A0A077ZLA2_TRITR Loading...

DDE-1 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZLA2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 163 aa.

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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	66.9	Low	90.8	Very high	208 Å²	208	116.7 Å²	116.7	100%	1.025	60%	0.604	S	S	*	*				0	-28.3	0	-109	165.7	174.8	0	0	112.6	A3 V4	M1-A3 PolarHBondContact O-N 3.03Å; M1-V4 PolarHBondContact O-N 3.1Å
2	D	86.9	Confident	91.1	Very high	104 Å²	104	116.6 Å²	116.6	56%	0.556	61%	0.605	S	S	*	*	H	α-helix	trans	-60	-36.3	-175.3	-54.1	-29.7	0	0	0	115.3	V4 L5 W6	D2-V4 VanDerWaalsContact C-N 3.3Å; D2-V4 PolarHBondContact O-N 2.89Å; D2-L5 WeakPolarHBondContact O-CB 3.36Å; D2-L5 PolarHBondContact O-N 3.48Å; D2-L5 VanDerWaalsContact O-N 3.13Å; D2-W6 PolarHBondContact O-N 2.97Å
3	A	93	Very high	91.4	Very high	62 Å²	62	118.9 Å²	118.9	51%	0.512	61%	0.607	S	S	.	*	H	α-helix	trans	-58.2	-41	-179.7	0	0	0	0	0	112.6	M1 W6 I7	M1-A3 PolarHBondContact O-N 3.03Å; A3-W6 PolarHBondContact O-N 3.29Å; A3-I7 VanDerWaalsContact O-CG1 3.28Å; A3-I7 WeakPolarHBondContact O-CG1 3.35Å; A3-I7 PolarHBondContact O-N 3.45Å
4	V	93	Very high	91.5	Very high	103 Å²	103	114.6 Å²	114.6	62%	0.624	59%	0.589	S	S	*	*	H	α-helix	trans	-65.9	-41.8	178.4	179	0	0	0	0	110.5	M1 D2 W6 I7 N8	M1-V4 PolarHBondContact O-N 3.1Å; D2-V4 VanDerWaalsContact C-N 3.3Å; D2-V4 PolarHBondContact O-N 2.89Å; V4-W6 VanDerWaalsContact C-N 3.31Å; V4-W6 PolarHBondContact O-N 3.18Å; V4-I7 PolarHBondContact O-N 3.44Å; V4-N8 WeakPolarHBondContact O-CB 3.47Å; V4-N8 PolarHBondContact O-N 2.89Å
5	L	92.2	Very high	91.5	Very high	114 Å²	114	115.7 Å²	115.7	60%	0.597	59%	0.591	S	S	*	*	H	α-helix	trans	-63.8	-37.8	176.1	-64.9	176.1	0	0	0	111.7	D2 S9	D2-L5 WeakPolarHBondContact O-CB 3.36Å; D2-L5 PolarHBondContact O-N 3.48Å; D2-L5 VanDerWaalsContact O-N 3.13Å; L5-S9 VanDerWaalsContact O-CB 3.27Å; L5-S9 WeakPolarHBondContact O-CB 3.41Å; L5-S9 PolarHBondContact O-N 3.36Å
6	W	94.5	Very high	91.5	Very high	183 Å²	183	113.7 Å²	113.7	69%	0.693	59%	0.588	S	S	*	*	H	α-helix	trans	-68.6	-42.4	176.7	-68.3	-2.8	0	0	0	112.7	D2 A3 V4 S9 S10	D2-W6 PolarHBondContact O-N 2.97Å; A3-W6 PolarHBondContact O-N 3.29Å; V4-W6 VanDerWaalsContact C-N 3.31Å; V4-W6 PolarHBondContact O-N 3.18Å; W6-S9 PolarHBondContact O-N 3.49Å; W6-S10 VanDerWaalsContact O-CB 3.32Å; W6-S10 WeakPolarHBondContact O-CB 3.32Å; W6-S10 PolarHBondContact O-N 2.99Å; W6-S10 PolarHBondContact O-OG 2.96Å
7	I	94.5	Very high	91.5	Very high	120 Å²	120	111.5 Å²	111.5	62%	0.615	57%	0.574	S	S	*	*	H	α-helix	trans	-61.7	-48.4	175.3	-67.6	164.3	0	0	0	109.5	A3 V4 S9 S10 W11	A3-I7 VanDerWaalsContact O-CG1 3.28Å; A3-I7 WeakPolarHBondContact O-CG1 3.35Å; A3-I7 PolarHBondContact O-N 3.45Å; V4-I7 PolarHBondContact O-N 3.44Å; I7-S9 PolarHBondContact O-N 2.97Å; I7-S10 PolarHBondContact O-N 3.39Å; I7-S10 VanDerWaalsContact O-N 3.16Å; I7-W11 WeakPolarHBondContact O-CB 3.45Å; I7-W11 PolarHBondContact O-N 3.41Å
8	N	95.3	Very high	91.4	Very high	92 Å²	92	107.7 Å²	107.7	49%	0.492	56%	0.562	S	S	.	*	H	α-helix	trans	-62.1	-42.6	178.7	-171.9	48.2	0	0	0	112.1	V4 S10 W11 N12	V4-N8 WeakPolarHBondContact O-CB 3.47Å; V4-N8 PolarHBondContact O-N 2.89Å; N8-S10 VanDerWaalsContact C-N 3.31Å; N8-S10 PolarHBondContact O-N 3.37Å; N8-W11 PolarHBondContact O-N 2.9Å; N8-N12 PolarHBondContact O-N 3.32Å; N8-N12 VanDerWaalsContact O-N 3.08Å; N8-N12 PolarHBondContact O-ND2 3.38Å; N8-N12 PolarHBondContact OD1-ND2 3.15Å
9	S	94.6	Very high	91.4	Very high	53 Å²	53	105.4 Å²	105.4	37%	0.371	55%	0.55	S	S	.	.	H	α-helix	trans	-62.6	-38	175.2	-171.2	0	0	0	0	112.4	L5 W6 I7 K13	L5-S9 VanDerWaalsContact O-CB 3.27Å; L5-S9 WeakPolarHBondContact O-CB 3.41Å; L5-S9 PolarHBondContact O-N 3.36Å; W6-S9 PolarHBondContact O-N 3.49Å; I7-S9 PolarHBondContact O-N 2.97Å; S9-K13 WeakPolarHBondContact O-CD 3.2Å; S9-K13 VanDerWaalsContact O-CG 3.3Å; S9-K13 WeakPolarHBondContact O-CG 3.48Å
10	S	94.3	Very high	91.2	Very high	71 Å²	71	107.6 Å²	107.6	50%	0.497	55%	0.55	S	S	.	*	H	α-helix	trans	-72.2	-42.7	179	-57.3	0	0	0	0	111.5	W6 I7 N8 N12 K13 V14	W6-S10 VanDerWaalsContact O-CB 3.32Å; W6-S10 WeakPolarHBondContact O-CB 3.32Å; W6-S10 PolarHBondContact O-N 2.99Å; W6-S10 PolarHBondContact O-OG 2.96Å; I7-S10 PolarHBondContact O-N 3.39Å; I7-S10 VanDerWaalsContact O-N 3.16Å; N8-S10 VanDerWaalsContact C-N 3.31Å; N8-S10 PolarHBondContact O-N 3.37Å; S10-N12 PolarHBondContact O-N 3.13Å; S10-K13 PolarHBondContact O-N 2.73Å; S10-K13 VanDerWaalsContact O-N 3.13Å; S10-V14 PolarHBondContact O-N 3.29Å
11	W	93.9	Very high	91.2	Very high	174 Å²	174	108.5 Å²	108.5	66%	0.659	55%	0.551	S	S	*	*	H	α-helix	trans	-60.1	-45.3	177.3	-174	-104.9	0	0	0	111.9	I7 N8 K13 V14	I7-W11 WeakPolarHBondContact O-CB 3.45Å; I7-W11 PolarHBondContact O-N 3.41Å; N8-W11 PolarHBondContact O-N 2.9Å; W11-K13 PolarHBondContact O-N 3.18Å; W11-K13 VanDerWaalsContact O-N 3.14Å; W11-V14 WeakPolarHBondContact O-CB 3.36Å; W11-V14 WeakPolarHBondContact O-CG2 3.37Å; W11-V14 PolarHBondContact O-N 2.99Å
12	N	94.6	Very high	92.2	Very high	115 Å²	115	102.7 Å²	102.7	62%	0.615	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-12.7	178.1	-71.1	-43.4	0	0	0	114.1	N8 S10	N8-N12 PolarHBondContact O-N 3.32Å; N8-N12 VanDerWaalsContact O-N 3.08Å; N8-N12 PolarHBondContact O-ND2 3.38Å; N8-N12 PolarHBondContact OD1-ND2 3.15Å; S10-N12 PolarHBondContact O-N 3.13Å
13	K	94.4	Very high	92.3	Very high	147 Å²	147	102.7 Å²	102.7	64%	0.639	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-10.5	173.6	-70	170.3	-173	173.7	0	112.9	S9 S10 W11 Q15	S9-K13 WeakPolarHBondContact O-CD 3.2Å; S9-K13 VanDerWaalsContact O-CG 3.3Å; S9-K13 WeakPolarHBondContact O-CG 3.48Å; S10-K13 PolarHBondContact O-N 2.73Å; S10-K13 VanDerWaalsContact O-N 3.13Å; W11-K13 PolarHBondContact O-N 3.18Å; W11-K13 VanDerWaalsContact O-N 3.14Å; K13-Q15 PolarHBondContact O-N 2.85Å
14	V	93.3	Very high	92	Very high	58 Å²	58	106.1 Å²	106.1	35%	0.352	52%	0.524	S	S	.	.	S	Bend	trans	-66.7	120.6	177.7	-179.6	0	0	0	0	108.5	S10 W11 A18 I19	S10-V14 PolarHBondContact O-N 3.29Å; W11-V14 WeakPolarHBondContact O-CB 3.36Å; W11-V14 WeakPolarHBondContact O-CG2 3.37Å; W11-V14 PolarHBondContact O-N 2.99Å; V14-A18 HydrophobicContact CG1-CB 4.21Å; V14-I19 HydrophobicContact CG1-CD1 4.13Å; V14-I19 HydrophobicContact CG1-CG1 3.69Å
15	Q	91.7	Very high	91.8	Very high	131 Å²	131	112.4 Å²	112.4	61%	0.612	54%	0.537	S	S	*	.			trans	-69.7	138.5	177.1	-66.9	-64.5	-26.1	0	0	109.9	K13 E17 A18 I19	K13-Q15 PolarHBondContact O-N 2.85Å; Q15-E17 PolarHBondContact O-N 3.36Å; Q15-E17 VanDerWaalsContact O-N 3.08Å; Q15-A18 VanDerWaalsContact O-CB 3.31Å; Q15-A18 WeakPolarHBondContact O-CB 3.48Å; Q15-A18 PolarHBondContact O-N 3.15Å; Q15-I19 PolarHBondContact O-N 3.26Å
16	P	91.5	Very high	91.6	Very high	84 Å²	84	110.1 Å²	110.1	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-53.6	-33.3	176.2	-27.2	34.5	0	0	0	112.9	A18 I19 R20	P16-A18 VanDerWaalsContact C-N 3.3Å; P16-A18 PolarHBondContact O-N 2.74Å; P16-I19 WeakPolarHBondContact O-CB 3.28Å; P16-I19 PolarHBondContact O-N 3.07Å; P16-R20 WeakPolarHBondContact O-CG 3.34Å; P16-R20 PolarHBondContact O-N 3.01Å
17	E	90.8	Very high	91.1	Very high	77 Å²	77	104.1 Å²	104.1	36%	0.36	53%	0.53	S	S	.	.	H	α-helix	trans	-59.4	-37	174.5	-169.3	61	-160.6	0	0	113.4	Q15 R20 K21	Q15-E17 PolarHBondContact O-N 3.36Å; Q15-E17 VanDerWaalsContact O-N 3.08Å; E17-R20 IonicContact OE2-CZ 2.71Å; E17-R20 IonicContact OE2-NE 2.98Å; E17-R20 PolarHBondContact OE2-NE 2.93Å; E17-R20 VanDerWaalsContact OE2-NE 3.17Å; E17-R20 IonicContact OE2-NH2 2.76Å; E17-R20 PolarHBondContact OE2-NH2 3.19Å; E17-K21 HydrophobicContact CG-CD 4.48Å; E17-K21 WeakPolarHBondContact O-CB 3.42Å; E17-K21 WeakPolarHBondContact O-CG 3.3Å; E17-K21 PolarHBondContact O-N 3.42Å; E17-K21 WeakPolarHBondContact OE1-CE 3.47Å
18	A	90.8	Very high	90.6	Very high	43 Å²	43	105.9 Å²	105.9	36%	0.355	53%	0.533	S	S	.	.	H	α-helix	trans	-67.6	-42.8	176.7	0	0	0	0	0	110.7	V14 Q15 P16 K21 C22	V14-A18 HydrophobicContact CG1-CB 4.21Å; Q15-A18 VanDerWaalsContact O-CB 3.31Å; Q15-A18 WeakPolarHBondContact O-CB 3.48Å; Q15-A18 PolarHBondContact O-N 3.15Å; P16-A18 VanDerWaalsContact C-N 3.3Å; P16-A18 PolarHBondContact O-N 2.74Å; A18-K21 PolarHBondContact O-N 2.89Å; A18-C22 PolarHBondContact O-N 3.13Å; A18-C22 PolarHBondContact O-SG 3.3Å
19	I	90.5	Very high	89.8	Confident	64 Å²	64	104.8 Å²	104.8	33%	0.328	53%	0.529	S	S	.	.	H	α-helix	trans	-59.3	-51.2	175.9	-57.3	176.5	0	0	0	109.4	V14 Q15 P16 K21 C22 F23	V14-I19 HydrophobicContact CG1-CD1 4.13Å; V14-I19 HydrophobicContact CG1-CG1 3.69Å; Q15-I19 PolarHBondContact O-N 3.26Å; P16-I19 WeakPolarHBondContact O-CB 3.28Å; P16-I19 PolarHBondContact O-N 3.07Å; I19-K21 VanDerWaalsContact C-N 3.33Å; I19-K21 PolarHBondContact O-N 3.07Å; I19-C22 WeakPolarHBondContact O-CB 3.32Å; I19-C22 PolarHBondContact O-N 2.72Å; I19-C22 VanDerWaalsContact O-N 3.1Å; I19-F23 HydrophobicContact CG2-CD2 3.75Å; I19-F23 HydrophobicContact CG2-CE2 3.67Å; I19-F23 WeakPolarHBondContact O-CD2 3.43Å; I19-F23 PolarHBondContact O-N 2.96Å
20	R	88	Confident	88.7	Confident	149 Å²	149	112.7 Å²	112.7	56%	0.562	55%	0.551	S	S	*	*	H	α-helix	trans	-54.9	-45.5	177	-71	-167	-69.6	-163.4	-5.8	112.7	P16 E17 C22 F23 R24	P16-R20 WeakPolarHBondContact O-CG 3.34Å; P16-R20 PolarHBondContact O-N 3.01Å; E17-R20 IonicContact OE2-CZ 2.71Å; E17-R20 IonicContact OE2-NE 2.98Å; E17-R20 PolarHBondContact OE2-NE 2.93Å; E17-R20 VanDerWaalsContact OE2-NE 3.17Å; E17-R20 IonicContact OE2-NH2 2.76Å; E17-R20 PolarHBondContact OE2-NH2 3.19Å; R20-C22 PolarHBondContact O-N 3.5Å; R20-F23 PolarHBondContact O-N 2.93Å; R20-R24 WeakPolarHBondContact O-CB 3Å; R20-R24 PolarHBondContact O-N 3.47Å
21	K	90	Very high	87.5	Confident	127 Å²	127	116.3 Å²	116.3	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-63.7	-38.9	177.6	-76.5	175.7	-177.6	176.2	0	112.7	E17 A18 I19 R25	E17-K21 HydrophobicContact CG-CD 4.48Å; E17-K21 WeakPolarHBondContact O-CB 3.42Å; E17-K21 WeakPolarHBondContact O-CG 3.3Å; E17-K21 PolarHBondContact O-N 3.42Å; E17-K21 WeakPolarHBondContact OE1-CE 3.47Å; A18-K21 PolarHBondContact O-N 2.89Å; I19-K21 VanDerWaalsContact C-N 3.33Å; I19-K21 PolarHBondContact O-N 3.07Å; K21-R25 WeakPolarHBondContact O-CB 3.33Å; K21-R25 PolarHBondContact O-N 3.2Å
22	C	88.3	Confident	85.9	Confident	86 Å²	86	115.8 Å²	115.8	58%	0.581	57%	0.57	S	S	*	*	H	α-helix	trans	-62.8	-49.6	176.2	-71.1	0	0	0	0	111.6	A18 I19 R20 R24 R25 A26	A18-C22 PolarHBondContact O-N 3.13Å; A18-C22 PolarHBondContact O-SG 3.3Å; I19-C22 WeakPolarHBondContact O-CB 3.32Å; I19-C22 PolarHBondContact O-N 2.72Å; I19-C22 VanDerWaalsContact O-N 3.1Å; R20-C22 PolarHBondContact O-N 3.5Å; C22-R24 PolarHBondContact O-N 2.95Å; C22-R25 PolarHBondContact O-N 2.96Å; C22-A26 WeakPolarHBondContact O-CB 3.3Å; C22-A26 PolarHBondContact O-N 3.23Å
23	F	88.4	Confident	83.9	Confident	104 Å²	104	118.2 Å²	118.2	46%	0.456	58%	0.578	S	S	.	*	H	α-helix	trans	-64	-40	178.5	-81.7	-83.9	0	0	0	112.4	I19 R20 A26 G27 F28 V29	I19-F23 HydrophobicContact CG2-CD2 3.75Å; I19-F23 HydrophobicContact CG2-CE2 3.67Å; I19-F23 WeakPolarHBondContact O-CD2 3.43Å; I19-F23 PolarHBondContact O-N 2.96Å; R20-F23 PolarHBondContact O-N 2.93Å; F23-A26 PolarHBondContact O-N 3.36Å; F23-G27 PolarHBondContact O-N 3.29Å; F23-F28 HydrophobicContact CB-CB 4.36Å; F23-F28 HydrophobicContact CD1-CB 4.03Å; F23-F28 AromaticContact CD1-CD2 3.69Å; F23-F28 HydrophobicContact CD1-CD2 3.69Å; F23-F28 HydrophobicContact CD1-CE2 4.43Å; F23-F28 HydrophobicContact CD1-CG 4.03Å; F23-F28 HydrophobicContact CE1-CD2 4.35Å; F23-F28 PolarHBondContact O-N 3.08Å; F23-V29 HydrophobicContact CB-CG2 4.3Å
24	R	88.2	Confident	81.9	Confident	134 Å²	134	117.8 Å²	117.8	51%	0.506	58%	0.582	S	S	.	*	H	α-helix	trans	-60.7	-46.7	173.5	-171	-177	-60.7	173.1	-1.4	111.8	R20 C22 A26 G27 V29	R20-R24 WeakPolarHBondContact O-CB 3Å; R20-R24 PolarHBondContact O-N 3.47Å; C22-R24 PolarHBondContact O-N 2.95Å; R24-A26 VanDerWaalsContact C-N 3.26Å; R24-A26 PolarHBondContact O-N 3.08Å; R24-G27 PolarHBondContact O-N 3.18Å; R24-V29 HydrophobicContact CB-CB 4.27Å; R24-V29 HydrophobicContact CG-CB 4.43Å
25	R	87.1	Confident	79.9	Confident	234 Å²	234	122.9 Å²	122.9	88%	0.883	60%	0.602	S	S	*	*	H	α-helix	trans	-65.2	-29.5	178.8	-176.1	165.4	176.3	131	-2	112.9	K21 C22 G27	K21-R25 WeakPolarHBondContact O-CB 3.33Å; K21-R25 PolarHBondContact O-N 3.2Å; C22-R25 PolarHBondContact O-N 2.96Å; R25-G27 PolarHBondContact O-N 2.92Å
26	A	88.8	Confident	78.1	Confident	66 Å²	66	120.5 Å²	120.5	55%	0.545	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-2.8	173.8	0	0	0	0	0	113.6	C22 F23 R24 F28	C22-A26 WeakPolarHBondContact O-CB 3.3Å; C22-A26 PolarHBondContact O-N 3.23Å; F23-A26 PolarHBondContact O-N 3.36Å; R24-A26 VanDerWaalsContact C-N 3.26Å; R24-A26 PolarHBondContact O-N 3.08Å; A26-F28 HydrophobicContact CB-CD2 3.59Å; A26-F28 HydrophobicContact CB-CE2 3.66Å
27	G	84	Confident	76.2	Confident	58 Å²	58	124.4 Å²	124.4	60%	0.598	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.7	9.8	176.5	0	0	0	0	0	115	F23 R24 R25 V29	F23-G27 PolarHBondContact O-N 3.29Å; R24-G27 PolarHBondContact O-N 3.18Å; R25-G27 PolarHBondContact O-N 2.92Å; G27-V29 VanDerWaalsContact C-N 3.32Å
28	F	85	Confident	74.4	Confident	156 Å²	156	127.5 Å²	127.5	68%	0.684	63%	0.625	S	S	*	*			trans	-79.3	-13.3	178.3	-66.7	-73.4	0	0	0	113.8	F23 A26	F23-F28 HydrophobicContact CB-CB 4.36Å; F23-F28 HydrophobicContact CD1-CB 4.03Å; F23-F28 AromaticContact CD1-CD2 3.69Å; F23-F28 HydrophobicContact CD1-CD2 3.69Å; F23-F28 HydrophobicContact CD1-CE2 4.43Å; F23-F28 HydrophobicContact CD1-CG 4.03Å; F23-F28 HydrophobicContact CE1-CD2 4.35Å; F23-F28 PolarHBondContact O-N 3.08Å; A26-F28 HydrophobicContact CB-CD2 3.59Å; A26-F28 HydrophobicContact CB-CE2 3.66Å
29	V	77.6	Confident	72.6	Confident	69 Å²	69	134.2 Å²	134.2	42%	0.418	64%	0.642	S	S	.	*	S	Bend	trans	-119.8	118.2	178.5	-175.9	0	0	0	0	107.8	F23 R24 G27	F23-V29 HydrophobicContact CB-CG2 4.3Å; R24-V29 HydrophobicContact CB-CB 4.27Å; R24-V29 HydrophobicContact CG-CB 4.43Å; G27-V29 VanDerWaalsContact C-N 3.32Å
30	R	70.6	Confident	71.1	Confident	220 Å²	220	137.2 Å²	137.2	83%	0.83	67%	0.665	S	S	*	*			trans	-77	148.2	171.3	-71.5	-179.8	151.1	-169.7	-6.7	109.2	E32	R30-E32 PolarHBondContact O-N 3.11Å; R30-E32 VanDerWaalsContact O-O 3.1Å
31	D	69.5	Low	69.7	Low	146 Å²	146	137.3 Å²	137.3	78%	0.781	68%	0.677	S	S	*	*	S	Bend	trans	-67.9	-10.3	-177.8	-72.3	-39	0	0	0	113.4	E33	D31-E33 PolarHBondContact O-N 3.3Å
32	E	59.9	Low	67.7	Low	164 Å²	164	134.5 Å²	134.5	77%	0.766	67%	0.673	S	S	*	*	S	Bend	trans	-67.7	125.5	167.8	-61.1	-157	161.4	0	0	108	R30 D34	R30-E32 PolarHBondContact O-N 3.11Å; R30-E32 VanDerWaalsContact O-O 3.1Å; E32-D34 PolarHBondContact O-N 3.12Å
33	E	53.6	Low	66.1	Low	166 Å²	166	135.8 Å²	135.8	78%	0.776	68%	0.68	S	S	*	*			trans	-63.2	68.5	177.2	-75.1	150.2	152.8	0	0	110	D31 H35	D31-E33 PolarHBondContact O-N 3.3Å; E33-H35 PolarHBondContact O-N 3.25Å
34	D	51.4	Low	64.5	Low	138 Å²	138	136.6 Å²	136.6	74%	0.738	69%	0.694	S	S	*	*			trans	-77.1	75.9	173.1	-134.6	6	0	0	0	105.7	E32 V36	E32-D34 PolarHBondContact O-N 3.12Å; D34-V36 HydrophobicContact CB-CG2 4.28Å; D34-V36 PolarHBondContact O-N 2.92Å; D34-V36 VanDerWaalsContact OD1-CG2 3.3Å; D34-V36 WeakPolarHBondContact OD1-CG2 3.42Å
35	H	51.6	Low	62.9	Low	165 Å²	165	135.6 Å²	135.6	76%	0.764	71%	0.705	S	S	*	*			trans	-67.1	47.7	162.3	-71.8	-74.5	0	0	0	109.6	E33 E37	E33-H35 PolarHBondContact O-N 3.25Å; H35-E37 PolarHBondContact O-N 3.2Å
36	V	54.6	Low	61.5	Low	81 Å²	81	132.9 Å²	132.9	49%	0.491	70%	0.702	S	S	.	*			trans	-71.4	93.9	163.3	-171.1	0	0	0	0	104.4	D34 L38	D34-V36 HydrophobicContact CB-CG2 4.28Å; D34-V36 PolarHBondContact O-N 2.92Å; D34-V36 VanDerWaalsContact OD1-CG2 3.3Å; D34-V36 WeakPolarHBondContact OD1-CG2 3.42Å; V36-L38 HydrophobicContact CG1-CD2 3.78Å; V36-L38 HydrophobicContact CG1-CG 4.21Å; V36-L38 PolarHBondContact O-N 3.24Å
37	E	52.4	Low	60.2	Low	166 Å²	166	135.1 Å²	135.1	78%	0.776	71%	0.709	S	S	*	*			trans	-60.3	86.2	163.6	-163.8	176	-160.6	0	0	105.9	H35 R39	H35-E37 PolarHBondContact O-N 3.2Å; E37-R39 PolarHBondContact O-N 3.46Å
38	L	51.8	Low	58.9	Low	141 Å²	141	140.9 Å²	140.9	74%	0.738	72%	0.72	S	S	*	*			trans	-63.1	91.8	176.7	-70.9	171.6	0	0	0	106.5	V36	V36-L38 HydrophobicContact CG1-CD2 3.78Å; V36-L38 HydrophobicContact CG1-CG 4.21Å; V36-L38 PolarHBondContact O-N 3.24Å
39	R	53.6	Low	57.9	Low	185 Å²	185	138.6 Å²	138.6	70%	0.698	71%	0.714	S	S	*	*			trans	-67	127.7	165.4	-80.5	-164.4	168.3	-173.1	-1.8	106.5	E37 D41 S42	E37-R39 PolarHBondContact O-N 3.46Å; R39-D41 PolarHBondContact O-N 3.06Å; R39-S42 PolarHBondContact O-N 3.13Å; R39-S42 PolarHBondContact O-OG 3.08Å
40	P	58.8	Low	57.4	Low	127 Å²	127	144.6 Å²	144.6	83%	0.825	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-19.4	-175	17.6	-29	0	0	0	113.8
41	D	58.6	Low	57.4	Low	150 Å²	150	137.9 Å²	137.9	80%	0.802	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	13.1	-178.2	-59.6	-33	0	0	0	114.3	R39 P43	R39-D41 PolarHBondContact O-N 3.06Å; D41-P43 VanDerWaalsContact O-CD 3.26Å; D41-P43 WeakPolarHBondContact O-CD 3.49Å
42	S	48	Very low	57.5	Low	68 Å²	68	134.4 Å²	134.4	48%	0.476	72%	0.72	S	S	.	*			trans	-80	114.9	169.8	59.9	0	0	0	0	108.6	R39 T44	R39-S42 PolarHBondContact O-N 3.13Å; R39-S42 PolarHBondContact O-OG 3.08Å; S42-T44 PolarHBondContact O-N 3.33Å; S42-T44 VanDerWaalsContact O-N 3.12Å
43	P	54.6	Low	58.5	Low	113 Å²	113	130.5 Å²	130.5	73%	0.734	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-56.1	123.7	170.6	-16.5	30	0	0	0	107.1	D41	D41-P43 VanDerWaalsContact O-CD 3.26Å; D41-P43 WeakPolarHBondContact O-CD 3.49Å
44	T	55.9	Low	59.7	Low	121 Å²	121	129.8 Å²	129.8	74%	0.742	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-47	132.1	165.5	27.3	0	0	0	0	107.7	S42 E46	S42-T44 PolarHBondContact O-N 3.33Å; S42-T44 VanDerWaalsContact O-N 3.12Å; T44-E46 PolarHBondContact O-N 2.92Å
45	P	54.4	Low	61.3	Low	114 Å²	114	128.4 Å²	128.4	74%	0.74	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-53.9	117	-178.2	-19.6	29	0	0	0	107.8	V47	P45-V47 PolarHBondContact O-N 3.46Å
46	E	57.6	Low	62.9	Low	177 Å²	177	124.8 Å²	124.8	83%	0.827	68%	0.675	S	S	*	*			trans	-61.3	91.3	167	-70.4	173.6	174.7	0	0	104.9	T44 E48	T44-E46 PolarHBondContact O-N 2.92Å; E46-E48 PolarHBondContact O-N 3.36Å
47	V	60.7	Low	64.2	Low	112 Å²	112	127 Å²	127	68%	0.679	68%	0.678	S	S	*	*			trans	-63	101.6	163.8	178.2	0	0	0	0	102.9	P45 I49	P45-V47 PolarHBondContact O-N 3.46Å; V47-I49 HydrophobicContact CB-CG1 4.42Å; V47-I49 HydrophobicContact CG1-CG1 3.96Å; V47-I49 WeakPolarHBondContact O-CG1 3.46Å; V47-I49 PolarHBondContact O-N 3.5Å
48	E	57.5	Low	65.8	Low	179 Å²	179	122.7 Å²	122.7	84%	0.836	66%	0.663	S	S	*	*			trans	-59.6	91.7	164.9	-71	-178.1	167.8	0	0	105.5	E46 E50	E46-E48 PolarHBondContact O-N 3.36Å; E48-E50 PolarHBondContact O-N 2.82Å
49	I	62.9	Low	67.4	Low	109 Å²	109	118.1 Å²	118.1	56%	0.559	64%	0.643	S	S	*	*			trans	-72.4	93.6	174.5	-52.5	174.5	0	0	0	104.9	V47 G51 V52	V47-I49 HydrophobicContact CB-CG1 4.42Å; V47-I49 HydrophobicContact CG1-CG1 3.96Å; V47-I49 WeakPolarHBondContact O-CG1 3.46Å; V47-I49 PolarHBondContact O-N 3.5Å; I49-G51 PolarHBondContact O-N 3.45Å; I49-V52 HydrophobicContact CB-CB 4.21Å; I49-V52 HydrophobicContact CB-CG2 3.95Å; I49-V52 HydrophobicContact CG2-CB 4.21Å; I49-V52 HydrophobicContact CG2-CG2 3.42Å; I49-V52 VanDerWaalsContact CG2-CG2 3.42Å; I49-V52 PolarHBondContact O-N 2.92Å; I49-V52 VanDerWaalsContact O-N 3.08Å
50	E	67.4	Low	68.9	Low	195 Å²	195	115.2 Å²	115.2	91%	0.911	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	121.7	179.8	-155.7	174.8	-162.5	0	0	109.2	E48	E48-E50 PolarHBondContact O-N 2.82Å
51	G	70.8	Confident	70.2	Confident	79 Å²	79	114.5 Å²	114.5	81%	0.814	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.8	4.8	179.7	0	0	0	0	0	116.2	I49	I49-G51 PolarHBondContact O-N 3.45Å
52	V	71.8	Confident	71.6	Confident	72 Å²	72	113.6 Å²	113.6	44%	0.436	62%	0.623	S	S	.	*			trans	-103.5	112.8	174	-178.5	0	0	0	0	110.2	I49 F57	I49-V52 HydrophobicContact CB-CB 4.21Å; I49-V52 HydrophobicContact CB-CG2 3.95Å; I49-V52 HydrophobicContact CG2-CB 4.21Å; I49-V52 HydrophobicContact CG2-CG2 3.42Å; I49-V52 VanDerWaalsContact CG2-CG2 3.42Å; I49-V52 PolarHBondContact O-N 2.92Å; I49-V52 VanDerWaalsContact O-N 3.08Å; V52-F57 HydrophobicContact CG1-CD2 3.9Å; V52-F57 HydrophobicContact CG1-CE2 3.05Å; V52-F57 HydrophobicContact CG1-CZ 3.61Å
53	N	80	Confident	73.1	Confident	82 Å²	82	119.2 Å²	119.2	44%	0.439	64%	0.642	S	S	.	*			trans	-87.1	134.6	177.3	174.7	23.2	0	0	0	110	E55 D56	N53-E55 WeakPolarHBondContact ND2-CB 3.43Å; N53-E55 PolarHBondContact O-N 3.11Å; N53-E55 PolarHBondContact OD1-N 3.33Å; N53-D56 HydrophobicContact CB-CB 4.5Å; N53-D56 PolarHBondContact ND2-OD1 2.91Å; N53-D56 WeakPolarHBondContact O-CB 3.31Å; N53-D56 PolarHBondContact O-N 3.22Å
54	F	80.2	Confident	74.4	Confident	151 Å²	151	118.9 Å²	118.9	66%	0.662	63%	0.633	S	S	*	*	H	α-helix	trans	-59	-38.5	176.9	174.6	-99.4	0	0	0	112	D56 F57 V58	F54-D56 PolarHBondContact O-N 2.98Å; F54-F57 PolarHBondContact O-N 3.36Å; F54-F57 VanDerWaalsContact O-N 3.12Å; F54-V58 HydrophobicContact CD1-CG2 3.95Å; F54-V58 HydrophobicContact CE1-CG2 3.43Å; F54-V58 VanDerWaalsContact CE1-CG2 3.43Å; F54-V58 HydrophobicContact CE2-CG2 4.29Å; F54-V58 HydrophobicContact CZ-CG2 3.62Å; F54-V58 PolarHBondContact O-N 3.45Å
55	E	85.3	Confident	75.4	Confident	110 Å²	110	118.1 Å²	118.1	51%	0.514	64%	0.64	S	S	.	*	H	α-helix	trans	-61.2	-35.2	-179.2	-160.2	64.1	-156.3	0	0	111.6	N53 F57 V58 S59	N53-E55 WeakPolarHBondContact ND2-CB 3.43Å; N53-E55 PolarHBondContact O-N 3.11Å; N53-E55 PolarHBondContact OD1-N 3.33Å; E55-F57 VanDerWaalsContact C-N 3.26Å; E55-F57 PolarHBondContact O-N 2.85Å; E55-V58 PolarHBondContact O-N 3.04Å; E55-V58 VanDerWaalsContact O-N 3.08Å; E55-S59 PolarHBondContact O-N 3.24Å; E55-S59 PolarHBondContact O-OG 3.37Å; E55-S59 VanDerWaalsContact O-OG 3.11Å
56	D	84.3	Confident	76.4	Confident	89 Å²	89	118.5 Å²	118.5	48%	0.476	64%	0.64	S	S	.	*	H	α-helix	trans	-62.7	-34.6	179.5	-58.4	1.3	0	0	0	111.3	N53 F54 M60	N53-D56 HydrophobicContact CB-CB 4.5Å; N53-D56 PolarHBondContact ND2-OD1 2.91Å; N53-D56 WeakPolarHBondContact O-CB 3.31Å; N53-D56 PolarHBondContact O-N 3.22Å; F54-D56 PolarHBondContact O-N 2.98Å; D56-M60 VanDerWaalsContact O-CG 3.31Å; D56-M60 WeakPolarHBondContact O-CG 3.4Å; D56-M60 PolarHBondContact O-N 2.88Å
57	F	82.3	Confident	77.1	Confident	126 Å²	126	114.4 Å²	114.4	55%	0.553	63%	0.631	S	S	*	*	H	α-helix	trans	-74	-33.8	174.7	-75.2	-71.3	0	0	0	113	V52 F54 E55 M60	V52-F57 HydrophobicContact CG1-CD2 3.9Å; V52-F57 HydrophobicContact CG1-CE2 3.05Å; V52-F57 HydrophobicContact CG1-CZ 3.61Å; F54-F57 PolarHBondContact O-N 3.36Å; F54-F57 VanDerWaalsContact O-N 3.12Å; E55-F57 VanDerWaalsContact C-N 3.26Å; E55-F57 PolarHBondContact O-N 2.85Å; F57-M60 HydrophobicContact CD1-SD 3.84Å; F57-M60 HydrophobicContact CE1-SD 4.45Å
58	V	85	Confident	77.6	Confident	77 Å²	77	115.4 Å²	115.4	47%	0.467	64%	0.638	S	S	.	*	H	α-helix	trans	-69.4	-41.7	178	176.9	0	0	0	0	109.9	F54 E55 M60	F54-V58 HydrophobicContact CD1-CG2 3.95Å; F54-V58 HydrophobicContact CE1-CG2 3.43Å; F54-V58 VanDerWaalsContact CE1-CG2 3.43Å; F54-V58 HydrophobicContact CE2-CG2 4.29Å; F54-V58 HydrophobicContact CZ-CG2 3.62Å; F54-V58 PolarHBondContact O-N 3.45Å; E55-V58 PolarHBondContact O-N 3.04Å; E55-V58 VanDerWaalsContact O-N 3.08Å; V58-M60 VanDerWaalsContact C-N 3.33Å
59	S	86.5	Confident	78	Confident	45 Å²	45	114.8 Å²	114.8	32%	0.315	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-86.2	1.1	-178.2	67.3	0	0	0	0	114.4	E55 D61 D62	E55-S59 PolarHBondContact O-N 3.24Å; E55-S59 PolarHBondContact O-OG 3.37Å; E55-S59 VanDerWaalsContact O-OG 3.11Å; S59-D61 PolarHBondContact O-N 2.78Å; S59-D62 WeakPolarHBondContact CA-OD2 3.31Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CB 3.45Å; S59-D62 PolarHBondContact O-N 3.04Å; S59-D62 VanDerWaalsContact O-N 3.13Å
60	M	85.2	Confident	78.3	Confident	124 Å²	124	113.1 Å²	113.1	61%	0.611	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-57.5	-32.7	-178.3	-106.1	175.8	60.6	0	0	112.7	D56 F57 V58	D56-M60 VanDerWaalsContact O-CG 3.31Å; D56-M60 WeakPolarHBondContact O-CG 3.4Å; D56-M60 PolarHBondContact O-N 2.88Å; F57-M60 HydrophobicContact CD1-SD 3.84Å; F57-M60 HydrophobicContact CE1-SD 4.45Å; V58-M60 VanDerWaalsContact C-N 3.33Å
61	D	86.5	Confident	78.7	Confident	111 Å²	111	108.8 Å²	108.8	59%	0.594	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-91.9	-8.6	-177.5	-71.5	-13.8	0	0	0	113.2	S59 E63 L64	S59-D61 PolarHBondContact O-N 2.78Å; D61-E63 VanDerWaalsContact C-N 3.3Å; D61-E63 PolarHBondContact O-N 3.3Å; D61-L64 HydrophobicContact CB-CD1 3.81Å; D61-L64 HydrophobicContact CB-CG 4.43Å; D61-L64 WeakPolarHBondContact O-CB 3.26Å; D61-L64 PolarHBondContact O-N 2.98Å; D61-L64 VanDerWaalsContact O-N 3.15Å; D61-L64 WeakPolarHBondContact OD1-CD1 3.41Å
62	D	86.6	Confident	79.2	Confident	132 Å²	132	110.6 Å²	110.6	71%	0.706	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-29.6	-177.3	-71.6	-22.3	0	0	0	112.6	S59	S59-D62 WeakPolarHBondContact CA-OD2 3.31Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CB 3.45Å; S59-D62 PolarHBondContact O-N 3.04Å; S59-D62 VanDerWaalsContact O-N 3.13Å
63	E	80.2	Confident	79.6	Confident	186 Å²	186	113.1 Å²	113.1	87%	0.869	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	5.4	175.9	-69	-170.3	-175.7	0	0	113.2	D61 A65	D61-E63 VanDerWaalsContact C-N 3.3Å; D61-E63 PolarHBondContact O-N 3.3Å; E63-A65 PolarHBondContact O-N 3.2Å
64	L	82.5	Confident	79.7	Confident	105 Å²	105	111.3 Å²	111.3	55%	0.55	61%	0.608	S	S	.	*			trans	-62.2	117.7	173.3	-75.9	174.1	0	0	0	108.8	D61 T66	D61-L64 HydrophobicContact CB-CD1 3.81Å; D61-L64 HydrophobicContact CB-CG 4.43Å; D61-L64 WeakPolarHBondContact O-CB 3.26Å; D61-L64 PolarHBondContact O-N 2.98Å; D61-L64 VanDerWaalsContact O-N 3.15Å; D61-L64 WeakPolarHBondContact OD1-CD1 3.41Å; L64-T66 PolarHBondContact O-N 3.17Å
65	A	76.7	Confident	80	Confident	106 Å²	106	107 Å²	107	88%	0.876	59%	0.591	S	S	*	*			trans	-63.2	88.5	170.2	0	0	0	0	0	108.5	E63 S67	E63-A65 PolarHBondContact O-N 3.2Å; A65-S67 PolarHBondContact O-N 2.93Å
66	T	74.5	Confident	79.9	Confident	121 Å²	121	108.1 Å²	108.1	74%	0.742	60%	0.595	S	S	*	*			trans	-69.8	119	165	54.4	0	0	0	0	105.8	L64 T68	L64-T66 PolarHBondContact O-N 3.17Å; T66-T68 PolarHBondContact O-N 2.89Å; T66-T68 VanDerWaalsContact O-N 3.1Å
67	S	72.1	Confident	79.9	Confident	92 Å²	92	109.6 Å²	109.6	64%	0.643	60%	0.599	S	S	*	*			trans	-50.7	122	158.5	161.9	0	0	0	0	105.4	A65 E69	A65-S67 PolarHBondContact O-N 2.93Å; S67-E69 PolarHBondContact O-N 3.41Å
68	T	70.8	Confident	80	Confident	133 Å²	133	107.1 Å²	107.1	82%	0.816	60%	0.597	S	S	*	*			trans	-53.1	102.6	161.3	-18.9	0	0	0	0	104.2	T66 P70	T66-T68 PolarHBondContact O-N 2.89Å; T66-T68 VanDerWaalsContact O-N 3.1Å; T68-P70 WeakPolarHBondContact O-CD 3.39Å
69	E	67.3	Low	80.1	Confident	165 Å²	165	108 Å²	108	77%	0.771	60%	0.598	S	S	*	*			trans	-51.2	121.2	174.4	-76.4	-179	166.1	0	0	104.5	S67 D71	S67-E69 PolarHBondContact O-N 3.41Å; E69-D71 PolarHBondContact O-N 3.42Å
70	P	67.5	Low	80.1	Confident	74 Å²	74	108.6 Å²	108.6	48%	0.481	60%	0.597	S	S	.	*			trans	-55.6	127.9	172.1	8	-6	0	0	0	105.1	T68 L72 I75	T68-P70 WeakPolarHBondContact O-CD 3.39Å; P70-L72 PolarHBondContact O-N 3.46Å; P70-L72 VanDerWaalsContact O-N 3.07Å; P70-I75 HydrophobicContact CB-CD1 4.13Å; P70-I75 HydrophobicContact CB-CG1 3.66Å; P70-I75 HydrophobicContact CG-CD1 3.75Å; P70-I75 HydrophobicContact CG-CG1 3.72Å; P70-I75 WeakPolarHBondContact O-CD1 3.49Å
71	D	77.1	Confident	80.1	Confident	105 Å²	105	106.4 Å²	106.4	56%	0.561	60%	0.599	S	S	*	*			trans	-39.4	124	174.7	169.5	20.4	0	0	0	107.5	E69 Q73 A74 I75	E69-D71 PolarHBondContact O-N 3.42Å; D71-Q73 CarbonylContact O-C 2.88Å; D71-Q73 PolarHBondContact O-N 3.04Å; D71-Q73 PolarHBondContact OD1-N 2.97Å; D71-A74 HydrophobicContact CB-CB 4.17Å; D71-A74 VanDerWaalsContact O-CA 3.32Å; D71-A74 WeakPolarHBondContact O-CA 3.48Å; D71-A74 VanDerWaalsContact O-CB 3.28Å; D71-A74 WeakPolarHBondContact O-CB 3.29Å; D71-A74 PolarHBondContact O-N 3.31Å; D71-I75 PolarHBondContact O-N 3.34Å
72	L	81.1	Confident	80.1	Confident	116 Å²	116	109.2 Å²	109.2	61%	0.607	61%	0.609	S	S	*	*	H	α-helix	trans	-49.7	-36	-174.6	-73.6	170.3	0	0	0	110.1	P70 A74 I75 F76	P70-L72 PolarHBondContact O-N 3.46Å; P70-L72 VanDerWaalsContact O-N 3.07Å; L72-A74 PolarHBondContact O-N 3.31Å; L72-I75 HydrophobicContact CD2-CD1 4.33Å; L72-I75 WeakPolarHBondContact O-CB 3.43Å; L72-I75 PolarHBondContact O-N 3.45Å; L72-F76 HydrophobicContact CB-CE2 4.34Å; L72-F76 WeakPolarHBondContact O-CD2 3.47Å; L72-F76 PolarHBondContact O-N 3.36Å
73	Q	80.8	Confident	80	Confident	125 Å²	125	105.9 Å²	105.9	58%	0.584	60%	0.599	S	S	*	*	H	α-helix	trans	-63.8	-38.8	175.8	-169.8	165	-0.9	0	0	113.2	D71 F76 Q77	D71-Q73 CarbonylContact O-C 2.88Å; D71-Q73 PolarHBondContact O-N 3.04Å; D71-Q73 PolarHBondContact OD1-N 2.97Å; Q73-F76 PolarHBondContact O-N 2.99Å; Q73-Q77 WeakPolarHBondContact O-CB 3.41Å; Q73-Q77 VanDerWaalsContact O-CG 3.3Å; Q73-Q77 WeakPolarHBondContact O-CG 3.23Å; Q73-Q77 PolarHBondContact O-N 3.49Å
74	A	82.1	Confident	80	Confident	45 Å²	45	100.2 Å²	100.2	37%	0.372	59%	0.591	S	S	.	*	H	α-helix	trans	-66.7	-36	172.1	0	0	0	0	0	112.3	D71 L72 Q77 S78	D71-A74 HydrophobicContact CB-CB 4.17Å; D71-A74 VanDerWaalsContact O-CA 3.32Å; D71-A74 WeakPolarHBondContact O-CA 3.48Å; D71-A74 VanDerWaalsContact O-CB 3.28Å; D71-A74 WeakPolarHBondContact O-CB 3.29Å; D71-A74 PolarHBondContact O-N 3.31Å; L72-A74 PolarHBondContact O-N 3.31Å; A74-Q77 PolarHBondContact O-N 3.04Å; A74-S78 WeakPolarHBondContact O-CB 3.45Å; A74-S78 PolarHBondContact O-N 2.96Å
75	I	84.8	Confident	79.6	Confident	60 Å²	60	99.8 Å²	99.8	31%	0.308	59%	0.589	S	S	.	*	H	α-helix	trans	-62	-51.1	173.3	-58.7	179.8	0	0	0	109.9	P70 D71 L72 Q77 S78 I79	P70-I75 HydrophobicContact CB-CD1 4.13Å; P70-I75 HydrophobicContact CB-CG1 3.66Å; P70-I75 HydrophobicContact CG-CD1 3.75Å; P70-I75 HydrophobicContact CG-CG1 3.72Å; P70-I75 WeakPolarHBondContact O-CD1 3.49Å; D71-I75 PolarHBondContact O-N 3.34Å; L72-I75 HydrophobicContact CD2-CD1 4.33Å; L72-I75 WeakPolarHBondContact O-CB 3.43Å; L72-I75 PolarHBondContact O-N 3.45Å; I75-Q77 VanDerWaalsContact C-N 3.34Å; I75-Q77 PolarHBondContact O-N 2.96Å; I75-S78 WeakPolarHBondContact O-CB 3.4Å; I75-S78 PolarHBondContact O-N 2.63Å; I75-I79 HydrophobicContact CG2-CD1 3.79Å; I75-I79 HydrophobicContact CG2-CG1 4.48Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 2.71Å
76	F	84.2	Confident	79	Confident	134 Å²	134	97.3 Å²	97.3	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-59.9	-44.2	178.4	-74.3	-63.6	0	0	0	111.8	L72 Q73 S78 I79 L80	L72-F76 HydrophobicContact CB-CE2 4.34Å; L72-F76 WeakPolarHBondContact O-CD2 3.47Å; L72-F76 PolarHBondContact O-N 3.36Å; Q73-F76 PolarHBondContact O-N 2.99Å; F76-S78 VanDerWaalsContact C-N 3.33Å; F76-S78 PolarHBondContact O-N 2.61Å; F76-I79 PolarHBondContact O-N 2.68Å; F76-L80 WeakPolarHBondContact O-CB 3.5Å; F76-L80 VanDerWaalsContact O-CG 3.3Å; F76-L80 WeakPolarHBondContact O-CG 3.38Å; F76-L80 PolarHBondContact O-N 3.23Å
77	Q	84.3	Confident	78.4	Confident	120 Å²	120	96.3 Å²	96.3	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-63.1	-38.7	176.6	-75.7	-177.9	8	0	0	112.5	Q73 A74 I75 A81	Q73-Q77 WeakPolarHBondContact O-CB 3.41Å; Q73-Q77 VanDerWaalsContact O-CG 3.3Å; Q73-Q77 WeakPolarHBondContact O-CG 3.23Å; Q73-Q77 PolarHBondContact O-N 3.49Å; A74-Q77 PolarHBondContact O-N 3.04Å; I75-Q77 VanDerWaalsContact C-N 3.34Å; I75-Q77 PolarHBondContact O-N 2.96Å; Q77-A81 WeakPolarHBondContact O-CB 3.47Å; Q77-A81 PolarHBondContact O-N 2.91Å
78	S	84.3	Confident	77.8	Confident	73 Å²	73	100 Å²	100	51%	0.51	57%	0.567	S	S	.	*	H	α-helix	trans	-63	-44.5	175.6	-171	0	0	0	0	111.4	A74 I75 F76 A81 E82	A74-S78 WeakPolarHBondContact O-CB 3.45Å; A74-S78 PolarHBondContact O-N 2.96Å; I75-S78 WeakPolarHBondContact O-CB 3.4Å; I75-S78 PolarHBondContact O-N 2.63Å; F76-S78 VanDerWaalsContact C-N 3.33Å; F76-S78 PolarHBondContact O-N 2.61Å; S78-A81 PolarHBondContact O-N 2.8Å; S78-E82 WeakPolarHBondContact O-CB 3.37Å; S78-E82 PolarHBondContact O-N 2.95Å
79	I	86.4	Confident	77.2	Confident	95 Å²	95	99.7 Å²	99.7	49%	0.487	56%	0.561	S	S	.	*	H	α-helix	trans	-65.5	-45.2	178.9	-66.1	167.6	0	0	0	110.6	I75 F76 A81 E82 A83	I75-I79 HydrophobicContact CG2-CD1 3.79Å; I75-I79 HydrophobicContact CG2-CG1 4.48Å; I75-I79 WeakPolarHBondContact O-CG1 3.44Å; I75-I79 PolarHBondContact O-N 2.71Å; F76-I79 PolarHBondContact O-N 2.68Å; I79-A81 PolarHBondContact O-N 2.82Å; I79-E82 PolarHBondContact O-N 2.9Å; I79-A83 VanDerWaalsContact O-CB 3.32Å; I79-A83 WeakPolarHBondContact O-CB 3.46Å; I79-A83 PolarHBondContact O-N 2.87Å
80	L	86.8	Confident	76.4	Confident	58 Å²	58	98.9 Å²	98.9	30%	0.304	56%	0.562	S	S	.	*	H	α-helix	trans	-63.4	-41.6	177.8	-72.1	173.6	0	0	0	111.7	F76 A83 G84 L85	F76-L80 WeakPolarHBondContact O-CB 3.5Å; F76-L80 VanDerWaalsContact O-CG 3.3Å; F76-L80 WeakPolarHBondContact O-CG 3.38Å; F76-L80 PolarHBondContact O-N 3.23Å; L80-A83 PolarHBondContact O-N 3.22Å; L80-G84 PolarHBondContact O-N 2.71Å; L80-L85 HydrophobicContact CD2-CB 3.95Å; L80-L85 PolarHBondContact O-N 2.86Å
81	A	85.1	Confident	75.6	Confident	79 Å²	79	101.3 Å²	101.3	65%	0.653	58%	0.575	S	S	*	*	H	α-helix	trans	-65	-39.4	176.4	0	0	0	0	0	112.4	Q77 S78 I79 G84	Q77-A81 WeakPolarHBondContact O-CB 3.47Å; Q77-A81 PolarHBondContact O-N 2.91Å; S78-A81 PolarHBondContact O-N 2.8Å; I79-A81 PolarHBondContact O-N 2.82Å; A81-G84 PolarHBondContact O-N 2.78Å
82	E	86.7	Confident	74.3	Confident	170 Å²	170	104.2 Å²	104.2	79%	0.794	59%	0.585	S	S	*	*	H	α-helix	trans	-67.9	-39.2	175.3	-174.1	174.7	176.1	0	0	112	S78 I79 G84	S78-E82 WeakPolarHBondContact O-CB 3.37Å; S78-E82 PolarHBondContact O-N 2.95Å; I79-E82 PolarHBondContact O-N 2.9Å; E82-G84 PolarHBondContact O-N 2.76Å
83	A	85	Confident	72.6	Confident	61 Å²	61	107.2 Å²	107.2	50%	0.504	60%	0.596	S	S	.	*	H	α-helix	trans	-74.8	-11.2	176.3	0	0	0	0	0	113.5	I79 L80 L85	I79-A83 VanDerWaalsContact O-CB 3.32Å; I79-A83 WeakPolarHBondContact O-CB 3.46Å; I79-A83 PolarHBondContact O-N 2.87Å; L80-A83 PolarHBondContact O-N 3.22Å; A83-L85 HydrophobicContact CB-CB 4.45Å; A83-L85 HydrophobicContact CB-CD1 3.84Å; A83-L85 HydrophobicContact CB-CG 3.83Å; A83-L85 PolarHBondContact O-N 2.99Å
84	G	79.4	Confident	71	Confident	67 Å²	67	108.9 Å²	108.9	69%	0.691	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.2	23.7	-175	0	0	0	0	0	113.5	L80 A81 E82	L80-G84 PolarHBondContact O-N 2.71Å; A81-G84 PolarHBondContact O-N 2.78Å; E82-G84 PolarHBondContact O-N 2.76Å
85	L	73.9	Confident	69.2	Low	97 Å²	97	111.3 Å²	111.3	51%	0.508	62%	0.618	S	S	.	*			trans	-96.6	131	-178.1	-61.9	176	0	0	0	109.9	L80 A83	L80-L85 HydrophobicContact CD2-CB 3.95Å; L80-L85 PolarHBondContact O-N 2.86Å; A83-L85 HydrophobicContact CB-CB 4.45Å; A83-L85 HydrophobicContact CB-CD1 3.84Å; A83-L85 HydrophobicContact CB-CG 3.83Å; A83-L85 PolarHBondContact O-N 2.99Å
86	S	65.3	Low	67.4	Low	54 Å²	54	116.8 Å²	116.8	38%	0.378	64%	0.642	S	S	.	*			trans	-76.9	142.5	171.9	-175.8	0	0	0	0	109.3	E88 D89	S86-E88 PolarHBondContact O-N 3.46Å; S86-D89 PolarHBondContact O-N 2.81Å; S86-D89 VanDerWaalsContact O-N 3.13Å
87	P	61.1	Low	65.8	Low	100 Å²	100	116.4 Å²	116.4	65%	0.649	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-8.4	175.4	25.5	-35.1	0	0	0	114
88	E	61	Low	63.8	Low	168 Å²	168	119.4 Å²	119.4	79%	0.785	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-12.7	179.8	-51.4	-168.9	-150.9	0	0	113.5	S86 D90	S86-E88 PolarHBondContact O-N 3.46Å; E88-D90 PolarHBondContact O-N 3.45Å
89	D	57.4	Low	61.9	Low	127 Å²	127	124.6 Å²	124.6	68%	0.679	67%	0.674	S	S	*	*			trans	-87.4	13	-179.3	-75.4	-37.3	0	0	0	113.2	S86 V91	S86-D89 PolarHBondContact O-N 2.81Å; S86-D89 VanDerWaalsContact O-N 3.13Å; D89-V91 PolarHBondContact O-N 2.94Å
90	D	49.8	Very low	60.2	Low	149 Å²	149	128 Å²	128	80%	0.797	69%	0.688	S	S	*	*			trans	-83.2	62.4	179	-157.8	19.1	0	0	0	111.8	E88	E88-D90 PolarHBondContact O-N 3.45Å
91	V	52.2	Low	58.1	Low	125 Å²	125	133.6 Å²	133.6	76%	0.758	72%	0.715	S	S	*	*			trans	-137.7	88	161.7	-171.6	0	0	0	0	107.6	D89	D89-V91 PolarHBondContact O-N 2.94Å
92	E	49.2	Very low	56.7	Low	165 Å²	165	135.2 Å²	135.2	77%	0.771	72%	0.716	S	S	*	*			trans	167	110.8	136	-81.5	-93.8	144.7	0	0	106.6	E94	E92-E94 PolarHBondContact O-N 2.76Å
93	E	45.6	Very low	55.3	Low	179 Å²	179	134.6 Å²	134.6	84%	0.836	71%	0.713	S	S	*	*			trans	-54.1	80	170.2	-81.6	-100.1	-173.1	0	0	111.6
94	E	45.7	Very low	54.6	Low	161 Å²	161	141.4 Å²	141.4	75%	0.752	73%	0.731	S	S	*	*			trans	-109.2	67.6	159.8	-71.9	-154	161.5	0	0	109.4	E92 E96	E92-E94 PolarHBondContact O-N 2.76Å; E94-E96 PolarHBondContact O-N 2.98Å
95	S	45.4	Very low	54.5	Low	96 Å²	96	143.9 Å²	143.9	67%	0.671	73%	0.728	S	S	*	*			trans	-70.9	64.2	157.9	58.1	0	0	0	0	109.9	N97	S95-N97 PolarHBondContact O-N 3.49Å
96	E	47.5	Very low	55.1	Low	174 Å²	174	145.9 Å²	145.9	81%	0.813	73%	0.733	S	S	*	*			trans	-69.9	69.4	151.6	-85.3	-159.6	149.7	0	0	107.6	E94 E98	E94-E96 PolarHBondContact O-N 2.98Å; E96-E98 PolarHBondContact O-N 3.45Å
97	N	48.8	Very low	56.1	Low	126 Å²	126	147.9 Å²	147.9	67%	0.674	74%	0.736	S	S	*	*			trans	-39.1	113	164	167	91.2	0	0	0	107.4	S95 K99	S95-N97 PolarHBondContact O-N 3.49Å; N97-K99 PolarHBondContact O-N 2.93Å
98	E	43	Very low	57.5	Low	184 Å²	184	149.2 Å²	149.2	86%	0.86	73%	0.734	S	S	*	*			trans	-31.4	84.1	176.6	-67	179.8	141.3	0	0	110.8	E96 E100	E96-E98 PolarHBondContact O-N 3.45Å; E98-E100 PolarHBondContact O-N 3.2Å
99	K	45.7	Very low	59	Low	181 Å²	181	143.4 Å²	143.4	79%	0.787	71%	0.708	S	S	*	*			trans	-76.4	84.8	158.9	-75	172.9	-171.5	156.2	0	101.1	N97 M101	N97-K99 PolarHBondContact O-N 2.93Å; K99-M101 VanDerWaalsContact C-N 3.3Å; K99-M101 PolarHBondContact O-N 2.89Å
100	E	48.8	Very low	60.6	Low	167 Å²	167	140 Å²	140	78%	0.78	69%	0.691	S	S	*	*			trans	-30.3	109	153.1	-178.8	-179.8	-171.3	0	0	104.7	E98 V102	E98-E100 PolarHBondContact O-N 3.2Å; E100-V102 HydrophobicContact CG-CG2 4.42Å; E100-V102 PolarHBondContact O-N 3.15Å
101	M	44.3	Very low	62.7	Low	176 Å²	176	134.2 Å²	134.2	87%	0.867	67%	0.667	S	S	*	*			trans	-68.3	77.3	-173.7	-78.8	-168.7	160.9	0	0	105.9	K99 Q103	K99-M101 VanDerWaalsContact C-N 3.3Å; K99-M101 PolarHBondContact O-N 2.89Å; M101-Q103 PolarHBondContact O-N 3.36Å
102	V	55.2	Low	64.7	Low	113 Å²	113	134.7 Å²	134.7	69%	0.685	66%	0.656	S	S	*	*			trans	-65.3	85	163.2	-177.9	0	0	0	0	102.4	E100 K104	E100-V102 HydrophobicContact CG-CG2 4.42Å; E100-V102 PolarHBondContact O-N 3.15Å; V102-K104 PolarHBondContact O-N 3.42Å
103	Q	58.1	Low	66.9	Low	156 Å²	156	131.2 Å²	131.2	73%	0.729	65%	0.645	S	S	*	*			trans	-46.6	119	170	-71.4	-175.3	11.2	0	0	104.7	M101 L105	M101-Q103 PolarHBondContact O-N 3.36Å; Q103-L105 PolarHBondContact O-N 3.31Å
104	K	68.7	Low	69.3	Low	204 Å²	204	123.6 Å²	123.6	89%	0.887	61%	0.61	S	S	*	*			trans	-64	87.9	177.3	-74.2	-177.2	179.4	175.2	0	106.7	V102 K106	V102-K104 PolarHBondContact O-N 3.42Å; K104-K106 PolarHBondContact O-N 3.05Å
105	L	77.1	Confident	71.6	Confident	119 Å²	119	118.3 Å²	118.3	62%	0.623	59%	0.594	S	S	*	*			trans	-57.4	129.2	174.3	-77.7	167.9	0	0	0	107.2	Q103 D109 V110	Q103-L105 PolarHBondContact O-N 3.31Å; L105-D109 HydrophobicContact CD2-CB 4.05Å; L105-V110 HydrophobicContact CB-CG2 4.14Å
106	K	87.1	Confident	74	Confident	139 Å²	139	120.3 Å²	120.3	60%	0.604	59%	0.592	S	S	*	*			trans	-70.5	151.8	174.7	-60.4	177.6	179.1	176.9	0	107.8	K104 E108 D109 V110	K104-K106 PolarHBondContact O-N 3.05Å; K106-E108 PolarHBondContact O-N 2.94Å; K106-E108 VanDerWaalsContact O-N 3.15Å; K106-D109 VanDerWaalsContact CB-OD2 3.3Å; K106-D109 WeakPolarHBondContact CB-OD2 3.45Å; K106-D109 PolarHBondContact N-OD2 3.1Å; K106-D109 WeakPolarHBondContact O-CA 3.48Å; K106-D109 WeakPolarHBondContact O-CB 3.3Å; K106-D109 PolarHBondContact O-N 3.03Å; K106-V110 PolarHBondContact O-N 3.5Å
107	E	86.8	Confident	76.3	Confident	97 Å²	97	115.5 Å²	115.5	45%	0.453	57%	0.572	S	S	.	*	H	α-helix	trans	-51.7	-38.2	174.4	-177.8	-170.5	136.7	0	0	111.8	D109 V110 G111 L139 V143	E107-D109 VanDerWaalsContact C-N 3.32Å; E107-D109 PolarHBondContact O-N 3.24Å; E107-V110 PolarHBondContact O-N 2.97Å; E107-G111 PolarHBondContact O-N 3.27Å; E107-L139 HydrophobicContact CG-CD1 4.32Å; E107-V143 HydrophobicContact CG-CG2 3.67Å; E107-V143 WeakPolarHBondContact OE1-CG1 3.43Å; E107-V143 WeakPolarHBondContact OE1-CG2 3.41Å; E107-V143 WeakPolarHBondContact OE2-CG2 3.32Å
108	E	89.1	Confident	78.5	Confident	127 Å²	127	113.7 Å²	113.7	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-61.4	-36.7	175.5	-61.9	172.9	-167	0	0	113	K106 G111 R112	K106-E108 PolarHBondContact O-N 2.94Å; K106-E108 VanDerWaalsContact O-N 3.15Å; E108-G111 PolarHBondContact O-N 3.4Å; E108-R112 WeakPolarHBondContact O-CG 3.24Å; E108-R112 PolarHBondContact O-N 2.92Å; E108-R112 IonicContact OE2-NH2 3.58Å
109	D	93.1	Very high	81	Confident	47 Å²	47	109.3 Å²	109.3	25%	0.251	55%	0.547	S	S	.	.	H	α-helix	trans	-69.7	-44	178.8	-58.5	-40.9	0	0	0	110.5	L105 K106 E107 G111 R112 V113	L105-D109 HydrophobicContact CD2-CB 4.05Å; K106-D109 VanDerWaalsContact CB-OD2 3.3Å; K106-D109 WeakPolarHBondContact CB-OD2 3.45Å; K106-D109 PolarHBondContact N-OD2 3.1Å; K106-D109 WeakPolarHBondContact O-CA 3.48Å; K106-D109 WeakPolarHBondContact O-CB 3.3Å; K106-D109 PolarHBondContact O-N 3.03Å; E107-D109 VanDerWaalsContact C-N 3.32Å; E107-D109 PolarHBondContact O-N 3.24Å; D109-G111 VanDerWaalsContact C-N 3.32Å; D109-G111 PolarHBondContact O-N 3.34Å; D109-R112 PolarHBondContact O-N 3.3Å; D109-R112 IonicContact OD1-CZ 3.21Å; D109-R112 IonicContact OD1-NE 3.64Å; D109-R112 IonicContact OD1-NH2 2.78Å; D109-R112 PolarHBondContact OD1-NH2 3.32Å; D109-V113 WeakPolarHBondContact O-CG2 3.5Å; D109-V113 PolarHBondContact O-N 2.99Å
110	V	91.8	Very high	83.4	Confident	54 Å²	54	106 Å²	106	33%	0.327	53%	0.532	S	S	.	.	H	α-helix	trans	-61.3	-43.5	175.3	-177.9	0	0	0	0	110.6	L105 K106 E107 R112 V113 L114 L139	L105-V110 HydrophobicContact CB-CG2 4.14Å; K106-V110 PolarHBondContact O-N 3.5Å; E107-V110 PolarHBondContact O-N 2.97Å; V110-R112 PolarHBondContact O-N 2.97Å; V110-V113 PolarHBondContact O-N 2.98Å; V110-L114 HydrophobicContact CG1-CD1 4.06Å; V110-L114 WeakPolarHBondContact O-CB 3.19Å; V110-L114 PolarHBondContact O-N 2.81Å; V110-L139 HydrophobicContact CG1-CD1 4.14Å; V110-L139 HydrophobicContact CG1-CD2 4.21Å
111	G	93.3	Very high	85.6	Confident	28 Å²	28	98 Å²	98	29%	0.289	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-41.5	175.1	0	0	0	0	0	113.3	E107 E108 D109 L114 A115	E107-G111 PolarHBondContact O-N 3.27Å; E108-G111 PolarHBondContact O-N 3.4Å; D109-G111 VanDerWaalsContact C-N 3.32Å; D109-G111 PolarHBondContact O-N 3.34Å; G111-L114 PolarHBondContact O-N 3.33Å; G111-A115 PolarHBondContact O-N 3.12Å
112	R	94.6	Very high	88	Confident	136 Å²	136	92.4 Å²	92.4	51%	0.513	48%	0.477	S	S	.	.	H	α-helix	trans	-62.5	-45.7	175.3	-80.5	-175	-83.2	-102.3	0.9	112.2	E108 D109 V110 A115 Q116	E108-R112 WeakPolarHBondContact O-CG 3.24Å; E108-R112 PolarHBondContact O-N 2.92Å; E108-R112 IonicContact OE2-NH2 3.58Å; D109-R112 PolarHBondContact O-N 3.3Å; D109-R112 IonicContact OD1-CZ 3.21Å; D109-R112 IonicContact OD1-NE 3.64Å; D109-R112 IonicContact OD1-NH2 2.78Å; D109-R112 PolarHBondContact OD1-NH2 3.32Å; V110-R112 PolarHBondContact O-N 2.97Å; R112-A115 PolarHBondContact O-N 3.16Å; R112-Q116 WeakPolarHBondContact O-CG 2.99Å; R112-Q116 PolarHBondContact O-N 3.35Å
113	V	95.4	Very high	89.9	Confident	91 Å²	91	93.7 Å²	93.7	55%	0.552	48%	0.476	S	S	*	.	H	α-helix	trans	-64.5	-41.5	178.8	173.3	0	0	0	0	111	D109 V110 A115 Q116 L117	D109-V113 WeakPolarHBondContact O-CG2 3.5Å; D109-V113 PolarHBondContact O-N 2.99Å; V110-V113 PolarHBondContact O-N 2.98Å; V113-A115 VanDerWaalsContact C-N 3.34Å; V113-A115 PolarHBondContact O-N 2.66Å; V113-Q116 PolarHBondContact O-N 3.01Å; V113-L117 WeakPolarHBondContact O-CB 3.47Å; V113-L117 PolarHBondContact O-N 3.29Å
114	L	95.4	Very high	91.7	Very high	20 Å²	20	92.5 Å²	92.5	11%	0.105	47%	0.468	C	S	.	.	H	α-helix	trans	-60.3	-41.9	174.9	-101.8	146.7	0	0	0	112.4	V110 G111 L117 K118 V132 A135 E136 L139	V110-L114 HydrophobicContact CG1-CD1 4.06Å; V110-L114 WeakPolarHBondContact O-CB 3.19Å; V110-L114 PolarHBondContact O-N 2.81Å; G111-L114 PolarHBondContact O-N 3.33Å; L114-L117 PolarHBondContact O-N 3.18Å; L114-K118 WeakPolarHBondContact O-CB 3.3Å; L114-K118 PolarHBondContact O-N 2.98Å; L114-V132 HydrophobicContact CD2-CG1 3.98Å; L114-A135 HydrophobicContact CD2-CB 3.68Å; L114-E136 HydrophobicContact CD2-CB 4.49Å; L114-E136 HydrophobicContact CD2-CG 3.68Å; L114-L139 HydrophobicContact CD1-CB 4.42Å; L114-L139 HydrophobicContact CD1-CD2 3.99Å
115	A	95.1	Very high	92.9	Very high	49 Å²	49	85.3 Å²	85.3	41%	0.405	44%	0.443	S	S	.	.	H	α-helix	trans	-63.4	-42.4	175.4	0	0	0	0	0	112.1	G111 R112 V113 K118 C119	G111-A115 PolarHBondContact O-N 3.12Å; R112-A115 PolarHBondContact O-N 3.16Å; V113-A115 VanDerWaalsContact C-N 3.34Å; V113-A115 PolarHBondContact O-N 2.66Å; A115-K118 WeakPolarHBondContact O-CB 3.26Å; A115-K118 PolarHBondContact O-N 3.28Å; A115-C119 PolarHBondContact O-N 3.48Å; A115-C119 VanDerWaalsContact O-N 3.11Å; A115-C119 PolarHBondContact O-SG 3.46Å
116	Q	95.4	Very high	93.7	Very high	138 Å²	138	83.7 Å²	83.7	65%	0.645	44%	0.439	S	S	*	.	H	α-helix	trans	-62.8	-44.8	174.4	-72.4	179.4	-17.1	0	0	111.8	R112 V113 K118 C119 F120	R112-Q116 WeakPolarHBondContact O-CG 2.99Å; R112-Q116 PolarHBondContact O-N 3.35Å; V113-Q116 PolarHBondContact O-N 3.01Å; Q116-K118 VanDerWaalsContact C-N 3.25Å; Q116-K118 PolarHBondContact O-N 2.95Å; Q116-C119 PolarHBondContact O-N 2.89Å; Q116-F120 PolarHBondContact O-N 2.87Å
117	L	95.2	Very high	94	Very high	73 Å²	73	86.1 Å²	86.1	38%	0.382	45%	0.45	S	S	.	.	H	α-helix	trans	-62.9	-34.2	178.3	-173.1	62.2	0	0	0	111.7	V113 L114 F120 A121 M128 V132	V113-L117 WeakPolarHBondContact O-CB 3.47Å; V113-L117 PolarHBondContact O-N 3.29Å; L114-L117 PolarHBondContact O-N 3.18Å; L117-F120 HydrophobicContact CD1-CD1 4.44Å; L117-F120 PolarHBondContact O-N 3.49Å; L117-A121 VanDerWaalsContact O-CB 3.26Å; L117-A121 WeakPolarHBondContact O-CB 3.46Å; L117-A121 PolarHBondContact O-N 3.41Å; L117-M128 HydrophobicContact CD1-CE 3.7Å; L117-M128 HydrophobicContact CG-CE 4.23Å; L117-V132 HydrophobicContact CD2-CG2 4.05Å; L117-V132 HydrophobicContact CG-CG2 3.91Å
118	K	96.1	Very high	94.3	Very high	89 Å²	89	84.4 Å²	84.4	39%	0.387	44%	0.443	S	S	.	.	H	α-helix	trans	-65	-46.3	173.7	-170.1	170.1	-175.8	164.2	0	112.4	L114 A115 Q116 F120 A121 A122 L129 V132 E136	L114-K118 WeakPolarHBondContact O-CB 3.3Å; L114-K118 PolarHBondContact O-N 2.98Å; A115-K118 WeakPolarHBondContact O-CB 3.26Å; A115-K118 PolarHBondContact O-N 3.28Å; Q116-K118 VanDerWaalsContact C-N 3.25Å; Q116-K118 PolarHBondContact O-N 2.95Å; K118-F120 VanDerWaalsContact C-N 3.33Å; K118-F120 PolarHBondContact O-N 3.35Å; K118-A121 PolarHBondContact O-N 3.31Å; K118-A122 WeakPolarHBondContact O-CB 3.35Å; K118-A122 PolarHBondContact O-N 3.36Å; K118-L129 HydrophobicContact CG-CD2 4.36Å; K118-V132 HydrophobicContact CB-CG1 3.82Å; K118-V132 HydrophobicContact CG-CG1 4.32Å; K118-E136 VanDerWaalsContact CD-OE1 3.23Å; K118-E136 WeakPolarHBondContact CD-OE1 3.42Å; K118-E136 VanDerWaalsContact NZ-CD 3.29Å; K118-E136 IonicContact NZ-OE1 3.67Å; K118-E136 PolarHBondContact NZ-OE1 3.17Å; K118-E136 IonicContact NZ-OE2 2.89Å; K118-E136 PolarHBondContact NZ-OE2 3.21Å
119	C	95.8	Very high	94.6	Very high	92 Å²	92	81.3 Å²	81.3	62%	0.622	43%	0.43	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174.5	-67.8	0	0	0	0	111.1	A115 Q116 A122 E123	A115-C119 PolarHBondContact O-N 3.48Å; A115-C119 VanDerWaalsContact O-N 3.11Å; A115-C119 PolarHBondContact O-SG 3.46Å; Q116-C119 PolarHBondContact O-N 2.89Å; C119-A122 PolarHBondContact O-N 3.46Å; C119-E123 PolarHBondContact O-N 3.26Å; C119-E123 VanDerWaalsContact O-N 3.15Å
120	F	95.4	Very high	94.7	Very high	110 Å²	110	82.8 Å²	82.8	48%	0.482	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-46.4	176.5	177.4	-92.7	0	0	0	112.4	Q116 L117 K118 A122 E123 K124 M128	Q116-F120 PolarHBondContact O-N 2.87Å; L117-F120 HydrophobicContact CD1-CD1 4.44Å; L117-F120 PolarHBondContact O-N 3.49Å; K118-F120 VanDerWaalsContact C-N 3.33Å; K118-F120 PolarHBondContact O-N 3.35Å; F120-A122 VanDerWaalsContact C-N 3.34Å; F120-A122 PolarHBondContact O-N 3.12Å; F120-E123 PolarHBondContact O-N 2.84Å; F120-K124 HydrophobicContact CD2-CG 4.01Å; F120-K124 HydrophobicContact CE1-CB 4.25Å; F120-K124 HydrophobicContact CE2-CB 4.23Å; F120-K124 HydrophobicContact CE2-CG 3.7Å; F120-K124 HydrophobicContact CZ-CB 4.03Å; F120-K124 HydrophobicContact CZ-CG 4.01Å; F120-K124 WeakPolarHBondContact O-CB 3.42Å; F120-K124 PolarHBondContact O-N 2.89Å; F120-M128 HydrophobicContact CD1-CE 3.99Å; F120-M128 HydrophobicContact CE1-CE 4.32Å
121	A	95.4	Very high	94.9	Very high	0 Å²	0	82.7 Å²	82.7	0%	0	45%	0.449	C	S	.	.	H	α-helix	trans	-61.7	-41.9	177.6	0	0	0	0	0	111.5	L117 K118 E123 C125 M128 L129 V132	L117-A121 VanDerWaalsContact O-CB 3.26Å; L117-A121 WeakPolarHBondContact O-CB 3.46Å; L117-A121 PolarHBondContact O-N 3.41Å; K118-A121 PolarHBondContact O-N 3.31Å; A121-E123 VanDerWaalsContact C-N 3.27Å; A121-E123 PolarHBondContact O-N 2.93Å; A121-C125 CarbonylContact O-C 3.57Å; A121-C125 WeakPolarHBondContact O-CA 3.39Å; A121-C125 PolarHBondContact O-N 3.07Å; A121-M128 HydrophobicContact CB-CB 4.21Å; A121-M128 HydrophobicContact CB-CE 3.66Å; A121-L129 HydrophobicContact CB-CD2 3.79Å; A121-L129 HydrophobicContact CB-CG 4.14Å; A121-V132 HydrophobicContact CB-CG2 4.17Å
122	A	94.3	Very high	95.1	Very high	59 Å²	59	81.5 Å²	81.5	49%	0.488	44%	0.436	S	S	.	.	H	α-helix	trans	-61.1	-36.8	178	0	0	0	0	0	112.4	K118 C119 F120 L129	K118-A122 WeakPolarHBondContact O-CB 3.35Å; K118-A122 PolarHBondContact O-N 3.36Å; C119-A122 PolarHBondContact O-N 3.46Å; F120-A122 VanDerWaalsContact C-N 3.34Å; F120-A122 PolarHBondContact O-N 3.12Å; A122-L129 HydrophobicContact CB-CD2 4.16Å
123	E	95.2	Very high	95.1	Very high	140 Å²	140	77 Å²	77	65%	0.654	43%	0.428	S	S	*	.	H	α-helix	trans	-84.2	-44.6	-178.7	-164.4	-167.2	148.4	0	0	113.1	C119 F120 A121	C119-E123 PolarHBondContact O-N 3.26Å; C119-E123 VanDerWaalsContact O-N 3.15Å; F120-E123 PolarHBondContact O-N 2.84Å; A121-E123 VanDerWaalsContact C-N 3.27Å; A121-E123 PolarHBondContact O-N 2.93Å
124	K	95.5	Very high	95.2	Very high	130 Å²	130	78.4 Å²	78.4	57%	0.565	43%	0.431	S	S	*	.	H	α-helix	trans	-104.9	-30.9	-167.3	-57.6	-56	-173.1	-162.3	0	114.3	F120	F120-K124 HydrophobicContact CD2-CG 4.01Å; F120-K124 HydrophobicContact CE1-CB 4.25Å; F120-K124 HydrophobicContact CE2-CB 4.23Å; F120-K124 HydrophobicContact CE2-CG 3.7Å; F120-K124 HydrophobicContact CZ-CB 4.03Å; F120-K124 HydrophobicContact CZ-CG 4.01Å; F120-K124 WeakPolarHBondContact O-CB 3.42Å; F120-K124 PolarHBondContact O-N 2.89Å
125	C	94.2	Very high	95.2	Very high	53 Å²	53	79.5 Å²	79.5	36%	0.358	44%	0.443	S	S	.	.			trans	-152.1	81.5	-174.7	-170.7	0	0	0	0	111.9	A121 K127 M128	A121-C125 CarbonylContact O-C 3.57Å; A121-C125 WeakPolarHBondContact O-CA 3.39Å; A121-C125 PolarHBondContact O-N 3.07Å; C125-K127 PolarHBondContact O-N 2.78Å; C125-M128 HydrophobicContact CB-CB 4.37Å; C125-M128 WeakPolarHBondContact O-CB 3.2Å; C125-M128 PolarHBondContact O-N 3.45Å
126	P	92.9	Very high	95.3	Very high	85 Å²	85	80.2 Å²	80.2	55%	0.552	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-58.1	-26.2	-178.4	-27.6	35.6	0	0	0	113.8	M128 L129	P126-M128 PolarHBondContact O-N 3.49Å; P126-L129 HydrophobicContact CB-CD1 4.29Å; P126-L129 VanDerWaalsContact O-CB 3.31Å; P126-L129 WeakPolarHBondContact O-CB 3.45Å; P126-L129 WeakPolarHBondContact O-CG 3.33Å; P126-L129 PolarHBondContact O-N 2.94Å; P126-L129 VanDerWaalsContact O-N 3.13Å
127	K	93.8	Very high	95.3	Very high	191 Å²	191	78.5 Å²	78.5	83%	0.83	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-60.9	-26.6	175.3	-65.4	-178.3	-179.6	177.9	0	112.9	C125 S130	C125-K127 PolarHBondContact O-N 2.78Å; K127-S130 PolarHBondContact O-OG 2.74Å
128	M	94.4	Very high	95.3	Very high	60 Å²	60	77.8 Å²	77.8	30%	0.296	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-80.9	-14.8	179.6	-164.1	172.2	70.2	0	0	112.7	L117 F120 A121 C125 P126 S130 A131 V132	L117-M128 HydrophobicContact CD1-CE 3.7Å; L117-M128 HydrophobicContact CG-CE 4.23Å; F120-M128 HydrophobicContact CD1-CE 3.99Å; F120-M128 HydrophobicContact CE1-CE 4.32Å; A121-M128 HydrophobicContact CB-CB 4.21Å; A121-M128 HydrophobicContact CB-CE 3.66Å; C125-M128 HydrophobicContact CB-CB 4.37Å; C125-M128 WeakPolarHBondContact O-CB 3.2Å; C125-M128 PolarHBondContact O-N 3.45Å; P126-M128 PolarHBondContact O-N 3.49Å; M128-S130 PolarHBondContact O-N 2.94Å; M128-A131 WeakPolarHBondContact O-CB 3.34Å; M128-A131 PolarHBondContact O-N 3.32Å; M128-V132 HydrophobicContact CE-CG2 4.49Å; M128-V132 HydrophobicContact CG-CG2 4.35Å; M128-V132 PolarHBondContact O-N 2.97Å; M128-V132 VanDerWaalsContact O-N 3.08Å
129	L	94.9	Very high	95.1	Very high	62 Å²	62	75.3 Å²	75.3	33%	0.325	43%	0.433	S	S	.	.	H	α-helix	trans	-57.8	-35.3	-176.5	-75.4	170.1	0	0	0	113.3	K118 A121 A122 P126 V132 A133	K118-L129 HydrophobicContact CG-CD2 4.36Å; A121-L129 HydrophobicContact CB-CD2 3.79Å; A121-L129 HydrophobicContact CB-CG 4.14Å; A122-L129 HydrophobicContact CB-CD2 4.16Å; P126-L129 HydrophobicContact CB-CD1 4.29Å; P126-L129 VanDerWaalsContact O-CB 3.31Å; P126-L129 WeakPolarHBondContact O-CB 3.45Å; P126-L129 WeakPolarHBondContact O-CG 3.33Å; P126-L129 PolarHBondContact O-N 2.94Å; P126-L129 VanDerWaalsContact O-N 3.13Å; L129-V132 PolarHBondContact O-N 3Å; L129-A133 WeakPolarHBondContact O-CB 3.47Å; L129-A133 PolarHBondContact O-N 3.25Å
130	S	95.6	Very high	95	Very high	78 Å²	78	72.6 Å²	72.6	55%	0.545	42%	0.42	S	S	.	.	H	α-helix	trans	-64.5	-42.4	176.2	56.5	0	0	0	0	112	K127 M128 A133 I134	K127-S130 PolarHBondContact O-OG 2.74Å; M128-S130 PolarHBondContact O-N 2.94Å; S130-A133 PolarHBondContact O-N 3.06Å; S130-I134 VanDerWaalsContact O-CG1 3.29Å; S130-I134 WeakPolarHBondContact O-CG1 3.4Å; S130-I134 PolarHBondContact O-N 3.1Å
131	A	96.1	Very high	94.8	Very high	53 Å²	53	70.1 Å²	70.1	44%	0.438	42%	0.42	S	S	.	.	H	α-helix	trans	-64.4	-41.6	176.9	0	0	0	0	0	111.4	M128 I134 A135	M128-A131 WeakPolarHBondContact O-CB 3.34Å; M128-A131 PolarHBondContact O-N 3.32Å; A131-I134 PolarHBondContact O-N 2.96Å; A131-A135 PolarHBondContact O-N 3.3Å
132	V	96.3	Very high	94.5	Very high	3 Å²	3	75.8 Å²	75.8	2%	0.018	44%	0.442	C	S	.	.	H	α-helix	trans	-63	-43.4	175.2	-178.1	0	0	0	0	110.8	L114 L117 K118 A121 M128 L129 I134 A135 E136	L114-V132 HydrophobicContact CD2-CG1 3.98Å; L117-V132 HydrophobicContact CD2-CG2 4.05Å; L117-V132 HydrophobicContact CG-CG2 3.91Å; K118-V132 HydrophobicContact CB-CG1 3.82Å; K118-V132 HydrophobicContact CG-CG1 4.32Å; A121-V132 HydrophobicContact CB-CG2 4.17Å; M128-V132 HydrophobicContact CE-CG2 4.49Å; M128-V132 HydrophobicContact CG-CG2 4.35Å; M128-V132 PolarHBondContact O-N 2.97Å; M128-V132 VanDerWaalsContact O-N 3.08Å; L129-V132 PolarHBondContact O-N 3Å; V132-I134 VanDerWaalsContact C-N 3.32Å; V132-I134 PolarHBondContact O-N 3.28Å; V132-A135 PolarHBondContact O-N 3.47Å; V132-E136 WeakPolarHBondContact O-CG 3.5Å; V132-E136 PolarHBondContact O-N 3.14Å
133	A	95.3	Very high	94.2	Very high	42 Å²	42	73.8 Å²	73.8	35%	0.347	42%	0.424	S	S	.	.	H	α-helix	trans	-63.4	-36.2	177.1	0	0	0	0	0	113	L129 S130 E136 T137	L129-A133 WeakPolarHBondContact O-CB 3.47Å; L129-A133 PolarHBondContact O-N 3.25Å; S130-A133 PolarHBondContact O-N 3.06Å; A133-E136 PolarHBondContact O-N 3.04Å; A133-T137 WeakPolarHBondContact O-CB 3.44Å; A133-T137 PolarHBondContact O-N 3.38Å; A133-T137 PolarHBondContact O-OG1 3.42Å
134	I	97.3	Very high	93.7	Very high	120 Å²	120	70.6 Å²	70.6	62%	0.615	42%	0.416	S	S	*	.	H	α-helix	trans	-63.3	-45.5	173.2	-69.3	163.6	0	0	0	110.2	S130 A131 V132 T137 A138	S130-I134 VanDerWaalsContact O-CG1 3.29Å; S130-I134 WeakPolarHBondContact O-CG1 3.4Å; S130-I134 PolarHBondContact O-N 3.1Å; A131-I134 PolarHBondContact O-N 2.96Å; V132-I134 VanDerWaalsContact C-N 3.32Å; V132-I134 PolarHBondContact O-N 3.28Å; I134-T137 WeakPolarHBondContact O-CB 3.45Å; I134-T137 PolarHBondContact O-N 3.36Å; I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.46Å
135	A	96.3	Very high	93.2	Very high	42 Å²	42	67.6 Å²	67.6	35%	0.347	41%	0.411	S	S	.	.	H	α-helix	trans	-64.5	-39	177.5	0	0	0	0	0	112.5	L114 A131 V132 T137 A138 L139	L114-A135 HydrophobicContact CD2-CB 3.68Å; A131-A135 PolarHBondContact O-N 3.3Å; V132-A135 PolarHBondContact O-N 3.47Å; A135-T137 VanDerWaalsContact C-N 3.32Å; A135-T137 PolarHBondContact O-N 3.41Å; A135-A138 PolarHBondContact O-N 2.86Å; A135-L139 PolarHBondContact O-N 2.6Å
136	E	95.4	Very high	92.5	Very high	64 Å²	64	70.8 Å²	70.8	30%	0.299	42%	0.419	S	S	.	.	H	α-helix	trans	-59.7	-43.6	172	-72.1	-177.9	139.2	0	0	111.3	L114 K118 V132 A133 L139 G140	L114-E136 HydrophobicContact CD2-CB 4.49Å; L114-E136 HydrophobicContact CD2-CG 3.68Å; K118-E136 VanDerWaalsContact CD-OE1 3.23Å; K118-E136 WeakPolarHBondContact CD-OE1 3.42Å; K118-E136 VanDerWaalsContact NZ-CD 3.29Å; K118-E136 IonicContact NZ-OE1 3.67Å; K118-E136 PolarHBondContact NZ-OE1 3.17Å; K118-E136 IonicContact NZ-OE2 2.89Å; K118-E136 PolarHBondContact NZ-OE2 3.21Å; V132-E136 WeakPolarHBondContact O-CG 3.5Å; V132-E136 PolarHBondContact O-N 3.14Å; A133-E136 PolarHBondContact O-N 3.04Å; E136-L139 PolarHBondContact O-N 3.15Å; E136-G140 PolarHBondContact O-N 3.43Å
137	T	96.1	Very high	91.6	Very high	102 Å²	102	75 Å²	75	63%	0.626	43%	0.429	S	S	*	.	H	α-helix	trans	-65	-42.3	178.2	-55.7	0	0	0	0	111.3	A133 I134 A135 G140 A141	A133-T137 WeakPolarHBondContact O-CB 3.44Å; A133-T137 PolarHBondContact O-N 3.38Å; A133-T137 PolarHBondContact O-OG1 3.42Å; I134-T137 WeakPolarHBondContact O-CB 3.45Å; I134-T137 PolarHBondContact O-N 3.36Å; A135-T137 VanDerWaalsContact C-N 3.32Å; A135-T137 PolarHBondContact O-N 3.41Å; T137-G140 PolarHBondContact O-N 3.14Å; T137-A141 PolarHBondContact O-N 2.93Å
138	A	95.4	Very high	90.4	Very high	58 Å²	58	73.9 Å²	73.9	48%	0.479	42%	0.424	S	S	.	.	H	α-helix	trans	-63.6	-41.9	177.3	0	0	0	0	0	111.8	I134 A135 A141 Y142	I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.46Å; A135-A138 PolarHBondContact O-N 2.86Å; A138-A141 PolarHBondContact O-N 3.08Å; A138-Y142 WeakPolarHBondContact O-CB 3.31Å; A138-Y142 PolarHBondContact O-N 3.45Å
139	L	92.8	Very high	88.9	Confident	38 Å²	38	78.8 Å²	78.8	20%	0.199	45%	0.446	C	S	.	.	H	α-helix	trans	-59.6	-51.1	173	-177.7	62.6	0	0	0	110.1	E107 V110 L114 A135 E136 A141 Y142 V143	E107-L139 HydrophobicContact CG-CD1 4.32Å; V110-L139 HydrophobicContact CG1-CD1 4.14Å; V110-L139 HydrophobicContact CG1-CD2 4.21Å; L114-L139 HydrophobicContact CD1-CB 4.42Å; L114-L139 HydrophobicContact CD1-CD2 3.99Å; A135-L139 PolarHBondContact O-N 2.6Å; E136-L139 PolarHBondContact O-N 3.15Å; L139-A141 VanDerWaalsContact C-N 3.29Å; L139-A141 PolarHBondContact O-N 2.88Å; L139-Y142 WeakPolarHBondContact O-CB 3.46Å; L139-Y142 PolarHBondContact O-N 3.43Å; L139-Y142 VanDerWaalsContact O-N 3.1Å; L139-V143 HydrophobicContact CD1-CG2 4.35Å; L139-V143 HydrophobicContact CG-CG2 4.47Å; L139-V143 VanDerWaalsContact O-CG2 3.24Å; L139-V143 WeakPolarHBondContact O-CG2 3.34Å; L139-V143 PolarHBondContact O-N 3.02Å
140	G	91.9	Very high	87.5	Confident	34 Å²	34	85 Å²	85	35%	0.351	47%	0.473	S	S	.	.	H	α-helix	trans	-55	-43	177	0	0	0	0	0	113.3	E136 T137 V143 C144	E136-G140 PolarHBondContact O-N 3.43Å; T137-G140 PolarHBondContact O-N 3.14Å; G140-V143 PolarHBondContact O-N 3.24Å; G140-C144 WeakPolarHBondContact O-CB 3.49Å; G140-C144 PolarHBondContact O-N 3.3Å; G140-C144 PolarHBondContact O-SG 2.83Å
141	A	92.2	Very high	86.3	Confident	59 Å²	59	85.9 Å²	85.9	49%	0.488	48%	0.476	S	S	.	.	H	α-helix	trans	-63.7	-42	176.8	0	0	0	0	0	112.7	T137 A138 L139 C144 S145	T137-A141 PolarHBondContact O-N 2.93Å; A138-A141 PolarHBondContact O-N 3.08Å; L139-A141 VanDerWaalsContact C-N 3.29Å; L139-A141 PolarHBondContact O-N 2.88Å; A141-C144 PolarHBondContact O-N 3.08Å; A141-S145 WeakPolarHBondContact O-CB 3.3Å; A141-S145 PolarHBondContact O-N 3.16Å; A141-S145 PolarHBondContact O-OG 3.45Å
142	Y	89.3	Confident	85.2	Confident	119 Å²	119	92.1 Å²	92.1	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-42.3	175.6	170.8	-100.7	0	0	0	112.2	A138 L139 S145 K146	A138-Y142 WeakPolarHBondContact O-CB 3.31Å; A138-Y142 PolarHBondContact O-N 3.45Å; L139-Y142 WeakPolarHBondContact O-CB 3.46Å; L139-Y142 PolarHBondContact O-N 3.43Å; L139-Y142 VanDerWaalsContact O-N 3.1Å; Y142-S145 PolarHBondContact O-N 2.88Å; Y142-S145 PolarHBondContact O-OG 3.39Å; Y142-K146 HydrophobicContact CE1-CD 4.35Å; Y142-K146 PolarHBondContact O-N 3.44Å; Y142-K146 VanDerWaalsContact O-N 3.12Å; Y142-K146 WeakPolarHBondContact OH-CE 3.28Å; Y142-K146 PolarHBondContact OH-NZ 3.13Å
143	V	87.5	Confident	84.4	Confident	17 Å²	17	98 Å²	98	10%	0.103	52%	0.518	C	S	.	.	H	α-helix	trans	-66.1	-43.9	177.6	177.8	0	0	0	0	110.9	E107 L139 G140 S145 K146 K147	E107-V143 HydrophobicContact CG-CG2 3.67Å; E107-V143 WeakPolarHBondContact OE1-CG1 3.43Å; E107-V143 WeakPolarHBondContact OE1-CG2 3.41Å; E107-V143 WeakPolarHBondContact OE2-CG2 3.32Å; L139-V143 HydrophobicContact CD1-CG2 4.35Å; L139-V143 HydrophobicContact CG-CG2 4.47Å; L139-V143 VanDerWaalsContact O-CG2 3.24Å; L139-V143 WeakPolarHBondContact O-CG2 3.34Å; L139-V143 PolarHBondContact O-N 3.02Å; G140-V143 PolarHBondContact O-N 3.24Å; V143-S145 VanDerWaalsContact C-N 3.35Å; V143-S145 PolarHBondContact O-N 2.95Å; V143-K146 PolarHBondContact O-N 3.41Å; V143-K147 PolarHBondContact O-N 3.49Å
144	C	85.5	Confident	83.6	Confident	72 Å²	72	99.1 Å²	99.1	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-37.6	175.9	-74	0	0	0	0	112.4	G140 A141 K147 K148	G140-C144 WeakPolarHBondContact O-CB 3.49Å; G140-C144 PolarHBondContact O-N 3.3Å; G140-C144 PolarHBondContact O-SG 2.83Å; A141-C144 PolarHBondContact O-N 3.08Å; C144-K147 PolarHBondContact O-N 2.94Å; C144-K148 WeakPolarHBondContact O-CG 3.27Å; C144-K148 PolarHBondContact O-N 3.31Å
145	S	85	Confident	82.5	Confident	67 Å²	67	95.8 Å²	95.8	47%	0.469	50%	0.503	S	S	.	.	H	α-helix	trans	-69	-37.5	179.6	71.5	0	0	0	0	111.8	A141 Y142 V143 K147 K148	A141-S145 WeakPolarHBondContact O-CB 3.3Å; A141-S145 PolarHBondContact O-N 3.16Å; A141-S145 PolarHBondContact O-OG 3.45Å; Y142-S145 PolarHBondContact O-N 2.88Å; Y142-S145 PolarHBondContact O-OG 3.39Å; V143-S145 VanDerWaalsContact C-N 3.35Å; V143-S145 PolarHBondContact O-N 2.95Å; S145-K147 VanDerWaalsContact C-N 3.31Å; S145-K147 PolarHBondContact O-N 2.74Å; S145-K148 WeakPolarHBondContact O-CB 3.46Å; S145-K148 PolarHBondContact O-N 3.3Å; S145-K148 VanDerWaalsContact O-N 3.14Å
146	K	79.6	Confident	81.4	Confident	121 Å²	121	99.8 Å²	99.8	53%	0.526	51%	0.513	S	S	.	.	H	α-helix	trans	-63.3	-34.8	173	-83.3	-159.3	163.9	179.8	0	113.7	Y142 V143 K148 H149	Y142-K146 HydrophobicContact CE1-CD 4.35Å; Y142-K146 PolarHBondContact O-N 3.44Å; Y142-K146 VanDerWaalsContact O-N 3.12Å; Y142-K146 WeakPolarHBondContact OH-CE 3.28Å; Y142-K146 PolarHBondContact OH-NZ 3.13Å; V143-K146 PolarHBondContact O-N 3.41Å; K146-K148 VanDerWaalsContact C-N 3.27Å; K146-K148 PolarHBondContact O-N 3.3Å; K146-H149 PolarHBondContact O-CD2 2.88Å
147	K	73	Confident	80.5	Confident	172 Å²	172	102.4 Å²	102.4	75%	0.748	52%	0.524	S	S	*	.	H	α-helix	trans	-73.2	-20.2	176.2	-69.2	179.8	-176.9	176.7	0	112.8	V143 C144 S145 H149	V143-K147 PolarHBondContact O-N 3.49Å; C144-K147 PolarHBondContact O-N 2.94Å; S145-K147 VanDerWaalsContact C-N 3.31Å; S145-K147 PolarHBondContact O-N 2.74Å; K147-H149 PolarHBondContact O-N 3.13Å
148	K	68.3	Low	79.5	Confident	169 Å²	169	100.9 Å²	100.9	74%	0.735	52%	0.517	S	S	*	.			trans	-82.1	56.2	173	-67.6	175	-176.5	-179.1	0	110.7	C144 S145 K146 Q150	C144-K148 WeakPolarHBondContact O-CG 3.27Å; C144-K148 PolarHBondContact O-N 3.31Å; S145-K148 WeakPolarHBondContact O-CB 3.46Å; S145-K148 PolarHBondContact O-N 3.3Å; S145-K148 VanDerWaalsContact O-N 3.14Å; K146-K148 VanDerWaalsContact C-N 3.27Å; K146-K148 PolarHBondContact O-N 3.3Å; K148-Q150 PolarHBondContact O-N 2.91Å; K148-Q150 VanDerWaalsContact O-N 3.15Å
149	H	64.3	Low	78.4	Confident	162 Å²	162	105.9 Å²	105.9	75%	0.75	53%	0.528	S	S	*	.			trans	-64.1	118.3	161.5	-84.7	-61	0	0	0	107.9	K146 K147 T151	K146-H149 PolarHBondContact O-CD2 2.88Å; K147-H149 PolarHBondContact O-N 3.13Å; H149-T151 VanDerWaalsContact C-N 3.34Å; H149-T151 PolarHBondContact O-N 3.28Å
150	Q	64.7	Low	77	Confident	192 Å²	192	110.9 Å²	110.9	90%	0.897	55%	0.551	S	S	*	*			trans	-61.7	99.3	170.7	-176.3	174.4	11.2	0	0	107.8	K148	K148-Q150 PolarHBondContact O-N 2.91Å; K148-Q150 VanDerWaalsContact O-N 3.15Å
151	T	70.5	Confident	75.4	Confident	98 Å²	98	114.4 Å²	114.4	60%	0.601	57%	0.569	S	S	*	*			trans	-67.2	134.2	168.9	41.6	0	0	0	0	108.3	H149 T155	H149-T151 VanDerWaalsContact C-N 3.34Å; H149-T151 PolarHBondContact O-N 3.28Å; T151-T155 HydrophobicContact CG2-CG2 4.45Å
152	R	73.6	Confident	73.4	Confident	183 Å²	183	116.1 Å²	116.1	69%	0.691	58%	0.577	S	S	*	*			trans	-56.3	144.9	172.3	-75.7	171.5	54	146.3	1	109.2	D154 T155	R152-D154 WeakPolarHBondContact CB-OD1 3.48Å; R152-D154 IonicContact CZ-OD2 3.83Å; R152-D154 IonicContact NE-OD1 3.17Å; R152-D154 IonicContact NE-OD2 2.6Å; R152-D154 PolarHBondContact NE-OD2 3.15Å; R152-D154 IonicContact NH2-OD2 3.19Å; R152-D154 PolarHBondContact NH2-OD2 2.9Å; R152-D154 PolarHBondContact O-N 3.32Å; R152-D154 VanDerWaalsContact O-N 3.16Å; R152-T155 WeakPolarHBondContact O-CB 3.2Å; R152-T155 PolarHBondContact O-N 3.27Å; R152-T155 PolarHBondContact O-OG1 3.1Å
153	I	78.1	Confident	71.5	Confident	126 Å²	126	120 Å²	120	65%	0.646	62%	0.616	S	S	*	*	H	α-helix	trans	-59.9	-29	-174.6	-161	177.4	0	0	0	112.5	T155 F156 F157	I153-T155 PolarHBondContact O-N 3.16Å; I153-F156 WeakPolarHBondContact O-CB 3.36Å; I153-F156 PolarHBondContact O-N 2.78Å; I153-F156 VanDerWaalsContact O-N 3.1Å; I153-F157 HydrophobicContact CD1-CE2 3.82Å; I153-F157 HydrophobicContact CD1-CZ 4.48Å; I153-F157 HydrophobicContact CG1-CD2 4.14Å; I153-F157 HydrophobicContact CG1-CE2 3.62Å; I153-F157 WeakPolarHBondContact O-CD2 3.21Å; I153-F157 PolarHBondContact O-N 2.89Å
154	D	79.3	Confident	70.7	Confident	67 Å²	67	125.1 Å²	125.1	36%	0.358	64%	0.642	S	S	.	*	H	α-helix	trans	-58.6	-33.3	172	52.8	12.3	0	0	0	113	R152 F156 F157 S158	R152-D154 WeakPolarHBondContact CB-OD1 3.48Å; R152-D154 IonicContact CZ-OD2 3.83Å; R152-D154 IonicContact NE-OD1 3.17Å; R152-D154 IonicContact NE-OD2 2.6Å; R152-D154 PolarHBondContact NE-OD2 3.15Å; R152-D154 IonicContact NH2-OD2 3.19Å; R152-D154 PolarHBondContact NH2-OD2 2.9Å; R152-D154 PolarHBondContact O-N 3.32Å; R152-D154 VanDerWaalsContact O-N 3.16Å; D154-F156 VanDerWaalsContact C-N 3.27Å; D154-F156 PolarHBondContact O-N 3.43Å; D154-F157 PolarHBondContact O-N 3.17Å; D154-S158 WeakPolarHBondContact O-CB 2.87Å; D154-S158 PolarHBondContact O-N 3.3Å; D154-S158 PolarHBondContact O-OG 3.31Å
155	T	74.8	Confident	70	Confident	50 Å²	50	127.9 Å²	127.9	31%	0.307	65%	0.65	S	S	.	*	H	α-helix	trans	-70	-27.7	178.1	-42.8	0	0	0	0	111.5	T151 R152 I153 S158	T151-T155 HydrophobicContact CG2-CG2 4.45Å; R152-T155 WeakPolarHBondContact O-CB 3.2Å; R152-T155 PolarHBondContact O-N 3.27Å; R152-T155 PolarHBondContact O-OG1 3.1Å; I153-T155 PolarHBondContact O-N 3.16Å; T155-S158 WeakPolarHBondContact CA-OG 3.46Å; T155-S158 PolarHBondContact O-OG 3.43Å
156	F	73	Confident	69.1	Low	125 Å²	125	131.3 Å²	131.3	55%	0.548	66%	0.66	S	S	.	*	H	α-helix	trans	-73.2	-45.2	174.1	-178.1	-92.9	0	0	0	110.9	I153 D154	I153-F156 WeakPolarHBondContact O-CB 3.36Å; I153-F156 PolarHBondContact O-N 2.78Å; I153-F156 VanDerWaalsContact O-N 3.1Å; D154-F156 VanDerWaalsContact C-N 3.27Å; D154-F156 PolarHBondContact O-N 3.43Å
157	F	76	Confident	68.5	Low	120 Å²	120	131.9 Å²	131.9	53%	0.526	67%	0.668	S	S	.	*	H	α-helix	trans	-70.2	-34.4	179.2	-68.5	-66.4	0	0	0	112.9	I153 D154 K159 Q160 C161	I153-F157 HydrophobicContact CD1-CE2 3.82Å; I153-F157 HydrophobicContact CD1-CZ 4.48Å; I153-F157 HydrophobicContact CG1-CD2 4.14Å; I153-F157 HydrophobicContact CG1-CE2 3.62Å; I153-F157 WeakPolarHBondContact O-CD2 3.21Å; I153-F157 PolarHBondContact O-N 2.89Å; D154-F157 PolarHBondContact O-N 3.17Å; F157-K159 VanDerWaalsContact C-N 3.34Å; F157-K159 PolarHBondContact O-N 2.91Å; F157-Q160 PolarHBondContact O-N 3.35Å; F157-C161 PolarHBondContact O-N 3.4Å
158	S	75.6	Confident	68.2	Low	70 Å²	70	129.4 Å²	129.4	49%	0.49	66%	0.663	S	S	.	*	H	α-helix	trans	-65.2	-35.3	178.1	63.3	0	0	0	0	113.1	D154 T155 C161	D154-S158 WeakPolarHBondContact O-CB 2.87Å; D154-S158 PolarHBondContact O-N 3.3Å; D154-S158 PolarHBondContact O-OG 3.31Å; T155-S158 WeakPolarHBondContact CA-OG 3.46Å; T155-S158 PolarHBondContact O-OG 3.43Å; S158-C161 PolarHBondContact O-N 3.34Å
159	K	70.6	Confident	68.2	Low	162 Å²	162	126.7 Å²	126.7	70%	0.704	66%	0.659	S	S	*	*	H	α-helix	trans	-70.4	-28.8	177.1	-74	-174.8	179.3	-175.1	0	113.8	F157 C161	F157-K159 VanDerWaalsContact C-N 3.34Å; F157-K159 PolarHBondContact O-N 2.91Å; K159-C161 VanDerWaalsContact C-N 3.29Å
160	Q	64.2	Low	68.5	Low	144 Å²	144	124.2 Å²	124.2	67%	0.673	65%	0.652	S	S	*	*	H	α-helix	trans	-80.7	-11.9	177.5	-64.8	-74.8	-2	0	0	112.5	F157	F157-Q160 PolarHBondContact O-N 3.35Å
161	C	58.8	Low	68.8	Low	108 Å²	108	119 Å²	119	73%	0.73	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	3.6	179.3	-75.4	0	0	0	0	114.4	F157 S158 K159	F157-C161 PolarHBondContact O-N 3.4Å; S158-C161 PolarHBondContact O-N 3.34Å; K159-C161 VanDerWaalsContact C-N 3.29Å
162	S	48.9	Very low	68.6	Low	95 Å²	95	120.8 Å²	120.8	66%	0.664	64%	0.636	S	S	*	*			trans	-90.2	120.4	167.3	-79.1	0	0	0	0	109.7
163	P	50.8	Low	68.2	Low	199 Å²	199	115.1 Å²	115.1	100%	1.292	63%	0.631	S	S	*	*			trans	-67.6	0	-176.4	28.8	-34.9	0	0	0	113.8

Retrieved 163 of 163 residues in 134.2 ms (Link to these results)

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