G4VHI8_SCHMA Loading...

Transposase

AlphaFold DB , UniProt , Accession G4VHI8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 106 aa.

						>G4VHI8_SCHMA|G4VHI8
MTRSTINTDESYIAYLTERQIGELYQLPTDHQCVPHFYTTQTGLECRRYFCEVCGPLARSNLKTGSTNIKHAGALQRQLDWIAGTTLPDALTRSREAMIYYGDYKH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	42	Very low	197 Å²	197	111.1 Å²	111.1	97%	0.97	60%	0.595	S	S	*	*				0	119.1	0	-74.9	175.8	-177.8	0	0	107.6
2	T	30.5	Very low	42.7	Very low	146 Å²	146	103.9 Å²	103.9	90%	0.896	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-82.2	123.4	174.8	-1.5	0	0	0	0	108	S4	T2-S4 PolarHBondContact O-N 3.35Å
3	R	34.4	Very low	43.4	Very low	200 Å²	200	96.1 Å²	96.1	76%	0.755	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-59.7	118.4	-178.5	177.2	177.4	163	-174.3	-4.5	109.8	A14	R3-A14 HydrophobicContact CG-CB 4.14Å
4	S	36.5	Very low	43.8	Very low	29 Å²	29	91.4 Å²	91.4	20%	0.203	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-64.7	136.3	172.6	178.7	0	0	0	0	110.4	T2 I6	T2-S4 PolarHBondContact O-N 3.35Å; S4-I6 VanDerWaalsContact C-N 3.33Å; S4-I6 PolarHBondContact OG-N 3.36Å
5	T	39.9	Very low	44.1	Very low	132 Å²	132	93.3 Å²	93.3	81%	0.81	49%	0.492	S	S	*	.			trans	-88.3	-2.5	175.2	44.8	0	0	0	0	112.8	N7	T5-N7 PolarHBondContact O-N 2.92Å
6	I	40.9	Very low	44.4	Very low	87 Å²	87	88.8 Å²	88.8	45%	0.446	47%	0.468	S	S	.	.	S	Bend	trans	-86	109.2	-179.3	-53.7	172.6	0	0	0	107.5	S4	S4-I6 VanDerWaalsContact C-N 3.33Å; S4-I6 PolarHBondContact OG-N 3.36Å
7	N	43.1	Very low	45	Very low	83 Å²	83	88.2 Å²	88.2	44%	0.444	47%	0.469	S	S	.	.			trans	71.8	103.4	-178.8	-81.5	-24.4	0	0	0	117	T5 I13	T5-N7 PolarHBondContact O-N 2.92Å; N7-I13 HydrophobicContact CB-CD1 3.72Å; N7-I13 HydrophobicContact CB-CG2 4.45Å
8	T	50	Low	45.7	Very low	120 Å²	120	90.9 Å²	90.9	74%	0.736	48%	0.478	S	S	*	.			trans	-88.1	-1.8	176.3	45.4	0	0	0	0	114.9
9	D	56	Low	46.3	Very low	142 Å²	142	95.8 Å²	95.8	76%	0.759	49%	0.49	S	S	*	.	S	Bend	trans	-83.4	-19.8	-168	-77.3	-15.1	0	0	0	114.8
10	E	47.8	Very low	46.7	Very low	33 Å²	33	93.6 Å²	93.6	15%	0.154	48%	0.477	C	S	.	.	S	Bend	trans	-131.3	129.2	179.1	-55.9	-161.5	165.3	0	0	113.4	Y12 I13 R77	E10-Y12 HydrophobicContact CB-CD1 4.11Å; E10-Y12 HydrophobicContact CB-CE1 3.65Å; E10-Y12 HydrophobicContact CG-CE1 4.4Å; E10-Y12 PolarHBondContact O-N 2.86Å; E10-Y12 WeakPolarHBondContact OE2-CE1 3.14Å; E10-Y12 PolarHBondContact OE2-OH 3.35Å; E10-I13 HydrophobicContact CB-CD1 3.9Å; E10-I13 HydrophobicContact CB-CG1 4.11Å; E10-I13 WeakPolarHBondContact O-CB 3.44Å; E10-I13 WeakPolarHBondContact O-CG1 3.43Å; E10-I13 PolarHBondContact O-N 3.36Å; E10-I13 VanDerWaalsContact O-N 3.09Å; E10-R77 IonicContact OE1-CZ 3.76Å; E10-R77 IonicContact OE1-NE 2.85Å; E10-R77 PolarHBondContact OE1-NE 3.06Å; E10-R77 IonicContact OE1-NH2 3.92Å; E10-R77 PolarHBondContact OE1-NH2 3.28Å; E10-R77 WeakPolarHBondContact OE2-CD 3.31Å; E10-R77 IonicContact OE2-CZ 3.16Å; E10-R77 IonicContact OE2-NE 2.89Å; E10-R77 PolarHBondContact OE2-NE 3.21Å; E10-R77 IonicContact OE2-NH2 2.63Å
11	S	51.5	Low	47.2	Very low	53 Å²	53	89.8 Å²	89.8	37%	0.371	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.3	-167.2	-43	0	0	0	0	114.7
12	Y	50.2	Low	48.4	Very low	25 Å²	25	81.9 Å²	81.9	10%	0.098	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-13.3	-176	62.2	-92.2	0	0	0	114.1	E10 A14 Y15 L16 K63 R77	E10-Y12 HydrophobicContact CB-CD1 4.11Å; E10-Y12 HydrophobicContact CB-CE1 3.65Å; E10-Y12 HydrophobicContact CG-CE1 4.4Å; E10-Y12 PolarHBondContact O-N 2.86Å; E10-Y12 WeakPolarHBondContact OE2-CE1 3.14Å; E10-Y12 PolarHBondContact OE2-OH 3.35Å; Y12-A14 PolarHBondContact O-N 3.17Å; Y12-Y15 PolarHBondContact O-N 3.33Å; Y12-Y15 VanDerWaalsContact O-N 3.14Å; Y12-L16 HydrophobicContact CD2-CD1 3.92Å; Y12-L16 HydrophobicContact CE2-CD1 4.12Å; Y12-K63 PolarHBondContact OH-NZ 3.02Å; Y12-R77 HydrophobicContact CE1-CB 4.32Å; Y12-R77 HydrophobicContact CE1-CG 4.47Å; Y12-R77 WeakPolarHBondContact OH-CD 3.47Å
13	I	52.3	Low	49.6	Very low	2 Å²	2	77.5 Å²	77.5	1%	0.01	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-60.6	-33.1	-178.3	-63.1	173.4	0	0	0	111.3	N7 E10 Y15 L16 I21 Y25	N7-I13 HydrophobicContact CB-CD1 3.72Å; N7-I13 HydrophobicContact CB-CG2 4.45Å; E10-I13 HydrophobicContact CB-CD1 3.9Å; E10-I13 HydrophobicContact CB-CG1 4.11Å; E10-I13 WeakPolarHBondContact O-CB 3.44Å; E10-I13 WeakPolarHBondContact O-CG1 3.43Å; E10-I13 PolarHBondContact O-N 3.36Å; E10-I13 VanDerWaalsContact O-N 3.09Å; I13-Y15 PolarHBondContact O-N 3.24Å; I13-L16 PolarHBondContact O-N 2.98Å; I13-I21 HydrophobicContact CG2-CD1 3.64Å; I13-I21 HydrophobicContact CG2-CG1 4.16Å; I13-Y25 HydrophobicContact CD1-CE2 4.27Å; I13-Y25 WeakPolarHBondContact CD1-OH 3.19Å
14	A	48.5	Very low	50.5	Low	31 Å²	31	69 Å²	69	26%	0.256	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-59.1	-17.5	179	0	0	0	0	0	114.5	R3 Y12	R3-A14 HydrophobicContact CG-CB 4.14Å; Y12-A14 PolarHBondContact O-N 3.17Å
15	Y	47.6	Very low	51.2	Low	120 Å²	120	72.3 Å²	72.3	47%	0.471	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-106.2	-1	-177.8	-57.4	-86.9	0	0	0	113.2	Y12 I13 W81 P88	Y12-Y15 PolarHBondContact O-N 3.33Å; Y12-Y15 VanDerWaalsContact O-N 3.14Å; I13-Y15 PolarHBondContact O-N 3.24Å; Y15-W81 HydrophobicContact CD2-CH2 4.09Å; Y15-W81 HydrophobicContact CD2-CZ3 4.26Å; Y15-W81 AromaticContact CE2-CH2 3.37Å; Y15-W81 HydrophobicContact CE2-CH2 3.37Å; Y15-W81 HydrophobicContact CE2-CZ2 4.32Å; Y15-W81 AromaticContact CE2-CZ3 3.98Å; Y15-W81 HydrophobicContact CE2-CZ3 3.98Å; Y15-W81 AromaticContact CZ-CH2 3.97Å; Y15-P88 HydrophobicContact CD1-CB 4.34Å; Y15-P88 HydrophobicContact CD2-CB 4.39Å; Y15-P88 HydrophobicContact CD2-CG 4.14Å; Y15-P88 HydrophobicContact CG-CB 4.05Å; Y15-P88 HydrophobicContact CG-CG 4.27Å
16	L	49	Very low	51.7	Low	20 Å²	20	73 Å²	73	11%	0.105	37%	0.369	C	S	.	.	S	Bend	trans	-95.9	142.6	178.4	-63	175.6	0	0	0	109.9	Y12 I13 Q20 I21 L24	Y12-L16 HydrophobicContact CD2-CD1 3.92Å; Y12-L16 HydrophobicContact CE2-CD1 4.12Å; I13-L16 PolarHBondContact O-N 2.98Å; L16-Q20 HydrophobicContact CB-CB 4.28Å; L16-Q20 HydrophobicContact CD2-CB 4.31Å; L16-I21 HydrophobicContact CB-CD1 4.2Å; L16-I21 HydrophobicContact CB-CG1 3.61Å; L16-I21 HydrophobicContact CD1-CG1 4.31Å; L16-L24 HydrophobicContact CD1-CD1 3.41Å; L16-L24 VanDerWaalsContact CD1-CD1 3.41Å
17	T	54.9	Low	51.8	Low	80 Å²	80	76.2 Å²	76.2	49%	0.491	39%	0.386	S	S	.	.			trans	-70.3	153.8	168.5	60.2	0	0	0	0	109.8	R19 Q20 I21	T17-R19 PolarHBondContact O-N 2.92Å; T17-R19 VanDerWaalsContact O-N 3.09Å; T17-Q20 PolarHBondContact O-N 2.88Å; T17-Q20 WeakPolarHBondContact OG1-CG 3.12Å; T17-Q20 PolarHBondContact OG1-N 3.19Å; T17-Q20 PolarHBondContact OG1-OE1 3.47Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; T17-I21 PolarHBondContact O-N 2.98Å
18	E	58.2	Low	52	Low	136 Å²	136	75 Å²	75	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-52.7	-34.6	176.7	-71.8	-177.6	166.3	0	0	112.6	I21 G22	E18-I21 PolarHBondContact O-N 2.84Å; E18-G22 PolarHBondContact O-N 3.14Å
19	R	57.7	Low	51.8	Low	184 Å²	184	76.2 Å²	76.2	69%	0.694	39%	0.39	S	S	*	.	H	α-helix	trans	-62.8	-48.1	174.8	-161.5	-172.1	91.9	-174.3	1.2	112.2	T17 I21 G22 E23	T17-R19 PolarHBondContact O-N 2.92Å; T17-R19 VanDerWaalsContact O-N 3.09Å; R19-I21 VanDerWaalsContact C-N 3.31Å; R19-I21 PolarHBondContact O-N 3.48Å; R19-G22 PolarHBondContact O-N 2.86Å; R19-E23 IonicContact CZ-OE1 3.65Å; R19-E23 IonicContact NE-OE1 2.94Å; R19-E23 PolarHBondContact NE-OE1 3.26Å; R19-E23 IonicContact NH2-OE1 3.56Å; R19-E23 WeakPolarHBondContact O-CG 3.45Å; R19-E23 PolarHBondContact O-N 3.41Å
20	Q	53.9	Low	50.9	Low	51 Å²	51	75.6 Å²	75.6	24%	0.238	39%	0.387	C	S	.	.	H	α-helix	trans	-66.7	-34.5	178.6	-70.8	167.5	-52	0	0	111.9	L16 T17 L24	L16-Q20 HydrophobicContact CB-CB 4.28Å; L16-Q20 HydrophobicContact CD2-CB 4.31Å; T17-Q20 PolarHBondContact O-N 2.88Å; T17-Q20 WeakPolarHBondContact OG1-CG 3.12Å; T17-Q20 PolarHBondContact OG1-N 3.19Å; T17-Q20 PolarHBondContact OG1-OE1 3.47Å; Q20-L24 WeakPolarHBondContact O-CB 3.44Å; Q20-L24 PolarHBondContact O-N 3.45Å
21	I	56.9	Low	50.5	Low	14 Å²	14	83.5 Å²	83.5	7%	0.072	42%	0.423	C	S	.	.	H	α-helix	trans	-63.1	-48.4	171.5	-64	171	0	0	0	109.3	I13 L16 T17 E18 R19 E23 L24 Y25	I13-I21 HydrophobicContact CG2-CD1 3.64Å; I13-I21 HydrophobicContact CG2-CG1 4.16Å; L16-I21 HydrophobicContact CB-CD1 4.2Å; L16-I21 HydrophobicContact CB-CG1 3.61Å; L16-I21 HydrophobicContact CD1-CG1 4.31Å; T17-I21 WeakPolarHBondContact O-CG1 3.34Å; T17-I21 PolarHBondContact O-N 2.98Å; E18-I21 PolarHBondContact O-N 2.84Å; R19-I21 VanDerWaalsContact C-N 3.31Å; R19-I21 PolarHBondContact O-N 3.48Å; I21-E23 VanDerWaalsContact C-N 3.32Å; I21-E23 PolarHBondContact O-N 2.83Å; I21-L24 PolarHBondContact O-N 3.23Å; I21-L24 VanDerWaalsContact O-N 3.15Å; I21-Y25 HydrophobicContact CG2-CD2 3.63Å; I21-Y25 HydrophobicContact CG2-CE2 3.98Å; I21-Y25 VanDerWaalsContact O-CD2 3.29Å; I21-Y25 WeakPolarHBondContact O-CD2 3.43Å; I21-Y25 PolarHBondContact O-N 2.97Å
22	G	57.1	Low	49.7	Very low	32 Å²	32	87.9 Å²	87.9	33%	0.33	44%	0.438	S	S	.	.	H	α-helix	trans	-58	-42.2	177.2	0	0	0	0	0	112.9	E18 R19 Q26	E18-G22 PolarHBondContact O-N 3.14Å; R19-G22 PolarHBondContact O-N 2.86Å; G22-Q26 WeakPolarHBondContact O-CB 3.46Å; G22-Q26 VanDerWaalsContact O-CG 3.25Å; G22-Q26 WeakPolarHBondContact O-CG 3.36Å; G22-Q26 PolarHBondContact O-N 3.26Å
23	E	55.2	Low	49.2	Very low	53 Å²	53	90.6 Å²	90.6	25%	0.248	46%	0.46	C	S	.	.	H	α-helix	trans	-60.2	-50.5	173.2	-70.6	164	-166.3	0	0	110.6	R19 I21 Y25 H36	R19-E23 IonicContact CZ-OE1 3.65Å; R19-E23 IonicContact NE-OE1 2.94Å; R19-E23 PolarHBondContact NE-OE1 3.26Å; R19-E23 IonicContact NH2-OE1 3.56Å; R19-E23 WeakPolarHBondContact O-CG 3.45Å; R19-E23 PolarHBondContact O-N 3.41Å; I21-E23 VanDerWaalsContact C-N 3.32Å; I21-E23 PolarHBondContact O-N 2.83Å; E23-Y25 PolarHBondContact O-N 3.25Å; E23-H36 VanDerWaalsContact C-CE1 3.46Å; E23-H36 PolarHBondContact O-CE1 3.43Å; E23-H36 PolarHBondContact O-NE2 3.28Å
24	L	52.9	Low	48.4	Very low	23 Å²	23	94.8 Å²	94.8	12%	0.12	49%	0.485	C	S	.	.	H	α-helix	trans	-65.4	-28.9	-177.7	-86.8	159.9	0	0	0	115.7	L16 Q20 I21 H36 F50	L16-L24 HydrophobicContact CD1-CD1 3.41Å; L16-L24 VanDerWaalsContact CD1-CD1 3.41Å; Q20-L24 WeakPolarHBondContact O-CB 3.44Å; Q20-L24 PolarHBondContact O-N 3.45Å; I21-L24 PolarHBondContact O-N 3.23Å; I21-L24 VanDerWaalsContact O-N 3.15Å; L24-H36 HydrophobicContact CD2-CB 4.01Å; L24-F50 HydrophobicContact CD2-CE1 4.22Å; L24-F50 HydrophobicContact CD2-CZ 3.92Å
25	Y	52.3	Low	47.9	Very low	98 Å²	98	94.7 Å²	94.7	38%	0.384	48%	0.482	S	S	.	.	H	α-helix	trans	-107.5	0.7	-175.8	-72.9	-78.1	0	0	0	113.7	I13 I21 E23 L27	I13-Y25 HydrophobicContact CD1-CE2 4.27Å; I13-Y25 WeakPolarHBondContact CD1-OH 3.19Å; I21-Y25 HydrophobicContact CG2-CD2 3.63Å; I21-Y25 HydrophobicContact CG2-CE2 3.98Å; I21-Y25 VanDerWaalsContact O-CD2 3.29Å; I21-Y25 WeakPolarHBondContact O-CD2 3.43Å; I21-Y25 PolarHBondContact O-N 2.97Å; E23-Y25 PolarHBondContact O-N 3.25Å; Y25-L27 PolarHBondContact O-N 3.15Å; Y25-L27 VanDerWaalsContact O-N 3.11Å
26	Q	49.2	Very low	47.5	Very low	145 Å²	145	91.3 Å²	91.3	68%	0.678	47%	0.47	S	S	*	.	S	Bend	trans	-59.2	119.9	169.9	-96.3	173.8	13.4	0	0	108.7	G22 P28	G22-Q26 WeakPolarHBondContact O-CB 3.46Å; G22-Q26 VanDerWaalsContact O-CG 3.25Å; G22-Q26 WeakPolarHBondContact O-CG 3.36Å; G22-Q26 PolarHBondContact O-N 3.26Å; Q26-P28 WeakPolarHBondContact O-CD 3.29Å
27	L	44.1	Very low	47	Very low	156 Å²	156	93.6 Å²	93.6	82%	0.817	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-57.4	124.1	173.9	-96	100.7	0	0	0	107.3	Y25 T29	Y25-L27 PolarHBondContact O-N 3.15Å; Y25-L27 VanDerWaalsContact O-N 3.11Å; L27-T29 PolarHBondContact O-N 2.87Å
28	P	47.3	Very low	46.1	Very low	57 Å²	57	93 Å²	93	37%	0.37	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-63	118.9	176.7	24.2	-28.3	0	0	0	107.4	Q26 D30 Q32	Q26-P28 WeakPolarHBondContact O-CD 3.29Å; P28-D30 CarbonylContact C-O 3.56Å; P28-D30 WeakPolarHBondContact CB-O 3.42Å; P28-D30 PolarHBondContact O-N 3.4Å; P28-D30 VanDerWaalsContact O-N 3.09Å; P28-Q32 WeakPolarHBondContact CB-O 3.14Å
29	T	44.8	Very low	45	Very low	146 Å²	146	91.7 Å²	91.7	90%	0.896	47%	0.471	S	S	*	.	S	Bend	trans	-70.1	0.4	-175.3	0.6	0	0	0	0	113.6	L27	L27-T29 PolarHBondContact O-N 2.87Å
30	D	36.9	Very low	44	Very low	128 Å²	128	85.8 Å²	85.8	68%	0.684	46%	0.455	S	S	*	.	S	Bend	trans	-149.8	162.9	165.8	-101.1	-43.8	0	0	0	106.9	P28 Q32	P28-D30 CarbonylContact C-O 3.56Å; P28-D30 WeakPolarHBondContact CB-O 3.42Å; P28-D30 PolarHBondContact O-N 3.4Å; P28-D30 VanDerWaalsContact O-N 3.09Å; D30-Q32 PolarHBondContact O-N 3.14Å
31	H	40	Very low	43.3	Very low	199 Å²	199	93 Å²	93	92%	0.921	49%	0.489	S	S	*	.	S	Bend	trans	-56.3	20.2	-174.4	-68.4	-57	0	0	0	117.9
32	Q	35.7	Very low	42.5	Very low	146 Å²	146	95.7 Å²	95.7	68%	0.682	51%	0.506	S	S	*	.			trans	-94.6	106.2	174.4	-64.5	180	6.8	0	0	108.9	P28 D30 V34	P28-Q32 WeakPolarHBondContact CB-O 3.14Å; D30-Q32 PolarHBondContact O-N 3.14Å; Q32-V34 HydrophobicContact CB-CG2 4.43Å; Q32-V34 PolarHBondContact O-N 3.26Å
33	C	37.7	Very low	41.5	Very low	82 Å²	82	97.9 Å²	97.9	55%	0.554	53%	0.529	S	S	*	.			trans	-56.3	90.1	157.5	-76.4	0	0	0	0	108.2	P35 T64	C33-P35 WeakPolarHBondContact O-CD 3.3Å; C33-T64 PolarHBondContact SG-OG1 2.85Å
34	V	37.3	Very low	40.6	Very low	89 Å²	89	101.6 Å²	101.6	54%	0.539	55%	0.55	S	S	.	.			trans	-72	110.9	174.9	-174.3	0	0	0	0	106.6	Q32 H36	Q32-V34 HydrophobicContact CB-CG2 4.43Å; Q32-V34 PolarHBondContact O-N 3.26Å; V34-H36 PolarHBondContact O-N 2.76Å
35	P	38	Very low	39.9	Very low	30 Å²	30	109.3 Å²	109.3	20%	0.195	59%	0.585	C	S	.	*			trans	-74.4	123.8	177.9	-7.4	27.3	0	0	0	106.6	C33 F37	C33-P35 WeakPolarHBondContact O-CD 3.3Å; P35-F37 VanDerWaalsContact C-N 3.28Å; P35-F37 HydrophobicContact CB-CD1 4.06Å; P35-F37 HydrophobicContact CB-CD2 4.26Å; P35-F37 HydrophobicContact CB-CE1 3.5Å; P35-F37 VanDerWaalsContact CB-CE1 3.5Å; P35-F37 HydrophobicContact CB-CE2 3.71Å; P35-F37 HydrophobicContact CB-CG 4.45Å; P35-F37 HydrophobicContact CB-CZ 3.35Å; P35-F37 HydrophobicContact CG-CE1 3.97Å; P35-F37 HydrophobicContact CG-CE2 3.7Å; P35-F37 HydrophobicContact CG-CZ 3.33Å; P35-F37 WeakPolarHBondContact O-CD2 3.31Å; P35-F37 WeakPolarHBondContact O-CE2 3.29Å; P35-F37 WeakPolarHBondContact O-CG 3.1Å; P35-F37 PolarHBondContact O-N 2.98Å
36	H	38.3	Very low	39.2	Very low	48 Å²	48	106.9 Å²	106.9	22%	0.222	58%	0.581	C	S	.	*			trans	-75.8	83.4	178.3	-79.4	-84.6	0	0	0	110.1	E23 L24 V34 F50	E23-H36 VanDerWaalsContact C-CE1 3.46Å; E23-H36 PolarHBondContact O-CE1 3.43Å; E23-H36 PolarHBondContact O-NE2 3.28Å; L24-H36 HydrophobicContact CD2-CB 4.01Å; V34-H36 PolarHBondContact O-N 2.76Å; H36-F50 HydrophobicContact CB-CD1 4.36Å; H36-F50 HydrophobicContact CB-CE1 4.36Å; H36-F50 WeakPolarHBondContact O-CB 3.37Å; H36-F50 WeakPolarHBondContact O-CD1 3.04Å; H36-F50 WeakPolarHBondContact O-CG 3.09Å
37	F	38.9	Very low	38.9	Very low	68 Å²	68	111.1 Å²	111.1	30%	0.298	59%	0.591	S	S	.	*			trans	-71.9	134.7	-179.9	-52.8	-71.4	0	0	0	111.6	P35 F50 C51 E52	P35-F37 VanDerWaalsContact C-N 3.28Å; P35-F37 HydrophobicContact CB-CD1 4.06Å; P35-F37 HydrophobicContact CB-CD2 4.26Å; P35-F37 HydrophobicContact CB-CE1 3.5Å; P35-F37 VanDerWaalsContact CB-CE1 3.5Å; P35-F37 HydrophobicContact CB-CE2 3.71Å; P35-F37 HydrophobicContact CB-CG 4.45Å; P35-F37 HydrophobicContact CB-CZ 3.35Å; P35-F37 HydrophobicContact CG-CE1 3.97Å; P35-F37 HydrophobicContact CG-CE2 3.7Å; P35-F37 HydrophobicContact CG-CZ 3.33Å; P35-F37 WeakPolarHBondContact O-CD2 3.31Å; P35-F37 WeakPolarHBondContact O-CE2 3.29Å; P35-F37 WeakPolarHBondContact O-CG 3.1Å; P35-F37 PolarHBondContact O-N 2.98Å; F37-F50 WeakPolarHBondContact CA-O 3.47Å; F37-F50 WeakPolarHBondContact CD1-O 3.28Å; F37-C51 WeakPolarHBondContact CE1-O 3.41Å; F37-E52 HydrophobicContact CD1-CB 4.08Å; F37-E52 HydrophobicContact CD1-CG 4.43Å; F37-E52 HydrophobicContact CD2-CG 4.31Å; F37-E52 HydrophobicContact CE1-CB 4.31Å; F37-E52 HydrophobicContact CE1-CG 4.43Å; F37-E52 HydrophobicContact CE2-CG 4.33Å; F37-E52 HydrophobicContact CG-CB 4.25Å; F37-E52 HydrophobicContact CG-CG 4.32Å; F37-E52 HydrophobicContact CZ-CG 4.34Å
38	Y	36.4	Very low	38.7	Very low	67 Å²	67	109.1 Å²	109.1	26%	0.263	57%	0.573	S	S	.	*			trans	-116.3	109.5	168.3	-63.2	-75.9	0	0	0	108.1	L87	Y38-L87 HydrophobicContact CD2-CD2 4.43Å
39	T	34.8	Very low	38.6	Very low	110 Å²	110	108.4 Å²	108.4	68%	0.675	56%	0.563	S	S	*	*			trans	-81.6	132.4	171.5	58.8	0	0	0	0	108.9
40	T	36.6	Very low	38.4	Very low	60 Å²	60	102.5 Å²	102.5	37%	0.368	53%	0.525	S	S	.	.			trans	-82.1	126.2	165.7	49.5	0	0	0	0	107.9	T42	T40-T42 PolarHBondContact O-N 3.28Å; T40-T42 PolarHBondContact OG1-OG1 3.37Å
41	Q	38	Very low	38.5	Very low	203 Å²	203	97.4 Å²	97.4	95%	0.949	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	6.1	178.3	-76.7	-176.9	-9.1	0	0	114.9
42	T	41	Very low	38.3	Very low	69 Å²	69	94.2 Å²	94.2	42%	0.423	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-2.9	-171.8	54	0	0	0	0	114.5	T40 L44 M98	T40-T42 PolarHBondContact O-N 3.28Å; T40-T42 PolarHBondContact OG1-OG1 3.37Å; T42-L44 PolarHBondContact O-N 3.19Å; T42-L44 VanDerWaalsContact O-N 3.14Å; T42-M98 HydrophobicContact CG2-CE 3.83Å; T42-M98 HydrophobicContact CG2-SD 4.4Å
43	G	36.9	Very low	38.3	Very low	79 Å²	79	93.2 Å²	93.2	81%	0.814	49%	0.488	S	S	*	.			trans	68.1	7.2	-179.6	0	0	0	0	0	115.1
44	L	35.7	Very low	38.6	Very low	131 Å²	131	92.6 Å²	92.6	69%	0.686	48%	0.484	S	S	*	.			trans	-90.6	128.9	175.4	-70.1	167.1	0	0	0	110	T42 C46	T42-L44 PolarHBondContact O-N 3.19Å; T42-L44 VanDerWaalsContact O-N 3.14Å; L44-C46 PolarHBondContact O-N 3.05Å; L44-C46 VanDerWaalsContact O-N 3.15Å
45	E	37.5	Very low	39.1	Very low	185 Å²	185	88.4 Å²	88.4	86%	0.864	46%	0.459	S	S	*	.			trans	-57.6	115.5	178.1	-69.6	-178	158	0	0	111.1	R47	E45-R47 PolarHBondContact O-N 3.14Å
46	C	37.5	Very low	39.8	Very low	46 Å²	46	91.7 Å²	91.7	31%	0.311	48%	0.48	S	S	.	.			trans	-71.2	114.4	-175.9	-173.8	0	0	0	0	110.9	L44 R48	L44-C46 PolarHBondContact O-N 3.05Å; L44-C46 VanDerWaalsContact O-N 3.15Å; C46-R48 PolarHBondContact O-N 2.86Å; C46-R48 PolarHBondContact SG-O 3.08Å; C46-R48 VanDerWaalsContact SG-O 3.38Å
47	R	42.8	Very low	40.5	Very low	235 Å²	235	96.7 Å²	96.7	89%	0.887	51%	0.508	S	S	*	.			trans	-83.9	9.3	-177.5	-71.8	-163.8	-178.3	-172	2.4	115.6	E45	E45-R47 PolarHBondContact O-N 3.14Å
48	R	41.8	Very low	41.6	Very low	113 Å²	113	94.7 Å²	94.7	43%	0.426	50%	0.504	S	S	.	.	S	Bend	trans	-159	133.1	177.1	-94.4	137.3	-170	-156.6	5.4	113.3	C46 G84 T85	C46-R48 PolarHBondContact O-N 2.86Å; C46-R48 PolarHBondContact SG-O 3.08Å; C46-R48 VanDerWaalsContact SG-O 3.38Å; R48-G84 PolarHBondContact NH1-O 3.32Å; R48-T85 WeakPolarHBondContact CB-O 3.44Å; R48-T85 WeakPolarHBondContact CD-O 3.5Å; R48-T85 WeakPolarHBondContact CG-O 3.14Å
49	Y	44.6	Very low	43.1	Very low	43 Å²	43	100.2 Å²	100.2	17%	0.169	52%	0.524	C	S	.	.	S	Bend	trans	56.5	110	157.3	-76	-117.3	0	0	0	115.8	S60 D80	Y49-S60 WeakPolarHBondContact CD1-OG 3.47Å; Y49-S60 WeakPolarHBondContact CE1-OG 3.45Å; Y49-S60 WeakPolarHBondContact OH-CB 3.39Å; Y49-S60 PolarHBondContact OH-OG 2.78Å; Y49-S60 VanDerWaalsContact OH-OG 3.05Å; Y49-D80 HydrophobicContact CE1-CB 4.1Å; Y49-D80 WeakPolarHBondContact CE1-OD2 3.22Å; Y49-D80 HydrophobicContact CE2-CB 4.38Å; Y49-D80 PolarHBondContact OH-OD1 3.46Å; Y49-D80 VanDerWaalsContact OH-OD1 3.05Å; Y49-D80 PolarHBondContact OH-OD2 2.99Å
50	F	40.5	Very low	44.5	Very low	22 Å²	22	95 Å²	95	10%	0.096	49%	0.492	C	S	.	.	S	Bend	trans	67.2	32.9	-174.3	-50.4	-87.7	0	0	0	114.6	L24 H36 F37 N61	L24-F50 HydrophobicContact CD2-CE1 4.22Å; L24-F50 HydrophobicContact CD2-CZ 3.92Å; H36-F50 HydrophobicContact CB-CD1 4.36Å; H36-F50 HydrophobicContact CB-CE1 4.36Å; H36-F50 WeakPolarHBondContact O-CB 3.37Å; H36-F50 WeakPolarHBondContact O-CD1 3.04Å; H36-F50 WeakPolarHBondContact O-CG 3.09Å; F37-F50 WeakPolarHBondContact CA-O 3.47Å; F37-F50 WeakPolarHBondContact CD1-O 3.28Å; F50-N61 VanDerWaalsContact CE1-OD1 3.25Å; F50-N61 WeakPolarHBondContact CE1-OD1 3.49Å; F50-N61 WeakPolarHBondContact CZ-OD1 3.44Å
51	C	38.9	Very low	45.7	Very low	21 Å²	21	93.5 Å²	93.5	14%	0.142	48%	0.482	C	S	.	.			trans	-67.7	129.5	161.2	174.8	0	0	0	0	108.9	F37 V53 C54 G55	F37-C51 WeakPolarHBondContact CE1-O 3.41Å; C51-V53 PolarHBondContact O-N 3.3Å; C51-V53 VanDerWaalsContact O-N 3.1Å; C51-V53 VanDerWaalsContact SG-CB 3.58Å; C51-V53 PolarHBondContact SG-N 3.46Å; C51-V53 VanDerWaalsContact SG-N 3.41Å; C51-C54 HydrophobicContact CB-CB 4.37Å; C51-C54 PolarHBondContact O-N 2.65Å; C51-G55 VanDerWaalsContact O-CA 3.31Å; C51-G55 WeakPolarHBondContact O-CA 2.97Å; C51-G55 PolarHBondContact O-N 2.92Å
52	E	36.1	Very low	47.2	Very low	131 Å²	131	86.9 Å²	86.9	61%	0.612	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-31.4	175.7	-160.2	172.7	-179.9	0	0	112.8	F37	F37-E52 HydrophobicContact CD1-CB 4.08Å; F37-E52 HydrophobicContact CD1-CG 4.43Å; F37-E52 HydrophobicContact CD2-CG 4.31Å; F37-E52 HydrophobicContact CE1-CB 4.31Å; F37-E52 HydrophobicContact CE1-CG 4.43Å; F37-E52 HydrophobicContact CE2-CG 4.33Å; F37-E52 HydrophobicContact CG-CB 4.25Å; F37-E52 HydrophobicContact CG-CG 4.32Å; F37-E52 HydrophobicContact CZ-CG 4.34Å
53	V	36	Very low	48.4	Very low	125 Å²	125	86.2 Å²	86.2	76%	0.758	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-35.1	179.7	-171.6	0	0	0	0	112.9	C51	C51-V53 PolarHBondContact O-N 3.3Å; C51-V53 VanDerWaalsContact O-N 3.1Å; C51-V53 VanDerWaalsContact SG-CB 3.58Å; C51-V53 PolarHBondContact SG-N 3.46Å; C51-V53 VanDerWaalsContact SG-N 3.41Å
54	C	43.1	Very low	49.5	Very low	70 Å²	70	85.4 Å²	85.4	47%	0.473	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-13.1	-174.5	-48.8	0	0	0	0	114.1	C51 P56 L57 A58	C51-C54 HydrophobicContact CB-CB 4.37Å; C51-C54 PolarHBondContact O-N 2.65Å; C54-P56 VanDerWaalsContact C-CD 3.44Å; C54-L57 PolarHBondContact O-N 3.42Å; C54-A58 PolarHBondContact O-N 3.38Å
55	G	48.6	Very low	51.1	Low	1 Å²	1	81.7 Å²	81.7	1%	0.01	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-28.1	-163.1	0	0	0	0	0	116.7	C51 L57 N61	C51-G55 VanDerWaalsContact O-CA 3.31Å; C51-G55 WeakPolarHBondContact O-CA 2.97Å; C51-G55 PolarHBondContact O-N 2.92Å; G55-L57 VanDerWaalsContact C-N 3.31Å; G55-N61 PolarHBondContact O-ND2 3.01Å
56	P	51.2	Low	53.1	Low	98 Å²	98	76 Å²	76	64%	0.636	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-24.1	171	-19	31.5	0	0	0	113.9	C54	C54-P56 VanDerWaalsContact C-CD 3.44Å
57	L	54.2	Low	55.1	Low	154 Å²	154	79.3 Å²	79.3	81%	0.806	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.4	-171.6	-63.4	173.4	0	0	0	113.6	C54 G55 R59	C54-L57 PolarHBondContact O-N 3.42Å; G55-L57 VanDerWaalsContact C-N 3.31Å; L57-R59 PolarHBondContact O-N 3.23Å
58	A	62.5	Low	56.9	Low	26 Å²	26	74.5 Å²	74.5	22%	0.215	41%	0.408	C	S	.	.			trans	-71.2	119.2	-178.9	0	0	0	0	0	110.8	C54 S60 N61	C54-A58 PolarHBondContact O-N 3.38Å; A58-S60 PolarHBondContact O-N 3.15Å; A58-N61 WeakPolarHBondContact O-CB 3.39Å; A58-N61 PolarHBondContact O-N 2.91Å
59	R	67.9	Low	58.3	Low	183 Å²	183	72.5 Å²	72.5	69%	0.691	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-57.8	-23.5	-179.2	-71.4	-176.3	178.7	-178.7	-0.5	113.8	L57 N61 L62 G73 Q76	L57-R59 PolarHBondContact O-N 3.23Å; R59-N61 VanDerWaalsContact C-N 3.26Å; R59-N61 PolarHBondContact O-N 3.37Å; R59-L62 HydrophobicContact CB-CD1 4.29Å; R59-L62 VanDerWaalsContact O-CB 3.22Å; R59-L62 WeakPolarHBondContact O-CB 3.3Å; R59-L62 WeakPolarHBondContact O-CD1 2.82Å; R59-L62 WeakPolarHBondContact O-CG 3.15Å; R59-L62 PolarHBondContact O-N 3.41Å; R59-G73 VanDerWaalsContact O-CA 3.31Å; R59-G73 WeakPolarHBondContact O-CA 3.15Å; R59-Q76 HydrophobicContact CB-CG 4.13Å
60	S	63.9	Low	59.7	Low	0 Å²	0	75.4 Å²	75.4	0%	0	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-70.5	-17	173.1	49	0	0	0	0	115.9	Y49 A58 R77	Y49-S60 WeakPolarHBondContact CD1-OG 3.47Å; Y49-S60 WeakPolarHBondContact CE1-OG 3.45Å; Y49-S60 WeakPolarHBondContact OH-CB 3.39Å; Y49-S60 PolarHBondContact OH-OG 2.78Å; Y49-S60 VanDerWaalsContact OH-OG 3.05Å; A58-S60 PolarHBondContact O-N 3.15Å; S60-R77 WeakPolarHBondContact O-CD 3.47Å; S60-R77 PolarHBondContact O-NH1 2.98Å
61	N	61	Low	61.4	Low	29 Å²	29	80.2 Å²	80.2	16%	0.155	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-87.3	3.9	174.6	-69.5	-19.4	0	0	0	112.1	F50 G55 A58 R59 K63	F50-N61 VanDerWaalsContact CE1-OD1 3.25Å; F50-N61 WeakPolarHBondContact CE1-OD1 3.49Å; F50-N61 WeakPolarHBondContact CZ-OD1 3.44Å; G55-N61 PolarHBondContact O-ND2 3.01Å; A58-N61 WeakPolarHBondContact O-CB 3.39Å; A58-N61 PolarHBondContact O-N 2.91Å; R59-N61 VanDerWaalsContact C-N 3.26Å; R59-N61 PolarHBondContact O-N 3.37Å; N61-K63 WeakPolarHBondContact O-CG 3.4Å; N61-K63 PolarHBondContact O-N 3.05Å
62	L	69.8	Low	63.2	Low	64 Å²	64	81.6 Å²	81.6	34%	0.335	45%	0.454	S	S	.	.			trans	-70.1	80.9	168.4	-60	177.4	0	0	0	109.3	R59 I69 G73 R77	R59-L62 HydrophobicContact CB-CD1 4.29Å; R59-L62 VanDerWaalsContact O-CB 3.22Å; R59-L62 WeakPolarHBondContact O-CB 3.3Å; R59-L62 WeakPolarHBondContact O-CD1 2.82Å; R59-L62 WeakPolarHBondContact O-CG 3.15Å; R59-L62 PolarHBondContact O-N 3.41Å; L62-I69 HydrophobicContact CB-CG2 3.72Å; L62-I69 WeakPolarHBondContact CB-O 3.1Å; L62-I69 HydrophobicContact CD1-CG2 4.27Å; L62-I69 HydrophobicContact CD2-CG2 3.88Å; L62-I69 HydrophobicContact CG-CG2 4.14Å; L62-G73 WeakPolarHBondContact O-CA 3.49Å; L62-R77 PolarHBondContact O-NH1 2.46Å
63	K	64.9	Low	65.1	Low	55 Å²	55	75.4 Å²	75.4	24%	0.239	43%	0.425	C	S	.	.			trans	-111	-17.8	-179.4	-46.1	-160.5	-177.6	-162.7	0	112.5	Y12 N61	Y12-K63 PolarHBondContact OH-NZ 3.02Å; N61-K63 WeakPolarHBondContact O-CG 3.4Å; N61-K63 PolarHBondContact O-N 3.05Å
64	T	61.5	Low	66.8	Low	62 Å²	62	71.1 Å²	71.1	38%	0.38	40%	0.403	S	S	.	.	S	Bend	trans	-124.4	162.1	-179.8	57.8	0	0	0	0	110	C33 I69	C33-T64 PolarHBondContact SG-OG1 2.85Å; T64-I69 WeakPolarHBondContact O-CG2 3.49Å
65	G	69.4	Low	68.5	Low	53 Å²	53	72 Å²	72	55%	0.546	40%	0.402	S	S	.	.	S	Bend	trans	104.9	-157.8	-174.9	0	0	0	0	0	113.6	K70	G65-K70 VanDerWaalsContact O-CE 3.3Å; G65-K70 WeakPolarHBondContact O-CE 3.41Å
66	S	78.8	Confident	69.6	Low	66 Å²	66	74.4 Å²	74.4	46%	0.462	41%	0.413	S	S	.	.	S	Bend	trans	-64.4	157.2	-177	69.3	0	0	0	0	112.3	N68 I69 K70	S66-N68 PolarHBondContact O-N 3.47Å; S66-I69 WeakPolarHBondContact O-CB 3.39Å; S66-I69 PolarHBondContact O-N 3.29Å; S66-I69 WeakPolarHBondContact OG-CG1 3.39Å; S66-K70 PolarHBondContact O-N 3.01Å
67	T	80	Confident	70.6	Confident	115 Å²	115	70.7 Å²	70.7	71%	0.706	39%	0.387	S	S	*	.	H	α-helix	trans	-52.7	-40.9	-179.3	-47.6	0	0	0	0	112.3	I69 K70 H71	T67-I69 PolarHBondContact O-N 3.02Å; T67-K70 PolarHBondContact O-N 3Å; T67-H71 WeakPolarHBondContact O-CB 2.98Å; T67-H71 PolarHBondContact O-N 3.24Å
68	N	79.3	Confident	71.4	Confident	134 Å²	134	68.4 Å²	68.4	72%	0.717	37%	0.372	S	S	*	.	H	α-helix	trans	-64	-39.5	178	-67.7	-13.7	0	0	0	112.5	S66 H71 A72	S66-N68 PolarHBondContact O-N 3.47Å; N68-H71 PolarHBondContact O-N 3.13Å; N68-A72 WeakPolarHBondContact O-CB 3.15Å; N68-A72 PolarHBondContact O-N 2.8Å
69	I	73	Confident	71.7	Confident	70 Å²	70	71.4 Å²	71.4	36%	0.359	38%	0.384	S	S	.	.	H	α-helix	trans	-66.4	-45.1	178.1	-73.2	-176	0	0	0	110.5	L62 T64 S66 T67 H71 A72 G73	L62-I69 HydrophobicContact CB-CG2 3.72Å; L62-I69 WeakPolarHBondContact CB-O 3.1Å; L62-I69 HydrophobicContact CD1-CG2 4.27Å; L62-I69 HydrophobicContact CD2-CG2 3.88Å; L62-I69 HydrophobicContact CG-CG2 4.14Å; T64-I69 WeakPolarHBondContact O-CG2 3.49Å; S66-I69 WeakPolarHBondContact O-CB 3.39Å; S66-I69 PolarHBondContact O-N 3.29Å; S66-I69 WeakPolarHBondContact OG-CG1 3.39Å; T67-I69 PolarHBondContact O-N 3.02Å; I69-H71 VanDerWaalsContact C-N 3.32Å; I69-H71 PolarHBondContact O-N 2.94Å; I69-A72 PolarHBondContact O-N 3.42Å; I69-G73 PolarHBondContact O-N 3.29Å
70	K	72.5	Confident	71.7	Confident	104 Å²	104	63.2 Å²	63.2	45%	0.452	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-43.3	176.2	-66.6	-178.3	176.4	177.7	0	111.8	G65 S66 T67 G73 A74	G65-K70 VanDerWaalsContact O-CE 3.3Å; G65-K70 WeakPolarHBondContact O-CE 3.41Å; S66-K70 PolarHBondContact O-N 3.01Å; T67-K70 PolarHBondContact O-N 3Å; K70-G73 PolarHBondContact O-N 3.49Å; K70-A74 WeakPolarHBondContact O-CB 3.33Å; K70-A74 PolarHBondContact O-N 3.22Å
71	H	77.2	Confident	71.6	Confident	124 Å²	124	66.7 Å²	66.7	57%	0.574	37%	0.367	S	S	*	.	H	α-helix	trans	-65.5	-42.7	178.6	-165.8	-73.7	0	0	0	112	T67 N68 I69 G73 A74 L75	T67-H71 WeakPolarHBondContact O-CB 2.98Å; T67-H71 PolarHBondContact O-N 3.24Å; N68-H71 PolarHBondContact O-N 3.13Å; I69-H71 VanDerWaalsContact C-N 3.32Å; I69-H71 PolarHBondContact O-N 2.94Å; H71-G73 VanDerWaalsContact C-N 3.32Å; H71-G73 PolarHBondContact O-N 2.92Å; H71-A74 PolarHBondContact O-N 3.05Å; H71-L75 WeakPolarHBondContact O-CB 3.36Å; H71-L75 PolarHBondContact O-N 2.96Å
72	A	76.4	Confident	71.8	Confident	50 Å²	50	71.5 Å²	71.5	41%	0.413	39%	0.391	S	S	.	.	H	α-helix	trans	-61.3	-42.1	175.4	0	0	0	0	0	111.8	N68 I69 L75 Q76	N68-A72 WeakPolarHBondContact O-CB 3.15Å; N68-A72 PolarHBondContact O-N 2.8Å; I69-A72 PolarHBondContact O-N 3.42Å; A72-L75 PolarHBondContact O-N 3.37Å; A72-Q76 WeakPolarHBondContact O-CB 3.42Å; A72-Q76 PolarHBondContact O-N 2.85Å
73	G	75.6	Confident	71.5	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-63.5	-42.6	174.3	0	0	0	0	0	112.9	R59 L62 I69 K70 H71 Q76 R77	R59-G73 VanDerWaalsContact O-CA 3.31Å; R59-G73 WeakPolarHBondContact O-CA 3.15Å; L62-G73 WeakPolarHBondContact O-CA 3.49Å; I69-G73 PolarHBondContact O-N 3.29Å; K70-G73 PolarHBondContact O-N 3.49Å; H71-G73 VanDerWaalsContact C-N 3.32Å; H71-G73 PolarHBondContact O-N 2.92Å; G73-Q76 PolarHBondContact O-N 2.47Å; G73-R77 VanDerWaalsContact O-CG 3.3Å; G73-R77 WeakPolarHBondContact O-CG 3.42Å; G73-R77 PolarHBondContact O-N 3.14Å; G73-R77 PolarHBondContact O-NH1 3.24Å
74	A	72.4	Confident	71	Confident	35 Å²	35	69.6 Å²	69.6	29%	0.289	40%	0.396	S	S	.	.	H	α-helix	trans	-62.4	-46.1	177.2	0	0	0	0	0	111.6	K70 H71 Q76 R77 Q78	K70-A74 WeakPolarHBondContact O-CB 3.33Å; K70-A74 PolarHBondContact O-N 3.22Å; H71-A74 PolarHBondContact O-N 3.05Å; A74-Q76 VanDerWaalsContact C-N 3.32Å; A74-Q76 PolarHBondContact O-N 3.17Å; A74-R77 VanDerWaalsContact CA-NH2 3.31Å; A74-R77 PolarHBondContact O-N 2.88Å; A74-Q78 WeakPolarHBondContact O-CB 3.44Å; A74-Q78 PolarHBondContact O-N 3.3Å
75	L	77.5	Confident	70.8	Confident	88 Å²	88	67.4 Å²	67.4	46%	0.461	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-42.4	177.4	-154.2	97.3	0	0	0	111.4	H71 A72 Q78 L79	H71-L75 WeakPolarHBondContact O-CB 3.36Å; H71-L75 PolarHBondContact O-N 2.96Å; A72-L75 PolarHBondContact O-N 3.37Å; L75-Q78 WeakPolarHBondContact O-CB 3.12Å; L75-Q78 PolarHBondContact O-N 3.05Å; L75-L79 WeakPolarHBondContact O-CG 3.31Å; L75-L79 PolarHBondContact O-N 3.41Å
76	Q	73.1	Confident	70	Confident	52 Å²	52	65.2 Å²	65.2	24%	0.243	36%	0.359	C	S	.	.	H	α-helix	trans	-61.2	-51.6	175.5	-170.8	62.1	56.8	0	0	110.1	R59 A72 G73 A74 Q78 L79 D80	R59-Q76 HydrophobicContact CB-CG 4.13Å; A72-Q76 WeakPolarHBondContact O-CB 3.42Å; A72-Q76 PolarHBondContact O-N 2.85Å; G73-Q76 PolarHBondContact O-N 2.47Å; A74-Q76 VanDerWaalsContact C-N 3.32Å; A74-Q76 PolarHBondContact O-N 3.17Å; Q76-Q78 PolarHBondContact O-N 3.09Å; Q76-Q78 VanDerWaalsContact O-N 3.13Å; Q76-L79 WeakPolarHBondContact O-CA 3.41Å; Q76-L79 WeakPolarHBondContact O-CB 3.48Å; Q76-L79 PolarHBondContact O-N 3.1Å; Q76-D80 PolarHBondContact NE2-OD1 3.24Å; Q76-D80 PolarHBondContact O-N 3.24Å
77	R	72.2	Confident	68.4	Low	20 Å²	20	64 Å²	64	8%	0.075	35%	0.347	C	S	.	.	H	α-helix	trans	-54.2	-36	177	-71.6	-176.6	-63.3	-85.7	3.5	112.5	E10 Y12 S60 L62 G73 A74 D80 W81	E10-R77 IonicContact OE1-CZ 3.76Å; E10-R77 IonicContact OE1-NE 2.85Å; E10-R77 PolarHBondContact OE1-NE 3.06Å; E10-R77 IonicContact OE1-NH2 3.92Å; E10-R77 PolarHBondContact OE1-NH2 3.28Å; E10-R77 WeakPolarHBondContact OE2-CD 3.31Å; E10-R77 IonicContact OE2-CZ 3.16Å; E10-R77 IonicContact OE2-NE 2.89Å; E10-R77 PolarHBondContact OE2-NE 3.21Å; E10-R77 IonicContact OE2-NH2 2.63Å; Y12-R77 HydrophobicContact CE1-CB 4.32Å; Y12-R77 HydrophobicContact CE1-CG 4.47Å; Y12-R77 WeakPolarHBondContact OH-CD 3.47Å; S60-R77 WeakPolarHBondContact O-CD 3.47Å; S60-R77 PolarHBondContact O-NH1 2.98Å; L62-R77 PolarHBondContact O-NH1 2.46Å; G73-R77 VanDerWaalsContact O-CG 3.3Å; G73-R77 WeakPolarHBondContact O-CG 3.42Å; G73-R77 PolarHBondContact O-N 3.14Å; G73-R77 PolarHBondContact O-NH1 3.24Å; A74-R77 VanDerWaalsContact CA-NH2 3.31Å; A74-R77 PolarHBondContact O-N 2.88Å; R77-D80 WeakPolarHBondContact CA-OD2 3.37Å; R77-D80 PolarHBondContact N-OD2 3.36Å; R77-W81 WeakPolarHBondContact O-CB 3.25Å; R77-W81 PolarHBondContact O-N 3.34Å
78	Q	69.5	Low	66.8	Low	107 Å²	107	59.6 Å²	59.6	50%	0.5	32%	0.32	S	S	.	.	H	α-helix	trans	-71.7	-41.9	176.5	-156.2	176.4	13.6	0	0	112.4	A74 L75 Q76 D80 W81 I82	A74-Q78 WeakPolarHBondContact O-CB 3.44Å; A74-Q78 PolarHBondContact O-N 3.3Å; L75-Q78 WeakPolarHBondContact O-CB 3.12Å; L75-Q78 PolarHBondContact O-N 3.05Å; Q76-Q78 PolarHBondContact O-N 3.09Å; Q76-Q78 VanDerWaalsContact O-N 3.13Å; Q78-D80 VanDerWaalsContact C-N 3.3Å; Q78-D80 PolarHBondContact O-N 2.77Å; Q78-W81 WeakPolarHBondContact O-CB 3.32Å; Q78-W81 PolarHBondContact O-N 2.96Å; Q78-I82 VanDerWaalsContact O-CG1 3.3Å; Q78-I82 WeakPolarHBondContact O-CG1 3.03Å; Q78-I82 PolarHBondContact O-N 3.26Å
79	L	70.3	Confident	65.3	Low	88 Å²	88	55.8 Å²	55.8	46%	0.461	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-42.1	172.1	-77.7	167.7	0	0	0	111.5	L75 Q76 W81 I82 A83	L75-L79 WeakPolarHBondContact O-CG 3.31Å; L75-L79 PolarHBondContact O-N 3.41Å; Q76-L79 WeakPolarHBondContact O-CA 3.41Å; Q76-L79 WeakPolarHBondContact O-CB 3.48Å; Q76-L79 PolarHBondContact O-N 3.1Å; L79-W81 VanDerWaalsContact C-N 3.28Å; L79-W81 PolarHBondContact O-N 2.87Å; L79-I82 PolarHBondContact O-N 3.05Å; L79-A83 VanDerWaalsContact O-CB 3.29Å; L79-A83 WeakPolarHBondContact O-CB 2.96Å; L79-A83 PolarHBondContact O-N 2.9Å
80	D	66.3	Low	64.1	Low	11 Å²	11	54.2 Å²	54.2	6%	0.059	30%	0.297	C	S	.	.	H	α-helix	trans	-65.1	-37.5	179.2	-56.1	-48.2	0	0	0	111.5	Y49 Q76 R77 Q78 G84 T85 T86	Y49-D80 HydrophobicContact CE1-CB 4.1Å; Y49-D80 WeakPolarHBondContact CE1-OD2 3.22Å; Y49-D80 HydrophobicContact CE2-CB 4.38Å; Y49-D80 PolarHBondContact OH-OD1 3.46Å; Y49-D80 VanDerWaalsContact OH-OD1 3.05Å; Y49-D80 PolarHBondContact OH-OD2 2.99Å; Q76-D80 PolarHBondContact NE2-OD1 3.24Å; Q76-D80 PolarHBondContact O-N 3.24Å; R77-D80 WeakPolarHBondContact CA-OD2 3.37Å; R77-D80 PolarHBondContact N-OD2 3.36Å; Q78-D80 VanDerWaalsContact C-N 3.3Å; Q78-D80 PolarHBondContact O-N 2.77Å; D80-G84 PolarHBondContact O-N 3.29Å; D80-T85 WeakPolarHBondContact CA-OG1 3.48Å; D80-T85 WeakPolarHBondContact CB-OG1 3.29Å; D80-T85 WeakPolarHBondContact O-CA 3.47Å; D80-T85 PolarHBondContact O-N 2.72Å; D80-T85 PolarHBondContact O-OG1 3.44Å; D80-T85 VanDerWaalsContact O-OG1 3.14Å; D80-T85 PolarHBondContact OD1-OG1 2.89Å; D80-T86 HydrophobicContact CB-CG2 3.75Å; D80-T86 PolarHBondContact O-N 2.93Å
81	W	62.3	Low	62.8	Low	74 Å²	74	52.8 Å²	52.8	28%	0.28	29%	0.294	S	S	.	.	H	α-helix	trans	-60.1	-52	174.1	174.8	-93.5	0	0	0	110.8	Y15 R77 Q78 L79 A83 G84 T86 P88	Y15-W81 HydrophobicContact CD2-CH2 4.09Å; Y15-W81 HydrophobicContact CD2-CZ3 4.26Å; Y15-W81 AromaticContact CE2-CH2 3.37Å; Y15-W81 HydrophobicContact CE2-CH2 3.37Å; Y15-W81 HydrophobicContact CE2-CZ2 4.32Å; Y15-W81 AromaticContact CE2-CZ3 3.98Å; Y15-W81 HydrophobicContact CE2-CZ3 3.98Å; Y15-W81 AromaticContact CZ-CH2 3.97Å; R77-W81 WeakPolarHBondContact O-CB 3.25Å; R77-W81 PolarHBondContact O-N 3.34Å; Q78-W81 WeakPolarHBondContact O-CB 3.32Å; Q78-W81 PolarHBondContact O-N 2.96Å; L79-W81 VanDerWaalsContact C-N 3.28Å; L79-W81 PolarHBondContact O-N 2.87Å; W81-A83 VanDerWaalsContact C-N 3.31Å; W81-A83 PolarHBondContact O-N 3.44Å; W81-G84 PolarHBondContact O-N 3.43Å; W81-G84 VanDerWaalsContact O-N 3.15Å; W81-T86 VanDerWaalsContact CA-CG2 3.49Å; W81-T86 WeakPolarHBondContact CA-OG1 3.44Å; W81-T86 HydrophobicContact CB-CG2 3.98Å; W81-T86 HydrophobicContact CE3-CG2 4.37Å; W81-T86 VanDerWaalsContact N-CG2 3.3Å; W81-P88 HydrophobicContact CE3-CG 4.43Å; W81-P88 HydrophobicContact CH2-CG 4.2Å; W81-P88 HydrophobicContact CZ3-CG 3.51Å
82	I	64.8	Low	61.5	Low	130 Å²	130	50.2 Å²	50.2	67%	0.667	29%	0.287	S	S	*	.	H	α-helix	trans	-61.8	-41.2	-179.2	-66.3	164.4	0	0	0	111.1	Q78 L79 G84	Q78-I82 VanDerWaalsContact O-CG1 3.3Å; Q78-I82 WeakPolarHBondContact O-CG1 3.03Å; Q78-I82 PolarHBondContact O-N 3.26Å; L79-I82 PolarHBondContact O-N 3.05Å; I82-G84 PolarHBondContact O-N 2.73Å
83	A	63.6	Low	60.1	Low	68 Å²	68	55.1 Å²	55.1	56%	0.562	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	4.8	-178.6	0	0	0	0	0	113.6	L79 W81 T85	L79-A83 VanDerWaalsContact O-CB 3.29Å; L79-A83 WeakPolarHBondContact O-CB 2.96Å; L79-A83 PolarHBondContact O-N 2.9Å; W81-A83 VanDerWaalsContact C-N 3.31Å; W81-A83 PolarHBondContact O-N 3.44Å; A83-T85 HydrophobicContact CB-CG2 3.74Å; A83-T85 WeakPolarHBondContact O-CG2 3.43Å; A83-T85 PolarHBondContact O-N 3.18Å
84	G	55.1	Low	58.6	Low	11 Å²	11	57.3 Å²	57.3	11%	0.113	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	26.4	-177.9	0	0	0	0	0	112.3	R48 D80 W81 I82	R48-G84 PolarHBondContact NH1-O 3.32Å; D80-G84 PolarHBondContact O-N 3.29Å; W81-G84 PolarHBondContact O-N 3.43Å; W81-G84 VanDerWaalsContact O-N 3.15Å; I82-G84 PolarHBondContact O-N 2.73Å
85	T	56.9	Low	57.5	Low	16 Å²	16	63 Å²	63	10%	0.098	32%	0.324	C	S	.	.			trans	-97.3	1.3	178.4	77.1	0	0	0	0	112.7	R48 D80 A83	R48-T85 WeakPolarHBondContact CB-O 3.44Å; R48-T85 WeakPolarHBondContact CD-O 3.5Å; R48-T85 WeakPolarHBondContact CG-O 3.14Å; D80-T85 WeakPolarHBondContact CA-OG1 3.48Å; D80-T85 WeakPolarHBondContact CB-OG1 3.29Å; D80-T85 WeakPolarHBondContact O-CA 3.47Å; D80-T85 PolarHBondContact O-N 2.72Å; D80-T85 PolarHBondContact O-OG1 3.44Å; D80-T85 VanDerWaalsContact O-OG1 3.14Å; D80-T85 PolarHBondContact OD1-OG1 2.89Å; A83-T85 HydrophobicContact CB-CG2 3.74Å; A83-T85 WeakPolarHBondContact O-CG2 3.43Å; A83-T85 PolarHBondContact O-N 3.18Å
86	T	52.2	Low	56.2	Low	7 Å²	7	64 Å²	64	4%	0.043	33%	0.327	C	S	.	.	S	Bend	trans	-86.1	156.7	175.4	47.4	0	0	0	0	115	D80 W81 D89 A90	D80-T86 HydrophobicContact CB-CG2 3.75Å; D80-T86 PolarHBondContact O-N 2.93Å; W81-T86 VanDerWaalsContact CA-CG2 3.49Å; W81-T86 WeakPolarHBondContact CA-OG1 3.44Å; W81-T86 HydrophobicContact CB-CG2 3.98Å; W81-T86 HydrophobicContact CE3-CG2 4.37Å; W81-T86 VanDerWaalsContact N-CG2 3.3Å; T86-D89 PolarHBondContact O-N 2.92Å; T86-D89 VanDerWaalsContact O-N 3.14Å; T86-A90 PolarHBondContact O-N 2.96Å; T86-A90 VanDerWaalsContact O-N 3.08Å
87	L	46.8	Very low	54.9	Low	41 Å²	41	63.9 Å²	63.9	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-44.8	-47.1	-176.3	-145.5	93.4	0	0	0	116.3	Y38 D89 A90 L91	Y38-L87 HydrophobicContact CD2-CD2 4.43Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 2.89Å; L87-A90 PolarHBondContact O-N 3.15Å; L87-L91 HydrophobicContact CD2-CD1 3.89Å; L87-L91 HydrophobicContact CG-CD1 4Å; L87-L91 VanDerWaalsContact O-CB 3.29Å; L87-L91 WeakPolarHBondContact O-CB 3.43Å; L87-L91 PolarHBondContact O-N 3.39Å
88	P	46.8	Very low	53.6	Low	21 Å²	21	68.1 Å²	68.1	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-70.5	-31.7	-177.2	21.1	-25.3	0	0	0	112.4	Y15 W81 T92	Y15-P88 HydrophobicContact CD1-CB 4.34Å; Y15-P88 HydrophobicContact CD2-CB 4.39Å; Y15-P88 HydrophobicContact CD2-CG 4.14Å; Y15-P88 HydrophobicContact CG-CB 4.05Å; Y15-P88 HydrophobicContact CG-CG 4.27Å; W81-P88 HydrophobicContact CE3-CG 4.43Å; W81-P88 HydrophobicContact CH2-CG 4.2Å; W81-P88 HydrophobicContact CZ3-CG 3.51Å; P88-T92 WeakPolarHBondContact O-CB 3.37Å; P88-T92 PolarHBondContact O-N 2.98Å; P88-T92 PolarHBondContact O-OG1 2.63Å
89	D	47	Very low	52.8	Low	54 Å²	54	68.2 Å²	68.2	29%	0.289	36%	0.359	S	S	.	.	H	α-helix	trans	-71.1	-41.5	172.8	-116.4	45.6	0	0	0	110.6	T86 L87 R93	T86-D89 PolarHBondContact O-N 2.92Å; T86-D89 VanDerWaalsContact O-N 3.14Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 2.89Å; D89-R93 WeakPolarHBondContact O-CB 3.41Å; D89-R93 WeakPolarHBondContact O-CG 3.47Å; D89-R93 PolarHBondContact O-N 2.93Å; D89-R93 IonicContact OD2-CZ 3.58Å; D89-R93 IonicContact OD2-NE 3.24Å; D89-R93 PolarHBondContact OD2-NE 3Å; D89-R93 IonicContact OD2-NH2 2.98Å; D89-R93 PolarHBondContact OD2-NH2 2.94Å
90	A	47.3	Very low	51.7	Low	38 Å²	38	71.9 Å²	71.9	31%	0.314	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-39.2	176.8	0	0	0	0	0	113	T86 L87 S94	T86-A90 PolarHBondContact O-N 2.96Å; T86-A90 VanDerWaalsContact O-N 3.08Å; L87-A90 PolarHBondContact O-N 3.15Å; A90-S94 WeakPolarHBondContact O-CB 3.45Å; A90-S94 PolarHBondContact O-N 3.41Å; A90-S94 PolarHBondContact O-OG 3.2Å
91	L	45.6	Very low	50.5	Low	73 Å²	73	79.9 Å²	79.9	38%	0.382	40%	0.399	S	S	.	.	H	α-helix	trans	-72.7	-40.4	175.7	-99.9	151.1	0	0	0	112.3	L87 S94 R95	L87-L91 HydrophobicContact CD2-CD1 3.89Å; L87-L91 HydrophobicContact CG-CD1 4Å; L87-L91 VanDerWaalsContact O-CB 3.29Å; L87-L91 WeakPolarHBondContact O-CB 3.43Å; L87-L91 PolarHBondContact O-N 3.39Å; L91-S94 PolarHBondContact O-OG 3.43Å; L91-R95 VanDerWaalsContact O-CB 3.31Å; L91-R95 WeakPolarHBondContact O-CB 3.47Å; L91-R95 VanDerWaalsContact O-CG 3.28Å; L91-R95 WeakPolarHBondContact O-CG 3.08Å; L91-R95 PolarHBondContact O-N 2.85Å
92	T	49.3	Very low	49.9	Very low	71 Å²	71	78.1 Å²	78.1	44%	0.436	40%	0.404	S	S	.	.	H	α-helix	trans	-66.7	-48.4	176.4	-58	0	0	0	0	109.6	P88 S94 R95 E96	P88-T92 WeakPolarHBondContact O-CB 3.37Å; P88-T92 PolarHBondContact O-N 2.98Å; P88-T92 PolarHBondContact O-OG1 2.63Å; T92-S94 VanDerWaalsContact C-N 3.34Å; T92-S94 PolarHBondContact O-N 2.96Å; T92-R95 PolarHBondContact O-N 3.42Å; T92-E96 WeakPolarHBondContact O-CB 3.25Å; T92-E96 WeakPolarHBondContact O-CG 3.48Å; T92-E96 PolarHBondContact O-N 3.09Å
93	R	48.1	Very low	49.3	Very low	152 Å²	152	77.8 Å²	77.8	57%	0.574	40%	0.403	S	S	*	.	H	α-helix	trans	-65.4	-34.3	176.3	-68.3	179.3	-163.4	-117.1	5.7	112.9	D89 A97	D89-R93 WeakPolarHBondContact O-CB 3.41Å; D89-R93 WeakPolarHBondContact O-CG 3.47Å; D89-R93 PolarHBondContact O-N 2.93Å; D89-R93 IonicContact OD2-CZ 3.58Å; D89-R93 IonicContact OD2-NE 3.24Å; D89-R93 PolarHBondContact OD2-NE 3Å; D89-R93 IonicContact OD2-NH2 2.98Å; D89-R93 PolarHBondContact OD2-NH2 2.94Å; R93-A97 WeakPolarHBondContact O-CB 3.3Å; R93-A97 PolarHBondContact O-N 3.48Å
94	S	43.8	Very low	48.5	Very low	46 Å²	46	83.8 Å²	83.8	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-71.2	-36.4	175.2	79.3	0	0	0	0	112.1	A90 L91 T92 M98	A90-S94 WeakPolarHBondContact O-CB 3.45Å; A90-S94 PolarHBondContact O-N 3.41Å; A90-S94 PolarHBondContact O-OG 3.2Å; L91-S94 PolarHBondContact O-OG 3.43Å; T92-S94 VanDerWaalsContact C-N 3.34Å; T92-S94 PolarHBondContact O-N 2.96Å; S94-M98 WeakPolarHBondContact O-CB 3.47Å; S94-M98 PolarHBondContact O-N 2.9Å
95	R	48.2	Very low	48	Very low	155 Å²	155	92 Å²	92	59%	0.585	45%	0.446	S	S	*	.	H	α-helix	trans	-65.5	-46.1	171.9	-79.3	177.2	174.7	178.6	-1.2	111.7	L91 T92 A97 M98 I99	L91-R95 VanDerWaalsContact O-CB 3.31Å; L91-R95 WeakPolarHBondContact O-CB 3.47Å; L91-R95 VanDerWaalsContact O-CG 3.28Å; L91-R95 WeakPolarHBondContact O-CG 3.08Å; L91-R95 PolarHBondContact O-N 2.85Å; T92-R95 PolarHBondContact O-N 3.42Å; R95-A97 VanDerWaalsContact C-N 3.34Å; R95-A97 PolarHBondContact O-N 3.37Å; R95-M98 PolarHBondContact O-N 3.46Å; R95-I99 WeakPolarHBondContact O-CG1 3.11Å; R95-I99 PolarHBondContact O-N 2.78Å
96	E	50.5	Low	47.3	Very low	109 Å²	109	102.7 Å²	102.7	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-59.5	-44.5	174.7	-74.4	173.6	169.4	0	0	111.4	T92 M98 I99 Y100	T92-E96 WeakPolarHBondContact O-CB 3.25Å; T92-E96 WeakPolarHBondContact O-CG 3.48Å; T92-E96 PolarHBondContact O-N 3.09Å; E96-M98 VanDerWaalsContact C-N 3.33Å; E96-M98 PolarHBondContact O-N 2.81Å; E96-I99 PolarHBondContact O-N 3.18Å; E96-Y100 PolarHBondContact O-N 3.06Å
97	A	47	Very low	47	Very low	49 Å²	49	107.5 Å²	107.5	41%	0.405	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-36.5	175.8	0	0	0	0	0	112.4	R93 R95 Y100 Y101	R93-A97 WeakPolarHBondContact O-CB 3.3Å; R93-A97 PolarHBondContact O-N 3.48Å; R95-A97 VanDerWaalsContact C-N 3.34Å; R95-A97 PolarHBondContact O-N 3.37Å; A97-Y100 PolarHBondContact O-N 2.97Å; A97-Y101 WeakPolarHBondContact O-CB 3.48Å; A97-Y101 PolarHBondContact O-N 3Å
98	M	44.9	Very low	47	Very low	109 Å²	109	110.9 Å²	110.9	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-38.6	176.1	-116.7	-164	-78.4	0	0	112.5	T42 S94 R95 E96 Y101 G102	T42-M98 HydrophobicContact CG2-CE 3.83Å; T42-M98 HydrophobicContact CG2-SD 4.4Å; S94-M98 WeakPolarHBondContact O-CB 3.47Å; S94-M98 PolarHBondContact O-N 2.9Å; R95-M98 PolarHBondContact O-N 3.46Å; E96-M98 VanDerWaalsContact C-N 3.33Å; E96-M98 PolarHBondContact O-N 2.81Å; M98-Y101 PolarHBondContact O-N 3.11Å; M98-G102 PolarHBondContact O-N 3.03Å
99	I	52.2	Low	47	Very low	109 Å²	109	115.9 Å²	115.9	56%	0.559	55%	0.554	S	S	*	*	H	α-helix	trans	-61.9	-48.3	174	-67.5	164.8	0	0	0	109.2	R95 E96 Y101 G102 D103	R95-I99 WeakPolarHBondContact O-CG1 3.11Å; R95-I99 PolarHBondContact O-N 2.78Å; E96-I99 PolarHBondContact O-N 3.18Å; I99-Y101 VanDerWaalsContact C-N 3.33Å; I99-Y101 PolarHBondContact O-N 3.35Å; I99-G102 PolarHBondContact O-N 3.02Å; I99-D103 PolarHBondContact O-N 2.91Å
100	Y	47.6	Very low	47	Very low	165 Å²	165	119.6 Å²	119.6	65%	0.647	57%	0.57	S	S	*	*	H	α-helix	trans	-58.6	-40.8	175.7	-104.7	-82.2	0	0	0	113.3	E96 A97 Y104	E96-Y100 PolarHBondContact O-N 3.06Å; A97-Y100 PolarHBondContact O-N 2.97Å; Y100-Y104 WeakPolarHBondContact O-CD2 3.46Å; Y100-Y104 PolarHBondContact O-N 3.05Å
101	Y	41.1	Very low	47	Very low	179 Å²	179	124.7 Å²	124.7	70%	0.702	59%	0.586	S	S	*	*	H	α-helix	trans	-73.9	-29.5	177.8	-104.3	-81	0	0	0	113.5	A97 M98 I99	A97-Y101 WeakPolarHBondContact O-CB 3.48Å; A97-Y101 PolarHBondContact O-N 3Å; M98-Y101 PolarHBondContact O-N 3.11Å; I99-Y101 VanDerWaalsContact C-N 3.33Å; I99-Y101 PolarHBondContact O-N 3.35Å
102	G	48.6	Very low	47.1	Very low	38 Å²	38	128.1 Å²	128.1	39%	0.392	60%	0.599	S	S	.	*	H	α-helix	trans	-70	-41.2	174.6	0	0	0	0	0	112	M98 I99 Y104 K105	M98-G102 PolarHBondContact O-N 3.03Å; I99-G102 PolarHBondContact O-N 3.02Å; G102-Y104 PolarHBondContact O-N 2.63Å; G102-K105 PolarHBondContact O-N 3.09Å
103	D	52.6	Low	47	Very low	122 Å²	122	132.2 Å²	132.2	65%	0.652	61%	0.611	S	S	*	*	H	α-helix	trans	-67.8	-23.6	176.8	-74.6	-15.9	0	0	0	112.9	I99 K105	I99-D103 PolarHBondContact O-N 2.91Å; D103-K105 VanDerWaalsContact C-N 3.33Å
104	Y	46.8	Very low	46.9	Very low	195 Å²	195	130.7 Å²	130.7	77%	0.765	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-3.8	175.5	-102	-91.4	0	0	0	114.6	Y100 G102	Y100-Y104 WeakPolarHBondContact O-CD2 3.46Å; Y100-Y104 PolarHBondContact O-N 3.05Å; G102-Y104 PolarHBondContact O-N 2.63Å
105	K	45.9	Very low	47.1	Very low	183 Å²	183	137.8 Å²	137.8	80%	0.796	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	12.5	-177.9	-90.6	-166.8	176.1	-175.8	0	114.9	G102 D103	G102-K105 PolarHBondContact O-N 3.09Å; D103-K105 VanDerWaalsContact C-N 3.33Å
106	H	40.6	Very low	47	Very low	240 Å²	240	136.2 Å²	136.2	100%	1.111	64%	0.643	S	S	*	*			trans	-118.8	0	169.1	-79.8	-54.3	0	0	0	111.1

Retrieved 106 of 106 residues in 20.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).