A0A087XF09_POEFO Loading...

Islet cell autoantigen 1 like

AlphaFold DB , UniProt , Accession A0A087XF09, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 547 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	35.5	Very low	35.1	Very low	220 Å²	220	138.8 Å²	138.8	100%	1.084	84%	0.838	S	S	*	*				0	78.4	0	-66.8	177.1	179.1	0	0	108.2
2	E	33.5	Very low	34.8	Very low	161 Å²	161	133.3 Å²	133.3	75%	0.752	83%	0.83	S	S	*	*				84.2	142.8	51.1	-64.9	159.9	113.7	0	0	113.5	F4	E2-F4 HydrophobicContact CB-CD2 4.04Å; E2-F4 HydrophobicContact CB-CE2 4.13Å; E2-F4 HydrophobicContact CG-CD2 4.37Å; E2-F4 HydrophobicContact CG-CE2 3.97Å
3	G	34.6	Very low	34.6	Very low	69 Å²	69	141.4 Å²	141.4	71%	0.711	84%	0.836	S	S	*	*			trans	126.3	45	-164.9	0	0	0	0	0	109.8
4	F	33.3	Very low	34.5	Very low	173 Å²	173	136 Å²	136	76%	0.759	82%	0.815	S	S	*	*				50.2	92.5	89.3	-81.7	-79	0	0	0	111.2	E2	E2-F4 HydrophobicContact CB-CD2 4.04Å; E2-F4 HydrophobicContact CB-CE2 4.13Å; E2-F4 HydrophobicContact CG-CD2 4.37Å; E2-F4 HydrophobicContact CG-CE2 3.97Å
5	A	36.2	Very low	34.8	Very low	90 Å²	90	137.3 Å²	137.3	74%	0.744	82%	0.815	S	S	*	*				80.9	97	79.7	0	0	0	0	0	113.1
6	A	35.8	Very low	35.1	Very low	112 Å²	112	136.3 Å²	136.3	93%	0.926	80%	0.804	S	S	*	*			trans	-151.6	38.6	164.7	0	0	0	0	0	110.6
7	D	36.8	Very low	35.5	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	80%	0.803	S	S	*	*	S	Bend	trans	-133.9	143.4	169.4	-141.9	-15	0	0	0	107.2
8	M	38	Very low	35.6	Very low	176 Å²	176	137.7 Å²	137.7	87%	0.867	80%	0.797	S	S	*	*			trans	69.2	66.2	-166.1	-55.1	-157.4	73.3	0	0	118.1
9	L	34.7	Very low	35.9	Very low	170 Å²	170	137 Å²	137	89%	0.89	79%	0.79	S	S	*	*			trans	-139.6	103.9	139.4	-83.5	-173.8	0	0	0	112
10	S	37.3	Very low	37	Very low	124 Å²	124	133.4 Å²	133.4	87%	0.867	77%	0.773	S	S	*	*				45.9	92.3	126.9	-153	0	0	0	0	118.1
11	G	30.5	Very low	39	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	76%	0.759	S	S	*	*			trans	-149.5	17.8	173.5	0	0	0	0	0	113.9	R13	G11-R13 VanDerWaalsContact C-N 3.33Å; G11-R13 PolarHBondContact O-N 3.08Å
12	G	31.9	Very low	41.2	Very low	73 Å²	73	125 Å²	125	75%	0.753	74%	0.739	S	S	*	*			trans	-67.6	89.4	174.5	0	0	0	0	0	110.8	A14	G12-A14 VanDerWaalsContact C-N 3.29Å; G12-A14 WeakPolarHBondContact O-CB 3.49Å; G12-A14 PolarHBondContact O-N 3.47Å
13	R	32.3	Very low	43.5	Very low	238 Å²	238	122.8 Å²	122.8	90%	0.898	73%	0.73	S	S	*	*			trans	-81.1	80.4	151.8	-119.9	179.7	-177.2	-157	1.3	105.2	G11 L15	G11-R13 VanDerWaalsContact C-N 3.33Å; G11-R13 PolarHBondContact O-N 3.08Å; R13-L15 PolarHBondContact O-N 3.1Å
14	A	33	Very low	45.7	Very low	66 Å²	66	121.1 Å²	121.1	55%	0.545	71%	0.71	S	S	.	*				33.5	67.8	67.7	0	0	0	0	0	108.7	G12 L16	G12-A14 VanDerWaalsContact C-N 3.29Å; G12-A14 WeakPolarHBondContact O-CB 3.49Å; G12-A14 PolarHBondContact O-N 3.47Å; A14-L16 PolarHBondContact O-N 3.2Å
15	L	39.3	Very low	48	Very low	155 Å²	155	118.5 Å²	118.5	81%	0.812	70%	0.695	S	S	*	*			trans	-52.9	109.9	157.2	-171.8	166.4	0	0	0	104.5	R13 D17	R13-L15 PolarHBondContact O-N 3.1Å; L15-D17 PolarHBondContact O-N 2.84Å
16	L	39.2	Very low	50.5	Low	122 Å²	122	120.2 Å²	120.2	64%	0.639	69%	0.689	S	S	*	*			trans	-69.2	84	-177.5	-67.9	173.7	0	0	0	108.4	A14 E18	A14-L16 PolarHBondContact O-N 3.2Å; L16-E18 HydrophobicContact CB-CB 4.42Å; L16-E18 HydrophobicContact CB-CG 4.12Å; L16-E18 HydrophobicContact CD2-CG 4.22Å; L16-E18 PolarHBondContact O-N 3Å
17	D	42.3	Very low	52.9	Low	149 Å²	149	118.5 Å²	118.5	80%	0.797	66%	0.662	S	S	*	*			trans	-69.4	56.7	148.5	-161	32.5	0	0	0	107.6	L15 D19	L15-D17 PolarHBondContact O-N 2.84Å; D17-D19 PolarHBondContact O-N 3.46Å
18	E	36.1	Very low	55.3	Low	149 Å²	149	114.7 Å²	114.7	70%	0.696	64%	0.637	S	S	*	*			trans	-64.5	104.4	169.3	-96.4	-176.8	157.5	0	0	106.4	L16 S20	L16-E18 HydrophobicContact CB-CB 4.42Å; L16-E18 HydrophobicContact CB-CG 4.12Å; L16-E18 HydrophobicContact CD2-CG 4.22Å; L16-E18 PolarHBondContact O-N 3Å; E18-S20 PolarHBondContact O-N 3.41Å; E18-S20 VanDerWaalsContact O-N 3.14Å
19	D	41.6	Very low	57.7	Low	124 Å²	124	111.4 Å²	111.4	66%	0.663	62%	0.618	S	S	*	*			trans	14.8	89.9	159.6	-97.8	-60.7	0	0	0	113.2	D17 S21 R25	D17-D19 PolarHBondContact O-N 3.46Å; D19-S21 PolarHBondContact O-N 2.79Å; D19-R25 IonicContact OD1-CZ 2.75Å; D19-R25 IonicContact OD1-NH1 2.74Å; D19-R25 IonicContact OD1-NH2 2.74Å; D19-R25 PolarHBondContact OD1-NH2 3Å
20	S	59	Low	60.5	Low	64 Å²	64	108.5 Å²	108.5	45%	0.448	60%	0.599	S	S	.	*			trans	-47.3	113.4	167.1	62.6	0	0	0	0	107.6	E18 R25	E18-S20 PolarHBondContact O-N 3.41Å; E18-S20 VanDerWaalsContact O-N 3.14Å; S20-R25 PolarHBondContact O-NE 3.17Å; S20-R25 PolarHBondContact O-NH2 3.06Å; S20-R25 WeakPolarHBondContact OG-CG 3.44Å
21	S	78.1	Confident	63.1	Low	68 Å²	68	103.3 Å²	103.3	48%	0.476	56%	0.56	S	S	.	*			trans	-47.4	150.3	-167.6	174.1	0	0	0	0	110.4	D19 M23 A24 R25	D19-S21 PolarHBondContact O-N 2.79Å; S21-M23 CarbonylContact O-C 3.54Å; S21-M23 PolarHBondContact O-N 3.11Å; S21-M23 PolarHBondContact OG-N 3.28Å; S21-A24 WeakPolarHBondContact O-CA 3.48Å; S21-A24 WeakPolarHBondContact O-CB 3.29Å; S21-A24 PolarHBondContact O-N 3.15Å; S21-R25 PolarHBondContact O-N 3.27Å
22	V	81.9	Confident	66	Low	109 Å²	109	102.3 Å²	102.3	66%	0.661	53%	0.534	S	S	*	.	H	α-helix	trans	-47.5	-36.5	173.9	-179.6	0	0	0	0	110.7	M26	V22-M26 WeakPolarHBondContact O-CB 3.46Å; V22-M26 PolarHBondContact O-N 3.07Å
23	M	81.2	Confident	68.9	Low	116 Å²	116	101.7 Å²	101.7	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-41.6	172.1	-64.4	-59.1	-67.4	0	0	114.4	S21 M26 Q27	S21-M23 CarbonylContact O-C 3.54Å; S21-M23 PolarHBondContact O-N 3.11Å; S21-M23 PolarHBondContact OG-N 3.28Å; M23-M26 PolarHBondContact O-N 3.32Å; M23-Q27 WeakPolarHBondContact O-CB 3.43Å; M23-Q27 VanDerWaalsContact O-CG 3.22Å; M23-Q27 WeakPolarHBondContact O-CG 3.37Å; M23-Q27 PolarHBondContact O-N 3.24Å
24	A	80.2	Confident	71.7	Confident	34 Å²	34	93.9 Å²	93.9	28%	0.281	49%	0.489	S	S	.	.	H	α-helix	trans	-70.1	-40.2	176.9	0	0	0	0	0	111.9	S21 Q27 K28	S21-A24 WeakPolarHBondContact O-CA 3.48Å; S21-A24 WeakPolarHBondContact O-CB 3.29Å; S21-A24 PolarHBondContact O-N 3.15Å; A24-Q27 PolarHBondContact O-N 3.33Å; A24-K28 PolarHBondContact O-N 3.49Å
25	R	83.1	Confident	74.5	Confident	118 Å²	118	91.3 Å²	91.3	45%	0.445	47%	0.466	S	S	.	.	H	α-helix	trans	-61.9	-44.2	171.1	-77.7	-177.2	-92.9	-162.4	-13.2	111.4	D19 S20 S21 K28 K29	D19-R25 IonicContact OD1-CZ 2.75Å; D19-R25 IonicContact OD1-NH1 2.74Å; D19-R25 IonicContact OD1-NH2 2.74Å; D19-R25 PolarHBondContact OD1-NH2 3Å; S20-R25 PolarHBondContact O-NE 3.17Å; S20-R25 PolarHBondContact O-NH2 3.06Å; S20-R25 WeakPolarHBondContact OG-CG 3.44Å; S21-R25 PolarHBondContact O-N 3.27Å; R25-K28 PolarHBondContact O-N 2.67Å; R25-K29 PolarHBondContact O-N 3.46Å
26	M	88.4	Confident	76.9	Confident	125 Å²	125	86.8 Å²	86.8	62%	0.616	44%	0.444	S	S	*	.	H	α-helix	trans	-62.8	-42.3	175.6	-171.7	-179.9	-172.9	0	0	111.9	V22 M23 K29 F30	V22-M26 WeakPolarHBondContact O-CB 3.46Å; V22-M26 PolarHBondContact O-N 3.07Å; M23-M26 PolarHBondContact O-N 3.32Å; M26-K29 PolarHBondContact O-N 2.71Å; M26-F30 VanDerWaalsContact O-CB 3.32Å; M26-F30 WeakPolarHBondContact O-CB 3.25Å; M26-F30 PolarHBondContact O-N 2.98Å
27	Q	86.8	Confident	79.4	Confident	76 Å²	76	85.3 Å²	85.3	36%	0.355	44%	0.436	S	S	.	.	H	α-helix	trans	-62.9	-46.3	173.9	-75.9	168.4	-4.1	0	0	111.6	M23 A24 K29 F30 W31 W172	M23-Q27 WeakPolarHBondContact O-CB 3.43Å; M23-Q27 VanDerWaalsContact O-CG 3.22Å; M23-Q27 WeakPolarHBondContact O-CG 3.37Å; M23-Q27 PolarHBondContact O-N 3.24Å; A24-Q27 PolarHBondContact O-N 3.33Å; Q27-K29 PolarHBondContact O-N 2.81Å; Q27-F30 PolarHBondContact O-N 3.02Å; Q27-W31 PolarHBondContact O-N 3.01Å; Q27-W172 HydrophobicContact CB-CH2 3.75Å; Q27-W172 HydrophobicContact CB-CZ2 3.77Å; Q27-W172 HydrophobicContact CB-CZ3 4.43Å; Q27-W172 HydrophobicContact CG-CZ2 4.34Å; Q27-W172 VanDerWaalsContact OE1-CZ2 3.3Å
28	K	86.3	Confident	81.5	Confident	77 Å²	77	79.5 Å²	79.5	34%	0.335	41%	0.405	S	S	.	.	H	α-helix	trans	-58	-46.8	175	-171.1	-172.5	175.2	-165.1	0	111.4	A24 R25 K32 E165	A24-K28 PolarHBondContact O-N 3.49Å; R25-K28 PolarHBondContact O-N 2.67Å; K28-K32 WeakPolarHBondContact O-CB 3.23Å; K28-K32 PolarHBondContact O-N 2.96Å; K28-K32 VanDerWaalsContact O-N 3.09Å; K28-E165 WeakPolarHBondContact CE-OE2 3.35Å; K28-E165 IonicContact NZ-OE2 3.4Å; K28-E165 PolarHBondContact NZ-OE2 2.78Å
29	K	88.5	Confident	83.9	Confident	107 Å²	107	78 Å²	78	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-60.2	-48.2	174.9	-78.6	-154.5	178.3	-158.9	0	111.3	R25 M26 Q27 W31 K32 T33 D410	R25-K29 PolarHBondContact O-N 3.46Å; M26-K29 PolarHBondContact O-N 2.71Å; Q27-K29 PolarHBondContact O-N 2.81Å; K29-W31 PolarHBondContact O-N 3.4Å; K29-K32 PolarHBondContact O-N 3.24Å; K29-T33 WeakPolarHBondContact O-CB 3.48Å; K29-T33 PolarHBondContact O-N 3.05Å; K29-T33 PolarHBondContact O-OG1 3.39Å; K29-T33 VanDerWaalsContact O-OG1 3.09Å; K29-D410 IonicContact NZ-OD1 3.36Å; K29-D410 PolarHBondContact NZ-OD1 3.34Å; K29-D410 IonicContact NZ-OD2 3.42Å; K29-D410 PolarHBondContact NZ-OD2 3.29Å
30	F	93.6	Very high	86.1	Confident	109 Å²	109	76 Å²	76	48%	0.478	40%	0.397	S	S	.	.	H	α-helix	trans	-55.1	-50.5	179.1	171.5	-96.6	0	0	0	112.4	M26 Q27 T33 K34	M26-F30 VanDerWaalsContact O-CB 3.32Å; M26-F30 WeakPolarHBondContact O-CB 3.25Å; M26-F30 PolarHBondContact O-N 2.98Å; Q27-F30 PolarHBondContact O-N 3.02Å; F30-T33 PolarHBondContact O-N 3.36Å; F30-K34 HydrophobicContact CE1-CD 4.01Å; F30-K34 HydrophobicContact CZ-CD 4.11Å; F30-K34 VanDerWaalsContact O-CB 3.31Å; F30-K34 WeakPolarHBondContact O-CB 3.46Å; F30-K34 PolarHBondContact O-N 2.93Å
31	W	92.8	Very high	87.5	Confident	16 Å²	16	76.3 Å²	76.3	6%	0.061	40%	0.396	C	S	.	.	H	α-helix	trans	-69.1	-35.4	-178.6	-71.9	110.2	0	0	0	113.1	Q27 K29 K34 Q35 L171 W172 D175	Q27-W31 PolarHBondContact O-N 3.01Å; K29-W31 PolarHBondContact O-N 3.4Å; W31-K34 HydrophobicContact CE3-CD 3.81Å; W31-K34 HydrophobicContact CH2-CD 4.36Å; W31-K34 VanDerWaalsContact CH2-NZ 3.32Å; W31-K34 HydrophobicContact CZ3-CD 3.6Å; W31-Q35 PolarHBondContact O-N 3.13Å; W31-L171 HydrophobicContact CE3-CB 4.33Å; W31-L171 HydrophobicContact CE3-CD2 3.93Å; W31-L171 HydrophobicContact CE3-CG 3.91Å; W31-L171 HydrophobicContact CZ3-CD2 4Å; W31-L171 HydrophobicContact CZ3-CG 3.79Å; W31-W172 HydrophobicContact CB-CB 4.2Å; W31-W172 AromaticContact CD1-CD1 3.64Å; W31-W172 AromaticContact CD1-CD2 3.4Å; W31-W172 VanDerWaalsContact CD1-CD2 3.4Å; W31-W172 AromaticContact CD1-CE2 3.84Å; W31-W172 AromaticContact CD1-CE3 3.9Å; W31-W172 AromaticContact CD1-CG 3.3Å; W31-W172 AromaticContact CD1-NE1 3.94Å; W31-W172 HydrophobicContact CD2-CB 3.69Å; W31-W172 AromaticContact CD2-CG 3.97Å; W31-W172 HydrophobicContact CD2-CG 3.97Å; W31-W172 AromaticContact CE2-CD1 3.47Å; W31-W172 VanDerWaalsContact CE2-CD1 3.47Å; W31-W172 AromaticContact CE2-CG 3.72Å; W31-W172 HydrophobicContact CE3-CB 4.25Å; W31-W172 HydrophobicContact CG-CB 3.61Å; W31-W172 HydrophobicContact CG-CD2 4.19Å; W31-W172 AromaticContact CG-CG 3.78Å; W31-W172 HydrophobicContact CG-CG 3.78Å; W31-W172 AromaticContact CZ2-CD1 3.9Å; W31-W172 HydrophobicContact CZ2-CG 4.49Å; W31-W172 AromaticContact NE1-CD1 3.09Å; W31-W172 AromaticContact NE1-CD2 3.66Å; W31-W172 AromaticContact NE1-CE2 3.73Å; W31-W172 AromaticContact NE1-CG 3.28Å; W31-W172 VanDerWaalsContact NE1-CG 3.28Å; W31-W172 AromaticContact NE1-NE1 3.38Å; W31-D175 HydrophobicContact CH2-CB 3.54Å; W31-D175 WeakPolarHBondContact CH2-OD1 3.5Å; W31-D175 WeakPolarHBondContact CH2-OD2 3.24Å; W31-D175 HydrophobicContact CZ2-CB 4Å; W31-D175 VanDerWaalsContact CZ2-OD2 3.31Å; W31-D175 WeakPolarHBondContact CZ2-OD2 3.46Å; W31-D175 HydrophobicContact CZ3-CB 4.24Å
32	K	90.7	Very high	87.7	Confident	53 Å²	53	76.3 Å²	76.3	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-60.7	-50.1	170.3	-175	-173.8	-177.6	171	0	111.2	K28 K29 K34 Q35 V36 T164 E165	K28-K32 WeakPolarHBondContact O-CB 3.23Å; K28-K32 PolarHBondContact O-N 2.96Å; K28-K32 VanDerWaalsContact O-N 3.09Å; K29-K32 PolarHBondContact O-N 3.24Å; K32-K34 PolarHBondContact O-N 3.13Å; K32-Q35 WeakPolarHBondContact O-CB 3.44Å; K32-Q35 PolarHBondContact O-N 3.14Å; K32-V36 WeakPolarHBondContact O-CG2 3.49Å; K32-V36 PolarHBondContact O-N 3.16Å; K32-T164 HydrophobicContact CG-CG2 4.42Å; K32-E165 HydrophobicContact CD-CG 3.67Å; K32-E165 WeakPolarHBondContact CE-OE1 3.45Å; K32-E165 HydrophobicContact CG-CG 4.06Å; K32-E165 IonicContact NZ-OE1 3.19Å; K32-E165 PolarHBondContact NZ-OE1 3.14Å
33	T	92.2	Very high	87.9	Confident	60 Å²	60	77.5 Å²	77.5	37%	0.368	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-39.2	178.9	-60.2	0	0	0	0	111.9	K29 F30 Q35 V36 L37 L414	K29-T33 WeakPolarHBondContact O-CB 3.48Å; K29-T33 PolarHBondContact O-N 3.05Å; K29-T33 PolarHBondContact O-OG1 3.39Å; K29-T33 VanDerWaalsContact O-OG1 3.09Å; F30-T33 PolarHBondContact O-N 3.36Å; T33-Q35 VanDerWaalsContact C-N 3.32Å; T33-Q35 PolarHBondContact O-N 3.1Å; T33-V36 PolarHBondContact O-N 3.09Å; T33-L37 WeakPolarHBondContact O-CB 3.48Å; T33-L37 PolarHBondContact O-N 2.86Å; T33-L414 HydrophobicContact CG2-CD2 4.2Å
34	K	90.9	Very high	88	Confident	74 Å²	74	80.1 Å²	80.1	32%	0.322	41%	0.411	S	S	.	.	H	α-helix	trans	-60.8	-40	173.7	-174.1	171.7	172.5	-178.2	0	111.6	F30 W31 K32 L37 I38 L171	F30-K34 HydrophobicContact CE1-CD 4.01Å; F30-K34 HydrophobicContact CZ-CD 4.11Å; F30-K34 VanDerWaalsContact O-CB 3.31Å; F30-K34 WeakPolarHBondContact O-CB 3.46Å; F30-K34 PolarHBondContact O-N 2.93Å; W31-K34 HydrophobicContact CE3-CD 3.81Å; W31-K34 HydrophobicContact CH2-CD 4.36Å; W31-K34 VanDerWaalsContact CH2-NZ 3.32Å; W31-K34 HydrophobicContact CZ3-CD 3.6Å; K32-K34 PolarHBondContact O-N 3.13Å; K34-L37 PolarHBondContact O-N 3.39Å; K34-I38 HydrophobicContact CG-CD1 4.2Å; K34-I38 VanDerWaalsContact O-CG1 3.28Å; K34-I38 WeakPolarHBondContact O-CG1 3.44Å; K34-I38 PolarHBondContact O-N 3.28Å; K34-L171 HydrophobicContact CD-CD2 4.21Å; K34-L171 HydrophobicContact CG-CD2 4.09Å
35	Q	91.5	Very high	88.2	Confident	13 Å²	13	80.4 Å²	80.4	6%	0.061	41%	0.407	C	S	.	.	H	α-helix	trans	-66.1	-44	173.9	-171.3	64	35	0	0	112.6	W31 K32 T33 L37 I38 K39 E45 T164 R167	W31-Q35 PolarHBondContact O-N 3.13Å; K32-Q35 WeakPolarHBondContact O-CB 3.44Å; K32-Q35 PolarHBondContact O-N 3.14Å; T33-Q35 VanDerWaalsContact C-N 3.32Å; T33-Q35 PolarHBondContact O-N 3.1Å; Q35-L37 VanDerWaalsContact C-N 3.28Å; Q35-L37 PolarHBondContact O-N 3.01Å; Q35-I38 PolarHBondContact O-N 3.16Å; Q35-K39 PolarHBondContact O-N 3.18Å; Q35-E45 PolarHBondContact NE2-OE1 3.3Å; Q35-E45 PolarHBondContact NE2-OE2 3.49Å; Q35-T164 HydrophobicContact CG-CG2 4.43Å; Q35-R167 HydrophobicContact CG-CB 3.7Å
36	V	90.3	Very high	88.3	Confident	60 Å²	60	77.7 Å²	77.7	36%	0.364	40%	0.401	S	S	.	.	H	α-helix	trans	-57.2	-44.7	174.7	173	0	0	0	0	110.5	K32 T33 K39 A40 T164	K32-V36 WeakPolarHBondContact O-CG2 3.49Å; K32-V36 PolarHBondContact O-N 3.16Å; T33-V36 PolarHBondContact O-N 3.09Å; V36-K39 PolarHBondContact O-N 3.24Å; V36-A40 VanDerWaalsContact O-CB 3.32Å; V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.09Å; V36-T164 HydrophobicContact CG2-CG2 3.62Å
37	L	91.5	Very high	88.3	Confident	90 Å²	90	77.7 Å²	77.7	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-65.9	-39.3	178.1	-174.5	66.2	0	0	0	112.5	T33 K34 Q35 A40 T41	T33-L37 WeakPolarHBondContact O-CB 3.48Å; T33-L37 PolarHBondContact O-N 2.86Å; K34-L37 PolarHBondContact O-N 3.39Å; Q35-L37 VanDerWaalsContact C-N 3.28Å; Q35-L37 PolarHBondContact O-N 3.01Å; L37-A40 PolarHBondContact O-N 2.69Å; L37-T41 HydrophobicContact CD1-CG2 3.83Å; L37-T41 HydrophobicContact CG-CG2 4.2Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.41Å; L37-T41 PolarHBondContact O-N 2.83Å; L37-T41 PolarHBondContact O-OG1 3.43Å
38	I	87.5	Confident	88.3	Confident	28 Å²	28	83.5 Å²	83.5	14%	0.144	42%	0.42	C	S	.	.	H	α-helix	trans	-59.9	-49.6	174.8	-75.6	163.8	0	0	0	110.5	K34 Q35 A40 T41 G42 K43 E45 L171	K34-I38 HydrophobicContact CG-CD1 4.2Å; K34-I38 VanDerWaalsContact O-CG1 3.28Å; K34-I38 WeakPolarHBondContact O-CG1 3.44Å; K34-I38 PolarHBondContact O-N 3.28Å; Q35-I38 PolarHBondContact O-N 3.16Å; I38-A40 PolarHBondContact O-N 3.28Å; I38-T41 PolarHBondContact O-N 3.05Å; I38-T41 PolarHBondContact O-OG1 3.13Å; I38-G42 PolarHBondContact O-N 2.91Å; I38-K43 HydrophobicContact CG2-CB 4.21Å; I38-K43 PolarHBondContact O-N 3.02Å; I38-E45 HydrophobicContact CG2-CG 3.76Å; I38-L171 HydrophobicContact CD1-CD2 3.59Å
39	K	86.6	Confident	88.5	Confident	118 Å²	118	81.4 Å²	81.4	51%	0.513	41%	0.413	S	S	.	.	H	α-helix	trans	-60.2	-43.2	176.8	-172.9	174.8	-177.9	175.6	0	111.9	Q35 V36 E160	Q35-K39 PolarHBondContact O-N 3.18Å; V36-K39 PolarHBondContact O-N 3.24Å; K39-E160 IonicContact NZ-OE2 3.93Å
40	A	87.2	Confident	88.5	Confident	81 Å²	81	79.6 Å²	79.6	67%	0.669	41%	0.411	S	S	*	.	H	α-helix	trans	-71.7	-33	180	0	0	0	0	0	113.8	V36 L37 I38 G42	V36-A40 VanDerWaalsContact O-CB 3.32Å; V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.09Å; L37-A40 PolarHBondContact O-N 2.69Å; I38-A40 PolarHBondContact O-N 3.28Å; A40-G42 VanDerWaalsContact C-N 3.34Å
41	T	87.8	Confident	88.3	Confident	71 Å²	71	77.6 Å²	77.6	44%	0.436	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	2.5	179.3	55.4	0	0	0	0	113.8	L37 I38 K43	L37-T41 HydrophobicContact CD1-CG2 3.83Å; L37-T41 HydrophobicContact CG-CG2 4.2Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 WeakPolarHBondContact O-CG2 3.41Å; L37-T41 PolarHBondContact O-N 2.83Å; L37-T41 PolarHBondContact O-OG1 3.43Å; I38-T41 PolarHBondContact O-N 3.05Å; I38-T41 PolarHBondContact O-OG1 3.13Å; T41-K43 PolarHBondContact O-N 3.39Å
42	G	81.9	Confident	88.2	Confident	68 Å²	68	80.6 Å²	80.6	70%	0.701	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	19.7	179	0	0	0	0	0	114.4	I38 A40	I38-G42 PolarHBondContact O-N 2.91Å; A40-G42 VanDerWaalsContact C-N 3.34Å
43	K	87.2	Confident	88.4	Confident	134 Å²	134	78.4 Å²	78.4	58%	0.583	43%	0.429	S	S	*	.			trans	-68.6	140.7	178.6	-72.8	177.7	-177.6	-179.5	0	109.8	I38 T41 E45	I38-K43 HydrophobicContact CG2-CB 4.21Å; I38-K43 PolarHBondContact O-N 3.02Å; T41-K43 PolarHBondContact O-N 3.39Å; K43-E45 PolarHBondContact O-N 3.22Å
44	K	83.4	Confident	88.4	Confident	171 Å²	171	78.1 Å²	78.1	74%	0.743	43%	0.432	S	S	*	.			trans	-57.2	115.3	-178	-173.8	173.8	-179.3	-180	0	110.5	E47	K44-E47 WeakPolarHBondContact CE-OE2 3.46Å; K44-E47 IonicContact NZ-OE2 3.18Å; K44-E47 PolarHBondContact NZ-OE2 3.36Å
45	E	84.3	Confident	88.5	Confident	40 Å²	40	81.1 Å²	81.1	19%	0.187	45%	0.452	C	S	.	.			trans	-78.3	173.6	171.9	-69.9	-160.9	-178.5	0	0	111.8	Q35 I38 K43 E47 V50 R167	Q35-E45 PolarHBondContact NE2-OE1 3.3Å; Q35-E45 PolarHBondContact NE2-OE2 3.49Å; I38-E45 HydrophobicContact CG2-CG 3.76Å; K43-E45 PolarHBondContact O-N 3.22Å; E45-E47 PolarHBondContact O-N 3.12Å; E45-V50 HydrophobicContact CB-CG2 3.86Å; E45-R167 IonicContact OE2-CZ 2.67Å; E45-R167 IonicContact OE2-NE 3.09Å; E45-R167 PolarHBondContact OE2-NE 3.41Å; E45-R167 IonicContact OE2-NH2 3.87Å; E45-R167 PolarHBondContact OE2-NH2 3.41Å
46	D	85.9	Confident	88.8	Confident	60 Å²	60	80.6 Å²	80.6	32%	0.321	45%	0.45	S	S	.	.			trans	-68.4	120.1	175.9	-160.3	-64.5	0	0	0	110.9	Y48 V49 V50 K174	D46-Y48 VanDerWaalsContact C-N 3.32Å; D46-Y48 PolarHBondContact O-N 3.33Å; D46-Y48 PolarHBondContact OD1-N 3.43Å; D46-V49 HydrophobicContact CB-CB 4.19Å; D46-V49 HydrophobicContact CB-CG2 3.83Å; D46-V49 PolarHBondContact O-N 3.04Å; D46-V50 PolarHBondContact O-N 3.24Å; D46-K174 IonicContact OD2-NZ 2.68Å; D46-K174 PolarHBondContact OD2-NZ 2.85Å
47	E	87.3	Confident	89.1	Confident	125 Å²	125	80.2 Å²	80.2	58%	0.584	45%	0.445	S	S	*	.	H	α-helix	trans	-63.2	-36.3	-167.2	-163.3	163.9	145.5	0	0	112.6	K44 E45 V50 A51	K44-E47 WeakPolarHBondContact CE-OE2 3.46Å; K44-E47 IonicContact NZ-OE2 3.18Å; K44-E47 PolarHBondContact NZ-OE2 3.36Å; E45-E47 PolarHBondContact O-N 3.12Å; E47-V50 PolarHBondContact O-N 3.19Å; E47-A51 WeakPolarHBondContact O-CB 3.41Å; E47-A51 PolarHBondContact O-N 3.21Å
48	Y	87.8	Confident	89.3	Confident	199 Å²	199	79.2 Å²	79.2	78%	0.78	45%	0.446	S	S	*	.	H	α-helix	trans	-70.7	-32.6	176.2	-61.2	-75.5	0	0	0	112.4	D46 S52	D46-Y48 VanDerWaalsContact C-N 3.32Å; D46-Y48 PolarHBondContact O-N 3.33Å; D46-Y48 PolarHBondContact OD1-N 3.43Å; Y48-S52 VanDerWaalsContact O-CB 3.25Å; Y48-S52 WeakPolarHBondContact O-CB 3.49Å; Y48-S52 PolarHBondContact O-N 2.87Å
49	V	88.7	Confident	89.7	Confident	33 Å²	33	80 Å²	80	20%	0.2	45%	0.448	C	S	.	.	H	α-helix	trans	-73.7	-35.8	176.9	-174.3	0	0	0	0	110.5	D46 D53 R167 L170	D46-V49 HydrophobicContact CB-CB 4.19Å; D46-V49 HydrophobicContact CB-CG2 3.83Å; D46-V49 PolarHBondContact O-N 3.04Å; V49-D53 PolarHBondContact O-N 3Å; V49-R167 HydrophobicContact CG1-CG 4.01Å; V49-L170 HydrophobicContact CG1-CD1 4.19Å; V49-L170 HydrophobicContact CG2-CD1 4.12Å
50	V	89.4	Confident	90.3	Very high	68 Å²	68	74.4 Å²	74.4	41%	0.412	42%	0.424	S	S	.	.	H	α-helix	trans	-66.3	-47.5	171	177.4	0	0	0	0	111	E45 D46 E47 S52 D53	E45-V50 HydrophobicContact CB-CG2 3.86Å; D46-V50 PolarHBondContact O-N 3.24Å; E47-V50 PolarHBondContact O-N 3.19Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.39Å; V50-D53 PolarHBondContact O-N 2.99Å; V50-D53 VanDerWaalsContact O-N 3.11Å
51	A	89.8	Confident	90.8	Very high	67 Å²	67	76.5 Å²	76.5	55%	0.554	42%	0.42	S	S	*	.	H	α-helix	trans	-60.1	-39.5	178.1	0	0	0	0	0	112.8	E47 D53 A54	E47-A51 WeakPolarHBondContact O-CB 3.41Å; E47-A51 PolarHBondContact O-N 3.21Å; A51-D53 PolarHBondContact O-N 3.01Å; A51-A54 WeakPolarHBondContact O-CB 3.5Å; A51-A54 PolarHBondContact O-N 3.46Å
52	S	90.7	Very high	91.3	Very high	80 Å²	80	77.7 Å²	77.7	56%	0.559	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.8	177	-171.3	0	0	0	0	114.3	Y48 V50	Y48-S52 VanDerWaalsContact O-CB 3.25Å; Y48-S52 WeakPolarHBondContact O-CB 3.49Å; Y48-S52 PolarHBondContact O-N 2.87Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.39Å
53	D	93.9	Very high	92	Very high	7 Å²	7	74.6 Å²	74.6	4%	0.037	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-9.1	179.6	-96.1	-55.2	0	0	0	113.9	V49 V50 A51 D55 L56 D57 R163 R167	V49-D53 PolarHBondContact O-N 3Å; V50-D53 PolarHBondContact O-N 2.99Å; V50-D53 VanDerWaalsContact O-N 3.11Å; A51-D53 PolarHBondContact O-N 3.01Å; D53-D55 PolarHBondContact O-N 3.16Å; D53-L56 PolarHBondContact O-N 3.26Å; D53-L56 VanDerWaalsContact O-N 3.08Å; D53-D57 PolarHBondContact O-N 3.4Å; D53-R163 VanDerWaalsContact CG-NH2 3.29Å; D53-R163 IonicContact OD1-CZ 2.73Å; D53-R163 IonicContact OD1-NE 2.68Å; D53-R163 PolarHBondContact OD1-NE 2.85Å; D53-R163 IonicContact OD1-NH2 2.73Å; D53-R163 PolarHBondContact OD1-NH2 2.9Å; D53-R163 IonicContact OD2-NE 3.84Å; D53-R167 IonicContact OD2-CZ 3.59Å; D53-R167 IonicContact OD2-NH1 3.4Å; D53-R167 PolarHBondContact OD2-NH1 3.05Å; D53-R167 IonicContact OD2-NH2 2.89Å
54	A	93.4	Very high	92.6	Very high	53 Å²	53	73.9 Å²	73.9	44%	0.438	38%	0.38	S	S	.	.	H	α-helix	trans	-56.6	-43.9	-171.1	0	0	0	0	0	113.9	A51 L56 D57 S58	A51-A54 WeakPolarHBondContact O-CB 3.5Å; A51-A54 PolarHBondContact O-N 3.46Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 3.46Å; A54-D57 PolarHBondContact O-N 3.29Å; A54-S58 PolarHBondContact O-N 3.32Å
55	D	93.2	Very high	93.3	Very high	137 Å²	137	68.6 Å²	68.6	73%	0.733	37%	0.365	S	S	*	.	H	α-helix	trans	-60.5	-43.1	178	-66.5	-26.8	0	0	0	111.6	D53 S58 K59	D53-D55 PolarHBondContact O-N 3.16Å; D55-S58 PolarHBondContact O-N 3.35Å; D55-S58 PolarHBondContact O-OG 3.14Å; D55-K59 PolarHBondContact O-N 2.93Å
56	L	96.3	Very high	93.9	Very high	3 Å²	3	66.8 Å²	66.8	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-70.5	-38.7	179	178.3	57.3	0	0	0	111.3	D53 A54 K59 L60 M159 F205 K209 V212	D53-L56 PolarHBondContact O-N 3.26Å; D53-L56 VanDerWaalsContact O-N 3.08Å; A54-L56 VanDerWaalsContact C-N 3.32Å; A54-L56 PolarHBondContact O-N 3.46Å; L56-K59 VanDerWaalsContact O-CB 3.27Å; L56-K59 WeakPolarHBondContact O-CB 3.39Å; L56-K59 PolarHBondContact O-N 3.31Å; L56-K59 VanDerWaalsContact O-N 3.15Å; L56-L60 WeakPolarHBondContact O-CG 3.27Å; L56-L60 PolarHBondContact O-N 2.7Å; L56-M159 HydrophobicContact CD1-CE 3.96Å; L56-M159 HydrophobicContact CD2-CE 3.96Å; L56-M159 HydrophobicContact CD2-SD 3.72Å; L56-M159 HydrophobicContact CG-CE 4.14Å; L56-F205 HydrophobicContact CD2-CE2 3.82Å; L56-F205 HydrophobicContact CD2-CZ 3.77Å; L56-K209 HydrophobicContact CD1-CG 4.22Å; L56-K209 HydrophobicContact CD2-CB 4.09Å; L56-K209 HydrophobicContact CD2-CD 3.99Å; L56-K209 HydrophobicContact CD2-CG 3.87Å; L56-V212 HydrophobicContact CD1-CG1 4.41Å
57	D	96.8	Very high	94.5	Very high	51 Å²	51	66.2 Å²	66.2	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-65.1	-39.4	175.8	-74.1	-25	0	0	0	111.8	D53 A54 K59 L60 E61 R163	D53-D57 PolarHBondContact O-N 3.4Å; A54-D57 PolarHBondContact O-N 3.29Å; D57-K59 VanDerWaalsContact C-N 3.26Å; D57-K59 PolarHBondContact O-N 3.09Å; D57-L60 WeakPolarHBondContact O-CB 3.4Å; D57-L60 PolarHBondContact O-N 3.09Å; D57-L60 VanDerWaalsContact O-N 3.14Å; D57-E61 WeakPolarHBondContact O-CG 3.43Å; D57-E61 PolarHBondContact O-N 2.99Å; D57-R163 VanDerWaalsContact CG-NH2 3.35Å; D57-R163 IonicContact OD1-CZ 3.67Å; D57-R163 IonicContact OD1-NH1 3.63Å; D57-R163 PolarHBondContact OD1-NH1 3.46Å; D57-R163 IonicContact OD1-NH2 3.19Å; D57-R163 PolarHBondContact OD1-NH2 3.45Å; D57-R163 IonicContact OD2-NH2 2.62Å
58	S	96.3	Very high	95	Very high	69 Å²	69	65.3 Å²	65.3	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-37.6	171.5	84.8	0	0	0	0	112.2	A54 D55 E61 F62	A54-S58 PolarHBondContact O-N 3.32Å; D55-S58 PolarHBondContact O-N 3.35Å; D55-S58 PolarHBondContact O-OG 3.14Å; S58-E61 PolarHBondContact O-N 2.9Å; S58-F62 PolarHBondContact O-N 2.81Å
59	K	97.1	Very high	95.5	Very high	45 Å²	45	58.2 Å²	58.2	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-66.6	-39.9	176.2	-154.4	71.9	157.3	-169.5	0	111.7	D55 L56 D57 F62 F63 C213 V216 D217	D55-K59 PolarHBondContact O-N 2.93Å; L56-K59 VanDerWaalsContact O-CB 3.27Å; L56-K59 WeakPolarHBondContact O-CB 3.39Å; L56-K59 PolarHBondContact O-N 3.31Å; L56-K59 VanDerWaalsContact O-N 3.15Å; D57-K59 VanDerWaalsContact C-N 3.26Å; D57-K59 PolarHBondContact O-N 3.09Å; K59-F62 PolarHBondContact O-N 2.9Å; K59-F63 PolarHBondContact O-N 3.21Å; K59-C213 WeakPolarHBondContact CE-O 3.3Å; K59-V216 HydrophobicContact CD-CG1 4.27Å; K59-V216 HydrophobicContact CG-CB 4.27Å; K59-V216 HydrophobicContact CG-CG1 4.06Å; K59-D217 WeakPolarHBondContact CE-OD1 3.45Å; K59-D217 WeakPolarHBondContact CE-OD2 3.36Å; K59-D217 IonicContact NZ-OD1 2.77Å; K59-D217 PolarHBondContact NZ-OD1 3.01Å; K59-D217 IonicContact NZ-OD2 3.64Å; K59-D217 PolarHBondContact NZ-OD2 2.59Å
60	L	98.1	Very high	95.9	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-68.4	-36.2	174.9	-67.1	-179.7	0	0	0	112.2	L56 D57 F63 R64 V156 M159 E160 V212	L56-L60 WeakPolarHBondContact O-CG 3.27Å; L56-L60 PolarHBondContact O-N 2.7Å; D57-L60 WeakPolarHBondContact O-CB 3.4Å; D57-L60 PolarHBondContact O-N 3.09Å; D57-L60 VanDerWaalsContact O-N 3.14Å; L60-F63 PolarHBondContact O-N 3.14Å; L60-R64 WeakPolarHBondContact O-CB 3.49Å; L60-R64 VanDerWaalsContact O-CG 3.24Å; L60-R64 WeakPolarHBondContact O-CG 3.18Å; L60-R64 PolarHBondContact O-N 3.4Å; L60-V156 HydrophobicContact CD2-CB 4.45Å; L60-V156 HydrophobicContact CD2-CG1 3.66Å; L60-V156 HydrophobicContact CD2-CG2 3.95Å; L60-M159 HydrophobicContact CD1-CE 4.01Å; L60-M159 HydrophobicContact CD2-CE 3.85Å; L60-M159 HydrophobicContact CG-CE 4.29Å; L60-E160 WeakPolarHBondContact CD1-OE1 3.46Å; L60-V212 HydrophobicContact CD2-CG1 4.18Å
61	E	97.8	Very high	96.3	Very high	125 Å²	125	55.9 Å²	55.9	58%	0.584	31%	0.314	S	S	*	.	H	α-helix	trans	-64.9	-44.6	173.3	-73.4	-178	171	0	0	111.9	D57 S58 F63 R64 S65	D57-E61 WeakPolarHBondContact O-CG 3.43Å; D57-E61 PolarHBondContact O-N 2.99Å; S58-E61 PolarHBondContact O-N 2.9Å; E61-F63 VanDerWaalsContact C-N 3.34Å; E61-F63 PolarHBondContact O-N 3.35Å; E61-R64 PolarHBondContact O-N 3.06Å; E61-S65 WeakPolarHBondContact O-CB 3.37Å; E61-S65 PolarHBondContact O-N 3.48Å
62	F	97.6	Very high	96.7	Very high	96 Å²	96	56.4 Å²	56.4	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-58.5	-45.6	171.7	175.4	-100.1	0	0	0	111.6	S58 K59 R64 S65 V66 V216	S58-F62 PolarHBondContact O-N 2.81Å; K59-F62 PolarHBondContact O-N 2.9Å; F62-R64 PolarHBondContact O-N 3.32Å; F62-S65 WeakPolarHBondContact O-CB 3.42Å; F62-S65 PolarHBondContact O-N 2.95Å; F62-V66 HydrophobicContact CD1-CG2 4.46Å; F62-V66 HydrophobicContact CE1-CG2 4Å; F62-V66 HydrophobicContact CE2-CG2 4.36Å; F62-V66 HydrophobicContact CZ-CG2 3.94Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.87Å; F62-V216 HydrophobicContact CD1-CG1 3.57Å; F62-V216 HydrophobicContact CE1-CG1 4.04Å
63	F	98.4	Very high	97.1	Very high	3 Å²	3	54.7 Å²	54.7	1%	0.013	29%	0.289	C	S	.	.	H	α-helix	trans	-57.1	-51.2	174.8	173.5	-114.1	0	0	0	112.1	K59 L60 E61 S65 V66 Q67 I149 T152 L153 V156 V216 L219	K59-F63 PolarHBondContact O-N 3.21Å; L60-F63 PolarHBondContact O-N 3.14Å; E61-F63 VanDerWaalsContact C-N 3.34Å; E61-F63 PolarHBondContact O-N 3.35Å; F63-S65 VanDerWaalsContact C-N 3.29Å; F63-S65 PolarHBondContact O-N 3.31Å; F63-V66 WeakPolarHBondContact O-CA 3.3Å; F63-V66 WeakPolarHBondContact O-CB 3.32Å; F63-V66 PolarHBondContact O-N 3.3Å; F63-Q67 HydrophobicContact CD1-CG 4.45Å; F63-Q67 HydrophobicContact CD2-CG 4.44Å; F63-Q67 VanDerWaalsContact CE1-CD 3.43Å; F63-Q67 HydrophobicContact CE1-CG 4.08Å; F63-Q67 HydrophobicContact CE2-CG 4.04Å; F63-Q67 VanDerWaalsContact CZ-CD 3.49Å; F63-Q67 HydrophobicContact CZ-CG 3.86Å; F63-Q67 WeakPolarHBondContact O-CG 3.37Å; F63-Q67 PolarHBondContact O-N 3.45Å; F63-I149 HydrophobicContact CE2-CG2 4.42Å; F63-I149 HydrophobicContact CZ-CG2 4.4Å; F63-T152 HydrophobicContact CD2-CG2 3.8Å; F63-T152 HydrophobicContact CE2-CG2 3.47Å; F63-T152 VanDerWaalsContact CE2-CG2 3.47Å; F63-T152 HydrophobicContact CZ-CG2 4.01Å; F63-L153 HydrophobicContact CE1-CB 4.44Å; F63-L153 HydrophobicContact CE1-CD1 4.05Å; F63-L153 HydrophobicContact CZ-CB 4.03Å; F63-L153 HydrophobicContact CZ-CD1 4.45Å; F63-V156 HydrophobicContact CD1-CG2 4.08Å; F63-V156 HydrophobicContact CE1-CB 4.49Å; F63-V156 HydrophobicContact CE1-CG2 4.05Å; F63-V216 HydrophobicContact CB-CG1 4.18Å; F63-V216 HydrophobicContact CB-CG2 3.9Å; F63-V216 HydrophobicContact CD2-CG2 4.15Å; F63-V216 HydrophobicContact CG-CG2 4.17Å; F63-L219 HydrophobicContact CE2-CD1 4.19Å
64	R	98.4	Very high	97.3	Very high	119 Å²	119	54.9 Å²	54.9	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-57.1	-40.8	176.5	-70.9	166.7	-169.9	146.8	5.7	111.9	L60 E61 F62 V66 Q67 L68 E160	L60-R64 WeakPolarHBondContact O-CB 3.49Å; L60-R64 VanDerWaalsContact O-CG 3.24Å; L60-R64 WeakPolarHBondContact O-CG 3.18Å; L60-R64 PolarHBondContact O-N 3.4Å; E61-R64 PolarHBondContact O-N 3.06Å; F62-R64 PolarHBondContact O-N 3.32Å; R64-V66 VanDerWaalsContact C-N 3.33Å; R64-V66 PolarHBondContact O-N 3.12Å; R64-Q67 WeakPolarHBondContact O-CB 3.42Å; R64-Q67 PolarHBondContact O-N 3.05Å; R64-L68 WeakPolarHBondContact O-CB 3.43Å; R64-L68 PolarHBondContact O-N 2.9Å; R64-E160 IonicContact NH2-OE1 2.86Å
65	S	98	Very high	97.5	Very high	60 Å²	60	57.4 Å²	57.4	42%	0.42	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-41.3	174.3	-179.8	0	0	0	0	111.8	E61 F62 F63 T69	E61-S65 WeakPolarHBondContact O-CB 3.37Å; E61-S65 PolarHBondContact O-N 3.48Å; F62-S65 WeakPolarHBondContact O-CB 3.42Å; F62-S65 PolarHBondContact O-N 2.95Å; F63-S65 VanDerWaalsContact C-N 3.29Å; F63-S65 PolarHBondContact O-N 3.31Å; S65-T69 WeakPolarHBondContact O-CB 3.27Å; S65-T69 WeakPolarHBondContact O-CG2 3.03Å; S65-T69 PolarHBondContact O-N 3.14Å; S65-T69 PolarHBondContact O-OG1 3.14Å
66	V	97.7	Very high	97.8	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-45	172.6	-179.7	0	0	0	0	111.7	F62 F63 R64 L68 C70 F144 I149 L219	F62-V66 HydrophobicContact CD1-CG2 4.46Å; F62-V66 HydrophobicContact CE1-CG2 4Å; F62-V66 HydrophobicContact CE2-CG2 4.36Å; F62-V66 HydrophobicContact CZ-CG2 3.94Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.87Å; F63-V66 WeakPolarHBondContact O-CA 3.3Å; F63-V66 WeakPolarHBondContact O-CB 3.32Å; F63-V66 PolarHBondContact O-N 3.3Å; R64-V66 VanDerWaalsContact C-N 3.33Å; R64-V66 PolarHBondContact O-N 3.12Å; V66-L68 PolarHBondContact O-N 3.28Å; V66-C70 WeakPolarHBondContact O-CB 3.5Å; V66-C70 PolarHBondContact O-N 3.19Å; V66-C70 PolarHBondContact O-SG 2.93Å; V66-F144 HydrophobicContact CG1-CE1 4.1Å; V66-I149 HydrophobicContact CG1-CD1 4.18Å; V66-L219 HydrophobicContact CB-CD2 4Å; V66-L219 HydrophobicContact CG1-CD2 3.43Å; V66-L219 VanDerWaalsContact CG1-CD2 3.43Å; V66-L219 HydrophobicContact CG2-CD2 4.26Å
67	Q	98	Very high	97.8	Very high	48 Å²	48	55.3 Å²	55.3	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-48.5	177.6	-56.2	-169.6	-74.7	0	0	112.4	F63 R64 T71 I149	F63-Q67 HydrophobicContact CD1-CG 4.45Å; F63-Q67 HydrophobicContact CD2-CG 4.44Å; F63-Q67 VanDerWaalsContact CE1-CD 3.43Å; F63-Q67 HydrophobicContact CE1-CG 4.08Å; F63-Q67 HydrophobicContact CE2-CG 4.04Å; F63-Q67 VanDerWaalsContact CZ-CD 3.49Å; F63-Q67 HydrophobicContact CZ-CG 3.86Å; F63-Q67 WeakPolarHBondContact O-CG 3.37Å; F63-Q67 PolarHBondContact O-N 3.45Å; R64-Q67 WeakPolarHBondContact O-CB 3.42Å; R64-Q67 PolarHBondContact O-N 3.05Å; Q67-T71 WeakPolarHBondContact O-CB 3.38Å; Q67-T71 PolarHBondContact O-N 3.42Å; Q67-T71 PolarHBondContact O-OG1 3.34Å; Q67-I149 HydrophobicContact CB-CG2 4.44Å; Q67-I149 HydrophobicContact CG-CG2 3.71Å
68	L	98.1	Very high	97.9	Very high	106 Å²	106	58.6 Å²	58.6	56%	0.555	30%	0.297	S	S	*	.	H	α-helix	trans	-64.2	-54.2	-179.6	179.4	62.6	0	0	0	111	R64 V66 C70 T71 E72	R64-L68 WeakPolarHBondContact O-CB 3.43Å; R64-L68 PolarHBondContact O-N 2.9Å; V66-L68 PolarHBondContact O-N 3.28Å; L68-C70 PolarHBondContact O-N 3.49Å; L68-T71 WeakPolarHBondContact O-CA 3.26Å; L68-T71 WeakPolarHBondContact O-CB 3.35Å; L68-T71 PolarHBondContact O-N 3.41Å; L68-E72 HydrophobicContact CD1-CG 4.25Å; L68-E72 PolarHBondContact O-N 3.44Å
69	T	98	Very high	98	Very high	51 Å²	51	61.6 Å²	61.6	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-68.8	-30.8	-173.7	54.2	0	0	0	0	113.4	S65 L73 R223	S65-T69 WeakPolarHBondContact O-CB 3.27Å; S65-T69 WeakPolarHBondContact O-CG2 3.03Å; S65-T69 PolarHBondContact O-N 3.14Å; S65-T69 PolarHBondContact O-OG1 3.14Å; T69-L73 VanDerWaalsContact O-CB 3.26Å; T69-L73 WeakPolarHBondContact O-CB 3.46Å; T69-L73 PolarHBondContact O-N 3.47Å; T69-R223 VanDerWaalsContact OG1-CZ 3.29Å; T69-R223 PolarHBondContact OG1-NH1 3.29Å; T69-R223 PolarHBondContact OG1-NH2 3.06Å
70	C	97.8	Very high	98	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-35.2	169.1	-74.7	0	0	0	0	112.4	V66 L68 L74 V141 I149	V66-C70 WeakPolarHBondContact O-CB 3.5Å; V66-C70 PolarHBondContact O-N 3.19Å; V66-C70 PolarHBondContact O-SG 2.93Å; L68-C70 PolarHBondContact O-N 3.49Å; C70-L74 WeakPolarHBondContact O-CG 3.4Å; C70-L74 PolarHBondContact O-N 3.12Å; C70-V141 HydrophobicContact CB-CG1 4.15Å; C70-I149 HydrophobicContact CB-CD1 4.1Å
71	T	97.8	Very high	98	Very high	51 Å²	51	64.9 Å²	64.9	31%	0.313	31%	0.314	S	S	.	.	H	α-helix	trans	-71.2	-42.9	177.7	-57.7	0	0	0	0	111.7	Q67 L68 L74 K75	Q67-T71 WeakPolarHBondContact O-CB 3.38Å; Q67-T71 PolarHBondContact O-N 3.42Å; Q67-T71 PolarHBondContact O-OG1 3.34Å; L68-T71 WeakPolarHBondContact O-CA 3.26Å; L68-T71 WeakPolarHBondContact O-CB 3.35Å; L68-T71 PolarHBondContact O-N 3.41Å; T71-L74 PolarHBondContact O-N 2.88Å; T71-K75 PolarHBondContact O-N 3.2Å
72	E	98.4	Very high	97.9	Very high	79 Å²	79	64.7 Å²	64.7	37%	0.369	31%	0.313	S	S	.	.	H	α-helix	trans	-66.1	-37.1	174.6	-65.5	-48.5	123.4	0	0	112.2	L68 L74 K75 V76	L68-E72 HydrophobicContact CD1-CG 4.25Å; L68-E72 PolarHBondContact O-N 3.44Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.95Å; E72-K75 PolarHBondContact O-N 3.36Å; E72-K75 IonicContact OE1-NZ 2.71Å; E72-K75 PolarHBondContact OE1-NZ 3.16Å; E72-K75 WeakPolarHBondContact OE2-CD 3.29Å; E72-K75 IonicContact OE2-NZ 2.7Å; E72-V76 WeakPolarHBondContact O-CG2 3.49Å; E72-V76 PolarHBondContact O-N 3.44Å
73	L	97.9	Very high	98	Very high	44 Å²	44	67.5 Å²	67.5	23%	0.23	32%	0.321	C	S	.	.	H	α-helix	trans	-59.3	-42	175.4	-179.7	58.5	0	0	0	112.1	T69 V76 I77 V141 L227	T69-L73 VanDerWaalsContact O-CB 3.26Å; T69-L73 WeakPolarHBondContact O-CB 3.46Å; T69-L73 PolarHBondContact O-N 3.47Å; L73-V76 PolarHBondContact O-N 2.64Å; L73-I77 HydrophobicContact CD1-CD1 3.92Å; L73-I77 HydrophobicContact CD1-CG1 4.09Å; L73-I77 HydrophobicContact CG-CD1 3.82Å; L73-I77 HydrophobicContact CG-CG1 4.44Å; L73-I77 VanDerWaalsContact O-CG1 3.25Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.35Å; L73-V141 HydrophobicContact CD2-CG1 4.39Å; L73-V141 HydrophobicContact CD2-CG2 3.87Å; L73-L227 HydrophobicContact CD2-CD2 3.8Å
74	L	98.1	Very high	97.9	Very high	11 Å²	11	67.7 Å²	67.7	6%	0.058	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-48.8	175.3	-70.5	169.1	0	0	0	111.9	C70 T71 E72 V76 I77 E78 Y138 V141 E142	C70-L74 WeakPolarHBondContact O-CG 3.4Å; C70-L74 PolarHBondContact O-N 3.12Å; T71-L74 PolarHBondContact O-N 2.88Å; E72-L74 VanDerWaalsContact C-N 3.33Å; E72-L74 PolarHBondContact O-N 2.95Å; L74-V76 VanDerWaalsContact C-N 3.31Å; L74-V76 PolarHBondContact O-N 2.65Å; L74-I77 PolarHBondContact O-N 2.95Å; L74-E78 WeakPolarHBondContact O-CB 3.42Å; L74-E78 PolarHBondContact O-N 3.41Å; L74-Y138 HydrophobicContact CB-CD2 4.42Å; L74-Y138 HydrophobicContact CB-CE2 3.99Å; L74-Y138 HydrophobicContact CD2-CD1 4.36Å; L74-Y138 HydrophobicContact CD2-CD2 3.6Å; L74-Y138 HydrophobicContact CD2-CE1 4.38Å; L74-Y138 HydrophobicContact CD2-CE2 3.65Å; L74-Y138 HydrophobicContact CD2-CG 3.96Å; L74-Y138 WeakPolarHBondContact CD2-O 3.29Å; L74-Y138 HydrophobicContact CG-CE2 4.4Å; L74-V141 HydrophobicContact CD1-CG1 4.33Å; L74-V141 HydrophobicContact CD2-CB 3.89Å; L74-V141 HydrophobicContact CD2-CG1 3.85Å; L74-V141 HydrophobicContact CG-CB 4.4Å; L74-V141 HydrophobicContact CG-CG1 3.78Å; L74-E142 HydrophobicContact CD1-CB 4.32Å; L74-E142 HydrophobicContact CD2-CB 3.98Å
75	K	98.4	Very high	97.8	Very high	105 Å²	105	64.2 Å²	64.2	46%	0.457	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-40.3	177.5	-63.7	171.9	-176.5	171.5	0	112.2	T71 E72 K79	T71-K75 PolarHBondContact O-N 3.2Å; E72-K75 PolarHBondContact O-N 3.36Å; E72-K75 IonicContact OE1-NZ 2.71Å; E72-K75 PolarHBondContact OE1-NZ 3.16Å; E72-K75 WeakPolarHBondContact OE2-CD 3.29Å; E72-K75 IonicContact OE2-NZ 2.7Å; K75-K79 VanDerWaalsContact O-CB 3.24Å; K75-K79 WeakPolarHBondContact O-CB 3.36Å; K75-K79 PolarHBondContact O-N 3.08Å
76	V	98.2	Very high	97.9	Very high	91 Å²	91	67.3 Å²	67.3	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-66	-45	177.8	169.7	0	0	0	0	110.7	E72 L73 L74 Y80	E72-V76 WeakPolarHBondContact O-CG2 3.49Å; E72-V76 PolarHBondContact O-N 3.44Å; L73-V76 PolarHBondContact O-N 2.64Å; L74-V76 VanDerWaalsContact C-N 3.31Å; L74-V76 PolarHBondContact O-N 2.65Å; V76-Y80 WeakPolarHBondContact O-CB 3.42Å; V76-Y80 PolarHBondContact O-N 3.16Å
77	I	97.8	Very high	97.9	Very high	5 Å²	5	71.9 Å²	71.9	3%	0.026	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-48.9	178.5	-66.8	163.6	0	0	0	110.8	L73 L74 K79 Y80 Q81 L134 M137 Y138	L73-I77 HydrophobicContact CD1-CD1 3.92Å; L73-I77 HydrophobicContact CD1-CG1 4.09Å; L73-I77 HydrophobicContact CG-CD1 3.82Å; L73-I77 HydrophobicContact CG-CG1 4.44Å; L73-I77 VanDerWaalsContact O-CG1 3.25Å; L73-I77 WeakPolarHBondContact O-CG1 3.46Å; L73-I77 PolarHBondContact O-N 3.35Å; L74-I77 PolarHBondContact O-N 2.95Å; I77-K79 PolarHBondContact O-N 2.92Å; I77-Y80 PolarHBondContact O-N 2.91Å; I77-Y80 VanDerWaalsContact O-N 3.15Å; I77-Q81 HydrophobicContact CG2-CG 4.34Å; I77-Q81 WeakPolarHBondContact O-CG 3.5Å; I77-Q81 PolarHBondContact O-N 2.81Å; I77-L134 HydrophobicContact CG2-CB 4.38Å; I77-M137 HydrophobicContact CD1-CB 4.48Å; I77-M137 HydrophobicContact CD1-CE 3.83Å; I77-M137 HydrophobicContact CD1-CG 3.88Å; I77-M137 HydrophobicContact CD1-SD 4.24Å; I77-M137 HydrophobicContact CG1-CE 3.99Å; I77-Y138 HydrophobicContact CB-CD2 4.39Å; I77-Y138 HydrophobicContact CG2-CD2 4.23Å
78	E	97.6	Very high	97.9	Very high	121 Å²	121	69.8 Å²	69.8	57%	0.565	33%	0.331	S	S	*	.	H	α-helix	trans	-57.9	-50.5	178.9	-177	-177.9	-167.8	0	0	111.6	L74 Y80 Q81 H82 Y138	L74-E78 WeakPolarHBondContact O-CB 3.42Å; L74-E78 PolarHBondContact O-N 3.41Å; E78-Y80 PolarHBondContact O-N 3.11Å; E78-Q81 PolarHBondContact O-N 3.32Å; E78-H82 PolarHBondContact O-N 3.18Å; E78-H82 VanDerWaalsContact O-N 3.1Å; E78-Y138 HydrophobicContact CB-CE2 4.4Å
79	K	98.3	Very high	97.9	Very high	132 Å²	132	69.5 Å²	69.5	57%	0.574	33%	0.327	S	S	*	.	H	α-helix	trans	-61.5	-33.2	176.9	-173.3	173.7	-176.4	174.5	0	112.4	K75 I77 R83	K75-K79 VanDerWaalsContact O-CB 3.24Å; K75-K79 WeakPolarHBondContact O-CB 3.36Å; K75-K79 PolarHBondContact O-N 3.08Å; I77-K79 PolarHBondContact O-N 2.92Å; K79-R83 WeakPolarHBondContact O-CD 3.42Å; K79-R83 VanDerWaalsContact O-CG 3.26Å; K79-R83 WeakPolarHBondContact O-CG 3.37Å; K79-R83 PolarHBondContact O-N 3.24Å
80	Y	98.1	Very high	97.9	Very high	79 Å²	79	71.5 Å²	71.5	31%	0.31	33%	0.333	S	S	.	.	H	α-helix	trans	-74.9	-42.1	177.8	-177.1	-129.8	0	0	0	112.4	V76 I77 E78 H82 R83 I84 L134 Y234	V76-Y80 WeakPolarHBondContact O-CB 3.42Å; V76-Y80 PolarHBondContact O-N 3.16Å; I77-Y80 PolarHBondContact O-N 2.91Å; I77-Y80 VanDerWaalsContact O-N 3.15Å; E78-Y80 PolarHBondContact O-N 3.11Å; Y80-H82 VanDerWaalsContact C-N 3.34Å; Y80-H82 PolarHBondContact O-N 3.12Å; Y80-R83 PolarHBondContact O-N 3.31Å; Y80-R83 VanDerWaalsContact O-N 3.16Å; Y80-I84 HydrophobicContact CD1-CD1 3.84Å; Y80-I84 HydrophobicContact CD2-CD1 4.2Å; Y80-I84 HydrophobicContact CD2-CG1 4.3Å; Y80-I84 HydrophobicContact CE1-CD1 3.43Å; Y80-I84 VanDerWaalsContact CE1-CD1 3.43Å; Y80-I84 HydrophobicContact CE1-CG1 4.41Å; Y80-I84 HydrophobicContact CE2-CD1 3.83Å; Y80-I84 HydrophobicContact CE2-CG1 3.91Å; Y80-I84 HydrophobicContact CG-CD1 4.2Å; Y80-I84 VanDerWaalsContact CZ-CD1 3.43Å; Y80-I84 PolarHBondContact O-N 3.06Å; Y80-L134 HydrophobicContact CD1-CD1 3.64Å; Y80-L134 HydrophobicContact CD1-CD2 3.86Å; Y80-L134 HydrophobicContact CD1-CG 4.43Å; Y80-L134 HydrophobicContact CE1-CD1 3.69Å; Y80-L134 HydrophobicContact CE1-CD2 4.05Å; Y80-L134 HydrophobicContact CE1-CG 4.5Å; Y80-Y234 HydrophobicContact CE1-CE2 4.04Å; Y80-Y234 AromaticContact CE1-CZ 3.91Å; Y80-Y234 VanDerWaalsContact CE1-OH 3.24Å; Y80-Y234 WeakPolarHBondContact CE1-OH 3.47Å; Y80-Y234 PolarHBondContact OH-OH 3.17Å; Y80-Y234 VanDerWaalsContact OH-OH 3.09Å
81	Q	97.3	Very high	97.9	Very high	35 Å²	35	72.6 Å²	72.6	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-59	-43.1	173.8	-72.7	-170.2	41.1	0	0	112.2	I77 E78 R83 I84 T85 L134	I77-Q81 HydrophobicContact CG2-CG 4.34Å; I77-Q81 WeakPolarHBondContact O-CG 3.5Å; I77-Q81 PolarHBondContact O-N 2.81Å; E78-Q81 PolarHBondContact O-N 3.32Å; Q81-R83 VanDerWaalsContact C-N 3.35Å; Q81-R83 PolarHBondContact O-N 3.02Å; Q81-I84 PolarHBondContact O-N 2.89Å; Q81-T85 PolarHBondContact O-N 3.48Å; Q81-T85 PolarHBondContact O-OG1 3.18Å; Q81-L134 HydrophobicContact CG-CB 3.87Å; Q81-L134 HydrophobicContact CG-CD1 4.1Å
82	H	97.2	Very high	97.9	Very high	121 Å²	121	72.4 Å²	72.4	56%	0.56	34%	0.335	S	S	*	.	H	α-helix	trans	-61.4	-43.3	174.9	-179.1	77.6	0	0	0	111.7	E78 Y80 T85 R86	E78-H82 PolarHBondContact O-N 3.18Å; E78-H82 VanDerWaalsContact O-N 3.1Å; Y80-H82 VanDerWaalsContact C-N 3.34Å; Y80-H82 PolarHBondContact O-N 3.12Å; H82-T85 PolarHBondContact O-N 3Å; H82-R86 PolarHBondContact O-N 2.92Å
83	R	98.1	Very high	97.9	Very high	156 Å²	156	74.3 Å²	74.3	59%	0.589	34%	0.344	S	S	*	.	H	α-helix	trans	-66.1	-40.3	178	-76.2	172.9	171.4	-145.7	-8.2	113.2	K79 Y80 Q81 L87	K79-R83 WeakPolarHBondContact O-CD 3.42Å; K79-R83 VanDerWaalsContact O-CG 3.26Å; K79-R83 WeakPolarHBondContact O-CG 3.37Å; K79-R83 PolarHBondContact O-N 3.24Å; Y80-R83 PolarHBondContact O-N 3.31Å; Y80-R83 VanDerWaalsContact O-N 3.16Å; Q81-R83 VanDerWaalsContact C-N 3.35Å; Q81-R83 PolarHBondContact O-N 3.02Å; R83-L87 VanDerWaalsContact O-CB 3.29Å; R83-L87 WeakPolarHBondContact O-CB 3.5Å; R83-L87 PolarHBondContact O-N 3.18Å
84	I	97.3	Very high	97.9	Very high	6 Å²	6	76.5 Å²	76.5	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-60	-51.5	173.5	-77.9	162.8	0	0	0	110.1	Y80 Q81 R86 L87 S88 R127 M128 L130 L134	Y80-I84 HydrophobicContact CD1-CD1 3.84Å; Y80-I84 HydrophobicContact CD2-CD1 4.2Å; Y80-I84 HydrophobicContact CD2-CG1 4.3Å; Y80-I84 HydrophobicContact CE1-CD1 3.43Å; Y80-I84 VanDerWaalsContact CE1-CD1 3.43Å; Y80-I84 HydrophobicContact CE1-CG1 4.41Å; Y80-I84 HydrophobicContact CE2-CD1 3.83Å; Y80-I84 HydrophobicContact CE2-CG1 3.91Å; Y80-I84 HydrophobicContact CG-CD1 4.2Å; Y80-I84 VanDerWaalsContact CZ-CD1 3.43Å; Y80-I84 PolarHBondContact O-N 3.06Å; Q81-I84 PolarHBondContact O-N 2.89Å; I84-R86 VanDerWaalsContact C-N 3.33Å; I84-R86 PolarHBondContact O-N 2.64Å; I84-L87 PolarHBondContact O-N 3.04Å; I84-S88 WeakPolarHBondContact O-CB 3.26Å; I84-S88 PolarHBondContact O-N 2.6Å; I84-S88 PolarHBondContact O-OG 3.03Å; I84-S88 VanDerWaalsContact O-OG 3.09Å; I84-R127 HydrophobicContact CG2-CG 3.97Å; I84-M128 HydrophobicContact CG2-SD 4.16Å; I84-L130 HydrophobicContact CD1-CB 4.2Å; I84-L130 HydrophobicContact CD1-CD1 4.31Å; I84-L134 HydrophobicContact CD1-CD1 3.39Å
85	T	96.9	Very high	97.9	Very high	47 Å²	47	76 Å²	76	29%	0.288	35%	0.353	S	S	.	.	H	α-helix	trans	-56.8	-48.5	-178.1	-56	0	0	0	0	111	Q81 H82 S88 Q89 M128	Q81-T85 PolarHBondContact O-N 3.48Å; Q81-T85 PolarHBondContact O-OG1 3.18Å; H82-T85 PolarHBondContact O-N 3Å; T85-S88 PolarHBondContact O-N 2.89Å; T85-Q89 WeakPolarHBondContact O-CG 3.31Å; T85-Q89 PolarHBondContact O-N 3.21Å; T85-Q89 VanDerWaalsContact O-N 3.11Å; T85-M128 HydrophobicContact CG2-CE 4.16Å
86	R	98.2	Very high	97.9	Very high	125 Å²	125	74.4 Å²	74.4	47%	0.472	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-49.2	176.3	-78.2	-144.1	62.3	-163.2	-5.5	113	H82 I84 S88 Q89 E90	H82-R86 PolarHBondContact O-N 2.92Å; I84-R86 VanDerWaalsContact C-N 3.33Å; I84-R86 PolarHBondContact O-N 2.64Å; R86-S88 VanDerWaalsContact C-N 3.26Å; R86-S88 PolarHBondContact O-N 2.68Å; R86-Q89 WeakPolarHBondContact O-CB 3.3Å; R86-Q89 PolarHBondContact O-N 3.35Å; R86-E90 IonicContact CZ-OE1 2.81Å; R86-E90 IonicContact NE-OE1 2.83Å; R86-E90 IonicContact NH2-OE1 2.7Å; R86-E90 PolarHBondContact NH2-OE1 3.43Å; R86-E90 WeakPolarHBondContact O-CG 3.29Å; R86-E90 PolarHBondContact O-N 3.22Å; R86-E90 VanDerWaalsContact O-N 3.08Å
87	L	97.9	Very high	97.9	Very high	96 Å²	96	75.4 Å²	75.4	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-58.3	-39.5	-179.9	179.8	61.6	0	0	0	112.2	R83 I84 E91	R83-L87 VanDerWaalsContact O-CB 3.29Å; R83-L87 WeakPolarHBondContact O-CB 3.5Å; R83-L87 PolarHBondContact O-N 3.18Å; I84-L87 PolarHBondContact O-N 3.04Å; L87-E91 WeakPolarHBondContact O-CB 3.34Å; L87-E91 PolarHBondContact O-N 2.89Å
88	S	98.1	Very high	97.9	Very high	5 Å²	5	76.8 Å²	76.8	4%	0.035	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-31.3	175.7	-60.4	0	0	0	0	113.2	I84 T85 R86 N92 A124 R127	I84-S88 WeakPolarHBondContact O-CB 3.26Å; I84-S88 PolarHBondContact O-N 2.6Å; I84-S88 PolarHBondContact O-OG 3.03Å; I84-S88 VanDerWaalsContact O-OG 3.09Å; T85-S88 PolarHBondContact O-N 2.89Å; R86-S88 VanDerWaalsContact C-N 3.26Å; R86-S88 PolarHBondContact O-N 2.68Å; S88-N92 WeakPolarHBondContact O-CB 3.29Å; S88-N92 PolarHBondContact O-N 2.95Å; S88-N92 VanDerWaalsContact O-N 3.11Å; S88-A124 WeakPolarHBondContact O-CB 3.38Å; S88-A124 PolarHBondContact OG-O 3.35Å; S88-R127 PolarHBondContact OG-NH1 2.98Å
89	Q	98	Very high	97.9	Very high	99 Å²	99	76.4 Å²	76.4	46%	0.463	35%	0.347	S	S	.	.	H	α-helix	trans	-65.9	-54.3	172.8	-72.1	165.4	-28.8	0	0	110.8	T85 R86 E91 N92 E93	T85-Q89 WeakPolarHBondContact O-CG 3.31Å; T85-Q89 PolarHBondContact O-N 3.21Å; T85-Q89 VanDerWaalsContact O-N 3.11Å; R86-Q89 WeakPolarHBondContact O-CB 3.3Å; R86-Q89 PolarHBondContact O-N 3.35Å; Q89-E91 VanDerWaalsContact C-N 3.34Å; Q89-E91 PolarHBondContact O-N 3.03Å; Q89-N92 PolarHBondContact O-N 3.31Å; Q89-N92 VanDerWaalsContact O-N 3.16Å; Q89-E93 WeakPolarHBondContact O-CG 3.13Å; Q89-E93 PolarHBondContact O-N 2.71Å
90	E	98.2	Very high	97.9	Very high	93 Å²	93	75.1 Å²	75.1	44%	0.435	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-41.3	-179	-51.6	-70.8	146.8	0	0	112.1	R86 E93 L94	R86-E90 IonicContact CZ-OE1 2.81Å; R86-E90 IonicContact NE-OE1 2.83Å; R86-E90 IonicContact NH2-OE1 2.7Å; R86-E90 PolarHBondContact NH2-OE1 3.43Å; R86-E90 WeakPolarHBondContact O-CG 3.29Å; R86-E90 PolarHBondContact O-N 3.22Å; R86-E90 VanDerWaalsContact O-N 3.08Å; E90-E93 PolarHBondContact O-N 3.06Å; E90-L94 PolarHBondContact O-N 2.79Å
91	E	98.1	Very high	97.8	Very high	23 Å²	23	74.4 Å²	74.4	11%	0.107	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-37	177.4	-178	178.7	177.7	0	0	112.7	L87 Q89 L94 G95 L120 S123 A124 R127	L87-E91 WeakPolarHBondContact O-CB 3.34Å; L87-E91 PolarHBondContact O-N 2.89Å; Q89-E91 VanDerWaalsContact C-N 3.34Å; Q89-E91 PolarHBondContact O-N 3.03Å; E91-L94 PolarHBondContact O-N 3.33Å; E91-G95 PolarHBondContact O-N 3.26Å; E91-L120 HydrophobicContact CG-CB 4.03Å; E91-L120 HydrophobicContact CG-CD2 4.03Å; E91-L120 WeakPolarHBondContact OE1-CD2 3.19Å; E91-S123 WeakPolarHBondContact OE1-CB 3.18Å; E91-S123 PolarHBondContact OE1-OG 3.3Å; E91-A124 HydrophobicContact CB-CB 4.33Å; E91-A124 HydrophobicContact CG-CB 4.36Å; E91-R127 IonicContact OE1-NH2 3.63Å; E91-R127 IonicContact OE2-CZ 3.93Å; E91-R127 IonicContact OE2-NH1 2.65Å; E91-R127 PolarHBondContact OE2-NH1 3.37Å; E91-R127 IonicContact OE2-NH2 2.64Å; E91-R127 PolarHBondContact OE2-NH2 3.31Å
92	N	98	Very high	97.8	Very high	47 Å²	47	73.3 Å²	73.3	25%	0.251	34%	0.338	S	S	.	.	H	α-helix	trans	-67	-39.7	174.8	-179	88.5	0	0	0	111	S88 Q89 G95 L96 A124	S88-N92 WeakPolarHBondContact O-CB 3.29Å; S88-N92 PolarHBondContact O-N 2.95Å; S88-N92 VanDerWaalsContact O-N 3.11Å; Q89-N92 PolarHBondContact O-N 3.31Å; Q89-N92 VanDerWaalsContact O-N 3.16Å; N92-G95 PolarHBondContact O-N 3.02Å; N92-L96 VanDerWaalsContact O-CG 3.29Å; N92-L96 WeakPolarHBondContact O-CG 3.25Å; N92-L96 PolarHBondContact O-N 3.41Å; N92-A124 HydrophobicContact CB-CB 3.89Å
93	E	98.4	Very high	97.7	Very high	120 Å²	120	73.8 Å²	73.8	56%	0.561	34%	0.34	S	S	*	.	H	α-helix	trans	-62.6	-42.6	173.2	-72.8	179	-160.2	0	0	112.1	Q89 E90 G95 L96 F97	Q89-E93 WeakPolarHBondContact O-CG 3.13Å; Q89-E93 PolarHBondContact O-N 2.71Å; E90-E93 PolarHBondContact O-N 3.06Å; E93-G95 PolarHBondContact O-N 3.28Å; E93-L96 PolarHBondContact O-N 3.11Å; E93-F97 PolarHBondContact O-N 3.45Å
94	L	98.4	Very high	97.5	Very high	90 Å²	90	74.8 Å²	74.8	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-42.8	172.4	178.2	60.6	0	0	0	112	E90 E91 F97 L98 L120	E90-L94 PolarHBondContact O-N 2.79Å; E91-L94 PolarHBondContact O-N 3.33Å; L94-F97 PolarHBondContact O-N 3.33Å; L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.67Å; L94-L120 HydrophobicContact CD2-CD1 3.92Å; L94-L120 HydrophobicContact CG-CD1 3.89Å
95	G	98.1	Very high	97.3	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60	-45.7	174.8	0	0	0	0	0	112.5	E91 N92 E93 F97 L98 R99 S117	E91-G95 PolarHBondContact O-N 3.26Å; N92-G95 PolarHBondContact O-N 3.02Å; E93-G95 PolarHBondContact O-N 3.28Å; G95-F97 PolarHBondContact O-N 3.38Å; G95-L98 PolarHBondContact O-N 3.03Å; G95-R99 PolarHBondContact O-N 3.47Å; G95-S117 VanDerWaalsContact O-CB 3.26Å; G95-S117 WeakPolarHBondContact O-CB 3.24Å; G95-S117 PolarHBondContact O-OG 3.2Å
96	L	98.1	Very high	97.1	Very high	71 Å²	71	85.8 Å²	85.8	37%	0.372	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-38.7	175.7	-69.9	173.2	0	0	0	112.6	N92 E93 R99 F100	N92-L96 VanDerWaalsContact O-CG 3.29Å; N92-L96 WeakPolarHBondContact O-CG 3.25Å; N92-L96 PolarHBondContact O-N 3.41Å; E93-L96 PolarHBondContact O-N 3.11Å; L96-R99 VanDerWaalsContact CD2-NH2 3.31Å; L96-R99 WeakPolarHBondContact O-CB 3.4Å; L96-R99 PolarHBondContact O-N 2.95Å; L96-F100 PolarHBondContact O-N 3.15Å; L96-F100 VanDerWaalsContact O-N 3.14Å
97	F	98.3	Very high	96.7	Very high	113 Å²	113	83.6 Å²	83.6	50%	0.496	38%	0.384	S	S	.	.	H	α-helix	trans	-62.1	-47.7	173.9	171.3	-95.7	0	0	0	111.8	E93 L94 G95 R99 F100 Q101	E93-F97 PolarHBondContact O-N 3.45Å; L94-F97 PolarHBondContact O-N 3.33Å; G95-F97 PolarHBondContact O-N 3.38Å; F97-R99 VanDerWaalsContact C-N 3.28Å; F97-R99 PolarHBondContact O-N 3.29Å; F97-F100 PolarHBondContact O-N 2.83Å; F97-Q101 HydrophobicContact CD1-CG 4.49Å; F97-Q101 HydrophobicContact CE1-CG 4.02Å; F97-Q101 HydrophobicContact CE2-CG 4.18Å; F97-Q101 VanDerWaalsContact CE2-NE2 3.29Å; F97-Q101 HydrophobicContact CZ-CG 3.86Å; F97-Q101 WeakPolarHBondContact O-CG 3.19Å; F97-Q101 PolarHBondContact O-N 3.41Å; F97-Q101 VanDerWaalsContact O-N 3.12Å
98	L	97.8	Very high	96.2	Very high	33 Å²	33	83.1 Å²	83.1	17%	0.173	38%	0.377	C	S	.	.	H	α-helix	trans	-60.7	-37.5	177.6	-70	-178.6	0	0	0	112	L94 G95 Q101 A102 M113 T116 L120	L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.67Å; G95-L98 PolarHBondContact O-N 3.03Å; L98-Q101 PolarHBondContact O-N 3.11Å; L98-A102 WeakPolarHBondContact O-CB 3.35Å; L98-A102 PolarHBondContact O-N 3.1Å; L98-M113 HydrophobicContact CD2-CG 4.31Å; L98-T116 HydrophobicContact CD1-CG2 3.69Å; L98-L120 HydrophobicContact CD1-CD1 3.89Å
99	R	97.6	Very high	95.7	Very high	114 Å²	114	84.4 Å²	84.4	43%	0.43	39%	0.389	S	S	.	.	H	α-helix	trans	-58.7	-50.3	174	-168.1	163.7	63.8	157.5	6	112	G95 L96 F97 Q101 A102 E103 E114 S117	G95-R99 PolarHBondContact O-N 3.47Å; L96-R99 VanDerWaalsContact CD2-NH2 3.31Å; L96-R99 WeakPolarHBondContact O-CB 3.4Å; L96-R99 PolarHBondContact O-N 2.95Å; F97-R99 VanDerWaalsContact C-N 3.28Å; F97-R99 PolarHBondContact O-N 3.29Å; R99-Q101 VanDerWaalsContact C-N 3.26Å; R99-Q101 PolarHBondContact O-N 3.38Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.92Å; R99-A102 VanDerWaalsContact O-N 3.13Å; R99-E103 WeakPolarHBondContact O-CG 3.47Å; R99-E103 PolarHBondContact O-N 3.43Å; R99-E114 WeakPolarHBondContact CG-OE2 3.37Å; R99-S117 WeakPolarHBondContact CB-OG 3.45Å
100	F	97.3	Very high	95.5	Very high	104 Å²	104	79.8 Å²	79.8	46%	0.456	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-33.5	-179.6	178.7	-99.3	0	0	0	112.8	L96 F97 R104	L96-F100 PolarHBondContact O-N 3.15Å; L96-F100 VanDerWaalsContact O-N 3.14Å; F97-F100 PolarHBondContact O-N 2.83Å; F100-R104 WeakPolarHBondContact O-CG 3.25Å
101	Q	96.4	Very high	95.2	Very high	64 Å²	64	80.3 Å²	80.3	30%	0.299	37%	0.373	S	S	.	.	H	α-helix	trans	-75.8	-37.9	174	-58	-60.7	0.8	0	0	112.2	F97 L98 R99 E103 R104 D105 M113	F97-Q101 HydrophobicContact CD1-CG 4.49Å; F97-Q101 HydrophobicContact CE1-CG 4.02Å; F97-Q101 HydrophobicContact CE2-CG 4.18Å; F97-Q101 VanDerWaalsContact CE2-NE2 3.29Å; F97-Q101 HydrophobicContact CZ-CG 3.86Å; F97-Q101 WeakPolarHBondContact O-CG 3.19Å; F97-Q101 PolarHBondContact O-N 3.41Å; F97-Q101 VanDerWaalsContact O-N 3.12Å; L98-Q101 PolarHBondContact O-N 3.11Å; R99-Q101 VanDerWaalsContact C-N 3.26Å; R99-Q101 PolarHBondContact O-N 3.38Å; Q101-E103 VanDerWaalsContact C-N 3.3Å; Q101-E103 PolarHBondContact O-N 3.37Å; Q101-R104 WeakPolarHBondContact O-CB 3.34Å; Q101-R104 PolarHBondContact O-N 3.4Å; Q101-D105 PolarHBondContact O-N 2.77Å; Q101-M113 HydrophobicContact CB-SD 4.05Å
102	A	96.8	Very high	95	Very high	12 Å²	12	82.8 Å²	82.8	10%	0.099	39%	0.386	C	S	.	.	H	α-helix	trans	-61.5	-35.7	176.6	0	0	0	0	0	113.2	L98 R99 R104 D105 G110 M113 E114	L98-A102 WeakPolarHBondContact O-CB 3.35Å; L98-A102 PolarHBondContact O-N 3.1Å; R99-A102 WeakPolarHBondContact O-CB 3.48Å; R99-A102 PolarHBondContact O-N 2.92Å; R99-A102 VanDerWaalsContact O-N 3.13Å; A102-R104 PolarHBondContact O-N 3.33Å; A102-D105 PolarHBondContact O-N 3.05Å; A102-D105 VanDerWaalsContact O-O 3.06Å; A102-G110 VanDerWaalsContact CB-O 3.27Å; A102-G110 WeakPolarHBondContact CB-O 3.44Å; A102-M113 HydrophobicContact CB-CB 3.86Å; A102-E114 HydrophobicContact CB-CB 3.72Å
103	E	95.3	Very high	94.9	Very high	131 Å²	131	82.7 Å²	82.7	61%	0.612	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24	173.5	-71.9	170.1	-165.6	0	0	113.2	R99 Q101	R99-E103 WeakPolarHBondContact O-CG 3.47Å; R99-E103 PolarHBondContact O-N 3.43Å; Q101-E103 VanDerWaalsContact C-N 3.3Å; Q101-E103 PolarHBondContact O-N 3.37Å
104	R	94.4	Very high	94.8	Very high	177 Å²	177	79.3 Å²	79.3	67%	0.668	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-28.6	-177.4	-56.4	173.7	80.9	92.8	1.7	112.6	F100 Q101 A102	F100-R104 WeakPolarHBondContact O-CG 3.25Å; Q101-R104 WeakPolarHBondContact O-CB 3.34Å; Q101-R104 PolarHBondContact O-N 3.4Å; A102-R104 PolarHBondContact O-N 3.33Å
105	D	92.9	Very high	94.7	Very high	43 Å²	43	76.5 Å²	76.5	23%	0.23	36%	0.358	C	S	.	.			trans	-96.5	112.5	179.6	-176.8	1	0	0	0	111.4	Q101 A102 T107 G110 M113	Q101-D105 PolarHBondContact O-N 2.77Å; A102-D105 PolarHBondContact O-N 3.05Å; A102-D105 VanDerWaalsContact O-O 3.06Å; D105-T107 VanDerWaalsContact C-N 3.33Å; D105-T107 VanDerWaalsContact CG-OG1 3.25Å; D105-T107 VanDerWaalsContact OD1-CB 3.23Å; D105-T107 WeakPolarHBondContact OD1-CB 3.22Å; D105-T107 VanDerWaalsContact OD1-CG2 3.25Å; D105-T107 WeakPolarHBondContact OD1-CG2 3.36Å; D105-T107 PolarHBondContact OD1-N 3.43Å; D105-T107 PolarHBondContact OD1-OG1 3.3Å; D105-T107 PolarHBondContact OD2-OG1 3.16Å; D105-T107 VanDerWaalsContact OD2-OG1 3.09Å; D105-G110 WeakPolarHBondContact O-CA 3.32Å; D105-G110 PolarHBondContact OD2-N 3.43Å; D105-G110 VanDerWaalsContact OD2-N 3.16Å; D105-M113 HydrophobicContact CB-CE 4.15Å; D105-M113 VanDerWaalsContact OD2-CE 3.31Å; D105-M113 WeakPolarHBondContact OD2-CE 3.49Å
106	R	92.2	Very high	94.7	Very high	241 Å²	241	78.5 Å²	78.5	91%	0.909	37%	0.37	S	S	*	.			trans	-88.3	5.1	178.2	-64.7	-172.1	176.4	125.9	2.3	114.1
107	T	90.6	Very high	94.6	Very high	79 Å²	79	75.2 Å²	75.2	49%	0.485	35%	0.353	S	S	.	.	S	Bend	trans	-82.2	175.6	177.2	74	0	0	0	0	111.7	D105 A109 G110 N111	D105-T107 VanDerWaalsContact C-N 3.33Å; D105-T107 VanDerWaalsContact CG-OG1 3.25Å; D105-T107 VanDerWaalsContact OD1-CB 3.23Å; D105-T107 WeakPolarHBondContact OD1-CB 3.22Å; D105-T107 VanDerWaalsContact OD1-CG2 3.25Å; D105-T107 WeakPolarHBondContact OD1-CG2 3.36Å; D105-T107 PolarHBondContact OD1-N 3.43Å; D105-T107 PolarHBondContact OD1-OG1 3.3Å; D105-T107 PolarHBondContact OD2-OG1 3.16Å; D105-T107 VanDerWaalsContact OD2-OG1 3.09Å; T107-A109 PolarHBondContact O-N 3.15Å; T107-A109 WeakPolarHBondContact OG1-CB 3.47Å; T107-A109 PolarHBondContact OG1-N 2.92Å; T107-G110 PolarHBondContact O-N 3.19Å; T107-G110 VanDerWaalsContact O-N 3.09Å; T107-N111 PolarHBondContact O-N 2.85Å
108	K	86.8	Confident	94.6	Very high	86 Å²	86	75.6 Å²	75.6	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-20.5	172.2	-176.2	173.2	172.1	177.3	0	112.3	M112 F256 H259	K108-M112 PolarHBondContact O-N 3.4Å; K108-M112 VanDerWaalsContact O-N 3.09Å; K108-F256 HydrophobicContact CD-CD1 4.37Å; K108-F256 HydrophobicContact CD-CE1 4.44Å; K108-F256 VanDerWaalsContact CE-CD1 3.48Å; K108-F256 HydrophobicContact CG-CD1 3.95Å; K108-F256 HydrophobicContact CG-CE1 3.68Å; K108-F256 WeakPolarHBondContact O-CE1 3.48Å; K108-H259 WeakPolarHBondContact CB-NE2 3.19Å; K108-H259 VanDerWaalsContact CD-CD2 3.44Å; K108-H259 WeakPolarHBondContact CD-CD2 3.42Å
109	A	89.1	Confident	94.6	Very high	33 Å²	33	74.7 Å²	74.7	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-39.7	170.7	0	0	0	0	0	112.1	T107 M112 M113	T107-A109 PolarHBondContact O-N 3.15Å; T107-A109 WeakPolarHBondContact OG1-CB 3.47Å; T107-A109 PolarHBondContact OG1-N 2.92Å; A109-M112 WeakPolarHBondContact O-CB 3.29Å; A109-M112 PolarHBondContact O-N 3.43Å; A109-M112 VanDerWaalsContact O-N 3.16Å; A109-M113 HydrophobicContact CB-CE 4.25Å; A109-M113 WeakPolarHBondContact O-CG 3.24Å; A109-M113 PolarHBondContact O-N 2.83Å
110	G	93.3	Very high	94.6	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-56.7	-48.2	169.6	0	0	0	0	0	112.9	A102 D105 T107 M112 M113 E114	A102-G110 VanDerWaalsContact CB-O 3.27Å; A102-G110 WeakPolarHBondContact CB-O 3.44Å; D105-G110 WeakPolarHBondContact O-CA 3.32Å; D105-G110 PolarHBondContact OD2-N 3.43Å; D105-G110 VanDerWaalsContact OD2-N 3.16Å; T107-G110 PolarHBondContact O-N 3.19Å; T107-G110 VanDerWaalsContact O-N 3.09Å; G110-M112 VanDerWaalsContact C-N 3.27Å; G110-M112 PolarHBondContact O-N 3.3Å; G110-M113 PolarHBondContact O-N 3.1Å; G110-M113 VanDerWaalsContact O-N 3.14Å; G110-E114 PolarHBondContact O-N 3.03Å
111	N	92.5	Very high	94.6	Very high	104 Å²	104	66.1 Å²	66.1	56%	0.556	32%	0.32	S	S	*	.	H	α-helix	trans	-59.2	-36.9	174.9	-67.6	-18.9	0	0	0	112.6	T107 A115 F256	T107-N111 PolarHBondContact O-N 2.85Å; N111-A115 PolarHBondContact O-N 2.85Å; N111-A115 VanDerWaalsContact O-N 3.09Å; N111-F256 HydrophobicContact CB-CE1 4.39Å; N111-F256 HydrophobicContact CB-CZ 4.21Å
112	M	93.6	Very high	94.6	Very high	76 Å²	76	66.1 Å²	66.1	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-69	-41.5	175.7	-169.8	177.4	67.8	0	0	111.9	K108 A109 G110 E114 A115 T116 F256	K108-M112 PolarHBondContact O-N 3.4Å; K108-M112 VanDerWaalsContact O-N 3.09Å; A109-M112 WeakPolarHBondContact O-CB 3.29Å; A109-M112 PolarHBondContact O-N 3.43Å; A109-M112 VanDerWaalsContact O-N 3.16Å; G110-M112 VanDerWaalsContact C-N 3.27Å; G110-M112 PolarHBondContact O-N 3.3Å; M112-E114 VanDerWaalsContact C-N 3.35Å; M112-A115 PolarHBondContact O-N 3.24Å; M112-T116 VanDerWaalsContact O-CB 3.3Å; M112-T116 WeakPolarHBondContact O-CB 3.41Å; M112-T116 PolarHBondContact O-N 3.48Å; M112-T116 PolarHBondContact O-OG1 3.42Å; M112-F256 HydrophobicContact CB-CD1 3.83Å; M112-F256 HydrophobicContact CB-CD2 4.2Å; M112-F256 HydrophobicContact CB-CE1 3.58Å; M112-F256 HydrophobicContact CB-CE2 3.99Å; M112-F256 HydrophobicContact CB-CG 4.17Å; M112-F256 HydrophobicContact CB-CZ 3.69Å; M112-F256 HydrophobicContact CG-CD1 4.06Å; M112-F256 HydrophobicContact CG-CD2 3.85Å; M112-F256 HydrophobicContact CG-CE1 4.23Å; M112-F256 HydrophobicContact CG-CE2 4.04Å; M112-F256 HydrophobicContact CG-CG 3.9Å; M112-F256 HydrophobicContact CG-CZ 4.25Å; M112-F256 HydrophobicContact SD-CB 4.24Å; M112-F256 HydrophobicContact SD-CD1 4.26Å; M112-F256 HydrophobicContact SD-CG 4.09Å
113	M	95.6	Very high	94.7	Very high	45 Å²	45	65.7 Å²	65.7	22%	0.222	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-41	174.7	-74.1	-174.9	-93.1	0	0	111.4	L98 Q101 A102 D105 A109 G110 T116 S117	L98-M113 HydrophobicContact CD2-CG 4.31Å; Q101-M113 HydrophobicContact CB-SD 4.05Å; A102-M113 HydrophobicContact CB-CB 3.86Å; D105-M113 HydrophobicContact CB-CE 4.15Å; D105-M113 VanDerWaalsContact OD2-CE 3.31Å; D105-M113 WeakPolarHBondContact OD2-CE 3.49Å; A109-M113 HydrophobicContact CB-CE 4.25Å; A109-M113 WeakPolarHBondContact O-CG 3.24Å; A109-M113 PolarHBondContact O-N 2.83Å; G110-M113 PolarHBondContact O-N 3.1Å; G110-M113 VanDerWaalsContact O-N 3.14Å; M113-T116 PolarHBondContact O-N 3.35Å; M113-S117 WeakPolarHBondContact O-CB 3.29Å; M113-S117 PolarHBondContact O-N 2.91Å
114	E	96.5	Very high	94.8	Very high	49 Å²	49	59.6 Å²	59.6	23%	0.229	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-43.5	177	175.5	58.1	-176.8	0	0	112.8	R99 A102 G110 M112 S117 K118	R99-E114 WeakPolarHBondContact CG-OE2 3.37Å; A102-E114 HydrophobicContact CB-CB 3.72Å; G110-E114 PolarHBondContact O-N 3.03Å; M112-E114 VanDerWaalsContact C-N 3.35Å; E114-S117 WeakPolarHBondContact O-CB 3.4Å; E114-S117 PolarHBondContact O-N 2.87Å; E114-K118 HydrophobicContact CG-CD 4.48Å; E114-K118 PolarHBondContact O-N 3.34Å; E114-K118 VanDerWaalsContact O-N 3.12Å; E114-K118 WeakPolarHBondContact OE1-CE 3.4Å; E114-K118 IonicContact OE1-NZ 3.41Å; E114-K118 PolarHBondContact OE1-NZ 3.12Å
115	A	96.1	Very high	94.9	Very high	30 Å²	30	58.2 Å²	58.2	25%	0.248	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-43.8	175.9	0	0	0	0	0	111.4	N111 M112 K118 A119 I252 F256	N111-A115 PolarHBondContact O-N 2.85Å; N111-A115 VanDerWaalsContact O-N 3.09Å; M112-A115 PolarHBondContact O-N 3.24Å; A115-K118 PolarHBondContact O-N 3.09Å; A115-A119 PolarHBondContact O-N 3.3Å; A115-I252 HydrophobicContact CB-CD1 4.24Å; A115-I252 HydrophobicContact CB-CG1 4.07Å; A115-I252 WeakPolarHBondContact O-CD1 3.46Å; A115-F256 HydrophobicContact CB-CE2 4.36Å
116	T	96.9	Very high	95	Very high	43 Å²	43	58.9 Å²	58.9	26%	0.264	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-42.8	177.1	-53.1	0	0	0	0	111.5	L98 M112 M113 K118 A119 L120	L98-T116 HydrophobicContact CD1-CG2 3.69Å; M112-T116 VanDerWaalsContact O-CB 3.3Å; M112-T116 WeakPolarHBondContact O-CB 3.41Å; M112-T116 PolarHBondContact O-N 3.48Å; M112-T116 PolarHBondContact O-OG1 3.42Å; M113-T116 PolarHBondContact O-N 3.35Å; T116-K118 PolarHBondContact O-N 3.09Å; T116-A119 PolarHBondContact O-N 3.36Å; T116-L120 HydrophobicContact CG2-CD1 4.17Å; T116-L120 HydrophobicContact CG2-CG 4.26Å; T116-L120 WeakPolarHBondContact O-CG 3.34Å; T116-L120 PolarHBondContact O-N 3.49Å
117	S	97.8	Very high	95.2	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-49.2	-54.5	171.5	139.9	0	0	0	0	111.7	G95 R99 M113 E114 A119 L120 C121	G95-S117 VanDerWaalsContact O-CB 3.26Å; G95-S117 WeakPolarHBondContact O-CB 3.24Å; G95-S117 PolarHBondContact O-OG 3.2Å; R99-S117 WeakPolarHBondContact CB-OG 3.45Å; M113-S117 WeakPolarHBondContact O-CB 3.29Å; M113-S117 PolarHBondContact O-N 2.91Å; E114-S117 WeakPolarHBondContact O-CB 3.4Å; E114-S117 PolarHBondContact O-N 2.87Å; S117-A119 PolarHBondContact O-N 3.17Å; S117-L120 PolarHBondContact O-N 3.01Å; S117-C121 WeakPolarHBondContact O-CB 3.44Å; S117-C121 PolarHBondContact O-N 2.97Å; S117-C121 PolarHBondContact O-SG 2.89Å
118	K	97.3	Very high	95.5	Very high	121 Å²	121	48 Å²	48	53%	0.526	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-41.7	179.1	-78.2	163.6	165	150.6	0	112.1	E114 A115 T116 T122	E114-K118 HydrophobicContact CG-CD 4.48Å; E114-K118 PolarHBondContact O-N 3.34Å; E114-K118 VanDerWaalsContact O-N 3.12Å; E114-K118 WeakPolarHBondContact OE1-CE 3.4Å; E114-K118 IonicContact OE1-NZ 3.41Å; E114-K118 PolarHBondContact OE1-NZ 3.12Å; A115-K118 PolarHBondContact O-N 3.09Å; T116-K118 PolarHBondContact O-N 3.09Å; K118-T122 VanDerWaalsContact O-CB 3.25Å; K118-T122 WeakPolarHBondContact O-CB 3.24Å; K118-T122 PolarHBondContact O-N 3.4Å; K118-T122 PolarHBondContact O-OG1 2.93Å
119	A	97.6	Very high	95.9	Very high	13 Å²	13	46.4 Å²	46.4	11%	0.107	25%	0.25	C	S	.	.	H	α-helix	trans	-65	-47.6	176.5	0	0	0	0	0	112.5	A115 T116 S117 T122 S123 A248 I252	A115-A119 PolarHBondContact O-N 3.3Å; T116-A119 PolarHBondContact O-N 3.36Å; S117-A119 PolarHBondContact O-N 3.17Å; A119-T122 PolarHBondContact O-N 3.25Å; A119-S123 VanDerWaalsContact O-CB 3.29Å; A119-S123 WeakPolarHBondContact O-CB 3.5Å; A119-S123 PolarHBondContact O-N 3.42Å; A119-A248 HydrophobicContact CB-CB 4.4Å; A119-I252 HydrophobicContact CB-CD1 3.54Å
120	L	97.8	Very high	96.2	Very high	20 Å²	20	44.9 Å²	44.9	11%	0.105	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-44.9	178.8	-66.8	-178.8	0	0	0	112.3	E91 L94 L98 T116 S117 T122 S123 A124 M249	E91-L120 HydrophobicContact CG-CB 4.03Å; E91-L120 HydrophobicContact CG-CD2 4.03Å; E91-L120 WeakPolarHBondContact OE1-CD2 3.19Å; L94-L120 HydrophobicContact CD2-CD1 3.92Å; L94-L120 HydrophobicContact CG-CD1 3.89Å; L98-L120 HydrophobicContact CD1-CD1 3.89Å; T116-L120 HydrophobicContact CG2-CD1 4.17Å; T116-L120 HydrophobicContact CG2-CG 4.26Å; T116-L120 WeakPolarHBondContact O-CG 3.34Å; T116-L120 PolarHBondContact O-N 3.49Å; S117-L120 PolarHBondContact O-N 3.01Å; L120-T122 PolarHBondContact O-N 2.97Å; L120-S123 PolarHBondContact O-N 3.18Å; L120-A124 WeakPolarHBondContact O-CB 3.48Å; L120-A124 PolarHBondContact O-N 3.39Å; L120-M249 HydrophobicContact CD2-CE 4.26Å
121	C	97.8	Very high	96.4	Very high	18 Å²	18	45.8 Å²	45.8	12%	0.122	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-33.9	176	-64.6	0	0	0	0	112	S117 K125	S117-C121 WeakPolarHBondContact O-CB 3.44Å; S117-C121 PolarHBondContact O-N 2.97Å; S117-C121 PolarHBondContact O-SG 2.89Å; C121-K125 WeakPolarHBondContact O-CD 3.29Å; C121-K125 VanDerWaalsContact O-CG 3.25Å; C121-K125 WeakPolarHBondContact O-CG 3.41Å; C121-K125 PolarHBondContact O-N 2.67Å
122	T	96.8	Very high	96.6	Very high	65 Å²	65	45 Å²	45	40%	0.399	24%	0.244	S	C	.	.	H	α-helix	trans	-76.2	-43.8	177.9	-58.8	0	0	0	0	111.6	K118 A119 L120 K125 Q126	K118-T122 VanDerWaalsContact O-CB 3.25Å; K118-T122 WeakPolarHBondContact O-CB 3.24Å; K118-T122 PolarHBondContact O-N 3.4Å; K118-T122 PolarHBondContact O-OG1 2.93Å; A119-T122 PolarHBondContact O-N 3.25Å; L120-T122 PolarHBondContact O-N 2.97Å; T122-K125 PolarHBondContact O-N 2.94Å; T122-Q126 HydrophobicContact CG2-CG 4.32Å; T122-Q126 WeakPolarHBondContact O-CB 3.44Å; T122-Q126 VanDerWaalsContact O-CG 3.29Å; T122-Q126 WeakPolarHBondContact O-CG 3.26Å; T122-Q126 PolarHBondContact O-N 3Å
123	S	97.8	Very high	96.8	Very high	3 Å²	3	42 Å²	42	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-56.1	-49.8	173.2	161.6	0	0	0	0	111.3	E91 A119 L120 K125 Q126 R127	E91-S123 WeakPolarHBondContact OE1-CB 3.18Å; E91-S123 PolarHBondContact OE1-OG 3.3Å; A119-S123 VanDerWaalsContact O-CB 3.29Å; A119-S123 WeakPolarHBondContact O-CB 3.5Å; A119-S123 PolarHBondContact O-N 3.42Å; L120-S123 PolarHBondContact O-N 3.18Å; S123-K125 PolarHBondContact O-N 3.25Å; S123-Q126 PolarHBondContact O-N 3.21Å; S123-R127 PolarHBondContact O-N 3.34Å
124	A	97.9	Very high	96.8	Very high	3 Å²	3	39.9 Å²	39.9	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-55.7	-48.5	175.5	0	0	0	0	0	112.6	S88 E91 N92 L120 R127 M128	S88-A124 WeakPolarHBondContact O-CB 3.38Å; S88-A124 PolarHBondContact OG-O 3.35Å; E91-A124 HydrophobicContact CB-CB 4.33Å; E91-A124 HydrophobicContact CG-CB 4.36Å; N92-A124 HydrophobicContact CB-CB 3.89Å; L120-A124 WeakPolarHBondContact O-CB 3.48Å; L120-A124 PolarHBondContact O-N 3.39Å; A124-R127 PolarHBondContact O-N 3.07Å; A124-M128 PolarHBondContact O-N 2.86Å
125	K	95.3	Very high	96.9	Very high	147 Å²	147	41.1 Å²	41.1	64%	0.639	23%	0.225	S	C	*	.	H	α-helix	trans	-63	-42.5	176.2	-72.2	171.6	-175.6	-178.5	0	112.3	C121 T122 S123 M128	C121-K125 WeakPolarHBondContact O-CD 3.29Å; C121-K125 VanDerWaalsContact O-CG 3.25Å; C121-K125 WeakPolarHBondContact O-CG 3.41Å; C121-K125 PolarHBondContact O-N 2.67Å; T122-K125 PolarHBondContact O-N 2.94Å; S123-K125 PolarHBondContact O-N 3.25Å; K125-M128 WeakPolarHBondContact O-CB 3.45Å; K125-M128 PolarHBondContact O-N 3.1Å
126	Q	95.4	Very high	96.9	Very high	58 Å²	58	46.7 Å²	46.7	27%	0.271	24%	0.24	S	C	.	.	H	α-helix	trans	-68.4	-35.7	179.2	-72.8	-179.4	9.7	0	0	112.2	T122 S123 M128 A129 F241	T122-Q126 HydrophobicContact CG2-CG 4.32Å; T122-Q126 WeakPolarHBondContact O-CB 3.44Å; T122-Q126 VanDerWaalsContact O-CG 3.29Å; T122-Q126 WeakPolarHBondContact O-CG 3.26Å; T122-Q126 PolarHBondContact O-N 3Å; S123-Q126 PolarHBondContact O-N 3.21Å; Q126-M128 PolarHBondContact O-N 3.2Å; Q126-A129 WeakPolarHBondContact O-CB 3.39Å; Q126-A129 PolarHBondContact O-N 3.02Å; Q126-F241 HydrophobicContact CB-CD2 3.98Å
127	R	97	Very high	96.9	Very high	22 Å²	22	44.9 Å²	44.9	8%	0.083	23%	0.229	C	C	.	.	H	α-helix	trans	-62.1	-33.6	174.4	-166.9	-173.7	-62.7	105.7	4.3	112	I84 S88 E91 S123 A124 A129 L130 F241	I84-R127 HydrophobicContact CG2-CG 3.97Å; S88-R127 PolarHBondContact OG-NH1 2.98Å; E91-R127 IonicContact OE1-NH2 3.63Å; E91-R127 IonicContact OE2-CZ 3.93Å; E91-R127 IonicContact OE2-NH1 2.65Å; E91-R127 PolarHBondContact OE2-NH1 3.37Å; E91-R127 IonicContact OE2-NH2 2.64Å; E91-R127 PolarHBondContact OE2-NH2 3.31Å; S123-R127 PolarHBondContact O-N 3.34Å; A124-R127 PolarHBondContact O-N 3.07Å; R127-A129 PolarHBondContact O-N 3.49Å; R127-L130 HydrophobicContact CG-CD1 3.88Å; R127-L130 VanDerWaalsContact O-CB 3.26Å; R127-L130 WeakPolarHBondContact O-CB 3.34Å; R127-L130 VanDerWaalsContact O-CG 3.29Å; R127-L130 WeakPolarHBondContact O-CG 3.47Å; R127-L130 PolarHBondContact O-N 3.04Å; R127-F241 HydrophobicContact CB-CD2 4.12Å; R127-F241 HydrophobicContact CB-CE2 3.7Å; R127-F241 HydrophobicContact CB-CZ 4.01Å; R127-F241 HydrophobicContact CG-CE1 4.42Å; R127-F241 HydrophobicContact CG-CE2 4.32Å; R127-F241 HydrophobicContact CG-CZ 4.15Å
128	M	96.9	Very high	97	Very high	70 Å²	70	47.1 Å²	47.1	35%	0.345	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-63.8	-19.1	174.8	-64.7	-55.1	-64.4	0	0	113.4	I84 T85 A124 K125 Q126 L130 C131	I84-M128 HydrophobicContact CG2-SD 4.16Å; T85-M128 HydrophobicContact CG2-CE 4.16Å; A124-M128 PolarHBondContact O-N 2.86Å; K125-M128 WeakPolarHBondContact O-CB 3.45Å; K125-M128 PolarHBondContact O-N 3.1Å; Q126-M128 PolarHBondContact O-N 3.2Å; M128-L130 PolarHBondContact O-N 3.25Å; M128-C131 WeakPolarHBondContact O-CB 3.26Å; M128-C131 PolarHBondContact O-N 3.2Å; M128-C131 VanDerWaalsContact O-N 3.1Å
129	A	95.3	Very high	97	Very high	51 Å²	51	46.3 Å²	46.3	42%	0.421	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-66.7	-12.1	171.2	0	0	0	0	0	113.4	Q126 R127 C131 P132 P133 T237	Q126-A129 WeakPolarHBondContact O-CB 3.39Å; Q126-A129 PolarHBondContact O-N 3.02Å; R127-A129 PolarHBondContact O-N 3.49Å; A129-C131 VanDerWaalsContact C-N 3.34Å; A129-P132 WeakPolarHBondContact O-CD 3.38Å; A129-P133 VanDerWaalsContact O-CD 3.29Å; A129-P133 WeakPolarHBondContact O-CD 3.24Å; A129-T237 HydrophobicContact CB-CG2 4.31Å
130	L	96.1	Very high	97	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-75.1	-21.2	171.1	-57.9	173.1	0	0	0	113	I84 R127 M128 P133 L134 Y234 T237 L238 F241	I84-L130 HydrophobicContact CD1-CB 4.2Å; I84-L130 HydrophobicContact CD1-CD1 4.31Å; R127-L130 HydrophobicContact CG-CD1 3.88Å; R127-L130 VanDerWaalsContact O-CB 3.26Å; R127-L130 WeakPolarHBondContact O-CB 3.34Å; R127-L130 VanDerWaalsContact O-CG 3.29Å; R127-L130 WeakPolarHBondContact O-CG 3.47Å; R127-L130 PolarHBondContact O-N 3.04Å; M128-L130 PolarHBondContact O-N 3.25Å; L130-P133 VanDerWaalsContact O-CD 3.27Å; L130-P133 WeakPolarHBondContact O-CD 3.49Å; L130-P133 WeakPolarHBondContact O-CG 3.43Å; L130-L134 HydrophobicContact CB-CD1 4.35Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 WeakPolarHBondContact O-CD1 3.48Å; L130-L134 WeakPolarHBondContact O-CG 3.21Å; L130-L134 PolarHBondContact O-N 2.9Å; L130-Y234 HydrophobicContact CD2-CE2 4.33Å; L130-T237 HydrophobicContact CD2-CG2 3.85Å; L130-L238 HydrophobicContact CD1-CD1 3.8Å; L130-L238 HydrophobicContact CD2-CB 4.03Å; L130-L238 HydrophobicContact CD2-CD1 4.09Å; L130-F241 HydrophobicContact CD1-CD1 4.37Å
131	C	96.6	Very high	97	Very high	20 Å²	20	47.4 Å²	47.4	14%	0.135	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-45.4	-176.6	-63.7	0	0	0	0	113.1	M128 A129 L134 Q135	M128-C131 WeakPolarHBondContact O-CB 3.26Å; M128-C131 PolarHBondContact O-N 3.2Å; M128-C131 VanDerWaalsContact O-N 3.1Å; A129-C131 VanDerWaalsContact C-N 3.34Å; C131-L134 PolarHBondContact O-N 3.38Å; C131-Q135 WeakPolarHBondContact O-CB 3.41Å; C131-Q135 PolarHBondContact O-N 3.49Å
132	P	96.6	Very high	97	Very high	86 Å²	86	48.1 Å²	48.1	56%	0.558	24%	0.239	S	C	*	.	H	α-helix	trans	-56.7	-48.7	176.2	-25.6	34.4	0	0	0	115.9	A129 Q135 R136	A129-P132 WeakPolarHBondContact O-CD 3.38Å; P132-Q135 PolarHBondContact O-N 2.95Å; P132-R136 PolarHBondContact O-N 3.1Å
133	P	97	Very high	97.1	Very high	13 Å²	13	48.7 Å²	48.7	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-68.3	-34.8	176.8	25.1	-33	0	0	0	112.9	A129 L130 Q135 R136 M137 T233	A129-P133 VanDerWaalsContact O-CD 3.29Å; A129-P133 WeakPolarHBondContact O-CD 3.24Å; L130-P133 VanDerWaalsContact O-CD 3.27Å; L130-P133 WeakPolarHBondContact O-CD 3.49Å; L130-P133 WeakPolarHBondContact O-CG 3.43Å; P133-Q135 VanDerWaalsContact C-N 3.34Å; P133-Q135 PolarHBondContact O-N 3.41Å; P133-R136 PolarHBondContact O-N 3.47Å; P133-M137 WeakPolarHBondContact O-CB 3.25Å; P133-M137 PolarHBondContact O-N 3.28Å; P133-T233 HydrophobicContact CB-CG2 4.11Å
134	L	97.4	Very high	97.1	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-40.2	172.1	-73.1	171.1	0	0	0	112.1	I77 Y80 Q81 I84 L130 C131 M137 Y138 Y234	I77-L134 HydrophobicContact CG2-CB 4.38Å; Y80-L134 HydrophobicContact CD1-CD1 3.64Å; Y80-L134 HydrophobicContact CD1-CD2 3.86Å; Y80-L134 HydrophobicContact CD1-CG 4.43Å; Y80-L134 HydrophobicContact CE1-CD1 3.69Å; Y80-L134 HydrophobicContact CE1-CD2 4.05Å; Y80-L134 HydrophobicContact CE1-CG 4.5Å; Q81-L134 HydrophobicContact CG-CB 3.87Å; Q81-L134 HydrophobicContact CG-CD1 4.1Å; I84-L134 HydrophobicContact CD1-CD1 3.39Å; L130-L134 HydrophobicContact CB-CD1 4.35Å; L130-L134 WeakPolarHBondContact O-CB 3.48Å; L130-L134 WeakPolarHBondContact O-CD1 3.48Å; L130-L134 WeakPolarHBondContact O-CG 3.21Å; L130-L134 PolarHBondContact O-N 2.9Å; C131-L134 PolarHBondContact O-N 3.38Å; L134-M137 HydrophobicContact CD2-CE 3.79Å; L134-M137 PolarHBondContact O-N 2.81Å; L134-Y138 PolarHBondContact O-N 3.49Å; L134-Y234 HydrophobicContact CD1-CE2 4.2Å; L134-Y234 HydrophobicContact CD2-CD2 3.63Å; L134-Y234 HydrophobicContact CD2-CE2 3.63Å; L134-Y234 HydrophobicContact CD2-CG 4.24Å; L134-Y234 HydrophobicContact CG-CD2 3.79Å; L134-Y234 HydrophobicContact CG-CE2 3.89Å
135	Q	97.1	Very high	97.1	Very high	74 Å²	74	53.1 Å²	53.1	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-70.4	-38.5	179.2	-175.6	61.1	2.3	0	0	112.2	C131 P132 P133 Y138 Q139	C131-Q135 WeakPolarHBondContact O-CB 3.41Å; C131-Q135 PolarHBondContact O-N 3.49Å; P132-Q135 PolarHBondContact O-N 2.95Å; P133-Q135 VanDerWaalsContact C-N 3.34Å; P133-Q135 PolarHBondContact O-N 3.41Å; Q135-Y138 PolarHBondContact O-N 3.46Å; Q135-Q139 VanDerWaalsContact O-CG 3.32Å; Q135-Q139 WeakPolarHBondContact O-CG 3.27Å; Q135-Q139 PolarHBondContact O-N 3.49Å
136	R	97.1	Very high	97.2	Very high	147 Å²	147	53.5 Å²	53.5	56%	0.555	26%	0.256	S	S	*	.	H	α-helix	trans	-60.7	-48	170.7	169.2	165.3	-94.5	106.6	-1.9	111.2	P132 P133 Y138 Q139 E140	P132-R136 PolarHBondContact O-N 3.1Å; P133-R136 PolarHBondContact O-N 3.47Å; R136-Y138 VanDerWaalsContact C-N 3.31Å; R136-Y138 PolarHBondContact O-N 3.24Å; R136-Q139 PolarHBondContact O-N 3.46Å; R136-E140 WeakPolarHBondContact CD-OE1 3.48Å; R136-E140 HydrophobicContact CG-CG 4.43Å; R136-E140 WeakPolarHBondContact CG-OE1 3.29Å; R136-E140 IonicContact NE-OE1 2.85Å; R136-E140 WeakPolarHBondContact O-CG 3.33Å; R136-E140 PolarHBondContact O-N 3.46Å
137	M	97.4	Very high	97.3	Very high	6 Å²	6	60 Å²	60	3%	0.03	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-40.5	176.8	-176	170.8	48.5	0	0	112.3	I77 P133 L134 E140 V141 L231	I77-M137 HydrophobicContact CD1-CB 4.48Å; I77-M137 HydrophobicContact CD1-CE 3.83Å; I77-M137 HydrophobicContact CD1-CG 3.88Å; I77-M137 HydrophobicContact CD1-SD 4.24Å; I77-M137 HydrophobicContact CG1-CE 3.99Å; P133-M137 WeakPolarHBondContact O-CB 3.25Å; P133-M137 PolarHBondContact O-N 3.28Å; L134-M137 HydrophobicContact CD2-CE 3.79Å; L134-M137 PolarHBondContact O-N 2.81Å; M137-E140 PolarHBondContact O-N 3.38Å; M137-V141 HydrophobicContact CG-CG2 4.44Å; M137-V141 VanDerWaalsContact O-CG2 3.28Å; M137-V141 WeakPolarHBondContact O-CG2 3.45Å; M137-V141 PolarHBondContact O-N 3.13Å; M137-L231 HydrophobicContact CE-CD2 4.34Å; M137-L231 HydrophobicContact SD-CD2 3.53Å; M137-L231 VanDerWaalsContact SD-CD2 3.53Å; M137-L231 HydrophobicContact SD-CG 4.08Å
138	Y	98.2	Very high	97.3	Very high	48 Å²	48	60.6 Å²	60.6	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-50.8	173.4	-178.4	-82.6	0	0	0	111.6	L74 I77 E78 L134 Q135 R136 E140 V141 E142	L74-Y138 HydrophobicContact CB-CD2 4.42Å; L74-Y138 HydrophobicContact CB-CE2 3.99Å; L74-Y138 HydrophobicContact CD2-CD1 4.36Å; L74-Y138 HydrophobicContact CD2-CD2 3.6Å; L74-Y138 HydrophobicContact CD2-CE1 4.38Å; L74-Y138 HydrophobicContact CD2-CE2 3.65Å; L74-Y138 HydrophobicContact CD2-CG 3.96Å; L74-Y138 WeakPolarHBondContact CD2-O 3.29Å; L74-Y138 HydrophobicContact CG-CE2 4.4Å; I77-Y138 HydrophobicContact CB-CD2 4.39Å; I77-Y138 HydrophobicContact CG2-CD2 4.23Å; E78-Y138 HydrophobicContact CB-CE2 4.4Å; L134-Y138 PolarHBondContact O-N 3.49Å; Q135-Y138 PolarHBondContact O-N 3.46Å; R136-Y138 VanDerWaalsContact C-N 3.31Å; R136-Y138 PolarHBondContact O-N 3.24Å; Y138-E140 VanDerWaalsContact C-N 3.34Å; Y138-E140 PolarHBondContact O-N 2.91Å; Y138-V141 PolarHBondContact O-N 3.39Å; Y138-E142 HydrophobicContact CE1-CB 4.31Å; Y138-E142 WeakPolarHBondContact CE1-OE2 3.33Å; Y138-E142 VanDerWaalsContact O-CB 3.28Å; Y138-E142 WeakPolarHBondContact O-CB 3.35Å; Y138-E142 PolarHBondContact O-N 3.02Å
139	Q	97.8	Very high	97.4	Very high	104 Å²	104	57.6 Å²	57.6	49%	0.486	27%	0.273	S	S	.	.	H	α-helix	trans	-62.2	-38.6	-178.8	-72.8	172.4	-15.8	0	0	112.8	Q135 R136 T143	Q135-Q139 VanDerWaalsContact O-CG 3.32Å; Q135-Q139 WeakPolarHBondContact O-CG 3.27Å; Q135-Q139 PolarHBondContact O-N 3.49Å; R136-Q139 PolarHBondContact O-N 3.46Å; Q139-T143 VanDerWaalsContact O-CB 3.31Å; Q139-T143 WeakPolarHBondContact O-CB 3.35Å; Q139-T143 PolarHBondContact O-N 3.33Å; Q139-T143 PolarHBondContact O-OG1 3.16Å
140	E	97.4	Very high	97.5	Very high	57 Å²	57	57.1 Å²	57.1	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-65.9	-52.2	176.5	-73.2	174.6	-158.7	0	0	111.3	R136 M137 Y138 E142 T143 F144 M226 S230	R136-E140 WeakPolarHBondContact CD-OE1 3.48Å; R136-E140 HydrophobicContact CG-CG 4.43Å; R136-E140 WeakPolarHBondContact CG-OE1 3.29Å; R136-E140 IonicContact NE-OE1 2.85Å; R136-E140 WeakPolarHBondContact O-CG 3.33Å; R136-E140 PolarHBondContact O-N 3.46Å; M137-E140 PolarHBondContact O-N 3.38Å; Y138-E140 VanDerWaalsContact C-N 3.34Å; Y138-E140 PolarHBondContact O-N 2.91Å; E140-E142 VanDerWaalsContact C-N 3.29Å; E140-E142 PolarHBondContact O-N 3Å; E140-T143 PolarHBondContact O-N 2.98Å; E140-F144 WeakPolarHBondContact O-CB 3.38Å; E140-F144 PolarHBondContact O-N 3.46Å; E140-M226 VanDerWaalsContact C-SD 3.52Å; E140-M226 HydrophobicContact CB-CG 3.97Å; E140-M226 HydrophobicContact CB-SD 3.98Å; E140-M226 VanDerWaalsContact O-SD 3.42Å; E140-S230 WeakPolarHBondContact OE2-CB 3.42Å
141	V	98.1	Very high	97.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-37.9	177.9	176.9	0	0	0	0	111.4	C70 L73 L74 M137 Y138 R145 M226 L227	C70-V141 HydrophobicContact CB-CG1 4.15Å; L73-V141 HydrophobicContact CD2-CG1 4.39Å; L73-V141 HydrophobicContact CD2-CG2 3.87Å; L74-V141 HydrophobicContact CD1-CG1 4.33Å; L74-V141 HydrophobicContact CD2-CB 3.89Å; L74-V141 HydrophobicContact CD2-CG1 3.85Å; L74-V141 HydrophobicContact CG-CB 4.4Å; L74-V141 HydrophobicContact CG-CG1 3.78Å; M137-V141 HydrophobicContact CG-CG2 4.44Å; M137-V141 VanDerWaalsContact O-CG2 3.28Å; M137-V141 WeakPolarHBondContact O-CG2 3.45Å; M137-V141 PolarHBondContact O-N 3.13Å; Y138-V141 PolarHBondContact O-N 3.39Å; V141-R145 WeakPolarHBondContact O-CB 3.42Å; V141-R145 PolarHBondContact O-N 2.9Å; V141-M226 HydrophobicContact CB-CE 4.41Å; V141-M226 HydrophobicContact CG2-CE 3.81Å; V141-M226 HydrophobicContact CG2-SD 4.49Å; V141-L227 HydrophobicContact CG2-CD2 4.02Å
142	E	98.1	Very high	97.7	Very high	32 Å²	32	60 Å²	60	15%	0.15	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-44.2	175.9	172.6	149.8	-122.7	0	0	111.8	L74 Y138 E140 F144 R145 R146	L74-E142 HydrophobicContact CD1-CB 4.32Å; L74-E142 HydrophobicContact CD2-CB 3.98Å; Y138-E142 HydrophobicContact CE1-CB 4.31Å; Y138-E142 WeakPolarHBondContact CE1-OE2 3.33Å; Y138-E142 VanDerWaalsContact O-CB 3.28Å; Y138-E142 WeakPolarHBondContact O-CB 3.35Å; Y138-E142 PolarHBondContact O-N 3.02Å; E140-E142 VanDerWaalsContact C-N 3.29Å; E140-E142 PolarHBondContact O-N 3Å; E142-F144 VanDerWaalsContact C-N 3.34Å; E142-F144 PolarHBondContact O-N 3.5Å; E142-R145 PolarHBondContact O-N 3.21Å; E142-R145 IonicContact OE1-NH2 2.64Å; E142-R145 PolarHBondContact OE1-NH2 3.33Å; E142-R146 VanDerWaalsContact CD-CZ 3.42Å; E142-R146 HydrophobicContact CG-CG 4.13Å; E142-R146 VanDerWaalsContact CG-NE 3.32Å; E142-R146 WeakPolarHBondContact O-CB 3.34Å; E142-R146 WeakPolarHBondContact O-CG 3.38Å; E142-R146 PolarHBondContact O-N 3.23Å; E142-R146 IonicContact OE1-CZ 2.7Å; E142-R146 IonicContact OE1-NE 3.1Å; E142-R146 PolarHBondContact OE1-NE 3.34Å; E142-R146 IonicContact OE1-NH2 2.74Å; E142-R146 PolarHBondContact OE1-NH2 3.27Å; E142-R146 IonicContact OE2-CZ 3.66Å; E142-R146 IonicContact OE2-NE 3.84Å; E142-R146 IonicContact OE2-NH2 2.64Å; E142-R146 PolarHBondContact OE2-NH2 3.39Å; E142-R146 VanDerWaalsContact OE2-NH2 3.09Å
143	T	97.8	Very high	97.7	Very high	77 Å²	77	59.2 Å²	59.2	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-62.9	-43.1	177.3	-60.2	0	0	0	0	110.9	Q139 E140 R145 R146 R147	Q139-T143 VanDerWaalsContact O-CB 3.31Å; Q139-T143 WeakPolarHBondContact O-CB 3.35Å; Q139-T143 PolarHBondContact O-N 3.33Å; Q139-T143 PolarHBondContact O-OG1 3.16Å; E140-T143 PolarHBondContact O-N 2.98Å; T143-R145 VanDerWaalsContact C-N 3.35Å; T143-R145 PolarHBondContact O-N 2.94Å; T143-R146 PolarHBondContact O-N 2.85Å; T143-R147 HydrophobicContact CG2-CG 4.39Å; T143-R147 WeakPolarHBondContact O-CB 3.49Å; T143-R147 WeakPolarHBondContact O-CG 3.47Å; T143-R147 PolarHBondContact O-N 2.98Å
144	F	97.9	Very high	97.8	Very high	19 Å²	19	63.7 Å²	63.7	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-58.1	-44.8	173.7	178.7	-102.4	0	0	0	112	V66 E140 E142 A148 I149 L219 R223 M226	V66-F144 HydrophobicContact CG1-CE1 4.1Å; E140-F144 WeakPolarHBondContact O-CB 3.38Å; E140-F144 PolarHBondContact O-N 3.46Å; E142-F144 VanDerWaalsContact C-N 3.34Å; E142-F144 PolarHBondContact O-N 3.5Å; F144-A148 HydrophobicContact CD2-CB 3.86Å; F144-A148 HydrophobicContact CE2-CB 3.91Å; F144-A148 WeakPolarHBondContact O-CB 3.38Å; F144-A148 PolarHBondContact O-N 2.98Å; F144-I149 HydrophobicContact CD1-CD1 3.89Å; F144-I149 HydrophobicContact CD1-CG1 4.24Å; F144-I149 HydrophobicContact CE1-CD1 3.69Å; F144-I149 HydrophobicContact CE1-CG1 3.9Å; F144-I149 HydrophobicContact CZ-CG1 4.47Å; F144-I149 PolarHBondContact O-N 3.42Å; F144-I149 VanDerWaalsContact O-N 3.11Å; F144-L219 HydrophobicContact CE1-CD2 4.31Å; F144-L219 HydrophobicContact CE2-CG 4.25Å; F144-L219 HydrophobicContact CZ-CD2 3.77Å; F144-L219 HydrophobicContact CZ-CG 3.69Å; F144-L219 WeakPolarHBondContact CZ-O 3.23Å; F144-R223 HydrophobicContact CE1-CB 4.08Å; F144-R223 HydrophobicContact CE1-CG 4.38Å; F144-R223 HydrophobicContact CE2-CB 4.34Å; F144-R223 HydrophobicContact CZ-CB 3.68Å; F144-R223 HydrophobicContact CZ-CG 4.46Å; F144-M226 HydrophobicContact CB-CE 4.01Å; F144-M226 HydrophobicContact CB-SD 3.57Å; F144-M226 VanDerWaalsContact CB-SD 3.57Å; F144-M226 HydrophobicContact CD1-CE 4.08Å; F144-M226 HydrophobicContact CD2-SD 4.43Å; F144-M226 HydrophobicContact CG-CE 3.97Å; F144-M226 HydrophobicContact CG-SD 4.02Å
145	R	97.8	Very high	97.8	Very high	81 Å²	81	64.1 Å²	64.1	31%	0.306	30%	0.3	S	S	.	.	I	π-helix	trans	-64.9	-47	175.9	-171.2	-170.9	63.7	76.4	-0.3	112.8	V141 E142 T143 R147 I149 A150	V141-R145 WeakPolarHBondContact O-CB 3.42Å; V141-R145 PolarHBondContact O-N 2.9Å; E142-R145 PolarHBondContact O-N 3.21Å; E142-R145 IonicContact OE1-NH2 2.64Å; E142-R145 PolarHBondContact OE1-NH2 3.33Å; T143-R145 VanDerWaalsContact C-N 3.35Å; T143-R145 PolarHBondContact O-N 2.94Å; R145-R147 VanDerWaalsContact C-N 3.33Å; R145-R147 PolarHBondContact O-N 3.42Å; R145-I149 HydrophobicContact CB-CD1 4.36Å; R145-I149 HydrophobicContact CG-CD1 4.38Å; R145-A150 PolarHBondContact O-N 3.19Å
146	R	97.6	Very high	97.9	Very high	155 Å²	155	61.2 Å²	61.2	59%	0.585	29%	0.287	S	S	*	.	I	π-helix	trans	-70.1	-25.9	-177.6	-70.6	-179.3	-174.6	-164.9	7.4	113.1	E142 T143 A150	E142-R146 VanDerWaalsContact CD-CZ 3.42Å; E142-R146 HydrophobicContact CG-CG 4.13Å; E142-R146 VanDerWaalsContact CG-NE 3.32Å; E142-R146 WeakPolarHBondContact O-CB 3.34Å; E142-R146 WeakPolarHBondContact O-CG 3.38Å; E142-R146 PolarHBondContact O-N 3.23Å; E142-R146 IonicContact OE1-CZ 2.7Å; E142-R146 IonicContact OE1-NE 3.1Å; E142-R146 PolarHBondContact OE1-NE 3.34Å; E142-R146 IonicContact OE1-NH2 2.74Å; E142-R146 PolarHBondContact OE1-NH2 3.27Å; E142-R146 IonicContact OE2-CZ 3.66Å; E142-R146 IonicContact OE2-NE 3.84Å; E142-R146 IonicContact OE2-NH2 2.64Å; E142-R146 PolarHBondContact OE2-NH2 3.39Å; E142-R146 VanDerWaalsContact OE2-NH2 3.09Å; T143-R146 PolarHBondContact O-N 2.85Å; R146-A150 WeakPolarHBondContact O-CB 3.26Å
147	R	97.7	Very high	97.9	Very high	195 Å²	195	57.5 Å²	57.5	74%	0.736	28%	0.283	S	S	*	.	I	π-helix	trans	-110.6	-67.6	-176.2	-52.3	-166.8	88.6	162.3	6.6	113	T143 R145 A150 D151	T143-R147 HydrophobicContact CG2-CG 4.39Å; T143-R147 WeakPolarHBondContact O-CB 3.49Å; T143-R147 WeakPolarHBondContact O-CG 3.47Å; T143-R147 PolarHBondContact O-N 2.98Å; R145-R147 VanDerWaalsContact C-N 3.33Å; R145-R147 PolarHBondContact O-N 3.42Å; R147-A150 PolarHBondContact O-N 3.39Å; R147-D151 WeakPolarHBondContact O-CB 3.17Å; R147-D151 PolarHBondContact O-N 2.65Å
148	A	97.8	Very high	98	Very high	33 Å²	33	65.2 Å²	65.2	27%	0.273	31%	0.312	S	S	.	.	I	π-helix	trans	-68.9	-45.7	-172.4	0	0	0	0	0	112.9	F144 T152 L219	F144-A148 HydrophobicContact CD2-CB 3.86Å; F144-A148 HydrophobicContact CE2-CB 3.91Å; F144-A148 WeakPolarHBondContact O-CB 3.38Å; F144-A148 PolarHBondContact O-N 2.98Å; A148-T152 WeakPolarHBondContact O-CB 3.41Å; A148-T152 PolarHBondContact O-N 2.85Å; A148-T152 VanDerWaalsContact O-N 3.1Å; A148-T152 PolarHBondContact O-OG1 3.18Å; A148-L219 HydrophobicContact CB-CD1 4.4Å; A148-L219 WeakPolarHBondContact O-CD1 3.49Å
149	I	98.1	Very high	98	Very high	7 Å²	7	62.9 Å²	62.9	4%	0.036	30%	0.303	C	S	.	.	I	π-helix	trans	-66.2	-40.3	176.7	-70.5	173.9	0	0	0	111.2	F63 V66 Q67 C70 F144 R145 T152 L153 L219	F63-I149 HydrophobicContact CE2-CG2 4.42Å; F63-I149 HydrophobicContact CZ-CG2 4.4Å; V66-I149 HydrophobicContact CG1-CD1 4.18Å; Q67-I149 HydrophobicContact CB-CG2 4.44Å; Q67-I149 HydrophobicContact CG-CG2 3.71Å; C70-I149 HydrophobicContact CB-CD1 4.1Å; F144-I149 HydrophobicContact CD1-CD1 3.89Å; F144-I149 HydrophobicContact CD1-CG1 4.24Å; F144-I149 HydrophobicContact CE1-CD1 3.69Å; F144-I149 HydrophobicContact CE1-CG1 3.9Å; F144-I149 HydrophobicContact CZ-CG1 4.47Å; F144-I149 PolarHBondContact O-N 3.42Å; F144-I149 VanDerWaalsContact O-N 3.11Å; R145-I149 HydrophobicContact CB-CD1 4.36Å; R145-I149 HydrophobicContact CG-CD1 4.38Å; I149-T152 PolarHBondContact O-N 3.03Å; I149-L153 WeakPolarHBondContact O-CB 3.33Å; I149-L153 PolarHBondContact O-N 3.33Å; I149-L219 HydrophobicContact CG1-CD1 3.95Å; I149-L219 HydrophobicContact CG1-CD2 4.3Å
150	A	97.9	Very high	97.9	Very high	41 Å²	41	59.6 Å²	59.6	34%	0.339	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-46.1	179.1	0	0	0	0	0	112.6	R145 R146 R147 T152 L153 L154	R145-A150 PolarHBondContact O-N 3.19Å; R146-A150 WeakPolarHBondContact O-CB 3.26Å; R147-A150 PolarHBondContact O-N 3.39Å; A150-T152 PolarHBondContact O-N 3.35Å; A150-L153 WeakPolarHBondContact O-CB 3.32Å; A150-L153 PolarHBondContact O-N 3.07Å; A150-L154 WeakPolarHBondContact O-CG 3.48Å; A150-L154 PolarHBondContact O-N 3.25Å
151	D	97.9	Very high	97.9	Very high	76 Å²	76	60.7 Å²	60.7	41%	0.406	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-41.4	175.7	169.3	72.9	0	0	0	112.6	R147 L153 L154 T155 K215	R147-D151 WeakPolarHBondContact O-CB 3.17Å; R147-D151 PolarHBondContact O-N 2.65Å; D151-L153 VanDerWaalsContact C-N 3.33Å; D151-L153 PolarHBondContact O-N 3.21Å; D151-L154 PolarHBondContact O-N 3.2Å; D151-T155 PolarHBondContact O-N 3.02Å; D151-T155 PolarHBondContact O-OG1 3.31Å; D151-K215 VanDerWaalsContact CG-NZ 3.3Å; D151-K215 IonicContact OD1-NZ 3.81Å; D151-K215 PolarHBondContact OD1-NZ 3.37Å; D151-K215 WeakPolarHBondContact OD2-CE 3.48Å; D151-K215 IonicContact OD2-NZ 3.01Å; D151-K215 PolarHBondContact OD2-NZ 3.29Å
152	T	98.2	Very high	97.8	Very high	6 Å²	6	61 Å²	61	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-40.2	176.2	-55.8	0	0	0	0	110.7	F63 A148 I149 A150 L154 T155 V156 K215 V216 L219	F63-T152 HydrophobicContact CD2-CG2 3.8Å; F63-T152 HydrophobicContact CE2-CG2 3.47Å; F63-T152 VanDerWaalsContact CE2-CG2 3.47Å; F63-T152 HydrophobicContact CZ-CG2 4.01Å; A148-T152 WeakPolarHBondContact O-CB 3.41Å; A148-T152 PolarHBondContact O-N 2.85Å; A148-T152 VanDerWaalsContact O-N 3.1Å; A148-T152 PolarHBondContact O-OG1 3.18Å; I149-T152 PolarHBondContact O-N 3.03Å; A150-T152 PolarHBondContact O-N 3.35Å; T152-L154 PolarHBondContact O-N 2.99Å; T152-T155 WeakPolarHBondContact O-CB 3.34Å; T152-T155 PolarHBondContact O-N 3.46Å; T152-T155 VanDerWaalsContact O-N 3.1Å; T152-V156 HydrophobicContact CG2-CG2 4.42Å; T152-V156 WeakPolarHBondContact O-CG2 3.28Å; T152-V156 PolarHBondContact O-N 3.23Å; T152-K215 HydrophobicContact CG2-CB 4.12Å; T152-V216 HydrophobicContact CG2-CG2 3.91Å; T152-L219 HydrophobicContact CG2-CD1 4.2Å; T152-L219 VanDerWaalsContact OG1-CD1 3.23Å; T152-L219 WeakPolarHBondContact OG1-CD1 3.41Å
153	L	98.3	Very high	97.7	Very high	71 Å²	71	59.6 Å²	59.6	37%	0.372	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-41.8	175.4	-176.9	61.1	0	0	0	112.4	F63 I149 A150 D151 T155 V156 S157	F63-L153 HydrophobicContact CE1-CB 4.44Å; F63-L153 HydrophobicContact CE1-CD1 4.05Å; F63-L153 HydrophobicContact CZ-CB 4.03Å; F63-L153 HydrophobicContact CZ-CD1 4.45Å; I149-L153 WeakPolarHBondContact O-CB 3.33Å; I149-L153 PolarHBondContact O-N 3.33Å; A150-L153 WeakPolarHBondContact O-CB 3.32Å; A150-L153 PolarHBondContact O-N 3.07Å; D151-L153 VanDerWaalsContact C-N 3.33Å; D151-L153 PolarHBondContact O-N 3.21Å; L153-T155 VanDerWaalsContact C-N 3.25Å; L153-T155 PolarHBondContact O-N 2.92Å; L153-V156 PolarHBondContact O-N 3.34Å; L153-S157 WeakPolarHBondContact O-CB 3.4Å; L153-S157 PolarHBondContact O-N 2.85Å; L153-S157 PolarHBondContact O-OG 3.39Å; L153-S157 VanDerWaalsContact O-OG 3.09Å
154	L	98.1	Very high	97.6	Very high	107 Å²	107	57 Å²	57	56%	0.56	27%	0.271	S	S	*	.	H	α-helix	trans	-60	-38	174.7	-68.2	174	0	0	0	111.9	A150 D151 T152 R158	A150-L154 WeakPolarHBondContact O-CG 3.48Å; A150-L154 PolarHBondContact O-N 3.25Å; D151-L154 PolarHBondContact O-N 3.2Å; T152-L154 PolarHBondContact O-N 2.99Å; L154-R158 WeakPolarHBondContact O-CG 3.46Å; L154-R158 PolarHBondContact O-N 3.35Å; L154-R158 VanDerWaalsContact O-N 3.17Å
155	T	97.9	Very high	97.5	Very high	11 Å²	11	57.5 Å²	57.5	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-70.7	-44.1	178.5	-45.8	0	0	0	0	110.9	D151 T152 L153 S157 R158 M159 D211 V212 K215	D151-T155 PolarHBondContact O-N 3.02Å; D151-T155 PolarHBondContact O-OG1 3.31Å; T152-T155 WeakPolarHBondContact O-CB 3.34Å; T152-T155 PolarHBondContact O-N 3.46Å; T152-T155 VanDerWaalsContact O-N 3.1Å; L153-T155 VanDerWaalsContact C-N 3.25Å; L153-T155 PolarHBondContact O-N 2.92Å; T155-S157 PolarHBondContact O-N 2.95Å; T155-R158 PolarHBondContact O-N 3.5Å; T155-M159 WeakPolarHBondContact O-CB 3.4Å; T155-M159 PolarHBondContact O-N 3.3Å; T155-D211 HydrophobicContact CG2-CB 4.2Å; T155-V212 HydrophobicContact CG2-CG2 3.89Å; T155-K215 HydrophobicContact CG2-CD 4.07Å; T155-K215 WeakPolarHBondContact OG1-CD 3.33Å; T155-K215 PolarHBondContact OG1-NZ 2.66Å
156	V	98.4	Very high	97.4	Very high	12 Å²	12	55.2 Å²	55.2	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-58.4	-45.2	173.7	167.8	0	0	0	0	111.5	L60 F63 T152 L153 R158 M159 E160 V212	L60-V156 HydrophobicContact CD2-CB 4.45Å; L60-V156 HydrophobicContact CD2-CG1 3.66Å; L60-V156 HydrophobicContact CD2-CG2 3.95Å; F63-V156 HydrophobicContact CD1-CG2 4.08Å; F63-V156 HydrophobicContact CE1-CB 4.49Å; F63-V156 HydrophobicContact CE1-CG2 4.05Å; T152-V156 HydrophobicContact CG2-CG2 4.42Å; T152-V156 WeakPolarHBondContact O-CG2 3.28Å; T152-V156 PolarHBondContact O-N 3.23Å; L153-V156 PolarHBondContact O-N 3.34Å; V156-R158 PolarHBondContact O-N 2.92Å; V156-M159 WeakPolarHBondContact O-CB 3.28Å; V156-M159 PolarHBondContact O-N 2.86Å; V156-E160 HydrophobicContact CG1-CG 4.45Å; V156-E160 PolarHBondContact O-N 3.28Å; V156-V212 HydrophobicContact CG2-CG1 3.81Å; V156-V212 HydrophobicContact CG2-CG2 4Å
157	S	98.1	Very high	97.3	Very high	69 Å²	69	49.1 Å²	49.1	48%	0.483	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-39.8	178	-64.9	0	0	0	0	112.8	L153 T155 K161	L153-S157 WeakPolarHBondContact O-CB 3.4Å; L153-S157 PolarHBondContact O-N 2.85Å; L153-S157 PolarHBondContact O-OG 3.39Å; L153-S157 VanDerWaalsContact O-OG 3.09Å; T155-S157 PolarHBondContact O-N 2.95Å; S157-K161 WeakPolarHBondContact O-CB 3.38Å; S157-K161 PolarHBondContact O-N 3.41Å; S157-K161 VanDerWaalsContact O-N 3.11Å
158	R	98.3	Very high	97.1	Very high	168 Å²	168	39.9 Å²	39.9	63%	0.634	21%	0.208	S	C	*	.	H	α-helix	trans	-64.5	-41.6	173.5	-71.8	170.9	-178.7	-179.2	0.5	111.5	L154 T155 V156 K161 A162 L208	L154-R158 WeakPolarHBondContact O-CG 3.46Å; L154-R158 PolarHBondContact O-N 3.35Å; L154-R158 VanDerWaalsContact O-N 3.17Å; T155-R158 PolarHBondContact O-N 3.5Å; V156-R158 PolarHBondContact O-N 2.92Å; R158-K161 PolarHBondContact O-N 3.32Å; R158-A162 PolarHBondContact O-N 3.44Å; R158-L208 HydrophobicContact CB-CD2 4.35Å
159	M	98.3	Very high	96.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-47.8	177.5	-175.1	-77.5	-70.8	0	0	111.8	L56 L60 T155 V156 K161 A162 R163 F205 L208 V212	L56-M159 HydrophobicContact CD1-CE 3.96Å; L56-M159 HydrophobicContact CD2-CE 3.96Å; L56-M159 HydrophobicContact CD2-SD 3.72Å; L56-M159 HydrophobicContact CG-CE 4.14Å; L60-M159 HydrophobicContact CD1-CE 4.01Å; L60-M159 HydrophobicContact CD2-CE 3.85Å; L60-M159 HydrophobicContact CG-CE 4.29Å; T155-M159 WeakPolarHBondContact O-CB 3.4Å; T155-M159 PolarHBondContact O-N 3.3Å; V156-M159 WeakPolarHBondContact O-CB 3.28Å; V156-M159 PolarHBondContact O-N 2.86Å; M159-K161 VanDerWaalsContact C-N 3.29Å; M159-K161 PolarHBondContact O-N 3.16Å; M159-A162 CarbonylContact O-C 3.57Å; M159-A162 WeakPolarHBondContact O-CB 3.42Å; M159-A162 PolarHBondContact O-N 3.39Å; M159-R163 WeakPolarHBondContact O-CB 3.05Å; M159-R163 PolarHBondContact O-N 3.37Å; M159-R163 HydrophobicContact SD-CB 4.42Å; M159-F205 HydrophobicContact SD-CD2 4.34Å; M159-F205 HydrophobicContact SD-CE2 3.81Å; M159-L208 HydrophobicContact CB-CB 3.89Å; M159-L208 HydrophobicContact CG-CB 3.95Å; M159-V212 HydrophobicContact CB-CG2 3.65Å; M159-V212 HydrophobicContact CE-CG1 4.31Å; M159-V212 HydrophobicContact CE-CG2 4.32Å; M159-V212 HydrophobicContact CG-CG2 3.97Å
160	E	97.4	Very high	96.7	Very high	35 Å²	35	39.9 Å²	39.9	16%	0.164	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-33.9	177.4	-74.6	-88.8	-142	0	0	112.2	K39 L60 R64 V156 R163 T164	K39-E160 IonicContact NZ-OE2 3.93Å; L60-E160 WeakPolarHBondContact CD1-OE1 3.46Å; R64-E160 IonicContact NH2-OE1 2.86Å; V156-E160 HydrophobicContact CG1-CG 4.45Å; V156-E160 PolarHBondContact O-N 3.28Å; E160-R163 IonicContact OE1-NH1 3.79Å; E160-R163 WeakPolarHBondContact OE2-CD 3.43Å; E160-R163 IonicContact OE2-NH1 3.92Å; E160-R163 PolarHBondContact OE2-NH1 3.39Å; E160-T164 WeakPolarHBondContact O-CB 3.32Å; E160-T164 PolarHBondContact O-N 2.93Å; E160-T164 PolarHBondContact O-OG1 3.45Å
161	K	95.9	Very high	96.4	Very high	79 Å²	79	40 Å²	40	34%	0.343	20%	0.199	S	C	.	.	H	α-helix	trans	-62.1	-46.9	170.2	-171.6	176.6	-179.4	179	0	110.9	S157 R158 M159 T164 E165 E407	S157-K161 WeakPolarHBondContact O-CB 3.38Å; S157-K161 PolarHBondContact O-N 3.41Å; S157-K161 VanDerWaalsContact O-N 3.11Å; R158-K161 PolarHBondContact O-N 3.32Å; M159-K161 VanDerWaalsContact C-N 3.29Å; M159-K161 PolarHBondContact O-N 3.16Å; K161-T164 PolarHBondContact O-N 2.79Å; K161-E165 WeakPolarHBondContact O-CG 3.24Å; K161-E165 PolarHBondContact O-N 3.02Å; K161-E407 IonicContact NZ-OE1 2.59Å; K161-E407 PolarHBondContact NZ-OE1 2.79Å; K161-E407 IonicContact NZ-OE2 2.74Å; K161-E407 PolarHBondContact NZ-OE2 3.14Å
162	A	96.9	Very high	96.2	Very high	6 Å²	6	37.4 Å²	37.4	5%	0.05	18%	0.183	C	C	.	.	H	α-helix	trans	-67	-40.3	178	0	0	0	0	0	113.1	R158 M159 T164 E165 Y166 F205 L208	R158-A162 PolarHBondContact O-N 3.44Å; M159-A162 CarbonylContact O-C 3.57Å; M159-A162 WeakPolarHBondContact O-CB 3.42Å; M159-A162 PolarHBondContact O-N 3.39Å; A162-T164 VanDerWaalsContact C-N 3.33Å; A162-T164 PolarHBondContact O-N 3.18Å; A162-E165 PolarHBondContact O-N 2.67Å; A162-Y166 WeakPolarHBondContact O-CB 3.42Å; A162-Y166 PolarHBondContact O-N 2.87Å; A162-F205 HydrophobicContact CB-CB 4.41Å; A162-L208 HydrophobicContact CB-CD1 3.66Å
163	R	96.4	Very high	95.9	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-56.6	-46.5	172.7	-174.5	-170.5	-113.9	178.6	-13.3	111.4	D53 D57 M159 E160 Y166 R167 F205	D53-R163 VanDerWaalsContact CG-NH2 3.29Å; D53-R163 IonicContact OD1-CZ 2.73Å; D53-R163 IonicContact OD1-NE 2.68Å; D53-R163 PolarHBondContact OD1-NE 2.85Å; D53-R163 IonicContact OD1-NH2 2.73Å; D53-R163 PolarHBondContact OD1-NH2 2.9Å; D53-R163 IonicContact OD2-NE 3.84Å; D57-R163 VanDerWaalsContact CG-NH2 3.35Å; D57-R163 IonicContact OD1-CZ 3.67Å; D57-R163 IonicContact OD1-NH1 3.63Å; D57-R163 PolarHBondContact OD1-NH1 3.46Å; D57-R163 IonicContact OD1-NH2 3.19Å; D57-R163 PolarHBondContact OD1-NH2 3.45Å; D57-R163 IonicContact OD2-NH2 2.62Å; M159-R163 WeakPolarHBondContact O-CB 3.05Å; M159-R163 PolarHBondContact O-N 3.37Å; M159-R163 HydrophobicContact SD-CB 4.42Å; E160-R163 IonicContact OE1-NH1 3.79Å; E160-R163 WeakPolarHBondContact OE2-CD 3.43Å; E160-R163 IonicContact OE2-NH1 3.92Å; E160-R163 PolarHBondContact OE2-NH1 3.39Å; R163-Y166 PolarHBondContact O-N 3.35Å; R163-R167 WeakPolarHBondContact O-CB 3.31Å; R163-R167 PolarHBondContact O-N 2.95Å; R163-F205 HydrophobicContact CB-CD2 3.67Å; R163-F205 HydrophobicContact CB-CE2 3.51Å; R163-F205 HydrophobicContact CB-CZ 4.36Å; R163-F205 HydrophobicContact CG-CD2 4.25Å; R163-F205 HydrophobicContact CG-CE2 3.67Å; R163-F205 HydrophobicContact CG-CZ 4.05Å
164	T	94.8	Very high	95.5	Very high	22 Å²	22	40.5 Å²	40.5	14%	0.135	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-39.5	178.2	-55.9	0	0	0	0	111.5	K32 Q35 V36 E160 K161 A162 G168	K32-T164 HydrophobicContact CG-CG2 4.42Å; Q35-T164 HydrophobicContact CG-CG2 4.43Å; V36-T164 HydrophobicContact CG2-CG2 3.62Å; E160-T164 WeakPolarHBondContact O-CB 3.32Å; E160-T164 PolarHBondContact O-N 2.93Å; E160-T164 PolarHBondContact O-OG1 3.45Å; K161-T164 PolarHBondContact O-N 2.79Å; A162-T164 VanDerWaalsContact C-N 3.33Å; A162-T164 PolarHBondContact O-N 3.18Å; T164-G168 PolarHBondContact O-N 3Å
165	E	94.9	Very high	95.2	Very high	29 Å²	29	37.7 Å²	37.7	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-66.5	-40.9	174.6	-75.7	-174.7	-148.8	0	0	112.8	K28 K32 K161 A162 G168 A169 T201	K28-E165 WeakPolarHBondContact CE-OE2 3.35Å; K28-E165 IonicContact NZ-OE2 3.4Å; K28-E165 PolarHBondContact NZ-OE2 2.78Å; K32-E165 HydrophobicContact CD-CG 3.67Å; K32-E165 WeakPolarHBondContact CE-OE1 3.45Å; K32-E165 HydrophobicContact CG-CG 4.06Å; K32-E165 IonicContact NZ-OE1 3.19Å; K32-E165 PolarHBondContact NZ-OE1 3.14Å; K161-E165 WeakPolarHBondContact O-CG 3.24Å; K161-E165 PolarHBondContact O-N 3.02Å; A162-E165 PolarHBondContact O-N 2.67Å; E165-G168 PolarHBondContact O-N 3.5Å; E165-A169 WeakPolarHBondContact O-CB 3.44Å; E165-A169 PolarHBondContact O-N 3.17Å; E165-T201 HydrophobicContact CB-CG2 4.47Å
166	Y	96.5	Very high	94.7	Very high	34 Å²	34	37.3 Å²	37.3	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-64.6	-47.1	175	173.5	-127.6	0	0	0	111.9	A162 R163 G168 A169 L170 V198 K202 F205	A162-Y166 WeakPolarHBondContact O-CB 3.42Å; A162-Y166 PolarHBondContact O-N 2.87Å; R163-Y166 PolarHBondContact O-N 3.35Å; Y166-G168 PolarHBondContact O-N 2.95Å; Y166-A169 PolarHBondContact O-N 3Å; Y166-A169 VanDerWaalsContact O-N 3.17Å; Y166-L170 HydrophobicContact CD1-CD1 4.38Å; Y166-L170 HydrophobicContact CD2-CD1 4.48Å; Y166-L170 HydrophobicContact CD2-CG 4.22Å; Y166-L170 HydrophobicContact CE1-CD1 3.85Å; Y166-L170 HydrophobicContact CE2-CD1 3.96Å; Y166-L170 HydrophobicContact CE2-CD2 3.93Å; Y166-L170 HydrophobicContact CE2-CG 3.77Å; Y166-L170 WeakPolarHBondContact O-CG 3.44Å; Y166-L170 PolarHBondContact O-N 3.37Å; Y166-V198 HydrophobicContact CE2-CG1 4.05Å; Y166-K202 HydrophobicContact CD2-CB 3.81Å; Y166-K202 HydrophobicContact CD2-CG 4.42Å; Y166-K202 HydrophobicContact CE1-CG 4.34Å; Y166-K202 HydrophobicContact CE2-CB 3.47Å; Y166-K202 VanDerWaalsContact CE2-CB 3.47Å; Y166-K202 HydrophobicContact CE2-CD 4.2Å; Y166-K202 HydrophobicContact CE2-CG 3.79Å; Y166-F205 AromaticContact CD1-CD1 3.68Å; Y166-F205 HydrophobicContact CD1-CD1 3.68Å; Y166-F205 HydrophobicContact CD1-CE1 4.21Å; Y166-F205 HydrophobicContact CD1-CG 4.29Å; Y166-F205 HydrophobicContact CE1-CD1 4.16Å; Y166-F205 HydrophobicContact CE1-CE1 4.49Å; Y166-F205 HydrophobicContact CG-CD1 4.45Å
167	R	94.9	Very high	94.1	Very high	26 Å²	26	39.5 Å²	39.5	10%	0.098	19%	0.194	C	C	.	.	H	α-helix	trans	-58.1	-44	173	-83.1	-178.5	139.2	105.8	1.5	112.4	Q35 E45 V49 D53 R163 A169 L170 L171	Q35-R167 HydrophobicContact CG-CB 3.7Å; E45-R167 IonicContact OE2-CZ 2.67Å; E45-R167 IonicContact OE2-NE 3.09Å; E45-R167 PolarHBondContact OE2-NE 3.41Å; E45-R167 IonicContact OE2-NH2 3.87Å; E45-R167 PolarHBondContact OE2-NH2 3.41Å; V49-R167 HydrophobicContact CG1-CG 4.01Å; D53-R167 IonicContact OD2-CZ 3.59Å; D53-R167 IonicContact OD2-NH1 3.4Å; D53-R167 PolarHBondContact OD2-NH1 3.05Å; D53-R167 IonicContact OD2-NH2 2.89Å; R163-R167 WeakPolarHBondContact O-CB 3.31Å; R163-R167 PolarHBondContact O-N 2.95Å; R167-A169 VanDerWaalsContact C-N 3.33Å; R167-A169 PolarHBondContact O-N 3.37Å; R167-L170 PolarHBondContact O-N 2.89Å; R167-L171 WeakPolarHBondContact O-CB 3.44Å; R167-L171 PolarHBondContact O-N 2.73Å
168	G	93.5	Very high	93.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-40.7	174.7	0	0	0	0	0	112.7	T164 E165 Y166 L171 W172	T164-G168 PolarHBondContact O-N 3Å; E165-G168 PolarHBondContact O-N 3.5Å; Y166-G168 PolarHBondContact O-N 2.95Å; G168-L171 PolarHBondContact O-N 2.83Å; G168-W172 PolarHBondContact O-N 2.75Å
169	A	94.1	Very high	92.5	Very high	7 Å²	7	40.7 Å²	40.7	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-67.4	-38.6	174.9	0	0	0	0	0	112.7	E165 Y166 R167 W172 M173 Q197 V198	E165-A169 WeakPolarHBondContact O-CB 3.44Å; E165-A169 PolarHBondContact O-N 3.17Å; Y166-A169 PolarHBondContact O-N 3Å; Y166-A169 VanDerWaalsContact O-N 3.17Å; R167-A169 VanDerWaalsContact C-N 3.33Å; R167-A169 PolarHBondContact O-N 3.37Å; A169-W172 PolarHBondContact O-N 2.92Å; A169-M173 WeakPolarHBondContact O-CB 3.43Å; A169-M173 PolarHBondContact O-N 2.97Å; A169-Q197 HydrophobicContact CB-CG 4.49Å; A169-V198 HydrophobicContact CB-CG2 3.78Å; A169-V198 VanDerWaalsContact O-CG2 3.3Å; A169-V198 WeakPolarHBondContact O-CG2 3.47Å
170	L	93.6	Very high	91.5	Very high	34 Å²	34	43.1 Å²	43.1	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-43.5	172.5	-73.2	176.4	0	0	0	111.8	V49 Y166 R167 W172 M173 K174 V198	V49-L170 HydrophobicContact CG1-CD1 4.19Å; V49-L170 HydrophobicContact CG2-CD1 4.12Å; Y166-L170 HydrophobicContact CD1-CD1 4.38Å; Y166-L170 HydrophobicContact CD2-CD1 4.48Å; Y166-L170 HydrophobicContact CD2-CG 4.22Å; Y166-L170 HydrophobicContact CE1-CD1 3.85Å; Y166-L170 HydrophobicContact CE2-CD1 3.96Å; Y166-L170 HydrophobicContact CE2-CD2 3.93Å; Y166-L170 HydrophobicContact CE2-CG 3.77Å; Y166-L170 WeakPolarHBondContact O-CG 3.44Å; Y166-L170 PolarHBondContact O-N 3.37Å; R167-L170 PolarHBondContact O-N 2.89Å; L170-W172 VanDerWaalsContact C-N 3.32Å; L170-W172 PolarHBondContact O-N 3.4Å; L170-M173 HydrophobicContact CD2-CE 4.03Å; L170-M173 PolarHBondContact O-N 3.09Å; L170-K174 WeakPolarHBondContact O-CB 3.45Å; L170-K174 PolarHBondContact O-N 3.31Å; L170-V198 HydrophobicContact CD2-CG1 3.8Å
171	L	92	Very high	90.4	Very high	42 Å²	42	44.9 Å²	44.9	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-40.5	176.8	-174.4	66.8	0	0	0	111.3	W31 K34 I38 R167 G168 K174 D175	W31-L171 HydrophobicContact CE3-CB 4.33Å; W31-L171 HydrophobicContact CE3-CD2 3.93Å; W31-L171 HydrophobicContact CE3-CG 3.91Å; W31-L171 HydrophobicContact CZ3-CD2 4Å; W31-L171 HydrophobicContact CZ3-CG 3.79Å; K34-L171 HydrophobicContact CD-CD2 4.21Å; K34-L171 HydrophobicContact CG-CD2 4.09Å; I38-L171 HydrophobicContact CD1-CD2 3.59Å; R167-L171 WeakPolarHBondContact O-CB 3.44Å; R167-L171 PolarHBondContact O-N 2.73Å; G168-L171 PolarHBondContact O-N 2.83Å; L171-K174 PolarHBondContact O-N 2.89Å; L171-D175 WeakPolarHBondContact O-CB 3.45Å; L171-D175 PolarHBondContact O-N 3.03Å; L171-D175 VanDerWaalsContact O-N 3.08Å
172	W	92.9	Very high	89.2	Confident	22 Å²	22	45.9 Å²	45.9	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-41.7	173.1	-171.5	12.6	0	0	0	112.4	Q27 W31 G168 A169 L170 K174 D175 V176 V194	Q27-W172 HydrophobicContact CB-CH2 3.75Å; Q27-W172 HydrophobicContact CB-CZ2 3.77Å; Q27-W172 HydrophobicContact CB-CZ3 4.43Å; Q27-W172 HydrophobicContact CG-CZ2 4.34Å; Q27-W172 VanDerWaalsContact OE1-CZ2 3.3Å; W31-W172 HydrophobicContact CB-CB 4.2Å; W31-W172 AromaticContact CD1-CD1 3.64Å; W31-W172 AromaticContact CD1-CD2 3.4Å; W31-W172 VanDerWaalsContact CD1-CD2 3.4Å; W31-W172 AromaticContact CD1-CE2 3.84Å; W31-W172 AromaticContact CD1-CE3 3.9Å; W31-W172 AromaticContact CD1-CG 3.3Å; W31-W172 AromaticContact CD1-NE1 3.94Å; W31-W172 HydrophobicContact CD2-CB 3.69Å; W31-W172 AromaticContact CD2-CG 3.97Å; W31-W172 HydrophobicContact CD2-CG 3.97Å; W31-W172 AromaticContact CE2-CD1 3.47Å; W31-W172 VanDerWaalsContact CE2-CD1 3.47Å; W31-W172 AromaticContact CE2-CG 3.72Å; W31-W172 HydrophobicContact CE3-CB 4.25Å; W31-W172 HydrophobicContact CG-CB 3.61Å; W31-W172 HydrophobicContact CG-CD2 4.19Å; W31-W172 AromaticContact CG-CG 3.78Å; W31-W172 HydrophobicContact CG-CG 3.78Å; W31-W172 AromaticContact CZ2-CD1 3.9Å; W31-W172 HydrophobicContact CZ2-CG 4.49Å; W31-W172 AromaticContact NE1-CD1 3.09Å; W31-W172 AromaticContact NE1-CD2 3.66Å; W31-W172 AromaticContact NE1-CE2 3.73Å; W31-W172 AromaticContact NE1-CG 3.28Å; W31-W172 VanDerWaalsContact NE1-CG 3.28Å; W31-W172 AromaticContact NE1-NE1 3.38Å; G168-W172 PolarHBondContact O-N 2.75Å; A169-W172 PolarHBondContact O-N 2.92Å; L170-W172 VanDerWaalsContact C-N 3.32Å; L170-W172 PolarHBondContact O-N 3.4Å; W172-K174 VanDerWaalsContact C-N 3.33Å; W172-K174 PolarHBondContact O-N 3.45Å; W172-D175 PolarHBondContact O-N 3.11Å; W172-V176 WeakPolarHBondContact O-CG2 3.43Å; W172-V176 PolarHBondContact O-N 3.03Å; W172-V194 HydrophobicContact CB-CG1 4.2Å; W172-V194 HydrophobicContact CD2-CB 4.5Å; W172-V194 HydrophobicContact CD2-CG1 3.94Å; W172-V194 HydrophobicContact CD2-CG2 3.71Å; W172-V194 VanDerWaalsContact CE2-CG2 3.41Å; W172-V194 HydrophobicContact CE3-CG1 4.24Å; W172-V194 HydrophobicContact CE3-CG2 4.16Å; W172-V194 HydrophobicContact CG-CG1 3.91Å; W172-V194 HydrophobicContact CG-CG2 4.21Å; W172-V194 HydrophobicContact CH2-CG2 4.1Å; W172-V194 HydrophobicContact CZ2-CG2 3.63Å; W172-V194 HydrophobicContact CZ3-CG2 4.35Å
173	M	92.6	Very high	88.1	Confident	51 Å²	51	52.8 Å²	52.8	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-39	177.1	-169.5	177.5	69.3	0	0	111.7	A169 L170 S177 F191 V194 V198	A169-M173 WeakPolarHBondContact O-CB 3.43Å; A169-M173 PolarHBondContact O-N 2.97Å; L170-M173 HydrophobicContact CD2-CE 4.03Å; L170-M173 PolarHBondContact O-N 3.09Å; M173-S177 VanDerWaalsContact O-CB 3.24Å; M173-S177 WeakPolarHBondContact O-CB 3.5Å; M173-S177 PolarHBondContact O-N 2.73Å; M173-S177 PolarHBondContact O-OG 3.33Å; M173-F191 HydrophobicContact CG-CE2 3.98Å; M173-V194 HydrophobicContact CB-CG1 3.84Å; M173-V194 HydrophobicContact CG-CG1 4.4Å; M173-V198 HydrophobicContact CB-CG2 3.9Å; M173-V198 HydrophobicContact CE-CG1 4.37Å; M173-V198 HydrophobicContact CG-CG2 4.42Å; M173-V198 HydrophobicContact SD-CB 4.23Å; M173-V198 HydrophobicContact SD-CG1 4.22Å; M173-V198 HydrophobicContact SD-CG2 3.92Å
174	K	90.9	Very high	87.4	Confident	91 Å²	91	55.1 Å²	55.1	40%	0.396	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-50.9	175.1	-172.2	171.8	-172.7	168.1	0	111.2	D46 L170 L171 W172 S177 Q178	D46-K174 IonicContact OD2-NZ 2.68Å; D46-K174 PolarHBondContact OD2-NZ 2.85Å; L170-K174 WeakPolarHBondContact O-CB 3.45Å; L170-K174 PolarHBondContact O-N 3.31Å; L171-K174 PolarHBondContact O-N 2.89Å; W172-K174 VanDerWaalsContact C-N 3.33Å; W172-K174 PolarHBondContact O-N 3.45Å; K174-S177 PolarHBondContact O-N 3.16Å; K174-S177 PolarHBondContact O-OG 3.09Å; K174-Q178 WeakPolarHBondContact O-CG 3.29Å; K174-Q178 PolarHBondContact O-N 3.17Å; K174-Q178 VanDerWaalsContact O-N 3.17Å
175	D	90.1	Very high	86.6	Confident	48 Å²	48	61.8 Å²	61.8	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-55.2	-54.6	175.9	-174.8	88.8	0	0	0	111.8	W31 L171 W172 S177 Q178 E179	W31-D175 HydrophobicContact CH2-CB 3.54Å; W31-D175 WeakPolarHBondContact CH2-OD1 3.5Å; W31-D175 WeakPolarHBondContact CH2-OD2 3.24Å; W31-D175 HydrophobicContact CZ2-CB 4Å; W31-D175 VanDerWaalsContact CZ2-OD2 3.31Å; W31-D175 WeakPolarHBondContact CZ2-OD2 3.46Å; W31-D175 HydrophobicContact CZ3-CB 4.24Å; L171-D175 WeakPolarHBondContact O-CB 3.45Å; L171-D175 PolarHBondContact O-N 3.03Å; L171-D175 VanDerWaalsContact O-N 3.08Å; W172-D175 PolarHBondContact O-N 3.11Å; D175-S177 VanDerWaalsContact C-N 3.28Å; D175-S177 PolarHBondContact O-N 3.45Å; D175-Q178 PolarHBondContact O-N 3.4Å; D175-Q178 VanDerWaalsContact O-N 3.13Å; D175-E179 PolarHBondContact O-N 3.48Å
176	V	88.2	Confident	85.9	Confident	4 Å²	4	69 Å²	69	2%	0.024	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-27.8	179.6	179.6	0	0	0	0	112.9	W172 L180 K190 F191 V194	W172-V176 WeakPolarHBondContact O-CG2 3.43Å; W172-V176 PolarHBondContact O-N 3.03Å; V176-L180 PolarHBondContact O-N 3.32Å; V176-K190 HydrophobicContact CG1-CD 4.05Å; V176-K190 HydrophobicContact CG1-CG 4.13Å; V176-K190 HydrophobicContact CG2-CD 4.32Å; V176-F191 HydrophobicContact CG1-CB 4.1Å; V176-F191 HydrophobicContact CG1-CD2 4.2Å; V176-V194 HydrophobicContact CG2-CG2 4.37Å
177	S	86.6	Confident	85.1	Confident	58 Å²	58	70.4 Å²	70.4	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-73.5	-26.1	175.8	72.8	0	0	0	0	113.9	M173 K174 D175	M173-S177 VanDerWaalsContact O-CB 3.24Å; M173-S177 WeakPolarHBondContact O-CB 3.5Å; M173-S177 PolarHBondContact O-N 2.73Å; M173-S177 PolarHBondContact O-OG 3.33Å; K174-S177 PolarHBondContact O-N 3.16Å; K174-S177 PolarHBondContact O-OG 3.09Å; D175-S177 VanDerWaalsContact C-N 3.28Å; D175-S177 PolarHBondContact O-N 3.45Å
178	Q	84.7	Confident	84.5	Confident	150 Å²	150	71.6 Å²	71.6	70%	0.701	36%	0.358	S	S	*	.	H	α-helix	trans	-78.4	-26.9	177.9	-71.7	176.1	-11.9	0	0	112.2	K174 D175	K174-Q178 WeakPolarHBondContact O-CG 3.29Å; K174-Q178 PolarHBondContact O-N 3.17Å; K174-Q178 VanDerWaalsContact O-N 3.17Å; D175-Q178 PolarHBondContact O-N 3.4Å; D175-Q178 VanDerWaalsContact O-N 3.13Å
179	E	76.4	Confident	84.1	Confident	112 Å²	112	74.3 Å²	74.3	52%	0.523	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	5.2	177.1	-58	-175.6	150.9	0	0	113.8	D175 D181 Q187 K190	D175-E179 PolarHBondContact O-N 3.48Å; E179-D181 PolarHBondContact O-N 3.06Å; E179-Q187 PolarHBondContact O-NE2 3.49Å; E179-Q187 PolarHBondContact O-OE1 2.94Å; E179-K190 IonicContact OE2-NZ 3.82Å
180	L	77.2	Confident	83.7	Confident	51 Å²	51	77.8 Å²	77.8	27%	0.267	38%	0.384	S	S	.	.			trans	-83.5	107.5	-168.7	-175.6	64	0	0	0	112.6	V176 Q187 F191	V176-L180 PolarHBondContact O-N 3.32Å; L180-Q187 HydrophobicContact CD1-CB 3.86Å; L180-F191 HydrophobicContact CD1-CB 4.24Å; L180-F191 HydrophobicContact CD2-CB 4.44Å; L180-F191 HydrophobicContact CD2-CD1 4.34Å; L180-F191 HydrophobicContact CD2-CD2 4.34Å; L180-F191 HydrophobicContact CD2-CG 4.11Å
181	D	74.3	Confident	83.4	Confident	72 Å²	72	78.2 Å²	78.2	39%	0.385	39%	0.385	S	S	.	.			trans	-88.9	116.9	164.2	177.3	7.7	0	0	0	109.9	E179 D183 T184	E179-D181 PolarHBondContact O-N 3.06Å; D181-D183 PolarHBondContact O-N 3.14Å; D181-D183 PolarHBondContact OD1-N 2.99Å; D181-D183 VanDerWaalsContact OD1-N 3.16Å; D181-T184 PolarHBondContact O-N 2.88Å; D181-T184 VanDerWaalsContact O-N 3.08Å; D181-T184 PolarHBondContact OD2-OG1 3.36Å; D181-T184 VanDerWaalsContact OD2-OG1 3.09Å
182	P	72.6	Confident	83.3	Confident	99 Å²	99	81.5 Å²	81.5	64%	0.643	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.7	-179.6	-25.8	35.5	0	0	0	114.6	T184	P182-T184 VanDerWaalsContact C-N 3.28Å; P182-T184 PolarHBondContact O-N 3.4Å
183	D	73	Confident	83.1	Confident	152 Å²	152	87.1 Å²	87.1	81%	0.813	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.7	-177.9	-67	-26.6	0	0	0	111.9	D181 Y185	D181-D183 PolarHBondContact O-N 3.14Å; D181-D183 PolarHBondContact OD1-N 2.99Å; D181-D183 VanDerWaalsContact OD1-N 3.16Å; D183-Y185 PolarHBondContact O-N 3Å
184	T	81.7	Confident	83	Confident	52 Å²	52	84.8 Å²	84.8	32%	0.319	41%	0.408	S	S	.	.			trans	-90.7	87	178	-63.6	0	0	0	0	111.4	D181 P182 K186 Q187 L188	D181-T184 PolarHBondContact O-N 2.88Å; D181-T184 VanDerWaalsContact O-N 3.08Å; D181-T184 PolarHBondContact OD2-OG1 3.36Å; D181-T184 VanDerWaalsContact OD2-OG1 3.09Å; P182-T184 VanDerWaalsContact C-N 3.28Å; P182-T184 PolarHBondContact O-N 3.4Å; T184-K186 PolarHBondContact O-N 3.3Å; T184-Q187 HydrophobicContact CG2-CB 4.15Å; T184-Q187 HydrophobicContact CG2-CG 3.71Å; T184-Q187 WeakPolarHBondContact O-CB 3.5Å; T184-Q187 PolarHBondContact O-N 3.49Å; T184-L188 PolarHBondContact O-N 3.5Å
185	Y	77.3	Confident	83.1	Confident	162 Å²	162	83.6 Å²	83.6	64%	0.635	40%	0.404	S	S	*	.	H	α-helix	trans	-45.2	-37.2	-179.9	-174.8	-92.4	0	0	0	114.9	D183 L188 E189	D183-Y185 PolarHBondContact O-N 3Å; Y185-L188 PolarHBondContact O-N 3.26Å; Y185-E189 PolarHBondContact O-N 2.85Å
186	K	79.9	Confident	83.2	Confident	182 Å²	182	85.1 Å²	85.1	79%	0.791	42%	0.418	S	S	*	.	H	α-helix	trans	-66.4	-34.9	178.4	-68.4	-178.4	180	176.3	0	113.3	T184 K190	T184-K186 PolarHBondContact O-N 3.3Å; K186-K190 PolarHBondContact O-N 2.89Å; K186-K190 VanDerWaalsContact O-N 3.11Å
187	Q	79.7	Confident	83.4	Confident	63 Å²	63	88.1 Å²	88.1	29%	0.294	43%	0.432	S	S	.	.	H	α-helix	trans	-74.5	-39.8	176.1	-71.2	178	-15.8	0	0	110.8	E179 L180 T184 E189 K190 F191	E179-Q187 PolarHBondContact O-NE2 3.49Å; E179-Q187 PolarHBondContact O-OE1 2.94Å; L180-Q187 HydrophobicContact CD1-CB 3.86Å; T184-Q187 HydrophobicContact CG2-CB 4.15Å; T184-Q187 HydrophobicContact CG2-CG 3.71Å; T184-Q187 WeakPolarHBondContact O-CB 3.5Å; T184-Q187 PolarHBondContact O-N 3.49Å; Q187-E189 VanDerWaalsContact C-N 3.27Å; Q187-E189 PolarHBondContact O-N 3.46Å; Q187-K190 WeakPolarHBondContact O-CB 3.43Å; Q187-K190 PolarHBondContact O-N 3.38Å; Q187-F191 WeakPolarHBondContact O-CB 3.15Å; Q187-F191 PolarHBondContact O-N 2.98Å
188	L	83.7	Confident	83.8	Confident	50 Å²	50	86 Å²	86	26%	0.262	42%	0.416	S	S	.	.	H	α-helix	trans	-59.2	-39.6	173.9	-170.8	65.7	0	0	0	111.8	T184 Y185 F191 R192	T184-L188 PolarHBondContact O-N 3.5Å; Y185-L188 PolarHBondContact O-N 3.26Å; L188-F191 PolarHBondContact O-N 3.42Å; L188-R192 WeakPolarHBondContact O-CG 3.4Å; L188-R192 PolarHBondContact O-N 3.46Å
189	E	85	Confident	84.4	Confident	58 Å²	58	86.9 Å²	86.9	27%	0.271	41%	0.413	S	S	.	.	H	α-helix	trans	-70.4	-38.1	175.7	-171.1	54.3	-151	0	0	112.8	Y185 Q187 F191 R192 K193	Y185-E189 PolarHBondContact O-N 2.85Å; Q187-E189 VanDerWaalsContact C-N 3.27Å; Q187-E189 PolarHBondContact O-N 3.46Å; E189-F191 VanDerWaalsContact C-N 3.33Å; E189-F191 PolarHBondContact O-N 3.02Å; E189-R192 PolarHBondContact O-N 2.94Å; E189-R192 IonicContact OE2-NH1 3.2Å; E189-R192 PolarHBondContact OE2-NH1 3.49Å; E189-K193 WeakPolarHBondContact O-CG 3.28Å; E189-K193 PolarHBondContact O-N 3.37Å; E189-K193 VanDerWaalsContact O-N 3.15Å; E189-K193 VanDerWaalsContact OE1-CE 3.29Å; E189-K193 WeakPolarHBondContact OE1-CE 3.41Å
190	K	84.4	Confident	85.4	Confident	81 Å²	81	83.6 Å²	83.6	35%	0.352	41%	0.41	S	S	.	.	H	α-helix	trans	-58.2	-45.6	169	-178.2	-169.2	175.1	-162.5	0	110.5	V176 E179 K186 Q187 K193 V194	V176-K190 HydrophobicContact CG1-CD 4.05Å; V176-K190 HydrophobicContact CG1-CG 4.13Å; V176-K190 HydrophobicContact CG2-CD 4.32Å; E179-K190 IonicContact OE2-NZ 3.82Å; K186-K190 PolarHBondContact O-N 2.89Å; K186-K190 VanDerWaalsContact O-N 3.11Å; Q187-K190 WeakPolarHBondContact O-CB 3.43Å; Q187-K190 PolarHBondContact O-N 3.38Å; K190-K193 PolarHBondContact O-N 3.13Å; K190-V194 WeakPolarHBondContact O-CG2 3.46Å; K190-V194 PolarHBondContact O-N 3.48Å; K190-V194 VanDerWaalsContact O-N 3.09Å
191	F	88.2	Confident	86.3	Confident	42 Å²	42	81.4 Å²	81.4	18%	0.184	40%	0.398	C	S	.	.	H	α-helix	trans	-62.5	-46.1	178.9	-178.6	-100.6	0	0	0	112.3	M173 V176 L180 Q187 L188 E189 K193 V194 Q195	M173-F191 HydrophobicContact CG-CE2 3.98Å; V176-F191 HydrophobicContact CG1-CB 4.1Å; V176-F191 HydrophobicContact CG1-CD2 4.2Å; L180-F191 HydrophobicContact CD1-CB 4.24Å; L180-F191 HydrophobicContact CD2-CB 4.44Å; L180-F191 HydrophobicContact CD2-CD1 4.34Å; L180-F191 HydrophobicContact CD2-CD2 4.34Å; L180-F191 HydrophobicContact CD2-CG 4.11Å; Q187-F191 WeakPolarHBondContact O-CB 3.15Å; Q187-F191 PolarHBondContact O-N 2.98Å; L188-F191 PolarHBondContact O-N 3.42Å; E189-F191 VanDerWaalsContact C-N 3.33Å; E189-F191 PolarHBondContact O-N 3.02Å; F191-K193 VanDerWaalsContact C-N 3.32Å; F191-K193 PolarHBondContact O-N 3.23Å; F191-V194 PolarHBondContact O-N 3.44Å; F191-Q195 WeakPolarHBondContact O-CB 3.46Å; F191-Q195 PolarHBondContact O-N 2.95Å
192	R	89.3	Confident	87.3	Confident	112 Å²	112	82.6 Å²	82.6	42%	0.423	40%	0.4	S	S	.	.	H	α-helix	trans	-57.1	-41.8	174.8	-74.8	175.2	-177.2	150	-0.5	112.8	L188 E189 Q195 S196	L188-R192 WeakPolarHBondContact O-CG 3.4Å; L188-R192 PolarHBondContact O-N 3.46Å; E189-R192 PolarHBondContact O-N 2.94Å; E189-R192 IonicContact OE2-NH1 3.2Å; E189-R192 PolarHBondContact OE2-NH1 3.49Å; R192-Q195 PolarHBondContact O-N 3.4Å; R192-S196 PolarHBondContact O-N 3Å
193	K	88.6	Confident	88.5	Confident	139 Å²	139	82 Å²	82	60%	0.604	40%	0.398	S	S	*	.	H	α-helix	trans	-64	-44.7	177.2	-71.3	177	-178.8	-174.5	0	112	E189 K190 F191 S196 Q197	E189-K193 WeakPolarHBondContact O-CG 3.28Å; E189-K193 PolarHBondContact O-N 3.37Å; E189-K193 VanDerWaalsContact O-N 3.15Å; E189-K193 VanDerWaalsContact OE1-CE 3.29Å; E189-K193 WeakPolarHBondContact OE1-CE 3.41Å; K190-K193 PolarHBondContact O-N 3.13Å; F191-K193 VanDerWaalsContact C-N 3.32Å; F191-K193 PolarHBondContact O-N 3.23Å; K193-S196 WeakPolarHBondContact O-CB 3.32Å; K193-S196 PolarHBondContact O-N 3.24Å; K193-Q197 PolarHBondContact O-N 3.23Å
194	V	91.2	Very high	89.7	Confident	2 Å²	2	79.7 Å²	79.7	1%	0.012	38%	0.383	C	S	.	.	H	α-helix	trans	-65.8	-39.7	175.3	179.5	0	0	0	0	111.5	W172 M173 V176 K190 F191 S196 Q197 V198	W172-V194 HydrophobicContact CB-CG1 4.2Å; W172-V194 HydrophobicContact CD2-CB 4.5Å; W172-V194 HydrophobicContact CD2-CG1 3.94Å; W172-V194 HydrophobicContact CD2-CG2 3.71Å; W172-V194 VanDerWaalsContact CE2-CG2 3.41Å; W172-V194 HydrophobicContact CE3-CG1 4.24Å; W172-V194 HydrophobicContact CE3-CG2 4.16Å; W172-V194 HydrophobicContact CG-CG1 3.91Å; W172-V194 HydrophobicContact CG-CG2 4.21Å; W172-V194 HydrophobicContact CH2-CG2 4.1Å; W172-V194 HydrophobicContact CZ2-CG2 3.63Å; W172-V194 HydrophobicContact CZ3-CG2 4.35Å; M173-V194 HydrophobicContact CB-CG1 3.84Å; M173-V194 HydrophobicContact CG-CG1 4.4Å; V176-V194 HydrophobicContact CG2-CG2 4.37Å; K190-V194 WeakPolarHBondContact O-CG2 3.46Å; K190-V194 PolarHBondContact O-N 3.48Å; K190-V194 VanDerWaalsContact O-N 3.09Å; F191-V194 PolarHBondContact O-N 3.44Å; V194-S196 VanDerWaalsContact C-N 3.32Å; V194-S196 PolarHBondContact O-N 3.49Å; V194-Q197 WeakPolarHBondContact O-CB 3.47Å; V194-Q197 PolarHBondContact O-N 3.03Å; V194-Q197 VanDerWaalsContact O-N 3.16Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.43Å
195	Q	92.7	Very high	90.5	Very high	66 Å²	66	77.5 Å²	77.5	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-39.5	175.2	-167.2	-171.3	14.9	0	0	111.9	F191 R192 V198 R199	F191-Q195 WeakPolarHBondContact O-CB 3.46Å; F191-Q195 PolarHBondContact O-N 2.95Å; R192-Q195 PolarHBondContact O-N 3.4Å; Q195-V198 PolarHBondContact O-N 3.26Å; Q195-R199 WeakPolarHBondContact O-CG 3.36Å; Q195-R199 PolarHBondContact O-N 3.09Å
196	S	92.6	Very high	91.5	Very high	80 Å²	80	72.3 Å²	72.3	56%	0.559	35%	0.35	S	S	*	.	H	α-helix	trans	-62.2	-45.7	172.8	-168	0	0	0	0	111.6	R192 K193 V194 V198 R199 G200	R192-S196 PolarHBondContact O-N 3Å; K193-S196 WeakPolarHBondContact O-CB 3.32Å; K193-S196 PolarHBondContact O-N 3.24Å; V194-S196 VanDerWaalsContact C-N 3.32Å; V194-S196 PolarHBondContact O-N 3.49Å; S196-V198 VanDerWaalsContact C-N 3.32Å; S196-V198 PolarHBondContact O-N 3Å; S196-R199 PolarHBondContact O-N 3.47Å; S196-R199 VanDerWaalsContact O-N 3.15Å; S196-G200 PolarHBondContact O-N 3.4Å
197	Q	92.3	Very high	92.3	Very high	67 Å²	67	70.4 Å²	70.4	31%	0.313	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-39.4	176.1	-171.8	63.1	42.5	0	0	112.7	A169 K193 V194 T201	A169-Q197 HydrophobicContact CB-CG 4.49Å; K193-Q197 PolarHBondContact O-N 3.23Å; V194-Q197 WeakPolarHBondContact O-CB 3.47Å; V194-Q197 PolarHBondContact O-N 3.03Å; V194-Q197 VanDerWaalsContact O-N 3.16Å; Q197-T201 WeakPolarHBondContact O-CB 3.48Å; Q197-T201 WeakPolarHBondContact O-CG2 3.39Å; Q197-T201 PolarHBondContact O-N 3.02Å; Q197-T201 PolarHBondContact O-OG1 2.9Å
198	V	95.9	Very high	93.2	Very high	13 Å²	13	68.8 Å²	68.8	8%	0.079	34%	0.335	C	S	.	.	H	α-helix	trans	-64.4	-44.5	174.3	170.2	0	0	0	0	111.4	Y166 A169 L170 M173 V194 Q195 S196 T201 K202	Y166-V198 HydrophobicContact CE2-CG1 4.05Å; A169-V198 HydrophobicContact CB-CG2 3.78Å; A169-V198 VanDerWaalsContact O-CG2 3.3Å; A169-V198 WeakPolarHBondContact O-CG2 3.47Å; L170-V198 HydrophobicContact CD2-CG1 3.8Å; M173-V198 HydrophobicContact CB-CG2 3.9Å; M173-V198 HydrophobicContact CE-CG1 4.37Å; M173-V198 HydrophobicContact CG-CG2 4.42Å; M173-V198 HydrophobicContact SD-CB 4.23Å; M173-V198 HydrophobicContact SD-CG1 4.22Å; M173-V198 HydrophobicContact SD-CG2 3.92Å; V194-V198 WeakPolarHBondContact O-CG2 3.45Å; V194-V198 PolarHBondContact O-N 3.43Å; Q195-V198 PolarHBondContact O-N 3.26Å; S196-V198 VanDerWaalsContact C-N 3.32Å; S196-V198 PolarHBondContact O-N 3Å; V198-T201 PolarHBondContact O-OG1 3.46Å; V198-K202 VanDerWaalsContact O-CB 3.26Å; V198-K202 WeakPolarHBondContact O-CB 3.43Å; V198-K202 PolarHBondContact O-N 3.46Å
199	R	96.8	Very high	93.9	Very high	169 Å²	169	68.4 Å²	68.4	64%	0.638	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-44.8	177	-70.1	177	-171.9	-132.4	4.8	111.8	Q195 S196 S203	Q195-R199 WeakPolarHBondContact O-CG 3.36Å; Q195-R199 PolarHBondContact O-N 3.09Å; S196-R199 PolarHBondContact O-N 3.47Å; S196-R199 VanDerWaalsContact O-N 3.15Å; R199-S203 PolarHBondContact O-N 3.48Å
200	G	96.2	Very high	94.5	Very high	44 Å²	44	69.7 Å²	69.7	45%	0.454	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-50.3	178	0	0	0	0	0	112.8	S196 K202 S203 Q204	S196-G200 PolarHBondContact O-N 3.4Å; G200-K202 PolarHBondContact O-N 3.23Å; G200-S203 PolarHBondContact O-N 3.48Å; G200-Q204 PolarHBondContact O-N 2.97Å; G200-Q204 VanDerWaalsContact O-N 3.1Å
201	T	96.3	Very high	95.1	Very high	4 Å²	4	68.5 Å²	68.5	3%	0.025	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-36.5	178.4	49.9	0	0	0	0	112.8	E165 Q197 V198 Q204 F205	E165-T201 HydrophobicContact CB-CG2 4.47Å; Q197-T201 WeakPolarHBondContact O-CB 3.48Å; Q197-T201 WeakPolarHBondContact O-CG2 3.39Å; Q197-T201 PolarHBondContact O-N 3.02Å; Q197-T201 PolarHBondContact O-OG1 2.9Å; V198-T201 PolarHBondContact O-OG1 3.46Å; T201-Q204 PolarHBondContact O-N 2.9Å; T201-F205 WeakPolarHBondContact O-CB 3.43Å; T201-F205 PolarHBondContact O-N 3.11Å
202	K	96.8	Very high	95.6	Very high	98 Å²	98	66.5 Å²	66.5	43%	0.426	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-48.8	172.3	-169.2	178	-178.7	-179.2	0	111.7	Y166 V198 G200 Q204 F205 E206	Y166-K202 HydrophobicContact CD2-CB 3.81Å; Y166-K202 HydrophobicContact CD2-CG 4.42Å; Y166-K202 HydrophobicContact CE1-CG 4.34Å; Y166-K202 HydrophobicContact CE2-CB 3.47Å; Y166-K202 VanDerWaalsContact CE2-CB 3.47Å; Y166-K202 HydrophobicContact CE2-CD 4.2Å; Y166-K202 HydrophobicContact CE2-CG 3.79Å; V198-K202 VanDerWaalsContact O-CB 3.26Å; V198-K202 WeakPolarHBondContact O-CB 3.43Å; V198-K202 PolarHBondContact O-N 3.46Å; G200-K202 PolarHBondContact O-N 3.23Å; K202-Q204 VanDerWaalsContact C-N 3.33Å; K202-Q204 PolarHBondContact O-N 2.89Å; K202-F205 PolarHBondContact O-N 3.19Å; K202-E206 HydrophobicContact CG-CG 4.24Å; K202-E206 WeakPolarHBondContact O-CG 3.48Å; K202-E206 PolarHBondContact O-N 2.95Å
203	S	97.8	Very high	96	Very high	85 Å²	85	62.6 Å²	62.6	59%	0.594	32%	0.318	S	S	*	.	H	α-helix	trans	-59.4	-44	-179.8	-174.9	0	0	0	0	111.8	R199 G200 K207	R199-S203 PolarHBondContact O-N 3.48Å; G200-S203 PolarHBondContact O-N 3.48Å; S203-K207 PolarHBondContact O-N 3.36Å; S203-K207 VanDerWaalsContact O-N 3.13Å
204	Q	97.4	Very high	96.4	Very high	105 Å²	105	62 Å²	62	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-42	175.8	-171.5	178.1	18.3	0	0	112.7	G200 T201 K202 L208	G200-Q204 PolarHBondContact O-N 2.97Å; G200-Q204 VanDerWaalsContact O-N 3.1Å; T201-Q204 PolarHBondContact O-N 2.9Å; K202-Q204 VanDerWaalsContact C-N 3.33Å; K202-Q204 PolarHBondContact O-N 2.89Å; Q204-L208 HydrophobicContact CG-CD1 4.29Å; Q204-L208 PolarHBondContact O-N 3.48Å
205	F	97.9	Very high	96.8	Very high	5 Å²	5	64.8 Å²	64.8	2%	0.022	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-50	177.2	167.4	-116.2	0	0	0	112.3	L56 M159 A162 R163 Y166 T201 K202 K207 L208 K209	L56-F205 HydrophobicContact CD2-CE2 3.82Å; L56-F205 HydrophobicContact CD2-CZ 3.77Å; M159-F205 HydrophobicContact SD-CD2 4.34Å; M159-F205 HydrophobicContact SD-CE2 3.81Å; A162-F205 HydrophobicContact CB-CB 4.41Å; R163-F205 HydrophobicContact CB-CD2 3.67Å; R163-F205 HydrophobicContact CB-CE2 3.51Å; R163-F205 HydrophobicContact CB-CZ 4.36Å; R163-F205 HydrophobicContact CG-CD2 4.25Å; R163-F205 HydrophobicContact CG-CE2 3.67Å; R163-F205 HydrophobicContact CG-CZ 4.05Å; Y166-F205 AromaticContact CD1-CD1 3.68Å; Y166-F205 HydrophobicContact CD1-CD1 3.68Å; Y166-F205 HydrophobicContact CD1-CE1 4.21Å; Y166-F205 HydrophobicContact CD1-CG 4.29Å; Y166-F205 HydrophobicContact CE1-CD1 4.16Å; Y166-F205 HydrophobicContact CE1-CE1 4.49Å; Y166-F205 HydrophobicContact CG-CD1 4.45Å; T201-F205 WeakPolarHBondContact O-CB 3.43Å; T201-F205 PolarHBondContact O-N 3.11Å; K202-F205 PolarHBondContact O-N 3.19Å; F205-K207 VanDerWaalsContact C-N 3.3Å; F205-K207 PolarHBondContact O-N 3.33Å; F205-L208 PolarHBondContact O-N 3.07Å; F205-L208 VanDerWaalsContact O-N 3.16Å; F205-K209 HydrophobicContact CE1-CD 4.27Å; F205-K209 HydrophobicContact CE2-CB 4.38Å; F205-K209 HydrophobicContact CZ-CD 4.11Å; F205-K209 VanDerWaalsContact O-CB 3.31Å; F205-K209 WeakPolarHBondContact O-CB 3.4Å; F205-K209 PolarHBondContact O-N 3.18Å
206	E	97.9	Very high	97	Very high	54 Å²	54	61.7 Å²	61.7	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-36.7	-179.9	-69.3	-64.7	158.5	0	0	112	K202 K209 N210	K202-E206 HydrophobicContact CG-CG 4.24Å; K202-E206 WeakPolarHBondContact O-CG 3.48Å; K202-E206 PolarHBondContact O-N 2.95Å; E206-K209 IonicContact OE1-NZ 3.19Å; E206-K209 PolarHBondContact OE1-NZ 3.06Å; E206-K209 WeakPolarHBondContact OE2-CD 3.48Å; E206-K209 WeakPolarHBondContact OE2-CE 3.39Å; E206-K209 IonicContact OE2-NZ 3.17Å; E206-K209 PolarHBondContact OE2-NZ 2.99Å; E206-N210 PolarHBondContact O-N 3.35Å; E206-N210 PolarHBondContact O-ND2 2.9Å; E206-N210 VanDerWaalsContact O-ND2 3.12Å
207	K	97.9	Very high	97.2	Very high	141 Å²	141	62 Å²	62	61%	0.613	31%	0.31	S	S	*	.	H	α-helix	trans	-59.3	-53.8	171.8	-176.8	178.5	177	179.8	0	111.5	S203 F205 K209 N210 D211	S203-K207 PolarHBondContact O-N 3.36Å; S203-K207 VanDerWaalsContact O-N 3.13Å; F205-K207 VanDerWaalsContact C-N 3.3Å; F205-K207 PolarHBondContact O-N 3.33Å; K207-K209 VanDerWaalsContact C-N 3.32Å; K207-K209 PolarHBondContact O-N 3.49Å; K207-N210 PolarHBondContact O-N 3.48Å; K207-D211 VanDerWaalsContact O-CG 3.28Å; K207-D211 PolarHBondContact O-N 3.21Å
208	L	98.3	Very high	97.4	Very high	30 Å²	30	65.4 Å²	65.4	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-30.5	-178.5	-75.3	167.7	0	0	0	113.2	R158 M159 A162 Q204 F205 V212	R158-L208 HydrophobicContact CB-CD2 4.35Å; M159-L208 HydrophobicContact CB-CB 3.89Å; M159-L208 HydrophobicContact CG-CB 3.95Å; A162-L208 HydrophobicContact CB-CD1 3.66Å; Q204-L208 HydrophobicContact CG-CD1 4.29Å; Q204-L208 PolarHBondContact O-N 3.48Å; F205-L208 PolarHBondContact O-N 3.07Å; F205-L208 VanDerWaalsContact O-N 3.16Å; L208-V212 WeakPolarHBondContact O-CB 3.37Å; L208-V212 VanDerWaalsContact O-CG2 3.31Å; L208-V212 WeakPolarHBondContact O-CG2 3.39Å; L208-V212 PolarHBondContact O-N 3.49Å
209	K	97.9	Very high	97.5	Very high	42 Å²	42	65 Å²	65	18%	0.183	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-48.1	170.7	162.9	176.5	166.7	-159.7	0	111	L56 F205 E206 K207 V212 C213	L56-K209 HydrophobicContact CD1-CG 4.22Å; L56-K209 HydrophobicContact CD2-CB 4.09Å; L56-K209 HydrophobicContact CD2-CD 3.99Å; L56-K209 HydrophobicContact CD2-CG 3.87Å; F205-K209 HydrophobicContact CE1-CD 4.27Å; F205-K209 HydrophobicContact CE2-CB 4.38Å; F205-K209 HydrophobicContact CZ-CD 4.11Å; F205-K209 VanDerWaalsContact O-CB 3.31Å; F205-K209 WeakPolarHBondContact O-CB 3.4Å; F205-K209 PolarHBondContact O-N 3.18Å; E206-K209 IonicContact OE1-NZ 3.19Å; E206-K209 PolarHBondContact OE1-NZ 3.06Å; E206-K209 WeakPolarHBondContact OE2-CD 3.48Å; E206-K209 WeakPolarHBondContact OE2-CE 3.39Å; E206-K209 IonicContact OE2-NZ 3.17Å; E206-K209 PolarHBondContact OE2-NZ 2.99Å; K207-K209 VanDerWaalsContact C-N 3.32Å; K207-K209 PolarHBondContact O-N 3.49Å; K209-V212 PolarHBondContact O-N 2.74Å; K209-C213 PolarHBondContact O-N 2.68Å; K209-C213 PolarHBondContact O-SG 3.49Å; K209-C213 VanDerWaalsContact O-SG 3.34Å
210	N	97.8	Very high	97.5	Very high	84 Å²	84	57.4 Å²	57.4	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-63.3	-44.5	175.6	-71	-34.8	0	0	0	111.9	E206 K207 V212 C213 Q214	E206-N210 PolarHBondContact O-N 3.35Å; E206-N210 PolarHBondContact O-ND2 2.9Å; E206-N210 VanDerWaalsContact O-ND2 3.12Å; K207-N210 PolarHBondContact O-N 3.48Å; N210-V212 VanDerWaalsContact C-N 3.33Å; N210-V212 PolarHBondContact O-N 3.32Å; N210-C213 PolarHBondContact O-N 3.05Å; N210-Q214 WeakPolarHBondContact O-CG 3.27Å; N210-Q214 PolarHBondContact O-N 2.89Å
211	D	97.9	Very high	97.5	Very high	57 Å²	57	58.4 Å²	58.4	31%	0.305	30%	0.304	S	S	.	.	H	α-helix	trans	-57.3	-44.3	175.8	-64.9	-23.6	0	0	0	111.5	T155 K207 K215	T155-D211 HydrophobicContact CG2-CB 4.2Å; K207-D211 VanDerWaalsContact O-CG 3.28Å; K207-D211 PolarHBondContact O-N 3.21Å; D211-K215 WeakPolarHBondContact O-CB 3.25Å; D211-K215 WeakPolarHBondContact O-CG 3.4Å; D211-K215 PolarHBondContact O-N 3.43Å
212	V	98.5	Very high	97.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-48.6	175.9	165.5	0	0	0	0	111.5	L56 L60 T155 V156 M159 L208 K209 N210 Q214 K215 V216	L56-V212 HydrophobicContact CD1-CG1 4.41Å; L60-V212 HydrophobicContact CD2-CG1 4.18Å; T155-V212 HydrophobicContact CG2-CG2 3.89Å; V156-V212 HydrophobicContact CG2-CG1 3.81Å; V156-V212 HydrophobicContact CG2-CG2 4Å; M159-V212 HydrophobicContact CB-CG2 3.65Å; M159-V212 HydrophobicContact CE-CG1 4.31Å; M159-V212 HydrophobicContact CE-CG2 4.32Å; M159-V212 HydrophobicContact CG-CG2 3.97Å; L208-V212 WeakPolarHBondContact O-CB 3.37Å; L208-V212 VanDerWaalsContact O-CG2 3.31Å; L208-V212 WeakPolarHBondContact O-CG2 3.39Å; L208-V212 PolarHBondContact O-N 3.49Å; K209-V212 PolarHBondContact O-N 2.74Å; N210-V212 VanDerWaalsContact C-N 3.33Å; N210-V212 PolarHBondContact O-N 3.32Å; V212-Q214 VanDerWaalsContact C-N 3.34Å; V212-Q214 PolarHBondContact O-N 3.08Å; V212-K215 PolarHBondContact O-N 3.28Å; V212-V216 HydrophobicContact CG1-CG2 4.14Å; V212-V216 WeakPolarHBondContact O-CB 3.48Å; V212-V216 VanDerWaalsContact O-CG2 3.25Å; V212-V216 WeakPolarHBondContact O-CG2 3.45Å; V212-V216 PolarHBondContact O-N 3.24Å
213	C	97.4	Very high	97.5	Very high	30 Å²	30	58.2 Å²	58.2	20%	0.203	31%	0.308	C	S	.	.	H	α-helix	trans	-56.1	-48.9	-179.8	-75.3	0	0	0	0	111.7	K59 K209 N210 V216 D217	K59-C213 WeakPolarHBondContact CE-O 3.3Å; K209-C213 PolarHBondContact O-N 2.68Å; K209-C213 PolarHBondContact O-SG 3.49Å; K209-C213 VanDerWaalsContact O-SG 3.34Å; N210-C213 PolarHBondContact O-N 3.05Å; C213-V216 PolarHBondContact O-N 3Å; C213-D217 PolarHBondContact O-N 2.76Å
214	Q	97.8	Very high	97.5	Very high	127 Å²	127	58 Å²	58	59%	0.593	31%	0.305	S	S	*	.	H	α-helix	trans	-63.5	-45.9	178.8	-67.9	176.9	12.8	0	0	112.2	N210 V212 V216 D217 M218	N210-Q214 WeakPolarHBondContact O-CG 3.27Å; N210-Q214 PolarHBondContact O-N 2.89Å; V212-Q214 VanDerWaalsContact C-N 3.34Å; V212-Q214 PolarHBondContact O-N 3.08Å; Q214-V216 VanDerWaalsContact C-N 3.32Å; Q214-V216 PolarHBondContact O-N 3.3Å; Q214-D217 PolarHBondContact O-N 3.15Å; Q214-M218 WeakPolarHBondContact O-CG 3.48Å; Q214-M218 PolarHBondContact O-N 3.11Å
215	K	97.9	Very high	97.4	Very high	60 Å²	60	57.7 Å²	57.7	26%	0.261	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-41.5	176.4	-78.9	-167.3	176.6	-166	0	112.1	D151 T152 T155 D211 V212 M218 L219	D151-K215 VanDerWaalsContact CG-NZ 3.3Å; D151-K215 IonicContact OD1-NZ 3.81Å; D151-K215 PolarHBondContact OD1-NZ 3.37Å; D151-K215 WeakPolarHBondContact OD2-CE 3.48Å; D151-K215 IonicContact OD2-NZ 3.01Å; D151-K215 PolarHBondContact OD2-NZ 3.29Å; T152-K215 HydrophobicContact CG2-CB 4.12Å; T155-K215 HydrophobicContact CG2-CD 4.07Å; T155-K215 WeakPolarHBondContact OG1-CD 3.33Å; T155-K215 PolarHBondContact OG1-NZ 2.66Å; D211-K215 WeakPolarHBondContact O-CB 3.25Å; D211-K215 WeakPolarHBondContact O-CG 3.4Å; D211-K215 PolarHBondContact O-N 3.43Å; V212-K215 PolarHBondContact O-N 3.28Å; K215-M218 PolarHBondContact O-N 2.74Å; K215-L219 WeakPolarHBondContact O-CB 3.4Å; K215-L219 PolarHBondContact O-N 2.75Å
216	V	98.2	Very high	97.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-37.7	179.3	171.6	0	0	0	0	111.8	K59 F62 F63 T152 V212 C213 Q214 L219 G220	K59-V216 HydrophobicContact CD-CG1 4.27Å; K59-V216 HydrophobicContact CG-CB 4.27Å; K59-V216 HydrophobicContact CG-CG1 4.06Å; F62-V216 HydrophobicContact CD1-CG1 3.57Å; F62-V216 HydrophobicContact CE1-CG1 4.04Å; F63-V216 HydrophobicContact CB-CG1 4.18Å; F63-V216 HydrophobicContact CB-CG2 3.9Å; F63-V216 HydrophobicContact CD2-CG2 4.15Å; F63-V216 HydrophobicContact CG-CG2 4.17Å; T152-V216 HydrophobicContact CG2-CG2 3.91Å; V212-V216 HydrophobicContact CG1-CG2 4.14Å; V212-V216 WeakPolarHBondContact O-CB 3.48Å; V212-V216 VanDerWaalsContact O-CG2 3.25Å; V212-V216 WeakPolarHBondContact O-CG2 3.45Å; V212-V216 PolarHBondContact O-N 3.24Å; C213-V216 PolarHBondContact O-N 3Å; Q214-V216 VanDerWaalsContact C-N 3.32Å; Q214-V216 PolarHBondContact O-N 3.3Å; V216-L219 PolarHBondContact O-N 3.41Å; V216-G220 PolarHBondContact O-N 3.19Å
217	D	96.9	Very high	97.2	Very high	86 Å²	86	57.5 Å²	57.5	46%	0.46	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-45.9	174.1	-73.2	-37.2	0	0	0	112.3	K59 C213 Q214 L219 G220 A221	K59-D217 WeakPolarHBondContact CE-OD1 3.45Å; K59-D217 WeakPolarHBondContact CE-OD2 3.36Å; K59-D217 IonicContact NZ-OD1 2.77Å; K59-D217 PolarHBondContact NZ-OD1 3.01Å; K59-D217 IonicContact NZ-OD2 3.64Å; K59-D217 PolarHBondContact NZ-OD2 2.59Å; C213-D217 PolarHBondContact O-N 2.76Å; Q214-D217 PolarHBondContact O-N 3.15Å; D217-L219 PolarHBondContact O-N 3.49Å; D217-G220 PolarHBondContact O-N 3.2Å; D217-A221 PolarHBondContact O-N 2.94Å
218	M	96.6	Very high	97	Very high	140 Å²	140	54.4 Å²	54.4	69%	0.69	30%	0.303	S	S	*	.	H	α-helix	trans	-59.5	-36.3	173.2	-70.5	-176.5	70.5	0	0	112	Q214 K215 S222	Q214-M218 WeakPolarHBondContact O-CG 3.48Å; Q214-M218 PolarHBondContact O-N 3.11Å; K215-M218 PolarHBondContact O-N 2.74Å; M218-S222 VanDerWaalsContact O-CB 3.31Å; M218-S222 WeakPolarHBondContact O-CB 3.39Å; M218-S222 PolarHBondContact O-N 3.34Å; M218-S222 PolarHBondContact O-OG 2.92Å
219	L	97.1	Very high	96.7	Very high	3 Å²	3	58.9 Å²	58.9	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-70.2	-37.1	177.7	-168	145.1	0	0	0	111.8	F63 V66 F144 A148 I149 T152 K215 V216 D217 S222 R223	F63-L219 HydrophobicContact CE2-CD1 4.19Å; V66-L219 HydrophobicContact CB-CD2 4Å; V66-L219 HydrophobicContact CG1-CD2 3.43Å; V66-L219 VanDerWaalsContact CG1-CD2 3.43Å; V66-L219 HydrophobicContact CG2-CD2 4.26Å; F144-L219 HydrophobicContact CE1-CD2 4.31Å; F144-L219 HydrophobicContact CE2-CG 4.25Å; F144-L219 HydrophobicContact CZ-CD2 3.77Å; F144-L219 HydrophobicContact CZ-CG 3.69Å; F144-L219 WeakPolarHBondContact CZ-O 3.23Å; A148-L219 HydrophobicContact CB-CD1 4.4Å; A148-L219 WeakPolarHBondContact O-CD1 3.49Å; I149-L219 HydrophobicContact CG1-CD1 3.95Å; I149-L219 HydrophobicContact CG1-CD2 4.3Å; T152-L219 HydrophobicContact CG2-CD1 4.2Å; T152-L219 VanDerWaalsContact OG1-CD1 3.23Å; T152-L219 WeakPolarHBondContact OG1-CD1 3.41Å; K215-L219 WeakPolarHBondContact O-CB 3.4Å; K215-L219 PolarHBondContact O-N 2.75Å; V216-L219 PolarHBondContact O-N 3.41Å; D217-L219 PolarHBondContact O-N 3.49Å; L219-S222 WeakPolarHBondContact CA-OG 3.17Å; L219-S222 PolarHBondContact O-OG 2.74Å; L219-R223 VanDerWaalsContact O-CB 3.29Å; L219-R223 WeakPolarHBondContact O-CB 3.31Å; L219-R223 PolarHBondContact O-N 2.74Å
220	G	96.6	Very high	96.5	Very high	10 Å²	10	57 Å²	57	10%	0.103	32%	0.316	C	S	.	.	H	α-helix	trans	-61.3	-51.6	169.6	0	0	0	0	0	112.4	V216 D217 R223 C224	V216-G220 PolarHBondContact O-N 3.19Å; D217-G220 PolarHBondContact O-N 3.2Å; G220-R223 WeakPolarHBondContact O-CB 3.31Å; G220-R223 PolarHBondContact O-N 2.82Å; G220-C224 PolarHBondContact O-N 3.33Å; G220-C224 VanDerWaalsContact O-N 3.13Å; G220-C224 PolarHBondContact O-SG 2.92Å; G220-C224 VanDerWaalsContact O-SG 3.4Å
221	A	96.8	Very high	96.3	Very high	66 Å²	66	56.7 Å²	56.7	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-45.7	-179.6	0	0	0	0	0	112.8	D217 C224 N225	D217-A221 PolarHBondContact O-N 2.94Å; A221-C224 PolarHBondContact O-N 3.02Å; A221-N225 PolarHBondContact O-N 3.2Å
222	S	96.6	Very high	96.3	Very high	49 Å²	49	57.2 Å²	57.2	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-35	179.1	53.2	0	0	0	0	113	M218 L219 N225 M226	M218-S222 VanDerWaalsContact O-CB 3.31Å; M218-S222 WeakPolarHBondContact O-CB 3.39Å; M218-S222 PolarHBondContact O-N 3.34Å; M218-S222 PolarHBondContact O-OG 2.92Å; L219-S222 WeakPolarHBondContact CA-OG 3.17Å; L219-S222 PolarHBondContact O-OG 2.74Å; S222-N225 PolarHBondContact O-N 3.01Å; S222-M226 WeakPolarHBondContact O-CB 3.48Å; S222-M226 PolarHBondContact O-N 2.93Å
223	R	97.1	Very high	96.1	Very high	49 Å²	49	60.7 Å²	60.7	19%	0.185	34%	0.342	C	S	.	.	H	α-helix	trans	-58	-50	169.5	178.5	-173	175.8	171.7	7.6	111.4	T69 F144 L219 G220 N225 M226 L227	T69-R223 VanDerWaalsContact OG1-CZ 3.29Å; T69-R223 PolarHBondContact OG1-NH1 3.29Å; T69-R223 PolarHBondContact OG1-NH2 3.06Å; F144-R223 HydrophobicContact CE1-CB 4.08Å; F144-R223 HydrophobicContact CE1-CG 4.38Å; F144-R223 HydrophobicContact CE2-CB 4.34Å; F144-R223 HydrophobicContact CZ-CB 3.68Å; F144-R223 HydrophobicContact CZ-CG 4.46Å; L219-R223 VanDerWaalsContact O-CB 3.29Å; L219-R223 WeakPolarHBondContact O-CB 3.31Å; L219-R223 PolarHBondContact O-N 2.74Å; G220-R223 WeakPolarHBondContact O-CB 3.31Å; G220-R223 PolarHBondContact O-N 2.82Å; R223-N225 VanDerWaalsContact C-N 3.34Å; R223-N225 PolarHBondContact O-N 2.96Å; R223-M226 PolarHBondContact O-N 3.39Å; R223-L227 HydrophobicContact CG-CD1 3.84Å; R223-L227 HydrophobicContact CG-CG 4.43Å; R223-L227 WeakPolarHBondContact O-CB 3.38Å; R223-L227 WeakPolarHBondContact O-CG 3.5Å; R223-L227 PolarHBondContact O-N 3.19Å
224	C	96.4	Very high	96	Very high	79 Å²	79	61.1 Å²	61.1	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-45.7	-179.9	-68.8	0	0	0	0	111.1	G220 A221 M226 L227 S228	G220-C224 PolarHBondContact O-N 3.33Å; G220-C224 VanDerWaalsContact O-N 3.13Å; G220-C224 PolarHBondContact O-SG 2.92Å; G220-C224 VanDerWaalsContact O-SG 3.4Å; A221-C224 PolarHBondContact O-N 3.02Å; C224-M226 PolarHBondContact O-N 3.44Å; C224-L227 PolarHBondContact O-N 3.4Å; C224-S228 WeakPolarHBondContact O-CB 3.34Å; C224-S228 PolarHBondContact O-N 2.82Å; C224-S228 PolarHBondContact O-OG 2.99Å
225	N	95.4	Very high	96	Very high	100 Å²	100	60.6 Å²	60.6	54%	0.535	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-48.3	178.5	-168.3	58.3	0	0	0	112.6	A221 S222 R223 L227 S228 H229	A221-N225 PolarHBondContact O-N 3.2Å; S222-N225 PolarHBondContact O-N 3.01Å; R223-N225 VanDerWaalsContact C-N 3.34Å; R223-N225 PolarHBondContact O-N 2.96Å; N225-L227 PolarHBondContact O-N 3.03Å; N225-S228 PolarHBondContact O-N 3.48Å; N225-H229 PolarHBondContact O-CD2 2.75Å; N225-H229 VanDerWaalsContact O-CD2 3.23Å; N225-H229 PolarHBondContact O-N 3.44Å
226	M	95.8	Very high	95.9	Very high	27 Å²	27	60.8 Å²	60.8	13%	0.133	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-47.6	177	177.3	-170.9	68.5	0	0	112.2	E140 V141 F144 S222 R223 C224 S230	E140-M226 VanDerWaalsContact C-SD 3.52Å; E140-M226 HydrophobicContact CB-CG 3.97Å; E140-M226 HydrophobicContact CB-SD 3.98Å; E140-M226 VanDerWaalsContact O-SD 3.42Å; V141-M226 HydrophobicContact CB-CE 4.41Å; V141-M226 HydrophobicContact CG2-CE 3.81Å; V141-M226 HydrophobicContact CG2-SD 4.49Å; F144-M226 HydrophobicContact CB-CE 4.01Å; F144-M226 HydrophobicContact CB-SD 3.57Å; F144-M226 VanDerWaalsContact CB-SD 3.57Å; F144-M226 HydrophobicContact CD1-CE 4.08Å; F144-M226 HydrophobicContact CD2-SD 4.43Å; F144-M226 HydrophobicContact CG-CE 3.97Å; F144-M226 HydrophobicContact CG-SD 4.02Å; S222-M226 WeakPolarHBondContact O-CB 3.48Å; S222-M226 PolarHBondContact O-N 2.93Å; R223-M226 PolarHBondContact O-N 3.39Å; C224-M226 PolarHBondContact O-N 3.44Å; M226-S230 PolarHBondContact O-N 3.46Å; M226-S230 PolarHBondContact O-OG 3.32Å
227	L	95.8	Very high	95.8	Very high	27 Å²	27	62.3 Å²	62.3	14%	0.141	35%	0.353	C	S	.	.	H	α-helix	trans	-69.3	-38.2	-177.8	-68.9	177.3	0	0	0	112.2	L73 V141 R223 C224 N225 H229 S230 L231	L73-L227 HydrophobicContact CD2-CD2 3.8Å; V141-L227 HydrophobicContact CG2-CD2 4.02Å; R223-L227 HydrophobicContact CG-CD1 3.84Å; R223-L227 HydrophobicContact CG-CG 4.43Å; R223-L227 WeakPolarHBondContact O-CB 3.38Å; R223-L227 WeakPolarHBondContact O-CG 3.5Å; R223-L227 PolarHBondContact O-N 3.19Å; C224-L227 PolarHBondContact O-N 3.4Å; N225-L227 PolarHBondContact O-N 3.03Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 2.86Å; L227-S230 PolarHBondContact O-N 2.9Å; L227-S230 PolarHBondContact O-OG 2.69Å; L227-L231 HydrophobicContact CB-CD1 4.09Å; L227-L231 WeakPolarHBondContact O-CB 3.45Å; L227-L231 VanDerWaalsContact O-CG 3.26Å; L227-L231 WeakPolarHBondContact O-CG 3.48Å; L227-L231 PolarHBondContact O-N 2.87Å
228	S	94.6	Very high	95.8	Very high	77 Å²	77	60 Å²	60	54%	0.538	34%	0.341	S	S	.	.	H	α-helix	trans	-57.6	-41.9	178	-68.9	0	0	0	0	112.9	C224 N225 C232	C224-S228 WeakPolarHBondContact O-CB 3.34Å; C224-S228 PolarHBondContact O-N 2.82Å; C224-S228 PolarHBondContact O-OG 2.99Å; N225-S228 PolarHBondContact O-N 3.48Å; S228-C232 WeakPolarHBondContact O-CB 3.32Å; S228-C232 PolarHBondContact O-N 2.87Å
229	H	91.4	Very high	95.9	Very high	123 Å²	123	58.4 Å²	58.4	57%	0.569	33%	0.334	S	S	*	.	H	α-helix	trans	-76.9	-44.5	179.9	-70.1	-63.4	0	0	0	113.4	N225 L227 T233	N225-H229 PolarHBondContact O-CD2 2.75Å; N225-H229 VanDerWaalsContact O-CD2 3.23Å; N225-H229 PolarHBondContact O-N 3.44Å; L227-H229 VanDerWaalsContact C-N 3.33Å; L227-H229 PolarHBondContact O-N 2.86Å; H229-T233 PolarHBondContact O-N 3.09Å; H229-T233 PolarHBondContact O-OG1 3.42Å
230	S	94	Very high	95.9	Very high	4 Å²	4	62.6 Å²	62.6	3%	0.028	35%	0.354	C	S	.	.	H	α-helix	trans	-68.4	-43.6	-179.2	49.1	0	0	0	0	112.7	E140 M226 L227 T233 Y234	E140-S230 WeakPolarHBondContact OE2-CB 3.42Å; M226-S230 PolarHBondContact O-N 3.46Å; M226-S230 PolarHBondContact O-OG 3.32Å; L227-S230 PolarHBondContact O-N 2.9Å; L227-S230 PolarHBondContact O-OG 2.69Å; S230-T233 PolarHBondContact O-N 3.3Å; S230-Y234 PolarHBondContact O-N 3.45Å; S230-Y234 VanDerWaalsContact O-N 3.16Å
231	L	94.4	Very high	95.9	Very high	76 Å²	76	62.5 Å²	62.5	40%	0.398	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-40.6	176.7	-69.4	169.1	0	0	0	112.3	M137 L227 T233 Y234 Q235	M137-L231 HydrophobicContact CE-CD2 4.34Å; M137-L231 HydrophobicContact SD-CD2 3.53Å; M137-L231 VanDerWaalsContact SD-CD2 3.53Å; M137-L231 HydrophobicContact SD-CG 4.08Å; L227-L231 HydrophobicContact CB-CD1 4.09Å; L227-L231 WeakPolarHBondContact O-CB 3.45Å; L227-L231 VanDerWaalsContact O-CG 3.26Å; L227-L231 WeakPolarHBondContact O-CG 3.48Å; L227-L231 PolarHBondContact O-N 2.87Å; L231-T233 VanDerWaalsContact C-N 3.3Å; L231-T233 PolarHBondContact O-N 3.43Å; L231-Y234 PolarHBondContact O-N 3.29Å; L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.46Å; L231-Q235 PolarHBondContact O-N 3.48Å
232	C	95.9	Very high	95.9	Very high	68 Å²	68	66.3 Å²	66.3	46%	0.459	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-42.7	177.3	179	0	0	0	0	111.7	S228 Q235 T236	S228-C232 WeakPolarHBondContact O-CB 3.32Å; S228-C232 PolarHBondContact O-N 2.87Å; C232-Q235 PolarHBondContact O-N 2.89Å; C232-T236 WeakPolarHBondContact O-CB 3.48Å; C232-T236 PolarHBondContact O-N 3.32Å; C232-T236 PolarHBondContact O-OG1 3.1Å
233	T	94.5	Very high	96	Very high	74 Å²	74	69.5 Å²	69.5	45%	0.454	36%	0.36	S	S	.	.	H	α-helix	trans	-63.1	-50.3	177.4	-53.2	0	0	0	0	110.9	P133 H229 S230 L231 Q235 T236 T237	P133-T233 HydrophobicContact CB-CG2 4.11Å; H229-T233 PolarHBondContact O-N 3.09Å; H229-T233 PolarHBondContact O-OG1 3.42Å; S230-T233 PolarHBondContact O-N 3.3Å; L231-T233 VanDerWaalsContact C-N 3.3Å; L231-T233 PolarHBondContact O-N 3.43Å; T233-Q235 PolarHBondContact O-N 3.19Å; T233-T236 PolarHBondContact O-N 2.88Å; T233-T237 PolarHBondContact O-N 3.2Å; T233-T237 VanDerWaalsContact O-N 3.16Å; T233-T237 PolarHBondContact O-OG1 3.11Å; T233-T237 VanDerWaalsContact O-OG1 3.14Å
234	Y	96.7	Very high	95.9	Very high	39 Å²	39	72.3 Å²	72.3	15%	0.153	37%	0.374	C	S	.	.	H	α-helix	trans	-59.3	-46.3	176.9	165	-107.1	0	0	0	112.7	Y80 L130 L134 S230 L231 T236 T237 L238	Y80-Y234 HydrophobicContact CE1-CE2 4.04Å; Y80-Y234 AromaticContact CE1-CZ 3.91Å; Y80-Y234 VanDerWaalsContact CE1-OH 3.24Å; Y80-Y234 WeakPolarHBondContact CE1-OH 3.47Å; Y80-Y234 PolarHBondContact OH-OH 3.17Å; Y80-Y234 VanDerWaalsContact OH-OH 3.09Å; L130-Y234 HydrophobicContact CD2-CE2 4.33Å; L134-Y234 HydrophobicContact CD1-CE2 4.2Å; L134-Y234 HydrophobicContact CD2-CD2 3.63Å; L134-Y234 HydrophobicContact CD2-CE2 3.63Å; L134-Y234 HydrophobicContact CD2-CG 4.24Å; L134-Y234 HydrophobicContact CG-CD2 3.79Å; L134-Y234 HydrophobicContact CG-CE2 3.89Å; S230-Y234 PolarHBondContact O-N 3.45Å; S230-Y234 VanDerWaalsContact O-N 3.16Å; L231-Y234 PolarHBondContact O-N 3.29Å; Y234-T236 PolarHBondContact O-N 3.36Å; Y234-T237 PolarHBondContact O-N 3.44Å; Y234-L238 HydrophobicContact CE1-CD2 4.25Å; Y234-L238 WeakPolarHBondContact O-CB 3.42Å; Y234-L238 PolarHBondContact O-N 3.33Å
235	Q	97	Very high	95.9	Very high	116 Å²	116	68.9 Å²	68.9	54%	0.542	35%	0.351	S	S	.	.	H	α-helix	trans	-60.4	-43.9	178.9	180	-178.5	-2.2	0	0	111.6	L231 C232 T233 L238 L239	L231-Q235 VanDerWaalsContact O-CB 3.24Å; L231-Q235 WeakPolarHBondContact O-CB 3.46Å; L231-Q235 PolarHBondContact O-N 3.48Å; C232-Q235 PolarHBondContact O-N 2.89Å; T233-Q235 PolarHBondContact O-N 3.19Å; Q235-L238 PolarHBondContact O-N 3.27Å; Q235-L239 HydrophobicContact CG-CD1 4.2Å; Q235-L239 WeakPolarHBondContact O-CG 3.25Å; Q235-L239 PolarHBondContact O-N 2.95Å
236	T	96.6	Very high	96	Very high	63 Å²	63	66.3 Å²	66.3	39%	0.387	34%	0.343	S	S	.	.	H	α-helix	trans	-62.2	-44.9	178.8	-56.9	0	0	0	0	111.1	C232 T233 Y234 L238 L239 Q240	C232-T236 WeakPolarHBondContact O-CB 3.48Å; C232-T236 PolarHBondContact O-N 3.32Å; C232-T236 PolarHBondContact O-OG1 3.1Å; T233-T236 PolarHBondContact O-N 2.88Å; Y234-T236 PolarHBondContact O-N 3.36Å; T236-L238 VanDerWaalsContact C-N 3.35Å; T236-L238 PolarHBondContact O-N 3.48Å; T236-L239 PolarHBondContact O-N 3.02Å; T236-Q240 WeakPolarHBondContact O-CG 3.46Å; T236-Q240 PolarHBondContact O-N 2.7Å; T236-Q240 VanDerWaalsContact O-N 3.13Å
237	T	96.1	Very high	96	Very high	32 Å²	32	70 Å²	70	20%	0.196	36%	0.364	C	S	.	.	H	α-helix	trans	-65.1	-37.6	175.5	-48.1	0	0	0	0	112.2	A129 L130 T233 Y234 Q240 F241	A129-T237 HydrophobicContact CB-CG2 4.31Å; L130-T237 HydrophobicContact CD2-CG2 3.85Å; T233-T237 PolarHBondContact O-N 3.2Å; T233-T237 VanDerWaalsContact O-N 3.16Å; T233-T237 PolarHBondContact O-OG1 3.11Å; T233-T237 VanDerWaalsContact O-OG1 3.14Å; Y234-T237 PolarHBondContact O-N 3.44Å; T237-Q240 PolarHBondContact O-N 3.06Å; T237-F241 WeakPolarHBondContact O-CB 3.49Å; T237-F241 PolarHBondContact O-N 2.71Å
238	L	97.3	Very high	96	Very high	39 Å²	39	70.9 Å²	70.9	20%	0.204	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-43.4	177.3	-174.2	68	0	0	0	112.4	L130 Y234 Q235 T236 F241 W242	L130-L238 HydrophobicContact CD1-CD1 3.8Å; L130-L238 HydrophobicContact CD2-CB 4.03Å; L130-L238 HydrophobicContact CD2-CD1 4.09Å; Y234-L238 HydrophobicContact CE1-CD2 4.25Å; Y234-L238 WeakPolarHBondContact O-CB 3.42Å; Y234-L238 PolarHBondContact O-N 3.33Å; Q235-L238 PolarHBondContact O-N 3.27Å; T236-L238 VanDerWaalsContact C-N 3.35Å; T236-L238 PolarHBondContact O-N 3.48Å; L238-F241 HydrophobicContact CD1-CD1 4.39Å; L238-F241 PolarHBondContact O-N 3.1Å; L238-W242 PolarHBondContact O-N 3.5Å; L238-W242 VanDerWaalsContact O-N 3.12Å
239	L	97.5	Very high	96	Very high	106 Å²	106	71.8 Å²	71.8	56%	0.555	37%	0.371	S	S	*	.	H	α-helix	trans	-62.7	-48.5	175.9	-71.5	169.3	0	0	0	111.1	Q235 T236 F241 W242 E243	Q235-L239 HydrophobicContact CG-CD1 4.2Å; Q235-L239 WeakPolarHBondContact O-CG 3.25Å; Q235-L239 PolarHBondContact O-N 2.95Å; T236-L239 PolarHBondContact O-N 3.02Å; L239-F241 VanDerWaalsContact C-N 3.29Å; L239-F241 PolarHBondContact O-N 2.82Å; L239-W242 PolarHBondContact O-N 3.09Å; L239-E243 WeakPolarHBondContact O-CB 3.47Å; L239-E243 PolarHBondContact O-N 3.38Å
240	Q	96.8	Very high	96.2	Very high	91 Å²	91	68.6 Å²	68.6	43%	0.425	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-35.2	178	-70.5	175.6	4.3	0	0	113.1	T236 T237 K244	T236-Q240 WeakPolarHBondContact O-CG 3.46Å; T236-Q240 PolarHBondContact O-N 2.7Å; T236-Q240 VanDerWaalsContact O-N 3.13Å; T237-Q240 PolarHBondContact O-N 3.06Å; Q240-K244 WeakPolarHBondContact O-CB 3.38Å; Q240-K244 WeakPolarHBondContact O-CD 3.45Å; Q240-K244 VanDerWaalsContact O-CG 3.24Å; Q240-K244 WeakPolarHBondContact O-CG 3.42Å; Q240-K244 PolarHBondContact O-N 2.83Å
241	F	97.3	Very high	96.2	Very high	8 Å²	8	70.2 Å²	70.2	4%	0.035	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-49.9	173.7	157.8	-107.4	0	0	0	111.4	Q126 R127 L130 T237 L238 L239 T245	Q126-F241 HydrophobicContact CB-CD2 3.98Å; R127-F241 HydrophobicContact CB-CD2 4.12Å; R127-F241 HydrophobicContact CB-CE2 3.7Å; R127-F241 HydrophobicContact CB-CZ 4.01Å; R127-F241 HydrophobicContact CG-CE1 4.42Å; R127-F241 HydrophobicContact CG-CE2 4.32Å; R127-F241 HydrophobicContact CG-CZ 4.15Å; L130-F241 HydrophobicContact CD1-CD1 4.37Å; T237-F241 WeakPolarHBondContact O-CB 3.49Å; T237-F241 PolarHBondContact O-N 2.71Å; L238-F241 HydrophobicContact CD1-CD1 4.39Å; L238-F241 PolarHBondContact O-N 3.1Å; L239-F241 VanDerWaalsContact C-N 3.29Å; L239-F241 PolarHBondContact O-N 2.82Å; F241-T245 VanDerWaalsContact CE2-OG1 3.29Å; F241-T245 WeakPolarHBondContact CE2-OG1 3.31Å; F241-T245 VanDerWaalsContact O-CB 3.32Å; F241-T245 WeakPolarHBondContact O-CB 3.36Å; F241-T245 PolarHBondContact O-N 3.47Å; F241-T245 PolarHBondContact O-OG1 2.7Å
242	W	97.4	Very high	96.1	Very high	145 Å²	145	68 Å²	68	55%	0.549	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-41.8	-179.4	-76.9	119.5	0	0	0	112.5	L238 L239 T245 A246	L238-W242 PolarHBondContact O-N 3.5Å; L238-W242 VanDerWaalsContact O-N 3.12Å; L239-W242 PolarHBondContact O-N 3.09Å; W242-T245 PolarHBondContact O-N 3.43Å; W242-A246 WeakPolarHBondContact O-CB 3.41Å; W242-A246 PolarHBondContact O-N 2.64Å
243	E	97.3	Very high	95.9	Very high	116 Å²	116	70.5 Å²	70.5	54%	0.542	37%	0.373	S	S	.	.	H	α-helix	trans	-59	-51.3	177.2	-178.4	-179	-165.2	0	0	111.7	L239 T245 A246 N247	L239-E243 WeakPolarHBondContact O-CB 3.47Å; L239-E243 PolarHBondContact O-N 3.38Å; E243-T245 VanDerWaalsContact C-N 3.34Å; E243-T245 PolarHBondContact O-N 3.47Å; E243-A246 PolarHBondContact O-N 3.13Å; E243-N247 WeakPolarHBondContact O-CB 3.31Å; E243-N247 PolarHBondContact O-N 3.27Å; E243-N247 PolarHBondContact O-ND2 2.98Å
244	K	96.1	Very high	95.8	Very high	109 Å²	109	73.2 Å²	73.2	47%	0.474	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-40.7	178.4	-71.8	172.3	-176.3	175.9	0	112.4	Q240 A248	Q240-K244 WeakPolarHBondContact O-CB 3.38Å; Q240-K244 WeakPolarHBondContact O-CD 3.45Å; Q240-K244 VanDerWaalsContact O-CG 3.24Å; Q240-K244 WeakPolarHBondContact O-CG 3.42Å; Q240-K244 PolarHBondContact O-N 2.83Å; K244-A248 WeakPolarHBondContact O-CB 3.49Å; K244-A248 PolarHBondContact O-N 3.44Å; K244-A248 VanDerWaalsContact O-N 3.1Å
245	T	96.1	Very high	95.4	Very high	7 Å²	7	74.5 Å²	74.5	4%	0.043	40%	0.399	C	S	.	.	H	α-helix	trans	-67.5	-45.3	179.1	-57.4	0	0	0	0	111.3	F241 W242 E243 A248 M249	F241-T245 VanDerWaalsContact CE2-OG1 3.29Å; F241-T245 WeakPolarHBondContact CE2-OG1 3.31Å; F241-T245 VanDerWaalsContact O-CB 3.32Å; F241-T245 WeakPolarHBondContact O-CB 3.36Å; F241-T245 PolarHBondContact O-N 3.47Å; F241-T245 PolarHBondContact O-OG1 2.7Å; W242-T245 PolarHBondContact O-N 3.43Å; E243-T245 VanDerWaalsContact C-N 3.34Å; E243-T245 PolarHBondContact O-N 3.47Å; T245-A248 PolarHBondContact O-N 3.42Å; T245-M249 HydrophobicContact CG2-CE 4.46Å; T245-M249 HydrophobicContact CG2-SD 4.04Å; T245-M249 WeakPolarHBondContact O-CB 3.46Å; T245-M249 WeakPolarHBondContact O-CG 3.48Å; T245-M249 PolarHBondContact O-N 3.17Å
246	A	96.8	Very high	94.7	Very high	46 Å²	46	70.6 Å²	70.6	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-47.2	176.7	0	0	0	0	0	111.5	W242 E243 A248 M249 S250	W242-A246 WeakPolarHBondContact O-CB 3.41Å; W242-A246 PolarHBondContact O-N 2.64Å; E243-A246 PolarHBondContact O-N 3.13Å; A246-A248 VanDerWaalsContact C-N 3.32Å; A246-A248 PolarHBondContact O-N 3.08Å; A246-M249 PolarHBondContact O-N 2.7Å; A246-S250 WeakPolarHBondContact O-CB 3.46Å; A246-S250 PolarHBondContact O-N 2.9Å; A246-S250 PolarHBondContact O-OG 3.41Å; A246-S250 VanDerWaalsContact O-OG 3.12Å
247	N	96.5	Very high	93.8	Very high	105 Å²	105	73.6 Å²	73.6	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-60.4	-40.8	178.6	-69.3	-15.6	0	0	0	112.1	E243 G251	E243-N247 WeakPolarHBondContact O-CB 3.31Å; E243-N247 PolarHBondContact O-N 3.27Å; E243-N247 PolarHBondContact O-ND2 2.98Å; N247-G251 PolarHBondContact O-N 2.91Å
248	A	95.4	Very high	92.3	Very high	45 Å²	45	75.6 Å²	75.6	37%	0.372	42%	0.417	S	S	.	.	H	α-helix	trans	-64.9	-43.1	175	0	0	0	0	0	112.5	A119 K244 T245 A246 I252	A119-A248 HydrophobicContact CB-CB 4.4Å; K244-A248 WeakPolarHBondContact O-CB 3.49Å; K244-A248 PolarHBondContact O-N 3.44Å; K244-A248 VanDerWaalsContact O-N 3.1Å; T245-A248 PolarHBondContact O-N 3.42Å; A246-A248 VanDerWaalsContact C-N 3.32Å; A246-A248 PolarHBondContact O-N 3.08Å; A248-I252 WeakPolarHBondContact O-CG1 3.37Å; A248-I252 PolarHBondContact O-N 3.21Å
249	M	94.9	Very high	90.7	Very high	95 Å²	95	78 Å²	78	47%	0.468	43%	0.427	S	S	.	.	H	α-helix	trans	-67.6	-41.3	177.7	-73.8	176.2	152	0	0	112.7	L120 T245 A246 I252 H253	L120-M249 HydrophobicContact CD2-CE 4.26Å; T245-M249 HydrophobicContact CG2-CE 4.46Å; T245-M249 HydrophobicContact CG2-SD 4.04Å; T245-M249 WeakPolarHBondContact O-CB 3.46Å; T245-M249 WeakPolarHBondContact O-CG 3.48Å; T245-M249 PolarHBondContact O-N 3.17Å; A246-M249 PolarHBondContact O-N 2.7Å; M249-I252 PolarHBondContact O-N 3.25Å; M249-H253 PolarHBondContact O-N 3.47Å
250	S	95.3	Very high	88.8	Confident	57 Å²	57	79.4 Å²	79.4	40%	0.399	43%	0.434	S	S	.	.	H	α-helix	trans	-64.2	-43.7	176.1	-64.8	0	0	0	0	111.8	A246 I252 H253 E254	A246-S250 WeakPolarHBondContact O-CB 3.46Å; A246-S250 PolarHBondContact O-N 2.9Å; A246-S250 PolarHBondContact O-OG 3.41Å; A246-S250 VanDerWaalsContact O-OG 3.12Å; S250-I252 VanDerWaalsContact C-N 3.26Å; S250-I252 PolarHBondContact O-N 3.48Å; S250-H253 WeakPolarHBondContact O-CB 3.49Å; S250-H253 PolarHBondContact O-N 3.43Å; S250-E254 WeakPolarHBondContact O-CG 3.31Å; S250-E254 PolarHBondContact O-N 3.34Å
251	G	94.1	Very high	86.7	Confident	37 Å²	37	79.7 Å²	79.7	38%	0.381	44%	0.443	S	S	.	.	H	α-helix	trans	-60.9	-34.2	175.8	0	0	0	0	0	113.2	N247 A255	N247-G251 PolarHBondContact O-N 2.91Å; G251-A255 VanDerWaalsContact O-CB 3.3Å; G251-A255 WeakPolarHBondContact O-CB 3.44Å; G251-A255 PolarHBondContact O-N 3.27Å; G251-A255 VanDerWaalsContact O-N 3.12Å
252	I	93.2	Very high	84.4	Confident	31 Å²	31	90 Å²	90	16%	0.159	48%	0.484	C	S	.	.	H	α-helix	trans	-67.5	-50.2	170.1	-65.2	167	0	0	0	110	A115 A119 A248 M249 S250 E254 A255 F256	A115-I252 HydrophobicContact CB-CD1 4.24Å; A115-I252 HydrophobicContact CB-CG1 4.07Å; A115-I252 WeakPolarHBondContact O-CD1 3.46Å; A119-I252 HydrophobicContact CB-CD1 3.54Å; A248-I252 WeakPolarHBondContact O-CG1 3.37Å; A248-I252 PolarHBondContact O-N 3.21Å; M249-I252 PolarHBondContact O-N 3.25Å; S250-I252 VanDerWaalsContact C-N 3.26Å; S250-I252 PolarHBondContact O-N 3.48Å; I252-E254 VanDerWaalsContact C-N 3.3Å; I252-E254 PolarHBondContact O-N 2.92Å; I252-A255 PolarHBondContact O-N 3.36Å; I252-F256 HydrophobicContact CG2-CD2 3.94Å; I252-F256 HydrophobicContact CG2-CE2 4.25Å; I252-F256 VanDerWaalsContact O-CD2 3.27Å; I252-F256 WeakPolarHBondContact O-CD2 3.43Å; I252-F256 PolarHBondContact O-N 3.3Å; I252-F256 VanDerWaalsContact O-N 3.14Å
253	H	91.1	Very high	81.8	Confident	120 Å²	120	87.1 Å²	87.1	56%	0.556	48%	0.476	S	S	*	.	H	α-helix	trans	-53.4	-47.9	179.9	175.9	66	0	0	0	112	M249 S250 F256 Q257	M249-H253 PolarHBondContact O-N 3.47Å; S250-H253 WeakPolarHBondContact O-CB 3.49Å; S250-H253 PolarHBondContact O-N 3.43Å; H253-F256 CarbonylContact O-C 3.57Å; H253-F256 PolarHBondContact O-N 3.04Å; H253-Q257 PolarHBondContact NE2-NE2 3.35Å; H253-Q257 WeakPolarHBondContact O-CG 3.39Å; H253-Q257 PolarHBondContact O-N 3.02Å
254	E	92.1	Very high	79.2	Confident	131 Å²	131	88.2 Å²	88.2	61%	0.612	48%	0.479	S	S	*	.	H	α-helix	trans	-61.5	-46.9	176.9	-71.3	170.5	-165.9	0	0	112.4	S250 I252 F256 Q257	S250-E254 WeakPolarHBondContact O-CG 3.31Å; S250-E254 PolarHBondContact O-N 3.34Å; I252-E254 VanDerWaalsContact C-N 3.3Å; I252-E254 PolarHBondContact O-N 2.92Å; E254-F256 PolarHBondContact O-N 3.41Å; E254-F256 VanDerWaalsContact O-N 3.14Å; E254-Q257 PolarHBondContact O-N 3.39Å; E254-Q257 VanDerWaalsContact O-N 3.16Å
255	A	87.9	Confident	76.9	Confident	65 Å²	65	88.5 Å²	88.5	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-62	-22.1	178.8	0	0	0	0	0	114.1	G251 I252	G251-A255 VanDerWaalsContact O-CB 3.3Å; G251-A255 WeakPolarHBondContact O-CB 3.44Å; G251-A255 PolarHBondContact O-N 3.27Å; G251-A255 VanDerWaalsContact O-N 3.12Å; I252-A255 PolarHBondContact O-N 3.36Å
256	F	83.9	Confident	74.6	Confident	35 Å²	35	93.7 Å²	93.7	15%	0.154	52%	0.523	C	S	.	.	H	α-helix	trans	-109.6	2.4	177.9	-66.5	-82.9	0	0	0	114.2	K108 N111 M112 A115 I252 H253 E254 H259	K108-F256 HydrophobicContact CD-CD1 4.37Å; K108-F256 HydrophobicContact CD-CE1 4.44Å; K108-F256 VanDerWaalsContact CE-CD1 3.48Å; K108-F256 HydrophobicContact CG-CD1 3.95Å; K108-F256 HydrophobicContact CG-CE1 3.68Å; K108-F256 WeakPolarHBondContact O-CE1 3.48Å; N111-F256 HydrophobicContact CB-CE1 4.39Å; N111-F256 HydrophobicContact CB-CZ 4.21Å; M112-F256 HydrophobicContact CB-CD1 3.83Å; M112-F256 HydrophobicContact CB-CD2 4.2Å; M112-F256 HydrophobicContact CB-CE1 3.58Å; M112-F256 HydrophobicContact CB-CE2 3.99Å; M112-F256 HydrophobicContact CB-CG 4.17Å; M112-F256 HydrophobicContact CB-CZ 3.69Å; M112-F256 HydrophobicContact CG-CD1 4.06Å; M112-F256 HydrophobicContact CG-CD2 3.85Å; M112-F256 HydrophobicContact CG-CE1 4.23Å; M112-F256 HydrophobicContact CG-CE2 4.04Å; M112-F256 HydrophobicContact CG-CG 3.9Å; M112-F256 HydrophobicContact CG-CZ 4.25Å; M112-F256 HydrophobicContact SD-CB 4.24Å; M112-F256 HydrophobicContact SD-CD1 4.26Å; M112-F256 HydrophobicContact SD-CG 4.09Å; A115-F256 HydrophobicContact CB-CE2 4.36Å; I252-F256 HydrophobicContact CG2-CD2 3.94Å; I252-F256 HydrophobicContact CG2-CE2 4.25Å; I252-F256 VanDerWaalsContact O-CD2 3.27Å; I252-F256 WeakPolarHBondContact O-CD2 3.43Å; I252-F256 PolarHBondContact O-N 3.3Å; I252-F256 VanDerWaalsContact O-N 3.14Å; H253-F256 CarbonylContact O-C 3.57Å; H253-F256 PolarHBondContact O-N 3.04Å; E254-F256 PolarHBondContact O-N 3.41Å; E254-F256 VanDerWaalsContact O-N 3.14Å; F256-H259 PolarHBondContact O-N 2.99Å
257	Q	77.1	Confident	72.5	Confident	126 Å²	126	94.8 Å²	94.8	59%	0.589	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	144.8	167.4	-75.6	-158.4	4.1	0	0	110.7	H253 E254 H259	H253-Q257 PolarHBondContact NE2-NE2 3.35Å; H253-Q257 WeakPolarHBondContact O-CG 3.39Å; H253-Q257 PolarHBondContact O-N 3.02Å; E254-Q257 PolarHBondContact O-N 3.39Å; E254-Q257 VanDerWaalsContact O-N 3.16Å; Q257-H259 VanDerWaalsContact C-N 3.29Å; Q257-H259 PolarHBondContact O-N 3.44Å
258	G	64.8	Low	70.5	Confident	74 Å²	74	98.4 Å²	98.4	76%	0.763	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	10.2	-175.9	0	0	0	0	0	115.3	I260	G258-I260 PolarHBondContact O-N 3.37Å
259	H	62.9	Low	68.4	Low	89 Å²	89	104.9 Å²	104.9	41%	0.412	55%	0.554	S	S	.	*			trans	-67.4	103.9	166	-159.7	-37.1	0	0	0	109.8	K108 F256 Q257 P261	K108-H259 WeakPolarHBondContact CB-NE2 3.19Å; K108-H259 VanDerWaalsContact CD-CD2 3.44Å; K108-H259 WeakPolarHBondContact CD-CD2 3.42Å; F256-H259 PolarHBondContact O-N 2.99Å; Q257-H259 VanDerWaalsContact C-N 3.29Å; Q257-H259 PolarHBondContact O-N 3.44Å; H259-P261 WeakPolarHBondContact O-CD 3.48Å
260	I	56.8	Low	66.4	Low	136 Å²	136	106.9 Å²	106.9	70%	0.697	57%	0.566	S	S	*	*			trans	-62.4	120.1	171.1	-54.4	174.4	0	0	0	106.7	G258	G258-I260 PolarHBondContact O-N 3.37Å
261	P	53.5	Low	64.3	Low	97 Å²	97	108.5 Å²	108.5	63%	0.63	56%	0.563	S	S	*	*			trans	-62.9	146.7	169.8	28.2	-33.6	0	0	0	108.1	H259 Q263	H259-P261 WeakPolarHBondContact O-CD 3.48Å; P261-Q263 PolarHBondContact O-N 2.99Å
262	Y	50.1	Low	62.6	Low	225 Å²	225	111.2 Å²	111.2	88%	0.882	57%	0.569	S	S	*	*			trans	-68.5	75.9	-173.1	-157.6	-86.2	0	0	0	111.5	F264	Y262-F264 PolarHBondContact O-N 3.25Å
263	Q	41.4	Very low	60.8	Low	83 Å²	83	114 Å²	114	39%	0.388	59%	0.589	S	S	.	*			trans	-65.8	132.1	170.5	-84.1	-167	-24.2	0	0	108.3	P261 T265 E275	P261-Q263 PolarHBondContact O-N 2.99Å; Q263-T265 PolarHBondContact O-N 2.88Å; Q263-E275 PolarHBondContact NE2-OE1 3.35Å; Q263-E275 PolarHBondContact NE2-OE2 3.4Å
264	F	43.1	Very low	58.9	Low	139 Å²	139	114.5 Å²	114.5	61%	0.61	60%	0.595	S	S	*	*			trans	-72.6	73.2	-174.7	-154	-91	0	0	0	111.1	Y262 T266 I267	Y262-F264 PolarHBondContact O-N 3.25Å; F264-T266 PolarHBondContact O-N 3.45Å; F264-I267 HydrophobicContact CD1-CB 4.44Å; F264-I267 HydrophobicContact CD1-CG1 4.29Å; F264-I267 HydrophobicContact CE1-CD1 3.85Å; F264-I267 HydrophobicContact CE1-CG1 3.93Å; F264-I267 PolarHBondContact O-N 3.17Å
265	T	46.9	Very low	57.2	Low	115 Å²	115	111.7 Å²	111.7	71%	0.706	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-10.6	-177	38.5	0	0	0	0	114.1	Q263 I267	Q263-T265 PolarHBondContact O-N 2.88Å; T265-I267 VanDerWaalsContact C-N 3.34Å; T265-I267 PolarHBondContact O-N 2.94Å
266	T	47.8	Very low	55.6	Low	117 Å²	117	114 Å²	114	72%	0.718	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-21.2	179.4	-39.9	0	0	0	0	113.8	F264	F264-T266 PolarHBondContact O-N 3.45Å
267	I	53.7	Low	54.3	Low	69 Å²	69	117 Å²	117	35%	0.354	60%	0.598	S	S	.	*			trans	-134	86.5	178.1	-50.4	174.7	0	0	0	110.9	F264 T265 H269 L270	F264-I267 HydrophobicContact CD1-CB 4.44Å; F264-I267 HydrophobicContact CD1-CG1 4.29Å; F264-I267 HydrophobicContact CE1-CD1 3.85Å; F264-I267 HydrophobicContact CE1-CG1 3.93Å; F264-I267 PolarHBondContact O-N 3.17Å; T265-I267 VanDerWaalsContact C-N 3.34Å; T265-I267 PolarHBondContact O-N 2.94Å; I267-H269 HydrophobicContact CG2-CB 4.13Å; I267-H269 PolarHBondContact O-N 3.43Å; I267-H269 VanDerWaalsContact O-N 3.08Å; I267-L270 HydrophobicContact CB-CB 4.37Å; I267-L270 HydrophobicContact CB-CD1 4.28Å; I267-L270 HydrophobicContact CD1-CD1 3.88Å; I267-L270 HydrophobicContact CG2-CB 3.98Å; I267-L270 HydrophobicContact CG2-CD1 3.88Å; I267-L270 HydrophobicContact CG2-CG 3.81Å; I267-L270 PolarHBondContact O-N 2.9Å; I267-L270 VanDerWaalsContact O-N 3.1Å
268	K	54	Low	53	Low	180 Å²	180	114 Å²	114	78%	0.783	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-53.5	-26.1	170.5	-66.2	-175.5	177	-175.8	0	113.3	L270	K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 3.44Å
269	H	51.8	Low	52.7	Low	182 Å²	182	113.5 Å²	113.5	84%	0.843	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-82.9	3.1	-179.9	-64.5	-73.8	0	0	0	115.4	I267	I267-H269 HydrophobicContact CG2-CB 4.13Å; I267-H269 PolarHBondContact O-N 3.43Å; I267-H269 VanDerWaalsContact O-N 3.08Å
270	L	51.8	Low	52.2	Low	137 Å²	137	112.5 Å²	112.5	72%	0.717	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-120	12.2	175	-77.1	173.3	0	0	0	112.8	I267 K268	I267-L270 HydrophobicContact CB-CB 4.37Å; I267-L270 HydrophobicContact CB-CD1 4.28Å; I267-L270 HydrophobicContact CD1-CD1 3.88Å; I267-L270 HydrophobicContact CG2-CB 3.98Å; I267-L270 HydrophobicContact CG2-CD1 3.88Å; I267-L270 HydrophobicContact CG2-CG 3.81Å; I267-L270 PolarHBondContact O-N 2.9Å; I267-L270 VanDerWaalsContact O-N 3.1Å; K268-L270 VanDerWaalsContact C-N 3.33Å; K268-L270 PolarHBondContact O-N 3.44Å
271	R	53	Low	52.1	Low	91 Å²	91	112.2 Å²	112.2	34%	0.343	57%	0.572	S	S	.	*	S	Bend	trans	-66.7	132.4	170.7	174.7	148.6	-81.9	165.4	-0.8	109.2	E275 E276	R271-E275 HydrophobicContact CG-CB 3.93Å; R271-E275 IonicContact CZ-OE2 3.6Å; R271-E275 IonicContact NE-OE2 2.82Å; R271-E275 PolarHBondContact NE-OE2 2.81Å; R271-E275 IonicContact NH2-OE2 3.67Å; R271-E275 PolarHBondContact NH2-OE2 2.94Å; R271-E276 HydrophobicContact CG-CG 4Å
272	D	57.8	Low	52.1	Low	94 Å²	94	115 Å²	115	50%	0.503	57%	0.574	S	S	.	*			trans	-61.5	127.2	174.8	-169.4	-29	0	0	0	108.9	L274 E275	D272-L274 PolarHBondContact O-N 2.86Å; D272-L274 PolarHBondContact OD1-N 3.24Å; D272-E275 WeakPolarHBondContact O-CB 3.48Å; D272-E275 PolarHBondContact O-N 3.38Å
273	P	55	Low	52.2	Low	88 Å²	88	110.2 Å²	110.2	57%	0.571	56%	0.56	S	S	*	*	H	α-helix	trans	-54	-21.9	179.2	-29.3	36.7	0	0	0	114.7	I277	P273-I277 WeakPolarHBondContact O-CG1 3.21Å
274	L	52.3	Low	52.8	Low	131 Å²	131	111.9 Å²	111.9	69%	0.686	57%	0.568	S	S	*	*	H	α-helix	trans	-71.8	-29.1	171.7	-81.3	96.2	0	0	0	114	D272 S278	D272-L274 PolarHBondContact O-N 2.86Å; D272-L274 PolarHBondContact OD1-N 3.24Å; L274-S278 PolarHBondContact O-N 3.44Å
275	E	54.5	Low	53.3	Low	73 Å²	73	112.8 Å²	112.8	34%	0.341	57%	0.571	S	S	.	*	H	α-helix	trans	-67.1	-39.4	175.4	-76.6	-158.8	148	0	0	111.1	Q263 R271 D272 I277 S278 V279	Q263-E275 PolarHBondContact NE2-OE1 3.35Å; Q263-E275 PolarHBondContact NE2-OE2 3.4Å; R271-E275 HydrophobicContact CG-CB 3.93Å; R271-E275 IonicContact CZ-OE2 3.6Å; R271-E275 IonicContact NE-OE2 2.82Å; R271-E275 PolarHBondContact NE-OE2 2.81Å; R271-E275 IonicContact NH2-OE2 3.67Å; R271-E275 PolarHBondContact NH2-OE2 2.94Å; D272-E275 WeakPolarHBondContact O-CB 3.48Å; D272-E275 PolarHBondContact O-N 3.38Å; E275-I277 PolarHBondContact O-N 3.04Å; E275-S278 PolarHBondContact O-N 2.74Å; E275-S278 VanDerWaalsContact O-N 3.15Å; E275-S278 PolarHBondContact O-OG 2.79Å; E275-V279 WeakPolarHBondContact O-CG2 3.48Å; E275-V279 PolarHBondContact O-N 3.06Å; E275-V279 VanDerWaalsContact O-N 3.07Å
276	E	56	Low	53.6	Low	113 Å²	113	112.9 Å²	112.9	53%	0.528	57%	0.567	S	S	.	*	H	α-helix	trans	-60.9	-45.5	179.5	-62.3	-167.6	143.5	0	0	111.5	R271 S278 V279 S280	R271-E276 HydrophobicContact CG-CG 4Å; E276-S278 VanDerWaalsContact C-N 3.27Å; E276-S278 PolarHBondContact O-N 3.02Å; E276-V279 PolarHBondContact O-N 2.89Å; E276-V279 VanDerWaalsContact O-N 3.17Å; E276-S280 PolarHBondContact O-N 3.3Å; E276-S280 PolarHBondContact O-OG 3.03Å
277	I	55.9	Low	53.8	Low	97 Å²	97	113.1 Å²	113.1	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-59.2	-39.4	176.2	-59.8	166.8	0	0	0	111	P273 E275 Q281	P273-I277 WeakPolarHBondContact O-CG1 3.21Å; E275-I277 PolarHBondContact O-N 3.04Å; I277-Q281 WeakPolarHBondContact O-CB 3.22Å; I277-Q281 VanDerWaalsContact O-CG 3.29Å; I277-Q281 WeakPolarHBondContact O-CG 3.39Å; I277-Q281 PolarHBondContact O-N 3.24Å; I277-Q281 VanDerWaalsContact O-N 3.11Å
278	S	50.2	Low	53.9	Low	63 Å²	63	116.3 Å²	116.3	44%	0.441	57%	0.572	S	S	.	*	H	α-helix	trans	-70.5	-28.5	179.9	80.6	0	0	0	0	114	L274 E275 E276	L274-S278 PolarHBondContact O-N 3.44Å; E275-S278 PolarHBondContact O-N 2.74Å; E275-S278 VanDerWaalsContact O-N 3.15Å; E275-S278 PolarHBondContact O-OG 2.79Å; E276-S278 VanDerWaalsContact C-N 3.27Å; E276-S278 PolarHBondContact O-N 3.02Å
279	V	57	Low	53.8	Low	64 Å²	64	110.1 Å²	110.1	39%	0.388	56%	0.555	S	S	.	*	H	α-helix	trans	-79	-47.8	176.5	174.5	0	0	0	0	110	E275 E276 Q281 K282 E283	E275-V279 WeakPolarHBondContact O-CG2 3.48Å; E275-V279 PolarHBondContact O-N 3.06Å; E275-V279 VanDerWaalsContact O-N 3.07Å; E276-V279 PolarHBondContact O-N 2.89Å; E276-V279 VanDerWaalsContact O-N 3.17Å; V279-Q281 VanDerWaalsContact C-N 3.28Å; V279-Q281 PolarHBondContact O-N 2.95Å; V279-K282 WeakPolarHBondContact O-CA 3.47Å; V279-K282 WeakPolarHBondContact O-CB 3.24Å; V279-K282 PolarHBondContact O-N 2.88Å; V279-E283 HydrophobicContact CG1-CG 4.48Å; V279-E283 PolarHBondContact O-N 3.18Å
280	S	52.9	Low	54	Low	68 Å²	68	110.9 Å²	110.9	48%	0.476	55%	0.55	S	S	.	.	H	α-helix	trans	-60.2	-35.6	177.4	-58.5	0	0	0	0	112.8	E276 K282 E283 E284	E276-S280 PolarHBondContact O-N 3.3Å; E276-S280 PolarHBondContact O-OG 3.03Å; S280-K282 VanDerWaalsContact C-N 3.29Å; S280-K282 PolarHBondContact O-N 2.7Å; S280-E283 PolarHBondContact O-N 3.34Å; S280-E284 PolarHBondContact O-N 2.89Å
281	Q	54.3	Low	54	Low	131 Å²	131	109.9 Å²	109.9	61%	0.612	54%	0.542	S	S	*	.	H	α-helix	trans	-68.2	-23.1	173.9	-76	179.8	3.5	0	0	114.3	I277 V279	I277-Q281 WeakPolarHBondContact O-CB 3.22Å; I277-Q281 VanDerWaalsContact O-CG 3.29Å; I277-Q281 WeakPolarHBondContact O-CG 3.39Å; I277-Q281 PolarHBondContact O-N 3.24Å; I277-Q281 VanDerWaalsContact O-N 3.11Å; V279-Q281 VanDerWaalsContact C-N 3.28Å; V279-Q281 PolarHBondContact O-N 2.95Å
282	K	54.1	Low	53.7	Low	156 Å²	156	109.6 Å²	109.6	68%	0.678	55%	0.553	S	S	*	*	H	α-helix	trans	-79.6	-44	171	-93.7	-179.2	172.4	178.4	0	111.2	V279 S280 K285 D286	V279-K282 WeakPolarHBondContact O-CA 3.47Å; V279-K282 WeakPolarHBondContact O-CB 3.24Å; V279-K282 PolarHBondContact O-N 2.88Å; S280-K282 VanDerWaalsContact C-N 3.29Å; S280-K282 PolarHBondContact O-N 2.7Å; K282-K285 WeakPolarHBondContact O-CB 3.26Å; K282-K285 PolarHBondContact O-N 2.86Å; K282-K285 VanDerWaalsContact O-N 3.1Å; K282-D286 PolarHBondContact O-N 2.62Å; K282-D286 VanDerWaalsContact O-N 3.13Å
283	E	53.5	Low	53.2	Low	123 Å²	123	111.3 Å²	111.3	58%	0.575	56%	0.562	S	S	*	*	H	α-helix	trans	-62.2	-45.3	179.3	-68.9	177.7	162.1	0	0	111.6	V279 S280 K285 D286 E287	V279-E283 HydrophobicContact CG1-CG 4.48Å; V279-E283 PolarHBondContact O-N 3.18Å; S280-E283 PolarHBondContact O-N 3.34Å; E283-K285 PolarHBondContact O-N 3.4Å; E283-K285 VanDerWaalsContact O-N 3.14Å; E283-D286 PolarHBondContact O-N 2.86Å; E283-E287 WeakPolarHBondContact O-CB 3.47Å; E283-E287 PolarHBondContact O-N 3.36Å
284	E	53.6	Low	52.8	Low	118 Å²	118	112.1 Å²	112.1	55%	0.551	57%	0.566	S	S	*	*	H	α-helix	trans	-57.3	-29.9	173.3	-81.3	-160	163.4	0	0	113.6	S280 K288	S280-E284 PolarHBondContact O-N 2.89Å; E284-K288 WeakPolarHBondContact O-CB 3.38Å; E284-K288 WeakPolarHBondContact O-CG 3.39Å; E284-K288 PolarHBondContact O-N 3.39Å; E284-K288 VanDerWaalsContact O-N 3.14Å; E284-K288 IonicContact OE2-NZ 3.24Å
285	K	53.7	Low	52.3	Low	159 Å²	159	113.4 Å²	113.4	69%	0.691	57%	0.574	S	S	*	*	H	α-helix	trans	-79.6	-38.5	-176.4	-161	176.9	-177	-177.6	0	111.6	K282 E283 A289	K282-K285 WeakPolarHBondContact O-CB 3.26Å; K282-K285 PolarHBondContact O-N 2.86Å; K282-K285 VanDerWaalsContact O-N 3.1Å; E283-K285 PolarHBondContact O-N 3.4Å; E283-K285 VanDerWaalsContact O-N 3.14Å; K285-A289 PolarHBondContact O-N 2.91Å
286	D	52.1	Low	51.8	Low	116 Å²	116	114.9 Å²	114.9	62%	0.62	59%	0.592	S	S	*	*	H	α-helix	trans	-72.7	-31.6	172.3	-77.4	-17.1	0	0	0	111.8	K282 E283 A289 R290	K282-D286 PolarHBondContact O-N 2.62Å; K282-D286 VanDerWaalsContact O-N 3.13Å; E283-D286 PolarHBondContact O-N 2.86Å; D286-A289 PolarHBondContact O-N 2.85Å; D286-R290 PolarHBondContact O-N 2.85Å; D286-R290 VanDerWaalsContact O-N 3.13Å
287	E	53.4	Low	51.3	Low	123 Å²	123	117.3 Å²	117.3	58%	0.575	61%	0.608	S	S	*	*	H	α-helix	trans	-69.3	-43.3	176.3	-143.8	177.6	-166.3	0	0	112	E283 A289 R290 Q291	E283-E287 WeakPolarHBondContact O-CB 3.47Å; E283-E287 PolarHBondContact O-N 3.36Å; E287-A289 VanDerWaalsContact C-N 3.3Å; E287-A289 PolarHBondContact O-N 3.47Å; E287-R290 PolarHBondContact O-N 3.35Å; E287-Q291 PolarHBondContact O-N 3.28Å
288	K	54.8	Low	50.3	Low	135 Å²	135	119.7 Å²	119.7	59%	0.587	63%	0.626	S	S	*	*	H	α-helix	trans	-61.5	-35.2	172	-80.5	170.4	179.2	152.6	0	112.9	E284 R290 S292	E284-K288 WeakPolarHBondContact O-CB 3.38Å; E284-K288 WeakPolarHBondContact O-CG 3.39Å; E284-K288 PolarHBondContact O-N 3.39Å; E284-K288 VanDerWaalsContact O-N 3.14Å; E284-K288 IonicContact OE2-NZ 3.24Å; K288-R290 VanDerWaalsContact C-N 3.28Å; K288-R290 PolarHBondContact O-N 3.2Å; K288-S292 PolarHBondContact O-N 3.05Å
289	A	52.7	Low	49.4	Very low	51 Å²	51	121 Å²	121	42%	0.421	64%	0.635	S	S	.	*	H	α-helix	trans	-71.6	-19.5	174.7	0	0	0	0	0	113.5	K285 D286 E287 S292 N293	K285-A289 PolarHBondContact O-N 2.91Å; D286-A289 PolarHBondContact O-N 2.85Å; E287-A289 VanDerWaalsContact C-N 3.3Å; E287-A289 PolarHBondContact O-N 3.47Å; A289-S292 PolarHBondContact O-OG 3.4Å; A289-N293 PolarHBondContact O-ND2 3.28Å
290	R	54.7	Low	48.2	Very low	197 Å²	197	124.7 Å²	124.7	74%	0.743	65%	0.653	S	S	*	*	H	α-helix	trans	-85.9	-39.7	173	-75.9	-177.4	168.3	-162.5	-4.1	112.5	D286 E287 K288 S292 N293	D286-R290 PolarHBondContact O-N 2.85Å; D286-R290 VanDerWaalsContact O-N 3.13Å; E287-R290 PolarHBondContact O-N 3.35Å; K288-R290 VanDerWaalsContact C-N 3.28Å; K288-R290 PolarHBondContact O-N 3.2Å; R290-S292 VanDerWaalsContact C-N 3.33Å; R290-S292 PolarHBondContact O-N 3.2Å; R290-N293 PolarHBondContact O-N 2.99Å
291	Q	51.6	Low	47.3	Very low	117 Å²	117	128.3 Å²	128.3	55%	0.547	67%	0.667	S	S	.	*	H	α-helix	trans	-65.6	-31.7	178.6	-74	170.5	-9.8	0	0	113.2	E287 N293 T294	E287-Q291 PolarHBondContact O-N 3.28Å; Q291-N293 PolarHBondContact O-N 2.89Å; Q291-T294 PolarHBondContact O-N 2.91Å; Q291-T294 PolarHBondContact O-OG1 3.12Å
292	S	47.9	Very low	46.4	Very low	84 Å²	84	129 Å²	129	59%	0.587	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-14.5	175.9	65.8	0	0	0	0	114.5	K288 A289 R290	K288-S292 PolarHBondContact O-N 3.05Å; A289-S292 PolarHBondContact O-OG 3.4Å; R290-S292 VanDerWaalsContact C-N 3.33Å; R290-S292 PolarHBondContact O-N 3.2Å
293	N	47.6	Very low	45.3	Very low	130 Å²	130	128.7 Å²	128.7	70%	0.695	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-3.8	-177.6	-73.8	-55	0	0	0	113.5	A289 R290 Q291	A289-N293 PolarHBondContact O-ND2 3.28Å; R290-N293 PolarHBondContact O-N 2.99Å; Q291-N293 PolarHBondContact O-N 2.89Å
294	T	45.1	Very low	44.5	Very low	105 Å²	105	131.2 Å²	131.2	64%	0.644	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-16.2	-178	46	0	0	0	0	114.8	Q291 S296	Q291-T294 PolarHBondContact O-N 2.91Å; Q291-T294 PolarHBondContact O-OG1 3.12Å; T294-S296 PolarHBondContact O-N 2.77Å
295	D	43.4	Very low	43.7	Very low	158 Å²	158	131.5 Å²	131.5	85%	0.845	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	7	-176.7	-87.9	-0.9	0	0	0	114.9
296	S	43	Very low	42.7	Very low	105 Å²	105	127.8 Å²	127.8	73%	0.734	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	32.8	-171.5	-171.6	0	0	0	0	114.7	T294	T294-S296 PolarHBondContact O-N 2.77Å
297	L	45.8	Very low	41.6	Very low	163 Å²	163	131.2 Å²	131.2	85%	0.853	71%	0.712	S	S	*	*			trans	-154.7	71.3	175.3	-125.8	157	0	0	0	116.6
298	V	34.2	Very low	40.6	Very low	147 Å²	147	130.3 Å²	130.3	89%	0.891	72%	0.72	S	S	*	*			trans	-150.5	128.4	165.2	-177.6	0	0	0	0	106.1
299	S	31	Very low	39.4	Very low	90 Å²	90	128.6 Å²	128.6	63%	0.629	73%	0.731	S	S	*	*			cis	-159.8	155	4.1	68.9	0	0	0	0	113.4
300	L	33.2	Very low	38.5	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	74%	0.742	S	S	*	*			trans	63.6	123.8	147.4	-61.4	163.7	0	0	0	118.7
301	D	32.8	Very low	37.4	Very low	144 Å²	144	128.9 Å²	128.9	77%	0.77	75%	0.748	S	S	*	*				58.6	123.7	79.4	-73	-46.6	0	0	0	112.4
302	D	35.5	Very low	36.5	Very low	144 Å²	144	128 Å²	128	77%	0.77	75%	0.754	S	S	*	*				-164.6	179.5	51	-147	-36	0	0	0	113.5
303	D	32.2	Very low	35.6	Very low	151 Å²	151	130.4 Å²	130.4	81%	0.807	76%	0.76	S	S	*	*			trans	87.2	147.7	150.2	-101.1	-41.6	0	0	0	124.8
304	K	35.5	Very low	34.9	Very low	176 Å²	176	131.5 Å²	131.5	77%	0.765	77%	0.765	S	S	*	*			trans	-134.2	143.2	-162.8	-170.2	-163.9	-177	179.6	0	111.5
305	P	38	Very low	34.2	Very low	124 Å²	124	135.8 Å²	135.8	81%	0.805	78%	0.775	S	S	*	*				-143.4	144.7	113.1	22.3	-1.2	0	0	0	112.2
306	A	32.7	Very low	33.5	Very low	80 Å²	80	135.4 Å²	135.4	66%	0.661	77%	0.772	S	S	*	*				83	103.4	54.8	0	0	0	0	0	115.5
307	E	29.1	Very low	32.9	Very low	188 Å²	188	135.5 Å²	135.5	88%	0.879	77%	0.773	S	S	*	*			trans	149.5	153	155.2	-88.6	-168.2	166.8	0	0	110
308	S	31	Very low	32.2	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	76%	0.763	S	S	*	*			cis	-171.4	156.4	-29.6	-99.9	0	0	0	0	109.9
309	A	31	Very low	31.9	Very low	98 Å²	98	133 Å²	133	81%	0.81	76%	0.762	S	S	*	*			trans	69.1	151.9	167.2	0	0	0	0	0	119.3
310	S	33.2	Very low	31.8	Very low	96 Å²	96	132.2 Å²	132.2	67%	0.671	77%	0.769	S	S	*	*			cis	-172.1	148.7	-20.3	-94	0	0	0	0	111.1
311	N	31.7	Very low	31.8	Very low	159 Å²	159	134 Å²	134	85%	0.85	77%	0.774	S	S	*	*			trans	64.3	149.8	153.7	-63.3	-6.2	0	0	0	119.2
312	S	33.1	Very low	31.6	Very low	97 Å²	97	132 Å²	132	68%	0.678	77%	0.771	S	S	*	*			cis	-158.7	177.9	-3.7	48.1	0	0	0	0	112.8
313	D	29.5	Very low	31.4	Very low	135 Å²	135	134.5 Å²	134.5	72%	0.722	78%	0.775	S	S	*	*			trans	87.3	78.7	151.5	-56.5	-46.6	0	0	0	123.3
314	L	31.8	Very low	31.2	Very low	153 Å²	153	132 Å²	132	80%	0.801	78%	0.776	S	S	*	*				26.8	114.7	117.2	-62.5	174.1	0	0	0	122
315	K	30	Very low	30.8	Very low	196 Å²	196	127 Å²	127	85%	0.852	77%	0.773	S	S	*	*				-168.9	119.7	120.2	-114.6	171	177.1	174.9	0	109.2
316	L	29.4	Very low	30.5	Very low	149 Å²	149	130 Å²	130	78%	0.78	78%	0.777	S	S	*	*				44.5	122.7	77.7	-78.5	154.3	0	0	0	112
317	S	30.4	Very low	30.4	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	79%	0.787	S	S	*	*			cis	-159.3	175.6	18	-127.2	0	0	0	0	108.1
318	S	30.5	Very low	30.4	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	78%	0.782	S	S	*	*			cis	-160.1	166.9	0.7	49.7	0	0	0	0	109.3
319	D	28.7	Very low	30.7	Very low	163 Å²	163	129.6 Å²	129.6	87%	0.872	78%	0.783	S	S	*	*			trans	7.9	142.3	147.6	-50.8	-31.2	0	0	0	119.4
320	G	29.6	Very low	30.7	Very low	75 Å²	75	132.7 Å²	132.7	77%	0.773	78%	0.78	S	S	*	*			cis	148.2	168.3	17.7	0	0	0	0	0	106.2
321	Q	32.2	Very low	30.6	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	78%	0.782	S	S	*	*			cis	179.8	136	2.1	166.3	178.1	61.5	0	0	104.5
322	S	28.7	Very low	30.5	Very low	103 Å²	103	134 Å²	134	72%	0.72	78%	0.779	S	S	*	*			trans	66.9	156.1	166.7	78.7	0	0	0	0	117.5
323	K	31.1	Very low	30.9	Very low	197 Å²	197	140.9 Å²	140.9	86%	0.857	79%	0.79	S	S	*	*			cis	-155.2	171.7	17.3	-143.9	161.1	-170.5	178.5	0	111.7
324	A	27.4	Very low	30.9	Very low	99 Å²	99	137.7 Å²	137.7	82%	0.818	79%	0.789	S	S	*	*			trans	-47.6	162.7	173.7	0	0	0	0	0	115.6
325	G	28.6	Very low	31	Very low	69 Å²	69	139 Å²	139	71%	0.711	80%	0.795	S	S	*	*			cis	165.8	-177.5	0.7	0	0	0	0	0	112.7
326	E	30.1	Very low	31.3	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	80%	0.797	S	S	*	*			trans	60.4	114	160.2	-60.1	-173	149.9	0	0	122.4
327	S	31.8	Very low	31.4	Very low	124 Å²	124	131.9 Å²	131.9	87%	0.867	79%	0.794	S	S	*	*				37	120.2	129.7	-58.3	0	0	0	0	124.1
328	A	29.6	Very low	31.7	Very low	94 Å²	94	134.8 Å²	134.8	78%	0.777	80%	0.801	S	S	*	*				173.1	100.8	128.4	0	0	0	0	0	109.4
329	I	35.7	Very low	32.1	Very low	146 Å²	146	135.1 Å²	135.1	75%	0.749	80%	0.803	S	S	*	*				26.1	126.7	94.9	-24.5	-174.3	0	0	0	117.5
330	H	32.5	Very low	32.9	Very low	163 Å²	163	130.5 Å²	130.5	76%	0.755	79%	0.794	S	S	*	*			trans	64.6	127.7	171.2	-71.5	-71.4	0	0	0	115.7
331	D	30.6	Very low	33.2	Very low	132 Å²	132	133.9 Å²	133.9	71%	0.706	79%	0.794	S	S	*	*			cis	-173.1	-165.3	38.3	-128.2	5.1	0	0	0	112.1
332	L	29.9	Very low	33.3	Very low	150 Å²	150	132.1 Å²	132.1	79%	0.785	79%	0.791	S	S	*	*			trans	87.6	116.5	168.6	-49.4	175.9	0	0	0	115.5
333	R	40.8	Very low	33.7	Very low	242 Å²	242	134.7 Å²	134.7	91%	0.913	80%	0.796	S	S	*	*			cis	60	75.7	42.9	-161	-171.1	-172	-178.5	3.5	112.6
334	G	29.7	Very low	33.9	Very low	68 Å²	68	132.5 Å²	132.5	70%	0.701	79%	0.79	S	S	*	*			trans	178	73.8	173.2	0	0	0	0	0	115.2
335	L	33.1	Very low	34.4	Very low	179 Å²	179	134.7 Å²	134.7	94%	0.937	79%	0.788	S	S	*	*			trans	-140.1	63.5	157.5	-74.9	-177.3	0	0	0	110.3
336	S	37.6	Very low	34.8	Very low	128 Å²	128	140.1 Å²	140.1	90%	0.895	80%	0.796	S	S	*	*			trans	-101.2	92.7	147.3	57.5	0	0	0	0	106.5
337	G	30.8	Very low	35	Very low	69 Å²	69	135.3 Å²	135.3	71%	0.711	79%	0.789	S	S	*	*			trans	-130.6	118	179.2	0	0	0	0	0	108.4
338	D	37.4	Very low	35.1	Very low	168 Å²	168	135.7 Å²	135.7	90%	0.898	79%	0.79	S	S	*	*			trans	-62.1	135.3	179.7	-175.5	25	0	0	0	111.5
339	S	37.3	Very low	35.1	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	79%	0.79	S	S	*	*			trans	-158.3	93.2	166.4	-166.5	0	0	0	0	107.5	D341	S339-D341 PolarHBondContact O-N 2.99Å
340	G	46	Very low	35.1	Very low	66 Å²	66	136.3 Å²	136.3	68%	0.68	80%	0.796	S	S	*	*			trans	-69.8	125.8	169.3	0	0	0	0	0	110.3
341	D	36.9	Very low	35.2	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	80%	0.795	S	S	*	*			trans	-142.9	116.4	163.6	-91.6	-40	0	0	0	109.6	S339	S339-D341 PolarHBondContact O-N 2.99Å
342	D	33.5	Very low	35.6	Very low	143 Å²	143	133 Å²	133	77%	0.765	80%	0.797	S	S	*	*			trans	24.1	92	161.2	-72.6	-10.6	0	0	0	120.4	M344	D342-M344 HydrophobicContact CB-CG 4.15Å; D342-M344 PolarHBondContact O-N 2.9Å
343	L	37.7	Very low	35.7	Very low	156 Å²	156	132 Å²	132	82%	0.817	80%	0.799	S	S	*	*			trans	-80.9	64.7	160.7	-152	165.1	0	0	0	110.7	L345	L343-L345 HydrophobicContact CD2-CD1 3.78Å; L343-L345 PolarHBondContact O-N 3.48Å; L343-L345 VanDerWaalsContact O-N 3.17Å
344	M	35	Very low	35.2	Very low	152 Å²	152	126.5 Å²	126.5	75%	0.749	79%	0.792	S	S	*	*			trans	-77.6	99.2	177.8	-75.2	-67	-83.7	0	0	111.7	D342 M346	D342-M344 HydrophobicContact CB-CG 4.15Å; D342-M344 PolarHBondContact O-N 2.9Å; M344-M346 PolarHBondContact O-N 3.2Å
345	L	38.3	Very low	35.2	Very low	145 Å²	145	130.2 Å²	130.2	76%	0.759	80%	0.796	S	S	*	*			trans	-62.4	113.1	163.6	-100.1	99.2	0	0	0	109.7	L343 A347	L343-L345 HydrophobicContact CD2-CD1 3.78Å; L343-L345 PolarHBondContact O-N 3.48Å; L343-L345 VanDerWaalsContact O-N 3.17Å; L345-A347 VanDerWaalsContact C-N 3.26Å; L345-A347 PolarHBondContact O-N 2.95Å
346	M	36.2	Very low	34.9	Very low	182 Å²	182	127.7 Å²	127.7	90%	0.897	79%	0.789	S	S	*	*			trans	-72.5	82.7	166.5	-78	-71.8	-81.1	0	0	110.2	M344	M344-M346 PolarHBondContact O-N 3.2Å
347	A	34.7	Very low	35	Very low	88 Å²	88	127 Å²	127	73%	0.727	78%	0.781	S	S	*	*			trans	-71	121.9	163.1	0	0	0	0	0	109.3	L345 G349	L345-A347 VanDerWaalsContact C-N 3.26Å; L345-A347 PolarHBondContact O-N 2.95Å; A347-G349 PolarHBondContact O-N 3.46Å; A347-G349 VanDerWaalsContact O-N 3.1Å
348	C	33.2	Very low	35.1	Very low	133 Å²	133	131.2 Å²	131.2	90%	0.899	79%	0.786	S	S	*	*			trans	-71.2	104.2	171.1	-66.3	0	0	0	0	109.5
349	G	29.7	Very low	35	Very low	75 Å²	75	129.3 Å²	129.3	77%	0.773	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73.4	136.9	179.8	0	0	0	0	0	113.7	A347	A347-G349 PolarHBondContact O-N 3.46Å; A347-G349 VanDerWaalsContact O-N 3.1Å
350	M	35.8	Very low	35	Very low	177 Å²	177	129.7 Å²	129.7	87%	0.872	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-78.8	152.2	155.5	-75.4	-75.5	-73.7	0	0	109.5
351	P	35.9	Very low	35.1	Very low	112 Å²	112	131.9 Å²	131.9	73%	0.727	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-76.4	151.6	-172.2	30.6	-35.7	0	0	0	113.7
352	P	37.1	Very low	35.6	Very low	114 Å²	114	130.2 Å²	130.2	74%	0.74	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-92.8	158.7	-177.7	37.1	-36	0	0	0	113.8
353	P	33.6	Very low	36.1	Very low	130 Å²	130	128.5 Å²	128.5	84%	0.844	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-86.6	153.6	158.6	35.3	-31.3	0	0	0	111.7
354	T	30	Very low	35.8	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-95.8	141.1	-174	41.4	0	0	0	0	115.1
355	D	28.8	Very low	35.5	Very low	147 Å²	147	128.3 Å²	128.3	79%	0.786	77%	0.774	S	S	*	*			trans	65.8	104.6	145.5	-58.1	-29.3	0	0	0	123.4
356	T	28.3	Very low	35	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	78%	0.78	S	S	*	*			trans	-33.3	160.6	140.2	18.8	0	0	0	0	117.3
357	P	38.7	Very low	34.6	Very low	112 Å²	112	123.6 Å²	123.6	73%	0.727	77%	0.773	S	S	*	*				-156.9	146.2	68.6	38.3	-15.2	0	0	0	122.4
358	L	32.6	Very low	34.3	Very low	159 Å²	159	127.4 Å²	127.4	83%	0.832	78%	0.776	S	S	*	*			trans	67.1	165.7	149.9	-58.3	167.1	0	0	0	117.8
359	V	35.3	Very low	34.1	Very low	128 Å²	128	125.2 Å²	125.2	78%	0.776	76%	0.762	S	S	*	*			cis	-150.3	168.7	-0.4	102.1	0	0	0	0	110.3
360	P	38.4	Very low	34	Very low	107 Å²	107	130.3 Å²	130.3	70%	0.695	77%	0.766	S	S	*	*			trans	-115.8	-161.7	-163.4	43	-32.5	0	0	0	115.6
361	P	48.3	Very low	33.4	Very low	112 Å²	112	126.4 Å²	126.4	73%	0.727	76%	0.756	S	S	*	*				-127.4	-140.7	-58.4	39.8	-19.8	0	0	0	109.9
362	P	46.2	Very low	32.8	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	76%	0.763	S	S	*	*			cis	-127.8	-144.8	-28.8	37.8	-15.5	0	0	0	111.5
363	P	44.5	Very low	32.1	Very low	106 Å²	106	132.5 Å²	132.5	69%	0.688	77%	0.769	S	S	*	*				-126.1	-174.7	-56.7	26.5	-4.2	0	0	0	115
364	Q	31	Very low	31.6	Very low	160 Å²	160	136.5 Å²	136.5	75%	0.748	77%	0.773	S	S	*	*			trans	119.3	119.2	142.1	-72.2	-167.3	-91.4	0	0	121
365	D	28.4	Very low	31.4	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	77%	0.771	S	S	*	*			trans	57.9	126.6	132.4	-51.1	-20.7	0	0	0	122.5
366	G	29	Very low	31.2	Very low	85 Å²	85	137 Å²	137	88%	0.876	77%	0.772	S	S	*	*			trans	174.5	84.5	174.1	0	0	0	0	0	111.6
367	D	27.1	Very low	31	Very low	143 Å²	143	140.8 Å²	140.8	77%	0.765	78%	0.778	S	S	*	*			trans	-81.8	171.2	-167.5	-174.7	30	0	0	0	115.1
368	Q	29.3	Very low	30.4	Very low	168 Å²	168	142.4 Å²	142.4	79%	0.785	78%	0.775	S	S	*	*			trans	77.3	145.1	165.2	-53.5	176.4	29.8	0	0	118
369	S	27.3	Very low	30.1	Very low	87 Å²	87	140.8 Å²	140.8	61%	0.608	78%	0.778	S	S	*	*			cis	-162	157.7	-22.7	-169	0	0	0	0	107.9
370	E	27.6	Very low	29.6	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	78%	0.78	S	S	*	*			trans	31.5	147.8	148.1	-71.3	171.7	140.1	0	0	122
371	S	23.6	Very low	29.3	Very low	95 Å²	95	141.3 Å²	141.3	66%	0.664	79%	0.788	S	S	*	*			cis	-168.2	146.3	-5.2	174.8	0	0	0	0	108.2
372	W	23	Very low	28.6	Very low	232 Å²	232	141.3 Å²	141.3	88%	0.879	79%	0.788	S	S	*	*			trans	-0.1	129.2	159.1	-58	73.1	0	0	0	119.4
373	S	22.8	Very low	27.7	Very low	122 Å²	122	144.9 Å²	144.9	85%	0.853	80%	0.795	S	S	*	*				-174.2	152.4	112.9	-83.9	0	0	0	0	115.4
374	F	23.5	Very low	27	Very low	214 Å²	214	147.4 Å²	147.4	94%	0.939	80%	0.802	S	S	*	*			trans	-53.3	145	175.9	-104.9	-121.7	0	0	0	114.9
375	G	25.3	Very low	27.2	Very low	69 Å²	69	145.8 Å²	145.8	71%	0.711	81%	0.806	S	S	*	*			trans	-165.8	90.1	171.1	0	0	0	0	0	114.2
376	R	25.1	Very low	27.2	Very low	215 Å²	215	142.8 Å²	142.8	81%	0.811	80%	0.801	S	S	*	*			trans	-45.4	139.7	168.6	168	-162.4	-89.3	-161.1	-6.6	111.8
377	F	23.5	Very low	27.3	Very low	204 Å²	204	144.9 Å²	144.9	90%	0.895	80%	0.802	S	S	*	*			trans	-133.7	140.4	158.2	-110.8	-84.1	0	0	0	113.3
378	E	26.7	Very low	27.2	Very low	146 Å²	146	141.4 Å²	141.4	68%	0.682	80%	0.8	S	S	*	*			trans	-96.1	158.1	174.2	-65.9	175.6	125.1	0	0	111
379	S	26.6	Very low	27.2	Very low	126 Å²	126	141 Å²	141	88%	0.881	80%	0.803	S	S	*	*			trans	34.1	115.3	140.9	-54.6	0	0	0	0	120.5
380	G	25	Very low	27.2	Very low	80 Å²	80	141.6 Å²	141.6	83%	0.825	81%	0.807	S	S	*	*			trans	-161.8	119.5	163.8	0	0	0	0	0	113.8
381	L	30.8	Very low	27.1	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	81%	0.812	S	S	*	*			trans	-85.3	146.7	172.2	-121.4	152.8	0	0	0	110.3
382	P	34.7	Very low	27.5	Very low	112 Å²	112	144.1 Å²	144.1	73%	0.727	82%	0.817	S	S	*	*				-141.1	137	123.5	23.8	-4.1	0	0	0	112.4
383	Q	28	Very low	27.9	Very low	187 Å²	187	139.9 Å²	139.9	87%	0.874	81%	0.81	S	S	*	*				71.1	128	76.9	-90.4	-172.5	-3.1	0	0	116.7
384	L	28.7	Very low	28.8	Very low	159 Å²	159	139.4 Å²	139.4	83%	0.832	80%	0.804	S	S	*	*			trans	-77.3	164.9	176.9	-106.4	97	0	0	0	113.3
385	P	36.3	Very low	29.2	Very low	127 Å²	127	134.1 Å²	134.1	83%	0.825	79%	0.794	S	S	*	*				-133.1	178.6	123.5	37.2	-26.5	0	0	0	113.9
386	A	26.9	Very low	29.3	Very low	81 Å²	81	139.2 Å²	139.2	67%	0.669	80%	0.799	S	S	*	*			trans	-133.9	168	-167.8	0	0	0	0	0	114.5
387	S	30.9	Very low	30.2	Very low	128 Å²	128	134.4 Å²	134.4	90%	0.895	80%	0.796	S	S	*	*			trans	72.2	144	166.2	-48.6	0	0	0	0	117.3
388	G	26.6	Very low	30.2	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	79%	0.788	S	S	*	*			cis	177.3	178.5	-3.4	0	0	0	0	0	112
389	D	28.2	Very low	30.4	Very low	161 Å²	161	128.2 Å²	128.2	86%	0.861	80%	0.798	S	S	*	*			trans	65.5	153.7	174.1	-83.5	-24.5	0	0	0	120
390	S	26.9	Very low	30.4	Very low	98 Å²	98	127.5 Å²	127.5	69%	0.685	79%	0.789	S	S	*	*			cis	-179.4	134	-29.8	-105	0	0	0	0	109.5
391	L	27.1	Very low	30.9	Very low	182 Å²	182	132.2 Å²	132.2	95%	0.953	79%	0.794	S	S	*	*			trans	-161.5	157.6	162.7	-98.3	-176.2	0	0	0	112.4
392	L	30.4	Very low	31.1	Very low	149 Å²	149	132.3 Å²	132.3	78%	0.78	79%	0.79	S	S	*	*			trans	-123.2	137.4	-158.1	-67.9	161.7	0	0	0	115.9
393	I	32.8	Very low	31.4	Very low	143 Å²	143	135.8 Å²	135.8	73%	0.733	80%	0.797	S	S	*	*				55.5	133.2	127.6	-61.3	-179.4	0	0	0	118.8
394	P	41.2	Very low	32.1	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	80%	0.795	S	S	*	*				-148.2	153.2	55.6	33	-9.3	0	0	0	122.2
395	S	30.7	Very low	32.7	Very low	103 Å²	103	134 Å²	134	72%	0.72	79%	0.788	S	S	*	*			trans	47.5	111	136.2	-50.7	0	0	0	0	122.2
396	E	29.3	Very low	33.1	Very low	176 Å²	176	130 Å²	130	82%	0.822	77%	0.771	S	S	*	*				89.7	153.2	85.3	-80	-88	119.1	0	0	114.4
397	P	43	Very low	34.3	Very low	115 Å²	115	131.3 Å²	131.3	75%	0.747	76%	0.763	S	S	*	*			cis	-130.5	171.8	-13.4	40.6	-25.8	0	0	0	114.9
398	G	24.6	Very low	35.2	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	76%	0.756	S	S	*	*			trans	147.6	116.3	148.3	0	0	0	0	0	120.5
399	V	29.9	Very low	36.7	Very low	148 Å²	148	134.7 Å²	134.7	90%	0.897	75%	0.745	S	S	*	*			trans	80	93.1	158.8	-163.9	0	0	0	0	118
400	T	27.2	Very low	38	Very low	111 Å²	111	130.2 Å²	130.2	68%	0.681	72%	0.721	S	S	*	*			trans	-84.6	144.3	165.6	20.8	0	0	0	0	113	E402	T400-E402 HydrophobicContact CG2-CG 4.43Å
401	L	34.8	Very low	39.3	Very low	180 Å²	180	132.1 Å²	132.1	94%	0.942	72%	0.721	S	S	*	*			trans	-104.5	102.3	160.6	-82.8	166.3	0	0	0	108.3
402	E	35.9	Very low	41	Very low	167 Å²	167	126.2 Å²	126.2	78%	0.78	70%	0.698	S	S	*	*			trans	-110.6	84.5	-179.7	-76.1	-179.9	-176.2	0	0	111.8	T400	T400-E402 HydrophobicContact CG2-CG 4.43Å
403	E	39.5	Very low	42.3	Very low	184 Å²	184	124.7 Å²	124.7	86%	0.86	69%	0.686	S	S	*	*	S	Bend	trans	-138.2	-18.3	162.8	-81.1	-162.6	140.5	0	0	114.8
404	E	42.4	Very low	43.6	Very low	179 Å²	179	120.1 Å²	120.1	84%	0.836	66%	0.663	S	S	*	*	S	Bend	trans	-81.3	-25.7	-176.5	-79.4	-167.3	121.7	0	0	115.5	G406 E407	E404-G406 PolarHBondContact O-N 2.88Å; E404-E407 PolarHBondContact O-N 3.22Å
405	D	41.8	Very low	44.7	Very low	130 Å²	130	122.1 Å²	122.1	70%	0.695	66%	0.66	S	S	*	*	H	α-helix	trans	-69	-33.3	-169.4	-162.6	49.3	0	0	0	113	E407 S409	D405-E407 PolarHBondContact O-N 3.19Å; D405-S409 PolarHBondContact O-N 3.43Å
406	G	45	Very low	46.2	Very low	44 Å²	44	123.3 Å²	123.3	45%	0.454	66%	0.658	S	S	.	*	H	α-helix	trans	-65.6	-36.6	178.9	0	0	0	0	0	114.3	E404 S409 D410	E404-G406 PolarHBondContact O-N 2.88Å; G406-S409 PolarHBondContact O-N 3.1Å; G406-D410 PolarHBondContact O-N 2.96Å; G406-D410 VanDerWaalsContact O-N 3.07Å
407	E	51.4	Low	47.3	Very low	108 Å²	108	120.7 Å²	120.7	51%	0.505	65%	0.649	S	S	.	*	H	α-helix	trans	-77.7	-30.9	-177.9	-54.1	-141.5	138.4	0	0	112	K161 E404 D405 S409 M411	K161-E407 IonicContact NZ-OE1 2.59Å; K161-E407 PolarHBondContact NZ-OE1 2.79Å; K161-E407 IonicContact NZ-OE2 2.74Å; K161-E407 PolarHBondContact NZ-OE2 3.14Å; E404-E407 PolarHBondContact O-N 3.22Å; D405-E407 PolarHBondContact O-N 3.19Å; E407-S409 VanDerWaalsContact C-N 3.35Å; E407-M411 PolarHBondContact O-N 3.13Å
408	R	50	Low	47.6	Very low	196 Å²	196	121 Å²	121	74%	0.74	64%	0.644	S	S	*	*	H	α-helix	trans	-66.7	-38.8	172.5	-168.2	179.3	-176.3	-148.7	2.2	111.3	A412	R408-A412 WeakPolarHBondContact O-CB 3.44Å; R408-A412 PolarHBondContact O-N 3.47Å
409	S	57.9	Low	48.8	Very low	72 Å²	72	120.5 Å²	120.5	50%	0.503	63%	0.629	S	S	.	*	H	α-helix	trans	-65.2	-45.9	174.2	-169.7	0	0	0	0	112.3	D405 G406 E407 M411 A412 F413	D405-S409 PolarHBondContact O-N 3.43Å; G406-S409 PolarHBondContact O-N 3.1Å; E407-S409 VanDerWaalsContact C-N 3.35Å; S409-M411 VanDerWaalsContact C-N 3.32Å; S409-M411 PolarHBondContact O-N 3.16Å; S409-A412 PolarHBondContact O-N 2.91Å; S409-A412 VanDerWaalsContact O-N 3.11Å; S409-F413 WeakPolarHBondContact O-CB 3.44Å; S409-F413 PolarHBondContact O-N 2.73Å
410	D	56.6	Low	49.6	Very low	68 Å²	68	119.5 Å²	119.5	36%	0.364	63%	0.626	S	S	.	*	H	α-helix	trans	-59.8	-38.4	177.4	-80.6	-9.6	0	0	0	112.4	K29 G406 L414	K29-D410 IonicContact NZ-OD1 3.36Å; K29-D410 PolarHBondContact NZ-OD1 3.34Å; K29-D410 IonicContact NZ-OD2 3.42Å; K29-D410 PolarHBondContact NZ-OD2 3.29Å; G406-D410 PolarHBondContact O-N 2.96Å; G406-D410 VanDerWaalsContact O-N 3.07Å; D410-L414 WeakPolarHBondContact O-CG 3.43Å; D410-L414 PolarHBondContact O-N 3.43Å; D410-L414 VanDerWaalsContact O-N 3.17Å
411	M	54.4	Low	50.4	Low	137 Å²	137	117 Å²	117	68%	0.675	62%	0.623	S	S	*	*	H	α-helix	trans	-73.8	-32.2	174.9	-72.1	-70.3	-75.1	0	0	113.1	E407 S409 K415	E407-M411 PolarHBondContact O-N 3.13Å; S409-M411 VanDerWaalsContact C-N 3.32Å; S409-M411 PolarHBondContact O-N 3.16Å; M411-K415 WeakPolarHBondContact O-CB 3.47Å; M411-K415 PolarHBondContact O-N 2.97Å; M411-K415 VanDerWaalsContact O-N 3.09Å
412	A	61.2	Low	51	Low	58 Å²	58	115.6 Å²	115.6	48%	0.479	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-42.7	173.4	0	0	0	0	0	111.5	R408 S409 K415 D416	R408-A412 WeakPolarHBondContact O-CB 3.44Å; R408-A412 PolarHBondContact O-N 3.47Å; S409-A412 PolarHBondContact O-N 2.91Å; S409-A412 VanDerWaalsContact O-N 3.11Å; A412-K415 WeakPolarHBondContact O-CB 3.3Å; A412-K415 PolarHBondContact O-N 2.86Å; A412-K415 VanDerWaalsContact O-N 3.16Å; A412-D416 WeakPolarHBondContact O-CB 3.38Å; A412-D416 PolarHBondContact O-N 3.41Å
413	F	59.4	Low	51.7	Low	118 Å²	118	111.3 Å²	111.3	52%	0.518	62%	0.624	S	S	.	*	H	α-helix	trans	-60.3	-44.1	174.9	175.7	-102.4	0	0	0	112.4	S409 K415 D416 L417	S409-F413 WeakPolarHBondContact O-CB 3.44Å; S409-F413 PolarHBondContact O-N 2.73Å; F413-K415 VanDerWaalsContact C-N 3.31Å; F413-K415 PolarHBondContact O-N 2.77Å; F413-D416 PolarHBondContact O-N 3.02Å; F413-L417 HydrophobicContact CZ-CD1 4.31Å; F413-L417 WeakPolarHBondContact O-CB 3.43Å; F413-L417 PolarHBondContact O-N 3.09Å
414	L	59.8	Low	51.9	Low	47 Å²	47	104.8 Å²	104.8	25%	0.246	61%	0.607	C	S	.	*	H	α-helix	trans	-65.5	-33.3	174.5	-73.7	171.6	0	0	0	112.9	T33 D410 L418	T33-L414 HydrophobicContact CG2-CD2 4.2Å; D410-L414 WeakPolarHBondContact O-CG 3.43Å; D410-L414 PolarHBondContact O-N 3.43Å; D410-L414 VanDerWaalsContact O-N 3.17Å; L414-L418 WeakPolarHBondContact O-CB 3.37Å; L414-L418 WeakPolarHBondContact O-CD1 3.41Å; L414-L418 VanDerWaalsContact O-CG 3.24Å; L414-L418 WeakPolarHBondContact O-CG 3.42Å; L414-L418 PolarHBondContact O-N 3.16Å
415	K	62.8	Low	51.9	Low	153 Å²	153	100.4 Å²	100.4	67%	0.665	60%	0.596	S	S	*	*	H	α-helix	trans	-69	-40.4	174.3	-175	-174.6	175.1	-169.6	0	111.6	M411 A412 F413 L418 S419	M411-K415 WeakPolarHBondContact O-CB 3.47Å; M411-K415 PolarHBondContact O-N 2.97Å; M411-K415 VanDerWaalsContact O-N 3.09Å; A412-K415 WeakPolarHBondContact O-CB 3.3Å; A412-K415 PolarHBondContact O-N 2.86Å; A412-K415 VanDerWaalsContact O-N 3.16Å; F413-K415 VanDerWaalsContact C-N 3.31Å; F413-K415 PolarHBondContact O-N 2.77Å; K415-L418 PolarHBondContact O-N 3.08Å; K415-S419 WeakPolarHBondContact O-CB 3.42Å; K415-S419 PolarHBondContact O-N 3.42Å; K415-S419 PolarHBondContact O-OG 3.37Å
416	D	63.3	Low	52.3	Low	128 Å²	128	100 Å²	100	68%	0.684	59%	0.593	S	S	*	*	H	α-helix	trans	-65	-45.6	178	-163.2	50	0	0	0	111.1	A412 F413 L418 S419	A412-D416 WeakPolarHBondContact O-CB 3.38Å; A412-D416 PolarHBondContact O-N 3.41Å; F413-D416 PolarHBondContact O-N 3.02Å; D416-L418 PolarHBondContact O-N 3.21Å; D416-S419 PolarHBondContact O-N 3.26Å
417	L	52.3	Low	52.9	Low	120 Å²	120	104.8 Å²	104.8	63%	0.628	60%	0.604	S	S	*	*	H	α-helix	trans	-66	-18.4	177.7	-151.4	84.6	0	0	0	114.5	F413	F413-L417 HydrophobicContact CZ-CD1 4.31Å; F413-L417 WeakPolarHBondContact O-CB 3.43Å; F413-L417 PolarHBondContact O-N 3.09Å
418	L	49.1	Very low	52.7	Low	122 Å²	122	106.4 Å²	106.4	64%	0.639	61%	0.61	S	S	*	*	H	α-helix	trans	-114.3	-0.8	-176.1	-64.8	175.2	0	0	0	113.7	L414 K415 D416	L414-L418 WeakPolarHBondContact O-CB 3.37Å; L414-L418 WeakPolarHBondContact O-CD1 3.41Å; L414-L418 VanDerWaalsContact O-CG 3.24Å; L414-L418 WeakPolarHBondContact O-CG 3.42Å; L414-L418 PolarHBondContact O-N 3.16Å; K415-L418 PolarHBondContact O-N 3.08Å; D416-L418 PolarHBondContact O-N 3.21Å
419	S	50.5	Low	53.2	Low	61 Å²	61	100 Å²	100	43%	0.427	60%	0.595	S	S	.	*	S	Bend	trans	-94.2	129.3	175.3	-62.4	0	0	0	0	109.9	K415 D416 G421	K415-S419 WeakPolarHBondContact O-CB 3.42Å; K415-S419 PolarHBondContact O-N 3.42Å; K415-S419 PolarHBondContact O-OG 3.37Å; D416-S419 PolarHBondContact O-N 3.26Å; S419-G421 PolarHBondContact O-N 3.19Å
420	P	46.5	Very low	53.1	Low	127 Å²	127	105.8 Å²	105.8	83%	0.825	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-62.5	123.5	166.8	-16.9	30.3	0	0	0	109.1
421	G	43.8	Very low	53.2	Low	59 Å²	59	108.7 Å²	108.7	61%	0.608	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-61.7	145.6	178.5	0	0	0	0	0	112.1	S419 G423	S419-G421 PolarHBondContact O-N 3.19Å; G421-G423 VanDerWaalsContact C-N 3.32Å; G421-G423 PolarHBondContact O-N 2.83Å
422	P	47	Very low	53.1	Low	149 Å²	149	108.8 Å²	108.8	97%	0.968	61%	0.61	S	S	*	*	S	Bend	trans	-76.6	80.1	-177.9	32	-35.2	0	0	0	111.4
423	G	50.1	Low	53.2	Low	77 Å²	77	111.2 Å²	111.2	79%	0.794	61%	0.612	S	S	*	*	S	Bend	trans	155.9	88.7	174.7	0	0	0	0	0	112.3	G421	G421-G423 VanDerWaalsContact C-N 3.32Å; G421-G423 PolarHBondContact O-N 2.83Å
424	G	44	Very low	53.1	Low	47 Å²	47	113 Å²	113	49%	0.485	63%	0.627	S	S	.	*			trans	154.3	13.3	178.9	0	0	0	0	0	117	D426	G424-D426 PolarHBondContact O-N 2.86Å; G424-D426 VanDerWaalsContact O-N 3.15Å
425	S	42.7	Very low	53	Low	87 Å²	87	114 Å²	114	61%	0.608	64%	0.642	S	S	*	*	H	α-helix	trans	-57.7	-29.1	-177.2	47.3	0	0	0	0	114.4	S429	S425-S429 WeakPolarHBondContact O-CB 3.47Å; S425-S429 PolarHBondContact O-OG 3.46Å
426	D	50.5	Low	52.4	Low	121 Å²	121	113.8 Å²	113.8	65%	0.647	64%	0.641	S	S	*	*	H	α-helix	trans	-95.7	-18.8	-164.1	-62.7	13.7	0	0	0	112.7	G424 R430	G424-D426 PolarHBondContact O-N 2.86Å; G424-D426 VanDerWaalsContact O-N 3.15Å; D426-R430 WeakPolarHBondContact O-CD 3.38Å; D426-R430 VanDerWaalsContact O-CG 3.29Å; D426-R430 WeakPolarHBondContact O-CG 3.5Å; D426-R430 PolarHBondContact O-N 3.35Å
427	E	57.7	Low	51.5	Low	145 Å²	145	109.5 Å²	109.5	68%	0.678	63%	0.627	S	S	*	*	H	α-helix	trans	-84	-51.8	-179	-166.2	157.3	-140.6	0	0	110.7	S429 R430 E431	E427-S429 VanDerWaalsContact C-N 3.3Å; E427-S429 PolarHBondContact O-N 2.95Å; E427-R430 PolarHBondContact O-N 3.49Å; E427-R430 VanDerWaalsContact O-N 3.11Å; E427-E431 PolarHBondContact O-N 2.82Å
428	F	47.1	Very low	51	Low	143 Å²	143	107.9 Å²	107.9	63%	0.627	63%	0.631	S	S	*	*	H	α-helix	trans	-60.3	-38.3	174.4	-176.6	-100.8	0	0	0	112.6	R430 E431 W432	F428-R430 VanDerWaalsContact C-N 3.3Å; F428-R430 PolarHBondContact O-N 3.09Å; F428-E431 PolarHBondContact O-N 3.36Å; F428-W432 VanDerWaalsContact O-CB 3.3Å; F428-W432 WeakPolarHBondContact O-CB 3.18Å; F428-W432 PolarHBondContact O-N 2.91Å
429	S	60	Low	50.6	Low	62 Å²	62	111.1 Å²	111.1	43%	0.434	64%	0.64	S	S	.	*	H	α-helix	trans	-65.3	-32.9	177.4	-60.6	0	0	0	0	112.5	S425 E427 Q433	S425-S429 WeakPolarHBondContact O-CB 3.47Å; S425-S429 PolarHBondContact O-OG 3.46Å; E427-S429 VanDerWaalsContact C-N 3.3Å; E427-S429 PolarHBondContact O-N 2.95Å; S429-Q433 WeakPolarHBondContact O-CG 3.32Å; S429-Q433 PolarHBondContact O-N 3.16Å
430	R	57.3	Low	50	Low	192 Å²	192	115.6 Å²	115.6	73%	0.725	66%	0.659	S	S	*	*	H	α-helix	trans	-72.6	-48.1	174.3	-79.3	173.8	67.9	178.2	-0.4	111.6	D426 E427 F428 W432 Q433 D434	D426-R430 WeakPolarHBondContact O-CD 3.38Å; D426-R430 VanDerWaalsContact O-CG 3.29Å; D426-R430 WeakPolarHBondContact O-CG 3.5Å; D426-R430 PolarHBondContact O-N 3.35Å; E427-R430 PolarHBondContact O-N 3.49Å; E427-R430 VanDerWaalsContact O-N 3.11Å; F428-R430 VanDerWaalsContact C-N 3.3Å; F428-R430 PolarHBondContact O-N 3.09Å; R430-W432 VanDerWaalsContact C-N 3.26Å; R430-W432 PolarHBondContact O-N 3.32Å; R430-Q433 PolarHBondContact O-N 3.4Å; R430-D434 WeakPolarHBondContact O-CB 3.38Å; R430-D434 PolarHBondContact O-N 3.23Å
431	E	57	Low	49.6	Very low	130 Å²	130	114.6 Å²	114.6	61%	0.607	65%	0.653	S	S	*	*	H	α-helix	trans	-60	-37.4	177.3	-68	-172.4	157.8	0	0	112.1	E427 F428 D434 A435	E427-E431 PolarHBondContact O-N 2.82Å; F428-E431 PolarHBondContact O-N 3.36Å; E431-D434 PolarHBondContact O-N 3.36Å; E431-A435 VanDerWaalsContact O-CB 3.31Å; E431-A435 WeakPolarHBondContact O-CB 3.41Å; E431-A435 PolarHBondContact O-N 3.15Å
432	W	53.5	Low	49.2	Very low	138 Å²	138	117.8 Å²	117.8	52%	0.523	66%	0.663	S	S	.	*	H	α-helix	trans	-67.3	-39.1	176.4	-165.5	88.1	0	0	0	112.7	F428 R430 F436	F428-W432 VanDerWaalsContact O-CB 3.3Å; F428-W432 WeakPolarHBondContact O-CB 3.18Å; F428-W432 PolarHBondContact O-N 2.91Å; R430-W432 VanDerWaalsContact C-N 3.26Å; R430-W432 PolarHBondContact O-N 3.32Å; W432-F436 HydrophobicContact CG-CD2 4.47Å; W432-F436 WeakPolarHBondContact O-CD2 3.36Å; W432-F436 PolarHBondContact O-N 3.15Å
433	Q	62.7	Low	48.4	Very low	110 Å²	110	116.2 Å²	116.2	51%	0.514	66%	0.655	S	S	.	*	H	α-helix	trans	-73.8	-32.5	175.8	-76.1	175.5	-13.8	0	0	113.1	S429 R430 G437	S429-Q433 WeakPolarHBondContact O-CG 3.32Å; S429-Q433 PolarHBondContact O-N 3.16Å; R430-Q433 PolarHBondContact O-N 3.4Å; Q433-G437 VanDerWaalsContact O-CA 3.32Å; Q433-G437 WeakPolarHBondContact O-CA 3.4Å; Q433-G437 PolarHBondContact O-N 3.04Å
434	D	57.8	Low	47.8	Very low	155 Å²	155	119.2 Å²	119.2	83%	0.829	66%	0.658	S	S	*	*	H	α-helix	trans	-70.6	-33.2	175.9	-147	44.3	0	0	0	111.5	R430 E431	R430-D434 WeakPolarHBondContact O-CB 3.38Å; R430-D434 PolarHBondContact O-N 3.23Å; E431-D434 PolarHBondContact O-N 3.36Å
435	A	57.7	Low	47.5	Very low	69 Å²	69	122.6 Å²	122.6	57%	0.57	67%	0.672	S	S	*	*	H	α-helix	trans	-79.9	-29.7	177.9	0	0	0	0	0	114.9	E431	E431-A435 VanDerWaalsContact O-CB 3.31Å; E431-A435 WeakPolarHBondContact O-CB 3.41Å; E431-A435 PolarHBondContact O-N 3.15Å
436	F	50.1	Low	47	Very low	148 Å²	148	123.4 Å²	123.4	65%	0.649	68%	0.683	S	S	*	*	H	α-helix	trans	-124.9	-8.2	-170.7	-65.4	-73.7	0	0	0	115.9	W432	W432-F436 HydrophobicContact CG-CD2 4.47Å; W432-F436 WeakPolarHBondContact O-CD2 3.36Å; W432-F436 PolarHBondContact O-N 3.15Å
437	G	43.9	Very low	46.2	Very low	37 Å²	37	122.9 Å²	122.9	38%	0.381	70%	0.696	S	S	.	*			trans	78.3	150.6	179.8	0	0	0	0	0	114.1	Q433	Q433-G437 VanDerWaalsContact O-CA 3.32Å; Q433-G437 WeakPolarHBondContact O-CA 3.4Å; Q433-G437 PolarHBondContact O-N 3.04Å
438	A	42.3	Very low	44.8	Very low	87 Å²	87	119.7 Å²	119.7	72%	0.719	70%	0.702	S	S	*	*			trans	-78.9	129.5	177.2	0	0	0	0	0	111.4
439	F	40	Very low	44.1	Very low	190 Å²	190	120.1 Å²	120.1	83%	0.833	72%	0.717	S	S	*	*			trans	-88.9	106.9	169.8	-79.9	-94	0	0	0	110.2
440	D	38.4	Very low	42.7	Very low	154 Å²	154	120.7 Å²	120.7	82%	0.824	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.8	167	-94.4	-37.3	0	0	0	110.6
441	P	37.9	Very low	42.2	Very low	107 Å²	107	118 Å²	118	70%	0.695	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-73.5	141	171.6	30.4	-33.1	0	0	0	110.8	S443	P441-S443 PolarHBondContact O-N 3.36Å
442	P	34.8	Very low	40.8	Very low	125 Å²	125	116.9 Å²	116.9	81%	0.812	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-68.3	135.1	-175.6	26.9	-34.2	0	0	0	112.4
443	S	31.1	Very low	39.8	Very low	116 Å²	116	121.6 Å²	121.6	81%	0.811	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.3	138.9	178.9	48.7	0	0	0	0	112.9	P441	P441-S443 PolarHBondContact O-N 3.36Å
444	V	37.2	Very low	39	Very low	140 Å²	140	121 Å²	121	85%	0.848	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-91.2	127.1	176.1	-159.3	0	0	0	0	109.7
445	P	37.2	Very low	38.1	Very low	119 Å²	119	119.5 Å²	119.5	77%	0.773	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-82.9	147.7	170.4	32.3	-32.1	0	0	0	111.9
446	A	32.7	Very low	36.8	Very low	103 Å²	103	121 Å²	121	85%	0.851	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-83.1	173.1	-174.2	0	0	0	0	0	114.4
447	A	33.2	Very low	35.8	Very low	111 Å²	111	121.4 Å²	121.4	92%	0.917	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-65.2	150.8	-170.7	0	0	0	0	0	115.7
448	G	29.8	Very low	35.4	Very low	78 Å²	78	125 Å²	125	80%	0.804	81%	0.806	S	S	*	*			trans	-136.9	149.7	168.9	0	0	0	0	0	111.4
449	T	32.1	Very low	35	Very low	152 Å²	152	126.8 Å²	126.8	93%	0.933	81%	0.811	S	S	*	*			trans	-97.2	146.8	-165.4	50.8	0	0	0	0	114.8
450	G	30.3	Very low	34.5	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	81%	0.807	S	S	*	*			trans	124.4	155.4	152.6	0	0	0	0	0	116.2
451	P	46.2	Very low	34.8	Very low	135 Å²	135	121.6 Å²	121.6	88%	0.877	81%	0.808	S	S	*	*			trans	-118.7	148.3	-148.2	38.9	-27.3	0	0	0	116.7
452	A	28.2	Very low	35.2	Very low	107 Å²	107	123 Å²	123	88%	0.884	81%	0.814	S	S	*	*			trans	-161.3	148.5	156.2	0	0	0	0	0	112.3
453	R	31.8	Very low	35.3	Very low	236 Å²	236	120.3 Å²	120.3	89%	0.891	81%	0.81	S	S	*	*			trans	-161.1	156.9	177.8	-173.2	-172.8	-179.3	-144.5	-0.3	109
454	P	47.1	Very low	35.8	Very low	99 Å²	99	123.4 Å²	123.4	64%	0.643	81%	0.809	S	S	*	*			cis	-114	-168	-45.2	41.7	-25.5	0	0	0	109.8
455	P	39.1	Very low	36.3	Very low	122 Å²	122	122.4 Å²	122.4	79%	0.792	80%	0.798	S	S	*	*				-122.5	-178.4	62	4.8	20.7	0	0	0	112.3
456	S	29.2	Very low	36.6	Very low	100 Å²	100	122 Å²	122	70%	0.699	80%	0.795	S	S	*	*			cis	-167.6	160.3	-24.2	50.1	0	0	0	0	109.5
457	N	30.2	Very low	37.2	Very low	157 Å²	157	120.6 Å²	120.6	84%	0.84	78%	0.779	S	S	*	*			trans	40	106.4	165.9	-69.6	7.5	0	0	0	120.3
458	P	34.3	Very low	37.7	Very low	112 Å²	112	119.6 Å²	119.6	73%	0.727	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-92.3	154.3	153.1	36.4	-31	0	0	0	112.2
459	P	34	Very low	38.5	Very low	126 Å²	126	122.3 Å²	122.3	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-82.6	131.7	168.4	32.4	-31.8	0	0	0	111.8
460	S	29.9	Very low	39.3	Very low	108 Å²	108	120.5 Å²	120.5	76%	0.755	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-89.3	134	177.9	-56.8	0	0	0	0	112.5
461	P	43.8	Very low	40	Very low	127 Å²	127	122 Å²	122	83%	0.825	73%	0.726	S	S	*	*			trans	-105.4	72.4	174.9	38.2	-31.2	0	0	0	112.5
462	T	47.8	Very low	39.7	Very low	135 Å²	135	122.8 Å²	122.8	83%	0.828	72%	0.717	S	S	*	*			trans	-146.8	109.8	168.5	50.7	0	0	0	0	110.2
463	G	37.3	Very low	40.4	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	70%	0.701	S	S	*	*			trans	-173.7	53.3	-173.1	0	0	0	0	0	115
464	F	40.9	Very low	41.1	Very low	181 Å²	181	116 Å²	116	79%	0.794	69%	0.689	S	S	*	*			trans	-128.9	128.4	164	-83.4	-79.7	0	0	0	109.6	Q468	F464-Q468 HydrophobicContact CD1-CB 4.43Å
465	L	47.1	Very low	41	Very low	119 Å²	119	116.6 Å²	116.6	62%	0.623	70%	0.695	S	S	*	*			trans	-88	146.3	178	-72.1	169	0	0	0	110.1	S467 Q468	L465-S467 PolarHBondContact O-N 3.4Å; L465-Q468 PolarHBondContact O-N 3.07Å
466	P	44.6	Very low	41	Very low	109 Å²	109	116 Å²	116	71%	0.708	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-25.1	-176.9	-28.6	35.9	0	0	0	115.5	L469	P466-L469 PolarHBondContact O-N 2.94Å
467	S	44	Very low	41.8	Very low	75 Å²	75	113.6 Å²	113.6	52%	0.524	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.8	-34.7	175.1	45.2	0	0	0	0	113.4	L465 L469 L470	L465-S467 PolarHBondContact O-N 3.4Å; S467-L469 PolarHBondContact O-N 3.32Å; S467-L470 PolarHBondContact O-N 2.97Å
468	Q	44.7	Very low	42.3	Very low	89 Å²	89	110.3 Å²	110.3	42%	0.416	68%	0.681	S	S	.	*	H	α-helix	trans	-74.1	-13	-177.3	-66.3	171.5	-34.9	0	0	113	F464 L465 H472	F464-Q468 HydrophobicContact CD1-CB 4.43Å; L465-Q468 PolarHBondContact O-N 3.07Å; Q468-H472 PolarHBondContact O-CD2 2.82Å
469	L	45.2	Very low	42.6	Very low	135 Å²	135	115.5 Å²	115.5	71%	0.707	69%	0.686	S	S	*	*	H	α-helix	trans	-84.5	-21.6	179.3	-138.8	153.4	0	0	0	112	P466 S467	P466-L469 PolarHBondContact O-N 2.94Å; S467-L469 PolarHBondContact O-N 3.32Å
470	L	49.3	Very low	43.1	Very low	114 Å²	114	116 Å²	116	60%	0.597	69%	0.687	S	S	*	*	H	α-helix	trans	-75.9	-45.7	178.2	-77.8	159.2	0	0	0	112.2	S467 H472 S473 L474	S467-L470 PolarHBondContact O-N 2.97Å; L470-H472 VanDerWaalsContact C-N 3.3Å; L470-H472 PolarHBondContact O-N 3.11Å; L470-S473 PolarHBondContact O-N 3.21Å; L470-L474 PolarHBondContact O-N 3.14Å
471	D	45.4	Very low	44	Very low	107 Å²	107	115.1 Å²	115.1	57%	0.572	68%	0.677	S	S	*	*	H	α-helix	trans	-61.8	-35.8	-177	-67.9	-23.5	0	0	0	113.1	S475	D471-S475 PolarHBondContact O-N 3.3Å; D471-S475 PolarHBondContact O-OG 3.07Å
472	H	40.5	Very low	43.9	Very low	151 Å²	151	112.4 Å²	112.4	70%	0.699	66%	0.659	S	S	*	*	H	α-helix	trans	-70.7	-30.8	176	-80.8	-107.4	0	0	0	113	Q468 L470	Q468-H472 PolarHBondContact O-CD2 2.82Å; L470-H472 VanDerWaalsContact C-N 3.3Å; L470-H472 PolarHBondContact O-N 3.11Å
473	S	43.2	Very low	43.8	Very low	76 Å²	76	111.2 Å²	111.2	53%	0.531	65%	0.653	S	S	.	*	H	α-helix	trans	-78.1	-36	-178.8	-165.6	0	0	0	0	112.6	L470 S477	L470-S473 PolarHBondContact O-N 3.21Å; S473-S477 PolarHBondContact O-OG 3.05Å
474	L	46.5	Very low	44.3	Very low	125 Å²	125	115.6 Å²	115.6	65%	0.654	66%	0.657	S	S	*	*	H	α-helix	trans	-75	-27.4	178.3	-63.4	175.8	0	0	0	113	L470	L470-L474 PolarHBondContact O-N 3.14Å
475	S	43.5	Very low	44.5	Very low	110 Å²	110	114.6 Å²	114.6	77%	0.769	65%	0.653	S	S	*	*	H	α-helix	trans	-79.5	-22.7	179	-58.3	0	0	0	0	114	D471	D471-S475 PolarHBondContact O-N 3.3Å; D471-S475 PolarHBondContact O-OG 3.07Å
476	S	39.7	Very low	44.2	Very low	111 Å²	111	115.9 Å²	115.9	78%	0.776	66%	0.656	S	S	*	*	H	α-helix	trans	-95	-13.1	-175.7	-166.1	0	0	0	0	113.8
477	S	45.8	Very low	43.9	Very low	48 Å²	48	114.9 Å²	114.9	34%	0.336	66%	0.656	S	S	.	*	S	Bend	trans	-117.8	115	179.3	60.4	0	0	0	0	108.9	S473 W479	S473-S477 PolarHBondContact O-OG 3.05Å; S477-W479 PolarHBondContact O-N 2.58Å
478	G	41.1	Very low	43.6	Very low	89 Å²	89	116.9 Å²	116.9	92%	0.918	67%	0.668	S	S	*	*			trans	-71.1	44.8	-167.7	0	0	0	0	0	116.2
479	W	40.9	Very low	43.3	Very low	221 Å²	221	118.6 Å²	118.6	84%	0.837	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-88	121.1	178.2	-66.6	91.1	0	0	0	110.6	S477	S477-W479 PolarHBondContact O-N 2.58Å
480	V	44.1	Very low	42.6	Very low	137 Å²	137	120.3 Å²	120.3	83%	0.83	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-74.8	125.8	169.9	179.6	0	0	0	0	109.1
481	T	48.8	Very low	41.9	Very low	89 Å²	89	124.1 Å²	124.1	55%	0.546	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-64.1	130.7	178.8	-31.8	0	0	0	0	111.2	F485	T481-F485 HydrophobicContact CG2-CB 4.14Å
482	P	42.6	Very low	41.2	Very low	70 Å²	70	126.8 Å²	126.8	46%	0.455	72%	0.723	S	S	.	*	P	Polyproline II helix	trans	-60.9	145.1	177	-25	34.8	0	0	0	112.6	M484 F485	P482-M484 HydrophobicContact CB-CG 4.17Å; P482-M484 PolarHBondContact O-N 3.24Å; P482-F485 PolarHBondContact O-N 3.42Å
483	P	45.2	Very low	40.8	Very low	109 Å²	109	125 Å²	125	71%	0.708	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-64.4	-14.3	-170.7	24.5	-34.7	0	0	0	114.9	F485 Q486	P483-F485 PolarHBondContact O-N 2.98Å; P483-Q486 PolarHBondContact O-N 3.46Å
484	M	47.4	Very low	40.4	Very low	163 Å²	163	127.9 Å²	127.9	80%	0.803	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-73.8	-5.5	174.3	51.2	178.9	56.2	0	0	114.6	P482	P482-M484 HydrophobicContact CB-CG 4.17Å; P482-M484 PolarHBondContact O-N 3.24Å
485	F	45.5	Very low	39.5	Very low	160 Å²	160	125.4 Å²	125.4	70%	0.702	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-111.5	5.3	175	-71.3	-80.6	0	0	0	114	T481 P482 P483 A487	T481-F485 HydrophobicContact CG2-CB 4.14Å; P482-F485 PolarHBondContact O-N 3.42Å; P483-F485 PolarHBondContact O-N 2.98Å; F485-A487 PolarHBondContact O-N 3.36Å
486	Q	41.1	Very low	39	Very low	146 Å²	146	129.7 Å²	129.7	68%	0.682	76%	0.755	S	S	*	*			trans	-85.6	111.1	174.8	-73.8	-175.3	-15.8	0	0	110.9	P483	P483-Q486 PolarHBondContact O-N 3.46Å
487	A	37	Very low	38.6	Very low	87 Å²	87	131.7 Å²	131.7	72%	0.719	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-71.8	143.8	166.5	0	0	0	0	0	110.4	F485	F485-A487 PolarHBondContact O-N 3.36Å
488	P	38.3	Very low	37.9	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.8	133.5	175.8	-19.2	31.7	0	0	0	111.2	L490	P488-L490 PolarHBondContact O-N 2.99Å
489	P	37.8	Very low	37.3	Very low	124 Å²	124	139.8 Å²	139.8	81%	0.805	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.8	125	179.3	28.4	-33.2	0	0	0	111.2	Q491	P489-Q491 PolarHBondContact O-N 2.85Å
490	L	30.1	Very low	36.7	Very low	171 Å²	171	134 Å²	134	90%	0.895	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71.5	121.7	168.6	-71.5	168.4	0	0	0	109.6	P488	P488-L490 PolarHBondContact O-N 2.99Å
491	Q	34.8	Very low	36.4	Very low	194 Å²	194	133.6 Å²	133.6	91%	0.907	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-75.8	142.3	175.9	-76.5	-179.3	-16.4	0	0	112	P489	P489-Q491 PolarHBondContact O-N 2.85Å
492	L	31	Very low	35.3	Very low	163 Å²	163	141.3 Å²	141.3	85%	0.853	80%	0.802	S	S	*	*			trans	-131.9	154.3	166.8	-86.1	159.2	0	0	0	109.3
493	P	32	Very low	34.6	Very low	113 Å²	113	143.4 Å²	143.4	73%	0.734	82%	0.818	S	S	*	*			trans	-77.5	165.7	-157.2	29.9	-36.6	0	0	0	115.6
494	P	34.9	Very low	34.1	Very low	137 Å²	137	147.2 Å²	147.2	89%	0.89	83%	0.827	S	S	*	*			trans	-84.8	144.6	-161.4	33	-36.4	0	0	0	115.2
495	G	28.9	Very low	33.3	Very low	74 Å²	74	145.6 Å²	145.6	76%	0.763	83%	0.828	S	S	*	*			trans	-145.6	97.2	175.5	0	0	0	0	0	113.7
496	Q	31.8	Very low	32.5	Very low	199 Å²	199	142.9 Å²	142.9	93%	0.93	84%	0.835	S	S	*	*			trans	42.6	125.9	156.8	-72.2	179	-27.4	0	0	122.8
497	N	30.6	Very low	31.9	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	84%	0.843	S	S	*	*			trans	-50.1	146.1	165.2	-66.9	-26.7	0	0	0	115.3
498	Q	32	Very low	31.7	Very low	205 Å²	205	141.5 Å²	141.5	96%	0.958	85%	0.849	S	S	*	*				-160.4	146.6	116.7	-113.2	161.8	92.2	0	0	112.8
499	A	27.8	Very low	31.3	Very low	102 Å²	102	144.1 Å²	144.1	84%	0.843	86%	0.856	S	S	*	*			trans	-126.5	137.6	-179.8	0	0	0	0	0	110.4
500	A	28.2	Very low	30.8	Very low	99 Å²	99	143.3 Å²	143.3	82%	0.818	86%	0.86	S	S	*	*			trans	-156.8	158.1	170	0	0	0	0	0	110.1
501	P	37.7	Very low	30.9	Very low	129 Å²	129	139.6 Å²	139.6	84%	0.838	85%	0.854	S	S	*	*			trans	-110.6	170.8	-139.4	38.1	-31.7	0	0	0	117
502	R	26.4	Very low	30.6	Very low	251 Å²	251	136.3 Å²	136.3	95%	0.947	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-83.8	128.9	-177.1	-158.3	178	-166.1	171.3	2.9	110.9
503	S	28.9	Very low	30.6	Very low	114 Å²	114	132.5 Å²	132.5	80%	0.797	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-98.1	136.6	176.8	48.7	0	0	0	0	112.7
504	Q	33.9	Very low	31	Very low	189 Å²	189	131.1 Å²	131.1	88%	0.883	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-89.7	149.9	165.4	-66.2	176.8	-22.5	0	0	110
505	P	31.1	Very low	31.1	Very low	129 Å²	129	130.1 Å²	130.1	84%	0.838	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-94.4	141.9	157.9	30.4	-21.1	0	0	0	111.5
506	A	28.3	Very low	32.1	Very low	103 Å²	103	135.3 Å²	135.3	85%	0.851	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-86	163.9	-177.8	0	0	0	0	0	113.4
507	A	29.1	Very low	33	Very low	103 Å²	103	131.9 Å²	131.9	85%	0.851	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-71.6	152.2	175.4	0	0	0	0	0	113
508	A	31.4	Very low	34.1	Very low	101 Å²	101	128.8 Å²	128.8	84%	0.835	83%	0.826	S	S	*	*			trans	-129.9	128.9	168.3	0	0	0	0	0	110
509	N	30.5	Very low	35.3	Very low	173 Å²	173	122.1 Å²	122.1	93%	0.925	80%	0.802	S	S	*	*			trans	-81.6	141.2	178.4	-74.7	-39.7	0	0	0	111.6
510	A	28.3	Very low	36.5	Very low	107 Å²	107	121.1 Å²	121.1	88%	0.884	79%	0.794	S	S	*	*			trans	-137.3	142.1	159.9	0	0	0	0	0	108.9
511	A	30.4	Very low	37.6	Very low	93 Å²	93	123.1 Å²	123.1	77%	0.769	78%	0.781	S	S	*	*			trans	-103.8	149.8	-159.9	0	0	0	0	0	115.6
512	S	30.3	Very low	38.3	Very low	125 Å²	125	123.4 Å²	123.4	87%	0.874	77%	0.769	S	S	*	*			trans	54.3	105.6	152.1	63.1	0	0	0	0	119.7
513	G	29	Very low	39.8	Very low	82 Å²	82	117 Å²	117	85%	0.845	75%	0.754	S	S	*	*			trans	-151.8	59.4	166.5	0	0	0	0	0	113	S515	G513-S515 PolarHBondContact O-N 3.29Å
514	G	41.4	Very low	41.2	Very low	84 Å²	84	117.8 Å²	117.8	87%	0.866	75%	0.748	S	S	*	*			trans	52.1	58.5	160.1	0	0	0	0	0	119.2
515	S	37.6	Very low	41.7	Very low	116 Å²	116	113.8 Å²	113.8	81%	0.811	73%	0.728	S	S	*	*			trans	-79.1	120.2	163.8	56.2	0	0	0	0	110.8	G513 D517	G513-S515 PolarHBondContact O-N 3.29Å; S515-D517 PolarHBondContact O-N 2.65Å
516	K	48.7	Very low	42.9	Very low	183 Å²	183	109.2 Å²	109.2	80%	0.796	70%	0.701	S	S	*	*			trans	-60.1	128.8	172.3	-161.3	175.7	-172.5	179.5	0	109	M518	K516-M518 PolarHBondContact O-N 2.96Å
517	D	51.3	Low	43.9	Very low	128 Å²	128	111.9 Å²	111.9	68%	0.684	70%	0.701	S	S	*	*			trans	-70.3	102.2	-177.9	-172.1	-0.3	0	0	0	110.5	S515 S519	S515-D517 PolarHBondContact O-N 2.65Å; D517-S519 VanDerWaalsContact C-N 3.31Å; D517-S519 WeakPolarHBondContact OD1-CB 3.38Å; D517-S519 PolarHBondContact OD1-N 3.49Å; D517-S519 PolarHBondContact OD1-OG 3.28Å
518	M	53	Low	44.6	Very low	89 Å²	89	113.9 Å²	113.9	44%	0.438	70%	0.696	S	S	.	*			trans	-89.9	7.1	-179.4	-63.5	-70.5	-86.3	0	0	112.2	K516 A520 W521 F522	K516-M518 PolarHBondContact O-N 2.96Å; M518-A520 PolarHBondContact O-N 3.47Å; M518-W521 HydrophobicContact CB-CB 4.48Å; M518-W521 HydrophobicContact CE-CB 4.38Å; M518-W521 HydrophobicContact CE-CD2 4.15Å; M518-W521 HydrophobicContact CE-CE3 4.19Å; M518-W521 HydrophobicContact CE-CG 4.24Å; M518-W521 WeakPolarHBondContact O-CA 3.43Å; M518-W521 WeakPolarHBondContact O-CB 3.43Å; M518-W521 PolarHBondContact O-N 3.04Å; M518-F522 HydrophobicContact CB-CD2 4.08Å; M518-F522 HydrophobicContact CB-CE2 3.95Å; M518-F522 WeakPolarHBondContact O-CD2 3.29Å; M518-F522 PolarHBondContact O-N 2.93Å
519	S	57.8	Low	45.4	Very low	65 Å²	65	112 Å²	112	46%	0.455	67%	0.672	S	S	.	*	H	α-helix	trans	-57.1	-37.3	179.5	-52.9	0	0	0	0	112.1	D517 W521 F522 N523	D517-S519 VanDerWaalsContact C-N 3.31Å; D517-S519 WeakPolarHBondContact OD1-CB 3.38Å; D517-S519 PolarHBondContact OD1-N 3.49Å; D517-S519 PolarHBondContact OD1-OG 3.28Å; S519-W521 VanDerWaalsContact C-N 3.26Å; S519-W521 PolarHBondContact O-N 3.02Å; S519-F522 PolarHBondContact O-N 2.77Å; S519-N523 WeakPolarHBondContact O-CB 3.49Å; S519-N523 VanDerWaalsContact O-CG 3.26Å; S519-N523 PolarHBondContact O-N 3.28Å; S519-N523 PolarHBondContact O-ND2 3.2Å
520	A	53.6	Low	46.1	Very low	81 Å²	81	109.4 Å²	109.4	67%	0.669	67%	0.665	S	S	*	*	H	α-helix	trans	-67	-23.2	173.5	0	0	0	0	0	114	M518	M518-A520 PolarHBondContact O-N 3.47Å
521	W	51.2	Low	46.9	Very low	141 Å²	141	112 Å²	112	53%	0.534	66%	0.663	S	S	.	*	H	α-helix	trans	-85.2	-40.1	176.4	-168.1	75.7	0	0	0	111.5	M518 S519 L524 F525	M518-W521 HydrophobicContact CB-CB 4.48Å; M518-W521 HydrophobicContact CE-CB 4.38Å; M518-W521 HydrophobicContact CE-CD2 4.15Å; M518-W521 HydrophobicContact CE-CE3 4.19Å; M518-W521 HydrophobicContact CE-CG 4.24Å; M518-W521 WeakPolarHBondContact O-CA 3.43Å; M518-W521 WeakPolarHBondContact O-CB 3.43Å; M518-W521 PolarHBondContact O-N 3.04Å; S519-W521 VanDerWaalsContact C-N 3.26Å; S519-W521 PolarHBondContact O-N 3.02Å; W521-L524 WeakPolarHBondContact O-CB 3.41Å; W521-L524 PolarHBondContact O-N 3.36Å; W521-F525 HydrophobicContact CD2-CE2 4.45Å; W521-F525 AromaticContact CE2-CE2 3.99Å; W521-F525 HydrophobicContact CZ2-CE2 4.08Å; W521-F525 WeakPolarHBondContact O-CD2 3.47Å
522	F	51.3	Low	47.9	Very low	135 Å²	135	111.3 Å²	111.3	59%	0.592	65%	0.653	S	S	*	*	H	α-helix	trans	-66.3	-40	174	-74.8	-70.9	0	0	0	112.5	M518 S519 L524 F525 A526	M518-F522 HydrophobicContact CB-CD2 4.08Å; M518-F522 HydrophobicContact CB-CE2 3.95Å; M518-F522 WeakPolarHBondContact O-CD2 3.29Å; M518-F522 PolarHBondContact O-N 2.93Å; S519-F522 PolarHBondContact O-N 2.77Å; F522-L524 PolarHBondContact O-N 3.12Å; F522-L524 VanDerWaalsContact O-N 3.14Å; F522-F525 PolarHBondContact O-N 3.14Å; F522-A526 PolarHBondContact O-N 3.28Å
523	N	59.3	Low	48.8	Very low	117 Å²	117	109 Å²	109	63%	0.626	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-19.6	175.4	-74.6	-15.2	0	0	0	113.7	S519 F525	S519-N523 WeakPolarHBondContact O-CB 3.49Å; S519-N523 VanDerWaalsContact O-CG 3.26Å; S519-N523 PolarHBondContact O-N 3.28Å; S519-N523 PolarHBondContact O-ND2 3.2Å; N523-F525 VanDerWaalsContact C-N 3.26Å; N523-F525 PolarHBondContact O-N 2.88Å
524	L	58.1	Low	49.9	Very low	129 Å²	129	109.7 Å²	109.7	68%	0.675	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-13.5	175.8	-152.8	79.4	0	0	0	113.3	W521 F522	W521-L524 WeakPolarHBondContact O-CB 3.41Å; W521-L524 PolarHBondContact O-N 3.36Å; F522-L524 PolarHBondContact O-N 3.12Å; F522-L524 VanDerWaalsContact O-N 3.14Å
525	F	44.4	Very low	50.4	Low	106 Å²	106	112 Å²	112	47%	0.465	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.2	-7	179.9	-67.8	-77.7	0	0	0	113.7	W521 F522 N523 D527 L528	W521-F525 HydrophobicContact CD2-CE2 4.45Å; W521-F525 AromaticContact CE2-CE2 3.99Å; W521-F525 HydrophobicContact CZ2-CE2 4.08Å; W521-F525 WeakPolarHBondContact O-CD2 3.47Å; F522-F525 PolarHBondContact O-N 3.14Å; N523-F525 VanDerWaalsContact C-N 3.26Å; N523-F525 PolarHBondContact O-N 2.88Å; F525-D527 PolarHBondContact O-N 3.03Å; F525-L528 HydrophobicContact CD1-CD1 4.3Å; F525-L528 PolarHBondContact O-N 3.45Å; F525-L528 VanDerWaalsContact O-N 3.1Å
526	A	55.8	Low	51.2	Low	32 Å²	32	108.4 Å²	108.4	26%	0.264	59%	0.59	S	S	.	*	G	3₁₀ helix	trans	-59.2	-32.5	177.8	0	0	0	0	0	113	F522 L528	F522-A526 PolarHBondContact O-N 3.28Å; A526-L528 PolarHBondContact O-N 3.26Å
527	D	49.4	Very low	51.1	Low	160 Å²	160	107.2 Å²	107.2	86%	0.856	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-78.5	1	178.6	-68.4	-16.6	0	0	0	114.2	F525	F525-D527 PolarHBondContact O-N 3.03Å
528	L	44.9	Very low	51.2	Low	144 Å²	144	104.9 Å²	104.9	75%	0.754	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-109.1	-3.4	-178	-84.4	167.1	0	0	0	114.9	F525 A526	F525-L528 HydrophobicContact CD1-CD1 4.3Å; F525-L528 PolarHBondContact O-N 3.45Å; F525-L528 VanDerWaalsContact O-N 3.1Å; A526-L528 PolarHBondContact O-N 3.26Å
529	D	46.5	Very low	51.2	Low	62 Å²	62	108.6 Å²	108.6	33%	0.332	61%	0.606	S	S	.	*			trans	-156.1	111.6	171.2	174.8	25.5	0	0	0	111.2	L531 S532	D529-L531 PolarHBondContact O-N 3.04Å; D529-L531 PolarHBondContact OD1-N 3.31Å; D529-S532 PolarHBondContact O-N 3.04Å; D529-S532 WeakPolarHBondContact OD2-CB 3.41Å; D529-S532 PolarHBondContact OD2-OG 3.19Å
530	P	46.2	Very low	50.9	Low	119 Å²	119	109.4 Å²	109.4	77%	0.773	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-6.3	-177.6	28.4	-35.3	0	0	0	114.3
531	L	45.4	Very low	50.7	Low	160 Å²	160	109.1 Å²	109.1	84%	0.838	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-7.3	173.9	-62.9	177.1	0	0	0	113.9	D529	D529-L531 PolarHBondContact O-N 3.04Å; D529-L531 PolarHBondContact OD1-N 3.31Å
532	S	51.5	Low	50.8	Low	80 Å²	80	108.8 Å²	108.8	56%	0.559	62%	0.618	S	S	*	*			trans	-97.1	7	-176.6	-73.6	0	0	0	0	114.3	D529 P534	D529-S532 PolarHBondContact O-N 3.04Å; D529-S532 WeakPolarHBondContact OD2-CB 3.41Å; D529-S532 PolarHBondContact OD2-OG 3.19Å; S532-P534 WeakPolarHBondContact O-CD 3.45Å
533	N	48	Very low	50.9	Low	77 Å²	77	108.2 Å²	108.2	41%	0.412	62%	0.617	S	S	.	*			trans	-82.5	113.8	177.9	-170.4	-9.1	0	0	0	111.3	D535 A536	N533-D535 PolarHBondContact O-N 3.02Å; N533-D535 PolarHBondContact OD1-N 3.38Å; N533-A536 WeakPolarHBondContact O-CB 3.49Å; N533-A536 PolarHBondContact O-N 3.06Å; N533-A536 VanDerWaalsContact O-N 3.12Å
534	P	52.5	Low	50.5	Low	96 Å²	96	108.4 Å²	108.4	62%	0.623	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-64.8	-22.6	-176.3	26.5	-34.9	0	0	0	113.9	S532 A536 I537	S532-P534 WeakPolarHBondContact O-CD 3.45Å; P534-A536 PolarHBondContact O-N 3.1Å; P534-I537 PolarHBondContact O-N 3.4Å
535	D	51.8	Low	50.2	Low	132 Å²	132	108.9 Å²	108.9	71%	0.706	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-74.9	-9.5	177.3	-77.5	-9.9	0	0	0	113.5	N533	N533-D535 PolarHBondContact O-N 3.02Å; N533-D535 PolarHBondContact OD1-N 3.38Å
536	A	54.5	Low	50.3	Low	41 Å²	41	111.1 Å²	111.1	34%	0.339	64%	0.637	S	S	.	*	G	3₁₀ helix	trans	-83.6	-8.8	176.5	0	0	0	0	0	113.5	N533 P534 G538	N533-A536 WeakPolarHBondContact O-CB 3.49Å; N533-A536 PolarHBondContact O-N 3.06Å; N533-A536 VanDerWaalsContact O-N 3.12Å; P534-A536 PolarHBondContact O-N 3.1Å; A536-G538 PolarHBondContact O-N 3.01Å
537	I	46.3	Very low	49.6	Very low	157 Å²	157	117.2 Å²	117.2	81%	0.805	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	87.8	-179.3	-56.8	177.3	0	0	0	109.8	P534	P534-I537 PolarHBondContact O-N 3.4Å
538	G	53.7	Low	49.6	Very low	80 Å²	80	115.1 Å²	115.1	83%	0.825	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.8	-4	172.2	0	0	0	0	0	116.1	A536	A536-G538 PolarHBondContact O-N 3.01Å
539	R	52.3	Low	49.9	Very low	167 Å²	167	113.5 Å²	113.5	63%	0.63	68%	0.675	S	S	*	*			trans	-96.6	138.5	175.5	-62	-169.9	-169.1	172.2	7.2	111.9	E543	R539-E543 WeakPolarHBondContact CD-OE2 3.04Å
540	S	52.6	Low	50.1	Low	82 Å²	82	116.4 Å²	116.4	57%	0.573	69%	0.694	S	S	*	*			trans	-75.9	148	177.4	48	0	0	0	0	112	D542 E543	S540-D542 PolarHBondContact O-N 3.37Å; S540-E543 PolarHBondContact O-N 2.88Å
541	A	50	Low	50.3	Low	74 Å²	74	116.2 Å²	116.2	61%	0.612	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-53.8	-28.8	-171.3	0	0	0	0	0	115.6	E543 L544	A541-E543 VanDerWaalsContact C-N 3.29Å; A541-E543 PolarHBondContact O-N 3.27Å; A541-L544 PolarHBondContact O-N 3.35Å
542	D	52	Low	50.6	Low	134 Å²	134	113.5 Å²	113.5	72%	0.717	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-67.6	-21.8	179.3	-75.3	-25.4	0	0	0	114.2	S540	S540-D542 PolarHBondContact O-N 3.37Å
543	E	53.2	Low	50.5	Low	124 Å²	124	115.7 Å²	115.7	58%	0.579	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-79.2	-20.5	175.6	-88.9	-170.4	154.3	0	0	113.3	R539 S540 A541	R539-E543 WeakPolarHBondContact CD-OE2 3.04Å; S540-E543 PolarHBondContact O-N 2.88Å; A541-E543 VanDerWaalsContact C-N 3.29Å; A541-E543 PolarHBondContact O-N 3.27Å
544	L	52.1	Low	50.7	Low	121 Å²	121	118.5 Å²	118.5	63%	0.634	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-3.6	-178.3	-73.7	170.1	0	0	0	113.8	A541	A541-L544 PolarHBondContact O-N 3.35Å
545	L	50.6	Low	50.6	Low	138 Å²	138	120.2 Å²	120.2	72%	0.723	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	0.4	-177.9	-78.4	168	0	0	0	114.5
546	N	47.4	Very low	50.5	Low	154 Å²	154	119.3 Å²	119.3	82%	0.824	71%	0.714	S	S	*	*			trans	-128.7	26.7	-176.5	-78.6	-48.8	0	0	0	113.7
547	A	40.8	Very low	50.1	Low	159 Å²	159	126.4 Å²	126.4	100%	1.314	75%	0.749	S	S	*	*			trans	-121.6	0	176.8	0	0	0	0	0	111.2

Retrieved 547 of 547 residues in 310.6 ms (Link to these results)

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