G4V9F8_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession G4V9F8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 191 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	30.3	Very low	67.9	Low	154 Å²	154	100.6 Å²	100.6	76%	0.759	58%	0.576	S	S	*	*				0	94.4	0	-110.3	161.5	-30.3	0	0	109.5	S3 T149	M1-S3 PolarHBondContact O-N 3.02Å; M1-T149 HydrophobicContact CB-CG2 3.82Å; M1-T149 HydrophobicContact CE-CG2 3.37Å; M1-T149 HydrophobicContact CG-CG2 3.22Å; M1-T149 HydrophobicContact SD-CG2 3.35Å; M1-T149 WeakPolarHBondContact SD-CG2 3.42Å
2	N	36.8	Very low	70.2	Confident	144 Å²	144	97.9 Å²	97.9	77%	0.77	57%	0.567	S	S	*	*			trans	-80.8	104.4	163.8	-87.6	-3.5	0	0	0	106.2	F4	N2-F4 VanDerWaalsContact C-N 3.25Å; N2-F4 HydrophobicContact CB-CE2 4.21Å; N2-F4 WeakPolarHBondContact O-CD2 3.44Å; N2-F4 PolarHBondContact O-N 3.03Å
3	S	43	Very low	71.9	Confident	114 Å²	114	94.2 Å²	94.2	80%	0.797	56%	0.562	S	S	*	*			trans	-65.2	87	176.5	-54.5	0	0	0	0	109.5	M1 N5	M1-S3 PolarHBondContact O-N 3.02Å; S3-N5 VanDerWaalsContact C-N 3.27Å; S3-N5 PolarHBondContact O-N 3.14Å
4	F	49.6	Very low	73.5	Confident	146 Å²	146	96.1 Å²	96.1	64%	0.64	56%	0.56	S	S	*	*			trans	-63.7	98.7	158.6	-70.6	-84.3	0	0	0	105.6	N2 D6	N2-F4 VanDerWaalsContact C-N 3.25Å; N2-F4 HydrophobicContact CB-CE2 4.21Å; N2-F4 WeakPolarHBondContact O-CD2 3.44Å; N2-F4 PolarHBondContact O-N 3.03Å; F4-D6 PolarHBondContact O-N 3.18Å
5	N	63.6	Low	74.8	Confident	88 Å²	88	95.7 Å²	95.7	47%	0.471	56%	0.559	S	S	.	*			trans	-72.3	74.3	171.2	177.3	72.3	0	0	0	107.3	S3 Q7	S3-N5 VanDerWaalsContact C-N 3.27Å; S3-N5 PolarHBondContact O-N 3.14Å; N5-Q7 VanDerWaalsContact ND2-CD 3.28Å; N5-Q7 WeakPolarHBondContact ND2-CG 3.36Å; N5-Q7 PolarHBondContact ND2-NE2 3.38Å; N5-Q7 PolarHBondContact O-N 3.27Å
6	D	75.1	Confident	75.7	Confident	92 Å²	92	91.1 Å²	91.1	49%	0.492	53%	0.532	S	S	.	.			trans	-64.6	113	172.8	-71.6	-17.2	0	0	0	107.5	F4 V15 S17	F4-D6 PolarHBondContact O-N 3.18Å; D6-V15 HydrophobicContact CB-CG1 3.77Å; D6-S17 WeakPolarHBondContact OD1-CA 3.39Å; D6-S17 WeakPolarHBondContact OD1-CB 3.4Å
7	Q	80.4	Confident	76.5	Confident	76 Å²	76	89.3 Å²	89.3	36%	0.355	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.8	177.9	-71.8	-178.1	-23.3	0	0	108.9	N5 V16 M22	N5-Q7 VanDerWaalsContact ND2-CD 3.28Å; N5-Q7 WeakPolarHBondContact ND2-CG 3.36Å; N5-Q7 PolarHBondContact ND2-NE2 3.38Å; N5-Q7 PolarHBondContact O-N 3.27Å; Q7-V16 PolarHBondContact N-O 3.21Å; Q7-V16 PolarHBondContact O-N 3.18Å; Q7-M22 HydrophobicContact CB-CE 4.25Å; Q7-M22 WeakPolarHBondContact O-CE 3.43Å
8	A	91.1	Very high	77.2	Confident	64 Å²	64	88.3 Å²	88.3	53%	0.529	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.4	170.5	0	0	0	0	0	110.2	A10 V15 M22	A8-A10 PolarHBondContact O-N 2.89Å; A8-V15 HydrophobicContact CB-CG2 4.19Å; A8-M22 VanDerWaalsContact C-CE 3.47Å
9	C	93.6	Very high	77.8	Confident	3 Å²	3	91.8 Å²	91.8	2%	0.02	53%	0.529	C	S	.	.			trans	-68	124.5	173	177.5	0	0	0	0	109.2	L11 C12 G13 K14 M22 H25	C9-L11 PolarHBondContact O-N 2.85Å; C9-L11 PolarHBondContact SG-N 3.34Å; C9-L11 VanDerWaalsContact SG-N 3.44Å; C9-C12 PolarHBondContact O-N 3.38Å; C9-G13 VanDerWaalsContact O-CA 3.22Å; C9-G13 WeakPolarHBondContact O-CA 3.31Å; C9-G13 PolarHBondContact O-N 3.34Å; C9-K14 HydrophobicContact CB-CB 4.43Å; C9-K14 WeakPolarHBondContact CB-O 3.37Å; C9-K14 PolarHBondContact N-O 3.13Å; C9-M22 HydrophobicContact CB-CE 3.94Å; C9-M22 HydrophobicContact CB-SD 3.77Å; C9-M22 VanDerWaalsContact N-CE 3.26Å; C9-H25 WeakPolarHBondContact CB-NE2 3.31Å; C9-H25 PolarHBondContact SG-NE2 3.33Å
10	A	91.7	Very high	78.4	Confident	107 Å²	107	94.7 Å²	94.7	88%	0.884	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.3	179.7	0	0	0	0	0	113.7	A8	A8-A10 PolarHBondContact O-N 2.89Å
11	L	92.1	Very high	78.9	Confident	119 Å²	119	90.3 Å²	90.3	62%	0.623	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-25.4	-176.1	-60.1	177.5	0	0	0	113.9	C9 L26 H30	C9-L11 PolarHBondContact O-N 2.85Å; C9-L11 PolarHBondContact SG-N 3.34Å; C9-L11 VanDerWaalsContact SG-N 3.44Å; L11-L26 HydrophobicContact CD1-CD2 4.03Å; L11-H30 WeakPolarHBondContact CB-CE1 3.29Å; L11-H30 HydrophobicContact CD1-CB 3.81Å
12	C	95.1	Very high	81.9	Confident	68 Å²	68	83.9 Å²	83.9	46%	0.459	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	1.9	-179.9	67.7	0	0	0	0	115.4	C9 K14 H25 H30	C9-C12 PolarHBondContact O-N 3.38Å; C12-K14 PolarHBondContact O-N 2.84Å; C12-K14 VanDerWaalsContact O-N 3.17Å; C12-K14 VanDerWaalsContact SG-CB 3.59Å; C12-H25 PolarHBondContact SG-CE1 3.26Å; C12-H25 PolarHBondContact SG-NE2 3Å; C12-H30 PolarHBondContact SG-NE2 3.42Å; C12-H30 VanDerWaalsContact SG-NE2 3.38Å
13	G	92.8	Very high	84.5	Confident	49 Å²	49	79.2 Å²	79.2	51%	0.505	46%	0.463	S	S	.	.			trans	73.6	-2.7	-179	0	0	0	0	0	115.3	C9 V15	C9-G13 VanDerWaalsContact O-CA 3.22Å; C9-G13 WeakPolarHBondContact O-CA 3.31Å; C9-G13 PolarHBondContact O-N 3.34Å; G13-V15 PolarHBondContact O-N 3.14Å
14	K	93.9	Very high	86.7	Confident	122 Å²	122	79 Å²	79	53%	0.53	45%	0.445	S	S	.	.			trans	-62.5	123	-179.7	-173.7	173.3	-174.4	169.1	0	111.4	C9 C12 V16	C9-K14 HydrophobicContact CB-CB 4.43Å; C9-K14 WeakPolarHBondContact CB-O 3.37Å; C9-K14 PolarHBondContact N-O 3.13Å; C12-K14 PolarHBondContact O-N 2.84Å; C12-K14 VanDerWaalsContact O-N 3.17Å; C12-K14 VanDerWaalsContact SG-CB 3.59Å; K14-V16 HydrophobicContact CG-CG2 4.48Å
15	V	92.6	Very high	88.7	Confident	90 Å²	90	72.7 Å²	72.7	55%	0.545	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	129.1	177.5	-176.2	0	0	0	0	110.5	D6 A8 G13	D6-V15 HydrophobicContact CB-CG1 3.77Å; A8-V15 HydrophobicContact CB-CG2 4.19Å; G13-V15 PolarHBondContact O-N 3.14Å
16	V	89.7	Confident	90.1	Very high	21 Å²	21	71 Å²	71	13%	0.127	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.2	176.7	-171.2	0	0	0	0	109.9	Q7 K14 T18 G21 M22 H25	Q7-V16 PolarHBondContact N-O 3.21Å; Q7-V16 PolarHBondContact O-N 3.18Å; K14-V16 HydrophobicContact CG-CG2 4.48Å; V16-T18 VanDerWaalsContact C-N 3.3Å; V16-T18 PolarHBondContact O-N 2.96Å; V16-G21 VanDerWaalsContact CG1-C 3.43Å; V16-M22 HydrophobicContact CB-CB 4.4Å; V16-M22 HydrophobicContact CB-CE 3.96Å; V16-M22 HydrophobicContact CG2-CE 3.97Å; V16-M22 HydrophobicContact CG2-SD 4.41Å; V16-H25 HydrophobicContact CG2-CB 4.29Å
17	S	89	Confident	90.9	Very high	61 Å²	61	71.7 Å²	71.7	43%	0.427	41%	0.407	S	S	.	.	S	Bend	trans	-80.5	-3.1	-169.7	58.3	0	0	0	0	116.1	D6	D6-S17 WeakPolarHBondContact OD1-CA 3.39Å; D6-S17 WeakPolarHBondContact OD1-CB 3.4Å
18	T	88.8	Confident	91.4	Very high	71 Å²	71	70.5 Å²	70.5	44%	0.436	40%	0.402	S	S	.	.	S	Bend	trans	-141.1	143.7	-180	63.2	0	0	0	0	110.7	V16 H20 G21 M22	V16-T18 VanDerWaalsContact C-N 3.3Å; V16-T18 PolarHBondContact O-N 2.96Å; T18-H20 PolarHBondContact O-N 3.17Å; T18-G21 PolarHBondContact O-N 3.36Å; T18-G21 PolarHBondContact OG1-N 3.12Å; T18-M22 PolarHBondContact O-N 2.88Å
19	K	89.3	Confident	91.5	Very high	155 Å²	155	71.4 Å²	71.4	67%	0.674	40%	0.401	S	S	*	.	H	α-helix	trans	-54.9	-41	173.7	-66.5	-176.7	177.8	-178.8	0	112.1	M22 A23	K19-M22 PolarHBondContact O-N 3.4Å; K19-A23 PolarHBondContact O-N 2.75Å
20	H	88.7	Confident	91.5	Very high	149 Å²	149	74.6 Å²	74.6	69%	0.69	42%	0.415	S	S	*	.	H	α-helix	trans	-65.5	-40.6	177	-173.2	76	0	0	0	112.2	T18 R24	T18-H20 PolarHBondContact O-N 3.17Å; H20-R24 WeakPolarHBondContact O-CB 3.49Å; H20-R24 PolarHBondContact O-N 2.82Å
21	G	90.1	Very high	91.5	Very high	4 Å²	4	75.2 Å²	75.2	4%	0.041	40%	0.4	C	S	.	.	H	α-helix	trans	-63.2	-40.8	173.6	0	0	0	0	0	112.6	V16 T18 R24 H25	V16-G21 VanDerWaalsContact CG1-C 3.43Å; T18-G21 PolarHBondContact O-N 3.36Å; T18-G21 PolarHBondContact OG1-N 3.12Å; G21-R24 PolarHBondContact O-N 2.86Å; G21-H25 WeakPolarHBondContact O-CB 3.33Å; G21-H25 PolarHBondContact O-N 3.2Å
22	M	92.6	Very high	91.3	Very high	18 Å²	18	72.1 Å²	72.1	9%	0.089	40%	0.396	C	S	.	.	H	α-helix	trans	-64	-48.7	176.7	-177.4	56.9	74.8	0	0	111.4	Q7 A8 C9 V16 T18 K19 R24 H25 L26	Q7-M22 HydrophobicContact CB-CE 4.25Å; Q7-M22 WeakPolarHBondContact O-CE 3.43Å; A8-M22 VanDerWaalsContact C-CE 3.47Å; C9-M22 HydrophobicContact CB-CE 3.94Å; C9-M22 HydrophobicContact CB-SD 3.77Å; C9-M22 VanDerWaalsContact N-CE 3.26Å; V16-M22 HydrophobicContact CB-CB 4.4Å; V16-M22 HydrophobicContact CB-CE 3.96Å; V16-M22 HydrophobicContact CG2-CE 3.97Å; V16-M22 HydrophobicContact CG2-SD 4.41Å; T18-M22 PolarHBondContact O-N 2.88Å; K19-M22 PolarHBondContact O-N 3.4Å; M22-R24 VanDerWaalsContact C-N 3.25Å; M22-R24 PolarHBondContact O-N 3.23Å; M22-H25 WeakPolarHBondContact O-CB 3.38Å; M22-H25 PolarHBondContact O-N 3.36Å; M22-L26 HydrophobicContact CG-CD1 4.49Å; M22-L26 WeakPolarHBondContact O-CG 3.3Å; M22-L26 PolarHBondContact O-N 3.3Å; M22-L26 HydrophobicContact SD-CG 4.45Å
23	A	91.3	Very high	90.9	Very high	47 Å²	47	73.1 Å²	73.1	39%	0.388	40%	0.397	S	S	.	.	H	α-helix	trans	-57.3	-40.1	176.1	0	0	0	0	0	112	K19 K27	K19-A23 PolarHBondContact O-N 2.75Å; A23-K27 WeakPolarHBondContact O-CG 3.24Å; A23-K27 PolarHBondContact O-N 2.66Å
24	R	89.1	Confident	90.4	Very high	109 Å²	109	77.8 Å²	77.8	41%	0.411	41%	0.405	S	S	.	.	H	α-helix	trans	-66.2	-43.2	174.1	-175.9	-172.5	68.9	-156.6	1.7	112.1	H20 G21 M22 L26 K27 I28	H20-R24 WeakPolarHBondContact O-CB 3.49Å; H20-R24 PolarHBondContact O-N 2.82Å; G21-R24 PolarHBondContact O-N 2.86Å; M22-R24 VanDerWaalsContact C-N 3.25Å; M22-R24 PolarHBondContact O-N 3.23Å; R24-L26 VanDerWaalsContact C-N 3.35Å; R24-K27 PolarHBondContact O-N 3.38Å; R24-I28 HydrophobicContact CG-CD1 3.61Å; R24-I28 HydrophobicContact CG-CG1 4.35Å; R24-I28 WeakPolarHBondContact O-CG1 3.42Å; R24-I28 PolarHBondContact O-N 3.06Å
25	H	91.9	Very high	90.2	Very high	13 Å²	13	74.6 Å²	74.6	6%	0.06	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-45.8	178.7	162.9	62.1	0	0	0	111.6	C9 C12 V16 G21 M22 K27 I28 V29 H30	C9-H25 WeakPolarHBondContact CB-NE2 3.31Å; C9-H25 PolarHBondContact SG-NE2 3.33Å; C12-H25 PolarHBondContact SG-CE1 3.26Å; C12-H25 PolarHBondContact SG-NE2 3Å; V16-H25 HydrophobicContact CG2-CB 4.29Å; G21-H25 WeakPolarHBondContact O-CB 3.33Å; G21-H25 PolarHBondContact O-N 3.2Å; M22-H25 WeakPolarHBondContact O-CB 3.38Å; M22-H25 PolarHBondContact O-N 3.36Å; H25-K27 PolarHBondContact O-N 3.46Å; H25-I28 PolarHBondContact O-N 2.95Å; H25-V29 VanDerWaalsContact ND1-CG2 3.34Å; H25-V29 WeakPolarHBondContact ND1-CG2 3.04Å; H25-V29 VanDerWaalsContact O-CB 3.31Å; H25-V29 WeakPolarHBondContact O-CB 3.4Å; H25-V29 WeakPolarHBondContact O-CG2 3.4Å; H25-V29 PolarHBondContact O-N 3.04Å; H25-H30 AromaticContact CE1-NE2 3.81Å; H25-H30 AromaticContact NE2-CD2 3.75Å; H25-H30 AromaticContact NE2-NE2 3.46Å; H25-H30 PolarHBondContact NE2-NE2 3.41Å
26	L	92.8	Very high	90.1	Very high	54 Å²	54	71.9 Å²	71.9	28%	0.283	38%	0.377	S	S	.	.	I	π-helix	trans	-57.5	-49.6	175.5	-66.8	173.6	0	0	0	111.2	L11 M22 R24 I28 H30 E31	L11-L26 HydrophobicContact CD1-CD2 4.03Å; M22-L26 HydrophobicContact CG-CD1 4.49Å; M22-L26 WeakPolarHBondContact O-CG 3.3Å; M22-L26 PolarHBondContact O-N 3.3Å; M22-L26 HydrophobicContact SD-CG 4.45Å; R24-L26 VanDerWaalsContact C-N 3.35Å; L26-I28 PolarHBondContact O-N 3.25Å; L26-H30 CarbonylContact O-C 3.54Å; L26-H30 WeakPolarHBondContact O-CA 3.4Å; L26-H30 WeakPolarHBondContact O-CB 3.32Å; L26-H30 PolarHBondContact O-N 3.48Å; L26-E31 PolarHBondContact O-N 2.85Å
27	K	91.9	Very high	90.3	Very high	106 Å²	106	76.1 Å²	76.1	46%	0.461	39%	0.394	S	S	.	.	I	π-helix	trans	-55.8	-48.4	177.7	-76.1	-176.1	178.5	-168.7	0	113.4	A23 R24 H25 E31 G32 L33	A23-K27 WeakPolarHBondContact O-CG 3.24Å; A23-K27 PolarHBondContact O-N 2.66Å; R24-K27 PolarHBondContact O-N 3.38Å; H25-K27 PolarHBondContact O-N 3.46Å; K27-E31 CarbonylContact O-C 3.52Å; K27-E31 WeakPolarHBondContact O-CB 3.48Å; K27-G32 PolarHBondContact O-N 3.48Å; K27-L33 HydrophobicContact CB-CB 4.43Å; K27-L33 HydrophobicContact CB-CD1 3.9Å; K27-L33 HydrophobicContact CD-CD1 4.14Å; K27-L33 HydrophobicContact CG-CD1 3.96Å; K27-L33 WeakPolarHBondContact O-CB 3.09Å; K27-L33 PolarHBondContact O-N 2.84Å
28	I	91.2	Very high	90.6	Very high	51 Å²	51	73.2 Å²	73.2	26%	0.262	37%	0.374	S	S	.	.	I	π-helix	trans	-78.2	-45.7	-174.2	-61.6	168.2	0	0	0	111.6	R24 H25 L26 L33 E35	R24-I28 HydrophobicContact CG-CD1 3.61Å; R24-I28 HydrophobicContact CG-CG1 4.35Å; R24-I28 WeakPolarHBondContact O-CG1 3.42Å; R24-I28 PolarHBondContact O-N 3.06Å; H25-I28 PolarHBondContact O-N 2.95Å; L26-I28 PolarHBondContact O-N 3.25Å; I28-L33 WeakPolarHBondContact CA-O 3.38Å; I28-E35 HydrophobicContact CD1-CG 3.58Å; I28-E35 HydrophobicContact CG1-CG 4.16Å; I28-E35 HydrophobicContact CG2-CG 4.33Å
29	V	92.9	Very high	90.9	Very high	83 Å²	83	77 Å²	77	50%	0.503	39%	0.391	S	S	.	.	I	π-helix	trans	-89.5	-34.5	-168.5	-178.8	0	0	0	0	112.1	H25	H25-V29 VanDerWaalsContact ND1-CG2 3.34Å; H25-V29 WeakPolarHBondContact ND1-CG2 3.04Å; H25-V29 VanDerWaalsContact O-CB 3.31Å; H25-V29 WeakPolarHBondContact O-CB 3.4Å; H25-V29 WeakPolarHBondContact O-CG2 3.4Å; H25-V29 PolarHBondContact O-N 3.04Å
30	H	93.8	Very high	91.1	Very high	69 Å²	69	74.1 Å²	74.1	32%	0.319	39%	0.39	S	S	.	.	I	π-helix	trans	-108.5	-32.6	-173	-64.6	-68.1	0	0	0	113.2	L11 C12 H25 L26	L11-H30 WeakPolarHBondContact CB-CE1 3.29Å; L11-H30 HydrophobicContact CD1-CB 3.81Å; C12-H30 PolarHBondContact SG-NE2 3.42Å; C12-H30 VanDerWaalsContact SG-NE2 3.38Å; H25-H30 AromaticContact CE1-NE2 3.81Å; H25-H30 AromaticContact NE2-CD2 3.75Å; H25-H30 AromaticContact NE2-NE2 3.46Å; H25-H30 PolarHBondContact NE2-NE2 3.41Å; L26-H30 CarbonylContact O-C 3.54Å; L26-H30 WeakPolarHBondContact O-CA 3.4Å; L26-H30 WeakPolarHBondContact O-CB 3.32Å; L26-H30 PolarHBondContact O-N 3.48Å
31	E	92.2	Very high	91.4	Very high	121 Å²	121	70.1 Å²	70.1	57%	0.565	38%	0.379	S	S	*	.	S	Bend	trans	-93.2	-7.3	173.8	-56.3	170.2	-160.8	0	0	112.8	L26 K27 L33	L26-E31 PolarHBondContact O-N 2.85Å; K27-E31 CarbonylContact O-C 3.52Å; K27-E31 WeakPolarHBondContact O-CB 3.48Å; E31-L33 VanDerWaalsContact C-N 3.27Å; E31-L33 HydrophobicContact CB-CG 4.37Å; E31-L33 PolarHBondContact O-N 2.81Å
32	G	86.8	Confident	91.6	Very high	53 Å²	53	71.5 Å²	71.5	55%	0.546	39%	0.392	S	S	.	.			trans	68.7	20.5	178.4	0	0	0	0	0	114.5	K27 E34	K27-G32 PolarHBondContact O-N 3.48Å; G32-E34 PolarHBondContact O-N 3.38Å
33	L	87.2	Confident	91.7	Very high	89 Å²	89	78.2 Å²	78.2	47%	0.466	42%	0.417	S	S	.	.			trans	-71.2	113.5	175.9	-67	178.6	0	0	0	110.2	K27 I28 E31	K27-L33 HydrophobicContact CB-CB 4.43Å; K27-L33 HydrophobicContact CB-CD1 3.9Å; K27-L33 HydrophobicContact CD-CD1 4.14Å; K27-L33 HydrophobicContact CG-CD1 3.96Å; K27-L33 WeakPolarHBondContact O-CB 3.09Å; K27-L33 PolarHBondContact O-N 2.84Å; I28-L33 WeakPolarHBondContact CA-O 3.38Å; E31-L33 VanDerWaalsContact C-N 3.27Å; E31-L33 HydrophobicContact CB-CG 4.37Å; E31-L33 PolarHBondContact O-N 2.81Å
34	E	83.5	Confident	91.7	Very high	147 Å²	147	80.6 Å²	80.6	69%	0.687	42%	0.418	S	S	*	.			trans	-64.5	142.9	179.4	-80.8	-66.8	154	0	0	112.7	G32 K44	G32-E34 PolarHBondContact O-N 3.38Å; E34-K44 IonicContact OE2-NZ 3.94Å; E34-K44 PolarHBondContact OE2-NZ 3.42Å
35	E	88.4	Confident	91.8	Very high	56 Å²	56	76.7 Å²	76.7	26%	0.262	40%	0.404	S	S	.	.			trans	-70	158.6	171	-66.9	-171.9	105.3	0	0	111.1	I28 K37 K44	I28-E35 HydrophobicContact CD1-CG 3.58Å; I28-E35 HydrophobicContact CG1-CG 4.16Å; I28-E35 HydrophobicContact CG2-CG 4.33Å; E35-K37 PolarHBondContact O-N 3.11Å; E35-K44 HydrophobicContact CB-CB 3.92Å; E35-K44 HydrophobicContact CB-CD 4.17Å; E35-K44 HydrophobicContact CB-CG 4.37Å; E35-K44 VanDerWaalsContact OE2-CB 3.32Å; E35-K44 WeakPolarHBondContact OE2-CB 3.37Å; E35-K44 VanDerWaalsContact OE2-CD 3.29Å; E35-K44 WeakPolarHBondContact OE2-CD 3.45Å
36	C	90.7	Very high	91.6	Very high	32 Å²	32	79.4 Å²	79.4	22%	0.216	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	105.2	171.4	-60.1	0	0	0	0	108.7	K44 F45 L51	C36-K44 CarbonylContact O-C 3.47Å; C36-F45 HydrophobicContact CB-CB 4.37Å; C36-F45 WeakPolarHBondContact CB-O 3.13Å; C36-F45 PolarHBondContact N-O 2.98Å; C36-F45 PolarHBondContact O-N 3.23Å; C36-L51 HydrophobicContact CB-CB 4.03Å; C36-L51 HydrophobicContact CB-CD2 3.79Å
37	K	93.8	Very high	91.2	Very high	110 Å²	110	80 Å²	80	48%	0.478	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.7	-180	-172.3	-178.3	173.3	-171.3	0	110.8	E35 K44 L51	E35-K37 PolarHBondContact O-N 3.11Å; K37-K44 HydrophobicContact CB-CG 4.46Å; K37-K44 HydrophobicContact CG-CG 4.38Å; K37-L51 WeakPolarHBondContact O-CD2 3.39Å
38	C	95.9	Very high	91.1	Very high	1 Å²	1	82.3 Å²	82.3	1%	0.007	44%	0.438	C	S	.	.			trans	-79.3	120.7	165.7	177.8	0	0	0	0	109.2	S40 C41 G42 R43 F45 L51 H59	C38-S40 VanDerWaalsContact C-N 3.3Å; C38-S40 PolarHBondContact O-N 3.11Å; C38-C41 VanDerWaalsContact SG-SG 3.61Å; C38-G42 WeakPolarHBondContact O-CA 2.96Å; C38-G42 PolarHBondContact O-N 3.47Å; C38-R43 PolarHBondContact N-O 2.9Å; C38-F45 HydrophobicContact CB-CE2 4.13Å; C38-L51 VanDerWaalsContact CA-CD1 3.5Å; C38-L51 HydrophobicContact CB-CD1 3.53Å; C38-H59 PolarHBondContact SG-NE2 3.36Å; C38-H59 VanDerWaalsContact SG-NE2 3.39Å
39	D	94.5	Very high	90.8	Very high	150 Å²	150	86 Å²	86	80%	0.802	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-28.9	-178.6	-62	-38.6	0	0	0	112.6
40	S	93.3	Very high	90.5	Very high	94 Å²	94	82.8 Å²	82.8	66%	0.657	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-32.1	-178.9	-49.5	0	0	0	0	114.2	C38	C38-S40 VanDerWaalsContact C-N 3.3Å; C38-S40 PolarHBondContact O-N 3.11Å
41	C	95.5	Very high	90.5	Very high	66 Å²	66	80.6 Å²	80.6	45%	0.446	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-0.7	-178	71.7	0	0	0	0	115	C38 R43 H54	C38-C41 VanDerWaalsContact SG-SG 3.61Å; C41-R43 PolarHBondContact O-N 3.13Å; C41-R43 VanDerWaalsContact O-N 3.16Å; C41-R43 VanDerWaalsContact SG-CB 3.53Å; C41-H54 PolarHBondContact SG-NE2 3.38Å
42	G	93.6	Very high	90.4	Very high	32 Å²	32	80.2 Å²	80.2	33%	0.33	42%	0.424	S	S	.	.			trans	73	-2.1	-179.6	0	0	0	0	0	115.7	C38 K44	C38-G42 WeakPolarHBondContact O-CA 2.96Å; C38-G42 PolarHBondContact O-N 3.47Å; G42-K44 PolarHBondContact O-N 3.26Å
43	R	94.7	Very high	90.3	Very high	159 Å²	159	83.6 Å²	83.6	60%	0.6	42%	0.42	S	S	*	.			trans	-66.3	132	-178.1	-170.1	168.6	-176.2	173.9	7.4	111.3	C38 C41 F45	C38-R43 PolarHBondContact N-O 2.9Å; C41-R43 PolarHBondContact O-N 3.13Å; C41-R43 VanDerWaalsContact O-N 3.16Å; C41-R43 VanDerWaalsContact SG-CB 3.53Å; R43-F45 HydrophobicContact CB-CE2 3.87Å; R43-F45 HydrophobicContact CB-CZ 4.1Å; R43-F45 HydrophobicContact CG-CE1 4.44Å; R43-F45 HydrophobicContact CG-CE2 3.81Å; R43-F45 HydrophobicContact CG-CZ 3.67Å; R43-F45 WeakPolarHBondContact O-CD2 2.99Å; R43-F45 VanDerWaalsContact O-CE2 3.29Å; R43-F45 WeakPolarHBondContact O-CE2 3.49Å
44	K	92.6	Very high	90.5	Very high	97 Å²	97	80.1 Å²	80.1	42%	0.422	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	146.4	179	-62.5	-171.4	176.7	-154.8	0	112.1	E34 E35 C36 K37 G42	E34-K44 IonicContact OE2-NZ 3.94Å; E34-K44 PolarHBondContact OE2-NZ 3.42Å; E35-K44 HydrophobicContact CB-CB 3.92Å; E35-K44 HydrophobicContact CB-CD 4.17Å; E35-K44 HydrophobicContact CB-CG 4.37Å; E35-K44 VanDerWaalsContact OE2-CB 3.32Å; E35-K44 WeakPolarHBondContact OE2-CB 3.37Å; E35-K44 VanDerWaalsContact OE2-CD 3.29Å; E35-K44 WeakPolarHBondContact OE2-CD 3.45Å; C36-K44 CarbonylContact O-C 3.47Å; K37-K44 HydrophobicContact CB-CG 4.46Å; K37-K44 HydrophobicContact CG-CG 4.38Å; G42-K44 PolarHBondContact O-N 3.26Å
45	F	91	Very high	90.9	Very high	27 Å²	27	75.2 Å²	75.2	12%	0.118	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.2	-178.2	-61.1	-90.3	0	0	0	111	C36 C38 R43 T47 A50 L51 H54	C36-F45 HydrophobicContact CB-CB 4.37Å; C36-F45 WeakPolarHBondContact CB-O 3.13Å; C36-F45 PolarHBondContact N-O 2.98Å; C36-F45 PolarHBondContact O-N 3.23Å; C38-F45 HydrophobicContact CB-CE2 4.13Å; R43-F45 HydrophobicContact CB-CE2 3.87Å; R43-F45 HydrophobicContact CB-CZ 4.1Å; R43-F45 HydrophobicContact CG-CE1 4.44Å; R43-F45 HydrophobicContact CG-CE2 3.81Å; R43-F45 HydrophobicContact CG-CZ 3.67Å; R43-F45 WeakPolarHBondContact O-CD2 2.99Å; R43-F45 VanDerWaalsContact O-CE2 3.29Å; R43-F45 WeakPolarHBondContact O-CE2 3.49Å; F45-T47 VanDerWaalsContact C-N 3.32Å; F45-T47 PolarHBondContact O-N 2.84Å; F45-A50 HydrophobicContact CB-CB 4.2Å; F45-A50 HydrophobicContact CD1-CB 3.99Å; F45-A50 HydrophobicContact CG-CB 4.46Å; F45-L51 HydrophobicContact CB-CB 4.07Å; F45-L51 HydrophobicContact CD2-CB 3.91Å; F45-L51 HydrophobicContact CD2-CD1 3.6Å; F45-L51 HydrophobicContact CD2-CG 4.36Å; F45-L51 HydrophobicContact CE2-CD1 3.8Å; F45-L51 HydrophobicContact CG-CB 4.09Å; F45-H54 HydrophobicContact CE1-CB 3.61Å; F45-H54 AromaticContact CE1-CG 3.96Å; F45-H54 HydrophobicContact CE2-CB 3.99Å; F45-H54 AromaticContact CE2-CD2 3.41Å; F45-H54 VanDerWaalsContact CE2-CD2 3.41Å; F45-H54 WeakPolarHBondContact CE2-CD2 3.32Å; F45-H54 AromaticContact CE2-CG 3.75Å; F45-H54 HydrophobicContact CZ-CB 3.3Å; F45-H54 AromaticContact CZ-CD2 3.33Å; F45-H54 WeakPolarHBondContact CZ-CD2 3.21Å; F45-H54 AromaticContact CZ-CG 3.15Å; F45-H54 AromaticContact CZ-ND1 3.75Å; F45-H54 AromaticContact CZ-NE2 3.95Å
46	T	86.3	Confident	90.9	Very high	71 Å²	71	75.8 Å²	75.8	44%	0.436	38%	0.379	S	S	.	.	S	Bend	trans	-81.1	-12.6	-175.7	63.4	0	0	0	0	113.6
47	T	85.5	Confident	90.7	Very high	67 Å²	67	81.5 Å²	81.5	41%	0.411	40%	0.4	S	S	.	.	S	Bend	trans	-143.2	148.5	177.4	66.5	0	0	0	0	110.8	F45 F49 A50 L51	F45-T47 VanDerWaalsContact C-N 3.32Å; F45-T47 PolarHBondContact O-N 2.84Å; T47-F49 PolarHBondContact O-N 2.77Å; T47-A50 PolarHBondContact O-N 2.96Å; T47-A50 VanDerWaalsContact O-N 3.09Å; T47-A50 WeakPolarHBondContact OG1-CB 3.5Å; T47-A50 PolarHBondContact OG1-N 3.49Å; T47-L51 PolarHBondContact O-N 3.47Å; T47-L51 VanDerWaalsContact O-N 3.11Å
48	K	88.7	Confident	90.5	Very high	153 Å²	153	80.4 Å²	80.4	67%	0.665	40%	0.403	S	S	*	.	H	α-helix	trans	-56.5	-37.5	173.2	-70.2	-173.5	176.5	-177.2	0	112.1	A50 L51 H52	K48-A50 PolarHBondContact O-N 2.98Å; K48-L51 PolarHBondContact O-N 2.86Å; K48-H52 WeakPolarHBondContact O-CB 3.34Å; K48-H52 VanDerWaalsContact O-CG 3.31Å; K48-H52 PolarHBondContact O-N 3.33Å
49	F	85.6	Confident	90.4	Very high	128 Å²	128	84 Å²	84	56%	0.561	42%	0.419	S	S	*	.	H	α-helix	trans	-60.6	-43	175.8	-179.9	-96.3	0	0	0	112.5	T47 R53	T47-F49 PolarHBondContact O-N 2.77Å; F49-R53 WeakPolarHBondContact O-CB 3.4Å; F49-R53 PolarHBondContact O-N 2.77Å
50	A	87.6	Confident	90.2	Very high	17 Å²	17	81.9 Å²	81.9	14%	0.14	40%	0.404	C	S	.	.	H	α-helix	trans	-67.6	-39.3	178.2	0	0	0	0	0	112	F45 T47 K48 H54	F45-A50 HydrophobicContact CB-CB 4.2Å; F45-A50 HydrophobicContact CD1-CB 3.99Å; F45-A50 HydrophobicContact CG-CB 4.46Å; T47-A50 PolarHBondContact O-N 2.96Å; T47-A50 VanDerWaalsContact O-N 3.09Å; T47-A50 WeakPolarHBondContact OG1-CB 3.5Å; T47-A50 PolarHBondContact OG1-N 3.49Å; K48-A50 PolarHBondContact O-N 2.98Å; A50-H54 WeakPolarHBondContact O-CB 3.46Å; A50-H54 PolarHBondContact O-N 2.94Å
51	L	92.2	Very high	89.6	Confident	22 Å²	22	80.3 Å²	80.3	12%	0.115	40%	0.403	C	S	.	.	H	α-helix	trans	-61.2	-52.8	172.8	172.3	59.9	0	0	0	111.4	C36 K37 C38 F45 T47 K48 R53 H54 I55	C36-L51 HydrophobicContact CB-CB 4.03Å; C36-L51 HydrophobicContact CB-CD2 3.79Å; K37-L51 WeakPolarHBondContact O-CD2 3.39Å; C38-L51 VanDerWaalsContact CA-CD1 3.5Å; C38-L51 HydrophobicContact CB-CD1 3.53Å; F45-L51 HydrophobicContact CB-CB 4.07Å; F45-L51 HydrophobicContact CD2-CB 3.91Å; F45-L51 HydrophobicContact CD2-CD1 3.6Å; F45-L51 HydrophobicContact CD2-CG 4.36Å; F45-L51 HydrophobicContact CE2-CD1 3.8Å; F45-L51 HydrophobicContact CG-CB 4.09Å; T47-L51 PolarHBondContact O-N 3.47Å; T47-L51 VanDerWaalsContact O-N 3.11Å; K48-L51 PolarHBondContact O-N 2.86Å; L51-R53 VanDerWaalsContact C-N 3.33Å; L51-R53 PolarHBondContact O-N 3.4Å; L51-H54 WeakPolarHBondContact O-CA 3.41Å; L51-H54 WeakPolarHBondContact O-CB 3.39Å; L51-H54 PolarHBondContact O-N 3.34Å; L51-I55 HydrophobicContact CD1-CD1 3.79Å; L51-I55 HydrophobicContact CD1-CG1 4.03Å; L51-I55 HydrophobicContact CG-CD1 3.9Å; L51-I55 WeakPolarHBondContact O-CG1 3.47Å; L51-I55 PolarHBondContact O-N 2.86Å
52	H	90.3	Very high	88.8	Confident	114 Å²	114	79.9 Å²	79.9	53%	0.528	40%	0.396	S	S	.	.	H	α-helix	trans	-58.1	-44.9	178.3	-69.8	162	0	0	0	111.6	K48 H54 I55 R56	K48-H52 WeakPolarHBondContact O-CB 3.34Å; K48-H52 VanDerWaalsContact O-CG 3.31Å; K48-H52 PolarHBondContact O-N 3.33Å; H52-H54 VanDerWaalsContact C-N 3.25Å; H52-H54 PolarHBondContact O-N 3.08Å; H52-I55 PolarHBondContact O-N 3.34Å; H52-R56 VanDerWaalsContact O-CG 3.3Å; H52-R56 WeakPolarHBondContact O-CG 3.43Å; H52-R56 PolarHBondContact O-N 2.97Å
53	R	86.3	Confident	87.6	Confident	123 Å²	123	82.8 Å²	82.8	46%	0.464	41%	0.411	S	S	.	.	H	α-helix	trans	-59.6	-38.1	175.8	-173.7	-176.5	67.9	174	0.2	112	F49 L51 K57	F49-R53 WeakPolarHBondContact O-CB 3.4Å; F49-R53 PolarHBondContact O-N 2.77Å; L51-R53 VanDerWaalsContact C-N 3.33Å; L51-R53 PolarHBondContact O-N 3.4Å; R53-K57 VanDerWaalsContact O-CB 3.25Å; R53-K57 WeakPolarHBondContact O-CB 3.48Å; R53-K57 PolarHBondContact O-N 3.27Å; R53-K57 VanDerWaalsContact O-N 3.1Å
54	H	89.9	Confident	86	Confident	17 Å²	17	80.9 Å²	80.9	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-65.9	-48.5	175.7	160.4	71.5	0	0	0	111.9	C41 F45 A50 L51 H52 R56 K57 V58 H59	C41-H54 PolarHBondContact SG-NE2 3.38Å; F45-H54 HydrophobicContact CE1-CB 3.61Å; F45-H54 AromaticContact CE1-CG 3.96Å; F45-H54 HydrophobicContact CE2-CB 3.99Å; F45-H54 AromaticContact CE2-CD2 3.41Å; F45-H54 VanDerWaalsContact CE2-CD2 3.41Å; F45-H54 WeakPolarHBondContact CE2-CD2 3.32Å; F45-H54 AromaticContact CE2-CG 3.75Å; F45-H54 HydrophobicContact CZ-CB 3.3Å; F45-H54 AromaticContact CZ-CD2 3.33Å; F45-H54 WeakPolarHBondContact CZ-CD2 3.21Å; F45-H54 AromaticContact CZ-CG 3.15Å; F45-H54 AromaticContact CZ-ND1 3.75Å; F45-H54 AromaticContact CZ-NE2 3.95Å; A50-H54 WeakPolarHBondContact O-CB 3.46Å; A50-H54 PolarHBondContact O-N 2.94Å; L51-H54 WeakPolarHBondContact O-CA 3.41Å; L51-H54 WeakPolarHBondContact O-CB 3.39Å; L51-H54 PolarHBondContact O-N 3.34Å; H52-H54 VanDerWaalsContact C-N 3.25Å; H52-H54 PolarHBondContact O-N 3.08Å; H54-R56 PolarHBondContact O-N 3.04Å; H54-K57 PolarHBondContact O-N 3.37Å; H54-V58 WeakPolarHBondContact ND1-CG2 3.45Å; H54-V58 VanDerWaalsContact O-CB 3.31Å; H54-V58 WeakPolarHBondContact O-CB 3.5Å; H54-V58 WeakPolarHBondContact O-CG2 3.43Å; H54-V58 PolarHBondContact O-N 3.04Å; H54-H59 AromaticContact CE1-NE2 3.73Å; H54-H59 AromaticContact NE2-CD2 3.75Å; H54-H59 AromaticContact NE2-NE2 3.29Å; H54-H59 PolarHBondContact NE2-NE2 3.26Å
55	I	92.4	Very high	84.5	Confident	44 Å²	44	80.7 Å²	80.7	23%	0.226	41%	0.412	C	S	.	.	I	π-helix	trans	-57.4	-52.7	179	-66.9	168.4	0	0	0	110	L51 H52 K57 V58 H59 E60	L51-I55 HydrophobicContact CD1-CD1 3.79Å; L51-I55 HydrophobicContact CD1-CG1 4.03Å; L51-I55 HydrophobicContact CG-CD1 3.9Å; L51-I55 WeakPolarHBondContact O-CG1 3.47Å; L51-I55 PolarHBondContact O-N 2.86Å; H52-I55 PolarHBondContact O-N 3.34Å; I55-K57 VanDerWaalsContact C-N 3.34Å; I55-K57 PolarHBondContact O-N 2.93Å; I55-V58 PolarHBondContact O-N 2.8Å; I55-H59 HydrophobicContact CG2-CB 4.44Å; I55-H59 WeakPolarHBondContact O-CA 3.48Å; I55-H59 WeakPolarHBondContact O-CB 3.49Å; I55-H59 PolarHBondContact O-N 2.91Å; I55-E60 HydrophobicContact CG2-CG 4.22Å; I55-E60 PolarHBondContact O-N 3.44Å
56	R	88.2	Confident	83.7	Confident	67 Å²	67	82 Å²	82	25%	0.253	42%	0.422	S	S	.	.	I	π-helix	trans	-55.5	-48.2	178.7	-65.3	-172.4	76.7	-166.1	8	112	H52 H54 E60 G61 I62 E64	H52-R56 VanDerWaalsContact O-CG 3.3Å; H52-R56 WeakPolarHBondContact O-CG 3.43Å; H52-R56 PolarHBondContact O-N 2.97Å; H54-R56 PolarHBondContact O-N 3.04Å; R56-E60 WeakPolarHBondContact CA-OE2 3.35Å; R56-E60 WeakPolarHBondContact CG-OE2 3.27Å; R56-E60 CarbonylContact O-C 3.56Å; R56-G61 PolarHBondContact O-N 3.42Å; R56-G61 VanDerWaalsContact O-N 3.13Å; R56-I62 CarbonylContact C-O 3.51Å; R56-I62 HydrophobicContact CB-CB 4.3Å; R56-I62 WeakPolarHBondContact O-CA 3.42Å; R56-I62 PolarHBondContact O-N 3.24Å; R56-E64 IonicContact CZ-OE2 3.69Å; R56-E64 IonicContact NH1-OE2 3.96Å; R56-E64 IonicContact NH2-OE1 3.32Å; R56-E64 PolarHBondContact NH2-OE1 2.79Å; R56-E64 IonicContact NH2-OE2 2.67Å; R56-E64 PolarHBondContact NH2-OE2 2.97Å
57	K	86.6	Confident	83.3	Confident	153 Å²	153	81.7 Å²	81.7	67%	0.665	42%	0.417	S	S	*	.	I	π-helix	trans	-72.3	-43.2	-176.3	-175.9	177.8	178.3	-176.9	0	113.7	R53 H54 I55	R53-K57 VanDerWaalsContact O-CB 3.25Å; R53-K57 WeakPolarHBondContact O-CB 3.48Å; R53-K57 PolarHBondContact O-N 3.27Å; R53-K57 VanDerWaalsContact O-N 3.1Å; H54-K57 PolarHBondContact O-N 3.37Å; I55-K57 VanDerWaalsContact C-N 3.34Å; I55-K57 PolarHBondContact O-N 2.93Å
58	V	90.8	Very high	83	Confident	87 Å²	87	82.1 Å²	82.1	53%	0.527	42%	0.421	S	S	.	.	I	π-helix	trans	-98.2	-36.2	-166.7	179.6	0	0	0	0	112.1	H54 I55	H54-V58 WeakPolarHBondContact ND1-CG2 3.45Å; H54-V58 VanDerWaalsContact O-CB 3.31Å; H54-V58 WeakPolarHBondContact O-CB 3.5Å; H54-V58 WeakPolarHBondContact O-CG2 3.43Å; H54-V58 PolarHBondContact O-N 3.04Å; I55-V58 PolarHBondContact O-N 2.8Å
59	H	93.1	Very high	82.5	Confident	77 Å²	77	75 Å²	75	36%	0.356	39%	0.39	S	S	.	.	I	π-helix	trans	-102.6	-35.9	-174.4	-63.3	-53.9	0	0	0	112.6	C38 H54 I55	C38-H59 PolarHBondContact SG-NE2 3.36Å; C38-H59 VanDerWaalsContact SG-NE2 3.39Å; H54-H59 AromaticContact CE1-NE2 3.73Å; H54-H59 AromaticContact NE2-CD2 3.75Å; H54-H59 AromaticContact NE2-NE2 3.29Å; H54-H59 PolarHBondContact NE2-NE2 3.26Å; I55-H59 HydrophobicContact CG2-CB 4.44Å; I55-H59 WeakPolarHBondContact O-CA 3.48Å; I55-H59 WeakPolarHBondContact O-CB 3.49Å; I55-H59 PolarHBondContact O-N 2.91Å
60	E	89	Confident	82	Confident	104 Å²	104	73.9 Å²	73.9	49%	0.486	41%	0.405	S	S	.	.	S	Bend	trans	-95.5	-11.4	179.2	-55	171.2	175.6	0	0	112.6	I55 R56 I62	I55-E60 HydrophobicContact CG2-CG 4.22Å; I55-E60 PolarHBondContact O-N 3.44Å; R56-E60 WeakPolarHBondContact CA-OE2 3.35Å; R56-E60 WeakPolarHBondContact CG-OE2 3.27Å; R56-E60 CarbonylContact O-C 3.56Å; E60-I62 HydrophobicContact CB-CB 4.29Å; E60-I62 HydrophobicContact CB-CD1 3.84Å; E60-I62 HydrophobicContact CB-CG1 3.7Å; E60-I62 PolarHBondContact O-N 3.47Å; E60-I62 VanDerWaalsContact O-N 3.13Å; E60-I62 WeakPolarHBondContact OE2-CD1 3.47Å
61	G	82.6	Confident	80.9	Confident	61 Å²	61	77.1 Å²	77.1	63%	0.629	43%	0.426	S	S	*	.			trans	65.9	8.8	-174.3	0	0	0	0	0	114.1	R56 S63	R56-G61 PolarHBondContact O-N 3.42Å; R56-G61 VanDerWaalsContact O-N 3.13Å; G61-S63 PolarHBondContact O-N 3.36Å; G61-S63 VanDerWaalsContact O-N 3.08Å
62	I	78.3	Confident	80	Confident	58 Å²	58	79.3 Å²	79.3	30%	0.297	44%	0.442	S	S	.	.			trans	-78.6	95.4	-178.3	-59.9	-178	0	0	0	108.9	R56 E60 E64	R56-I62 CarbonylContact C-O 3.51Å; R56-I62 HydrophobicContact CB-CB 4.3Å; R56-I62 WeakPolarHBondContact O-CA 3.42Å; R56-I62 PolarHBondContact O-N 3.24Å; E60-I62 HydrophobicContact CB-CB 4.29Å; E60-I62 HydrophobicContact CB-CD1 3.84Å; E60-I62 HydrophobicContact CB-CG1 3.7Å; E60-I62 PolarHBondContact O-N 3.47Å; E60-I62 VanDerWaalsContact O-N 3.13Å; E60-I62 WeakPolarHBondContact OE2-CD1 3.47Å; I62-E64 HydrophobicContact CG2-CB 3.74Å; I62-E64 VanDerWaalsContact CG2-CD 3.46Å; I62-E64 HydrophobicContact CG2-CG 3.39Å; I62-E64 WeakPolarHBondContact CG2-OE1 3.22Å; I62-E64 PolarHBondContact O-N 2.85Å
63	S	68.8	Low	79.2	Confident	93 Å²	93	76 Å²	76	65%	0.65	44%	0.44	S	S	*	.			trans	-79.3	59.2	169.5	177.4	0	0	0	0	110.9	G61	G61-S63 PolarHBondContact O-N 3.36Å; G61-S63 VanDerWaalsContact O-N 3.08Å
64	E	59.9	Low	78.8	Confident	118 Å²	118	75.6 Å²	75.6	55%	0.551	44%	0.441	S	S	*	.			trans	-96.8	146.8	172.3	-72.1	-178.4	-136.9	0	0	110.1	R56 I62	R56-E64 IonicContact CZ-OE2 3.69Å; R56-E64 IonicContact NH1-OE2 3.96Å; R56-E64 IonicContact NH2-OE1 3.32Å; R56-E64 PolarHBondContact NH2-OE1 2.79Å; R56-E64 IonicContact NH2-OE2 2.67Å; R56-E64 PolarHBondContact NH2-OE2 2.97Å; I62-E64 HydrophobicContact CG2-CB 3.74Å; I62-E64 VanDerWaalsContact CG2-CD 3.46Å; I62-E64 HydrophobicContact CG2-CG 3.39Å; I62-E64 WeakPolarHBondContact CG2-OE1 3.22Å; I62-E64 PolarHBondContact O-N 2.85Å
65	L	61.7	Low	78.5	Confident	93 Å²	93	81.7 Å²	81.7	49%	0.487	47%	0.467	S	S	.	.			trans	89.3	22.4	177.4	-49.1	161.1	0	0	0	116.7	S77	L65-S77 CarbonylContact O-C 3.09Å; L65-S77 WeakPolarHBondContact O-CA 3.31Å
66	V	73.2	Confident	78.1	Confident	56 Å²	56	80.8 Å²	80.8	34%	0.339	46%	0.462	S	S	.	.			trans	-87.2	113.1	150.2	-72.1	0	0	0	0	108.5	P68 K75 F76	V66-P68 WeakPolarHBondContact O-CD 3.42Å; V66-K75 HydrophobicContact CB-CB 3.79Å; V66-K75 HydrophobicContact CB-CD 4.29Å; V66-K75 HydrophobicContact CB-CG 4.02Å; V66-K75 HydrophobicContact CG1-CB 4.09Å; V66-K75 HydrophobicContact CG2-CB 4.29Å; V66-K75 HydrophobicContact CG2-CD 3.83Å; V66-K75 HydrophobicContact CG2-CG 4Å; V66-F76 CarbonylContact C-O 3.56Å; V66-F76 VanDerWaalsContact CA-O 3.27Å; V66-F76 WeakPolarHBondContact CA-O 3.34Å
67	L	79.6	Confident	77.7	Confident	64 Å²	64	80.9 Å²	80.9	34%	0.335	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	110.8	168.6	-59.2	169.9	0	0	0	107.3	F76 K79 L82	L67-F76 PolarHBondContact N-O 3.41Å; L67-F76 PolarHBondContact O-N 3.44Å; L67-K79 HydrophobicContact CD1-CB 3.81Å; L67-K79 HydrophobicContact CD1-CG 4.24Å; L67-L82 HydrophobicContact CB-CB 4.42Å; L67-L82 HydrophobicContact CB-CD2 3.7Å; L67-L82 HydrophobicContact CD1-CB 4.45Å; L67-L82 HydrophobicContact CD1-CD2 4.28Å
68	P	78.6	Confident	77.5	Confident	76 Å²	76	75 Å²	75	49%	0.494	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	139	171.9	31.3	-32.9	0	0	0	109	V66 A70 K74 K75	V66-P68 WeakPolarHBondContact O-CD 3.42Å; P68-A70 PolarHBondContact O-N 2.78Å; P68-K74 CarbonylContact C-O 3.59Å; P68-K74 WeakPolarHBondContact CA-O 3.2Å; P68-K75 HydrophobicContact CB-CG 4.49Å
69	C	77.5	Confident	77.2	Confident	2 Å²	2	77.5 Å²	77.5	1%	0.014	46%	0.456	C	S	.	.			trans	-63.2	123.6	162	171.9	0	0	0	0	108.7	C71 C72 G73 K74 F76 L82 H85 M86 H90	C69-C71 PolarHBondContact O-N 3.36Å; C69-C71 PolarHBondContact SG-N 3.31Å; C69-C72 PolarHBondContact O-N 3.21Å; C69-C72 PolarHBondContact SG-N 3.48Å; C69-C72 VanDerWaalsContact SG-N 3.39Å; C69-G73 VanDerWaalsContact O-CA 3.28Å; C69-G73 WeakPolarHBondContact O-CA 3.5Å; C69-G73 PolarHBondContact O-N 3.08Å; C69-K74 PolarHBondContact N-O 3.1Å; C69-F76 HydrophobicContact CB-CE2 4.28Å; C69-L82 HydrophobicContact CB-CD1 3.86Å; C69-H85 WeakPolarHBondContact CB-NE2 3.45Å; C69-H85 PolarHBondContact SG-NE2 2.99Å; C69-M86 VanDerWaalsContact SG-SD 3.68Å; C69-H90 PolarHBondContact SG-NE2 3.23Å
70	A	75.9	Confident	76.9	Confident	106 Å²	106	80.2 Å²	80.2	88%	0.876	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.2	177.1	0	0	0	0	0	112.8	P68	P68-A70 PolarHBondContact O-N 2.78Å
71	C	64.9	Low	76.8	Confident	84 Å²	84	75.8 Å²	75.8	57%	0.568	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-31.2	-178.2	-56.4	0	0	0	0	114.1	C69 H90	C69-C71 PolarHBondContact O-N 3.36Å; C69-C71 PolarHBondContact SG-N 3.31Å; C71-H90 VanDerWaalsContact CB-CE1 3.41Å; C71-H90 WeakPolarHBondContact CB-CE1 3.22Å
72	C	72.2	Confident	76.9	Confident	68 Å²	68	74.3 Å²	74.3	46%	0.459	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-0.6	-174.5	73.4	0	0	0	0	115.7	C69 K74 H85	C69-C72 PolarHBondContact O-N 3.21Å; C69-C72 PolarHBondContact SG-N 3.48Å; C69-C72 VanDerWaalsContact SG-N 3.39Å; C72-K74 PolarHBondContact O-N 3.35Å; C72-K74 VanDerWaalsContact O-N 3.1Å; C72-K74 VanDerWaalsContact SG-CB 3.59Å; C72-H85 PolarHBondContact SG-NE2 2.8Å; C72-H85 VanDerWaalsContact SG-NE2 3.38Å
73	G	73.4	Confident	77.3	Confident	46 Å²	46	76 Å²	76	47%	0.474	44%	0.435	S	S	.	.			trans	72.6	-4.3	179.7	0	0	0	0	0	115.4	C69 K75	C69-G73 VanDerWaalsContact O-CA 3.28Å; C69-G73 WeakPolarHBondContact O-CA 3.5Å; C69-G73 PolarHBondContact O-N 3.08Å; G73-K75 PolarHBondContact O-N 3.2Å
74	K	78.2	Confident	78	Confident	114 Å²	114	79.4 Å²	79.4	50%	0.496	43%	0.434	S	S	.	.			trans	-59.9	130.2	177.7	-173.4	169.1	-174.6	-70.9	0	110.6	P68 C69 C72 F76	P68-K74 CarbonylContact C-O 3.59Å; P68-K74 WeakPolarHBondContact CA-O 3.2Å; C69-K74 PolarHBondContact N-O 3.1Å; C72-K74 PolarHBondContact O-N 3.35Å; C72-K74 VanDerWaalsContact O-N 3.1Å; C72-K74 VanDerWaalsContact SG-CB 3.59Å; K74-F76 HydrophobicContact CB-CE2 3.92Å; K74-F76 HydrophobicContact CB-CZ 4.29Å; K74-F76 HydrophobicContact CD-CE2 4.27Å; K74-F76 HydrophobicContact CD-CZ 3.78Å; K74-F76 HydrophobicContact CG-CE2 3.8Å; K74-F76 HydrophobicContact CG-CZ 3.81Å; K74-F76 VanDerWaalsContact O-CD2 3.27Å; K74-F76 WeakPolarHBondContact O-CD2 3.47Å; K74-F76 VanDerWaalsContact O-CE2 3.24Å; K74-F76 WeakPolarHBondContact O-CE2 3.34Å
75	K	83.8	Confident	79.1	Confident	144 Å²	144	74.6 Å²	74.6	63%	0.626	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.5	-173.3	-78.6	173.5	-179.5	-173.7	0	112	V66 P68 G73	V66-K75 HydrophobicContact CB-CB 3.79Å; V66-K75 HydrophobicContact CB-CD 4.29Å; V66-K75 HydrophobicContact CB-CG 4.02Å; V66-K75 HydrophobicContact CG1-CB 4.09Å; V66-K75 HydrophobicContact CG2-CB 4.29Å; V66-K75 HydrophobicContact CG2-CD 3.83Å; V66-K75 HydrophobicContact CG2-CG 4Å; P68-K75 HydrophobicContact CB-CG 4.49Å; G73-K75 PolarHBondContact O-N 3.2Å
76	F	82.8	Confident	80	Confident	25 Å²	25	72.8 Å²	72.8	11%	0.11	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.7	-178.3	-64.5	-92.1	0	0	0	112	V66 L67 C69 K74 A78 G81 L82 H85	V66-F76 CarbonylContact C-O 3.56Å; V66-F76 VanDerWaalsContact CA-O 3.27Å; V66-F76 WeakPolarHBondContact CA-O 3.34Å; L67-F76 PolarHBondContact N-O 3.41Å; L67-F76 PolarHBondContact O-N 3.44Å; C69-F76 HydrophobicContact CB-CE2 4.28Å; K74-F76 HydrophobicContact CB-CE2 3.92Å; K74-F76 HydrophobicContact CB-CZ 4.29Å; K74-F76 HydrophobicContact CD-CE2 4.27Å; K74-F76 HydrophobicContact CD-CZ 3.78Å; K74-F76 HydrophobicContact CG-CE2 3.8Å; K74-F76 HydrophobicContact CG-CZ 3.81Å; K74-F76 VanDerWaalsContact O-CD2 3.27Å; K74-F76 WeakPolarHBondContact O-CD2 3.47Å; K74-F76 VanDerWaalsContact O-CE2 3.24Å; K74-F76 WeakPolarHBondContact O-CE2 3.34Å; F76-A78 PolarHBondContact O-N 2.73Å; F76-G81 WeakPolarHBondContact CD1-O 3.4Å; F76-G81 WeakPolarHBondContact CE1-O 3.06Å; F76-L82 HydrophobicContact CB-CB 4.13Å; F76-L82 HydrophobicContact CD2-CB 4.05Å; F76-L82 HydrophobicContact CD2-CD1 3.8Å; F76-L82 HydrophobicContact CE2-CD1 3.98Å; F76-L82 HydrophobicContact CG-CB 4.1Å; F76-H85 HydrophobicContact CE1-CB 3.63Å; F76-H85 HydrophobicContact CE2-CB 4.02Å; F76-H85 AromaticContact CE2-CD2 3.54Å; F76-H85 AromaticContact CE2-CG 3.7Å; F76-H85 HydrophobicContact CZ-CB 3.29Å; F76-H85 AromaticContact CZ-CD2 3.55Å; F76-H85 AromaticContact CZ-CG 3.19Å; F76-H85 AromaticContact CZ-ND1 3.6Å
77	S	81.8	Confident	80.3	Confident	70 Å²	70	78.4 Å²	78.4	49%	0.49	42%	0.416	S	S	.	.	S	Bend	trans	-74.6	-2	-179.4	62.9	0	0	0	0	115.2	L65	L65-S77 CarbonylContact O-C 3.09Å; L65-S77 WeakPolarHBondContact O-CA 3.31Å
78	A	81.6	Confident	79.9	Confident	29 Å²	29	80.1 Å²	80.1	24%	0.24	43%	0.425	C	S	.	.	S	Bend	trans	-158.1	148.1	-177.6	0	0	0	0	0	111.8	F76 H80 G81 L82	F76-A78 PolarHBondContact O-N 2.73Å; A78-H80 WeakPolarHBondContact CB-CE1 3.05Å; A78-H80 PolarHBondContact O-N 2.84Å; A78-G81 PolarHBondContact O-N 3.39Å; A78-G81 VanDerWaalsContact O-N 3.11Å; A78-L82 PolarHBondContact O-N 3.29Å
79	K	84.2	Confident	79.5	Confident	140 Å²	140	78.4 Å²	78.4	61%	0.609	41%	0.411	S	S	*	.	H	α-helix	trans	-57.4	-47.9	-177.6	-165.9	-172	-176.9	-158.3	0	113.4	L67 G81 L82 E83	L67-K79 HydrophobicContact CD1-CB 3.81Å; L67-K79 HydrophobicContact CD1-CG 4.24Å; K79-G81 PolarHBondContact O-N 2.92Å; K79-G81 VanDerWaalsContact O-N 3.16Å; K79-L82 CarbonylContact O-C 3.5Å; K79-L82 WeakPolarHBondContact O-CA 3.21Å; K79-L82 WeakPolarHBondContact O-CB 3.4Å; K79-L82 PolarHBondContact O-N 3.37Å; K79-E83 WeakPolarHBondContact CD-OE1 3.24Å; K79-E83 WeakPolarHBondContact CE-OE1 3.35Å; K79-E83 HydrophobicContact CG-CG 4.3Å; K79-E83 IonicContact NZ-OE1 3.88Å; K79-E83 PolarHBondContact NZ-OE1 2.81Å; K79-E83 WeakPolarHBondContact O-CG 3.36Å; K79-E83 PolarHBondContact O-N 3.47Å
80	H	86.6	Confident	79.2	Confident	134 Å²	134	81.2 Å²	81.2	62%	0.62	42%	0.424	S	S	*	.	H	α-helix	trans	-57.5	-32.8	177.8	66.7	-95.7	0	0	0	112.9	A78 R84	A78-H80 WeakPolarHBondContact CB-CE1 3.05Å; A78-H80 PolarHBondContact O-N 2.84Å; H80-R84 VanDerWaalsContact O-CB 3.29Å; H80-R84 WeakPolarHBondContact O-CB 3.08Å; H80-R84 PolarHBondContact O-N 3.27Å
81	G	86.7	Confident	78.9	Confident	10 Å²	10	82.6 Å²	82.6	10%	0.103	41%	0.412	C	S	.	.	H	α-helix	trans	-69.6	-40.6	176.8	0	0	0	0	0	111.8	F76 A78 K79 H85	F76-G81 WeakPolarHBondContact CD1-O 3.4Å; F76-G81 WeakPolarHBondContact CE1-O 3.06Å; A78-G81 PolarHBondContact O-N 3.39Å; A78-G81 VanDerWaalsContact O-N 3.11Å; K79-G81 PolarHBondContact O-N 2.92Å; K79-G81 VanDerWaalsContact O-N 3.16Å; G81-H85 WeakPolarHBondContact O-CB 3.37Å; G81-H85 PolarHBondContact O-N 3.32Å; G81-H85 VanDerWaalsContact O-N 3.1Å
82	L	85.2	Confident	78.8	Confident	30 Å²	30	80.4 Å²	80.4	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-66.3	-48.7	172.6	173.9	60.8	0	0	0	111.1	L67 C69 F76 A78 K79 R84 H85 M86	L67-L82 HydrophobicContact CB-CB 4.42Å; L67-L82 HydrophobicContact CB-CD2 3.7Å; L67-L82 HydrophobicContact CD1-CB 4.45Å; L67-L82 HydrophobicContact CD1-CD2 4.28Å; C69-L82 HydrophobicContact CB-CD1 3.86Å; F76-L82 HydrophobicContact CB-CB 4.13Å; F76-L82 HydrophobicContact CD2-CB 4.05Å; F76-L82 HydrophobicContact CD2-CD1 3.8Å; F76-L82 HydrophobicContact CE2-CD1 3.98Å; F76-L82 HydrophobicContact CG-CB 4.1Å; A78-L82 PolarHBondContact O-N 3.29Å; K79-L82 CarbonylContact O-C 3.5Å; K79-L82 WeakPolarHBondContact O-CA 3.21Å; K79-L82 WeakPolarHBondContact O-CB 3.4Å; K79-L82 PolarHBondContact O-N 3.37Å; L82-R84 PolarHBondContact O-N 2.82Å; L82-H85 CarbonylContact O-C 3.57Å; L82-H85 WeakPolarHBondContact O-CA 3.49Å; L82-H85 VanDerWaalsContact O-CB 3.29Å; L82-H85 WeakPolarHBondContact O-CB 3.32Å; L82-H85 PolarHBondContact O-N 3.43Å; L82-M86 HydrophobicContact CD1-CG 4.15Å; L82-M86 HydrophobicContact CD1-SD 4.17Å; L82-M86 HydrophobicContact CG-CG 4.38Å; L82-M86 WeakPolarHBondContact O-CG 3.12Å; L82-M86 PolarHBondContact O-N 2.98Å
83	E	87.3	Confident	78	Confident	93 Å²	93	82 Å²	82	44%	0.435	42%	0.416	S	S	.	.	H	α-helix	trans	-59.1	-46.1	179.4	-72.5	170	171.5	0	0	111.9	K79 H85 M86 R87	K79-E83 WeakPolarHBondContact CD-OE1 3.24Å; K79-E83 WeakPolarHBondContact CE-OE1 3.35Å; K79-E83 HydrophobicContact CG-CG 4.3Å; K79-E83 IonicContact NZ-OE1 3.88Å; K79-E83 PolarHBondContact NZ-OE1 2.81Å; K79-E83 WeakPolarHBondContact O-CG 3.36Å; K79-E83 PolarHBondContact O-N 3.47Å; E83-H85 VanDerWaalsContact C-N 3.26Å; E83-H85 PolarHBondContact O-N 3.29Å; E83-M86 WeakPolarHBondContact O-CB 3.26Å; E83-M86 PolarHBondContact O-N 2.83Å; E83-R87 PolarHBondContact O-N 3.29Å
84	R	83.6	Confident	77.5	Confident	166 Å²	166	87.6 Å²	87.6	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-61	-38.4	174.2	-174.3	-179.3	67.3	-178.3	0.6	111.5	H80 L82 L88	H80-R84 VanDerWaalsContact O-CB 3.29Å; H80-R84 WeakPolarHBondContact O-CB 3.08Å; H80-R84 PolarHBondContact O-N 3.27Å; L82-R84 PolarHBondContact O-N 2.82Å; R84-L88 HydrophobicContact CG-CD1 3.8Å; R84-L88 HydrophobicContact CG-CG 4.29Å; R84-L88 WeakPolarHBondContact O-CB 3.45Å; R84-L88 VanDerWaalsContact O-CG 3.25Å; R84-L88 WeakPolarHBondContact O-CG 3.34Å; R84-L88 PolarHBondContact O-N 3.01Å
85	H	82.2	Confident	77.1	Confident	17 Å²	17	86.7 Å²	86.7	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-64.8	-44.8	174	161.5	79.5	0	0	0	111.9	C69 C72 F76 G81 L82 E83 R87 L88 I89 H90	C69-H85 WeakPolarHBondContact CB-NE2 3.45Å; C69-H85 PolarHBondContact SG-NE2 2.99Å; C72-H85 PolarHBondContact SG-NE2 2.8Å; C72-H85 VanDerWaalsContact SG-NE2 3.38Å; F76-H85 HydrophobicContact CE1-CB 3.63Å; F76-H85 HydrophobicContact CE2-CB 4.02Å; F76-H85 AromaticContact CE2-CD2 3.54Å; F76-H85 AromaticContact CE2-CG 3.7Å; F76-H85 HydrophobicContact CZ-CB 3.29Å; F76-H85 AromaticContact CZ-CD2 3.55Å; F76-H85 AromaticContact CZ-CG 3.19Å; F76-H85 AromaticContact CZ-ND1 3.6Å; G81-H85 WeakPolarHBondContact O-CB 3.37Å; G81-H85 PolarHBondContact O-N 3.32Å; G81-H85 VanDerWaalsContact O-N 3.1Å; L82-H85 CarbonylContact O-C 3.57Å; L82-H85 WeakPolarHBondContact O-CA 3.49Å; L82-H85 VanDerWaalsContact O-CB 3.29Å; L82-H85 WeakPolarHBondContact O-CB 3.32Å; L82-H85 PolarHBondContact O-N 3.43Å; E83-H85 VanDerWaalsContact C-N 3.26Å; E83-H85 PolarHBondContact O-N 3.29Å; H85-R87 VanDerWaalsContact C-N 3.33Å; H85-R87 PolarHBondContact O-N 2.83Å; H85-L88 PolarHBondContact O-N 2.83Å; H85-I89 WeakPolarHBondContact ND1-CG1 3.45Å; H85-I89 WeakPolarHBondContact O-CA 3.46Å; H85-I89 WeakPolarHBondContact O-CB 3.18Å; H85-I89 VanDerWaalsContact O-CG1 3.28Å; H85-I89 WeakPolarHBondContact O-CG1 3.36Å; H85-I89 PolarHBondContact O-N 3.13Å; H85-H90 AromaticContact CE1-NE2 3.64Å; H85-H90 AromaticContact NE2-CD2 3.54Å; H85-H90 AromaticContact NE2-NE2 3.23Å; H85-H90 PolarHBondContact NE2-NE2 3.29Å
86	M	81.4	Confident	76.5	Confident	55 Å²	55	81.4 Å²	81.4	27%	0.271	41%	0.411	S	S	.	.	H	α-helix	trans	-56	-49.9	174.6	-65.3	-53.8	-64.7	0	0	110.1	C69 L82 E83 L88 H90 E91	C69-M86 VanDerWaalsContact SG-SD 3.68Å; L82-M86 HydrophobicContact CD1-CG 4.15Å; L82-M86 HydrophobicContact CD1-SD 4.17Å; L82-M86 HydrophobicContact CG-CG 4.38Å; L82-M86 WeakPolarHBondContact O-CG 3.12Å; L82-M86 PolarHBondContact O-N 2.98Å; E83-M86 WeakPolarHBondContact O-CB 3.26Å; E83-M86 PolarHBondContact O-N 2.83Å; M86-L88 PolarHBondContact O-N 3.36Å; M86-H90 HydrophobicContact CE-CB 3.87Å; M86-H90 CarbonylContact O-C 3.51Å; M86-H90 VanDerWaalsContact O-CA 3.32Å; M86-H90 WeakPolarHBondContact O-CA 3.31Å; M86-H90 WeakPolarHBondContact O-CB 3.32Å; M86-H90 PolarHBondContact O-N 3.41Å; M86-H90 HydrophobicContact SD-CB 4.48Å; M86-H90 VanDerWaalsContact SD-CD2 3.58Å; M86-E91 PolarHBondContact O-N 3.03Å
87	R	78.9	Confident	76.1	Confident	173 Å²	173	84.7 Å²	84.7	65%	0.653	43%	0.429	S	S	*	.	H	α-helix	trans	-58.9	-46.6	176.9	-167.2	-175.6	-61	168.2	0.5	113.8	E83 H85 E91	E83-R87 PolarHBondContact O-N 3.29Å; H85-R87 VanDerWaalsContact C-N 3.33Å; H85-R87 PolarHBondContact O-N 2.83Å; R87-E91 CarbonylContact O-C 3.47Å
88	L	71.8	Confident	75.8	Confident	100 Å²	100	81.3 Å²	81.3	52%	0.524	41%	0.405	S	S	.	.	H	α-helix	trans	-79.8	-27.8	-173.8	-68.1	176.6	0	0	0	113.5	R84 H85 M86	R84-L88 HydrophobicContact CG-CD1 3.8Å; R84-L88 HydrophobicContact CG-CG 4.29Å; R84-L88 WeakPolarHBondContact O-CB 3.45Å; R84-L88 VanDerWaalsContact O-CG 3.25Å; R84-L88 WeakPolarHBondContact O-CG 3.34Å; R84-L88 PolarHBondContact O-N 3.01Å; H85-L88 PolarHBondContact O-N 2.83Å; M86-L88 PolarHBondContact O-N 3.36Å
89	I	70.4	Confident	75.2	Confident	41 Å²	41	85.5 Å²	85.5	21%	0.21	43%	0.43	C	S	.	.	H	α-helix	trans	-119	-19.6	-164.8	-48.1	-62.6	0	0	0	112.6	H85 T107 F109	H85-I89 WeakPolarHBondContact ND1-CG1 3.45Å; H85-I89 WeakPolarHBondContact O-CA 3.46Å; H85-I89 WeakPolarHBondContact O-CB 3.18Å; H85-I89 VanDerWaalsContact O-CG1 3.28Å; H85-I89 WeakPolarHBondContact O-CG1 3.36Å; H85-I89 PolarHBondContact O-N 3.13Å; I89-T107 WeakPolarHBondContact O-CB 3.41Å; I89-T107 WeakPolarHBondContact O-CG2 3.33Å; I89-T107 PolarHBondContact O-OG1 3.36Å; I89-F109 HydrophobicContact CD1-CB 3.57Å; I89-F109 HydrophobicContact CD1-CD2 4.28Å; I89-F109 HydrophobicContact CD1-CG 4.13Å; I89-F109 HydrophobicContact CG2-CB 4.11Å; I89-F109 HydrophobicContact CG2-CD1 4.39Å; I89-F109 HydrophobicContact CG2-CG 4.29Å
90	H	70.9	Confident	74.8	Confident	61 Å²	61	82.8 Å²	82.8	28%	0.282	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-30	-177.1	-65.2	-60.1	0	0	0	113.9	C69 C71 H85 M86	C69-H90 PolarHBondContact SG-NE2 3.23Å; C71-H90 VanDerWaalsContact CB-CE1 3.41Å; C71-H90 WeakPolarHBondContact CB-CE1 3.22Å; H85-H90 AromaticContact CE1-NE2 3.64Å; H85-H90 AromaticContact NE2-CD2 3.54Å; H85-H90 AromaticContact NE2-NE2 3.23Å; H85-H90 PolarHBondContact NE2-NE2 3.29Å; M86-H90 HydrophobicContact CE-CB 3.87Å; M86-H90 CarbonylContact O-C 3.51Å; M86-H90 VanDerWaalsContact O-CA 3.32Å; M86-H90 WeakPolarHBondContact O-CA 3.31Å; M86-H90 WeakPolarHBondContact O-CB 3.32Å; M86-H90 PolarHBondContact O-N 3.41Å; M86-H90 HydrophobicContact SD-CB 4.48Å; M86-H90 VanDerWaalsContact SD-CD2 3.58Å
91	E	68.6	Low	74.6	Confident	134 Å²	134	79.2 Å²	79.2	63%	0.626	41%	0.411	S	S	*	.			trans	-114.8	78.3	-175.3	-178.4	175.5	-148.3	0	0	109.6	M86 R87	M86-E91 PolarHBondContact O-N 3.03Å; R87-E91 CarbonylContact O-C 3.47Å
92	S	62.4	Low	74.2	Confident	38 Å²	38	84.9 Å²	84.9	27%	0.266	44%	0.439	S	S	.	.			trans	-99.8	119.9	160.2	91.2	0	0	0	0	109.3	E94 S106	S92-E94 VanDerWaalsContact C-N 3.34Å; S92-E94 PolarHBondContact OG-O 3.03Å; S92-S106 WeakPolarHBondContact CB-O 3.43Å; S92-S106 PolarHBondContact N-O 2.75Å; S92-S106 WeakPolarHBondContact OG-CA 3.39Å; S92-S106 PolarHBondContact OG-O 3.14Å
93	A	56.3	Low	74.1	Confident	102 Å²	102	91 Å²	91	84%	0.843	46%	0.46	S	S	*	.	S	Bend	trans	-71.6	-31.2	170.8	0	0	0	0	0	112.1
94	E	62	Low	73.8	Confident	163 Å²	163	89.4 Å²	89.4	76%	0.762	46%	0.459	S	S	*	.	S	Bend	trans	-109	121	179.3	-66.9	-62	142.1	0	0	110.2	S92 C96	S92-E94 VanDerWaalsContact C-N 3.34Å; S92-E94 PolarHBondContact OG-O 3.03Å; E94-C96 PolarHBondContact O-N 3.06Å
95	L	70.8	Confident	73.7	Confident	95 Å²	95	82.5 Å²	82.5	50%	0.497	43%	0.434	S	S	.	.			trans	-60.5	128.4	178.8	-68.4	168.3	0	0	0	110.1	I97 F105	L95-I97 HydrophobicContact CB-CG1 4.49Å; L95-I97 PolarHBondContact O-N 2.93Å; L95-F105 CarbonylContact C-O 3.57Å; L95-F105 WeakPolarHBondContact CA-O 2.92Å
96	C	70.7	Confident	73.4	Confident	34 Å²	34	85 Å²	85	23%	0.23	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	111.5	165.5	-64.3	0	0	0	0	107.9	E94 S104 F105 F111	E94-C96 PolarHBondContact O-N 3.06Å; C96-S104 CarbonylContact O-C 3.57Å; C96-F105 HydrophobicContact CB-CB 4.35Å; C96-F105 PolarHBondContact N-O 2.93Å; C96-F105 WeakPolarHBondContact O-CD2 3.04Å; C96-F105 PolarHBondContact O-N 3.44Å; C96-F111 HydrophobicContact CB-CB 3.55Å; C96-F111 HydrophobicContact CB-CD1 4.07Å; C96-F111 HydrophobicContact CB-CD2 4.26Å; C96-F111 HydrophobicContact CB-CG 3.69Å
97	I	75.1	Confident	72.9	Confident	93 Å²	93	83 Å²	83	48%	0.477	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	130.8	179	-59.5	173.3	0	0	0	109.5	L95 P99 N102	L95-I97 HydrophobicContact CB-CG1 4.49Å; L95-I97 PolarHBondContact O-N 2.93Å; I97-P99 WeakPolarHBondContact O-CD 3.26Å; I97-N102 WeakPolarHBondContact CG2-OD1 3.31Å
98	C	75.9	Confident	72.6	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	43%	0.433	C	S	.	.			trans	-75.7	120.4	173.1	-178.4	0	0	0	0	111	L100 N102 R103 F105 F111 H119	C98-L100 PolarHBondContact O-N 3.24Å; C98-L100 PolarHBondContact SG-N 2.82Å; C98-N102 WeakPolarHBondContact O-CA 3.09Å; C98-N102 PolarHBondContact O-N 2.81Å; C98-R103 PolarHBondContact N-O 2.77Å; C98-F105 HydrophobicContact CB-CE2 4.1Å; C98-F111 HydrophobicContact CB-CD2 4.36Å; C98-F111 HydrophobicContact CB-CE2 3.89Å; C98-H119 VanDerWaalsContact SG-CD2 3.55Å; C98-H119 PolarHBondContact SG-NE2 2.9Å
99	P	68.8	Low	72.7	Confident	116 Å²	116	80 Å²	80	75%	0.753	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.3	179.8	29.5	-35.6	0	0	0	113.3	I97	I97-P99 WeakPolarHBondContact O-CD 3.26Å
100	L	75	Confident	73.2	Confident	83 Å²	83	79 Å²	79	44%	0.435	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-29.2	-177	-60.3	176.7	0	0	0	113.6	C98 H119 I123	C98-L100 PolarHBondContact O-N 3.24Å; C98-L100 PolarHBondContact SG-N 2.82Å; L100-H119 HydrophobicContact CD1-CB 3.6Å; L100-H119 VanDerWaalsContact CD1-CG 3.49Å; L100-I123 HydrophobicContact CD1-CG2 3.66Å
101	C	82.8	Confident	73.6	Confident	60 Å²	60	77.7 Å²	77.7	41%	0.405	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	5.2	-179.4	67	0	0	0	0	113.9	R103 H114 H119	C101-R103 PolarHBondContact O-N 2.89Å; C101-R103 VanDerWaalsContact SG-CB 3.51Å; C101-H114 VanDerWaalsContact SG-CE1 3.5Å; C101-H114 PolarHBondContact SG-NE2 3.16Å; C101-H119 PolarHBondContact SG-NE2 3.47Å; C101-H119 VanDerWaalsContact SG-NE2 3.37Å
102	N	78.6	Confident	74	Confident	129 Å²	129	72.5 Å²	72.5	69%	0.69	40%	0.399	S	S	*	.			trans	56.3	13.8	-176.9	-149.6	38.2	0	0	0	115.3	I97 C98	I97-N102 WeakPolarHBondContact CG2-OD1 3.31Å; C98-N102 WeakPolarHBondContact O-CA 3.09Å; C98-N102 PolarHBondContact O-N 2.81Å
103	R	82.7	Confident	74.9	Confident	159 Å²	159	78 Å²	78	60%	0.6	41%	0.414	S	S	*	.			trans	-71.9	131.8	177.5	-171.8	167.7	178.6	165.3	5.1	110.2	C98 C101 F105	C98-R103 PolarHBondContact N-O 2.77Å; C101-R103 PolarHBondContact O-N 2.89Å; C101-R103 VanDerWaalsContact SG-CB 3.51Å; R103-F105 HydrophobicContact CB-CE2 3.95Å; R103-F105 HydrophobicContact CB-CZ 3.94Å; R103-F105 HydrophobicContact CG-CE1 4.21Å; R103-F105 HydrophobicContact CG-CE2 3.93Å; R103-F105 HydrophobicContact CG-CZ 3.55Å; R103-F105 WeakPolarHBondContact O-CD2 3.2Å; R103-F105 WeakPolarHBondContact O-CE2 3.14Å
104	S	81.5	Confident	76.2	Confident	59 Å²	59	73.7 Å²	73.7	41%	0.413	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	148.2	177.1	59.2	0	0	0	0	112.2	C96	C96-S104 CarbonylContact O-C 3.57Å
105	F	80.3	Confident	77.1	Confident	21 Å²	21	66.1 Å²	66.1	9%	0.092	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	130.1	179.2	-59.1	-85	0	0	0	110.1	L95 C96 C98 R103 T107 A110 F111 H114	L95-F105 CarbonylContact C-O 3.57Å; L95-F105 WeakPolarHBondContact CA-O 2.92Å; C96-F105 HydrophobicContact CB-CB 4.35Å; C96-F105 PolarHBondContact N-O 2.93Å; C96-F105 WeakPolarHBondContact O-CD2 3.04Å; C96-F105 PolarHBondContact O-N 3.44Å; C98-F105 HydrophobicContact CB-CE2 4.1Å; R103-F105 HydrophobicContact CB-CE2 3.95Å; R103-F105 HydrophobicContact CB-CZ 3.94Å; R103-F105 HydrophobicContact CG-CE1 4.21Å; R103-F105 HydrophobicContact CG-CE2 3.93Å; R103-F105 HydrophobicContact CG-CZ 3.55Å; R103-F105 WeakPolarHBondContact O-CD2 3.2Å; R103-F105 WeakPolarHBondContact O-CE2 3.14Å; F105-T107 PolarHBondContact O-N 3.37Å; F105-T107 VanDerWaalsContact O-N 3.16Å; F105-A110 HydrophobicContact CB-CB 4.2Å; F105-A110 HydrophobicContact CD1-CB 3.93Å; F105-A110 HydrophobicContact CG-CB 4.44Å; F105-F111 HydrophobicContact CB-CB 3.88Å; F105-F111 HydrophobicContact CD2-CB 3.86Å; F105-F111 AromaticContact CD2-CD2 3.68Å; F105-F111 HydrophobicContact CD2-CD2 3.68Å; F105-F111 HydrophobicContact CD2-CG 4.26Å; F105-F111 HydrophobicContact CE2-CD2 4.05Å; F105-F111 HydrophobicContact CG-CB 3.94Å; F105-H114 HydrophobicContact CD1-CB 4.28Å; F105-H114 HydrophobicContact CE1-CB 3.39Å; F105-H114 AromaticContact CE1-CG 3.69Å; F105-H114 HydrophobicContact CE2-CB 4.03Å; F105-H114 AromaticContact CE2-CD2 3.26Å; F105-H114 WeakPolarHBondContact CE2-CD2 3.27Å; F105-H114 AromaticContact CE2-CG 3.68Å; F105-H114 AromaticContact CE2-NE2 3.87Å; F105-H114 HydrophobicContact CZ-CB 3.27Å; F105-H114 AromaticContact CZ-CD2 3.12Å; F105-H114 WeakPolarHBondContact CZ-CD2 3.17Å; F105-H114 AromaticContact CZ-CE1 3.96Å; F105-H114 AromaticContact CZ-CG 3.01Å; F105-H114 AromaticContact CZ-ND1 3.58Å; F105-H114 AromaticContact CZ-NE2 3.72Å
106	S	76.1	Confident	77.6	Confident	70 Å²	70	66.4 Å²	66.4	49%	0.49	34%	0.338	S	S	.	.	S	Bend	trans	-75.7	7.4	176.9	56.5	0	0	0	0	114.4	S92	S92-S106 WeakPolarHBondContact CB-O 3.43Å; S92-S106 PolarHBondContact N-O 2.75Å; S92-S106 WeakPolarHBondContact OG-CA 3.39Å; S92-S106 PolarHBondContact OG-O 3.14Å
107	T	72	Confident	78.1	Confident	13 Å²	13	69.3 Å²	69.3	8%	0.08	36%	0.356	C	S	.	.	S	Bend	trans	-154.7	140.5	-179.6	91.1	0	0	0	0	109.7	I89 F105 F109 A110 F111	I89-T107 WeakPolarHBondContact O-CB 3.41Å; I89-T107 WeakPolarHBondContact O-CG2 3.33Å; I89-T107 PolarHBondContact O-OG1 3.36Å; F105-T107 PolarHBondContact O-N 3.37Å; F105-T107 VanDerWaalsContact O-N 3.16Å; T107-F109 PolarHBondContact O-N 2.89Å; T107-A110 PolarHBondContact O-N 3.38Å; T107-A110 VanDerWaalsContact O-N 3.16Å; T107-A110 VanDerWaalsContact OG1-CB 3.27Å; T107-A110 WeakPolarHBondContact OG1-CB 3.33Å; T107-A110 PolarHBondContact OG1-N 3.29Å; T107-F111 PolarHBondContact O-N 2.85Å
108	K	72.5	Confident	78.5	Confident	98 Å²	98	69 Å²	69	43%	0.426	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-31.1	175.5	-173.7	169.7	-176.5	171.4	0	111.5	N112	K108-N112 VanDerWaalsContact O-CB 3.26Å; K108-N112 WeakPolarHBondContact O-CB 3.38Å; K108-N112 PolarHBondContact O-N 3.05Å; K108-N112 PolarHBondContact O-OD1 3.4Å
109	F	73.7	Confident	78.8	Confident	112 Å²	112	70.1 Å²	70.1	49%	0.491	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-44.8	175.5	179.8	-95.1	0	0	0	112.7	I89 T107 F111 N112 R113	I89-F109 HydrophobicContact CD1-CB 3.57Å; I89-F109 HydrophobicContact CD1-CD2 4.28Å; I89-F109 HydrophobicContact CD1-CG 4.13Å; I89-F109 HydrophobicContact CG2-CB 4.11Å; I89-F109 HydrophobicContact CG2-CD1 4.39Å; I89-F109 HydrophobicContact CG2-CG 4.29Å; T107-F109 PolarHBondContact O-N 2.89Å; F109-F111 VanDerWaalsContact C-N 3.34Å; F109-N112 PolarHBondContact O-N 3.2Å; F109-R113 WeakPolarHBondContact O-CB 3.38Å; F109-R113 PolarHBondContact O-N 3.5Å
110	A	80.5	Confident	79	Confident	18 Å²	18	67.6 Å²	67.6	15%	0.149	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-41.4	177.8	0	0	0	0	0	110.9	F105 T107 R113 H114	F105-A110 HydrophobicContact CB-CB 4.2Å; F105-A110 HydrophobicContact CD1-CB 3.93Å; F105-A110 HydrophobicContact CG-CB 4.44Å; T107-A110 PolarHBondContact O-N 3.38Å; T107-A110 VanDerWaalsContact O-N 3.16Å; T107-A110 VanDerWaalsContact OG1-CB 3.27Å; T107-A110 WeakPolarHBondContact OG1-CB 3.33Å; T107-A110 PolarHBondContact OG1-N 3.29Å; A110-R113 PolarHBondContact O-N 3.05Å; A110-H114 VanDerWaalsContact O-CB 3.31Å; A110-H114 WeakPolarHBondContact O-CB 3.39Å; A110-H114 PolarHBondContact O-N 3.24Å
111	F	79.8	Confident	79	Confident	35 Å²	35	71 Å²	71	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-58.7	-51.7	171.9	173.3	-117.6	0	0	0	112.1	C96 C98 F105 T107 F109 R113 H114 T115 L132	C96-F111 HydrophobicContact CB-CB 3.55Å; C96-F111 HydrophobicContact CB-CD1 4.07Å; C96-F111 HydrophobicContact CB-CD2 4.26Å; C96-F111 HydrophobicContact CB-CG 3.69Å; C98-F111 HydrophobicContact CB-CD2 4.36Å; C98-F111 HydrophobicContact CB-CE2 3.89Å; F105-F111 HydrophobicContact CB-CB 3.88Å; F105-F111 HydrophobicContact CD2-CB 3.86Å; F105-F111 AromaticContact CD2-CD2 3.68Å; F105-F111 HydrophobicContact CD2-CD2 3.68Å; F105-F111 HydrophobicContact CD2-CG 4.26Å; F105-F111 HydrophobicContact CE2-CD2 4.05Å; F105-F111 HydrophobicContact CG-CB 3.94Å; T107-F111 PolarHBondContact O-N 2.85Å; F109-F111 VanDerWaalsContact C-N 3.34Å; F111-R113 VanDerWaalsContact C-N 3.31Å; F111-R113 PolarHBondContact O-N 3.31Å; F111-H114 PolarHBondContact O-N 3.16Å; F111-T115 HydrophobicContact CD2-CG2 3.82Å; F111-T115 HydrophobicContact CE2-CG2 3.35Å; F111-T115 HydrophobicContact CZ-CG2 3.78Å; F111-T115 WeakPolarHBondContact O-CB 2.85Å; F111-T115 WeakPolarHBondContact O-CG2 3.15Å; F111-T115 PolarHBondContact O-N 3.18Å; F111-T115 PolarHBondContact O-OG1 3.38Å; F111-L132 HydrophobicContact CD1-CD1 4.25Å; F111-L132 HydrophobicContact CE1-CD1 3.66Å; F111-L132 HydrophobicContact CZ-CD1 3.98Å
112	N	76.8	Confident	78.5	Confident	25 Å²	25	71.2 Å²	71.2	13%	0.134	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-36.4	178.7	-75.8	0.4	0	0	0	112.5	K108 F109 T115 K116 L132	K108-N112 VanDerWaalsContact O-CB 3.26Å; K108-N112 WeakPolarHBondContact O-CB 3.38Å; K108-N112 PolarHBondContact O-N 3.05Å; K108-N112 PolarHBondContact O-OD1 3.4Å; F109-N112 PolarHBondContact O-N 3.2Å; N112-T115 WeakPolarHBondContact CA-OG1 3.45Å; N112-T115 PolarHBondContact O-OG1 3.44Å; N112-K116 WeakPolarHBondContact O-CB 3.46Å; N112-K116 WeakPolarHBondContact O-CG 3.44Å; N112-K116 PolarHBondContact O-N 3.46Å; N112-K116 VanDerWaalsContact O-N 3.13Å; N112-L132 WeakPolarHBondContact OD1-CD1 3.29Å
113	R	80.9	Confident	78.6	Confident	152 Å²	152	66.2 Å²	66.2	57%	0.574	34%	0.342	S	S	*	.	H	α-helix	trans	-67.5	-50.1	175.2	-174.6	-174.2	68.5	-176.3	0.1	110.6	F109 A110 F111 T115 K116 T117	F109-R113 WeakPolarHBondContact O-CB 3.38Å; F109-R113 PolarHBondContact O-N 3.5Å; A110-R113 PolarHBondContact O-N 3.05Å; F111-R113 VanDerWaalsContact C-N 3.31Å; F111-R113 PolarHBondContact O-N 3.31Å; R113-T115 PolarHBondContact O-N 2.66Å; R113-K116 CarbonylContact O-C 3.57Å; R113-K116 PolarHBondContact O-N 3.42Å; R113-T117 HydrophobicContact CG-CG2 4.32Å; R113-T117 WeakPolarHBondContact O-CG2 3.29Å; R113-T117 PolarHBondContact O-N 3.23Å; R113-T117 PolarHBondContact O-OG1 2.91Å
114	H	84.3	Confident	78.5	Confident	13 Å²	13	59.5 Å²	59.5	6%	0.06	32%	0.319	C	S	.	.	H	α-helix	trans	-56.4	-50.6	179.6	155	75.3	0	0	0	111.5	C101 F105 A110 F111 K116 T117 V118 H119	C101-H114 VanDerWaalsContact SG-CE1 3.5Å; C101-H114 PolarHBondContact SG-NE2 3.16Å; F105-H114 HydrophobicContact CD1-CB 4.28Å; F105-H114 HydrophobicContact CE1-CB 3.39Å; F105-H114 AromaticContact CE1-CG 3.69Å; F105-H114 HydrophobicContact CE2-CB 4.03Å; F105-H114 AromaticContact CE2-CD2 3.26Å; F105-H114 WeakPolarHBondContact CE2-CD2 3.27Å; F105-H114 AromaticContact CE2-CG 3.68Å; F105-H114 AromaticContact CE2-NE2 3.87Å; F105-H114 HydrophobicContact CZ-CB 3.27Å; F105-H114 AromaticContact CZ-CD2 3.12Å; F105-H114 WeakPolarHBondContact CZ-CD2 3.17Å; F105-H114 AromaticContact CZ-CE1 3.96Å; F105-H114 AromaticContact CZ-CG 3.01Å; F105-H114 AromaticContact CZ-ND1 3.58Å; F105-H114 AromaticContact CZ-NE2 3.72Å; A110-H114 VanDerWaalsContact O-CB 3.31Å; A110-H114 WeakPolarHBondContact O-CB 3.39Å; A110-H114 PolarHBondContact O-N 3.24Å; F111-H114 PolarHBondContact O-N 3.16Å; H114-K116 VanDerWaalsContact C-N 3.31Å; H114-K116 PolarHBondContact O-N 3.16Å; H114-T117 PolarHBondContact O-N 3.33Å; H114-T117 PolarHBondContact O-OG1 2.87Å; H114-V118 VanDerWaalsContact ND1-CG2 3.32Å; H114-V118 WeakPolarHBondContact ND1-CG2 3.25Å; H114-V118 VanDerWaalsContact O-CB 3.31Å; H114-V118 WeakPolarHBondContact O-CB 3.37Å; H114-V118 WeakPolarHBondContact O-CG2 3.28Å; H114-V118 PolarHBondContact O-N 3.39Å; H114-H119 AromaticContact CE1-CD2 3.82Å; H114-H119 AromaticContact CE1-NE2 3.56Å; H114-H119 AromaticContact NE2-CD2 3.39Å; H114-H119 PolarHBondContact NE2-CD2 3.29Å; H114-H119 AromaticContact NE2-NE2 3.29Å; H114-H119 PolarHBondContact NE2-NE2 2.96Å
115	T	80.2	Confident	78.3	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.018	31%	0.313	C	S	.	.	H	α-helix	trans	-60.7	-43.6	-179.9	51.3	0	0	0	0	110.2	F111 N112 R113 T117 H119 S120 I123 L132	F111-T115 HydrophobicContact CD2-CG2 3.82Å; F111-T115 HydrophobicContact CE2-CG2 3.35Å; F111-T115 HydrophobicContact CZ-CG2 3.78Å; F111-T115 WeakPolarHBondContact O-CB 2.85Å; F111-T115 WeakPolarHBondContact O-CG2 3.15Å; F111-T115 PolarHBondContact O-N 3.18Å; F111-T115 PolarHBondContact O-OG1 3.38Å; N112-T115 WeakPolarHBondContact CA-OG1 3.45Å; N112-T115 PolarHBondContact O-OG1 3.44Å; R113-T115 PolarHBondContact O-N 2.66Å; T115-T117 VanDerWaalsContact C-N 3.31Å; T115-T117 PolarHBondContact O-N 3.17Å; T115-H119 CarbonylContact O-C 3.45Å; T115-H119 VanDerWaalsContact O-CA 3.24Å; T115-H119 WeakPolarHBondContact O-CA 3.38Å; T115-H119 WeakPolarHBondContact O-CB 3.34Å; T115-H119 PolarHBondContact O-N 3.02Å; T115-S120 PolarHBondContact O-N 3.28Å; T115-I123 HydrophobicContact CG2-CD1 4.47Å; T115-I123 WeakPolarHBondContact O-CD1 3.42Å; T115-L132 HydrophobicContact CG2-CD1 3.93Å; T115-L132 WeakPolarHBondContact OG1-CD1 3.36Å
116	K	80.7	Confident	78	Confident	101 Å²	101	58.3 Å²	58.3	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-26.7	173	-75.2	179.5	-175.8	-165.1	0	115.3	N112 R113 H114 S120 L125	N112-K116 WeakPolarHBondContact O-CB 3.46Å; N112-K116 WeakPolarHBondContact O-CG 3.44Å; N112-K116 PolarHBondContact O-N 3.46Å; N112-K116 VanDerWaalsContact O-N 3.13Å; R113-K116 CarbonylContact O-C 3.57Å; R113-K116 PolarHBondContact O-N 3.42Å; H114-K116 VanDerWaalsContact C-N 3.31Å; H114-K116 PolarHBondContact O-N 3.16Å; K116-S120 VanDerWaalsContact O-CB 3.31Å; K116-S120 WeakPolarHBondContact O-CB 3.31Å; K116-L125 VanDerWaalsContact CE-CD2 3.47Å; K116-L125 VanDerWaalsContact NZ-CD2 3.32Å
117	T	82.4	Confident	77.8	Confident	96 Å²	96	59.6 Å²	59.6	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-101.5	-27.7	-176	55.9	0	0	0	0	114.1	R113 H114 T115	R113-T117 HydrophobicContact CG-CG2 4.32Å; R113-T117 WeakPolarHBondContact O-CG2 3.29Å; R113-T117 PolarHBondContact O-N 3.23Å; R113-T117 PolarHBondContact O-OG1 2.91Å; H114-T117 PolarHBondContact O-N 3.33Å; H114-T117 PolarHBondContact O-OG1 2.87Å; T115-T117 VanDerWaalsContact C-N 3.31Å; T115-T117 PolarHBondContact O-N 3.17Å
118	V	83.3	Confident	77.5	Confident	86 Å²	86	63.4 Å²	63.4	52%	0.521	34%	0.343	S	S	.	.	H	α-helix	trans	-106.7	-31.1	-175.2	-177.9	0	0	0	0	111.1	H114	H114-V118 VanDerWaalsContact ND1-CG2 3.32Å; H114-V118 WeakPolarHBondContact ND1-CG2 3.25Å; H114-V118 VanDerWaalsContact O-CB 3.31Å; H114-V118 WeakPolarHBondContact O-CB 3.37Å; H114-V118 WeakPolarHBondContact O-CG2 3.28Å; H114-V118 PolarHBondContact O-N 3.39Å
119	H	81.6	Confident	77.5	Confident	23 Å²	23	60.9 Å²	60.9	11%	0.106	34%	0.337	C	S	.	.	S	Bend	trans	-121.2	25.8	-177.7	-56.8	-60.5	0	0	0	111.4	C98 L100 C101 H114 T115 D121 S122 I123	C98-H119 VanDerWaalsContact SG-CD2 3.55Å; C98-H119 PolarHBondContact SG-NE2 2.9Å; L100-H119 HydrophobicContact CD1-CB 3.6Å; L100-H119 VanDerWaalsContact CD1-CG 3.49Å; C101-H119 PolarHBondContact SG-NE2 3.47Å; C101-H119 VanDerWaalsContact SG-NE2 3.37Å; H114-H119 AromaticContact CE1-CD2 3.82Å; H114-H119 AromaticContact CE1-NE2 3.56Å; H114-H119 AromaticContact NE2-CD2 3.39Å; H114-H119 PolarHBondContact NE2-CD2 3.29Å; H114-H119 AromaticContact NE2-NE2 3.29Å; H114-H119 PolarHBondContact NE2-NE2 2.96Å; T115-H119 CarbonylContact O-C 3.45Å; T115-H119 VanDerWaalsContact O-CA 3.24Å; T115-H119 WeakPolarHBondContact O-CA 3.38Å; T115-H119 WeakPolarHBondContact O-CB 3.34Å; T115-H119 PolarHBondContact O-N 3.02Å; H119-D121 PolarHBondContact O-N 2.95Å; H119-D121 VanDerWaalsContact O-N 3.08Å; H119-S122 CarbonylContact O-C 3.58Å; H119-S122 PolarHBondContact O-N 3.04Å; H119-I123 HydrophobicContact CB-CD1 4.47Å; H119-I123 HydrophobicContact CB-CG2 4.07Å; H119-I123 WeakPolarHBondContact O-CG1 3.48Å; H119-I123 PolarHBondContact O-N 3.07Å; H119-I123 VanDerWaalsContact O-N 3.1Å
120	S	73.9	Confident	77	Confident	63 Å²	63	59.1 Å²	59.1	44%	0.441	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-38.8	-178.5	52.8	0	0	0	0	112.6	T115 K116	T115-S120 PolarHBondContact O-N 3.28Å; K116-S120 VanDerWaalsContact O-CB 3.31Å; K116-S120 WeakPolarHBondContact O-CB 3.31Å
121	D	74.7	Confident	76.6	Confident	155 Å²	155	62.5 Å²	62.5	83%	0.829	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-15.9	-174.6	-55.1	-14.3	0	0	0	111.8	H119	H119-D121 PolarHBondContact O-N 2.95Å; H119-D121 VanDerWaalsContact O-N 3.08Å
122	S	73.4	Confident	76.3	Confident	64 Å²	64	62.5 Å²	62.5	45%	0.448	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-0.9	-175	-44.1	0	0	0	0	113.8	H119 P134	H119-S122 CarbonylContact O-C 3.58Å; H119-S122 PolarHBondContact O-N 3.04Å; S122-P134 VanDerWaalsContact O-O 3.1Å
123	I	79	Confident	76.3	Confident	25 Å²	25	62.9 Å²	62.9	13%	0.128	35%	0.348	C	S	.	.			trans	-134.5	157.4	179.6	74.3	-168.6	0	0	0	111.9	L100 T115 H119 L132 F133	L100-I123 HydrophobicContact CD1-CG2 3.66Å; T115-I123 HydrophobicContact CG2-CD1 4.47Å; T115-I123 WeakPolarHBondContact O-CD1 3.42Å; H119-I123 HydrophobicContact CB-CD1 4.47Å; H119-I123 HydrophobicContact CB-CG2 4.07Å; H119-I123 WeakPolarHBondContact O-CG1 3.48Å; H119-I123 PolarHBondContact O-N 3.07Å; H119-I123 VanDerWaalsContact O-N 3.1Å; I123-L132 HydrophobicContact CD1-CD2 3.87Å; I123-L132 HydrophobicContact CG1-CD2 4.44Å; I123-F133 CarbonylContact C-O 3.46Å; I123-F133 WeakPolarHBondContact CA-O 3.41Å; I123-F133 WeakPolarHBondContact CB-O 3.36Å
124	S	80.9	Confident	76.2	Confident	17 Å²	17	60.2 Å²	60.2	12%	0.119	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.5	174.3	-65.3	0	0	0	0	109.6	F133 K136	S124-F133 PolarHBondContact N-O 3.49Å; S124-F133 PolarHBondContact O-N 2.94Å; S124-K136 WeakPolarHBondContact OG-CA 3.38Å; S124-K136 WeakPolarHBondContact OG-CG 3.36Å; S124-K136 PolarHBondContact OG-N 3.38Å
125	L	76.8	Confident	76	Confident	55 Å²	55	62 Å²	62	29%	0.288	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.8	-178.2	178.5	81.2	0	0	0	110.9	K116 S127 N130 L132 L139	K116-L125 VanDerWaalsContact CE-CD2 3.47Å; K116-L125 VanDerWaalsContact NZ-CD2 3.32Å; L125-S127 PolarHBondContact O-N 2.9Å; L125-N130 HydrophobicContact CD1-CB 4.36Å; L125-L132 HydrophobicContact CB-CD2 4.19Å; L125-L132 HydrophobicContact CD1-CD2 3.51Å; L125-L132 HydrophobicContact CD1-CG 4.34Å; L125-L132 HydrophobicContact CG-CD2 4.47Å; L125-L139 WeakPolarHBondContact O-CD2 3.32Å
126	C	75.6	Confident	76.2	Confident	1 Å²	1	69 Å²	69	1%	0.007	40%	0.395	C	S	.	.			trans	-78.1	113.2	165.9	-176.3	0	0	0	0	110.8	P128 C129 N130 M131 F133 L139 H142 H147	C126-P128 VanDerWaalsContact SG-CD 3.57Å; C126-C129 VanDerWaalsContact CB-SG 3.57Å; C126-C129 PolarHBondContact SG-SG 3.44Å; C126-N130 WeakPolarHBondContact O-CA 3.48Å; C126-N130 PolarHBondContact O-N 3.43Å; C126-M131 HydrophobicContact CB-CB 4.5Å; C126-M131 PolarHBondContact N-O 3.3Å; C126-F133 HydrophobicContact CB-CE2 3.82Å; C126-L139 VanDerWaalsContact CA-CD1 3.42Å; C126-L139 HydrophobicContact CB-CD1 3.41Å; C126-L139 VanDerWaalsContact CB-CD1 3.41Å; C126-H142 VanDerWaalsContact SG-CD2 3.55Å; C126-H142 PolarHBondContact SG-NE2 2.79Å; C126-H142 VanDerWaalsContact SG-NE2 3.42Å; C126-H147 PolarHBondContact SG-CD2 2.8Å; C126-H147 PolarHBondContact SG-NE2 2.85Å
127	S	70.4	Confident	76.5	Confident	96 Å²	96	65.6 Å²	65.6	67%	0.671	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-43.3	-179.1	179.4	0	0	0	0	113.8	L125 C129	L125-S127 PolarHBondContact O-N 2.9Å; S127-C129 PolarHBondContact O-N 2.87Å
128	P	67	Low	76.6	Confident	93 Å²	93	62.1 Å²	62.1	60%	0.604	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-41	177.8	-27.6	32.8	0	0	0	115.6	C126	C126-P128 VanDerWaalsContact SG-CD 3.57Å
129	C	72.4	Confident	76.7	Confident	45 Å²	45	59.4 Å²	59.4	30%	0.304	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-5.6	-174	70.5	0	0	0	0	114.9	C126 S127 M131 H142	C126-C129 VanDerWaalsContact CB-SG 3.57Å; C126-C129 PolarHBondContact SG-SG 3.44Å; S127-C129 PolarHBondContact O-N 2.87Å; C129-M131 HydrophobicContact CB-CG 4.34Å; C129-M131 PolarHBondContact O-N 3.38Å; C129-M131 VanDerWaalsContact SG-CB 3.58Å; C129-M131 WeakPolarHBondContact SG-CG 3.43Å; C129-H142 PolarHBondContact SG-NE2 3.11Å
130	N	62.9	Low	76.9	Confident	76 Å²	76	60 Å²	60	41%	0.406	35%	0.347	S	S	.	.			trans	56.3	27.7	-175.8	-66.4	-68.7	0	0	0	114.9	L125 C126	L125-N130 HydrophobicContact CD1-CB 4.36Å; C126-N130 WeakPolarHBondContact O-CA 3.48Å; C126-N130 PolarHBondContact O-N 3.43Å
131	M	72.7	Confident	77.5	Confident	88 Å²	88	61.5 Å²	61.5	43%	0.433	35%	0.347	S	S	.	.			trans	-78.7	148.7	170.1	-66.8	-67.2	-73.3	0	0	110.6	C126 C129 F133	C126-M131 HydrophobicContact CB-CB 4.5Å; C126-M131 PolarHBondContact N-O 3.3Å; C129-M131 HydrophobicContact CB-CG 4.34Å; C129-M131 PolarHBondContact O-N 3.38Å; C129-M131 VanDerWaalsContact SG-CB 3.58Å; C129-M131 WeakPolarHBondContact SG-CG 3.43Å; M131-F133 HydrophobicContact CB-CE2 3.55Å; M131-F133 HydrophobicContact CB-CZ 3.69Å
132	L	72.4	Confident	77.8	Confident	36 Å²	36	55.4 Å²	55.4	19%	0.188	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	140.2	-179	-63.1	169	0	0	0	109.8	F111 N112 T115 I123 L125	F111-L132 HydrophobicContact CD1-CD1 4.25Å; F111-L132 HydrophobicContact CE1-CD1 3.66Å; F111-L132 HydrophobicContact CZ-CD1 3.98Å; N112-L132 WeakPolarHBondContact OD1-CD1 3.29Å; T115-L132 HydrophobicContact CG2-CD1 3.93Å; T115-L132 WeakPolarHBondContact OG1-CD1 3.36Å; I123-L132 HydrophobicContact CD1-CD2 3.87Å; I123-L132 HydrophobicContact CG1-CD2 4.44Å; L125-L132 HydrophobicContact CB-CD2 4.19Å; L125-L132 HydrophobicContact CD1-CD2 3.51Å; L125-L132 HydrophobicContact CD1-CG 4.34Å; L125-L132 HydrophobicContact CG-CD2 4.47Å
133	F	77.8	Confident	78.2	Confident	32 Å²	32	54.4 Å²	54.4	14%	0.14	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.1	-177.1	-62.3	-87.6	0	0	0	110.1	I123 S124 C126 M131 S135 A138 L139 H142	I123-F133 CarbonylContact C-O 3.46Å; I123-F133 WeakPolarHBondContact CA-O 3.41Å; I123-F133 WeakPolarHBondContact CB-O 3.36Å; S124-F133 PolarHBondContact N-O 3.49Å; S124-F133 PolarHBondContact O-N 2.94Å; C126-F133 HydrophobicContact CB-CE2 3.82Å; M131-F133 HydrophobicContact CB-CE2 3.55Å; M131-F133 HydrophobicContact CB-CZ 3.69Å; F133-S135 PolarHBondContact O-N 3.05Å; F133-A138 HydrophobicContact CB-CB 4.05Å; F133-A138 HydrophobicContact CD1-CB 4.2Å; F133-A138 WeakPolarHBondContact CD1-O 3.49Å; F133-L139 HydrophobicContact CB-CB 3.95Å; F133-L139 HydrophobicContact CD2-CB 3.92Å; F133-L139 HydrophobicContact CD2-CD1 3.52Å; F133-L139 HydrophobicContact CD2-CG 4.33Å; F133-L139 HydrophobicContact CE2-CD1 3.78Å; F133-L139 HydrophobicContact CG-CB 4Å; F133-L139 HydrophobicContact CG-CD1 4.4Å; F133-H142 HydrophobicContact CD1-CB 4.15Å; F133-H142 HydrophobicContact CE1-CB 3.36Å; F133-H142 AromaticContact CE1-CG 3.69Å; F133-H142 AromaticContact CE1-ND1 3.97Å; F133-H142 HydrophobicContact CE2-CB 4.01Å; F133-H142 AromaticContact CE2-CD2 3.91Å; F133-H142 AromaticContact CE2-CG 3.74Å; F133-H142 HydrophobicContact CZ-CB 3.31Å; F133-H142 AromaticContact CZ-CD2 3.7Å; F133-H142 AromaticContact CZ-CG 3.09Å; F133-H142 AromaticContact CZ-ND1 3.34Å; F133-H142 VanDerWaalsContact CZ-ND1 3.34Å; F133-H142 WeakPolarHBondContact CZ-ND1 3.45Å
134	P	77	Confident	78.4	Confident	97 Å²	97	54.7 Å²	54.7	63%	0.63	31%	0.305	S	S	*	.	S	Bend	trans	-71.8	-11.4	-177.6	29.7	-36.2	0	0	0	113.7	S122 A138	S122-P134 VanDerWaalsContact O-O 3.1Å; P134-A138 HydrophobicContact CG-CB 4.34Å
135	S	80.8	Confident	78.4	Confident	50 Å²	50	59.2 Å²	59.2	35%	0.35	33%	0.332	S	S	.	.	S	Bend	trans	-151.3	161.6	178.5	71.8	0	0	0	0	111.4	F133 F137 A138 L139	F133-S135 PolarHBondContact O-N 3.05Å; S135-F137 PolarHBondContact O-N 3.27Å; S135-A138 PolarHBondContact O-N 2.95Å; S135-A138 WeakPolarHBondContact OG-CB 3.37Å; S135-A138 PolarHBondContact OG-N 3.33Å; S135-L139 PolarHBondContact O-N 3.39Å; S135-L139 VanDerWaalsContact O-N 3.08Å
136	K	84.6	Confident	78.4	Confident	151 Å²	151	60.6 Å²	60.6	66%	0.657	34%	0.342	S	S	*	.	H	α-helix	trans	-60.9	-34.9	172.6	-68.1	-179.2	-179.6	174.5	0	111.6	S124 L139 L140 L159	S124-K136 WeakPolarHBondContact OG-CA 3.38Å; S124-K136 WeakPolarHBondContact OG-CG 3.36Å; S124-K136 PolarHBondContact OG-N 3.38Å; K136-L139 PolarHBondContact O-N 3.3Å; K136-L140 WeakPolarHBondContact O-CB 3.41Å; K136-L140 PolarHBondContact O-N 3.23Å; K136-L159 HydrophobicContact CB-CD1 3.71Å; K136-L159 HydrophobicContact CD-CD1 4.38Å
137	F	86	Confident	78.6	Confident	29 Å²	29	63.3 Å²	63.3	13%	0.127	36%	0.355	C	S	.	.	H	α-helix	trans	-66.1	-47.7	177	-177.2	-95.8	0	0	0	112.1	S135 L139 L140 E141 A154 H156 L159	S135-F137 PolarHBondContact O-N 3.27Å; F137-L139 VanDerWaalsContact C-N 3.28Å; F137-L139 PolarHBondContact O-N 3Å; F137-L140 CarbonylContact O-C 3.49Å; F137-L140 WeakPolarHBondContact O-CA 3.42Å; F137-L140 WeakPolarHBondContact O-CB 3.27Å; F137-L140 PolarHBondContact O-N 2.82Å; F137-E141 HydrophobicContact CD1-CG 4.08Å; F137-E141 HydrophobicContact CE1-CG 3.44Å; F137-E141 VanDerWaalsContact CE1-CG 3.44Å; F137-E141 WeakPolarHBondContact CE1-OE1 3.48Å; F137-E141 WeakPolarHBondContact CE1-OE2 3.24Å; F137-E141 HydrophobicContact CE2-CG 4.34Å; F137-E141 HydrophobicContact CZ-CG 3.56Å; F137-E141 PolarHBondContact O-N 3.16Å; F137-A154 HydrophobicContact CE2-CB 4.08Å; F137-H156 AromaticContact CD1-CE1 3.76Å; F137-H156 AromaticContact CD1-ND1 3.58Å; F137-H156 HydrophobicContact CD2-CB 4.24Å; F137-H156 AromaticContact CD2-CG 3.86Å; F137-H156 AromaticContact CD2-ND1 3.82Å; F137-H156 AromaticContact CE1-CE1 2.99Å; F137-H156 WeakPolarHBondContact CE1-CE1 3.2Å; F137-H156 AromaticContact CE1-ND1 3.29Å; F137-H156 VanDerWaalsContact CE1-ND1 3.29Å; F137-H156 WeakPolarHBondContact CE1-ND1 3.34Å; F137-H156 AromaticContact CE1-NE2 3.66Å; F137-H156 HydrophobicContact CE2-CB 4.26Å; F137-H156 AromaticContact CE2-CD2 3.54Å; F137-H156 AromaticContact CE2-CE1 3.65Å; F137-H156 AromaticContact CE2-CG 3.51Å; F137-H156 AromaticContact CE2-ND1 3.57Å; F137-H156 AromaticContact CE2-NE2 3.64Å; F137-H156 AromaticContact CG-ND1 3.84Å; F137-H156 AromaticContact CZ-CD2 3.55Å; F137-H156 AromaticContact CZ-CE1 2.96Å; F137-H156 WeakPolarHBondContact CZ-CE1 3.28Å; F137-H156 AromaticContact CZ-CG 3.69Å; F137-H156 AromaticContact CZ-ND1 3.32Å; F137-H156 VanDerWaalsContact CZ-ND1 3.32Å; F137-H156 WeakPolarHBondContact CZ-ND1 3.27Å; F137-H156 AromaticContact CZ-NE2 3.09Å; F137-H156 WeakPolarHBondContact CZ-NE2 3.12Å; F137-L159 HydrophobicContact CB-CD2 3.96Å; F137-L159 HydrophobicContact CD2-CD2 3.83Å; F137-L159 HydrophobicContact CG-CD2 4.41Å
138	A	84.8	Confident	78.9	Confident	22 Å²	22	61.8 Å²	61.8	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-36.9	176.8	0	0	0	0	0	112	F133 P134 S135 L140 H142	F133-A138 HydrophobicContact CB-CB 4.05Å; F133-A138 HydrophobicContact CD1-CB 4.2Å; F133-A138 WeakPolarHBondContact CD1-O 3.49Å; P134-A138 HydrophobicContact CG-CB 4.34Å; S135-A138 PolarHBondContact O-N 2.95Å; S135-A138 WeakPolarHBondContact OG-CB 3.37Å; S135-A138 PolarHBondContact OG-N 3.33Å; A138-L140 VanDerWaalsContact C-N 3.34Å; A138-H142 WeakPolarHBondContact O-CB 3.4Å; A138-H142 PolarHBondContact O-N 3.21Å
139	L	85.5	Confident	79.2	Confident	30 Å²	30	60.9 Å²	60.9	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-61.7	-43.3	170.2	171.8	62.1	0	0	0	111.4	L125 C126 F133 S135 K136 F137 H142 N143	L125-L139 WeakPolarHBondContact O-CD2 3.32Å; C126-L139 VanDerWaalsContact CA-CD1 3.42Å; C126-L139 HydrophobicContact CB-CD1 3.41Å; C126-L139 VanDerWaalsContact CB-CD1 3.41Å; F133-L139 HydrophobicContact CB-CB 3.95Å; F133-L139 HydrophobicContact CD2-CB 3.92Å; F133-L139 HydrophobicContact CD2-CD1 3.52Å; F133-L139 HydrophobicContact CD2-CG 4.33Å; F133-L139 HydrophobicContact CE2-CD1 3.78Å; F133-L139 HydrophobicContact CG-CB 4Å; F133-L139 HydrophobicContact CG-CD1 4.4Å; S135-L139 PolarHBondContact O-N 3.39Å; S135-L139 VanDerWaalsContact O-N 3.08Å; K136-L139 PolarHBondContact O-N 3.3Å; F137-L139 VanDerWaalsContact C-N 3.28Å; F137-L139 PolarHBondContact O-N 3Å; L139-H142 WeakPolarHBondContact O-CB 3.41Å; L139-H142 PolarHBondContact O-N 2.98Å; L139-N143 WeakPolarHBondContact CD1-ND2 3.46Å; L139-N143 PolarHBondContact O-N 3.44Å; L139-N143 PolarHBondContact O-ND2 3.43Å
140	L	87.2	Confident	79.5	Confident	34 Å²	34	62 Å²	62	18%	0.178	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-48.9	178.8	-179.9	57.5	0	0	0	110.9	K136 F137 A138 H142 N143 L144 A154 L159	K136-L140 WeakPolarHBondContact O-CB 3.41Å; K136-L140 PolarHBondContact O-N 3.23Å; F137-L140 CarbonylContact O-C 3.49Å; F137-L140 WeakPolarHBondContact O-CA 3.42Å; F137-L140 WeakPolarHBondContact O-CB 3.27Å; F137-L140 PolarHBondContact O-N 2.82Å; A138-L140 VanDerWaalsContact C-N 3.34Å; L140-H142 VanDerWaalsContact C-N 3.29Å; L140-H142 PolarHBondContact O-N 3.1Å; L140-N143 CarbonylContact O-C 3.6Å; L140-N143 WeakPolarHBondContact O-CA 3.39Å; L140-N143 WeakPolarHBondContact O-CB 3.34Å; L140-N143 PolarHBondContact O-N 2.91Å; L140-L144 HydrophobicContact CD1-CD1 4.46Å; L140-L144 HydrophobicContact CD1-CD2 4.37Å; L140-L144 HydrophobicContact CD1-CG 4.16Å; L140-L144 HydrophobicContact CG-CD1 4.25Å; L140-L144 HydrophobicContact CG-CG 4.34Å; L140-L144 VanDerWaalsContact O-CG 3.32Å; L140-L144 WeakPolarHBondContact O-CG 3.49Å; L140-L144 PolarHBondContact O-N 2.92Å; L140-A154 HydrophobicContact CD2-CB 3.33Å; L140-A154 HydrophobicContact CG-CB 3.97Å; L140-L159 HydrophobicContact CD2-CB 3.8Å; L140-L159 HydrophobicContact CD2-CD2 4Å; L140-L159 HydrophobicContact CD2-CG 4.41Å; L140-L159 WeakPolarHBondContact CD2-O 3.41Å
141	E	85.4	Confident	80.3	Confident	96 Å²	96	66.7 Å²	66.7	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-55.8	-43.3	175.2	-71.5	-166	117.7	0	0	112.4	F137 N143 L144 T145	F137-E141 HydrophobicContact CD1-CG 4.08Å; F137-E141 HydrophobicContact CE1-CG 3.44Å; F137-E141 VanDerWaalsContact CE1-CG 3.44Å; F137-E141 WeakPolarHBondContact CE1-OE1 3.48Å; F137-E141 WeakPolarHBondContact CE1-OE2 3.24Å; F137-E141 HydrophobicContact CE2-CG 4.34Å; F137-E141 HydrophobicContact CZ-CG 3.56Å; F137-E141 PolarHBondContact O-N 3.16Å; E141-N143 VanDerWaalsContact C-N 3.35Å; E141-N143 PolarHBondContact O-N 3.19Å; E141-L144 PolarHBondContact O-N 2.79Å; E141-T145 WeakPolarHBondContact O-CB 3.43Å; E141-T145 WeakPolarHBondContact O-CG2 3.29Å; E141-T145 PolarHBondContact O-N 3.39Å; E141-T145 PolarHBondContact O-OG1 3.29Å
142	H	81.5	Confident	80.9	Confident	26 Å²	26	64.4 Å²	64.4	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-46.2	172.2	166	83.9	0	0	0	111.8	C126 C129 F133 A138 L139 L140 L144 T145 V146 H147	C126-H142 VanDerWaalsContact SG-CD2 3.55Å; C126-H142 PolarHBondContact SG-NE2 2.79Å; C126-H142 VanDerWaalsContact SG-NE2 3.42Å; C129-H142 PolarHBondContact SG-NE2 3.11Å; F133-H142 HydrophobicContact CD1-CB 4.15Å; F133-H142 HydrophobicContact CE1-CB 3.36Å; F133-H142 AromaticContact CE1-CG 3.69Å; F133-H142 AromaticContact CE1-ND1 3.97Å; F133-H142 HydrophobicContact CE2-CB 4.01Å; F133-H142 AromaticContact CE2-CD2 3.91Å; F133-H142 AromaticContact CE2-CG 3.74Å; F133-H142 HydrophobicContact CZ-CB 3.31Å; F133-H142 AromaticContact CZ-CD2 3.7Å; F133-H142 AromaticContact CZ-CG 3.09Å; F133-H142 AromaticContact CZ-ND1 3.34Å; F133-H142 VanDerWaalsContact CZ-ND1 3.34Å; F133-H142 WeakPolarHBondContact CZ-ND1 3.45Å; A138-H142 WeakPolarHBondContact O-CB 3.4Å; A138-H142 PolarHBondContact O-N 3.21Å; L139-H142 WeakPolarHBondContact O-CB 3.41Å; L139-H142 PolarHBondContact O-N 2.98Å; L140-H142 VanDerWaalsContact C-N 3.29Å; L140-H142 PolarHBondContact O-N 3.1Å; H142-L144 VanDerWaalsContact C-N 3.3Å; H142-L144 PolarHBondContact O-N 2.79Å; H142-T145 PolarHBondContact O-N 3.47Å; H142-T145 PolarHBondContact O-OG1 3.22Å; H142-V146 VanDerWaalsContact O-CB 3.27Å; H142-V146 WeakPolarHBondContact O-CB 3.32Å; H142-V146 WeakPolarHBondContact O-CG2 3.33Å; H142-V146 PolarHBondContact O-N 3.35Å; H142-H147 AromaticContact CD2-CD2 3.85Å; H142-H147 AromaticContact CD2-NE2 3.89Å; H142-H147 AromaticContact CE1-NE2 3.88Å; H142-H147 AromaticContact NE2-CD2 3.36Å; H142-H147 PolarHBondContact NE2-CD2 2.88Å; H142-H147 AromaticContact NE2-CE1 3.99Å; H142-H147 AromaticContact NE2-NE2 2.97Å; H142-H147 PolarHBondContact NE2-NE2 3Å
143	N	81.2	Confident	81.6	Confident	44 Å²	44	65.3 Å²	65.3	24%	0.235	35%	0.351	C	S	.	.	I	π-helix	trans	-62.4	-40.5	177.7	-80.9	-81.3	0	0	0	111.3	L139 L140 E141 T145 H147 N148	L139-N143 WeakPolarHBondContact CD1-ND2 3.46Å; L139-N143 PolarHBondContact O-N 3.44Å; L139-N143 PolarHBondContact O-ND2 3.43Å; L140-N143 CarbonylContact O-C 3.6Å; L140-N143 WeakPolarHBondContact O-CA 3.39Å; L140-N143 WeakPolarHBondContact O-CB 3.34Å; L140-N143 PolarHBondContact O-N 2.91Å; E141-N143 VanDerWaalsContact C-N 3.35Å; E141-N143 PolarHBondContact O-N 3.19Å; N143-T145 VanDerWaalsContact C-N 3.35Å; N143-T145 PolarHBondContact O-N 2.78Å; N143-H147 CarbonylContact O-C 3.57Å; N143-H147 WeakPolarHBondContact O-CA 3.23Å; N143-H147 WeakPolarHBondContact O-CB 3.43Å; N143-H147 PolarHBondContact O-N 3.37Å; N143-H147 PolarHBondContact OD1-CD2 3.1Å; N143-N148 PolarHBondContact O-N 3.04Å
144	L	83.4	Confident	82	Confident	30 Å²	30	64 Å²	64	16%	0.157	35%	0.346	C	S	.	.	I	π-helix	trans	-67.2	-33.6	179.2	-65.9	-175.4	0	0	0	113.2	L140 E141 H142 N148 V152 A154	L140-L144 HydrophobicContact CD1-CD1 4.46Å; L140-L144 HydrophobicContact CD1-CD2 4.37Å; L140-L144 HydrophobicContact CD1-CG 4.16Å; L140-L144 HydrophobicContact CG-CD1 4.25Å; L140-L144 HydrophobicContact CG-CG 4.34Å; L140-L144 VanDerWaalsContact O-CG 3.32Å; L140-L144 WeakPolarHBondContact O-CG 3.49Å; L140-L144 PolarHBondContact O-N 2.92Å; E141-L144 PolarHBondContact O-N 2.79Å; H142-L144 VanDerWaalsContact C-N 3.3Å; H142-L144 PolarHBondContact O-N 2.79Å; L144-N148 HydrophobicContact CD2-CB 4.32Å; L144-N148 WeakPolarHBondContact CD2-ND2 3.01Å; L144-V152 HydrophobicContact CD1-CG2 4.01Å; L144-V152 HydrophobicContact CD2-CG2 3.32Å; L144-V152 HydrophobicContact CG-CG2 4.22Å; L144-A154 HydrophobicContact CD1-CB 4.02Å
145	T	80.9	Confident	82.4	Confident	112 Å²	112	59.4 Å²	59.4	69%	0.687	32%	0.316	S	S	*	.	I	π-helix	trans	-91.6	-30	-177.2	51.9	0	0	0	0	113.7	E141 H142 N143	E141-T145 WeakPolarHBondContact O-CB 3.43Å; E141-T145 WeakPolarHBondContact O-CG2 3.29Å; E141-T145 PolarHBondContact O-N 3.39Å; E141-T145 PolarHBondContact O-OG1 3.29Å; H142-T145 PolarHBondContact O-N 3.47Å; H142-T145 PolarHBondContact O-OG1 3.22Å; N143-T145 VanDerWaalsContact C-N 3.35Å; N143-T145 PolarHBondContact O-N 2.78Å
146	V	77.7	Confident	82.6	Confident	84 Å²	84	61.5 Å²	61.5	51%	0.509	32%	0.32	S	S	.	.	I	π-helix	trans	-109.6	-32.7	-172.4	-176	0	0	0	0	112.9	H142	H142-V146 VanDerWaalsContact O-CB 3.27Å; H142-V146 WeakPolarHBondContact O-CB 3.32Å; H142-V146 WeakPolarHBondContact O-CG2 3.33Å; H142-V146 PolarHBondContact O-N 3.35Å
147	H	78.5	Confident	82.6	Confident	58 Å²	58	60.5 Å²	60.5	27%	0.269	32%	0.318	S	S	.	.	I	π-helix	trans	-111.3	-29.8	-173.3	-62.9	-43.3	0	0	0	113.7	C126 H142 N143	C126-H147 PolarHBondContact SG-CD2 2.8Å; C126-H147 PolarHBondContact SG-NE2 2.85Å; H142-H147 AromaticContact CD2-CD2 3.85Å; H142-H147 AromaticContact CD2-NE2 3.89Å; H142-H147 AromaticContact CE1-NE2 3.88Å; H142-H147 AromaticContact NE2-CD2 3.36Å; H142-H147 PolarHBondContact NE2-CD2 2.88Å; H142-H147 AromaticContact NE2-CE1 3.99Å; H142-H147 AromaticContact NE2-NE2 2.97Å; H142-H147 PolarHBondContact NE2-NE2 3Å; N143-H147 CarbonylContact O-C 3.57Å; N143-H147 WeakPolarHBondContact O-CA 3.23Å; N143-H147 WeakPolarHBondContact O-CB 3.43Å; N143-H147 PolarHBondContact O-N 3.37Å; N143-H147 PolarHBondContact OD1-CD2 3.1Å
148	N	76.9	Confident	82.6	Confident	64 Å²	64	61.8 Å²	61.8	34%	0.342	33%	0.33	S	S	.	.			trans	-79.7	144.4	177	-162.2	-3.7	0	0	0	111	N143 L144 S150	N143-N148 PolarHBondContact O-N 3.04Å; L144-N148 HydrophobicContact CD2-CB 4.32Å; L144-N148 WeakPolarHBondContact CD2-ND2 3.01Å; N148-S150 VanDerWaalsContact CG-O 3.3Å; N148-S150 PolarHBondContact ND2-O 3.46Å; N148-S150 VanDerWaalsContact ND2-O 3.11Å; N148-S150 PolarHBondContact OD1-N 3.26Å; N148-S150 VanDerWaalsContact OD1-N 3.13Å
149	T	74.2	Confident	82.7	Confident	75 Å²	75	63.4 Å²	63.4	46%	0.46	34%	0.335	S	S	.	.	S	Bend	trans	-90.7	-23.5	-179.7	60.3	0	0	0	0	111.9	M1	M1-T149 HydrophobicContact CB-CG2 3.82Å; M1-T149 HydrophobicContact CE-CG2 3.37Å; M1-T149 HydrophobicContact CG-CG2 3.22Å; M1-T149 HydrophobicContact SD-CG2 3.35Å; M1-T149 WeakPolarHBondContact SD-CG2 3.42Å
150	S	77.4	Confident	82.7	Confident	68 Å²	68	67.9 Å²	67.9	48%	0.476	35%	0.354	S	S	.	.	S	Bend	trans	-115.8	132.5	-172.1	-56.9	0	0	0	0	109.5	N148 V152	N148-S150 VanDerWaalsContact CG-O 3.3Å; N148-S150 PolarHBondContact ND2-O 3.46Å; N148-S150 VanDerWaalsContact ND2-O 3.11Å; N148-S150 PolarHBondContact OD1-N 3.26Å; N148-S150 VanDerWaalsContact OD1-N 3.13Å; S150-V152 PolarHBondContact O-N 3.33Å
151	K	81.4	Confident	82.8	Confident	175 Å²	175	69.1 Å²	69.1	76%	0.761	36%	0.364	S	S	*	.			trans	-70.6	121.9	175.7	-169.6	177.9	-175.9	-178.5	0	109	F153	K151-F153 HydrophobicContact CD-CZ 4.4Å; K151-F153 HydrophobicContact CG-CZ 4.44Å
152	V	85.5	Confident	82.9	Confident	40 Å²	40	65.7 Å²	65.7	24%	0.242	35%	0.348	C	S	.	.			trans	-140.6	164.7	175	-62.9	0	0	0	0	108.8	L144 S150 C161 F162	L144-V152 HydrophobicContact CD1-CG2 4.01Å; L144-V152 HydrophobicContact CD2-CG2 3.32Å; L144-V152 HydrophobicContact CG-CG2 4.22Å; S150-V152 PolarHBondContact O-N 3.33Å; V152-C161 HydrophobicContact CB-CB 4.47Å; V152-C161 HydrophobicContact CG2-CB 4.21Å; V152-F162 CarbonylContact C-O 3.46Å; V152-F162 WeakPolarHBondContact CA-O 3.31Å; V152-F162 WeakPolarHBondContact CB-O 3.44Å
153	F	85.3	Confident	83.2	Confident	54 Å²	54	68.9 Å²	68.9	24%	0.237	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.5	-175.2	-58.1	-92.7	0	0	0	110.3	K151 C161 F162 P163 D164 T165	K151-F153 HydrophobicContact CD-CZ 4.4Å; K151-F153 HydrophobicContact CG-CZ 4.44Å; F153-C161 CarbonylContact O-C 3.59Å; F153-C161 WeakPolarHBondContact O-CA 3.39Å; F153-F162 PolarHBondContact N-O 2.77Å; F153-F162 PolarHBondContact O-N 3.43Å; F153-P163 WeakPolarHBondContact CE2-O 3.25Å; F153-D164 VanDerWaalsContact CD2-C 3.45Å; F153-T165 HydrophobicContact CD1-CG2 3.37Å; F153-T165 HydrophobicContact CD2-CG2 4.44Å; F153-T165 HydrophobicContact CE1-CG2 3.41Å; F153-T165 VanDerWaalsContact CE1-CG2 3.41Å; F153-T165 HydrophobicContact CE2-CG2 4.47Å; F153-T165 HydrophobicContact CG-CG2 3.91Å; F153-T165 HydrophobicContact CZ-CG2 3.98Å
154	A	87.5	Confident	83.5	Confident	5 Å²	5	69.9 Å²	69.9	4%	0.041	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	138.6	-178.2	0	0	0	0	0	112.3	F137 L140 L144 K160 R168	F137-A154 HydrophobicContact CE2-CB 4.08Å; L140-A154 HydrophobicContact CD2-CB 3.33Å; L140-A154 HydrophobicContact CG-CB 3.97Å; L144-A154 HydrophobicContact CD1-CB 4.02Å; A154-K160 CarbonylContact C-O 3.55Å; A154-K160 WeakPolarHBondContact CA-O 3.4Å; A154-R168 VanDerWaalsContact C-CD 3.41Å; A154-R168 WeakPolarHBondContact O-CD 3.3Å; A154-R168 PolarHBondContact O-NH1 3.34Å
155	C	83.9	Confident	83.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.387	C	S	.	.			trans	-66	134.8	165.9	173.7	0	0	0	0	110.4	E157 C158 L159 K160 F162 R168 E172 H176	C155-E157 PolarHBondContact SG-N 3.24Å; C155-E157 VanDerWaalsContact SG-N 3.42Å; C155-C158 PolarHBondContact SG-N 3.47Å; C155-L159 WeakPolarHBondContact O-CA 3.29Å; C155-L159 PolarHBondContact O-N 3.33Å; C155-K160 PolarHBondContact N-O 3.07Å; C155-F162 HydrophobicContact CB-CE2 4.08Å; C155-R168 HydrophobicContact CB-CG 4.26Å; C155-E172 WeakPolarHBondContact CA-OE1 3.33Å; C155-E172 HydrophobicContact CB-CG 4.37Å; C155-H176 VanDerWaalsContact SG-CD2 3.6Å
156	H	86.3	Confident	84.5	Confident	94 Å²	94	71.4 Å²	71.4	44%	0.435	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-31.7	-179.3	-73.3	-113.9	0	0	0	113.1	F137 E172	F137-H156 AromaticContact CD1-CE1 3.76Å; F137-H156 AromaticContact CD1-ND1 3.58Å; F137-H156 HydrophobicContact CD2-CB 4.24Å; F137-H156 AromaticContact CD2-CG 3.86Å; F137-H156 AromaticContact CD2-ND1 3.82Å; F137-H156 AromaticContact CE1-CE1 2.99Å; F137-H156 WeakPolarHBondContact CE1-CE1 3.2Å; F137-H156 AromaticContact CE1-ND1 3.29Å; F137-H156 VanDerWaalsContact CE1-ND1 3.29Å; F137-H156 WeakPolarHBondContact CE1-ND1 3.34Å; F137-H156 AromaticContact CE1-NE2 3.66Å; F137-H156 HydrophobicContact CE2-CB 4.26Å; F137-H156 AromaticContact CE2-CD2 3.54Å; F137-H156 AromaticContact CE2-CE1 3.65Å; F137-H156 AromaticContact CE2-CG 3.51Å; F137-H156 AromaticContact CE2-ND1 3.57Å; F137-H156 AromaticContact CE2-NE2 3.64Å; F137-H156 AromaticContact CG-ND1 3.84Å; F137-H156 AromaticContact CZ-CD2 3.55Å; F137-H156 AromaticContact CZ-CE1 2.96Å; F137-H156 WeakPolarHBondContact CZ-CE1 3.28Å; F137-H156 AromaticContact CZ-CG 3.69Å; F137-H156 AromaticContact CZ-ND1 3.32Å; F137-H156 VanDerWaalsContact CZ-ND1 3.32Å; F137-H156 WeakPolarHBondContact CZ-ND1 3.27Å; F137-H156 AromaticContact CZ-NE2 3.09Å; F137-H156 WeakPolarHBondContact CZ-NE2 3.12Å; H156-E172 PolarHBondContact N-OE1 3.24Å
157	E	84	Confident	85.3	Confident	130 Å²	130	69.6 Å²	69.6	61%	0.607	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-51.4	-177.4	-63.5	-59.8	137.3	0	0	112.1	C155 H176 V178	C155-E157 PolarHBondContact SG-N 3.24Å; C155-E157 VanDerWaalsContact SG-N 3.42Å; E157-H176 HydrophobicContact CB-CB 4.47Å; E157-H176 HydrophobicContact CG-CB 4.12Å; E157-V178 HydrophobicContact CG-CG2 4.46Å
158	C	86.6	Confident	85.9	Confident	57 Å²	57	69.3 Å²	69.3	39%	0.385	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-1.9	-175.3	79.3	0	0	0	0	115.6	C155 K160 H171	C155-C158 PolarHBondContact SG-N 3.47Å; C158-K160 PolarHBondContact O-N 2.9Å; C158-K160 VanDerWaalsContact O-N 3.11Å; C158-K160 VanDerWaalsContact SG-CB 3.5Å; C158-H171 PolarHBondContact SG-NE2 2.82Å
159	L	86.8	Confident	86.7	Confident	56 Å²	56	72 Å²	72	29%	0.293	37%	0.372	S	S	.	.			trans	65.3	6.7	178.5	-52.5	-178.9	0	0	0	115.7	K136 F137 L140 C155	K136-L159 HydrophobicContact CB-CD1 3.71Å; K136-L159 HydrophobicContact CD-CD1 4.38Å; F137-L159 HydrophobicContact CB-CD2 3.96Å; F137-L159 HydrophobicContact CD2-CD2 3.83Å; F137-L159 HydrophobicContact CG-CD2 4.41Å; L140-L159 HydrophobicContact CD2-CB 3.8Å; L140-L159 HydrophobicContact CD2-CD2 4Å; L140-L159 HydrophobicContact CD2-CG 4.41Å; L140-L159 WeakPolarHBondContact CD2-O 3.41Å; C155-L159 WeakPolarHBondContact O-CA 3.29Å; C155-L159 PolarHBondContact O-N 3.33Å
160	K	84.9	Confident	87.6	Confident	124 Å²	124	71.2 Å²	71.2	54%	0.539	37%	0.37	S	S	.	.			trans	-63.2	138.9	173.8	-167.2	172.7	-179.6	-174.6	0	110.3	A154 C155 C158 F162	A154-K160 CarbonylContact C-O 3.55Å; A154-K160 WeakPolarHBondContact CA-O 3.4Å; C155-K160 PolarHBondContact N-O 3.07Å; C158-K160 PolarHBondContact O-N 2.9Å; C158-K160 VanDerWaalsContact O-N 3.11Å; C158-K160 VanDerWaalsContact SG-CB 3.5Å; K160-F162 HydrophobicContact CB-CE2 3.85Å; K160-F162 HydrophobicContact CB-CZ 4.04Å; K160-F162 HydrophobicContact CD-CE1 4.44Å; K160-F162 HydrophobicContact CD-CE2 4.44Å; K160-F162 HydrophobicContact CD-CZ 3.79Å; K160-F162 HydrophobicContact CG-CE2 4Å; K160-F162 HydrophobicContact CG-CZ 3.82Å; K160-F162 WeakPolarHBondContact O-CD2 3.48Å; K160-F162 VanDerWaalsContact O-CE2 3.24Å; K160-F162 WeakPolarHBondContact O-CE2 3.35Å
161	C	89.1	Confident	88.3	Confident	59 Å²	59	68.8 Å²	68.8	40%	0.399	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.3	-177.2	-67.3	0	0	0	0	111.4	V152 F153	V152-C161 HydrophobicContact CB-CB 4.47Å; V152-C161 HydrophobicContact CG2-CB 4.21Å; F153-C161 CarbonylContact O-C 3.59Å; F153-C161 WeakPolarHBondContact O-CA 3.39Å
162	F	87	Confident	88.9	Confident	24 Å²	24	61.7 Å²	61.7	11%	0.105	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.6	-175.5	-61	-91.2	0	0	0	110.6	V152 F153 C155 K160 D164 R168 H171	V152-F162 CarbonylContact C-O 3.46Å; V152-F162 WeakPolarHBondContact CA-O 3.31Å; V152-F162 WeakPolarHBondContact CB-O 3.44Å; F153-F162 PolarHBondContact N-O 2.77Å; F153-F162 PolarHBondContact O-N 3.43Å; C155-F162 HydrophobicContact CB-CE2 4.08Å; K160-F162 HydrophobicContact CB-CE2 3.85Å; K160-F162 HydrophobicContact CB-CZ 4.04Å; K160-F162 HydrophobicContact CD-CE1 4.44Å; K160-F162 HydrophobicContact CD-CE2 4.44Å; K160-F162 HydrophobicContact CD-CZ 3.79Å; K160-F162 HydrophobicContact CG-CE2 4Å; K160-F162 HydrophobicContact CG-CZ 3.82Å; K160-F162 WeakPolarHBondContact O-CD2 3.48Å; K160-F162 VanDerWaalsContact O-CE2 3.24Å; K160-F162 WeakPolarHBondContact O-CE2 3.35Å; F162-D164 VanDerWaalsContact C-N 3.28Å; F162-D164 PolarHBondContact O-N 3.32Å; F162-R168 HydrophobicContact CB-CB 4.02Å; F162-R168 HydrophobicContact CD2-CB 3.64Å; F162-R168 HydrophobicContact CD2-CG 3.71Å; F162-R168 HydrophobicContact CE2-CB 4.36Å; F162-R168 HydrophobicContact CE2-CG 4.11Å; F162-R168 HydrophobicContact CG-CB 3.9Å; F162-R168 HydrophobicContact CG-CG 4.47Å; F162-H171 HydrophobicContact CE1-CB 3.64Å; F162-H171 AromaticContact CE1-CG 3.92Å; F162-H171 HydrophobicContact CE2-CB 4.19Å; F162-H171 AromaticContact CE2-CD2 3.53Å; F162-H171 AromaticContact CE2-CG 3.91Å; F162-H171 HydrophobicContact CZ-CB 3.4Å; F162-H171 VanDerWaalsContact CZ-CB 3.4Å; F162-H171 AromaticContact CZ-CD2 3.3Å; F162-H171 WeakPolarHBondContact CZ-CD2 3.44Å; F162-H171 AromaticContact CZ-CG 3.19Å; F162-H171 AromaticContact CZ-ND1 3.81Å; F162-H171 AromaticContact CZ-NE2 3.93Å
163	P	88.6	Confident	89.2	Confident	94 Å²	94	63.8 Å²	63.8	61%	0.61	33%	0.328	S	S	*	.	S	Bend	trans	-67.1	-29	-179.5	26.9	-34.4	0	0	0	113	F153	F153-P163 WeakPolarHBondContact CE2-O 3.25Å
164	D	88.1	Confident	89.6	Confident	64 Å²	64	66.9 Å²	66.9	34%	0.342	35%	0.346	S	S	.	.	S	Bend	trans	-142.4	168.4	-179.3	58.9	67.1	0	0	0	112.1	F153 F162 E166 S167 R168	F153-D164 VanDerWaalsContact CD2-C 3.45Å; F162-D164 VanDerWaalsContact C-N 3.28Å; F162-D164 PolarHBondContact O-N 3.32Å; D164-E166 VanDerWaalsContact C-N 3.3Å; D164-E166 PolarHBondContact O-N 3.19Å; D164-E166 PolarHBondContact OD1-N 3.11Å; D164-S167 WeakPolarHBondContact OD1-CB 3.42Å; D164-S167 PolarHBondContact OD1-N 3Å; D164-S167 PolarHBondContact OD1-OG 3.46Å; D164-S167 PolarHBondContact OD2-OG 3.16Å; D164-R168 PolarHBondContact O-N 2.76Å
165	T	90.7	Very high	89.7	Confident	64 Å²	64	71.9 Å²	71.9	39%	0.393	37%	0.373	S	S	.	.	H	α-helix	trans	-68	-26.6	-179.9	48.8	0	0	0	0	113.7	F153 R169	F153-T165 HydrophobicContact CD1-CG2 3.37Å; F153-T165 HydrophobicContact CD2-CG2 4.44Å; F153-T165 HydrophobicContact CE1-CG2 3.41Å; F153-T165 VanDerWaalsContact CE1-CG2 3.41Å; F153-T165 HydrophobicContact CE2-CG2 4.47Å; F153-T165 HydrophobicContact CG-CG2 3.91Å; F153-T165 HydrophobicContact CZ-CG2 3.98Å; T165-R169 WeakPolarHBondContact O-CB 3.47Å; T165-R169 PolarHBondContact O-N 2.77Å
166	E	93.8	Very high	90.1	Very high	110 Å²	110	75.1 Å²	75.1	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-76.6	-45.4	-176	-171.1	57.6	-146.6	0	0	110.6	D164 R168 R169 S170	D164-E166 VanDerWaalsContact C-N 3.3Å; D164-E166 PolarHBondContact O-N 3.19Å; D164-E166 PolarHBondContact OD1-N 3.11Å; E166-R168 VanDerWaalsContact C-N 3.27Å; E166-R168 PolarHBondContact O-N 3.26Å; E166-R169 PolarHBondContact O-N 3.22Å; E166-R169 VanDerWaalsContact O-N 3.12Å; E166-R169 IonicContact OE2-NH1 3.33Å; E166-R169 PolarHBondContact OE2-NH1 3.29Å; E166-S170 PolarHBondContact O-N 3.09Å
167	S	94	Very high	89.8	Confident	46 Å²	46	73.3 Å²	73.3	32%	0.322	39%	0.394	S	S	.	.	H	α-helix	trans	-56.7	-41.8	171.5	-61.8	0	0	0	0	111.4	D164 H171	D164-S167 WeakPolarHBondContact OD1-CB 3.42Å; D164-S167 PolarHBondContact OD1-N 3Å; D164-S167 PolarHBondContact OD1-OG 3.46Å; D164-S167 PolarHBondContact OD2-OG 3.16Å; S167-H171 WeakPolarHBondContact O-CB 3.47Å; S167-H171 PolarHBondContact O-N 3.18Å
168	R	92.3	Very high	88.9	Confident	53 Å²	53	70.7 Å²	70.7	20%	0.2	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-47.3	173.7	-172.9	-161	68.2	-176.8	1.1	111.7	A154 C155 F162 D164 E166 H171 E172	A154-R168 VanDerWaalsContact C-CD 3.41Å; A154-R168 WeakPolarHBondContact O-CD 3.3Å; A154-R168 PolarHBondContact O-NH1 3.34Å; C155-R168 HydrophobicContact CB-CG 4.26Å; F162-R168 HydrophobicContact CB-CB 4.02Å; F162-R168 HydrophobicContact CD2-CB 3.64Å; F162-R168 HydrophobicContact CD2-CG 3.71Å; F162-R168 HydrophobicContact CE2-CB 4.36Å; F162-R168 HydrophobicContact CE2-CG 4.11Å; F162-R168 HydrophobicContact CG-CB 3.9Å; F162-R168 HydrophobicContact CG-CG 4.47Å; D164-R168 PolarHBondContact O-N 2.76Å; E166-R168 VanDerWaalsContact C-N 3.27Å; E166-R168 PolarHBondContact O-N 3.26Å; R168-H171 WeakPolarHBondContact O-CB 3.48Å; R168-H171 PolarHBondContact O-N 2.81Å; R168-E172 HydrophobicContact CG-CG 4.44Å; R168-E172 IonicContact CZ-OE2 3.57Å; R168-E172 IonicContact NE-OE1 3.34Å; R168-E172 IonicContact NE-OE2 2.66Å; R168-E172 PolarHBondContact NE-OE2 2.9Å; R168-E172 IonicContact NH2-OE2 3.25Å; R168-E172 WeakPolarHBondContact O-CG 3.42Å; R168-E172 PolarHBondContact O-N 3.49Å
169	R	93.2	Very high	87.3	Confident	120 Å²	120	69.7 Å²	69.7	45%	0.453	39%	0.387	S	S	.	.	H	α-helix	trans	-63.7	-42.9	-178.7	-174.6	-171.1	-66.4	161.7	-4.4	111.7	T165 E166 H171 E172 Q173	T165-R169 WeakPolarHBondContact O-CB 3.47Å; T165-R169 PolarHBondContact O-N 2.77Å; E166-R169 PolarHBondContact O-N 3.22Å; E166-R169 VanDerWaalsContact O-N 3.12Å; E166-R169 IonicContact OE2-NH1 3.33Å; E166-R169 PolarHBondContact OE2-NH1 3.29Å; R169-H171 VanDerWaalsContact C-N 3.26Å; R169-H171 PolarHBondContact O-N 3.17Å; R169-E172 PolarHBondContact O-N 3.3Å; R169-Q173 WeakPolarHBondContact O-CB 3.36Å; R169-Q173 PolarHBondContact O-N 3.32Å
170	S	94.2	Very high	85.2	Confident	58 Å²	58	71.7 Å²	71.7	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-41.5	175	178.1	0	0	0	0	111.2	E166 N174	E166-S170 PolarHBondContact O-N 3.09Å; S170-N174 VanDerWaalsContact O-CB 3.31Å; S170-N174 WeakPolarHBondContact O-CB 3.37Å; S170-N174 PolarHBondContact O-N 3.37Å; S170-N174 PolarHBondContact O-ND2 2.95Å; S170-N174 PolarHBondContact OG-ND2 2.85Å
171	H	91.7	Very high	83.1	Confident	17 Å²	17	71.4 Å²	71.4	8%	0.079	42%	0.415	C	S	.	.	H	α-helix	trans	-63.4	-47.6	173.3	160.9	76	0	0	0	112.2	C158 F162 S167 R168 R169 Q173 N174 D175 H176	C158-H171 PolarHBondContact SG-NE2 2.82Å; F162-H171 HydrophobicContact CE1-CB 3.64Å; F162-H171 AromaticContact CE1-CG 3.92Å; F162-H171 HydrophobicContact CE2-CB 4.19Å; F162-H171 AromaticContact CE2-CD2 3.53Å; F162-H171 AromaticContact CE2-CG 3.91Å; F162-H171 HydrophobicContact CZ-CB 3.4Å; F162-H171 VanDerWaalsContact CZ-CB 3.4Å; F162-H171 AromaticContact CZ-CD2 3.3Å; F162-H171 WeakPolarHBondContact CZ-CD2 3.44Å; F162-H171 AromaticContact CZ-CG 3.19Å; F162-H171 AromaticContact CZ-ND1 3.81Å; F162-H171 AromaticContact CZ-NE2 3.93Å; S167-H171 WeakPolarHBondContact O-CB 3.47Å; S167-H171 PolarHBondContact O-N 3.18Å; R168-H171 WeakPolarHBondContact O-CB 3.48Å; R168-H171 PolarHBondContact O-N 2.81Å; R169-H171 VanDerWaalsContact C-N 3.26Å; R169-H171 PolarHBondContact O-N 3.17Å; H171-Q173 VanDerWaalsContact C-N 3.27Å; H171-Q173 PolarHBondContact O-N 3.29Å; H171-N174 PolarHBondContact O-N 2.94Å; H171-D175 IonicContact CE1-OD2 3.75Å; H171-D175 PolarHBondContact CE1-OD2 3.44Å; H171-D175 VanDerWaalsContact CE1-OD2 3.25Å; H171-D175 IonicContact CG-OD2 3.24Å; H171-D175 IonicContact ND1-OD2 3.34Å; H171-D175 PolarHBondContact ND1-OD2 3Å; H171-D175 WeakPolarHBondContact O-CB 3.4Å; H171-D175 PolarHBondContact O-N 3.1Å; H171-H176 AromaticContact CE1-NE2 3.8Å; H171-H176 AromaticContact NE2-CD2 3.87Å; H171-H176 AromaticContact NE2-NE2 3.38Å; H171-H176 PolarHBondContact NE2-NE2 3.03Å
172	E	93.3	Very high	80.6	Confident	26 Å²	26	75.1 Å²	75.1	12%	0.121	43%	0.43	C	S	.	.	H	α-helix	trans	-59.6	-38.4	177.8	-73.5	169.6	161.2	0	0	112.1	C155 H156 R168 R169 H176 G177 V178	C155-E172 WeakPolarHBondContact CA-OE1 3.33Å; C155-E172 HydrophobicContact CB-CG 4.37Å; H156-E172 PolarHBondContact N-OE1 3.24Å; R168-E172 HydrophobicContact CG-CG 4.44Å; R168-E172 IonicContact CZ-OE2 3.57Å; R168-E172 IonicContact NE-OE1 3.34Å; R168-E172 IonicContact NE-OE2 2.66Å; R168-E172 PolarHBondContact NE-OE2 2.9Å; R168-E172 IonicContact NH2-OE2 3.25Å; R168-E172 WeakPolarHBondContact O-CG 3.42Å; R168-E172 PolarHBondContact O-N 3.49Å; R169-E172 PolarHBondContact O-N 3.3Å; E172-H176 CarbonylContact O-C 3.57Å; E172-H176 WeakPolarHBondContact O-CA 3.48Å; E172-H176 VanDerWaalsContact O-CB 3.31Å; E172-H176 WeakPolarHBondContact O-CB 3.15Å; E172-H176 PolarHBondContact O-N 3.39Å; E172-H176 VanDerWaalsContact O-N 3.14Å; E172-G177 PolarHBondContact O-N 2.86Å; E172-G177 VanDerWaalsContact O-N 3.13Å; E172-V178 PolarHBondContact O-N 3.32Å
173	Q	92.6	Very high	78.1	Confident	85 Å²	85	81.1 Å²	81.1	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-69.4	-43.4	177	-178.2	60.7	78.8	0	0	112.7	R169 H171 G177	R169-Q173 WeakPolarHBondContact O-CB 3.36Å; R169-Q173 PolarHBondContact O-N 3.32Å; H171-Q173 VanDerWaalsContact C-N 3.27Å; H171-Q173 PolarHBondContact O-N 3.29Å; Q173-G177 WeakPolarHBondContact O-CA 3.4Å; Q173-G177 PolarHBondContact O-N 3.03Å
174	N	92.1	Very high	75.5	Confident	118 Å²	118	86.7 Å²	86.7	63%	0.631	47%	0.471	S	S	*	.	H	α-helix	trans	-81.1	-39.6	-174.1	-69.8	-22.4	0	0	0	113	S170 H171	S170-N174 VanDerWaalsContact O-CB 3.31Å; S170-N174 WeakPolarHBondContact O-CB 3.37Å; S170-N174 PolarHBondContact O-N 3.37Å; S170-N174 PolarHBondContact O-ND2 2.95Å; S170-N174 PolarHBondContact OG-ND2 2.85Å; H171-N174 PolarHBondContact O-N 2.94Å
175	D	91.3	Very high	72.9	Confident	111 Å²	111	88.3 Å²	88.3	59%	0.594	49%	0.488	S	S	*	.	H	α-helix	trans	-101.6	-21.7	-171	-63.4	-36.5	0	0	0	112.9	H171	H171-D175 IonicContact CE1-OD2 3.75Å; H171-D175 PolarHBondContact CE1-OD2 3.44Å; H171-D175 VanDerWaalsContact CE1-OD2 3.25Å; H171-D175 IonicContact CG-OD2 3.24Å; H171-D175 IonicContact ND1-OD2 3.34Å; H171-D175 PolarHBondContact ND1-OD2 3Å; H171-D175 WeakPolarHBondContact O-CB 3.4Å; H171-D175 PolarHBondContact O-N 3.1Å
176	H	90.7	Very high	70.4	Confident	67 Å²	67	91.3 Å²	91.3	31%	0.31	51%	0.508	S	S	.	.	S	Bend	trans	-118.3	-9.8	179.7	-56.1	-51.3	0	0	0	113.9	C155 E157 H171 E172 V178	C155-H176 VanDerWaalsContact SG-CD2 3.6Å; E157-H176 HydrophobicContact CB-CB 4.47Å; E157-H176 HydrophobicContact CG-CB 4.12Å; H171-H176 AromaticContact CE1-NE2 3.8Å; H171-H176 AromaticContact NE2-CD2 3.87Å; H171-H176 AromaticContact NE2-NE2 3.38Å; H171-H176 PolarHBondContact NE2-NE2 3.03Å; E172-H176 CarbonylContact O-C 3.57Å; E172-H176 WeakPolarHBondContact O-CA 3.48Å; E172-H176 VanDerWaalsContact O-CB 3.31Å; E172-H176 WeakPolarHBondContact O-CB 3.15Å; E172-H176 PolarHBondContact O-N 3.39Å; E172-H176 VanDerWaalsContact O-N 3.14Å; H176-V178 HydrophobicContact CB-CG2 3.92Å; H176-V178 PolarHBondContact O-N 3.13Å
177	G	80.7	Confident	67.7	Low	56 Å²	56	91.5 Å²	91.5	58%	0.577	52%	0.517	S	S	*	.			trans	65.3	15	-178.8	0	0	0	0	0	113.8	E172 Q173 G179	E172-G177 PolarHBondContact O-N 2.86Å; E172-G177 VanDerWaalsContact O-N 3.13Å; Q173-G177 WeakPolarHBondContact O-CA 3.4Å; Q173-G177 PolarHBondContact O-N 3.03Å; G177-G179 VanDerWaalsContact C-N 3.26Å; G177-G179 PolarHBondContact O-N 3.45Å
178	V	66	Low	64.8	Low	76 Å²	76	95.3 Å²	95.3	46%	0.461	54%	0.539	S	S	.	.			trans	-78.1	83.3	179.2	-173.8	0	0	0	0	108.2	E157 E172 H176	E157-V178 HydrophobicContact CG-CG2 4.46Å; E172-V178 PolarHBondContact O-N 3.32Å; H176-V178 HydrophobicContact CB-CG2 3.92Å; H176-V178 PolarHBondContact O-N 3.13Å
179	G	51.6	Low	62.3	Low	36 Å²	36	101.7 Å²	101.7	37%	0.371	57%	0.571	S	S	.	*			trans	-67.7	131.8	168.2	0	0	0	0	0	110.3	G177 S181	G177-G179 VanDerWaalsContact C-N 3.26Å; G177-G179 PolarHBondContact O-N 3.45Å; G179-S181 PolarHBondContact O-N 3.13Å
180	T	43.4	Very low	59.5	Low	98 Å²	98	101 Å²	101	60%	0.601	58%	0.584	S	S	*	*			trans	-50.7	96.4	-178.9	53.6	0	0	0	0	112.2	N182	T180-N182 PolarHBondContact O-N 2.78Å
181	S	41.6	Very low	57	Low	118 Å²	118	107.7 Å²	107.7	83%	0.825	63%	0.631	S	S	*	*			trans	-77.3	71.1	149	26.7	0	0	0	0	107.8	G179	G179-S181 PolarHBondContact O-N 3.13Å
182	N	35.4	Very low	55.2	Low	136 Å²	136	112.2 Å²	112.2	73%	0.727	66%	0.658	S	S	*	*			trans	-63	157.7	141.3	-163.1	24.4	0	0	0	107.3	T180	T180-N182 PolarHBondContact O-N 2.78Å
183	M	35	Very low	53.2	Low	151 Å²	151	116.7 Å²	116.7	74%	0.744	69%	0.687	S	S	*	*			trans	92.3	112.1	-174.2	-41.5	-99.4	-158.6	0	0	111.3
184	Y	34.4	Very low	51.1	Low	210 Å²	210	118.5 Å²	118.5	82%	0.824	70%	0.703	S	S	*	*			cis	-148.5	133.2	43.1	-97.8	-99.7	0	0	0	111.6
185	S	32.9	Very low	48.6	Very low	99 Å²	99	118.5 Å²	118.5	69%	0.692	71%	0.707	S	S	*	*			trans	-57.3	135.3	157.9	-47.2	0	0	0	0	109.7	T187	S185-T187 PolarHBondContact O-N 3.08Å
186	P	38.4	Very low	46	Very low	126 Å²	126	119 Å²	119	82%	0.818	71%	0.714	S	S	*	*			trans	-68.1	106.2	165.4	-3.5	17.7	0	0	0	107.5	T188	P186-T188 PolarHBondContact O-N 3.32Å; P186-T188 VanDerWaalsContact O-N 3.14Å
187	T	37	Very low	43	Very low	115 Å²	115	122.5 Å²	122.5	71%	0.706	74%	0.741	S	S	*	*			trans	-60.4	115.7	166.5	-36.4	0	0	0	0	107.4	S185 Q189	S185-T187 PolarHBondContact O-N 3.08Å; T187-Q189 PolarHBondContact O-N 2.67Å
188	T	34.1	Very low	40.3	Very low	126 Å²	126	127.2 Å²	127.2	77%	0.773	75%	0.752	S	S	*	*			trans	-55.9	118.2	164.5	47.6	0	0	0	0	109.2	P186	P186-T188 PolarHBondContact O-N 3.32Å; P186-T188 VanDerWaalsContact O-N 3.14Å
189	Q	38.1	Very low	38.3	Very low	187 Å²	187	131.2 Å²	131.2	87%	0.874	78%	0.775	S	S	*	*			trans	-122.9	105.3	149.4	-79.1	-170.6	15.8	0	0	108.5	T187	T187-Q189 PolarHBondContact O-N 2.67Å
190	S	34.2	Very low	37.2	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	81%	0.809	S	S	*	*			trans	-68.9	154.9	162.4	43	0	0	0	0	111.6
191	S	42.2	Very low	36.7	Very low	199 Å²	199	142.8 Å²	142.8	100%	1.392	83%	0.827	S	S	*	*			trans	87.5	0	166.3	-58.4	0	0	0	0	116.6

Retrieved 191 of 191 residues in 297.3 ms (Link to these results)

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