
21	R	94.9	Very high	92.5	Very high	71 Å²	71	86.7 Å²	86.7	27%	0.268	45%	0.448	S	S	.	.	H	α-helix	trans	-59.2	-41.5	176.1	-174	179.7	-61.2	-75.9	-0.4	112.7	A17 F18 R19 M24 K25 V33 V38	A17-R21 WeakPolarHBondContact O-CB 3.49Å; A17-R21 PolarHBondContact O-N 2.98Å; F18-R21 PolarHBondContact O-N 3.28Å; R19-R21 VanDerWaalsContact C-N 3.34Å; R19-R21 PolarHBondContact O-N 3.46Å; R21-M24 PolarHBondContact O-N 2.92Å; R21-K25 PolarHBondContact O-N 3.19Å; R21-V33 HydrophobicContact CG-CB 4.45Å; R21-V33 HydrophobicContact CG-CG1 4.23Å; R21-V33 PolarHBondContact NH1-O 3.38Å; R21-V38 HydrophobicContact CB-CG2 3.89Å; R21-V38 HydrophobicContact CG-CG2 4.3Å
22	L	95.3	Very high	93.2	Very high	83 Å²	83	87.8 Å²	87.8	44%	0.435	46%	0.464	S	S	.	.	H	α-helix	trans	-62.2	-44	177.5	-178.3	66	0	0	0	111.3	F18 R19 T20 M24 K25 S26	F18-L22 WeakPolarHBondContact O-CB 3.44Å; F18-L22 PolarHBondContact O-N 3.24Å; R19-L22 WeakPolarHBondContact O-CB 3.48Å; R19-L22 PolarHBondContact O-N 2.97Å; T20-L22 VanDerWaalsContact C-N 3.32Å; T20-L22 PolarHBondContact O-N 3.42Å; L22-M24 VanDerWaalsContact C-N 3.35Å; L22-K25 PolarHBondContact O-N 3.15Å; L22-S26 PolarHBondContact O-N 2.74Å
23	M	96	Very high	93.5	Very high	119 Å²	119	86.6 Å²	86.6	59%	0.586	45%	0.447	S	S	*	.	H	α-helix	trans	-66.3	-35.7	177	-65.5	-61.4	167.4	0	0	112.4	R19 T20 S26	R19-M23 WeakPolarHBondContact O-CG 3.49Å; R19-M23 PolarHBondContact O-N 3.45Å; T20-M23 PolarHBondContact O-N 2.91Å; M23-S26 PolarHBondContact O-N 3.31Å; M23-S26 PolarHBondContact O-OG 3.43Å
24	M	96.6	Very high	93.7	Very high	38 Å²	38	88.7 Å²	88.7	19%	0.187	46%	0.463	C	S	.	.	H	α-helix	trans	-63.6	-43.8	173.8	-66.9	175.7	78	0	0	111.2	T20 R21 L22 S26 S27 V30 V33 V38 L41	T20-M24 HydrophobicContact CG2-SD 4.32Å; T20-M24 WeakPolarHBondContact O-CG 3.24Å; T20-M24 PolarHBondContact O-N 3.2Å; R21-M24 PolarHBondContact O-N 2.92Å; L22-M24 VanDerWaalsContact C-N 3.35Å; M24-S26 VanDerWaalsContact C-N 3.29Å; M24-S26 PolarHBondContact O-N 3.22Å; M24-S27 PolarHBondContact O-N 2.93Å; M24-V30 WeakPolarHBondContact O-CB 3.43Å; M24-V33 HydrophobicContact CB-CG1 4.27Å; M24-V33 HydrophobicContact CB-CG2 3.8Å; M24-V33 HydrophobicContact CE-CG1 3.65Å; M24-V33 HydrophobicContact CE-CG2 4.36Å; M24-V33 HydrophobicContact SD-CG1 3.49Å; M24-V33 WeakPolarHBondContact SD-CG1 3.26Å; M24-V38 HydrophobicContact SD-CG2 3.91Å; M24-L41 HydrophobicContact CE-CD2 4.23Å; M24-L41 HydrophobicContact CG-CD2 3.37Å; M24-L41 HydrophobicContact SD-CB 4.44Å; M24-L41 HydrophobicContact SD-CD2 3.63Å
25	K	95.9	Very high	93.7	Very high	118 Å²	118	82.4 Å²	82.4	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-74	-11.4	179.6	-74.4	-165.4	168.1	-158.2	0	115	R21 L22 S27 V33	R21-K25 PolarHBondContact O-N 3.19Å; L22-K25 PolarHBondContact O-N 3.15Å; K25-S27 PolarHBondContact O-N 2.82Å; K25-V33 HydrophobicContact CG-CG2 3.91Å
26	S	95.8	Very high	93.9	Very high	88 Å²	88	85.7 Å²	85.7	62%	0.615	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.2	173.1	63.7	0	0	0	0	112.7	L22 M23 M24	L22-S26 PolarHBondContact O-N 2.74Å; M23-S26 PolarHBondContact O-N 3.31Å; M23-S26 PolarHBondContact O-OG 3.43Å; M24-S26 VanDerWaalsContact C-N 3.29Å; M24-S26 PolarHBondContact O-N 3.22Å
27	S	94	Very high	94	Very high	57 Å²	57	86 Å²	86	40%	0.399	47%	0.473	S	S	.	.	S	Bend	trans	-78.7	129.2	173.1	-56.9	0	0	0	0	109.3	M24 K25 D29 V30	M24-S27 PolarHBondContact O-N 2.93Å; K25-S27 PolarHBondContact O-N 2.82Å; S27-D29 PolarHBondContact O-N 3.05Å; S27-V30 PolarHBondContact O-N 3.27Å
28	P	94.3	Very high	94.2	Very high	120 Å²	120	85.2 Å²	85.2	78%	0.779	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-26	-173.7	24.9	-33.9	0	0	0	113.3
29	D	93.9	Very high	94.4	Very high	149 Å²	149	79.5 Å²	79.5	80%	0.797	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	10.8	-175.9	-50.9	-51.4	0	0	0	113.7	S27	S27-D29 PolarHBondContact O-N 3.05Å
30	V	94.1	Very high	94.4	Very high	51 Å²	51	76.4 Å²	76.4	31%	0.309	44%	0.444	S	S	.	.			trans	-112	97.1	-175.4	179.3	0	0	0	0	111.2	M24 S27 V33	M24-V30 WeakPolarHBondContact O-CB 3.43Å; S27-V30 PolarHBondContact O-N 3.27Å; V30-V33 HydrophobicContact CG1-CG2 3.52Å
31	D	91	Very high	94.5	Very high	153 Å²	153	79.4 Å²	79.4	82%	0.818	46%	0.459	S	S	*	.			trans	-75.4	-51.8	177.8	-71.2	-32.7	0	0	0	112.8
32	C	93	Very high	94.5	Very high	114 Å²	114	76 Å²	76	77%	0.77	45%	0.446	S	S	*	.			trans	-127	145.2	-173.9	69.7	0	0	0	0	111.5
33	V	95.1	Very high	94.5	Very high	19 Å²	19	75.3 Å²	75.3	12%	0.115	44%	0.44	C	S	.	.			trans	-131.3	116.2	-178.2	176.5	0	0	0	0	107.7	R21 M24 K25 V30 V38	R21-V33 HydrophobicContact CG-CB 4.45Å; R21-V33 HydrophobicContact CG-CG1 4.23Å; R21-V33 PolarHBondContact NH1-O 3.38Å; M24-V33 HydrophobicContact CB-CG1 4.27Å; M24-V33 HydrophobicContact CB-CG2 3.8Å; M24-V33 HydrophobicContact CE-CG1 3.65Å; M24-V33 HydrophobicContact CE-CG2 4.36Å; M24-V33 HydrophobicContact SD-CG1 3.49Å; M24-V33 WeakPolarHBondContact SD-CG1 3.26Å; K25-V33 HydrophobicContact CG-CG2 3.91Å; V30-V33 HydrophobicContact CG1-CG2 3.52Å; V33-V38 HydrophobicContact CG1-CG2 3.43Å; V33-V38 VanDerWaalsContact CG1-CG2 3.43Å
34	S	94.3	Very high	94.5	Very high	57 Å²	57	71.7 Å²	71.7	40%	0.399	43%	0.429	S	S	.	.			trans	-73.6	161.7	178	84.5	0	0	0	0	111.8	D36 S37 V38	S34-D36 PolarHBondContact OG-N 3Å; S34-S37 WeakPolarHBondContact OG-CB 3.43Å; S34-S37 PolarHBondContact OG-N 2.89Å; S34-S37 PolarHBondContact OG-OG 2.89Å; S34-V38 WeakPolarHBondContact O-CG2 3.33Å; S34-V38 PolarHBondContact O-N 3.22Å
35	S	92.1	Very high	94.5	Very high	80 Å²	80	72.3 Å²	72.3	56%	0.559	44%	0.435	S	S	*	.	H	α-helix	trans	-60.8	-45.2	173.2	-43.1	0	0	0	0	111.7	V38 V39	S35-V38 WeakPolarHBondContact O-CB 3.31Å; S35-V38 PolarHBondContact O-N 3.31Å; S35-V39 PolarHBondContact O-N 3.09Å; S35-V39 VanDerWaalsContact O-N 3.14Å
36	D	93.1	Very high	94.5	Very high	116 Å²	116	68.2 Å²	68.2	62%	0.62	42%	0.418	S	S	*	.	H	α-helix	trans	-68.3	-39.7	-175.1	-60.7	-14.9	0	0	0	110.9	S34 V38 V39 C40	S34-D36 PolarHBondContact OG-N 3Å; D36-V38 PolarHBondContact O-N 3.01Å; D36-V39 PolarHBondContact O-N 3.07Å; D36-C40 WeakPolarHBondContact O-CB 3.45Å; D36-C40 PolarHBondContact O-N 3.4Å; D36-C40 PolarHBondContact O-SG 3.49Å; D36-C40 VanDerWaalsContact O-SG 3.35Å
37	S	94.9	Very high	94.5	Very high	52 Å²	52	70 Å²	70	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-59.3	-36.9	174.4	-54.3	0	0	0	0	112	S34 L41	S34-S37 WeakPolarHBondContact OG-CB 3.43Å; S34-S37 PolarHBondContact OG-N 2.89Å; S34-S37 PolarHBondContact OG-OG 2.89Å; S37-L41 VanDerWaalsContact O-CB 3.29Å; S37-L41 WeakPolarHBondContact O-CB 3.15Å; S37-L41 PolarHBondContact O-N 3.13Å
38	V	95	Very high	94.6	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.006	41%	0.412	C	S	.	.	H	α-helix	trans	-67	-45	176.5	170.8	0	0	0	0	111.1	A17 T20 R21 M24 V33 S34 S35 D36 L41 S42	A17-V38 HydrophobicContact CB-CG1 3.69Å; A17-V38 VanDerWaalsContact O-CG1 3.27Å; A17-V38 WeakPolarHBondContact O-CG1 3.26Å; T20-V38 HydrophobicContact CG2-CG1 4.15Å; R21-V38 HydrophobicContact CB-CG2 3.89Å; R21-V38 HydrophobicContact CG-CG2 4.3Å; M24-V38 HydrophobicContact SD-CG2 3.91Å; V33-V38 HydrophobicContact CG1-CG2 3.43Å; V33-V38 VanDerWaalsContact CG1-CG2 3.43Å; S34-V38 WeakPolarHBondContact O-CG2 3.33Å; S34-V38 PolarHBondContact O-N 3.22Å; S35-V38 WeakPolarHBondContact O-CB 3.31Å; S35-V38 PolarHBondContact O-N 3.31Å; D36-V38 PolarHBondContact O-N 3.01Å; V38-L41 PolarHBondContact O-N 2.97Å; V38-S42 WeakPolarHBondContact O-CB 3.48Å; V38-S42 PolarHBondContact O-N 2.99Å; V38-S42 PolarHBondContact O-OG 3.18Å; V38-S42 VanDerWaalsContact O-OG 3.12Å
39	V	94	Very high	94.7	Very high	24 Å²	24	68.3 Å²	68.3	15%	0.145	40%	0.397	C	S	.	.	H	α-helix	trans	-61.8	-48.5	177.4	175.6	0	0	0	0	110.3	M11 L13 S35 D36 L41 S42 K43	M11-V39 HydrophobicContact CB-CG1 4.47Å; M11-V39 HydrophobicContact CE-CG1 4.13Å; M11-V39 HydrophobicContact CE-CG2 4.13Å; M11-V39 HydrophobicContact CG-CG1 4.43Å; M11-V39 HydrophobicContact CG-CG2 4.29Å; L13-V39 HydrophobicContact CD1-CG2 4.38Å; L13-V39 HydrophobicContact CD2-CG1 4.31Å; S35-V39 PolarHBondContact O-N 3.09Å; S35-V39 VanDerWaalsContact O-N 3.14Å; D36-V39 PolarHBondContact O-N 3.07Å; V39-L41 PolarHBondContact O-N 3.48Å; V39-S42 PolarHBondContact O-N 3.07Å; V39-K43 PolarHBondContact O-N 2.76Å
40	C	95.3	Very high	94.8	Very high	86 Å²	86	65 Å²	65	58%	0.581	39%	0.386	S	S	*	.	H	α-helix	trans	-59.1	-48.2	178.7	-72.5	0	0	0	0	111.8	D36 K43 A44	D36-C40 WeakPolarHBondContact O-CB 3.45Å; D36-C40 PolarHBondContact O-N 3.4Å; D36-C40 PolarHBondContact O-SG 3.49Å; D36-C40 VanDerWaalsContact O-SG 3.35Å; C40-K43 PolarHBondContact O-N 2.99Å; C40-A44 VanDerWaalsContact O-CB 3.32Å; C40-A44 WeakPolarHBondContact O-CB 3.38Å; C40-A44 PolarHBondContact O-N 3.27Å
41	L	96.1	Very high	94.8	Very high	71 Å²	71	65.7 Å²	65.7	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-67.2	-39.4	-179.8	-174.9	62.5	0	0	0	111.9	T20 M24 S37 V38 V39 K43 A44 T45	T20-L41 HydrophobicContact CG2-CB 3.98Å; T20-L41 HydrophobicContact CG2-CD2 3.9Å; T20-L41 HydrophobicContact CG2-CG 4.01Å; M24-L41 HydrophobicContact CE-CD2 4.23Å; M24-L41 HydrophobicContact CG-CD2 3.37Å; M24-L41 HydrophobicContact SD-CB 4.44Å; M24-L41 HydrophobicContact SD-CD2 3.63Å; S37-L41 VanDerWaalsContact O-CB 3.29Å; S37-L41 WeakPolarHBondContact O-CB 3.15Å; S37-L41 PolarHBondContact O-N 3.13Å; V38-L41 PolarHBondContact O-N 2.97Å; V39-L41 PolarHBondContact O-N 3.48Å; L41-K43 PolarHBondContact O-N 2.93Å; L41-A44 PolarHBondContact O-N 3.18Å; L41-T45 WeakPolarHBondContact O-CB 3.49Å; L41-T45 PolarHBondContact O-N 2.97Å; L41-T45 PolarHBondContact O-OG1 3.39Å
42	S	95	Very high	95	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-58.3	-47.9	173.9	-74.2	0	0	0	0	111.1	T20 V38 V39 T45 E46	T20-S42 WeakPolarHBondContact CB-OG 3.43Å; T20-S42 PolarHBondContact OG1-OG 3.25Å; V38-S42 WeakPolarHBondContact O-CB 3.48Å; V38-S42 PolarHBondContact O-N 2.99Å; V38-S42 PolarHBondContact O-OG 3.18Å; V38-S42 VanDerWaalsContact O-OG 3.12Å; V39-S42 PolarHBondContact O-N 3.07Å; S42-T45 PolarHBondContact O-N 2.93Å; S42-E46 WeakPolarHBondContact O-CG 3.28Å; S42-E46 PolarHBondContact O-N 3.22Å
43	K	94.7	Very high	95.1	Very high	68 Å²	68	56.7 Å²	56.7	30%	0.296	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-41.2	177.7	-72.1	-54.9	-170.8	-170.7	0	112.9	M11 G12 L13 V39 C40 L41 T45 E46 M47	M11-K43 WeakPolarHBondContact O-CE 3.4Å; G12-K43 PolarHBondContact O-NZ 3.19Å; L13-K43 HydrophobicContact CD2-CD 4.01Å; L13-K43 HydrophobicContact CD2-CG 4.03Å; V39-K43 PolarHBondContact O-N 2.76Å; C40-K43 PolarHBondContact O-N 2.99Å; L41-K43 PolarHBondContact O-N 2.93Å; K43-T45 VanDerWaalsContact C-N 3.28Å; K43-T45 PolarHBondContact O-N 3.22Å; K43-E46 WeakPolarHBondContact CD-OE2 3.24Å; K43-E46 IonicContact NZ-OE1 3.86Å; K43-E46 IonicContact NZ-OE2 2.92Å; K43-E46 PolarHBondContact NZ-OE2 3.37Å; K43-E46 PolarHBondContact O-N 3.36Å; K43-M47 WeakPolarHBondContact O-CE 3.13Å; K43-M47 WeakPolarHBondContact O-CG 3.37Å; K43-M47 PolarHBondContact O-N 3.41Å
44	A	96.4	Very high	94.9	Very high	44 Å²	44	59.5 Å²	59.5	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-59.6	-41.1	174.1	0	0	0	0	0	111.6	C40 L41 M47 F48	C40-A44 VanDerWaalsContact O-CB 3.32Å; C40-A44 WeakPolarHBondContact O-CB 3.38Å; C40-A44 PolarHBondContact O-N 3.27Å; L41-A44 PolarHBondContact O-N 3.18Å; A44-M47 PolarHBondContact O-N 2.7Å; A44-F48 VanDerWaalsContact O-CB 3.25Å; A44-F48 WeakPolarHBondContact O-CB 3.48Å; A44-F48 PolarHBondContact O-N 3.4Å
45	T	96.5	Very high	94.9	Very high	50 Å²	50	58.9 Å²	58.9	31%	0.307	35%	0.346	S	S	.	.	H	α-helix	trans	-67.5	-40.7	177.9	-54	0	0	0	0	111.6	I15 L41 S42 K43 M47 F48 V49	I15-T45 HydrophobicContact CD1-CG2 3.53Å; L41-T45 WeakPolarHBondContact O-CB 3.49Å; L41-T45 PolarHBondContact O-N 2.97Å; L41-T45 PolarHBondContact O-OG1 3.39Å; S42-T45 PolarHBondContact O-N 2.93Å; K43-T45 VanDerWaalsContact C-N 3.28Å; K43-T45 PolarHBondContact O-N 3.22Å; T45-M47 VanDerWaalsContact C-N 3.34Å; T45-M47 PolarHBondContact O-N 2.7Å; T45-F48 PolarHBondContact O-N 2.56Å; T45-V49 WeakPolarHBondContact O-CG2 3.49Å; T45-V49 PolarHBondContact O-N 2.81Å
46	E	95.4	Very high	95	Very high	33 Å²	33	55.1 Å²	55.1	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-46.6	173.3	-72.9	169.6	-156.2	0	0	111.5	R14 I15 S42 K43 S50	R14-E46 HydrophobicContact CB-CG 4.14Å; R14-E46 WeakPolarHBondContact CB-OE1 3.32Å; R14-E46 HydrophobicContact CG-CG 4.47Å; R14-E46 PolarHBondContact N-OE1 3.35Å; I15-E46 HydrophobicContact CD1-CG 4.17Å; I15-E46 HydrophobicContact CG1-CG 4.22Å; I15-E46 PolarHBondContact N-OE1 3.5Å; S42-E46 WeakPolarHBondContact O-CG 3.28Å; S42-E46 PolarHBondContact O-N 3.22Å; K43-E46 WeakPolarHBondContact CD-OE2 3.24Å; K43-E46 IonicContact NZ-OE1 3.86Å; K43-E46 IonicContact NZ-OE2 2.92Å; K43-E46 PolarHBondContact NZ-OE2 3.37Å; K43-E46 PolarHBondContact O-N 3.36Å; E46-S50 PolarHBondContact O-N 3.39Å
47	M	96.5	Very high	94.8	Very high	126 Å²	126	51.3 Å²	51.3	62%	0.621	30%	0.299	S	S	*	.	H	α-helix	trans	-66.4	-42.8	177.6	-69.2	-176.1	-69.7	0	0	111.8	K43 A44 T45 V49 S50 E51	K43-M47 WeakPolarHBondContact O-CE 3.13Å; K43-M47 WeakPolarHBondContact O-CG 3.37Å; K43-M47 PolarHBondContact O-N 3.41Å; A44-M47 PolarHBondContact O-N 2.7Å; T45-M47 VanDerWaalsContact C-N 3.34Å; T45-M47 PolarHBondContact O-N 2.7Å; M47-V49 PolarHBondContact O-N 3.07Å; M47-S50 PolarHBondContact O-N 3.03Å; M47-E51 WeakPolarHBondContact O-CB 3.23Å; M47-E51 PolarHBondContact O-N 3.38Å
48	F	97.2	Very high	94.1	Very high	64 Å²	64	55.5 Å²	55.5	28%	0.281	31%	0.307	S	S	.	.	H	α-helix	trans	-58.5	-46.5	177.7	170.8	-103	0	0	0	111.9	A44 T45 S50 E51 L52 Y79 F81 L82	A44-F48 VanDerWaalsContact O-CB 3.25Å; A44-F48 WeakPolarHBondContact O-CB 3.48Å; A44-F48 PolarHBondContact O-N 3.4Å; T45-F48 PolarHBondContact O-N 2.56Å; F48-S50 VanDerWaalsContact C-N 3.34Å; F48-S50 PolarHBondContact O-N 3.11Å; F48-E51 PolarHBondContact O-N 3.47Å; F48-L52 HydrophobicContact CE1-CD2 4.19Å; F48-L52 HydrophobicContact CZ-CD1 4.49Å; F48-L52 HydrophobicContact CZ-CD2 4.19Å; F48-L52 VanDerWaalsContact O-CB 3.23Å; F48-L52 WeakPolarHBondContact O-CB 3.4Å; F48-L52 PolarHBondContact O-N 3.34Å; F48-Y79 HydrophobicContact CE2-CD1 4.05Å; F48-Y79 AromaticContact CE2-CE1 3.87Å; F48-Y79 HydrophobicContact CE2-CE1 3.87Å; F48-Y79 HydrophobicContact CZ-CD1 4.48Å; F48-F81 HydrophobicContact CE1-CZ 4.38Å; F48-F81 HydrophobicContact CE2-CE1 4.18Å; F48-F81 AromaticContact CE2-CZ 3.77Å; F48-F81 HydrophobicContact CE2-CZ 3.77Å; F48-F81 HydrophobicContact CZ-CE1 4.3Å; F48-F81 HydrophobicContact CZ-CE2 4.48Å; F48-F81 AromaticContact CZ-CZ 3.55Å; F48-F81 HydrophobicContact CZ-CZ 3.55Å; F48-L82 HydrophobicContact CZ-CD1 4.19Å
49	V	95.9	Very high	93.4	Very high	76 Å²	76	58.9 Å²	58.9	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-42.1	178.2	172.8	0	0	0	0	111.1	T45 M47 E51 L52 V53	T45-V49 WeakPolarHBondContact O-CG2 3.49Å; T45-V49 PolarHBondContact O-N 2.81Å; M47-V49 PolarHBondContact O-N 3.07Å; V49-E51 VanDerWaalsContact C-N 3.34Å; V49-E51 PolarHBondContact O-N 3.41Å; V49-L52 PolarHBondContact O-N 3.06Å; V49-V53 VanDerWaalsContact O-CG2 3.28Å; V49-V53 WeakPolarHBondContact O-CG2 3.17Å; V49-V53 PolarHBondContact O-N 2.96Å
50	S	94.4	Very high	92.7	Very high	81 Å²	81	66.3 Å²	66.3	57%	0.566	38%	0.381	S	S	*	.	H	α-helix	trans	-62.6	-41.9	177.7	-170.6	0	0	0	0	112.2	E46 M47 F48 S54	E46-S50 PolarHBondContact O-N 3.39Å; M47-S50 PolarHBondContact O-N 3.03Å; F48-S50 VanDerWaalsContact C-N 3.34Å; F48-S50 PolarHBondContact O-N 3.11Å; S50-S54 WeakPolarHBondContact O-CB 3.38Å; S50-S54 PolarHBondContact O-N 2.64Å; S50-S54 PolarHBondContact O-OG 3.07Å
51	E	95.3	Very high	92.4	Very high	64 Å²	64	67.7 Å²	67.7	30%	0.299	37%	0.374	S	S	.	.	H	α-helix	trans	-71	-40	179.5	-174.9	-86.5	171.7	0	0	112	M47 F48 V49 V53 S54 T55 R78 Y79	M47-E51 WeakPolarHBondContact O-CB 3.23Å; M47-E51 PolarHBondContact O-N 3.38Å; F48-E51 PolarHBondContact O-N 3.47Å; V49-E51 VanDerWaalsContact C-N 3.34Å; V49-E51 PolarHBondContact O-N 3.41Å; E51-V53 VanDerWaalsContact C-N 3.35Å; E51-V53 PolarHBondContact O-N 3.46Å; E51-S54 PolarHBondContact O-N 3.22Å; E51-S54 PolarHBondContact O-OG 2.71Å; E51-S54 VanDerWaalsContact O-OG 3.1Å; E51-T55 VanDerWaalsContact O-CB 3.24Å; E51-T55 WeakPolarHBondContact O-CB 3.42Å; E51-T55 PolarHBondContact O-N 2.92Å; E51-T55 PolarHBondContact O-OG1 3.1Å; E51-T55 PolarHBondContact OE1-OG1 3.45Å; E51-R78 IonicContact OE1-CZ 2.76Å; E51-R78 IonicContact OE1-NE 3.36Å; E51-R78 PolarHBondContact OE1-NE 2.86Å; E51-R78 IonicContact OE1-NH2 2.7Å; E51-R78 PolarHBondContact OE1-NH2 3.32Å; E51-Y79 PolarHBondContact OE1-OH 2.83Å; E51-Y79 PolarHBondContact OE2-OH 2.84Å
52	L	95.3	Very high	92	Very high	24 Å²	24	70.2 Å²	70.2	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-59.8	-47.2	176	-178.6	69.4	0	0	0	110.6	F48 V49 A56 L69 L72 Y79 L82	F48-L52 HydrophobicContact CE1-CD2 4.19Å; F48-L52 HydrophobicContact CZ-CD1 4.49Å; F48-L52 HydrophobicContact CZ-CD2 4.19Å; F48-L52 VanDerWaalsContact O-CB 3.23Å; F48-L52 WeakPolarHBondContact O-CB 3.4Å; F48-L52 PolarHBondContact O-N 3.34Å; V49-L52 PolarHBondContact O-N 3.06Å; L52-A56 WeakPolarHBondContact O-CB 3.25Å; L52-A56 PolarHBondContact O-N 3.47Å; L52-L69 HydrophobicContact CD1-CD2 4.33Å; L52-L69 HydrophobicContact CD2-CD2 4.28Å; L52-L69 HydrophobicContact CG-CD2 4.05Å; L52-L72 HydrophobicContact CD1-CD2 3.77Å; L52-Y79 HydrophobicContact CD1-CD1 3.88Å; L52-Y79 HydrophobicContact CD1-CE1 3.62Å; L52-L82 HydrophobicContact CD1-CD1 4.35Å
53	V	94.1	Very high	91.9	Very high	54 Å²	54	76.4 Å²	76.4	33%	0.327	43%	0.427	S	S	.	.	H	α-helix	trans	-66.9	-47	180	174.6	0	0	0	0	111.2	V49 E51 T55 A56 I57 L64	V49-V53 VanDerWaalsContact O-CG2 3.28Å; V49-V53 WeakPolarHBondContact O-CG2 3.17Å; V49-V53 PolarHBondContact O-N 2.96Å; E51-V53 VanDerWaalsContact C-N 3.35Å; E51-V53 PolarHBondContact O-N 3.46Å; V53-T55 VanDerWaalsContact C-N 3.29Å; V53-T55 PolarHBondContact O-N 3.39Å; V53-A56 PolarHBondContact O-N 3.21Å; V53-I57 HydrophobicContact CG1-CD1 3.87Å; V53-I57 WeakPolarHBondContact O-CG1 3.41Å; V53-I57 PolarHBondContact O-N 3.06Å; V53-I57 VanDerWaalsContact O-N 3.12Å; V53-L64 HydrophobicContact CG2-CD2 4.19Å
54	S	92.5	Very high	91.8	Very high	79 Å²	79	76.2 Å²	76.2	55%	0.552	43%	0.428	S	S	*	.	H	α-helix	trans	-65.5	-32.9	-179.1	68.1	0	0	0	0	112.8	S50 E51	S50-S54 WeakPolarHBondContact O-CB 3.38Å; S50-S54 PolarHBondContact O-N 2.64Å; S50-S54 PolarHBondContact O-OG 3.07Å; E51-S54 PolarHBondContact O-N 3.22Å; E51-S54 PolarHBondContact O-OG 2.71Å; E51-S54 VanDerWaalsContact O-OG 3.1Å
55	T	93.3	Very high	91.7	Very high	43 Å²	43	76.2 Å²	76.2	26%	0.264	42%	0.424	S	S	.	.	H	α-helix	trans	-79.7	-34.5	178.3	-50.2	0	0	0	0	112	E51 V53 L72 L76	E51-T55 VanDerWaalsContact O-CB 3.24Å; E51-T55 WeakPolarHBondContact O-CB 3.42Å; E51-T55 PolarHBondContact O-N 2.92Å; E51-T55 PolarHBondContact O-OG1 3.1Å; E51-T55 PolarHBondContact OE1-OG1 3.45Å; V53-T55 VanDerWaalsContact C-N 3.29Å; V53-T55 PolarHBondContact O-N 3.39Å; T55-L72 HydrophobicContact CG2-CD1 3.58Å; T55-L72 HydrophobicContact CG2-CD2 4.33Å; T55-L76 HydrophobicContact CG2-CD1 4.29Å
56	A	93.7	Very high	91.6	Very high	2 Å²	2	77.8 Å²	77.8	2%	0.017	43%	0.425	C	S	.	.	H	α-helix	trans	-70.3	-41.6	179.8	0	0	0	0	0	112.2	L52 V53 R58 L64 D68 L69 L72	L52-A56 WeakPolarHBondContact O-CB 3.25Å; L52-A56 PolarHBondContact O-N 3.47Å; V53-A56 PolarHBondContact O-N 3.21Å; A56-R58 PolarHBondContact O-N 3.45Å; A56-R58 VanDerWaalsContact O-N 3.11Å; A56-L64 HydrophobicContact CB-CD1 3.55Å; A56-D68 HydrophobicContact CB-CB 4.38Å; A56-L69 HydrophobicContact CB-CD2 3.84Å; A56-L72 HydrophobicContact CB-CD2 3.88Å
57	I	90.6	Very high	91.5	Very high	36 Å²	36	84 Å²	84	19%	0.185	45%	0.451	C	S	.	.	S	Bend	trans	-74.7	103	178.7	-61.9	177.9	0	0	0	108.9	V53 R61 L64	V53-I57 HydrophobicContact CG1-CD1 3.87Å; V53-I57 WeakPolarHBondContact O-CG1 3.41Å; V53-I57 PolarHBondContact O-N 3.06Å; V53-I57 VanDerWaalsContact O-N 3.12Å; I57-R61 HydrophobicContact CG2-CB 4.15Å; I57-R61 WeakPolarHBondContact CG2-O 3.05Å; I57-L64 HydrophobicContact CD1-CB 4.14Å; I57-L64 HydrophobicContact CG1-CB 4.16Å; I57-L64 HydrophobicContact CG1-CD1 3.87Å
58	R	79.6	Confident	91.4	Very high	140 Å²	140	78.5 Å²	78.5	53%	0.528	42%	0.424	S	S	.	.			trans	-84	130.8	173.8	-65.7	-167.5	179.2	-150.6	-0.9	111.1	A56	A56-R58 PolarHBondContact O-N 3.45Å; A56-R58 VanDerWaalsContact O-N 3.11Å
59	G	80.1	Confident	91.3	Very high	71 Å²	71	76.9 Å²	76.9	73%	0.732	42%	0.418	S	S	*	.	S	Bend	trans	74.4	-154.5	175.3	0	0	0	0	0	112.9	R61	G59-R61 VanDerWaalsContact C-N 3.25Å; G59-R61 PolarHBondContact O-N 3.12Å
60	N	79.2	Confident	91.2	Very high	181 Å²	181	73.6 Å²	73.6	97%	0.968	40%	0.399	S	S	*	.	S	Bend	trans	-89	25.6	-172.6	-122.3	29.6	0	0	0	113.9
61	R	88.5	Confident	91.1	Very high	114 Å²	114	73.5 Å²	73.5	43%	0.43	39%	0.386	S	S	.	.			trans	-77.5	142.1	177.8	-68.4	-178.3	65.9	-143.1	-4.6	109.5	I57 G59 D68	I57-R61 HydrophobicContact CG2-CB 4.15Å; I57-R61 WeakPolarHBondContact CG2-O 3.05Å; G59-R61 VanDerWaalsContact C-N 3.25Å; G59-R61 PolarHBondContact O-N 3.12Å; R61-D68 IonicContact NH1-OD1 3.37Å; R61-D68 IonicContact NH1-OD2 3.07Å; R61-D68 PolarHBondContact NH1-OD2 3.25Å; R61-D68 VanDerWaalsContact NH1-OD2 3.07Å
62	S	87.2	Confident	91.1	Very high	125 Å²	125	70.9 Å²	70.9	87%	0.874	37%	0.374	S	S	*	.			trans	-96.8	-9.3	175.5	52.8	0	0	0	0	113.5
63	E	92.8	Very high	91.1	Very high	130 Å²	130	70.6 Å²	70.6	61%	0.607	37%	0.373	S	S	*	.			trans	-111.3	127.7	-174.9	-170.7	-179.4	-163.4	0	0	111.4
64	L	94.1	Very high	91	Very high	63 Å²	63	71.7 Å²	71.7	33%	0.33	38%	0.381	S	S	.	.			trans	-89.1	126.2	172.6	179.9	67.6	0	0	0	109.7	V53 A56 I57 D68 L69	V53-L64 HydrophobicContact CG2-CD2 4.19Å; A56-L64 HydrophobicContact CB-CD1 3.55Å; I57-L64 HydrophobicContact CD1-CB 4.14Å; I57-L64 HydrophobicContact CG1-CB 4.16Å; I57-L64 HydrophobicContact CG1-CD1 3.87Å; L64-D68 HydrophobicContact CD1-CB 4.15Å; L64-L69 HydrophobicContact CD1-CD2 4.07Å; L64-L69 HydrophobicContact CD1-CG 4.07Å; L64-L69 HydrophobicContact CD2-CD1 4.17Å; L64-L69 HydrophobicContact CD2-CD2 4.23Å; L64-L69 HydrophobicContact CD2-CG 4.3Å; L64-L69 HydrophobicContact CG-CD1 4.49Å; L64-L69 HydrophobicContact CG-CG 4.32Å
65	T	94.1	Very high	91	Very high	45 Å²	45	72.7 Å²	72.7	28%	0.276	38%	0.378	S	S	.	.			trans	-108.6	157.2	174.3	72.8	0	0	0	0	111.4	K67 D68 L69	T65-K67 PolarHBondContact O-N 3.05Å; T65-D68 WeakPolarHBondContact CB-OD2 3.38Å; T65-D68 PolarHBondContact N-OD2 2.69Å; T65-D68 WeakPolarHBondContact O-CB 3.48Å; T65-D68 PolarHBondContact O-N 3.37Å; T65-D68 VanDerWaalsContact OG1-CG 3.31Å; T65-D68 PolarHBondContact OG1-N 2.94Å; T65-D68 PolarHBondContact OG1-OD2 3.36Å; T65-L69 PolarHBondContact O-N 3.05Å
66	Y	94.4	Very high	91	Very high	82 Å²	82	73.5 Å²	73.5	32%	0.322	38%	0.38	S	S	.	.	H	α-helix	trans	-55.4	-36.6	173.1	-176.1	-88.7	0	0	0	112.4	D68 L69 S70 L86 P87 K89	Y66-D68 VanDerWaalsContact C-N 3.27Å; Y66-D68 PolarHBondContact O-N 3.28Å; Y66-L69 PolarHBondContact O-N 3.21Å; Y66-S70 PolarHBondContact O-N 3.48Å; Y66-S70 PolarHBondContact O-OG 3.39Å; Y66-L86 HydrophobicContact CD2-CD2 4.39Å; Y66-L86 HydrophobicContact CE2-CD2 3.8Å; Y66-P87 WeakPolarHBondContact OH-CD 3.28Å; Y66-P87 PolarHBondContact OH-O 3.25Å; Y66-P87 VanDerWaalsContact OH-O 3.05Å; Y66-K89 HydrophobicContact CD1-CD 4.24Å; Y66-K89 HydrophobicContact CE1-CD 4.12Å; Y66-K89 HydrophobicContact CE1-CG 3.98Å
67	K	92.8	Very high	91.1	Very high	163 Å²	163	80 Å²	80	71%	0.709	41%	0.414	S	S	*	.	H	α-helix	trans	-64.1	-32.8	178.4	-173.5	175.2	-178.7	175.8	0	112.1	T65 R71	T65-K67 PolarHBondContact O-N 3.05Å; K67-R71 WeakPolarHBondContact O-CB 3.34Å; K67-R71 PolarHBondContact O-N 3.17Å
68	D	93.9	Very high	91.3	Very high	11 Å²	11	85 Å²	85	6%	0.059	43%	0.431	C	S	.	.	H	α-helix	trans	-66.4	-43.1	175.8	-65.7	-53	0	0	0	110.7	A56 R61 L64 T65 Y66 R71 L72	A56-D68 HydrophobicContact CB-CB 4.38Å; R61-D68 IonicContact NH1-OD1 3.37Å; R61-D68 IonicContact NH1-OD2 3.07Å; R61-D68 PolarHBondContact NH1-OD2 3.25Å; R61-D68 VanDerWaalsContact NH1-OD2 3.07Å; L64-D68 HydrophobicContact CD1-CB 4.15Å; T65-D68 WeakPolarHBondContact CB-OD2 3.38Å; T65-D68 PolarHBondContact N-OD2 2.69Å; T65-D68 WeakPolarHBondContact O-CB 3.48Å; T65-D68 PolarHBondContact O-N 3.37Å; T65-D68 VanDerWaalsContact OG1-CG 3.31Å; T65-D68 PolarHBondContact OG1-N 2.94Å; T65-D68 PolarHBondContact OG1-OD2 3.36Å; Y66-D68 VanDerWaalsContact C-N 3.27Å; Y66-D68 PolarHBondContact O-N 3.28Å; D68-R71 IonicContact OD1-NH2 3.32Å; D68-R71 PolarHBondContact OD1-NH2 3.37Å; D68-L72 WeakPolarHBondContact O-CB 3.36Å; D68-L72 PolarHBondContact O-N 3.3Å
69	L	95.3	Very high	92.1	Very high	30 Å²	30	78.4 Å²	78.4	16%	0.157	41%	0.406	C	S	.	.	H	α-helix	trans	-67.5	-49.9	177.7	-67.8	175.2	0	0	0	113.1	L52 A56 L64 T65 Y66 R71 L72 Q73 L86	L52-L69 HydrophobicContact CD1-CD2 4.33Å; L52-L69 HydrophobicContact CD2-CD2 4.28Å; L52-L69 HydrophobicContact CG-CD2 4.05Å; A56-L69 HydrophobicContact CB-CD2 3.84Å; L64-L69 HydrophobicContact CD1-CD2 4.07Å; L64-L69 HydrophobicContact CD1-CG 4.07Å; L64-L69 HydrophobicContact CD2-CD1 4.17Å; L64-L69 HydrophobicContact CD2-CD2 4.23Å; L64-L69 HydrophobicContact CD2-CG 4.3Å; L64-L69 HydrophobicContact CG-CD1 4.49Å; L64-L69 HydrophobicContact CG-CG 4.32Å; T65-L69 PolarHBondContact O-N 3.05Å; Y66-L69 PolarHBondContact O-N 3.21Å; L69-R71 VanDerWaalsContact C-N 3.29Å; L69-R71 PolarHBondContact O-N 2.96Å; L69-L72 WeakPolarHBondContact O-CB 3.49Å; L69-L72 PolarHBondContact O-N 3.49Å; L69-Q73 WeakPolarHBondContact O-CB 3.29Å; L69-Q73 PolarHBondContact O-N 2.73Å; L69-L86 HydrophobicContact CB-CD1 4.13Å; L69-L86 HydrophobicContact CB-CD2 4.39Å; L69-L86 HydrophobicContact CD1-CD2 4.49Å
70	S	94.6	Very high	92.8	Very high	8 Å²	8	79.2 Å²	79.2	6%	0.056	39%	0.393	C	S	.	.	H	α-helix	trans	-68.2	-29.7	-179.5	65.2	0	0	0	0	112.6	Y66 C74	Y66-S70 PolarHBondContact O-N 3.48Å; Y66-S70 PolarHBondContact O-OG 3.39Å; S70-C74 WeakPolarHBondContact O-CB 3.41Å; S70-C74 PolarHBondContact O-N 3.02Å
71	R	93	Very high	93.6	Very high	78 Å²	78	77 Å²	77	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-68	-46.7	169.9	-178.7	-178.7	62.1	176.1	-8.8	111.2	K67 D68 L69 Q73 C74 Q75	K67-R71 WeakPolarHBondContact O-CB 3.34Å; K67-R71 PolarHBondContact O-N 3.17Å; D68-R71 IonicContact OD1-NH2 3.32Å; D68-R71 PolarHBondContact OD1-NH2 3.37Å; L69-R71 VanDerWaalsContact C-N 3.29Å; L69-R71 PolarHBondContact O-N 2.96Å; R71-Q73 VanDerWaalsContact C-N 3.32Å; R71-Q73 PolarHBondContact O-N 2.91Å; R71-C74 PolarHBondContact O-N 2.74Å; R71-Q75 HydrophobicContact CG-CG 4.15Å; R71-Q75 WeakPolarHBondContact O-CB 3.4Å; R71-Q75 VanDerWaalsContact O-CG 3.28Å; R71-Q75 WeakPolarHBondContact O-CG 3.37Å; R71-Q75 PolarHBondContact O-N 3.48Å
72	L	93.9	Very high	94	Very high	9 Å²	9	72.6 Å²	72.6	5%	0.047	36%	0.36	C	S	.	.	H	α-helix	trans	-58.3	-47	179.3	-178.9	69.2	0	0	0	111.1	L52 T55 A56 D68 L69 C74 Q75 L76 Y79	L52-L72 HydrophobicContact CD1-CD2 3.77Å; T55-L72 HydrophobicContact CG2-CD1 3.58Å; T55-L72 HydrophobicContact CG2-CD2 4.33Å; A56-L72 HydrophobicContact CB-CD2 3.88Å; D68-L72 WeakPolarHBondContact O-CB 3.36Å; D68-L72 PolarHBondContact O-N 3.3Å; L69-L72 WeakPolarHBondContact O-CB 3.49Å; L69-L72 PolarHBondContact O-N 3.49Å; L72-C74 VanDerWaalsContact C-N 3.32Å; L72-C74 PolarHBondContact O-N 3.35Å; L72-Q75 PolarHBondContact O-N 2.92Å; L72-L76 HydrophobicContact CD1-CD1 3.57Å; L72-L76 HydrophobicContact CD1-CG 4.28Å; L72-L76 PolarHBondContact O-N 3.34Å; L72-L76 VanDerWaalsContact O-N 3.07Å; L72-Y79 HydrophobicContact CD1-CD2 4.27Å; L72-Y79 HydrophobicContact CD1-CE2 3.84Å; L72-Y79 HydrophobicContact CD2-CD2 4.06Å; L72-Y79 HydrophobicContact CD2-CE2 3.61Å; L72-Y79 HydrophobicContact CG-CD2 3.71Å; L72-Y79 HydrophobicContact CG-CE2 3.57Å
73	Q	94.8	Very high	94.3	Very high	19 Å²	19	68.2 Å²	68.2	9%	0.089	33%	0.332	C	S	.	.	H	α-helix	trans	-54.6	-47.2	176.2	176.3	-80.3	-35	0	0	111.8	L69 R71 Q75 Y79 L82	L69-Q73 WeakPolarHBondContact O-CB 3.29Å; L69-Q73 PolarHBondContact O-N 2.73Å; R71-Q73 VanDerWaalsContact C-N 3.32Å; R71-Q73 PolarHBondContact O-N 2.91Å; Q73-Q75 PolarHBondContact O-N 3.36Å; Q73-Y79 WeakPolarHBondContact CG-O 3.39Å; Q73-L82 HydrophobicContact CG-CB 4.05Å
74	C	91.9	Very high	94.4	Very high	76 Å²	76	69.6 Å²	69.6	51%	0.514	34%	0.343	S	S	.	.	H	α-helix	trans	-74.1	-23.8	-178.9	-175.3	0	0	0	0	113.8	S70 R71 L72 Q88	S70-C74 WeakPolarHBondContact O-CB 3.41Å; S70-C74 PolarHBondContact O-N 3.02Å; R71-C74 PolarHBondContact O-N 2.74Å; L72-C74 VanDerWaalsContact C-N 3.32Å; L72-C74 PolarHBondContact O-N 3.35Å; C74-Q88 HydrophobicContact CB-CG 4.23Å; C74-Q88 PolarHBondContact SG-NE2 2.88Å
75	Q	93	Very high	94.5	Very high	101 Å²	101	71.6 Å²	71.6	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-89	-29.6	-176.1	-77.6	-175.9	-24.5	0	0	113.7	R71 L72 Q73	R71-Q75 HydrophobicContact CG-CG 4.15Å; R71-Q75 WeakPolarHBondContact O-CB 3.4Å; R71-Q75 VanDerWaalsContact O-CG 3.28Å; R71-Q75 WeakPolarHBondContact O-CG 3.37Å; R71-Q75 PolarHBondContact O-N 3.48Å; L72-Q75 PolarHBondContact O-N 2.92Å; Q73-Q75 PolarHBondContact O-N 3.36Å
76	L	94.3	Very high	94.5	Very high	59 Å²	59	70.5 Å²	70.5	31%	0.309	35%	0.35	S	S	.	.			trans	-123.2	116.6	-173.8	-60.9	179.9	0	0	0	110.2	T55 L72 R78 Y79	T55-L76 HydrophobicContact CG2-CD1 4.29Å; L72-L76 HydrophobicContact CD1-CD1 3.57Å; L72-L76 HydrophobicContact CD1-CG 4.28Å; L72-L76 PolarHBondContact O-N 3.34Å; L72-L76 VanDerWaalsContact O-N 3.07Å; L76-R78 HydrophobicContact CB-CG 4.34Å; L76-R78 PolarHBondContact O-N 2.98Å; L76-R78 VanDerWaalsContact O-N 3.09Å; L76-Y79 HydrophobicContact CB-CD2 3.85Å; L76-Y79 HydrophobicContact CB-CE2 4.22Å; L76-Y79 HydrophobicContact CD1-CD2 4.34Å; L76-Y79 HydrophobicContact CD1-CE2 3.9Å; L76-Y79 PolarHBondContact O-N 3.37Å
77	D	95.2	Very high	94.3	Very high	138 Å²	138	69.8 Å²	69.8	74%	0.738	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-55.4	-31.5	-176.1	-172.4	53.7	0	0	0	113.6	Y79 N80	D77-Y79 PolarHBondContact O-N 3.49Å; D77-N80 WeakPolarHBondContact O-CB 3.32Å; D77-N80 PolarHBondContact O-N 3.35Å
78	R	95.5	Very high	94.2	Very high	141 Å²	141	66.5 Å²	66.5	53%	0.532	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-58.3	-20	176.3	72.3	176.1	-176.4	-120.4	8.7	114.5	E51 L76 F81	E51-R78 IonicContact OE1-CZ 2.76Å; E51-R78 IonicContact OE1-NE 3.36Å; E51-R78 PolarHBondContact OE1-NE 2.86Å; E51-R78 IonicContact OE1-NH2 2.7Å; E51-R78 PolarHBondContact OE1-NH2 3.32Å; L76-R78 HydrophobicContact CB-CG 4.34Å; L76-R78 PolarHBondContact O-N 2.98Å; L76-R78 VanDerWaalsContact O-N 3.09Å; R78-F81 WeakPolarHBondContact O-CD1 3.48Å; R78-F81 WeakPolarHBondContact O-CE1 3.42Å
79	Y	95.8	Very high	94	Very high	3 Å²	3	73.8 Å²	73.8	1%	0.012	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-104.7	5.7	176.5	-59.4	-64.1	0	0	0	113	F48 E51 L52 L72 Q73 L76 D77 F81 L82	F48-Y79 HydrophobicContact CE2-CD1 4.05Å; F48-Y79 AromaticContact CE2-CE1 3.87Å; F48-Y79 HydrophobicContact CE2-CE1 3.87Å; F48-Y79 HydrophobicContact CZ-CD1 4.48Å; E51-Y79 PolarHBondContact OE1-OH 2.83Å; E51-Y79 PolarHBondContact OE2-OH 2.84Å; L52-Y79 HydrophobicContact CD1-CD1 3.88Å; L52-Y79 HydrophobicContact CD1-CE1 3.62Å; L72-Y79 HydrophobicContact CD1-CD2 4.27Å; L72-Y79 HydrophobicContact CD1-CE2 3.84Å; L72-Y79 HydrophobicContact CD2-CD2 4.06Å; L72-Y79 HydrophobicContact CD2-CE2 3.61Å; L72-Y79 HydrophobicContact CG-CD2 3.71Å; L72-Y79 HydrophobicContact CG-CE2 3.57Å; Q73-Y79 WeakPolarHBondContact CG-O 3.39Å; L76-Y79 HydrophobicContact CB-CD2 3.85Å; L76-Y79 HydrophobicContact CB-CE2 4.22Å; L76-Y79 HydrophobicContact CD1-CD2 4.34Å; L76-Y79 HydrophobicContact CD1-CE2 3.9Å; L76-Y79 PolarHBondContact O-N 3.37Å; D77-Y79 PolarHBondContact O-N 3.49Å; Y79-F81 PolarHBondContact O-N 3.01Å; Y79-F81 VanDerWaalsContact O-N 3.13Å; Y79-L82 HydrophobicContact CD1-CD1 4.27Å; Y79-L82 VanDerWaalsContact O-CB 3.31Å; Y79-L82 WeakPolarHBondContact O-CB 3.44Å; Y79-L82 PolarHBondContact O-N 3.48Å
80	N	94.5	Very high	93.8	Very high	87 Å²	87	76 Å²	76	47%	0.465	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-59.6	-28.1	-177.2	-168.6	32.2	0	0	0	112.4	D77 L82 A83	D77-N80 WeakPolarHBondContact O-CB 3.32Å; D77-N80 PolarHBondContact O-N 3.35Å; N80-L82 PolarHBondContact O-N 3.29Å; N80-A83 VanDerWaalsContact O-CB 3.26Å; N80-A83 WeakPolarHBondContact O-CB 3.39Å; N80-A83 PolarHBondContact O-N 2.97Å
81	F	95.9	Very high	93.7	Very high	134 Å²	134	79.3 Å²	79.3	59%	0.588	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-58.9	-14.2	172.5	79.6	-86.7	0	0	0	114.2	F48 R78 Y79	F48-F81 HydrophobicContact CE1-CZ 4.38Å; F48-F81 HydrophobicContact CE2-CE1 4.18Å; F48-F81 AromaticContact CE2-CZ 3.77Å; F48-F81 HydrophobicContact CE2-CZ 3.77Å; F48-F81 HydrophobicContact CZ-CE1 4.3Å; F48-F81 HydrophobicContact CZ-CE2 4.48Å; F48-F81 AromaticContact CZ-CZ 3.55Å; F48-F81 HydrophobicContact CZ-CZ 3.55Å; R78-F81 WeakPolarHBondContact O-CD1 3.48Å; R78-F81 WeakPolarHBondContact O-CE1 3.42Å; Y79-F81 PolarHBondContact O-N 3.01Å; Y79-F81 VanDerWaalsContact O-N 3.13Å
82	L	96.6	Very high	93.7	Very high	22 Å²	22	79.3 Å²	79.3	12%	0.115	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-92.6	2.3	175	-58.5	174.4	0	0	0	113.4	F48 L52 Q73 Y79 N80 D84 V85 L86	F48-L82 HydrophobicContact CZ-CD1 4.19Å; L52-L82 HydrophobicContact CD1-CD1 4.35Å; Q73-L82 HydrophobicContact CG-CB 4.05Å; Y79-L82 HydrophobicContact CD1-CD1 4.27Å; Y79-L82 VanDerWaalsContact O-CB 3.31Å; Y79-L82 WeakPolarHBondContact O-CB 3.44Å; Y79-L82 PolarHBondContact O-N 3.48Å; N80-L82 PolarHBondContact O-N 3.29Å; L82-D84 VanDerWaalsContact C-N 3.25Å; L82-D84 PolarHBondContact O-N 3.29Å; L82-V85 CarbonylContact O-C 3.59Å; L82-V85 PolarHBondContact O-N 2.81Å; L82-L86 HydrophobicContact CB-CD1 4.14Å; L82-L86 HydrophobicContact CD1-CD1 3.92Å; L82-L86 PolarHBondContact O-N 3.23Å
83	A	94.8	Very high	93.8	Very high	33 Å²	33	87.2 Å²	87.2	27%	0.273	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-41.7	-174.8	0	0	0	0	0	113	N80 V85	N80-A83 VanDerWaalsContact O-CB 3.26Å; N80-A83 WeakPolarHBondContact O-CB 3.39Å; N80-A83 PolarHBondContact O-N 2.97Å; A83-V85 VanDerWaalsContact C-N 3.29Å; A83-V85 PolarHBondContact O-N 3.42Å
84	D	94.6	Very high	93.8	Very high	159 Å²	159	90.7 Å²	90.7	85%	0.85	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.8	-179.2	-60	-28.5	0	0	0	112.6	L82	L82-D84 VanDerWaalsContact C-N 3.25Å; L82-D84 PolarHBondContact O-N 3.29Å
85	V	95.4	Very high	93.9	Very high	106 Å²	106	91.8 Å²	91.8	64%	0.642	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-34.1	-178	-176.8	0	0	0	0	111.5	L82 A83 P87	L82-V85 CarbonylContact O-C 3.59Å; L82-V85 PolarHBondContact O-N 2.81Å; A83-V85 VanDerWaalsContact C-N 3.29Å; A83-V85 PolarHBondContact O-N 3.42Å; V85-P87 WeakPolarHBondContact O-CD 3.38Å
86	L	94.2	Very high	94	Very high	22 Å²	22	91.4 Å²	91.4	12%	0.115	46%	0.461	C	S	.	.	S	Bend	trans	-124.9	56.3	-175	-65.5	174.8	0	0	0	112.3	Y66 L69 L82	Y66-L86 HydrophobicContact CD2-CD2 4.39Å; Y66-L86 HydrophobicContact CE2-CD2 3.8Å; L69-L86 HydrophobicContact CB-CD1 4.13Å; L69-L86 HydrophobicContact CB-CD2 4.39Å; L69-L86 HydrophobicContact CD1-CD2 4.49Å; L82-L86 HydrophobicContact CB-CD1 4.14Å; L82-L86 HydrophobicContact CD1-CD1 3.92Å; L82-L86 PolarHBondContact O-N 3.23Å
87	P	91.4	Very high	94	Very high	66 Å²	66	94.6 Å²	94.6	43%	0.429	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-63.5	146	179.9	26.6	-35.6	0	0	0	112	Y66 V85 K89	Y66-P87 WeakPolarHBondContact OH-CD 3.28Å; Y66-P87 PolarHBondContact OH-O 3.25Å; Y66-P87 VanDerWaalsContact OH-O 3.05Å; V85-P87 WeakPolarHBondContact O-CD 3.38Å; P87-K89 PolarHBondContact O-N 2.97Å
88	Q	89.7	Confident	93.9	Very high	94 Å²	94	94.4 Å²	94.4	44%	0.439	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-67.3	123.6	168.4	-77.2	-159.1	6.5	0	0	110.5	C74 I90	C74-Q88 HydrophobicContact CB-CG 4.23Å; C74-Q88 PolarHBondContact SG-NE2 2.88Å; Q88-I90 PolarHBondContact O-N 3.47Å
89	K	90.3	Very high	93.8	Very high	164 Å²	164	91.5 Å²	91.5	71%	0.713	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-69.9	125.4	173.4	-65	-177.2	-179.8	-176.8	0	109	Y66 P87	Y66-K89 HydrophobicContact CD1-CD 4.24Å; Y66-K89 HydrophobicContact CE1-CD 4.12Å; Y66-K89 HydrophobicContact CE1-CG 3.98Å; P87-K89 PolarHBondContact O-N 2.97Å
90	I	90.3	Very high	93.6	Very high	77 Å²	77	95.7 Å²	95.7	40%	0.395	47%	0.474	S	S	.	.			trans	-122.7	148.6	169.5	58.1	179.5	0	0	0	108.8	Q88 E94 W95 Y99	Q88-I90 PolarHBondContact O-N 3.47Å; I90-E94 HydrophobicContact CB-CB 4.26Å; I90-W95 HydrophobicContact CD1-CB 3.9Å; I90-W95 HydrophobicContact CD1-CG 4.18Å; I90-W95 HydrophobicContact CG1-CB 4.4Å; I90-Y99 HydrophobicContact CD1-CD2 4.29Å; I90-Y99 HydrophobicContact CD1-CE2 3.72Å
91	T	93	Very high	93.4	Very high	77 Å²	77	95.6 Å²	95.6	47%	0.472	48%	0.481	S	S	.	.			trans	-73.3	157.2	174.1	62.1	0	0	0	0	110.3	R93 E94 W95	T91-R93 PolarHBondContact O-N 3.47Å; T91-E94 WeakPolarHBondContact CB-OE2 3.37Å; T91-E94 WeakPolarHBondContact CG2-OE2 3.34Å; T91-E94 PolarHBondContact N-OE2 3.25Å; T91-E94 PolarHBondContact O-N 3.36Å; T91-E94 VanDerWaalsContact O-N 3.15Å; T91-E94 WeakPolarHBondContact OG1-CB 3.4Å; T91-E94 VanDerWaalsContact OG1-CD 3.27Å; T91-E94 VanDerWaalsContact OG1-CG 3.24Å; T91-E94 WeakPolarHBondContact OG1-CG 3.4Å; T91-E94 PolarHBondContact OG1-N 2.92Å; T91-E94 PolarHBondContact OG1-OE2 3.48Å; T91-W95 PolarHBondContact O-N 2.92Å
92	A	93	Very high	93.3	Very high	78 Å²	78	95.3 Å²	95.3	65%	0.645	48%	0.481	S	S	*	.	H	α-helix	trans	-55.8	-35.1	174.3	0	0	0	0	0	111.9	W95 I96	A92-W95 PolarHBondContact O-N 3.38Å; A92-I96 WeakPolarHBondContact O-CB 3.39Å; A92-I96 VanDerWaalsContact O-CG1 3.26Å; A92-I96 WeakPolarHBondContact O-CG1 3.48Å; A92-I96 PolarHBondContact O-N 2.9Å
93	R	95.7	Very high	93	Very high	176 Å²	176	99.2 Å²	99.2	66%	0.664	50%	0.497	S	S	*	.	H	α-helix	trans	-64.4	-49.7	176.4	-159.8	-172.2	90.2	-174.2	-2.6	111.9	T91 W95 I96 E97	T91-R93 PolarHBondContact O-N 3.47Å; R93-W95 VanDerWaalsContact C-N 3.29Å; R93-W95 PolarHBondContact O-N 3.33Å; R93-I96 PolarHBondContact O-N 3.11Å; R93-E97 IonicContact CZ-OE1 2.92Å; R93-E97 IonicContact NE-OE1 3.66Å; R93-E97 PolarHBondContact NE-OE1 3.48Å; R93-E97 IonicContact NH2-OE1 3.36Å; R93-E97 WeakPolarHBondContact O-CG 3.27Å; R93-E97 PolarHBondContact O-N 3.17Å
94	E	94.2	Very high	92.9	Very high	91 Å²	91	101.5 Å²	101.5	43%	0.425	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-37.7	177.2	-71.7	162.3	146.2	0	0	111.7	I90 T91 E97 K98	I90-E94 HydrophobicContact CB-CB 4.26Å; T91-E94 WeakPolarHBondContact CB-OE2 3.37Å; T91-E94 WeakPolarHBondContact CG2-OE2 3.34Å; T91-E94 PolarHBondContact N-OE2 3.25Å; T91-E94 PolarHBondContact O-N 3.36Å; T91-E94 VanDerWaalsContact O-N 3.15Å; T91-E94 WeakPolarHBondContact OG1-CB 3.4Å; T91-E94 VanDerWaalsContact OG1-CD 3.27Å; T91-E94 VanDerWaalsContact OG1-CG 3.24Å; T91-E94 WeakPolarHBondContact OG1-CG 3.4Å; T91-E94 PolarHBondContact OG1-N 2.92Å; T91-E94 PolarHBondContact OG1-OE2 3.48Å; E94-E97 PolarHBondContact O-N 3.12Å; E94-K98 WeakPolarHBondContact O-CB 3.41Å; E94-K98 PolarHBondContact O-N 3.34Å
95	W	95.2	Very high	92.7	Very high	100 Å²	100	98.1 Å²	98.1	38%	0.379	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-46.9	175.5	-172	97.4	0	0	0	111.3	I90 T91 A92 R93 E97 K98 Y99 F103	I90-W95 HydrophobicContact CD1-CB 3.9Å; I90-W95 HydrophobicContact CD1-CG 4.18Å; I90-W95 HydrophobicContact CG1-CB 4.4Å; T91-W95 PolarHBondContact O-N 2.92Å; A92-W95 PolarHBondContact O-N 3.38Å; R93-W95 VanDerWaalsContact C-N 3.29Å; R93-W95 PolarHBondContact O-N 3.33Å; W95-E97 PolarHBondContact O-N 2.71Å; W95-K98 PolarHBondContact O-N 3.41Å; W95-Y99 AromaticContact CD1-CD2 3.63Å; W95-Y99 HydrophobicContact CD2-CD2 4.45Å; W95-Y99 HydrophobicContact CG-CD2 4Å; W95-Y99 AromaticContact NE1-CD2 3.82Å; W95-Y99 PolarHBondContact O-N 3.49Å; W95-F103 HydrophobicContact CH2-CB 3.97Å; W95-F103 HydrophobicContact CH2-CD1 4.37Å; W95-F103 HydrophobicContact CH2-CD2 4.22Å; W95-F103 AromaticContact CH2-CG 3.92Å; W95-F103 HydrophobicContact CH2-CG 3.92Å; W95-F103 HydrophobicContact CZ2-CD2 4.47Å
96	I	94.7	Very high	92.4	Very high	92 Å²	92	97 Å²	97	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-48.2	177.1	-73.1	165.5	0	0	0	110.4	A92 R93 K98 K100	A92-I96 WeakPolarHBondContact O-CB 3.39Å; A92-I96 VanDerWaalsContact O-CG1 3.26Å; A92-I96 WeakPolarHBondContact O-CG1 3.48Å; A92-I96 PolarHBondContact O-N 2.9Å; R93-I96 PolarHBondContact O-N 3.11Å; I96-K98 VanDerWaalsContact C-N 3.27Å; I96-K98 PolarHBondContact O-N 3.14Å; I96-K100 HydrophobicContact CG2-CB 4.24Å; I96-K100 HydrophobicContact CG2-CD 3.81Å; I96-K100 WeakPolarHBondContact O-CB 3.5Å; I96-K100 PolarHBondContact O-N 2.92Å
97	E	95.2	Very high	91.6	Very high	127 Å²	127	99.2 Å²	99.2	59%	0.593	51%	0.513	S	S	*	.	H	α-helix	trans	-61.7	-35.7	-179.9	-75.1	169.9	-164	0	0	112.3	R93 E94 W95	R93-E97 IonicContact CZ-OE1 2.92Å; R93-E97 IonicContact NE-OE1 3.66Å; R93-E97 PolarHBondContact NE-OE1 3.48Å; R93-E97 IonicContact NH2-OE1 3.36Å; R93-E97 WeakPolarHBondContact O-CG 3.27Å; R93-E97 PolarHBondContact O-N 3.17Å; E94-E97 PolarHBondContact O-N 3.12Å; W95-E97 PolarHBondContact O-N 2.71Å
98	K	91.3	Very high	90.4	Very high	134 Å²	134	105.6 Å²	105.6	58%	0.583	55%	0.554	S	S	*	*	H	α-helix	trans	-95	-33.4	-170.8	-158.5	173.8	-178	-164.7	0	114.5	E94 W95 I96	E94-K98 WeakPolarHBondContact O-CB 3.41Å; E94-K98 PolarHBondContact O-N 3.34Å; W95-K98 PolarHBondContact O-N 3.41Å; I96-K98 VanDerWaalsContact C-N 3.27Å; I96-K98 PolarHBondContact O-N 3.14Å
99	Y	93.8	Very high	90.4	Very high	80 Å²	80	106.2 Å²	106.2	31%	0.314	56%	0.56	S	S	.	*	H	α-helix	trans	-125.5	-8.7	-169.2	-54.1	-67.9	0	0	0	114.4	I90 W95 S101 E102 F103	I90-Y99 HydrophobicContact CD1-CD2 4.29Å; I90-Y99 HydrophobicContact CD1-CE2 3.72Å; W95-Y99 AromaticContact CD1-CD2 3.63Å; W95-Y99 HydrophobicContact CD2-CD2 4.45Å; W95-Y99 HydrophobicContact CG-CD2 4Å; W95-Y99 AromaticContact NE1-CD2 3.82Å; W95-Y99 PolarHBondContact O-N 3.49Å; Y99-S101 VanDerWaalsContact C-N 3.34Å; Y99-S101 PolarHBondContact O-N 2.94Å; Y99-E102 PolarHBondContact O-N 2.99Å; Y99-F103 WeakPolarHBondContact O-CB 3.07Å; Y99-F103 PolarHBondContact O-N 3.2Å
100	K	92.4	Very high	90.4	Very high	90 Å²	90	103.2 Å²	103.2	39%	0.391	55%	0.552	S	S	.	*	H	α-helix	trans	-59.9	-43	-176.4	-179.9	169.1	172.3	47.2	0	112.6	I96 E102 F103 D104	I96-K100 HydrophobicContact CG2-CB 4.24Å; I96-K100 HydrophobicContact CG2-CD 3.81Å; I96-K100 WeakPolarHBondContact O-CB 3.5Å; I96-K100 PolarHBondContact O-N 2.92Å; K100-E102 PolarHBondContact O-N 2.74Å; K100-F103 PolarHBondContact O-N 2.72Å; K100-D104 WeakPolarHBondContact CE-OD2 3.46Å; K100-D104 WeakPolarHBondContact CG-OD2 3.35Å; K100-D104 IonicContact NZ-OD1 3.78Å; K100-D104 PolarHBondContact NZ-OD1 3Å; K100-D104 IonicContact NZ-OD2 3.66Å; K100-D104 PolarHBondContact NZ-OD2 3.39Å; K100-D104 VanDerWaalsContact O-CB 3.31Å; K100-D104 WeakPolarHBondContact O-CB 3.44Å; K100-D104 PolarHBondContact O-N 3.31Å
101	S	90.7	Very high	90.4	Very high	86 Å²	86	104.6 Å²	104.6	60%	0.601	56%	0.561	S	S	*	*	H	α-helix	trans	-65.1	-40	-179.9	53.7	0	0	0	0	112.4	Y99 A105	Y99-S101 VanDerWaalsContact C-N 3.34Å; Y99-S101 PolarHBondContact O-N 2.94Å; S101-A105 VanDerWaalsContact O-CB 3.25Å; S101-A105 WeakPolarHBondContact O-CB 3.34Å; S101-A105 PolarHBondContact O-N 2.94Å
102	E	92.3	Very high	90.2	Very high	127 Å²	127	106.2 Å²	106.2	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-68	-42.4	177.1	-66.3	177.3	-175.8	0	0	110.9	Y99 K100 A105 S106	Y99-E102 PolarHBondContact O-N 2.99Å; K100-E102 PolarHBondContact O-N 2.74Å; E102-A105 PolarHBondContact O-N 3.38Å; E102-S106 WeakPolarHBondContact O-CB 3.41Å; E102-S106 PolarHBondContact O-N 2.99Å; E102-S106 PolarHBondContact O-OG 3.15Å
103	F	91.7	Very high	90.1	Very high	104 Å²	104	108 Å²	108	46%	0.456	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-50.9	176.9	-177.1	-95.1	0	0	0	111.7	W95 Y99 K100 A105 S106 C107	W95-F103 HydrophobicContact CH2-CB 3.97Å; W95-F103 HydrophobicContact CH2-CD1 4.37Å; W95-F103 HydrophobicContact CH2-CD2 4.22Å; W95-F103 AromaticContact CH2-CG 3.92Å; W95-F103 HydrophobicContact CH2-CG 3.92Å; W95-F103 HydrophobicContact CZ2-CD2 4.47Å; Y99-F103 WeakPolarHBondContact O-CB 3.07Å; Y99-F103 PolarHBondContact O-N 3.2Å; K100-F103 PolarHBondContact O-N 2.72Å; F103-A105 PolarHBondContact O-N 3.45Å; F103-S106 WeakPolarHBondContact CA-OG 3.19Å; F103-S106 PolarHBondContact O-N 2.88Å; F103-S106 PolarHBondContact O-OG 2.76Å; F103-C107 PolarHBondContact O-N 3.14Å
104	D	91.3	Very high	89.7	Confident	82 Å²	82	103.5 Å²	103.5	44%	0.439	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-32.8	179.4	-68.8	-12.9	0	0	0	111.3	K100	K100-D104 WeakPolarHBondContact CE-OD2 3.46Å; K100-D104 WeakPolarHBondContact CG-OD2 3.35Å; K100-D104 IonicContact NZ-OD1 3.78Å; K100-D104 PolarHBondContact NZ-OD1 3Å; K100-D104 IonicContact NZ-OD2 3.66Å; K100-D104 PolarHBondContact NZ-OD2 3.39Å; K100-D104 VanDerWaalsContact O-CB 3.31Å; K100-D104 WeakPolarHBondContact O-CB 3.44Å; K100-D104 PolarHBondContact O-N 3.31Å
105	A	91.5	Very high	89.4	Confident	87 Å²	87	104.4 Å²	104.4	72%	0.719	56%	0.563	S	S	*	*	H	α-helix	trans	-75.7	-24.8	174.5	0	0	0	0	0	113.6	S101 E102 F103	S101-A105 VanDerWaalsContact O-CB 3.25Å; S101-A105 WeakPolarHBondContact O-CB 3.34Å; S101-A105 PolarHBondContact O-N 2.94Å; E102-A105 PolarHBondContact O-N 3.38Å; F103-A105 PolarHBondContact O-N 3.45Å
106	S	89.4	Confident	88.9	Confident	83 Å²	83	104.7 Å²	104.7	58%	0.58	58%	0.577	S	S	*	*	H	α-helix	trans	-82.6	-17.9	179.1	72.1	0	0	0	0	113.7	E102 F103 P108	E102-S106 WeakPolarHBondContact O-CB 3.41Å; E102-S106 PolarHBondContact O-N 2.99Å; E102-S106 PolarHBondContact O-OG 3.15Å; F103-S106 WeakPolarHBondContact CA-OG 3.19Å; F103-S106 PolarHBondContact O-N 2.88Å; F103-S106 PolarHBondContact O-OG 2.76Å; S106-P108 WeakPolarHBondContact O-CD 3.5Å
107	C	76.2	Confident	88.5	Confident	69 Å²	69	105.8 Å²	105.8	47%	0.466	59%	0.586	S	S	.	*			trans	-86	119.2	174.5	-82	0	0	0	0	110.2	F103	F103-C107 PolarHBondContact O-N 3.14Å
108	P	65.9	Low	87.8	Confident	200 Å²	200	103.8 Å²	103.8	100%	1.299	59%	0.586	S	S	*	*			trans	-68.4	0	174.2	28.7	-33.5	0	0	0	113.3	S106	S106-P108 WeakPolarHBondContact O-CD 3.5Å

Retrieved 108 of 108 residues in 26.4 ms (Link to these results)

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