A0A077ZKE9_TRITR Loading...

DNA pol3 theta domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZKE9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 76 aa.

						>A0A077ZKE9_TRITR|A0A077ZKE9
MLKNLAKLDQTEMDNVNVDLAAAGVAFKERYNMPVIAEAVEREQPEHLRSWFRERLIAHRLASVNLSRLPYEPKLK
					

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(Predicted Aligned Error values between residue pairs)

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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	44.4	Very low	63.5	Low	221 Å²	221	128.7 Å²	128.7	100%	1.089	66%	0.662	S	S	*	*				0	108.6	0	-97.7	-178.5	174.9	0	0	108.8	K3	M1-K3 PolarHBondContact O-N 3.21Å
2	L	52.6	Low	64.6	Low	154 Å²	154	126.7 Å²	126.7	81%	0.806	65%	0.648	S	S	*	*			trans	-71.5	94	172.4	-78.3	159	0	0	0	108.3	N4	L2-N4 PolarHBondContact O-N 3.05Å
3	K	61.9	Low	65.6	Low	192 Å²	192	123.9 Å²	123.9	84%	0.835	63%	0.632	S	S	*	*			trans	-80.3	56.5	173.1	-73.9	173.5	173.9	177.7	0	110	M1	M1-K3 PolarHBondContact O-N 3.21Å
4	N	66.7	Low	66.6	Low	89 Å²	89	118.9 Å²	118.9	48%	0.476	61%	0.607	S	S	.	*			trans	-96.1	108.7	177.7	-159.1	-14	0	0	0	108.9	L2 A6 K7	L2-N4 PolarHBondContact O-N 3.05Å; N4-A6 PolarHBondContact O-N 3.03Å; N4-A6 VanDerWaalsContact O-N 3.13Å; N4-K7 PolarHBondContact O-N 3.13Å
5	L	61	Low	67.5	Low	121 Å²	121	113.7 Å²	113.7	63%	0.634	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-56	-30	-178.3	-70	159.6	0	0	0	112.1	K7 L8	L5-K7 PolarHBondContact O-N 3.29Å; L5-L8 HydrophobicContact CD2-CD1 4.39Å; L5-L8 WeakPolarHBondContact O-CD1 3.4Å; L5-L8 PolarHBondContact O-N 3.04Å
6	A	64	Low	68.3	Low	83 Å²	83	111.2 Å²	111.2	69%	0.686	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-71.5	-6.4	179.6	0	0	0	0	0	115.1	N4	N4-A6 PolarHBondContact O-N 3.03Å; N4-A6 VanDerWaalsContact O-N 3.13Å
7	K	65.3	Low	69	Low	162 Å²	162	109.1 Å²	109.1	70%	0.704	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-100.7	-3.7	175.7	-72.6	-163.9	174.7	-170.1	0	113.6	N4 L5	N4-K7 PolarHBondContact O-N 3.13Å; L5-K7 PolarHBondContact O-N 3.29Å
8	L	63.9	Low	69.8	Low	68 Å²	68	103.1 Å²	103.1	36%	0.356	53%	0.532	S	S	.	.	S	Bend	trans	-75.7	152.9	176.1	-74.6	100.6	0	0	0	110.4	L5 E12	L5-L8 HydrophobicContact CD2-CD1 4.39Å; L5-L8 WeakPolarHBondContact O-CD1 3.4Å; L5-L8 PolarHBondContact O-N 3.04Å; L8-E12 HydrophobicContact CB-CB 4.07Å; L8-E12 HydrophobicContact CD2-CB 3.83Å; L8-E12 HydrophobicContact CD2-CG 4.41Å
9	D	71.9	Confident	70.5	Confident	103 Å²	103	99.7 Å²	99.7	55%	0.551	52%	0.515	S	S	*	.			trans	-60.5	149	175.2	-161.2	-93.3	0	0	0	110	T11 E12 M13	D9-T11 PolarHBondContact O-N 2.93Å; D9-T11 VanDerWaalsContact O-N 3.11Å; D9-T11 PolarHBondContact OD1-N 3.13Å; D9-T11 PolarHBondContact OD1-OG1 3.46Å; D9-T11 VanDerWaalsContact OD1-OG1 3.13Å; D9-E12 PolarHBondContact O-N 3.11Å; D9-M13 PolarHBondContact O-N 3.03Å
10	Q	72.8	Confident	71.2	Confident	149 Å²	149	100.7 Å²	100.7	70%	0.696	52%	0.521	S	S	*	.	H	α-helix	trans	-52.8	-39.7	-176.9	-72.7	174.9	57.8	0	0	111	E12 M13 D14	Q10-E12 VanDerWaalsContact C-N 3.35Å; Q10-E12 PolarHBondContact O-N 3.31Å; Q10-M13 WeakPolarHBondContact O-CB 3.34Å; Q10-M13 PolarHBondContact O-N 3.01Å; Q10-M13 VanDerWaalsContact O-N 3.13Å; Q10-D14 PolarHBondContact O-N 3.11Å
11	T	74.4	Confident	71.9	Confident	74 Å²	74	97 Å²	97	45%	0.454	51%	0.505	S	S	.	.	H	α-helix	trans	-58.2	-42.9	176.9	-42.7	0	0	0	0	113	D9 N15	D9-T11 PolarHBondContact O-N 2.93Å; D9-T11 VanDerWaalsContact O-N 3.11Å; D9-T11 PolarHBondContact OD1-N 3.13Å; D9-T11 PolarHBondContact OD1-OG1 3.46Å; D9-T11 VanDerWaalsContact OD1-OG1 3.13Å; T11-N15 VanDerWaalsContact O-CG 3.3Å; T11-N15 PolarHBondContact O-N 3.27Å; T11-N15 PolarHBondContact O-ND2 2.86Å; T11-N15 VanDerWaalsContact O-ND2 3.11Å
12	E	76	Confident	73.8	Confident	104 Å²	104	86.5 Å²	86.5	49%	0.486	45%	0.454	S	S	.	.	H	α-helix	trans	-71.6	-37.3	177.8	-70.9	-167.2	100	0	0	111.2	L8 D9 Q10 D14 N15 V16	L8-E12 HydrophobicContact CB-CB 4.07Å; L8-E12 HydrophobicContact CD2-CB 3.83Å; L8-E12 HydrophobicContact CD2-CG 4.41Å; D9-E12 PolarHBondContact O-N 3.11Å; Q10-E12 VanDerWaalsContact C-N 3.35Å; Q10-E12 PolarHBondContact O-N 3.31Å; E12-D14 VanDerWaalsContact C-N 3.35Å; E12-N15 PolarHBondContact O-N 2.96Å; E12-V16 WeakPolarHBondContact O-CG2 3.41Å; E12-V16 PolarHBondContact O-N 3.13Å
13	M	77.6	Confident	75.2	Confident	91 Å²	91	80.6 Å²	80.6	45%	0.448	43%	0.427	S	S	.	.	H	α-helix	trans	-62.2	-43.8	175	-170.8	170.9	68.3	0	0	111.4	D9 Q10 V16 N17	D9-M13 PolarHBondContact O-N 3.03Å; Q10-M13 WeakPolarHBondContact O-CB 3.34Å; Q10-M13 PolarHBondContact O-N 3.01Å; Q10-M13 VanDerWaalsContact O-N 3.13Å; M13-V16 PolarHBondContact O-N 3.34Å; M13-N17 PolarHBondContact O-N 3.02Å; M13-N17 PolarHBondContact O-ND2 3.31Å
14	D	80.2	Confident	76.2	Confident	53 Å²	53	72.8 Å²	72.8	28%	0.283	40%	0.401	S	S	.	.	H	α-helix	trans	-65.8	-40.7	176.7	-66.9	-54.9	0	0	0	111.5	Q10 E12 V16 N17 V18 L48	Q10-D14 PolarHBondContact O-N 3.11Å; E12-D14 VanDerWaalsContact C-N 3.35Å; D14-V16 VanDerWaalsContact C-N 3.32Å; D14-V16 PolarHBondContact O-N 3.22Å; D14-N17 PolarHBondContact O-N 3.38Å; D14-V18 WeakPolarHBondContact O-CB 3.42Å; D14-V18 WeakPolarHBondContact O-CG2 3.4Å; D14-V18 PolarHBondContact O-N 2.89Å; D14-L48 HydrophobicContact CB-CD1 3.32Å
15	N	79.6	Confident	76.9	Confident	42 Å²	42	68.7 Å²	68.7	23%	0.225	38%	0.379	C	S	.	.	H	α-helix	trans	-58.2	-41.5	173.5	-79.4	-37.1	0	0	0	112.9	T11 E12 V18 D19 L48 W51	T11-N15 VanDerWaalsContact O-CG 3.3Å; T11-N15 PolarHBondContact O-N 3.27Å; T11-N15 PolarHBondContact O-ND2 2.86Å; T11-N15 VanDerWaalsContact O-ND2 3.11Å; E12-N15 PolarHBondContact O-N 2.96Å; N15-V18 PolarHBondContact O-N 2.91Å; N15-D19 WeakPolarHBondContact O-CB 3.14Å; N15-D19 PolarHBondContact O-N 3.49Å; N15-L48 WeakPolarHBondContact OD1-CD2 3.47Å; N15-W51 PolarHBondContact O-NE1 3.36Å
16	V	80.6	Confident	77.9	Confident	73 Å²	73	63 Å²	63	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-69.3	-39.2	177.2	174.3	0	0	0	0	111.1	E12 M13 D14 V18 D19 L20	E12-V16 WeakPolarHBondContact O-CG2 3.41Å; E12-V16 PolarHBondContact O-N 3.13Å; M13-V16 PolarHBondContact O-N 3.34Å; D14-V16 VanDerWaalsContact C-N 3.32Å; D14-V16 PolarHBondContact O-N 3.22Å; V16-V18 VanDerWaalsContact C-N 3.34Å; V16-D19 PolarHBondContact O-N 3.32Å; V16-L20 WeakPolarHBondContact O-CB 3.33Å; V16-L20 PolarHBondContact O-N 2.89Å
17	N	81	Confident	78.5	Confident	76 Å²	76	64 Å²	64	41%	0.406	34%	0.338	S	S	.	.	H	α-helix	trans	-62.8	-42.1	174.8	-79.3	-36.9	0	0	0	111.8	M13 D14 L20 A21	M13-N17 PolarHBondContact O-N 3.02Å; M13-N17 PolarHBondContact O-ND2 3.31Å; D14-N17 PolarHBondContact O-N 3.38Å; N17-L20 PolarHBondContact O-N 3.36Å; N17-A21 WeakPolarHBondContact O-CB 3.06Å; N17-A21 PolarHBondContact O-N 2.88Å
18	V	82.7	Confident	79.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-42.8	176.5	173.2	0	0	0	0	111	D14 N15 V16 A21 A22 Q44 L48 F52	D14-V18 WeakPolarHBondContact O-CB 3.42Å; D14-V18 WeakPolarHBondContact O-CG2 3.4Å; D14-V18 PolarHBondContact O-N 2.89Å; N15-V18 PolarHBondContact O-N 2.91Å; V16-V18 VanDerWaalsContact C-N 3.34Å; V18-A21 PolarHBondContact O-N 3.2Å; V18-A22 WeakPolarHBondContact O-CB 3.28Å; V18-A22 PolarHBondContact O-N 3.45Å; V18-Q44 HydrophobicContact CG1-CG 4.48Å; V18-Q44 HydrophobicContact CG2-CB 4.36Å; V18-Q44 HydrophobicContact CG2-CG 4.03Å; V18-L48 HydrophobicContact CG1-CB 4.47Å; V18-L48 HydrophobicContact CG2-CB 3.62Å; V18-L48 HydrophobicContact CG2-CD1 3.55Å; V18-L48 HydrophobicContact CG2-CG 4.14Å; V18-F52 HydrophobicContact CG1-CB 3.53Å; V18-F52 HydrophobicContact CG1-CD2 3.87Å; V18-F52 HydrophobicContact CG1-CG 4.2Å
19	D	83.8	Confident	79.9	Confident	39 Å²	39	61.3 Å²	61.3	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-60.3	-46.5	174.2	-178.4	19.3	0	0	0	111.3	N15 V16 A21 A22 A23 R55 H59	N15-D19 WeakPolarHBondContact O-CB 3.14Å; N15-D19 PolarHBondContact O-N 3.49Å; V16-D19 PolarHBondContact O-N 3.32Å; D19-A21 VanDerWaalsContact C-N 3.3Å; D19-A21 PolarHBondContact O-N 3.37Å; D19-A22 PolarHBondContact O-N 3.14Å; D19-A23 WeakPolarHBondContact O-CB 3.34Å; D19-A23 PolarHBondContact O-N 2.97Å; D19-R55 HydrophobicContact CB-CG 4.12Å; D19-R55 WeakPolarHBondContact OD1-CD 3.35Å; D19-R55 WeakPolarHBondContact OD1-CG 3.47Å; D19-R55 IonicContact OD1-CZ 2.81Å; D19-R55 IonicContact OD1-NE 2.66Å; D19-R55 PolarHBondContact OD1-NE 2.82Å; D19-R55 IonicContact OD1-NH2 3.44Å; D19-R55 PolarHBondContact OD1-NH2 3.08Å; D19-R55 IonicContact OD2-CZ 3.45Å; D19-R55 IonicContact OD2-NE 3.31Å; D19-R55 PolarHBondContact OD2-NE 3.4Å; D19-R55 IonicContact OD2-NH2 2.77Å; D19-R55 PolarHBondContact OD2-NH2 2.92Å; D19-H59 IonicContact OD1-CD2 3.79Å; D19-H59 IonicContact OD1-CE1 3.59Å; D19-H59 IonicContact OD1-NE2 2.74Å; D19-H59 PolarHBondContact OD1-NE2 3.27Å
20	L	84.5	Confident	80.1	Confident	120 Å²	120	59 Å²	59	63%	0.628	31%	0.309	S	S	*	.	H	α-helix	trans	-59.6	-42.4	177	-178.7	63.6	0	0	0	111.6	V16 N17 A23 G24	V16-L20 WeakPolarHBondContact O-CB 3.33Å; V16-L20 PolarHBondContact O-N 2.89Å; N17-L20 PolarHBondContact O-N 3.36Å; L20-A23 PolarHBondContact O-N 2.97Å; L20-G24 PolarHBondContact O-N 3.5Å
21	A	84.3	Confident	80.1	Confident	24 Å²	24	55.3 Å²	55.3	20%	0.198	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-44.5	176.7	0	0	0	0	0	111.4	N17 V18 D19 G24 V25 V40 F52	N17-A21 WeakPolarHBondContact O-CB 3.06Å; N17-A21 PolarHBondContact O-N 2.88Å; V18-A21 PolarHBondContact O-N 3.2Å; D19-A21 VanDerWaalsContact C-N 3.3Å; D19-A21 PolarHBondContact O-N 3.37Å; A21-G24 PolarHBondContact O-N 3.36Å; A21-V25 WeakPolarHBondContact O-CG2 3.42Å; A21-V25 PolarHBondContact O-N 3.43Å; A21-V40 HydrophobicContact CB-CG1 3.63Å; A21-F52 HydrophobicContact CB-CE2 4.27Å
22	A	84.1	Confident	79.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-42.3	177.2	0	0	0	0	0	112	V18 D19 G24 V25 A26 F52 R55	V18-A22 WeakPolarHBondContact O-CB 3.28Å; V18-A22 PolarHBondContact O-N 3.45Å; D19-A22 PolarHBondContact O-N 3.14Å; A22-G24 VanDerWaalsContact C-N 3.32Å; A22-G24 PolarHBondContact O-N 2.85Å; A22-V25 PolarHBondContact O-N 2.89Å; A22-A26 PolarHBondContact O-N 2.96Å; A22-F52 HydrophobicContact CB-CD2 3.77Å; A22-F52 HydrophobicContact CB-CE2 3.71Å; A22-R55 HydrophobicContact CB-CB 4.07Å; A22-R55 HydrophobicContact CB-CG 4.14Å
23	A	82	Confident	79.8	Confident	29 Å²	29	58.2 Å²	58.2	24%	0.24	30%	0.303	C	S	.	.	H	α-helix	trans	-60.5	-43.8	173.8	0	0	0	0	0	111	D19 L20 V25 A26 F27 H59	D19-A23 WeakPolarHBondContact O-CB 3.34Å; D19-A23 PolarHBondContact O-N 2.97Å; L20-A23 PolarHBondContact O-N 2.97Å; A23-V25 PolarHBondContact O-N 2.88Å; A23-A26 PolarHBondContact O-N 3.26Å; A23-F27 VanDerWaalsContact O-CB 3.28Å; A23-F27 WeakPolarHBondContact O-CB 3.43Å; A23-F27 PolarHBondContact O-N 3.11Å; A23-H59 VanDerWaalsContact CB-CE1 3.45Å; A23-H59 WeakPolarHBondContact CB-CE1 3.43Å; A23-H59 WeakPolarHBondContact CB-NE2 3.45Å; A23-H59 PolarHBondContact N-CD2 3.37Å; A23-H59 VanDerWaalsContact N-CD2 3.33Å
24	G	83	Confident	79.7	Confident	29 Å²	29	60.3 Å²	60.3	30%	0.299	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-39.7	177.2	0	0	0	0	0	112.9	L20 A21 A22 K28	L20-G24 PolarHBondContact O-N 3.5Å; A21-G24 PolarHBondContact O-N 3.36Å; A22-G24 VanDerWaalsContact C-N 3.32Å; A22-G24 PolarHBondContact O-N 2.85Å; G24-K28 WeakPolarHBondContact O-CB 3.07Å; G24-K28 VanDerWaalsContact O-CG 3.23Å; G24-K28 WeakPolarHBondContact O-CG 3.23Å; G24-K28 PolarHBondContact O-N 3.14Å
25	V	82.9	Confident	79.4	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-52.7	174.9	174.5	0	0	0	0	110.7	A21 A22 A23 F27 K28 E29 V35 A37 V40 F52 L56	A21-V25 WeakPolarHBondContact O-CG2 3.42Å; A21-V25 PolarHBondContact O-N 3.43Å; A22-V25 PolarHBondContact O-N 2.89Å; A23-V25 PolarHBondContact O-N 2.88Å; V25-F27 VanDerWaalsContact C-N 3.29Å; V25-F27 PolarHBondContact O-N 2.74Å; V25-K28 PolarHBondContact O-N 2.77Å; V25-K28 VanDerWaalsContact O-N 3.16Å; V25-E29 HydrophobicContact CG1-CG 4.43Å; V25-E29 WeakPolarHBondContact O-CG 3.35Å; V25-E29 PolarHBondContact O-N 3.31Å; V25-V35 HydrophobicContact CB-CG2 4.25Å; V25-V35 HydrophobicContact CG1-CG1 4.02Å; V25-V35 HydrophobicContact CG1-CG2 4.21Å; V25-V35 HydrophobicContact CG2-CG2 3.81Å; V25-A37 HydrophobicContact CG1-CB 3.77Å; V25-V40 HydrophobicContact CG2-CB 4.04Å; V25-V40 HydrophobicContact CG2-CG1 4.2Å; V25-V40 HydrophobicContact CG2-CG2 3.64Å; V25-F52 HydrophobicContact CG2-CZ 4.19Å; V25-L56 HydrophobicContact CB-CD1 4Å; V25-L56 HydrophobicContact CG1-CD1 3.71Å
26	A	80.8	Confident	79.3	Confident	2 Å²	2	63 Å²	63	2%	0.017	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-37.6	-179.8	0	0	0	0	0	112.6	A22 A23 R30 H59	A22-A26 PolarHBondContact O-N 2.96Å; A23-A26 PolarHBondContact O-N 3.26Å; A26-R30 WeakPolarHBondContact O-CB 3.38Å; A26-R30 PolarHBondContact O-N 3.49Å; A26-H59 HydrophobicContact CB-CB 3.46Å; A26-H59 VanDerWaalsContact CB-CB 3.46Å
27	F	76.9	Confident	79.2	Confident	102 Å²	102	60.7 Å²	60.7	45%	0.447	33%	0.327	S	S	.	.	H	α-helix	trans	-64	-49.7	173.3	-169	-85.9	0	0	0	110.8	A23 V25 E29 R30 Y31	A23-F27 VanDerWaalsContact O-CB 3.28Å; A23-F27 WeakPolarHBondContact O-CB 3.43Å; A23-F27 PolarHBondContact O-N 3.11Å; V25-F27 VanDerWaalsContact C-N 3.29Å; V25-F27 PolarHBondContact O-N 2.74Å; F27-E29 VanDerWaalsContact C-N 3.33Å; F27-E29 PolarHBondContact O-N 3.06Å; F27-R30 WeakPolarHBondContact O-CB 3.28Å; F27-R30 PolarHBondContact O-N 3.33Å; F27-Y31 AromaticContact CD1-CD2 3.5Å; F27-Y31 HydrophobicContact CD1-CD2 3.5Å; F27-Y31 AromaticContact CD1-CE2 3.79Å; F27-Y31 HydrophobicContact CD1-CE2 3.79Å; F27-Y31 HydrophobicContact CD2-CD2 4.13Å; F27-Y31 AromaticContact CD2-CE2 3.63Å; F27-Y31 HydrophobicContact CD2-CE2 3.63Å; F27-Y31 AromaticContact CE1-CD2 3.3Å; F27-Y31 HydrophobicContact CE1-CD2 3.3Å; F27-Y31 AromaticContact CE1-CE2 3.36Å; F27-Y31 HydrophobicContact CE1-CE2 3.36Å; F27-Y31 HydrophobicContact CE1-CG 4.13Å; F27-Y31 AromaticContact CE2-CD2 3.98Å; F27-Y31 HydrophobicContact CE2-CD2 3.98Å; F27-Y31 AromaticContact CE2-CE2 3.2Å; F27-Y31 HydrophobicContact CE2-CE2 3.2Å; F27-Y31 AromaticContact CE2-CZ 3.87Å; F27-Y31 AromaticContact CG-CD2 3.92Å; F27-Y31 HydrophobicContact CG-CD2 3.92Å; F27-Y31 AromaticContact CG-CE2 3.91Å; F27-Y31 HydrophobicContact CG-CE2 3.91Å; F27-Y31 AromaticContact CZ-CD2 3.57Å; F27-Y31 HydrophobicContact CZ-CD2 3.57Å; F27-Y31 HydrophobicContact CZ-CE1 4.49Å; F27-Y31 AromaticContact CZ-CE2 3.04Å; F27-Y31 HydrophobicContact CZ-CE2 3.04Å; F27-Y31 AromaticContact CZ-CZ 3.56Å; F27-Y31 VanDerWaalsContact O-CD2 3.25Å; F27-Y31 WeakPolarHBondContact O-CD2 3.39Å; F27-Y31 PolarHBondContact O-N 3.22Å
28	K	81.4	Confident	79.2	Confident	92 Å²	92	62.5 Å²	62.5	40%	0.4	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-41.7	177.8	-74.8	174.2	-177.4	-177.8	0	112.2	G24 V25 R30 Y31 N32 M33 V35	G24-K28 WeakPolarHBondContact O-CB 3.07Å; G24-K28 VanDerWaalsContact O-CG 3.23Å; G24-K28 WeakPolarHBondContact O-CG 3.23Å; G24-K28 PolarHBondContact O-N 3.14Å; V25-K28 PolarHBondContact O-N 2.77Å; V25-K28 VanDerWaalsContact O-N 3.16Å; K28-R30 VanDerWaalsContact C-N 3.32Å; K28-R30 PolarHBondContact O-N 3.44Å; K28-Y31 PolarHBondContact O-N 2.81Å; K28-N32 PolarHBondContact O-N 3.22Å; K28-M33 HydrophobicContact CB-CB 4.03Å; K28-M33 HydrophobicContact CG-CB 4.22Å; K28-M33 HydrophobicContact CG-CE 4.07Å; K28-M33 PolarHBondContact O-N 2.91Å; K28-V35 HydrophobicContact CB-CB 3.66Å; K28-V35 HydrophobicContact CB-CG1 3.63Å; K28-V35 HydrophobicContact CB-CG2 4.27Å; K28-V35 HydrophobicContact CD-CB 3.77Å; K28-V35 HydrophobicContact CD-CG2 3.73Å; K28-V35 HydrophobicContact CG-CB 4.37Å
29	E	78.4	Confident	79.2	Confident	83 Å²	83	64.4 Å²	64.4	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-41.3	172.9	-71.2	-167.8	112.6	0	0	111.4	V25 F27 N32 V35 R60	V25-E29 HydrophobicContact CG1-CG 4.43Å; V25-E29 WeakPolarHBondContact O-CG 3.35Å; V25-E29 PolarHBondContact O-N 3.31Å; F27-E29 VanDerWaalsContact C-N 3.33Å; F27-E29 PolarHBondContact O-N 3.06Å; E29-N32 PolarHBondContact O-N 2.87Å; E29-V35 HydrophobicContact CG-CG1 3.65Å; E29-R60 IonicContact OE1-CZ 3.9Å; E29-R60 IonicContact OE1-NH2 2.92Å; E29-R60 PolarHBondContact OE1-NH2 2.66Å; E29-R60 IonicContact OE2-CZ 3.67Å; E29-R60 IonicContact OE2-NE 2.83Å; E29-R60 PolarHBondContact OE2-NE 3.32Å; E29-R60 IonicContact OE2-NH2 2.71Å; E29-R60 PolarHBondContact OE2-NH2 2.94Å
30	R	75.2	Confident	78.9	Confident	53 Å²	53	63.6 Å²	63.6	20%	0.2	35%	0.345	C	S	.	.	H	α-helix	trans	-66.2	-36.5	178.4	178.8	174	169.4	-131.3	-3.2	113.7	A26 F27 K28 N32 L66 S67	A26-R30 WeakPolarHBondContact O-CB 3.38Å; A26-R30 PolarHBondContact O-N 3.49Å; F27-R30 WeakPolarHBondContact O-CB 3.28Å; F27-R30 PolarHBondContact O-N 3.33Å; K28-R30 VanDerWaalsContact C-N 3.32Å; K28-R30 PolarHBondContact O-N 3.44Å; R30-N32 VanDerWaalsContact C-N 3.32Å; R30-L66 PolarHBondContact NE-O 2.91Å; R30-S67 PolarHBondContact NH2-O 3.49Å
31	Y	73.1	Confident	78.7	Confident	72 Å²	72	59.6 Å²	59.6	28%	0.282	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	13.7	179.2	-70.8	-88.8	0	0	0	113.3	F27 K28 M33 Y71	F27-Y31 AromaticContact CD1-CD2 3.5Å; F27-Y31 HydrophobicContact CD1-CD2 3.5Å; F27-Y31 AromaticContact CD1-CE2 3.79Å; F27-Y31 HydrophobicContact CD1-CE2 3.79Å; F27-Y31 HydrophobicContact CD2-CD2 4.13Å; F27-Y31 AromaticContact CD2-CE2 3.63Å; F27-Y31 HydrophobicContact CD2-CE2 3.63Å; F27-Y31 AromaticContact CE1-CD2 3.3Å; F27-Y31 HydrophobicContact CE1-CD2 3.3Å; F27-Y31 AromaticContact CE1-CE2 3.36Å; F27-Y31 HydrophobicContact CE1-CE2 3.36Å; F27-Y31 HydrophobicContact CE1-CG 4.13Å; F27-Y31 AromaticContact CE2-CD2 3.98Å; F27-Y31 HydrophobicContact CE2-CD2 3.98Å; F27-Y31 AromaticContact CE2-CE2 3.2Å; F27-Y31 HydrophobicContact CE2-CE2 3.2Å; F27-Y31 AromaticContact CE2-CZ 3.87Å; F27-Y31 AromaticContact CG-CD2 3.92Å; F27-Y31 HydrophobicContact CG-CD2 3.92Å; F27-Y31 AromaticContact CG-CE2 3.91Å; F27-Y31 HydrophobicContact CG-CE2 3.91Å; F27-Y31 AromaticContact CZ-CD2 3.57Å; F27-Y31 HydrophobicContact CZ-CD2 3.57Å; F27-Y31 HydrophobicContact CZ-CE1 4.49Å; F27-Y31 AromaticContact CZ-CE2 3.04Å; F27-Y31 HydrophobicContact CZ-CE2 3.04Å; F27-Y31 AromaticContact CZ-CZ 3.56Å; F27-Y31 VanDerWaalsContact O-CD2 3.25Å; F27-Y31 WeakPolarHBondContact O-CD2 3.39Å; F27-Y31 PolarHBondContact O-N 3.22Å; K28-Y31 PolarHBondContact O-N 2.81Å; Y31-M33 PolarHBondContact O-N 3.05Å; Y31-M33 VanDerWaalsContact O-N 3.17Å; Y31-Y71 HydrophobicContact CD1-CG 4.29Å; Y31-Y71 HydrophobicContact CE1-CD2 4.36Å; Y31-Y71 HydrophobicContact CE1-CG 4.4Å
32	N	70.2	Confident	78.6	Confident	149 Å²	149	66.8 Å²	66.8	80%	0.797	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	27.8	179.8	-150.7	91.9	0	0	0	113.3	K28 E29 R30	K28-N32 PolarHBondContact O-N 3.22Å; E29-N32 PolarHBondContact O-N 2.87Å; R30-N32 VanDerWaalsContact C-N 3.32Å
33	M	72.6	Confident	78.6	Confident	90 Å²	90	74.1 Å²	74.1	44%	0.443	38%	0.379	S	S	.	.			trans	-83.6	138.7	171.5	-79.2	-168.1	-84.3	0	0	109.7	K28 Y31 V35	K28-M33 HydrophobicContact CB-CB 4.03Å; K28-M33 HydrophobicContact CG-CB 4.22Å; K28-M33 HydrophobicContact CG-CE 4.07Å; K28-M33 PolarHBondContact O-N 2.91Å; Y31-M33 PolarHBondContact O-N 3.05Å; Y31-M33 VanDerWaalsContact O-N 3.17Å; M33-V35 PolarHBondContact O-N 3.38Å; M33-V35 VanDerWaalsContact O-N 3.08Å
34	P	75.6	Confident	78.4	Confident	135 Å²	135	74.1 Å²	74.1	88%	0.877	37%	0.374	S	S	*	.			trans	-65.2	114.2	177.4	27.3	-33.2	0	0	0	109.6
35	V	74	Confident	78.2	Confident	34 Å²	34	75 Å²	75	21%	0.206	37%	0.374	C	S	.	.			trans	-132.4	137	172.4	65.9	0	0	0	0	109.6	V25 K28 E29 M33	V25-V35 HydrophobicContact CB-CG2 4.25Å; V25-V35 HydrophobicContact CG1-CG1 4.02Å; V25-V35 HydrophobicContact CG1-CG2 4.21Å; V25-V35 HydrophobicContact CG2-CG2 3.81Å; K28-V35 HydrophobicContact CB-CB 3.66Å; K28-V35 HydrophobicContact CB-CG1 3.63Å; K28-V35 HydrophobicContact CB-CG2 4.27Å; K28-V35 HydrophobicContact CD-CB 3.77Å; K28-V35 HydrophobicContact CD-CG2 3.73Å; K28-V35 HydrophobicContact CG-CB 4.37Å; E29-V35 HydrophobicContact CG-CG1 3.65Å; M33-V35 PolarHBondContact O-N 3.38Å; M33-V35 VanDerWaalsContact O-N 3.08Å
36	I	78.6	Confident	78.2	Confident	119 Å²	119	81.9 Å²	81.9	61%	0.61	41%	0.406	S	S	*	.			trans	-104.6	97.5	178.1	-52.4	175.2	0	0	0	106.8	E38 A39 V40	I36-E38 HydrophobicContact CG2-CB 4.16Å; I36-E38 PolarHBondContact O-N 3.4Å; I36-A39 HydrophobicContact CB-CB 3.77Å; I36-A39 HydrophobicContact CG2-CB 3.83Å; I36-A39 WeakPolarHBondContact O-CB 3.48Å; I36-A39 PolarHBondContact O-N 3.36Å; I36-V40 PolarHBondContact O-N 2.78Å
37	A	78.7	Confident	78.2	Confident	24 Å²	24	87.6 Å²	87.6	20%	0.198	43%	0.433	C	S	.	.	H	α-helix	trans	-55.3	-35.6	177.7	0	0	0	0	0	111.9	V25 V40 E41 L56	V25-A37 HydrophobicContact CG1-CB 3.77Å; A37-V40 PolarHBondContact O-N 3.13Å; A37-E41 PolarHBondContact O-N 3Å; A37-L56 HydrophobicContact CB-CD2 4.35Å
38	E	80	Confident	78.4	Confident	114 Å²	114	83.1 Å²	83.1	53%	0.533	41%	0.413	S	S	.	.	H	α-helix	trans	-66.5	-35.6	176.4	-168.4	-176.8	116.8	0	0	112.8	I36 V40 E41 R42	I36-E38 HydrophobicContact CG2-CB 4.16Å; I36-E38 PolarHBondContact O-N 3.4Å; E38-V40 VanDerWaalsContact C-N 3.32Å; E38-E41 PolarHBondContact O-N 3.36Å; E38-R42 VanDerWaalsContact O-CG 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.5Å; E38-R42 PolarHBondContact O-N 3.02Å; E38-R42 IonicContact OE1-CZ 3.4Å; E38-R42 VanDerWaalsContact OE1-CZ 3.28Å; E38-R42 IonicContact OE1-NE 3.48Å; E38-R42 PolarHBondContact OE1-NE 2.96Å; E38-R42 IonicContact OE1-NH2 3.66Å; E38-R42 PolarHBondContact OE1-NH2 3.5Å
39	A	82.3	Confident	78.4	Confident	39 Å²	39	82 Å²	82	32%	0.322	41%	0.407	S	S	.	.	H	α-helix	trans	-64.6	-43.1	175.5	0	0	0	0	0	109.9	I36 E41 R42 E43	I36-A39 HydrophobicContact CB-CB 3.77Å; I36-A39 HydrophobicContact CG2-CB 3.83Å; I36-A39 WeakPolarHBondContact O-CB 3.48Å; I36-A39 PolarHBondContact O-N 3.36Å; A39-E41 PolarHBondContact O-N 3.22Å; A39-R42 WeakPolarHBondContact O-CB 3.4Å; A39-R42 PolarHBondContact O-N 3.32Å; A39-R42 VanDerWaalsContact O-N 3.16Å; A39-E43 WeakPolarHBondContact O-CG 3.39Å; A39-E43 PolarHBondContact O-N 3.35Å
40	V	79.2	Confident	78.7	Confident	22 Å²	22	82 Å²	82	13%	0.133	42%	0.416	C	S	.	.	H	α-helix	trans	-64.1	-42.5	176.1	-177.7	0	0	0	0	111	A21 V25 I36 A37 E38 R42 E43 Q44 F52	A21-V40 HydrophobicContact CB-CG1 3.63Å; V25-V40 HydrophobicContact CG2-CB 4.04Å; V25-V40 HydrophobicContact CG2-CG1 4.2Å; V25-V40 HydrophobicContact CG2-CG2 3.64Å; I36-V40 PolarHBondContact O-N 2.78Å; A37-V40 PolarHBondContact O-N 3.13Å; E38-V40 VanDerWaalsContact C-N 3.32Å; V40-R42 PolarHBondContact O-N 3.16Å; V40-E43 PolarHBondContact O-N 2.91Å; V40-E43 VanDerWaalsContact O-N 3.14Å; V40-Q44 HydrophobicContact CG1-CG 4.49Å; V40-Q44 WeakPolarHBondContact O-CG 3.43Å; V40-Q44 PolarHBondContact O-N 3.32Å; V40-F52 HydrophobicContact CB-CE2 4.28Å; V40-F52 HydrophobicContact CB-CZ 3.9Å; V40-F52 HydrophobicContact CG1-CD2 4.41Å; V40-F52 HydrophobicContact CG1-CE2 3.43Å; V40-F52 VanDerWaalsContact CG1-CE2 3.43Å; V40-F52 HydrophobicContact CG1-CZ 3.56Å
41	E	80.1	Confident	79.1	Confident	37 Å²	37	84.9 Å²	84.9	17%	0.173	43%	0.427	C	S	.	.	H	α-helix	trans	-62.4	-31	175.5	-168.8	179.9	107.9	0	0	112.5	A37 E38 A39 R49 F52 R53	A37-E41 PolarHBondContact O-N 3Å; E38-E41 PolarHBondContact O-N 3.36Å; A39-E41 PolarHBondContact O-N 3.22Å; E41-R49 HydrophobicContact CG-CB 4.2Å; E41-R49 HydrophobicContact CG-CG 3.76Å; E41-R49 PolarHBondContact O-NE 3.23Å; E41-F52 HydrophobicContact CB-CD1 4.14Å; E41-F52 HydrophobicContact CB-CE1 4.1Å; E41-F52 HydrophobicContact CG-CD1 4.29Å; E41-R53 IonicContact OE1-CZ 3.36Å; E41-R53 IonicContact OE1-NE 3.58Å; E41-R53 IonicContact OE1-NH2 3.43Å; E41-R53 PolarHBondContact OE1-NH2 2.77Å; E41-R53 WeakPolarHBondContact OE2-CG 3.33Å; E41-R53 IonicContact OE2-CZ 3.34Å; E41-R53 IonicContact OE2-NE 2.97Å; E41-R53 PolarHBondContact OE2-NE 2.7Å; E41-R53 IonicContact OE2-NH2 3Å; E41-R53 PolarHBondContact OE2-NH2 3.47Å
42	R	81.7	Confident	79.6	Confident	174 Å²	174	81.5 Å²	81.5	66%	0.657	41%	0.414	S	S	*	.	H	α-helix	trans	-75.7	-31.5	174.6	-72.7	177	-175.5	-157.5	4.5	112.9	E38 A39 V40	E38-R42 VanDerWaalsContact O-CG 3.29Å; E38-R42 WeakPolarHBondContact O-CG 3.5Å; E38-R42 PolarHBondContact O-N 3.02Å; E38-R42 IonicContact OE1-CZ 3.4Å; E38-R42 VanDerWaalsContact OE1-CZ 3.28Å; E38-R42 IonicContact OE1-NE 3.48Å; E38-R42 PolarHBondContact OE1-NE 2.96Å; E38-R42 IonicContact OE1-NH2 3.66Å; E38-R42 PolarHBondContact OE1-NH2 3.5Å; A39-R42 WeakPolarHBondContact O-CB 3.4Å; A39-R42 PolarHBondContact O-N 3.32Å; A39-R42 VanDerWaalsContact O-N 3.16Å; V40-R42 PolarHBondContact O-N 3.16Å
43	E	83.9	Confident	80.2	Confident	154 Å²	154	80.9 Å²	80.9	72%	0.72	40%	0.4	S	S	*	.	H	α-helix	trans	-73.7	-30.4	173.8	-70.7	-178.8	107.2	0	0	112.1	A39 V40	A39-E43 WeakPolarHBondContact O-CG 3.39Å; A39-E43 PolarHBondContact O-N 3.35Å; V40-E43 PolarHBondContact O-N 2.91Å; V40-E43 VanDerWaalsContact O-N 3.14Å
44	Q	77.2	Confident	80.8	Confident	29 Å²	29	82.8 Å²	82.8	14%	0.136	41%	0.408	C	S	.	.	S	Bend	trans	-74.5	144.3	175.8	-61.6	-43.3	-46.1	0	0	111.9	V18 V40 F52	V18-Q44 HydrophobicContact CG1-CG 4.48Å; V18-Q44 HydrophobicContact CG2-CB 4.36Å; V18-Q44 HydrophobicContact CG2-CG 4.03Å; V40-Q44 HydrophobicContact CG1-CG 4.49Å; V40-Q44 WeakPolarHBondContact O-CG 3.43Å; V40-Q44 PolarHBondContact O-N 3.32Å; Q44-F52 HydrophobicContact CG-CD2 4.2Å
45	P	80.2	Confident	81.3	Confident	47 Å²	47	80.8 Å²	80.8	31%	0.305	38%	0.383	S	S	.	.			trans	-66.1	147.1	178.8	29.6	-36	0	0	0	111	H47 L48 R49	P45-H47 PolarHBondContact O-N 3.27Å; P45-H47 VanDerWaalsContact O-N 3.11Å; P45-L48 HydrophobicContact CG-CB 4.14Å; P45-L48 HydrophobicContact CG-CD1 3.58Å; P45-L48 HydrophobicContact CG-CG 3.95Å; P45-L48 PolarHBondContact O-N 3.34Å; P45-R49 PolarHBondContact O-N 2.98Å
46	E	82.2	Confident	81.7	Confident	148 Å²	148	80 Å²	80	69%	0.692	38%	0.378	S	S	*	.	H	α-helix	trans	-57.1	-35.6	-168.8	-61.9	-166.7	95.6	0	0	113.7	L48 R49	E46-L48 PolarHBondContact O-N 3.36Å; E46-R49 PolarHBondContact O-N 3.08Å; E46-R49 IonicContact OE1-NH1 3.28Å; E46-R49 PolarHBondContact OE1-NH1 3.29Å
47	H	80.9	Confident	82	Confident	123 Å²	123	79.3 Å²	79.3	57%	0.569	37%	0.374	S	S	*	.	H	α-helix	trans	-66.9	-19.1	178.3	68.6	-83.7	0	0	0	113.5	P45	P45-H47 PolarHBondContact O-N 3.27Å; P45-H47 VanDerWaalsContact O-N 3.11Å
48	L	81.8	Confident	82.2	Confident	7 Å²	7	80.2 Å²	80.2	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-104.4	-1.9	178.5	-60.3	177	0	0	0	113.6	D14 N15 V18 P45 E46 S50 W51 F52	D14-L48 HydrophobicContact CB-CD1 3.32Å; N15-L48 WeakPolarHBondContact OD1-CD2 3.47Å; V18-L48 HydrophobicContact CG1-CB 4.47Å; V18-L48 HydrophobicContact CG2-CB 3.62Å; V18-L48 HydrophobicContact CG2-CD1 3.55Å; V18-L48 HydrophobicContact CG2-CG 4.14Å; P45-L48 HydrophobicContact CG-CB 4.14Å; P45-L48 HydrophobicContact CG-CD1 3.58Å; P45-L48 HydrophobicContact CG-CG 3.95Å; P45-L48 PolarHBondContact O-N 3.34Å; E46-L48 PolarHBondContact O-N 3.36Å; L48-S50 VanDerWaalsContact C-N 3.27Å; L48-S50 PolarHBondContact O-N 3.01Å; L48-W51 HydrophobicContact CD2-CB 4.47Å; L48-W51 CarbonylContact O-C 3.59Å; L48-W51 WeakPolarHBondContact O-CB 3.29Å; L48-W51 PolarHBondContact O-N 3.17Å; L48-W51 VanDerWaalsContact O-N 3.13Å; L48-F52 WeakPolarHBondContact O-CB 3.26Å; L48-F52 PolarHBondContact O-N 3.37Å
49	R	80.9	Confident	82.1	Confident	69 Å²	69	76.5 Å²	76.5	26%	0.26	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-38.9	176.2	-71.8	-174.5	176.9	153.6	6.1	112.1	E41 P45 E46 W51 F52 R53	E41-R49 HydrophobicContact CG-CB 4.2Å; E41-R49 HydrophobicContact CG-CG 3.76Å; E41-R49 PolarHBondContact O-NE 3.23Å; P45-R49 PolarHBondContact O-N 2.98Å; E46-R49 PolarHBondContact O-N 3.08Å; E46-R49 IonicContact OE1-NH1 3.28Å; E46-R49 PolarHBondContact OE1-NH1 3.29Å; R49-W51 VanDerWaalsContact C-N 3.34Å; R49-F52 WeakPolarHBondContact O-CB 3.5Å; R49-F52 PolarHBondContact O-N 3.33Å; R49-R53 WeakPolarHBondContact O-CG 3.47Å; R49-R53 PolarHBondContact O-N 2.64Å
50	S	84.3	Confident	81.9	Confident	84 Å²	84	80.1 Å²	80.1	59%	0.587	37%	0.369	S	S	*	.	H	α-helix	trans	-60.7	-46.1	174.2	-58	0	0	0	0	111	L48 R53 E54	L48-S50 VanDerWaalsContact C-N 3.27Å; L48-S50 PolarHBondContact O-N 3.01Å; S50-R53 PolarHBondContact O-N 2.99Å; S50-E54 PolarHBondContact O-N 3.4Å; S50-E54 VanDerWaalsContact O-N 3.09Å
51	W	83.1	Confident	82	Confident	112 Å²	112	84.4 Å²	84.4	42%	0.424	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-43.7	176.3	-174.2	-106.1	0	0	0	112.3	N15 L48 R49 R53 E54 R55	N15-W51 PolarHBondContact O-NE1 3.36Å; L48-W51 HydrophobicContact CD2-CB 4.47Å; L48-W51 CarbonylContact O-C 3.59Å; L48-W51 WeakPolarHBondContact O-CB 3.29Å; L48-W51 PolarHBondContact O-N 3.17Å; L48-W51 VanDerWaalsContact O-N 3.13Å; R49-W51 VanDerWaalsContact C-N 3.34Å; W51-R53 VanDerWaalsContact C-N 3.32Å; W51-R53 PolarHBondContact O-N 3.33Å; W51-E54 PolarHBondContact O-N 3.02Å; W51-R55 VanDerWaalsContact O-CB 3.28Å; W51-R55 WeakPolarHBondContact O-CB 3.34Å; W51-R55 PolarHBondContact O-N 3.05Å
52	F	84.4	Confident	81.7	Confident	1 Å²	1	84.5 Å²	84.5	0%	0.004	40%	0.397	C	S	.	.	H	α-helix	trans	-57.5	-43.9	175.5	-178.3	-102.4	0	0	0	111.6	V18 A21 A22 V25 V40 E41 Q44 L48 R49 R55 L56	V18-F52 HydrophobicContact CG1-CB 3.53Å; V18-F52 HydrophobicContact CG1-CD2 3.87Å; V18-F52 HydrophobicContact CG1-CG 4.2Å; A21-F52 HydrophobicContact CB-CE2 4.27Å; A22-F52 HydrophobicContact CB-CD2 3.77Å; A22-F52 HydrophobicContact CB-CE2 3.71Å; V25-F52 HydrophobicContact CG2-CZ 4.19Å; V40-F52 HydrophobicContact CB-CE2 4.28Å; V40-F52 HydrophobicContact CB-CZ 3.9Å; V40-F52 HydrophobicContact CG1-CD2 4.41Å; V40-F52 HydrophobicContact CG1-CE2 3.43Å; V40-F52 VanDerWaalsContact CG1-CE2 3.43Å; V40-F52 HydrophobicContact CG1-CZ 3.56Å; E41-F52 HydrophobicContact CB-CD1 4.14Å; E41-F52 HydrophobicContact CB-CE1 4.1Å; E41-F52 HydrophobicContact CG-CD1 4.29Å; Q44-F52 HydrophobicContact CG-CD2 4.2Å; L48-F52 WeakPolarHBondContact O-CB 3.26Å; L48-F52 PolarHBondContact O-N 3.37Å; R49-F52 WeakPolarHBondContact O-CB 3.5Å; R49-F52 PolarHBondContact O-N 3.33Å; F52-R55 PolarHBondContact O-N 3.4Å; F52-L56 HydrophobicContact CE1-CD2 4.19Å; F52-L56 WeakPolarHBondContact O-CB 3.25Å; F52-L56 PolarHBondContact O-N 3.22Å
53	R	83.2	Confident	81.1	Confident	137 Å²	137	77.5 Å²	77.5	52%	0.517	38%	0.375	S	S	.	.	H	α-helix	trans	-65.8	-47.6	179.2	-73.8	176.9	-177.2	-179.5	3.8	112.2	E41 R49 S50 W51 R55 L56 I57	E41-R53 IonicContact OE1-CZ 3.36Å; E41-R53 IonicContact OE1-NE 3.58Å; E41-R53 IonicContact OE1-NH2 3.43Å; E41-R53 PolarHBondContact OE1-NH2 2.77Å; E41-R53 WeakPolarHBondContact OE2-CG 3.33Å; E41-R53 IonicContact OE2-CZ 3.34Å; E41-R53 IonicContact OE2-NE 2.97Å; E41-R53 PolarHBondContact OE2-NE 2.7Å; E41-R53 IonicContact OE2-NH2 3Å; E41-R53 PolarHBondContact OE2-NH2 3.47Å; R49-R53 WeakPolarHBondContact O-CG 3.47Å; R49-R53 PolarHBondContact O-N 2.64Å; S50-R53 PolarHBondContact O-N 2.99Å; W51-R53 VanDerWaalsContact C-N 3.32Å; W51-R53 PolarHBondContact O-N 3.33Å; R53-R55 PolarHBondContact O-N 2.81Å; R53-L56 PolarHBondContact O-N 3.35Å; R53-I57 VanDerWaalsContact O-CG1 3.27Å; R53-I57 WeakPolarHBondContact O-CG1 3.22Å; R53-I57 PolarHBondContact O-N 3.43Å
54	E	85.6	Confident	80.4	Confident	129 Å²	129	76 Å²	76	60%	0.603	38%	0.376	S	S	*	.	H	α-helix	trans	-58	-42.5	175.5	-71.2	-170	90.2	0	0	110.9	S50 W51 I57 A58	S50-E54 PolarHBondContact O-N 3.4Å; S50-E54 VanDerWaalsContact O-N 3.09Å; W51-E54 PolarHBondContact O-N 3.02Å; E54-I57 PolarHBondContact O-N 3Å; E54-A58 PolarHBondContact O-N 2.97Å
55	R	84.5	Confident	79.9	Confident	94 Å²	94	81.1 Å²	81.1	36%	0.355	41%	0.405	S	S	.	.	H	α-helix	trans	-73.4	-35.7	-178.9	-158.6	53.6	174.2	-167	-7.1	113	D19 A22 W51 F52 R53 I57 A58 H59	D19-R55 HydrophobicContact CB-CG 4.12Å; D19-R55 WeakPolarHBondContact OD1-CD 3.35Å; D19-R55 WeakPolarHBondContact OD1-CG 3.47Å; D19-R55 IonicContact OD1-CZ 2.81Å; D19-R55 IonicContact OD1-NE 2.66Å; D19-R55 PolarHBondContact OD1-NE 2.82Å; D19-R55 IonicContact OD1-NH2 3.44Å; D19-R55 PolarHBondContact OD1-NH2 3.08Å; D19-R55 IonicContact OD2-CZ 3.45Å; D19-R55 IonicContact OD2-NE 3.31Å; D19-R55 PolarHBondContact OD2-NE 3.4Å; D19-R55 IonicContact OD2-NH2 2.77Å; D19-R55 PolarHBondContact OD2-NH2 2.92Å; A22-R55 HydrophobicContact CB-CB 4.07Å; A22-R55 HydrophobicContact CB-CG 4.14Å; W51-R55 VanDerWaalsContact O-CB 3.28Å; W51-R55 WeakPolarHBondContact O-CB 3.34Å; W51-R55 PolarHBondContact O-N 3.05Å; F52-R55 PolarHBondContact O-N 3.4Å; R53-R55 PolarHBondContact O-N 2.81Å; R55-I57 VanDerWaalsContact C-N 3.35Å; R55-A58 PolarHBondContact O-N 2.87Å; R55-H59 WeakPolarHBondContact O-CB 3.43Å; R55-H59 PolarHBondContact O-CD2 3.36Å; R55-H59 PolarHBondContact O-N 2.96Å
56	L	83.2	Confident	79	Confident	18 Å²	18	83.1 Å²	83.1	9%	0.094	41%	0.412	C	S	.	.	H	α-helix	trans	-62.8	-41.9	172.6	-176.2	68	0	0	0	110.9	V25 A37 F52 R53 H59 R60	V25-L56 HydrophobicContact CB-CD1 4Å; V25-L56 HydrophobicContact CG1-CD1 3.71Å; A37-L56 HydrophobicContact CB-CD2 4.35Å; F52-L56 HydrophobicContact CE1-CD2 4.19Å; F52-L56 WeakPolarHBondContact O-CB 3.25Å; F52-L56 PolarHBondContact O-N 3.22Å; R53-L56 PolarHBondContact O-N 3.35Å; L56-H59 PolarHBondContact O-N 2.96Å; L56-R60 WeakPolarHBondContact O-CB 3.42Å; L56-R60 WeakPolarHBondContact O-CG 3.41Å; L56-R60 PolarHBondContact O-N 3.09Å
57	I	84.1	Confident	77.9	Confident	104 Å²	104	80.2 Å²	80.2	53%	0.533	41%	0.409	S	S	.	.	H	α-helix	trans	-62.5	-47.9	174	-66.8	164.5	0	0	0	109.9	R53 E54 R55 H59 R60 L61	R53-I57 VanDerWaalsContact O-CG1 3.27Å; R53-I57 WeakPolarHBondContact O-CG1 3.22Å; R53-I57 PolarHBondContact O-N 3.43Å; E54-I57 PolarHBondContact O-N 3Å; R55-I57 VanDerWaalsContact C-N 3.35Å; I57-H59 VanDerWaalsContact C-N 3.32Å; I57-H59 PolarHBondContact O-N 3.41Å; I57-R60 PolarHBondContact O-N 3.45Å; I57-L61 HydrophobicContact CG2-CD1 4.09Å; I57-L61 HydrophobicContact CG2-CG 4.45Å; I57-L61 WeakPolarHBondContact O-CG 3.4Å; I57-L61 PolarHBondContact O-N 2.83Å
58	A	82.8	Confident	76.6	Confident	42 Å²	42	84.9 Å²	84.9	35%	0.347	42%	0.421	S	S	.	.	H	α-helix	trans	-58.9	-42.4	177	0	0	0	0	0	112.1	E54 R55 L61 A62	E54-A58 PolarHBondContact O-N 2.97Å; R55-A58 PolarHBondContact O-N 2.87Å; A58-L61 PolarHBondContact O-N 3.16Å; A58-A62 WeakPolarHBondContact O-CB 3.18Å; A58-A62 PolarHBondContact O-N 3.3Å
59	H	78.1	Confident	75.4	Confident	37 Å²	37	90.4 Å²	90.4	17%	0.171	45%	0.45	C	S	.	.	H	α-helix	trans	-71	-32.1	177.2	-76.9	-59.9	0	0	0	113.1	D19 A23 A26 R55 L56 I57 A62 S63	D19-H59 IonicContact OD1-CD2 3.79Å; D19-H59 IonicContact OD1-CE1 3.59Å; D19-H59 IonicContact OD1-NE2 2.74Å; D19-H59 PolarHBondContact OD1-NE2 3.27Å; A23-H59 VanDerWaalsContact CB-CE1 3.45Å; A23-H59 WeakPolarHBondContact CB-CE1 3.43Å; A23-H59 WeakPolarHBondContact CB-NE2 3.45Å; A23-H59 PolarHBondContact N-CD2 3.37Å; A23-H59 VanDerWaalsContact N-CD2 3.33Å; A26-H59 HydrophobicContact CB-CB 3.46Å; A26-H59 VanDerWaalsContact CB-CB 3.46Å; R55-H59 WeakPolarHBondContact O-CB 3.43Å; R55-H59 PolarHBondContact O-CD2 3.36Å; R55-H59 PolarHBondContact O-N 2.96Å; L56-H59 PolarHBondContact O-N 2.96Å; I57-H59 VanDerWaalsContact C-N 3.32Å; I57-H59 PolarHBondContact O-N 3.41Å; H59-A62 PolarHBondContact O-N 3.33Å; H59-S63 VanDerWaalsContact O-CB 3.22Å; H59-S63 WeakPolarHBondContact O-CB 3.45Å; H59-S63 PolarHBondContact O-N 2.75Å; H59-S63 PolarHBondContact O-OG 2.86Å
60	R	79.2	Confident	73.9	Confident	115 Å²	115	92.1 Å²	92.1	43%	0.434	47%	0.47	S	S	.	.	H	α-helix	trans	-67.1	-44.3	171.1	-79.3	177.3	170.9	-178.2	-3.6	111.1	E29 L56 I57 A62 S63 V64	E29-R60 IonicContact OE1-CZ 3.9Å; E29-R60 IonicContact OE1-NH2 2.92Å; E29-R60 PolarHBondContact OE1-NH2 2.66Å; E29-R60 IonicContact OE2-CZ 3.67Å; E29-R60 IonicContact OE2-NE 2.83Å; E29-R60 PolarHBondContact OE2-NE 3.32Å; E29-R60 IonicContact OE2-NH2 2.71Å; E29-R60 PolarHBondContact OE2-NH2 2.94Å; L56-R60 WeakPolarHBondContact O-CB 3.42Å; L56-R60 WeakPolarHBondContact O-CG 3.41Å; L56-R60 PolarHBondContact O-N 3.09Å; I57-R60 PolarHBondContact O-N 3.45Å; R60-A62 VanDerWaalsContact C-N 3.33Å; R60-A62 PolarHBondContact O-N 2.81Å; R60-S63 WeakPolarHBondContact O-CB 3.5Å; R60-S63 PolarHBondContact O-N 3.29Å; R60-S63 VanDerWaalsContact O-N 3.15Å; R60-V64 WeakPolarHBondContact O-CG2 3.35Å; R60-V64 PolarHBondContact O-N 2.97Å
61	L	80	Confident	72.3	Confident	112 Å²	112	96.2 Å²	96.2	59%	0.586	47%	0.474	S	S	*	.	H	α-helix	trans	-62	-39.7	173	-69.2	172.9	0	0	0	112	I57 A58 V64 N65	I57-L61 HydrophobicContact CG2-CD1 4.09Å; I57-L61 HydrophobicContact CG2-CG 4.45Å; I57-L61 WeakPolarHBondContact O-CG 3.4Å; I57-L61 PolarHBondContact O-N 2.83Å; A58-L61 PolarHBondContact O-N 3.16Å; L61-V64 PolarHBondContact O-N 2.71Å; L61-N65 PolarHBondContact O-N 3.45Å; L61-N65 PolarHBondContact O-ND2 3.23Å
62	A	74.2	Confident	70.8	Confident	38 Å²	38	98.8 Å²	98.8	31%	0.314	49%	0.49	S	S	.	.	H	α-helix	trans	-65.6	-40.9	172.8	0	0	0	0	0	111.1	A58 H59 R60 V64 N65 L66	A58-A62 WeakPolarHBondContact O-CB 3.18Å; A58-A62 PolarHBondContact O-N 3.3Å; H59-A62 PolarHBondContact O-N 3.33Å; R60-A62 VanDerWaalsContact C-N 3.33Å; R60-A62 PolarHBondContact O-N 2.81Å; A62-V64 PolarHBondContact O-N 2.66Å; A62-N65 CarbonylContact O-C 3.55Å; A62-N65 WeakPolarHBondContact O-CA 3.39Å; A62-N65 PolarHBondContact O-N 3.3Å; A62-L66 HydrophobicContact CB-CD1 4.24Å; A62-L66 WeakPolarHBondContact O-CB 3.48Å; A62-L66 WeakPolarHBondContact O-CD1 3.4Å; A62-L66 WeakPolarHBondContact O-CG 3.42Å; A62-L66 PolarHBondContact O-N 3.39Å
63	S	68.4	Low	69.5	Low	27 Å²	27	102.3 Å²	102.3	19%	0.189	51%	0.514	C	S	.	.	H	α-helix	trans	-63.4	-27.9	177.9	-64.9	0	0	0	0	112.7	H59 R60	H59-S63 VanDerWaalsContact O-CB 3.22Å; H59-S63 WeakPolarHBondContact O-CB 3.45Å; H59-S63 PolarHBondContact O-N 2.75Å; H59-S63 PolarHBondContact O-OG 2.86Å; R60-S63 WeakPolarHBondContact O-CB 3.5Å; R60-S63 PolarHBondContact O-N 3.29Å; R60-S63 VanDerWaalsContact O-N 3.15Å
64	V	70.1	Confident	67.9	Low	122 Å²	122	105.6 Å²	105.6	74%	0.739	53%	0.532	S	S	*	.	H	α-helix	trans	-68.3	-35.4	171	173.3	0	0	0	0	111.6	R60 L61 A62	R60-V64 WeakPolarHBondContact O-CG2 3.35Å; R60-V64 PolarHBondContact O-N 2.97Å; L61-V64 PolarHBondContact O-N 2.71Å; A62-V64 PolarHBondContact O-N 2.66Å
65	N	67	Low	66.3	Low	138 Å²	138	107.3 Å²	107.3	74%	0.738	54%	0.544	S	S	*	.	H	α-helix	trans	-84.1	-23.4	178.1	-73.4	-77.3	0	0	0	113.3	L61 A62 S67	L61-N65 PolarHBondContact O-N 3.45Å; L61-N65 PolarHBondContact O-ND2 3.23Å; A62-N65 CarbonylContact O-C 3.55Å; A62-N65 WeakPolarHBondContact O-CA 3.39Å; A62-N65 PolarHBondContact O-N 3.3Å; N65-S67 PolarHBondContact O-N 2.99Å
66	L	62.1	Low	64.7	Low	88 Å²	88	115.6 Å²	115.6	46%	0.461	58%	0.583	S	S	.	*	S	Bend	trans	-80.1	100	176.4	-74.1	151.8	0	0	0	109.4	R30 A62 R68	R30-L66 PolarHBondContact NE-O 2.91Å; A62-L66 HydrophobicContact CB-CD1 4.24Å; A62-L66 WeakPolarHBondContact O-CB 3.48Å; A62-L66 WeakPolarHBondContact O-CD1 3.4Å; A62-L66 WeakPolarHBondContact O-CG 3.42Å; A62-L66 PolarHBondContact O-N 3.39Å; L66-R68 PolarHBondContact O-N 3.01Å
67	S	57.5	Low	63.8	Low	88 Å²	88	120.5 Å²	120.5	62%	0.615	61%	0.607	S	S	*	*			trans	-35.4	127.1	176.8	-81.9	0	0	0	0	111.9	R30 N65 L69	R30-S67 PolarHBondContact NH2-O 3.49Å; N65-S67 PolarHBondContact O-N 2.99Å; S67-L69 PolarHBondContact O-N 3.15Å
68	R	55	Low	62.7	Low	221 Å²	221	121.4 Å²	121.4	83%	0.834	61%	0.611	S	S	*	*			trans	-65.3	65.9	170.7	-62.9	169	69.9	133.8	1.7	109.5	L66 P70	L66-R68 PolarHBondContact O-N 3.01Å; R68-P70 WeakPolarHBondContact O-CD 3.35Å; R68-P70 VanDerWaalsContact O-N 3.15Å
69	L	54.8	Low	61.6	Low	123 Å²	123	125.8 Å²	125.8	64%	0.644	63%	0.626	S	S	*	*			trans	-59.1	120.2	172.5	-77.7	161.5	0	0	0	105.6	S67 Y71	S67-L69 PolarHBondContact O-N 3.15Å; L69-Y71 PolarHBondContact O-N 3.48Å; L69-Y71 VanDerWaalsContact O-N 3.08Å
70	P	51.2	Low	60.6	Low	105 Å²	105	131 Å²	131	68%	0.682	65%	0.653	S	S	*	*			trans	-55.6	120.7	176.8	22.1	-30.7	0	0	0	107.6	R68 E72	R68-P70 WeakPolarHBondContact O-CD 3.35Å; R68-P70 VanDerWaalsContact O-N 3.15Å; P70-E72 VanDerWaalsContact C-N 3.33Å; P70-E72 PolarHBondContact O-N 3.21Å
71	Y	49.7	Very low	59.5	Low	170 Å²	170	132 Å²	132	67%	0.667	67%	0.666	S	S	*	*			trans	-70	98.2	167.1	178.3	-102.1	0	0	0	106.9	Y31 L69 P73	Y31-Y71 HydrophobicContact CD1-CG 4.29Å; Y31-Y71 HydrophobicContact CE1-CD2 4.36Å; Y31-Y71 HydrophobicContact CE1-CG 4.4Å; L69-Y71 PolarHBondContact O-N 3.48Å; L69-Y71 VanDerWaalsContact O-N 3.08Å; Y71-P73 HydrophobicContact CE1-CB 3.83Å; Y71-P73 HydrophobicContact CE1-CG 4.31Å; Y71-P73 VanDerWaalsContact O-CD 3.26Å; Y71-P73 WeakPolarHBondContact O-CD 3.27Å
72	E	52.3	Low	58.1	Low	165 Å²	165	133.3 Å²	133.3	77%	0.771	67%	0.672	S	S	*	*			trans	-84.9	107.8	162.9	-72	-173.4	110	0	0	107.4	P70 K74	P70-E72 VanDerWaalsContact C-N 3.33Å; P70-E72 PolarHBondContact O-N 3.21Å; E72-K74 PolarHBondContact O-N 2.85Å; E72-K74 VanDerWaalsContact O-N 3.14Å
73	P	57.5	Low	57	Low	76 Å²	76	140.1 Å²	140.1	49%	0.494	70%	0.697	S	S	.	*			trans	-59.5	121.7	167.7	24.9	-30.6	0	0	0	107.3	Y71 L75	Y71-P73 HydrophobicContact CE1-CB 3.83Å; Y71-P73 HydrophobicContact CE1-CG 4.31Å; Y71-P73 VanDerWaalsContact O-CD 3.26Å; Y71-P73 WeakPolarHBondContact O-CD 3.27Å; P73-L75 PolarHBondContact O-N 2.89Å
74	K	49.6	Very low	56.1	Low	205 Å²	205	148.8 Å²	148.8	89%	0.891	74%	0.736	S	S	*	*			trans	-59.6	101.3	169.5	-66.5	-175.8	179.7	-179.2	0	107.2	E72 K76	E72-K74 PolarHBondContact O-N 2.85Å; E72-K74 VanDerWaalsContact O-N 3.14Å; K74-K76 PolarHBondContact O-N 2.92Å
75	L	50.7	Low	54.9	Low	166 Å²	166	151.1 Å²	151.1	87%	0.869	74%	0.736	S	S	*	*			trans	-59.9	121.9	161.7	-108.3	90.6	0	0	0	106.2	P73	P73-L75 PolarHBondContact O-N 2.89Å
76	K	51.8	Low	53.8	Low	268 Å²	268	152.3 Å²	152.3	100%	1.165	74%	0.736	S	S	*	*			trans	-85.3	0	167.8	-160.2	-178.5	-175.6	-173.5	0	108.9	K74	K74-K76 PolarHBondContact O-N 2.92Å

Retrieved 76 of 76 residues in 295.2 ms (Link to these results)

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