A0A096N6R5_PAPAN Loading...

Centromere protein S

AlphaFold DB , UniProt , Accession A0A096N6R5, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 137 aa.

						>A0A096N6R5_PAPAN|A0A096N6R5
MEEEAETEEQRFSYQQRLKAAVHYTVGCLCEEVALDKEMQFSKQTIAAISELTFRQCENFAKDLEMFARHAKRTTINTEDVKLLARRSNSLLKYITDKSEEIAQINLERKAQKKKKSEDGGKNSREPAEAGVVESEN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	65.1	Low	79.9	Confident	190 Å²	190	135.5 Å²	135.5	94%	0.936	65%	0.649	S	S	*	*				0	-64.7	0	-156.9	173.4	-75.7	0	0	111.9	E4 A5	M1-E4 WeakPolarHBondContact CA-OE2 3.4Å; M1-E4 PolarHBondContact N-OE2 3.43Å; M1-A5 PolarHBondContact O-N 2.75Å; M1-A5 VanDerWaalsContact O-N 3.16Å
2	E	70.5	Confident	81.2	Confident	169 Å²	169	134.3 Å²	134.3	79%	0.79	64%	0.639	S	S	*	*	H	α-helix	trans	-68.5	-47.8	177.2	-70.6	177.9	175.5	0	0	112.8	E4 A5 E6	E2-E4 VanDerWaalsContact C-N 3.3Å; E2-E4 PolarHBondContact O-N 3.1Å; E2-A5 PolarHBondContact O-N 3.49Å; E2-E6 PolarHBondContact O-N 3.4Å; E2-E6 VanDerWaalsContact O-N 3.07Å
3	E	69.9	Low	82.3	Confident	161 Å²	161	128.5 Å²	128.5	75%	0.752	62%	0.622	S	S	*	*	H	α-helix	trans	-62.2	-35.3	176	-69.3	-176	161.1	0	0	113	E6 T7	E3-E6 PolarHBondContact O-N 3.25Å; E3-T7 VanDerWaalsContact O-CG2 3.31Å; E3-T7 WeakPolarHBondContact O-CG2 3.49Å; E3-T7 PolarHBondContact O-N 3.15Å; E3-T7 VanDerWaalsContact O-N 3.11Å
4	E	73.2	Confident	83.4	Confident	125 Å²	125	128.5 Å²	128.5	58%	0.584	61%	0.614	S	S	*	*	H	α-helix	trans	-65.7	-42.9	176.2	-75.3	165.9	144.8	0	0	111.1	M1 E2 E6 T7 E8	M1-E4 WeakPolarHBondContact CA-OE2 3.4Å; M1-E4 PolarHBondContact N-OE2 3.43Å; E2-E4 VanDerWaalsContact C-N 3.3Å; E2-E4 PolarHBondContact O-N 3.1Å; E4-E6 PolarHBondContact O-N 3.45Å; E4-T7 PolarHBondContact O-N 3.23Å; E4-T7 PolarHBondContact O-OG1 3.15Å; E4-E8 PolarHBondContact O-N 3.37Å; E4-E8 VanDerWaalsContact O-N 3.08Å
5	A	77.1	Confident	84.3	Confident	55 Å²	55	125.3 Å²	125.3	46%	0.455	60%	0.598	S	S	.	*	H	α-helix	trans	-63	-41.8	177	0	0	0	0	0	112.2	M1 E2 T7 E8 E9	M1-A5 PolarHBondContact O-N 2.75Å; M1-A5 VanDerWaalsContact O-N 3.16Å; E2-A5 PolarHBondContact O-N 3.49Å; A5-T7 VanDerWaalsContact C-N 3.33Å; A5-T7 PolarHBondContact O-N 3.38Å; A5-E8 PolarHBondContact O-N 3.16Å; A5-E9 PolarHBondContact O-N 3.11Å
6	E	76	Confident	85.2	Confident	122 Å²	122	122.8 Å²	122.8	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-61.6	-39.6	175	-72.7	-174.9	173.7	0	0	112.1	E2 E3 E4 E8 E9 Q10	E2-E6 PolarHBondContact O-N 3.4Å; E2-E6 VanDerWaalsContact O-N 3.07Å; E3-E6 PolarHBondContact O-N 3.25Å; E4-E6 PolarHBondContact O-N 3.45Å; E6-E8 PolarHBondContact O-N 3.04Å; E6-E9 PolarHBondContact O-N 3.1Å; E6-Q10 VanDerWaalsContact O-CG 3.26Å; E6-Q10 WeakPolarHBondContact O-CG 3.46Å; E6-Q10 PolarHBondContact O-N 3.38Å; E6-Q10 VanDerWaalsContact O-N 3.09Å
7	T	84	Confident	86	Confident	69 Å²	69	124.8 Å²	124.8	42%	0.423	59%	0.586	S	S	.	*	H	α-helix	trans	-67.8	-34.2	177.4	64.2	0	0	0	0	113.1	E3 E4 A5 R11	E3-T7 VanDerWaalsContact O-CG2 3.31Å; E3-T7 WeakPolarHBondContact O-CG2 3.49Å; E3-T7 PolarHBondContact O-N 3.15Å; E3-T7 VanDerWaalsContact O-N 3.11Å; E4-T7 PolarHBondContact O-N 3.23Å; E4-T7 PolarHBondContact O-OG1 3.15Å; A5-T7 VanDerWaalsContact C-N 3.33Å; A5-T7 PolarHBondContact O-N 3.38Å; T7-R11 WeakPolarHBondContact O-CG 3.38Å; T7-R11 PolarHBondContact O-N 3.5Å; T7-R11 VanDerWaalsContact O-N 3.11Å
8	E	87.5	Confident	86.7	Confident	138 Å²	138	121.9 Å²	121.9	65%	0.645	57%	0.574	S	S	*	*	H	α-helix	trans	-69.5	-42.8	176.3	-74.2	-176	173.4	0	0	111.8	E4 A5 E6 Q10 R11 F12	E4-E8 PolarHBondContact O-N 3.37Å; E4-E8 VanDerWaalsContact O-N 3.08Å; A5-E8 PolarHBondContact O-N 3.16Å; E6-E8 PolarHBondContact O-N 3.04Å; E8-Q10 PolarHBondContact O-N 3.24Å; E8-R11 PolarHBondContact O-N 2.94Å; E8-F12 WeakPolarHBondContact O-CB 3.43Å; E8-F12 PolarHBondContact O-N 2.93Å
9	E	89.8	Confident	87.3	Confident	143 Å²	143	117.8 Å²	117.8	67%	0.668	55%	0.554	S	S	*	*	H	α-helix	trans	-62.8	-43.3	177.4	-171.3	175.9	-171.6	0	0	111.5	A5 E6 R11 F12 S13	A5-E9 PolarHBondContact O-N 3.11Å; E6-E9 PolarHBondContact O-N 3.1Å; E9-R11 PolarHBondContact O-N 3.49Å; E9-F12 PolarHBondContact O-N 3.36Å; E9-S13 WeakPolarHBondContact O-CB 3.32Å; E9-S13 PolarHBondContact O-N 3.31Å
10	Q	92.5	Very high	87.9	Confident	128 Å²	128	115 Å²	115	60%	0.598	55%	0.552	S	S	*	*	H	α-helix	trans	-60.8	-44.5	175.2	-72.5	173.5	10.2	0	0	112	E6 E8 S13 Y14	E6-Q10 VanDerWaalsContact O-CG 3.26Å; E6-Q10 WeakPolarHBondContact O-CG 3.46Å; E6-Q10 PolarHBondContact O-N 3.38Å; E6-Q10 VanDerWaalsContact O-N 3.09Å; E8-Q10 PolarHBondContact O-N 3.24Å; Q10-S13 PolarHBondContact O-N 3.38Å; Q10-Y14 WeakPolarHBondContact O-CB 3.49Å; Q10-Y14 PolarHBondContact O-N 3.19Å
11	R	93.9	Very high	88.4	Confident	190 Å²	190	112.1 Å²	112.1	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-62.5	-44.1	176.3	-79.3	178.9	176.7	-174.2	2.2	111.6	T7 E8 E9 Y14 Q15	T7-R11 WeakPolarHBondContact O-CG 3.38Å; T7-R11 PolarHBondContact O-N 3.5Å; T7-R11 VanDerWaalsContact O-N 3.11Å; E8-R11 PolarHBondContact O-N 2.94Å; E9-R11 PolarHBondContact O-N 3.49Å; R11-Y14 PolarHBondContact O-N 3.2Å; R11-Q15 WeakPolarHBondContact O-CB 3.34Å; R11-Q15 PolarHBondContact O-N 3.47Å
12	F	94.8	Very high	90	Very high	121 Å²	121	104.9 Å²	104.9	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-60.2	-51.6	177.8	179.4	-99.6	0	0	0	111.2	E8 E9 Y14 Q15 Q16	E8-F12 WeakPolarHBondContact O-CB 3.43Å; E8-F12 PolarHBondContact O-N 2.93Å; E9-F12 PolarHBondContact O-N 3.36Å; F12-Y14 VanDerWaalsContact C-N 3.33Å; F12-Y14 PolarHBondContact O-N 3.11Å; F12-Q15 PolarHBondContact O-N 2.96Å; F12-Q16 HydrophobicContact CD1-CG 4.25Å; F12-Q16 HydrophobicContact CE1-CG 3.85Å; F12-Q16 HydrophobicContact CE2-CG 4.37Å; F12-Q16 HydrophobicContact CZ-CG 3.92Å; F12-Q16 WeakPolarHBondContact O-CG 3.33Å; F12-Q16 PolarHBondContact O-N 3.31Å
13	S	96.4	Very high	91.3	Very high	60 Å²	60	100.6 Å²	100.6	42%	0.42	49%	0.493	S	S	.	.	H	α-helix	trans	-59.3	-42	177.9	174.8	0	0	0	0	112.4	E9 Q10 Q16 R17	E9-S13 WeakPolarHBondContact O-CB 3.32Å; E9-S13 PolarHBondContact O-N 3.31Å; Q10-S13 PolarHBondContact O-N 3.38Å; S13-Q16 PolarHBondContact O-N 3.09Å; S13-R17 WeakPolarHBondContact O-CG 3.42Å; S13-R17 PolarHBondContact O-N 3.46Å; S13-R17 VanDerWaalsContact O-N 3.12Å
14	Y	97.2	Very high	92.7	Very high	128 Å²	128	100.9 Å²	100.9	50%	0.502	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-45	175	-179	-115.2	0	0	0	112.3	Q10 R11 F12 Q16 R17 L18	Q10-Y14 WeakPolarHBondContact O-CB 3.49Å; Q10-Y14 PolarHBondContact O-N 3.19Å; R11-Y14 PolarHBondContact O-N 3.2Å; F12-Y14 VanDerWaalsContact C-N 3.33Å; F12-Y14 PolarHBondContact O-N 3.11Å; Y14-Q16 VanDerWaalsContact C-N 3.33Å; Y14-Q16 PolarHBondContact O-N 3.02Å; Y14-R17 PolarHBondContact O-N 3.03Å; Y14-L18 HydrophobicContact CD1-CD1 4.13Å; Y14-L18 HydrophobicContact CE1-CD1 3.6Å; Y14-L18 HydrophobicContact CE1-CG 4.3Å; Y14-L18 HydrophobicContact CE2-CD2 4.49Å; Y14-L18 HydrophobicContact CE2-CG 4.42Å; Y14-L18 PolarHBondContact O-N 3.23Å; Y14-L18 VanDerWaalsContact O-N 3.11Å
15	Q	97.3	Very high	93.9	Very high	81 Å²	81	98.7 Å²	98.7	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-40.9	177.2	-169.2	-178.7	8	0	0	111.8	R11 F12 R17 L18 K19 F54	R11-Q15 WeakPolarHBondContact O-CB 3.34Å; R11-Q15 PolarHBondContact O-N 3.47Å; F12-Q15 PolarHBondContact O-N 2.96Å; Q15-R17 VanDerWaalsContact C-N 3.34Å; Q15-R17 PolarHBondContact O-N 3.28Å; Q15-L18 PolarHBondContact O-N 3.04Å; Q15-K19 WeakPolarHBondContact O-CG 3.45Å; Q15-K19 PolarHBondContact O-N 3.16Å; Q15-F54 HydrophobicContact CG-CE1 4.19Å; Q15-F54 HydrophobicContact CG-CZ 3.82Å
16	Q	98	Very high	94.9	Very high	85 Å²	85	96.6 Å²	96.6	40%	0.397	47%	0.466	S	S	.	.	H	α-helix	trans	-61.5	-41.4	176.3	-69.3	-55.6	-38.9	0	0	112	F12 S13 Y14 L18 K19 A20	F12-Q16 HydrophobicContact CD1-CG 4.25Å; F12-Q16 HydrophobicContact CE1-CG 3.85Å; F12-Q16 HydrophobicContact CE2-CG 4.37Å; F12-Q16 HydrophobicContact CZ-CG 3.92Å; F12-Q16 WeakPolarHBondContact O-CG 3.33Å; F12-Q16 PolarHBondContact O-N 3.31Å; S13-Q16 PolarHBondContact O-N 3.09Å; Y14-Q16 VanDerWaalsContact C-N 3.33Å; Y14-Q16 PolarHBondContact O-N 3.02Å; Q16-L18 PolarHBondContact O-N 3Å; Q16-K19 PolarHBondContact O-N 3.07Å; Q16-A20 WeakPolarHBondContact O-CB 3.39Å; Q16-A20 PolarHBondContact O-N 3.4Å
17	R	98.4	Very high	96	Very high	157 Å²	157	91.8 Å²	91.8	59%	0.592	45%	0.448	S	S	*	.	H	α-helix	trans	-61.8	-41.8	175.3	-71.9	-177.4	-71.5	153.3	-7.2	112.3	S13 Y14 Q15 A20 A21	S13-R17 WeakPolarHBondContact O-CG 3.42Å; S13-R17 PolarHBondContact O-N 3.46Å; S13-R17 VanDerWaalsContact O-N 3.12Å; Y14-R17 PolarHBondContact O-N 3.03Å; Q15-R17 VanDerWaalsContact C-N 3.34Å; Q15-R17 PolarHBondContact O-N 3.28Å; R17-A20 PolarHBondContact O-N 3.08Å; R17-A21 PolarHBondContact O-N 3.5Å
18	L	98.5	Very high	96.7	Very high	72 Å²	72	90.5 Å²	90.5	38%	0.377	44%	0.442	S	S	.	.	H	α-helix	trans	-65.2	-44.6	175.6	-66.5	178.1	0	0	0	111.8	Y14 Q15 Q16 A20 A21 V22 F54	Y14-L18 HydrophobicContact CD1-CD1 4.13Å; Y14-L18 HydrophobicContact CE1-CD1 3.6Å; Y14-L18 HydrophobicContact CE1-CG 4.3Å; Y14-L18 HydrophobicContact CE2-CD2 4.49Å; Y14-L18 HydrophobicContact CE2-CG 4.42Å; Y14-L18 PolarHBondContact O-N 3.23Å; Y14-L18 VanDerWaalsContact O-N 3.11Å; Q15-L18 PolarHBondContact O-N 3.04Å; Q16-L18 PolarHBondContact O-N 3Å; L18-A20 VanDerWaalsContact C-N 3.32Å; L18-A20 PolarHBondContact O-N 3.44Å; L18-A21 PolarHBondContact O-N 3Å; L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 3.46Å; L18-F54 HydrophobicContact CB-CE2 3.88Å
19	K	98.6	Very high	97.3	Very high	44 Å²	44	88.2 Å²	88.2	19%	0.191	43%	0.434	C	S	.	.	H	α-helix	trans	-59.6	-42.5	175.9	-76.6	-171.4	172.2	-149.8	0	111.9	Q15 Q16 V22 H23 E51 F54	Q15-K19 WeakPolarHBondContact O-CG 3.45Å; Q15-K19 PolarHBondContact O-N 3.16Å; Q16-K19 PolarHBondContact O-N 3.07Å; K19-V22 PolarHBondContact O-N 3.05Å; K19-H23 WeakPolarHBondContact O-CB 3.31Å; K19-H23 PolarHBondContact O-N 3.13Å; K19-E51 IonicContact NZ-OE1 3.47Å; K19-E51 PolarHBondContact NZ-OE1 3.48Å; K19-E51 IonicContact NZ-OE2 3.51Å; K19-E51 PolarHBondContact NZ-OE2 3.01Å; K19-F54 HydrophobicContact CB-CD2 4.41Å; K19-F54 HydrophobicContact CB-CE2 4.45Å; K19-F54 HydrophobicContact CD-CD1 4.42Å; K19-F54 HydrophobicContact CD-CE1 4.45Å; K19-F54 HydrophobicContact CG-CD1 4.01Å; K19-F54 HydrophobicContact CG-CD2 3.58Å; K19-F54 HydrophobicContact CG-CE1 4.01Å; K19-F54 HydrophobicContact CG-CE2 3.56Å; K19-F54 HydrophobicContact CG-CG 3.82Å; K19-F54 HydrophobicContact CG-CZ 3.79Å
20	A	98.6	Very high	97.7	Very high	62 Å²	62	82 Å²	82	51%	0.512	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.6	0	0	0	0	0	112.3	Q16 R17 L18 H23 Y24	Q16-A20 WeakPolarHBondContact O-CB 3.39Å; Q16-A20 PolarHBondContact O-N 3.4Å; R17-A20 PolarHBondContact O-N 3.08Å; L18-A20 VanDerWaalsContact C-N 3.32Å; L18-A20 PolarHBondContact O-N 3.44Å; A20-H23 PolarHBondContact O-N 2.7Å; A20-Y24 PolarHBondContact O-N 2.77Å
21	A	98.8	Very high	98	Very high	55 Å²	55	82 Å²	82	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-64	-41.2	176.3	0	0	0	0	0	112.6	R17 L18 T25	R17-A21 PolarHBondContact O-N 3.5Å; L18-A21 PolarHBondContact O-N 3Å; A21-T25 PolarHBondContact O-N 3.12Å; A21-T25 PolarHBondContact O-OG1 2.89Å
22	V	98.7	Very high	98.2	Very high	37 Å²	37	78.9 Å²	78.9	22%	0.224	40%	0.399	C	S	.	.	H	α-helix	trans	-62.9	-46.2	173	171.8	0	0	0	0	110.4	L18 K19 Y24 T25 V26 T53 F54	L18-V22 WeakPolarHBondContact O-CG2 3.45Å; L18-V22 PolarHBondContact O-N 3.46Å; K19-V22 PolarHBondContact O-N 3.05Å; V22-Y24 VanDerWaalsContact C-N 3.34Å; V22-Y24 PolarHBondContact O-N 3.28Å; V22-T25 PolarHBondContact O-N 3.48Å; V22-V26 HydrophobicContact CG1-CG2 4.07Å; V22-V26 WeakPolarHBondContact O-CB 3.45Å; V22-V26 WeakPolarHBondContact O-CG2 3.41Å; V22-V26 PolarHBondContact O-N 2.67Å; V22-T53 HydrophobicContact CG1-CG2 4.25Å; V22-F54 HydrophobicContact CG2-CD2 4.19Å
23	H	98.8	Very high	98.4	Very high	79 Å²	79	76.3 Å²	76.3	37%	0.366	39%	0.393	S	S	.	.	H	α-helix	trans	-59.1	-44.3	-180	-171.8	81.8	0	0	0	112.6	K19 A20 V26 G27 S50	K19-H23 WeakPolarHBondContact O-CB 3.31Å; K19-H23 PolarHBondContact O-N 3.13Å; A20-H23 PolarHBondContact O-N 2.7Å; H23-V26 PolarHBondContact O-N 3.06Å; H23-G27 PolarHBondContact O-N 3.46Å; H23-S50 WeakPolarHBondContact CA-OG 3.49Å; H23-S50 VanDerWaalsContact CB-OG 3.32Å; H23-S50 WeakPolarHBondContact CB-OG 3.13Å; H23-S50 PolarHBondContact N-OG 3.45Å; H23-S50 WeakPolarHBondContact ND1-CB 3.37Å; H23-S50 PolarHBondContact ND1-OG 3.45Å
24	Y	98.8	Very high	98.5	Very high	168 Å²	168	73.9 Å²	73.9	66%	0.659	38%	0.377	S	S	*	.	H	α-helix	trans	-57	-51.9	175	173.5	-102.3	0	0	0	111.5	A20 V22 V26 G27 C28	A20-Y24 PolarHBondContact O-N 2.77Å; V22-Y24 VanDerWaalsContact C-N 3.34Å; V22-Y24 PolarHBondContact O-N 3.28Å; Y24-V26 PolarHBondContact O-N 2.91Å; Y24-G27 WeakPolarHBondContact O-CA 3.4Å; Y24-G27 PolarHBondContact O-N 2.72Å; Y24-G27 VanDerWaalsContact O-N 3.12Å; Y24-C28 PolarHBondContact O-N 3.02Å; Y24-C28 VanDerWaalsContact O-N 3.09Å; Y24-C28 PolarHBondContact O-SG 3.49Å
25	T	98.8	Very high	98.5	Very high	78 Å²	78	74 Å²	74	48%	0.479	39%	0.385	S	S	.	.	H	α-helix	trans	-65.4	-40.3	-177.7	-50.4	0	0	0	0	111.9	A21 V22 G27 C28 L29	A21-T25 PolarHBondContact O-N 3.12Å; A21-T25 PolarHBondContact O-OG1 2.89Å; V22-T25 PolarHBondContact O-N 3.48Å; T25-G27 VanDerWaalsContact C-N 3.29Å; T25-G27 PolarHBondContact O-N 2.94Å; T25-C28 PolarHBondContact O-N 3.34Å; T25-L29 HydrophobicContact CG2-CD1 4.48Å; T25-L29 WeakPolarHBondContact O-CG 3.49Å; T25-L29 PolarHBondContact O-N 3.04Å
26	V	98.8	Very high	98.6	Very high	12 Å²	12	75.4 Å²	75.4	7%	0.073	40%	0.395	C	S	.	.	H	α-helix	trans	-61.8	-39.9	173.9	167.5	0	0	0	0	110.8	V22 H23 Y24 L29 C30 I46 I49	V22-V26 HydrophobicContact CG1-CG2 4.07Å; V22-V26 WeakPolarHBondContact O-CB 3.45Å; V22-V26 WeakPolarHBondContact O-CG2 3.41Å; V22-V26 PolarHBondContact O-N 2.67Å; H23-V26 PolarHBondContact O-N 3.06Å; Y24-V26 PolarHBondContact O-N 2.91Å; V26-L29 PolarHBondContact O-N 3.25Å; V26-C30 WeakPolarHBondContact O-CB 3.33Å; V26-C30 PolarHBondContact O-N 3.06Å; V26-C30 PolarHBondContact O-SG 3.33Å; V26-C30 VanDerWaalsContact O-SG 3.33Å; V26-I46 HydrophobicContact CG1-CG2 4.27Å; V26-I49 HydrophobicContact CG1-CB 4.03Å; V26-I49 HydrophobicContact CG1-CG2 3.62Å
27	G	98.8	Very high	98.6	Very high	20 Å²	20	77.7 Å²	77.7	21%	0.206	40%	0.404	C	S	.	.	H	α-helix	trans	-56.2	-49.5	173.4	0	0	0	0	0	112.4	H23 Y24 T25 L29 C30 E31	H23-G27 PolarHBondContact O-N 3.46Å; Y24-G27 WeakPolarHBondContact O-CA 3.4Å; Y24-G27 PolarHBondContact O-N 2.72Å; Y24-G27 VanDerWaalsContact O-N 3.12Å; T25-G27 VanDerWaalsContact C-N 3.29Å; T25-G27 PolarHBondContact O-N 2.94Å; G27-L29 PolarHBondContact O-N 3.28Å; G27-C30 PolarHBondContact O-N 3.28Å; G27-E31 PolarHBondContact O-N 2.97Å
28	C	98.8	Very high	98.5	Very high	42 Å²	42	79.1 Å²	79.1	28%	0.284	42%	0.417	S	S	.	.	H	α-helix	trans	-59.4	-46.8	176.7	-61.8	0	0	0	0	112.3	Y24 T25 C30 E31 E32	Y24-C28 PolarHBondContact O-N 3.02Å; Y24-C28 VanDerWaalsContact O-N 3.09Å; Y24-C28 PolarHBondContact O-SG 3.49Å; T25-C28 PolarHBondContact O-N 3.34Å; C28-C30 VanDerWaalsContact C-N 3.35Å; C28-C30 PolarHBondContact O-N 3.47Å; C28-E31 WeakPolarHBondContact O-CB 3.28Å; C28-E31 PolarHBondContact O-N 3.4Å; C28-E31 VanDerWaalsContact O-N 3.16Å; C28-E32 PolarHBondContact O-N 3.33Å
29	L	98.8	Very high	98.5	Very high	91 Å²	91	80.4 Å²	80.4	48%	0.476	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-38.8	178.1	-67.9	172.4	0	0	0	112.2	T25 V26 G27 E31 E32 V33	T25-L29 HydrophobicContact CG2-CD1 4.48Å; T25-L29 WeakPolarHBondContact O-CG 3.49Å; T25-L29 PolarHBondContact O-N 3.04Å; V26-L29 PolarHBondContact O-N 3.25Å; G27-L29 PolarHBondContact O-N 3.28Å; L29-E31 VanDerWaalsContact C-N 3.29Å; L29-E31 PolarHBondContact O-N 2.97Å; L29-E32 PolarHBondContact O-N 2.84Å; L29-V33 WeakPolarHBondContact O-CG2 3.44Å; L29-V33 PolarHBondContact O-N 2.75Å
30	C	98.6	Very high	98.4	Very high	11 Å²	11	86 Å²	86	7%	0.074	45%	0.45	C	S	.	.	H	α-helix	trans	-64.8	-33.8	174.6	-75.9	0	0	0	0	112	V26 G27 C28 V33 A34 F41 I46	V26-C30 WeakPolarHBondContact O-CB 3.33Å; V26-C30 PolarHBondContact O-N 3.06Å; V26-C30 PolarHBondContact O-SG 3.33Å; V26-C30 VanDerWaalsContact O-SG 3.33Å; G27-C30 PolarHBondContact O-N 3.28Å; C28-C30 VanDerWaalsContact C-N 3.35Å; C28-C30 PolarHBondContact O-N 3.47Å; C30-V33 PolarHBondContact O-N 2.94Å; C30-A34 WeakPolarHBondContact O-CB 3.35Å; C30-A34 PolarHBondContact O-N 2.83Å; C30-F41 HydrophobicContact CB-CD2 4.01Å; C30-F41 HydrophobicContact CB-CE2 4.38Å; C30-F41 WeakPolarHBondContact O-CD2 3.36Å; C30-F41 WeakPolarHBondContact O-CE2 3.45Å; C30-I46 HydrophobicContact CB-CD1 4.37Å; C30-I46 HydrophobicContact CB-CG1 4.11Å
31	E	98.4	Very high	98.4	Very high	129 Å²	129	85.8 Å²	85.8	60%	0.603	44%	0.437	S	S	*	.	H	α-helix	trans	-67.7	-43.8	175.2	-173.4	165.4	-147	0	0	111.7	G27 C28 L29 V33 A34 L35	G27-E31 PolarHBondContact O-N 2.97Å; C28-E31 WeakPolarHBondContact O-CB 3.28Å; C28-E31 PolarHBondContact O-N 3.4Å; C28-E31 VanDerWaalsContact O-N 3.16Å; L29-E31 VanDerWaalsContact C-N 3.29Å; L29-E31 PolarHBondContact O-N 2.97Å; E31-V33 VanDerWaalsContact C-N 3.32Å; E31-V33 PolarHBondContact O-N 3.45Å; E31-A34 WeakPolarHBondContact O-CB 3.38Å; E31-A34 PolarHBondContact O-N 3.41Å; E31-L35 WeakPolarHBondContact O-CG 3.48Å; E31-L35 PolarHBondContact O-N 3.23Å
32	E	98.6	Very high	98.4	Very high	124 Å²	124	85.6 Å²	85.6	58%	0.579	43%	0.432	S	S	*	.	H	α-helix	trans	-57.2	-45.8	172.8	-69.1	173.8	-160.5	0	0	111.5	C28 L29 L35 D36	C28-E32 PolarHBondContact O-N 3.33Å; L29-E32 PolarHBondContact O-N 2.84Å; E32-L35 PolarHBondContact O-N 3.31Å; E32-D36 PolarHBondContact O-N 3.37Å
33	V	98.5	Very high	98.3	Very high	67 Å²	67	92.3 Å²	92.3	41%	0.406	46%	0.459	S	S	.	.	H	α-helix	trans	-68.7	-36.9	178.2	175.1	0	0	0	0	112	L29 C30 E31 L35 D36 K37 F41	L29-V33 WeakPolarHBondContact O-CG2 3.44Å; L29-V33 PolarHBondContact O-N 2.75Å; C30-V33 PolarHBondContact O-N 2.94Å; E31-V33 VanDerWaalsContact C-N 3.32Å; E31-V33 PolarHBondContact O-N 3.45Å; V33-L35 VanDerWaalsContact C-N 3.31Å; V33-L35 PolarHBondContact O-N 3.41Å; V33-D36 PolarHBondContact O-N 2.89Å; V33-K37 HydrophobicContact CG1-CG 4.16Å; V33-K37 WeakPolarHBondContact O-CB 3.48Å; V33-K37 WeakPolarHBondContact O-CG 3.4Å; V33-K37 PolarHBondContact O-N 2.98Å; V33-F41 HydrophobicContact CB-CE2 4.26Å; V33-F41 HydrophobicContact CG1-CE2 4.06Å; V33-F41 HydrophobicContact CG1-CZ 4.02Å
34	A	98.2	Very high	98.3	Very high	9 Å²	9	95.3 Å²	95.3	7%	0.074	47%	0.473	C	S	.	.	H	α-helix	trans	-60.4	-42.6	176.5	0	0	0	0	0	111.5	C30 E31 E38 M39 F41	C30-A34 WeakPolarHBondContact O-CB 3.35Å; C30-A34 PolarHBondContact O-N 2.83Å; E31-A34 WeakPolarHBondContact O-CB 3.38Å; E31-A34 PolarHBondContact O-N 3.41Å; A34-E38 WeakPolarHBondContact O-CA 3.46Å; A34-E38 PolarHBondContact O-N 3.04Å; A34-M39 CarbonylContact C-O 3.47Å; A34-M39 WeakPolarHBondContact CA-O 3.37Å; A34-M39 WeakPolarHBondContact CB-O 3.32Å; A34-M39 PolarHBondContact O-N 3.44Å; A34-M39 VanDerWaalsContact O-O 3.12Å; A34-F41 HydrophobicContact CB-CD2 3.96Å; A34-F41 HydrophobicContact CB-CE2 4.12Å
35	L	98.2	Very high	98.3	Very high	130 Å²	130	90.1 Å²	90.1	68%	0.681	46%	0.459	S	S	*	.	H	α-helix	trans	-67.6	-48.6	176.4	-67.2	171.6	0	0	0	111.6	E31 E32 V33 K37 E38	E31-L35 WeakPolarHBondContact O-CG 3.48Å; E31-L35 PolarHBondContact O-N 3.23Å; E32-L35 PolarHBondContact O-N 3.31Å; V33-L35 VanDerWaalsContact C-N 3.31Å; V33-L35 PolarHBondContact O-N 3.41Å; L35-K37 VanDerWaalsContact C-N 3.27Å; L35-K37 PolarHBondContact O-N 3.23Å; L35-E38 PolarHBondContact O-N 3.43Å
36	D	98.4	Very high	98.3	Very high	111 Å²	111	88 Å²	88	59%	0.594	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-32.6	179.5	179.1	67.7	0	0	0	113.2	E32 V33	E32-D36 PolarHBondContact O-N 3.37Å; V33-D36 PolarHBondContact O-N 2.89Å
37	K	98.1	Very high	98.3	Very high	134 Å²	134	89.4 Å²	89.4	58%	0.583	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	2.5	-178.2	-58.9	-53.3	-177.7	-141.9	0	114.4	V33 L35 M39	V33-K37 HydrophobicContact CG1-CG 4.16Å; V33-K37 WeakPolarHBondContact O-CB 3.48Å; V33-K37 WeakPolarHBondContact O-CG 3.4Å; V33-K37 PolarHBondContact O-N 2.98Å; L35-K37 VanDerWaalsContact C-N 3.27Å; L35-K37 PolarHBondContact O-N 3.23Å; K37-M39 PolarHBondContact O-N 3.04Å
38	E	97.8	Very high	98.3	Very high	186 Å²	186	91.4 Å²	91.4	87%	0.869	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	39.8	-176.7	-58.5	-177.7	173.5	0	0	112.9	A34 L35	A34-E38 WeakPolarHBondContact O-CA 3.46Å; A34-E38 PolarHBondContact O-N 3.04Å; L35-E38 PolarHBondContact O-N 3.43Å
39	M	96.9	Very high	98.3	Very high	100 Å²	100	92.1 Å²	92.1	49%	0.493	47%	0.472	S	S	.	.			trans	-132.4	153.8	-176.3	-176.5	179.2	68.3	0	0	110.4	A34 K37 F41	A34-M39 CarbonylContact C-O 3.47Å; A34-M39 WeakPolarHBondContact CA-O 3.37Å; A34-M39 WeakPolarHBondContact CB-O 3.32Å; A34-M39 PolarHBondContact O-N 3.44Å; A34-M39 VanDerWaalsContact O-O 3.12Å; K37-M39 PolarHBondContact O-N 3.04Å; M39-F41 HydrophobicContact CE-CE1 3.98Å; M39-F41 HydrophobicContact CE-CZ 3.96Å
40	Q	96.8	Very high	98.3	Very high	161 Å²	161	88.1 Å²	88.1	75%	0.752	45%	0.452	S	S	*	.			trans	-104.3	141.9	178.3	-59.3	-59.5	-54.3	0	0	111.9
41	F	98.3	Very high	98.3	Very high	57 Å²	57	90.7 Å²	90.7	25%	0.25	46%	0.463	C	S	.	.			trans	-100.2	136.6	169.3	-66.5	-78.2	0	0	0	110.8	C30 V33 A34 M39 T45 I46	C30-F41 HydrophobicContact CB-CD2 4.01Å; C30-F41 HydrophobicContact CB-CE2 4.38Å; C30-F41 WeakPolarHBondContact O-CD2 3.36Å; C30-F41 WeakPolarHBondContact O-CE2 3.45Å; V33-F41 HydrophobicContact CB-CE2 4.26Å; V33-F41 HydrophobicContact CG1-CE2 4.06Å; V33-F41 HydrophobicContact CG1-CZ 4.02Å; A34-F41 HydrophobicContact CB-CD2 3.96Å; A34-F41 HydrophobicContact CB-CE2 4.12Å; M39-F41 HydrophobicContact CE-CE1 3.98Å; M39-F41 HydrophobicContact CE-CZ 3.96Å; F41-T45 HydrophobicContact CD1-CG2 3.9Å; F41-I46 HydrophobicContact CB-CD1 4.12Å; F41-I46 HydrophobicContact CB-CG1 3.87Å
42	S	98.6	Very high	98.3	Very high	51 Å²	51	89.1 Å²	89.1	36%	0.357	46%	0.458	S	S	.	.			trans	-71.5	155.6	170.4	79.5	0	0	0	0	111.1	Q44 T45 I46	S42-Q44 PolarHBondContact O-N 3.05Å; S42-T45 WeakPolarHBondContact O-CB 3.5Å; S42-T45 PolarHBondContact O-N 3.39Å; S42-T45 VanDerWaalsContact O-N 3.09Å; S42-T45 WeakPolarHBondContact OG-CB 3.48Å; S42-T45 PolarHBondContact OG-N 3.29Å; S42-T45 PolarHBondContact OG-OG1 3.34Å; S42-I46 PolarHBondContact O-N 2.91Å
43	K	98.5	Very high	98.3	Very high	178 Å²	178	85.9 Å²	85.9	77%	0.774	45%	0.447	S	S	*	.	H	α-helix	trans	-57.7	-37.4	175.3	-65.5	-176.3	179.5	-178.7	0	111.7	I46 A47	K43-I46 PolarHBondContact O-N 3.44Å; K43-A47 WeakPolarHBondContact O-CB 3.44Å; K43-A47 PolarHBondContact O-N 3.14Å
44	Q	98.6	Very high	98.3	Very high	142 Å²	142	84.7 Å²	84.7	66%	0.664	44%	0.436	S	S	*	.	H	α-helix	trans	-67.4	-39.5	178.2	-62.1	80.5	-2.6	0	0	111.2	S42 A47 A48	S42-Q44 PolarHBondContact O-N 3.05Å; Q44-A47 PolarHBondContact O-N 3.47Å; Q44-A48 WeakPolarHBondContact O-CB 3.13Å; Q44-A48 PolarHBondContact O-N 2.75Å
45	T	98.8	Very high	98.3	Very high	59 Å²	59	90.7 Å²	90.7	36%	0.362	46%	0.457	S	S	.	.	H	α-helix	trans	-62.5	-46.9	174.7	-55.6	0	0	0	0	111.1	F41 S42 A47 A48 I49	F41-T45 HydrophobicContact CD1-CG2 3.9Å; S42-T45 WeakPolarHBondContact O-CB 3.5Å; S42-T45 PolarHBondContact O-N 3.39Å; S42-T45 VanDerWaalsContact O-N 3.09Å; S42-T45 WeakPolarHBondContact OG-CB 3.48Å; S42-T45 PolarHBondContact OG-N 3.29Å; S42-T45 PolarHBondContact OG-OG1 3.34Å; T45-A47 VanDerWaalsContact C-N 3.34Å; T45-A47 PolarHBondContact O-N 2.91Å; T45-A48 PolarHBondContact O-N 3.21Å; T45-I49 HydrophobicContact CG2-CD1 4.03Å; T45-I49 WeakPolarHBondContact O-CG1 3.26Å; T45-I49 PolarHBondContact O-N 3.29Å
46	I	98.8	Very high	98.3	Very high	33 Å²	33	87.8 Å²	87.8	17%	0.169	44%	0.44	C	S	.	.	H	α-helix	trans	-61.6	-43.6	177.3	-62.7	171.8	0	0	0	110.5	V26 C30 F41 S42 K43 A48 I49 S50	V26-I46 HydrophobicContact CG1-CG2 4.27Å; C30-I46 HydrophobicContact CB-CD1 4.37Å; C30-I46 HydrophobicContact CB-CG1 4.11Å; F41-I46 HydrophobicContact CB-CD1 4.12Å; F41-I46 HydrophobicContact CB-CG1 3.87Å; S42-I46 PolarHBondContact O-N 2.91Å; K43-I46 PolarHBondContact O-N 3.44Å; I46-A48 VanDerWaalsContact C-N 3.34Å; I46-A48 PolarHBondContact O-N 3.32Å; I46-I49 PolarHBondContact O-N 3.45Å; I46-S50 WeakPolarHBondContact O-CB 3.45Å; I46-S50 PolarHBondContact O-N 3.5Å
47	A	98.7	Very high	98.3	Very high	43 Å²	43	85.7 Å²	85.7	36%	0.355	43%	0.433	S	S	.	.	H	α-helix	trans	-60.7	-41.3	175.5	0	0	0	0	0	112.6	K43 Q44 T45 S50 E51	K43-A47 WeakPolarHBondContact O-CB 3.44Å; K43-A47 PolarHBondContact O-N 3.14Å; Q44-A47 PolarHBondContact O-N 3.47Å; T45-A47 VanDerWaalsContact C-N 3.34Å; T45-A47 PolarHBondContact O-N 2.91Å; A47-S50 WeakPolarHBondContact O-CB 3.2Å; A47-S50 PolarHBondContact O-N 3.43Å; A47-E51 PolarHBondContact O-N 3.02Å
48	A	98.8	Very high	98.3	Very high	61 Å²	61	84.5 Å²	84.5	50%	0.504	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-42.8	176.8	0	0	0	0	0	112.3	Q44 T45 I46 S50 E51 L52	Q44-A48 WeakPolarHBondContact O-CB 3.13Å; Q44-A48 PolarHBondContact O-N 2.75Å; T45-A48 PolarHBondContact O-N 3.21Å; I46-A48 VanDerWaalsContact C-N 3.34Å; I46-A48 PolarHBondContact O-N 3.32Å; A48-S50 VanDerWaalsContact C-N 3.32Å; A48-E51 PolarHBondContact O-N 3.18Å; A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 PolarHBondContact O-N 3.39Å
49	I	98.8	Very high	98.3	Very high	57 Å²	57	79.4 Å²	79.4	29%	0.292	41%	0.408	S	S	.	.	H	α-helix	trans	-62.8	-41.8	174.9	-65.2	167	0	0	0	110.4	V26 T45 I46 L52 T53	V26-I49 HydrophobicContact CG1-CB 4.03Å; V26-I49 HydrophobicContact CG1-CG2 3.62Å; T45-I49 HydrophobicContact CG2-CD1 4.03Å; T45-I49 WeakPolarHBondContact O-CG1 3.26Å; T45-I49 PolarHBondContact O-N 3.29Å; I46-I49 PolarHBondContact O-N 3.45Å; I49-L52 PolarHBondContact O-N 3.05Å; I49-T53 WeakPolarHBondContact O-CB 3.32Å; I49-T53 PolarHBondContact O-N 3.32Å; I49-T53 PolarHBondContact O-OG1 3.42Å
50	S	98.8	Very high	98.4	Very high	7 Å²	7	78.6 Å²	78.6	5%	0.049	40%	0.402	C	S	.	.	H	α-helix	trans	-60	-48.3	175.9	178	0	0	0	0	112.1	H23 I46 A47 A48 L52 T53 F54	H23-S50 WeakPolarHBondContact CA-OG 3.49Å; H23-S50 VanDerWaalsContact CB-OG 3.32Å; H23-S50 WeakPolarHBondContact CB-OG 3.13Å; H23-S50 PolarHBondContact N-OG 3.45Å; H23-S50 WeakPolarHBondContact ND1-CB 3.37Å; H23-S50 PolarHBondContact ND1-OG 3.45Å; I46-S50 WeakPolarHBondContact O-CB 3.45Å; I46-S50 PolarHBondContact O-N 3.5Å; A47-S50 WeakPolarHBondContact O-CB 3.2Å; A47-S50 PolarHBondContact O-N 3.43Å; A48-S50 VanDerWaalsContact C-N 3.32Å; S50-L52 VanDerWaalsContact C-N 3.35Å; S50-T53 PolarHBondContact O-N 3.21Å; S50-F54 WeakPolarHBondContact O-CB 3.4Å; S50-F54 PolarHBondContact O-N 3.43Å
51	E	98.4	Very high	98.5	Very high	66 Å²	66	73.7 Å²	73.7	31%	0.308	39%	0.389	S	S	.	.	H	α-helix	trans	-67.8	-36	179.2	-174.7	60.9	-151.3	0	0	111.9	K19 A47 A48 R55	K19-E51 IonicContact NZ-OE1 3.47Å; K19-E51 PolarHBondContact NZ-OE1 3.48Å; K19-E51 IonicContact NZ-OE2 3.51Å; K19-E51 PolarHBondContact NZ-OE2 3.01Å; A47-E51 PolarHBondContact O-N 3.02Å; A48-E51 PolarHBondContact O-N 3.18Å; E51-R55 WeakPolarHBondContact O-CG 3.45Å; E51-R55 PolarHBondContact O-N 3.13Å; E51-R55 VanDerWaalsContact O-N 3.09Å; E51-R55 PolarHBondContact O-NE 3.33Å; E51-R55 IonicContact OE1-NE 2.75Å
52	L	98.8	Very high	98.5	Very high	95 Å²	95	75.6 Å²	75.6	50%	0.497	40%	0.397	S	S	.	.	H	α-helix	trans	-62.2	-47.4	173.1	177.6	62.4	0	0	0	111.1	A48 I49 S50 F54 R55 Q56	A48-L52 WeakPolarHBondContact O-CB 3.34Å; A48-L52 PolarHBondContact O-N 3.39Å; I49-L52 PolarHBondContact O-N 3.05Å; S50-L52 VanDerWaalsContact C-N 3.35Å; L52-F54 PolarHBondContact O-N 2.95Å; L52-R55 PolarHBondContact O-N 3.19Å; L52-Q56 WeakPolarHBondContact O-CB 3.35Å; L52-Q56 PolarHBondContact O-N 2.99Å
53	T	98.8	Very high	98.5	Very high	56 Å²	56	76.4 Å²	76.4	34%	0.344	40%	0.398	S	S	.	.	H	α-helix	trans	-61.7	-45	179.3	-56.6	0	0	0	0	111	V22 I49 S50 R55 Q56 C57	V22-T53 HydrophobicContact CG1-CG2 4.25Å; I49-T53 WeakPolarHBondContact O-CB 3.32Å; I49-T53 PolarHBondContact O-N 3.32Å; I49-T53 PolarHBondContact O-OG1 3.42Å; S50-T53 PolarHBondContact O-N 3.21Å; T53-R55 PolarHBondContact O-N 3.26Å; T53-Q56 WeakPolarHBondContact O-CB 3.48Å; T53-Q56 PolarHBondContact O-N 3.35Å; T53-C57 PolarHBondContact O-N 3.04Å; T53-C57 PolarHBondContact O-SG 2.84Å
54	F	98.4	Very high	98.5	Very high	42 Å²	42	69.3 Å²	69.3	18%	0.184	37%	0.368	C	S	.	.	H	α-helix	trans	-60.4	-45.7	178.1	-170.4	-88.3	0	0	0	112.1	Q15 L18 K19 V22 S50 L52 Q56 C57	Q15-F54 HydrophobicContact CG-CE1 4.19Å; Q15-F54 HydrophobicContact CG-CZ 3.82Å; L18-F54 HydrophobicContact CB-CE2 3.88Å; K19-F54 HydrophobicContact CB-CD2 4.41Å; K19-F54 HydrophobicContact CB-CE2 4.45Å; K19-F54 HydrophobicContact CD-CD1 4.42Å; K19-F54 HydrophobicContact CD-CE1 4.45Å; K19-F54 HydrophobicContact CG-CD1 4.01Å; K19-F54 HydrophobicContact CG-CD2 3.58Å; K19-F54 HydrophobicContact CG-CE1 4.01Å; K19-F54 HydrophobicContact CG-CE2 3.56Å; K19-F54 HydrophobicContact CG-CG 3.82Å; K19-F54 HydrophobicContact CG-CZ 3.79Å; V22-F54 HydrophobicContact CG2-CD2 4.19Å; S50-F54 WeakPolarHBondContact O-CB 3.4Å; S50-F54 PolarHBondContact O-N 3.43Å; L52-F54 PolarHBondContact O-N 2.95Å; F54-Q56 VanDerWaalsContact C-N 3.34Å; F54-C57 WeakPolarHBondContact O-CB 3.44Å; F54-C57 PolarHBondContact O-N 3.49Å
55	R	98.3	Very high	98.5	Very high	135 Å²	135	68.2 Å²	68.2	51%	0.509	36%	0.363	S	S	.	.	H	α-helix	trans	-66.3	-35.1	175.6	-74.7	-177.7	-71.9	137.5	-5.1	112.5	E51 L52 T53 C57 E58	E51-R55 WeakPolarHBondContact O-CG 3.45Å; E51-R55 PolarHBondContact O-N 3.13Å; E51-R55 VanDerWaalsContact O-N 3.09Å; E51-R55 PolarHBondContact O-NE 3.33Å; E51-R55 IonicContact OE1-NE 2.75Å; L52-R55 PolarHBondContact O-N 3.19Å; T53-R55 PolarHBondContact O-N 3.26Å; R55-C57 VanDerWaalsContact C-N 3.25Å; R55-C57 PolarHBondContact O-N 3.33Å; R55-E58 WeakPolarHBondContact O-CB 3.44Å; R55-E58 PolarHBondContact O-N 3.46Å; R55-E58 VanDerWaalsContact O-N 3.14Å
56	Q	98.3	Very high	98.5	Very high	69 Å²	69	69.9 Å²	69.9	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-31.7	178.8	-172	58.1	39.7	0	0	112.4	L52 T53 F54 E58 N59 F60	L52-Q56 WeakPolarHBondContact O-CB 3.35Å; L52-Q56 PolarHBondContact O-N 2.99Å; T53-Q56 WeakPolarHBondContact O-CB 3.48Å; T53-Q56 PolarHBondContact O-N 3.35Å; F54-Q56 VanDerWaalsContact C-N 3.34Å; Q56-E58 PolarHBondContact O-N 3.45Å; Q56-N59 PolarHBondContact O-N 2.85Å; Q56-F60 HydrophobicContact CG-CD1 4.36Å; Q56-F60 HydrophobicContact CG-CD2 4.16Å; Q56-F60 HydrophobicContact CG-CE1 3.91Å; Q56-F60 HydrophobicContact CG-CE2 3.65Å; Q56-F60 HydrophobicContact CG-CZ 3.53Å; Q56-F60 WeakPolarHBondContact O-CG 3.21Å; Q56-F60 PolarHBondContact O-N 3.46Å
57	C	98.3	Very high	98.5	Very high	67 Å²	67	69.8 Å²	69.8	45%	0.453	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-31.9	174.6	-69.1	0	0	0	0	113	T53 F54 R55 F60 A61	T53-C57 PolarHBondContact O-N 3.04Å; T53-C57 PolarHBondContact O-SG 2.84Å; F54-C57 WeakPolarHBondContact O-CB 3.44Å; F54-C57 PolarHBondContact O-N 3.49Å; R55-C57 VanDerWaalsContact C-N 3.25Å; R55-C57 PolarHBondContact O-N 3.33Å; C57-F60 PolarHBondContact O-N 3.28Å; C57-A61 WeakPolarHBondContact O-CB 3.07Å; C57-A61 PolarHBondContact O-N 3.29Å
58	E	97.7	Very high	98.5	Very high	109 Å²	109	67.9 Å²	67.9	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-44.4	177.1	-170.5	-175.1	162.1	0	0	111.3	R55 Q56 A61 K62	R55-E58 WeakPolarHBondContact O-CB 3.44Å; R55-E58 PolarHBondContact O-N 3.46Å; R55-E58 VanDerWaalsContact O-N 3.14Å; Q56-E58 PolarHBondContact O-N 3.45Å; E58-A61 PolarHBondContact O-N 3.47Å; E58-K62 HydrophobicContact CG-CD 4.32Å; E58-K62 WeakPolarHBondContact O-CG 3.15Å; E58-K62 PolarHBondContact O-N 3.23Å; E58-K62 VanDerWaalsContact O-N 3.1Å; E58-K62 WeakPolarHBondContact OE1-CE 3.41Å; E58-K62 IonicContact OE1-NZ 3.91Å; E58-K62 PolarHBondContact OE1-NZ 2.96Å
59	N	97.4	Very high	98.5	Very high	79 Å²	79	72.6 Å²	72.6	42%	0.422	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-46.2	175.6	-65.6	-32.6	0	0	0	110.7	Q56 A61 K62 D63	Q56-N59 PolarHBondContact O-N 2.85Å; N59-A61 PolarHBondContact O-N 3.41Å; N59-K62 PolarHBondContact O-N 2.83Å; N59-D63 WeakPolarHBondContact O-CB 3.32Å; N59-D63 PolarHBondContact O-N 3.4Å
60	F	98.6	Very high	98.5	Very high	84 Å²	84	78 Å²	78	37%	0.368	38%	0.378	S	S	.	.	H	α-helix	trans	-60.6	-44.9	177.7	-66.2	-19.7	0	0	0	112.4	Q56 C57 K62 D63 L64 L84	Q56-F60 HydrophobicContact CG-CD1 4.36Å; Q56-F60 HydrophobicContact CG-CD2 4.16Å; Q56-F60 HydrophobicContact CG-CE1 3.91Å; Q56-F60 HydrophobicContact CG-CE2 3.65Å; Q56-F60 HydrophobicContact CG-CZ 3.53Å; Q56-F60 WeakPolarHBondContact O-CG 3.21Å; Q56-F60 PolarHBondContact O-N 3.46Å; C57-F60 PolarHBondContact O-N 3.28Å; F60-K62 PolarHBondContact O-N 3.45Å; F60-D63 PolarHBondContact O-N 3.49Å; F60-L64 WeakPolarHBondContact O-CB 3.33Å; F60-L64 WeakPolarHBondContact O-CD1 3.27Å; F60-L64 WeakPolarHBondContact O-CG 3.24Å; F60-L64 PolarHBondContact O-N 3.32Å; F60-L84 HydrophobicContact CB-CD2 4.2Å; F60-L84 HydrophobicContact CD1-CD1 3.92Å; F60-L84 HydrophobicContact CD1-CD2 3.57Å; F60-L84 HydrophobicContact CD1-CG 4.01Å; F60-L84 HydrophobicContact CD2-CD2 4.43Å; F60-L84 HydrophobicContact CE1-CD2 3.89Å; F60-L84 HydrophobicContact CE1-CG 4.22Å; F60-L84 HydrophobicContact CG-CD2 3.84Å; F60-L84 HydrophobicContact CZ-CD2 4.46Å
61	A	98.6	Very high	98.4	Very high	57 Å²	57	80 Å²	80	47%	0.471	40%	0.395	S	S	.	.	H	α-helix	trans	-61.2	-46.7	179.4	0	0	0	0	0	111.9	C57 E58 N59 L64 E65	C57-A61 WeakPolarHBondContact O-CB 3.07Å; C57-A61 PolarHBondContact O-N 3.29Å; E58-A61 PolarHBondContact O-N 3.47Å; N59-A61 PolarHBondContact O-N 3.41Å; A61-L64 PolarHBondContact O-N 3.07Å; A61-E65 WeakPolarHBondContact O-CB 3.46Å; A61-E65 PolarHBondContact O-N 3.19Å
62	K	98.6	Very high	98.4	Very high	97 Å²	97	86.4 Å²	86.4	42%	0.422	42%	0.422	S	S	.	.	H	α-helix	trans	-62.6	-46.5	178.2	-73.7	171.8	173.6	171.6	0	111.8	E58 N59 F60 E65 M66	E58-K62 HydrophobicContact CG-CD 4.32Å; E58-K62 WeakPolarHBondContact O-CG 3.15Å; E58-K62 PolarHBondContact O-N 3.23Å; E58-K62 VanDerWaalsContact O-N 3.1Å; E58-K62 WeakPolarHBondContact OE1-CE 3.41Å; E58-K62 IonicContact OE1-NZ 3.91Å; E58-K62 PolarHBondContact OE1-NZ 2.96Å; N59-K62 PolarHBondContact O-N 2.83Å; F60-K62 PolarHBondContact O-N 3.45Å; K62-E65 PolarHBondContact O-N 3.48Å; K62-M66 VanDerWaalsContact O-CG 3.3Å; K62-M66 WeakPolarHBondContact O-CG 3.09Å; K62-M66 PolarHBondContact O-N 3.32Å
63	D	98.6	Very high	98.4	Very high	69 Å²	69	85.4 Å²	85.4	37%	0.369	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-45.4	179.5	-78	-10.3	0	0	0	111.5	N59 F60 E65 M66 F67 L84	N59-D63 WeakPolarHBondContact O-CB 3.32Å; N59-D63 PolarHBondContact O-N 3.4Å; F60-D63 PolarHBondContact O-N 3.49Å; D63-E65 PolarHBondContact O-N 3Å; D63-M66 PolarHBondContact O-N 3.2Å; D63-F67 HydrophobicContact CB-CE2 3.94Å; D63-F67 HydrophobicContact CB-CZ 3.98Å; D63-F67 WeakPolarHBondContact O-CD1 3.33Å; D63-F67 VanDerWaalsContact O-CD2 3.27Å; D63-F67 WeakPolarHBondContact O-CD2 3.33Å; D63-F67 WeakPolarHBondContact O-CG 3.46Å; D63-F67 PolarHBondContact O-N 3.09Å; D63-L84 HydrophobicContact CB-CD1 3.75Å
64	L	98.8	Very high	98.4	Very high	28 Å²	28	89.6 Å²	89.6	15%	0.147	44%	0.438	C	S	.	.	H	α-helix	trans	-62	-42.6	178.7	-70.4	170.7	0	0	0	112.1	F60 A61 M66 F67 A68 I76 D80 V81	F60-L64 WeakPolarHBondContact O-CB 3.33Å; F60-L64 WeakPolarHBondContact O-CD1 3.27Å; F60-L64 WeakPolarHBondContact O-CG 3.24Å; F60-L64 PolarHBondContact O-N 3.32Å; A61-L64 PolarHBondContact O-N 3.07Å; L64-M66 VanDerWaalsContact C-N 3.34Å; L64-F67 PolarHBondContact O-N 3.12Å; L64-A68 PolarHBondContact O-N 3.01Å; L64-I76 HydrophobicContact CB-CD1 3.78Å; L64-I76 HydrophobicContact CB-CG1 4.24Å; L64-I76 HydrophobicContact CB-CG2 4.17Å; L64-I76 HydrophobicContact CD2-CG2 4.23Å; L64-D80 HydrophobicContact CD2-CB 3.96Å; L64-V81 HydrophobicContact CD2-CB 4.43Å; L64-V81 HydrophobicContact CD2-CG2 3.88Å
65	E	98.7	Very high	98.4	Very high	119 Å²	119	92.7 Å²	92.7	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-60.3	-45.3	173.8	-177.4	-177.3	-151.7	0	0	111.1	A61 K62 D63 F67 A68 R69	A61-E65 WeakPolarHBondContact O-CB 3.46Å; A61-E65 PolarHBondContact O-N 3.19Å; K62-E65 PolarHBondContact O-N 3.48Å; D63-E65 PolarHBondContact O-N 3Å; E65-F67 PolarHBondContact O-N 3.16Å; E65-A68 PolarHBondContact O-N 2.85Å; E65-R69 VanDerWaalsContact O-CB 3.32Å; E65-R69 WeakPolarHBondContact O-CB 3.45Å; E65-R69 PolarHBondContact O-N 3.48Å
66	M	98.6	Very high	98.4	Very high	95 Å²	95	90 Å²	90	47%	0.468	46%	0.455	S	S	.	.	H	α-helix	trans	-64.8	-38.2	178.3	-71.5	-168.7	-160	0	0	112.6	K62 D63 L64 R69 H70	K62-M66 VanDerWaalsContact O-CG 3.3Å; K62-M66 WeakPolarHBondContact O-CG 3.09Å; K62-M66 PolarHBondContact O-N 3.32Å; D63-M66 PolarHBondContact O-N 3.2Å; L64-M66 VanDerWaalsContact C-N 3.34Å; M66-R69 PolarHBondContact O-N 3.47Å; M66-H70 WeakPolarHBondContact O-CB 3.47Å; M66-H70 PolarHBondContact O-N 3.37Å
67	F	98.7	Very high	98.4	Very high	31 Å²	31	89.8 Å²	89.8	14%	0.136	46%	0.456	C	S	.	.	H	α-helix	trans	-65.8	-45.4	176.8	-61.6	-24.9	0	0	0	111.9	D63 L64 E65 R69 H70 A71 D80 L83 L84	D63-F67 HydrophobicContact CB-CE2 3.94Å; D63-F67 HydrophobicContact CB-CZ 3.98Å; D63-F67 WeakPolarHBondContact O-CD1 3.33Å; D63-F67 VanDerWaalsContact O-CD2 3.27Å; D63-F67 WeakPolarHBondContact O-CD2 3.33Å; D63-F67 WeakPolarHBondContact O-CG 3.46Å; D63-F67 PolarHBondContact O-N 3.09Å; L64-F67 PolarHBondContact O-N 3.12Å; E65-F67 PolarHBondContact O-N 3.16Å; F67-R69 VanDerWaalsContact C-N 3.34Å; F67-R69 PolarHBondContact O-N 2.95Å; F67-H70 WeakPolarHBondContact O-CB 3.41Å; F67-H70 PolarHBondContact O-N 3.03Å; F67-A71 PolarHBondContact O-N 2.98Å; F67-D80 HydrophobicContact CB-CB 4.03Å; F67-D80 WeakPolarHBondContact CD2-O 3.42Å; F67-L83 HydrophobicContact CB-CD2 4.17Å; F67-L83 HydrophobicContact CD1-CD2 3.62Å; F67-L83 HydrophobicContact CD1-CG 4.47Å; F67-L83 HydrophobicContact CD2-CB 4.11Å; F67-L83 HydrophobicContact CD2-CD2 3.97Å; F67-L83 HydrophobicContact CD2-CG 4.23Å; F67-L83 HydrophobicContact CE1-CD2 3.94Å; F67-L83 HydrophobicContact CE1-CG 4.41Å; F67-L83 HydrophobicContact CE2-CB 4.22Å; F67-L83 HydrophobicContact CE2-CD2 4.26Å; F67-L83 HydrophobicContact CE2-CG 4.16Å; F67-L83 HydrophobicContact CG-CD2 3.65Å; F67-L83 HydrophobicContact CG-CG 4.4Å; F67-L83 HydrophobicContact CZ-CD2 4.25Å; F67-L83 HydrophobicContact CZ-CG 4.26Å; F67-L84 HydrophobicContact CE2-CB 4.42Å; F67-L84 HydrophobicContact CE2-CD1 4.04Å
68	A	98.8	Very high	98.4	Very high	2 Å²	2	90.1 Å²	90.1	2%	0.017	46%	0.456	C	S	.	.	H	α-helix	trans	-60.1	-46.2	174.8	0	0	0	0	0	111	L64 E65 H70 A71 K72 R73 I76 D80	L64-A68 PolarHBondContact O-N 3.01Å; E65-A68 PolarHBondContact O-N 2.85Å; A68-H70 PolarHBondContact O-N 3.44Å; A68-A71 CarbonylContact O-C 3.44Å; A68-A71 PolarHBondContact O-N 2.94Å; A68-A71 VanDerWaalsContact O-N 3.14Å; A68-K72 PolarHBondContact O-N 3.45Å; A68-R73 CarbonylContact C-O 3.25Å; A68-R73 VanDerWaalsContact C-O 3.25Å; A68-R73 HydrophobicContact CB-CB 4.49Å; A68-R73 PolarHBondContact O-N 3.48Å; A68-I76 HydrophobicContact CB-CG1 4.09Å; A68-D80 PolarHBondContact N-OD1 3.45Å
69	R	98.6	Very high	98.4	Very high	160 Å²	160	89.9 Å²	89.9	60%	0.604	46%	0.455	S	S	*	.	H	α-helix	trans	-63	-39.1	178.2	-172.9	173.7	67.8	-164.8	0.6	112.5	E65 M66 F67 A71 K72 R73	E65-R69 VanDerWaalsContact O-CB 3.32Å; E65-R69 WeakPolarHBondContact O-CB 3.45Å; E65-R69 PolarHBondContact O-N 3.48Å; M66-R69 PolarHBondContact O-N 3.47Å; F67-R69 VanDerWaalsContact C-N 3.34Å; F67-R69 PolarHBondContact O-N 2.95Å; R69-A71 PolarHBondContact O-N 3.17Å; R69-K72 WeakPolarHBondContact O-CA 3.36Å; R69-K72 PolarHBondContact O-N 3.03Å; R69-R73 PolarHBondContact N-O 3.44Å
70	H	98.4	Very high	98.5	Very high	170 Å²	170	86.3 Å²	86.3	79%	0.787	44%	0.436	S	S	*	.	H	α-helix	trans	-59.4	-35.9	175.8	-176.5	76.5	0	0	0	111.7	M66 F67 A68 K72	M66-H70 WeakPolarHBondContact O-CB 3.47Å; M66-H70 PolarHBondContact O-N 3.37Å; F67-H70 WeakPolarHBondContact O-CB 3.41Å; F67-H70 PolarHBondContact O-N 3.03Å; A68-H70 PolarHBondContact O-N 3.44Å; H70-K72 PolarHBondContact O-N 2.84Å
71	A	98.1	Very high	98.5	Very high	49 Å²	49	85.2 Å²	85.2	41%	0.405	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	15.7	173.3	0	0	0	0	0	114	F67 A68 R69 R73	F67-A71 PolarHBondContact O-N 2.98Å; A68-A71 CarbonylContact O-C 3.44Å; A68-A71 PolarHBondContact O-N 2.94Å; A68-A71 VanDerWaalsContact O-N 3.14Å; R69-A71 PolarHBondContact O-N 3.17Å; A71-R73 VanDerWaalsContact CB-NH2 3.34Å; A71-R73 PolarHBondContact O-N 2.94Å
72	K	98.3	Very high	98.5	Very high	202 Å²	202	84.3 Å²	84.3	88%	0.878	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	30.5	-178.7	-53.1	178.7	-177.7	178.6	0	114	A68 R69 H70	A68-K72 PolarHBondContact O-N 3.45Å; R69-K72 WeakPolarHBondContact O-CA 3.36Å; R69-K72 PolarHBondContact O-N 3.03Å; H70-K72 PolarHBondContact O-N 2.84Å
73	R	98.4	Very high	98.5	Very high	74 Å²	74	82.9 Å²	82.9	28%	0.279	42%	0.418	S	S	.	.			trans	-111.5	154.5	176.2	-68.5	177.8	-74.4	103.6	-3.5	110.7	A68 R69 A71 T75 D80	A68-R73 CarbonylContact C-O 3.25Å; A68-R73 VanDerWaalsContact C-O 3.25Å; A68-R73 HydrophobicContact CB-CB 4.49Å; A68-R73 PolarHBondContact O-N 3.48Å; R69-R73 PolarHBondContact N-O 3.44Å; A71-R73 VanDerWaalsContact CB-NH2 3.34Å; A71-R73 PolarHBondContact O-N 2.94Å; R73-T75 PolarHBondContact NH1-O 2.85Å; R73-D80 IonicContact CZ-OD1 2.77Å; R73-D80 IonicContact CZ-OD2 3.53Å; R73-D80 IonicContact NH1-OD1 2.67Å; R73-D80 IonicContact NH1-OD2 3.54Å; R73-D80 PolarHBondContact NH1-OD2 2.96Å; R73-D80 IonicContact NH2-OD1 3.6Å; R73-D80 PolarHBondContact NH2-OD1 3.47Å; R73-D80 IonicContact NH2-OD2 3.58Å; R73-D80 PolarHBondContact NH2-OD2 3.43Å
74	T	97.9	Very high	98.4	Very high	144 Å²	144	81.9 Å²	81.9	88%	0.883	41%	0.412	S	S	*	.	S	Bend	trans	-104.7	-15.5	169.6	54.9	0	0	0	0	112.4
75	T	98.6	Very high	98.4	Very high	106 Å²	106	81 Å²	81	65%	0.65	41%	0.409	S	S	*	.	S	Bend	trans	-102.8	123.4	177.6	-49.3	0	0	0	0	110	R73	R73-T75 PolarHBondContact NH1-O 2.85Å
76	I	98.7	Very high	98.4	Very high	79 Å²	79	81.7 Å²	81.7	41%	0.405	41%	0.406	S	S	.	.			trans	-68.7	138	174.3	-63.4	161.9	0	0	0	109.4	L64 A68 D80	L64-I76 HydrophobicContact CB-CD1 3.78Å; L64-I76 HydrophobicContact CB-CG1 4.24Å; L64-I76 HydrophobicContact CB-CG2 4.17Å; L64-I76 HydrophobicContact CD2-CG2 4.23Å; A68-I76 HydrophobicContact CB-CG1 4.09Å; I76-D80 WeakPolarHBondContact CA-OD2 3.33Å; I76-D80 HydrophobicContact CG2-CB 4.03Å
77	N	98.1	Very high	98.3	Very high	64 Å²	64	88.6 Å²	88.6	34%	0.342	43%	0.427	S	S	.	.			trans	-128.3	-176.9	175.9	73.6	15.9	0	0	0	112.3	E79 D80 V81	N77-E79 VanDerWaalsContact C-N 3.27Å; N77-E79 PolarHBondContact O-N 3.26Å; N77-E79 WeakPolarHBondContact OD1-CB 3.32Å; N77-E79 PolarHBondContact OD1-N 3.05Å; N77-D80 PolarHBondContact N-OD2 3.49Å; N77-D80 PolarHBondContact O-N 3.11Å; N77-D80 PolarHBondContact OD1-N 3.47Å; N77-D80 PolarHBondContact OD1-OD2 3.46Å; N77-V81 PolarHBondContact O-N 3.39Å
78	T	98.2	Very high	98.3	Very high	75 Å²	75	89.3 Å²	89.3	46%	0.46	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-27.2	-177.9	51.2	0	0	0	0	113.8	V81 K82	T78-V81 PolarHBondContact O-N 2.75Å; T78-K82 WeakPolarHBondContact O-CG 3.41Å; T78-K82 PolarHBondContact O-N 3.44Å
79	E	98.3	Very high	98.3	Very high	103 Å²	103	95.7 Å²	95.7	48%	0.481	47%	0.47	S	S	.	.	H	α-helix	trans	-70.3	-35	178.4	-59.5	-53.7	119.7	0	0	111.4	N77 V81 K82 L83	N77-E79 VanDerWaalsContact C-N 3.27Å; N77-E79 PolarHBondContact O-N 3.26Å; N77-E79 WeakPolarHBondContact OD1-CB 3.32Å; N77-E79 PolarHBondContact OD1-N 3.05Å; E79-V81 VanDerWaalsContact C-N 3.31Å; E79-V81 PolarHBondContact O-N 2.97Å; E79-K82 PolarHBondContact O-N 3.4Å; E79-K82 IonicContact OE1-NZ 3.94Å; E79-K82 PolarHBondContact OE1-NZ 3.38Å; E79-K82 IonicContact OE2-NZ 2.86Å; E79-L83 WeakPolarHBondContact O-CB 3.48Å; E79-L83 PolarHBondContact O-N 3.21Å
80	D	98.6	Very high	98.3	Very high	5 Å²	5	92.6 Å²	92.6	3%	0.027	47%	0.472	C	S	.	.	H	α-helix	trans	-63.5	-39.7	173.2	-53.1	-45.4	0	0	0	110.8	L64 F67 A68 R73 I76 N77 L83 L84	L64-D80 HydrophobicContact CD2-CB 3.96Å; F67-D80 HydrophobicContact CB-CB 4.03Å; F67-D80 WeakPolarHBondContact CD2-O 3.42Å; A68-D80 PolarHBondContact N-OD1 3.45Å; R73-D80 IonicContact CZ-OD1 2.77Å; R73-D80 IonicContact CZ-OD2 3.53Å; R73-D80 IonicContact NH1-OD1 2.67Å; R73-D80 IonicContact NH1-OD2 3.54Å; R73-D80 PolarHBondContact NH1-OD2 2.96Å; R73-D80 IonicContact NH2-OD1 3.6Å; R73-D80 PolarHBondContact NH2-OD1 3.47Å; R73-D80 IonicContact NH2-OD2 3.58Å; R73-D80 PolarHBondContact NH2-OD2 3.43Å; I76-D80 WeakPolarHBondContact CA-OD2 3.33Å; I76-D80 HydrophobicContact CG2-CB 4.03Å; N77-D80 PolarHBondContact N-OD2 3.49Å; N77-D80 PolarHBondContact O-N 3.11Å; N77-D80 PolarHBondContact OD1-N 3.47Å; N77-D80 PolarHBondContact OD1-OD2 3.46Å; D80-L83 WeakPolarHBondContact O-CB 3.41Å; D80-L83 PolarHBondContact O-N 3.46Å; D80-L84 PolarHBondContact O-N 3.06Å
81	V	98.5	Very high	98.3	Very high	60 Å²	60	88.4 Å²	88.4	36%	0.364	46%	0.456	S	S	.	.	H	α-helix	trans	-69.3	-40.8	177.3	-178.8	0	0	0	0	111.8	L64 N77 T78 E79 L83 L84 I95	L64-V81 HydrophobicContact CD2-CB 4.43Å; L64-V81 HydrophobicContact CD2-CG2 3.88Å; N77-V81 PolarHBondContact O-N 3.39Å; T78-V81 PolarHBondContact O-N 2.75Å; E79-V81 VanDerWaalsContact C-N 3.31Å; E79-V81 PolarHBondContact O-N 2.97Å; V81-L83 VanDerWaalsContact C-N 3.27Å; V81-L83 PolarHBondContact O-N 3.29Å; V81-L84 WeakPolarHBondContact O-CB 3.38Å; V81-L84 PolarHBondContact O-N 2.89Å; V81-I95 HydrophobicContact CG1-CG2 4.2Å
82	K	98.4	Very high	98.3	Very high	38 Å²	38	88.6 Å²	88.6	17%	0.165	45%	0.449	C	S	.	.	H	α-helix	trans	-60.8	-40	172.7	-71.4	171.9	-174.2	171.7	0	111	T78 E79 L84 A85 R86 L92 I95	T78-K82 WeakPolarHBondContact O-CG 3.41Å; T78-K82 PolarHBondContact O-N 3.44Å; E79-K82 PolarHBondContact O-N 3.4Å; E79-K82 IonicContact OE1-NZ 3.94Å; E79-K82 PolarHBondContact OE1-NZ 3.38Å; E79-K82 IonicContact OE2-NZ 2.86Å; K82-L84 PolarHBondContact O-N 3.44Å; K82-A85 PolarHBondContact O-N 3.42Å; K82-R86 PolarHBondContact O-N 2.97Å; K82-L92 HydrophobicContact CB-CD1 4.13Å; K82-L92 WeakPolarHBondContact O-CD1 3.36Å; K82-I95 HydrophobicContact CG-CG2 4.49Å
83	L	98.4	Very high	98.3	Very high	68 Å²	68	85 Å²	85	36%	0.356	43%	0.434	S	S	.	.	H	α-helix	trans	-63.4	-31.6	178.3	-168.1	64.2	0	0	0	112.5	F67 E79 D80 V81 A85 R86	F67-L83 HydrophobicContact CB-CD2 4.17Å; F67-L83 HydrophobicContact CD1-CD2 3.62Å; F67-L83 HydrophobicContact CD1-CG 4.47Å; F67-L83 HydrophobicContact CD2-CB 4.11Å; F67-L83 HydrophobicContact CD2-CD2 3.97Å; F67-L83 HydrophobicContact CD2-CG 4.23Å; F67-L83 HydrophobicContact CE1-CD2 3.94Å; F67-L83 HydrophobicContact CE1-CG 4.41Å; F67-L83 HydrophobicContact CE2-CB 4.22Å; F67-L83 HydrophobicContact CE2-CD2 4.26Å; F67-L83 HydrophobicContact CE2-CG 4.16Å; F67-L83 HydrophobicContact CG-CD2 3.65Å; F67-L83 HydrophobicContact CG-CG 4.4Å; F67-L83 HydrophobicContact CZ-CD2 4.25Å; F67-L83 HydrophobicContact CZ-CG 4.26Å; E79-L83 WeakPolarHBondContact O-CB 3.48Å; E79-L83 PolarHBondContact O-N 3.21Å; D80-L83 WeakPolarHBondContact O-CB 3.41Å; D80-L83 PolarHBondContact O-N 3.46Å; V81-L83 VanDerWaalsContact C-N 3.27Å; V81-L83 PolarHBondContact O-N 3.29Å; L83-A85 VanDerWaalsContact C-N 3.27Å; L83-A85 PolarHBondContact O-N 3.1Å; L83-R86 HydrophobicContact CD1-CB 4.48Å; L83-R86 VanDerWaalsContact O-CB 3.26Å; L83-R86 WeakPolarHBondContact O-CB 3.37Å; L83-R86 VanDerWaalsContact O-CD 3.24Å; L83-R86 WeakPolarHBondContact O-CD 3.4Å; L83-R86 WeakPolarHBondContact O-CG 3.3Å; L83-R86 PolarHBondContact O-N 2.86Å
84	L	98.3	Very high	98.3	Very high	48 Å²	48	88 Å²	88	25%	0.251	45%	0.446	S	S	.	.	H	α-helix	trans	-60	-36.6	173.1	-160.6	75.1	0	0	0	112.2	F60 D63 F67 D80 V81 K82 R86	F60-L84 HydrophobicContact CB-CD2 4.2Å; F60-L84 HydrophobicContact CD1-CD1 3.92Å; F60-L84 HydrophobicContact CD1-CD2 3.57Å; F60-L84 HydrophobicContact CD1-CG 4.01Å; F60-L84 HydrophobicContact CD2-CD2 4.43Å; F60-L84 HydrophobicContact CE1-CD2 3.89Å; F60-L84 HydrophobicContact CE1-CG 4.22Å; F60-L84 HydrophobicContact CG-CD2 3.84Å; F60-L84 HydrophobicContact CZ-CD2 4.46Å; D63-L84 HydrophobicContact CB-CD1 3.75Å; F67-L84 HydrophobicContact CE2-CB 4.42Å; F67-L84 HydrophobicContact CE2-CD1 4.04Å; D80-L84 PolarHBondContact O-N 3.06Å; V81-L84 WeakPolarHBondContact O-CB 3.38Å; V81-L84 PolarHBondContact O-N 2.89Å; K82-L84 PolarHBondContact O-N 3.44Å; L84-R86 VanDerWaalsContact C-N 3.35Å
85	A	98.3	Very high	98.4	Very high	8 Å²	8	83.5 Å²	83.5	7%	0.066	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-3.8	-179.1	0	0	0	0	0	114.4	K82 L83 R87 S88 L91 L92 I95	K82-A85 PolarHBondContact O-N 3.42Å; L83-A85 VanDerWaalsContact C-N 3.27Å; L83-A85 PolarHBondContact O-N 3.1Å; A85-R87 PolarHBondContact O-N 3.14Å; A85-S88 PolarHBondContact O-N 3.19Å; A85-S88 VanDerWaalsContact O-N 3.13Å; A85-L91 HydrophobicContact CB-CD2 4.18Å; A85-L91 HydrophobicContact CB-CG 3.96Å; A85-L92 HydrophobicContact CB-CB 4.37Å; A85-L92 HydrophobicContact CB-CD1 4.4Å; A85-I95 HydrophobicContact CB-CB 4.46Å; A85-I95 HydrophobicContact CB-CG1 4.21Å
86	R	97.9	Very high	98.4	Very high	135 Å²	135	79.9 Å²	79.9	51%	0.509	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24	-168	74.3	-171.5	179.9	-147.1	-1.6	116.4	K82 L83 L84 S88	K82-R86 PolarHBondContact O-N 2.97Å; L83-R86 HydrophobicContact CD1-CB 4.48Å; L83-R86 VanDerWaalsContact O-CB 3.26Å; L83-R86 WeakPolarHBondContact O-CB 3.37Å; L83-R86 VanDerWaalsContact O-CD 3.24Å; L83-R86 WeakPolarHBondContact O-CD 3.4Å; L83-R86 WeakPolarHBondContact O-CG 3.3Å; L83-R86 PolarHBondContact O-N 2.86Å; L84-R86 VanDerWaalsContact C-N 3.35Å; R86-S88 VanDerWaalsContact C-N 3.3Å; R86-S88 PolarHBondContact O-N 3.28Å
87	R	97.7	Very high	98.3	Very high	240 Å²	240	79.3 Å²	79.3	91%	0.906	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.3	-175.7	-66	-174.2	67.4	-179.5	-0.3	113.2	A85	A85-R87 PolarHBondContact O-N 3.14Å
88	S	98.2	Very high	98.4	Very high	46 Å²	46	80 Å²	80	32%	0.322	39%	0.392	S	S	.	.			trans	-126.7	113.7	-180	171.3	0	0	0	0	109.3	A85 R86 S90 L91 L92	A85-S88 PolarHBondContact O-N 3.19Å; A85-S88 VanDerWaalsContact O-N 3.13Å; R86-S88 VanDerWaalsContact C-N 3.3Å; R86-S88 PolarHBondContact O-N 3.28Å; S88-S90 VanDerWaalsContact C-N 3.3Å; S88-S90 PolarHBondContact O-N 3.34Å; S88-S90 PolarHBondContact OG-OG 3.19Å; S88-L91 PolarHBondContact O-N 3.39Å; S88-L91 PolarHBondContact OG-N 2.89Å; S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 3.36Å
89	N	98	Very high	98.3	Very high	136 Å²	136	77.5 Å²	77.5	73%	0.727	38%	0.377	S	S	*	.	H	α-helix	trans	-62.2	-37.5	-178	-69.9	-25.6	0	0	0	112.4	K93	N89-K93 WeakPolarHBondContact O-CB 3.5Å; N89-K93 PolarHBondContact O-N 3.09Å
90	S	98.6	Very high	98.3	Very high	94 Å²	94	78.2 Å²	78.2	66%	0.657	38%	0.381	S	S	*	.	H	α-helix	trans	-66.5	-41.3	177.1	54.5	0	0	0	0	111.7	S88 Y94	S88-S90 VanDerWaalsContact C-N 3.3Å; S88-S90 PolarHBondContact O-N 3.34Å; S88-S90 PolarHBondContact OG-OG 3.19Å; S90-Y94 WeakPolarHBondContact O-CB 3.46Å; S90-Y94 PolarHBondContact O-N 3.34Å
91	L	98.4	Very high	98.3	Very high	83 Å²	83	82.4 Å²	82.4	44%	0.435	40%	0.4	S	S	.	.	H	α-helix	trans	-69.1	-43.8	176.4	-175.6	62.3	0	0	0	111.6	A85 S88 K93 Y94 I95	A85-L91 HydrophobicContact CB-CD2 4.18Å; A85-L91 HydrophobicContact CB-CG 3.96Å; S88-L91 PolarHBondContact O-N 3.39Å; S88-L91 PolarHBondContact OG-N 2.89Å; L91-K93 VanDerWaalsContact C-N 3.3Å; L91-K93 PolarHBondContact O-N 3.49Å; L91-Y94 PolarHBondContact O-N 3.19Å; L91-I95 HydrophobicContact CD1-CG1 4.1Å; L91-I95 HydrophobicContact CG-CG1 4.29Å; L91-I95 WeakPolarHBondContact O-CB 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.35Å; L91-I95 PolarHBondContact O-N 3.38Å
92	L	98.6	Very high	98.2	Very high	52 Å²	52	84 Å²	84	27%	0.272	41%	0.405	S	S	.	.	H	α-helix	trans	-57.9	-44.7	176.6	177.1	61.3	0	0	0	111	K82 A85 S88 T96	K82-L92 HydrophobicContact CB-CD1 4.13Å; K82-L92 WeakPolarHBondContact O-CD1 3.36Å; A85-L92 HydrophobicContact CB-CB 4.37Å; A85-L92 HydrophobicContact CB-CD1 4.4Å; S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 3.36Å; L92-T96 VanDerWaalsContact O-CB 3.31Å; L92-T96 WeakPolarHBondContact O-CB 3.37Å; L92-T96 PolarHBondContact O-N 3.17Å; L92-T96 PolarHBondContact O-OG1 3.32Å
93	K	98.6	Very high	98.1	Very high	127 Å²	127	84.6 Å²	84.6	55%	0.552	42%	0.417	S	S	*	.	H	α-helix	trans	-59.7	-52.7	174.9	-173.1	-175.1	-176.9	-58.7	0	110.9	N89 L91 I95 T96 D97	N89-K93 WeakPolarHBondContact O-CB 3.5Å; N89-K93 PolarHBondContact O-N 3.09Å; L91-K93 VanDerWaalsContact C-N 3.3Å; L91-K93 PolarHBondContact O-N 3.49Å; K93-I95 VanDerWaalsContact C-N 3.34Å; K93-I95 PolarHBondContact O-N 2.94Å; K93-T96 PolarHBondContact O-N 2.89Å; K93-T96 VanDerWaalsContact O-N 3.12Å; K93-D97 IonicContact NZ-OD1 2.77Å; K93-D97 IonicContact NZ-OD2 2.7Å; K93-D97 PolarHBondContact NZ-OD2 2.86Å; K93-D97 PolarHBondContact O-N 3.31Å
94	Y	98.7	Very high	98	Very high	138 Å²	138	86 Å²	86	54%	0.541	42%	0.423	S	S	.	.	H	α-helix	trans	-56.5	-45.6	-179.3	179.1	-93.7	0	0	0	112.8	S90 L91 D97 K98	S90-Y94 WeakPolarHBondContact O-CB 3.46Å; S90-Y94 PolarHBondContact O-N 3.34Å; L91-Y94 PolarHBondContact O-N 3.19Å; Y94-D97 PolarHBondContact O-N 3.46Å; Y94-K98 HydrophobicContact CD1-CG 4.5Å; Y94-K98 HydrophobicContact CE1-CG 4.05Å; Y94-K98 WeakPolarHBondContact O-CG 3.47Å; Y94-K98 PolarHBondContact O-N 3.35Å
95	I	98.5	Very high	97.8	Very high	48 Å²	48	86.6 Å²	86.6	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-67.5	-36.7	178.4	-66.6	-63.5	0	0	0	111.6	V81 K82 A85 L91 K93 K98 S99	V81-I95 HydrophobicContact CG1-CG2 4.2Å; K82-I95 HydrophobicContact CG-CG2 4.49Å; A85-I95 HydrophobicContact CB-CB 4.46Å; A85-I95 HydrophobicContact CB-CG1 4.21Å; L91-I95 HydrophobicContact CD1-CG1 4.1Å; L91-I95 HydrophobicContact CG-CG1 4.29Å; L91-I95 WeakPolarHBondContact O-CB 3.32Å; L91-I95 WeakPolarHBondContact O-CG1 3.35Å; L91-I95 PolarHBondContact O-N 3.38Å; K93-I95 VanDerWaalsContact C-N 3.34Å; K93-I95 PolarHBondContact O-N 2.94Å; I95-K98 PolarHBondContact O-N 2.9Å; I95-S99 WeakPolarHBondContact O-CB 3.14Å; I95-S99 PolarHBondContact O-N 3.38Å
96	T	98.4	Very high	97.6	Very high	31 Å²	31	89.6 Å²	89.6	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-65.1	-48.9	176.3	-58.7	0	0	0	0	110.8	L92 K93 K98 S99 E100	L92-T96 VanDerWaalsContact O-CB 3.31Å; L92-T96 WeakPolarHBondContact O-CB 3.37Å; L92-T96 PolarHBondContact O-N 3.17Å; L92-T96 PolarHBondContact O-OG1 3.32Å; K93-T96 PolarHBondContact O-N 2.89Å; K93-T96 VanDerWaalsContact O-N 3.12Å; T96-K98 VanDerWaalsContact C-N 3.29Å; T96-K98 PolarHBondContact O-N 2.9Å; T96-S99 WeakPolarHBondContact O-CB 3.46Å; T96-S99 PolarHBondContact O-N 2.95Å; T96-E100 PolarHBondContact O-N 3.36Å
97	D	98.4	Very high	97.4	Very high	67 Å²	67	88.2 Å²	88.2	36%	0.358	44%	0.442	S	S	.	.	H	α-helix	trans	-56.6	-44.5	176.6	-61.9	-13	0	0	0	110.6	K93 Y94 S99 E100 E101	K93-D97 IonicContact NZ-OD1 2.77Å; K93-D97 IonicContact NZ-OD2 2.7Å; K93-D97 PolarHBondContact NZ-OD2 2.86Å; K93-D97 PolarHBondContact O-N 3.31Å; Y94-D97 PolarHBondContact O-N 3.46Å; D97-S99 PolarHBondContact O-N 3.25Å; D97-E100 PolarHBondContact O-N 2.9Å; D97-E101 PolarHBondContact O-N 3.43Å
98	K	98.4	Very high	97.2	Very high	79 Å²	79	81.3 Å²	81.3	34%	0.343	42%	0.42	S	S	.	.	H	α-helix	trans	-65.7	-35.7	176.2	-77.5	-71.8	169	-161.6	0	113.4	Y94 I95 T96 E100 E101 I102	Y94-K98 HydrophobicContact CD1-CG 4.5Å; Y94-K98 HydrophobicContact CE1-CG 4.05Å; Y94-K98 WeakPolarHBondContact O-CG 3.47Å; Y94-K98 PolarHBondContact O-N 3.35Å; I95-K98 PolarHBondContact O-N 2.9Å; T96-K98 VanDerWaalsContact C-N 3.29Å; T96-K98 PolarHBondContact O-N 2.9Å; K98-E100 VanDerWaalsContact C-N 3.31Å; K98-E100 PolarHBondContact O-N 3.33Å; K98-E101 WeakPolarHBondContact CD-OE2 3.39Å; K98-E101 WeakPolarHBondContact CE-OE2 3.42Å; K98-E101 IonicContact NZ-OE1 2.63Å; K98-E101 IonicContact NZ-OE2 2.75Å; K98-E101 PolarHBondContact NZ-OE2 3.22Å; K98-E101 PolarHBondContact O-N 2.9Å; K98-I102 WeakPolarHBondContact O-CD1 3.32Å; K98-I102 VanDerWaalsContact O-CG1 3.28Å; K98-I102 WeakPolarHBondContact O-CG1 3.48Å; K98-I102 PolarHBondContact O-N 3.5Å
99	S	97.9	Very high	96.9	Very high	22 Å²	22	86.3 Å²	86.3	15%	0.154	43%	0.432	C	S	.	.	H	α-helix	trans	-63.1	-39.6	174.9	-178.5	0	0	0	0	111.5	I95 T96 D97 A103	I95-S99 WeakPolarHBondContact O-CB 3.14Å; I95-S99 PolarHBondContact O-N 3.38Å; T96-S99 WeakPolarHBondContact O-CB 3.46Å; T96-S99 PolarHBondContact O-N 2.95Å; D97-S99 PolarHBondContact O-N 3.25Å; S99-A103 WeakPolarHBondContact O-CB 3.35Å; S99-A103 PolarHBondContact O-N 3.46Å
100	E	97.4	Very high	96.6	Very high	118 Å²	118	86.7 Å²	86.7	55%	0.551	43%	0.427	S	S	*	.	H	α-helix	trans	-69.7	-43.7	178.1	-68.8	173.1	-171.6	0	0	111.4	T96 D97 K98 I102 A103 Q104	T96-E100 PolarHBondContact O-N 3.36Å; D97-E100 PolarHBondContact O-N 2.9Å; K98-E100 VanDerWaalsContact C-N 3.31Å; K98-E100 PolarHBondContact O-N 3.33Å; E100-I102 VanDerWaalsContact C-N 3.34Å; E100-I102 PolarHBondContact O-N 2.96Å; E100-A103 WeakPolarHBondContact O-CB 3.47Å; E100-A103 PolarHBondContact O-N 2.79Å; E100-A103 VanDerWaalsContact O-N 3.16Å; E100-Q104 PolarHBondContact O-N 3.22Å
101	E	97.8	Very high	96.3	Very high	92 Å²	92	84.7 Å²	84.7	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-55.8	-47.5	174.2	-173.7	-173.1	157.3	0	0	111.6	D97 K98 A103 Q104 I105	D97-E101 PolarHBondContact O-N 3.43Å; K98-E101 WeakPolarHBondContact CD-OE2 3.39Å; K98-E101 WeakPolarHBondContact CE-OE2 3.42Å; K98-E101 IonicContact NZ-OE1 2.63Å; K98-E101 IonicContact NZ-OE2 2.75Å; K98-E101 PolarHBondContact NZ-OE2 3.22Å; K98-E101 PolarHBondContact O-N 2.9Å; E101-A103 VanDerWaalsContact C-N 3.34Å; E101-A103 PolarHBondContact O-N 2.95Å; E101-Q104 PolarHBondContact O-N 3.12Å; E101-I105 HydrophobicContact CG-CD1 4.14Å; E101-I105 WeakPolarHBondContact O-CG1 3.41Å; E101-I105 PolarHBondContact O-N 2.92Å
102	I	97.3	Very high	95.8	Very high	93 Å²	93	86.8 Å²	86.8	48%	0.477	42%	0.424	S	S	.	.	H	α-helix	trans	-64.5	-39.8	178	-68.3	166.2	0	0	0	111.3	K98 E100 Q104 I105 N106	K98-I102 WeakPolarHBondContact O-CD1 3.32Å; K98-I102 VanDerWaalsContact O-CG1 3.28Å; K98-I102 WeakPolarHBondContact O-CG1 3.48Å; K98-I102 PolarHBondContact O-N 3.5Å; E100-I102 VanDerWaalsContact C-N 3.34Å; E100-I102 PolarHBondContact O-N 2.96Å; I102-Q104 VanDerWaalsContact C-N 3.31Å; I102-Q104 PolarHBondContact O-N 3.43Å; I102-I105 PolarHBondContact O-N 2.89Å; I102-N106 WeakPolarHBondContact O-CB 3.48Å; I102-N106 VanDerWaalsContact O-CG 3.22Å; I102-N106 PolarHBondContact O-N 3.39Å; I102-N106 PolarHBondContact O-ND2 3.45Å; I102-N106 VanDerWaalsContact O-ND2 3.13Å
103	A	95.8	Very high	95.3	Very high	51 Å²	51	91.9 Å²	91.9	42%	0.421	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-42.7	176.9	0	0	0	0	0	111.3	S99 E100 E101 N106 L107	S99-A103 WeakPolarHBondContact O-CB 3.35Å; S99-A103 PolarHBondContact O-N 3.46Å; E100-A103 WeakPolarHBondContact O-CB 3.47Å; E100-A103 PolarHBondContact O-N 2.79Å; E100-A103 VanDerWaalsContact O-N 3.16Å; E101-A103 VanDerWaalsContact C-N 3.34Å; E101-A103 PolarHBondContact O-N 2.95Å; A103-N106 PolarHBondContact O-N 3.38Å; A103-L107 WeakPolarHBondContact O-CG 3.43Å; A103-L107 PolarHBondContact O-N 3.49Å
104	Q	95.8	Very high	94.5	Very high	99 Å²	99	93 Å²	93	46%	0.463	45%	0.449	S	S	.	.	H	α-helix	trans	-64.1	-48.3	177.2	-175.2	57.9	26.7	0	0	112	E100 E101 I102 N106 L107 E108	E100-Q104 PolarHBondContact O-N 3.22Å; E101-Q104 PolarHBondContact O-N 3.12Å; I102-Q104 VanDerWaalsContact C-N 3.31Å; I102-Q104 PolarHBondContact O-N 3.43Å; Q104-N106 PolarHBondContact O-N 2.96Å; Q104-L107 WeakPolarHBondContact O-CB 3.31Å; Q104-L107 PolarHBondContact O-N 3.06Å; Q104-L107 VanDerWaalsContact O-N 3.08Å; Q104-E108 PolarHBondContact NE2-OE1 3.4Å; Q104-E108 PolarHBondContact O-N 3.01Å
105	I	95.6	Very high	93.6	Very high	59 Å²	59	93.8 Å²	93.8	30%	0.303	46%	0.455	S	S	.	.	H	α-helix	trans	-56.4	-39.9	175.8	-68.8	166	0	0	0	110.9	E101 I102 E108 R109	E101-I105 HydrophobicContact CG-CD1 4.14Å; E101-I105 WeakPolarHBondContact O-CG1 3.41Å; E101-I105 PolarHBondContact O-N 2.92Å; I102-I105 PolarHBondContact O-N 2.89Å; I105-E108 PolarHBondContact O-N 3.26Å; I105-R109 WeakPolarHBondContact O-CB 3.44Å; I105-R109 VanDerWaalsContact O-CG 3.32Å; I105-R109 WeakPolarHBondContact O-CG 3.46Å; I105-R109 PolarHBondContact O-N 3.08Å
106	N	93.5	Very high	92.5	Very high	71 Å²	71	99.9 Å²	99.9	38%	0.38	48%	0.48	S	S	.	.	H	α-helix	trans	-69.2	-35.8	179	-74.8	-30.5	0	0	0	112.9	I102 A103 Q104 K110	I102-N106 WeakPolarHBondContact O-CB 3.48Å; I102-N106 VanDerWaalsContact O-CG 3.22Å; I102-N106 PolarHBondContact O-N 3.39Å; I102-N106 PolarHBondContact O-ND2 3.45Å; I102-N106 VanDerWaalsContact O-ND2 3.13Å; A103-N106 PolarHBondContact O-N 3.38Å; Q104-N106 PolarHBondContact O-N 2.96Å; N106-K110 WeakPolarHBondContact O-CG 3.26Å; N106-K110 PolarHBondContact O-N 3.27Å; N106-K110 VanDerWaalsContact O-N 3.09Å
107	L	93.9	Very high	91.2	Very high	107 Å²	107	102.4 Å²	102.4	56%	0.56	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-45.3	173.8	-73.2	168.4	0	0	0	111.2	A103 Q104 K110 A111	A103-L107 WeakPolarHBondContact O-CG 3.43Å; A103-L107 PolarHBondContact O-N 3.49Å; Q104-L107 WeakPolarHBondContact O-CB 3.31Å; Q104-L107 PolarHBondContact O-N 3.06Å; Q104-L107 VanDerWaalsContact O-N 3.08Å; L107-K110 WeakPolarHBondContact O-CB 3.35Å; L107-K110 PolarHBondContact O-N 3.09Å; L107-A111 PolarHBondContact O-N 2.72Å
108	E	93.4	Very high	89.4	Confident	95 Å²	95	106 Å²	106	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-45.8	178.4	-71.2	172.1	-168.3	0	0	111.9	Q104 I105 K110 A111 Q112	Q104-E108 PolarHBondContact NE2-OE1 3.4Å; Q104-E108 PolarHBondContact O-N 3.01Å; I105-E108 PolarHBondContact O-N 3.26Å; E108-K110 VanDerWaalsContact C-N 3.29Å; E108-K110 PolarHBondContact O-N 2.63Å; E108-A111 PolarHBondContact O-N 3.11Å; E108-Q112 WeakPolarHBondContact O-CG 3.41Å; E108-Q112 PolarHBondContact O-N 3.3Å
109	R	92.6	Very high	87.5	Confident	151 Å²	151	108.3 Å²	108.3	57%	0.57	53%	0.529	S	S	*	.	H	α-helix	trans	-60	-38.3	174.8	-74	175.3	-179.3	177.5	0.5	112.3	I105 K113	I105-R109 WeakPolarHBondContact O-CB 3.44Å; I105-R109 VanDerWaalsContact O-CG 3.32Å; I105-R109 WeakPolarHBondContact O-CG 3.46Å; I105-R109 PolarHBondContact O-N 3.08Å; R109-K113 WeakPolarHBondContact O-CG 3.39Å; R109-K113 PolarHBondContact O-N 3.39Å; R109-K113 VanDerWaalsContact O-N 3.11Å
110	K	91.4	Very high	85.4	Confident	143 Å²	143	110.2 Å²	110.2	62%	0.622	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-42.1	175.6	-77.8	176.9	179.3	179.7	0	111.8	N106 L107 E108 K113 K114	N106-K110 WeakPolarHBondContact O-CG 3.26Å; N106-K110 PolarHBondContact O-N 3.27Å; N106-K110 VanDerWaalsContact O-N 3.09Å; L107-K110 WeakPolarHBondContact O-CB 3.35Å; L107-K110 PolarHBondContact O-N 3.09Å; E108-K110 VanDerWaalsContact C-N 3.29Å; E108-K110 PolarHBondContact O-N 2.63Å; K110-K113 PolarHBondContact O-N 3.5Å; K110-K114 PolarHBondContact O-N 3.28Å; K110-K114 VanDerWaalsContact O-N 3.11Å
111	A	91	Very high	83.1	Confident	52 Å²	52	107.1 Å²	107.1	43%	0.43	55%	0.553	S	S	.	*	H	α-helix	trans	-63.5	-42.7	177	0	0	0	0	0	111.9	L107 E108 K113 K114 K115	L107-A111 PolarHBondContact O-N 2.72Å; E108-A111 PolarHBondContact O-N 3.11Å; A111-K113 PolarHBondContact O-N 2.88Å; A111-K114 PolarHBondContact O-N 3.47Å; A111-K115 PolarHBondContact O-N 3.09Å; A111-K115 VanDerWaalsContact O-N 3.1Å
112	Q	88.9	Confident	80.8	Confident	127 Å²	127	111.4 Å²	111.4	59%	0.593	57%	0.57	S	S	*	*	H	α-helix	trans	-63.2	-40.2	176.2	-70.8	178.2	8.7	0	0	112.6	E108 K115 K116	E108-Q112 WeakPolarHBondContact O-CG 3.41Å; E108-Q112 PolarHBondContact O-N 3.3Å; Q112-K115 PolarHBondContact O-N 3.48Å; Q112-K116 PolarHBondContact O-N 2.92Å; Q112-K116 VanDerWaalsContact O-N 3.16Å
113	K	87.8	Confident	78.3	Confident	160 Å²	160	114.8 Å²	114.8	70%	0.696	59%	0.589	S	S	*	*	H	α-helix	trans	-62.6	-42	175.3	-77.4	-178	177.6	-174.5	0	112.2	R109 K110 A111 K116 S117	R109-K113 WeakPolarHBondContact O-CG 3.39Å; R109-K113 PolarHBondContact O-N 3.39Å; R109-K113 VanDerWaalsContact O-N 3.11Å; K110-K113 PolarHBondContact O-N 3.5Å; A111-K113 PolarHBondContact O-N 2.88Å; K113-K116 PolarHBondContact O-N 3.04Å; K113-S117 PolarHBondContact O-N 3.34Å; K113-S117 VanDerWaalsContact O-N 3.15Å; K113-S117 PolarHBondContact O-OG 3.11Å
114	K	82.8	Confident	75.9	Confident	149 Å²	149	117 Å²	117	65%	0.648	60%	0.602	S	S	*	*	H	α-helix	trans	-62.8	-43.6	177.1	-75.3	-173.9	174.8	-172.1	0	112.6	K110 A111 K116 S117 E118	K110-K114 PolarHBondContact O-N 3.28Å; K110-K114 VanDerWaalsContact O-N 3.11Å; A111-K114 PolarHBondContact O-N 3.47Å; K114-K116 VanDerWaalsContact C-N 3.35Å; K114-K116 PolarHBondContact O-N 3.49Å; K114-S117 WeakPolarHBondContact CA-OG 3.43Å; K114-S117 PolarHBondContact O-N 2.77Å; K114-S117 PolarHBondContact O-OG 2.86Å; K114-E118 PolarHBondContact O-N 3.43Å; K114-E118 VanDerWaalsContact O-N 3.1Å
115	K	78.5	Confident	73.5	Confident	156 Å²	156	123.9 Å²	123.9	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-61.1	-41.1	176.5	-72.3	-175.9	178.2	-175.5	0	112.4	A111 Q112 S117 E118 D119	A111-K115 PolarHBondContact O-N 3.09Å; A111-K115 VanDerWaalsContact O-N 3.1Å; Q112-K115 PolarHBondContact O-N 3.48Å; K115-S117 PolarHBondContact O-N 3.47Å; K115-E118 PolarHBondContact O-N 3.49Å; K115-D119 PolarHBondContact O-N 3.24Å; K115-D119 VanDerWaalsContact O-N 3.15Å
116	K	75.6	Confident	70.8	Confident	175 Å²	175	130.3 Å²	130.3	76%	0.761	65%	0.652	S	S	*	*	H	α-helix	trans	-64.9	-36.1	175.9	-80	-173.1	174.5	-175.6	0	113.4	Q112 K113 K114 G120	Q112-K116 PolarHBondContact O-N 2.92Å; Q112-K116 VanDerWaalsContact O-N 3.16Å; K113-K116 PolarHBondContact O-N 3.04Å; K114-K116 VanDerWaalsContact C-N 3.35Å; K114-K116 PolarHBondContact O-N 3.49Å; K116-G120 PolarHBondContact O-N 3.07Å
117	S	72	Confident	68.4	Low	84 Å²	84	132.7 Å²	132.7	59%	0.587	67%	0.671	S	S	*	*	H	α-helix	trans	-72.6	-30.1	176.8	48	0	0	0	0	113.5	K113 K114 K115	K113-S117 PolarHBondContact O-N 3.34Å; K113-S117 VanDerWaalsContact O-N 3.15Å; K113-S117 PolarHBondContact O-OG 3.11Å; K114-S117 WeakPolarHBondContact CA-OG 3.43Å; K114-S117 PolarHBondContact O-N 2.77Å; K114-S117 PolarHBondContact O-OG 2.86Å; K115-S117 PolarHBondContact O-N 3.47Å
118	E	60.9	Low	66.1	Low	142 Å²	142	132.2 Å²	132.2	66%	0.664	68%	0.683	S	S	*	*	H	α-helix	trans	-76.9	-33.5	177.1	-73	178.8	144.5	0	0	112.7	K114 K115 G121	K114-E118 PolarHBondContact O-N 3.43Å; K114-E118 VanDerWaalsContact O-N 3.1Å; K115-E118 PolarHBondContact O-N 3.49Å; E118-G121 PolarHBondContact O-N 3.2Å
119	D	58.3	Low	63.3	Low	128 Å²	128	136.7 Å²	136.7	68%	0.684	70%	0.704	S	S	*	*	H	α-helix	trans	-71.8	-35.6	178.4	-162.5	37.8	0	0	0	112.5	K115 G121 K122	K115-D119 PolarHBondContact O-N 3.24Å; K115-D119 VanDerWaalsContact O-N 3.15Å; D119-G121 PolarHBondContact O-N 3.16Å; D119-K122 PolarHBondContact O-N 2.93Å
120	G	52.2	Low	61	Low	62 Å²	62	134 Å²	134	64%	0.639	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-14.9	174.3	0	0	0	0	0	114.9	K116	K116-G120 PolarHBondContact O-N 3.07Å
121	G	49.9	Very low	58.2	Low	54 Å²	54	130.9 Å²	130.9	56%	0.557	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-8.2	-179	0	0	0	0	0	115.2	E118 D119	E118-G121 PolarHBondContact O-N 3.2Å; D119-G121 PolarHBondContact O-N 3.16Å
122	K	50.4	Low	55.9	Low	182 Å²	182	135 Å²	135	79%	0.791	74%	0.742	S	S	*	*	S	Bend	trans	-96.2	-4.4	-175.1	-94.4	177.9	176.3	173.4	0	115.3	D119	D119-K122 PolarHBondContact O-N 2.93Å
123	N	43.9	Very low	53.4	Low	163 Å²	163	135.3 Å²	135.3	87%	0.872	75%	0.752	S	S	*	*	S	Bend	trans	-97.1	17.1	-174	-127.4	36.1	0	0	0	115.3
124	S	46.3	Very low	51	Low	99 Å²	99	136.9 Å²	136.9	69%	0.692	76%	0.762	S	S	*	*			trans	-132.1	52.8	-178.3	50.4	0	0	0	0	113.4
125	R	45	Very low	49.1	Very low	242 Å²	242	134.5 Å²	134.5	91%	0.913	76%	0.764	S	S	*	*			trans	-141.6	81.8	158.4	-75.2	-170.8	177.9	170.2	-1.7	109.7
126	E	38.6	Very low	47.4	Very low	194 Å²	194	135.7 Å²	135.7	91%	0.907	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-73.4	130	156.6	-73	-168.9	150.3	0	0	108.3
127	P	42.2	Very low	45.4	Very low	122 Å²	122	138.3 Å²	138.3	79%	0.792	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-80.7	128	172.4	31.1	-27.6	0	0	0	109.5
128	A	45.4	Very low	44.1	Very low	97 Å²	97	141 Å²	141	80%	0.802	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.9	125	161.9	0	0	0	0	0	109.1
129	E	35.3	Very low	43.2	Very low	188 Å²	188	140.9 Å²	140.9	88%	0.879	81%	0.812	S	S	*	*			trans	-145.4	137.9	160.8	-89.5	-64.4	157.7	0	0	109.2
130	A	44.6	Very low	42.4	Very low	94 Å²	94	141.7 Å²	141.7	78%	0.777	82%	0.819	S	S	*	*			trans	-87.4	153.6	-161.4	0	0	0	0	0	113
131	G	33.2	Very low	41.8	Very low	79 Å²	79	146.4 Å²	146.4	81%	0.814	83%	0.83	S	S	*	*			trans	-153.3	71.1	173.5	0	0	0	0	0	111.6
132	V	41.3	Very low	41.3	Very low	138 Å²	138	152.1 Å²	152.1	84%	0.836	85%	0.847	S	S	*	*			trans	-78	120	163	173.4	0	0	0	0	107.5
133	V	36.9	Very low	40.7	Very low	134 Å²	134	150.1 Å²	150.1	81%	0.812	85%	0.851	S	S	*	*				-161.5	111.6	125.4	-148.6	0	0	0	0	108.8
134	E	38.1	Very low	40.5	Very low	192 Å²	192	149.2 Å²	149.2	90%	0.897	85%	0.849	S	S	*	*			trans	-93	135.6	155.7	-81.2	-165.3	141.7	0	0	108.3
135	S	43.2	Very low	40	Very low	99 Å²	99	153.1 Å²	153.1	69%	0.692	86%	0.861	S	S	*	*			trans	-126.7	113	160	-116.4	0	0	0	0	108.8
136	E	42	Very low	39.6	Very low	182 Å²	182	145.7 Å²	145.7	85%	0.85	86%	0.857	S	S	*	*			trans	61.5	116.7	140.3	-58.1	177.2	114.7	0	0	119.3
137	N	34.3	Very low	39.7	Very low	229 Å²	229	141.3 Å²	141.3	100%	1.225	85%	0.852	S	S	*	*				-161	0	87.4	-155.7	102.2	0	0	0	112.3

Retrieved 137 of 137 residues in 143.9 ms (Link to these results)

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