G4LWS5_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4LWS5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 117 aa.

						>G4LWS5_SCHMA|G4LWS5
MKKEARTLFRQNAHITDEIEIENHIKEAEARIELTLHYGTPYPRLSNLPPNTLAAYMITSTKRSTPPPSSSLSSESLTTTNNSNSTHEKRRISRRTERALYESVPSYLKSYSYRPKK
					

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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	85.3	Confident	94.3	Very high	100 Å²	100	115.4 Å²	115.4	49%	0.493	52%	0.519	S	S	.	.				0	-65	0	-153.6	-178.6	-173.1	0	0	113.6	K3 E4 A5 R31 P41	M1-K3 PolarHBondContact O-N 2.78Å; M1-K3 VanDerWaalsContact O-N 3.14Å; M1-E4 WeakPolarHBondContact O-CB 3.49Å; M1-E4 PolarHBondContact O-N 3.32Å; M1-A5 PolarHBondContact O-N 3.18Å; M1-R31 HydrophobicContact CE-CB 3.88Å; M1-P41 HydrophobicContact CB-CG 4.37Å; M1-P41 HydrophobicContact CE-CB 3.65Å; M1-P41 HydrophobicContact CE-CG 4.44Å; M1-P41 HydrophobicContact CG-CB 4.31Å; M1-P41 HydrophobicContact CG-CG 4.11Å; M1-P41 HydrophobicContact SD-CB 3.76Å; M1-P41 HydrophobicContact SD-CG 3.99Å
2	K	90.8	Very high	94.4	Very high	185 Å²	185	109.8 Å²	109.8	80%	0.804	50%	0.497	S	S	*	.	H	α-helix	trans	-49.2	-46.5	-174	-66.8	-174.2	179.4	-178	0	115.7	R6	K2-R6 WeakPolarHBondContact O-CG 3.31Å; K2-R6 PolarHBondContact O-N 2.79Å; K2-R6 VanDerWaalsContact O-N 3.13Å
3	K	94.8	Very high	94.5	Very high	176 Å²	176	107.8 Å²	107.8	77%	0.765	51%	0.512	S	S	*	.	H	α-helix	trans	-63.1	-43.4	178.1	-71.2	-176.9	179.2	-178.5	0	112.4	M1 R6 T7	M1-K3 PolarHBondContact O-N 2.78Å; M1-K3 VanDerWaalsContact O-N 3.14Å; K3-R6 PolarHBondContact O-N 3.4Å; K3-T7 PolarHBondContact O-N 3.11Å; K3-T7 VanDerWaalsContact O-N 3.13Å; K3-T7 PolarHBondContact O-OG1 3.44Å; K3-T7 VanDerWaalsContact O-OG1 3.14Å
4	E	94.2	Very high	94.6	Very high	50 Å²	50	110.8 Å²	110.8	23%	0.234	53%	0.525	C	S	.	.	H	α-helix	trans	-65.7	-48.2	178.9	-177.4	-161.2	158.4	0	0	111.2	M1 R6 T7 L8 R31 Y42	M1-E4 WeakPolarHBondContact O-CB 3.49Å; M1-E4 PolarHBondContact O-N 3.32Å; E4-R6 VanDerWaalsContact C-N 3.3Å; E4-R6 PolarHBondContact O-N 3Å; E4-T7 CarbonylContact O-C 3.59Å; E4-T7 WeakPolarHBondContact O-CA 3.39Å; E4-T7 WeakPolarHBondContact O-CB 2.89Å; E4-T7 PolarHBondContact O-N 3.39Å; E4-L8 HydrophobicContact CG-CD1 4.15Å; E4-L8 HydrophobicContact CG-CG 4.44Å; E4-L8 PolarHBondContact O-N 3.03Å; E4-R31 IonicContact OE1-CZ 3.66Å; E4-R31 IonicContact OE1-NH1 2.7Å; E4-R31 PolarHBondContact OE1-NH1 3.44Å; E4-R31 IonicContact OE1-NH2 3.79Å; E4-Y42 PolarHBondContact OE1-OH 3.2Å; E4-Y42 PolarHBondContact OE2-OH 3.12Å
5	A	94.1	Very high	94.8	Very high	33 Å²	33	105.1 Å²	105.1	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-54.2	-47.5	176.2	0	0	0	0	0	111.1	M1 T7 L8 F9	M1-A5 PolarHBondContact O-N 3.18Å; A5-T7 VanDerWaalsContact C-N 3.27Å; A5-T7 PolarHBondContact O-N 3.35Å; A5-L8 PolarHBondContact O-N 3.29Å; A5-F9 WeakPolarHBondContact O-CD2 3.43Å; A5-F9 PolarHBondContact O-N 2.95Å
6	R	96.3	Very high	94.9	Very high	180 Å²	180	106.8 Å²	106.8	68%	0.679	52%	0.518	S	S	*	.	H	α-helix	trans	-59	-36.4	175.5	-71.9	177.6	69.3	-129.7	2	113.3	K2 K3 E4 R10	K2-R6 WeakPolarHBondContact O-CG 3.31Å; K2-R6 PolarHBondContact O-N 2.79Å; K2-R6 VanDerWaalsContact O-N 3.13Å; K3-R6 PolarHBondContact O-N 3.4Å; E4-R6 VanDerWaalsContact C-N 3.3Å; E4-R6 PolarHBondContact O-N 3Å; R6-R10 PolarHBondContact O-N 3.31Å
7	T	96.7	Very high	95.1	Very high	56 Å²	56	105.6 Å²	105.6	34%	0.344	52%	0.515	S	S	.	.	H	α-helix	trans	-69.8	-47.7	176.8	-62.4	0	0	0	0	110.7	K3 E4 A5 R10 Q11	K3-T7 PolarHBondContact O-N 3.11Å; K3-T7 VanDerWaalsContact O-N 3.13Å; K3-T7 PolarHBondContact O-OG1 3.44Å; K3-T7 VanDerWaalsContact O-OG1 3.14Å; E4-T7 CarbonylContact O-C 3.59Å; E4-T7 WeakPolarHBondContact O-CA 3.39Å; E4-T7 WeakPolarHBondContact O-CB 2.89Å; E4-T7 PolarHBondContact O-N 3.39Å; A5-T7 VanDerWaalsContact C-N 3.27Å; A5-T7 PolarHBondContact O-N 3.35Å; T7-R10 PolarHBondContact O-N 2.97Å; T7-Q11 HydrophobicContact CG2-CG 4.39Å; T7-Q11 WeakPolarHBondContact O-CB 3.13Å; T7-Q11 WeakPolarHBondContact O-CG 3.2Å; T7-Q11 PolarHBondContact O-N 2.89Å
8	L	95.9	Very high	95.3	Very high	53 Å²	53	106.3 Å²	106.3	28%	0.277	52%	0.517	S	S	.	.	H	α-helix	trans	-61.8	-45.1	179.1	-68.4	176.1	0	0	0	111.8	E4 A5 R10 Q11 N12	E4-L8 HydrophobicContact CG-CD1 4.15Å; E4-L8 HydrophobicContact CG-CG 4.44Å; E4-L8 PolarHBondContact O-N 3.03Å; A5-L8 PolarHBondContact O-N 3.29Å; L8-R10 VanDerWaalsContact C-N 3.29Å; L8-R10 PolarHBondContact O-N 3.47Å; L8-Q11 PolarHBondContact O-N 3.16Å; L8-N12 VanDerWaalsContact O-CB 3.3Å; L8-N12 WeakPolarHBondContact O-CB 3.41Å; L8-N12 VanDerWaalsContact O-CG 3.3Å; L8-N12 PolarHBondContact O-N 3.29Å; L8-N12 PolarHBondContact O-OD1 2.7Å
9	F	95.5	Very high	95.4	Very high	156 Å²	156	106.5 Å²	106.5	68%	0.684	52%	0.519	S	S	*	.	H	α-helix	trans	-59.2	-40	175.8	-83.9	-67.4	0	0	0	112.7	A5 A13	A5-F9 WeakPolarHBondContact O-CD2 3.43Å; A5-F9 PolarHBondContact O-N 2.95Å; F9-A13 PolarHBondContact O-N 3.1Å
10	R	97.1	Very high	95.5	Very high	175 Å²	175	105.4 Å²	105.4	66%	0.66	51%	0.513	S	S	*	.	H	α-helix	trans	-72.3	-35.1	178.8	-160.8	174.9	73.5	-106.8	3.3	111.9	R6 T7 L8	R6-R10 PolarHBondContact O-N 3.31Å; T7-R10 PolarHBondContact O-N 2.97Å; L8-R10 VanDerWaalsContact C-N 3.29Å; L8-R10 PolarHBondContact O-N 3.47Å
11	Q	95.9	Very high	95.6	Very high	105 Å²	105	103.1 Å²	103.1	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-45	175.3	-74.7	175.4	-41.3	0	0	110.8	T7 L8 A13 H14	T7-Q11 HydrophobicContact CG2-CG 4.39Å; T7-Q11 WeakPolarHBondContact O-CB 3.13Å; T7-Q11 WeakPolarHBondContact O-CG 3.2Å; T7-Q11 PolarHBondContact O-N 2.89Å; L8-Q11 PolarHBondContact O-N 3.16Å; Q11-A13 PolarHBondContact O-N 3.3Å; Q11-H14 PolarHBondContact O-CE1 2.82Å; Q11-H14 PolarHBondContact O-ND1 2.77Å
12	N	96.2	Very high	96.2	Very high	49 Å²	49	102.3 Å²	102.3	26%	0.262	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-79.3	-1.2	-174.8	-67.9	5.2	0	0	0	113.7	L8 H14 I15 H24	L8-N12 VanDerWaalsContact O-CB 3.3Å; L8-N12 WeakPolarHBondContact O-CB 3.41Å; L8-N12 VanDerWaalsContact O-CG 3.3Å; L8-N12 PolarHBondContact O-N 3.29Å; L8-N12 PolarHBondContact O-OD1 2.7Å; N12-H14 PolarHBondContact O-N 3.04Å; N12-H14 VanDerWaalsContact O-N 3.1Å; N12-I15 HydrophobicContact CB-CD1 3.6Å; N12-I15 HydrophobicContact CB-CG1 4.33Å; N12-I15 WeakPolarHBondContact O-CB 3.48Å; N12-I15 WeakPolarHBondContact O-CG1 3.42Å; N12-I15 PolarHBondContact O-N 2.95Å; N12-I15 VanDerWaalsContact O-N 3.1Å; N12-H24 PolarHBondContact ND2-CD2 3.03Å; N12-H24 PolarHBondContact ND2-CE1 3.14Å; N12-H24 PolarHBondContact ND2-ND1 3.44Å; N12-H24 PolarHBondContact ND2-NE2 3.45Å
13	A	95.8	Very high	96.6	Very high	83 Å²	83	97.7 Å²	97.7	69%	0.686	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-63.1	-17.1	-176.5	0	0	0	0	0	115	F9 Q11	F9-A13 PolarHBondContact O-N 3.1Å; Q11-A13 PolarHBondContact O-N 3.3Å
14	H	96.2	Very high	96.7	Very high	150 Å²	150	91.9 Å²	91.9	69%	0.694	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-98.8	-3.2	179.1	65.3	-82.2	0	0	0	113.3	Q11 N12 T16	Q11-H14 PolarHBondContact O-CE1 2.82Å; Q11-H14 PolarHBondContact O-ND1 2.77Å; N12-H14 PolarHBondContact O-N 3.04Å; N12-H14 VanDerWaalsContact O-N 3.1Å; H14-T16 PolarHBondContact O-N 2.98Å; H14-T16 PolarHBondContact O-OG1 2.89Å
15	I	96.6	Very high	96.8	Very high	26 Å²	26	93.6 Å²	93.6	13%	0.133	47%	0.467	C	S	.	.			trans	-69	127.5	-180	-61	177.5	0	0	0	108.2	N12 E20 I21 H24	N12-I15 HydrophobicContact CB-CD1 3.6Å; N12-I15 HydrophobicContact CB-CG1 4.33Å; N12-I15 WeakPolarHBondContact O-CB 3.48Å; N12-I15 WeakPolarHBondContact O-CG1 3.42Å; N12-I15 PolarHBondContact O-N 2.95Å; N12-I15 VanDerWaalsContact O-N 3.1Å; I15-E20 HydrophobicContact CD1-CG 4.2Å; I15-E20 HydrophobicContact CG2-CB 3.86Å; I15-E20 HydrophobicContact CG2-CG 3.79Å; I15-E20 WeakPolarHBondContact CG2-OE2 3.38Å; I15-I21 HydrophobicContact CG2-CG1 3.86Å; I15-H24 WeakPolarHBondContact CD1-CE1 3.48Å; I15-H24 WeakPolarHBondContact CD1-ND1 3.4Å
16	T	97	Very high	97	Very high	131 Å²	131	97.2 Å²	97.2	80%	0.804	48%	0.477	S	S	*	.			trans	-115.2	-15.8	-178	-49.8	0	0	0	0	111.9	H14	H14-T16 PolarHBondContact O-N 2.98Å; H14-T16 PolarHBondContact O-OG1 2.89Å
17	D	98.2	Very high	97	Very high	87 Å²	87	92 Å²	92	47%	0.465	46%	0.46	S	S	.	.			trans	-75.2	126.6	179.6	-177.7	37.1	0	0	0	111.2	I19 E20 I21	D17-I19 PolarHBondContact O-N 3.13Å; D17-E20 HydrophobicContact CB-CB 4.07Å; D17-E20 PolarHBondContact O-N 3.25Å; D17-E20 PolarHBondContact OD2-N 2.93Å; D17-I21 VanDerWaalsContact O-CG1 3.29Å; D17-I21 WeakPolarHBondContact O-CG1 3.39Å; D17-I21 PolarHBondContact O-N 3.45Å
18	E	97.8	Very high	97	Very high	119 Å²	119	91.1 Å²	91.1	56%	0.556	46%	0.459	S	S	*	.	H	α-helix	trans	-62.7	-43.5	-175.6	-172.6	63.3	-143.8	0	0	111.3	E20 I21 E22	E18-E20 VanDerWaalsContact C-N 3.32Å; E18-E20 PolarHBondContact O-N 3.1Å; E18-I21 PolarHBondContact O-N 3.42Å; E18-E22 PolarHBondContact O-N 2.82Å
19	I	98.3	Very high	97	Very high	110 Å²	110	94.3 Å²	94.3	56%	0.564	47%	0.472	S	S	*	.	H	α-helix	trans	-63.9	-41.9	-178.1	-60.5	173.8	0	0	0	110.1	D17 E22 N23	D17-I19 PolarHBondContact O-N 3.13Å; I19-E22 PolarHBondContact O-N 3.36Å; I19-N23 WeakPolarHBondContact O-CB 3.37Å; I19-N23 PolarHBondContact O-N 2.97Å; I19-N23 PolarHBondContact O-ND2 3.32Å; I19-N23 VanDerWaalsContact O-ND2 3.13Å
20	E	97.5	Very high	97.1	Very high	84 Å²	84	89 Å²	89	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-65.8	-39.8	177.3	-170	174.3	-173.7	0	0	112.2	I15 D17 E18 N23 H24	I15-E20 HydrophobicContact CD1-CG 4.2Å; I15-E20 HydrophobicContact CG2-CB 3.86Å; I15-E20 HydrophobicContact CG2-CG 3.79Å; I15-E20 WeakPolarHBondContact CG2-OE2 3.38Å; D17-E20 HydrophobicContact CB-CB 4.07Å; D17-E20 PolarHBondContact O-N 3.25Å; D17-E20 PolarHBondContact OD2-N 2.93Å; E18-E20 VanDerWaalsContact C-N 3.32Å; E18-E20 PolarHBondContact O-N 3.1Å; E20-N23 PolarHBondContact O-N 3.34Å; E20-H24 PolarHBondContact O-N 2.96Å; E20-H24 PolarHBondContact O-ND1 3.44Å; E20-H24 VanDerWaalsContact O-ND1 3.08Å; E20-H24 IonicContact OE1-CE1 2.96Å
21	I	97.7	Very high	97	Very high	58 Å²	58	82.9 Å²	82.9	30%	0.297	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-48.1	175.2	-67.3	164.5	0	0	0	110.5	I15 D17 E18 N23 H24 I25	I15-I21 HydrophobicContact CG2-CG1 3.86Å; D17-I21 VanDerWaalsContact O-CG1 3.29Å; D17-I21 WeakPolarHBondContact O-CG1 3.39Å; D17-I21 PolarHBondContact O-N 3.45Å; E18-I21 PolarHBondContact O-N 3.42Å; I21-N23 VanDerWaalsContact C-N 3.27Å; I21-N23 PolarHBondContact O-N 3.07Å; I21-H24 PolarHBondContact O-N 2.74Å; I21-I25 HydrophobicContact CG2-CD1 3.86Å; I21-I25 HydrophobicContact CG2-CG1 4.5Å; I21-I25 WeakPolarHBondContact O-CG1 3.25Å; I21-I25 PolarHBondContact O-N 3.09Å
22	E	98.4	Very high	97	Very high	83 Å²	83	82.5 Å²	82.5	39%	0.388	43%	0.434	S	S	.	.	H	α-helix	trans	-56.7	-42.1	176.2	-77.1	-167.7	-167	0	0	112.1	E18 I19 I25 K26	E18-E22 PolarHBondContact O-N 2.82Å; I19-E22 PolarHBondContact O-N 3.36Å; E22-I25 PolarHBondContact O-N 3.43Å; E22-K26 WeakPolarHBondContact O-CB 3.16Å; E22-K26 VanDerWaalsContact O-CG 3.3Å; E22-K26 WeakPolarHBondContact O-CG 3.45Å; E22-K26 PolarHBondContact O-N 3.06Å; E22-K26 IonicContact OE2-NZ 2.82Å; E22-K26 PolarHBondContact OE2-NZ 2.86Å
23	N	97.9	Very high	97.1	Very high	87 Å²	87	85.6 Å²	85.6	47%	0.465	45%	0.447	S	S	.	.	H	α-helix	trans	-64.4	-41.9	179.2	-71.9	-26.5	0	0	0	111.6	I19 E20 I21 I25 K26 E27	I19-N23 WeakPolarHBondContact O-CB 3.37Å; I19-N23 PolarHBondContact O-N 2.97Å; I19-N23 PolarHBondContact O-ND2 3.32Å; I19-N23 VanDerWaalsContact O-ND2 3.13Å; E20-N23 PolarHBondContact O-N 3.34Å; I21-N23 VanDerWaalsContact C-N 3.27Å; I21-N23 PolarHBondContact O-N 3.07Å; N23-I25 VanDerWaalsContact C-N 3.33Å; N23-I25 PolarHBondContact O-N 3.26Å; N23-K26 PolarHBondContact O-N 3.06Å; N23-E27 WeakPolarHBondContact O-CB 3.48Å; N23-E27 PolarHBondContact O-N 3.09Å
24	H	96.9	Very high	97	Very high	54 Å²	54	83.7 Å²	83.7	25%	0.25	43%	0.425	C	S	.	.	H	α-helix	trans	-65.3	-35.6	175.3	-71.9	132.7	0	0	0	112.8	N12 I15 E20 I21 A28	N12-H24 PolarHBondContact ND2-CD2 3.03Å; N12-H24 PolarHBondContact ND2-CE1 3.14Å; N12-H24 PolarHBondContact ND2-ND1 3.44Å; N12-H24 PolarHBondContact ND2-NE2 3.45Å; I15-H24 WeakPolarHBondContact CD1-CE1 3.48Å; I15-H24 WeakPolarHBondContact CD1-ND1 3.4Å; E20-H24 PolarHBondContact O-N 2.96Å; E20-H24 PolarHBondContact O-ND1 3.44Å; E20-H24 VanDerWaalsContact O-ND1 3.08Å; E20-H24 IonicContact OE1-CE1 2.96Å; I21-H24 PolarHBondContact O-N 2.74Å; H24-A28 WeakPolarHBondContact O-CB 3.41Å; H24-A28 PolarHBondContact O-N 3.49Å
25	I	97.2	Very high	96.9	Very high	87 Å²	87	78.7 Å²	78.7	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-66.5	-50.9	174.6	-67.1	168.2	0	0	0	110.3	I21 E22 N23 E27 A28 E29	I21-I25 HydrophobicContact CG2-CD1 3.86Å; I21-I25 HydrophobicContact CG2-CG1 4.5Å; I21-I25 WeakPolarHBondContact O-CG1 3.25Å; I21-I25 PolarHBondContact O-N 3.09Å; E22-I25 PolarHBondContact O-N 3.43Å; N23-I25 VanDerWaalsContact C-N 3.33Å; N23-I25 PolarHBondContact O-N 3.26Å; I25-E27 VanDerWaalsContact C-N 3.27Å; I25-E27 PolarHBondContact O-N 3.05Å; I25-A28 WeakPolarHBondContact O-CB 3.31Å; I25-A28 PolarHBondContact O-N 3.02Å; I25-E29 HydrophobicContact CG2-CG 4.43Å; I25-E29 WeakPolarHBondContact O-CG 3.31Å; I25-E29 PolarHBondContact O-N 2.92Å
26	K	98.2	Very high	96.9	Very high	108 Å²	108	84 Å²	84	47%	0.47	43%	0.433	S	S	.	.	H	α-helix	trans	-57.1	-41.3	177.7	-72.1	166.8	-171.2	153.7	0	111.6	E22 N23 A30	E22-K26 WeakPolarHBondContact O-CB 3.16Å; E22-K26 VanDerWaalsContact O-CG 3.3Å; E22-K26 WeakPolarHBondContact O-CG 3.45Å; E22-K26 PolarHBondContact O-N 3.06Å; E22-K26 IonicContact OE2-NZ 2.82Å; E22-K26 PolarHBondContact OE2-NZ 2.86Å; N23-K26 PolarHBondContact O-N 3.06Å; K26-A30 WeakPolarHBondContact O-CB 3.42Å; K26-A30 PolarHBondContact O-N 2.99Å
27	E	96	Very high	96.8	Very high	72 Å²	72	83.9 Å²	83.9	34%	0.336	42%	0.423	S	S	.	.	H	α-helix	trans	-61.7	-46	174.4	-169.5	-145.3	172.4	0	0	111.8	N23 I25 A30 R31	N23-E27 WeakPolarHBondContact O-CB 3.48Å; N23-E27 PolarHBondContact O-N 3.09Å; I25-E27 VanDerWaalsContact C-N 3.27Å; I25-E27 PolarHBondContact O-N 3.05Å; E27-A30 PolarHBondContact O-N 3.44Å; E27-R31 VanDerWaalsContact O-CG 3.28Å; E27-R31 WeakPolarHBondContact O-CG 3.34Å; E27-R31 PolarHBondContact O-N 3.08Å; E27-R31 IonicContact OE1-CZ 3.03Å; E27-R31 IonicContact OE1-NE 2.73Å; E27-R31 PolarHBondContact OE1-NE 3.3Å; E27-R31 IonicContact OE1-NH2 2.67Å; E27-R31 PolarHBondContact OE1-NH2 3.38Å
28	A	96	Very high	96.6	Very high	37 Å²	37	85.8 Å²	85.8	31%	0.306	43%	0.425	S	S	.	.	H	α-helix	trans	-62.4	-43.7	179.4	0	0	0	0	0	112	H24 I25 R31 I32	H24-A28 WeakPolarHBondContact O-CB 3.41Å; H24-A28 PolarHBondContact O-N 3.49Å; I25-A28 WeakPolarHBondContact O-CB 3.31Å; I25-A28 PolarHBondContact O-N 3.02Å; A28-R31 PolarHBondContact O-N 3.32Å; A28-I32 WeakPolarHBondContact O-CG1 3.48Å; A28-I32 PolarHBondContact O-N 3.06Å; A28-I32 VanDerWaalsContact O-N 3.1Å
29	E	97.5	Very high	96.3	Very high	120 Å²	120	83.2 Å²	83.2	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-60.5	-50.1	176	-70.7	177.2	161.7	0	0	111.5	I25 R31 I32 E33	I25-E29 HydrophobicContact CG2-CG 4.43Å; I25-E29 WeakPolarHBondContact O-CG 3.31Å; I25-E29 PolarHBondContact O-N 2.92Å; E29-R31 VanDerWaalsContact C-N 3.29Å; E29-R31 PolarHBondContact O-N 3.13Å; E29-I32 WeakPolarHBondContact O-CB 3.45Å; E29-I32 PolarHBondContact O-N 3.39Å; E29-I32 VanDerWaalsContact O-N 3.08Å; E29-E33 PolarHBondContact O-N 3.4Å
30	A	96.6	Very high	96.1	Very high	44 Å²	44	79.5 Å²	79.5	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-39	178.3	0	0	0	0	0	112.4	K26 E27 E33 L34	K26-A30 WeakPolarHBondContact O-CB 3.42Å; K26-A30 PolarHBondContact O-N 2.99Å; E27-A30 PolarHBondContact O-N 3.44Å; A30-E33 PolarHBondContact O-N 2.99Å; A30-L34 WeakPolarHBondContact O-CB 3.45Å; A30-L34 VanDerWaalsContact O-CG 3.31Å; A30-L34 WeakPolarHBondContact O-CG 3.2Å; A30-L34 PolarHBondContact O-N 3.4Å
31	R	95.5	Very high	95.9	Very high	46 Å²	46	76.3 Å²	76.3	17%	0.174	40%	0.399	C	S	.	.	H	α-helix	trans	-67.9	-34	176.7	-71.9	174.9	170.2	-130.8	13	112.7	M1 E4 E27 A28 E29 T35 P41	M1-R31 HydrophobicContact CE-CB 3.88Å; E4-R31 IonicContact OE1-CZ 3.66Å; E4-R31 IonicContact OE1-NH1 2.7Å; E4-R31 PolarHBondContact OE1-NH1 3.44Å; E4-R31 IonicContact OE1-NH2 3.79Å; E27-R31 VanDerWaalsContact O-CG 3.28Å; E27-R31 WeakPolarHBondContact O-CG 3.34Å; E27-R31 PolarHBondContact O-N 3.08Å; E27-R31 IonicContact OE1-CZ 3.03Å; E27-R31 IonicContact OE1-NE 2.73Å; E27-R31 PolarHBondContact OE1-NE 3.3Å; E27-R31 IonicContact OE1-NH2 2.67Å; E27-R31 PolarHBondContact OE1-NH2 3.38Å; A28-R31 PolarHBondContact O-N 3.32Å; E29-R31 VanDerWaalsContact C-N 3.29Å; E29-R31 PolarHBondContact O-N 3.13Å; R31-T35 WeakPolarHBondContact O-CB 3.38Å; R31-T35 PolarHBondContact O-N 2.66Å; R31-T35 PolarHBondContact O-OG1 3.22Å; R31-P41 HydrophobicContact CB-CB 4.1Å; R31-P41 WeakPolarHBondContact CG-O 3.42Å; R31-P41 WeakPolarHBondContact O-CA 3.37Å
32	I	96.1	Very high	95.7	Very high	98 Å²	98	77.9 Å²	77.9	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-65.8	-50.1	174.5	-70	164.9	0	0	0	109.1	A28 E29 L34 T35 L36	A28-I32 WeakPolarHBondContact O-CG1 3.48Å; A28-I32 PolarHBondContact O-N 3.06Å; A28-I32 VanDerWaalsContact O-N 3.1Å; E29-I32 WeakPolarHBondContact O-CB 3.45Å; E29-I32 PolarHBondContact O-N 3.39Å; E29-I32 VanDerWaalsContact O-N 3.08Å; I32-L34 PolarHBondContact O-N 3.34Å; I32-T35 WeakPolarHBondContact O-CB 3.28Å; I32-T35 PolarHBondContact O-N 2.88Å; I32-T35 VanDerWaalsContact O-N 3.09Å; I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.49Å; I32-L36 WeakPolarHBondContact O-CG 3.41Å; I32-L36 PolarHBondContact O-N 2.99Å
33	E	96.7	Very high	95	Very high	114 Å²	114	78.8 Å²	78.8	53%	0.533	42%	0.415	S	S	.	.	H	α-helix	trans	-56.4	-48.7	177.5	-176.6	177.1	-168.8	0	0	111.9	E29 A30 T35 L36 H37	E29-E33 PolarHBondContact O-N 3.4Å; A30-E33 PolarHBondContact O-N 2.99Å; E33-T35 VanDerWaalsContact C-N 3.29Å; E33-T35 PolarHBondContact O-N 3.1Å; E33-L36 PolarHBondContact O-N 3.38Å; E33-L36 VanDerWaalsContact O-N 3.13Å; E33-H37 PolarHBondContact O-CD2 3.02Å; E33-H37 VanDerWaalsContact O-CD2 3.25Å; E33-H37 PolarHBondContact O-N 3.24Å; E33-H37 IonicContact OE1-NE2 3.87Å
34	L	94.2	Very high	94.2	Very high	43 Å²	43	82.3 Å²	82.3	23%	0.225	42%	0.422	C	S	.	.	H	α-helix	trans	-59.4	-38.3	175.4	-74.7	175	0	0	0	112.9	A30 I32 H37 Y38 T40 P43	A30-L34 WeakPolarHBondContact O-CB 3.45Å; A30-L34 VanDerWaalsContact O-CG 3.31Å; A30-L34 WeakPolarHBondContact O-CG 3.2Å; A30-L34 PolarHBondContact O-N 3.4Å; I32-L34 PolarHBondContact O-N 3.34Å; L34-H37 PolarHBondContact O-N 3.4Å; L34-Y38 HydrophobicContact CD2-CD2 3.73Å; L34-Y38 HydrophobicContact CD2-CE2 3.83Å; L34-Y38 WeakPolarHBondContact O-CA 3.21Å; L34-Y38 WeakPolarHBondContact O-CB 3.25Å; L34-Y38 PolarHBondContact O-N 3.24Å; L34-T40 CarbonylContact C-O 3.3Å; L34-T40 VanDerWaalsContact C-O 3.3Å; L34-P43 HydrophobicContact CD1-CG 4.11Å
35	T	94.6	Very high	93	Very high	45 Å²	45	83.4 Å²	83.4	28%	0.276	43%	0.429	S	S	.	.	H	α-helix	trans	-66.1	-40.8	177	-57.3	0	0	0	0	111.1	R31 I32 E33 G39 P41	R31-T35 WeakPolarHBondContact O-CB 3.38Å; R31-T35 PolarHBondContact O-N 2.66Å; R31-T35 PolarHBondContact O-OG1 3.22Å; I32-T35 WeakPolarHBondContact O-CB 3.28Å; I32-T35 PolarHBondContact O-N 2.88Å; I32-T35 VanDerWaalsContact O-N 3.09Å; E33-T35 VanDerWaalsContact C-N 3.29Å; E33-T35 PolarHBondContact O-N 3.1Å; T35-G39 WeakPolarHBondContact O-CA 3.48Å; T35-G39 PolarHBondContact O-N 3.09Å; T35-P41 WeakPolarHBondContact OG1-CA 3.43Å; T35-P41 VanDerWaalsContact OG1-CB 3.25Å; T35-P41 WeakPolarHBondContact OG1-CB 3.38Å
36	L	95.8	Very high	91.6	Very high	136 Å²	136	83.4 Å²	83.4	71%	0.712	44%	0.437	S	S	*	.	H	α-helix	trans	-66.4	-39.8	178.2	-67.7	173.4	0	0	0	111.7	I32 E33	I32-L36 HydrophobicContact CG2-CD1 4.07Å; I32-L36 HydrophobicContact CG2-CG 4.49Å; I32-L36 WeakPolarHBondContact O-CG 3.41Å; I32-L36 PolarHBondContact O-N 2.99Å; E33-L36 PolarHBondContact O-N 3.38Å; E33-L36 VanDerWaalsContact O-N 3.13Å
37	H	95.1	Very high	90.6	Very high	129 Å²	129	85.7 Å²	85.7	60%	0.597	45%	0.454	S	S	*	.	H	α-helix	trans	-82.5	-39.5	-178.3	-66.9	-45.1	0	0	0	114.4	E33 L34	E33-H37 PolarHBondContact O-CD2 3.02Å; E33-H37 VanDerWaalsContact O-CD2 3.25Å; E33-H37 PolarHBondContact O-N 3.24Å; E33-H37 IonicContact OE1-NE2 3.87Å; L34-H37 PolarHBondContact O-N 3.4Å
38	Y	93.9	Very high	89.6	Confident	128 Å²	128	85.6 Å²	85.6	50%	0.502	46%	0.455	S	S	.	.	H	α-helix	trans	-119.4	-1.9	-170	-59.2	-71.1	0	0	0	114	L34 T40 R44	L34-Y38 HydrophobicContact CD2-CD2 3.73Å; L34-Y38 HydrophobicContact CD2-CE2 3.83Å; L34-Y38 WeakPolarHBondContact O-CA 3.21Å; L34-Y38 WeakPolarHBondContact O-CB 3.25Å; L34-Y38 PolarHBondContact O-N 3.24Å; Y38-T40 PolarHBondContact O-N 2.96Å; Y38-T40 VanDerWaalsContact O-N 3.16Å; Y38-R44 PolarHBondContact O-NH2 3.47Å
39	G	93.1	Very high	88.9	Confident	65 Å²	65	87.6 Å²	87.6	67%	0.67	47%	0.465	S	S	*	.	S	Bend	trans	68.7	6.5	-175.5	0	0	0	0	0	114.3	T35	T35-G39 WeakPolarHBondContact O-CA 3.48Å; T35-G39 PolarHBondContact O-N 3.09Å
40	T	92.2	Very high	87.7	Confident	32 Å²	32	85.9 Å²	85.9	20%	0.196	47%	0.465	C	S	.	.			trans	-134.2	129.6	178.9	172.7	0	0	0	0	109.6	L34 Y38 Y42 R44	L34-T40 CarbonylContact C-O 3.3Å; L34-T40 VanDerWaalsContact C-O 3.3Å; Y38-T40 PolarHBondContact O-N 2.96Å; Y38-T40 VanDerWaalsContact O-N 3.16Å; T40-Y42 PolarHBondContact O-N 3.14Å; T40-R44 HydrophobicContact CG2-CG 4.15Å
41	P	93.3	Very high	86.8	Confident	17 Å²	17	88.4 Å²	88.4	11%	0.11	47%	0.472	C	S	.	.	S	Bend	trans	-72.1	-13.2	-178.7	24.8	-31.4	0	0	0	113.8	M1 R31 T35	M1-P41 HydrophobicContact CB-CG 4.37Å; M1-P41 HydrophobicContact CE-CB 3.65Å; M1-P41 HydrophobicContact CE-CG 4.44Å; M1-P41 HydrophobicContact CG-CB 4.31Å; M1-P41 HydrophobicContact CG-CG 4.11Å; M1-P41 HydrophobicContact SD-CB 3.76Å; M1-P41 HydrophobicContact SD-CG 3.99Å; R31-P41 HydrophobicContact CB-CB 4.1Å; R31-P41 WeakPolarHBondContact CG-O 3.42Å; R31-P41 WeakPolarHBondContact O-CA 3.37Å; T35-P41 WeakPolarHBondContact OG1-CA 3.43Å; T35-P41 VanDerWaalsContact OG1-CB 3.25Å; T35-P41 WeakPolarHBondContact OG1-CB 3.38Å
42	Y	93.6	Very high	85.8	Confident	90 Å²	90	88.3 Å²	88.3	35%	0.353	48%	0.477	S	S	.	.	S	Bend	trans	-102.8	144.5	-175.2	-61.6	-79.9	0	0	0	111.6	E4 T40	E4-Y42 PolarHBondContact OE1-OH 3.2Å; E4-Y42 PolarHBondContact OE2-OH 3.12Å; T40-Y42 PolarHBondContact O-N 3.14Å
43	P	84.8	Confident	85.1	Confident	103 Å²	103	90.1 Å²	90.1	67%	0.669	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-52.6	139.2	175	-26.2	33.9	0	0	0	112.5	L34	L34-P43 HydrophobicContact CD1-CG 4.11Å
44	R	80.1	Confident	84	Confident	160 Å²	160	86.8 Å²	86.8	60%	0.604	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-92.5	133.5	170.3	-63.8	-178.8	179.9	-170.4	0.7	108.9	Y38 T40 S46	Y38-R44 PolarHBondContact O-NH2 3.47Å; T40-R44 HydrophobicContact CG2-CG 4.15Å; R44-S46 PolarHBondContact O-N 3.41Å
45	L	72.3	Confident	82.9	Confident	78 Å²	78	85.3 Å²	85.3	41%	0.408	47%	0.472	S	S	.	.			trans	-83.3	67.2	171.6	-56.8	-179	0	0	0	110.3	L48 I58	L45-L48 HydrophobicContact CB-CD1 3.87Å; L45-L48 HydrophobicContact CD1-CD1 4.45Å; L45-L48 HydrophobicContact CD2-CD1 4.06Å; L45-L48 HydrophobicContact CG-CD1 4.34Å; L45-I58 HydrophobicContact CD1-CB 3.93Å; L45-I58 HydrophobicContact CD1-CD1 3.26Å; L45-I58 HydrophobicContact CD1-CG1 4.12Å; L45-I58 HydrophobicContact CD1-CG2 3.96Å; L45-I58 HydrophobicContact CD2-CD1 3.87Å; L45-I58 HydrophobicContact CG-CD1 4.02Å
46	S	68.8	Low	81.9	Confident	86 Å²	86	89.2 Å²	89.2	60%	0.601	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	130	163.7	45	0	0	0	0	107.4	R44	R44-S46 PolarHBondContact O-N 3.41Å
47	N	76.7	Confident	80.8	Confident	156 Å²	156	88.9 Å²	88.9	83%	0.834	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	2.2	175	-40.9	-37	0	0	0	117.7
48	L	75.2	Confident	79.4	Confident	70 Å²	70	86.9 Å²	86.9	37%	0.366	47%	0.472	S	S	.	.			trans	-89.6	128.9	168.6	-78.1	98.6	0	0	0	110.9	L45 A54	L45-L48 HydrophobicContact CB-CD1 3.87Å; L45-L48 HydrophobicContact CD1-CD1 4.45Å; L45-L48 HydrophobicContact CD2-CD1 4.06Å; L45-L48 HydrophobicContact CG-CD1 4.34Å; L48-A54 HydrophobicContact CD2-CB 3.4Å
49	P	80.1	Confident	77.9	Confident	79 Å²	79	84.7 Å²	84.7	51%	0.513	47%	0.472	S	S	.	.			trans	-57.7	140.6	171.7	-17	24.8	0	0	0	110.3	N51 T52	P49-N51 PolarHBondContact O-N 3.02Å; P49-T52 HydrophobicContact CB-CG2 3.88Å; P49-T52 HydrophobicContact CG-CG2 3.84Å; P49-T52 WeakPolarHBondContact O-CG2 3.35Å; P49-T52 PolarHBondContact O-N 3.23Å; P49-T52 VanDerWaalsContact O-N 3.09Å; P49-T52 PolarHBondContact O-OG1 2.91Å
50	P	73	Confident	76.2	Confident	84 Å²	84	86 Å²	86	55%	0.545	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.7	-172.5	23.2	-34.2	0	0	0	113.3
51	N	77.1	Confident	74.4	Confident	97 Å²	97	89.8 Å²	89.8	52%	0.519	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	16.1	-176.1	-58.1	-12.8	0	0	0	112.9	P49	P49-N51 PolarHBondContact O-N 3.02Å
52	T	75.8	Confident	72.5	Confident	44 Å²	44	95.8 Å²	95.8	27%	0.27	52%	0.519	S	S	.	.	S	Bend	trans	-85.1	147.2	175.2	58.2	0	0	0	0	111.6	P49 A54 A55 Y56	P49-T52 HydrophobicContact CB-CG2 3.88Å; P49-T52 HydrophobicContact CG-CG2 3.84Å; P49-T52 WeakPolarHBondContact O-CG2 3.35Å; P49-T52 PolarHBondContact O-N 3.23Å; P49-T52 VanDerWaalsContact O-N 3.09Å; P49-T52 PolarHBondContact O-OG1 2.91Å; T52-A54 PolarHBondContact O-N 2.79Å; T52-A55 WeakPolarHBondContact O-CB 3.44Å; T52-A55 PolarHBondContact O-N 3.13Å; T52-A55 WeakPolarHBondContact OG1-CB 3.37Å; T52-A55 PolarHBondContact OG1-N 2.97Å; T52-Y56 WeakPolarHBondContact O-CD2 3.45Å; T52-Y56 PolarHBondContact O-N 2.72Å; T52-Y56 VanDerWaalsContact O-N 3.12Å
53	L	80.3	Confident	70.3	Confident	136 Å²	136	102.1 Å²	102.1	71%	0.712	54%	0.542	S	S	*	.	H	α-helix	trans	-53	-42	175.5	177.8	61.4	0	0	0	111.8	A55 Y56 M57	L53-A55 VanDerWaalsContact C-N 3.32Å; L53-A55 PolarHBondContact O-N 2.99Å; L53-Y56 PolarHBondContact O-N 3.49Å; L53-M57 HydrophobicContact CD1-CG 3.95Å; L53-M57 HydrophobicContact CD1-SD 4.34Å; L53-M57 HydrophobicContact CG-CG 4.16Å; L53-M57 VanDerWaalsContact O-CG 3.25Å; L53-M57 WeakPolarHBondContact O-CG 3.38Å; L53-M57 PolarHBondContact O-N 3.29Å
54	A	73.2	Confident	68.6	Low	44 Å²	44	102.7 Å²	102.7	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-60.8	-39.2	177.7	0	0	0	0	0	112.6	L48 T52 I58	L48-A54 HydrophobicContact CD2-CB 3.4Å; T52-A54 PolarHBondContact O-N 2.79Å; A54-I58 WeakPolarHBondContact O-CD1 3.44Å; A54-I58 WeakPolarHBondContact O-CG1 3.36Å; A54-I58 PolarHBondContact O-N 2.85Å
55	A	72	Confident	67.1	Low	12 Å²	12	100.9 Å²	100.9	10%	0.099	56%	0.555	C	S	.	*	H	α-helix	trans	-62.9	-47.7	173.4	0	0	0	0	0	111.4	T52 L53 M57 I58 T59	T52-A55 WeakPolarHBondContact O-CB 3.44Å; T52-A55 PolarHBondContact O-N 3.13Å; T52-A55 WeakPolarHBondContact OG1-CB 3.37Å; T52-A55 PolarHBondContact OG1-N 2.97Å; L53-A55 VanDerWaalsContact C-N 3.32Å; L53-A55 PolarHBondContact O-N 2.99Å; A55-M57 PolarHBondContact O-N 3.14Å; A55-I58 PolarHBondContact O-N 3.49Å; A55-T59 WeakPolarHBondContact O-CG2 3.39Å; A55-T59 PolarHBondContact O-N 2.9Å; A55-T59 PolarHBondContact O-OG1 2.59Å; A55-T59 VanDerWaalsContact O-OG1 3.14Å
56	Y	73.9	Confident	66.1	Low	128 Å²	128	102.8 Å²	102.8	50%	0.502	57%	0.572	S	S	.	*	H	α-helix	trans	-61.9	-42.9	179.2	-73.8	-68	0	0	0	113.7	T52 L53 I58 T59 S60	T52-Y56 WeakPolarHBondContact O-CD2 3.45Å; T52-Y56 PolarHBondContact O-N 2.72Å; T52-Y56 VanDerWaalsContact O-N 3.12Å; L53-Y56 PolarHBondContact O-N 3.49Å; Y56-I58 PolarHBondContact O-N 3.04Å; Y56-T59 PolarHBondContact O-N 2.98Å; Y56-T59 PolarHBondContact O-OG1 3.43Å; Y56-S60 WeakPolarHBondContact O-CB 3.4Å; Y56-S60 PolarHBondContact O-N 2.94Å; Y56-S60 PolarHBondContact O-OG 2.94Å
57	M	72.1	Confident	65.4	Low	128 Å²	128	103.5 Å²	103.5	63%	0.631	58%	0.575	S	S	*	*	H	α-helix	trans	-61.1	-30.4	-179.9	-69.9	-65.9	-87.3	0	0	111.7	L53 A55 S60	L53-M57 HydrophobicContact CD1-CG 3.95Å; L53-M57 HydrophobicContact CD1-SD 4.34Å; L53-M57 HydrophobicContact CG-CG 4.16Å; L53-M57 VanDerWaalsContact O-CG 3.25Å; L53-M57 WeakPolarHBondContact O-CG 3.38Å; L53-M57 PolarHBondContact O-N 3.29Å; A55-M57 PolarHBondContact O-N 3.14Å; M57-S60 PolarHBondContact O-OG 3.5Å
58	I	65.1	Low	64	Low	87 Å²	87	101.8 Å²	101.8	45%	0.446	57%	0.572	S	S	.	*	H	α-helix	trans	-89.8	-39.3	-177.2	-64.9	168.2	0	0	0	110.8	L45 A54 A55 Y56 S60 T61	L45-I58 HydrophobicContact CD1-CB 3.93Å; L45-I58 HydrophobicContact CD1-CD1 3.26Å; L45-I58 HydrophobicContact CD1-CG1 4.12Å; L45-I58 HydrophobicContact CD1-CG2 3.96Å; L45-I58 HydrophobicContact CD2-CD1 3.87Å; L45-I58 HydrophobicContact CG-CD1 4.02Å; A54-I58 WeakPolarHBondContact O-CD1 3.44Å; A54-I58 WeakPolarHBondContact O-CG1 3.36Å; A54-I58 PolarHBondContact O-N 2.85Å; A55-I58 PolarHBondContact O-N 3.49Å; Y56-I58 PolarHBondContact O-N 3.04Å; I58-S60 PolarHBondContact O-N 3.49Å; I58-T61 PolarHBondContact O-OG1 3.32Å
59	T	63	Low	62.5	Low	82 Å²	82	104.3 Å²	104.3	50%	0.503	60%	0.596	S	S	.	*	H	α-helix	trans	-71.2	-26.7	177.2	57.2	0	0	0	0	113.4	A55 Y56 T61 K62	A55-T59 WeakPolarHBondContact O-CG2 3.39Å; A55-T59 PolarHBondContact O-N 2.9Å; A55-T59 PolarHBondContact O-OG1 2.59Å; A55-T59 VanDerWaalsContact O-OG1 3.14Å; Y56-T59 PolarHBondContact O-N 2.98Å; Y56-T59 PolarHBondContact O-OG1 3.43Å; T59-T61 PolarHBondContact O-N 3.43Å; T59-T61 VanDerWaalsContact O-N 3.13Å; T59-K62 CarbonylContact O-C 3.48Å; T59-K62 PolarHBondContact O-N 3.02Å; T59-K62 VanDerWaalsContact O-O 3.1Å
60	S	57.1	Low	61	Low	92 Å²	92	104.9 Å²	104.9	64%	0.643	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-27.6	178.9	66.4	0	0	0	0	113	Y56 M57 I58 K62	Y56-S60 WeakPolarHBondContact O-CB 3.4Å; Y56-S60 PolarHBondContact O-N 2.94Å; Y56-S60 PolarHBondContact O-OG 2.94Å; M57-S60 PolarHBondContact O-OG 3.5Å; I58-S60 PolarHBondContact O-N 3.49Å; S60-K62 VanDerWaalsContact C-N 3.32Å; S60-K62 PolarHBondContact O-N 3.02Å
61	T	55.2	Low	59.5	Low	112 Å²	112	106.6 Å²	106.6	69%	0.687	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-19.6	176.1	67.7	0	0	0	0	113.5	I58 T59	I58-T61 PolarHBondContact O-OG1 3.32Å; T59-T61 PolarHBondContact O-N 3.43Å; T59-T61 VanDerWaalsContact O-N 3.13Å
62	K	53.9	Low	57.8	Low	144 Å²	144	108.6 Å²	108.6	63%	0.626	63%	0.626	S	S	*	*	S	Bend	trans	-110.1	92.9	178.5	-64.2	-163	-172.7	-179.5	0	110.1	T59 S60 S64	T59-K62 CarbonylContact O-C 3.48Å; T59-K62 PolarHBondContact O-N 3.02Å; T59-K62 VanDerWaalsContact O-O 3.1Å; S60-K62 VanDerWaalsContact C-N 3.32Å; S60-K62 PolarHBondContact O-N 3.02Å; K62-S64 PolarHBondContact O-N 3.35Å
63	R	47.5	Very low	56.3	Low	223 Å²	223	112.2 Å²	112.2	84%	0.842	65%	0.653	S	S	*	*			trans	12.8	104.1	149.9	-69.7	-177.1	-73.3	-113.5	-0.8	115.2	T65	R63-T65 PolarHBondContact O-N 2.92Å
64	S	48.6	Very low	54.9	Low	115 Å²	115	109.9 Å²	109.9	80%	0.804	65%	0.648	S	S	*	*	S	Bend	trans	32	64.2	141.2	67.1	0	0	0	0	116.7	K62	K62-S64 PolarHBondContact O-N 3.35Å
65	T	48.6	Very low	53.9	Low	121 Å²	121	114.2 Å²	114.2	74%	0.742	66%	0.66	S	S	*	*			trans	-132.8	99.8	153.5	40.2	0	0	0	0	107.1	R63	R63-T65 PolarHBondContact O-N 2.92Å
66	P	51.1	Low	52.5	Low	118 Å²	118	116.2 Å²	116.2	77%	0.766	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-61.1	133.2	172.7	24.8	-30.8	0	0	0	107.9
67	P	54	Low	51.1	Low	101 Å²	101	117.9 Å²	117.9	66%	0.656	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-57.9	146.2	174.3	24.5	-32.3	0	0	0	109.8	S69	P67-S69 PolarHBondContact O-N 3.03Å
68	P	47.5	Very low	50	Low	120 Å²	120	114.8 Å²	114.8	78%	0.779	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-55.3	132.6	176.2	23.1	-32.4	0	0	0	109.5	S70	P68-S70 VanDerWaalsContact C-N 3.28Å; P68-S70 PolarHBondContact O-N 3.01Å
69	S	43.8	Very low	49.3	Very low	123 Å²	123	116.1 Å²	116.1	86%	0.86	69%	0.691	S	S	*	*			trans	-59.3	81.2	178.7	51.7	0	0	0	0	111.5	P67	P67-S69 PolarHBondContact O-N 3.03Å
70	S	48.1	Very low	48.6	Very low	91 Å²	91	116.3 Å²	116.3	64%	0.636	69%	0.693	S	S	*	*			trans	-82.2	111.8	159.7	58.7	0	0	0	0	106.9	P68 L72	P68-S70 VanDerWaalsContact C-N 3.28Å; P68-S70 PolarHBondContact O-N 3.01Å; S70-L72 VanDerWaalsContact C-N 3.26Å; S70-L72 PolarHBondContact O-N 3.31Å
71	S	41.3	Very low	48.2	Very low	121 Å²	121	119.1 Å²	119.1	85%	0.846	70%	0.701	S	S	*	*			trans	-58.2	84.3	173.9	52.8	0	0	0	0	110.5
72	L	42.7	Very low	47.8	Very low	138 Å²	138	119.5 Å²	119.5	72%	0.723	70%	0.698	S	S	*	*			trans	-107.5	118.2	165.4	-119.7	78.2	0	0	0	107.6	S70 S74	S70-L72 VanDerWaalsContact C-N 3.26Å; S70-L72 PolarHBondContact O-N 3.31Å; L72-S74 PolarHBondContact O-N 3.49Å
73	S	44.3	Very low	47.8	Very low	120 Å²	120	117.9 Å²	117.9	84%	0.839	71%	0.705	S	S	*	*			trans	-50.3	102.2	176.1	-21.8	0	0	0	0	109.4	E75	S73-E75 PolarHBondContact O-N 2.91Å
74	S	49.8	Very low	48	Very low	87 Å²	87	112.6 Å²	112.6	61%	0.608	69%	0.694	S	S	*	*			trans	-71.7	95.4	-178	-66.6	0	0	0	0	110.6	L72 S76	L72-S74 PolarHBondContact O-N 3.49Å; S74-S76 VanDerWaalsContact C-N 3.31Å; S74-S76 PolarHBondContact O-N 3.5Å
75	E	52.8	Low	48.2	Very low	135 Å²	135	111.7 Å²	111.7	63%	0.631	69%	0.687	S	S	*	*			trans	-73.6	93.2	159.6	-68.6	-163.7	-176.4	0	0	108.4	S73 L77	S73-E75 PolarHBondContact O-N 2.91Å; E75-L77 PolarHBondContact O-N 2.94Å
76	S	42.3	Very low	48.7	Very low	55 Å²	55	110.7 Å²	110.7	39%	0.385	68%	0.681	S	S	.	*			trans	-61.2	134.4	-178.1	128.3	0	0	0	0	110.4	S74 T78 R95	S74-S76 VanDerWaalsContact C-N 3.31Å; S74-S76 PolarHBondContact O-N 3.5Å; S76-T78 WeakPolarHBondContact OG-CG2 3.34Å; S76-R95 VanDerWaalsContact CB-NH2 3.31Å; S76-R95 PolarHBondContact O-NE 3.05Å; S76-R95 PolarHBondContact O-NH1 2.94Å; S76-R95 VanDerWaalsContact O-NH1 3.09Å; S76-R95 PolarHBondContact O-NH2 3.41Å; S76-R95 PolarHBondContact OG-NH1 3.3Å; S76-R95 PolarHBondContact OG-NH2 3.22Å
77	L	45.3	Very low	49	Very low	163 Å²	163	110.6 Å²	110.6	85%	0.853	67%	0.67	S	S	*	*			trans	-103.3	90.3	169.1	-74.5	110.2	0	0	0	107.6	E75 T79	E75-L77 PolarHBondContact O-N 2.94Å; L77-T79 PolarHBondContact O-N 3.15Å
78	T	48.8	Very low	49.1	Very low	62 Å²	62	108.2 Å²	108.2	38%	0.38	65%	0.65	S	S	.	*			trans	-84.2	91.4	173.5	55.8	0	0	0	0	109.3	S76 T80 R95	S76-T78 WeakPolarHBondContact OG-CG2 3.34Å; T78-T80 VanDerWaalsContact C-N 3.31Å; T78-T80 PolarHBondContact O-N 2.98Å; T78-R95 PolarHBondContact OG1-NH1 3.27Å
79	T	49.4	Very low	49.6	Very low	115 Å²	115	110.1 Å²	110.1	71%	0.706	65%	0.646	S	S	*	*			trans	-90.2	77.2	159.4	-47.6	0	0	0	0	107.1	L77 N81	L77-T79 PolarHBondContact O-N 3.15Å; T79-N81 PolarHBondContact O-N 2.7Å; T79-N81 VanDerWaalsContact O-N 3.17Å
80	T	48.4	Very low	50.9	Low	87 Å²	87	111.6 Å²	111.6	53%	0.534	63%	0.633	S	S	.	*			trans	-75.2	103.5	170.5	55	0	0	0	0	107.6	T78 N82	T78-T80 VanDerWaalsContact C-N 3.31Å; T78-T80 PolarHBondContact O-N 2.98Å; T80-N82 VanDerWaalsContact C-N 3.28Å; T80-N82 PolarHBondContact O-N 2.67Å
81	N	48.3	Very low	52	Low	151 Å²	151	113.8 Å²	113.8	81%	0.807	63%	0.627	S	S	*	*			trans	-60.9	92.1	165	-69	-26.8	0	0	0	107.9	T79	T79-N81 PolarHBondContact O-N 2.7Å; T79-N81 VanDerWaalsContact O-N 3.17Å
82	N	48.2	Very low	53.3	Low	120 Å²	120	110.7 Å²	110.7	64%	0.642	60%	0.601	S	S	*	*			trans	-150.5	131.3	164.4	-131.8	-20.3	0	0	0	110.3	T80 N84	T80-N82 VanDerWaalsContact C-N 3.28Å; T80-N82 PolarHBondContact O-N 2.67Å; N82-N84 PolarHBondContact O-N 2.73Å
83	S	52.2	Low	55	Low	110 Å²	110	107.3 Å²	107.3	77%	0.769	59%	0.588	S	S	*	*			trans	-69.2	45.6	-165	43.5	0	0	0	0	114.5	S85	S83-S85 PolarHBondContact O-N 3.26Å
84	N	52.4	Low	56.8	Low	112 Å²	112	106.6 Å²	106.6	60%	0.599	57%	0.567	S	S	*	*			trans	-101.4	73.8	178.8	-67.1	-22.7	0	0	0	110.3	N82	N82-N84 PolarHBondContact O-N 2.73Å
85	S	53.6	Low	58.2	Low	96 Å²	96	107 Å²	107	67%	0.671	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	21.6	103.9	139.7	-171.5	0	0	0	0	116.2	S83 H87	S83-S85 PolarHBondContact O-N 3.26Å; S85-H87 VanDerWaalsContact C-N 3.25Å; S85-H87 PolarHBondContact O-N 3.36Å
86	T	59.1	Low	59.5	Low	100 Å²	100	104.1 Å²	104.1	61%	0.613	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-48.8	166.1	72.3	0	0	0	0	118.7	R90	T86-R90 WeakPolarHBondContact O-CG 3.18Å; T86-R90 PolarHBondContact O-N 3.49Å
87	H	56.3	Low	61.4	Low	115 Å²	115	107.8 Å²	107.8	53%	0.532	56%	0.558	S	S	.	*	H	α-helix	trans	-69.2	-40.3	-174.5	-161.5	83.6	0	0	0	112	S85 R90 R91	S85-H87 VanDerWaalsContact C-N 3.25Å; S85-H87 PolarHBondContact O-N 3.36Å; H87-R90 WeakPolarHBondContact O-CB 3.48Å; H87-R90 PolarHBondContact O-N 3.31Å; H87-R91 PolarHBondContact O-N 2.95Å; H87-R91 VanDerWaalsContact O-N 3.15Å
88	E	57.4	Low	63.3	Low	51 Å²	51	107.4 Å²	107.4	24%	0.238	55%	0.545	C	S	.	.	H	α-helix	trans	-70.9	-36.3	-179.9	-166.9	55.4	-140.4	0	0	112	R90 R91 I92	E88-R90 PolarHBondContact O-N 3.29Å; E88-R91 WeakPolarHBondContact O-CB 3.24Å; E88-R91 PolarHBondContact O-N 3.13Å; E88-R91 WeakPolarHBondContact OE2-CD 3.46Å; E88-R91 IonicContact OE2-CZ 3.82Å; E88-R91 IonicContact OE2-NE 3.95Å; E88-R91 IonicContact OE2-NH1 3.59Å; E88-R91 PolarHBondContact OE2-NH1 3.32Å; E88-I92 HydrophobicContact CG-CD1 4.31Å; E88-I92 PolarHBondContact O-N 3.24Å; E88-I92 VanDerWaalsContact OE1-CD1 3.24Å; E88-I92 WeakPolarHBondContact OE1-CD1 3.14Å
89	K	58.1	Low	65.2	Low	160 Å²	160	106 Å²	106	70%	0.696	54%	0.54	S	S	*	.	H	α-helix	trans	-55.7	-43.1	171.1	-66	-173.6	178.7	-175.9	0	110.7	R91 I92 S93	K89-R91 VanDerWaalsContact C-N 3.32Å; K89-R91 PolarHBondContact O-N 2.89Å; K89-I92 PolarHBondContact O-N 2.86Å; K89-S93 WeakPolarHBondContact O-CB 3.42Å; K89-S93 PolarHBondContact O-N 3.14Å; K89-S93 PolarHBondContact O-OG 3.43Å
90	R	70	Confident	66.9	Low	154 Å²	154	106.2 Å²	106.2	58%	0.581	54%	0.537	S	S	*	.	H	α-helix	trans	-63.6	-35	175.5	-64.4	178	77.4	162.6	4.8	112.4	T86 H87 E88 R94	T86-R90 WeakPolarHBondContact O-CG 3.18Å; T86-R90 PolarHBondContact O-N 3.49Å; H87-R90 WeakPolarHBondContact O-CB 3.48Å; H87-R90 PolarHBondContact O-N 3.31Å; E88-R90 PolarHBondContact O-N 3.29Å; R90-R94 WeakPolarHBondContact O-CB 3.39Å; R90-R94 WeakPolarHBondContact O-CD 3.48Å; R90-R94 WeakPolarHBondContact O-CG 3.3Å; R90-R94 PolarHBondContact O-N 3.3Å
91	R	72.2	Confident	68.7	Low	137 Å²	137	108.7 Å²	108.7	52%	0.517	54%	0.537	S	S	.	.	H	α-helix	trans	-71.1	-46.8	178.3	-67.4	176.4	73.5	-162.3	11.7	112	H87 E88 K89 S93 R94 R95	H87-R91 PolarHBondContact O-N 2.95Å; H87-R91 VanDerWaalsContact O-N 3.15Å; E88-R91 WeakPolarHBondContact O-CB 3.24Å; E88-R91 PolarHBondContact O-N 3.13Å; E88-R91 WeakPolarHBondContact OE2-CD 3.46Å; E88-R91 IonicContact OE2-CZ 3.82Å; E88-R91 IonicContact OE2-NE 3.95Å; E88-R91 IonicContact OE2-NH1 3.59Å; E88-R91 PolarHBondContact OE2-NH1 3.32Å; K89-R91 VanDerWaalsContact C-N 3.32Å; K89-R91 PolarHBondContact O-N 2.89Å; R91-S93 VanDerWaalsContact C-N 3.34Å; R91-S93 PolarHBondContact O-N 2.82Å; R91-R94 PolarHBondContact O-N 3.02Å; R91-R95 PolarHBondContact O-N 3.49Å
92	I	68.8	Low	70.7	Confident	57 Å²	57	107.3 Å²	107.3	29%	0.292	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-44.2	174	-99.4	68.9	0	0	0	110.9	E88 K89 R94 R95 T96	E88-I92 HydrophobicContact CG-CD1 4.31Å; E88-I92 PolarHBondContact O-N 3.24Å; E88-I92 VanDerWaalsContact OE1-CD1 3.24Å; E88-I92 WeakPolarHBondContact OE1-CD1 3.14Å; K89-I92 PolarHBondContact O-N 2.86Å; I92-R94 PolarHBondContact O-N 2.97Å; I92-R95 PolarHBondContact O-N 3.18Å; I92-T96 PolarHBondContact O-N 3.45Å; I92-T96 PolarHBondContact O-OG1 3.4Å
93	S	77.9	Confident	72.7	Confident	66 Å²	66	105.8 Å²	105.8	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-45.1	177.4	-66	0	0	0	0	111.7	K89 R91 R95 T96 E97	K89-S93 WeakPolarHBondContact O-CB 3.42Å; K89-S93 PolarHBondContact O-N 3.14Å; K89-S93 PolarHBondContact O-OG 3.43Å; R91-S93 VanDerWaalsContact C-N 3.34Å; R91-S93 PolarHBondContact O-N 2.82Å; S93-R95 VanDerWaalsContact C-N 3.3Å; S93-R95 PolarHBondContact O-N 2.91Å; S93-T96 WeakPolarHBondContact CA-OG1 3.38Å; S93-T96 PolarHBondContact O-N 3.45Å; S93-T96 PolarHBondContact O-OG1 3.39Å; S93-E97 WeakPolarHBondContact O-CB 3.49Å; S93-E97 PolarHBondContact O-N 3.17Å
94	R	81.2	Confident	74.3	Confident	105 Å²	105	103 Å²	103	40%	0.396	50%	0.503	S	S	.	.	H	α-helix	trans	-62.3	-35.9	175.6	-73.1	168.8	-171	165.1	0.8	112.8	R90 R91 I92 R98	R90-R94 WeakPolarHBondContact O-CB 3.39Å; R90-R94 WeakPolarHBondContact O-CD 3.48Å; R90-R94 WeakPolarHBondContact O-CG 3.3Å; R90-R94 PolarHBondContact O-N 3.3Å; R91-R94 PolarHBondContact O-N 3.02Å; I92-R94 PolarHBondContact O-N 2.97Å; R94-R98 WeakPolarHBondContact O-CB 3.42Å; R94-R98 WeakPolarHBondContact O-CG 3.43Å; R94-R98 PolarHBondContact O-N 2.9Å
95	R	79.4	Confident	76.1	Confident	97 Å²	97	100.3 Å²	100.3	37%	0.366	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-48.4	179.2	-174	-175.8	-171.1	169.6	9.6	111.1	S76 T78 R91 I92 S93 R98 A99	S76-R95 VanDerWaalsContact CB-NH2 3.31Å; S76-R95 PolarHBondContact O-NE 3.05Å; S76-R95 PolarHBondContact O-NH1 2.94Å; S76-R95 VanDerWaalsContact O-NH1 3.09Å; S76-R95 PolarHBondContact O-NH2 3.41Å; S76-R95 PolarHBondContact OG-NH1 3.3Å; S76-R95 PolarHBondContact OG-NH2 3.22Å; T78-R95 PolarHBondContact OG1-NH1 3.27Å; R91-R95 PolarHBondContact O-N 3.49Å; I92-R95 PolarHBondContact O-N 3.18Å; S93-R95 VanDerWaalsContact C-N 3.3Å; S93-R95 PolarHBondContact O-N 2.91Å; R95-R98 PolarHBondContact O-N 2.96Å; R95-A99 PolarHBondContact O-N 3.22Å; R95-A99 VanDerWaalsContact O-N 3.07Å
96	T	81.1	Confident	77.8	Confident	74 Å²	74	100.2 Å²	100.2	45%	0.454	49%	0.49	S	S	.	.	H	α-helix	trans	-65.8	-41.7	178.5	48.3	0	0	0	0	111.5	I92 S93 R98 A99 L100	I92-T96 PolarHBondContact O-N 3.45Å; I92-T96 PolarHBondContact O-OG1 3.4Å; S93-T96 WeakPolarHBondContact CA-OG1 3.38Å; S93-T96 PolarHBondContact O-N 3.45Å; S93-T96 PolarHBondContact O-OG1 3.39Å; T96-R98 PolarHBondContact O-N 3.31Å; T96-A99 PolarHBondContact O-N 3.28Å; T96-L100 VanDerWaalsContact O-CG 3.31Å; T96-L100 WeakPolarHBondContact O-CG 3.41Å; T96-L100 PolarHBondContact O-N 2.91Å
97	E	80.7	Confident	79.2	Confident	131 Å²	131	103.1 Å²	103.1	61%	0.612	49%	0.491	S	S	*	.	H	α-helix	trans	-58.3	-44	173.6	-176	-176.8	-172.5	0	0	112.3	S93 L100 Y101	S93-E97 WeakPolarHBondContact O-CB 3.49Å; S93-E97 PolarHBondContact O-N 3.17Å; E97-L100 PolarHBondContact O-N 2.8Å; E97-Y101 WeakPolarHBondContact O-CB 3.5Å; E97-Y101 PolarHBondContact O-N 3.34Å
98	R	86.2	Confident	80.7	Confident	155 Å²	155	102.2 Å²	102.2	59%	0.585	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-48.1	175.6	-80	-175	-177.3	114.9	-3.4	112.7	R94 R95 T96 L100 Y101 E102	R94-R98 WeakPolarHBondContact O-CB 3.42Å; R94-R98 WeakPolarHBondContact O-CG 3.43Å; R94-R98 PolarHBondContact O-N 2.9Å; R95-R98 PolarHBondContact O-N 2.96Å; T96-R98 PolarHBondContact O-N 3.31Å; R98-L100 VanDerWaalsContact C-N 3.27Å; R98-L100 PolarHBondContact O-N 3.03Å; R98-Y101 PolarHBondContact O-N 3.47Å; R98-Y101 VanDerWaalsContact O-N 3.1Å; R98-E102 WeakPolarHBondContact O-CB 3.34Å; R98-E102 WeakPolarHBondContact O-CG 3.49Å; R98-E102 PolarHBondContact O-N 2.93Å
99	A	88.2	Confident	82	Confident	33 Å²	33	103.8 Å²	103.8	27%	0.273	50%	0.496	S	S	.	.	H	α-helix	trans	-58.7	-42.2	178.4	0	0	0	0	0	111.2	R95 T96 E102 S103	R95-A99 PolarHBondContact O-N 3.22Å; R95-A99 VanDerWaalsContact O-N 3.07Å; T96-A99 PolarHBondContact O-N 3.28Å; A99-E102 PolarHBondContact O-N 3.17Å; A99-S103 WeakPolarHBondContact O-CB 3.29Å; A99-S103 PolarHBondContact O-N 3.13Å; A99-S103 PolarHBondContact O-OG 3.41Å
100	L	84.5	Confident	83.5	Confident	120 Å²	120	100.5 Å²	100.5	63%	0.628	49%	0.493	S	S	*	.	H	α-helix	trans	-62.1	-47.1	173.7	-69.6	176.8	0	0	0	111.4	T96 E97 R98 E102 S103 V104	T96-L100 VanDerWaalsContact O-CG 3.31Å; T96-L100 WeakPolarHBondContact O-CG 3.41Å; T96-L100 PolarHBondContact O-N 2.91Å; E97-L100 PolarHBondContact O-N 2.8Å; R98-L100 VanDerWaalsContact C-N 3.27Å; R98-L100 PolarHBondContact O-N 3.03Å; L100-E102 VanDerWaalsContact C-N 3.34Å; L100-E102 PolarHBondContact O-N 3.32Å; L100-S103 PolarHBondContact O-N 3.23Å; L100-S103 PolarHBondContact O-OG 3.05Å; L100-V104 WeakPolarHBondContact O-CG2 3.37Å; L100-V104 PolarHBondContact O-N 3.08Å
101	Y	86.9	Confident	84.2	Confident	139 Å²	139	101 Å²	101	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-63.3	-36.7	178.8	-176.1	-96.3	0	0	0	113.6	E97 R98 V104 K109	E97-Y101 WeakPolarHBondContact O-CB 3.5Å; E97-Y101 PolarHBondContact O-N 3.34Å; R98-Y101 PolarHBondContact O-N 3.47Å; R98-Y101 VanDerWaalsContact O-N 3.1Å; Y101-V104 PolarHBondContact O-N 3.35Å; Y101-K109 HydrophobicContact CE1-CD 4.05Å; Y101-K109 HydrophobicContact CE2-CD 4.47Å; Y101-K109 WeakPolarHBondContact O-CE 3.3Å; Y101-K109 PolarHBondContact O-NZ 3.23Å; Y101-K109 VanDerWaalsContact O-NZ 3.1Å
102	E	90.4	Very high	84.6	Confident	122 Å²	122	98.7 Å²	98.7	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-73.1	-34.2	178.2	-73.6	172.7	-163.9	0	0	111.7	R98 A99 L100 V104	R98-E102 WeakPolarHBondContact O-CB 3.34Å; R98-E102 WeakPolarHBondContact O-CG 3.49Å; R98-E102 PolarHBondContact O-N 2.93Å; A99-E102 PolarHBondContact O-N 3.17Å; L100-E102 VanDerWaalsContact C-N 3.34Å; L100-E102 PolarHBondContact O-N 3.32Å; E102-V104 PolarHBondContact O-N 3.48Å
103	S	90.4	Very high	85.2	Confident	87 Å²	87	104.4 Å²	104.4	61%	0.608	52%	0.52	S	S	*	.	H	α-helix	trans	-68.3	-19.7	173.9	76.9	0	0	0	0	114	A99 L100	A99-S103 WeakPolarHBondContact O-CB 3.29Å; A99-S103 PolarHBondContact O-N 3.13Å; A99-S103 PolarHBondContact O-OG 3.41Å; L100-S103 PolarHBondContact O-N 3.23Å; L100-S103 PolarHBondContact O-OG 3.05Å
104	V	84.3	Confident	85.4	Confident	53 Å²	53	111.3 Å²	111.3	32%	0.321	54%	0.536	S	S	.	.	S	Bend	trans	-73.9	127.9	177.3	173.6	0	0	0	0	110.3	L100 Y101 E102 L108 K109	L100-V104 WeakPolarHBondContact O-CG2 3.37Å; L100-V104 PolarHBondContact O-N 3.08Å; Y101-V104 PolarHBondContact O-N 3.35Å; E102-V104 PolarHBondContact O-N 3.48Å; V104-L108 HydrophobicContact CG1-CB 3.63Å; V104-L108 HydrophobicContact CG1-CD2 4.4Å; V104-K109 HydrophobicContact CG1-CG 4.12Å; V104-K109 WeakPolarHBondContact O-CE 3.38Å
105	P	90.3	Very high	85.5	Confident	55 Å²	55	110.7 Å²	110.7	36%	0.357	55%	0.546	S	S	.	.			trans	-57.3	145.2	175.6	-25.5	34.1	0	0	0	113.5	Y107 L108 K109	P105-Y107 VanDerWaalsContact C-N 3.3Å; P105-Y107 HydrophobicContact CB-CD1 3.89Å; P105-Y107 HydrophobicContact CB-CE1 3.3Å; P105-Y107 HydrophobicContact CB-CE2 4.09Å; P105-Y107 HydrophobicContact CB-CG 4.5Å; P105-Y107 HydrophobicContact CG-CE1 4.28Å; P105-Y107 PolarHBondContact O-N 3.5Å; P105-L108 WeakPolarHBondContact O-CB 3.26Å; P105-L108 PolarHBondContact O-N 3.1Å; P105-K109 PolarHBondContact O-N 3.1Å
106	S	89.2	Confident	85.5	Confident	93 Å²	93	116 Å²	116	65%	0.65	57%	0.571	S	S	*	*	H	α-helix	trans	-55.9	-38.9	-172.5	58.4	0	0	0	0	114.2	L108 K109	S106-L108 VanDerWaalsContact C-N 3.29Å; S106-L108 PolarHBondContact O-N 3.33Å; S106-K109 WeakPolarHBondContact O-CB 3.49Å; S106-K109 PolarHBondContact O-N 2.73Å; S106-K109 VanDerWaalsContact O-N 3.11Å
107	Y	90.1	Very high	85.2	Confident	162 Å²	162	125.8 Å²	125.8	64%	0.635	61%	0.608	S	S	*	*	H	α-helix	trans	-68.1	-26.4	179.9	54.5	-93.3	0	0	0	113.3	P105 S110	P105-Y107 VanDerWaalsContact C-N 3.3Å; P105-Y107 HydrophobicContact CB-CD1 3.89Å; P105-Y107 HydrophobicContact CB-CE1 3.3Å; P105-Y107 HydrophobicContact CB-CE2 4.09Å; P105-Y107 HydrophobicContact CB-CG 4.5Å; P105-Y107 HydrophobicContact CG-CE1 4.28Å; P105-Y107 PolarHBondContact O-N 3.5Å; Y107-S110 PolarHBondContact O-OG 2.76Å
108	L	86.6	Confident	85.4	Confident	96 Å²	96	125.6 Å²	125.6	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-76.2	-27.3	172.3	-107.6	79.4	0	0	0	112	V104 P105 S106 S110 Y111	V104-L108 HydrophobicContact CG1-CB 3.63Å; V104-L108 HydrophobicContact CG1-CD2 4.4Å; P105-L108 WeakPolarHBondContact O-CB 3.26Å; P105-L108 PolarHBondContact O-N 3.1Å; S106-L108 VanDerWaalsContact C-N 3.29Å; S106-L108 PolarHBondContact O-N 3.33Å; L108-S110 VanDerWaalsContact C-N 3.25Å; L108-S110 PolarHBondContact O-N 2.88Å; L108-Y111 VanDerWaalsContact O-CB 3.31Å; L108-Y111 WeakPolarHBondContact O-CB 3.47Å; L108-Y111 PolarHBondContact O-N 3.45Å
109	K	85.5	Confident	85.4	Confident	84 Å²	84	124 Å²	124	37%	0.365	61%	0.609	S	S	.	*	H	α-helix	trans	-64	-31.3	-178.3	-60.1	-175.3	-174.7	-166.2	0	112.7	Y101 V104 P105 S106	Y101-K109 HydrophobicContact CE1-CD 4.05Å; Y101-K109 HydrophobicContact CE2-CD 4.47Å; Y101-K109 WeakPolarHBondContact O-CE 3.3Å; Y101-K109 PolarHBondContact O-NZ 3.23Å; Y101-K109 VanDerWaalsContact O-NZ 3.1Å; V104-K109 HydrophobicContact CG1-CG 4.12Å; V104-K109 WeakPolarHBondContact O-CE 3.38Å; P105-K109 PolarHBondContact O-N 3.1Å; S106-K109 WeakPolarHBondContact O-CB 3.49Å; S106-K109 PolarHBondContact O-N 2.73Å; S106-K109 VanDerWaalsContact O-N 3.11Å
110	S	88.8	Confident	85.2	Confident	91 Å²	91	129.1 Å²	129.1	64%	0.636	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-6.8	174.8	53.7	0	0	0	0	113.6	Y107 L108 S112	Y107-S110 PolarHBondContact O-OG 2.76Å; L108-S110 VanDerWaalsContact C-N 3.25Å; L108-S110 PolarHBondContact O-N 2.88Å; S110-S112 PolarHBondContact O-N 2.71Å
111	Y	85	Confident	85.2	Confident	163 Å²	163	129.6 Å²	129.6	64%	0.639	63%	0.627	S	S	*	*			trans	-68.7	102.9	-177.6	-175.3	-100	0	0	0	109.9	L108 Y113	L108-Y111 VanDerWaalsContact O-CB 3.31Å; L108-Y111 WeakPolarHBondContact O-CB 3.47Å; L108-Y111 PolarHBondContact O-N 3.45Å; Y111-Y113 HydrophobicContact CE1-CD2 4.4Å
112	S	80.2	Confident	85.1	Confident	89 Å²	89	129 Å²	129	62%	0.622	63%	0.633	S	S	*	*			trans	-94.8	107.6	173.2	-61	0	0	0	0	108.4	S110 R114	S110-S112 PolarHBondContact O-N 2.71Å; S112-R114 PolarHBondContact O-N 3.32Å; S112-R114 VanDerWaalsContact O-N 3.14Å
113	Y	82.1	Confident	84.8	Confident	177 Å²	177	129.5 Å²	129.5	69%	0.694	64%	0.637	S	S	*	*			trans	-60.1	116	175.5	179.9	-104	0	0	0	109.9	Y111 P115	Y111-Y113 HydrophobicContact CE1-CD2 4.4Å; Y113-P115 HydrophobicContact CE1-CB 4.08Å; Y113-P115 HydrophobicContact CE1-CG 4.48Å
114	R	81.8	Confident	84.4	Confident	212 Å²	212	132.5 Å²	132.5	80%	0.8	64%	0.639	S	S	*	*			trans	-111.3	107.4	173.2	-72	-174.5	-179.3	-96.6	1.1	108.5	S112 K116	S112-R114 PolarHBondContact O-N 3.32Å; S112-R114 VanDerWaalsContact O-N 3.14Å; R114-K116 PolarHBondContact O-N 3.37Å
115	P	83.9	Confident	84.4	Confident	92 Å²	92	138.6 Å²	138.6	60%	0.597	66%	0.663	S	S	*	*			trans	-61	136.3	177.3	23.2	-30.3	0	0	0	110.1	Y113	Y113-P115 HydrophobicContact CE1-CB 4.08Å; Y113-P115 HydrophobicContact CE1-CG 4.48Å
116	K	78.2	Confident	83.9	Confident	207 Å²	207	145.6 Å²	145.6	90%	0.9	69%	0.689	S	S	*	*			trans	-67	132.2	171.3	-67.4	-94.4	-175.4	169.8	0	107.8	R114	R114-K116 PolarHBondContact O-N 3.37Å
117	K	75.4	Confident	83.4	Confident	281 Å²	281	150.4 Å²	150.4	100%	1.222	69%	0.692	S	S	*	*			trans	-68.2	0	168.1	-73.2	-175.1	177.4	-175	0	110.1

Retrieved 117 of 117 residues in 22.8 ms (Link to these results)

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