A0A077ZCQ7_TRITR Loading...

Zf-C2H2 6 and zf-C2H2 and zf-C2H2 4 domain contai ning protein

AlphaFold DB , UniProt , Accession A0A077ZCQ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 210 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	33.5	Very low	70.9	Confident	236 Å²	236	109.5 Å²	109.5	100%	1.163	62%	0.617	S	S	*	*				0	99.6	0	-71.4	171.9	162.2	0	0	107.2	N3	M1-N3 PolarHBondContact O-N 3.33Å
2	N	44.9	Very low	72	Confident	149 Å²	149	112.7 Å²	112.7	80%	0.797	63%	0.63	S	S	*	*			trans	-82.6	101	176.5	-82.3	7.1	0	0	0	108.4	E4	N2-E4 HydrophobicContact CB-CG 4.48Å; N2-E4 PolarHBondContact O-N 3.09Å
3	N	52.2	Low	72.8	Confident	166 Å²	166	115.6 Å²	115.6	89%	0.888	64%	0.644	S	S	*	*			trans	-71.6	73.2	163.3	-96.4	-1.5	0	0	0	108.1	M1 A5	M1-N3 PolarHBondContact O-N 3.33Å; N3-A5 PolarHBondContact O-N 2.91Å; N3-A5 VanDerWaalsContact O-N 3.13Å
4	E	59.5	Low	73.4	Confident	148 Å²	148	108.5 Å²	108.5	69%	0.692	61%	0.606	S	S	*	*			trans	-70.5	108.7	166.6	-77.8	-172.9	177.4	0	0	107.8	N2 T6	N2-E4 HydrophobicContact CB-CG 4.48Å; N2-E4 PolarHBondContact O-N 3.09Å; E4-T6 PolarHBondContact O-N 3.09Å
5	A	74.8	Confident	74.3	Confident	81 Å²	81	111.5 Å²	111.5	67%	0.669	62%	0.62	S	S	*	*			trans	-56	113.6	176.8	0	0	0	0	0	110.1	N3	N3-A5 PolarHBondContact O-N 2.91Å; N3-A5 VanDerWaalsContact O-N 3.13Å
6	T	85.8	Confident	75	Confident	87 Å²	87	112.3 Å²	112.3	53%	0.534	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-92.5	143.2	174.9	59.7	0	0	0	0	111	E4	E4-T6 PolarHBondContact O-N 3.09Å
7	F	87.3	Confident	75.6	Confident	70 Å²	70	110.6 Å²	110.6	31%	0.307	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.6	120	177.1	-56.8	-85.7	0	0	0	110.1	T17 F18 K20 M21 L24	F7-T17 CarbonylContact O-C 3.5Å; F7-T17 WeakPolarHBondContact O-CA 3.33Å; F7-F18 PolarHBondContact N-O 3.06Å; F7-F18 PolarHBondContact O-N 3.13Å; F7-K20 VanDerWaalsContact CD2-C 3.48Å; F7-M21 HydrophobicContact CD1-CB 4.08Å; F7-M21 HydrophobicContact CD1-CE 3.43Å; F7-M21 VanDerWaalsContact CD1-CE 3.43Å; F7-M21 HydrophobicContact CD1-SD 4.1Å; F7-M21 HydrophobicContact CD2-CB 4.39Å; F7-M21 VanDerWaalsContact CD2-N 3.3Å; F7-M21 HydrophobicContact CE1-CB 3.96Å; F7-M21 HydrophobicContact CE1-CE 3.66Å; F7-M21 HydrophobicContact CE2-CB 4.28Å; F7-M21 HydrophobicContact CG-CB 4.29Å; F7-M21 HydrophobicContact CG-CE 4.43Å; F7-M21 HydrophobicContact CZ-CB 4.06Å; F7-L24 HydrophobicContact CB-CB 4.26Å; F7-L24 HydrophobicContact CB-CD2 3.81Å
8	V	87	Confident	76.1	Confident	78 Å²	78	106.8 Å²	106.8	47%	0.473	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	143.4	-177.1	-172.6	0	0	0	0	110.6	T17 L24	V8-T17 HydrophobicContact CB-CG2 4.25Å; V8-T17 HydrophobicContact CG1-CG2 4.04Å; V8-T17 HydrophobicContact CG2-CG2 3.79Å; V8-L24 WeakPolarHBondContact O-CD2 3.48Å
9	C	84.6	Confident	76.9	Confident	6 Å²	6	105.3 Å²	105.3	4%	0.041	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-77.2	118.7	169.7	-170.8	0	0	0	0	110.4	V11 C14 K16 L24 H32	C9-V11 VanDerWaalsContact C-N 3.27Å; C9-V11 PolarHBondContact O-N 3.16Å; C9-C14 HydrophobicContact CB-CB 4.38Å; C9-K16 HydrophobicContact CB-CB 4.28Å; C9-K16 WeakPolarHBondContact CB-O 3.38Å; C9-K16 PolarHBondContact N-O 3.01Å; C9-L24 HydrophobicContact CB-CD1 3.76Å; C9-H32 PolarHBondContact SG-NE2 2.87Å
10	S	86.2	Confident	77.3	Confident	126 Å²	126	105.8 Å²	105.8	88%	0.881	58%	0.579	S	S	*	*			trans	-85.6	6.5	-179	-44.2	0	0	0	0	114
11	V	83.9	Confident	77.8	Confident	57 Å²	57	104.2 Å²	104.2	35%	0.345	57%	0.569	S	S	.	*	S	Bend	trans	-73.4	131.5	178.5	178.1	0	0	0	0	108.9	C9 N13 C14 H32	C9-V11 VanDerWaalsContact C-N 3.27Å; C9-V11 PolarHBondContact O-N 3.16Å; V11-N13 PolarHBondContact O-N 2.82Å; V11-C14 HydrophobicContact CB-CB 4.12Å; V11-C14 VanDerWaalsContact O-CB 3.26Å; V11-C14 WeakPolarHBondContact O-CB 3.25Å; V11-C14 PolarHBondContact O-N 3.02Å; V11-H32 HydrophobicContact CG2-CB 4.25Å
12	L	84.2	Confident	80.3	Confident	148 Å²	148	99 Å²	99	78%	0.775	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	131.5	179.3	-170.8	68.5	0	0	0	110.7	C14	L12-C14 VanDerWaalsContact C-N 3.31Å; L12-C14 PolarHBondContact O-N 2.82Å
13	N	82.8	Confident	82.3	Confident	151 Å²	151	95.5 Å²	95.5	81%	0.807	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	25	-175.2	-51.6	-40.3	0	0	0	115	V11	V11-N13 PolarHBondContact O-N 2.82Å
14	C	81.1	Confident	83.7	Confident	16 Å²	16	88.6 Å²	88.6	11%	0.108	48%	0.481	C	S	.	.			trans	-120.9	95.5	173.2	-167.9	0	0	0	0	112.9	C9 V11 L12 K16 H27 H32	C9-C14 HydrophobicContact CB-CB 4.38Å; V11-C14 HydrophobicContact CB-CB 4.12Å; V11-C14 VanDerWaalsContact O-CB 3.26Å; V11-C14 WeakPolarHBondContact O-CB 3.25Å; V11-C14 PolarHBondContact O-N 3.02Å; L12-C14 VanDerWaalsContact C-N 3.31Å; L12-C14 PolarHBondContact O-N 2.82Å; C14-K16 PolarHBondContact O-N 2.72Å; C14-H27 PolarHBondContact SG-NE2 3.45Å; C14-H32 VanDerWaalsContact SG-CE1 3.6Å; C14-H32 PolarHBondContact SG-NE2 3.31Å
15	D	86.2	Confident	84.9	Confident	154 Å²	154	89.8 Å²	89.8	82%	0.824	48%	0.479	S	S	*	.			trans	-84.3	32.4	-178.2	-50.4	-44.6	0	0	0	113.3
16	K	85.4	Confident	85	Confident	124 Å²	124	91.8 Å²	91.8	54%	0.539	47%	0.469	S	S	.	.			trans	-88.8	125.1	-175.9	-68	-63.7	-177.5	-169.5	0	111.4	C9 C14 F18	C9-K16 HydrophobicContact CB-CB 4.28Å; C9-K16 WeakPolarHBondContact CB-O 3.38Å; C9-K16 PolarHBondContact N-O 3.01Å; C14-K16 PolarHBondContact O-N 2.72Å; K16-F18 HydrophobicContact CB-CE2 3.64Å; K16-F18 HydrophobicContact CB-CZ 3.73Å
17	T	86	Confident	84.8	Confident	83 Å²	83	88.8 Å²	88.8	51%	0.509	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	151.5	173.4	62.5	0	0	0	0	111	F7 V8	F7-T17 CarbonylContact O-C 3.5Å; F7-T17 WeakPolarHBondContact O-CA 3.33Å; V8-T17 HydrophobicContact CB-CG2 4.25Å; V8-T17 HydrophobicContact CG1-CG2 4.04Å; V8-T17 HydrophobicContact CG2-CG2 3.79Å
18	F	85	Confident	84.3	Confident	42 Å²	42	87.3 Å²	87.3	18%	0.184	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	143.5	-172.8	-59.2	-85.9	0	0	0	110.9	F7 K16 K20 L24 H27	F7-F18 PolarHBondContact N-O 3.06Å; F7-F18 PolarHBondContact O-N 3.13Å; K16-F18 HydrophobicContact CB-CE2 3.64Å; K16-F18 HydrophobicContact CB-CZ 3.73Å; F18-K20 VanDerWaalsContact C-N 3.28Å; F18-K20 PolarHBondContact O-N 2.79Å; F18-L24 HydrophobicContact CB-CB 4.3Å; F18-L24 HydrophobicContact CD2-CB 3.74Å; F18-L24 HydrophobicContact CD2-CD1 3.72Å; F18-L24 HydrophobicContact CD2-CG 4.31Å; F18-L24 HydrophobicContact CE2-CB 4.42Å; F18-L24 HydrophobicContact CE2-CD1 3.77Å; F18-L24 HydrophobicContact CG-CB 4.17Å; F18-H27 HydrophobicContact CE1-CB 3.94Å; F18-H27 HydrophobicContact CE2-CB 3.88Å; F18-H27 AromaticContact CE2-CD2 3.6Å; F18-H27 AromaticContact CE2-CG 3.73Å; F18-H27 HydrophobicContact CZ-CB 3.35Å; F18-H27 AromaticContact CZ-CD2 3.64Å; F18-H27 AromaticContact CZ-CG 3.29Å; F18-H27 AromaticContact CZ-ND1 3.77Å
19	S	90.1	Very high	83.8	Confident	79 Å²	79	89.4 Å²	89.4	55%	0.552	45%	0.445	S	S	*	.	S	Bend	trans	-75.8	-15.2	175.1	54.6	0	0	0	0	113.8
20	K	86.5	Confident	83	Confident	114 Å²	114	91.3 Å²	91.3	50%	0.496	46%	0.457	S	S	.	.	S	Bend	trans	-136.5	138.1	179.9	-62.1	-172.4	179.3	-175.1	0	111.2	F7 F18 E22 Y23 L24	F7-K20 VanDerWaalsContact CD2-C 3.48Å; F18-K20 VanDerWaalsContact C-N 3.28Å; F18-K20 PolarHBondContact O-N 2.79Å; K20-E22 VanDerWaalsContact C-N 3.25Å; K20-E22 PolarHBondContact O-N 2.95Å; K20-Y23 HydrophobicContact CB-CD2 3.87Å; K20-Y23 HydrophobicContact CB-CE2 4.1Å; K20-Y23 HydrophobicContact CB-CG 4.28Å; K20-Y23 HydrophobicContact CD-CE2 3.92Å; K20-Y23 HydrophobicContact CG-CD2 4.35Å; K20-Y23 HydrophobicContact CG-CE2 4.14Å; K20-Y23 PolarHBondContact O-N 2.91Å; K20-L24 PolarHBondContact O-N 3.38Å
21	M	86.9	Confident	82.4	Confident	74 Å²	74	94.3 Å²	94.3	37%	0.365	45%	0.449	S	S	.	.	H	α-helix	trans	-57.1	-37.2	176.6	180	60.3	85.1	0	0	112.4	F7 Y23 L24 R25	F7-M21 HydrophobicContact CD1-CB 4.08Å; F7-M21 HydrophobicContact CD1-CE 3.43Å; F7-M21 VanDerWaalsContact CD1-CE 3.43Å; F7-M21 HydrophobicContact CD1-SD 4.1Å; F7-M21 HydrophobicContact CD2-CB 4.39Å; F7-M21 VanDerWaalsContact CD2-N 3.3Å; F7-M21 HydrophobicContact CE1-CB 3.96Å; F7-M21 HydrophobicContact CE1-CE 3.66Å; F7-M21 HydrophobicContact CE2-CB 4.28Å; F7-M21 HydrophobicContact CG-CB 4.29Å; F7-M21 HydrophobicContact CG-CE 4.43Å; F7-M21 HydrophobicContact CZ-CB 4.06Å; M21-Y23 VanDerWaalsContact C-N 3.26Å; M21-Y23 PolarHBondContact O-N 3.09Å; M21-L24 PolarHBondContact O-N 3.23Å; M21-L24 HydrophobicContact SD-CD2 4.09Å; M21-R25 HydrophobicContact CG-CG 4.34Å; M21-R25 WeakPolarHBondContact O-CG 3.5Å; M21-R25 PolarHBondContact O-N 3.02Å; M21-R25 HydrophobicContact SD-CG 4.3Å
22	E	86.9	Confident	82.2	Confident	125 Å²	125	95 Å²	95	58%	0.584	45%	0.448	S	S	*	.	H	α-helix	trans	-57.2	-39.7	176.7	-169.4	-160.7	151.8	0	0	112.2	K20 R25 R26	K20-E22 VanDerWaalsContact C-N 3.25Å; K20-E22 PolarHBondContact O-N 2.95Å; E22-R25 PolarHBondContact O-N 3.46Å; E22-R26 WeakPolarHBondContact O-CB 3.17Å; E22-R26 PolarHBondContact O-N 3.44Å
23	Y	86.1	Confident	81.6	Confident	77 Å²	77	93 Å²	93	30%	0.302	44%	0.438	S	S	.	.	H	α-helix	trans	-71.9	-37.5	179.2	-59.8	-22.7	0	0	0	111.9	K20 M21 R26 H27	K20-Y23 HydrophobicContact CB-CD2 3.87Å; K20-Y23 HydrophobicContact CB-CE2 4.1Å; K20-Y23 HydrophobicContact CB-CG 4.28Å; K20-Y23 HydrophobicContact CD-CE2 3.92Å; K20-Y23 HydrophobicContact CG-CD2 4.35Å; K20-Y23 HydrophobicContact CG-CE2 4.14Å; K20-Y23 PolarHBondContact O-N 2.91Å; M21-Y23 VanDerWaalsContact C-N 3.26Å; M21-Y23 PolarHBondContact O-N 3.09Å; Y23-R26 PolarHBondContact O-N 3.41Å; Y23-H27 VanDerWaalsContact O-CB 3.27Å; Y23-H27 WeakPolarHBondContact O-CB 3.5Å; Y23-H27 PolarHBondContact O-N 2.69Å
24	L	82.1	Confident	80.7	Confident	20 Å²	20	87.9 Å²	87.9	11%	0.105	42%	0.42	C	S	.	.	H	α-helix	trans	-61.6	-49.7	171.7	173.6	60.4	0	0	0	110.8	F7 V8 C9 F18 K20 M21 R26 H27 V28	F7-L24 HydrophobicContact CB-CB 4.26Å; F7-L24 HydrophobicContact CB-CD2 3.81Å; V8-L24 WeakPolarHBondContact O-CD2 3.48Å; C9-L24 HydrophobicContact CB-CD1 3.76Å; F18-L24 HydrophobicContact CB-CB 4.3Å; F18-L24 HydrophobicContact CD2-CB 3.74Å; F18-L24 HydrophobicContact CD2-CD1 3.72Å; F18-L24 HydrophobicContact CD2-CG 4.31Å; F18-L24 HydrophobicContact CE2-CB 4.42Å; F18-L24 HydrophobicContact CE2-CD1 3.77Å; F18-L24 HydrophobicContact CG-CB 4.17Å; K20-L24 PolarHBondContact O-N 3.38Å; M21-L24 PolarHBondContact O-N 3.23Å; M21-L24 HydrophobicContact SD-CD2 4.09Å; L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 2.98Å; L24-H27 WeakPolarHBondContact O-CA 3.41Å; L24-H27 WeakPolarHBondContact O-CB 3.22Å; L24-H27 PolarHBondContact O-N 3.38Å; L24-V28 HydrophobicContact CD1-CG2 3.89Å; L24-V28 HydrophobicContact CG-CG2 4.44Å; L24-V28 WeakPolarHBondContact O-CG2 3.24Å; L24-V28 PolarHBondContact O-N 2.87Å
25	R	83.5	Confident	79.5	Confident	173 Å²	173	92.4 Å²	92.4	65%	0.653	44%	0.442	S	S	*	.	H	α-helix	trans	-57.9	-45.2	177.6	-71.3	179.4	-174.7	168.4	1.3	111.6	M21 E22 H27 V28 R29	M21-R25 HydrophobicContact CG-CG 4.34Å; M21-R25 WeakPolarHBondContact O-CG 3.5Å; M21-R25 PolarHBondContact O-N 3.02Å; M21-R25 HydrophobicContact SD-CG 4.3Å; E22-R25 PolarHBondContact O-N 3.46Å; R25-H27 VanDerWaalsContact C-N 3.32Å; R25-H27 PolarHBondContact O-N 2.8Å; R25-V28 PolarHBondContact O-N 3.04Å; R25-R29 WeakPolarHBondContact O-CB 3.42Å; R25-R29 PolarHBondContact O-N 3.18Å
26	R	77.8	Confident	78	Confident	123 Å²	123	86.6 Å²	86.6	46%	0.464	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-41.4	174.8	-179.7	177.1	63.6	-170.7	-2.6	111.8	E22 Y23 L24 T30	E22-R26 WeakPolarHBondContact O-CB 3.17Å; E22-R26 PolarHBondContact O-N 3.44Å; Y23-R26 PolarHBondContact O-N 3.41Å; L24-R26 VanDerWaalsContact C-N 3.32Å; L24-R26 PolarHBondContact O-N 2.98Å; R26-T30 HydrophobicContact CG-CG2 4.41Å; R26-T30 WeakPolarHBondContact O-CB 3.23Å; R26-T30 WeakPolarHBondContact O-CG2 3.44Å; R26-T30 PolarHBondContact O-N 3.24Å; R26-T30 PolarHBondContact O-OG1 3.42Å
27	H	80.4	Confident	76.6	Confident	24 Å²	24	83.4 Å²	83.4	11%	0.111	41%	0.412	C	S	.	.	H	α-helix	trans	-62.4	-53	177.4	164	74.8	0	0	0	111.5	C14 F18 Y23 L24 R25 R29 T30 R31 H32	C14-H27 PolarHBondContact SG-NE2 3.45Å; F18-H27 HydrophobicContact CE1-CB 3.94Å; F18-H27 HydrophobicContact CE2-CB 3.88Å; F18-H27 AromaticContact CE2-CD2 3.6Å; F18-H27 AromaticContact CE2-CG 3.73Å; F18-H27 HydrophobicContact CZ-CB 3.35Å; F18-H27 AromaticContact CZ-CD2 3.64Å; F18-H27 AromaticContact CZ-CG 3.29Å; F18-H27 AromaticContact CZ-ND1 3.77Å; Y23-H27 VanDerWaalsContact O-CB 3.27Å; Y23-H27 WeakPolarHBondContact O-CB 3.5Å; Y23-H27 PolarHBondContact O-N 2.69Å; L24-H27 WeakPolarHBondContact O-CA 3.41Å; L24-H27 WeakPolarHBondContact O-CB 3.22Å; L24-H27 PolarHBondContact O-N 3.38Å; R25-H27 VanDerWaalsContact C-N 3.32Å; R25-H27 PolarHBondContact O-N 2.8Å; H27-R29 VanDerWaalsContact C-N 3.32Å; H27-R29 PolarHBondContact O-N 3.07Å; H27-T30 PolarHBondContact O-N 3.25Å; H27-T30 PolarHBondContact O-OG1 3.47Å; H27-R31 VanDerWaalsContact O-CB 3.25Å; H27-R31 WeakPolarHBondContact O-CB 3.42Å; H27-R31 PolarHBondContact O-N 3.48Å; H27-H32 AromaticContact CE1-NE2 3.74Å; H27-H32 AromaticContact NE2-CD2 3.78Å; H27-H32 AromaticContact NE2-NE2 3.17Å; H27-H32 PolarHBondContact NE2-NE2 3.15Å; H27-H32 VanDerWaalsContact NE2-NE2 3.17Å
28	V	77.5	Confident	75.2	Confident	40 Å²	40	84 Å²	84	24%	0.242	42%	0.419	C	S	.	.	H	α-helix	trans	-57.9	-47.7	179.4	175.5	0	0	0	0	110.8	L24 R25 T30 H32 L33	L24-V28 HydrophobicContact CD1-CG2 3.89Å; L24-V28 HydrophobicContact CG-CG2 4.44Å; L24-V28 WeakPolarHBondContact O-CG2 3.24Å; L24-V28 PolarHBondContact O-N 2.87Å; R25-V28 PolarHBondContact O-N 3.04Å; V28-T30 PolarHBondContact O-N 2.72Å; V28-H32 WeakPolarHBondContact O-CB 3.45Å; V28-H32 PolarHBondContact O-N 2.91Å; V28-L33 HydrophobicContact CG1-CD1 4.27Å; V28-L33 HydrophobicContact CG1-CG 4.29Å; V28-L33 PolarHBondContact O-N 3.16Å
29	R	77.4	Confident	74.5	Confident	121 Å²	121	87.2 Å²	87.2	46%	0.457	43%	0.434	S	S	.	.	H	α-helix	trans	-56.7	-50.4	177.3	178.2	169	67.3	132.7	0.9	112.4	R25 H27 G34 I35	R25-R29 WeakPolarHBondContact O-CB 3.42Å; R25-R29 PolarHBondContact O-N 3.18Å; H27-R29 VanDerWaalsContact C-N 3.32Å; H27-R29 PolarHBondContact O-N 3.07Å; R29-G34 PolarHBondContact O-N 3.39Å; R29-G34 VanDerWaalsContact O-N 3.14Å; R29-I35 CarbonylContact C-O 3.43Å; R29-I35 HydrophobicContact CG-CB 4.38Å; R29-I35 HydrophobicContact CG-CG2 4.49Å; R29-I35 WeakPolarHBondContact CG-O 3.5Å; R29-I35 PolarHBondContact O-N 2.96Å
30	T	66.6	Low	73.9	Confident	47 Å²	47	85.8 Å²	85.8	29%	0.288	42%	0.422	S	S	.	.	H	α-helix	trans	-86	-23.2	-172.8	57.7	0	0	0	0	115.2	R26 H27 V28	R26-T30 HydrophobicContact CG-CG2 4.41Å; R26-T30 WeakPolarHBondContact O-CB 3.23Å; R26-T30 WeakPolarHBondContact O-CG2 3.44Å; R26-T30 PolarHBondContact O-N 3.24Å; R26-T30 PolarHBondContact O-OG1 3.42Å; H27-T30 PolarHBondContact O-N 3.25Å; H27-T30 PolarHBondContact O-OG1 3.47Å; V28-T30 PolarHBondContact O-N 2.72Å
31	R	73.9	Confident	73.8	Confident	189 Å²	189	83 Å²	83	71%	0.713	42%	0.421	S	S	*	.	H	α-helix	trans	-109.3	-28.1	-173.4	-60.7	-57.9	-174.2	176.2	-0.1	114.4	H27	H27-R31 VanDerWaalsContact O-CB 3.25Å; H27-R31 WeakPolarHBondContact O-CB 3.42Å; H27-R31 PolarHBondContact O-N 3.48Å
32	H	79.3	Confident	73.8	Confident	72 Å²	72	80 Å²	80	33%	0.333	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-43.8	-178.7	-61.1	-54.6	0	0	0	112	C9 V11 C14 H27 V28	C9-H32 PolarHBondContact SG-NE2 2.87Å; V11-H32 HydrophobicContact CG2-CB 4.25Å; C14-H32 VanDerWaalsContact SG-CE1 3.6Å; C14-H32 PolarHBondContact SG-NE2 3.31Å; H27-H32 AromaticContact CE1-NE2 3.74Å; H27-H32 AromaticContact NE2-CD2 3.78Å; H27-H32 AromaticContact NE2-NE2 3.17Å; H27-H32 PolarHBondContact NE2-NE2 3.15Å; H27-H32 VanDerWaalsContact NE2-NE2 3.17Å; V28-H32 WeakPolarHBondContact O-CB 3.45Å; V28-H32 PolarHBondContact O-N 2.91Å
33	L	72.4	Confident	73.8	Confident	106 Å²	106	79.7 Å²	79.7	56%	0.555	41%	0.409	S	S	*	.	S	Bend	trans	-85.7	-21.5	-178.7	-57.1	178.4	0	0	0	112.8	V28 I35	V28-L33 HydrophobicContact CG1-CD1 4.27Å; V28-L33 HydrophobicContact CG1-CG 4.29Å; V28-L33 PolarHBondContact O-N 3.16Å; L33-I35 HydrophobicContact CB-CB 4.16Å; L33-I35 HydrophobicContact CB-CD1 3.91Å; L33-I35 HydrophobicContact CB-CG1 3.92Å; L33-I35 HydrophobicContact CD1-CD1 4.32Å; L33-I35 PolarHBondContact O-N 2.85Å
34	G	62.8	Low	73.9	Confident	43 Å²	43	77.5 Å²	77.5	44%	0.443	40%	0.404	S	S	.	.			trans	66.6	-10.8	-171.9	0	0	0	0	0	114.3	R29 G36 S37	R29-G34 PolarHBondContact O-N 3.39Å; R29-G34 VanDerWaalsContact O-N 3.14Å; G34-G36 PolarHBondContact O-N 2.89Å; G34-S37 PolarHBondContact O-N 2.85Å
35	I	56.2	Low	74.1	Confident	110 Å²	110	79.9 Å²	79.9	56%	0.564	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	129.2	176.4	-60.8	173	0	0	0	108.7	R29 L33 S37	R29-I35 CarbonylContact C-O 3.43Å; R29-I35 HydrophobicContact CG-CB 4.38Å; R29-I35 HydrophobicContact CG-CG2 4.49Å; R29-I35 WeakPolarHBondContact CG-O 3.5Å; R29-I35 PolarHBondContact O-N 2.96Å; L33-I35 HydrophobicContact CB-CB 4.16Å; L33-I35 HydrophobicContact CB-CD1 3.91Å; L33-I35 HydrophobicContact CB-CG1 3.92Å; L33-I35 HydrophobicContact CD1-CD1 4.32Å; L33-I35 PolarHBondContact O-N 2.85Å; I35-S37 PolarHBondContact O-N 3.12Å
36	G	54.6	Low	74.3	Confident	33 Å²	33	79.4 Å²	79.4	34%	0.34	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	20.9	179.9	0	0	0	0	0	114.1	G34 C38	G34-G36 PolarHBondContact O-N 2.89Å; G36-C38 PolarHBondContact O-N 2.93Å
37	S	56.5	Low	74.7	Confident	57 Å²	57	74.6 Å²	74.6	40%	0.399	43%	0.429	S	S	.	.			trans	-63.6	89.5	153.6	88.9	0	0	0	0	106.5	G34 I35 Q39	G34-S37 PolarHBondContact O-N 2.85Å; I35-S37 PolarHBondContact O-N 3.12Å; S37-Q39 PolarHBondContact O-N 3.1Å
38	C	55.9	Low	75	Confident	96 Å²	96	83.2 Å²	83.2	65%	0.649	47%	0.466	S	S	*	.			trans	-71.5	65.9	172.5	-59.1	0	0	0	0	107.2	G36 V40	G36-C38 PolarHBondContact O-N 2.93Å; C38-V40 PolarHBondContact O-N 3.17Å
39	Q	70.3	Confident	75.6	Confident	108 Å²	108	87.6 Å²	87.6	51%	0.505	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-68.8	116.5	170.4	-65.2	-168.3	0.2	0	0	106.7	S37 T50 F51	S37-Q39 PolarHBondContact O-N 3.1Å; Q39-T50 PolarHBondContact OE1-OG1 2.84Å; Q39-F51 CarbonylContact C-O 3.37Å; Q39-F51 VanDerWaalsContact CA-O 3.23Å; Q39-F51 WeakPolarHBondContact CA-O 3.43Å
40	V	77.7	Confident	75.9	Confident	49 Å²	49	85.2 Å²	85.2	30%	0.297	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	121	178.8	-162.7	0	0	0	0	107.1	C38 F51 R54 L57	C38-V40 PolarHBondContact O-N 3.17Å; V40-F51 PolarHBondContact N-O 3.12Å; V40-F51 PolarHBondContact O-N 3.28Å; V40-R54 HydrophobicContact CG2-CG 4.22Å; V40-L57 HydrophobicContact CB-CD2 3.83Å; V40-L57 HydrophobicContact CG1-CD2 3.37Å
41	A	84.7	Confident	76.6	Confident	57 Å²	57	84.8 Å²	84.8	47%	0.471	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	150	178.3	0	0	0	0	0	111.2	K49 T50 L57	A41-K49 CarbonylContact C-O 3.5Å; A41-T50 HydrophobicContact CB-CG2 4.1Å; A41-L57 WeakPolarHBondContact O-CD2 3.46Å
42	C	86.7	Confident	76.9	Confident	11 Å²	11	78.9 Å²	78.9	7%	0.074	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-72.2	127.3	162.2	-162.7	0	0	0	0	108.6	C47 K49 F51 L57 H60 H65	C42-C47 HydrophobicContact CB-CB 4Å; C42-C47 VanDerWaalsContact O-O 3.05Å; C42-K49 PolarHBondContact N-O 2.88Å; C42-F51 HydrophobicContact CB-CE2 4.43Å; C42-L57 HydrophobicContact CB-CD1 3.88Å; C42-H60 PolarHBondContact SG-NE2 3.04Å; C42-H60 VanDerWaalsContact SG-NE2 3.41Å; C42-H65 PolarHBondContact SG-NE2 3.22Å
43	D	87.5	Confident	77.1	Confident	117 Å²	117	79.5 Å²	79.5	63%	0.626	48%	0.479	S	S	*	.			trans	-97.3	3.4	177.8	55.7	-5.2	0	0	0	111.9	G45 K61	D43-G45 PolarHBondContact O-N 3.02Å; D43-K61 WeakPolarHBondContact OD1-CE 3.45Å; D43-K61 IonicContact OD1-NZ 3.48Å; D43-K61 PolarHBondContact OD1-NZ 3.19Å; D43-K61 IonicContact OD2-NZ 2.97Å; D43-K61 PolarHBondContact OD2-NZ 3.2Å
44	V	87.2	Confident	77.6	Confident	31 Å²	31	84.4 Å²	84.4	19%	0.188	49%	0.49	C	S	.	.	S	Bend	trans	-85.7	106.2	-174.7	-174	0	0	0	0	109.8	N46 C47 K61 H65 L67	V44-N46 PolarHBondContact O-N 3.43Å; V44-C47 WeakPolarHBondContact O-CB 3.47Å; V44-C47 PolarHBondContact O-N 2.68Å; V44-C47 VanDerWaalsContact O-N 3.13Å; V44-K61 HydrophobicContact CG2-CD 4.22Å; V44-K61 HydrophobicContact CG2-CG 4.07Å; V44-H65 HydrophobicContact CG1-CB 3.98Å; V44-L67 HydrophobicContact CB-CD1 4.31Å; V44-L67 HydrophobicContact CG1-CD1 3.93Å; V44-L67 HydrophobicContact CG2-CD1 3.37Å
45	G	86.5	Confident	78.7	Confident	70 Å²	70	87.8 Å²	87.8	72%	0.722	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	-134.6	178.4	0	0	0	0	0	112.1	D43 C47	D43-G45 PolarHBondContact O-N 3.02Å; G45-C47 PolarHBondContact O-N 2.59Å
46	N	88	Confident	80.2	Confident	164 Å²	164	84.1 Å²	84.1	88%	0.877	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	21.3	180	-68.5	-21.6	0	0	0	113.6	V44 K48	V44-N46 PolarHBondContact O-N 3.43Å; N46-K48 PolarHBondContact O-N 3.08Å; N46-K48 VanDerWaalsContact O-N 3.11Å
47	C	87.1	Confident	81.7	Confident	22 Å²	22	83.2 Å²	83.2	15%	0.149	47%	0.465	C	S	.	.			trans	-75.2	100.5	-177.3	-169.8	0	0	0	0	112.1	C42 V44 G45 K49 H60 H65	C42-C47 HydrophobicContact CB-CB 4Å; C42-C47 VanDerWaalsContact O-O 3.05Å; V44-C47 WeakPolarHBondContact O-CB 3.47Å; V44-C47 PolarHBondContact O-N 2.68Å; V44-C47 VanDerWaalsContact O-N 3.13Å; G45-C47 PolarHBondContact O-N 2.59Å; C47-K49 PolarHBondContact O-N 2.9Å; C47-K49 VanDerWaalsContact O-N 3.12Å; C47-H60 PolarHBondContact SG-NE2 3.42Å; C47-H65 WeakPolarHBondContact CB-NE2 3.35Å; C47-H65 PolarHBondContact SG-NE2 2.92Å
48	K	87.2	Confident	83.2	Confident	204 Å²	204	85.5 Å²	85.5	89%	0.887	47%	0.466	S	S	*	.			trans	-81.1	22.4	179.8	-57.6	-172.6	179.1	-173.3	0	114.7	N46	N46-K48 PolarHBondContact O-N 3.08Å; N46-K48 VanDerWaalsContact O-N 3.11Å
49	K	88.8	Confident	84.7	Confident	132 Å²	132	82.5 Å²	82.5	57%	0.574	44%	0.444	S	S	*	.			trans	-84.6	139.4	-176.9	-70	-72.1	-175.1	176.1	0	111.1	A41 C42 C47 F51	A41-K49 CarbonylContact C-O 3.5Å; C42-K49 PolarHBondContact N-O 2.88Å; C47-K49 PolarHBondContact O-N 2.9Å; C47-K49 VanDerWaalsContact O-N 3.12Å; K49-F51 HydrophobicContact CB-CE2 3.69Å; K49-F51 HydrophobicContact CB-CZ 3.79Å
50	T	83.1	Confident	85.5	Confident	71 Å²	71	78.4 Å²	78.4	44%	0.436	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	150.2	175.2	64.8	0	0	0	0	111	Q39 A41	Q39-T50 PolarHBondContact OE1-OG1 2.84Å; A41-T50 HydrophobicContact CB-CG2 4.1Å
51	F	82.3	Confident	86.1	Confident	38 Å²	38	78.1 Å²	78.1	17%	0.167	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.2	-172.8	-60.6	-89.1	0	0	0	111.5	Q39 V40 C42 K49 N53 A56 L57 H60	Q39-F51 CarbonylContact C-O 3.37Å; Q39-F51 VanDerWaalsContact CA-O 3.23Å; Q39-F51 WeakPolarHBondContact CA-O 3.43Å; V40-F51 PolarHBondContact N-O 3.12Å; V40-F51 PolarHBondContact O-N 3.28Å; C42-F51 HydrophobicContact CB-CE2 4.43Å; K49-F51 HydrophobicContact CB-CE2 3.69Å; K49-F51 HydrophobicContact CB-CZ 3.79Å; F51-N53 PolarHBondContact O-N 2.86Å; F51-A56 HydrophobicContact CB-CB 4.09Å; F51-A56 HydrophobicContact CD1-CB 3.94Å; F51-A56 HydrophobicContact CG-CB 4.37Å; F51-L57 HydrophobicContact CB-CB 4.03Å; F51-L57 HydrophobicContact CD2-CB 3.82Å; F51-L57 HydrophobicContact CD2-CD1 3.55Å; F51-L57 HydrophobicContact CD2-CG 4.28Å; F51-L57 HydrophobicContact CE2-CD1 3.77Å; F51-L57 HydrophobicContact CG-CB 4.03Å; F51-H60 HydrophobicContact CD1-CB 4.44Å; F51-H60 HydrophobicContact CE1-CB 3.58Å; F51-H60 AromaticContact CE1-CG 3.92Å; F51-H60 HydrophobicContact CE2-CB 3.88Å; F51-H60 AromaticContact CE2-CD2 3.37Å; F51-H60 WeakPolarHBondContact CE2-CD2 3.38Å; F51-H60 AromaticContact CE2-CG 3.61Å; F51-H60 AromaticContact CE2-NE2 3.98Å; F51-H60 HydrophobicContact CZ-CB 3.27Å; F51-H60 AromaticContact CZ-CD2 3.38Å; F51-H60 WeakPolarHBondContact CZ-CD2 3.39Å; F51-H60 AromaticContact CZ-CG 3.1Å; F51-H60 AromaticContact CZ-ND1 3.57Å; F51-H60 AromaticContact CZ-NE2 3.93Å
52	G	80.9	Confident	86.2	Confident	65 Å²	65	75.4 Å²	75.4	67%	0.67	40%	0.397	S	S	*	.	S	Bend	trans	-68.5	-2	-178.9	0	0	0	0	0	115.9
53	N	82.2	Confident	86.3	Confident	86 Å²	86	78.2 Å²	78.2	46%	0.46	41%	0.411	S	S	.	.	S	Bend	trans	-159.8	160.8	170.5	59.9	67.2	0	0	0	111.7	F51 K55 A56 L57	F51-N53 PolarHBondContact O-N 2.86Å; N53-K55 VanDerWaalsContact C-N 3.31Å; N53-K55 PolarHBondContact O-N 3.2Å; N53-K55 PolarHBondContact OD1-N 3.49Å; N53-A56 PolarHBondContact O-N 3.44Å; N53-A56 WeakPolarHBondContact OD1-CB 3.33Å; N53-A56 PolarHBondContact OD1-N 3.29Å; N53-L57 PolarHBondContact O-N 3.29Å
54	R	84.1	Confident	86.4	Confident	209 Å²	209	77.1 Å²	77.1	79%	0.789	41%	0.408	S	S	*	.	H	α-helix	trans	-60.4	-34.9	-179.8	-71.3	-176	174.2	-179.5	-2.1	113.6	V40 L57 Y58	V40-R54 HydrophobicContact CG2-CG 4.22Å; R54-L57 PolarHBondContact O-N 3.33Å; R54-Y58 WeakPolarHBondContact O-CB 3.33Å; R54-Y58 PolarHBondContact O-N 3.04Å
55	K	85.5	Confident	86.5	Confident	114 Å²	114	78.1 Å²	78.1	50%	0.496	41%	0.411	S	S	.	.	H	α-helix	trans	-64.2	-43.6	179	-176.3	178.5	-175	-57.6	0	111.6	N53 Y58 D59	N53-K55 VanDerWaalsContact C-N 3.31Å; N53-K55 PolarHBondContact O-N 3.2Å; N53-K55 PolarHBondContact OD1-N 3.49Å; K55-Y58 PolarHBondContact O-N 3.25Å; K55-D59 IonicContact NZ-OD1 3.63Å; K55-D59 IonicContact NZ-OD2 3.95Å; K55-D59 PolarHBondContact NZ-OD2 3.48Å; K55-D59 WeakPolarHBondContact O-CB 3.09Å; K55-D59 VanDerWaalsContact O-CG 3.31Å; K55-D59 PolarHBondContact O-N 3.03Å
56	A	86.4	Confident	86.4	Confident	33 Å²	33	84.1 Å²	84.1	27%	0.273	41%	0.411	S	S	.	.	H	α-helix	trans	-66.9	-38.9	178.1	0	0	0	0	0	111.9	F51 N53 H60	F51-A56 HydrophobicContact CB-CB 4.09Å; F51-A56 HydrophobicContact CD1-CB 3.94Å; F51-A56 HydrophobicContact CG-CB 4.37Å; N53-A56 PolarHBondContact O-N 3.44Å; N53-A56 WeakPolarHBondContact OD1-CB 3.33Å; N53-A56 PolarHBondContact OD1-N 3.29Å; A56-H60 WeakPolarHBondContact O-CB 3.36Å; A56-H60 PolarHBondContact O-N 3.36Å
57	L	86.3	Confident	85.8	Confident	13 Å²	13	80.9 Å²	80.9	7%	0.068	39%	0.393	C	S	.	.	H	α-helix	trans	-62.3	-45.5	171.6	173.4	61.6	0	0	0	111.5	V40 A41 C42 F51 N53 R54 H60 K61	V40-L57 HydrophobicContact CB-CD2 3.83Å; V40-L57 HydrophobicContact CG1-CD2 3.37Å; A41-L57 WeakPolarHBondContact O-CD2 3.46Å; C42-L57 HydrophobicContact CB-CD1 3.88Å; F51-L57 HydrophobicContact CB-CB 4.03Å; F51-L57 HydrophobicContact CD2-CB 3.82Å; F51-L57 HydrophobicContact CD2-CD1 3.55Å; F51-L57 HydrophobicContact CD2-CG 4.28Å; F51-L57 HydrophobicContact CE2-CD1 3.77Å; F51-L57 HydrophobicContact CG-CB 4.03Å; N53-L57 PolarHBondContact O-N 3.29Å; R54-L57 PolarHBondContact O-N 3.33Å; L57-H60 WeakPolarHBondContact O-CB 3.27Å; L57-H60 PolarHBondContact O-N 2.86Å; L57-K61 HydrophobicContact CD1-CD 4.38Å; L57-K61 HydrophobicContact CD1-CG 4.12Å; L57-K61 HydrophobicContact CG-CD 4.37Å; L57-K61 HydrophobicContact CG-CG 4.47Å; L57-K61 WeakPolarHBondContact O-CG 3.44Å; L57-K61 PolarHBondContact O-N 3.42Å
58	Y	87.7	Confident	85	Confident	106 Å²	106	84.1 Å²	84.1	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-59.4	-51	177.1	176.7	-95.9	0	0	0	111.6	R54 K55 H60 K61 V62 L68 G81	R54-Y58 WeakPolarHBondContact O-CB 3.33Å; R54-Y58 PolarHBondContact O-N 3.04Å; K55-Y58 PolarHBondContact O-N 3.25Å; Y58-H60 PolarHBondContact O-N 3.25Å; Y58-K61 PolarHBondContact O-N 3.23Å; Y58-K61 VanDerWaalsContact O-N 3.16Å; Y58-V62 HydrophobicContact CD1-CG2 4.18Å; Y58-V62 HydrophobicContact CE1-CG2 3.85Å; Y58-V62 HydrophobicContact CE2-CG2 4.19Å; Y58-V62 HydrophobicContact CG-CG2 4.49Å; Y58-V62 VanDerWaalsContact O-CG2 3.25Å; Y58-V62 WeakPolarHBondContact O-CG2 3.15Å; Y58-V62 PolarHBondContact O-N 3.4Å; Y58-L68 HydrophobicContact CD2-CD1 4.19Å; Y58-L68 HydrophobicContact CE2-CD1 3.46Å; Y58-L68 VanDerWaalsContact CE2-CD1 3.46Å; Y58-G81 WeakPolarHBondContact CE1-O 3.42Å
59	D	87.7	Confident	84.4	Confident	33 Å²	33	77.5 Å²	77.5	18%	0.176	40%	0.398	C	S	.	.	H	α-helix	trans	-58.1	-38.3	176.7	-71	-28.5	0	0	0	110.7	K55 L63 G81	K55-D59 IonicContact NZ-OD1 3.63Å; K55-D59 IonicContact NZ-OD2 3.95Å; K55-D59 PolarHBondContact NZ-OD2 3.48Å; K55-D59 WeakPolarHBondContact O-CB 3.09Å; K55-D59 VanDerWaalsContact O-CG 3.31Å; K55-D59 PolarHBondContact O-N 3.03Å; D59-L63 VanDerWaalsContact O-CB 3.3Å; D59-L63 WeakPolarHBondContact O-CB 3.45Å; D59-L63 WeakPolarHBondContact O-CG 3.45Å; D59-L63 PolarHBondContact O-N 3.39Å; D59-G81 VanDerWaalsContact OD1-CA 3.29Å; D59-G81 WeakPolarHBondContact OD1-CA 3.37Å
60	H	88.4	Confident	84.2	Confident	21 Å²	21	72.4 Å²	72.4	10%	0.097	38%	0.381	C	S	.	.	H	α-helix	trans	-64.2	-49.6	173.8	163.5	73	0	0	0	113	C42 C47 F51 A56 L57 Y58 V62 L63 V64 H65	C42-H60 PolarHBondContact SG-NE2 3.04Å; C42-H60 VanDerWaalsContact SG-NE2 3.41Å; C47-H60 PolarHBondContact SG-NE2 3.42Å; F51-H60 HydrophobicContact CD1-CB 4.44Å; F51-H60 HydrophobicContact CE1-CB 3.58Å; F51-H60 AromaticContact CE1-CG 3.92Å; F51-H60 HydrophobicContact CE2-CB 3.88Å; F51-H60 AromaticContact CE2-CD2 3.37Å; F51-H60 WeakPolarHBondContact CE2-CD2 3.38Å; F51-H60 AromaticContact CE2-CG 3.61Å; F51-H60 AromaticContact CE2-NE2 3.98Å; F51-H60 HydrophobicContact CZ-CB 3.27Å; F51-H60 AromaticContact CZ-CD2 3.38Å; F51-H60 WeakPolarHBondContact CZ-CD2 3.39Å; F51-H60 AromaticContact CZ-CG 3.1Å; F51-H60 AromaticContact CZ-ND1 3.57Å; F51-H60 AromaticContact CZ-NE2 3.93Å; A56-H60 WeakPolarHBondContact O-CB 3.36Å; A56-H60 PolarHBondContact O-N 3.36Å; L57-H60 WeakPolarHBondContact O-CB 3.27Å; L57-H60 PolarHBondContact O-N 2.86Å; Y58-H60 PolarHBondContact O-N 3.25Å; H60-V62 VanDerWaalsContact C-N 3.27Å; H60-V62 PolarHBondContact O-N 2.91Å; H60-L63 PolarHBondContact O-N 3.44Å; H60-V64 WeakPolarHBondContact ND1-CG2 3.32Å; H60-V64 VanDerWaalsContact O-CB 3.31Å; H60-V64 WeakPolarHBondContact O-CB 3.49Å; H60-V64 PolarHBondContact O-N 3.17Å; H60-H65 AromaticContact CE1-NE2 3.67Å; H60-H65 AromaticContact NE2-CD2 3.61Å; H60-H65 AromaticContact NE2-NE2 3.21Å; H60-H65 PolarHBondContact NE2-NE2 3.37Å
61	K	88.9	Confident	84.3	Confident	43 Å²	43	74.1 Å²	74.1	19%	0.187	38%	0.382	C	S	.	.	H	α-helix	trans	-57.9	-42.4	178.3	-73.2	-177	175.5	-166.8	0	111.4	D43 V44 L57 Y58 H65 R66	D43-K61 WeakPolarHBondContact OD1-CE 3.45Å; D43-K61 IonicContact OD1-NZ 3.48Å; D43-K61 PolarHBondContact OD1-NZ 3.19Å; D43-K61 IonicContact OD2-NZ 2.97Å; D43-K61 PolarHBondContact OD2-NZ 3.2Å; V44-K61 HydrophobicContact CG2-CD 4.22Å; V44-K61 HydrophobicContact CG2-CG 4.07Å; L57-K61 HydrophobicContact CD1-CD 4.38Å; L57-K61 HydrophobicContact CD1-CG 4.12Å; L57-K61 HydrophobicContact CG-CD 4.37Å; L57-K61 HydrophobicContact CG-CG 4.47Å; L57-K61 WeakPolarHBondContact O-CG 3.44Å; L57-K61 PolarHBondContact O-N 3.42Å; Y58-K61 PolarHBondContact O-N 3.23Å; Y58-K61 VanDerWaalsContact O-N 3.16Å; K61-H65 CarbonylContact O-C 3.59Å; K61-H65 WeakPolarHBondContact O-CA 3.27Å; K61-H65 VanDerWaalsContact O-CB 3.31Å; K61-H65 WeakPolarHBondContact O-CB 3.44Å; K61-H65 PolarHBondContact O-N 3.21Å; K61-H65 VanDerWaalsContact O-N 3.1Å; K61-R66 PolarHBondContact O-N 3.14Å; K61-R66 VanDerWaalsContact O-N 3.1Å
62	V	87.8	Confident	84.6	Confident	1 Å²	1	78 Å²	78	1%	0.006	40%	0.396	C	S	.	.	H	α-helix	trans	-65.5	-48.3	178.1	168.5	0	0	0	0	111.6	Y58 H60 R66 L68 A70	Y58-V62 HydrophobicContact CD1-CG2 4.18Å; Y58-V62 HydrophobicContact CE1-CG2 3.85Å; Y58-V62 HydrophobicContact CE2-CG2 4.19Å; Y58-V62 HydrophobicContact CG-CG2 4.49Å; Y58-V62 VanDerWaalsContact O-CG2 3.25Å; Y58-V62 WeakPolarHBondContact O-CG2 3.15Å; Y58-V62 PolarHBondContact O-N 3.4Å; H60-V62 VanDerWaalsContact C-N 3.27Å; H60-V62 PolarHBondContact O-N 2.91Å; V62-R66 VanDerWaalsContact O-CA 3.23Å; V62-R66 WeakPolarHBondContact O-CA 3.44Å; V62-R66 PolarHBondContact O-N 2.79Å; V62-L68 WeakPolarHBondContact CG1-O 3.46Å; V62-L68 HydrophobicContact CG2-CB 3.91Å; V62-L68 WeakPolarHBondContact CG2-O 3.07Å; V62-A70 HydrophobicContact CG1-CB 3.65Å
63	L	89.3	Confident	85.1	Confident	70 Å²	70	75 Å²	75	37%	0.366	36%	0.364	S	S	.	.	H	α-helix	trans	-85.6	-31	-170.4	-65.4	174.4	0	0	0	113.9	D59 H60 A70 E79	D59-L63 VanDerWaalsContact O-CB 3.3Å; D59-L63 WeakPolarHBondContact O-CB 3.45Å; D59-L63 WeakPolarHBondContact O-CG 3.45Å; D59-L63 PolarHBondContact O-N 3.39Å; H60-L63 PolarHBondContact O-N 3.44Å; L63-A70 HydrophobicContact CD2-CB 4.14Å; L63-E79 HydrophobicContact CD2-CB 3.94Å
64	V	89.3	Confident	85.4	Confident	93 Å²	93	78.7 Å²	78.7	56%	0.564	38%	0.379	S	S	*	.	H	α-helix	trans	-98.8	-42	-176.7	-178.6	0	0	0	0	111.3	H60	H60-V64 WeakPolarHBondContact ND1-CG2 3.32Å; H60-V64 VanDerWaalsContact O-CB 3.31Å; H60-V64 WeakPolarHBondContact O-CB 3.49Å; H60-V64 PolarHBondContact O-N 3.17Å
65	H	89.9	Confident	85.6	Confident	53 Å²	53	74.8 Å²	74.8	25%	0.245	37%	0.368	C	S	.	.	H	α-helix	trans	-100	-4	-177.8	-58.6	-63.1	0	0	0	113.6	C42 V44 C47 H60 K61 L67	C42-H65 PolarHBondContact SG-NE2 3.22Å; V44-H65 HydrophobicContact CG1-CB 3.98Å; C47-H65 WeakPolarHBondContact CB-NE2 3.35Å; C47-H65 PolarHBondContact SG-NE2 2.92Å; H60-H65 AromaticContact CE1-NE2 3.67Å; H60-H65 AromaticContact NE2-CD2 3.61Å; H60-H65 AromaticContact NE2-NE2 3.21Å; H60-H65 PolarHBondContact NE2-NE2 3.37Å; K61-H65 CarbonylContact O-C 3.59Å; K61-H65 WeakPolarHBondContact O-CA 3.27Å; K61-H65 VanDerWaalsContact O-CB 3.31Å; K61-H65 WeakPolarHBondContact O-CB 3.44Å; K61-H65 PolarHBondContact O-N 3.21Å; K61-H65 VanDerWaalsContact O-N 3.1Å; H65-L67 HydrophobicContact CB-CD1 4.13Å; H65-L67 HydrophobicContact CB-CD2 4.42Å; H65-L67 HydrophobicContact CB-CG 3.76Å; H65-L67 PolarHBondContact O-N 3.09Å
66	R	84.1	Confident	85.8	Confident	195 Å²	195	71.8 Å²	71.8	74%	0.736	36%	0.36	S	S	*	.			trans	51.9	24.6	177.8	-61.9	-176.2	177.6	171.9	1.2	114.7	K61 V62	K61-R66 PolarHBondContact O-N 3.14Å; K61-R66 VanDerWaalsContact O-N 3.1Å; V62-R66 VanDerWaalsContact O-CA 3.23Å; V62-R66 WeakPolarHBondContact O-CA 3.44Å; V62-R66 PolarHBondContact O-N 2.79Å
67	L	74.2	Confident	85.9	Confident	96 Å²	96	73.5 Å²	73.5	50%	0.503	37%	0.37	S	S	.	.			trans	-72.2	-34	-172.3	-64.5	-179	0	0	0	113.7	V44 H65	V44-L67 HydrophobicContact CB-CD1 4.31Å; V44-L67 HydrophobicContact CG1-CD1 3.93Å; V44-L67 HydrophobicContact CG2-CD1 3.37Å; H65-L67 HydrophobicContact CB-CD1 4.13Å; H65-L67 HydrophobicContact CB-CD2 4.42Å; H65-L67 HydrophobicContact CB-CG 3.76Å; H65-L67 PolarHBondContact O-N 3.09Å
68	L	70.8	Confident	86.1	Confident	91 Å²	91	79 Å²	79	48%	0.476	39%	0.393	S	S	.	.	S	Bend	trans	-127.9	113.3	-179.5	-63.7	173.8	0	0	0	106.8	Y58 V62 A70	Y58-L68 HydrophobicContact CD2-CD1 4.19Å; Y58-L68 HydrophobicContact CE2-CD1 3.46Å; Y58-L68 VanDerWaalsContact CE2-CD1 3.46Å; V62-L68 WeakPolarHBondContact CG1-O 3.46Å; V62-L68 HydrophobicContact CG2-CB 3.91Å; V62-L68 WeakPolarHBondContact CG2-O 3.07Å; L68-A70 PolarHBondContact O-N 3.4Å; L68-A70 VanDerWaalsContact O-N 3.15Å
69	G	75	Confident	86.2	Confident	64 Å²	64	76.9 Å²	76.9	66%	0.66	39%	0.387	S	S	*	.			trans	-43.2	117.4	-165.5	0	0	0	0	0	114.3
70	A	83.5	Confident	86.2	Confident	25 Å²	25	77.1 Å²	77.1	21%	0.207	39%	0.387	C	S	.	.			trans	-61.2	144	177.7	0	0	0	0	0	110.9	V62 L63 L68 R72 E79	V62-A70 HydrophobicContact CG1-CB 3.65Å; L63-A70 HydrophobicContact CD2-CB 4.14Å; L68-A70 PolarHBondContact O-N 3.4Å; L68-A70 VanDerWaalsContact O-N 3.15Å; A70-R72 PolarHBondContact O-N 3.43Å; A70-E79 HydrophobicContact CB-CB 3.86Å; A70-E79 HydrophobicContact CB-CG 4.2Å
71	K	85.9	Confident	86.1	Confident	107 Å²	107	76.4 Å²	76.4	47%	0.465	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	109.8	177.4	-58.4	-55.8	-176.1	-175.3	0	108.4	F80 L86	K71-F80 PolarHBondContact N-O 3.07Å; K71-F80 PolarHBondContact O-N 3.46Å; K71-L86 HydrophobicContact CB-CB 4.13Å; K71-L86 HydrophobicContact CB-CD2 3.73Å
72	R	89.3	Confident	86	Confident	121 Å²	121	75.5 Å²	75.5	46%	0.457	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136	-174.3	-176	177.4	-70.2	-138.1	2.5	111.7	A70 K78 E79	A70-R72 PolarHBondContact O-N 3.43Å; R72-K78 WeakPolarHBondContact CA-O 3.47Å; R72-E79 HydrophobicContact CB-CG 4.45Å; R72-E79 HydrophobicContact CG-CG 4.48Å; R72-E79 IonicContact CZ-OE1 3.01Å; R72-E79 IonicContact NE-OE1 2.59Å; R72-E79 PolarHBondContact NE-OE1 3.29Å; R72-E79 IonicContact NH2-OE1 2.6Å; R72-E79 PolarHBondContact NH2-OE1 2.78Å
73	C	90.5	Very high	86	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.007	41%	0.406	C	S	.	.			trans	-78.3	120.4	168.6	-176.1	0	0	0	0	110.5	K75 S77 K78 F80 L86 H89 H93	C73-K75 PolarHBondContact O-N 2.97Å; C73-S77 WeakPolarHBondContact O-CA 3.5Å; C73-S77 PolarHBondContact O-N 2.77Å; C73-K78 PolarHBondContact N-O 3.48Å; C73-F80 HydrophobicContact CB-CE2 4.19Å; C73-L86 HydrophobicContact CB-CD1 3.67Å; C73-H89 VanDerWaalsContact SG-CD2 3.54Å; C73-H89 PolarHBondContact SG-NE2 3.48Å; C73-H93 PolarHBondContact SG-NE2 2.93Å; C73-H93 VanDerWaalsContact SG-NE2 3.43Å
74	Q	89.6	Confident	86	Confident	163 Å²	163	82.2 Å²	82.2	76%	0.762	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-21.1	-178.6	-62.7	-62.7	-10.3	0	0	113.7
75	K	88	Confident	86	Confident	128 Å²	128	78.5 Å²	78.5	56%	0.557	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-27.5	-178.9	-70.2	-177	171.8	173.5	0	114.4	C73 H93 D94	C73-K75 PolarHBondContact O-N 2.97Å; K75-H93 HydrophobicContact CD-CB 3.74Å; K75-D94 IonicContact NZ-OD1 3.66Å; K75-D94 PolarHBondContact NZ-OD1 3.29Å; K75-D94 IonicContact NZ-OD2 2.69Å; K75-D94 PolarHBondContact NZ-OD2 2.85Å
76	C	90.1	Very high	86	Confident	50 Å²	50	76.7 Å²	76.7	34%	0.338	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	9.1	-175.7	69.9	0	0	0	0	114.2	K78 H89 H93	C76-K78 PolarHBondContact O-N 3.37Å; C76-H89 PolarHBondContact SG-NE2 2.79Å; C76-H93 PolarHBondContact SG-NE2 3.33Å
77	S	87.5	Confident	86.3	Confident	69 Å²	69	71.1 Å²	71.1	48%	0.483	38%	0.377	S	S	.	.			trans	57.9	10.4	179.1	-60.3	0	0	0	0	116.2	C73	C73-S77 WeakPolarHBondContact O-CA 3.5Å; C73-S77 PolarHBondContact O-N 2.77Å
78	K	90.2	Very high	86.9	Confident	128 Å²	128	74.6 Å²	74.6	56%	0.557	38%	0.383	S	S	*	.			trans	-65.6	137.7	174	-75	-174.6	-179.8	-179.2	0	111	R72 C73 C76 F80	R72-K78 WeakPolarHBondContact CA-O 3.47Å; C73-K78 PolarHBondContact N-O 3.48Å; C76-K78 PolarHBondContact O-N 3.37Å; K78-F80 HydrophobicContact CB-CE2 3.72Å; K78-F80 HydrophobicContact CB-CZ 3.92Å; K78-F80 WeakPolarHBondContact O-CE2 3.49Å
79	E	90	Very high	87.7	Confident	62 Å²	62	71.2 Å²	71.2	29%	0.29	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.6	-178.1	-67.7	-172.8	156.3	0	0	111.8	L63 A70 R72	L63-E79 HydrophobicContact CD2-CB 3.94Å; A70-E79 HydrophobicContact CB-CB 3.86Å; A70-E79 HydrophobicContact CB-CG 4.2Å; R72-E79 HydrophobicContact CB-CG 4.45Å; R72-E79 HydrophobicContact CG-CG 4.48Å; R72-E79 IonicContact CZ-OE1 3.01Å; R72-E79 IonicContact NE-OE1 2.59Å; R72-E79 PolarHBondContact NE-OE1 3.29Å; R72-E79 IonicContact NH2-OE1 2.6Å; R72-E79 PolarHBondContact NH2-OE1 2.78Å
80	F	87.8	Confident	88.3	Confident	38 Å²	38	71.5 Å²	71.5	17%	0.167	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.6	-177.5	-61.4	-88.9	0	0	0	110.3	K71 C73 K78 S82 A85 L86 H89	K71-F80 PolarHBondContact N-O 3.07Å; K71-F80 PolarHBondContact O-N 3.46Å; C73-F80 HydrophobicContact CB-CE2 4.19Å; K78-F80 HydrophobicContact CB-CE2 3.72Å; K78-F80 HydrophobicContact CB-CZ 3.92Å; K78-F80 WeakPolarHBondContact O-CE2 3.49Å; F80-S82 PolarHBondContact O-N 3.35Å; F80-A85 HydrophobicContact CB-CB 4.17Å; F80-A85 HydrophobicContact CD1-CB 3.98Å; F80-A85 HydrophobicContact CG-CB 4.43Å; F80-L86 HydrophobicContact CB-CB 4.12Å; F80-L86 HydrophobicContact CD2-CB 4.04Å; F80-L86 HydrophobicContact CD2-CD1 3.74Å; F80-L86 HydrophobicContact CE2-CD1 4.05Å; F80-L86 HydrophobicContact CG-CB 4.19Å; F80-H89 HydrophobicContact CD1-CB 4.42Å; F80-H89 HydrophobicContact CE1-CB 3.6Å; F80-H89 AromaticContact CE1-CG 3.89Å; F80-H89 HydrophobicContact CE2-CB 3.85Å; F80-H89 AromaticContact CE2-CD2 3.25Å; F80-H89 WeakPolarHBondContact CE2-CD2 2.92Å; F80-H89 AromaticContact CE2-CG 3.57Å; F80-H89 HydrophobicContact CZ-CB 3.29Å; F80-H89 AromaticContact CZ-CD2 3.27Å; F80-H89 WeakPolarHBondContact CZ-CD2 3.33Å; F80-H89 AromaticContact CZ-CG 3.08Å; F80-H89 AromaticContact CZ-ND1 3.72Å; F80-H89 AromaticContact CZ-NE2 3.96Å
81	G	87	Confident	88.5	Confident	7 Å²	7	77.1 Å²	77.1	7%	0.072	37%	0.365	C	S	.	.	S	Bend	trans	-70.1	-15.1	177.4	0	0	0	0	0	114.1	Y58 D59	Y58-G81 WeakPolarHBondContact CE1-O 3.42Å; D59-G81 VanDerWaalsContact OD1-CA 3.29Å; D59-G81 WeakPolarHBondContact OD1-CA 3.37Å
82	S	86.4	Confident	88.4	Confident	23 Å²	23	74.9 Å²	74.9	16%	0.161	36%	0.36	C	S	.	.	S	Bend	trans	-142.6	150	179.7	54	0	0	0	0	112.4	F80 N84 A85 L86	F80-S82 PolarHBondContact O-N 3.35Å; S82-N84 VanDerWaalsContact C-N 3.33Å; S82-N84 PolarHBondContact O-N 2.8Å; S82-A85 WeakPolarHBondContact O-CB 3.16Å; S82-A85 PolarHBondContact O-N 3.17Å; S82-A85 VanDerWaalsContact O-N 3.1Å; S82-A85 WeakPolarHBondContact OG-CB 3.27Å; S82-L86 PolarHBondContact O-N 3.23Å; S82-L86 VanDerWaalsContact O-N 3.1Å
83	N	88.1	Confident	88.3	Confident	84 Å²	84	71.6 Å²	71.6	45%	0.449	35%	0.35	S	S	.	.	H	α-helix	trans	-60.5	-41.4	179.2	-165.8	39	0	0	0	112.1	A85 L86 L87	N83-A85 PolarHBondContact O-N 2.87Å; N83-L86 WeakPolarHBondContact O-CB 3.25Å; N83-L86 PolarHBondContact O-N 3.45Å; N83-L86 VanDerWaalsContact O-N 3.11Å; N83-L87 WeakPolarHBondContact O-CG 3.37Å; N83-L87 PolarHBondContact O-N 3.44Å
84	N	89.1	Confident	88	Confident	128 Å²	128	76.5 Å²	76.5	68%	0.684	38%	0.376	S	S	*	.	H	α-helix	trans	-60.4	-34.4	176.6	-68.9	-12.4	0	0	0	112.5	S82 R88	S82-N84 VanDerWaalsContact C-N 3.33Å; S82-N84 PolarHBondContact O-N 2.8Å; N84-R88 VanDerWaalsContact O-CB 3.29Å; N84-R88 WeakPolarHBondContact O-CB 3.44Å; N84-R88 PolarHBondContact O-N 2.95Å
85	A	88.6	Confident	87.8	Confident	16 Å²	16	69.9 Å²	69.9	13%	0.132	35%	0.352	C	S	.	.	H	α-helix	trans	-71.8	-40.4	175.7	0	0	0	0	0	111.7	F80 S82 N83 H89	F80-A85 HydrophobicContact CB-CB 4.17Å; F80-A85 HydrophobicContact CD1-CB 3.98Å; F80-A85 HydrophobicContact CG-CB 4.43Å; S82-A85 WeakPolarHBondContact O-CB 3.16Å; S82-A85 PolarHBondContact O-N 3.17Å; S82-A85 VanDerWaalsContact O-N 3.1Å; S82-A85 WeakPolarHBondContact OG-CB 3.27Å; N83-A85 PolarHBondContact O-N 2.87Å; A85-H89 WeakPolarHBondContact O-CB 3.28Å; A85-H89 PolarHBondContact O-N 2.95Å
86	L	90.3	Very high	87.8	Confident	15 Å²	15	69.3 Å²	69.3	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-50.9	173	172.5	61.1	0	0	0	111.5	K71 C73 F80 S82 N83 R88 H89 Q90	K71-L86 HydrophobicContact CB-CB 4.13Å; K71-L86 HydrophobicContact CB-CD2 3.73Å; C73-L86 HydrophobicContact CB-CD1 3.67Å; F80-L86 HydrophobicContact CB-CB 4.12Å; F80-L86 HydrophobicContact CD2-CB 4.04Å; F80-L86 HydrophobicContact CD2-CD1 3.74Å; F80-L86 HydrophobicContact CE2-CD1 4.05Å; F80-L86 HydrophobicContact CG-CB 4.19Å; S82-L86 PolarHBondContact O-N 3.23Å; S82-L86 VanDerWaalsContact O-N 3.1Å; N83-L86 WeakPolarHBondContact O-CB 3.25Å; N83-L86 PolarHBondContact O-N 3.45Å; N83-L86 VanDerWaalsContact O-N 3.11Å; L86-R88 VanDerWaalsContact C-N 3.31Å; L86-R88 PolarHBondContact O-N 2.98Å; L86-H89 CarbonylContact O-C 3.36Å; L86-H89 WeakPolarHBondContact O-CA 3.46Å; L86-H89 WeakPolarHBondContact O-CB 3.44Å; L86-H89 PolarHBondContact O-N 2.9Å; L86-Q90 HydrophobicContact CD1-CG 4.16Å; L86-Q90 WeakPolarHBondContact O-CG 3.31Å; L86-Q90 PolarHBondContact O-N 2.94Å
87	L	89.6	Confident	87.7	Confident	78 Å²	78	73.8 Å²	73.8	41%	0.408	36%	0.357	S	S	.	.	H	α-helix	trans	-58	-44.2	178.8	-72.3	172.4	0	0	0	111.6	N83 H89 Q90 R91	N83-L87 WeakPolarHBondContact O-CG 3.37Å; N83-L87 PolarHBondContact O-N 3.44Å; L87-H89 VanDerWaalsContact C-N 3.29Å; L87-H89 PolarHBondContact O-N 3.42Å; L87-Q90 PolarHBondContact O-N 3.14Å; L87-R91 PolarHBondContact O-N 3.06Å
88	R	86.9	Confident	87.7	Confident	168 Å²	168	70.8 Å²	70.8	63%	0.634	34%	0.335	S	S	*	.	H	α-helix	trans	-62.5	-38.4	174.6	-177.7	177.2	64	-169.7	-0.3	111.8	N84 L86 R91	N84-R88 VanDerWaalsContact O-CB 3.29Å; N84-R88 WeakPolarHBondContact O-CB 3.44Å; N84-R88 PolarHBondContact O-N 2.95Å; L86-R88 VanDerWaalsContact C-N 3.31Å; L86-R88 PolarHBondContact O-N 2.98Å; R88-R91 WeakPolarHBondContact O-CB 3.43Å; R88-R91 PolarHBondContact O-N 3.37Å
89	H	88.5	Confident	87.4	Confident	21 Å²	21	71.1 Å²	71.1	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-68	-37.7	175.4	167	62.5	0	0	0	112.4	C73 C76 F80 A85 L86 L87 R91 T92 H93	C73-H89 VanDerWaalsContact SG-CD2 3.54Å; C73-H89 PolarHBondContact SG-NE2 3.48Å; C76-H89 PolarHBondContact SG-NE2 2.79Å; F80-H89 HydrophobicContact CD1-CB 4.42Å; F80-H89 HydrophobicContact CE1-CB 3.6Å; F80-H89 AromaticContact CE1-CG 3.89Å; F80-H89 HydrophobicContact CE2-CB 3.85Å; F80-H89 AromaticContact CE2-CD2 3.25Å; F80-H89 WeakPolarHBondContact CE2-CD2 2.92Å; F80-H89 AromaticContact CE2-CG 3.57Å; F80-H89 HydrophobicContact CZ-CB 3.29Å; F80-H89 AromaticContact CZ-CD2 3.27Å; F80-H89 WeakPolarHBondContact CZ-CD2 3.33Å; F80-H89 AromaticContact CZ-CG 3.08Å; F80-H89 AromaticContact CZ-ND1 3.72Å; F80-H89 AromaticContact CZ-NE2 3.96Å; A85-H89 WeakPolarHBondContact O-CB 3.28Å; A85-H89 PolarHBondContact O-N 2.95Å; L86-H89 CarbonylContact O-C 3.36Å; L86-H89 WeakPolarHBondContact O-CA 3.46Å; L86-H89 WeakPolarHBondContact O-CB 3.44Å; L86-H89 PolarHBondContact O-N 2.9Å; L87-H89 VanDerWaalsContact C-N 3.29Å; L87-H89 PolarHBondContact O-N 3.42Å; H89-R91 PolarHBondContact O-N 3.25Å; H89-R91 VanDerWaalsContact O-N 3.17Å; H89-T92 PolarHBondContact CE1-OG1 3Å; H89-T92 PolarHBondContact ND1-OG1 2.83Å; H89-T92 WeakPolarHBondContact O-CA 3.29Å; H89-T92 WeakPolarHBondContact O-CB 3.36Å; H89-T92 PolarHBondContact O-N 3.42Å; H89-T92 PolarHBondContact O-OG1 2.81Å; H89-H93 AromaticContact CE1-NE2 3.4Å; H89-H93 PolarHBondContact CE1-NE2 2.84Å; H89-H93 AromaticContact NE2-CD2 3.81Å; H89-H93 AromaticContact NE2-NE2 3.09Å; H89-H93 PolarHBondContact NE2-NE2 2.87Å
90	Q	88.2	Confident	87	Confident	70 Å²	70	71.9 Å²	71.9	33%	0.327	35%	0.351	S	S	.	.	H	α-helix	trans	-59.5	-30.4	177.3	-74.2	173.2	-44.9	0	0	112.1	L86 L87 T92 H93 D94	L86-Q90 HydrophobicContact CD1-CG 4.16Å; L86-Q90 WeakPolarHBondContact O-CG 3.31Å; L86-Q90 PolarHBondContact O-N 2.94Å; L87-Q90 PolarHBondContact O-N 3.14Å; Q90-T92 PolarHBondContact O-N 3.06Å; Q90-T92 VanDerWaalsContact O-N 3.14Å; Q90-H93 WeakPolarHBondContact O-CB 3.43Å; Q90-H93 PolarHBondContact O-N 3.38Å; Q90-D94 PolarHBondContact O-N 3.28Å; Q90-D94 VanDerWaalsContact O-N 3.08Å
91	R	87.1	Confident	86.4	Confident	143 Å²	143	76.3 Å²	76.3	54%	0.54	39%	0.386	S	S	.	.	H	α-helix	trans	-63.7	-14.1	170.6	-57.5	-179.2	-176.4	175.1	-0.9	113.9	L87 R88 H89 H93 G95 A108	L87-R91 PolarHBondContact O-N 3.06Å; R88-R91 WeakPolarHBondContact O-CB 3.43Å; R88-R91 PolarHBondContact O-N 3.37Å; H89-R91 PolarHBondContact O-N 3.25Å; H89-R91 VanDerWaalsContact O-N 3.17Å; R91-H93 VanDerWaalsContact C-N 3.29Å; R91-G95 WeakPolarHBondContact O-CA 3.41Å; R91-G95 PolarHBondContact O-N 3.41Å; R91-A108 HydrophobicContact CB-CB 4Å; R91-A108 WeakPolarHBondContact CD-O 3.37Å; R91-A108 WeakPolarHBondContact O-CA 3.5Å
92	T	84.5	Confident	86	Confident	59 Å²	59	80.7 Å²	80.7	36%	0.362	41%	0.408	S	S	.	.	H	α-helix	trans	-78.1	-17.4	170.5	71.3	0	0	0	0	112.6	H89 Q90 A108	H89-T92 PolarHBondContact CE1-OG1 3Å; H89-T92 PolarHBondContact ND1-OG1 2.83Å; H89-T92 WeakPolarHBondContact O-CA 3.29Å; H89-T92 WeakPolarHBondContact O-CB 3.36Å; H89-T92 PolarHBondContact O-N 3.42Å; H89-T92 PolarHBondContact O-OG1 2.81Å; Q90-T92 PolarHBondContact O-N 3.06Å; Q90-T92 VanDerWaalsContact O-N 3.14Å; T92-A108 HydrophobicContact CG2-CB 4.06Å
93	H	86.1	Confident	85.9	Confident	53 Å²	53	80.2 Å²	80.2	25%	0.245	40%	0.404	C	S	.	.	H	α-helix	trans	-91.6	-45	173.6	-61	-58.9	0	0	0	111.1	C73 K75 C76 H89 Q90 R91	C73-H93 PolarHBondContact SG-NE2 2.93Å; C73-H93 VanDerWaalsContact SG-NE2 3.43Å; K75-H93 HydrophobicContact CD-CB 3.74Å; C76-H93 PolarHBondContact SG-NE2 3.33Å; H89-H93 AromaticContact CE1-NE2 3.4Å; H89-H93 PolarHBondContact CE1-NE2 2.84Å; H89-H93 AromaticContact NE2-CD2 3.81Å; H89-H93 AromaticContact NE2-NE2 3.09Å; H89-H93 PolarHBondContact NE2-NE2 2.87Å; Q90-H93 WeakPolarHBondContact O-CB 3.43Å; Q90-H93 PolarHBondContact O-N 3.38Å; R91-H93 VanDerWaalsContact C-N 3.29Å
94	D	84.1	Confident	85.7	Confident	104 Å²	104	84.2 Å²	84.2	56%	0.556	42%	0.421	S	S	*	.	H	α-helix	trans	-116.8	6.8	-168.3	-54.8	-42.6	0	0	0	114	K75 Q90	K75-D94 IonicContact NZ-OD1 3.66Å; K75-D94 PolarHBondContact NZ-OD1 3.29Å; K75-D94 IonicContact NZ-OD2 2.69Å; K75-D94 PolarHBondContact NZ-OD2 2.85Å; Q90-D94 PolarHBondContact O-N 3.28Å; Q90-D94 VanDerWaalsContact O-N 3.08Å
95	G	84.9	Confident	85.7	Confident	24 Å²	24	83 Å²	83	25%	0.247	41%	0.412	C	S	.	.	S	Bend	trans	-76.1	-144.4	-177.8	0	0	0	0	0	113	R91 R97	R91-G95 WeakPolarHBondContact O-CA 3.41Å; R91-G95 PolarHBondContact O-N 3.41Å; G95-R97 PolarHBondContact O-N 2.78Å; G95-R97 VanDerWaalsContact O-N 3.16Å
96	Y	88.5	Confident	85.7	Confident	116 Å²	116	83.7 Å²	83.7	46%	0.455	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	104.8	-171.3	-60.2	-90.6	0	0	0	109.9	F107 Y110	Y96-F107 PolarHBondContact N-O 3.11Å; Y96-F107 PolarHBondContact O-N 3.25Å; Y96-Y110 AromaticContact CD1-CD2 3.98Å; Y96-Y110 HydrophobicContact CD1-CD2 3.98Å; Y96-Y110 VanDerWaalsContact CD2-N 3.28Å; Y96-Y110 HydrophobicContact CE1-CD2 4.21Å; Y96-Y110 HydrophobicContact CE1-CG 4.45Å
97	R	89	Confident	85.6	Confident	144 Å²	144	84.2 Å²	84.2	54%	0.543	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.2	177.5	-175.2	174.1	-72.9	-90.4	0.9	110.9	G95 T99 V106	G95-R97 PolarHBondContact O-N 2.78Å; G95-R97 VanDerWaalsContact O-N 3.16Å; R97-T99 PolarHBondContact O-N 3.08Å; R97-V106 HydrophobicContact CB-CG2 4.29Å; R97-V106 HydrophobicContact CG-CG2 4.31Å
98	C	86.7	Confident	85.4	Confident	5 Å²	5	81.2 Å²	81.2	3%	0.034	40%	0.402	C	S	.	.			trans	-68.1	126.4	168	-166.3	0	0	0	0	109.5	K100 C103 M105 F107 L113	C98-K100 VanDerWaalsContact C-N 3.28Å; C98-C103 HydrophobicContact CB-CB 4.02Å; C98-C103 VanDerWaalsContact CB-SG 3.55Å; C98-C103 VanDerWaalsContact SG-SG 3.68Å; C98-M105 PolarHBondContact N-O 3.11Å; C98-F107 HydrophobicContact CB-CE2 4.36Å; C98-L113 HydrophobicContact CB-CD1 3.85Å
99	T	84.4	Confident	85.4	Confident	136 Å²	136	75.8 Å²	75.8	83%	0.834	39%	0.388	S	S	*	.			trans	-90.9	10.2	-179.2	55.9	0	0	0	0	112.9	R97	R97-T99 PolarHBondContact O-N 3.08Å
100	K	81.3	Confident	85.4	Confident	78 Å²	78	80.7 Å²	80.7	34%	0.339	41%	0.407	S	S	.	.	S	Bend	trans	-80.6	135.5	177.7	-60.8	-68	-174.9	-173.4	0	108.9	C98 D102 C103 H121	C98-K100 VanDerWaalsContact C-N 3.28Å; K100-D102 PolarHBondContact O-N 3.19Å; K100-D102 VanDerWaalsContact O-N 3.09Å; K100-C103 HydrophobicContact CB-CB 4.16Å; K100-C103 PolarHBondContact O-N 3.37Å; K100-H121 HydrophobicContact CB-CB 4.47Å; K100-H121 HydrophobicContact CD-CB 4.06Å; K100-H121 HydrophobicContact CG-CB 3.71Å
101	S	76	Confident	85.5	Confident	130 Å²	130	81.7 Å²	81.7	91%	0.909	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.4	-166.3	50.3	0	0	0	0	114.5
102	D	78.5	Confident	85.7	Confident	100 Å²	100	78.4 Å²	78.4	54%	0.535	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	5.8	-179.9	66.9	-30.7	0	0	0	113.5	K100 H121	K100-D102 PolarHBondContact O-N 3.19Å; K100-D102 VanDerWaalsContact O-N 3.09Å; D102-H121 IonicContact OD1-CE1 3.41Å; D102-H121 PolarHBondContact OD1-CE1 2.67Å; D102-H121 IonicContact OD1-ND1 3.4Å
103	C	83.2	Confident	86	Confident	12 Å²	12	76.6 Å²	76.6	8%	0.081	40%	0.398	C	S	.	.			trans	-125	106.8	-172.6	-170.6	0	0	0	0	112.8	C98 K100 M105 H116 H121	C98-C103 HydrophobicContact CB-CB 4.02Å; C98-C103 VanDerWaalsContact CB-SG 3.55Å; C98-C103 VanDerWaalsContact SG-SG 3.68Å; K100-C103 HydrophobicContact CB-CB 4.16Å; K100-C103 PolarHBondContact O-N 3.37Å; C103-M105 VanDerWaalsContact C-N 3.32Å; C103-H116 PolarHBondContact SG-NE2 3.31Å; C103-H121 VanDerWaalsContact CB-CE1 3.42Å; C103-H121 WeakPolarHBondContact CB-CE1 3.27Å; C103-H121 WeakPolarHBondContact CB-NE2 3.37Å; C103-H121 PolarHBondContact SG-NE2 3.37Å; C103-H121 VanDerWaalsContact SG-NE2 3.41Å
104	Q	84.4	Confident	86.3	Confident	169 Å²	169	81.2 Å²	81.2	79%	0.79	41%	0.413	S	S	*	.			trans	-95	15.9	176.6	-57.9	-176.6	16.1	0	0	112.7
105	M	88.3	Confident	86.6	Confident	101 Å²	101	84 Å²	84	50%	0.498	42%	0.416	S	S	.	.			trans	-72	137.7	-178.9	-64.1	-164.8	76.2	0	0	111.6	C98 C103 F107	C98-M105 PolarHBondContact N-O 3.11Å; C103-M105 VanDerWaalsContact C-N 3.32Å; M105-F107 HydrophobicContact CB-CE2 3.6Å; M105-F107 HydrophobicContact CB-CZ 3.62Å; M105-F107 HydrophobicContact CE-CE1 4.31Å; M105-F107 HydrophobicContact CE-CZ 4.14Å; M105-F107 HydrophobicContact CG-CZ 4.44Å; M105-F107 HydrophobicContact SD-CZ 4.04Å
106	V	88.9	Confident	86.8	Confident	31 Å²	31	84 Å²	84	19%	0.188	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	135.5	174.3	-176.9	0	0	0	0	109.2	R97	R97-V106 HydrophobicContact CB-CG2 4.29Å; R97-V106 HydrophobicContact CG-CG2 4.31Å
107	F	87.7	Confident	86.7	Confident	26 Å²	26	80 Å²	80	11%	0.114	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.9	-174.6	-61.1	-88.4	0	0	0	111.9	Y96 C98 M105 T109 L112 L113 H116	Y96-F107 PolarHBondContact N-O 3.11Å; Y96-F107 PolarHBondContact O-N 3.25Å; C98-F107 HydrophobicContact CB-CE2 4.36Å; M105-F107 HydrophobicContact CB-CE2 3.6Å; M105-F107 HydrophobicContact CB-CZ 3.62Å; M105-F107 HydrophobicContact CE-CE1 4.31Å; M105-F107 HydrophobicContact CE-CZ 4.14Å; M105-F107 HydrophobicContact CG-CZ 4.44Å; M105-F107 HydrophobicContact SD-CZ 4.04Å; F107-T109 PolarHBondContact O-N 2.66Å; F107-L112 HydrophobicContact CB-CB 4.14Å; F107-L112 HydrophobicContact CD1-CB 3.99Å; F107-L112 HydrophobicContact CG-CB 4.4Å; F107-L113 HydrophobicContact CB-CB 4.07Å; F107-L113 HydrophobicContact CD2-CB 3.81Å; F107-L113 HydrophobicContact CD2-CD1 3.65Å; F107-L113 HydrophobicContact CD2-CG 4.34Å; F107-L113 HydrophobicContact CE2-CD1 3.85Å; F107-L113 HydrophobicContact CG-CB 4.08Å; F107-H116 HydrophobicContact CE1-CB 3.67Å; F107-H116 AromaticContact CE1-CG 3.9Å; F107-H116 HydrophobicContact CE2-CB 3.99Å; F107-H116 AromaticContact CE2-CD2 3.6Å; F107-H116 AromaticContact CE2-CG 3.74Å; F107-H116 HydrophobicContact CZ-CB 3.38Å; F107-H116 AromaticContact CZ-CD2 3.47Å; F107-H116 VanDerWaalsContact CZ-CD2 3.47Å; F107-H116 WeakPolarHBondContact CZ-CD2 3.41Å; F107-H116 AromaticContact CZ-CE1 3.99Å; F107-H116 AromaticContact CZ-CG 3.14Å; F107-H116 AromaticContact CZ-ND1 3.51Å; F107-H116 AromaticContact CZ-NE2 3.98Å
108	A	86.8	Confident	86.5	Confident	15 Å²	15	76.1 Å²	76.1	12%	0.124	40%	0.396	C	S	.	.	S	Bend	trans	-65.9	-20.9	179.7	0	0	0	0	0	114.4	R91 T92	R91-A108 HydrophobicContact CB-CB 4Å; R91-A108 WeakPolarHBondContact CD-O 3.37Å; R91-A108 WeakPolarHBondContact O-CA 3.5Å; T92-A108 HydrophobicContact CG2-CB 4.06Å
109	T	86.6	Confident	86.4	Confident	54 Å²	54	80.6 Å²	80.6	33%	0.331	42%	0.415	S	S	.	.	S	Bend	trans	-141.5	152.6	178.4	70	0	0	0	0	111.4	F107 V111 L112 L113	F107-T109 PolarHBondContact O-N 2.66Å; T109-V111 VanDerWaalsContact C-N 3.29Å; T109-V111 PolarHBondContact O-N 2.81Å; T109-L112 PolarHBondContact O-N 3.41Å; T109-L112 VanDerWaalsContact OG1-CG 3.31Å; T109-L112 WeakPolarHBondContact OG1-CG 3.48Å; T109-L112 PolarHBondContact OG1-N 2.97Å; T109-L113 PolarHBondContact O-N 3.39Å
110	Y	87.8	Confident	86.2	Confident	124 Å²	124	75.8 Å²	75.8	49%	0.486	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-37.2	176.7	-178.3	-111.4	0	0	0	112.6	Y96 L112 L113 R114	Y96-Y110 AromaticContact CD1-CD2 3.98Å; Y96-Y110 HydrophobicContact CD1-CD2 3.98Å; Y96-Y110 VanDerWaalsContact CD2-N 3.28Å; Y96-Y110 HydrophobicContact CE1-CD2 4.21Å; Y96-Y110 HydrophobicContact CE1-CG 4.45Å; Y110-L112 VanDerWaalsContact C-N 3.29Å; Y110-L112 PolarHBondContact O-N 3.21Å; Y110-L113 PolarHBondContact O-N 2.83Å; Y110-R114 HydrophobicContact CD1-CG 4.01Å; Y110-R114 HydrophobicContact CD2-CG 4.32Å; Y110-R114 HydrophobicContact CE1-CG 3.57Å; Y110-R114 HydrophobicContact CE2-CG 3.89Å; Y110-R114 HydrophobicContact CG-CG 4.37Å; Y110-R114 WeakPolarHBondContact O-CB 3.48Å; Y110-R114 WeakPolarHBondContact O-CG 3.49Å; Y110-R114 PolarHBondContact O-N 3.15Å; Y110-R114 WeakPolarHBondContact OH-CD 3.36Å
111	V	91.2	Very high	86.2	Confident	92 Å²	92	73.2 Å²	73.2	56%	0.558	37%	0.373	S	S	*	.	H	α-helix	trans	-60.3	-39.7	177.3	177.7	0	0	0	0	111.6	T109 R115	T109-V111 VanDerWaalsContact C-N 3.29Å; T109-V111 PolarHBondContact O-N 2.81Å; V111-R115 WeakPolarHBondContact O-CB 3.5Å; V111-R115 PolarHBondContact O-N 3.1Å
112	L	91.7	Very high	86	Confident	73 Å²	73	69.4 Å²	69.4	38%	0.382	35%	0.347	S	S	.	.	H	α-helix	trans	-70.2	-41.8	177.3	-68.9	173.5	0	0	0	111.6	F107 T109 Y110 R115 H116	F107-L112 HydrophobicContact CB-CB 4.14Å; F107-L112 HydrophobicContact CD1-CB 3.99Å; F107-L112 HydrophobicContact CG-CB 4.4Å; T109-L112 PolarHBondContact O-N 3.41Å; T109-L112 VanDerWaalsContact OG1-CG 3.31Å; T109-L112 WeakPolarHBondContact OG1-CG 3.48Å; T109-L112 PolarHBondContact OG1-N 2.97Å; Y110-L112 VanDerWaalsContact C-N 3.29Å; Y110-L112 PolarHBondContact O-N 3.21Å; L112-R115 PolarHBondContact O-N 3.26Å; L112-H116 WeakPolarHBondContact O-CB 3.45Å; L112-H116 PolarHBondContact O-N 3.4Å
113	L	90.3	Very high	85.3	Confident	21 Å²	21	74.6 Å²	74.6	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-58.4	-51	173.2	170.1	62.5	0	0	0	110.9	C98 F107 T109 Y110 R115 H116 V117	C98-L113 HydrophobicContact CB-CD1 3.85Å; F107-L113 HydrophobicContact CB-CB 4.07Å; F107-L113 HydrophobicContact CD2-CB 3.81Å; F107-L113 HydrophobicContact CD2-CD1 3.65Å; F107-L113 HydrophobicContact CD2-CG 4.34Å; F107-L113 HydrophobicContact CE2-CD1 3.85Å; F107-L113 HydrophobicContact CG-CB 4.08Å; T109-L113 PolarHBondContact O-N 3.39Å; Y110-L113 PolarHBondContact O-N 2.83Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 3.1Å; L113-H116 WeakPolarHBondContact O-CB 3.5Å; L113-H116 PolarHBondContact O-N 3.42Å; L113-H116 VanDerWaalsContact O-N 3.1Å; L113-V117 HydrophobicContact CD1-CG2 3.79Å; L113-V117 HydrophobicContact CG-CG2 4.36Å; L113-V117 WeakPolarHBondContact O-CG2 3.29Å; L113-V117 PolarHBondContact O-N 2.88Å
114	R	91.6	Very high	84.2	Confident	150 Å²	150	83.6 Å²	83.6	57%	0.566	40%	0.397	S	S	*	.	H	α-helix	trans	-58.6	-44	-179.7	-76.4	-67	-64.9	-169.8	-0.5	112	Y110 H116 V117 A118	Y110-R114 HydrophobicContact CD1-CG 4.01Å; Y110-R114 HydrophobicContact CD2-CG 4.32Å; Y110-R114 HydrophobicContact CE1-CG 3.57Å; Y110-R114 HydrophobicContact CE2-CG 3.89Å; Y110-R114 HydrophobicContact CG-CG 4.37Å; Y110-R114 WeakPolarHBondContact O-CB 3.48Å; Y110-R114 WeakPolarHBondContact O-CG 3.49Å; Y110-R114 PolarHBondContact O-N 3.15Å; Y110-R114 WeakPolarHBondContact OH-CD 3.36Å; R114-H116 VanDerWaalsContact C-N 3.35Å; R114-V117 PolarHBondContact O-N 3.11Å; R114-A118 VanDerWaalsContact O-CB 3.32Å; R114-A118 WeakPolarHBondContact O-CB 3.46Å; R114-A118 PolarHBondContact O-N 3.41Å
115	R	90.3	Very high	83.4	Confident	163 Å²	163	79.4 Å²	79.4	62%	0.615	39%	0.386	S	S	*	.	H	α-helix	trans	-61.5	-43.4	175	-172.6	-176.4	-53.9	-176.9	2	111.8	V111 L112 L113 A118 K119	V111-R115 WeakPolarHBondContact O-CB 3.5Å; V111-R115 PolarHBondContact O-N 3.1Å; L112-R115 PolarHBondContact O-N 3.26Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 3.1Å; R115-A118 PolarHBondContact O-N 2.8Å; R115-K119 WeakPolarHBondContact O-CB 3.31Å; R115-K119 PolarHBondContact O-N 3.14Å
116	H	89.2	Confident	82.6	Confident	23 Å²	23	77 Å²	77	11%	0.106	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-48.5	177.3	165.3	83.7	0	0	0	111.6	C103 F107 L112 L113 R114 A118 K119 N120 H121	C103-H116 PolarHBondContact SG-NE2 3.31Å; F107-H116 HydrophobicContact CE1-CB 3.67Å; F107-H116 AromaticContact CE1-CG 3.9Å; F107-H116 HydrophobicContact CE2-CB 3.99Å; F107-H116 AromaticContact CE2-CD2 3.6Å; F107-H116 AromaticContact CE2-CG 3.74Å; F107-H116 HydrophobicContact CZ-CB 3.38Å; F107-H116 AromaticContact CZ-CD2 3.47Å; F107-H116 VanDerWaalsContact CZ-CD2 3.47Å; F107-H116 WeakPolarHBondContact CZ-CD2 3.41Å; F107-H116 AromaticContact CZ-CE1 3.99Å; F107-H116 AromaticContact CZ-CG 3.14Å; F107-H116 AromaticContact CZ-ND1 3.51Å; F107-H116 AromaticContact CZ-NE2 3.98Å; L112-H116 WeakPolarHBondContact O-CB 3.45Å; L112-H116 PolarHBondContact O-N 3.4Å; L113-H116 WeakPolarHBondContact O-CB 3.5Å; L113-H116 PolarHBondContact O-N 3.42Å; L113-H116 VanDerWaalsContact O-N 3.1Å; R114-H116 VanDerWaalsContact C-N 3.35Å; H116-A118 PolarHBondContact O-N 3.44Å; H116-K119 PolarHBondContact O-N 3.42Å; H116-N120 PolarHBondContact ND1-ND2 2.99Å; H116-N120 VanDerWaalsContact ND1-ND2 3.17Å; H116-N120 WeakPolarHBondContact O-CB 3.31Å; H116-N120 PolarHBondContact O-N 2.75Å; H116-N120 PolarHBondContact O-ND2 3.22Å; H116-H121 AromaticContact CD2-CD2 3.87Å; H116-H121 AromaticContact CE1-NE2 3.79Å; H116-H121 AromaticContact NE2-CD2 3.38Å; H116-H121 PolarHBondContact NE2-CD2 3.43Å; H116-H121 AromaticContact NE2-NE2 3.09Å; H116-H121 PolarHBondContact NE2-NE2 3.17Å
117	V	86.7	Confident	82.3	Confident	33 Å²	33	78.5 Å²	78.5	20%	0.2	39%	0.389	C	S	.	.	H	α-helix	trans	-60.4	-46	177.8	172.7	0	0	0	0	110.6	L113 R114 K119 H121 S122	L113-V117 HydrophobicContact CD1-CG2 3.79Å; L113-V117 HydrophobicContact CG-CG2 4.36Å; L113-V117 WeakPolarHBondContact O-CG2 3.29Å; L113-V117 PolarHBondContact O-N 2.88Å; R114-V117 PolarHBondContact O-N 3.11Å; V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 3.07Å; V117-H121 HydrophobicContact CG1-CB 4.29Å; V117-H121 CarbonylContact O-C 3.53Å; V117-H121 WeakPolarHBondContact O-CA 3.45Å; V117-H121 PolarHBondContact O-N 3.15Å; V117-S122 PolarHBondContact O-N 2.95Å; V117-S122 VanDerWaalsContact O-N 3.13Å
118	A	85.6	Confident	82.1	Confident	63 Å²	63	77.3 Å²	77.3	52%	0.521	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-41.1	177.9	0	0	0	0	0	112.4	R114 R115 H116 S122	R114-A118 VanDerWaalsContact O-CB 3.32Å; R114-A118 WeakPolarHBondContact O-CB 3.46Å; R114-A118 PolarHBondContact O-N 3.41Å; R115-A118 PolarHBondContact O-N 2.8Å; H116-A118 PolarHBondContact O-N 3.44Å; A118-S122 WeakPolarHBondContact O-CB 3.47Å; A118-S122 PolarHBondContact O-OG 3.21Å
119	K	83.2	Confident	81.9	Confident	98 Å²	98	82 Å²	82	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-77.7	-36.4	-178.4	-177.5	169.7	178.2	167	0	113.6	R115 H116 V117 R138 V139 E142	R115-K119 WeakPolarHBondContact O-CB 3.31Å; R115-K119 PolarHBondContact O-N 3.14Å; H116-K119 PolarHBondContact O-N 3.42Å; V117-K119 VanDerWaalsContact C-N 3.32Å; V117-K119 PolarHBondContact O-N 3.07Å; K119-R138 WeakPolarHBondContact O-CB 3.22Å; K119-V139 HydrophobicContact CD-CG2 4.21Å; K119-V139 VanDerWaalsContact CE-CG2 3.48Å; K119-V139 HydrophobicContact CG-CG2 3.86Å; K119-E142 IonicContact NZ-OE2 2.69Å
120	N	81.5	Confident	81.8	Confident	35 Å²	35	85.3 Å²	85.3	19%	0.187	42%	0.424	C	S	.	.	H	α-helix	trans	-110.1	-28.9	-168.7	-62	-84.2	0	0	0	113.9	H116 V139	H116-N120 PolarHBondContact ND1-ND2 2.99Å; H116-N120 VanDerWaalsContact ND1-ND2 3.17Å; H116-N120 WeakPolarHBondContact O-CB 3.31Å; H116-N120 PolarHBondContact O-N 2.75Å; H116-N120 PolarHBondContact O-ND2 3.22Å; N120-V139 WeakPolarHBondContact OD1-CG2 3.5Å
121	H	80.6	Confident	81.8	Confident	24 Å²	24	82.7 Å²	82.7	11%	0.111	42%	0.424	C	S	.	.			trans	-124.5	11.6	-169.1	-59.9	-71	0	0	0	113.9	K100 D102 C103 H116 V117 K123	K100-H121 HydrophobicContact CB-CB 4.47Å; K100-H121 HydrophobicContact CD-CB 4.06Å; K100-H121 HydrophobicContact CG-CB 3.71Å; D102-H121 IonicContact OD1-CE1 3.41Å; D102-H121 PolarHBondContact OD1-CE1 2.67Å; D102-H121 IonicContact OD1-ND1 3.4Å; C103-H121 VanDerWaalsContact CB-CE1 3.42Å; C103-H121 WeakPolarHBondContact CB-CE1 3.27Å; C103-H121 WeakPolarHBondContact CB-NE2 3.37Å; C103-H121 PolarHBondContact SG-NE2 3.37Å; C103-H121 VanDerWaalsContact SG-NE2 3.41Å; H116-H121 AromaticContact CD2-CD2 3.87Å; H116-H121 AromaticContact CE1-NE2 3.79Å; H116-H121 AromaticContact NE2-CD2 3.38Å; H116-H121 PolarHBondContact NE2-CD2 3.43Å; H116-H121 AromaticContact NE2-NE2 3.09Å; H116-H121 PolarHBondContact NE2-NE2 3.17Å; V117-H121 HydrophobicContact CG1-CB 4.29Å; V117-H121 CarbonylContact O-C 3.53Å; V117-H121 WeakPolarHBondContact O-CA 3.45Å; V117-H121 PolarHBondContact O-N 3.15Å; H121-K123 PolarHBondContact O-N 2.95Å
122	S	71.7	Confident	81.6	Confident	51 Å²	51	80.6 Å²	80.6	36%	0.357	42%	0.421	S	S	.	.			trans	-58.4	112.7	164.9	34.6	0	0	0	0	107.3	V117 A118 R124	V117-S122 PolarHBondContact O-N 2.95Å; V117-S122 VanDerWaalsContact O-N 3.13Å; A118-S122 WeakPolarHBondContact O-CB 3.47Å; A118-S122 PolarHBondContact O-OG 3.21Å; S122-R124 PolarHBondContact O-N 3.41Å
123	K	63.2	Low	81.4	Confident	208 Å²	208	85 Å²	85	90%	0.904	43%	0.432	S	S	*	.	S	Bend	trans	-66.8	84.5	175.6	-80.2	-169.3	176.2	-174	0	108.2	H121	H121-K123 PolarHBondContact O-N 2.95Å
124	R	60.3	Low	81.2	Confident	202 Å²	202	88.2 Å²	88.2	76%	0.762	45%	0.453	S	S	*	.			trans	-145.5	100.7	158.1	-152.3	169.5	-173.7	166.5	0.9	102.8	S122 V126	S122-R124 PolarHBondContact O-N 3.41Å; R124-V126 HydrophobicContact CB-CG2 4.24Å; R124-V126 WeakPolarHBondContact O-CG2 3.22Å; R124-V126 PolarHBondContact O-N 2.69Å
125	S	68.6	Low	80.8	Confident	80 Å²	80	81.9 Å²	81.9	56%	0.559	43%	0.43	S	S	*	.			trans	-53	117.6	158.7	46.9	0	0	0	0	105.6	I135	S125-I135 CarbonylContact C-O 3.59Å; S125-I135 WeakPolarHBondContact CA-O 3.3Å
126	V	71	Confident	80.4	Confident	51 Å²	51	78.3 Å²	78.3	31%	0.309	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.9	-177.3	-170.8	0	0	0	0	106.5	R124 I135 L141	R124-V126 HydrophobicContact CB-CG2 4.24Å; R124-V126 WeakPolarHBondContact O-CG2 3.22Å; R124-V126 PolarHBondContact O-N 2.69Å; V126-I135 PolarHBondContact N-O 3.31Å; V126-I135 PolarHBondContact O-N 2.84Å; V126-I135 VanDerWaalsContact O-N 3.09Å; V126-L141 HydrophobicContact CB-CD2 3.58Å; V126-L141 HydrophobicContact CG1-CD2 3.34Å; V126-L141 HydrophobicContact CG2-CD2 4.48Å
127	S	82.5	Confident	79.9	Confident	63 Å²	63	82.1 Å²	82.1	44%	0.441	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.4	173.1	-56.2	0	0	0	0	109.3	P129 R133	S127-P129 WeakPolarHBondContact O-CD 3.3Å; S127-R133 WeakPolarHBondContact CA-O 3.27Å
128	C	84.7	Confident	79.5	Confident	1 Å²	1	87.4 Å²	87.4	1%	0.007	46%	0.46	C	S	.	.			trans	-59.6	124.6	170.9	177.8	0	0	0	0	109	Q130 C131 G132 R133 L141 H144 H148	C128-Q130 PolarHBondContact O-N 3.36Å; C128-Q130 PolarHBondContact SG-N 3.16Å; C128-C131 VanDerWaalsContact SG-SG 3.68Å; C128-G132 VanDerWaalsContact O-CA 3.25Å; C128-G132 WeakPolarHBondContact O-CA 3.43Å; C128-G132 PolarHBondContact O-N 2.98Å; C128-R133 HydrophobicContact CB-CB 4.41Å; C128-R133 PolarHBondContact N-O 3.1Å; C128-L141 HydrophobicContact CB-CD1 4.12Å; C128-H144 PolarHBondContact SG-NE2 2.98Å; C128-H144 VanDerWaalsContact SG-NE2 3.42Å; C128-H148 PolarHBondContact SG-NE2 2.96Å
129	P	82.6	Confident	79.3	Confident	112 Å²	112	85.6 Å²	85.6	73%	0.727	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-18	-179.5	26.8	-35.1	0	0	0	113.3	S127 L145	S127-P129 WeakPolarHBondContact O-CD 3.3Å; P129-L145 HydrophobicContact CG-CD2 4.39Å
130	Q	84	Confident	79.5	Confident	124 Å²	124	82.9 Å²	82.9	58%	0.579	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-32.5	-176.9	-71.7	167	-43.7	0	0	113.6	C128 H148	C128-Q130 PolarHBondContact O-N 3.36Å; C128-Q130 PolarHBondContact SG-N 3.16Å; Q130-H148 PolarHBondContact OE1-CD2 3.28Å
131	C	88.5	Confident	79.5	Confident	70 Å²	70	82 Å²	82	47%	0.473	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	3.3	-177.7	69.8	0	0	0	0	114.8	C128 R133 H144 H148	C128-C131 VanDerWaalsContact SG-SG 3.68Å; C131-R133 PolarHBondContact O-N 3.26Å; C131-R133 VanDerWaalsContact SG-CB 3.55Å; C131-H144 PolarHBondContact SG-NE2 3.24Å; C131-H148 PolarHBondContact SG-NE2 2.95Å
132	G	86	Confident	79.7	Confident	48 Å²	48	84.6 Å²	84.6	50%	0.495	44%	0.44	S	S	.	.			trans	71.4	-6.3	179.9	0	0	0	0	0	115.2	C128 T134	C128-G132 VanDerWaalsContact O-CA 3.25Å; C128-G132 WeakPolarHBondContact O-CA 3.43Å; C128-G132 PolarHBondContact O-N 2.98Å; G132-T134 PolarHBondContact O-N 3.1Å; G132-T134 VanDerWaalsContact O-N 3.16Å
133	R	88.3	Confident	80.3	Confident	164 Å²	164	88.2 Å²	88.2	62%	0.619	45%	0.449	S	S	*	.			trans	-56.6	122.1	-179.2	-175	175.1	-178.6	164.1	1.3	110.8	S127 C128 C131 I135	S127-R133 WeakPolarHBondContact CA-O 3.27Å; C128-R133 HydrophobicContact CB-CB 4.41Å; C128-R133 PolarHBondContact N-O 3.1Å; C131-R133 PolarHBondContact O-N 3.26Å; C131-R133 VanDerWaalsContact SG-CB 3.55Å; R133-I135 HydrophobicContact CG-CG1 4.4Å
134	T	85.7	Confident	81.5	Confident	89 Å²	89	79.5 Å²	79.5	55%	0.546	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.6	179.5	-62.1	0	0	0	0	110.4	G132	G132-T134 PolarHBondContact O-N 3.1Å; G132-T134 VanDerWaalsContact O-N 3.16Å
135	I	83.5	Confident	82.6	Confident	17 Å²	17	72.3 Å²	72.3	9%	0.087	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.7	-178.9	-59.7	174.4	0	0	0	109.9	S125 V126 R133 D140 L141 H144	S125-I135 CarbonylContact C-O 3.59Å; S125-I135 WeakPolarHBondContact CA-O 3.3Å; V126-I135 PolarHBondContact N-O 3.31Å; V126-I135 PolarHBondContact O-N 2.84Å; V126-I135 VanDerWaalsContact O-N 3.09Å; R133-I135 HydrophobicContact CG-CG1 4.4Å; I135-D140 HydrophobicContact CG2-CB 3.48Å; I135-D140 VanDerWaalsContact CG2-CB 3.48Å; I135-L141 HydrophobicContact CB-CB 4.35Å; I135-L141 HydrophobicContact CD1-CB 4.33Å; I135-L141 HydrophobicContact CD1-CD1 3.92Å; I135-L141 HydrophobicContact CG2-CB 4.33Å; I135-H144 HydrophobicContact CD1-CB 3.3Å; I135-H144 VanDerWaalsContact CD1-CD2 3.44Å; I135-H144 WeakPolarHBondContact CD1-CD2 3.47Å
136	S	80.4	Confident	83.4	Confident	88 Å²	88	72 Å²	72	62%	0.615	38%	0.378	S	S	*	.	S	Bend	trans	-75.5	-27	-171.4	54.4	0	0	0	0	114.5
137	R	79	Confident	83.9	Confident	104 Å²	104	74.7 Å²	74.7	39%	0.392	39%	0.394	S	S	.	.	S	Bend	trans	-123.3	134.9	-177.7	-60.9	-178.8	-65.4	-169.3	-0.9	110.7	V139 D140 L141	R137-V139 VanDerWaalsContact C-N 3.25Å; R137-V139 PolarHBondContact O-N 3.44Å; R137-D140 HydrophobicContact CB-CB 4.36Å; R137-D140 IonicContact CZ-OD2 2.72Å; R137-D140 IonicContact NE-OD2 2.67Å; R137-D140 PolarHBondContact NE-OD2 2.86Å; R137-D140 IonicContact NH2-OD1 3.57Å; R137-D140 IonicContact NH2-OD2 3.33Å; R137-D140 PolarHBondContact NH2-OD2 3.33Å; R137-D140 WeakPolarHBondContact O-CB 3.45Å; R137-D140 PolarHBondContact O-N 3.5Å; R137-L141 PolarHBondContact O-N 3.41Å
138	R	79.3	Confident	84	Confident	143 Å²	143	74.7 Å²	74.7	54%	0.54	39%	0.387	S	S	.	.	H	α-helix	trans	-57.7	-36.4	178.3	179.6	177.1	-176.9	145.5	6	113	K119 D140 L141 E142	K119-R138 WeakPolarHBondContact O-CB 3.22Å; R138-D140 VanDerWaalsContact C-N 3.29Å; R138-D140 PolarHBondContact O-N 3.29Å; R138-L141 PolarHBondContact O-N 3.38Å; R138-E142 IonicContact NE-OE1 3.56Å; R138-E142 WeakPolarHBondContact O-CG 3.42Å; R138-E142 PolarHBondContact O-N 2.84Å
139	V	81.9	Confident	83.9	Confident	26 Å²	26	79 Å²	79	16%	0.158	41%	0.407	C	S	.	.	H	α-helix	trans	-65.5	-33.6	176.3	174.7	0	0	0	0	112.4	K119 N120 R137 K143	K119-V139 HydrophobicContact CD-CG2 4.21Å; K119-V139 VanDerWaalsContact CE-CG2 3.48Å; K119-V139 HydrophobicContact CG-CG2 3.86Å; N120-V139 WeakPolarHBondContact OD1-CG2 3.5Å; R137-V139 VanDerWaalsContact C-N 3.25Å; R137-V139 PolarHBondContact O-N 3.44Å; V139-K143 WeakPolarHBondContact O-CG 3.25Å; V139-K143 PolarHBondContact O-N 3.34Å; V139-K143 VanDerWaalsContact O-N 3.12Å
140	D	85.4	Confident	83.8	Confident	40 Å²	40	82.8 Å²	82.8	21%	0.214	41%	0.412	C	S	.	.	H	α-helix	trans	-75.1	-33.1	175.4	-65.6	-25.9	0	0	0	111	I135 R137 R138 K143 H144	I135-D140 HydrophobicContact CG2-CB 3.48Å; I135-D140 VanDerWaalsContact CG2-CB 3.48Å; R137-D140 HydrophobicContact CB-CB 4.36Å; R137-D140 IonicContact CZ-OD2 2.72Å; R137-D140 IonicContact NE-OD2 2.67Å; R137-D140 PolarHBondContact NE-OD2 2.86Å; R137-D140 IonicContact NH2-OD1 3.57Å; R137-D140 IonicContact NH2-OD2 3.33Å; R137-D140 PolarHBondContact NH2-OD2 3.33Å; R137-D140 WeakPolarHBondContact O-CB 3.45Å; R137-D140 PolarHBondContact O-N 3.5Å; R138-D140 VanDerWaalsContact C-N 3.29Å; R138-D140 PolarHBondContact O-N 3.29Å; D140-K143 PolarHBondContact O-N 3.3Å; D140-H144 VanDerWaalsContact O-CB 3.23Å; D140-H144 WeakPolarHBondContact O-CB 3.44Å; D140-H144 PolarHBondContact O-N 3.33Å
141	L	83.5	Confident	83.8	Confident	17 Å²	17	82.7 Å²	82.7	9%	0.089	41%	0.412	C	S	.	.	H	α-helix	trans	-63.1	-47.2	170.7	176.4	62.5	0	0	0	111	V126 C128 I135 R137 R138 K143 H144 L145	V126-L141 HydrophobicContact CB-CD2 3.58Å; V126-L141 HydrophobicContact CG1-CD2 3.34Å; V126-L141 HydrophobicContact CG2-CD2 4.48Å; C128-L141 HydrophobicContact CB-CD1 4.12Å; I135-L141 HydrophobicContact CB-CB 4.35Å; I135-L141 HydrophobicContact CD1-CB 4.33Å; I135-L141 HydrophobicContact CD1-CD1 3.92Å; I135-L141 HydrophobicContact CG2-CB 4.33Å; R137-L141 PolarHBondContact O-N 3.41Å; R138-L141 PolarHBondContact O-N 3.38Å; L141-K143 PolarHBondContact O-N 2.87Å; L141-H144 WeakPolarHBondContact O-CB 3.16Å; L141-H144 PolarHBondContact O-N 3.4Å; L141-L145 HydrophobicContact CD1-CD2 4.28Å; L141-L145 HydrophobicContact CD1-CG 4.1Å; L141-L145 HydrophobicContact CG-CD1 4.32Å; L141-L145 HydrophobicContact CG-CG 4.36Å; L141-L145 WeakPolarHBondContact O-CG 3.38Å; L141-L145 PolarHBondContact O-N 3.25Å
142	E	84.3	Confident	83.6	Confident	78 Å²	78	82.2 Å²	82.2	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-56.2	-40.1	176.3	-75.2	172.9	-175.8	0	0	111.8	K119 R138	K119-E142 IonicContact NZ-OE2 2.69Å; R138-E142 IonicContact NE-OE1 3.56Å; R138-E142 WeakPolarHBondContact O-CG 3.42Å; R138-E142 PolarHBondContact O-N 2.84Å
143	K	84.8	Confident	83.6	Confident	127 Å²	127	85.2 Å²	85.2	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-71.3	-38.2	174.3	-70.7	172.5	-175.1	172	0	112.5	V139 D140 L141 L145 Q146	V139-K143 WeakPolarHBondContact O-CG 3.25Å; V139-K143 PolarHBondContact O-N 3.34Å; V139-K143 VanDerWaalsContact O-N 3.12Å; D140-K143 PolarHBondContact O-N 3.3Å; L141-K143 PolarHBondContact O-N 2.87Å; K143-L145 VanDerWaalsContact C-N 3.34Å; K143-Q146 VanDerWaalsContact O-CB 3.27Å; K143-Q146 WeakPolarHBondContact O-CB 3.25Å; K143-Q146 PolarHBondContact O-N 3.48Å
144	H	87.4	Confident	83.5	Confident	25 Å²	25	78 Å²	78	12%	0.116	39%	0.386	C	S	.	.	H	α-helix	trans	-66.8	-36.6	179.2	170.9	68.2	0	0	0	112.1	C128 C131 I135 D140 L141 Q146 V147 H148	C128-H144 PolarHBondContact SG-NE2 2.98Å; C128-H144 VanDerWaalsContact SG-NE2 3.42Å; C131-H144 PolarHBondContact SG-NE2 3.24Å; I135-H144 HydrophobicContact CD1-CB 3.3Å; I135-H144 VanDerWaalsContact CD1-CD2 3.44Å; I135-H144 WeakPolarHBondContact CD1-CD2 3.47Å; D140-H144 VanDerWaalsContact O-CB 3.23Å; D140-H144 WeakPolarHBondContact O-CB 3.44Å; D140-H144 PolarHBondContact O-N 3.33Å; L141-H144 WeakPolarHBondContact O-CB 3.16Å; L141-H144 PolarHBondContact O-N 3.4Å; H144-Q146 PolarHBondContact O-N 2.87Å; H144-Q146 VanDerWaalsContact O-N 3.15Å; H144-V147 VanDerWaalsContact O-CB 3.22Å; H144-V147 WeakPolarHBondContact O-CB 3.29Å; H144-V147 WeakPolarHBondContact O-CG2 3.46Å; H144-V147 PolarHBondContact O-N 3.41Å; H144-H148 AromaticContact CD2-NE2 3.88Å; H144-H148 AromaticContact CE1-NE2 3.56Å; H144-H148 AromaticContact NE2-CD2 3.87Å; H144-H148 AromaticContact NE2-NE2 3.07Å; H144-H148 PolarHBondContact NE2-NE2 3.21Å
145	L	84.1	Confident	83.5	Confident	51 Å²	51	78.6 Å²	78.6	27%	0.267	39%	0.391	S	S	.	.	H	α-helix	trans	-58.1	-28	176.2	-70.3	173.9	0	0	0	112.3	P129 L141 K143 V147 H148 E149	P129-L145 HydrophobicContact CG-CD2 4.39Å; L141-L145 HydrophobicContact CD1-CD2 4.28Å; L141-L145 HydrophobicContact CD1-CG 4.1Å; L141-L145 HydrophobicContact CG-CD1 4.32Å; L141-L145 HydrophobicContact CG-CG 4.36Å; L141-L145 WeakPolarHBondContact O-CG 3.38Å; L141-L145 PolarHBondContact O-N 3.25Å; K143-L145 VanDerWaalsContact C-N 3.34Å; L145-V147 PolarHBondContact O-N 3.29Å; L145-H148 PolarHBondContact O-N 3.27Å; L145-E149 PolarHBondContact O-N 3.33Å
146	Q	84.4	Confident	83.5	Confident	74 Å²	74	80.2 Å²	80.2	35%	0.346	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.9	173.7	-59.7	-176.8	18.4	0	0	113.5	K143 H144 H148 H164 S166	K143-Q146 VanDerWaalsContact O-CB 3.27Å; K143-Q146 WeakPolarHBondContact O-CB 3.25Å; K143-Q146 PolarHBondContact O-N 3.48Å; H144-Q146 PolarHBondContact O-N 2.87Å; H144-Q146 VanDerWaalsContact O-N 3.15Å; Q146-H148 VanDerWaalsContact C-N 3.29Å; Q146-H164 WeakPolarHBondContact CA-NE2 3.18Å; Q146-H164 VanDerWaalsContact CB-NE2 3.27Å; Q146-H164 WeakPolarHBondContact CB-NE2 3.23Å; Q146-H164 PolarHBondContact O-CD2 2.82Å; Q146-H164 PolarHBondContact O-NE2 3.31Å; Q146-S166 PolarHBondContact OE1-OG 3.13Å
147	V	82.4	Confident	83.6	Confident	108 Å²	108	81.7 Å²	81.7	66%	0.655	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-26.4	174.6	-178.4	0	0	0	0	111.1	H144 L145	H144-V147 VanDerWaalsContact O-CB 3.22Å; H144-V147 WeakPolarHBondContact O-CB 3.29Å; H144-V147 WeakPolarHBondContact O-CG2 3.46Å; H144-V147 PolarHBondContact O-N 3.41Å; L145-V147 PolarHBondContact O-N 3.29Å
148	H	84	Confident	83.9	Confident	62 Å²	62	80.8 Å²	80.8	29%	0.287	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-16.8	178.6	-59.8	-61.9	0	0	0	112.9	C128 Q130 C131 H144 L145 Q146 K150	C128-H148 PolarHBondContact SG-NE2 2.96Å; Q130-H148 PolarHBondContact OE1-CD2 3.28Å; C131-H148 PolarHBondContact SG-NE2 2.95Å; H144-H148 AromaticContact CD2-NE2 3.88Å; H144-H148 AromaticContact CE1-NE2 3.56Å; H144-H148 AromaticContact NE2-CD2 3.87Å; H144-H148 AromaticContact NE2-NE2 3.07Å; H144-H148 PolarHBondContact NE2-NE2 3.21Å; L145-H148 PolarHBondContact O-N 3.27Å; Q146-H148 VanDerWaalsContact C-N 3.29Å; H148-K150 PolarHBondContact O-N 3.45Å
149	E	81.7	Confident	84.2	Confident	93 Å²	93	74.6 Å²	74.6	44%	0.435	41%	0.413	S	S	.	.	S	Bend	trans	-69	128.6	172.6	-75.9	-177.6	-148.8	0	0	110.4	L145 H151 H164	L145-E149 PolarHBondContact O-N 3.33Å; E149-H151 PolarHBondContact O-N 2.72Å; E149-H164 WeakPolarHBondContact CB-NE2 3.31Å; E149-H164 IonicContact OE2-CD2 3.1Å; E149-H164 IonicContact OE2-CE1 2.68Å; E149-H164 PolarHBondContact OE2-CE1 3.01Å; E149-H164 IonicContact OE2-NE2 3.69Å; E149-H164 PolarHBondContact OE2-NE2 2.78Å
150	K	80.6	Confident	84.4	Confident	190 Å²	190	79 Å²	79	83%	0.826	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-63.3	135.8	-179.7	-67.4	-175	179.7	-179.6	0	110.5	H148	H148-K150 PolarHBondContact O-N 3.45Å
151	H	85.1	Confident	84.4	Confident	123 Å²	123	82.1 Å²	82.1	57%	0.569	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-63.9	141.5	168.8	-69.5	171.6	0	0	0	110.2	E149 R162 H164	E149-H151 PolarHBondContact O-N 2.72Å; H151-R162 HydrophobicContact CB-CB 4.43Å; H151-H164 PolarHBondContact CD2-N 3.3Å; H151-H164 VanDerWaalsContact CD2-N 3.25Å
152	V	84.2	Confident	84.5	Confident	59 Å²	59	89.7 Å²	89.7	36%	0.358	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	145.7	177.6	-69.9	0	0	0	0	109.8	R162 M163 P165 L168	V152-R162 WeakPolarHBondContact O-CA 3.35Å; V152-M163 WeakPolarHBondContact CG2-O 3.41Å; V152-M163 PolarHBondContact N-O 3.03Å; V152-M163 PolarHBondContact O-N 2.93Å; V152-P165 HydrophobicContact CG2-CG 4.25Å; V152-L168 HydrophobicContact CG2-CD2 3.57Å
153	D	86.2	Confident	84.5	Confident	112 Å²	112	86.9 Å²	86.9	60%	0.599	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	146.1	172.4	-65.9	-72	0	0	0	111	R162	D153-R162 WeakPolarHBondContact OD1-CD 3.42Å; D153-R162 WeakPolarHBondContact OD1-CG 3.33Å
154	C	86.6	Confident	84.4	Confident	12 Å²	12	81.3 Å²	81.3	8%	0.081	45%	0.45	C	S	.	.			trans	-71.7	126.8	174	-172.7	0	0	0	0	109.8	V156 C159 M161 L168 H171	C154-V156 PolarHBondContact O-N 2.78Å; C154-C159 HydrophobicContact CB-CB 4.18Å; C154-M161 WeakPolarHBondContact CB-O 3.31Å; C154-M161 PolarHBondContact N-O 3.24Å; C154-L168 HydrophobicContact CB-CD1 4.1Å; C154-H171 VanDerWaalsContact SG-CD2 3.51Å; C154-H171 PolarHBondContact SG-NE2 3.01Å; C154-H171 VanDerWaalsContact SG-NE2 3.37Å
155	P	85.4	Confident	84.2	Confident	101 Å²	101	82.7 Å²	82.7	66%	0.656	46%	0.461	S	S	*	.			trans	-76.7	1.1	179.4	32.6	-37	0	0	0	113.4	L172	P155-L172 HydrophobicContact CG-CD1 4.19Å; P155-L172 HydrophobicContact CG-CD2 4.18Å
156	V	82.6	Confident	83.9	Confident	51 Å²	51	83 Å²	83	31%	0.309	47%	0.467	S	S	.	.	S	Bend	trans	-81.4	123.2	179.5	178.1	0	0	0	0	108.8	C154 G158 C159 L172	C154-V156 PolarHBondContact O-N 2.78Å; V156-G158 PolarHBondContact O-N 3.23Å; V156-C159 HydrophobicContact CB-CB 3.99Å; V156-C159 HydrophobicContact CG1-CB 4.29Å; V156-C159 VanDerWaalsContact O-CB 3.27Å; V156-C159 WeakPolarHBondContact O-CB 3.44Å; V156-C159 PolarHBondContact O-N 3.19Å; V156-L172 HydrophobicContact CG2-CD2 3.39Å
157	S	83.8	Confident	83.8	Confident	119 Å²	119	87 Å²	87	83%	0.832	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	133.5	176.2	48	0	0	0	0	111.5	C159	S157-C159 VanDerWaalsContact C-N 3.26Å; S157-C159 PolarHBondContact O-N 3.47Å
158	G	84.8	Confident	83.9	Confident	85 Å²	85	82.8 Å²	82.8	88%	0.876	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	2.9	-175.1	0	0	0	0	0	115.3	V156	V156-G158 PolarHBondContact O-N 3.23Å
159	C	84.4	Confident	83.9	Confident	13 Å²	13	82.9 Å²	82.9	9%	0.088	47%	0.465	C	S	.	.			trans	-106.8	96.4	176.5	-166.7	0	0	0	0	111.7	C154 V156 S157 M161 H171	C154-C159 HydrophobicContact CB-CB 4.18Å; V156-C159 HydrophobicContact CB-CB 3.99Å; V156-C159 HydrophobicContact CG1-CB 4.29Å; V156-C159 VanDerWaalsContact O-CB 3.27Å; V156-C159 WeakPolarHBondContact O-CB 3.44Å; V156-C159 PolarHBondContact O-N 3.19Å; S157-C159 VanDerWaalsContact C-N 3.26Å; S157-C159 PolarHBondContact O-N 3.47Å; C159-M161 PolarHBondContact O-N 2.94Å; C159-H171 PolarHBondContact SG-NE2 2.8Å; C159-H171 VanDerWaalsContact SG-NE2 3.41Å
160	S	86.9	Confident	84.1	Confident	119 Å²	119	86.6 Å²	86.6	83%	0.832	48%	0.475	S	S	*	.			trans	-80.5	23.3	-179.2	-43.4	0	0	0	0	114.6
161	M	85.2	Confident	84.2	Confident	106 Å²	106	79.3 Å²	79.3	52%	0.522	44%	0.444	S	S	.	.			trans	-84.9	128.1	-175.5	-67.2	-71.7	-69	0	0	110.9	C154 C159 M163	C154-M161 WeakPolarHBondContact CB-O 3.31Å; C154-M161 PolarHBondContact N-O 3.24Å; C159-M161 PolarHBondContact O-N 2.94Å; M161-M163 HydrophobicContact CB-CE 3.49Å; M161-M163 VanDerWaalsContact CB-CE 3.49Å; M161-M163 HydrophobicContact CG-CE 4.39Å
162	R	86	Confident	84.1	Confident	176 Å²	176	75.4 Å²	75.4	66%	0.664	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.2	167.7	-70.3	-172.5	-63.2	-178.7	0.1	110.5	H151 V152 D153	H151-R162 HydrophobicContact CB-CB 4.43Å; V152-R162 WeakPolarHBondContact O-CA 3.35Å; D153-R162 WeakPolarHBondContact OD1-CD 3.42Å; D153-R162 WeakPolarHBondContact OD1-CG 3.33Å
163	M	84.3	Confident	84	Confident	18 Å²	18	80 Å²	80	9%	0.089	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	160.4	-179.7	67.8	-168.8	83.7	0	0	113.1	V152 M161 R167 L168 H171	V152-M163 WeakPolarHBondContact CG2-O 3.41Å; V152-M163 PolarHBondContact N-O 3.03Å; V152-M163 PolarHBondContact O-N 2.93Å; M161-M163 HydrophobicContact CB-CE 3.49Å; M161-M163 VanDerWaalsContact CB-CE 3.49Å; M161-M163 HydrophobicContact CG-CE 4.39Å; M163-R167 HydrophobicContact CB-CB 4.17Å; M163-R167 HydrophobicContact CG-CB 4.15Å; M163-R167 VanDerWaalsContact SD-C 3.52Å; M163-R167 HydrophobicContact SD-CB 4.03Å; M163-L168 HydrophobicContact CE-CD1 4.4Å; M163-L168 HydrophobicContact CG-CB 3.73Å; M163-L168 HydrophobicContact CG-CD1 4.23Å; M163-L168 WeakPolarHBondContact SD-CA 3.49Å; M163-L168 HydrophobicContact SD-CB 4.14Å; M163-L168 HydrophobicContact SD-CD1 4.2Å; M163-L168 PolarHBondContact SD-N 2.69Å; M163-L168 VanDerWaalsContact SD-N 3.45Å; M163-H171 HydrophobicContact CE-CB 4.01Å; M163-H171 HydrophobicContact SD-CB 3.56Å; M163-H171 VanDerWaalsContact SD-CB 3.56Å
164	H	83	Confident	83.6	Confident	11 Å²	11	78.6 Å²	78.6	5%	0.051	44%	0.437	C	S	.	.			trans	-55	143	171.2	-177.4	-90.7	0	0	0	112.1	Q146 E149 H151 S166 R167 L168	Q146-H164 WeakPolarHBondContact CA-NE2 3.18Å; Q146-H164 VanDerWaalsContact CB-NE2 3.27Å; Q146-H164 WeakPolarHBondContact CB-NE2 3.23Å; Q146-H164 PolarHBondContact O-CD2 2.82Å; Q146-H164 PolarHBondContact O-NE2 3.31Å; E149-H164 WeakPolarHBondContact CB-NE2 3.31Å; E149-H164 IonicContact OE2-CD2 3.1Å; E149-H164 IonicContact OE2-CE1 2.68Å; E149-H164 PolarHBondContact OE2-CE1 3.01Å; E149-H164 IonicContact OE2-NE2 3.69Å; E149-H164 PolarHBondContact OE2-NE2 2.78Å; H151-H164 PolarHBondContact CD2-N 3.3Å; H151-H164 VanDerWaalsContact CD2-N 3.25Å; H164-S166 VanDerWaalsContact C-N 3.29Å; H164-S166 PolarHBondContact CE1-OG 2.6Å; H164-S166 WeakPolarHBondContact ND1-CB 3.36Å; H164-S166 PolarHBondContact ND1-N 2.91Å; H164-S166 PolarHBondContact ND1-OG 2.87Å; H164-S166 PolarHBondContact O-N 3.12Å; H164-S166 VanDerWaalsContact O-N 3.14Å; H164-R167 CarbonylContact O-C 3.48Å; H164-R167 WeakPolarHBondContact O-CA 3.43Å; H164-R167 WeakPolarHBondContact O-CB 3.38Å; H164-R167 PolarHBondContact O-N 3.11Å; H164-L168 PolarHBondContact O-N 3.13Å
165	P	82.1	Confident	82.9	Confident	53 Å²	53	83.3 Å²	83.3	34%	0.344	45%	0.453	S	S	.	.	H	α-helix	trans	-50.7	-39.5	-178.5	-31.1	36.3	0	0	0	115.3	V152 R167 L168 A169	V152-P165 HydrophobicContact CG2-CG 4.25Å; P165-R167 VanDerWaalsContact C-N 3.34Å; P165-R167 PolarHBondContact O-N 2.95Å; P165-L168 PolarHBondContact O-N 3.06Å; P165-A169 WeakPolarHBondContact O-CB 3.23Å; P165-A169 PolarHBondContact O-N 3.47Å
166	S	77.7	Confident	81.8	Confident	57 Å²	57	85.7 Å²	85.7	40%	0.399	45%	0.453	S	S	.	.	H	α-helix	trans	-64.3	-36.5	176.5	72.5	0	0	0	0	113	Q146 H164 R170	Q146-S166 PolarHBondContact OE1-OG 3.13Å; H164-S166 VanDerWaalsContact C-N 3.29Å; H164-S166 PolarHBondContact CE1-OG 2.6Å; H164-S166 WeakPolarHBondContact ND1-CB 3.36Å; H164-S166 PolarHBondContact ND1-N 2.91Å; H164-S166 PolarHBondContact ND1-OG 2.87Å; H164-S166 PolarHBondContact O-N 3.12Å; H164-S166 VanDerWaalsContact O-N 3.14Å; S166-R170 PolarHBondContact O-N 3.33Å
167	R	82.8	Confident	80.4	Confident	159 Å²	159	86.9 Å²	86.9	60%	0.6	46%	0.461	S	S	*	.	H	α-helix	trans	-74.7	-36.8	173.8	-67.5	-172.5	-178.5	-174.9	2.6	110.7	M163 H164 P165 R170 H171	M163-R167 HydrophobicContact CB-CB 4.17Å; M163-R167 HydrophobicContact CG-CB 4.15Å; M163-R167 VanDerWaalsContact SD-C 3.52Å; M163-R167 HydrophobicContact SD-CB 4.03Å; H164-R167 CarbonylContact O-C 3.48Å; H164-R167 WeakPolarHBondContact O-CA 3.43Å; H164-R167 WeakPolarHBondContact O-CB 3.38Å; H164-R167 PolarHBondContact O-N 3.11Å; P165-R167 VanDerWaalsContact C-N 3.34Å; P165-R167 PolarHBondContact O-N 2.95Å; R167-R170 PolarHBondContact O-N 3.31Å; R167-H171 VanDerWaalsContact O-CB 3.28Å; R167-H171 WeakPolarHBondContact O-CB 3.37Å; R167-H171 PolarHBondContact O-N 2.76Å
168	L	84	Confident	78.8	Confident	20 Å²	20	84.6 Å²	84.6	11%	0.105	44%	0.442	C	S	.	.	H	α-helix	trans	-61.7	-47	175.7	-176.8	61.6	0	0	0	110.9	V152 C154 M163 H164 P165 R170 H171 L172	V152-L168 HydrophobicContact CG2-CD2 3.57Å; C154-L168 HydrophobicContact CB-CD1 4.1Å; M163-L168 HydrophobicContact CE-CD1 4.4Å; M163-L168 HydrophobicContact CG-CB 3.73Å; M163-L168 HydrophobicContact CG-CD1 4.23Å; M163-L168 WeakPolarHBondContact SD-CA 3.49Å; M163-L168 HydrophobicContact SD-CB 4.14Å; M163-L168 HydrophobicContact SD-CD1 4.2Å; M163-L168 PolarHBondContact SD-N 2.69Å; M163-L168 VanDerWaalsContact SD-N 3.45Å; H164-L168 PolarHBondContact O-N 3.13Å; P165-L168 PolarHBondContact O-N 3.06Å; L168-R170 VanDerWaalsContact C-N 3.28Å; L168-R170 PolarHBondContact O-N 3.19Å; L168-H171 WeakPolarHBondContact O-CB 3.37Å; L168-H171 PolarHBondContact O-N 3.28Å; L168-H171 VanDerWaalsContact O-N 3.11Å; L168-L172 HydrophobicContact CD1-CD1 4.15Å; L168-L172 HydrophobicContact CD1-CD2 4.23Å; L168-L172 HydrophobicContact CD1-CG 3.88Å; L168-L172 HydrophobicContact CD2-CD1 4.42Å; L168-L172 HydrophobicContact CG-CD1 3.9Å; L168-L172 HydrophobicContact CG-CG 4.08Å; L168-L172 WeakPolarHBondContact O-CB 3.11Å; L168-L172 VanDerWaalsContact O-CG 3.29Å; L168-L172 WeakPolarHBondContact O-CG 3.42Å; L168-L172 PolarHBondContact O-N 3.41Å
169	A	84.5	Confident	77.2	Confident	64 Å²	64	83.2 Å²	83.2	53%	0.529	42%	0.422	S	S	.	.	H	α-helix	trans	-56.5	-42.7	176.8	0	0	0	0	0	112.1	P165 K173	P165-A169 WeakPolarHBondContact O-CB 3.23Å; P165-A169 PolarHBondContact O-N 3.47Å; A169-K173 WeakPolarHBondContact O-CB 2.91Å; A169-K173 PolarHBondContact O-N 2.78Å; A169-K173 VanDerWaalsContact O-N 3.08Å
170	R	84.8	Confident	75	Confident	171 Å²	171	91 Å²	91	65%	0.645	46%	0.455	S	S	*	.	H	α-helix	trans	-67.4	-44.9	174.8	-175.2	176.7	66.3	179	2.5	112	S166 R167 L168 K173 V174	S166-R170 PolarHBondContact O-N 3.33Å; R167-R170 PolarHBondContact O-N 3.31Å; L168-R170 VanDerWaalsContact C-N 3.28Å; L168-R170 PolarHBondContact O-N 3.19Å; R170-K173 WeakPolarHBondContact O-CB 3.36Å; R170-K173 PolarHBondContact O-N 3.06Å; R170-V174 WeakPolarHBondContact O-CG2 3.33Å; R170-V174 PolarHBondContact O-N 3.3Å; R170-V174 VanDerWaalsContact O-N 3.11Å
171	H	84.3	Confident	72.9	Confident	36 Å²	36	92.6 Å²	92.6	17%	0.167	45%	0.453	C	S	.	.	H	α-helix	trans	-58.4	-48.3	177.5	172.1	86.6	0	0	0	111.5	C154 C159 M163 R167 L168 K173 V174 R175	C154-H171 VanDerWaalsContact SG-CD2 3.51Å; C154-H171 PolarHBondContact SG-NE2 3.01Å; C154-H171 VanDerWaalsContact SG-NE2 3.37Å; C159-H171 PolarHBondContact SG-NE2 2.8Å; C159-H171 VanDerWaalsContact SG-NE2 3.41Å; M163-H171 HydrophobicContact CE-CB 4.01Å; M163-H171 HydrophobicContact SD-CB 3.56Å; M163-H171 VanDerWaalsContact SD-CB 3.56Å; R167-H171 VanDerWaalsContact O-CB 3.28Å; R167-H171 WeakPolarHBondContact O-CB 3.37Å; R167-H171 PolarHBondContact O-N 2.76Å; L168-H171 WeakPolarHBondContact O-CB 3.37Å; L168-H171 PolarHBondContact O-N 3.28Å; L168-H171 VanDerWaalsContact O-N 3.11Å; H171-K173 VanDerWaalsContact C-N 3.31Å; H171-K173 PolarHBondContact O-N 3.06Å; H171-V174 PolarHBondContact O-N 2.71Å; H171-V174 VanDerWaalsContact O-N 3.15Å; H171-R175 WeakPolarHBondContact NE2-CG 3.26Å; H171-R175 WeakPolarHBondContact O-CG 3.46Å; H171-R175 PolarHBondContact O-N 3.48Å
172	L	83.2	Confident	70.7	Confident	42 Å²	42	92.1 Å²	92.1	22%	0.22	46%	0.46	C	S	.	.	H	α-helix	trans	-63.9	-34.6	177.3	-68	179.7	0	0	0	112.2	P155 V156 L168 V174 R175 K176	P155-L172 HydrophobicContact CG-CD1 4.19Å; P155-L172 HydrophobicContact CG-CD2 4.18Å; V156-L172 HydrophobicContact CG2-CD2 3.39Å; L168-L172 HydrophobicContact CD1-CD1 4.15Å; L168-L172 HydrophobicContact CD1-CD2 4.23Å; L168-L172 HydrophobicContact CD1-CG 3.88Å; L168-L172 HydrophobicContact CD2-CD1 4.42Å; L168-L172 HydrophobicContact CG-CD1 3.9Å; L168-L172 HydrophobicContact CG-CG 4.08Å; L168-L172 WeakPolarHBondContact O-CB 3.11Å; L168-L172 VanDerWaalsContact O-CG 3.29Å; L168-L172 WeakPolarHBondContact O-CG 3.42Å; L168-L172 PolarHBondContact O-N 3.41Å; L172-V174 VanDerWaalsContact C-N 3.34Å; L172-R175 PolarHBondContact O-N 2.86Å; L172-K176 VanDerWaalsContact O-CB 3.3Å; L172-K176 WeakPolarHBondContact O-CB 3.48Å; L172-K176 VanDerWaalsContact O-CG 3.27Å; L172-K176 WeakPolarHBondContact O-CG 3.35Å; L172-K176 PolarHBondContact O-N 3.46Å
173	K	81.7	Confident	68	Low	156 Å²	156	91.5 Å²	91.5	68%	0.678	46%	0.459	S	S	*	.	H	α-helix	trans	-62	-44.1	173.1	-170.8	175.5	-178.8	177.8	0	111.3	A169 R170 H171 T177	A169-K173 WeakPolarHBondContact O-CB 2.91Å; A169-K173 PolarHBondContact O-N 2.78Å; A169-K173 VanDerWaalsContact O-N 3.08Å; R170-K173 WeakPolarHBondContact O-CB 3.36Å; R170-K173 PolarHBondContact O-N 3.06Å; H171-K173 VanDerWaalsContact C-N 3.31Å; H171-K173 PolarHBondContact O-N 3.06Å; K173-T177 WeakPolarHBondContact O-CG2 3.44Å; K173-T177 PolarHBondContact O-N 3.34Å; K173-T177 VanDerWaalsContact O-N 3.14Å; K173-T177 PolarHBondContact O-OG1 3.01Å
174	V	77.9	Confident	65.6	Low	82 Å²	82	98.1 Å²	98.1	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-68.3	-42.6	176.5	178.2	0	0	0	0	111.2	R170 H171 L172 T177 V178	R170-V174 WeakPolarHBondContact O-CG2 3.33Å; R170-V174 PolarHBondContact O-N 3.3Å; R170-V174 VanDerWaalsContact O-N 3.11Å; H171-V174 PolarHBondContact O-N 2.71Å; H171-V174 VanDerWaalsContact O-N 3.15Å; L172-V174 VanDerWaalsContact C-N 3.34Å; V174-T177 VanDerWaalsContact C-OG1 3.31Å; V174-T177 VanDerWaalsContact CA-OG1 3.31Å; V174-T177 WeakPolarHBondContact CA-OG1 3.39Å; V174-T177 PolarHBondContact O-N 2.97Å; V174-T177 PolarHBondContact O-OG1 3.48Å; V174-V178 HydrophobicContact CG1-CG2 4.27Å; V174-V178 VanDerWaalsContact O-CG2 3.31Å; V174-V178 WeakPolarHBondContact O-CG2 3.27Å; V174-V178 PolarHBondContact O-N 2.86Å
175	R	70.4	Confident	63.5	Low	111 Å²	111	103.5 Å²	103.5	42%	0.419	52%	0.523	S	S	.	.	H	α-helix	trans	-66.1	-40.1	177.2	-73.9	-70.9	-169.8	169.3	-1.3	112.6	H171 L172 T177 V178 A179	H171-R175 WeakPolarHBondContact NE2-CG 3.26Å; H171-R175 WeakPolarHBondContact O-CG 3.46Å; H171-R175 PolarHBondContact O-N 3.48Å; L172-R175 PolarHBondContact O-N 2.86Å; R175-T177 VanDerWaalsContact C-N 3.27Å; R175-T177 PolarHBondContact O-N 3.49Å; R175-V178 PolarHBondContact O-N 3.17Å; R175-A179 VanDerWaalsContact O-CB 3.22Å; R175-A179 WeakPolarHBondContact O-CB 3.36Å; R175-A179 PolarHBondContact O-N 3.37Å
176	K	63.9	Low	61.2	Low	150 Å²	150	109.6 Å²	109.6	65%	0.652	54%	0.544	S	S	*	.	H	α-helix	trans	-59.3	-41.2	171.8	-77.4	-178	-179.3	-172.2	0	110.8	L172 F180	L172-K176 VanDerWaalsContact O-CB 3.3Å; L172-K176 WeakPolarHBondContact O-CB 3.48Å; L172-K176 VanDerWaalsContact O-CG 3.27Å; L172-K176 WeakPolarHBondContact O-CG 3.35Å; L172-K176 PolarHBondContact O-N 3.46Å; K176-F180 WeakPolarHBondContact O-CB 3.25Å; K176-F180 WeakPolarHBondContact O-CD2 3.45Å; K176-F180 PolarHBondContact O-N 3.46Å
177	T	52.3	Low	59.3	Low	76 Å²	76	111.3 Å²	111.3	47%	0.466	56%	0.562	S	S	.	*	H	α-helix	trans	-68.3	-39.2	175.5	51.5	0	0	0	0	112.5	K173 V174 R175 F180 L181	K173-T177 WeakPolarHBondContact O-CG2 3.44Å; K173-T177 PolarHBondContact O-N 3.34Å; K173-T177 VanDerWaalsContact O-N 3.14Å; K173-T177 PolarHBondContact O-OG1 3.01Å; V174-T177 VanDerWaalsContact C-OG1 3.31Å; V174-T177 VanDerWaalsContact CA-OG1 3.31Å; V174-T177 WeakPolarHBondContact CA-OG1 3.39Å; V174-T177 PolarHBondContact O-N 2.97Å; V174-T177 PolarHBondContact O-OG1 3.48Å; R175-T177 VanDerWaalsContact C-N 3.27Å; R175-T177 PolarHBondContact O-N 3.49Å; T177-F180 PolarHBondContact O-N 3.45Å; T177-L181 VanDerWaalsContact O-CG 3.25Å; T177-L181 WeakPolarHBondContact O-CG 2.95Å; T177-L181 PolarHBondContact O-N 3.25Å
178	V	51.6	Low	57.1	Low	71 Å²	71	113.1 Å²	113.1	43%	0.43	57%	0.569	S	S	.	*	H	α-helix	trans	-71.5	-40.7	178.3	175.3	0	0	0	0	111.6	V174 R175 F180 L181 S182	V174-V178 HydrophobicContact CG1-CG2 4.27Å; V174-V178 VanDerWaalsContact O-CG2 3.31Å; V174-V178 WeakPolarHBondContact O-CG2 3.27Å; V174-V178 PolarHBondContact O-N 2.86Å; R175-V178 PolarHBondContact O-N 3.17Å; V178-F180 VanDerWaalsContact C-N 3.26Å; V178-F180 PolarHBondContact O-N 2.81Å; V178-L181 CarbonylContact O-C 3.58Å; V178-L181 WeakPolarHBondContact O-CA 3.37Å; V178-L181 WeakPolarHBondContact O-CB 3.19Å; V178-L181 PolarHBondContact O-N 3.39Å; V178-S182 PolarHBondContact O-N 3.24Å; V178-S182 PolarHBondContact O-OG 2.8Å
179	A	49.7	Very low	54.8	Low	56 Å²	56	121.4 Å²	121.4	46%	0.463	61%	0.607	S	S	.	*	H	α-helix	trans	-62.8	-33.6	174.8	0	0	0	0	0	112	R175 S182 Y183	R175-A179 VanDerWaalsContact O-CB 3.22Å; R175-A179 WeakPolarHBondContact O-CB 3.36Å; R175-A179 PolarHBondContact O-N 3.37Å; A179-S182 PolarHBondContact O-OG 2.74Å; A179-Y183 PolarHBondContact O-N 3.28Å
180	F	39.1	Very low	52.6	Low	177 Å²	177	123 Å²	123	78%	0.776	62%	0.615	S	S	*	*	H	α-helix	trans	-69.8	-33.7	168.5	-102.6	-88.3	0	0	0	112.8	K176 T177 V178 S182 Y183	K176-F180 WeakPolarHBondContact O-CB 3.25Å; K176-F180 WeakPolarHBondContact O-CD2 3.45Å; K176-F180 PolarHBondContact O-N 3.46Å; T177-F180 PolarHBondContact O-N 3.45Å; V178-F180 VanDerWaalsContact C-N 3.26Å; V178-F180 PolarHBondContact O-N 2.81Å; F180-S182 VanDerWaalsContact C-N 3.3Å; F180-S182 PolarHBondContact O-N 3.24Å; F180-Y183 PolarHBondContact O-N 3.45Å
181	L	41.7	Very low	50.1	Low	152 Å²	152	120.4 Å²	120.4	80%	0.796	62%	0.621	S	S	*	*	H	α-helix	trans	-72.7	-22.6	176.4	-69.9	170.2	0	0	0	112.8	T177 V178	T177-L181 VanDerWaalsContact O-CG 3.25Å; T177-L181 WeakPolarHBondContact O-CG 2.95Å; T177-L181 PolarHBondContact O-N 3.25Å; V178-L181 CarbonylContact O-C 3.58Å; V178-L181 WeakPolarHBondContact O-CA 3.37Å; V178-L181 WeakPolarHBondContact O-CB 3.19Å; V178-L181 PolarHBondContact O-N 3.39Å
182	S	39.6	Very low	47.6	Very low	96 Å²	96	123 Å²	123	67%	0.671	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	1.9	175.2	52.6	0	0	0	0	114.4	V178 A179 F180	V178-S182 PolarHBondContact O-N 3.24Å; V178-S182 PolarHBondContact O-OG 2.8Å; A179-S182 PolarHBondContact O-OG 2.74Å; F180-S182 VanDerWaalsContact C-N 3.3Å; F180-S182 PolarHBondContact O-N 3.24Å
183	Y	29	Very low	45.8	Very low	164 Å²	164	130 Å²	130	64%	0.643	67%	0.674	S	S	*	*	S	Bend	trans	-125.5	106.3	175.6	-161.7	-102.3	0	0	0	112.9	A179 F180	A179-Y183 PolarHBondContact O-N 3.28Å; F180-Y183 PolarHBondContact O-N 3.45Å
184	K	33.8	Very low	43.8	Very low	156 Å²	156	133.2 Å²	133.2	68%	0.678	68%	0.682	S	S	*	*			trans	77	119.4	168.6	-74.8	-178.2	174.6	175.6	0	117.7	F186	K184-F186 PolarHBondContact O-N 3.42Å
185	P	39.7	Very low	41.7	Very low	124 Å²	124	134.9 Å²	134.9	81%	0.805	70%	0.696	S	S	*	*			trans	-59.1	135.7	166.7	27.7	-30.3	0	0	0	106.8	A187	P185-A187 VanDerWaalsContact C-N 3.26Å; P185-A187 PolarHBondContact O-N 2.86Å
186	F	33.4	Very low	40.1	Very low	181 Å²	181	138.8 Å²	138.8	79%	0.794	72%	0.719	S	S	*	*			trans	-53.3	94.7	174.2	-143.1	-80.1	0	0	0	107.4	K184 R188	K184-F186 PolarHBondContact O-N 3.42Å; F186-R188 HydrophobicContact CD1-CB 4.23Å; F186-R188 HydrophobicContact CD1-CG 3.29Å; F186-R188 HydrophobicContact CE1-CG 3.76Å; F186-R188 HydrophobicContact CG-CG 4.32Å; F186-R188 PolarHBondContact O-N 3.47Å
187	A	37.1	Very low	38.7	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	73%	0.726	S	S	*	*			trans	-64.8	83.9	155.9	0	0	0	0	0	103.6	P185 E189	P185-A187 VanDerWaalsContact C-N 3.26Å; P185-A187 PolarHBondContact O-N 2.86Å; A187-E189 VanDerWaalsContact C-N 3.31Å; A187-E189 PolarHBondContact O-N 2.93Å
188	R	36.6	Very low	37.7	Very low	198 Å²	198	143.3 Å²	143.3	75%	0.747	75%	0.747	S	S	*	*			trans	-56.9	111.3	162.6	-75.4	-171.5	176.1	-158.2	1.2	103	F186 S190	F186-R188 HydrophobicContact CD1-CB 4.23Å; F186-R188 HydrophobicContact CD1-CG 3.29Å; F186-R188 HydrophobicContact CE1-CG 3.76Å; F186-R188 HydrophobicContact CG-CG 4.32Å; F186-R188 PolarHBondContact O-N 3.47Å; R188-S190 PolarHBondContact O-N 2.88Å
189	E	36.3	Very low	37	Very low	194 Å²	194	142.7 Å²	142.7	91%	0.907	76%	0.755	S	S	*	*			trans	-56.2	77.1	154.6	-71.5	164.4	154.5	0	0	107.1	A187 C191	A187-E189 VanDerWaalsContact C-N 3.31Å; A187-E189 PolarHBondContact O-N 2.93Å; E189-C191 PolarHBondContact O-N 2.98Å
190	S	38.9	Very low	36.3	Very low	98 Å²	98	149.7 Å²	149.7	69%	0.685	78%	0.775	S	S	*	*			trans	-88.6	75.8	147.4	55.7	0	0	0	0	105.1	R188 C192	R188-S190 PolarHBondContact O-N 2.88Å; S190-C192 PolarHBondContact O-N 3.02Å
191	C	30.9	Very low	35.9	Very low	115 Å²	115	152.3 Å²	152.3	78%	0.777	78%	0.78	S	S	*	*			trans	-62.9	89.1	154.5	-172.9	0	0	0	0	106.1	E189	E189-C191 PolarHBondContact O-N 2.98Å
192	C	33.2	Very low	35.3	Very low	91 Å²	91	153 Å²	153	62%	0.615	78%	0.779	S	S	*	*			trans	-116.5	101.9	165.4	-170.7	0	0	0	0	104.9	S190 R194	S190-C192 PolarHBondContact O-N 3.02Å; C192-R194 PolarHBondContact O-N 3.34Å
193	Q	44.6	Very low	35	Very low	190 Å²	190	156.7 Å²	156.7	89%	0.888	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	33.2	-176.3	-74.2	-172.4	-55.6	0	0	114.4
194	R	40.3	Very low	35.2	Very low	223 Å²	223	155.8 Å²	155.8	84%	0.842	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-3.2	-175.1	-150.2	158.9	170.8	-179	-4.9	115.3	C192	C192-R194 PolarHBondContact O-N 3.34Å
195	C	33.1	Very low	35.1	Very low	117 Å²	117	155.6 Å²	155.6	79%	0.791	79%	0.794	S	S	*	*			trans	-120.7	82.4	-179.4	-51.3	0	0	0	0	110.4	S197	C195-S197 PolarHBondContact O-N 3.14Å
196	Q	37	Very low	34.7	Very low	193 Å²	193	157.2 Å²	157.2	90%	0.902	80%	0.795	S	S	*	*			trans	-77.1	68.9	170.1	-69.3	-177.6	-4.5	0	0	110.9
197	S	34.4	Very low	34.6	Very low	115 Å²	115	153.2 Å²	153.2	80%	0.804	80%	0.796	S	S	*	*			trans	-143	91.6	167.4	-79	0	0	0	0	110.1	C195 G199	C195-S197 PolarHBondContact O-N 3.14Å; S197-G199 PolarHBondContact O-N 3.48Å
198	F	32.1	Very low	34.1	Very low	206 Å²	206	152.9 Å²	152.9	90%	0.904	79%	0.793	S	S	*	*			trans	-72.3	108.6	168.7	-111.2	-104.5	0	0	0	108.2
199	G	35.6	Very low	34	Very low	58 Å²	58	149.8 Å²	149.8	60%	0.598	80%	0.796	S	S	*	*			trans	-116.3	113.3	169.5	0	0	0	0	0	109.3	S197	S197-G199 PolarHBondContact O-N 3.48Å
200	F	35.8	Very low	33.8	Very low	203 Å²	203	153.1 Å²	153.1	89%	0.89	81%	0.811	S	S	*	*			trans	-56.1	135.1	-175.8	-91.7	-111.6	0	0	0	113.6
201	W	31.3	Very low	33.6	Very low	232 Å²	232	155.9 Å²	155.9	88%	0.879	82%	0.818	S	S	*	*			trans	-97.8	109.7	170.6	-75.9	79.9	0	0	0	109.6
202	H	29.4	Very low	33.7	Very low	166 Å²	166	158.1 Å²	158.1	77%	0.769	82%	0.82	S	S	*	*			trans	-80.5	118.1	175.7	-171.7	-115.2	0	0	0	110.3
203	F	33.2	Very low	33.8	Very low	173 Å²	173	161.8 Å²	161.8	76%	0.759	83%	0.831	S	S	*	*			trans	-77.5	113.6	174.3	-79.7	-101.1	0	0	0	109.9
204	L	32	Very low	33.1	Very low	145 Å²	145	160.1 Å²	160.1	76%	0.759	83%	0.828	S	S	*	*			trans	-96.8	94.1	162.7	-95.8	151.5	0	0	0	108.5	L206	L204-L206 PolarHBondContact O-N 2.89Å
205	L	32.9	Very low	32.7	Very low	152 Å²	152	156.2 Å²	156.2	80%	0.796	83%	0.827	S	S	*	*			trans	-72.7	101.1	164.2	-117.8	110.7	0	0	0	107.5	A207	L205-A207 PolarHBondContact O-N 2.76Å
206	L	31.1	Very low	32.7	Very low	158 Å²	158	158.8 Å²	158.8	83%	0.827	83%	0.83	S	S	*	*			trans	-84.8	95.5	161.6	-81	162.4	0	0	0	107.4	L204 A208	L204-L206 PolarHBondContact O-N 2.89Å; L206-A208 PolarHBondContact O-N 3.05Å
207	A	31.5	Very low	32.3	Very low	98 Å²	98	156.4 Å²	156.4	81%	0.81	82%	0.824	S	S	*	*			trans	-78.5	103.7	159.6	0	0	0	0	0	107	L205	L205-A207 PolarHBondContact O-N 2.76Å
208	A	26.5	Very low	32.2	Very low	85 Å²	85	159.5 Å²	159.5	70%	0.702	83%	0.826	S	S	*	*			trans	-121.4	134.6	166.6	0	0	0	0	0	107.5	L206	L206-A208 PolarHBondContact O-N 3.05Å
209	V	33.5	Very low	32.2	Very low	133 Å²	133	155.7 Å²	155.7	81%	0.806	82%	0.819	S	S	*	*			trans	135.6	92.1	157.4	177	0	0	0	0	108.6
210	E	33.5	Very low	31.9	Very low	265 Å²	265	164.5 Å²	164.5	100%	1.238	84%	0.84	S	S	*	*			trans	43.6	0	148.5	-59.1	179.1	155.1	0	0	120.2

Retrieved 210 of 210 residues in 252.5 ms (Link to these results)

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