A0A077ZN75_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZN75, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 102 aa.

						>A0A077ZN75_TRITR|A0A077ZN75
MNEEHVKAAFIYFEKEKRKFEARQAEIEAEATDDDDVQALEARLESLKITLSIPGVPADLELALLEYWLEKSQTTGGRFEVYLTDDESADESYANEGSRIDD
					

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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	67.1	Low	83	Confident	138 Å²	138	70.5 Å²	70.5	68%	0.68	35%	0.353	S	S	*	.				0	143.5	0	-78.6	164.1	167.9	0	0	108.1	V6 A63 L64	M1-V6 HydrophobicContact CB-CG2 3.91Å; M1-V6 HydrophobicContact SD-CG2 4.45Å; M1-A63 HydrophobicContact CE-CB 3.45Å; M1-A63 VanDerWaalsContact CE-CB 3.45Å; M1-L64 HydrophobicContact SD-CD2 4.27Å
2	N	80.3	Confident	83.3	Confident	69 Å²	69	68.3 Å²	68.3	37%	0.369	34%	0.338	S	S	.	.			trans	-69.9	131.9	173.2	-171	5.6	0	0	0	109.1	E4 H5 V6	N2-E4 VanDerWaalsContact C-N 3.28Å; N2-E4 PolarHBondContact ND2-OE2 3.26Å; N2-E4 VanDerWaalsContact ND2-OE2 3.13Å; N2-E4 PolarHBondContact O-N 3.21Å; N2-H5 HydrophobicContact CB-CB 4.27Å; N2-H5 PolarHBondContact O-N 2.73Å; N2-V6 WeakPolarHBondContact O-CG2 3.2Å; N2-V6 PolarHBondContact O-N 2.93Å; N2-V6 VanDerWaalsContact O-N 3.11Å
3	E	82.7	Confident	83.5	Confident	127 Å²	127	63.4 Å²	63.4	59%	0.593	31%	0.313	S	S	*	.	H	α-helix	trans	-63.8	-36.2	-177.3	-165.7	179.5	97.8	0	0	111.5	H5 V6 K7	E3-H5 VanDerWaalsContact C-N 3.35Å; E3-H5 PolarHBondContact O-N 2.74Å; E3-V6 PolarHBondContact O-N 3.29Å; E3-K7 HydrophobicContact CG-CD 4.41Å; E3-K7 WeakPolarHBondContact O-CG 3.18Å; E3-K7 PolarHBondContact O-N 2.73Å; E3-K7 WeakPolarHBondContact OE1-CE 2.83Å; E3-K7 IonicContact OE1-NZ 2.73Å; E3-K7 PolarHBondContact OE1-NZ 2.89Å
4	E	85.9	Confident	83.7	Confident	133 Å²	133	64 Å²	64	62%	0.621	32%	0.315	S	S	*	.	H	α-helix	trans	-61.7	-41.8	175.4	-62.6	173.2	98.8	0	0	112.1	N2 V6 K7 A8	N2-E4 VanDerWaalsContact C-N 3.28Å; N2-E4 PolarHBondContact ND2-OE2 3.26Å; N2-E4 VanDerWaalsContact ND2-OE2 3.13Å; N2-E4 PolarHBondContact O-N 3.21Å; E4-V6 VanDerWaalsContact C-N 3.34Å; E4-K7 PolarHBondContact O-N 2.84Å; E4-A8 WeakPolarHBondContact O-CB 3.41Å; E4-A8 PolarHBondContact O-N 2.84Å
5	H	83.9	Confident	83.8	Confident	46 Å²	46	68.5 Å²	68.5	21%	0.213	33%	0.332	C	S	.	.	H	α-helix	trans	-67.1	-38.3	177.2	-61.8	169.8	0	0	0	111.3	N2 E3 A9 V56 L60 L64	N2-H5 HydrophobicContact CB-CB 4.27Å; N2-H5 PolarHBondContact O-N 2.73Å; E3-H5 VanDerWaalsContact C-N 3.35Å; E3-H5 PolarHBondContact O-N 2.74Å; H5-A9 WeakPolarHBondContact O-CB 3.1Å; H5-A9 PolarHBondContact O-N 2.76Å; H5-V56 HydrophobicContact CB-CG2 4.18Å; H5-L60 WeakPolarHBondContact ND1-CD1 3.33Å; H5-L64 HydrophobicContact CB-CD1 4.24Å
6	V	84.7	Confident	83.8	Confident	26 Å²	26	65.8 Å²	65.8	16%	0.158	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-46.9	174.6	176.9	0	0	0	0	110.3	M1 N2 E3 E4 A9 F10 L64 Y67	M1-V6 HydrophobicContact CB-CG2 3.91Å; M1-V6 HydrophobicContact SD-CG2 4.45Å; N2-V6 WeakPolarHBondContact O-CG2 3.2Å; N2-V6 PolarHBondContact O-N 2.93Å; N2-V6 VanDerWaalsContact O-N 3.11Å; E3-V6 PolarHBondContact O-N 3.29Å; E4-V6 VanDerWaalsContact C-N 3.34Å; V6-A9 PolarHBondContact O-N 2.76Å; V6-F10 HydrophobicContact CG1-CD2 3.81Å; V6-F10 HydrophobicContact CG1-CE2 3.82Å; V6-F10 WeakPolarHBondContact O-CB 3.41Å; V6-F10 WeakPolarHBondContact O-CD2 3.34Å; V6-F10 PolarHBondContact O-N 3.13Å; V6-L64 HydrophobicContact CB-CD2 4.19Å; V6-L64 HydrophobicContact CG2-CD2 3.58Å; V6-Y67 HydrophobicContact CG1-CD1 4.15Å; V6-Y67 HydrophobicContact CG1-CE1 3.82Å
7	K	83.7	Confident	83.7	Confident	83 Å²	83	65.9 Å²	65.9	36%	0.361	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-51.9	177.2	-73.6	171.8	179.9	169.4	0	111.5	E3 E4 A9 F10 I11	E3-K7 HydrophobicContact CG-CD 4.41Å; E3-K7 WeakPolarHBondContact O-CG 3.18Å; E3-K7 PolarHBondContact O-N 2.73Å; E3-K7 WeakPolarHBondContact OE1-CE 2.83Å; E3-K7 IonicContact OE1-NZ 2.73Å; E3-K7 PolarHBondContact OE1-NZ 2.89Å; E4-K7 PolarHBondContact O-N 2.84Å; K7-A9 VanDerWaalsContact C-N 3.33Å; K7-A9 PolarHBondContact O-N 3.21Å; K7-F10 PolarHBondContact O-N 2.9Å; K7-I11 VanDerWaalsContact O-CG1 3.32Å; K7-I11 WeakPolarHBondContact O-CG1 3.37Å; K7-I11 PolarHBondContact O-N 3.46Å
8	A	86.1	Confident	83.7	Confident	37 Å²	37	73.1 Å²	73.1	31%	0.306	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-44.3	178.9	0	0	0	0	0	111.8	E4 Y12 V56	E4-A8 WeakPolarHBondContact O-CB 3.41Å; E4-A8 PolarHBondContact O-N 2.84Å; A8-Y12 VanDerWaalsContact O-CB 3.28Å; A8-Y12 WeakPolarHBondContact O-CB 2.84Å; A8-Y12 PolarHBondContact O-N 2.9Å; A8-V56 HydrophobicContact CB-CG2 4.21Å
9	A	85.9	Confident	83.7	Confident	0 Å²	0	74 Å²	74	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.8	-44.3	177.8	0	0	0	0	0	112.7	H5 V6 K7 Y12 F13 I53 L64	H5-A9 WeakPolarHBondContact O-CB 3.1Å; H5-A9 PolarHBondContact O-N 2.76Å; V6-A9 PolarHBondContact O-N 2.76Å; K7-A9 VanDerWaalsContact C-N 3.33Å; K7-A9 PolarHBondContact O-N 3.21Å; A9-Y12 PolarHBondContact O-N 2.67Å; A9-F13 HydrophobicContact CB-CD2 4.17Å; A9-F13 HydrophobicContact CB-CE2 3.8Å; A9-F13 WeakPolarHBondContact O-CB 3.43Å; A9-F13 WeakPolarHBondContact O-CD2 3.18Å; A9-F13 VanDerWaalsContact O-CG 3.26Å; A9-F13 WeakPolarHBondContact O-CG 3.32Å; A9-F13 PolarHBondContact O-N 3.18Å; A9-I53 HydrophobicContact CB-CD1 3.49Å; A9-I53 VanDerWaalsContact CB-CD1 3.49Å; A9-L64 HydrophobicContact CB-CB 3.9Å; A9-L64 HydrophobicContact CB-CD1 3.86Å; A9-L64 HydrophobicContact CB-CD2 4.28Å; A9-L64 HydrophobicContact CB-CG 4.23Å
10	F	86.3	Confident	83.6	Confident	22 Å²	22	73 Å²	73	10%	0.096	34%	0.338	C	S	.	.	H	α-helix	trans	-62.5	-47.3	178.7	-90.2	-120.1	0	0	0	111.7	V6 K7 Y12 F13 E14 Y67 W68 K71	V6-F10 HydrophobicContact CG1-CD2 3.81Å; V6-F10 HydrophobicContact CG1-CE2 3.82Å; V6-F10 WeakPolarHBondContact O-CB 3.41Å; V6-F10 WeakPolarHBondContact O-CD2 3.34Å; V6-F10 PolarHBondContact O-N 3.13Å; K7-F10 PolarHBondContact O-N 2.9Å; F10-Y12 VanDerWaalsContact C-N 3.25Å; F10-Y12 PolarHBondContact O-N 3.25Å; F10-F13 PolarHBondContact O-N 2.54Å; F10-E14 WeakPolarHBondContact O-CB 3.36Å; F10-E14 VanDerWaalsContact O-CG 3.28Å; F10-E14 WeakPolarHBondContact O-CG 3.3Å; F10-E14 PolarHBondContact O-N 3.24Å; F10-Y67 AromaticContact CE2-CD1 3.47Å; F10-Y67 HydrophobicContact CE2-CD1 3.47Å; F10-Y67 VanDerWaalsContact CE2-CD1 3.47Å; F10-Y67 AromaticContact CE2-CE1 3.77Å; F10-Y67 HydrophobicContact CE2-CE1 3.77Å; F10-Y67 AromaticContact CZ-CD1 3.62Å; F10-Y67 HydrophobicContact CZ-CD1 3.62Å; F10-Y67 AromaticContact CZ-CE1 3.64Å; F10-Y67 HydrophobicContact CZ-CE1 3.64Å; F10-W68 AromaticContact CD1-CD1 3.79Å; F10-W68 HydrophobicContact CD2-CB 4.29Å; F10-W68 AromaticContact CE1-CD1 3.89Å; F10-W68 HydrophobicContact CE2-CB 3.81Å; F10-W68 HydrophobicContact CE2-CG 4.49Å; F10-W68 AromaticContact CG-CD1 3.98Å; F10-W68 HydrophobicContact CZ-CB 3.99Å; F10-W68 HydrophobicContact CZ-CG 4.49Å; F10-K71 HydrophobicContact CE1-CB 4.24Å; F10-K71 HydrophobicContact CE1-CG 4.35Å; F10-K71 HydrophobicContact CZ-CB 4.25Å; F10-K71 HydrophobicContact CZ-CG 4.06Å
11	I	86.2	Confident	83.7	Confident	95 Å²	95	74 Å²	74	49%	0.487	34%	0.343	S	S	.	.	H	α-helix	trans	-59	-42.2	176.8	-66.2	165.7	0	0	0	110.4	K7 K15 L83	K7-I11 VanDerWaalsContact O-CG1 3.32Å; K7-I11 WeakPolarHBondContact O-CG1 3.37Å; K7-I11 PolarHBondContact O-N 3.46Å; I11-K15 WeakPolarHBondContact O-CB 3.38Å; I11-K15 PolarHBondContact O-N 3.22Å; I11-K15 VanDerWaalsContact O-N 3.12Å; I11-L83 HydrophobicContact CD1-CD2 4.22Å; I11-L83 HydrophobicContact CG1-CD2 4.46Å
12	Y	86.6	Confident	84.6	Confident	44 Å²	44	70.4 Å²	70.4	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-50.8	178.4	-175.6	-83.8	0	0	0	112.1	A8 A9 F10 E14 K15 E16 T50 S52 I53	A8-Y12 VanDerWaalsContact O-CB 3.28Å; A8-Y12 WeakPolarHBondContact O-CB 2.84Å; A8-Y12 PolarHBondContact O-N 2.9Å; A9-Y12 PolarHBondContact O-N 2.67Å; F10-Y12 VanDerWaalsContact C-N 3.25Å; F10-Y12 PolarHBondContact O-N 3.25Å; Y12-E14 PolarHBondContact O-N 3.4Å; Y12-K15 WeakPolarHBondContact O-CB 3.35Å; Y12-K15 PolarHBondContact O-N 3.12Å; Y12-E16 HydrophobicContact CD1-CG 3.94Å; Y12-E16 HydrophobicContact CE1-CG 3.48Å; Y12-E16 VanDerWaalsContact CE1-CG 3.48Å; Y12-E16 PolarHBondContact O-N 2.86Å; Y12-T50 VanDerWaalsContact CE1-O 3.26Å; Y12-T50 WeakPolarHBondContact CE1-O 3.33Å; Y12-T50 PolarHBondContact OH-O 3.12Å; Y12-S52 WeakPolarHBondContact CE2-O 3.31Å; Y12-S52 VanDerWaalsContact CZ-O 3.28Å; Y12-S52 PolarHBondContact OH-O 3.47Å; Y12-S52 VanDerWaalsContact OH-O 3.07Å; Y12-I53 HydrophobicContact CD1-CG1 3.7Å; Y12-I53 HydrophobicContact CD2-CG2 4.46Å; Y12-I53 HydrophobicContact CE1-CG1 4.13Å; Y12-I53 HydrophobicContact CG-CB 4.44Å; Y12-I53 HydrophobicContact CG-CG1 3.98Å; Y12-I53 HydrophobicContact CG-CG2 4.18Å
13	F	86	Confident	84.7	Confident	4 Å²	4	73.7 Å²	73.7	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-40.4	-179.1	-66.4	-46.2	0	0	0	112.2	A9 F10 K15 E16 K17 L51 I53 L64 L65 W68	A9-F13 HydrophobicContact CB-CD2 4.17Å; A9-F13 HydrophobicContact CB-CE2 3.8Å; A9-F13 WeakPolarHBondContact O-CB 3.43Å; A9-F13 WeakPolarHBondContact O-CD2 3.18Å; A9-F13 VanDerWaalsContact O-CG 3.26Å; A9-F13 WeakPolarHBondContact O-CG 3.32Å; A9-F13 PolarHBondContact O-N 3.18Å; F10-F13 PolarHBondContact O-N 2.54Å; F13-K15 VanDerWaalsContact C-N 3.32Å; F13-K15 PolarHBondContact O-N 3.35Å; F13-E16 PolarHBondContact O-N 3.23Å; F13-K17 WeakPolarHBondContact O-CB 3.17Å; F13-K17 PolarHBondContact O-N 3.11Å; F13-L51 HydrophobicContact CE1-CG 4.32Å; F13-I53 HydrophobicContact CE1-CD1 3.82Å; F13-I53 HydrophobicContact CE1-CG1 4.31Å; F13-I53 HydrophobicContact CE2-CD1 3.77Å; F13-I53 HydrophobicContact CZ-CD1 3.33Å; F13-I53 HydrophobicContact CZ-CG1 4.29Å; F13-L64 HydrophobicContact CE2-CB 4.15Å; F13-L65 HydrophobicContact CD1-CD1 4.08Å; F13-L65 HydrophobicContact CE1-CB 4.32Å; F13-L65 HydrophobicContact CE1-CD1 3.85Å; F13-L65 HydrophobicContact CE2-CB 4.21Å; F13-L65 HydrophobicContact CE2-CD1 4.47Å; F13-L65 HydrophobicContact CZ-CB 3.76Å; F13-L65 HydrophobicContact CZ-CD1 4.05Å; F13-W68 HydrophobicContact CB-CD2 3.62Å; F13-W68 HydrophobicContact CB-CE3 4.12Å; F13-W68 HydrophobicContact CB-CG 3.88Å; F13-W68 HydrophobicContact CB-CH2 4.46Å; F13-W68 HydrophobicContact CB-CZ2 4.02Å; F13-W68 HydrophobicContact CD2-CB 3.72Å; F13-W68 HydrophobicContact CD2-CD2 4.17Å; F13-W68 AromaticContact CD2-CG 3.78Å; F13-W68 HydrophobicContact CD2-CG 3.78Å; F13-W68 HydrophobicContact CE2-CB 4.26Å; F13-W68 HydrophobicContact CG-CD2 4.12Å; F13-W68 HydrophobicContact CG-CE3 4.38Å; F13-W68 HydrophobicContact CG-CG 4.18Å
14	E	85.8	Confident	84.7	Confident	72 Å²	72	70.8 Å²	70.8	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-42	174	-74.1	-64.8	108.6	0	0	111.6	F10 Y12 R18 W68	F10-E14 WeakPolarHBondContact O-CB 3.36Å; F10-E14 VanDerWaalsContact O-CG 3.28Å; F10-E14 WeakPolarHBondContact O-CG 3.3Å; F10-E14 PolarHBondContact O-N 3.24Å; Y12-E14 PolarHBondContact O-N 3.4Å; E14-R18 WeakPolarHBondContact O-CB 3.33Å; E14-R18 PolarHBondContact O-N 3.45Å; E14-W68 WeakPolarHBondContact OE1-CZ2 3.47Å; E14-W68 PolarHBondContact OE1-NE1 2.82Å
15	K	85.9	Confident	84.6	Confident	131 Å²	131	67 Å²	67	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-65.5	-44.5	177.1	-175.7	177.9	-177	177.3	0	111.9	I11 Y12 F13 K19	I11-K15 WeakPolarHBondContact O-CB 3.38Å; I11-K15 PolarHBondContact O-N 3.22Å; I11-K15 VanDerWaalsContact O-N 3.12Å; Y12-K15 WeakPolarHBondContact O-CB 3.35Å; Y12-K15 PolarHBondContact O-N 3.12Å; F13-K15 VanDerWaalsContact C-N 3.32Å; F13-K15 PolarHBondContact O-N 3.35Å; K15-K19 WeakPolarHBondContact O-CG 3.03Å; K15-K19 PolarHBondContact O-N 3.11Å; K15-K19 VanDerWaalsContact O-N 3.1Å
16	E	83.1	Confident	84.7	Confident	26 Å²	26	71.2 Å²	71.2	12%	0.121	34%	0.34	C	S	.	.	H	α-helix	trans	-68.7	-39.6	177.8	-71.3	-57.3	108.4	0	0	111.9	Y12 F13 K19 F20 I49	Y12-E16 HydrophobicContact CD1-CG 3.94Å; Y12-E16 HydrophobicContact CE1-CG 3.48Å; Y12-E16 VanDerWaalsContact CE1-CG 3.48Å; Y12-E16 PolarHBondContact O-N 2.86Å; F13-E16 PolarHBondContact O-N 3.23Å; E16-K19 PolarHBondContact O-N 2.94Å; E16-K19 WeakPolarHBondContact OE1-CD 3.43Å; E16-K19 IonicContact OE1-NZ 2.77Å; E16-K19 PolarHBondContact OE1-NZ 3.01Å; E16-F20 WeakPolarHBondContact O-CB 3.31Å; E16-F20 PolarHBondContact O-N 2.89Å; E16-I49 HydrophobicContact CB-CG2 3.83Å; E16-I49 HydrophobicContact CG-CG2 4.37Å
17	K	82.8	Confident	84.6	Confident	67 Å²	67	70.5 Å²	70.5	29%	0.291	34%	0.335	S	S	.	.	H	α-helix	trans	-58.1	-49.6	172.6	-177.7	-171.3	170.7	-175.7	0	110.7	F13 K19 F20 E21 W68	F13-K17 WeakPolarHBondContact O-CB 3.17Å; F13-K17 PolarHBondContact O-N 3.11Å; K17-K19 VanDerWaalsContact C-N 3.3Å; K17-K19 PolarHBondContact O-N 2.74Å; K17-F20 CarbonylContact O-C 3.56Å; K17-F20 WeakPolarHBondContact O-CA 3.33Å; K17-F20 WeakPolarHBondContact O-CB 3.03Å; K17-F20 PolarHBondContact O-N 3.27Å; K17-E21 HydrophobicContact CG-CG 4.38Å; K17-E21 WeakPolarHBondContact O-CG 3.26Å; K17-E21 PolarHBondContact O-N 3.3Å; K17-W68 HydrophobicContact CB-CH2 3.97Å; K17-W68 HydrophobicContact CB-CZ2 3.99Å; K17-W68 HydrophobicContact CD-CH2 3.75Å; K17-W68 HydrophobicContact CD-CZ2 3.65Å; K17-W68 HydrophobicContact CG-CH2 4.15Å; K17-W68 HydrophobicContact CG-CZ2 4.33Å
18	R	84.4	Confident	84.5	Confident	196 Å²	196	71.5 Å²	71.5	74%	0.74	34%	0.341	S	S	*	.	H	α-helix	trans	-61.5	-37.5	178.6	-173	175.7	-178.5	174.6	1.7	112.6	E14 A22	E14-R18 WeakPolarHBondContact O-CB 3.33Å; E14-R18 PolarHBondContact O-N 3.45Å; R18-A22 VanDerWaalsContact O-CB 3.32Å; R18-A22 WeakPolarHBondContact O-CB 3.16Å; R18-A22 PolarHBondContact O-N 2.88Å
19	K	83.2	Confident	84.3	Confident	90 Å²	90	72.9 Å²	72.9	39%	0.391	35%	0.353	S	S	.	.	H	α-helix	trans	-66.8	-39.6	173.3	-72.2	172.5	-175.9	172.3	0	111.8	K15 E16 K17 A22 R23	K15-K19 WeakPolarHBondContact O-CG 3.03Å; K15-K19 PolarHBondContact O-N 3.11Å; K15-K19 VanDerWaalsContact O-N 3.1Å; E16-K19 PolarHBondContact O-N 2.94Å; E16-K19 WeakPolarHBondContact OE1-CD 3.43Å; E16-K19 IonicContact OE1-NZ 2.77Å; E16-K19 PolarHBondContact OE1-NZ 3.01Å; K17-K19 VanDerWaalsContact C-N 3.3Å; K17-K19 PolarHBondContact O-N 2.74Å; K19-A22 PolarHBondContact O-N 3.47Å; K19-R23 WeakPolarHBondContact O-CB 3.42Å; K19-R23 WeakPolarHBondContact O-CG 3.18Å; K19-R23 PolarHBondContact O-N 3.47Å
20	F	81.5	Confident	83.7	Confident	54 Å²	54	77.6 Å²	77.6	24%	0.237	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-49.2	175.4	-179.9	-81.6	0	0	0	110.5	E16 K17 A22 R23 Q24 L47 I49	E16-F20 WeakPolarHBondContact O-CB 3.31Å; E16-F20 PolarHBondContact O-N 2.89Å; K17-F20 CarbonylContact O-C 3.56Å; K17-F20 WeakPolarHBondContact O-CA 3.33Å; K17-F20 WeakPolarHBondContact O-CB 3.03Å; K17-F20 PolarHBondContact O-N 3.27Å; F20-A22 VanDerWaalsContact C-N 3.33Å; F20-A22 PolarHBondContact O-N 3.46Å; F20-R23 PolarHBondContact O-N 2.94Å; F20-Q24 WeakPolarHBondContact O-CB 3.13Å; F20-Q24 PolarHBondContact O-N 2.85Å; F20-L47 HydrophobicContact CD2-CB 3.78Å; F20-L47 HydrophobicContact CD2-CD1 4.32Å; F20-L47 HydrophobicContact CE2-CB 3.26Å; F20-L47 HydrophobicContact CE2-CD1 3.96Å; F20-L47 HydrophobicContact CE2-CG 4.21Å; F20-L47 HydrophobicContact CZ-CB 4.03Å; F20-L47 HydrophobicContact CZ-CD1 4.07Å; F20-I49 HydrophobicContact CB-CD1 4.44Å; F20-I49 HydrophobicContact CB-CG1 4.34Å; F20-I49 HydrophobicContact CD2-CD1 4.27Å; F20-I49 HydrophobicContact CD2-CG1 3.95Å; F20-I49 HydrophobicContact CG-CD1 4.41Å; F20-I49 HydrophobicContact CG-CG1 4.41Å
21	E	84.5	Confident	82.8	Confident	94 Å²	94	77.7 Å²	77.7	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-41.5	176.2	-70.5	173.5	125.3	0	0	111.5	K17 Q24 A25	K17-E21 HydrophobicContact CG-CG 4.38Å; K17-E21 WeakPolarHBondContact O-CG 3.26Å; K17-E21 PolarHBondContact O-N 3.3Å; E21-Q24 PolarHBondContact O-N 3.36Å; E21-A25 VanDerWaalsContact O-CB 3.31Å; E21-A25 WeakPolarHBondContact O-CB 3.35Å; E21-A25 PolarHBondContact O-N 3.42Å
22	A	86.2	Confident	81.8	Confident	62 Å²	62	79.4 Å²	79.4	51%	0.512	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-41.4	175.5	0	0	0	0	0	112.4	R18 K19 F20 E26	R18-A22 VanDerWaalsContact O-CB 3.32Å; R18-A22 WeakPolarHBondContact O-CB 3.16Å; R18-A22 PolarHBondContact O-N 2.88Å; K19-A22 PolarHBondContact O-N 3.47Å; F20-A22 VanDerWaalsContact C-N 3.33Å; F20-A22 PolarHBondContact O-N 3.46Å; A22-E26 WeakPolarHBondContact O-CB 3.43Å; A22-E26 PolarHBondContact O-N 3.01Å
23	R	82.9	Confident	80.8	Confident	139 Å²	139	84.8 Å²	84.8	53%	0.525	43%	0.426	S	S	.	.	H	α-helix	trans	-69.4	-39.1	176	-77	179.8	174.3	166.7	-1.7	112.5	K19 F20 E26 I27 L47	K19-R23 WeakPolarHBondContact O-CB 3.42Å; K19-R23 WeakPolarHBondContact O-CG 3.18Å; K19-R23 PolarHBondContact O-N 3.47Å; F20-R23 PolarHBondContact O-N 2.94Å; R23-E26 PolarHBondContact O-N 3.48Å; R23-I27 WeakPolarHBondContact O-CB 3.42Å; R23-I27 WeakPolarHBondContact O-CD1 3.36Å; R23-I27 VanDerWaalsContact O-CG1 3.24Å; R23-I27 WeakPolarHBondContact O-CG1 3.47Å; R23-I27 PolarHBondContact O-N 2.88Å; R23-L47 HydrophobicContact CB-CD1 4.49Å; R23-L47 HydrophobicContact CB-CD2 3.75Å; R23-L47 HydrophobicContact CG-CD2 4.41Å
24	Q	82.8	Confident	79.5	Confident	66 Å²	66	88.7 Å²	88.7	31%	0.308	45%	0.447	S	S	.	.	H	α-helix	trans	-61	-49.7	174.2	169.7	171.3	61.2	0	0	109.8	F20 E21 E26 I27 E28 L44 L47	F20-Q24 WeakPolarHBondContact O-CB 3.13Å; F20-Q24 PolarHBondContact O-N 2.85Å; E21-Q24 PolarHBondContact O-N 3.36Å; Q24-E26 VanDerWaalsContact C-N 3.3Å; Q24-E26 PolarHBondContact O-N 2.77Å; Q24-I27 PolarHBondContact O-N 3.19Å; Q24-I27 VanDerWaalsContact O-N 3.16Å; Q24-E28 HydrophobicContact CG-CG 4.47Å; Q24-E28 VanDerWaalsContact CG-OE2 3.27Å; Q24-E28 WeakPolarHBondContact CG-OE2 3.49Å; Q24-E28 WeakPolarHBondContact O-CB 3.28Å; Q24-E28 WeakPolarHBondContact O-CG 3.39Å; Q24-E28 PolarHBondContact O-N 2.85Å; Q24-L44 HydrophobicContact CB-CD2 3.97Å; Q24-L44 HydrophobicContact CG-CD2 3.76Å; Q24-L47 HydrophobicContact CB-CD1 4.27Å
25	A	85.1	Confident	78.6	Confident	53 Å²	53	92.9 Å²	92.9	44%	0.438	47%	0.472	S	S	.	.	H	α-helix	trans	-61.9	-35.3	176	0	0	0	0	0	112.9	E21 A29	E21-A25 VanDerWaalsContact O-CB 3.31Å; E21-A25 WeakPolarHBondContact O-CB 3.35Å; E21-A25 PolarHBondContact O-N 3.42Å; A25-A29 WeakPolarHBondContact O-CB 3.28Å; A25-A29 PolarHBondContact O-N 3.34Å
26	E	85.5	Confident	78.1	Confident	134 Å²	134	91 Å²	91	63%	0.626	47%	0.468	S	S	*	.	H	α-helix	trans	-65.2	-44.4	173.8	-175.3	176	83.5	0	0	111.6	A22 R23 Q24 A29 E30	A22-E26 WeakPolarHBondContact O-CB 3.43Å; A22-E26 PolarHBondContact O-N 3.01Å; R23-E26 PolarHBondContact O-N 3.48Å; Q24-E26 VanDerWaalsContact C-N 3.3Å; Q24-E26 PolarHBondContact O-N 2.77Å; E26-A29 PolarHBondContact O-N 2.94Å; E26-E30 WeakPolarHBondContact O-CB 3.32Å; E26-E30 PolarHBondContact O-N 2.98Å
27	I	83.1	Confident	77.7	Confident	11 Å²	11	94.1 Å²	94.1	6%	0.056	49%	0.489	C	S	.	.	H	α-helix	trans	-64.8	-43.6	175.8	-68.2	161.8	0	0	0	110.7	R23 Q24 A29 E30 A31 L40 R43 L44 L47	R23-I27 WeakPolarHBondContact O-CB 3.42Å; R23-I27 WeakPolarHBondContact O-CD1 3.36Å; R23-I27 VanDerWaalsContact O-CG1 3.24Å; R23-I27 WeakPolarHBondContact O-CG1 3.47Å; R23-I27 PolarHBondContact O-N 2.88Å; Q24-I27 PolarHBondContact O-N 3.19Å; Q24-I27 VanDerWaalsContact O-N 3.16Å; I27-A29 VanDerWaalsContact C-N 3.34Å; I27-E30 PolarHBondContact O-N 3.09Å; I27-A31 VanDerWaalsContact O-CB 3.29Å; I27-A31 WeakPolarHBondContact O-CB 3.24Å; I27-A31 PolarHBondContact O-N 3.35Å; I27-L40 HydrophobicContact CG2-CB 4.44Å; I27-L40 HydrophobicContact CG2-CD2 3.6Å; I27-L40 WeakPolarHBondContact O-CD2 3.47Å; I27-R43 HydrophobicContact CD1-CB 4.17Å; I27-R43 HydrophobicContact CG2-CB 4.27Å; I27-L44 HydrophobicContact CB-CD2 4.18Å; I27-L44 HydrophobicContact CD1-CD2 4.09Å; I27-L44 HydrophobicContact CG2-CD2 4.06Å; I27-L44 HydrophobicContact CG2-CG 4.1Å; I27-L47 HydrophobicContact CD1-CD1 3.93Å; I27-L47 HydrophobicContact CD1-CD2 4.35Å; I27-L47 HydrophobicContact CD1-CG 4.18Å
28	E	80.9	Confident	77.5	Confident	104 Å²	104	98.7 Å²	98.7	49%	0.486	51%	0.511	S	S	.	.	H	α-helix	trans	-68.3	-30.1	176.7	-71.2	179.9	103.9	0	0	113.1	Q24 A31 T32	Q24-E28 HydrophobicContact CG-CG 4.47Å; Q24-E28 VanDerWaalsContact CG-OE2 3.27Å; Q24-E28 WeakPolarHBondContact CG-OE2 3.49Å; Q24-E28 WeakPolarHBondContact O-CB 3.28Å; Q24-E28 WeakPolarHBondContact O-CG 3.39Å; Q24-E28 PolarHBondContact O-N 2.85Å; E28-A31 WeakPolarHBondContact O-CB 3.35Å; E28-T32 PolarHBondContact O-N 3.44Å; E28-T32 PolarHBondContact O-OG1 2.88Å; E28-T32 VanDerWaalsContact O-OG1 3.09Å
29	A	81.4	Confident	77.1	Confident	67 Å²	67	91.5 Å²	91.5	55%	0.554	49%	0.494	S	S	*	.	H	α-helix	trans	-72.7	-42.7	173.4	0	0	0	0	0	111.3	A25 E26 I27 A31 T32	A25-A29 WeakPolarHBondContact O-CB 3.28Å; A25-A29 PolarHBondContact O-N 3.34Å; E26-A29 PolarHBondContact O-N 2.94Å; I27-A29 VanDerWaalsContact C-N 3.34Å; A29-A31 VanDerWaalsContact C-N 3.29Å; A29-A31 PolarHBondContact O-N 2.8Å; A29-T32 PolarHBondContact O-N 2.8Å
30	E	72.9	Confident	76.7	Confident	98 Å²	98	88.1 Å²	88.1	46%	0.458	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-37.2	174.3	-168.3	168.9	75.2	0	0	111.1	E26 I27 T32 D33 D34 R43	E26-E30 WeakPolarHBondContact O-CB 3.32Å; E26-E30 PolarHBondContact O-N 2.98Å; I27-E30 PolarHBondContact O-N 3.09Å; E30-T32 VanDerWaalsContact C-N 3.3Å; E30-T32 PolarHBondContact O-N 3.25Å; E30-D33 WeakPolarHBondContact O-CB 3.34Å; E30-D33 PolarHBondContact O-N 2.87Å; E30-D33 VanDerWaalsContact O-N 3.11Å; E30-D34 PolarHBondContact O-N 2.76Å; E30-R43 IonicContact OE1-CZ 3.13Å; E30-R43 IonicContact OE1-NH1 2.74Å; E30-R43 PolarHBondContact OE1-NH1 3.07Å; E30-R43 IonicContact OE1-NH2 2.73Å; E30-R43 PolarHBondContact OE1-NH2 3.24Å
31	A	67.2	Low	76.5	Confident	24 Å²	24	91.1 Å²	91.1	20%	0.198	50%	0.495	C	S	.	.	H	α-helix	trans	-59.2	-33.5	174	0	0	0	0	0	115.5	I27 E28 A29 D33 D34 L40	I27-A31 VanDerWaalsContact O-CB 3.29Å; I27-A31 WeakPolarHBondContact O-CB 3.24Å; I27-A31 PolarHBondContact O-N 3.35Å; E28-A31 WeakPolarHBondContact O-CB 3.35Å; A29-A31 VanDerWaalsContact C-N 3.29Å; A29-A31 PolarHBondContact O-N 2.8Å; A31-D33 PolarHBondContact O-N 3.38Å; A31-D34 CarbonylContact O-C 3.49Å; A31-D34 PolarHBondContact O-N 2.89Å; A31-L40 HydrophobicContact CB-CD1 3.03Å; A31-L40 HydrophobicContact CB-CD2 3.49Å; A31-L40 VanDerWaalsContact CB-CD2 3.49Å; A31-L40 HydrophobicContact CB-CG 3.79Å
32	T	65	Low	76.2	Confident	131 Å²	131	88.9 Å²	88.9	80%	0.804	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.7	-179.6	-57.6	0	0	0	0	110.6	E28 A29 E30	E28-T32 PolarHBondContact O-N 3.44Å; E28-T32 PolarHBondContact O-OG1 2.88Å; E28-T32 VanDerWaalsContact O-OG1 3.09Å; A29-T32 PolarHBondContact O-N 2.8Å; E30-T32 VanDerWaalsContact C-N 3.3Å; E30-T32 PolarHBondContact O-N 3.25Å
33	D	65.7	Low	75.8	Confident	158 Å²	158	91.1 Å²	91.1	85%	0.845	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-31.8	175.1	-156.4	-114	0	0	0	112.6	E30 A31	E30-D33 WeakPolarHBondContact O-CB 3.34Å; E30-D33 PolarHBondContact O-N 2.87Å; E30-D33 VanDerWaalsContact O-N 3.11Å; A31-D33 PolarHBondContact O-N 3.38Å
34	D	59.2	Low	75.5	Confident	86 Å²	86	86.6 Å²	86.6	46%	0.46	47%	0.474	S	S	.	.			trans	-111.4	110.4	-175.3	-156.2	-121.7	0	0	0	111	E30 A31 D36	E30-D34 PolarHBondContact O-N 2.76Å; A31-D34 CarbonylContact O-C 3.49Å; A31-D34 PolarHBondContact O-N 2.89Å; D34-D36 PolarHBondContact O-N 2.92Å
35	D	66.5	Low	75.1	Confident	159 Å²	159	91 Å²	91	85%	0.85	49%	0.494	S	S	*	.			trans	-64.1	8.8	-175.4	-163.4	-117.1	0	0	0	114.3	V37	D35-V37 PolarHBondContact O-N 3.41Å; D35-V37 VanDerWaalsContact O-N 3.09Å
36	D	76.2	Confident	74.7	Confident	93 Å²	93	92.6 Å²	92.6	50%	0.497	50%	0.502	S	S	.	.			trans	-87.7	64.4	-176.2	-83.7	-79.2	0	0	0	112.8	D34 Q38 A39 L40	D34-D36 PolarHBondContact O-N 2.92Å; D36-Q38 PolarHBondContact O-N 3.18Å; D36-A39 HydrophobicContact CB-CB 4.04Å; D36-A39 PolarHBondContact O-N 3.42Å; D36-L40 WeakPolarHBondContact O-CD1 3.26Å; D36-L40 WeakPolarHBondContact O-CG 3.32Å; D36-L40 PolarHBondContact O-N 2.76Å
37	V	74.8	Confident	74.1	Confident	91 Å²	91	87.6 Å²	87.6	55%	0.552	48%	0.479	S	S	*	.	H	α-helix	trans	-45.2	-39.9	175.8	-179	0	0	0	0	112.8	D35 L40 E41	D35-V37 PolarHBondContact O-N 3.41Å; D35-V37 VanDerWaalsContact O-N 3.09Å; V37-L40 WeakPolarHBondContact O-CB 3.17Å; V37-L40 PolarHBondContact O-N 3.03Å; V37-E41 WeakPolarHBondContact O-CG 3.41Å; V37-E41 PolarHBondContact O-N 3.37Å
38	Q	77.8	Confident	73.8	Confident	162 Å²	162	95.2 Å²	95.2	76%	0.757	51%	0.512	S	S	*	.	H	α-helix	trans	-69.5	-37.2	-178.7	-58.1	-164.4	-71.3	0	0	113.4	D36 L40 A42	D36-Q38 PolarHBondContact O-N 3.18Å; Q38-L40 PolarHBondContact O-N 2.91Å; Q38-A42 WeakPolarHBondContact O-CB 3.32Å; Q38-A42 PolarHBondContact O-N 3.36Å; Q38-A42 VanDerWaalsContact O-N 3.09Å
39	A	77.8	Confident	73.3	Confident	46 Å²	46	93.8 Å²	93.8	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-33.4	176.2	0	0	0	0	0	110.5	D36 R43	D36-A39 HydrophobicContact CB-CB 4.04Å; D36-A39 PolarHBondContact O-N 3.42Å; A39-R43 WeakPolarHBondContact O-CB 3.4Å; A39-R43 WeakPolarHBondContact O-CG 3.49Å; A39-R43 PolarHBondContact O-N 2.88Å
40	L	73.9	Confident	73.1	Confident	19 Å²	19	94.3 Å²	94.3	10%	0.099	50%	0.503	C	S	.	.	H	α-helix	trans	-71.5	-47.3	179	-62.1	158.5	0	0	0	111.8	I27 A31 D36 V37 Q38 A42 R43 L44	I27-L40 HydrophobicContact CG2-CB 4.44Å; I27-L40 HydrophobicContact CG2-CD2 3.6Å; I27-L40 WeakPolarHBondContact O-CD2 3.47Å; A31-L40 HydrophobicContact CB-CD1 3.03Å; A31-L40 HydrophobicContact CB-CD2 3.49Å; A31-L40 VanDerWaalsContact CB-CD2 3.49Å; A31-L40 HydrophobicContact CB-CG 3.79Å; D36-L40 WeakPolarHBondContact O-CD1 3.26Å; D36-L40 WeakPolarHBondContact O-CG 3.32Å; D36-L40 PolarHBondContact O-N 2.76Å; V37-L40 WeakPolarHBondContact O-CB 3.17Å; V37-L40 PolarHBondContact O-N 3.03Å; Q38-L40 PolarHBondContact O-N 2.91Å; L40-A42 VanDerWaalsContact C-N 3.29Å; L40-A42 PolarHBondContact O-N 3.31Å; L40-R43 PolarHBondContact O-N 3.13Å; L40-R43 VanDerWaalsContact O-N 3.12Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 WeakPolarHBondContact O-CG 3.32Å; L40-L44 PolarHBondContact O-N 3.5Å
41	E	77.3	Confident	73.1	Confident	116 Å²	116	92.3 Å²	92.3	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-55.9	-46.8	172.7	-71.6	-172.9	108	0	0	110.5	V37 R43 L44 E45	V37-E41 WeakPolarHBondContact O-CG 3.41Å; V37-E41 PolarHBondContact O-N 3.37Å; E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 3.31Å; E41-L44 PolarHBondContact O-N 2.88Å; E41-E45 WeakPolarHBondContact O-CB 3.34Å; E41-E45 WeakPolarHBondContact O-CG 3.27Å; E41-E45 PolarHBondContact O-N 2.94Å
42	A	78.6	Confident	73.9	Confident	48 Å²	48	95 Å²	95	40%	0.397	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-36.1	177.2	0	0	0	0	0	113.2	Q38 L40 S46	Q38-A42 WeakPolarHBondContact O-CB 3.32Å; Q38-A42 PolarHBondContact O-N 3.36Å; Q38-A42 VanDerWaalsContact O-N 3.09Å; L40-A42 VanDerWaalsContact C-N 3.29Å; L40-A42 PolarHBondContact O-N 3.31Å; A42-S46 VanDerWaalsContact O-CB 3.25Å; A42-S46 WeakPolarHBondContact O-CB 3.44Å; A42-S46 PolarHBondContact O-N 2.77Å; A42-S46 PolarHBondContact O-OG 3.02Å
43	R	76.6	Confident	74.8	Confident	109 Å²	109	89 Å²	89	41%	0.411	48%	0.476	S	S	.	.	H	α-helix	trans	-70.9	-40.6	175.8	-76.4	171.3	72.2	174.9	-0.6	111.8	I27 E30 A39 L40 E41 S46 L47	I27-R43 HydrophobicContact CD1-CB 4.17Å; I27-R43 HydrophobicContact CG2-CB 4.27Å; E30-R43 IonicContact OE1-CZ 3.13Å; E30-R43 IonicContact OE1-NH1 2.74Å; E30-R43 PolarHBondContact OE1-NH1 3.07Å; E30-R43 IonicContact OE1-NH2 2.73Å; E30-R43 PolarHBondContact OE1-NH2 3.24Å; A39-R43 WeakPolarHBondContact O-CB 3.4Å; A39-R43 WeakPolarHBondContact O-CG 3.49Å; A39-R43 PolarHBondContact O-N 2.88Å; L40-R43 PolarHBondContact O-N 3.13Å; L40-R43 VanDerWaalsContact O-N 3.12Å; E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 3.31Å; R43-S46 PolarHBondContact O-N 3.36Å; R43-L47 PolarHBondContact O-N 3.45Å
44	L	77.6	Confident	75.6	Confident	43 Å²	43	86.3 Å²	86.3	23%	0.225	47%	0.467	C	S	.	.	H	α-helix	trans	-66.4	-44.3	175.6	-70.6	176.9	0	0	0	111.3	Q24 I27 L40 E41 S46 L47	Q24-L44 HydrophobicContact CB-CD2 3.97Å; Q24-L44 HydrophobicContact CG-CD2 3.76Å; I27-L44 HydrophobicContact CB-CD2 4.18Å; I27-L44 HydrophobicContact CD1-CD2 4.09Å; I27-L44 HydrophobicContact CG2-CD2 4.06Å; I27-L44 HydrophobicContact CG2-CG 4.1Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 WeakPolarHBondContact O-CG 3.32Å; L40-L44 PolarHBondContact O-N 3.5Å; E41-L44 PolarHBondContact O-N 2.88Å; L44-S46 PolarHBondContact O-N 3.34Å; L44-L47 HydrophobicContact CD2-CD1 3.76Å; L44-L47 VanDerWaalsContact O-CB 3.3Å; L44-L47 WeakPolarHBondContact O-CB 3.41Å; L44-L47 PolarHBondContact O-N 3.35Å
45	E	75.2	Confident	76.8	Confident	160 Å²	160	85.7 Å²	85.7	75%	0.748	48%	0.481	S	S	*	.	H	α-helix	trans	-64	-28.6	174.1	-73.3	-170.8	99.2	0	0	112.5	E41 L47	E41-E45 WeakPolarHBondContact O-CB 3.34Å; E41-E45 WeakPolarHBondContact O-CG 3.27Å; E41-E45 PolarHBondContact O-N 2.94Å; E45-L47 VanDerWaalsContact C-N 3.31Å
46	S	76.7	Confident	77.7	Confident	85 Å²	85	78.8 Å²	78.8	59%	0.594	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-12.6	175.1	-65.2	0	0	0	0	113.4	A42 R43 L44 K48	A42-S46 VanDerWaalsContact O-CB 3.25Å; A42-S46 WeakPolarHBondContact O-CB 3.44Å; A42-S46 PolarHBondContact O-N 2.77Å; A42-S46 PolarHBondContact O-OG 3.02Å; R43-S46 PolarHBondContact O-N 3.36Å; L44-S46 PolarHBondContact O-N 3.34Å; S46-K48 PolarHBondContact O-N 3.19Å
47	L	73	Confident	78.2	Confident	29 Å²	29	77.3 Å²	77.3	15%	0.152	44%	0.44	C	S	.	.			trans	-67.1	116.9	174.2	-74	166.6	0	0	0	109.2	F20 R23 Q24 I27 R43 L44 E45	F20-L47 HydrophobicContact CD2-CB 3.78Å; F20-L47 HydrophobicContact CD2-CD1 4.32Å; F20-L47 HydrophobicContact CE2-CB 3.26Å; F20-L47 HydrophobicContact CE2-CD1 3.96Å; F20-L47 HydrophobicContact CE2-CG 4.21Å; F20-L47 HydrophobicContact CZ-CB 4.03Å; F20-L47 HydrophobicContact CZ-CD1 4.07Å; R23-L47 HydrophobicContact CB-CD1 4.49Å; R23-L47 HydrophobicContact CB-CD2 3.75Å; R23-L47 HydrophobicContact CG-CD2 4.41Å; Q24-L47 HydrophobicContact CB-CD1 4.27Å; I27-L47 HydrophobicContact CD1-CD1 3.93Å; I27-L47 HydrophobicContact CD1-CD2 4.35Å; I27-L47 HydrophobicContact CD1-CG 4.18Å; R43-L47 PolarHBondContact O-N 3.45Å; L44-L47 HydrophobicContact CD2-CD1 3.76Å; L44-L47 VanDerWaalsContact O-CB 3.3Å; L44-L47 WeakPolarHBondContact O-CB 3.41Å; L44-L47 PolarHBondContact O-N 3.35Å; E45-L47 VanDerWaalsContact C-N 3.31Å
48	K	75.6	Confident	78.7	Confident	172 Å²	172	76.5 Å²	76.5	75%	0.748	44%	0.443	S	S	*	.			trans	-115.7	138.7	177.4	-66.7	175	-175.9	179.7	0	109.5	S46	S46-K48 PolarHBondContact O-N 3.19Å
49	I	70.6	Confident	79.2	Confident	74 Å²	74	75.8 Å²	75.8	38%	0.379	44%	0.444	S	S	.	.			trans	-88.6	131.6	167.5	-64.7	169.7	0	0	0	107.1	E16 F20	E16-I49 HydrophobicContact CB-CG2 3.83Å; E16-I49 HydrophobicContact CG-CG2 4.37Å; F20-I49 HydrophobicContact CB-CD1 4.44Å; F20-I49 HydrophobicContact CB-CG1 4.34Å; F20-I49 HydrophobicContact CD2-CD1 4.27Å; F20-I49 HydrophobicContact CD2-CG1 3.95Å; F20-I49 HydrophobicContact CG-CD1 4.41Å; F20-I49 HydrophobicContact CG-CG1 4.41Å
50	T	77.8	Confident	79.6	Confident	77 Å²	77	75.7 Å²	75.7	47%	0.472	44%	0.437	S	S	.	.			trans	-77.3	129.7	172.7	-59.1	0	0	0	0	107.7	Y12	Y12-T50 VanDerWaalsContact CE1-O 3.26Å; Y12-T50 WeakPolarHBondContact CE1-O 3.33Å; Y12-T50 PolarHBondContact OH-O 3.12Å
51	L	73.3	Confident	80.2	Confident	57 Å²	57	76.1 Å²	76.1	30%	0.298	44%	0.439	S	S	.	.			trans	-96.3	6.4	-176.8	-154.1	123.5	0	0	0	112.9	F13 I53 E61 L65	F13-L51 HydrophobicContact CE1-CG 4.32Å; L51-I53 PolarHBondContact O-N 2.87Å; L51-E61 HydrophobicContact CD2-CB 3.4Å; L51-E61 HydrophobicContact CG-CB 4.48Å; L51-E61 VanDerWaalsContact O-OE1 3.09Å; L51-L65 HydrophobicContact CD1-CB 4.09Å; L51-L65 HydrophobicContact CD1-CD1 4.3Å; L51-L65 HydrophobicContact CD1-CD2 3.42Å; L51-L65 VanDerWaalsContact CD1-CD2 3.42Å; L51-L65 HydrophobicContact CD1-CG 4.1Å
52	S	82.1	Confident	80.6	Confident	79 Å²	79	75.6 Å²	75.6	55%	0.552	44%	0.439	S	S	*	.			trans	-84.3	99.9	-177.2	-59.5	0	0	0	0	111.6	Y12 E61	Y12-S52 WeakPolarHBondContact CE2-O 3.31Å; Y12-S52 VanDerWaalsContact CZ-O 3.28Å; Y12-S52 PolarHBondContact OH-O 3.47Å; Y12-S52 VanDerWaalsContact OH-O 3.07Å; S52-E61 VanDerWaalsContact CA-OE1 3.24Å; S52-E61 WeakPolarHBondContact CA-OE1 3.37Å
53	I	83.9	Confident	81	Confident	6 Å²	6	74.8 Å²	74.8	3%	0.031	43%	0.432	C	S	.	.			trans	-95.3	119.1	-176.3	-54.9	163.6	0	0	0	108.9	A9 Y12 F13 L51 G55 V56 E61	A9-I53 HydrophobicContact CB-CD1 3.49Å; A9-I53 VanDerWaalsContact CB-CD1 3.49Å; Y12-I53 HydrophobicContact CD1-CG1 3.7Å; Y12-I53 HydrophobicContact CD2-CG2 4.46Å; Y12-I53 HydrophobicContact CE1-CG1 4.13Å; Y12-I53 HydrophobicContact CG-CB 4.44Å; Y12-I53 HydrophobicContact CG-CG1 3.98Å; Y12-I53 HydrophobicContact CG-CG2 4.18Å; F13-I53 HydrophobicContact CE1-CD1 3.82Å; F13-I53 HydrophobicContact CE1-CG1 4.31Å; F13-I53 HydrophobicContact CE2-CD1 3.77Å; F13-I53 HydrophobicContact CZ-CD1 3.33Å; F13-I53 HydrophobicContact CZ-CG1 4.29Å; L51-I53 PolarHBondContact O-N 2.87Å; I53-G55 PolarHBondContact O-N 3.31Å; I53-V56 HydrophobicContact CB-CB 3.94Å; I53-V56 HydrophobicContact CB-CG2 4.02Å; I53-V56 HydrophobicContact CG2-CB 4.03Å; I53-V56 HydrophobicContact CG2-CG2 3.52Å; I53-V56 PolarHBondContact O-N 3.07Å; I53-E61 PolarHBondContact N-OE1 2.93Å
54	P	84.3	Confident	81.5	Confident	102 Å²	102	69.7 Å²	69.7	66%	0.662	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	133.2	179.1	26.4	-33.6	0	0	0	110.9	V56	P54-V56 VanDerWaalsContact C-N 3.26Å; P54-V56 PolarHBondContact O-N 3.04Å
55	G	83.6	Confident	81.9	Confident	73 Å²	73	69.3 Å²	69.3	75%	0.753	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-2.9	179.6	0	0	0	0	0	115	I53	I53-G55 PolarHBondContact O-N 3.31Å
56	V	84.9	Confident	82.4	Confident	13 Å²	13	67.4 Å²	67.4	8%	0.079	40%	0.402	C	S	.	.	S	Bend	trans	-106.6	132.7	176	177.9	0	0	0	0	109.2	H5 A8 I53 P54 L60 E61 L64	H5-V56 HydrophobicContact CB-CG2 4.18Å; A8-V56 HydrophobicContact CB-CG2 4.21Å; I53-V56 HydrophobicContact CB-CB 3.94Å; I53-V56 HydrophobicContact CB-CG2 4.02Å; I53-V56 HydrophobicContact CG2-CB 4.03Å; I53-V56 HydrophobicContact CG2-CG2 3.52Å; I53-V56 PolarHBondContact O-N 3.07Å; P54-V56 VanDerWaalsContact C-N 3.26Å; P54-V56 PolarHBondContact O-N 3.04Å; V56-L60 HydrophobicContact CG1-CB 4.17Å; V56-E61 HydrophobicContact CG1-CG 4.11Å; V56-L64 HydrophobicContact CG1-CD1 3.43Å; V56-L64 VanDerWaalsContact CG1-CD1 3.43Å
57	P	87.2	Confident	82.8	Confident	62 Å²	62	67.4 Å²	67.4	40%	0.403	39%	0.39	S	S	.	.			trans	-68.7	139.1	175.5	28.4	-34.3	0	0	0	110.8	D59 L60 E61	P57-D59 PolarHBondContact O-N 2.8Å; P57-L60 HydrophobicContact CG-CB 4.17Å; P57-L60 HydrophobicContact CG-CD1 3.55Å; P57-L60 HydrophobicContact CG-CG 3.79Å; P57-L60 PolarHBondContact O-N 2.83Å; P57-E61 PolarHBondContact O-N 3.1Å
58	A	85.9	Confident	83.4	Confident	75 Å²	75	66.8 Å²	66.8	62%	0.62	39%	0.386	S	S	*	.	H	α-helix	trans	-53.2	-33.1	-176.3	0	0	0	0	0	114.7	L60 E61	A58-L60 PolarHBondContact O-N 3.27Å; A58-E61 WeakPolarHBondContact CA-OE2 3.37Å; A58-E61 PolarHBondContact O-N 3.32Å
59	D	88.1	Confident	83.7	Confident	147 Å²	147	61.8 Å²	61.8	79%	0.786	37%	0.367	S	S	*	.	H	α-helix	trans	-62.6	-28.5	177	-174.6	-106.7	0	0	0	113.1	P57	P57-D59 PolarHBondContact O-N 2.8Å
60	L	86.3	Confident	84.4	Confident	44 Å²	44	63.8 Å²	63.8	23%	0.23	38%	0.375	C	S	.	.	H	α-helix	trans	-90.3	-17.7	178.4	-64.4	-178.3	0	0	0	113.2	H5 V56 P57 A58 L62 A63 L64	H5-L60 WeakPolarHBondContact ND1-CD1 3.33Å; V56-L60 HydrophobicContact CG1-CB 4.17Å; P57-L60 HydrophobicContact CG-CB 4.17Å; P57-L60 HydrophobicContact CG-CD1 3.55Å; P57-L60 HydrophobicContact CG-CG 3.79Å; P57-L60 PolarHBondContact O-N 2.83Å; A58-L60 PolarHBondContact O-N 3.27Å; L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.69Å; L60-A63 PolarHBondContact O-N 3.18Å; L60-L64 HydrophobicContact CB-CD1 3.91Å; L60-L64 HydrophobicContact CB-CG 4.45Å; L60-L64 WeakPolarHBondContact O-CB 3.41Å; L60-L64 WeakPolarHBondContact O-CD1 3.47Å; L60-L64 WeakPolarHBondContact O-CG 3.3Å; L60-L64 PolarHBondContact O-N 2.86Å
61	E	85.5	Confident	84.5	Confident	27 Å²	27	63.7 Å²	63.7	13%	0.126	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-40.2	-171.3	-60.8	176.1	137	0	0	112	L51 S52 I53 V56 P57 A58 L64 L65	L51-E61 HydrophobicContact CD2-CB 3.4Å; L51-E61 HydrophobicContact CG-CB 4.48Å; L51-E61 VanDerWaalsContact O-OE1 3.09Å; S52-E61 VanDerWaalsContact CA-OE1 3.24Å; S52-E61 WeakPolarHBondContact CA-OE1 3.37Å; I53-E61 PolarHBondContact N-OE1 2.93Å; V56-E61 HydrophobicContact CG1-CG 4.11Å; P57-E61 PolarHBondContact O-N 3.1Å; A58-E61 WeakPolarHBondContact CA-OE2 3.37Å; A58-E61 PolarHBondContact O-N 3.32Å; E61-L64 PolarHBondContact O-N 2.92Å; E61-L65 WeakPolarHBondContact O-CB 3.38Å; E61-L65 PolarHBondContact O-N 3.46Å
62	L	85.3	Confident	84.3	Confident	106 Å²	106	62.1 Å²	62.1	56%	0.555	36%	0.361	S	S	*	.	H	α-helix	trans	-64.8	-49.2	177	-178.4	62.5	0	0	0	111.4	L60 L64 L65 E66	L60-L62 VanDerWaalsContact C-N 3.33Å; L60-L62 PolarHBondContact O-N 2.69Å; L62-L64 PolarHBondContact O-N 2.78Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; L62-L65 PolarHBondContact O-N 3.42Å; L62-L65 VanDerWaalsContact O-N 3.13Å; L62-E66 WeakPolarHBondContact O-CG 3.43Å; L62-E66 PolarHBondContact O-N 3.42Å
63	A	87.2	Confident	83.3	Confident	31 Å²	31	65.8 Å²	65.8	26%	0.256	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-32.7	-180	0	0	0	0	0	111.9	M1 L60 Y67	M1-A63 HydrophobicContact CE-CB 3.45Å; M1-A63 VanDerWaalsContact CE-CB 3.45Å; L60-A63 PolarHBondContact O-N 3.18Å; A63-Y67 VanDerWaalsContact O-CB 3.3Å; A63-Y67 WeakPolarHBondContact O-CB 3.24Å; A63-Y67 PolarHBondContact O-N 2.94Å
64	L	87.6	Confident	81.6	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-72.4	-38.1	174.5	-71.4	166.7	0	0	0	112.1	M1 H5 V6 A9 F13 V56 L60 E61 L62 Y67 W68	M1-L64 HydrophobicContact SD-CD2 4.27Å; H5-L64 HydrophobicContact CB-CD1 4.24Å; V6-L64 HydrophobicContact CB-CD2 4.19Å; V6-L64 HydrophobicContact CG2-CD2 3.58Å; A9-L64 HydrophobicContact CB-CB 3.9Å; A9-L64 HydrophobicContact CB-CD1 3.86Å; A9-L64 HydrophobicContact CB-CD2 4.28Å; A9-L64 HydrophobicContact CB-CG 4.23Å; F13-L64 HydrophobicContact CE2-CB 4.15Å; V56-L64 HydrophobicContact CG1-CD1 3.43Å; V56-L64 VanDerWaalsContact CG1-CD1 3.43Å; L60-L64 HydrophobicContact CB-CD1 3.91Å; L60-L64 HydrophobicContact CB-CG 4.45Å; L60-L64 WeakPolarHBondContact O-CB 3.41Å; L60-L64 WeakPolarHBondContact O-CD1 3.47Å; L60-L64 WeakPolarHBondContact O-CG 3.3Å; L60-L64 PolarHBondContact O-N 2.86Å; E61-L64 PolarHBondContact O-N 2.92Å; L62-L64 PolarHBondContact O-N 2.78Å; L64-Y67 PolarHBondContact O-N 2.81Å; L64-W68 VanDerWaalsContact O-CB 3.31Å; L64-W68 WeakPolarHBondContact O-CB 3.35Å; L64-W68 PolarHBondContact O-N 3.33Å
65	L	85.5	Confident	79.6	Confident	36 Å²	36	68.5 Å²	68.5	19%	0.188	39%	0.385	C	S	.	.	H	α-helix	trans	-62.3	-48.4	171.9	178.4	72.1	0	0	0	110.3	F13 L51 E61 L62 Y67 W68 L69	F13-L65 HydrophobicContact CD1-CD1 4.08Å; F13-L65 HydrophobicContact CE1-CB 4.32Å; F13-L65 HydrophobicContact CE1-CD1 3.85Å; F13-L65 HydrophobicContact CE2-CB 4.21Å; F13-L65 HydrophobicContact CE2-CD1 4.47Å; F13-L65 HydrophobicContact CZ-CB 3.76Å; F13-L65 HydrophobicContact CZ-CD1 4.05Å; L51-L65 HydrophobicContact CD1-CB 4.09Å; L51-L65 HydrophobicContact CD1-CD1 4.3Å; L51-L65 HydrophobicContact CD1-CD2 3.42Å; L51-L65 VanDerWaalsContact CD1-CD2 3.42Å; L51-L65 HydrophobicContact CD1-CG 4.1Å; E61-L65 WeakPolarHBondContact O-CB 3.38Å; E61-L65 PolarHBondContact O-N 3.46Å; L62-L65 WeakPolarHBondContact O-CB 3.37Å; L62-L65 PolarHBondContact O-N 3.42Å; L62-L65 VanDerWaalsContact O-N 3.13Å; L65-Y67 VanDerWaalsContact C-N 3.31Å; L65-Y67 PolarHBondContact O-N 3.06Å; L65-W68 HydrophobicContact CD1-CE3 3.93Å; L65-W68 HydrophobicContact CD1-CZ3 4.27Å; L65-W68 PolarHBondContact O-N 3.22Å; L65-L69 HydrophobicContact CD1-CD1 4.32Å; L65-L69 HydrophobicContact CD1-CG 4.24Å; L65-L69 HydrophobicContact CD2-CD1 4.19Å; L65-L69 HydrophobicContact CG-CD1 3.9Å; L65-L69 HydrophobicContact CG-CG 4.23Å; L65-L69 WeakPolarHBondContact O-CB 3.46Å; L65-L69 WeakPolarHBondContact O-CG 3.43Å; L65-L69 PolarHBondContact O-N 3.18Å
66	E	86.5	Confident	77.6	Confident	120 Å²	120	69.6 Å²	69.6	56%	0.561	40%	0.396	S	S	*	.	H	α-helix	trans	-58.5	-44.8	178	-71.3	-179.1	107.2	0	0	111.1	L62 L69 E70	L62-E66 WeakPolarHBondContact O-CG 3.43Å; L62-E66 PolarHBondContact O-N 3.42Å; E66-L69 PolarHBondContact O-N 3.2Å; E66-E70 WeakPolarHBondContact O-CB 3.47Å; E66-E70 PolarHBondContact O-N 3.35Å
67	Y	85.1	Confident	75.4	Confident	84 Å²	84	71.2 Å²	71.2	33%	0.329	42%	0.416	S	S	.	.	H	α-helix	trans	-63.4	-42.1	175.7	-176.4	-113.6	0	0	0	112.2	V6 F10 A63 L64 L65 K71	V6-Y67 HydrophobicContact CG1-CD1 4.15Å; V6-Y67 HydrophobicContact CG1-CE1 3.82Å; F10-Y67 AromaticContact CE2-CD1 3.47Å; F10-Y67 HydrophobicContact CE2-CD1 3.47Å; F10-Y67 VanDerWaalsContact CE2-CD1 3.47Å; F10-Y67 AromaticContact CE2-CE1 3.77Å; F10-Y67 HydrophobicContact CE2-CE1 3.77Å; F10-Y67 AromaticContact CZ-CD1 3.62Å; F10-Y67 HydrophobicContact CZ-CD1 3.62Å; F10-Y67 AromaticContact CZ-CE1 3.64Å; F10-Y67 HydrophobicContact CZ-CE1 3.64Å; A63-Y67 VanDerWaalsContact O-CB 3.3Å; A63-Y67 WeakPolarHBondContact O-CB 3.24Å; A63-Y67 PolarHBondContact O-N 2.94Å; L64-Y67 PolarHBondContact O-N 2.81Å; L65-Y67 VanDerWaalsContact C-N 3.31Å; L65-Y67 PolarHBondContact O-N 3.06Å; Y67-K71 HydrophobicContact CE1-CG 4.43Å; Y67-K71 VanDerWaalsContact CE2-CE 3.46Å; Y67-K71 HydrophobicContact CE2-CG 4.36Å; Y67-K71 VanDerWaalsContact CZ-CE 3.45Å; Y67-K71 WeakPolarHBondContact O-CG 3.5Å; Y67-K71 PolarHBondContact O-N 2.85Å; Y67-K71 WeakPolarHBondContact OH-CE 3.43Å
68	W	85	Confident	73	Confident	17 Å²	17	78.9 Å²	78.9	6%	0.064	44%	0.437	C	S	.	.	H	α-helix	trans	-66.1	-40	175.6	174.6	82.1	0	0	0	112.6	F10 F13 E14 K17 L64 L65 K71 S72	F10-W68 AromaticContact CD1-CD1 3.79Å; F10-W68 HydrophobicContact CD2-CB 4.29Å; F10-W68 AromaticContact CE1-CD1 3.89Å; F10-W68 HydrophobicContact CE2-CB 3.81Å; F10-W68 HydrophobicContact CE2-CG 4.49Å; F10-W68 AromaticContact CG-CD1 3.98Å; F10-W68 HydrophobicContact CZ-CB 3.99Å; F10-W68 HydrophobicContact CZ-CG 4.49Å; F13-W68 HydrophobicContact CB-CD2 3.62Å; F13-W68 HydrophobicContact CB-CE3 4.12Å; F13-W68 HydrophobicContact CB-CG 3.88Å; F13-W68 HydrophobicContact CB-CH2 4.46Å; F13-W68 HydrophobicContact CB-CZ2 4.02Å; F13-W68 HydrophobicContact CD2-CB 3.72Å; F13-W68 HydrophobicContact CD2-CD2 4.17Å; F13-W68 AromaticContact CD2-CG 3.78Å; F13-W68 HydrophobicContact CD2-CG 3.78Å; F13-W68 HydrophobicContact CE2-CB 4.26Å; F13-W68 HydrophobicContact CG-CD2 4.12Å; F13-W68 HydrophobicContact CG-CE3 4.38Å; F13-W68 HydrophobicContact CG-CG 4.18Å; E14-W68 WeakPolarHBondContact OE1-CZ2 3.47Å; E14-W68 PolarHBondContact OE1-NE1 2.82Å; K17-W68 HydrophobicContact CB-CH2 3.97Å; K17-W68 HydrophobicContact CB-CZ2 3.99Å; K17-W68 HydrophobicContact CD-CH2 3.75Å; K17-W68 HydrophobicContact CD-CZ2 3.65Å; K17-W68 HydrophobicContact CG-CH2 4.15Å; K17-W68 HydrophobicContact CG-CZ2 4.33Å; L64-W68 VanDerWaalsContact O-CB 3.31Å; L64-W68 WeakPolarHBondContact O-CB 3.35Å; L64-W68 PolarHBondContact O-N 3.33Å; L65-W68 HydrophobicContact CD1-CE3 3.93Å; L65-W68 HydrophobicContact CD1-CZ3 4.27Å; L65-W68 PolarHBondContact O-N 3.22Å; W68-K71 PolarHBondContact O-N 3.37Å; W68-S72 VanDerWaalsContact CE2-OG 3.27Å; W68-S72 PolarHBondContact NE1-OG 2.92Å; W68-S72 WeakPolarHBondContact O-CB 3.25Å; W68-S72 PolarHBondContact O-N 3.09Å; W68-S72 PolarHBondContact O-OG 3.33Å
69	L	82.9	Confident	70.9	Confident	67 Å²	67	78.9 Å²	78.9	35%	0.351	42%	0.422	S	S	.	.	H	α-helix	trans	-66.9	-42.7	176.1	-77.3	173.4	0	0	0	111.7	L65 E66 S72 Q73	L65-L69 HydrophobicContact CD1-CD1 4.32Å; L65-L69 HydrophobicContact CD1-CG 4.24Å; L65-L69 HydrophobicContact CD2-CD1 4.19Å; L65-L69 HydrophobicContact CG-CD1 3.9Å; L65-L69 HydrophobicContact CG-CG 4.23Å; L65-L69 WeakPolarHBondContact O-CB 3.46Å; L65-L69 WeakPolarHBondContact O-CG 3.43Å; L65-L69 PolarHBondContact O-N 3.18Å; E66-L69 PolarHBondContact O-N 3.2Å; L69-S72 PolarHBondContact O-N 3.31Å; L69-Q73 WeakPolarHBondContact O-CB 3.43Å; L69-Q73 WeakPolarHBondContact O-CG 3.19Å; L69-Q73 PolarHBondContact O-N 3.02Å; L69-Q73 PolarHBondContact O-NE2 3.16Å
70	E	83.8	Confident	68.4	Low	116 Å²	116	78.1 Å²	78.1	54%	0.542	41%	0.414	S	S	.	.	H	α-helix	trans	-56.9	-53.1	174.4	-178.3	-176.5	85.3	0	0	109	E66 T74	E66-E70 WeakPolarHBondContact O-CB 3.47Å; E66-E70 PolarHBondContact O-N 3.35Å; E70-T74 WeakPolarHBondContact O-CB 3.2Å; E70-T74 PolarHBondContact O-N 2.83Å; E70-T74 VanDerWaalsContact O-N 3.11Å; E70-T74 PolarHBondContact O-OG1 2.97Å
71	K	79.6	Confident	66.2	Low	74 Å²	74	79 Å²	79	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-57.9	-60.8	175.7	-66	-57	-179.4	-164	0	110.2	F10 Y67 W68 Q73 T74 T75 F79	F10-K71 HydrophobicContact CE1-CB 4.24Å; F10-K71 HydrophobicContact CE1-CG 4.35Å; F10-K71 HydrophobicContact CZ-CB 4.25Å; F10-K71 HydrophobicContact CZ-CG 4.06Å; Y67-K71 HydrophobicContact CE1-CG 4.43Å; Y67-K71 VanDerWaalsContact CE2-CE 3.46Å; Y67-K71 HydrophobicContact CE2-CG 4.36Å; Y67-K71 VanDerWaalsContact CZ-CE 3.45Å; Y67-K71 WeakPolarHBondContact O-CG 3.5Å; Y67-K71 PolarHBondContact O-N 2.85Å; Y67-K71 WeakPolarHBondContact OH-CE 3.43Å; W68-K71 PolarHBondContact O-N 3.37Å; K71-Q73 VanDerWaalsContact C-N 3.27Å; K71-Q73 PolarHBondContact O-N 2.95Å; K71-Q73 VanDerWaalsContact O-N 3.09Å; K71-T74 PolarHBondContact O-N 3.34Å; K71-T75 PolarHBondContact O-N 3.29Å; K71-F79 HydrophobicContact CB-CE1 3.78Å; K71-F79 HydrophobicContact CB-CZ 3.67Å; K71-F79 WeakPolarHBondContact O-CE2 3.46Å; K71-F79 WeakPolarHBondContact O-CZ 3.41Å
72	S	70.2	Confident	64	Low	24 Å²	24	86.4 Å²	86.4	17%	0.168	45%	0.45	C	S	.	.	H	α-helix	trans	-51.6	-39.4	-174.6	-64.9	0	0	0	0	114.5	W68 L69 F79	W68-S72 VanDerWaalsContact CE2-OG 3.27Å; W68-S72 PolarHBondContact NE1-OG 2.92Å; W68-S72 WeakPolarHBondContact O-CB 3.25Å; W68-S72 PolarHBondContact O-N 3.09Å; W68-S72 PolarHBondContact O-OG 3.33Å; L69-S72 PolarHBondContact O-N 3.31Å; S72-F79 VanDerWaalsContact CA-CE2 3.44Å
73	Q	59.8	Low	61.8	Low	156 Å²	156	87.5 Å²	87.5	73%	0.729	46%	0.455	S	S	*	.	H	α-helix	trans	-78.8	-30.7	177.9	-71	-178	90.6	0	0	113.6	L69 K71 T75	L69-Q73 WeakPolarHBondContact O-CB 3.43Å; L69-Q73 WeakPolarHBondContact O-CG 3.19Å; L69-Q73 PolarHBondContact O-N 3.02Å; L69-Q73 PolarHBondContact O-NE2 3.16Å; K71-Q73 VanDerWaalsContact C-N 3.27Å; K71-Q73 PolarHBondContact O-N 2.95Å; K71-Q73 VanDerWaalsContact O-N 3.09Å; Q73-T75 PolarHBondContact O-N 3.47Å
74	T	49.8	Very low	59.2	Low	109 Å²	109	90.7 Å²	90.7	67%	0.669	47%	0.472	S	S	*	.	H	α-helix	trans	-66.4	-22.2	-179.4	-48.5	0	0	0	0	111.9	E70 K71	E70-T74 WeakPolarHBondContact O-CB 3.2Å; E70-T74 PolarHBondContact O-N 2.83Å; E70-T74 VanDerWaalsContact O-N 3.11Å; E70-T74 PolarHBondContact O-OG1 2.97Å; K71-T74 PolarHBondContact O-N 3.34Å
75	T	42.3	Very low	57	Low	57 Å²	57	94.9 Å²	94.9	35%	0.35	49%	0.494	S	S	.	.			trans	-121.6	85.8	-172.5	-32.2	0	0	0	0	111.1	K71 Q73 G77 F79	K71-T75 PolarHBondContact O-N 3.29Å; Q73-T75 PolarHBondContact O-N 3.47Å; T75-G77 WeakPolarHBondContact CG2-O 3.42Å; T75-G77 PolarHBondContact O-N 3.23Å; T75-F79 HydrophobicContact CG2-CE2 4.34Å; T75-F79 WeakPolarHBondContact OG1-CE2 3.42Å; T75-F79 WeakPolarHBondContact OG1-CZ 3.29Å
76	G	40.7	Very low	54.9	Low	95 Å²	95	100.1 Å²	100.1	98%	0.979	52%	0.522	S	S	*	.	S	Bend	trans	-62.9	37.3	162.7	0	0	0	0	0	114.3
77	G	39.2	Very low	52.7	Low	48 Å²	48	102.2 Å²	102.2	50%	0.495	53%	0.532	S	S	.	.	S	Bend	trans	171.4	105.3	179.6	0	0	0	0	0	112.5	T75	T75-G77 WeakPolarHBondContact CG2-O 3.42Å; T75-G77 PolarHBondContact O-N 3.23Å
78	R	35.6	Very low	50.9	Low	223 Å²	223	102.7 Å²	102.7	84%	0.842	55%	0.547	S	S	*	.			trans	62	88.6	167.4	-62.4	178.7	-174.3	172.2	1.5	115.2	E80	R78-E80 VanDerWaalsContact C-N 3.31Å; R78-E80 PolarHBondContact O-N 3.33Å; R78-E80 VanDerWaalsContact O-N 3.12Å
79	F	42.1	Very low	48.9	Very low	74 Å²	74	105.3 Å²	105.3	33%	0.325	57%	0.573	S	S	.	*			trans	-73	93.8	147.8	-84.8	-78.1	0	0	0	108.7	K71 S72 T75 V81	K71-F79 HydrophobicContact CB-CE1 3.78Å; K71-F79 HydrophobicContact CB-CZ 3.67Å; K71-F79 WeakPolarHBondContact O-CE2 3.46Å; K71-F79 WeakPolarHBondContact O-CZ 3.41Å; S72-F79 VanDerWaalsContact CA-CE2 3.44Å; T75-F79 HydrophobicContact CG2-CE2 4.34Å; T75-F79 WeakPolarHBondContact OG1-CE2 3.42Å; T75-F79 WeakPolarHBondContact OG1-CZ 3.29Å; F79-V81 HydrophobicContact CB-CG2 4.35Å; F79-V81 PolarHBondContact O-N 3.12Å
80	E	35.4	Very low	47.1	Very low	132 Å²	132	107.9 Å²	107.9	62%	0.617	59%	0.587	S	S	*	*			trans	-68.6	85.9	148.7	-75.4	-179.5	81.4	0	0	106	R78 Y82	R78-E80 VanDerWaalsContact C-N 3.31Å; R78-E80 PolarHBondContact O-N 3.33Å; R78-E80 VanDerWaalsContact O-N 3.12Å; E80-Y82 HydrophobicContact CB-CE2 4.36Å; E80-Y82 PolarHBondContact O-N 2.96Å
81	V	42	Very low	45	Very low	62 Å²	62	109.6 Å²	109.6	38%	0.376	60%	0.595	S	S	.	*			trans	-61.5	101.9	156.7	-179.9	0	0	0	0	103.8	F79 L83	F79-V81 HydrophobicContact CB-CG2 4.35Å; F79-V81 PolarHBondContact O-N 3.12Å; V81-L83 PolarHBondContact O-N 2.75Å
82	Y	37.8	Very low	43.3	Very low	183 Å²	183	110.6 Å²	110.6	72%	0.718	61%	0.611	S	S	*	*			trans	-60.5	91.7	165.5	-75.4	-89	0	0	0	106	E80 T84	E80-Y82 HydrophobicContact CB-CE2 4.36Å; E80-Y82 PolarHBondContact O-N 2.96Å; Y82-T84 PolarHBondContact O-N 3.09Å
83	L	38.8	Very low	42.3	Very low	129 Å²	129	119.7 Å²	119.7	68%	0.675	64%	0.643	S	S	*	*			trans	-63.8	77.7	154.8	-68.5	161.3	0	0	0	104.7	I11 V81 D85	I11-L83 HydrophobicContact CD1-CD2 4.22Å; I11-L83 HydrophobicContact CG1-CD2 4.46Å; V81-L83 PolarHBondContact O-N 2.75Å; L83-D85 PolarHBondContact O-N 3.4Å
84	T	34.2	Very low	41.8	Very low	98 Å²	98	116 Å²	116	60%	0.601	64%	0.64	S	S	*	*			trans	-69.4	87.9	151	-46.6	0	0	0	0	103.9	Y82 D86	Y82-T84 PolarHBondContact O-N 3.09Å; T84-D86 PolarHBondContact O-N 3.11Å
85	D	40.3	Very low	41.3	Very low	89 Å²	89	117.9 Å²	117.9	48%	0.476	65%	0.646	S	S	.	*			trans	-56.2	90.7	163.6	-170.8	-131	0	0	0	106.3	L83 E87 S88	L83-D85 PolarHBondContact O-N 3.4Å; D85-E87 PolarHBondContact O-N 2.64Å; D85-S88 VanDerWaalsContact CG-N 3.35Å; D85-S88 PolarHBondContact O-N 3.35Å; D85-S88 WeakPolarHBondContact OD1-CA 3.36Å; D85-S88 WeakPolarHBondContact OD1-CB 3.47Å; D85-S88 PolarHBondContact OD1-N 3.31Å; D85-S88 PolarHBondContact OD1-OG 3.23Å
86	D	41.8	Very low	41.9	Very low	145 Å²	145	124.6 Å²	124.6	78%	0.775	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	8.3	166.6	-154.2	-116.2	0	0	0	110.7	T84	T84-D86 PolarHBondContact O-N 3.11Å
87	E	40.7	Very low	42.1	Very low	165 Å²	165	122.7 Å²	122.7	77%	0.771	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	32.2	166.4	-78.3	-170.7	88.5	0	0	112.9	D85 A89	D85-E87 PolarHBondContact O-N 2.64Å; E87-A89 PolarHBondContact O-N 3.32Å
88	S	46.1	Very low	42.2	Very low	93 Å²	93	125.7 Å²	125.7	65%	0.65	67%	0.667	S	S	*	*			trans	-75.8	50.7	142.3	-76.8	0	0	0	0	108.3	D85 D90	D85-S88 VanDerWaalsContact CG-N 3.35Å; D85-S88 PolarHBondContact O-N 3.35Å; D85-S88 WeakPolarHBondContact OD1-CA 3.36Å; D85-S88 WeakPolarHBondContact OD1-CB 3.47Å; D85-S88 PolarHBondContact OD1-N 3.31Å; D85-S88 PolarHBondContact OD1-OG 3.23Å; S88-D90 PolarHBondContact O-N 3.49Å
89	A	44.7	Very low	43.5	Very low	72 Å²	72	124.8 Å²	124.8	60%	0.595	66%	0.664	S	S	*	*			trans	-75.6	62.5	144.1	0	0	0	0	0	107.3	E87	E87-A89 PolarHBondContact O-N 3.32Å
90	D	43.9	Very low	44	Very low	121 Å²	121	129.3 Å²	129.3	65%	0.647	69%	0.689	S	S	*	*			trans	-103.2	86.6	142.8	-162	-86.8	0	0	0	101.8	S88 S92	S88-D90 PolarHBondContact O-N 3.49Å; D90-S92 PolarHBondContact O-N 2.87Å; D90-S92 PolarHBondContact OD1-N 3.17Å; D90-S92 PolarHBondContact OD1-OG 2.77Å
91	E	40.8	Very low	45.1	Very low	152 Å²	152	128.1 Å²	128.1	71%	0.71	69%	0.687	S	S	*	*				31	34.4	82.2	-66	-146.4	103.5	0	0	113.5	Y93	E91-Y93 PolarHBondContact O-N 2.96Å
92	S	44	Very low	45.8	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	73%	0.729	S	S	*	*			trans	-67.5	58.3	145.8	-79.1	0	0	0	0	109.1	D90 A94	D90-S92 PolarHBondContact O-N 2.87Å; D90-S92 PolarHBondContact OD1-N 3.17Å; D90-S92 PolarHBondContact OD1-OG 2.77Å; S92-A94 PolarHBondContact O-N 3.4Å
93	Y	48.8	Very low	46.2	Very low	215 Å²	215	134 Å²	134	84%	0.843	73%	0.729	S	S	*	*			trans	-63.1	59.5	143.2	-112.6	-83.6	0	0	0	108	E91	E91-Y93 PolarHBondContact O-N 2.96Å
94	A	49.1	Very low	46.6	Very low	80 Å²	80	134.2 Å²	134.2	66%	0.661	73%	0.732	S	S	*	*			trans	-157.1	60.4	179	0	0	0	0	0	109.9	S92	S92-A94 PolarHBondContact O-N 3.4Å
95	N	39	Very low	47.3	Very low	147 Å²	147	136.2 Å²	136.2	79%	0.786	74%	0.739	S	S	*	*			trans	-158.7	88.1	132.6	-159.7	52.8	0	0	0	110.3	G97	N95-G97 PolarHBondContact O-N 3.03Å
96	E	54.5	Low	47.7	Very low	198 Å²	198	139 Å²	139	93%	0.925	76%	0.755	S	S	*	*			trans	-33.8	116.7	143.2	-167.6	-178.8	109	0	0	109.5
97	G	44.6	Very low	48.1	Very low	55 Å²	55	138.6 Å²	138.6	57%	0.567	75%	0.754	S	S	*	*			trans	-154.4	48.9	-159.1	0	0	0	0	0	114.5	N95	N95-G97 PolarHBondContact O-N 3.03Å
98	S	41.2	Very low	48.6	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	75%	0.753	S	S	*	*			trans	63.5	107.1	149.6	-65.2	0	0	0	0	118.6
99	R	62.9	Low	48.7	Very low	204 Å²	204	140 Å²	140	77%	0.77	76%	0.76	S	S	*	*				37.6	119.9	116	-176.5	-176.5	-172.4	175.4	3.2	117.1	D101	R99-D101 IonicContact CZ-OD2 3.15Å; R99-D101 IonicContact NE-OD2 2.64Å; R99-D101 PolarHBondContact NE-OD2 3.09Å; R99-D101 IonicContact NH2-OD2 2.69Å; R99-D101 PolarHBondContact NH2-OD2 2.84Å
100	I	52.8	Low	49.1	Very low	168 Å²	168	145.2 Å²	145.2	86%	0.862	77%	0.772	S	S	*	*			trans	-146.8	94.2	137.4	-37.5	173.8	0	0	0	106.1
101	D	58.2	Low	49.5	Very low	107 Å²	107	147.3 Å²	147.3	57%	0.572	78%	0.783	S	S	*	*				76.3	133.1	79.1	-133	-111.2	0	0	0	113.9	R99	R99-D101 IonicContact CZ-OD2 3.15Å; R99-D101 IonicContact NE-OD2 2.64Å; R99-D101 PolarHBondContact NE-OD2 3.09Å; R99-D101 IonicContact NH2-OD2 2.69Å; R99-D101 PolarHBondContact NH2-OD2 2.84Å
102	D	58	Low	50.3	Low	234 Å²	234	146.8 Å²	146.8	100%	1.251	79%	0.79	S	S	*	*			trans	85.2	0	177.6	-143.8	-120.6	0	0	0	118.7

Retrieved 102 of 102 residues in 136.3 ms (Link to these results)

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