A0A3Q0KSW4_SCHMA Loading...

Mimitin, mitochondrial

AlphaFold DB , UniProt , Accession A0A3Q0KSW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 169 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	40	Very low	66.1	Low	225 Å²	225	115.4 Å²	115.4	100%	1.108	62%	0.623	S	S	*	*				0	104.5	0	-69.7	-160.4	168.8	0	0	109.2	T3	M1-T3 PolarHBondContact O-N 3.38Å
2	T	52.2	Low	67.3	Low	138 Å²	138	112.8 Å²	112.8	85%	0.847	61%	0.609	S	S	*	*			trans	-90	64.1	-178.2	39.8	0	0	0	0	110.7
3	T	55.1	Low	68.4	Low	85 Å²	85	114.3 Å²	114.3	52%	0.521	61%	0.606	S	S	.	*			trans	-90.1	-10.3	-178	50.8	0	0	0	0	114	M1 N7	M1-T3 PolarHBondContact O-N 3.38Å; T3-N7 PolarHBondContact O-N 3.12Å
4	S	61.8	Low	69.5	Low	85 Å²	85	111.7 Å²	111.7	59%	0.594	59%	0.591	S	S	*	*	H	α-helix	trans	-68.5	-38.4	-170.7	59.7	0	0	0	0	114.6	R8	S4-R8 PolarHBondContact O-N 2.93Å
5	N	60.3	Low	70.4	Confident	135 Å²	135	113.1 Å²	113.1	72%	0.722	59%	0.59	S	S	*	*	H	α-helix	trans	-71.2	-34.4	-178	-83.3	-32.4	0	0	0	113	S9	N5-S9 PolarHBondContact O-N 3.37Å
6	V	67.2	Low	70.8	Confident	86 Å²	86	111.4 Å²	111.4	52%	0.521	58%	0.582	S	S	.	*	H	α-helix	trans	-68.6	-40.8	179	-161.2	0	0	0	0	110.2	R8 S9 I10	V6-R8 PolarHBondContact O-N 3.37Å; V6-S9 WeakPolarHBondContact O-CB 3.38Å; V6-S9 PolarHBondContact O-N 3.41Å; V6-I10 HydrophobicContact CG1-CD1 3.93Å; V6-I10 WeakPolarHBondContact O-CG1 3.23Å; V6-I10 PolarHBondContact O-N 3.39Å
7	N	69.3	Low	71.1	Confident	88 Å²	88	109.2 Å²	109.2	47%	0.471	58%	0.578	S	S	.	*	H	α-helix	trans	-62.6	-41.4	179.2	-69.5	-7.9	0	0	0	112.7	T3 S9 I10 L11	T3-N7 PolarHBondContact O-N 3.12Å; N7-S9 VanDerWaalsContact C-N 3.34Å; N7-S9 PolarHBondContact O-N 2.87Å; N7-I10 PolarHBondContact O-N 3.02Å; N7-L11 WeakPolarHBondContact O-CB 3.36Å; N7-L11 WeakPolarHBondContact O-CG 3.43Å; N7-L11 PolarHBondContact O-N 3.2Å
8	R	72.5	Confident	71.6	Confident	178 Å²	178	109.1 Å²	109.1	67%	0.672	57%	0.572	S	S	*	*	H	α-helix	trans	-64.8	-39	176.2	-167.7	177.9	-177.3	-177	0.7	111.9	S4 V6 N12	S4-R8 PolarHBondContact O-N 2.93Å; V6-R8 PolarHBondContact O-N 3.37Å; R8-N12 VanDerWaalsContact O-CB 3.29Å; R8-N12 WeakPolarHBondContact O-CB 3.44Å; R8-N12 PolarHBondContact O-N 3.43Å
9	S	82.4	Confident	72	Confident	55 Å²	55	110.3 Å²	110.3	39%	0.385	57%	0.568	S	S	.	*	H	α-helix	trans	-63.9	-44.6	175.8	-175.7	0	0	0	0	111.7	N5 V6 N7 N12 K13	N5-S9 PolarHBondContact O-N 3.37Å; V6-S9 WeakPolarHBondContact O-CB 3.38Å; V6-S9 PolarHBondContact O-N 3.41Å; N7-S9 VanDerWaalsContact C-N 3.34Å; N7-S9 PolarHBondContact O-N 2.87Å; S9-N12 PolarHBondContact O-N 3.47Å; S9-K13 VanDerWaalsContact O-CG 3.29Å; S9-K13 WeakPolarHBondContact O-CG 3.01Å; S9-K13 PolarHBondContact O-N 3.23Å
10	I	83.8	Confident	72	Confident	81 Å²	81	107.7 Å²	107.7	42%	0.415	56%	0.557	S	S	.	*	H	α-helix	trans	-65.1	-48.1	178.3	-64.8	161.6	0	0	0	111.3	V6 N7 N12 K13 I14	V6-I10 HydrophobicContact CG1-CD1 3.93Å; V6-I10 WeakPolarHBondContact O-CG1 3.23Å; V6-I10 PolarHBondContact O-N 3.39Å; N7-I10 PolarHBondContact O-N 3.02Å; I10-N12 VanDerWaalsContact C-N 3.32Å; I10-N12 PolarHBondContact O-N 2.9Å; I10-K13 WeakPolarHBondContact O-CB 3.48Å; I10-K13 PolarHBondContact O-N 3.06Å; I10-K13 VanDerWaalsContact O-N 3.1Å; I10-I14 HydrophobicContact CG2-CD1 3.83Å; I10-I14 HydrophobicContact CG2-CG1 4.43Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.5Å
11	L	82.8	Confident	72	Confident	113 Å²	113	108 Å²	108	59%	0.592	56%	0.557	S	S	*	*	H	α-helix	trans	-61.4	-41	178.1	-71.5	174	0	0	0	111.9	N7 K13 I14 F15	N7-L11 WeakPolarHBondContact O-CB 3.36Å; N7-L11 WeakPolarHBondContact O-CG 3.43Å; N7-L11 PolarHBondContact O-N 3.2Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.39Å; L11-I14 PolarHBondContact O-N 3.43Å; L11-F15 WeakPolarHBondContact O-CB 3.46Å; L11-F15 PolarHBondContact O-N 3Å
12	N	80.6	Confident	73.7	Confident	85 Å²	85	105.2 Å²	105.2	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-61	-41.4	173.7	-77.8	-7.6	0	0	0	111.6	R8 S9 I10 F15 L16	R8-N12 VanDerWaalsContact O-CB 3.29Å; R8-N12 WeakPolarHBondContact O-CB 3.44Å; R8-N12 PolarHBondContact O-N 3.43Å; S9-N12 PolarHBondContact O-N 3.47Å; I10-N12 VanDerWaalsContact C-N 3.32Å; I10-N12 PolarHBondContact O-N 2.9Å; N12-F15 PolarHBondContact O-N 3.07Å; N12-L16 VanDerWaalsContact O-CB 3.31Å; N12-L16 WeakPolarHBondContact O-CB 3.44Å; N12-L16 WeakPolarHBondContact O-CD1 3.44Å; N12-L16 WeakPolarHBondContact O-CG 3.38Å; N12-L16 PolarHBondContact O-N 3.43Å
13	K	81.5	Confident	74.5	Confident	132 Å²	132	105.8 Å²	105.8	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-41.1	175	-72	174.5	-176.5	-171.9	0	112.2	S9 I10 L11 S17	S9-K13 VanDerWaalsContact O-CG 3.29Å; S9-K13 WeakPolarHBondContact O-CG 3.01Å; S9-K13 PolarHBondContact O-N 3.23Å; I10-K13 WeakPolarHBondContact O-CB 3.48Å; I10-K13 PolarHBondContact O-N 3.06Å; I10-K13 VanDerWaalsContact O-N 3.1Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.39Å; K13-S17 WeakPolarHBondContact O-CB 3.12Å; K13-S17 PolarHBondContact O-N 3.45Å; K13-S17 PolarHBondContact O-OG 2.83Å
14	I	83.1	Confident	75.3	Confident	78 Å²	78	108.5 Å²	108.5	40%	0.4	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-48.9	176.2	-67.8	166.7	0	0	0	110.2	I10 L11 L16 S17 F18	I10-I14 HydrophobicContact CG2-CD1 3.83Å; I10-I14 HydrophobicContact CG2-CG1 4.43Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.5Å; L11-I14 PolarHBondContact O-N 3.43Å; I14-L16 PolarHBondContact O-N 3.35Å; I14-S17 WeakPolarHBondContact O-CB 3.29Å; I14-S17 PolarHBondContact O-N 2.97Å; I14-S17 VanDerWaalsContact O-N 3.12Å; I14-F18 HydrophobicContact CG2-CD2 3.55Å; I14-F18 HydrophobicContact CG2-CE2 3.4Å; I14-F18 VanDerWaalsContact O-CD2 3.25Å; I14-F18 WeakPolarHBondContact O-CD2 3.11Å; I14-F18 PolarHBondContact O-N 3.44Å
15	F	83.8	Confident	76	Confident	132 Å²	132	112.4 Å²	112.4	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-59.9	-44.7	176.9	174.6	-99.3	0	0	0	112.3	L11 N12 S17 F18 R19	L11-F15 WeakPolarHBondContact O-CB 3.46Å; L11-F15 PolarHBondContact O-N 3Å; N12-F15 PolarHBondContact O-N 3.07Å; F15-S17 VanDerWaalsContact C-N 3.29Å; F15-S17 PolarHBondContact O-N 3.3Å; F15-F18 PolarHBondContact O-N 3.08Å; F15-R19 VanDerWaalsContact O-CB 3.3Å; F15-R19 WeakPolarHBondContact O-CB 3.31Å; F15-R19 PolarHBondContact O-N 3.02Å
16	L	76.7	Confident	77.1	Confident	86 Å²	86	116.7 Å²	116.7	45%	0.45	55%	0.545	S	S	.	.	H	α-helix	trans	-60.9	-40.5	174.6	-74.3	165.7	0	0	0	111.2	N12 I14 R19 V20	N12-L16 VanDerWaalsContact O-CB 3.31Å; N12-L16 WeakPolarHBondContact O-CB 3.44Å; N12-L16 WeakPolarHBondContact O-CD1 3.44Å; N12-L16 WeakPolarHBondContact O-CG 3.38Å; N12-L16 PolarHBondContact O-N 3.43Å; I14-L16 PolarHBondContact O-N 3.35Å; L16-R19 PolarHBondContact O-N 2.84Å; L16-V20 WeakPolarHBondContact O-CB 3.43Å; L16-V20 WeakPolarHBondContact O-CG2 3.43Å; L16-V20 PolarHBondContact O-N 3.44Å
17	S	75.7	Confident	78.1	Confident	74 Å²	74	115.1 Å²	115.1	52%	0.517	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-45.8	176.5	-59.7	0	0	0	0	112	K13 I14 F15 V20 M21	K13-S17 WeakPolarHBondContact O-CB 3.12Å; K13-S17 PolarHBondContact O-N 3.45Å; K13-S17 PolarHBondContact O-OG 2.83Å; I14-S17 WeakPolarHBondContact O-CB 3.29Å; I14-S17 PolarHBondContact O-N 2.97Å; I14-S17 VanDerWaalsContact O-N 3.12Å; F15-S17 VanDerWaalsContact C-N 3.29Å; F15-S17 PolarHBondContact O-N 3.3Å; S17-V20 PolarHBondContact O-N 2.9Å; S17-M21 WeakPolarHBondContact O-CB 3.47Å; S17-M21 PolarHBondContact O-N 3.07Å
18	F	80.3	Confident	79.2	Confident	107 Å²	107	120 Å²	120	47%	0.469	55%	0.548	S	S	.	.	H	α-helix	trans	-62.7	-47.4	174.3	-83	-68.1	0	0	0	111.7	I14 F15 V20 M21 F22	I14-F18 HydrophobicContact CG2-CD2 3.55Å; I14-F18 HydrophobicContact CG2-CE2 3.4Å; I14-F18 VanDerWaalsContact O-CD2 3.25Å; I14-F18 WeakPolarHBondContact O-CD2 3.11Å; I14-F18 PolarHBondContact O-N 3.44Å; F15-F18 PolarHBondContact O-N 3.08Å; F18-V20 VanDerWaalsContact C-N 3.31Å; F18-V20 PolarHBondContact O-N 3.29Å; F18-M21 CarbonylContact O-C 3.59Å; F18-M21 WeakPolarHBondContact O-CA 3.32Å; F18-M21 VanDerWaalsContact O-CB 3.32Å; F18-M21 WeakPolarHBondContact O-CB 3.38Å; F18-M21 PolarHBondContact O-N 2.91Å; F18-F22 HydrophobicContact CB-CD2 4.39Å; F18-F22 HydrophobicContact CB-CE2 4.32Å; F18-F22 HydrophobicContact CD1-CE2 4.15Å; F18-F22 WeakPolarHBondContact O-CD2 3.44Å; F18-F22 PolarHBondContact O-N 3.33Å
19	R	78.3	Confident	80.3	Confident	133 Å²	133	115.4 Å²	115.4	50%	0.502	54%	0.537	S	S	.	.	H	α-helix	trans	-57.6	-46.6	178	-173.3	177.4	83.5	153.8	4.3	111.1	F15 L16 M21 F22 H23	F15-R19 VanDerWaalsContact O-CB 3.3Å; F15-R19 WeakPolarHBondContact O-CB 3.31Å; F15-R19 PolarHBondContact O-N 3.02Å; L16-R19 PolarHBondContact O-N 2.84Å; R19-M21 VanDerWaalsContact C-N 3.31Å; R19-M21 PolarHBondContact O-N 3.08Å; R19-F22 PolarHBondContact O-N 3.21Å; R19-H23 PolarHBondContact O-CD2 3.38Å; R19-H23 PolarHBondContact O-N 3.35Å; R19-H23 VanDerWaalsContact O-N 3.09Å
20	V	72.7	Confident	80.8	Confident	57 Å²	57	114.6 Å²	114.6	35%	0.345	53%	0.53	S	S	.	.	H	α-helix	trans	-58.8	-46	174.5	167.7	0	0	0	0	110.1	L16 S17 F18 H23 R24	L16-V20 WeakPolarHBondContact O-CB 3.43Å; L16-V20 WeakPolarHBondContact O-CG2 3.43Å; L16-V20 PolarHBondContact O-N 3.44Å; S17-V20 PolarHBondContact O-N 2.9Å; F18-V20 VanDerWaalsContact C-N 3.31Å; F18-V20 PolarHBondContact O-N 3.29Å; V20-H23 PolarHBondContact O-N 3Å; V20-R24 WeakPolarHBondContact O-CG 3.3Å; V20-R24 PolarHBondContact O-N 3.45Å; V20-R24 VanDerWaalsContact O-N 3.08Å
21	M	72.7	Confident	81.3	Confident	114 Å²	114	111.6 Å²	111.6	56%	0.562	52%	0.518	S	S	*	.	H	α-helix	trans	-58.3	-47.7	178.8	-172	-175.8	-70.5	0	0	112.6	S17 F18 R19 H23 R24	S17-M21 WeakPolarHBondContact O-CB 3.47Å; S17-M21 PolarHBondContact O-N 3.07Å; F18-M21 CarbonylContact O-C 3.59Å; F18-M21 WeakPolarHBondContact O-CA 3.32Å; F18-M21 VanDerWaalsContact O-CB 3.32Å; F18-M21 WeakPolarHBondContact O-CB 3.38Å; F18-M21 PolarHBondContact O-N 2.91Å; R19-M21 VanDerWaalsContact C-N 3.31Å; R19-M21 PolarHBondContact O-N 3.08Å; M21-H23 VanDerWaalsContact C-N 3.34Å; M21-H23 PolarHBondContact O-N 3.48Å; M21-R24 PolarHBondContact O-N 3.1Å
22	F	73.9	Confident	81.9	Confident	167 Å²	167	111.1 Å²	111.1	73%	0.732	52%	0.515	S	S	*	.	H	α-helix	trans	-66.5	-32.6	179.5	-77.9	-70.7	0	0	0	113.2	F18 R19	F18-F22 HydrophobicContact CB-CD2 4.39Å; F18-F22 HydrophobicContact CB-CE2 4.32Å; F18-F22 HydrophobicContact CD1-CE2 4.15Å; F18-F22 WeakPolarHBondContact O-CD2 3.44Å; F18-F22 PolarHBondContact O-N 3.33Å; R19-F22 PolarHBondContact O-N 3.21Å
23	H	70.3	Confident	82.4	Confident	150 Å²	150	107.7 Å²	107.7	69%	0.694	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	3.5	177.3	-66.6	-63.5	0	0	0	114.1	R19 V20 M21 K25	R19-H23 PolarHBondContact O-CD2 3.38Å; R19-H23 PolarHBondContact O-N 3.35Å; R19-H23 VanDerWaalsContact O-N 3.09Å; V20-H23 PolarHBondContact O-N 3Å; M21-H23 VanDerWaalsContact C-N 3.34Å; M21-H23 PolarHBondContact O-N 3.48Å; H23-K25 PolarHBondContact O-N 3.11Å
24	R	70.6	Confident	82.8	Confident	142 Å²	142	109 Å²	109	54%	0.536	50%	0.503	S	S	.	.	S	Bend	trans	-66.4	123.8	172.3	-62.8	-163.6	175.7	156.8	-1.7	108.8	V20 M21 R26	V20-R24 WeakPolarHBondContact O-CG 3.3Å; V20-R24 PolarHBondContact O-N 3.45Å; V20-R24 VanDerWaalsContact O-N 3.08Å; M21-R24 PolarHBondContact O-N 3.1Å; R24-R26 PolarHBondContact O-N 2.89Å
25	K	78.5	Confident	83.1	Confident	168 Å²	168	108.6 Å²	108.6	73%	0.73	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-58.5	133.3	169.9	-68.3	-175.1	177	-173	0	108.8	H23 P43	H23-K25 PolarHBondContact O-N 3.11Å; K25-P43 HydrophobicContact CB-CG 3.68Å; K25-P43 HydrophobicContact CD-CG 4.13Å; K25-P43 HydrophobicContact CG-CG 4.39Å
26	R	82.6	Confident	83.4	Confident	224 Å²	224	103.7 Å²	103.7	85%	0.845	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-60.4	146.2	178.5	-67.7	-71.9	-178.3	166.3	-1	110.2	R24 R28	R24-R26 PolarHBondContact O-N 2.89Å; R26-R28 PolarHBondContact O-N 3.28Å
27	P	88.4	Confident	84	Confident	53 Å²	53	99.8 Å²	99.8	34%	0.344	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-58.9	136.8	171	26	-33.3	0	0	0	109.8	F40 A42 F60	P27-F40 HydrophobicContact CB-CB 4.22Å; P27-F40 HydrophobicContact CB-CD1 4.35Å; P27-A42 HydrophobicContact CB-CB 4.2Å; P27-F60 HydrophobicContact CB-CE1 3.93Å; P27-F60 HydrophobicContact CB-CZ 3.69Å; P27-F60 HydrophobicContact CG-CZ 4.04Å
28	R	92.5	Very high	84.8	Confident	190 Å²	190	99.8 Å²	99.8	72%	0.717	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.8	176.8	175.9	-179.9	174.1	-175.8	0.5	109.4	R26 V30 F40 E41	R26-R28 PolarHBondContact O-N 3.28Å; R28-V30 PolarHBondContact O-N 3.4Å; R28-F40 CarbonylContact O-C 3.5Å; R28-F40 VanDerWaalsContact O-CA 3.24Å; R28-F40 WeakPolarHBondContact O-CA 3.07Å; R28-E41 PolarHBondContact N-O 3.3Å; R28-E41 PolarHBondContact O-N 3.03Å
29	L	94.2	Very high	85.4	Confident	83 Å²	83	94.7 Å²	94.7	44%	0.435	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	123.1	167.3	-178.9	68.6	0	0	0	108.9	R38 F40	L29-R38 HydrophobicContact CD1-CB 3.94Å; L29-F40 HydrophobicContact CB-CD1 4.19Å; L29-F40 HydrophobicContact CB-CE1 3.86Å; L29-F40 HydrophobicContact CD1-CD1 4.3Å; L29-F40 HydrophobicContact CD1-CE1 3.78Å; L29-F40 HydrophobicContact CD1-CE2 4.22Å; L29-F40 HydrophobicContact CD1-CZ 3.73Å; L29-F40 HydrophobicContact CG-CE1 4.42Å
30	V	94.4	Very high	86.2	Confident	38 Å²	38	89.6 Å²	89.6	23%	0.23	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-42.9	-176.1	178.9	0	0	0	0	111.1	R28 Y39 E41 W87 W90 P98	R28-V30 PolarHBondContact O-N 3.4Å; V30-Y39 PolarHBondContact N-O 3.06Å; V30-E41 HydrophobicContact CG2-CB 3.58Å; V30-W87 HydrophobicContact CG1-CH2 4.27Å; V30-W87 HydrophobicContact CG1-CZ3 4.25Å; V30-W90 HydrophobicContact CB-CH2 4.02Å; V30-W90 HydrophobicContact CB-CZ2 4.28Å; V30-W90 HydrophobicContact CG1-CH2 4.13Å; V30-W90 HydrophobicContact CG1-CZ2 3.98Å; V30-W90 HydrophobicContact CG2-CH2 3.73Å; V30-W90 HydrophobicContact CG2-CZ2 3.88Å; V30-P98 HydrophobicContact CG1-CB 3.33Å; V30-P98 HydrophobicContact CG1-CG 3.51Å
31	G	94.4	Very high	87.1	Confident	17 Å²	17	89.3 Å²	89.3	18%	0.175	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	177.5	178.9	0	0	0	0	0	112.9	Y39	G31-Y39 PolarHBondContact O-N 3.34Å
32	I	93.9	Very high	87.9	Confident	103 Å²	103	84.7 Å²	84.7	53%	0.528	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	134	-179.6	-54.2	-179.4	0	0	0	107.8	N37 R38	I32-N37 VanDerWaalsContact CA-O 3.27Å; I32-N37 WeakPolarHBondContact CA-O 3.42Å; I32-R38 HydrophobicContact CD1-CG 4.36Å; I32-R38 HydrophobicContact CG1-CG 4.21Å
33	D	91.7	Very high	88.7	Confident	14 Å²	14	79.9 Å²	79.9	8%	0.075	38%	0.381	C	S	.	.			trans	-85.4	165.8	174.4	174.8	45.6	0	0	0	112	S35 G36 N37 Y39 P84	D33-S35 PolarHBondContact O-N 3.07Å; D33-S35 VanDerWaalsContact O-N 3.1Å; D33-S35 WeakPolarHBondContact OD2-CB 3.46Å; D33-S35 PolarHBondContact OD2-N 3.05Å; D33-S35 PolarHBondContact OD2-OG 3.3Å; D33-G36 WeakPolarHBondContact O-CA 3.34Å; D33-G36 PolarHBondContact O-N 3.22Å; D33-N37 HydrophobicContact CB-CB 4.39Å; D33-N37 PolarHBondContact N-O 3.5Å; D33-Y39 HydrophobicContact CB-CE2 3.73Å; D33-P84 HydrophobicContact CB-CG 4.27Å; D33-P84 WeakPolarHBondContact OD1-CG 3.33Å; D33-P84 WeakPolarHBondContact OD2-CD 3.27Å; D33-P84 WeakPolarHBondContact OD2-CG 3.19Å
34	K	89.4	Confident	89.6	Confident	158 Å²	158	74.7 Å²	74.7	69%	0.687	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.6	174.3	-62.9	-174.3	178	-176.1	0	113.2	G36	K34-G36 PolarHBondContact O-N 3.28Å
35	S	89.3	Confident	90.3	Very high	71 Å²	71	70.5 Å²	70.5	50%	0.497	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-5.7	175.1	-46.4	0	0	0	0	113.9	D33	D33-S35 PolarHBondContact O-N 3.07Å; D33-S35 VanDerWaalsContact O-N 3.1Å; D33-S35 WeakPolarHBondContact OD2-CB 3.46Å; D33-S35 PolarHBondContact OD2-N 3.05Å; D33-S35 PolarHBondContact OD2-OG 3.3Å
36	G	90.1	Very high	90.5	Very high	28 Å²	28	71 Å²	71	29%	0.289	35%	0.351	S	S	.	.			trans	83.9	6.4	-174.7	0	0	0	0	0	114.6	D33 K34 R38	D33-G36 WeakPolarHBondContact O-CA 3.34Å; D33-G36 PolarHBondContact O-N 3.22Å; K34-G36 PolarHBondContact O-N 3.28Å; G36-R38 PolarHBondContact O-N 3.21Å
37	N	91.1	Very high	90.5	Very high	4 Å²	4	64.3 Å²	64.3	2%	0.021	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-68.4	128.6	176.6	-67.6	-26.9	0	0	0	110.2	I32 D33 Y39 F61 P64	I32-N37 VanDerWaalsContact CA-O 3.27Å; I32-N37 WeakPolarHBondContact CA-O 3.42Å; D33-N37 HydrophobicContact CB-CB 4.39Å; D33-N37 PolarHBondContact N-O 3.5Å; N37-Y39 HydrophobicContact CB-CE2 3.9Å; N37-Y39 WeakPolarHBondContact O-CD2 3.37Å; N37-Y39 WeakPolarHBondContact O-CE2 3.28Å; N37-F61 HydrophobicContact CB-CD2 4.43Å; N37-P64 WeakPolarHBondContact OD1-CD 3.47Å
38	R	92.1	Very high	90.1	Very high	74 Å²	74	62.8 Å²	62.8	28%	0.279	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.7	-178.1	-61.8	-175.9	-66.1	174.7	-3.9	110.5	L29 I32 G36 F40 F61 L62 Q66	L29-R38 HydrophobicContact CD1-CB 3.94Å; I32-R38 HydrophobicContact CD1-CG 4.36Å; I32-R38 HydrophobicContact CG1-CG 4.21Å; G36-R38 PolarHBondContact O-N 3.21Å; R38-F40 HydrophobicContact CB-CE2 3.64Å; R38-F40 HydrophobicContact CB-CZ 4.09Å; R38-F40 WeakPolarHBondContact O-CD2 3.36Å; R38-F61 CarbonylContact O-C 3.44Å; R38-F61 WeakPolarHBondContact O-CA 3.35Å; R38-F61 WeakPolarHBondContact O-CB 3.48Å; R38-L62 PolarHBondContact N-O 3.33Å; R38-L62 PolarHBondContact O-N 3.43Å; R38-Q66 PolarHBondContact NH2-O 2.7Å
39	Y	93.1	Very high	89.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.6	-176.1	-63.9	-90.3	0	0	0	111.5	V30 G31 D33 N37 F61 I83 W87 W90 L91	V30-Y39 PolarHBondContact N-O 3.06Å; G31-Y39 PolarHBondContact O-N 3.34Å; D33-Y39 HydrophobicContact CB-CE2 3.73Å; N37-Y39 HydrophobicContact CB-CE2 3.9Å; N37-Y39 WeakPolarHBondContact O-CD2 3.37Å; N37-Y39 WeakPolarHBondContact O-CE2 3.28Å; Y39-F61 HydrophobicContact CD1-CB 3.57Å; Y39-F61 HydrophobicContact CE1-CB 3.68Å; Y39-F61 HydrophobicContact CE1-CG 4.19Å; Y39-F61 HydrophobicContact CG-CB 4.23Å; Y39-I83 HydrophobicContact CE1-CG2 4.36Å; Y39-W87 VanDerWaalsContact CB-CZ3 3.41Å; Y39-W87 HydrophobicContact CD1-CB 4.26Å; Y39-W87 AromaticContact CD1-CD2 3.87Å; Y39-W87 HydrophobicContact CD1-CD2 3.87Å; Y39-W87 AromaticContact CD1-CE3 3.44Å; Y39-W87 HydrophobicContact CD1-CE3 3.44Å; Y39-W87 VanDerWaalsContact CD1-CE3 3.44Å; Y39-W87 HydrophobicContact CD1-CG 4.24Å; Y39-W87 HydrophobicContact CD1-CZ3 4.08Å; Y39-W87 AromaticContact CD2-CD2 3.5Å; Y39-W87 HydrophobicContact CD2-CD2 3.5Å; Y39-W87 AromaticContact CD2-CE2 3.64Å; Y39-W87 AromaticContact CD2-CE3 3.58Å; Y39-W87 HydrophobicContact CD2-CE3 3.58Å; Y39-W87 HydrophobicContact CD2-CG 4.12Å; Y39-W87 AromaticContact CD2-CH2 3.96Å; Y39-W87 HydrophobicContact CD2-CH2 3.96Å; Y39-W87 AromaticContact CD2-CZ2 3.88Å; Y39-W87 HydrophobicContact CD2-CZ2 3.88Å; Y39-W87 AromaticContact CD2-CZ3 3.81Å; Y39-W87 HydrophobicContact CD2-CZ3 3.81Å; Y39-W87 HydrophobicContact CE1-CB 3.53Å; Y39-W87 AromaticContact CE1-CD2 3.87Å; Y39-W87 HydrophobicContact CE1-CD2 3.87Å; Y39-W87 AromaticContact CE1-CE3 3.91Å; Y39-W87 HydrophobicContact CE1-CE3 3.91Å; Y39-W87 AromaticContact CE1-CG 3.75Å; Y39-W87 HydrophobicContact CE1-CG 3.75Å; Y39-W87 HydrophobicContact CE2-CB 4.26Å; Y39-W87 AromaticContact CE2-CD1 3.83Å; Y39-W87 AromaticContact CE2-CD2 3.51Å; Y39-W87 HydrophobicContact CE2-CD2 3.51Å; Y39-W87 AromaticContact CE2-CE2 3.69Å; Y39-W87 HydrophobicContact CE2-CE3 4.02Å; Y39-W87 AromaticContact CE2-CG 3.62Å; Y39-W87 HydrophobicContact CE2-CG 3.62Å; Y39-W87 HydrophobicContact CE2-CZ2 4.35Å; Y39-W87 AromaticContact CE2-NE1 3.86Å; Y39-W87 AromaticContact CG-CD2 3.69Å; Y39-W87 HydrophobicContact CG-CD2 3.69Å; Y39-W87 AromaticContact CG-CE3 3.26Å; Y39-W87 HydrophobicContact CG-CE3 3.26Å; Y39-W87 HydrophobicContact CG-CG 4.41Å; Y39-W87 HydrophobicContact CG-CH2 4.07Å; Y39-W87 HydrophobicContact CG-CZ2 4.41Å; Y39-W87 AromaticContact CG-CZ3 3.48Å; Y39-W87 HydrophobicContact CG-CZ3 3.48Å; Y39-W87 VanDerWaalsContact CG-CZ3 3.48Å; Y39-W87 AromaticContact CZ-CD1 3.86Å; Y39-W87 AromaticContact CZ-CD2 3.68Å; Y39-W87 AromaticContact CZ-CG 3.38Å; Y39-W90 HydrophobicContact CD1-CZ3 4.41Å; Y39-L91 HydrophobicContact CD1-CD1 4.2Å; Y39-L91 HydrophobicContact CD1-CD2 4.24Å; Y39-L91 HydrophobicContact CD1-CG 4.28Å; Y39-L91 HydrophobicContact CE1-CD1 3.91Å; Y39-L91 HydrophobicContact CE1-CG 4.41Å
40	F	93.4	Very high	89	Confident	26 Å²	26	64 Å²	64	11%	0.114	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.1	-174.7	-65.3	-88.6	0	0	0	112.1	P27 R28 L29 R38 R59 F60 L62	P27-F40 HydrophobicContact CB-CB 4.22Å; P27-F40 HydrophobicContact CB-CD1 4.35Å; R28-F40 CarbonylContact O-C 3.5Å; R28-F40 VanDerWaalsContact O-CA 3.24Å; R28-F40 WeakPolarHBondContact O-CA 3.07Å; L29-F40 HydrophobicContact CB-CD1 4.19Å; L29-F40 HydrophobicContact CB-CE1 3.86Å; L29-F40 HydrophobicContact CD1-CD1 4.3Å; L29-F40 HydrophobicContact CD1-CE1 3.78Å; L29-F40 HydrophobicContact CD1-CE2 4.22Å; L29-F40 HydrophobicContact CD1-CZ 3.73Å; L29-F40 HydrophobicContact CG-CE1 4.42Å; R38-F40 HydrophobicContact CB-CE2 3.64Å; R38-F40 HydrophobicContact CB-CZ 4.09Å; R38-F40 WeakPolarHBondContact O-CD2 3.36Å; F40-R59 WeakPolarHBondContact O-CA 3.09Å; F40-F60 HydrophobicContact CB-CD1 4.24Å; F40-F60 HydrophobicContact CB-CD2 4.19Å; F40-F60 HydrophobicContact CB-CE1 3.76Å; F40-F60 HydrophobicContact CB-CE2 3.69Å; F40-F60 HydrophobicContact CB-CG 4.43Å; F40-F60 HydrophobicContact CB-CZ 3.45Å; F40-F60 VanDerWaalsContact CB-CZ 3.45Å; F40-F60 HydrophobicContact CD2-CD2 4.34Å; F40-F60 AromaticContact CD2-CE2 3.85Å; F40-F60 HydrophobicContact CD2-CE2 3.85Å; F40-F60 HydrophobicContact CD2-CZ 4.37Å; F40-F60 AromaticContact CG-CE2 3.93Å; F40-F60 HydrophobicContact CG-CE2 3.93Å; F40-F60 AromaticContact CG-CZ 3.98Å; F40-F60 HydrophobicContact CG-CZ 3.98Å; F40-F60 PolarHBondContact N-O 3.16Å; F40-F60 PolarHBondContact O-N 3.26Å; F40-F60 VanDerWaalsContact O-N 3.12Å; F40-L62 HydrophobicContact CD2-CD1 4.42Å; F40-L62 HydrophobicContact CD2-CG 4.3Å; F40-L62 HydrophobicContact CE2-CB 4.29Å; F40-L62 HydrophobicContact CE2-CD1 3.72Å; F40-L62 HydrophobicContact CE2-CG 3.91Å; F40-L62 HydrophobicContact CZ-CD1 4.29Å
41	E	92.4	Very high	88.4	Confident	52 Å²	52	66.2 Å²	66.2	24%	0.243	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	124.5	172.3	-173.1	169.6	-140.4	0	0	109.8	R28 V30 P57 K58 R59 W90	R28-E41 PolarHBondContact N-O 3.3Å; R28-E41 PolarHBondContact O-N 3.03Å; V30-E41 HydrophobicContact CG2-CB 3.58Å; E41-P57 HydrophobicContact CG-CB 3.79Å; E41-P57 HydrophobicContact CG-CG 4.43Å; E41-P57 WeakPolarHBondContact OE1-CB 3.43Å; E41-P57 WeakPolarHBondContact OE1-CG 3.38Å; E41-K58 WeakPolarHBondContact CA-O 3.47Å; E41-R59 HydrophobicContact CG-CG 4.32Å; E41-R59 IonicContact OE1-CZ 2.93Å; E41-R59 IonicContact OE1-NE 2.7Å; E41-R59 PolarHBondContact OE1-NE 2.92Å; E41-R59 IonicContact OE1-NH2 2.67Å; E41-R59 PolarHBondContact OE1-NH2 2.91Å; E41-W90 HydrophobicContact CB-CH2 3.99Å; E41-W90 HydrophobicContact CB-CZ2 3.93Å; E41-W90 HydrophobicContact CG-CZ2 4.35Å
42	A	90.4	Very high	87.5	Confident	17 Å²	17	71.1 Å²	71.1	14%	0.14	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.3	171.5	0	0	0	0	0	109.7	P27 P57 K58	P27-A42 HydrophobicContact CB-CB 4.2Å; A42-P57 CarbonylContact O-C 3.58Å; A42-P57 VanDerWaalsContact O-CA 3.27Å; A42-P57 WeakPolarHBondContact O-CA 3.35Å; A42-P57 WeakPolarHBondContact O-CB 3.49Å; A42-K58 HydrophobicContact CB-CB 4.31Å; A42-K58 PolarHBondContact N-O 3.48Å; A42-K58 PolarHBondContact O-N 3Å
43	P	90.3	Very high	86.8	Confident	65 Å²	65	69.5 Å²	69.5	42%	0.422	37%	0.369	S	S	.	.			trans	-61.5	151.8	178.2	24.7	-31.6	0	0	0	111.3	K25	K25-P43 HydrophobicContact CB-CG 3.68Å; K25-P43 HydrophobicContact CD-CG 4.13Å; K25-P43 HydrophobicContact CG-CG 4.39Å
44	P	88.5	Confident	86.4	Confident	41 Å²	41	70.1 Å²	70.1	27%	0.266	38%	0.375	S	S	.	.			trans	-57.5	142	179.8	21.6	-32	0	0	0	111.4	K46 S54 L56	P44-K46 VanDerWaalsContact C-N 3.33Å; P44-K46 PolarHBondContact O-N 3.16Å; P44-S54 WeakPolarHBondContact CB-O 3.35Å; P44-L56 WeakPolarHBondContact CB-O 3.43Å
45	N	84.9	Confident	86.3	Confident	54 Å²	54	70 Å²	70	29%	0.289	38%	0.375	S	S	.	.			trans	-80.3	83.6	172.3	-178.5	10.5	0	0	0	109.5	A47 S48 L53 S54	N45-A47 PolarHBondContact O-N 2.81Å; N45-A47 PolarHBondContact OD1-N 2.89Å; N45-S48 WeakPolarHBondContact O-CB 3.46Å; N45-S48 PolarHBondContact O-N 3.37Å; N45-S48 PolarHBondContact O-OG 3.15Å; N45-L53 PolarHBondContact N-O 3.11Å; N45-S54 VanDerWaalsContact O-CA 3.23Å; N45-S54 WeakPolarHBondContact O-CA 3.41Å; N45-S54 WeakPolarHBondContact O-CB 3.44Å
46	K	83.1	Confident	86.2	Confident	180 Å²	180	70.6 Å²	70.6	78%	0.783	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.5	179.1	-62.2	-173.3	179.2	-173	0	114.2	P44	P44-K46 VanDerWaalsContact C-N 3.33Å; P44-K46 PolarHBondContact O-N 3.16Å
47	A	82.6	Confident	86.3	Confident	83 Å²	83	70.5 Å²	70.5	69%	0.686	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-4.8	178.7	0	0	0	0	0	113.9	N45	N45-A47 PolarHBondContact O-N 2.81Å; N45-A47 PolarHBondContact OD1-N 2.89Å
48	S	79.8	Confident	86.2	Confident	20 Å²	20	74.2 Å²	74.2	14%	0.14	38%	0.382	C	S	.	.			trans	-77.4	140.2	176.3	58.9	0	0	0	0	111.6	N45 H50 L53 S54	N45-S48 WeakPolarHBondContact O-CB 3.46Å; N45-S48 PolarHBondContact O-N 3.37Å; N45-S48 PolarHBondContact O-OG 3.15Å; S48-H50 VanDerWaalsContact C-N 3.28Å; S48-H50 PolarHBondContact OG-O 3.08Å; S48-L53 VanDerWaalsContact OG-C 3.31Å; S48-L53 WeakPolarHBondContact OG-CB 3.37Å; S48-S54 WeakPolarHBondContact O-CB 3.38Å; S48-S54 WeakPolarHBondContact OG-CB 3.37Å; S48-S54 PolarHBondContact OG-N 3.01Å
49	E	83.1	Confident	86.1	Confident	184 Å²	184	72 Å²	72	86%	0.86	37%	0.374	S	S	*	.	S	Bend	trans	-68.8	-31.2	173	-174	176.2	177.6	0	0	111.5	T51	E49-T51 PolarHBondContact O-N 3.26Å
50	H	80.6	Confident	85.9	Confident	115 Å²	115	73 Å²	73	53%	0.532	38%	0.378	S	S	.	.	S	Bend	trans	-70.5	116.1	178.9	-57.7	-56.7	0	0	0	111.4	S48 H52 L53 S54	S48-H50 VanDerWaalsContact C-N 3.28Å; S48-H50 PolarHBondContact OG-O 3.08Å; H50-H52 VanDerWaalsContact C-N 3.26Å; H50-H52 PolarHBondContact O-N 2.99Å; H50-H52 VanDerWaalsContact O-N 3.16Å; H50-L53 HydrophobicContact CB-CB 4.35Å; H50-L53 HydrophobicContact CB-CD1 4.09Å; H50-L53 HydrophobicContact CB-CG 4.18Å; H50-L53 PolarHBondContact O-N 3.33Å; H50-S54 PolarHBondContact O-N 3.28Å; H50-S54 PolarHBondContact O-OG 3.01Å
51	T	82.2	Confident	85.8	Confident	84 Å²	84	72 Å²	72	52%	0.515	37%	0.374	S	S	.	.	H	α-helix	trans	-53.7	-38.3	-175.8	-67.1	0	0	0	0	113.6	E49 S54 K55	E49-T51 PolarHBondContact O-N 3.26Å; T51-S54 WeakPolarHBondContact CA-OG 3.47Å; T51-S54 PolarHBondContact O-N 3.4Å; T51-S54 PolarHBondContact O-OG 2.8Å; T51-K55 HydrophobicContact CG2-CD 3.63Å; T51-K55 HydrophobicContact CG2-CG 4.32Å; T51-K55 WeakPolarHBondContact O-CB 3.44Å; T51-K55 WeakPolarHBondContact O-CG 3.41Å; T51-K55 PolarHBondContact O-N 3.01Å; T51-K55 VanDerWaalsContact O-N 3.11Å
52	H	76.6	Confident	85.6	Confident	120 Å²	120	70 Å²	70	56%	0.556	36%	0.364	S	S	*	.	H	α-helix	trans	-69.5	-36.5	179.9	65.2	-88.5	0	0	0	112.2	H50 L56	H50-H52 VanDerWaalsContact C-N 3.26Å; H50-H52 PolarHBondContact O-N 2.99Å; H50-H52 VanDerWaalsContact O-N 3.16Å; H52-L56 WeakPolarHBondContact O-CB 3.5Å; H52-L56 PolarHBondContact O-N 3.28Å
53	L	77.3	Confident	85.5	Confident	69 Å²	69	71.7 Å²	71.7	36%	0.361	37%	0.37	S	S	.	.	H	α-helix	trans	-76.7	-26.7	177.8	-63	179.6	0	0	0	112.8	N45 S48 H50	N45-L53 PolarHBondContact N-O 3.11Å; S48-L53 VanDerWaalsContact OG-C 3.31Å; S48-L53 WeakPolarHBondContact OG-CB 3.37Å; H50-L53 HydrophobicContact CB-CB 4.35Å; H50-L53 HydrophobicContact CB-CD1 4.09Å; H50-L53 HydrophobicContact CB-CG 4.18Å; H50-L53 PolarHBondContact O-N 3.33Å
54	S	83.4	Confident	85.4	Confident	28 Å²	28	72.5 Å²	72.5	20%	0.196	38%	0.375	C	S	.	.	H	α-helix	trans	-89.4	-25.4	-177.2	62.8	0	0	0	0	114.4	P44 N45 S48 H50 T51	P44-S54 WeakPolarHBondContact CB-O 3.35Å; N45-S54 VanDerWaalsContact O-CA 3.23Å; N45-S54 WeakPolarHBondContact O-CA 3.41Å; N45-S54 WeakPolarHBondContact O-CB 3.44Å; S48-S54 WeakPolarHBondContact O-CB 3.38Å; S48-S54 WeakPolarHBondContact OG-CB 3.37Å; S48-S54 PolarHBondContact OG-N 3.01Å; H50-S54 PolarHBondContact O-N 3.28Å; H50-S54 PolarHBondContact O-OG 3.01Å; T51-S54 WeakPolarHBondContact CA-OG 3.47Å; T51-S54 PolarHBondContact O-N 3.4Å; T51-S54 PolarHBondContact O-OG 2.8Å
55	K	87.6	Confident	85.2	Confident	156 Å²	156	74.2 Å²	74.2	68%	0.678	40%	0.4	S	S	*	.	H	α-helix	trans	-97.9	-40.7	-179.6	-66	-178	-179.4	171	0	113.4	T51	T51-K55 HydrophobicContact CG2-CD 3.63Å; T51-K55 HydrophobicContact CG2-CG 4.32Å; T51-K55 WeakPolarHBondContact O-CB 3.44Å; T51-K55 WeakPolarHBondContact O-CG 3.41Å; T51-K55 PolarHBondContact O-N 3.01Å; T51-K55 VanDerWaalsContact O-N 3.11Å
56	L	88.4	Confident	85.1	Confident	82 Å²	82	73.7 Å²	73.7	43%	0.429	40%	0.396	S	S	.	.	S	Bend	trans	-101.9	141.9	-171.8	-66.5	162.3	0	0	0	111.5	P44 H52	P44-L56 WeakPolarHBondContact CB-O 3.43Å; H52-L56 WeakPolarHBondContact O-CB 3.5Å; H52-L56 PolarHBondContact O-N 3.28Å
57	P	91	Very high	84.9	Confident	27 Å²	27	71.5 Å²	71.5	18%	0.175	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-63.8	141.3	172.1	28.9	-33.9	0	0	0	110	E41 A42 R59 H93	E41-P57 HydrophobicContact CG-CB 3.79Å; E41-P57 HydrophobicContact CG-CG 4.43Å; E41-P57 WeakPolarHBondContact OE1-CB 3.43Å; E41-P57 WeakPolarHBondContact OE1-CG 3.38Å; A42-P57 CarbonylContact O-C 3.58Å; A42-P57 VanDerWaalsContact O-CA 3.27Å; A42-P57 WeakPolarHBondContact O-CA 3.35Å; A42-P57 WeakPolarHBondContact O-CB 3.49Å; P57-R59 PolarHBondContact O-N 3.49Å; P57-H93 PolarHBondContact O-NE2 3.37Å
58	K	89.1	Confident	84.5	Confident	82 Å²	82	73.8 Å²	73.8	36%	0.357	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	120.3	176.1	-176.3	176.6	-177.2	175.5	0	108.8	E41 A42 F60 H73	E41-K58 WeakPolarHBondContact CA-O 3.47Å; A42-K58 HydrophobicContact CB-CB 4.31Å; A42-K58 PolarHBondContact N-O 3.48Å; A42-K58 PolarHBondContact O-N 3Å; K58-F60 HydrophobicContact CG-CD1 4.38Å; K58-H73 PolarHBondContact NZ-CE1 3.28Å; K58-H73 PolarHBondContact NZ-NE2 2.99Å
59	R	90.6	Very high	83.8	Confident	28 Å²	28	76 Å²	76	11%	0.106	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.2	179.8	-61.7	176.1	179.6	174.2	-4.6	109.5	F40 E41 P57 W90 L91 R95 S96	F40-R59 WeakPolarHBondContact O-CA 3.09Å; E41-R59 HydrophobicContact CG-CG 4.32Å; E41-R59 IonicContact OE1-CZ 2.93Å; E41-R59 IonicContact OE1-NE 2.7Å; E41-R59 PolarHBondContact OE1-NE 2.92Å; E41-R59 IonicContact OE1-NH2 2.67Å; E41-R59 PolarHBondContact OE1-NH2 2.91Å; P57-R59 PolarHBondContact O-N 3.49Å; R59-W90 HydrophobicContact CB-CH2 4.25Å; R59-W90 HydrophobicContact CB-CZ3 4.2Å; R59-W90 WeakPolarHBondContact CD-O 3.42Å; R59-W90 HydrophobicContact CG-CH2 4.02Å; R59-W90 HydrophobicContact CG-CZ2 4Å; R59-W90 HydrophobicContact CG-CZ3 4.37Å; R59-W90 PolarHBondContact NH1-O 3.32Å; R59-L91 HydrophobicContact CB-CD2 3.94Å; R59-R95 PolarHBondContact NH1-O 3.03Å; R59-S96 PolarHBondContact NH2-O 2.63Å
60	F	89.6	Confident	82.7	Confident	19 Å²	19	75 Å²	75	8%	0.083	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	167.6	-179.9	63.6	-84.1	0	0	0	110.1	P27 F40 K58 L69	P27-F60 HydrophobicContact CB-CE1 3.93Å; P27-F60 HydrophobicContact CB-CZ 3.69Å; P27-F60 HydrophobicContact CG-CZ 4.04Å; F40-F60 HydrophobicContact CB-CD1 4.24Å; F40-F60 HydrophobicContact CB-CD2 4.19Å; F40-F60 HydrophobicContact CB-CE1 3.76Å; F40-F60 HydrophobicContact CB-CE2 3.69Å; F40-F60 HydrophobicContact CB-CG 4.43Å; F40-F60 HydrophobicContact CB-CZ 3.45Å; F40-F60 VanDerWaalsContact CB-CZ 3.45Å; F40-F60 HydrophobicContact CD2-CD2 4.34Å; F40-F60 AromaticContact CD2-CE2 3.85Å; F40-F60 HydrophobicContact CD2-CE2 3.85Å; F40-F60 HydrophobicContact CD2-CZ 4.37Å; F40-F60 AromaticContact CG-CE2 3.93Å; F40-F60 HydrophobicContact CG-CE2 3.93Å; F40-F60 AromaticContact CG-CZ 3.98Å; F40-F60 HydrophobicContact CG-CZ 3.98Å; F40-F60 PolarHBondContact N-O 3.16Å; F40-F60 PolarHBondContact O-N 3.26Å; F40-F60 VanDerWaalsContact O-N 3.12Å; K58-F60 HydrophobicContact CG-CD1 4.38Å; F60-L69 HydrophobicContact CD2-CD1 4.32Å; F60-L69 HydrophobicContact CD2-CG 4.4Å; F60-L69 HydrophobicContact CE1-CD1 3.95Å; F60-L69 HydrophobicContact CE2-CD1 3.56Å; F60-L69 HydrophobicContact CE2-CG 4.01Å; F60-L69 HydrophobicContact CZ-CD1 3.34Å; F60-L69 HydrophobicContact CZ-CG 4.26Å
61	F	90.4	Very high	81.3	Confident	6 Å²	6	72.4 Å²	72.4	3%	0.026	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	159.2	176	74.7	-80.1	0	0	0	111.2	N37 R38 Y39 M63 S72 N75 I83 L91	N37-F61 HydrophobicContact CB-CD2 4.43Å; R38-F61 CarbonylContact O-C 3.44Å; R38-F61 WeakPolarHBondContact O-CA 3.35Å; R38-F61 WeakPolarHBondContact O-CB 3.48Å; Y39-F61 HydrophobicContact CD1-CB 3.57Å; Y39-F61 HydrophobicContact CE1-CB 3.68Å; Y39-F61 HydrophobicContact CE1-CG 4.19Å; Y39-F61 HydrophobicContact CG-CB 4.23Å; F61-M63 HydrophobicContact CE2-CG 4.07Å; F61-S72 PolarHBondContact O-OG 2.73Å; F61-N75 HydrophobicContact CE1-CB 4.04Å; F61-N75 HydrophobicContact CZ-CB 3.94Å; F61-I83 HydrophobicContact CD1-CD1 4.05Å; F61-I83 HydrophobicContact CE1-CD1 3.31Å; F61-I83 HydrophobicContact CE1-CG1 4.19Å; F61-I83 HydrophobicContact CE2-CD1 4.36Å; F61-I83 HydrophobicContact CE2-CG1 4.4Å; F61-I83 HydrophobicContact CZ-CD1 3.5Å; F61-I83 VanDerWaalsContact CZ-CD1 3.5Å; F61-I83 HydrophobicContact CZ-CG1 3.96Å; F61-L91 HydrophobicContact CD1-CD1 3.73Å; F61-L91 HydrophobicContact CE1-CD1 4.37Å
62	L	89	Confident	79.9	Confident	10 Å²	10	69 Å²	69	5%	0.052	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.5	170.9	-62	178.8	0	0	0	108.5	R38 F40 Q66	R38-L62 PolarHBondContact N-O 3.33Å; R38-L62 PolarHBondContact O-N 3.43Å; F40-L62 HydrophobicContact CD2-CD1 4.42Å; F40-L62 HydrophobicContact CD2-CG 4.3Å; F40-L62 HydrophobicContact CE2-CB 4.29Å; F40-L62 HydrophobicContact CE2-CD1 3.72Å; F40-L62 HydrophobicContact CE2-CG 3.91Å; F40-L62 HydrophobicContact CZ-CD1 4.29Å; L62-Q66 HydrophobicContact CB-CB 4.33Å; L62-Q66 HydrophobicContact CD2-CB 4.5Å
63	M	87.9	Confident	78.7	Confident	53 Å²	53	69.5 Å²	69.5	26%	0.261	37%	0.371	S	S	.	.			trans	-67.7	157.5	171.2	-61.9	177.7	81.2	0	0	110.5	F61 G65 Q66 E79	F61-M63 HydrophobicContact CE2-CG 4.07Å; M63-G65 PolarHBondContact O-N 2.96Å; M63-Q66 HydrophobicContact CB-CG 4.1Å; M63-Q66 WeakPolarHBondContact O-CB 3.48Å; M63-Q66 PolarHBondContact O-N 2.67Å; M63-E79 VanDerWaalsContact CE-OE1 3.29Å; M63-E79 WeakPolarHBondContact CE-OE1 2.88Å
64	P	87.1	Confident	77.4	Confident	81 Å²	81	68.8 Å²	68.8	53%	0.526	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	131.6	168.2	24.1	-34.6	0	0	0	110.4	N37	N37-P64 WeakPolarHBondContact OD1-CD 3.47Å
65	G	86	Confident	75.9	Confident	77 Å²	77	68.7 Å²	68.7	79%	0.794	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-16.3	-176.6	0	0	0	0	0	115.4	M63	M63-G65 PolarHBondContact O-N 2.96Å
66	Q	82.2	Confident	74.2	Confident	43 Å²	43	66.3 Å²	66.3	20%	0.201	37%	0.372	C	S	.	.			trans	-85.3	124.1	173.6	-67	180	-28.3	0	0	110.8	R38 L62 M63	R38-Q66 PolarHBondContact NH2-O 2.7Å; L62-Q66 HydrophobicContact CB-CB 4.33Å; L62-Q66 HydrophobicContact CD2-CB 4.5Å; M63-Q66 HydrophobicContact CB-CG 4.1Å; M63-Q66 WeakPolarHBondContact O-CB 3.48Å; M63-Q66 PolarHBondContact O-N 2.67Å
67	N	78	Confident	72.8	Confident	135 Å²	135	69.1 Å²	69.1	72%	0.722	39%	0.388	S	S	*	.			trans	-106.6	-23.3	177.6	-68.7	-31.7	0	0	0	113.4
68	E	73.9	Confident	71.1	Confident	131 Å²	131	74.1 Å²	74.1	61%	0.612	42%	0.417	S	S	*	.			trans	-107.7	145	-172.5	-68.3	-177.8	173.8	0	0	112.3	E70	E68-E70 VanDerWaalsContact C-N 3.27Å; E68-E70 PolarHBondContact O-N 2.88Å
69	L	66.1	Low	69.9	Low	67 Å²	67	72.5 Å²	72.5	35%	0.351	41%	0.411	S	S	.	.	S	Bend	trans	-74.7	-19.6	-178.1	-156.6	144.9	0	0	0	112.1	F60 S71 S72	F60-L69 HydrophobicContact CD2-CD1 4.32Å; F60-L69 HydrophobicContact CD2-CG 4.4Å; F60-L69 HydrophobicContact CE1-CD1 3.95Å; F60-L69 HydrophobicContact CE2-CD1 3.56Å; F60-L69 HydrophobicContact CE2-CG 4.01Å; F60-L69 HydrophobicContact CZ-CD1 3.34Å; F60-L69 HydrophobicContact CZ-CG 4.26Å; L69-S71 PolarHBondContact O-N 3.33Å; L69-S72 VanDerWaalsContact O-CB 3.3Å; L69-S72 WeakPolarHBondContact O-CB 3.34Å; L69-S72 PolarHBondContact O-N 3.08Å
70	E	60.5	Low	68.7	Low	163 Å²	163	74.3 Å²	74.3	76%	0.762	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-59.2	-37.5	179.3	-166.7	163.8	-176.1	0	0	111.3	E68 S72	E68-E70 VanDerWaalsContact C-N 3.27Å; E68-E70 PolarHBondContact O-N 2.88Å; E70-S72 PolarHBondContact O-N 3.13Å
71	S	50.6	Low	67.8	Low	60 Å²	60	79.6 Å²	79.6	42%	0.42	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-71.9	-8.2	174.4	-46.6	0	0	0	0	114.5	L69 N75	L69-S71 PolarHBondContact O-N 3.33Å; S71-N75 PolarHBondContact O-ND2 3.46Å; S71-N75 PolarHBondContact O-OD1 3.09Å
72	S	52.4	Low	67.3	Low	11 Å²	11	82 Å²	82	8%	0.077	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-95.4	-27.4	-174.4	-169.3	0	0	0	0	113.5	F61 L69 E70 G74 N75	F61-S72 PolarHBondContact O-OG 2.73Å; L69-S72 VanDerWaalsContact O-CB 3.3Å; L69-S72 WeakPolarHBondContact O-CB 3.34Å; L69-S72 PolarHBondContact O-N 3.08Å; E70-S72 PolarHBondContact O-N 3.13Å; S72-G74 PolarHBondContact O-N 2.96Å; S72-G74 VanDerWaalsContact O-N 3.11Å; S72-N75 PolarHBondContact O-N 3.42Å; S72-N75 VanDerWaalsContact O-N 3.08Å
73	H	51.2	Low	67.2	Low	132 Å²	132	82.2 Å²	82.2	61%	0.611	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.9	-175.1	-87.8	104.5	0	0	0	114	K58	K58-H73 PolarHBondContact NZ-CE1 3.28Å; K58-H73 PolarHBondContact NZ-NE2 2.99Å
74	G	49.4	Very low	67.4	Low	54 Å²	54	80.7 Å²	80.7	56%	0.557	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-6.9	178	0	0	0	0	0	115.2	S72 L76	S72-G74 PolarHBondContact O-N 2.96Å; S72-G74 VanDerWaalsContact O-N 3.11Å; G74-L76 VanDerWaalsContact C-N 3.35Å; G74-L76 PolarHBondContact O-N 3.3Å
75	N	51.9	Low	67.6	Low	25 Å²	25	81 Å²	81	13%	0.134	48%	0.476	C	S	.	.	H	α-helix	trans	-84.5	-7.6	-166.5	-61.9	-13.1	0	0	0	114	F61 S71 S72 D77	F61-N75 HydrophobicContact CE1-CB 4.04Å; F61-N75 HydrophobicContact CZ-CB 3.94Å; S71-N75 PolarHBondContact O-ND2 3.46Å; S71-N75 PolarHBondContact O-OD1 3.09Å; S72-N75 PolarHBondContact O-N 3.42Å; S72-N75 VanDerWaalsContact O-N 3.08Å; N75-D77 PolarHBondContact O-N 2.93Å
76	L	53.7	Low	68	Low	107 Å²	107	78 Å²	78	56%	0.56	44%	0.442	S	S	*	.	H	α-helix	trans	-70.2	-32.5	-173.9	-163.1	74.8	0	0	0	112.8	G74 L80	G74-L76 VanDerWaalsContact C-N 3.35Å; G74-L76 PolarHBondContact O-N 3.3Å; L76-L80 WeakPolarHBondContact O-CD1 3.19Å
77	D	58.2	Low	68.5	Low	141 Å²	141	76.3 Å²	76.3	75%	0.754	43%	0.433	S	S	*	.	H	α-helix	trans	-103.8	-26.3	-172	-69.2	-20.7	0	0	0	114	N75 L80	N75-D77 PolarHBondContact O-N 2.93Å; D77-L80 WeakPolarHBondContact O-CD1 3.15Å
78	V	54.4	Low	69.2	Low	132 Å²	132	72 Å²	72	80%	0.8	41%	0.409	S	S	*	.	H	α-helix	trans	-98.6	-29.4	-169	-175	0	0	0	0	113.1
79	E	64.3	Low	70.1	Confident	47 Å²	47	66.8 Å²	66.8	22%	0.22	39%	0.387	C	S	.	.			trans	-113.2	29.3	-171.6	-145.2	-166.3	154.5	0	0	114.4	M63 S81 S82	M63-E79 VanDerWaalsContact CE-OE1 3.29Å; M63-E79 WeakPolarHBondContact CE-OE1 2.88Å; E79-S81 PolarHBondContact O-N 2.99Å; E79-S82 PolarHBondContact O-N 3.33Å; E79-S82 VanDerWaalsContact OE1-CB 3.24Å; E79-S82 WeakPolarHBondContact OE1-CB 3.43Å; E79-S82 PolarHBondContact OE1-OG 2.98Å
80	L	66.2	Low	71.5	Confident	66 Å²	66	63.6 Å²	63.6	35%	0.346	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-62.5	-31.9	-179.2	-73.2	73.6	0	0	0	112.7	L76 D77 S82 I83 H88	L76-L80 WeakPolarHBondContact O-CD1 3.19Å; D77-L80 WeakPolarHBondContact O-CD1 3.15Å; L80-S82 PolarHBondContact O-N 3.39Å; L80-I83 PolarHBondContact O-N 3.11Å; L80-H88 VanDerWaalsContact CD2-NE2 3.34Å; L80-H88 WeakPolarHBondContact CD2-NE2 3.24Å
81	S	70.6	Confident	73	Confident	130 Å²	130	56.2 Å²	56.2	91%	0.909	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-68.7	-21.9	-176	-58.1	0	0	0	0	113.6	E79	E79-S81 PolarHBondContact O-N 2.99Å
82	S	79.4	Confident	74.8	Confident	56 Å²	56	55.4 Å²	55.4	39%	0.392	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-82.3	-23.1	-179.9	-171.5	0	0	0	0	112.1	E79 L80	E79-S82 PolarHBondContact O-N 3.33Å; E79-S82 VanDerWaalsContact OE1-CB 3.24Å; E79-S82 WeakPolarHBondContact OE1-CB 3.43Å; E79-S82 PolarHBondContact OE1-OG 2.98Å; L80-S82 PolarHBondContact O-N 3.39Å
83	I	88.3	Confident	76.7	Confident	15 Å²	15	58.1 Å²	58.1	8%	0.077	34%	0.342	C	S	.	.	S	Bend	trans	-89.6	136.1	-170.8	-56.4	167.5	0	0	0	110	Y39 F61 L80 W87 H88 L91	Y39-I83 HydrophobicContact CE1-CG2 4.36Å; F61-I83 HydrophobicContact CD1-CD1 4.05Å; F61-I83 HydrophobicContact CE1-CD1 3.31Å; F61-I83 HydrophobicContact CE1-CG1 4.19Å; F61-I83 HydrophobicContact CE2-CD1 4.36Å; F61-I83 HydrophobicContact CE2-CG1 4.4Å; F61-I83 HydrophobicContact CZ-CD1 3.5Å; F61-I83 VanDerWaalsContact CZ-CD1 3.5Å; F61-I83 HydrophobicContact CZ-CG1 3.96Å; L80-I83 PolarHBondContact O-N 3.11Å; I83-W87 HydrophobicContact CG2-CB 4.02Å; I83-H88 HydrophobicContact CG2-CB 4.1Å; I83-L91 HydrophobicContact CD1-CD1 4.35Å; I83-L91 HydrophobicContact CG2-CD1 4.46Å
84	P	91.2	Very high	78.6	Confident	21 Å²	21	59.1 Å²	59.1	14%	0.136	34%	0.34	C	S	.	.			trans	-56.8	141.7	170.9	-21	29.1	0	0	0	112.3	D33 E86 W87 H88	D33-P84 HydrophobicContact CB-CG 4.27Å; D33-P84 WeakPolarHBondContact OD1-CG 3.33Å; D33-P84 WeakPolarHBondContact OD2-CD 3.27Å; D33-P84 WeakPolarHBondContact OD2-CG 3.19Å; P84-E86 WeakPolarHBondContact CB-OE2 3.4Å; P84-E86 PolarHBondContact O-N 3.28Å; P84-E86 VanDerWaalsContact O-N 3.14Å; P84-W87 PolarHBondContact O-N 2.81Å; P84-H88 PolarHBondContact O-N 3.01Å
85	P	91.5	Very high	80.7	Confident	87 Å²	87	60.1 Å²	60.1	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-28.7	-174.8	24.4	-34.1	0	0	0	113.5	S89	P85-S89 WeakPolarHBondContact O-CB 3.47Å; P85-S89 PolarHBondContact O-N 3.43Å; P85-S89 PolarHBondContact O-OG 3Å
86	E	93.7	Very high	82.6	Confident	15 Å²	15	63.4 Å²	63.4	7%	0.07	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-50.4	177.8	-59.1	83.2	-178.7	0	0	111.4	P84 S89 W90 P99 I104 N107	P84-E86 WeakPolarHBondContact CB-OE2 3.4Å; P84-E86 PolarHBondContact O-N 3.28Å; P84-E86 VanDerWaalsContact O-N 3.14Å; E86-S89 PolarHBondContact O-N 3.4Å; E86-W90 PolarHBondContact O-N 3.46Å; E86-W90 VanDerWaalsContact O-N 3.14Å; E86-P99 HydrophobicContact CB-CB 3.71Å; E86-P99 HydrophobicContact CB-CG 4.08Å; E86-I104 HydrophobicContact CG-CG1 4.39Å; E86-N107 VanDerWaalsContact CG-ND2 3.28Å; E86-N107 WeakPolarHBondContact CG-ND2 3.48Å; E86-N107 WeakPolarHBondContact OE1-CB 3.46Å; E86-N107 PolarHBondContact OE1-ND2 3.34Å
87	W	93.8	Very high	84.6	Confident	7 Å²	7	64.2 Å²	64.2	3%	0.027	36%	0.357	C	S	.	.	H	α-helix	trans	-67.3	-40.7	177.9	-78.9	110.6	0	0	0	111.6	V30 Y39 I83 P84 S89 W90 L91 P98 P99	V30-W87 HydrophobicContact CG1-CH2 4.27Å; V30-W87 HydrophobicContact CG1-CZ3 4.25Å; Y39-W87 VanDerWaalsContact CB-CZ3 3.41Å; Y39-W87 HydrophobicContact CD1-CB 4.26Å; Y39-W87 AromaticContact CD1-CD2 3.87Å; Y39-W87 HydrophobicContact CD1-CD2 3.87Å; Y39-W87 AromaticContact CD1-CE3 3.44Å; Y39-W87 HydrophobicContact CD1-CE3 3.44Å; Y39-W87 VanDerWaalsContact CD1-CE3 3.44Å; Y39-W87 HydrophobicContact CD1-CG 4.24Å; Y39-W87 HydrophobicContact CD1-CZ3 4.08Å; Y39-W87 AromaticContact CD2-CD2 3.5Å; Y39-W87 HydrophobicContact CD2-CD2 3.5Å; Y39-W87 AromaticContact CD2-CE2 3.64Å; Y39-W87 AromaticContact CD2-CE3 3.58Å; Y39-W87 HydrophobicContact CD2-CE3 3.58Å; Y39-W87 HydrophobicContact CD2-CG 4.12Å; Y39-W87 AromaticContact CD2-CH2 3.96Å; Y39-W87 HydrophobicContact CD2-CH2 3.96Å; Y39-W87 AromaticContact CD2-CZ2 3.88Å; Y39-W87 HydrophobicContact CD2-CZ2 3.88Å; Y39-W87 AromaticContact CD2-CZ3 3.81Å; Y39-W87 HydrophobicContact CD2-CZ3 3.81Å; Y39-W87 HydrophobicContact CE1-CB 3.53Å; Y39-W87 AromaticContact CE1-CD2 3.87Å; Y39-W87 HydrophobicContact CE1-CD2 3.87Å; Y39-W87 AromaticContact CE1-CE3 3.91Å; Y39-W87 HydrophobicContact CE1-CE3 3.91Å; Y39-W87 AromaticContact CE1-CG 3.75Å; Y39-W87 HydrophobicContact CE1-CG 3.75Å; Y39-W87 HydrophobicContact CE2-CB 4.26Å; Y39-W87 AromaticContact CE2-CD1 3.83Å; Y39-W87 AromaticContact CE2-CD2 3.51Å; Y39-W87 HydrophobicContact CE2-CD2 3.51Å; Y39-W87 AromaticContact CE2-CE2 3.69Å; Y39-W87 HydrophobicContact CE2-CE3 4.02Å; Y39-W87 AromaticContact CE2-CG 3.62Å; Y39-W87 HydrophobicContact CE2-CG 3.62Å; Y39-W87 HydrophobicContact CE2-CZ2 4.35Å; Y39-W87 AromaticContact CE2-NE1 3.86Å; Y39-W87 AromaticContact CG-CD2 3.69Å; Y39-W87 HydrophobicContact CG-CD2 3.69Å; Y39-W87 AromaticContact CG-CE3 3.26Å; Y39-W87 HydrophobicContact CG-CE3 3.26Å; Y39-W87 HydrophobicContact CG-CG 4.41Å; Y39-W87 HydrophobicContact CG-CH2 4.07Å; Y39-W87 HydrophobicContact CG-CZ2 4.41Å; Y39-W87 AromaticContact CG-CZ3 3.48Å; Y39-W87 HydrophobicContact CG-CZ3 3.48Å; Y39-W87 VanDerWaalsContact CG-CZ3 3.48Å; Y39-W87 AromaticContact CZ-CD1 3.86Å; Y39-W87 AromaticContact CZ-CD2 3.68Å; Y39-W87 AromaticContact CZ-CG 3.38Å; I83-W87 HydrophobicContact CG2-CB 4.02Å; P84-W87 PolarHBondContact O-N 2.81Å; W87-S89 VanDerWaalsContact C-N 3.29Å; W87-S89 PolarHBondContact O-N 2.95Å; W87-W90 HydrophobicContact CE3-CD2 4.43Å; W87-W90 AromaticContact CE3-CE3 3.76Å; W87-W90 HydrophobicContact CE3-CE3 3.76Å; W87-W90 HydrophobicContact CE3-CZ3 4.24Å; W87-W90 HydrophobicContact CZ3-CD2 4.37Å; W87-W90 AromaticContact CZ3-CE3 3.85Å; W87-W90 HydrophobicContact CZ3-CE3 3.85Å; W87-W90 HydrophobicContact CZ3-CZ3 4.03Å; W87-W90 PolarHBondContact O-N 2.74Å; W87-W90 VanDerWaalsContact O-N 3.13Å; W87-L91 WeakPolarHBondContact O-CG 3.38Å; W87-L91 PolarHBondContact O-N 3.45Å; W87-P98 HydrophobicContact CH2-CB 4.27Å; W87-P98 HydrophobicContact CZ3-CB 4.13Å; W87-P99 HydrophobicContact CD2-CG 3.51Å; W87-P99 VanDerWaalsContact CE2-CG 3.49Å; W87-P99 HydrophobicContact CE3-CG 3.86Å; W87-P99 HydrophobicContact CG-CG 3.94Å; W87-P99 HydrophobicContact CH2-CG 4.16Å; W87-P99 HydrophobicContact CZ2-CG 3.84Å; W87-P99 HydrophobicContact CZ3-CG 4.17Å
88	H	92.1	Very high	86.3	Confident	45 Å²	45	59.7 Å²	59.7	21%	0.208	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-40.5	174.2	178.2	-121.3	0	0	0	112.1	L80 I83 P84 W90 L91 S92 R94	L80-H88 VanDerWaalsContact CD2-NE2 3.34Å; L80-H88 WeakPolarHBondContact CD2-NE2 3.24Å; I83-H88 HydrophobicContact CG2-CB 4.1Å; P84-H88 PolarHBondContact O-N 3.01Å; H88-W90 VanDerWaalsContact C-N 3.31Å; H88-W90 PolarHBondContact O-N 3.02Å; H88-L91 PolarHBondContact O-N 3.41Å; H88-S92 WeakPolarHBondContact O-CB 3.48Å; H88-S92 PolarHBondContact O-N 3.14Å; H88-S92 PolarHBondContact O-OG 3.13Å; H88-R94 PolarHBondContact CE1-NH2 2.96Å; H88-R94 PolarHBondContact ND1-NH2 3.18Å
89	S	93	Very high	88.2	Confident	22 Å²	22	54 Å²	54	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-67.6	-31.4	176.6	-61.2	0	0	0	0	112.8	P85 E86 W87 S92 R94 R95	P85-S89 WeakPolarHBondContact O-CB 3.47Å; P85-S89 PolarHBondContact O-N 3.43Å; P85-S89 PolarHBondContact O-OG 3Å; E86-S89 PolarHBondContact O-N 3.4Å; W87-S89 VanDerWaalsContact C-N 3.29Å; W87-S89 PolarHBondContact O-N 2.95Å; S89-S92 WeakPolarHBondContact CA-OG 3.21Å; S89-S92 PolarHBondContact O-OG 3.14Å; S89-R94 WeakPolarHBondContact O-CA 3.35Å; S89-R94 WeakPolarHBondContact O-CB 3.43Å; S89-R94 PolarHBondContact O-N 3.07Å; S89-R94 PolarHBondContact OG-NH2 3.42Å; S89-R95 PolarHBondContact O-N 3.37Å
90	W	94.2	Very high	89.7	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-74.4	-43.5	172	177.1	75.2	0	0	0	112.7	V30 Y39 E41 R59 E86 W87 H88 S92 H93 R95 N97 P98	V30-W90 HydrophobicContact CB-CH2 4.02Å; V30-W90 HydrophobicContact CB-CZ2 4.28Å; V30-W90 HydrophobicContact CG1-CH2 4.13Å; V30-W90 HydrophobicContact CG1-CZ2 3.98Å; V30-W90 HydrophobicContact CG2-CH2 3.73Å; V30-W90 HydrophobicContact CG2-CZ2 3.88Å; Y39-W90 HydrophobicContact CD1-CZ3 4.41Å; E41-W90 HydrophobicContact CB-CH2 3.99Å; E41-W90 HydrophobicContact CB-CZ2 3.93Å; E41-W90 HydrophobicContact CG-CZ2 4.35Å; R59-W90 HydrophobicContact CB-CH2 4.25Å; R59-W90 HydrophobicContact CB-CZ3 4.2Å; R59-W90 WeakPolarHBondContact CD-O 3.42Å; R59-W90 HydrophobicContact CG-CH2 4.02Å; R59-W90 HydrophobicContact CG-CZ2 4Å; R59-W90 HydrophobicContact CG-CZ3 4.37Å; R59-W90 PolarHBondContact NH1-O 3.32Å; E86-W90 PolarHBondContact O-N 3.46Å; E86-W90 VanDerWaalsContact O-N 3.14Å; W87-W90 HydrophobicContact CE3-CD2 4.43Å; W87-W90 AromaticContact CE3-CE3 3.76Å; W87-W90 HydrophobicContact CE3-CE3 3.76Å; W87-W90 HydrophobicContact CE3-CZ3 4.24Å; W87-W90 HydrophobicContact CZ3-CD2 4.37Å; W87-W90 AromaticContact CZ3-CE3 3.85Å; W87-W90 HydrophobicContact CZ3-CE3 3.85Å; W87-W90 HydrophobicContact CZ3-CZ3 4.03Å; W87-W90 PolarHBondContact O-N 2.74Å; W87-W90 VanDerWaalsContact O-N 3.13Å; H88-W90 VanDerWaalsContact C-N 3.31Å; H88-W90 PolarHBondContact O-N 3.02Å; W90-S92 VanDerWaalsContact C-N 3.3Å; W90-S92 PolarHBondContact O-N 2.73Å; W90-H93 PolarHBondContact O-N 3.45Å; W90-R95 HydrophobicContact CB-CB 4.37Å; W90-N97 VanDerWaalsContact CD1-O 3.24Å; W90-P98 HydrophobicContact CD2-CB 4.4Å; W90-P98 HydrophobicContact CG-CB 4.48Å
91	L	92.2	Very high	90.9	Very high	8 Å²	8	59.8 Å²	59.8	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-40.2	177.1	-75.7	173.8	0	0	0	112.5	Y39 R59 F61 I83 W87 H88 H93	Y39-L91 HydrophobicContact CD1-CD1 4.2Å; Y39-L91 HydrophobicContact CD1-CD2 4.24Å; Y39-L91 HydrophobicContact CD1-CG 4.28Å; Y39-L91 HydrophobicContact CE1-CD1 3.91Å; Y39-L91 HydrophobicContact CE1-CG 4.41Å; R59-L91 HydrophobicContact CB-CD2 3.94Å; F61-L91 HydrophobicContact CD1-CD1 3.73Å; F61-L91 HydrophobicContact CE1-CD1 4.37Å; I83-L91 HydrophobicContact CD1-CD1 4.35Å; I83-L91 HydrophobicContact CG2-CD1 4.46Å; W87-L91 WeakPolarHBondContact O-CG 3.38Å; W87-L91 PolarHBondContact O-N 3.45Å; H88-L91 PolarHBondContact O-N 3.41Å; L91-H93 PolarHBondContact O-N 3.33Å; L91-H93 PolarHBondContact O-ND1 3.4Å
92	S	89.9	Confident	92.1	Very high	43 Å²	43	61 Å²	61	30%	0.301	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	10.7	176.9	55.8	0	0	0	0	114.3	H88 S89 W90 R94	H88-S92 WeakPolarHBondContact O-CB 3.48Å; H88-S92 PolarHBondContact O-N 3.14Å; H88-S92 PolarHBondContact O-OG 3.13Å; S89-S92 WeakPolarHBondContact CA-OG 3.21Å; S89-S92 PolarHBondContact O-OG 3.14Å; W90-S92 VanDerWaalsContact C-N 3.3Å; W90-S92 PolarHBondContact O-N 2.73Å; S92-R94 PolarHBondContact O-N 3.32Å; S92-R94 VanDerWaalsContact OG-CZ 3.25Å; S92-R94 PolarHBondContact OG-NH1 3.31Å; S92-R94 PolarHBondContact OG-NH2 3.37Å
93	H	91.1	Very high	92.8	Very high	68 Å²	68	61.2 Å²	61.2	32%	0.315	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	13.7	-177.6	-54.1	89.7	0	0	0	115.4	P57 W90 L91 R95	P57-H93 PolarHBondContact O-NE2 3.37Å; W90-H93 PolarHBondContact O-N 3.45Å; L91-H93 PolarHBondContact O-N 3.33Å; L91-H93 PolarHBondContact O-ND1 3.4Å; H93-R95 PolarHBondContact O-N 3.02Å
94	R	92.1	Very high	93.1	Very high	152 Å²	152	61.7 Å²	61.7	57%	0.574	32%	0.321	S	S	*	.	S	Bend	trans	-65.4	-30.1	170.1	-65.3	-167.1	-69.7	-97.6	-5	111.6	H88 S89 S92	H88-R94 PolarHBondContact CE1-NH2 2.96Å; H88-R94 PolarHBondContact ND1-NH2 3.18Å; S89-R94 WeakPolarHBondContact O-CA 3.35Å; S89-R94 WeakPolarHBondContact O-CB 3.43Å; S89-R94 PolarHBondContact O-N 3.07Å; S89-R94 PolarHBondContact OG-NH2 3.42Å; S92-R94 PolarHBondContact O-N 3.32Å; S92-R94 VanDerWaalsContact OG-CZ 3.25Å; S92-R94 PolarHBondContact OG-NH1 3.31Å; S92-R94 PolarHBondContact OG-NH2 3.37Å
95	R	92.7	Very high	93.2	Very high	75 Å²	75	65.4 Å²	65.4	28%	0.283	34%	0.337	S	S	.	.			trans	-109.1	136.5	172.2	-65.6	-178.7	175.3	-179.9	-6.5	110.9	R59 S89 W90 H93 E103	R59-R95 PolarHBondContact NH1-O 3.03Å; S89-R95 PolarHBondContact O-N 3.37Å; W90-R95 HydrophobicContact CB-CB 4.37Å; H93-R95 PolarHBondContact O-N 3.02Å; R95-E103 IonicContact CZ-OE1 3.41Å; R95-E103 IonicContact NH1-OE1 3.33Å; R95-E103 PolarHBondContact NH1-OE1 3.37Å; R95-E103 IonicContact NH1-OE2 3.26Å; R95-E103 PolarHBondContact NH1-OE2 2.84Å; R95-E103 IonicContact NH2-OE1 3.77Å; R95-E103 PolarHBondContact NH2-OE1 3.33Å
96	S	92.5	Very high	93.4	Very high	94 Å²	94	63.7 Å²	63.7	66%	0.657	33%	0.33	S	S	*	.	S	Bend	trans	-71.8	-51.8	173.7	-172.4	0	0	0	0	110.9	R59	R59-S96 PolarHBondContact NH2-O 2.63Å
97	N	94.3	Very high	93.5	Very high	124 Å²	124	65.3 Å²	65.3	66%	0.663	34%	0.339	S	S	*	.	S	Bend	trans	-91.7	148.8	-178.2	-61.7	-35.5	0	0	0	111.6	W90	W90-N97 VanDerWaalsContact CD1-O 3.24Å
98	P	95.1	Very high	93.4	Very high	47 Å²	47	67.2 Å²	67.2	31%	0.305	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-64.5	154.7	171.2	30.4	-36.4	0	0	0	111.1	V30 W87 W90	V30-P98 HydrophobicContact CG1-CB 3.33Å; V30-P98 HydrophobicContact CG1-CG 3.51Å; W87-P98 HydrophobicContact CH2-CB 4.27Å; W87-P98 HydrophobicContact CZ3-CB 4.13Å; W90-P98 HydrophobicContact CD2-CB 4.4Å; W90-P98 HydrophobicContact CG-CB 4.48Å
99	P	94.9	Very high	93.6	Very high	13 Å²	13	68.7 Å²	68.7	8%	0.084	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-65.5	144.5	178.7	29.5	-35.4	0	0	0	111.8	E86 W87 I104	E86-P99 HydrophobicContact CB-CB 3.71Å; E86-P99 HydrophobicContact CB-CG 4.08Å; W87-P99 HydrophobicContact CD2-CG 3.51Å; W87-P99 VanDerWaalsContact CE2-CG 3.49Å; W87-P99 HydrophobicContact CE3-CG 3.86Å; W87-P99 HydrophobicContact CG-CG 3.94Å; W87-P99 HydrophobicContact CH2-CG 4.16Å; W87-P99 HydrophobicContact CZ2-CG 3.84Å; W87-P99 HydrophobicContact CZ3-CG 4.17Å; P99-I104 HydrophobicContact CB-CD1 4.28Å; P99-I104 HydrophobicContact CB-CG1 4.21Å; P99-I104 HydrophobicContact CG-CD1 4.4Å
100	T	95.1	Very high	93.8	Very high	88 Å²	88	70.3 Å²	70.3	54%	0.54	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-92.8	153.8	175.5	-54.9	0	0	0	0	110.2	E102 E103 I104	T100-E102 VanDerWaalsContact C-N 3.34Å; T100-E102 HydrophobicContact CG2-CB 4.49Å; T100-E102 PolarHBondContact O-N 2.83Å; T100-E103 WeakPolarHBondContact O-CB 3.4Å; T100-E103 PolarHBondContact O-N 3.44Å; T100-E103 VanDerWaalsContact O-N 3.09Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.26Å; T100-I104 VanDerWaalsContact O-N 3.08Å
101	E	92.1	Very high	93.9	Very high	145 Å²	145	77.1 Å²	77.1	68%	0.678	41%	0.409	S	S	*	.	H	α-helix	trans	-56.8	-45.2	179.3	-173	164.3	-156.7	0	0	112.5	E103 I104 E105	E101-E103 VanDerWaalsContact C-N 3.28Å; E101-E103 PolarHBondContact O-N 3.45Å; E101-I104 WeakPolarHBondContact O-CB 3.41Å; E101-I104 PolarHBondContact O-N 3.28Å; E101-I104 VanDerWaalsContact O-N 3.13Å; E101-E105 WeakPolarHBondContact O-CG 3.27Å; E101-E105 PolarHBondContact O-N 2.84Å
102	E	94.5	Very high	94.1	Very high	155 Å²	155	80.1 Å²	80.1	72%	0.724	43%	0.431	S	S	*	.	H	α-helix	trans	-56.2	-41	174.7	-175	-176	174.7	0	0	112.4	T100 E105 A106	T100-E102 VanDerWaalsContact C-N 3.34Å; T100-E102 HydrophobicContact CG2-CB 4.49Å; T100-E102 PolarHBondContact O-N 2.83Å; E102-E105 PolarHBondContact O-N 3.1Å; E102-A106 WeakPolarHBondContact O-CB 3.24Å; E102-A106 PolarHBondContact O-N 3Å
103	E	94.8	Very high	94.5	Very high	62 Å²	62	84.5 Å²	84.5	29%	0.29	44%	0.444	S	S	.	.	H	α-helix	trans	-65.8	-43.1	178.7	-165.3	-163.1	160.3	0	0	111.2	R95 T100 E101 E105 A106 N107	R95-E103 IonicContact CZ-OE1 3.41Å; R95-E103 IonicContact NH1-OE1 3.33Å; R95-E103 PolarHBondContact NH1-OE1 3.37Å; R95-E103 IonicContact NH1-OE2 3.26Å; R95-E103 PolarHBondContact NH1-OE2 2.84Å; R95-E103 IonicContact NH2-OE1 3.77Å; R95-E103 PolarHBondContact NH2-OE1 3.33Å; T100-E103 WeakPolarHBondContact O-CB 3.4Å; T100-E103 PolarHBondContact O-N 3.44Å; T100-E103 VanDerWaalsContact O-N 3.09Å; E101-E103 VanDerWaalsContact C-N 3.28Å; E101-E103 PolarHBondContact O-N 3.45Å; E103-E105 VanDerWaalsContact C-N 3.31Å; E103-E105 PolarHBondContact O-N 2.77Å; E103-A106 PolarHBondContact O-N 2.76Å; E103-N107 WeakPolarHBondContact O-CB 3.42Å; E103-N107 PolarHBondContact O-N 3.04Å; E103-N107 PolarHBondContact O-ND2 3.42Å
104	I	94.2	Very high	94.8	Very high	25 Å²	25	88.4 Å²	88.4	13%	0.128	46%	0.457	C	S	.	.	H	α-helix	trans	-62.6	-41.3	178.6	-65	166.9	0	0	0	110.1	E86 P99 T100 E101 A108	E86-I104 HydrophobicContact CG-CG1 4.39Å; P99-I104 HydrophobicContact CB-CD1 4.28Å; P99-I104 HydrophobicContact CB-CG1 4.21Å; P99-I104 HydrophobicContact CG-CD1 4.4Å; T100-I104 WeakPolarHBondContact O-CG1 3.48Å; T100-I104 PolarHBondContact O-N 3.26Å; T100-I104 VanDerWaalsContact O-N 3.08Å; E101-I104 WeakPolarHBondContact O-CB 3.41Å; E101-I104 PolarHBondContact O-N 3.28Å; E101-I104 VanDerWaalsContact O-N 3.13Å; I104-A108 WeakPolarHBondContact O-CB 3.48Å; I104-A108 PolarHBondContact O-N 2.81Å
105	E	94.1	Very high	95	Very high	99 Å²	99	87.3 Å²	87.3	46%	0.463	46%	0.461	S	S	.	.	H	α-helix	trans	-66.7	-47.6	176.8	-69.3	-178.6	169.2	0	0	112.5	E101 E102 E103 N107 A108 V109	E101-E105 WeakPolarHBondContact O-CG 3.27Å; E101-E105 PolarHBondContact O-N 2.84Å; E102-E105 PolarHBondContact O-N 3.1Å; E103-E105 VanDerWaalsContact C-N 3.31Å; E103-E105 PolarHBondContact O-N 2.77Å; E105-N107 VanDerWaalsContact C-N 3.27Å; E105-N107 PolarHBondContact O-N 3.02Å; E105-A108 WeakPolarHBondContact O-CB 3.17Å; E105-A108 PolarHBondContact O-N 2.91Å; E105-A108 VanDerWaalsContact O-N 3.11Å; E105-V109 WeakPolarHBondContact O-CG2 3.29Å; E105-V109 PolarHBondContact O-N 2.89Å
106	A	95.4	Very high	95.3	Very high	51 Å²	51	86.8 Å²	86.8	42%	0.421	47%	0.469	S	S	.	.	H	α-helix	trans	-58.9	-39.9	177.3	0	0	0	0	0	112	E102 E103 S110	E102-A106 WeakPolarHBondContact O-CB 3.24Å; E102-A106 PolarHBondContact O-N 3Å; E103-A106 PolarHBondContact O-N 2.76Å; A106-S110 WeakPolarHBondContact O-CB 3.45Å; A106-S110 PolarHBondContact O-N 3.27Å; A106-S110 PolarHBondContact O-OG 3.27Å
107	N	94.5	Very high	95.6	Very high	48 Å²	48	89.7 Å²	89.7	26%	0.257	47%	0.465	S	S	.	.	H	α-helix	trans	-68.6	-38.5	175.9	-72.2	-18.8	0	0	0	112.3	E86 E103 E105 S110 K111	E86-N107 VanDerWaalsContact CG-ND2 3.28Å; E86-N107 WeakPolarHBondContact CG-ND2 3.48Å; E86-N107 WeakPolarHBondContact OE1-CB 3.46Å; E86-N107 PolarHBondContact OE1-ND2 3.34Å; E103-N107 WeakPolarHBondContact O-CB 3.42Å; E103-N107 PolarHBondContact O-N 3.04Å; E103-N107 PolarHBondContact O-ND2 3.42Å; E105-N107 VanDerWaalsContact C-N 3.27Å; E105-N107 PolarHBondContact O-N 3.02Å; N107-S110 PolarHBondContact O-N 3.47Å; N107-K111 WeakPolarHBondContact O-CB 3.23Å; N107-K111 PolarHBondContact O-N 3.49Å
108	A	93.5	Very high	95.7	Very high	48 Å²	48	86.1 Å²	86.1	40%	0.397	45%	0.454	S	S	.	.	H	α-helix	trans	-61.8	-44.6	175.5	0	0	0	0	0	111.8	I104 E105 S110 K111 S112	I104-A108 WeakPolarHBondContact O-CB 3.48Å; I104-A108 PolarHBondContact O-N 2.81Å; E105-A108 WeakPolarHBondContact O-CB 3.17Å; E105-A108 PolarHBondContact O-N 2.91Å; E105-A108 VanDerWaalsContact O-N 3.11Å; A108-S110 VanDerWaalsContact C-N 3.34Å; A108-S110 PolarHBondContact O-N 3.16Å; A108-K111 WeakPolarHBondContact O-CB 3.2Å; A108-K111 PolarHBondContact O-N 3.11Å; A108-S112 PolarHBondContact O-N 3.4Å
109	V	96.4	Very high	95.9	Very high	76 Å²	76	86.3 Å²	86.3	46%	0.461	46%	0.459	S	S	.	.	H	α-helix	trans	-60.6	-45.7	174.2	173.9	0	0	0	0	110.7	E105 K111 S112 K113	E105-V109 WeakPolarHBondContact O-CG2 3.29Å; E105-V109 PolarHBondContact O-N 2.89Å; V109-K111 VanDerWaalsContact C-N 3.3Å; V109-K111 PolarHBondContact O-N 3.28Å; V109-S112 PolarHBondContact O-N 2.86Å; V109-K113 HydrophobicContact CG1-CD 4.22Å; V109-K113 WeakPolarHBondContact O-CG 3.44Å; V109-K113 PolarHBondContact O-N 3.4Å
110	S	96.6	Very high	96	Very high	55 Å²	55	92 Å²	92	39%	0.385	49%	0.485	S	S	.	.	H	α-helix	trans	-64.1	-34.9	178.5	-61.9	0	0	0	0	112.6	A106 N107 A108 R114	A106-S110 WeakPolarHBondContact O-CB 3.45Å; A106-S110 PolarHBondContact O-N 3.27Å; A106-S110 PolarHBondContact O-OG 3.27Å; N107-S110 PolarHBondContact O-N 3.47Å; A108-S110 VanDerWaalsContact C-N 3.34Å; A108-S110 PolarHBondContact O-N 3.16Å; S110-R114 WeakPolarHBondContact O-CB 3.3Å; S110-R114 WeakPolarHBondContact O-CG 3.49Å; S110-R114 PolarHBondContact O-N 3.48Å; S110-R114 VanDerWaalsContact O-N 3.08Å; S110-R114 PolarHBondContact O-NE 2.82Å; S110-R114 VanDerWaalsContact O-NE 3.15Å
111	K	95.1	Very high	96.1	Very high	143 Å²	143	91.3 Å²	91.3	62%	0.622	48%	0.477	S	S	*	.	H	α-helix	trans	-64.9	-47.5	174.2	-179	-176.9	177.5	-178.5	0	110.9	N107 A108 V109 R114 L115	N107-K111 WeakPolarHBondContact O-CB 3.23Å; N107-K111 PolarHBondContact O-N 3.49Å; A108-K111 WeakPolarHBondContact O-CB 3.2Å; A108-K111 PolarHBondContact O-N 3.11Å; V109-K111 VanDerWaalsContact C-N 3.3Å; V109-K111 PolarHBondContact O-N 3.28Å; K111-R114 PolarHBondContact O-N 2.82Å; K111-L115 PolarHBondContact O-N 2.87Å
112	S	96.7	Very high	96.3	Very high	72 Å²	72	90.2 Å²	90.2	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-58.7	-49.2	177.1	173.1	0	0	0	0	111.6	A108 V109 R114 L115 S116	A108-S112 PolarHBondContact O-N 3.4Å; V109-S112 PolarHBondContact O-N 2.86Å; S112-R114 VanDerWaalsContact C-N 3.32Å; S112-R114 PolarHBondContact O-N 3.12Å; S112-L115 WeakPolarHBondContact O-CB 3.09Å; S112-L115 PolarHBondContact O-N 2.82Å; S112-L115 VanDerWaalsContact O-N 3.11Å; S112-S116 PolarHBondContact O-N 2.92Å; S112-S116 PolarHBondContact O-OG 3.47Å
113	K	98	Very high	96.5	Very high	134 Å²	134	87.3 Å²	87.3	58%	0.583	46%	0.464	S	S	*	.	H	α-helix	trans	-57.8	-41.9	176.6	-70.6	176	179.9	177.3	0	112.9	V109 R117	V109-K113 HydrophobicContact CG1-CD 4.22Å; V109-K113 WeakPolarHBondContact O-CG 3.44Å; V109-K113 PolarHBondContact O-N 3.4Å; K113-R117 WeakPolarHBondContact O-CB 3.21Å; K113-R117 PolarHBondContact O-N 2.86Å
114	R	98	Very high	96.5	Very high	151 Å²	151	90.8 Å²	90.8	57%	0.57	48%	0.479	S	S	*	.	H	α-helix	trans	-63.4	-41.5	176.4	-80.7	179.8	-76.3	136.8	-10.3	111.8	S110 K111 S112 R117 A118	S110-R114 WeakPolarHBondContact O-CB 3.3Å; S110-R114 WeakPolarHBondContact O-CG 3.49Å; S110-R114 PolarHBondContact O-N 3.48Å; S110-R114 VanDerWaalsContact O-N 3.08Å; S110-R114 PolarHBondContact O-NE 2.82Å; S110-R114 VanDerWaalsContact O-NE 3.15Å; K111-R114 PolarHBondContact O-N 2.82Å; S112-R114 VanDerWaalsContact C-N 3.32Å; S112-R114 PolarHBondContact O-N 3.12Å; R114-R117 PolarHBondContact O-N 3.05Å; R114-A118 VanDerWaalsContact O-CB 3.3Å; R114-A118 WeakPolarHBondContact O-CB 3.37Å; R114-A118 PolarHBondContact O-N 3.29Å
115	L	97.5	Very high	96.6	Very high	129 Å²	129	96.4 Å²	96.4	68%	0.675	50%	0.499	S	S	*	.	H	α-helix	trans	-64.8	-45.3	178.7	-172.6	66.8	0	0	0	111.6	K111 S112 A118 A119	K111-L115 PolarHBondContact O-N 2.87Å; S112-L115 WeakPolarHBondContact O-CB 3.09Å; S112-L115 PolarHBondContact O-N 2.82Å; S112-L115 VanDerWaalsContact O-N 3.11Å; L115-A118 PolarHBondContact O-N 3.21Å; L115-A119 PolarHBondContact O-N 3.02Å
116	S	97.9	Very high	96.7	Very high	63 Å²	63	95.5 Å²	95.5	44%	0.441	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-48	175.9	-57.6	0	0	0	0	111.9	S112 A118 A119 E120	S112-S116 PolarHBondContact O-N 2.92Å; S112-S116 PolarHBondContact O-OG 3.47Å; S116-A118 VanDerWaalsContact C-N 3.32Å; S116-A118 PolarHBondContact O-N 3.06Å; S116-A119 PolarHBondContact O-N 3.5Å; S116-E120 WeakPolarHBondContact O-CG 3.32Å; S116-E120 PolarHBondContact O-N 3.19Å
117	R	98	Very high	96.7	Very high	155 Å²	155	96.3 Å²	96.3	59%	0.585	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-39	176.9	-179.3	179	-74	126.1	-5.2	112.4	K113 R114 A119 E120 L121	K113-R117 WeakPolarHBondContact O-CB 3.21Å; K113-R117 PolarHBondContact O-N 2.86Å; R114-R117 PolarHBondContact O-N 3.05Å; R117-A119 VanDerWaalsContact C-N 3.32Å; R117-E120 PolarHBondContact O-N 3.29Å; R117-L121 HydrophobicContact CG-CD1 4.19Å; R117-L121 WeakPolarHBondContact O-CG 3.43Å; R117-L121 PolarHBondContact O-N 2.89Å
118	A	98.1	Very high	96.6	Very high	50 Å²	50	98.3 Å²	98.3	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-41.7	177.4	0	0	0	0	0	111.3	R114 L115 S116 L121 E122	R114-A118 VanDerWaalsContact O-CB 3.3Å; R114-A118 WeakPolarHBondContact O-CB 3.37Å; R114-A118 PolarHBondContact O-N 3.29Å; L115-A118 PolarHBondContact O-N 3.21Å; S116-A118 VanDerWaalsContact C-N 3.32Å; S116-A118 PolarHBondContact O-N 3.06Å; A118-L121 PolarHBondContact O-N 2.97Å; A118-E122 WeakPolarHBondContact O-CB 3.38Å; A118-E122 PolarHBondContact O-N 2.84Å
119	A	97.5	Very high	96.6	Very high	51 Å²	51	102.2 Å²	102.2	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-64.1	-42.3	176.1	0	0	0	0	0	112.3	L115 S116 R117 L121 E122 V123	L115-A119 PolarHBondContact O-N 3.02Å; S116-A119 PolarHBondContact O-N 3.5Å; R117-A119 VanDerWaalsContact C-N 3.32Å; A119-L121 VanDerWaalsContact C-N 3.35Å; A119-L121 PolarHBondContact O-N 3.02Å; A119-E122 PolarHBondContact O-N 3.48Å; A119-V123 WeakPolarHBondContact O-CG2 3.29Å; A119-V123 PolarHBondContact O-N 3.11Å; A119-V123 VanDerWaalsContact O-N 3.1Å
120	E	97.5	Very high	96.4	Very high	133 Å²	133	105 Å²	105	62%	0.621	52%	0.518	S	S	*	.	H	α-helix	trans	-60.7	-43.7	174.9	-70	167.5	-166.5	0	0	112	S116 R117 V123 K124	S116-E120 WeakPolarHBondContact O-CG 3.32Å; S116-E120 PolarHBondContact O-N 3.19Å; R117-E120 PolarHBondContact O-N 3.29Å; E120-V123 PolarHBondContact O-N 2.84Å; E120-K124 PolarHBondContact O-N 2.68Å; E120-K124 VanDerWaalsContact O-N 3.08Å
121	L	97.6	Very high	96.2	Very high	72 Å²	72	108.2 Å²	108.2	38%	0.377	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-41.4	177.1	-75.4	173.1	0	0	0	111.8	R117 A118 A119 V123 K124 Y125	R117-L121 HydrophobicContact CG-CD1 4.19Å; R117-L121 WeakPolarHBondContact O-CG 3.43Å; R117-L121 PolarHBondContact O-N 2.89Å; A118-L121 PolarHBondContact O-N 2.97Å; A119-L121 VanDerWaalsContact C-N 3.35Å; A119-L121 PolarHBondContact O-N 3.02Å; L121-V123 VanDerWaalsContact C-N 3.33Å; L121-V123 PolarHBondContact O-N 3.25Å; L121-K124 PolarHBondContact O-N 2.93Å; L121-Y125 HydrophobicContact CB-CD2 4.18Å; L121-Y125 HydrophobicContact CB-CE2 4.01Å; L121-Y125 HydrophobicContact CD2-CE2 4.31Å; L121-Y125 WeakPolarHBondContact O-CB 3.36Å; L121-Y125 WeakPolarHBondContact O-CD2 3.3Å; L121-Y125 PolarHBondContact O-N 2.76Å
122	E	97.2	Very high	96.1	Very high	122 Å²	122	104.2 Å²	104.2	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-60	-43.3	177.2	-176.8	171.2	-163.2	0	0	111.6	A118 A119 Y125 N126	A118-E122 WeakPolarHBondContact O-CB 3.38Å; A118-E122 PolarHBondContact O-N 2.84Å; A119-E122 PolarHBondContact O-N 3.48Å; E122-Y125 PolarHBondContact O-N 3.26Å; E122-N126 VanDerWaalsContact O-CB 3.29Å; E122-N126 WeakPolarHBondContact O-CB 3.44Å; E122-N126 PolarHBondContact O-N 3.08Å; E122-N126 PolarHBondContact O-ND2 3.08Å; E122-N126 VanDerWaalsContact O-ND2 3.11Å
123	V	96.7	Very high	95.8	Very high	94 Å²	94	103.1 Å²	103.1	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-60.6	-47.8	174	174	0	0	0	0	110.9	A119 E120 L121 Y125 N126 V127	A119-V123 WeakPolarHBondContact O-CG2 3.29Å; A119-V123 PolarHBondContact O-N 3.11Å; A119-V123 VanDerWaalsContact O-N 3.1Å; E120-V123 PolarHBondContact O-N 2.84Å; L121-V123 VanDerWaalsContact C-N 3.33Å; L121-V123 PolarHBondContact O-N 3.25Å; V123-Y125 PolarHBondContact O-N 3.24Å; V123-N126 PolarHBondContact O-N 3.27Å; V123-V127 WeakPolarHBondContact O-CG2 3.18Å; V123-V127 PolarHBondContact O-N 3.33Å
124	K	96.4	Very high	95.5	Very high	136 Å²	136	105.6 Å²	105.6	59%	0.591	51%	0.509	S	S	*	.	H	α-helix	trans	-59.1	-49.1	178.4	-175.5	-175.7	174.5	-173.3	0	111.8	E120 L121 N126 V127 E128	E120-K124 PolarHBondContact O-N 2.68Å; E120-K124 VanDerWaalsContact O-N 3.08Å; L121-K124 PolarHBondContact O-N 2.93Å; K124-N126 VanDerWaalsContact C-N 3.3Å; K124-N126 PolarHBondContact O-N 3.17Å; K124-V127 PolarHBondContact O-N 3.02Å; K124-E128 PolarHBondContact O-N 3.38Å
125	Y	95.7	Very high	95.2	Very high	142 Å²	142	105.7 Å²	105.7	56%	0.557	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-35.7	179.2	-75.2	-57	0	0	0	112.2	L121 E122 V123 R129	L121-Y125 HydrophobicContact CB-CD2 4.18Å; L121-Y125 HydrophobicContact CB-CE2 4.01Å; L121-Y125 HydrophobicContact CD2-CE2 4.31Å; L121-Y125 WeakPolarHBondContact O-CB 3.36Å; L121-Y125 WeakPolarHBondContact O-CD2 3.3Å; L121-Y125 PolarHBondContact O-N 2.76Å; E122-Y125 PolarHBondContact O-N 3.26Å; V123-Y125 PolarHBondContact O-N 3.24Å; Y125-R129 WeakPolarHBondContact O-CB 3.41Å; Y125-R129 PolarHBondContact O-N 3.46Å
126	N	95.5	Very high	94.7	Very high	81 Å²	81	101.8 Å²	101.8	43%	0.433	51%	0.507	S	S	.	.	H	α-helix	trans	-66.4	-40.8	176.8	-75.2	-27.6	0	0	0	112	E122 V123 K124 Q130	E122-N126 VanDerWaalsContact O-CB 3.29Å; E122-N126 WeakPolarHBondContact O-CB 3.44Å; E122-N126 PolarHBondContact O-N 3.08Å; E122-N126 PolarHBondContact O-ND2 3.08Å; E122-N126 VanDerWaalsContact O-ND2 3.11Å; V123-N126 PolarHBondContact O-N 3.27Å; K124-N126 VanDerWaalsContact C-N 3.3Å; K124-N126 PolarHBondContact O-N 3.17Å; N126-Q130 VanDerWaalsContact O-CG 3.31Å; N126-Q130 WeakPolarHBondContact O-CG 3.37Å; N126-Q130 PolarHBondContact O-N 3.33Å
127	V	95.4	Very high	94.1	Very high	68 Å²	68	104.9 Å²	104.9	41%	0.412	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-50	174.9	173.9	0	0	0	0	110.8	V123 K124 R129 Q130 E131	V123-V127 WeakPolarHBondContact O-CG2 3.18Å; V123-V127 PolarHBondContact O-N 3.33Å; K124-V127 PolarHBondContact O-N 3.02Å; V127-R129 VanDerWaalsContact C-N 3.29Å; V127-R129 PolarHBondContact O-N 2.91Å; V127-Q130 WeakPolarHBondContact O-CB 3.25Å; V127-Q130 PolarHBondContact O-N 3.09Å; V127-Q130 VanDerWaalsContact O-N 3.08Å; V127-E131 PolarHBondContact O-N 3.46Å
128	E	93.7	Very high	93.2	Very high	89 Å²	89	100.6 Å²	100.6	42%	0.416	51%	0.506	S	S	.	.	H	α-helix	trans	-58.4	-42.4	177.4	-177.9	175	-171.3	0	0	111.5	K124 Q130 E131 M132	K124-E128 PolarHBondContact O-N 3.38Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 2.88Å; E128-E131 PolarHBondContact O-N 3.38Å; E128-M132 WeakPolarHBondContact O-CG 3.31Å; E128-M132 PolarHBondContact O-N 3.46Å
129	R	92.5	Very high	92.2	Very high	131 Å²	131	105.4 Å²	105.4	49%	0.494	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-41.3	175.3	-174.2	178	-173.5	-80.8	-4.9	111.9	Y125 V127 M132 I133 L138	Y125-R129 WeakPolarHBondContact O-CB 3.41Å; Y125-R129 PolarHBondContact O-N 3.46Å; V127-R129 VanDerWaalsContact C-N 3.29Å; V127-R129 PolarHBondContact O-N 2.91Å; R129-M132 PolarHBondContact O-N 2.86Å; R129-I133 HydrophobicContact CG-CD1 4.23Å; R129-I133 WeakPolarHBondContact O-CD1 3.47Å; R129-I133 VanDerWaalsContact O-CG1 3.23Å; R129-I133 WeakPolarHBondContact O-CG1 3.12Å; R129-I133 PolarHBondContact O-N 3.12Å; R129-I133 VanDerWaalsContact O-N 3.07Å; R129-L138 HydrophobicContact CG-CD1 4.04Å
130	Q	93	Very high	90.8	Very high	135 Å²	135	106.9 Å²	106.9	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-39.7	176	-75.6	177.6	-5.8	0	0	112	N126 V127 E128 I133 K134	N126-Q130 VanDerWaalsContact O-CG 3.31Å; N126-Q130 WeakPolarHBondContact O-CG 3.37Å; N126-Q130 PolarHBondContact O-N 3.33Å; V127-Q130 WeakPolarHBondContact O-CB 3.25Å; V127-Q130 PolarHBondContact O-N 3.09Å; V127-Q130 VanDerWaalsContact O-N 3.08Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 2.88Å; Q130-I133 PolarHBondContact O-N 3.03Å; Q130-K134 PolarHBondContact O-N 2.75Å
131	E	92.5	Very high	89.2	Confident	122 Å²	122	105.9 Å²	105.9	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-64.9	-44.6	175.4	-69.8	177.9	173.5	0	0	111.8	V127 E128 I133 K134 Q135	V127-E131 PolarHBondContact O-N 3.46Å; E128-E131 PolarHBondContact O-N 3.38Å; E131-I133 VanDerWaalsContact C-N 3.3Å; E131-I133 PolarHBondContact O-N 3.45Å; E131-K134 WeakPolarHBondContact O-CB 3.29Å; E131-K134 PolarHBondContact O-N 3.42Å; E131-K134 VanDerWaalsContact O-N 3.12Å; E131-Q135 WeakPolarHBondContact O-CG 3.37Å; E131-Q135 PolarHBondContact O-N 2.93Å
132	M	92	Very high	87.1	Confident	58 Å²	58	112.3 Å²	112.3	29%	0.286	55%	0.548	S	S	.	.	H	α-helix	trans	-60.6	-37.5	175.6	-72.8	179.3	76.6	0	0	112.7	E128 R129 Q135 G136 L137 L138	E128-M132 WeakPolarHBondContact O-CG 3.31Å; E128-M132 PolarHBondContact O-N 3.46Å; R129-M132 PolarHBondContact O-N 2.86Å; M132-Q135 PolarHBondContact O-N 3.45Å; M132-G136 PolarHBondContact O-N 3.34Å; M132-L137 HydrophobicContact CB-CB 4.32Å; M132-L137 HydrophobicContact CE-CB 4.36Å; M132-L137 HydrophobicContact CE-CD2 3.94Å; M132-L137 HydrophobicContact CE-CG 4.43Å; M132-L137 PolarHBondContact O-N 3.12Å; M132-L138 HydrophobicContact CB-CB 4.36Å; M132-L138 HydrophobicContact CB-CD1 3.74Å; M132-L138 HydrophobicContact CB-CG 3.87Å; M132-L138 HydrophobicContact CE-CD1 3.74Å; M132-L138 HydrophobicContact CE-CD2 3.9Å; M132-L138 HydrophobicContact CE-CG 3.56Å; M132-L138 HydrophobicContact CG-CD1 4.38Å; M132-L138 PolarHBondContact O-N 3.01Å; M132-L138 HydrophobicContact SD-CD1 3.7Å; M132-L138 HydrophobicContact SD-CG 4.17Å
133	I	91.8	Very high	84.9	Confident	50 Å²	50	112 Å²	112	26%	0.256	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-44.9	173.9	-68.8	161.2	0	0	0	110.2	R129 Q130 E131 Q135 G136 L138 T140	R129-I133 HydrophobicContact CG-CD1 4.23Å; R129-I133 WeakPolarHBondContact O-CD1 3.47Å; R129-I133 VanDerWaalsContact O-CG1 3.23Å; R129-I133 WeakPolarHBondContact O-CG1 3.12Å; R129-I133 PolarHBondContact O-N 3.12Å; R129-I133 VanDerWaalsContact O-N 3.07Å; Q130-I133 PolarHBondContact O-N 3.03Å; E131-I133 VanDerWaalsContact C-N 3.3Å; E131-I133 PolarHBondContact O-N 3.45Å; I133-Q135 VanDerWaalsContact C-N 3.28Å; I133-Q135 PolarHBondContact O-N 3.45Å; I133-G136 PolarHBondContact O-N 3.43Å; I133-L138 HydrophobicContact CG1-CB 4.08Å; I133-T140 HydrophobicContact CB-CG2 4.45Å; I133-T140 HydrophobicContact CD1-CG2 3.42Å; I133-T140 VanDerWaalsContact CD1-CG2 3.42Å; I133-T140 HydrophobicContact CG1-CG2 3.72Å; I133-T140 HydrophobicContact CG2-CG2 3.83Å
134	K	91.1	Very high	82.4	Confident	185 Å²	185	115.3 Å²	115.3	80%	0.804	56%	0.558	S	S	*	*	H	α-helix	trans	-61.7	-36.1	177.2	-174.1	-178.7	177.9	-177.1	0	112.5	Q130 E131 G136	Q130-K134 PolarHBondContact O-N 2.75Å; E131-K134 WeakPolarHBondContact O-CB 3.29Å; E131-K134 PolarHBondContact O-N 3.42Å; E131-K134 VanDerWaalsContact O-N 3.12Å; K134-G136 PolarHBondContact O-N 2.86Å
135	Q	91.8	Very high	80.1	Confident	154 Å²	154	115.3 Å²	115.3	72%	0.72	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-2.9	175.8	-62.9	-64.3	-13.3	0	0	113.4	E131 M132 I133 L137	E131-Q135 WeakPolarHBondContact O-CG 3.37Å; E131-Q135 PolarHBondContact O-N 2.93Å; M132-Q135 PolarHBondContact O-N 3.45Å; I133-Q135 VanDerWaalsContact C-N 3.28Å; I133-Q135 PolarHBondContact O-N 3.45Å; Q135-L137 PolarHBondContact O-N 2.81Å
136	G	86.5	Confident	77.8	Confident	47 Å²	47	112.8 Å²	112.8	49%	0.485	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	71.7	15.1	-176.9	0	0	0	0	0	114.4	M132 I133 K134	M132-G136 PolarHBondContact O-N 3.34Å; I133-G136 PolarHBondContact O-N 3.43Å; K134-G136 PolarHBondContact O-N 2.86Å
137	L	85.4	Confident	75.4	Confident	127 Å²	127	116 Å²	116	67%	0.665	60%	0.595	S	S	*	*	S	Bend	trans	-83.4	-22.1	-179	-141.4	70.7	0	0	0	112.5	M132 Q135	M132-L137 HydrophobicContact CB-CB 4.32Å; M132-L137 HydrophobicContact CE-CB 4.36Å; M132-L137 HydrophobicContact CE-CD2 3.94Å; M132-L137 HydrophobicContact CE-CG 4.43Å; M132-L137 PolarHBondContact O-N 3.12Å; Q135-L137 PolarHBondContact O-N 2.81Å
138	L	78.5	Confident	73.2	Confident	65 Å²	65	120 Å²	120	34%	0.34	61%	0.613	S	S	.	*	S	Bend	trans	-125.9	122.6	173.5	-69	178.5	0	0	0	110.4	R129 M132 I133	R129-L138 HydrophobicContact CG-CD1 4.04Å; M132-L138 HydrophobicContact CB-CB 4.36Å; M132-L138 HydrophobicContact CB-CD1 3.74Å; M132-L138 HydrophobicContact CB-CG 3.87Å; M132-L138 HydrophobicContact CE-CD1 3.74Å; M132-L138 HydrophobicContact CE-CD2 3.9Å; M132-L138 HydrophobicContact CE-CG 3.56Å; M132-L138 HydrophobicContact CG-CD1 4.38Å; M132-L138 PolarHBondContact O-N 3.01Å; M132-L138 HydrophobicContact SD-CD1 3.7Å; M132-L138 HydrophobicContact SD-CG 4.17Å; I133-L138 HydrophobicContact CG1-CB 4.08Å
139	H	77.1	Confident	71.1	Confident	152 Å²	152	123.7 Å²	123.7	70%	0.704	63%	0.63	S	S	*	*			trans	-80.6	125.6	170.2	-61.7	-65	0	0	0	109.8	D141	H139-D141 VanDerWaalsContact C-N 3.28Å
140	T	68.9	Low	69.3	Low	81 Å²	81	122.2 Å²	122.2	50%	0.497	64%	0.64	S	S	.	*			trans	-78.7	-16.9	175.5	47.1	0	0	0	0	113.3	I133 K142	I133-T140 HydrophobicContact CB-CG2 4.45Å; I133-T140 HydrophobicContact CD1-CG2 3.42Å; I133-T140 VanDerWaalsContact CD1-CG2 3.42Å; I133-T140 HydrophobicContact CG1-CG2 3.72Å; I133-T140 HydrophobicContact CG2-CG2 3.83Å; T140-K142 PolarHBondContact O-N 3.45Å; T140-K142 VanDerWaalsContact O-N 3.16Å
141	D	62.9	Low	67.8	Low	112 Å²	112	124.9 Å²	124.9	60%	0.599	65%	0.649	S	S	*	*			trans	-68.2	119.9	-170.3	-61.1	-13	0	0	0	108	H139 I143	H139-D141 VanDerWaalsContact C-N 3.28Å; D141-I143 HydrophobicContact CB-CD1 4.4Å; D141-I143 HydrophobicContact CB-CG1 3.68Å; D141-I143 PolarHBondContact O-N 3.1Å
142	K	53.5	Low	66.3	Low	207 Å²	207	122.7 Å²	122.7	90%	0.9	65%	0.646	S	S	*	*			trans	-61.9	74.5	156	-70.9	177	177.9	179.7	0	106.2	T140 E144	T140-K142 PolarHBondContact O-N 3.45Å; T140-K142 VanDerWaalsContact O-N 3.16Å; K142-E144 PolarHBondContact O-N 3.46Å
143	I	51	Low	65.5	Low	115 Å²	115	126.6 Å²	126.6	59%	0.59	68%	0.679	S	S	*	*			trans	-65.6	107.8	176.5	-62.3	169.7	0	0	0	104.7	D141 S145	D141-I143 HydrophobicContact CB-CD1 4.4Å; D141-I143 HydrophobicContact CB-CG1 3.68Å; D141-I143 PolarHBondContact O-N 3.1Å; I143-S145 PolarHBondContact O-N 2.86Å; I143-S145 VanDerWaalsContact O-N 3.16Å
144	E	44.3	Very low	64.8	Low	165 Å²	165	131.4 Å²	131.4	77%	0.771	70%	0.698	S	S	*	*			trans	-36.6	119.8	164.6	-65.2	172.9	165.1	0	0	108.3	K142 S146	K142-E144 PolarHBondContact O-N 3.46Å; E144-S146 PolarHBondContact O-N 3.48Å
145	S	49.8	Very low	64.2	Low	135 Å²	135	125.7 Å²	125.7	94%	0.944	68%	0.68	S	S	*	*	S	Bend	trans	-54.6	80.1	179.7	-56.1	0	0	0	0	111.2	I143	I143-S145 PolarHBondContact O-N 2.86Å; I143-S145 VanDerWaalsContact O-N 3.16Å
146	S	46.5	Very low	63.3	Low	89 Å²	89	122.7 Å²	122.7	62%	0.622	67%	0.672	S	S	*	*			trans	-148	112.8	170.3	65.5	0	0	0	0	106.1	E144	E144-S146 PolarHBondContact O-N 3.48Å
147	N	46.1	Very low	62.9	Low	148 Å²	148	126.8 Å²	126.8	79%	0.791	67%	0.674	S	S	*	*			trans	86.9	32.6	171.2	-129.1	-4.1	0	0	0	119.3	Q149	N147-Q149 PolarHBondContact O-N 2.99Å
148	I	48.7	Very low	62.4	Low	153 Å²	153	125.9 Å²	125.9	79%	0.785	68%	0.678	S	S	*	*			trans	-86.7	90.4	147.3	-57.2	174.5	0	0	0	106.5	S150	I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.41Å
149	Q	50.3	Low	62.5	Low	166 Å²	166	128.5 Å²	128.5	78%	0.776	69%	0.693	S	S	*	*			trans	-47.5	106.6	153.7	-160.5	87.5	-19.4	0	0	105.7	N147 K151	N147-Q149 PolarHBondContact O-N 2.99Å; Q149-K151 PolarHBondContact O-N 2.91Å
150	S	53.1	Low	62.3	Low	101 Å²	101	127.8 Å²	127.8	71%	0.706	69%	0.693	S	S	*	*			trans	-52.7	97.8	-167.4	52.7	0	0	0	0	111.1	I148 P152	I148-S150 VanDerWaalsContact C-N 3.32Å; I148-S150 PolarHBondContact O-N 3.41Å; S150-P152 WeakPolarHBondContact O-CD 3.39Å
151	K	62.3	Low	62	Low	190 Å²	190	130.9 Å²	130.9	83%	0.826	70%	0.702	S	S	*	*			trans	-64.5	117.9	153.6	-83.2	175.8	179.5	175.8	0	104.9	Q149 S153	Q149-K151 PolarHBondContact O-N 2.91Å; K151-S153 PolarHBondContact O-N 3.25Å
152	P	61.1	Low	61.8	Low	76 Å²	76	131.3 Å²	131.3	49%	0.494	71%	0.709	S	S	.	*			trans	-60.3	133.5	-178.1	27.4	-34.7	0	0	0	108	S150 F154 V156	S150-P152 WeakPolarHBondContact O-CD 3.39Å; P152-F154 VanDerWaalsContact CB-O 3.32Å; P152-F154 WeakPolarHBondContact CB-O 3.32Å; P152-F154 WeakPolarHBondContact CG-O 3.46Å; P152-F154 PolarHBondContact O-N 2.94Å; P152-V156 HydrophobicContact CB-CG2 3.66Å; P152-V156 HydrophobicContact CG-CB 4.1Å; P152-V156 HydrophobicContact CG-CG2 3.37Å
153	S	74.2	Confident	62.2	Low	140 Å²	140	125.7 Å²	125.7	98%	0.979	70%	0.695	S	S	*	*	S	Bend	trans	-61.6	-12.4	177	-161	0	0	0	0	112.3	K151	K151-S153 PolarHBondContact O-N 3.25Å
154	F	77.8	Confident	62.8	Low	151 Å²	151	125.3 Å²	125.3	66%	0.662	70%	0.7	S	S	*	*	S	Bend	trans	-122.1	144.5	177.8	-169.1	-95.7	0	0	0	109.5	P152 V156 Y157	P152-F154 VanDerWaalsContact CB-O 3.32Å; P152-F154 WeakPolarHBondContact CB-O 3.32Å; P152-F154 WeakPolarHBondContact CG-O 3.46Å; P152-F154 PolarHBondContact O-N 2.94Å; F154-V156 PolarHBondContact O-N 3.37Å; F154-Y157 HydrophobicContact CE1-CE2 4.48Å
155	P	79.2	Confident	63.7	Low	66 Å²	66	124 Å²	124	43%	0.429	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-54.4	126.7	174.7	22.1	-34.6	0	0	0	111.3	Y157	P155-Y157 HydrophobicContact CB-CD2 4.48Å; P155-Y157 HydrophobicContact CB-CE2 3.74Å; P155-Y157 HydrophobicContact CG-CE2 3.79Å
156	V	73.2	Confident	64	Low	91 Å²	91	127 Å²	127	55%	0.552	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-96.4	121.5	172.8	168.8	0	0	0	0	108.2	P152 F154	P152-V156 HydrophobicContact CB-CG2 3.66Å; P152-V156 HydrophobicContact CG-CB 4.1Å; P152-V156 HydrophobicContact CG-CG2 3.37Å; F154-V156 PolarHBondContact O-N 3.37Å
157	Y	77.3	Confident	64.3	Low	133 Å²	133	129.2 Å²	129.2	52%	0.522	70%	0.703	S	S	.	*	P	Polyproline II helix	trans	-101.9	127.8	-179.8	-60.2	-87.2	0	0	0	110	F154 P155 D159 L160	F154-Y157 HydrophobicContact CE1-CE2 4.48Å; P155-Y157 HydrophobicContact CB-CD2 4.48Å; P155-Y157 HydrophobicContact CB-CE2 3.74Å; P155-Y157 HydrophobicContact CG-CE2 3.79Å; Y157-D159 VanDerWaalsContact C-N 3.31Å; Y157-D159 WeakPolarHBondContact CB-OD1 3.34Å; Y157-D159 PolarHBondContact O-N 2.83Å; Y157-L160 PolarHBondContact O-N 3.32Å
158	S	75.7	Confident	64.2	Low	108 Å²	108	130.7 Å²	130.7	76%	0.755	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-69.2	-25.6	-173.3	44	0	0	0	0	113.9	L160 Q161	S158-L160 VanDerWaalsContact C-N 3.26Å; S158-L160 PolarHBondContact O-N 3.48Å; S158-Q161 PolarHBondContact O-N 3.22Å
159	D	78.8	Confident	64.4	Low	120 Å²	120	135.1 Å²	135.1	64%	0.642	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-70.6	-17.9	176.6	56.5	-16.6	0	0	0	113.7	Y157	Y157-D159 VanDerWaalsContact C-N 3.31Å; Y157-D159 WeakPolarHBondContact CB-OD1 3.34Å; Y157-D159 PolarHBondContact O-N 2.83Å
160	L	73.9	Confident	65.1	Low	136 Å²	136	133.6 Å²	133.6	71%	0.712	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-92.2	-5.8	175.2	-60.9	178.8	0	0	0	113.4	Y157 S158 T162	Y157-L160 PolarHBondContact O-N 3.32Å; S158-L160 VanDerWaalsContact C-N 3.26Å; S158-L160 PolarHBondContact O-N 3.48Å; L160-T162 PolarHBondContact O-N 2.98Å
161	Q	62	Low	65.7	Low	147 Å²	147	135.3 Å²	135.3	69%	0.687	73%	0.726	S	S	*	*			trans	-89.9	46.3	174.1	-65	-166.3	-3.1	0	0	111.8	S158 S163	S158-Q161 PolarHBondContact O-N 3.22Å; Q161-S163 PolarHBondContact O-N 3.46Å
162	T	60.2	Low	65.9	Low	120 Å²	120	132.2 Å²	132.2	74%	0.736	72%	0.72	S	S	*	*			trans	-81.2	90.8	158.9	43.4	0	0	0	0	108.1	L160	L160-T162 PolarHBondContact O-N 2.98Å
163	S	61.3	Low	66.2	Low	89 Å²	89	135.5 Å²	135.5	62%	0.622	73%	0.734	S	S	*	*			trans	-70.3	130.4	164.9	-157.3	0	0	0	0	108	Q161 D165	Q161-S163 PolarHBondContact O-N 3.46Å; S163-D165 PolarHBondContact O-N 3.45Å
164	P	62.6	Low	65.7	Low	107 Å²	107	135.3 Å²	135.3	70%	0.695	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-63.5	-4	-171.5	-22.3	32.8	0	0	0	116.4	N167	P164-N167 PolarHBondContact O-OD1 3.38Å
165	D	62.9	Low	64.9	Low	139 Å²	139	134.2 Å²	134.2	74%	0.743	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-93.8	1.3	-169.2	-72.6	-28.5	0	0	0	115.3	S163 N167	S163-D165 PolarHBondContact O-N 3.45Å; D165-N167 PolarHBondContact O-N 3.26Å
166	E	56.7	Low	63.9	Low	196 Å²	196	139.1 Å²	139.1	92%	0.916	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-88.6	10.6	178.5	-91.8	-169.1	169.2	0	0	115.7
167	N	52.3	Low	63.2	Low	136 Å²	136	142.8 Å²	142.8	73%	0.727	76%	0.758	S	S	*	*			trans	-104.4	53.2	171.9	75.1	-14.3	0	0	0	113.6	P164 D165	P164-N167 PolarHBondContact O-OD1 3.38Å; D165-N167 PolarHBondContact O-N 3.26Å
168	K	45.3	Very low	62	Low	180 Å²	180	143.6 Å²	143.6	78%	0.783	78%	0.777	S	S	*	*			trans	-133.6	86.2	165	-68.3	-172.9	-176.3	173.1	0	111.1
169	N	52	Low	60.7	Low	245 Å²	245	146.8 Å²	146.8	100%	1.31	78%	0.779	S	S	*	*			trans	-126.1	0	149.3	-92.2	-27.2	0	0	0	107.8

Retrieved 169 of 169 residues in 126.8 ms (Link to these results)

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