1433F_BOVIN Loading...

14-3-3 protein eta

Adapter protein implicated in the regulation of a large spectrum of both general and specialized signaling pathways. Binds to a large number of partners, usually by recognition of a phosphoserine or phosphothreonine motif. Binding generally results in the modulation of the activity of the binding partner. Negatively regulates the kinase activity of PDPK1 (By similarity).

AlphaFold DB (P68511), UniProt , Accession P68509, Species BOVIN (Bos taurus, Bovine), Gene YWHAH, Length 246 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56	Low	90.9	Very high	170 Å²	170	73.9 Å²	73.9	84%	0.837	37%	0.37	S	S	*	.				0	125.4	0	-72.1	166.9	171.2	0	0	107.4	Q6	M1-Q6 HydrophobicContact CB-CG 3.89Å; M1-Q6 PolarHBondContact O-NE2 3.11Å; M1-Q6 VanDerWaalsContact O-NE2 3.07Å
2	G	76.3	Confident	91.5	Very high	53 Å²	53	72.8 Å²	72.8	55%	0.546	36%	0.358	S	S	.	.			trans	-64.2	161	173.7	0	0	0	0	0	111.2	R4 E5 Q6	G2-R4 VanDerWaalsContact C-N 3.31Å; G2-R4 PolarHBondContact O-N 3.07Å; G2-E5 PolarHBondContact O-N 3.29Å; G2-E5 VanDerWaalsContact O-N 3.16Å; G2-Q6 PolarHBondContact O-N 3.16Å
3	D	89.6	Confident	92	Very high	103 Å²	103	74.8 Å²	74.8	55%	0.551	37%	0.37	S	S	*	.	H	α-helix	trans	-55.4	-44.1	-176.8	-168.7	32.3	0	0	0	112.1	E5 Q6 L7	D3-E5 PolarHBondContact O-N 2.94Å; D3-Q6 PolarHBondContact O-N 3.44Å; D3-L7 WeakPolarHBondContact O-CG 3.45Å; D3-L7 PolarHBondContact O-N 3.36Å; D3-L7 VanDerWaalsContact O-N 3.11Å
4	R	95.4	Very high	92.5	Very high	43 Å²	43	70.1 Å²	70.1	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-54.2	-47.5	174.8	-174.6	178	177.8	123.7	0.6	113.7	G2 Q6 L7 L8 V30 L33 E35 P36 D41	G2-R4 VanDerWaalsContact C-N 3.31Å; G2-R4 PolarHBondContact O-N 3.07Å; R4-Q6 VanDerWaalsContact C-N 3.32Å; R4-Q6 PolarHBondContact O-N 3.44Å; R4-L7 PolarHBondContact O-N 2.93Å; R4-L8 HydrophobicContact CG-CD1 4.1Å; R4-L8 HydrophobicContact CG-CG 4.45Å; R4-L8 WeakPolarHBondContact O-CG 3.41Å; R4-L8 PolarHBondContact O-N 3.34Å; R4-V30 HydrophobicContact CG-CG1 4.3Å; R4-L33 HydrophobicContact CB-CD1 3.63Å; R4-L33 HydrophobicContact CG-CD1 4.05Å; R4-E35 VanDerWaalsContact CD-OE2 3.24Å; R4-E35 WeakPolarHBondContact CD-OE2 3.32Å; R4-E35 IonicContact CZ-OE2 3.52Å; R4-E35 IonicContact NE-OE2 2.94Å; R4-E35 PolarHBondContact NH1-O 2.94Å; R4-E35 IonicContact NH1-OE2 2.73Å; R4-E35 PolarHBondContact NH1-OE2 3.44Å; R4-P36 PolarHBondContact NH2-O 3.23Å; R4-P36 VanDerWaalsContact NH2-O 3.08Å; R4-D41 IonicContact CZ-OD2 3.82Å; R4-D41 IonicContact NE-OD2 3.74Å; R4-D41 IonicContact NH2-OD2 2.82Å; R4-D41 PolarHBondContact NH2-OD2 3.23Å
5	E	96.1	Very high	92.9	Very high	87 Å²	87	70.1 Å²	70.1	41%	0.407	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-35.7	-176.5	-172.2	56.8	-141.3	0	0	111.4	G2 D3 L7 L8 Q9 R12	G2-E5 PolarHBondContact O-N 3.29Å; G2-E5 VanDerWaalsContact O-N 3.16Å; D3-E5 PolarHBondContact O-N 2.94Å; E5-L7 VanDerWaalsContact C-N 3.34Å; E5-L8 PolarHBondContact O-N 3.44Å; E5-Q9 WeakPolarHBondContact O-CB 3.49Å; E5-Q9 PolarHBondContact O-N 3.24Å; E5-R12 IonicContact OE1-NH1 3.46Å; E5-R12 PolarHBondContact OE1-NH1 2.88Å
6	Q	96.5	Very high	93.2	Very high	104 Å²	104	75.4 Å²	75.4	49%	0.486	37%	0.371	S	S	.	.	H	α-helix	trans	-65.3	-40.1	175.2	-62.8	-179.6	29.9	0	0	111.3	M1 G2 D3 R4 R10	M1-Q6 HydrophobicContact CB-CG 3.89Å; M1-Q6 PolarHBondContact O-NE2 3.11Å; M1-Q6 VanDerWaalsContact O-NE2 3.07Å; G2-Q6 PolarHBondContact O-N 3.16Å; D3-Q6 PolarHBondContact O-N 3.44Å; R4-Q6 VanDerWaalsContact C-N 3.32Å; R4-Q6 PolarHBondContact O-N 3.44Å; Q6-R10 WeakPolarHBondContact O-CB 3.42Å; Q6-R10 PolarHBondContact O-N 3.24Å
7	L	97.7	Very high	93.5	Very high	25 Å²	25	74.8 Å²	74.8	13%	0.131	38%	0.38	C	S	.	.	H	α-helix	trans	-66.5	-43.4	175.8	-66.4	168.9	0	0	0	112.1	D3 R4 E5 R10 A11 A29 V30 L33	D3-L7 WeakPolarHBondContact O-CG 3.45Å; D3-L7 PolarHBondContact O-N 3.36Å; D3-L7 VanDerWaalsContact O-N 3.11Å; R4-L7 PolarHBondContact O-N 2.93Å; E5-L7 VanDerWaalsContact C-N 3.34Å; L7-R10 WeakPolarHBondContact O-CB 3.38Å; L7-R10 PolarHBondContact O-N 3.33Å; L7-A11 PolarHBondContact O-N 3.08Å; L7-A29 HydrophobicContact CD1-CB 3.76Å; L7-A29 HydrophobicContact CD2-CB 3.93Å; L7-A29 HydrophobicContact CG-CB 4.47Å; L7-V30 HydrophobicContact CB-CG2 3.42Å; L7-V30 VanDerWaalsContact CB-CG2 3.42Å; L7-V30 HydrophobicContact CD1-CG2 4.17Å; L7-V30 HydrophobicContact CG-CG2 4.44Å; L7-L33 HydrophobicContact CD1-CD1 4.31Å
8	L	98.1	Very high	93.7	Very high	5 Å²	5	78.4 Å²	78.4	3%	0.026	40%	0.396	C	S	.	.	H	α-helix	trans	-63.1	-43.3	175	-72.1	173.2	0	0	0	111.7	R4 E5 R10 A11 R12 M27 V30 D41 L44	R4-L8 HydrophobicContact CG-CD1 4.1Å; R4-L8 HydrophobicContact CG-CG 4.45Å; R4-L8 WeakPolarHBondContact O-CG 3.41Å; R4-L8 PolarHBondContact O-N 3.34Å; E5-L8 PolarHBondContact O-N 3.44Å; L8-R10 VanDerWaalsContact C-N 3.31Å; L8-R10 PolarHBondContact O-N 3.3Å; L8-A11 PolarHBondContact O-N 3.42Å; L8-R12 WeakPolarHBondContact O-CG 3.24Å; L8-R12 PolarHBondContact O-N 3.31Å; L8-M27 HydrophobicContact CD2-CE 4.18Å; L8-M27 HydrophobicContact CD2-SD 4.01Å; L8-V30 HydrophobicContact CD2-CG1 4.06Å; L8-V30 HydrophobicContact CD2-CG2 4.03Å; L8-V30 HydrophobicContact CG-CG1 4.44Å; L8-V30 HydrophobicContact CG-CG2 4.1Å; L8-D41 HydrophobicContact CD2-CB 4.18Å; L8-D41 WeakPolarHBondContact CD2-OD1 3.32Å; L8-L44 HydrophobicContact CD2-CD1 4.43Å
9	Q	97.7	Very high	94	Very high	87 Å²	87	81.5 Å²	81.5	41%	0.407	40%	0.402	S	S	.	.	H	α-helix	trans	-60.1	-42.3	174.2	-172.5	179.8	15.2	0	0	111.5	E5 R12 L13	E5-Q9 WeakPolarHBondContact O-CB 3.49Å; E5-Q9 PolarHBondContact O-N 3.24Å; Q9-R12 PolarHBondContact O-N 3.42Å; Q9-L13 HydrophobicContact CG-CD1 4.34Å; Q9-L13 WeakPolarHBondContact O-CG 3.45Å; Q9-L13 PolarHBondContact O-N 2.78Å
10	R	97.9	Very high	94.2	Very high	136 Å²	136	80.2 Å²	80.2	51%	0.513	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-42.6	175	-178.4	178.6	176.3	-178.2	-1.8	111.8	Q6 L7 L8 L13 A14 A26	Q6-R10 WeakPolarHBondContact O-CB 3.42Å; Q6-R10 PolarHBondContact O-N 3.24Å; L7-R10 WeakPolarHBondContact O-CB 3.38Å; L7-R10 PolarHBondContact O-N 3.33Å; L8-R10 VanDerWaalsContact C-N 3.31Å; L8-R10 PolarHBondContact O-N 3.3Å; R10-L13 PolarHBondContact O-N 3.43Å; R10-A14 WeakPolarHBondContact O-CB 3.37Å; R10-A14 PolarHBondContact O-N 2.89Å; R10-A26 HydrophobicContact CB-CB 4.42Å; R10-A26 HydrophobicContact CG-CB 4.28Å
11	A	98.4	Very high	94.4	Very high	0 Å²	0	79.9 Å²	79.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-61.2	-45.6	176.7	0	0	0	0	0	111.5	L7 L8 L13 A14 E15 M23 A26 M27	L7-A11 PolarHBondContact O-N 3.08Å; L8-A11 PolarHBondContact O-N 3.42Å; A11-L13 PolarHBondContact O-N 3.08Å; A11-A14 PolarHBondContact O-N 3.42Å; A11-E15 PolarHBondContact O-N 3.25Å; A11-M23 HydrophobicContact CB-CG 4.18Å; A11-A26 HydrophobicContact CB-CB 4.02Å; A11-M27 HydrophobicContact CB-CG 3.89Å; A11-M27 HydrophobicContact CB-SD 3.6Å; A11-M27 VanDerWaalsContact CB-SD 3.6Å
12	R	98.3	Very high	96.4	Very high	61 Å²	61	74 Å²	74	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-40.2	176.6	-67	178.6	-173.3	114.5	-3.5	112.8	E5 L8 Q9 E15 Q16 E40 L44	E5-R12 IonicContact OE1-NH1 3.46Å; E5-R12 PolarHBondContact OE1-NH1 2.88Å; L8-R12 WeakPolarHBondContact O-CG 3.24Å; L8-R12 PolarHBondContact O-N 3.31Å; Q9-R12 PolarHBondContact O-N 3.42Å; R12-E15 PolarHBondContact O-N 3.17Å; R12-Q16 WeakPolarHBondContact O-CG 3.46Å; R12-Q16 PolarHBondContact O-N 3.08Å; R12-Q16 VanDerWaalsContact O-N 3.12Å; R12-E40 IonicContact CZ-OE1 3.44Å; R12-E40 IonicContact NE-OE1 3.41Å; R12-E40 PolarHBondContact NE-OE1 3.33Å; R12-E40 VanDerWaalsContact NE-OE1 3.15Å; R12-E40 IonicContact NH2-OE1 3.84Å; R12-E40 PolarHBondContact NH2-OE1 2.79Å; R12-E40 IonicContact NH2-OE2 3.88Å; R12-L44 HydrophobicContact CG-CD1 3.97Å; R12-L44 HydrophobicContact CG-CD2 4.33Å
13	L	98.4	Very high	97.4	Very high	99 Å²	99	71.5 Å²	71.5	52%	0.518	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-39.6	174.3	-72.7	171.8	0	0	0	111.9	Q9 R10 A11 Q16 A17	Q9-L13 HydrophobicContact CG-CD1 4.34Å; Q9-L13 WeakPolarHBondContact O-CG 3.45Å; Q9-L13 PolarHBondContact O-N 2.78Å; R10-L13 PolarHBondContact O-N 3.43Å; A11-L13 PolarHBondContact O-N 3.08Å; L13-Q16 PolarHBondContact O-N 3.02Å; L13-A17 WeakPolarHBondContact O-CB 3.46Å; L13-A17 PolarHBondContact O-N 3.21Å; L13-A17 VanDerWaalsContact O-N 3.12Å
14	A	98.5	Very high	97.9	Very high	8 Å²	8	66.9 Å²	66.9	7%	0.066	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-38.6	176.3	0	0	0	0	0	111.8	R10 A11 A17 E18 R19 D22 M23	R10-A14 WeakPolarHBondContact O-CB 3.37Å; R10-A14 PolarHBondContact O-N 2.89Å; A11-A14 PolarHBondContact O-N 3.42Å; A14-A17 CarbonylContact O-C 3.59Å; A14-A17 PolarHBondContact O-N 3.38Å; A14-E18 PolarHBondContact O-N 3.15Å; A14-R19 HydrophobicContact CB-CB 4.19Å; A14-R19 PolarHBondContact O-N 3.41Å; A14-D22 HydrophobicContact CB-CB 4Å; A14-M23 HydrophobicContact CB-CB 3.9Å
15	E	98.2	Very high	98	Very high	70 Å²	70	68.3 Å²	68.3	33%	0.327	33%	0.332	S	S	.	.	H	α-helix	trans	-59.2	-50.3	172.8	-176.7	-179.4	-151	0	0	111.5	A11 R12 A17 E18 M23 L44	A11-E15 PolarHBondContact O-N 3.25Å; R12-E15 PolarHBondContact O-N 3.17Å; E15-A17 PolarHBondContact O-N 2.96Å; E15-E18 PolarHBondContact O-N 2.88Å; E15-M23 HydrophobicContact CB-CE 3.95Å; E15-M23 HydrophobicContact CB-SD 3.9Å; E15-M23 HydrophobicContact CG-CE 4.16Å; E15-M23 HydrophobicContact CG-SD 4.32Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.45Å
16	Q	97.9	Very high	98.1	Very high	156 Å²	156	64.2 Å²	64.2	73%	0.729	31%	0.313	S	S	*	.	H	α-helix	trans	-61.3	-27.6	178	-70.1	175.2	31.1	0	0	113.2	R12 L13	R12-Q16 WeakPolarHBondContact O-CG 3.46Å; R12-Q16 PolarHBondContact O-N 3.08Å; R12-Q16 VanDerWaalsContact O-N 3.12Å; L13-Q16 PolarHBondContact O-N 3.02Å
17	A	98	Very high	98.2	Very high	64 Å²	64	59.2 Å²	59.2	53%	0.529	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	4.3	176.3	0	0	0	0	0	113.5	L13 A14 E15 R19	L13-A17 WeakPolarHBondContact O-CB 3.46Å; L13-A17 PolarHBondContact O-N 3.21Å; L13-A17 VanDerWaalsContact O-N 3.12Å; A14-A17 CarbonylContact O-C 3.59Å; A14-A17 PolarHBondContact O-N 3.38Å; E15-A17 PolarHBondContact O-N 2.96Å; A17-R19 HydrophobicContact CB-CB 4.46Å; A17-R19 HydrophobicContact CB-CG 3.91Å; A17-R19 PolarHBondContact O-N 2.8Å; A17-R19 VanDerWaalsContact O-N 3.12Å
18	E	97.8	Very high	98.3	Very high	141 Å²	141	60.6 Å²	60.6	66%	0.659	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	28.2	-174.7	-56.4	-173.4	161.5	0	0	113.7	A14 E15 Y20	A14-E18 PolarHBondContact O-N 3.15Å; E15-E18 PolarHBondContact O-N 2.88Å; E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 3.89Å; E18-Y20 HydrophobicContact CG-CE2 4.48Å; E18-Y20 WeakPolarHBondContact O-CD2 3.47Å; E18-Y20 PolarHBondContact O-N 2.95Å
19	R	98.4	Very high	98.3	Very high	136 Å²	136	61.9 Å²	61.9	51%	0.513	31%	0.306	S	S	.	.			trans	-89.9	63	178.8	-71.9	-73.1	-56.6	173	9.9	110.3	A14 A17 D21 D22 M23	A14-R19 HydrophobicContact CB-CB 4.19Å; A14-R19 PolarHBondContact O-N 3.41Å; A17-R19 HydrophobicContact CB-CB 4.46Å; A17-R19 HydrophobicContact CB-CG 3.91Å; A17-R19 PolarHBondContact O-N 2.8Å; A17-R19 VanDerWaalsContact O-N 3.12Å; R19-D21 VanDerWaalsContact C-N 3.3Å; R19-D21 PolarHBondContact O-N 3.19Å; R19-D22 HydrophobicContact CB-CB 4.22Å; R19-D22 IonicContact CZ-OD2 3.75Å; R19-D22 IonicContact NE-OD2 3.69Å; R19-D22 PolarHBondContact NE-OD2 3.42Å; R19-D22 VanDerWaalsContact NH2-CG 3.3Å; R19-D22 IonicContact NH2-OD1 4Å; R19-D22 PolarHBondContact NH2-OD1 3.33Å; R19-D22 VanDerWaalsContact NH2-OD1 3.12Å; R19-D22 IonicContact NH2-OD2 2.89Å; R19-D22 PolarHBondContact NH2-OD2 3.23Å; R19-D22 WeakPolarHBondContact O-CB 3.45Å; R19-D22 PolarHBondContact O-N 3.44Å; R19-M23 PolarHBondContact O-N 2.96Å
20	Y	98.5	Very high	98.3	Very high	55 Å²	55	57.7 Å²	57.7	22%	0.216	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-28.1	-169.3	-57.8	-70.1	0	0	0	115	E18 M23 A24 V47 N51 V52	E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 3.89Å; E18-Y20 HydrophobicContact CG-CE2 4.48Å; E18-Y20 WeakPolarHBondContact O-CD2 3.47Å; E18-Y20 PolarHBondContact O-N 2.95Å; Y20-M23 HydrophobicContact CD1-SD 4.07Å; Y20-M23 WeakPolarHBondContact O-CB 3.17Å; Y20-M23 PolarHBondContact O-N 2.94Å; Y20-A24 WeakPolarHBondContact O-CB 3.39Å; Y20-A24 PolarHBondContact O-N 3.41Å; Y20-V47 HydrophobicContact CE1-CG1 4.38Å; Y20-N51 HydrophobicContact CD1-CB 3.51Å; Y20-N51 HydrophobicContact CD2-CB 3.48Å; Y20-N51 VanDerWaalsContact CD2-CB 3.48Å; Y20-N51 HydrophobicContact CE1-CB 3.85Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.44Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; Y20-V52 VanDerWaalsContact O-CG2 3.28Å; Y20-V52 WeakPolarHBondContact O-CG2 3.47Å
21	D	98.3	Very high	98.3	Very high	74 Å²	74	51.3 Å²	51.3	40%	0.396	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-37.4	172.5	-66.8	-79.5	0	0	0	112.2	R19 S25 R56	R19-D21 VanDerWaalsContact C-N 3.3Å; R19-D21 PolarHBondContact O-N 3.19Å; D21-S25 WeakPolarHBondContact O-CB 3.22Å; D21-S25 PolarHBondContact O-N 2.88Å; D21-S25 PolarHBondContact O-OG 3.45Å; D21-R56 IonicContact OD1-CZ 3.19Å; D21-R56 IonicContact OD1-NH1 2.69Å; D21-R56 PolarHBondContact OD1-NH1 3.34Å; D21-R56 IonicContact OD1-NH2 3.79Å; D21-R56 PolarHBondContact OD1-NH2 3.03Å; D21-R56 IonicContact OD2-NH2 2.64Å
22	D	98.4	Very high	98.2	Very high	47 Å²	47	55.8 Å²	55.8	25%	0.251	28%	0.283	S	S	.	.	H	α-helix	trans	-70.7	-37.8	174.8	-61	-29.2	0	0	0	110.5	A14 R19 S25 A26	A14-D22 HydrophobicContact CB-CB 4Å; R19-D22 HydrophobicContact CB-CB 4.22Å; R19-D22 IonicContact CZ-OD2 3.75Å; R19-D22 IonicContact NE-OD2 3.69Å; R19-D22 PolarHBondContact NE-OD2 3.42Å; R19-D22 VanDerWaalsContact NH2-CG 3.3Å; R19-D22 IonicContact NH2-OD1 4Å; R19-D22 PolarHBondContact NH2-OD1 3.33Å; R19-D22 VanDerWaalsContact NH2-OD1 3.12Å; R19-D22 IonicContact NH2-OD2 2.89Å; R19-D22 PolarHBondContact NH2-OD2 3.23Å; R19-D22 WeakPolarHBondContact O-CB 3.45Å; R19-D22 PolarHBondContact O-N 3.44Å; D22-S25 PolarHBondContact O-N 3.3Å; D22-A26 WeakPolarHBondContact O-CB 3.39Å; D22-A26 PolarHBondContact O-N 2.82Å
23	M	98.3	Very high	98.2	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-46.9	174.2	-165.8	-168.9	178.6	0	0	111	A11 A14 E15 R19 Y20 S25 A26 M27 L44 V47 A48	A11-M23 HydrophobicContact CB-CG 4.18Å; A14-M23 HydrophobicContact CB-CB 3.9Å; E15-M23 HydrophobicContact CB-CE 3.95Å; E15-M23 HydrophobicContact CB-SD 3.9Å; E15-M23 HydrophobicContact CG-CE 4.16Å; E15-M23 HydrophobicContact CG-SD 4.32Å; R19-M23 PolarHBondContact O-N 2.96Å; Y20-M23 HydrophobicContact CD1-SD 4.07Å; Y20-M23 WeakPolarHBondContact O-CB 3.17Å; Y20-M23 PolarHBondContact O-N 2.94Å; M23-S25 PolarHBondContact O-N 3.15Å; M23-A26 PolarHBondContact O-N 2.78Å; M23-M27 WeakPolarHBondContact O-CB 3.42Å; M23-M27 WeakPolarHBondContact O-CG 3.35Å; M23-M27 PolarHBondContact O-N 3.41Å; M23-L44 HydrophobicContact CE-CB 3.96Å; M23-L44 HydrophobicContact CE-CD2 3.57Å; M23-L44 HydrophobicContact CE-CG 4.4Å; M23-L44 WeakPolarHBondContact CE-O 3.12Å; M23-V47 HydrophobicContact CE-CB 4.08Å; M23-V47 HydrophobicContact CE-CG1 4Å; M23-V47 HydrophobicContact SD-CG1 4.24Å; M23-A48 HydrophobicContact CB-CB 3.97Å; M23-A48 HydrophobicContact CE-CB 4.14Å; M23-A48 HydrophobicContact CG-CB 3.6Å; M23-A48 VanDerWaalsContact SD-CA 3.55Å; M23-A48 HydrophobicContact SD-CB 3.58Å; M23-A48 VanDerWaalsContact SD-CB 3.58Å
24	A	98.6	Very high	98	Very high	7 Å²	7	55.3 Å²	55.3	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-64.3	-40.9	178	0	0	0	0	0	111.4	Y20 M27 K28 A48 Y49 V52	Y20-A24 WeakPolarHBondContact O-CB 3.39Å; Y20-A24 PolarHBondContact O-N 3.41Å; A24-M27 PolarHBondContact O-N 3.26Å; A24-K28 VanDerWaalsContact O-CB 3.22Å; A24-K28 WeakPolarHBondContact O-CB 3.24Å; A24-K28 PolarHBondContact O-N 3.28Å; A24-A48 HydrophobicContact CB-CB 4.19Å; A24-Y49 HydrophobicContact CB-CD1 4.43Å; A24-Y49 HydrophobicContact CB-CD2 4.3Å; A24-Y49 HydrophobicContact CB-CE1 4.27Å; A24-Y49 HydrophobicContact CB-CE2 4.12Å; A24-Y49 HydrophobicContact CB-CG 4.46Å; A24-V52 HydrophobicContact CB-CG2 4.09Å
25	S	98.4	Very high	97.7	Very high	72 Å²	72	59.9 Å²	59.9	50%	0.503	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-43	175.9	-59.6	0	0	0	0	112.2	D21 D22 M23 A29	D21-S25 WeakPolarHBondContact O-CB 3.22Å; D21-S25 PolarHBondContact O-N 2.88Å; D21-S25 PolarHBondContact O-OG 3.45Å; D22-S25 PolarHBondContact O-N 3.3Å; M23-S25 PolarHBondContact O-N 3.15Å; S25-A29 PolarHBondContact O-N 3.38Å
26	A	98.3	Very high	97.5	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-46	176.4	0	0	0	0	0	111.6	R10 A11 D22 M23 K28 A29 V30	R10-A26 HydrophobicContact CB-CB 4.42Å; R10-A26 HydrophobicContact CG-CB 4.28Å; A11-A26 HydrophobicContact CB-CB 4.02Å; D22-A26 WeakPolarHBondContact O-CB 3.39Å; D22-A26 PolarHBondContact O-N 2.82Å; M23-A26 PolarHBondContact O-N 2.78Å; A26-K28 VanDerWaalsContact C-N 3.33Å; A26-K28 PolarHBondContact O-N 2.96Å; A26-A29 WeakPolarHBondContact O-CB 3.19Å; A26-A29 PolarHBondContact O-N 3.45Å; A26-V30 WeakPolarHBondContact O-CG2 3.28Å; A26-V30 PolarHBondContact O-N 2.88Å
27	M	98.5	Very high	97.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.7	-29.9	179.7	-69.5	-52	-54.9	0	0	113.2	L8 A11 M23 A24 V30 T31 D41 L44 L45	L8-M27 HydrophobicContact CD2-CE 4.18Å; L8-M27 HydrophobicContact CD2-SD 4.01Å; A11-M27 HydrophobicContact CB-CG 3.89Å; A11-M27 HydrophobicContact CB-SD 3.6Å; A11-M27 VanDerWaalsContact CB-SD 3.6Å; M23-M27 WeakPolarHBondContact O-CB 3.42Å; M23-M27 WeakPolarHBondContact O-CG 3.35Å; M23-M27 PolarHBondContact O-N 3.41Å; A24-M27 PolarHBondContact O-N 3.26Å; M27-V30 HydrophobicContact CE-CB 4.38Å; M27-V30 HydrophobicContact CE-CG1 4.35Å; M27-V30 PolarHBondContact O-N 3.17Å; M27-V30 HydrophobicContact SD-CG2 4.46Å; M27-T31 WeakPolarHBondContact O-CB 3.3Å; M27-T31 PolarHBondContact O-N 3.18Å; M27-T31 PolarHBondContact O-OG1 3.2Å; M27-D41 HydrophobicContact CE-CB 4.47Å; M27-D41 WeakPolarHBondContact CE-O 3.42Å; M27-L44 HydrophobicContact CE-CB 4.1Å; M27-L44 HydrophobicContact CG-CB 4.39Å; M27-L44 HydrophobicContact SD-CB 3.89Å; M27-L45 HydrophobicContact CB-CB 4.42Å; M27-L45 HydrophobicContact CB-CD1 3.74Å; M27-L45 HydrophobicContact CE-CB 4.01Å
28	K	98.5	Very high	97.3	Very high	53 Å²	53	54 Å²	54	23%	0.23	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-52	168.1	178.4	165.7	-174.2	175.4	0	110.6	A24 A26 V30 T31 E32 D99 L103	A24-K28 VanDerWaalsContact O-CB 3.22Å; A24-K28 WeakPolarHBondContact O-CB 3.24Å; A24-K28 PolarHBondContact O-N 3.28Å; A26-K28 VanDerWaalsContact C-N 3.33Å; A26-K28 PolarHBondContact O-N 2.96Å; K28-V30 PolarHBondContact O-N 3.03Å; K28-T31 PolarHBondContact O-N 2.98Å; K28-T31 VanDerWaalsContact O-N 3.15Å; K28-E32 VanDerWaalsContact CE-OE1 3.28Å; K28-E32 WeakPolarHBondContact CE-OE1 3.26Å; K28-E32 WeakPolarHBondContact O-CG 3.2Å; K28-E32 PolarHBondContact O-N 3.49Å; K28-D99 VanDerWaalsContact NZ-CG 3.25Å; K28-D99 IonicContact NZ-OD1 3.59Å; K28-D99 PolarHBondContact NZ-OD1 3.12Å; K28-D99 IonicContact NZ-OD2 2.66Å; K28-D99 PolarHBondContact NZ-OD2 2.66Å; K28-L103 HydrophobicContact CB-CD1 4.03Å; K28-L103 HydrophobicContact CG-CD1 4.01Å; K28-L103 HydrophobicContact CG-CD2 4.14Å
29	A	98.1	Very high	97.1	Very high	32 Å²	32	51.3 Å²	51.3	26%	0.264	27%	0.272	S	S	.	.	H	α-helix	trans	-60.1	-42.7	177.4	0	0	0	0	0	112.3	L7 S25 A26 T31 E32 L33	L7-A29 HydrophobicContact CD1-CB 3.76Å; L7-A29 HydrophobicContact CD2-CB 3.93Å; L7-A29 HydrophobicContact CG-CB 4.47Å; S25-A29 PolarHBondContact O-N 3.38Å; A26-A29 WeakPolarHBondContact O-CB 3.19Å; A26-A29 PolarHBondContact O-N 3.45Å; A29-T31 VanDerWaalsContact C-N 3.33Å; A29-T31 PolarHBondContact O-N 3.49Å; A29-E32 PolarHBondContact O-N 2.79Å; A29-L33 WeakPolarHBondContact O-CG 3.4Å; A29-L33 PolarHBondContact O-N 3.34Å
30	V	98.3	Very high	97	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.2	-45	174.5	173.5	0	0	0	0	111.5	R4 L7 L8 A26 M27 K28 E32 L33 L37	R4-V30 HydrophobicContact CG-CG1 4.3Å; L7-V30 HydrophobicContact CB-CG2 3.42Å; L7-V30 VanDerWaalsContact CB-CG2 3.42Å; L7-V30 HydrophobicContact CD1-CG2 4.17Å; L7-V30 HydrophobicContact CG-CG2 4.44Å; L8-V30 HydrophobicContact CD2-CG1 4.06Å; L8-V30 HydrophobicContact CD2-CG2 4.03Å; L8-V30 HydrophobicContact CG-CG1 4.44Å; L8-V30 HydrophobicContact CG-CG2 4.1Å; A26-V30 WeakPolarHBondContact O-CG2 3.28Å; A26-V30 PolarHBondContact O-N 2.88Å; M27-V30 HydrophobicContact CE-CB 4.38Å; M27-V30 HydrophobicContact CE-CG1 4.35Å; M27-V30 PolarHBondContact O-N 3.17Å; M27-V30 HydrophobicContact SD-CG2 4.46Å; K28-V30 PolarHBondContact O-N 3.03Å; V30-E32 VanDerWaalsContact C-N 3.35Å; V30-L33 WeakPolarHBondContact O-CB 3.46Å; V30-L33 PolarHBondContact O-N 3.22Å; V30-L37 HydrophobicContact CG1-CD2 3.81Å
31	T	98	Very high	97	Very high	2 Å²	2	48 Å²	48	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-36.5	-178	-56.7	0	0	0	0	111.7	M27 K28 A29 L33 N34 L103 F107 L108	M27-T31 WeakPolarHBondContact O-CB 3.3Å; M27-T31 PolarHBondContact O-N 3.18Å; M27-T31 PolarHBondContact O-OG1 3.2Å; K28-T31 PolarHBondContact O-N 2.98Å; K28-T31 VanDerWaalsContact O-N 3.15Å; A29-T31 VanDerWaalsContact C-N 3.33Å; A29-T31 PolarHBondContact O-N 3.49Å; T31-L33 PolarHBondContact O-N 3.27Å; T31-N34 PolarHBondContact O-N 3.1Å; T31-N34 VanDerWaalsContact O-N 3.08Å; T31-L103 HydrophobicContact CG2-CB 4.11Å; T31-L103 HydrophobicContact CG2-CD2 4.01Å; T31-L103 HydrophobicContact CG2-CG 4.47Å; T31-F107 HydrophobicContact CG2-CB 3.82Å; T31-F107 HydrophobicContact CG2-CD2 4.42Å; T31-F107 HydrophobicContact CG2-CG 4.38Å; T31-L108 HydrophobicContact CG2-CD1 3.93Å; T31-L108 HydrophobicContact CG2-CD2 3.84Å; T31-L108 HydrophobicContact CG2-CG 3.78Å
32	E	97.4	Very high	96.9	Very high	93 Å²	93	44.8 Å²	44.8	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-71.3	-12.9	178.2	-71.7	175.7	166.3	0	0	113.6	K28 A29 V30 N34 L103 F107	K28-E32 VanDerWaalsContact CE-OE1 3.28Å; K28-E32 WeakPolarHBondContact CE-OE1 3.26Å; K28-E32 WeakPolarHBondContact O-CG 3.2Å; K28-E32 PolarHBondContact O-N 3.49Å; A29-E32 PolarHBondContact O-N 2.79Å; V30-E32 VanDerWaalsContact C-N 3.35Å; E32-N34 PolarHBondContact O-N 3.12Å; E32-L103 HydrophobicContact CG-CD2 3.78Å; E32-F107 HydrophobicContact CB-CZ 4.31Å; E32-F107 HydrophobicContact CG-CD2 4.46Å; E32-F107 HydrophobicContact CG-CE2 3.8Å; E32-F107 HydrophobicContact CG-CZ 3.9Å
33	L	96.4	Very high	96.8	Very high	65 Å²	65	46.2 Å²	46.2	34%	0.34	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.3	166.5	-61.3	176.9	0	0	0	112.7	R4 L7 A29 V30 T31 E35	R4-L33 HydrophobicContact CB-CD1 3.63Å; R4-L33 HydrophobicContact CG-CD1 4.05Å; L7-L33 HydrophobicContact CD1-CD1 4.31Å; A29-L33 WeakPolarHBondContact O-CG 3.4Å; A29-L33 PolarHBondContact O-N 3.34Å; V30-L33 WeakPolarHBondContact O-CB 3.46Å; V30-L33 PolarHBondContact O-N 3.22Å; T31-L33 PolarHBondContact O-N 3.27Å; L33-E35 PolarHBondContact O-N 3.03Å
34	N	95.1	Very high	96.8	Very high	85 Å²	85	46.7 Å²	46.7	46%	0.455	26%	0.257	S	S	.	.			trans	58.5	33.1	172.9	-165.4	58.7	0	0	0	113.8	T31 E32 F107 N111	T31-N34 PolarHBondContact O-N 3.1Å; T31-N34 VanDerWaalsContact O-N 3.08Å; E32-N34 PolarHBondContact O-N 3.12Å; N34-F107 HydrophobicContact CB-CD1 3.98Å; N34-F107 HydrophobicContact CB-CE1 4.42Å; N34-F107 WeakPolarHBondContact OD1-CD1 3.17Å; N34-N111 PolarHBondContact OD1-ND2 3.26Å
35	E	93.3	Very high	96.8	Very high	105 Å²	105	46.4 Å²	46.4	49%	0.491	26%	0.255	S	S	.	.			trans	-111.1	140.9	173.9	-77.8	175.2	-175.6	0	0	109.2	R4 L33 L37	R4-E35 VanDerWaalsContact CD-OE2 3.24Å; R4-E35 WeakPolarHBondContact CD-OE2 3.32Å; R4-E35 IonicContact CZ-OE2 3.52Å; R4-E35 IonicContact NE-OE2 2.94Å; R4-E35 PolarHBondContact NH1-O 2.94Å; R4-E35 IonicContact NH1-OE2 2.73Å; R4-E35 PolarHBondContact NH1-OE2 3.44Å; L33-E35 PolarHBondContact O-N 3.03Å; E35-L37 PolarHBondContact O-N 3.49Å
36	P	92.8	Very high	96.8	Very high	100 Å²	100	44.3 Å²	44.3	65%	0.649	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-51.1	137	178.9	-27.5	35	0	0	0	113	R4	R4-P36 PolarHBondContact NH2-O 3.23Å; R4-P36 VanDerWaalsContact NH2-O 3.08Å
37	L	96.5	Very high	96.8	Very high	13 Å²	13	46.5 Å²	46.5	7%	0.068	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-81.4	138.1	172.3	-59	-173	0	0	0	109.8	V30 E35 D41 R42 L45 L108	V30-L37 HydrophobicContact CG1-CD2 3.81Å; E35-L37 PolarHBondContact O-N 3.49Å; L37-D41 HydrophobicContact CB-CB 4Å; L37-D41 HydrophobicContact CD2-CB 4.16Å; L37-R42 HydrophobicContact CB-CB 4.19Å; L37-L45 HydrophobicContact CD1-CB 4.44Å; L37-L45 HydrophobicContact CD1-CD2 4.01Å; L37-L108 HydrophobicContact CD1-CD2 3.8Å; L37-L108 HydrophobicContact CG-CD2 3.89Å
38	S	95.8	Very high	96.8	Very high	54 Å²	54	46.5 Å²	46.5	38%	0.378	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-66.5	167.6	165.6	73.4	0	0	0	0	110.2	E40 D41 R42	S38-E40 PolarHBondContact O-N 3.12Å; S38-E40 PolarHBondContact OG-N 3.39Å; S38-D41 PolarHBondContact O-N 2.83Å; S38-D41 PolarHBondContact OG-N 2.74Å; S38-D41 PolarHBondContact OG-OD1 2.9Å; S38-D41 PolarHBondContact OG-OD2 2.87Å; S38-R42 WeakPolarHBondContact O-CB 3.44Å; S38-R42 PolarHBondContact O-N 2.96Å
39	N	94.1	Very high	96.8	Very high	84 Å²	84	44.2 Å²	44.2	45%	0.449	24%	0.243	S	C	.	.	H	α-helix	trans	-58.4	-36.8	173.7	-74.9	-13.1	0	0	0	111.9	N43	N39-N43 WeakPolarHBondContact O-CB 3.44Å; N39-N43 PolarHBondContact O-N 2.83Å; N39-N43 VanDerWaalsContact O-N 3.07Å; N39-N43 PolarHBondContact O-ND2 3.42Å
40	E	95.8	Very high	96.8	Very high	109 Å²	109	49 Å²	49	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-65.9	-51.2	175.6	-170.3	-169.7	148.3	0	0	111.4	R12 S38 R42 N43 L44	R12-E40 IonicContact CZ-OE1 3.44Å; R12-E40 IonicContact NE-OE1 3.41Å; R12-E40 PolarHBondContact NE-OE1 3.33Å; R12-E40 VanDerWaalsContact NE-OE1 3.15Å; R12-E40 IonicContact NH2-OE1 3.84Å; R12-E40 PolarHBondContact NH2-OE1 2.79Å; R12-E40 IonicContact NH2-OE2 3.88Å; S38-E40 PolarHBondContact O-N 3.12Å; S38-E40 PolarHBondContact OG-N 3.39Å; E40-R42 VanDerWaalsContact C-N 3.29Å; E40-R42 PolarHBondContact O-N 3.44Å; E40-N43 WeakPolarHBondContact O-CB 3.42Å; E40-N43 PolarHBondContact O-N 3.49Å; E40-N43 VanDerWaalsContact O-N 3.1Å; E40-L44 PolarHBondContact O-N 2.95Å
41	D	97.4	Very high	96.9	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.059	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-38.8	-179	-63.4	-9	0	0	0	111.4	R4 L8 M27 L37 S38 N43 L44 L45	R4-D41 IonicContact CZ-OD2 3.82Å; R4-D41 IonicContact NE-OD2 3.74Å; R4-D41 IonicContact NH2-OD2 2.82Å; R4-D41 PolarHBondContact NH2-OD2 3.23Å; L8-D41 HydrophobicContact CD2-CB 4.18Å; L8-D41 WeakPolarHBondContact CD2-OD1 3.32Å; M27-D41 HydrophobicContact CE-CB 4.47Å; M27-D41 WeakPolarHBondContact CE-O 3.42Å; L37-D41 HydrophobicContact CB-CB 4Å; L37-D41 HydrophobicContact CD2-CB 4.16Å; S38-D41 PolarHBondContact O-N 2.83Å; S38-D41 PolarHBondContact OG-N 2.74Å; S38-D41 PolarHBondContact OG-OD1 2.9Å; S38-D41 PolarHBondContact OG-OD2 2.87Å; D41-N43 VanDerWaalsContact C-N 3.34Å; D41-L44 WeakPolarHBondContact O-CB 3.43Å; D41-L44 PolarHBondContact O-N 3.39Å; D41-L45 PolarHBondContact O-N 3.4Å
42	R	97.3	Very high	96.9	Very high	8 Å²	8	51.8 Å²	51.8	3%	0.03	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-40.5	175.5	178.9	-178.1	81.9	-164.9	-0.8	111.6	L37 S38 E40 L45 S46 S119 F122 Y123	L37-R42 HydrophobicContact CB-CB 4.19Å; S38-R42 WeakPolarHBondContact O-CB 3.44Å; S38-R42 PolarHBondContact O-N 2.96Å; E40-R42 VanDerWaalsContact C-N 3.29Å; E40-R42 PolarHBondContact O-N 3.44Å; R42-L45 PolarHBondContact O-N 3.29Å; R42-S46 PolarHBondContact O-N 2.81Å; R42-S119 VanDerWaalsContact NH1-CA 3.28Å; R42-S119 PolarHBondContact NH1-OG 3.01Å; R42-F122 HydrophobicContact CG-CD1 3.49Å; R42-F122 VanDerWaalsContact CG-CD1 3.49Å; R42-F122 HydrophobicContact CG-CE1 3.24Å; R42-F122 HydrophobicContact CG-CG 4.23Å; R42-F122 HydrophobicContact CG-CZ 3.83Å; R42-Y123 WeakPolarHBondContact CD-OH 3.34Å; R42-Y123 HydrophobicContact CG-CD1 4.46Å; R42-Y123 HydrophobicContact CG-CE1 3.54Å
43	N	96.5	Very high	96.9	Very high	77 Å²	77	47.4 Å²	47.4	41%	0.412	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-40	174.9	-72.7	-16.2	0	0	0	111.3	N39 E40 D41 L45 S46 V47	N39-N43 WeakPolarHBondContact O-CB 3.44Å; N39-N43 PolarHBondContact O-N 2.83Å; N39-N43 VanDerWaalsContact O-N 3.07Å; N39-N43 PolarHBondContact O-ND2 3.42Å; E40-N43 WeakPolarHBondContact O-CB 3.42Å; E40-N43 PolarHBondContact O-N 3.49Å; E40-N43 VanDerWaalsContact O-N 3.1Å; D41-N43 VanDerWaalsContact C-N 3.34Å; N43-L45 PolarHBondContact O-N 2.95Å; N43-S46 WeakPolarHBondContact O-CB 3.34Å; N43-S46 PolarHBondContact O-N 3.34Å; N43-V47 WeakPolarHBondContact O-CG2 3.44Å; N43-V47 PolarHBondContact O-N 3.1Å
44	L	98.1	Very high	97	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-46.5	173.3	-71.1	172.8	0	0	0	111.8	L8 R12 E15 M23 M27 E40 D41 S46 V47 A48	L8-L44 HydrophobicContact CD2-CD1 4.43Å; R12-L44 HydrophobicContact CG-CD1 3.97Å; R12-L44 HydrophobicContact CG-CD2 4.33Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.45Å; M23-L44 HydrophobicContact CE-CB 3.96Å; M23-L44 HydrophobicContact CE-CD2 3.57Å; M23-L44 HydrophobicContact CE-CG 4.4Å; M23-L44 WeakPolarHBondContact CE-O 3.12Å; M27-L44 HydrophobicContact CE-CB 4.1Å; M27-L44 HydrophobicContact CG-CB 4.39Å; M27-L44 HydrophobicContact SD-CB 3.89Å; E40-L44 PolarHBondContact O-N 2.95Å; D41-L44 WeakPolarHBondContact O-CB 3.43Å; D41-L44 PolarHBondContact O-N 3.39Å; L44-S46 VanDerWaalsContact C-N 3.29Å; L44-S46 PolarHBondContact O-N 3.38Å; L44-V47 PolarHBondContact O-N 2.99Å; L44-A48 WeakPolarHBondContact O-CB 3.33Å; L44-A48 PolarHBondContact O-N 3.48Å
45	L	98.6	Very high	97.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-44.5	175.2	179.2	70.5	0	0	0	111.4	M27 L37 D41 R42 N43 A48 Y49 L103 L108	M27-L45 HydrophobicContact CB-CB 4.42Å; M27-L45 HydrophobicContact CB-CD1 3.74Å; M27-L45 HydrophobicContact CE-CB 4.01Å; L37-L45 HydrophobicContact CD1-CB 4.44Å; L37-L45 HydrophobicContact CD1-CD2 4.01Å; D41-L45 PolarHBondContact O-N 3.4Å; R42-L45 PolarHBondContact O-N 3.29Å; N43-L45 PolarHBondContact O-N 2.95Å; L45-A48 PolarHBondContact O-N 3.31Å; L45-Y49 HydrophobicContact CD1-CD2 3.65Å; L45-Y49 HydrophobicContact CD1-CE2 3.54Å; L45-Y49 HydrophobicContact CG-CD2 4.35Å; L45-Y49 PolarHBondContact O-N 2.83Å; L45-L103 HydrophobicContact CD1-CD1 4.42Å; L45-L108 HydrophobicContact CD2-CD1 3.52Å
46	S	98.3	Very high	97.4	Very high	28 Å²	28	41.3 Å²	41.3	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-48.6	179.6	-169.7	0	0	0	0	112.2	R42 N43 L44 A48 K50	R42-S46 PolarHBondContact O-N 2.81Å; N43-S46 WeakPolarHBondContact O-CB 3.34Å; N43-S46 PolarHBondContact O-N 3.34Å; L44-S46 VanDerWaalsContact C-N 3.29Å; L44-S46 PolarHBondContact O-N 3.38Å; S46-A48 VanDerWaalsContact C-N 3.34Å; S46-A48 PolarHBondContact O-N 3.05Å; S46-K50 WeakPolarHBondContact O-CB 3.45Å; S46-K50 PolarHBondContact O-N 3.29Å
47	V	98.4	Very high	97.7	Very high	47 Å²	47	37.9 Å²	37.9	29%	0.285	21%	0.208	S	C	.	.	H	α-helix	trans	-60.4	-43.3	177.7	169.2	0	0	0	0	111.2	Y20 M23 N43 L44 N51	Y20-V47 HydrophobicContact CE1-CG1 4.38Å; M23-V47 HydrophobicContact CE-CB 4.08Å; M23-V47 HydrophobicContact CE-CG1 4Å; M23-V47 HydrophobicContact SD-CG1 4.24Å; N43-V47 WeakPolarHBondContact O-CG2 3.44Å; N43-V47 PolarHBondContact O-N 3.1Å; L44-V47 PolarHBondContact O-N 2.99Å; V47-N51 PolarHBondContact O-N 3.07Å; V47-N51 VanDerWaalsContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 3.35Å
48	A	98.7	Very high	97.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.7	-61.9	179	0	0	0	0	0	111.5	M23 A24 L44 L45 S46 K50 N51 V52	M23-A48 HydrophobicContact CB-CB 3.97Å; M23-A48 HydrophobicContact CE-CB 4.14Å; M23-A48 HydrophobicContact CG-CB 3.6Å; M23-A48 VanDerWaalsContact SD-CA 3.55Å; M23-A48 HydrophobicContact SD-CB 3.58Å; M23-A48 VanDerWaalsContact SD-CB 3.58Å; A24-A48 HydrophobicContact CB-CB 4.19Å; L44-A48 WeakPolarHBondContact O-CB 3.33Å; L44-A48 PolarHBondContact O-N 3.48Å; L45-A48 PolarHBondContact O-N 3.31Å; S46-A48 VanDerWaalsContact C-N 3.34Å; S46-A48 PolarHBondContact O-N 3.05Å; A48-K50 PolarHBondContact O-N 3.05Å; A48-N51 PolarHBondContact O-N 3.36Å; A48-V52 VanDerWaalsContact O-CG2 3.29Å; A48-V52 WeakPolarHBondContact O-CG2 3.46Å; A48-V52 PolarHBondContact O-N 3.29Å; A48-V52 VanDerWaalsContact O-N 3.13Å
49	Y	98.8	Very high	97.9	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.02	23%	0.229	C	C	.	.	H	α-helix	trans	-70.6	-32.1	-175.3	-80.6	-84.5	0	0	0	112.9	A24 L45 N51 V52 V53 V96 D99 V100 L103 Y130	A24-Y49 HydrophobicContact CB-CD1 4.43Å; A24-Y49 HydrophobicContact CB-CD2 4.3Å; A24-Y49 HydrophobicContact CB-CE1 4.27Å; A24-Y49 HydrophobicContact CB-CE2 4.12Å; A24-Y49 HydrophobicContact CB-CG 4.46Å; L45-Y49 HydrophobicContact CD1-CD2 3.65Å; L45-Y49 HydrophobicContact CD1-CE2 3.54Å; L45-Y49 HydrophobicContact CG-CD2 4.35Å; L45-Y49 PolarHBondContact O-N 2.83Å; Y49-N51 VanDerWaalsContact C-N 3.33Å; Y49-N51 PolarHBondContact O-N 3.11Å; Y49-V52 PolarHBondContact O-N 3.42Å; Y49-V53 WeakPolarHBondContact O-CB 3.47Å; Y49-V53 WeakPolarHBondContact O-CG2 3.48Å; Y49-V53 PolarHBondContact O-N 2.92Å; Y49-V96 HydrophobicContact CD1-CG1 3.74Å; Y49-V96 HydrophobicContact CE1-CG1 4.09Å; Y49-D99 HydrophobicContact CE1-CB 4.27Å; Y49-V100 HydrophobicContact CD1-CB 3.69Å; Y49-V100 HydrophobicContact CD1-CG1 4.17Å; Y49-V100 HydrophobicContact CD1-CG2 4.34Å; Y49-V100 HydrophobicContact CD2-CB 4.26Å; Y49-V100 HydrophobicContact CD2-CG2 4.13Å; Y49-V100 HydrophobicContact CE1-CB 3.8Å; Y49-V100 HydrophobicContact CE2-CB 4.37Å; Y49-V100 HydrophobicContact CE2-CG2 4.48Å; Y49-V100 HydrophobicContact CG-CB 3.92Å; Y49-V100 HydrophobicContact CG-CG2 4.05Å; Y49-L103 HydrophobicContact CE2-CD1 4.03Å; Y49-L103 WeakPolarHBondContact OH-CD1 3.42Å; Y49-Y130 VanDerWaalsContact C-OH 3.26Å; Y49-Y130 WeakPolarHBondContact CB-OH 3.43Å
50	K	98.2	Very high	98.1	Very high	134 Å²	134	38.5 Å²	38.5	58%	0.583	21%	0.214	S	C	*	.	H	α-helix	trans	-58.7	-45.2	174.7	178.8	-177.2	175.3	-175.2	0	111.2	S46 A48 G54 Y130	S46-K50 WeakPolarHBondContact O-CB 3.45Å; S46-K50 PolarHBondContact O-N 3.29Å; A48-K50 PolarHBondContact O-N 3.05Å; K50-G54 WeakPolarHBondContact O-CA 3.45Å; K50-G54 PolarHBondContact O-N 3.25Å; K50-Y130 PolarHBondContact N-OH 3.28Å
51	N	98.5	Very high	98.2	Very high	57 Å²	57	38.1 Å²	38.1	31%	0.305	21%	0.208	S	C	.	.	H	α-helix	trans	-71.8	-42.4	-180	-79.8	-72.5	0	0	0	112.1	Y20 V47 A48 Y49 V53 G54 A55	Y20-N51 HydrophobicContact CD1-CB 3.51Å; Y20-N51 HydrophobicContact CD2-CB 3.48Å; Y20-N51 VanDerWaalsContact CD2-CB 3.48Å; Y20-N51 HydrophobicContact CE1-CB 3.85Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.44Å; Y20-N51 HydrophobicContact CE2-CB 3.82Å; Y20-N51 HydrophobicContact CG-CB 3.3Å; V47-N51 PolarHBondContact O-N 3.07Å; V47-N51 VanDerWaalsContact O-N 3.15Å; V47-N51 PolarHBondContact O-ND2 3.35Å; A48-N51 PolarHBondContact O-N 3.36Å; Y49-N51 VanDerWaalsContact C-N 3.33Å; Y49-N51 PolarHBondContact O-N 3.11Å; N51-V53 PolarHBondContact O-N 3.36Å; N51-G54 PolarHBondContact O-N 2.87Å; N51-A55 PolarHBondContact O-N 3.13Å
52	V	98.6	Very high	98.3	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-58.4	-49.6	176.9	174.1	0	0	0	0	110.9	Y20 A24 A48 Y49 R56 V96	Y20-V52 VanDerWaalsContact O-CG2 3.28Å; Y20-V52 WeakPolarHBondContact O-CG2 3.47Å; A24-V52 HydrophobicContact CB-CG2 4.09Å; A48-V52 VanDerWaalsContact O-CG2 3.29Å; A48-V52 WeakPolarHBondContact O-CG2 3.46Å; A48-V52 PolarHBondContact O-N 3.29Å; A48-V52 VanDerWaalsContact O-N 3.13Å; Y49-V52 PolarHBondContact O-N 3.42Å; V52-R56 WeakPolarHBondContact O-CD 3.29Å; V52-R56 PolarHBondContact O-NH1 2.93Å; V52-V96 HydrophobicContact CB-CG1 4.28Å; V52-V96 HydrophobicContact CG1-CB 4.27Å; V52-V96 HydrophobicContact CG1-CG1 3.5Å; V52-V96 HydrophobicContact CG1-CG2 3.77Å
53	V	98.6	Very high	98.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.9	-40.1	178.3	173.1	0	0	0	0	111.5	Y49 N51 A55 R56 R57 V96 Y130 Y133	Y49-V53 WeakPolarHBondContact O-CB 3.47Å; Y49-V53 WeakPolarHBondContact O-CG2 3.48Å; Y49-V53 PolarHBondContact O-N 2.92Å; N51-V53 PolarHBondContact O-N 3.36Å; V53-A55 VanDerWaalsContact C-N 3.34Å; V53-A55 PolarHBondContact O-N 2.95Å; V53-R56 PolarHBondContact O-N 3.08Å; V53-R56 VanDerWaalsContact O-N 3.15Å; V53-R57 HydrophobicContact CG1-CG 3.99Å; V53-R57 WeakPolarHBondContact O-CG 3.49Å; V53-R57 PolarHBondContact O-N 2.96Å; V53-V96 HydrophobicContact CG2-CB 4.1Å; V53-V96 HydrophobicContact CG2-CG1 3.41Å; V53-V96 VanDerWaalsContact CG2-CG1 3.41Å; V53-Y130 HydrophobicContact CB-CE1 4.22Å; V53-Y130 HydrophobicContact CG2-CD1 4.1Å; V53-Y130 HydrophobicContact CG2-CE1 3.68Å; V53-Y133 HydrophobicContact CG1-CD2 3.61Å; V53-Y133 HydrophobicContact CG1-CE2 4.25Å; V53-Y133 HydrophobicContact CG1-CG 4.05Å
54	G	98.2	Very high	98.3	Very high	26 Å²	26	39.6 Å²	39.6	27%	0.268	22%	0.221	S	C	.	.	H	α-helix	trans	-55.4	-45.6	177.8	0	0	0	0	0	113	K50 N51 R56 R57 S58	K50-G54 WeakPolarHBondContact O-CA 3.45Å; K50-G54 PolarHBondContact O-N 3.25Å; N51-G54 PolarHBondContact O-N 2.87Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 3.36Å; G54-R57 PolarHBondContact O-N 3.35Å; G54-S58 PolarHBondContact O-N 3.48Å; G54-S58 PolarHBondContact O-OG 2.83Å
55	A	98.3	Very high	98.3	Very high	56 Å²	56	41.3 Å²	41.3	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-61.4	-40	177.6	0	0	0	0	0	112.8	N51 V53 S59	N51-A55 PolarHBondContact O-N 3.13Å; V53-A55 VanDerWaalsContact C-N 3.34Å; V53-A55 PolarHBondContact O-N 2.95Å; A55-S59 WeakPolarHBondContact O-CB 3.23Å; A55-S59 PolarHBondContact O-N 3.22Å; A55-S59 PolarHBondContact O-OG 3.05Å
56	R	98.4	Very high	98.3	Very high	45 Å²	45	44.5 Å²	44.5	17%	0.17	25%	0.25	C	S	.	.	H	α-helix	trans	-71.9	-40.3	179.1	-72	155.1	178.7	85.8	-8.3	111.6	D21 V52 V53 G54 S59 W60 I89 L93	D21-R56 IonicContact OD1-CZ 3.19Å; D21-R56 IonicContact OD1-NH1 2.69Å; D21-R56 PolarHBondContact OD1-NH1 3.34Å; D21-R56 IonicContact OD1-NH2 3.79Å; D21-R56 PolarHBondContact OD1-NH2 3.03Å; D21-R56 IonicContact OD2-NH2 2.64Å; V52-R56 WeakPolarHBondContact O-CD 3.29Å; V52-R56 PolarHBondContact O-NH1 2.93Å; V53-R56 PolarHBondContact O-N 3.08Å; V53-R56 VanDerWaalsContact O-N 3.15Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 3.36Å; R56-S59 WeakPolarHBondContact O-CB 2.94Å; R56-S59 PolarHBondContact O-N 2.95Å; R56-W60 WeakPolarHBondContact O-CB 3.27Å; R56-W60 PolarHBondContact O-N 3.27Å; R56-I89 WeakPolarHBondContact O-CG2 3.47Å; R56-L93 HydrophobicContact CB-CB 4.29Å
57	R	98.2	Very high	98.2	Very high	28 Å²	28	44.5 Å²	44.5	11%	0.106	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-45.9	172.7	-71.8	178.5	71.7	-138.7	9.8	112	V53 G54 S59 W60 R61 L93 Y133 E136	V53-R57 HydrophobicContact CG1-CG 3.99Å; V53-R57 WeakPolarHBondContact O-CG 3.49Å; V53-R57 PolarHBondContact O-N 2.96Å; G54-R57 PolarHBondContact O-N 3.35Å; R57-S59 VanDerWaalsContact C-N 3.33Å; R57-S59 PolarHBondContact O-N 3.48Å; R57-W60 WeakPolarHBondContact O-CB 3.48Å; R57-W60 PolarHBondContact O-N 2.95Å; R57-R61 WeakPolarHBondContact O-CG 3.49Å; R57-R61 PolarHBondContact O-N 3.19Å; R57-L93 HydrophobicContact CB-CD1 4.48Å; R57-L93 HydrophobicContact CG-CD1 3.5Å; R57-Y133 VanDerWaalsContact CZ-CD1 3.45Å; R57-E136 IonicContact CZ-OE2 3.8Å; R57-E136 IonicContact NE-OE2 2.88Å; R57-E136 PolarHBondContact NE-OE2 3.45Å; R57-E136 IonicContact NH2-OE1 3.72Å; R57-E136 IonicContact NH2-OE2 3.01Å; R57-E136 PolarHBondContact NH2-OE2 3.02Å
58	S	98.4	Very high	98.1	Very high	66 Å²	66	48.6 Å²	48.6	46%	0.462	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-44.8	175.3	-65.8	0	0	0	0	111.5	G54 W60 R61 V62	G54-S58 PolarHBondContact O-N 3.48Å; G54-S58 PolarHBondContact O-OG 2.83Å; S58-W60 VanDerWaalsContact C-N 3.33Å; S58-W60 PolarHBondContact O-N 3.12Å; S58-R61 PolarHBondContact O-N 3.21Å; S58-V62 WeakPolarHBondContact O-CG2 3.34Å; S58-V62 PolarHBondContact O-N 2.9Å; S58-V62 VanDerWaalsContact O-N 3.16Å
59	S	98.5	Very high	98	Very high	61 Å²	61	54.9 Å²	54.9	43%	0.427	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-42.5	175.8	-59.1	0	0	0	0	111.9	A55 R56 R57 V62 I63	A55-S59 WeakPolarHBondContact O-CB 3.23Å; A55-S59 PolarHBondContact O-N 3.22Å; A55-S59 PolarHBondContact O-OG 3.05Å; R56-S59 WeakPolarHBondContact O-CB 2.94Å; R56-S59 PolarHBondContact O-N 2.95Å; R57-S59 VanDerWaalsContact C-N 3.33Å; R57-S59 PolarHBondContact O-N 3.48Å; S59-V62 PolarHBondContact O-N 3.48Å; S59-I63 WeakPolarHBondContact O-CG2 3.38Å; S59-I63 PolarHBondContact O-N 2.68Å
60	W	98.5	Very high	97.8	Very high	37 Å²	37	54.7 Å²	54.7	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-46.7	177.7	-178.5	82.3	0	0	0	112.1	R56 R57 S58 V62 I63 S64 I89 E90 E136 V137	R56-W60 WeakPolarHBondContact O-CB 3.27Å; R56-W60 PolarHBondContact O-N 3.27Å; R57-W60 WeakPolarHBondContact O-CB 3.48Å; R57-W60 PolarHBondContact O-N 2.95Å; S58-W60 VanDerWaalsContact C-N 3.33Å; S58-W60 PolarHBondContact O-N 3.12Å; W60-V62 VanDerWaalsContact C-N 3.34Å; W60-V62 PolarHBondContact O-N 3Å; W60-I63 WeakPolarHBondContact O-CG2 3.29Å; W60-I63 PolarHBondContact O-N 3.42Å; W60-S64 WeakPolarHBondContact O-CB 3.28Å; W60-S64 PolarHBondContact O-N 3.28Å; W60-S64 PolarHBondContact O-OG 3.2Å; W60-I89 HydrophobicContact CB-CG2 3.8Å; W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 PolarHBondContact NE1-OE1 3.12Å; W60-E136 HydrophobicContact CE3-CG 4.45Å; W60-E136 HydrophobicContact CH2-CG 4.23Å; W60-E136 WeakPolarHBondContact CH2-O 3.36Å; W60-E136 HydrophobicContact CZ3-CG 3.77Å; W60-V137 HydrophobicContact CD2-CG1 3.64Å; W60-V137 HydrophobicContact CE3-CG1 4.03Å; W60-V137 HydrophobicContact CG-CG1 3.99Å; W60-V137 HydrophobicContact CH2-CG1 4.33Å; W60-V137 HydrophobicContact CZ2-CB 4.24Å; W60-V137 HydrophobicContact CZ2-CG1 3.97Å; W60-V137 HydrophobicContact CZ3-CG1 4.37Å
61	R	98.1	Very high	97.6	Very high	102 Å²	102	54 Å²	54	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-61.1	-42.4	178.1	-70.3	171.9	-177.2	172	-18.8	112.4	R57 S58 S65 E136	R57-R61 WeakPolarHBondContact O-CG 3.49Å; R57-R61 PolarHBondContact O-N 3.19Å; S58-R61 PolarHBondContact O-N 3.21Å; R61-S65 PolarHBondContact O-N 3.03Å; R61-E136 IonicContact CZ-OE1 2.74Å; R61-E136 IonicContact NE-OE1 2.67Å; R61-E136 PolarHBondContact NE-OE1 3.32Å; R61-E136 IonicContact NH2-OE1 2.63Å; R61-E136 PolarHBondContact NH2-OE1 3.21Å; R61-E136 IonicContact NH2-OE2 3.95Å
62	V	98.4	Very high	97.4	Very high	90 Å²	90	55.6 Å²	55.6	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-48.4	177.5	172.1	0	0	0	0	110.8	S58 S59 W60 S64 S65 I66	S58-V62 WeakPolarHBondContact O-CG2 3.34Å; S58-V62 PolarHBondContact O-N 2.9Å; S58-V62 VanDerWaalsContact O-N 3.16Å; S59-V62 PolarHBondContact O-N 3.48Å; W60-V62 VanDerWaalsContact C-N 3.34Å; W60-V62 PolarHBondContact O-N 3Å; V62-S64 PolarHBondContact O-N 2.81Å; V62-S65 PolarHBondContact O-N 3.27Å; V62-I66 HydrophobicContact CG1-CD1 3.94Å; V62-I66 WeakPolarHBondContact O-CG1 3.45Å; V62-I66 PolarHBondContact O-N 3.5Å
63	I	98.2	Very high	97.1	Very high	17 Å²	17	60.5 Å²	60.5	9%	0.087	34%	0.338	C	S	.	.	H	α-helix	trans	-68.2	-36.1	-178.8	-164.8	66	0	0	0	111.9	S59 W60 S65 I66 E67 V82 Y85 R86 I89	S59-I63 WeakPolarHBondContact O-CG2 3.38Å; S59-I63 PolarHBondContact O-N 2.68Å; W60-I63 WeakPolarHBondContact O-CG2 3.29Å; W60-I63 PolarHBondContact O-N 3.42Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 3.42Å; I63-I66 HydrophobicContact CD1-CB 4.43Å; I63-I66 HydrophobicContact CD1-CD1 4.38Å; I63-I66 CarbonylContact O-C 3.47Å; I63-I66 PolarHBondContact O-N 3.46Å; I63-E67 PolarHBondContact O-N 3.1Å; I63-V82 HydrophobicContact CD1-CG1 3.79Å; I63-V82 HydrophobicContact CG1-CG1 3.98Å; I63-Y85 HydrophobicContact CD1-CD1 3.85Å; I63-Y85 HydrophobicContact CG1-CD1 4Å; I63-R86 HydrophobicContact CG1-CB 4.23Å; I63-R86 HydrophobicContact CG2-CB 3.78Å; I63-R86 HydrophobicContact CG2-CG 3.95Å; I63-I89 HydrophobicContact CB-CD1 4.4Å; I63-I89 HydrophobicContact CG2-CD1 3.88Å
64	S	97.3	Very high	96.7	Very high	20 Å²	20	63.3 Å²	63.3	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-61.8	-39.9	173.4	-65.7	0	0	0	0	111.7	W60 V62 E67 Q68 R86	W60-S64 WeakPolarHBondContact O-CB 3.28Å; W60-S64 PolarHBondContact O-N 3.28Å; W60-S64 PolarHBondContact O-OG 3.2Å; V62-S64 PolarHBondContact O-N 2.81Å; S64-E67 WeakPolarHBondContact O-CB 3.48Å; S64-E67 PolarHBondContact O-N 3.35Å; S64-Q68 WeakPolarHBondContact O-CG 3.48Å; S64-Q68 PolarHBondContact O-N 2.73Å; S64-Q68 VanDerWaalsContact O-N 3.08Å; S64-R86 WeakPolarHBondContact OG-CD 3.31Å
65	S	97.4	Very high	96.5	Very high	45 Å²	45	65.9 Å²	65.9	32%	0.315	37%	0.374	S	S	.	.	H	α-helix	trans	-65.4	-39.9	172.7	-175.4	0	0	0	0	112.5	R61 V62 I63 E67 Q68 K69	R61-S65 PolarHBondContact O-N 3.03Å; V62-S65 PolarHBondContact O-N 3.27Å; I63-S65 VanDerWaalsContact C-N 3.33Å; I63-S65 PolarHBondContact O-N 3.42Å; S65-E67 VanDerWaalsContact C-N 3.31Å; S65-E67 PolarHBondContact O-N 3.35Å; S65-Q68 PolarHBondContact O-N 3.45Å; S65-K69 WeakPolarHBondContact O-CG 3.48Å; S65-K69 PolarHBondContact O-N 3.13Å; S65-K69 VanDerWaalsContact O-N 3.15Å
66	I	97.7	Very high	96.3	Very high	67 Å²	67	70.9 Å²	70.9	34%	0.344	39%	0.388	S	S	.	.	H	α-helix	trans	-64.9	-37.3	174.9	-67.5	167.2	0	0	0	110.9	V62 I63 K69 T70 V82	V62-I66 HydrophobicContact CG1-CD1 3.94Å; V62-I66 WeakPolarHBondContact O-CG1 3.45Å; V62-I66 PolarHBondContact O-N 3.5Å; I63-I66 HydrophobicContact CD1-CB 4.43Å; I63-I66 HydrophobicContact CD1-CD1 4.38Å; I63-I66 CarbonylContact O-C 3.47Å; I63-I66 PolarHBondContact O-N 3.46Å; I66-K69 PolarHBondContact O-N 3.5Å; I66-T70 VanDerWaalsContact O-CB 3.27Å; I66-T70 WeakPolarHBondContact O-CB 3.28Å; I66-T70 PolarHBondContact O-N 2.86Å; I66-T70 PolarHBondContact O-OG1 2.87Å; I66-V82 HydrophobicContact CG2-CG1 4.16Å; I66-V82 HydrophobicContact CG2-CG2 4Å
67	E	96.9	Very high	96.2	Very high	28 Å²	28	76.7 Å²	76.7	13%	0.131	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-50.4	176.1	-169.6	179.5	159.2	0	0	111	I63 S64 S65 K69 T70 M71 L79 V82 K83 R86	I63-E67 PolarHBondContact O-N 3.1Å; S64-E67 WeakPolarHBondContact O-CB 3.48Å; S64-E67 PolarHBondContact O-N 3.35Å; S65-E67 VanDerWaalsContact C-N 3.31Å; S65-E67 PolarHBondContact O-N 3.35Å; E67-K69 VanDerWaalsContact C-N 3.33Å; E67-K69 PolarHBondContact O-N 3.44Å; E67-T70 PolarHBondContact O-N 3.15Å; E67-T70 VanDerWaalsContact O-N 3.17Å; E67-M71 WeakPolarHBondContact O-CB 3.39Å; E67-M71 PolarHBondContact O-N 3.18Å; E67-L79 HydrophobicContact CG-CD1 3.73Å; E67-V82 HydrophobicContact CB-CG1 3.62Å; E67-V82 HydrophobicContact CG-CG1 4.13Å; E67-K83 HydrophobicContact CG-CG 4.16Å; E67-K83 WeakPolarHBondContact OE1-CE 3.19Å; E67-K83 WeakPolarHBondContact OE1-CG 3.27Å; E67-R86 IonicContact OE1-NH2 3.48Å; E67-R86 VanDerWaalsContact OE2-CD 3.32Å; E67-R86 WeakPolarHBondContact OE2-CD 3.05Å; E67-R86 IonicContact OE2-CZ 3.36Å; E67-R86 IonicContact OE2-NE 3.12Å; E67-R86 PolarHBondContact OE2-NE 2.92Å; E67-R86 IonicContact OE2-NH2 2.83Å
68	Q	95.8	Very high	96.1	Very high	133 Å²	133	79.5 Å²	79.5	62%	0.621	43%	0.427	S	S	*	.	H	α-helix	trans	-56.9	-45.6	178	-71.5	174.1	-9.4	0	0	111.8	S64 S65 M71 A72	S64-Q68 WeakPolarHBondContact O-CG 3.48Å; S64-Q68 PolarHBondContact O-N 2.73Å; S64-Q68 VanDerWaalsContact O-N 3.08Å; S65-Q68 PolarHBondContact O-N 3.45Å; Q68-M71 PolarHBondContact O-N 3.09Å; Q68-A72 PolarHBondContact O-N 3.25Å
69	K	96.2	Very high	96	Very high	133 Å²	133	77.7 Å²	77.7	58%	0.578	41%	0.412	S	S	*	.	H	α-helix	trans	-64.3	-43.7	176.4	-69.1	171.2	-177.4	171.1	0	112.1	S65 I66 E67 M71 A72 D73	S65-K69 WeakPolarHBondContact O-CG 3.48Å; S65-K69 PolarHBondContact O-N 3.13Å; S65-K69 VanDerWaalsContact O-N 3.15Å; I66-K69 PolarHBondContact O-N 3.5Å; E67-K69 VanDerWaalsContact C-N 3.33Å; E67-K69 PolarHBondContact O-N 3.44Å; K69-M71 VanDerWaalsContact C-N 3.29Å; K69-M71 PolarHBondContact O-N 2.93Å; K69-A72 WeakPolarHBondContact O-CB 3.29Å; K69-A72 PolarHBondContact O-N 3.21Å; K69-A72 VanDerWaalsContact O-N 3.15Å; K69-D73 PolarHBondContact O-N 2.91Å; K69-D73 VanDerWaalsContact O-N 3.09Å
70	T	95.7	Very high	96	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.006	42%	0.423	C	S	.	.	H	α-helix	trans	-67	-32.5	-180	-58.2	0	0	0	0	112.1	I66 E67 A72 D73 G74 K78 L79	I66-T70 VanDerWaalsContact O-CB 3.27Å; I66-T70 WeakPolarHBondContact O-CB 3.28Å; I66-T70 PolarHBondContact O-N 2.86Å; I66-T70 PolarHBondContact O-OG1 2.87Å; E67-T70 PolarHBondContact O-N 3.15Å; E67-T70 VanDerWaalsContact O-N 3.17Å; T70-A72 VanDerWaalsContact C-N 3.34Å; T70-D73 PolarHBondContact O-N 3.11Å; T70-G74 PolarHBondContact O-N 3.16Å; T70-K78 HydrophobicContact CG2-CB 3.82Å; T70-K78 HydrophobicContact CG2-CD 3.76Å; T70-K78 HydrophobicContact CG2-CG 3.67Å; T70-K78 WeakPolarHBondContact OG1-CE 3.31Å; T70-L79 HydrophobicContact CG2-CB 3.98Å; T70-L79 HydrophobicContact CG2-CD1 4.39Å
71	M	94.5	Very high	95.9	Very high	119 Å²	119	87.2 Å²	87.2	59%	0.586	45%	0.449	S	S	*	.	H	α-helix	trans	-64	-39.5	173.1	-175.3	173	63.7	0	0	111.3	E67 Q68 K69 D73 G74 L79	E67-M71 WeakPolarHBondContact O-CB 3.39Å; E67-M71 PolarHBondContact O-N 3.18Å; Q68-M71 PolarHBondContact O-N 3.09Å; K69-M71 VanDerWaalsContact C-N 3.29Å; K69-M71 PolarHBondContact O-N 2.93Å; M71-D73 VanDerWaalsContact C-N 3.35Å; M71-G74 PolarHBondContact O-N 3.25Å; M71-L79 HydrophobicContact CB-CD1 4.13Å; M71-L79 HydrophobicContact CB-CD2 4.43Å; M71-L79 HydrophobicContact CG-CD2 4.48Å
72	A	94.3	Very high	95.9	Very high	90 Å²	90	83 Å²	83	74%	0.744	44%	0.435	S	S	*	.	H	α-helix	trans	-68.5	-30.8	174.3	0	0	0	0	0	113.2	Q68 K69 T70 G74	Q68-A72 PolarHBondContact O-N 3.25Å; K69-A72 WeakPolarHBondContact O-CB 3.29Å; K69-A72 PolarHBondContact O-N 3.21Å; K69-A72 VanDerWaalsContact O-N 3.15Å; T70-A72 VanDerWaalsContact C-N 3.34Å; A72-G74 VanDerWaalsContact C-N 3.25Å; A72-G74 PolarHBondContact O-N 3.45Å
73	D	91.1	Very high	95.9	Very high	107 Å²	107	82.5 Å²	82.5	57%	0.572	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.7	177.6	-64	-20.5	0	0	0	113.7	K69 T70 M71 N75 K78	K69-D73 PolarHBondContact O-N 2.91Å; K69-D73 VanDerWaalsContact O-N 3.09Å; T70-D73 PolarHBondContact O-N 3.11Å; M71-D73 VanDerWaalsContact C-N 3.35Å; D73-N75 PolarHBondContact O-N 2.74Å; D73-K78 IonicContact OD2-NZ 3.95Å
74	G	90.9	Very high	95.9	Very high	58 Å²	58	84.4 Å²	84.4	60%	0.598	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	8.6	-178	0	0	0	0	0	115.5	T70 M71 A72 E76	T70-G74 PolarHBondContact O-N 3.16Å; M71-G74 PolarHBondContact O-N 3.25Å; A72-G74 VanDerWaalsContact C-N 3.25Å; A72-G74 PolarHBondContact O-N 3.45Å; G74-E76 PolarHBondContact O-N 3.43Å; G74-E76 VanDerWaalsContact O-N 3.12Å
75	N	93.1	Very high	95.9	Very high	80 Å²	80	89.5 Å²	89.5	43%	0.428	46%	0.46	S	S	.	.			trans	-83.3	87.8	-179.5	-172.6	-26	0	0	0	111.5	D73 K77 K78 L79	D73-N75 PolarHBondContact O-N 2.74Å; N75-K77 PolarHBondContact O-N 3.2Å; N75-K78 HydrophobicContact CB-CB 4.02Å; N75-K78 VanDerWaalsContact CG-CB 3.46Å; N75-K78 PolarHBondContact O-N 3.36Å; N75-K78 VanDerWaalsContact O-N 3.16Å; N75-K78 WeakPolarHBondContact OD1-CB 3.45Å; N75-K78 PolarHBondContact OD1-N 2.9Å; N75-K78 VanDerWaalsContact OD1-N 3.09Å; N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 2.97Å
76	E	95.1	Very high	96	Very high	162 Å²	162	89.5 Å²	89.5	76%	0.757	45%	0.453	S	S	*	.	H	α-helix	trans	-56.4	-44	-175.4	-64.4	-179.3	171	0	0	113.9	G74 K78 L79 E80	G74-E76 PolarHBondContact O-N 3.43Å; G74-E76 VanDerWaalsContact O-N 3.12Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.38Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 PolarHBondContact O-N 3.3Å; E76-E80 PolarHBondContact O-N 3.47Å
77	K	95.2	Very high	96	Very high	167 Å²	167	90.4 Å²	90.4	73%	0.726	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-36.2	179.8	-71	-176.6	179.5	177.5	0	112.4	N75 K81	N75-K77 PolarHBondContact O-N 3.2Å; K77-K81 WeakPolarHBondContact O-CG 3.24Å; K77-K81 PolarHBondContact O-N 3Å
78	K	96	Very high	96	Very high	87 Å²	87	94.2 Å²	94.2	38%	0.378	47%	0.472	S	S	.	.	H	α-helix	trans	-71.6	-41.7	174.8	-173.5	-175.2	163.5	-163.1	0	109.8	T70 D73 N75 E76 E80 K81 V82	T70-K78 HydrophobicContact CG2-CB 3.82Å; T70-K78 HydrophobicContact CG2-CD 3.76Å; T70-K78 HydrophobicContact CG2-CG 3.67Å; T70-K78 WeakPolarHBondContact OG1-CE 3.31Å; D73-K78 IonicContact OD2-NZ 3.95Å; N75-K78 HydrophobicContact CB-CB 4.02Å; N75-K78 VanDerWaalsContact CG-CB 3.46Å; N75-K78 PolarHBondContact O-N 3.36Å; N75-K78 VanDerWaalsContact O-N 3.16Å; N75-K78 WeakPolarHBondContact OD1-CB 3.45Å; N75-K78 PolarHBondContact OD1-N 2.9Å; N75-K78 VanDerWaalsContact OD1-N 3.09Å; E76-K78 VanDerWaalsContact C-N 3.32Å; E76-K78 PolarHBondContact O-N 3.38Å; K78-E80 PolarHBondContact O-N 3.35Å; K78-K81 PolarHBondContact O-N 3.46Å; K78-V82 HydrophobicContact CG-CG2 4.45Å; K78-V82 VanDerWaalsContact O-CG2 3.31Å; K78-V82 WeakPolarHBondContact O-CG2 3.47Å; K78-V82 PolarHBondContact O-N 2.87Å
79	L	97.4	Very high	96.2	Very high	28 Å²	28	88.1 Å²	88.1	15%	0.147	44%	0.444	C	S	.	.	H	α-helix	trans	-59.3	-45.2	178.5	-176.3	60.2	0	0	0	111.8	E67 T70 M71 N75 E76 K81 V82 K83	E67-L79 HydrophobicContact CG-CD1 3.73Å; T70-L79 HydrophobicContact CG2-CB 3.98Å; T70-L79 HydrophobicContact CG2-CD1 4.39Å; M71-L79 HydrophobicContact CB-CD1 4.13Å; M71-L79 HydrophobicContact CB-CD2 4.43Å; M71-L79 HydrophobicContact CG-CD2 4.48Å; N75-L79 WeakPolarHBondContact O-CB 3.39Å; N75-L79 PolarHBondContact O-N 2.97Å; E76-L79 WeakPolarHBondContact O-CB 3.38Å; E76-L79 PolarHBondContact O-N 3.3Å; L79-K81 PolarHBondContact O-N 3.38Å; L79-V82 PolarHBondContact O-N 3.48Å; L79-K83 HydrophobicContact CD1-CD 4.49Å; L79-K83 HydrophobicContact CD1-CG 4.48Å; L79-K83 HydrophobicContact CG-CD 4.26Å; L79-K83 WeakPolarHBondContact O-CB 3.01Å; L79-K83 WeakPolarHBondContact O-CG 3.06Å; L79-K83 PolarHBondContact O-N 3.02Å
80	E	97.6	Very high	96.3	Very high	138 Å²	138	83.3 Å²	83.3	65%	0.645	42%	0.423	S	S	*	.	H	α-helix	trans	-57.9	-46.1	176.4	-172.6	-174.1	176.5	0	0	112	E76 K78 V82 K83 A84	E76-E80 PolarHBondContact O-N 3.47Å; K78-E80 PolarHBondContact O-N 3.35Å; E80-V82 PolarHBondContact O-N 2.72Å; E80-K83 PolarHBondContact O-N 3.26Å; E80-A84 WeakPolarHBondContact O-CB 3.16Å; E80-A84 PolarHBondContact O-N 3.26Å
81	K	97.9	Very high	96.4	Very high	160 Å²	160	89.6 Å²	89.6	70%	0.696	45%	0.451	S	S	*	.	H	α-helix	trans	-64.1	-40.3	177.7	-70.4	179.2	-179.8	-175.8	0	112.7	K77 K78 L79 Y85	K77-K81 WeakPolarHBondContact O-CG 3.24Å; K77-K81 PolarHBondContact O-N 3Å; K78-K81 PolarHBondContact O-N 3.46Å; L79-K81 PolarHBondContact O-N 3.38Å; K81-Y85 PolarHBondContact O-N 2.86Å; K81-Y85 VanDerWaalsContact O-N 3.08Å
82	V	97.9	Very high	96.6	Very high	14 Å²	14	87.5 Å²	87.5	9%	0.085	44%	0.439	C	S	.	.	H	α-helix	trans	-66.3	-44.8	178.6	171.7	0	0	0	0	110.4	I63 I66 E67 K78 L79 E80 Y85 R86	I63-V82 HydrophobicContact CD1-CG1 3.79Å; I63-V82 HydrophobicContact CG1-CG1 3.98Å; I66-V82 HydrophobicContact CG2-CG1 4.16Å; I66-V82 HydrophobicContact CG2-CG2 4Å; E67-V82 HydrophobicContact CB-CG1 3.62Å; E67-V82 HydrophobicContact CG-CG1 4.13Å; K78-V82 HydrophobicContact CG-CG2 4.45Å; K78-V82 VanDerWaalsContact O-CG2 3.31Å; K78-V82 WeakPolarHBondContact O-CG2 3.47Å; K78-V82 PolarHBondContact O-N 2.87Å; L79-V82 PolarHBondContact O-N 3.48Å; E80-V82 PolarHBondContact O-N 2.72Å; V82-Y85 PolarHBondContact O-N 2.92Å; V82-R86 PolarHBondContact O-N 3.17Å
83	K	97.7	Very high	96.7	Very high	79 Å²	79	83.2 Å²	83.2	34%	0.343	40%	0.404	S	S	.	.	H	α-helix	trans	-57.9	-50.1	174.5	-79.1	178.1	175.7	-176.5	0	112.2	E67 L79 E80 Y85 R86 E87	E67-K83 HydrophobicContact CG-CG 4.16Å; E67-K83 WeakPolarHBondContact OE1-CE 3.19Å; E67-K83 WeakPolarHBondContact OE1-CG 3.27Å; L79-K83 HydrophobicContact CD1-CD 4.49Å; L79-K83 HydrophobicContact CD1-CG 4.48Å; L79-K83 HydrophobicContact CG-CD 4.26Å; L79-K83 WeakPolarHBondContact O-CB 3.01Å; L79-K83 WeakPolarHBondContact O-CG 3.06Å; L79-K83 PolarHBondContact O-N 3.02Å; E80-K83 PolarHBondContact O-N 3.26Å; K83-Y85 PolarHBondContact O-N 2.84Å; K83-R86 PolarHBondContact O-N 2.91Å; K83-R86 VanDerWaalsContact O-N 3.15Å; K83-E87 WeakPolarHBondContact O-CG 3.17Å; K83-E87 PolarHBondContact O-N 3.29Å
84	A	98.1	Very high	97.1	Very high	56 Å²	56	81.2 Å²	81.2	46%	0.463	39%	0.391	S	S	.	.	H	α-helix	trans	-59.2	-36.1	178.4	0	0	0	0	0	112.3	E80 K88	E80-A84 WeakPolarHBondContact O-CB 3.16Å; E80-A84 PolarHBondContact O-N 3.26Å; A84-K88 PolarHBondContact O-N 3.42Å; A84-K88 VanDerWaalsContact O-N 3.1Å
85	Y	98.3	Very high	97.4	Very high	128 Å²	128	82.5 Å²	82.5	50%	0.502	39%	0.388	S	S	.	.	H	α-helix	trans	-74	-38.7	176.5	-164	-114.8	0	0	0	112.8	I63 K81 V82 K83 K88 I89	I63-Y85 HydrophobicContact CD1-CD1 3.85Å; I63-Y85 HydrophobicContact CG1-CD1 4Å; K81-Y85 PolarHBondContact O-N 2.86Å; K81-Y85 VanDerWaalsContact O-N 3.08Å; V82-Y85 PolarHBondContact O-N 2.92Å; K83-Y85 PolarHBondContact O-N 2.84Å; Y85-K88 HydrophobicContact CD2-CD 4.37Å; Y85-K88 HydrophobicContact CE2-CD 4.37Å; Y85-K88 WeakPolarHBondContact O-CB 3.41Å; Y85-K88 PolarHBondContact O-N 3.27Å; Y85-I89 HydrophobicContact CD1-CD1 3.9Å; Y85-I89 HydrophobicContact CE1-CD1 3.7Å; Y85-I89 HydrophobicContact CE1-CG1 4.48Å; Y85-I89 PolarHBondContact O-N 3.23Å; Y85-I89 VanDerWaalsContact O-N 3.13Å
86	R	98.1	Very high	97.7	Very high	44 Å²	44	79.4 Å²	79.4	17%	0.166	37%	0.372	C	S	.	.	H	α-helix	trans	-57.3	-51.2	171.1	-179.5	-176.3	54.2	72.6	7.3	110.8	I63 S64 E67 V82 K83 K88 I89 E90	I63-R86 HydrophobicContact CG1-CB 4.23Å; I63-R86 HydrophobicContact CG2-CB 3.78Å; I63-R86 HydrophobicContact CG2-CG 3.95Å; S64-R86 WeakPolarHBondContact OG-CD 3.31Å; E67-R86 IonicContact OE1-NH2 3.48Å; E67-R86 VanDerWaalsContact OE2-CD 3.32Å; E67-R86 WeakPolarHBondContact OE2-CD 3.05Å; E67-R86 IonicContact OE2-CZ 3.36Å; E67-R86 IonicContact OE2-NE 3.12Å; E67-R86 PolarHBondContact OE2-NE 2.92Å; E67-R86 IonicContact OE2-NH2 2.83Å; V82-R86 PolarHBondContact O-N 3.17Å; K83-R86 PolarHBondContact O-N 2.91Å; K83-R86 VanDerWaalsContact O-N 3.15Å; R86-K88 PolarHBondContact O-N 3.38Å; R86-I89 WeakPolarHBondContact O-CB 3.37Å; R86-I89 PolarHBondContact O-N 3.45Å; R86-E90 HydrophobicContact CG-CG 4.46Å; R86-E90 IonicContact CZ-OE1 3.29Å; R86-E90 IonicContact NH1-OE1 3.67Å; R86-E90 PolarHBondContact NH1-OE1 3.47Å; R86-E90 IonicContact NH1-OE2 2.68Å; R86-E90 PolarHBondContact NH1-OE2 2.95Å; R86-E90 WeakPolarHBondContact O-CG 3.4Å; R86-E90 PolarHBondContact O-N 3.39Å
87	E	97.6	Very high	97.9	Very high	86 Å²	86	71.7 Å²	71.7	40%	0.402	34%	0.336	S	S	.	.	H	α-helix	trans	-61.4	-32.5	179.5	-71	173.7	-170.5	0	0	112.8	K83 E90 K91	K83-E87 WeakPolarHBondContact O-CG 3.17Å; K83-E87 PolarHBondContact O-N 3.29Å; E87-E90 PolarHBondContact O-N 3.04Å; E87-K91 WeakPolarHBondContact O-CG 3.18Å; E87-K91 PolarHBondContact O-N 3.28Å; E87-K91 VanDerWaalsContact O-N 3.07Å
88	K	98.4	Very high	98	Very high	109 Å²	109	67.1 Å²	67.1	47%	0.474	32%	0.319	S	S	.	.	H	α-helix	trans	-62.6	-47.9	172.1	-175.4	-173.1	176.5	-161.3	0	111.1	A84 Y85 R86 E90 K91 E92	A84-K88 PolarHBondContact O-N 3.42Å; A84-K88 VanDerWaalsContact O-N 3.1Å; Y85-K88 HydrophobicContact CD2-CD 4.37Å; Y85-K88 HydrophobicContact CE2-CD 4.37Å; Y85-K88 WeakPolarHBondContact O-CB 3.41Å; Y85-K88 PolarHBondContact O-N 3.27Å; R86-K88 PolarHBondContact O-N 3.38Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 3.13Å; K88-K91 PolarHBondContact O-N 3.37Å; K88-E92 WeakPolarHBondContact CE-OE1 3.47Å; K88-E92 IonicContact NZ-OE1 2.8Å; K88-E92 WeakPolarHBondContact O-CG 3.27Å; K88-E92 PolarHBondContact O-N 3.41Å
89	I	98.5	Very high	98.1	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-38.9	178.2	-66.3	162.9	0	0	0	110.7	R56 W60 I63 Y85 R86 K91 E92 L93	R56-I89 WeakPolarHBondContact O-CG2 3.47Å; W60-I89 HydrophobicContact CB-CG2 3.8Å; I63-I89 HydrophobicContact CB-CD1 4.4Å; I63-I89 HydrophobicContact CG2-CD1 3.88Å; Y85-I89 HydrophobicContact CD1-CD1 3.9Å; Y85-I89 HydrophobicContact CE1-CD1 3.7Å; Y85-I89 HydrophobicContact CE1-CG1 4.48Å; Y85-I89 PolarHBondContact O-N 3.23Å; Y85-I89 VanDerWaalsContact O-N 3.13Å; R86-I89 WeakPolarHBondContact O-CB 3.37Å; R86-I89 PolarHBondContact O-N 3.45Å; I89-K91 PolarHBondContact O-N 3.32Å; I89-E92 PolarHBondContact O-N 3.02Å; I89-L93 WeakPolarHBondContact O-CB 3.47Å; I89-L93 PolarHBondContact O-N 3.43Å
90	E	98.2	Very high	98.2	Very high	31 Å²	31	64.4 Å²	64.4	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-44.7	175.9	-69.6	174.4	170.3	0	0	112	W60 R86 E87 K88 E92 L93 E94 V137	W60-E90 VanDerWaalsContact CD1-CG 3.47Å; W60-E90 PolarHBondContact NE1-OE1 3.12Å; R86-E90 HydrophobicContact CG-CG 4.46Å; R86-E90 IonicContact CZ-OE1 3.29Å; R86-E90 IonicContact NH1-OE1 3.67Å; R86-E90 PolarHBondContact NH1-OE1 3.47Å; R86-E90 IonicContact NH1-OE2 2.68Å; R86-E90 PolarHBondContact NH1-OE2 2.95Å; R86-E90 WeakPolarHBondContact O-CG 3.4Å; R86-E90 PolarHBondContact O-N 3.39Å; E87-E90 PolarHBondContact O-N 3.04Å; K88-E90 VanDerWaalsContact C-N 3.3Å; K88-E90 PolarHBondContact O-N 3.13Å; E90-E92 VanDerWaalsContact C-N 3.35Å; E90-E92 PolarHBondContact O-N 3.35Å; E90-L93 PolarHBondContact O-N 3.08Å; E90-E94 VanDerWaalsContact O-CB 3.28Å; E90-E94 WeakPolarHBondContact O-CB 3.31Å; E90-E94 PolarHBondContact O-N 3.22Å; E90-V137 HydrophobicContact CG-CB 4.13Å
91	K	98.1	Very high	98.2	Very high	134 Å²	134	58.1 Å²	58.1	58%	0.583	28%	0.279	S	S	*	.	H	α-helix	trans	-63.7	-39.4	176.1	-72.5	169.8	-177.9	170	0	112.3	E87 K88 I89 T95	E87-K91 WeakPolarHBondContact O-CG 3.18Å; E87-K91 PolarHBondContact O-N 3.28Å; E87-K91 VanDerWaalsContact O-N 3.07Å; K88-K91 PolarHBondContact O-N 3.37Å; I89-K91 PolarHBondContact O-N 3.32Å; K91-T95 WeakPolarHBondContact O-CB 3.49Å; K91-T95 PolarHBondContact O-N 3.27Å; K91-T95 PolarHBondContact O-OG1 3.04Å
92	E	98.4	Very high	98.3	Very high	75 Å²	75	52.1 Å²	52.1	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-45.2	175.7	-71.2	172.4	-173.4	0	0	111.4	K88 I89 E90 T95 V96	K88-E92 WeakPolarHBondContact CE-OE1 3.47Å; K88-E92 IonicContact NZ-OE1 2.8Å; K88-E92 WeakPolarHBondContact O-CG 3.27Å; K88-E92 PolarHBondContact O-N 3.41Å; I89-E92 PolarHBondContact O-N 3.02Å; E90-E92 VanDerWaalsContact C-N 3.35Å; E90-E92 PolarHBondContact O-N 3.35Å; E92-T95 PolarHBondContact O-N 3.48Å; E92-V96 WeakPolarHBondContact O-CG2 3.15Å; E92-V96 PolarHBondContact O-N 3.16Å; E92-V96 VanDerWaalsContact O-N 3.16Å
93	L	98.3	Very high	98.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-47.9	175.4	-176.4	156.2	0	0	0	110.9	R56 R57 I89 E90 T95 V96 C97 L134 V137	R56-L93 HydrophobicContact CB-CB 4.29Å; R57-L93 HydrophobicContact CB-CD1 4.48Å; R57-L93 HydrophobicContact CG-CD1 3.5Å; I89-L93 WeakPolarHBondContact O-CB 3.47Å; I89-L93 PolarHBondContact O-N 3.43Å; E90-L93 PolarHBondContact O-N 3.08Å; L93-T95 VanDerWaalsContact C-N 3.31Å; L93-T95 PolarHBondContact O-N 3.43Å; L93-V96 PolarHBondContact O-N 3.17Å; L93-C97 WeakPolarHBondContact O-CB 3.26Å; L93-C97 PolarHBondContact O-N 2.84Å; L93-C97 PolarHBondContact O-SG 3.42Å; L93-C97 VanDerWaalsContact O-SG 3.41Å; L93-L134 HydrophobicContact CD2-CD2 4.21Å; L93-V137 HydrophobicContact CD1-CG1 4.06Å; L93-V137 HydrophobicContact CD2-CG2 4Å
94	E	98	Very high	98.4	Very high	65 Å²	65	47.8 Å²	47.8	30%	0.304	24%	0.24	S	C	.	.	H	α-helix	trans	-58.2	-44.6	178.3	173.2	172.5	-165.5	0	0	111.9	E90 V96 C97 N98 L134 K142	E90-E94 VanDerWaalsContact O-CB 3.28Å; E90-E94 WeakPolarHBondContact O-CB 3.31Å; E90-E94 PolarHBondContact O-N 3.22Å; E94-V96 VanDerWaalsContact C-N 3.35Å; E94-V96 PolarHBondContact O-N 2.98Å; E94-C97 PolarHBondContact O-N 2.92Å; E94-N98 VanDerWaalsContact CG-ND2 3.26Å; E94-N98 WeakPolarHBondContact CG-ND2 3.41Å; E94-N98 VanDerWaalsContact O-CB 3.31Å; E94-N98 WeakPolarHBondContact O-CB 3.27Å; E94-N98 VanDerWaalsContact O-CG 3.29Å; E94-N98 PolarHBondContact O-N 3.2Å; E94-N98 PolarHBondContact O-ND2 3Å; E94-L134 HydrophobicContact CB-CD2 4.09Å; E94-L134 HydrophobicContact CG-CD2 4.17Å; E94-K142 IonicContact OE1-NZ 3.15Å; E94-K142 PolarHBondContact OE1-NZ 3.29Å; E94-K142 IonicContact OE2-NZ 3.69Å; E94-K142 PolarHBondContact OE2-NZ 2.6Å
95	T	98.5	Very high	98.4	Very high	85 Å²	85	47.9 Å²	47.9	52%	0.521	23%	0.233	S	C	.	.	H	α-helix	trans	-58.7	-48	178.4	-59.7	0	0	0	0	110.8	K91 E92 L93 N98 D99	K91-T95 WeakPolarHBondContact O-CB 3.49Å; K91-T95 PolarHBondContact O-N 3.27Å; K91-T95 PolarHBondContact O-OG1 3.04Å; E92-T95 PolarHBondContact O-N 3.48Å; L93-T95 VanDerWaalsContact C-N 3.31Å; L93-T95 PolarHBondContact O-N 3.43Å; T95-N98 PolarHBondContact O-N 3Å; T95-D99 WeakPolarHBondContact O-CB 3.41Å; T95-D99 PolarHBondContact O-N 3.21Å
96	V	98.5	Very high	98.3	Very high	15 Å²	15	48 Å²	48	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-42.9	-179.5	177.5	0	0	0	0	111.6	Y49 V52 V53 E92 L93 E94 D99 V100	Y49-V96 HydrophobicContact CD1-CG1 3.74Å; Y49-V96 HydrophobicContact CE1-CG1 4.09Å; V52-V96 HydrophobicContact CB-CG1 4.28Å; V52-V96 HydrophobicContact CG1-CB 4.27Å; V52-V96 HydrophobicContact CG1-CG1 3.5Å; V52-V96 HydrophobicContact CG1-CG2 3.77Å; V53-V96 HydrophobicContact CG2-CB 4.1Å; V53-V96 HydrophobicContact CG2-CG1 3.41Å; V53-V96 VanDerWaalsContact CG2-CG1 3.41Å; E92-V96 WeakPolarHBondContact O-CG2 3.15Å; E92-V96 PolarHBondContact O-N 3.16Å; E92-V96 VanDerWaalsContact O-N 3.16Å; L93-V96 PolarHBondContact O-N 3.17Å; E94-V96 VanDerWaalsContact C-N 3.35Å; E94-V96 PolarHBondContact O-N 2.98Å; V96-D99 WeakPolarHBondContact O-CB 3.48Å; V96-D99 PolarHBondContact O-N 2.87Å; V96-V100 PolarHBondContact O-N 2.86Å
97	C	98.7	Very high	98.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-45.6	176.5	-73.6	0	0	0	0	111.3	L93 E94 D99 V100 L101 Y130 L134	L93-C97 WeakPolarHBondContact O-CB 3.26Å; L93-C97 PolarHBondContact O-N 2.84Å; L93-C97 PolarHBondContact O-SG 3.42Å; L93-C97 VanDerWaalsContact O-SG 3.41Å; E94-C97 PolarHBondContact O-N 2.92Å; C97-D99 VanDerWaalsContact C-N 3.3Å; C97-D99 PolarHBondContact O-N 2.99Å; C97-V100 WeakPolarHBondContact O-CG1 3.49Å; C97-V100 PolarHBondContact O-N 3.36Å; C97-L101 WeakPolarHBondContact O-CB 3.35Å; C97-L101 WeakPolarHBondContact O-CD1 3.38Å; C97-L101 WeakPolarHBondContact O-CG 3.46Å; C97-L101 PolarHBondContact O-N 2.82Å; C97-Y130 HydrophobicContact CB-CD1 4.46Å; C97-L134 HydrophobicContact CB-CD1 4.04Å; C97-L134 HydrophobicContact CB-CD2 3.71Å; C97-L134 HydrophobicContact CB-CG 3.73Å
98	N	98.5	Very high	98.4	Very high	71 Å²	71	44.6 Å²	44.6	38%	0.38	22%	0.221	S	C	.	.	H	α-helix	trans	-66.4	-33.1	179.1	-74.1	-28.1	0	0	0	112.4	E94 T95 A102	E94-N98 VanDerWaalsContact CG-ND2 3.26Å; E94-N98 WeakPolarHBondContact CG-ND2 3.41Å; E94-N98 VanDerWaalsContact O-CB 3.31Å; E94-N98 WeakPolarHBondContact O-CB 3.27Å; E94-N98 VanDerWaalsContact O-CG 3.29Å; E94-N98 PolarHBondContact O-N 3.2Å; E94-N98 PolarHBondContact O-ND2 3Å; T95-N98 PolarHBondContact O-N 3Å; N98-A102 VanDerWaalsContact O-CB 3.29Å; N98-A102 WeakPolarHBondContact O-CB 3.39Å; N98-A102 PolarHBondContact O-N 3.46Å
99	D	98.4	Very high	98.3	Very high	58 Å²	58	40.6 Å²	40.6	31%	0.31	21%	0.205	S	C	.	.	H	α-helix	trans	-59.6	-52.4	173.2	-95.5	-14.5	0	0	0	111.7	K28 Y49 T95 V96 C97 A102 L103	K28-D99 VanDerWaalsContact NZ-CG 3.25Å; K28-D99 IonicContact NZ-OD1 3.59Å; K28-D99 PolarHBondContact NZ-OD1 3.12Å; K28-D99 IonicContact NZ-OD2 2.66Å; K28-D99 PolarHBondContact NZ-OD2 2.66Å; Y49-D99 HydrophobicContact CE1-CB 4.27Å; T95-D99 WeakPolarHBondContact O-CB 3.41Å; T95-D99 PolarHBondContact O-N 3.21Å; V96-D99 WeakPolarHBondContact O-CB 3.48Å; V96-D99 PolarHBondContact O-N 2.87Å; C97-D99 VanDerWaalsContact C-N 3.3Å; C97-D99 PolarHBondContact O-N 2.99Å; D99-A102 PolarHBondContact O-N 3.45Å; D99-L103 WeakPolarHBondContact O-CG 3.32Å; D99-L103 PolarHBondContact O-N 2.92Å; D99-L103 VanDerWaalsContact O-N 3.11Å
100	V	98.5	Very high	98.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69.8	-36.8	179.6	62.6	0	0	0	0	112.3	Y49 V96 C97 A102 L103 L104 M126 Y130	Y49-V100 HydrophobicContact CD1-CB 3.69Å; Y49-V100 HydrophobicContact CD1-CG1 4.17Å; Y49-V100 HydrophobicContact CD1-CG2 4.34Å; Y49-V100 HydrophobicContact CD2-CB 4.26Å; Y49-V100 HydrophobicContact CD2-CG2 4.13Å; Y49-V100 HydrophobicContact CE1-CB 3.8Å; Y49-V100 HydrophobicContact CE2-CB 4.37Å; Y49-V100 HydrophobicContact CE2-CG2 4.48Å; Y49-V100 HydrophobicContact CG-CB 3.92Å; Y49-V100 HydrophobicContact CG-CG2 4.05Å; V96-V100 PolarHBondContact O-N 2.86Å; C97-V100 WeakPolarHBondContact O-CG1 3.49Å; C97-V100 PolarHBondContact O-N 3.36Å; V100-A102 VanDerWaalsContact C-N 3.3Å; V100-A102 PolarHBondContact O-N 3.41Å; V100-L103 WeakPolarHBondContact O-CB 3.35Å; V100-L103 PolarHBondContact O-N 3.26Å; V100-L103 VanDerWaalsContact O-N 3.13Å; V100-L104 HydrophobicContact CG2-CD1 4.09Å; V100-L104 HydrophobicContact CG2-CG 4.26Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 VanDerWaalsContact O-CG 3.23Å; V100-L104 WeakPolarHBondContact O-CG 3.25Å; V100-L104 PolarHBondContact O-N 3.49Å; V100-M126 HydrophobicContact CG2-CE 4.26Å; V100-Y130 HydrophobicContact CB-CD2 4.44Å; V100-Y130 HydrophobicContact CB-CE2 4.36Å; V100-Y130 HydrophobicContact CG1-CD1 3.46Å; V100-Y130 VanDerWaalsContact CG1-CD1 3.46Å; V100-Y130 HydrophobicContact CG1-CD2 3.47Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.47Å; V100-Y130 HydrophobicContact CG1-CE1 3.66Å; V100-Y130 HydrophobicContact CG1-CE2 3.7Å; V100-Y130 HydrophobicContact CG1-CG 3.4Å; V100-Y130 HydrophobicContact CG2-CD2 4.08Å; V100-Y130 HydrophobicContact CG2-CE2 3.76Å
101	L	98.8	Very high	98	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-42.4	174.1	-72.6	169.7	0	0	0	111.2	C97 L103 L104 D105 K127 Y131 L134	C97-L101 WeakPolarHBondContact O-CB 3.35Å; C97-L101 WeakPolarHBondContact O-CD1 3.38Å; C97-L101 WeakPolarHBondContact O-CG 3.46Å; C97-L101 PolarHBondContact O-N 2.82Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.06Å; L101-L104 PolarHBondContact O-N 3.4Å; L101-D105 WeakPolarHBondContact O-CB 3.36Å; L101-D105 PolarHBondContact O-N 2.94Å; L101-K127 HydrophobicContact CD2-CB 4.4Å; L101-K127 HydrophobicContact CD2-CG 3.8Å; L101-Y131 HydrophobicContact CD1-CD1 4.03Å; L101-Y131 HydrophobicContact CD1-CE1 3.74Å; L101-Y131 HydrophobicContact CD1-CE2 4.27Å; L101-Y131 HydrophobicContact CD1-CG 4.39Å; L101-Y131 HydrophobicContact CD2-CD2 3.79Å; L101-Y131 HydrophobicContact CD2-CE2 3.58Å; L101-Y131 HydrophobicContact CD2-CG 4.34Å; L101-L134 HydrophobicContact CD1-CD1 3.7Å
102	A	98.6	Very high	97.9	Very high	35 Å²	35	44.5 Å²	44.5	29%	0.289	23%	0.227	S	C	.	.	H	α-helix	trans	-63.6	-37.9	175.1	0	0	0	0	0	112.2	N98 D99 V100 K106	N98-A102 VanDerWaalsContact O-CB 3.29Å; N98-A102 WeakPolarHBondContact O-CB 3.39Å; N98-A102 PolarHBondContact O-N 3.46Å; D99-A102 PolarHBondContact O-N 3.45Å; V100-A102 VanDerWaalsContact C-N 3.3Å; V100-A102 PolarHBondContact O-N 3.41Å; A102-K106 WeakPolarHBondContact O-CB 3.37Å; A102-K106 VanDerWaalsContact O-CG 3.24Å; A102-K106 WeakPolarHBondContact O-CG 3.24Å; A102-K106 PolarHBondContact O-N 2.82Å
103	L	98.7	Very high	97.6	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-46.4	175.3	-68.2	176.4	0	0	0	112.1	K28 T31 E32 L45 Y49 D99 V100 L101 D105 F107 L108	K28-L103 HydrophobicContact CB-CD1 4.03Å; K28-L103 HydrophobicContact CG-CD1 4.01Å; K28-L103 HydrophobicContact CG-CD2 4.14Å; T31-L103 HydrophobicContact CG2-CB 4.11Å; T31-L103 HydrophobicContact CG2-CD2 4.01Å; T31-L103 HydrophobicContact CG2-CG 4.47Å; E32-L103 HydrophobicContact CG-CD2 3.78Å; L45-L103 HydrophobicContact CD1-CD1 4.42Å; Y49-L103 HydrophobicContact CE2-CD1 4.03Å; Y49-L103 WeakPolarHBondContact OH-CD1 3.42Å; D99-L103 WeakPolarHBondContact O-CG 3.32Å; D99-L103 PolarHBondContact O-N 2.92Å; D99-L103 VanDerWaalsContact O-N 3.11Å; V100-L103 WeakPolarHBondContact O-CB 3.35Å; V100-L103 PolarHBondContact O-N 3.26Å; V100-L103 VanDerWaalsContact O-N 3.13Å; L101-L103 VanDerWaalsContact C-N 3.33Å; L101-L103 PolarHBondContact O-N 3.06Å; L103-D105 PolarHBondContact O-N 2.96Å; L103-F107 HydrophobicContact CD2-CD2 3.88Å; L103-F107 HydrophobicContact CD2-CE2 4.02Å; L103-F107 PolarHBondContact O-N 2.89Å; L103-L108 PolarHBondContact O-N 3.41Å
104	L	98.6	Very high	97.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.268	C	S	.	.	I	π-helix	trans	-57.6	-50.4	178.2	-69.9	167.4	0	0	0	110.6	V100 L101 L108 I109 Y123 M126 K127 Y130	V100-L104 HydrophobicContact CG2-CD1 4.09Å; V100-L104 HydrophobicContact CG2-CG 4.26Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 VanDerWaalsContact O-CG 3.23Å; V100-L104 WeakPolarHBondContact O-CG 3.25Å; V100-L104 PolarHBondContact O-N 3.49Å; L101-L104 PolarHBondContact O-N 3.4Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 2.94Å; L104-I109 HydrophobicContact CB-CD1 4Å; L104-I109 HydrophobicContact CB-CG1 4.44Å; L104-I109 WeakPolarHBondContact O-CB 3.39Å; L104-I109 WeakPolarHBondContact O-CG1 3.44Å; L104-I109 PolarHBondContact O-N 2.77Å; L104-Y123 HydrophobicContact CD2-CD1 3.76Å; L104-Y123 HydrophobicContact CD2-CG 4.13Å; L104-M126 HydrophobicContact CD1-CB 4.05Å; L104-M126 HydrophobicContact CD2-CB 4.25Å; L104-K127 HydrophobicContact CD1-CB 4.06Å; L104-Y130 HydrophobicContact CD1-CD2 4.39Å
105	D	98.3	Very high	96.8	Very high	57 Å²	57	57.2 Å²	57.2	31%	0.305	29%	0.291	S	S	.	.	I	π-helix	trans	-73	-38.1	-176	-74.4	-23.2	0	0	0	113.3	L101 L103 K110 K127	L101-D105 WeakPolarHBondContact O-CB 3.36Å; L101-D105 PolarHBondContact O-N 2.94Å; L103-D105 PolarHBondContact O-N 2.96Å; D105-K110 VanDerWaalsContact O-CB 3.26Å; D105-K110 WeakPolarHBondContact O-CB 3.42Å; D105-K127 VanDerWaalsContact OD1-CE 3.31Å; D105-K127 WeakPolarHBondContact OD1-CE 3.27Å; D105-K127 IonicContact OD1-NZ 2.7Å; D105-K127 PolarHBondContact OD1-NZ 3.27Å; D105-K127 IonicContact OD2-NZ 3.12Å; D105-K127 PolarHBondContact OD2-NZ 2.83Å
106	K	97.8	Very high	96.6	Very high	131 Å²	131	56.1 Å²	56.1	57%	0.57	28%	0.28	S	S	*	.	I	π-helix	trans	-85.8	-34	-172.9	-66.6	176.2	-177.7	175.9	0	114	A102	A102-K106 WeakPolarHBondContact O-CB 3.37Å; A102-K106 VanDerWaalsContact O-CG 3.24Å; A102-K106 WeakPolarHBondContact O-CG 3.24Å; A102-K106 PolarHBondContact O-N 2.82Å
107	F	97.9	Very high	96.5	Very high	50 Å²	50	59.3 Å²	59.3	22%	0.219	29%	0.291	C	S	.	.	I	π-helix	trans	-123.8	-24.3	-167.4	-56.4	-79.9	0	0	0	114.4	T31 E32 N34 L103 N111	T31-F107 HydrophobicContact CG2-CB 3.82Å; T31-F107 HydrophobicContact CG2-CD2 4.42Å; T31-F107 HydrophobicContact CG2-CG 4.38Å; E32-F107 HydrophobicContact CB-CZ 4.31Å; E32-F107 HydrophobicContact CG-CD2 4.46Å; E32-F107 HydrophobicContact CG-CE2 3.8Å; E32-F107 HydrophobicContact CG-CZ 3.9Å; N34-F107 HydrophobicContact CB-CD1 3.98Å; N34-F107 HydrophobicContact CB-CE1 4.42Å; N34-F107 WeakPolarHBondContact OD1-CD1 3.17Å; L103-F107 HydrophobicContact CD2-CD2 3.88Å; L103-F107 HydrophobicContact CD2-CE2 4.02Å; L103-F107 PolarHBondContact O-N 2.89Å; F107-N111 WeakPolarHBondContact O-CB 3.49Å; F107-N111 PolarHBondContact O-ND2 3.42Å
108	L	98.2	Very high	96.4	Very high	9 Å²	9	62.2 Å²	62.2	5%	0.047	31%	0.305	C	S	.	.	I	π-helix	trans	-107.7	-65.7	-170.5	-59.7	172.1	0	0	0	112.2	T31 L37 L45 L103 L104 K110 N111 C112 Y123	T31-L108 HydrophobicContact CG2-CD1 3.93Å; T31-L108 HydrophobicContact CG2-CD2 3.84Å; T31-L108 HydrophobicContact CG2-CG 3.78Å; L37-L108 HydrophobicContact CD1-CD2 3.8Å; L37-L108 HydrophobicContact CG-CD2 3.89Å; L45-L108 HydrophobicContact CD2-CD1 3.52Å; L103-L108 PolarHBondContact O-N 3.41Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 2.94Å; L108-K110 PolarHBondContact O-N 3.11Å; L108-N111 PolarHBondContact O-N 3.44Å; L108-C112 PolarHBondContact O-N 2.82Å; L108-C112 PolarHBondContact O-SG 2.89Å; L108-Y123 HydrophobicContact CB-CD1 4.05Å; L108-Y123 HydrophobicContact CB-CD2 3.82Å; L108-Y123 HydrophobicContact CB-CE1 4.06Å; L108-Y123 HydrophobicContact CB-CE2 3.86Å; L108-Y123 HydrophobicContact CB-CG 3.95Å; L108-Y123 HydrophobicContact CD1-CD1 3.95Å; L108-Y123 HydrophobicContact CD1-CE1 3.72Å; L108-Y123 HydrophobicContact CD2-CE1 4.15Å; L108-Y123 HydrophobicContact CD2-CE2 4.37Å; L108-Y123 HydrophobicContact CG-CE1 4.19Å
109	I	97.8	Very high	96.4	Very high	25 Å²	25	59.6 Å²	59.6	13%	0.128	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-47.4	-179.7	-63.1	170.9	0	0	0	110.1	L104 N111 C112 Y123 L124 K127	L104-I109 HydrophobicContact CB-CD1 4Å; L104-I109 HydrophobicContact CB-CG1 4.44Å; L104-I109 WeakPolarHBondContact O-CB 3.39Å; L104-I109 WeakPolarHBondContact O-CG1 3.44Å; L104-I109 PolarHBondContact O-N 2.77Å; I109-N111 PolarHBondContact O-N 2.96Å; I109-C112 PolarHBondContact O-N 3.31Å; I109-Y123 HydrophobicContact CG1-CG 4.48Å; I109-L124 HydrophobicContact CD1-CD2 4.02Å; I109-L124 HydrophobicContact CD1-CG 4.42Å; I109-L124 HydrophobicContact CG2-CD2 4.35Å; I109-K127 HydrophobicContact CD1-CB 4.26Å; I109-K127 HydrophobicContact CD1-CD 3.76Å
110	K	95.4	Very high	96.4	Very high	158 Å²	158	59.7 Å²	59.7	69%	0.687	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.7	-179.9	177.2	-179.5	175.9	-171.8	0	113.6	D105 L108	D105-K110 VanDerWaalsContact O-CB 3.26Å; D105-K110 WeakPolarHBondContact O-CB 3.42Å; L108-K110 PolarHBondContact O-N 3.11Å
111	N	95	Very high	96.4	Very high	72 Å²	72	59.7 Å²	59.7	39%	0.385	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	0.9	-175.7	-67.1	-31.7	0	0	0	113.4	N34 F107 L108 I109 N113	N34-N111 PolarHBondContact OD1-ND2 3.26Å; F107-N111 WeakPolarHBondContact O-CB 3.49Å; F107-N111 PolarHBondContact O-ND2 3.42Å; L108-N111 PolarHBondContact O-N 3.44Å; I109-N111 PolarHBondContact O-N 2.96Å; N111-N113 PolarHBondContact O-N 2.92Å
112	C	95.2	Very high	96.4	Very high	22 Å²	22	60.6 Å²	60.6	15%	0.149	29%	0.294	C	S	.	.			trans	-69	126.1	170.6	-71.8	0	0	0	0	109.6	L108 I109 K120	L108-C112 PolarHBondContact O-N 2.82Å; L108-C112 PolarHBondContact O-SG 2.89Å; I109-C112 PolarHBondContact O-N 3.31Å; C112-K120 HydrophobicContact CB-CB 4.11Å; C112-K120 HydrophobicContact CB-CG 4.46Å
113	N	92.2	Very high	96.4	Very high	80 Å²	80	59.2 Å²	59.2	43%	0.428	28%	0.281	S	S	.	.			trans	-81.8	170.3	169.4	68	45.1	0	0	0	111.7	N111 F115 Q116	N111-N113 PolarHBondContact O-N 2.92Å; N113-F115 PolarHBondContact O-N 3.37Å; N113-F115 VanDerWaalsContact O-N 3.1Å; N113-F115 PolarHBondContact OD1-N 3.03Å; N113-Q116 PolarHBondContact ND2-OE1 3.06Å; N113-Q116 PolarHBondContact O-N 3.49Å; N113-Q116 VanDerWaalsContact OD1-CG 3.3Å; N113-Q116 WeakPolarHBondContact OD1-CG 3.4Å; N113-Q116 PolarHBondContact OD1-N 2.73Å; N113-Q116 VanDerWaalsContact OD1-N 3.08Å
114	D	87.8	Confident	96.4	Very high	147 Å²	147	59.1 Å²	59.1	79%	0.786	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.7	-175.4	-61.2	-25.4	0	0	0	114
115	F	92.2	Very high	96.4	Very high	179 Å²	179	60.7 Å²	60.7	79%	0.785	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-10	178.7	-53.3	-76.3	0	0	0	113.1	N113 Y117	N113-F115 PolarHBondContact O-N 3.37Å; N113-F115 VanDerWaalsContact O-N 3.1Å; N113-F115 PolarHBondContact OD1-N 3.03Å; F115-Y117 VanDerWaalsContact C-N 3.26Å; F115-Y117 WeakPolarHBondContact O-CD1 3.3Å; F115-Y117 PolarHBondContact O-N 2.82Å
116	Q	94.5	Very high	96.4	Very high	63 Å²	63	58.2 Å²	58.2	29%	0.294	27%	0.274	S	S	.	.			trans	-91.8	40.5	-179.7	-74.3	173.9	-42.8	0	0	112.1	N113 E118 S119 K120	N113-Q116 PolarHBondContact ND2-OE1 3.06Å; N113-Q116 PolarHBondContact O-N 3.49Å; N113-Q116 VanDerWaalsContact OD1-CG 3.3Å; N113-Q116 WeakPolarHBondContact OD1-CG 3.4Å; N113-Q116 PolarHBondContact OD1-N 2.73Å; N113-Q116 VanDerWaalsContact OD1-N 3.08Å; Q116-E118 VanDerWaalsContact C-N 3.31Å; Q116-E118 PolarHBondContact O-N 3.02Å; Q116-S119 PolarHBondContact O-N 3.47Å; Q116-S119 VanDerWaalsContact O-N 3.08Å; Q116-K120 PolarHBondContact O-N 3.14Å
117	Y	96.3	Very high	96.4	Very high	81 Å²	81	53.9 Å²	53.9	32%	0.318	26%	0.255	S	S	.	.	H	α-helix	trans	-56.8	-40.2	-174.8	56	-94.6	0	0	0	112.7	F115 S119 K120 V121 H164 M165	F115-Y117 VanDerWaalsContact C-N 3.26Å; F115-Y117 WeakPolarHBondContact O-CD1 3.3Å; F115-Y117 PolarHBondContact O-N 2.82Å; Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 3.14Å; Y117-K120 PolarHBondContact O-N 2.85Å; Y117-V121 WeakPolarHBondContact O-CB 3.41Å; Y117-V121 VanDerWaalsContact O-CG2 3.29Å; Y117-V121 WeakPolarHBondContact O-CG2 3.43Å; Y117-V121 PolarHBondContact O-N 2.79Å; Y117-H164 HydrophobicContact CD1-CB 4.05Å; Y117-H164 HydrophobicContact CD2-CB 3.54Å; Y117-H164 HydrophobicContact CE1-CB 4.41Å; Y117-H164 HydrophobicContact CE2-CB 3.95Å; Y117-H164 WeakPolarHBondContact CE2-O 3.48Å; Y117-H164 HydrophobicContact CG-CB 3.62Å; Y117-M165 HydrophobicContact CD2-CG 3.93Å; Y117-M165 HydrophobicContact CE2-CG 4.11Å
118	E	96.5	Very high	96.5	Very high	62 Å²	62	51.5 Å²	51.5	29%	0.29	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-42	177.3	-67.5	-176.3	-179.5	0	0	112.5	Q116 F122 M165 H169 I171	Q116-E118 VanDerWaalsContact C-N 3.31Å; Q116-E118 PolarHBondContact O-N 3.02Å; E118-F122 VanDerWaalsContact O-CB 3.27Å; E118-F122 WeakPolarHBondContact O-CB 3.49Å; E118-F122 PolarHBondContact O-N 3.37Å; E118-M165 HydrophobicContact CG-CE 4.07Å; E118-H169 IonicContact OE1-NE2 2.73Å; E118-H169 PolarHBondContact OE1-NE2 3.37Å; E118-I171 HydrophobicContact CB-CD1 4.34Å
119	S	97.4	Very high	96.5	Very high	16 Å²	16	51.4 Å²	51.4	11%	0.112	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-43.4	176.6	-72.3	0	0	0	0	111.3	R42 Q116 Y117 V121 F122 Y123	R42-S119 VanDerWaalsContact NH1-CA 3.28Å; R42-S119 PolarHBondContact NH1-OG 3.01Å; Q116-S119 PolarHBondContact O-N 3.47Å; Q116-S119 VanDerWaalsContact O-N 3.08Å; Y117-S119 VanDerWaalsContact C-N 3.32Å; Y117-S119 PolarHBondContact O-N 3.14Å; S119-V121 PolarHBondContact O-N 3.38Å; S119-F122 PolarHBondContact O-N 3.16Å; S119-Y123 WeakPolarHBondContact O-CD2 3.37Å; S119-Y123 VanDerWaalsContact O-CG 3.24Å; S119-Y123 PolarHBondContact O-N 2.87Å
120	K	98	Very high	96.6	Very high	60 Å²	60	50.5 Å²	50.5	26%	0.261	24%	0.239	S	C	.	.	H	α-helix	trans	-60.1	-47.3	177.1	-169.4	169.6	176.9	-174	0	111.6	C112 Q116 Y117 Y123 L124 E156 I160	C112-K120 HydrophobicContact CB-CB 4.11Å; C112-K120 HydrophobicContact CB-CG 4.46Å; Q116-K120 PolarHBondContact O-N 3.14Å; Y117-K120 PolarHBondContact O-N 2.85Å; K120-Y123 PolarHBondContact O-N 3.38Å; K120-L124 HydrophobicContact CG-CD1 3.82Å; K120-L124 HydrophobicContact CG-CG 4.45Å; K120-L124 WeakPolarHBondContact O-CB 3.16Å; K120-L124 VanDerWaalsContact O-CG 3.28Å; K120-L124 WeakPolarHBondContact O-CG 3.47Å; K120-L124 PolarHBondContact O-N 3.38Å; K120-E156 WeakPolarHBondContact CE-OE1 3.36Å; K120-E156 IonicContact NZ-OE1 3.74Å; K120-I160 HydrophobicContact CD-CD1 3.81Å; K120-I160 HydrophobicContact CG-CD1 4.07Å
121	V	98.6	Very high	96.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.6	175.8	175.5	0	0	0	0	111.1	Y117 S119 Y123 L124 K125 A157 I160 M165 I171 L175	Y117-V121 WeakPolarHBondContact O-CB 3.41Å; Y117-V121 VanDerWaalsContact O-CG2 3.29Å; Y117-V121 WeakPolarHBondContact O-CG2 3.43Å; Y117-V121 PolarHBondContact O-N 2.79Å; S119-V121 PolarHBondContact O-N 3.38Å; V121-Y123 PolarHBondContact O-N 3.07Å; V121-L124 PolarHBondContact O-N 2.66Å; V121-K125 WeakPolarHBondContact O-CB 3.39Å; V121-K125 PolarHBondContact O-N 2.95Å; V121-A157 HydrophobicContact CG1-CB 4.36Å; V121-I160 HydrophobicContact CG2-CB 3.81Å; V121-I160 HydrophobicContact CG2-CG2 3.51Å; V121-M165 HydrophobicContact CB-SD 4.06Å; V121-M165 HydrophobicContact CG1-SD 4.03Å; V121-M165 HydrophobicContact CG2-SD 3.9Å; V121-I171 HydrophobicContact CB-CG2 4.33Å; V121-I171 HydrophobicContact CG1-CG2 3.73Å; V121-L175 HydrophobicContact CG1-CD2 4.04Å
122	F	98.4	Very high	96.9	Very high	23 Å²	23	42.3 Å²	42.3	10%	0.101	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-47.6	177.3	-172.8	-81.6	0	0	0	112.1	R42 E118 S119 M126 I171	R42-F122 HydrophobicContact CG-CD1 3.49Å; R42-F122 VanDerWaalsContact CG-CD1 3.49Å; R42-F122 HydrophobicContact CG-CE1 3.24Å; R42-F122 HydrophobicContact CG-CG 4.23Å; R42-F122 HydrophobicContact CG-CZ 3.83Å; E118-F122 VanDerWaalsContact O-CB 3.27Å; E118-F122 WeakPolarHBondContact O-CB 3.49Å; E118-F122 PolarHBondContact O-N 3.37Å; S119-F122 PolarHBondContact O-N 3.16Å; F122-M126 HydrophobicContact CD1-CG 4.25Å; F122-M126 HydrophobicContact CD1-SD 3.69Å; F122-M126 HydrophobicContact CE1-CG 4.11Å; F122-M126 HydrophobicContact CE1-SD 3.24Å; F122-M126 WeakPolarHBondContact CE1-SD 3.4Å; F122-M126 HydrophobicContact CZ-SD 4.22Å; F122-M126 WeakPolarHBondContact O-CG 3.42Å; F122-M126 PolarHBondContact O-N 3.14Å; F122-I171 HydrophobicContact CB-CD1 4.43Å; F122-I171 HydrophobicContact CB-CG2 4.44Å; F122-I171 HydrophobicContact CD2-CD1 4.1Å; F122-I171 HydrophobicContact CD2-CG1 4.24Å
123	Y	98.7	Very high	97	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.027	20%	0.196	C	C	.	.	H	α-helix	trans	-70.8	-39.5	-179.2	-61.9	-45.9	0	0	0	112.8	R42 L104 L108 I109 S119 K120 V121 M126 K127	R42-Y123 WeakPolarHBondContact CD-OH 3.34Å; R42-Y123 HydrophobicContact CG-CD1 4.46Å; R42-Y123 HydrophobicContact CG-CE1 3.54Å; L104-Y123 HydrophobicContact CD2-CD1 3.76Å; L104-Y123 HydrophobicContact CD2-CG 4.13Å; L108-Y123 HydrophobicContact CB-CD1 4.05Å; L108-Y123 HydrophobicContact CB-CD2 3.82Å; L108-Y123 HydrophobicContact CB-CE1 4.06Å; L108-Y123 HydrophobicContact CB-CE2 3.86Å; L108-Y123 HydrophobicContact CB-CG 3.95Å; L108-Y123 HydrophobicContact CD1-CD1 3.95Å; L108-Y123 HydrophobicContact CD1-CE1 3.72Å; L108-Y123 HydrophobicContact CD2-CE1 4.15Å; L108-Y123 HydrophobicContact CD2-CE2 4.37Å; L108-Y123 HydrophobicContact CG-CE1 4.19Å; I109-Y123 HydrophobicContact CG1-CG 4.48Å; S119-Y123 WeakPolarHBondContact O-CD2 3.37Å; S119-Y123 VanDerWaalsContact O-CG 3.24Å; S119-Y123 PolarHBondContact O-N 2.87Å; K120-Y123 PolarHBondContact O-N 3.38Å; V121-Y123 PolarHBondContact O-N 3.07Å; Y123-M126 WeakPolarHBondContact O-CB 3.03Å; Y123-M126 PolarHBondContact O-N 3.43Å; Y123-K127 WeakPolarHBondContact O-CB 3.38Å; Y123-K127 PolarHBondContact O-N 2.89Å
124	L	98.8	Very high	97.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-41	175.3	-74.3	167.4	0	0	0	111.6	I109 K120 V121 M126 K127 G128 E156 A157 I160	I109-L124 HydrophobicContact CD1-CD2 4.02Å; I109-L124 HydrophobicContact CD1-CG 4.42Å; I109-L124 HydrophobicContact CG2-CD2 4.35Å; K120-L124 HydrophobicContact CG-CD1 3.82Å; K120-L124 HydrophobicContact CG-CG 4.45Å; K120-L124 WeakPolarHBondContact O-CB 3.16Å; K120-L124 VanDerWaalsContact O-CG 3.28Å; K120-L124 WeakPolarHBondContact O-CG 3.47Å; K120-L124 PolarHBondContact O-N 3.38Å; V121-L124 PolarHBondContact O-N 2.66Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-M126 PolarHBondContact O-N 2.88Å; L124-K127 WeakPolarHBondContact O-CB 3.46Å; L124-K127 PolarHBondContact O-N 3.01Å; L124-K127 VanDerWaalsContact O-N 3.17Å; L124-G128 PolarHBondContact O-N 3.34Å; L124-E156 HydrophobicContact CD1-CB 4.14Å; L124-E156 HydrophobicContact CD1-CG 3.73Å; L124-E156 HydrophobicContact CD2-CB 4.46Å; L124-E156 HydrophobicContact CD2-CG 4.43Å; L124-E156 WeakPolarHBondContact CD2-OE2 3.24Å; L124-A157 HydrophobicContact CB-CB 3.67Å; L124-A157 HydrophobicContact CD1-CB 4.47Å; L124-I160 HydrophobicContact CD1-CD1 3.8Å
125	K	98.7	Very high	97.8	Very high	33 Å²	33	31.9 Å²	31.9	14%	0.143	14%	0.14	C	C	.	.	H	α-helix	trans	-56.5	-49.3	170.8	179	-167.2	170.3	-66.2	0	110.8	V121 K127 G128 D129 G174 L175 N178	V121-K125 WeakPolarHBondContact O-CB 3.39Å; V121-K125 PolarHBondContact O-N 2.95Å; K125-K127 VanDerWaalsContact C-N 3.31Å; K125-K127 PolarHBondContact O-N 3.48Å; K125-G128 PolarHBondContact O-N 3.27Å; K125-D129 IonicContact NZ-OD2 2.76Å; K125-D129 PolarHBondContact NZ-OD2 3.44Å; K125-D129 PolarHBondContact O-N 3.49Å; K125-G174 WeakPolarHBondContact CE-O 3.25Å; K125-L175 HydrophobicContact CB-CD1 4.04Å; K125-L175 HydrophobicContact CD-CB 4.13Å; K125-L175 HydrophobicContact CG-CB 4.31Å; K125-L175 HydrophobicContact CG-CD1 4.01Å; K125-N178 PolarHBondContact NZ-ND2 2.93Å
126	M	98.7	Very high	98	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.025	11%	0.112	C	C	.	.	H	α-helix	trans	-58.1	-43.7	175.5	-76.8	-177.9	70.7	0	0	111.6	V100 L104 F122 Y123 L124 G128 D129 Y130	V100-M126 HydrophobicContact CG2-CE 4.26Å; L104-M126 HydrophobicContact CD1-CB 4.05Å; L104-M126 HydrophobicContact CD2-CB 4.25Å; F122-M126 HydrophobicContact CD1-CG 4.25Å; F122-M126 HydrophobicContact CD1-SD 3.69Å; F122-M126 HydrophobicContact CE1-CG 4.11Å; F122-M126 HydrophobicContact CE1-SD 3.24Å; F122-M126 WeakPolarHBondContact CE1-SD 3.4Å; F122-M126 HydrophobicContact CZ-SD 4.22Å; F122-M126 WeakPolarHBondContact O-CG 3.42Å; F122-M126 PolarHBondContact O-N 3.14Å; Y123-M126 WeakPolarHBondContact O-CB 3.03Å; Y123-M126 PolarHBondContact O-N 3.43Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-M126 PolarHBondContact O-N 2.88Å; M126-G128 VanDerWaalsContact C-N 3.34Å; M126-G128 PolarHBondContact O-N 3.33Å; M126-D129 WeakPolarHBondContact O-CB 3.39Å; M126-D129 PolarHBondContact O-N 3.45Å; M126-D129 VanDerWaalsContact O-N 3.11Å; M126-Y130 HydrophobicContact CB-CD2 4.47Å; M126-Y130 HydrophobicContact CB-CE2 4.28Å; M126-Y130 HydrophobicContact CE-CE2 3.81Å; M126-Y130 WeakPolarHBondContact O-CD2 3.49Å; M126-Y130 PolarHBondContact O-N 2.98Å
127	K	98.9	Very high	98.1	Very high	40 Å²	40	23.1 Å²	23.1	17%	0.174	10%	0.103	C	C	.	.	H	α-helix	trans	-57.6	-46.9	176.9	-176.8	174.8	179.8	172.2	0	111.3	L101 L104 D105 I109 Y123 L124 K125 D129 Y130 Y131 A153	L101-K127 HydrophobicContact CD2-CB 4.4Å; L101-K127 HydrophobicContact CD2-CG 3.8Å; L104-K127 HydrophobicContact CD1-CB 4.06Å; D105-K127 VanDerWaalsContact OD1-CE 3.31Å; D105-K127 WeakPolarHBondContact OD1-CE 3.27Å; D105-K127 IonicContact OD1-NZ 2.7Å; D105-K127 PolarHBondContact OD1-NZ 3.27Å; D105-K127 IonicContact OD2-NZ 3.12Å; D105-K127 PolarHBondContact OD2-NZ 2.83Å; I109-K127 HydrophobicContact CD1-CB 4.26Å; I109-K127 HydrophobicContact CD1-CD 3.76Å; Y123-K127 WeakPolarHBondContact O-CB 3.38Å; Y123-K127 PolarHBondContact O-N 2.89Å; L124-K127 WeakPolarHBondContact O-CB 3.46Å; L124-K127 PolarHBondContact O-N 3.01Å; L124-K127 VanDerWaalsContact O-N 3.17Å; K125-K127 VanDerWaalsContact C-N 3.31Å; K125-K127 PolarHBondContact O-N 3.48Å; K127-D129 VanDerWaalsContact C-N 3.34Å; K127-D129 PolarHBondContact O-N 2.71Å; K127-Y130 PolarHBondContact O-N 3.18Å; K127-Y131 HydrophobicContact CD-CE2 4.34Å; K127-Y131 HydrophobicContact CG-CD2 3.88Å; K127-Y131 HydrophobicContact CG-CE2 3.73Å; K127-Y131 VanDerWaalsContact O-CD2 3.29Å; K127-Y131 WeakPolarHBondContact O-CD2 3.32Å; K127-Y131 PolarHBondContact O-N 3.37Å; K127-A153 HydrophobicContact CB-CB 4.1Å; K127-A153 HydrophobicContact CD-CB 4.18Å; K127-A153 HydrophobicContact CG-CB 3.94Å
128	G	98.8	Very high	98.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.6	-42.9	172.8	0	0	0	0	0	112.6	L124 K125 M126 Y131 R132 S150 Y154	L124-G128 PolarHBondContact O-N 3.34Å; K125-G128 PolarHBondContact O-N 3.27Å; M126-G128 VanDerWaalsContact C-N 3.34Å; M126-G128 PolarHBondContact O-N 3.33Å; G128-Y131 PolarHBondContact O-N 2.89Å; G128-R132 VanDerWaalsContact O-CB 3.26Å; G128-R132 WeakPolarHBondContact O-CB 3.35Å; G128-R132 PolarHBondContact O-N 2.75Å; G128-S150 PolarHBondContact O-OG 3.09Å; G128-Y154 VanDerWaalsContact C-OH 3.25Å; G128-Y154 PolarHBondContact O-OH 3.2Å
129	D	98.8	Very high	97.7	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-59.7	-47.2	176.7	-78.9	-48	0	0	0	112.5	K125 M126 K127 R132 Y133 Y154 N178	K125-D129 IonicContact NZ-OD2 2.76Å; K125-D129 PolarHBondContact NZ-OD2 3.44Å; K125-D129 PolarHBondContact O-N 3.49Å; M126-D129 WeakPolarHBondContact O-CB 3.39Å; M126-D129 PolarHBondContact O-N 3.45Å; M126-D129 VanDerWaalsContact O-N 3.11Å; K127-D129 VanDerWaalsContact C-N 3.34Å; K127-D129 PolarHBondContact O-N 2.71Å; D129-R132 WeakPolarHBondContact O-CB 3.43Å; D129-R132 PolarHBondContact O-N 3.14Å; D129-R132 IonicContact OD1-CZ 2.82Å; D129-R132 IonicContact OD1-NE 3.62Å; D129-R132 IonicContact OD1-NH2 3.56Å; D129-R132 PolarHBondContact OD1-NH2 3.39Å; D129-Y133 HydrophobicContact CB-CE2 4.09Å; D129-Y133 WeakPolarHBondContact O-CD1 3.26Å; D129-Y133 WeakPolarHBondContact O-CD2 3.37Å; D129-Y133 WeakPolarHBondContact O-CE2 3.43Å; D129-Y133 PolarHBondContact O-N 3.16Å; D129-Y154 VanDerWaalsContact CA-OH 3.25Å; D129-Y154 WeakPolarHBondContact CA-OH 3.28Å; D129-Y154 PolarHBondContact N-OH 3.15Å; D129-Y154 VanDerWaalsContact N-OH 3.14Å; D129-Y154 PolarHBondContact OD1-OH 3.42Å; D129-N178 WeakPolarHBondContact OD1-CB 3.29Å; D129-N178 PolarHBondContact OD1-ND2 2.94Å; D129-N178 PolarHBondContact OD2-ND2 2.86Å
130	Y	98.8	Very high	97.4	Very high	5 Å²	5	23.6 Å²	23.6	2%	0.02	14%	0.135	C	C	.	.	H	α-helix	trans	-71.9	-34.7	-178.5	-70.7	-72.9	0	0	0	113.1	Y49 K50 V53 C97 V100 L104 M126 K127 Y133 L134	Y49-Y130 VanDerWaalsContact C-OH 3.26Å; Y49-Y130 WeakPolarHBondContact CB-OH 3.43Å; K50-Y130 PolarHBondContact N-OH 3.28Å; V53-Y130 HydrophobicContact CB-CE1 4.22Å; V53-Y130 HydrophobicContact CG2-CD1 4.1Å; V53-Y130 HydrophobicContact CG2-CE1 3.68Å; C97-Y130 HydrophobicContact CB-CD1 4.46Å; V100-Y130 HydrophobicContact CB-CD2 4.44Å; V100-Y130 HydrophobicContact CB-CE2 4.36Å; V100-Y130 HydrophobicContact CG1-CD1 3.46Å; V100-Y130 VanDerWaalsContact CG1-CD1 3.46Å; V100-Y130 HydrophobicContact CG1-CD2 3.47Å; V100-Y130 VanDerWaalsContact CG1-CD2 3.47Å; V100-Y130 HydrophobicContact CG1-CE1 3.66Å; V100-Y130 HydrophobicContact CG1-CE2 3.7Å; V100-Y130 HydrophobicContact CG1-CG 3.4Å; V100-Y130 HydrophobicContact CG2-CD2 4.08Å; V100-Y130 HydrophobicContact CG2-CE2 3.76Å; L104-Y130 HydrophobicContact CD1-CD2 4.39Å; M126-Y130 HydrophobicContact CB-CD2 4.47Å; M126-Y130 HydrophobicContact CB-CE2 4.28Å; M126-Y130 HydrophobicContact CE-CE2 3.81Å; M126-Y130 WeakPolarHBondContact O-CD2 3.49Å; M126-Y130 PolarHBondContact O-N 2.98Å; K127-Y130 PolarHBondContact O-N 3.18Å; Y130-Y133 AromaticContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CE2 4.16Å; Y130-Y133 HydrophobicContact CE1-CD2 4.18Å; Y130-Y133 HydrophobicContact CE1-CE2 4.19Å; Y130-Y133 HydrophobicContact CG-CD2 4.4Å; Y130-Y133 PolarHBondContact O-N 2.86Å; Y130-L134 WeakPolarHBondContact O-CG 3.31Å; Y130-L134 PolarHBondContact O-N 2.81Å
131	Y	98.8	Very high	97	Very high	46 Å²	46	29.3 Å²	29.3	18%	0.18	16%	0.163	C	C	.	.	H	α-helix	trans	-66.5	-37.9	169.4	-80.3	-60.4	0	0	0	112.4	L101 K127 G128 Y133 L134 A135 V146 A149	L101-Y131 HydrophobicContact CD1-CD1 4.03Å; L101-Y131 HydrophobicContact CD1-CE1 3.74Å; L101-Y131 HydrophobicContact CD1-CE2 4.27Å; L101-Y131 HydrophobicContact CD1-CG 4.39Å; L101-Y131 HydrophobicContact CD2-CD2 3.79Å; L101-Y131 HydrophobicContact CD2-CE2 3.58Å; L101-Y131 HydrophobicContact CD2-CG 4.34Å; K127-Y131 HydrophobicContact CD-CE2 4.34Å; K127-Y131 HydrophobicContact CG-CD2 3.88Å; K127-Y131 HydrophobicContact CG-CE2 3.73Å; K127-Y131 VanDerWaalsContact O-CD2 3.29Å; K127-Y131 WeakPolarHBondContact O-CD2 3.32Å; K127-Y131 PolarHBondContact O-N 3.37Å; G128-Y131 PolarHBondContact O-N 2.89Å; Y131-Y133 VanDerWaalsContact C-N 3.34Å; Y131-Y133 PolarHBondContact O-N 3.03Å; Y131-L134 HydrophobicContact CD1-CD1 4.04Å; Y131-L134 HydrophobicContact CE1-CD1 4.42Å; Y131-L134 CarbonylContact O-C 3.59Å; Y131-L134 WeakPolarHBondContact O-CB 3.24Å; Y131-L134 PolarHBondContact O-N 3.37Å; Y131-A135 WeakPolarHBondContact O-CB 3.35Å; Y131-A135 PolarHBondContact O-N 2.97Å; Y131-V146 HydrophobicContact CD1-CB 4.24Å; Y131-V146 HydrophobicContact CD1-CG1 4.29Å; Y131-A149 HydrophobicContact CD1-CB 3.78Å; Y131-A149 HydrophobicContact CD2-CB 3.8Å; Y131-A149 HydrophobicContact CE1-CB 3.78Å; Y131-A149 HydrophobicContact CE2-CB 3.8Å; Y131-A149 HydrophobicContact CG-CB 3.81Å
132	R	98.5	Very high	96.6	Very high	13 Å²	13	33.1 Å²	33.1	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-43.4	171.7	171.8	168.5	71.8	88.5	2.1	112	G128 D129 L134 A135 E136 Y154 F182 E185 I186	G128-R132 VanDerWaalsContact O-CB 3.26Å; G128-R132 WeakPolarHBondContact O-CB 3.35Å; G128-R132 PolarHBondContact O-N 2.75Å; D129-R132 WeakPolarHBondContact O-CB 3.43Å; D129-R132 PolarHBondContact O-N 3.14Å; D129-R132 IonicContact OD1-CZ 2.82Å; D129-R132 IonicContact OD1-NE 3.62Å; D129-R132 IonicContact OD1-NH2 3.56Å; D129-R132 PolarHBondContact OD1-NH2 3.39Å; R132-L134 VanDerWaalsContact C-N 3.33Å; R132-L134 PolarHBondContact O-N 2.96Å; R132-A135 WeakPolarHBondContact O-CB 3.47Å; R132-A135 PolarHBondContact O-N 3.36Å; R132-E136 PolarHBondContact O-N 3.4Å; R132-Y154 PolarHBondContact NE-OH 3.15Å; R132-F182 HydrophobicContact CB-CD2 4.36Å; R132-F182 HydrophobicContact CG-CD2 4.41Å; R132-E185 IonicContact NH1-OE2 3.21Å; R132-I186 HydrophobicContact CG-CD1 4.31Å; R132-I186 HydrophobicContact CG-CG1 3.79Å
133	Y	98.5	Very high	96.5	Very high	24 Å²	24	36.2 Å²	36.2	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-35.8	175.5	-55.9	-32.6	0	0	0	112.5	V53 R57 D129 Y130 Y131	V53-Y133 HydrophobicContact CG1-CD2 3.61Å; V53-Y133 HydrophobicContact CG1-CE2 4.25Å; V53-Y133 HydrophobicContact CG1-CG 4.05Å; R57-Y133 VanDerWaalsContact CZ-CD1 3.45Å; D129-Y133 HydrophobicContact CB-CE2 4.09Å; D129-Y133 WeakPolarHBondContact O-CD1 3.26Å; D129-Y133 WeakPolarHBondContact O-CD2 3.37Å; D129-Y133 WeakPolarHBondContact O-CE2 3.43Å; D129-Y133 PolarHBondContact O-N 3.16Å; Y130-Y133 AromaticContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CD2 3.79Å; Y130-Y133 HydrophobicContact CD1-CE2 4.16Å; Y130-Y133 HydrophobicContact CE1-CD2 4.18Å; Y130-Y133 HydrophobicContact CE1-CE2 4.19Å; Y130-Y133 HydrophobicContact CG-CD2 4.4Å; Y130-Y133 PolarHBondContact O-N 2.86Å; Y131-Y133 VanDerWaalsContact C-N 3.34Å; Y131-Y133 PolarHBondContact O-N 3.03Å
134	L	98.5	Very high	96.3	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-40.8	170.8	-71	171.9	0	0	0	111.4	L93 E94 C97 L101 Y130 Y131 R132 E136 V137 A138 V146	L93-L134 HydrophobicContact CD2-CD2 4.21Å; E94-L134 HydrophobicContact CB-CD2 4.09Å; E94-L134 HydrophobicContact CG-CD2 4.17Å; C97-L134 HydrophobicContact CB-CD1 4.04Å; C97-L134 HydrophobicContact CB-CD2 3.71Å; C97-L134 HydrophobicContact CB-CG 3.73Å; L101-L134 HydrophobicContact CD1-CD1 3.7Å; Y130-L134 WeakPolarHBondContact O-CG 3.31Å; Y130-L134 PolarHBondContact O-N 2.81Å; Y131-L134 HydrophobicContact CD1-CD1 4.04Å; Y131-L134 HydrophobicContact CE1-CD1 4.42Å; Y131-L134 CarbonylContact O-C 3.59Å; Y131-L134 WeakPolarHBondContact O-CB 3.24Å; Y131-L134 PolarHBondContact O-N 3.37Å; R132-L134 VanDerWaalsContact C-N 3.33Å; R132-L134 PolarHBondContact O-N 2.96Å; L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 2.94Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; L134-V137 PolarHBondContact O-N 2.87Å; L134-A138 WeakPolarHBondContact O-CB 3.45Å; L134-A138 PolarHBondContact O-N 3.34Å; L134-V146 HydrophobicContact CB-CB 4.23Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.47Å; L134-V146 HydrophobicContact CD1-CG1 4.43Å
135	A	97.9	Very high	96.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-33.3	179.3	0	0	0	0	0	113.2	Y131 R132 V137 V146 V147 I186	Y131-A135 WeakPolarHBondContact O-CB 3.35Å; Y131-A135 PolarHBondContact O-N 2.97Å; R132-A135 WeakPolarHBondContact O-CB 3.47Å; R132-A135 PolarHBondContact O-N 3.36Å; A135-V137 VanDerWaalsContact C-N 3.26Å; A135-V137 PolarHBondContact O-N 3.1Å; A135-V146 VanDerWaalsContact CA-CG2 3.48Å; A135-V146 HydrophobicContact CB-CG2 3.75Å; A135-V147 HydrophobicContact CB-CG2 3.83Å; A135-I186 HydrophobicContact CB-CD1 4.33Å; A135-I186 HydrophobicContact CB-CG2 3.82Å
136	E	96.6	Very high	96.2	Very high	40 Å²	40	42.7 Å²	42.7	19%	0.187	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-36.3	175.5	-177.4	177.7	-162.3	0	0	112.3	R57 W60 R61 R132 L134 I186	R57-E136 IonicContact CZ-OE2 3.8Å; R57-E136 IonicContact NE-OE2 2.88Å; R57-E136 PolarHBondContact NE-OE2 3.45Å; R57-E136 IonicContact NH2-OE1 3.72Å; R57-E136 IonicContact NH2-OE2 3.01Å; R57-E136 PolarHBondContact NH2-OE2 3.02Å; W60-E136 HydrophobicContact CE3-CG 4.45Å; W60-E136 HydrophobicContact CH2-CG 4.23Å; W60-E136 WeakPolarHBondContact CH2-O 3.36Å; W60-E136 HydrophobicContact CZ3-CG 3.77Å; R61-E136 IonicContact CZ-OE1 2.74Å; R61-E136 IonicContact NE-OE1 2.67Å; R61-E136 PolarHBondContact NE-OE1 3.32Å; R61-E136 IonicContact NH2-OE1 2.63Å; R61-E136 PolarHBondContact NH2-OE1 3.21Å; R61-E136 IonicContact NH2-OE2 3.95Å; R132-E136 PolarHBondContact O-N 3.4Å; L134-E136 VanDerWaalsContact C-N 3.3Å; L134-E136 PolarHBondContact O-N 2.94Å; E136-I186 HydrophobicContact CB-CD1 4.38Å
137	V	96.2	Very high	96.2	Very high	18 Å²	18	43 Å²	43	11%	0.109	24%	0.237	C	C	.	.	H	α-helix	trans	-105.3	-12.6	-176.1	-52.8	0	0	0	0	114	W60 E90 L93 L134 A135	W60-V137 HydrophobicContact CD2-CG1 3.64Å; W60-V137 HydrophobicContact CE3-CG1 4.03Å; W60-V137 HydrophobicContact CG-CG1 3.99Å; W60-V137 HydrophobicContact CH2-CG1 4.33Å; W60-V137 HydrophobicContact CZ2-CB 4.24Å; W60-V137 HydrophobicContact CZ2-CG1 3.97Å; W60-V137 HydrophobicContact CZ3-CG1 4.37Å; E90-V137 HydrophobicContact CG-CB 4.13Å; L93-V137 HydrophobicContact CD1-CG1 4.06Å; L93-V137 HydrophobicContact CD2-CG2 4Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; L134-V137 PolarHBondContact O-N 2.87Å; A135-V137 VanDerWaalsContact C-N 3.26Å; A135-V137 PolarHBondContact O-N 3.1Å
138	A	95.2	Very high	96.1	Very high	13 Å²	13	47.4 Å²	47.4	11%	0.107	26%	0.258	C	S	.	.			trans	-73	148.4	-178.5	0	0	0	0	0	112.1	L134 K142 K143 V146	L134-A138 WeakPolarHBondContact O-CB 3.45Å; L134-A138 PolarHBondContact O-N 3.34Å; A138-K142 HydrophobicContact CB-CG 4.31Å; A138-K143 HydrophobicContact CB-CB 4.1Å; A138-V146 HydrophobicContact CB-CG2 3.93Å
139	S	89.9	Confident	96.1	Very high	96 Å²	96	48.8 Å²	48.8	67%	0.671	27%	0.27	S	S	*	.			trans	-131.9	161.5	174.7	57.2	0	0	0	0	110.9
140	G	90.7	Very high	96.1	Very high	61 Å²	61	48.5 Å²	48.5	63%	0.629	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	-147.3	179.4	0	0	0	0	0	113.6	K142 K143	G140-K142 PolarHBondContact O-N 3.13Å; G140-K143 WeakPolarHBondContact O-CB 3.41Å; G140-K143 PolarHBondContact O-N 2.93Å; G140-K143 VanDerWaalsContact O-N 3.08Å
141	E	88.7	Confident	96.1	Very high	180 Å²	180	50 Å²	50	84%	0.841	28%	0.275	S	S	*	.	H	α-helix	trans	-59.4	-32.7	-176.5	-64.3	-179.6	172.4	0	0	113.3	K143 N144	E141-K143 PolarHBondContact O-N 3.47Å; E141-N144 PolarHBondContact O-N 3.04Å
142	K	91.5	Very high	96.1	Very high	80 Å²	80	50.7 Å²	50.7	35%	0.348	29%	0.291	S	S	.	.	H	α-helix	trans	-59.1	-36.4	177.9	-176.6	174.7	170.2	-175.5	0	111.3	E94 A138 G140 N144 S145 V146	E94-K142 IonicContact OE1-NZ 3.15Å; E94-K142 PolarHBondContact OE1-NZ 3.29Å; E94-K142 IonicContact OE2-NZ 3.69Å; E94-K142 PolarHBondContact OE2-NZ 2.6Å; A138-K142 HydrophobicContact CB-CG 4.31Å; G140-K142 PolarHBondContact O-N 3.13Å; K142-N144 PolarHBondContact O-N 3.29Å; K142-S145 PolarHBondContact O-N 3.45Å; K142-S145 PolarHBondContact O-OG 3.11Å; K142-V146 HydrophobicContact CG-CG1 4.46Å; K142-V146 WeakPolarHBondContact O-CG2 3.45Å; K142-V146 PolarHBondContact O-N 3.28Å
143	K	95.2	Very high	96.1	Very high	87 Å²	87	50.3 Å²	50.3	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-58	-48.4	-179.1	-173.1	171.9	-179.2	174.3	0	111.4	A138 G140 E141 S145 V146 V147	A138-K143 HydrophobicContact CB-CB 4.1Å; G140-K143 WeakPolarHBondContact O-CB 3.41Å; G140-K143 PolarHBondContact O-N 2.93Å; G140-K143 VanDerWaalsContact O-N 3.08Å; E141-K143 PolarHBondContact O-N 3.47Å; K143-S145 VanDerWaalsContact C-N 3.34Å; K143-S145 PolarHBondContact O-N 2.7Å; K143-V146 WeakPolarHBondContact O-CG2 3.45Å; K143-V146 PolarHBondContact O-N 3.26Å; K143-V147 HydrophobicContact CG-CG2 4.18Å; K143-V147 WeakPolarHBondContact O-CB 3.48Å; K143-V147 WeakPolarHBondContact O-CG2 3.36Å; K143-V147 PolarHBondContact O-N 2.91Å
144	N	95.5	Very high	96.1	Very high	104 Å²	104	49.1 Å²	49.1	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-60.4	-45.5	-178.6	-65.7	-8.8	0	0	0	111.4	E141 K142 V146 V147 E148	E141-N144 PolarHBondContact O-N 3.04Å; K142-N144 PolarHBondContact O-N 3.29Å; N144-V146 PolarHBondContact O-N 3.23Å; N144-V147 PolarHBondContact O-N 3.4Å; N144-E148 WeakPolarHBondContact O-CG 3.41Å; N144-E148 PolarHBondContact O-N 3.48Å
145	S	96.3	Very high	96.1	Very high	63 Å²	63	53.6 Å²	53.6	44%	0.441	31%	0.305	S	S	.	.	H	α-helix	trans	-61.5	-39.3	-179.7	69.4	0	0	0	0	113.7	K142 K143 A149	K142-S145 PolarHBondContact O-N 3.45Å; K142-S145 PolarHBondContact O-OG 3.11Å; K143-S145 VanDerWaalsContact C-N 3.34Å; K143-S145 PolarHBondContact O-N 2.7Å; S145-A149 WeakPolarHBondContact O-CB 3.38Å; S145-A149 PolarHBondContact O-N 3.2Å; S145-A149 VanDerWaalsContact O-N 3.09Å
146	V	97.7	Very high	96.1	Very high	9 Å²	9	57.4 Å²	57.4	6%	0.055	32%	0.322	C	S	.	.	H	α-helix	trans	-77.2	-30.7	178.9	-61.9	0	0	0	0	112.1	Y131 L134 A135 A138 K142 K143 N144 S150	Y131-V146 HydrophobicContact CD1-CB 4.24Å; Y131-V146 HydrophobicContact CD1-CG1 4.29Å; L134-V146 HydrophobicContact CB-CB 4.23Å; L134-V146 HydrophobicContact CB-CG1 4.1Å; L134-V146 HydrophobicContact CB-CG2 4.47Å; L134-V146 HydrophobicContact CD1-CG1 4.43Å; A135-V146 VanDerWaalsContact CA-CG2 3.48Å; A135-V146 HydrophobicContact CB-CG2 3.75Å; A138-V146 HydrophobicContact CB-CG2 3.93Å; K142-V146 HydrophobicContact CG-CG1 4.46Å; K142-V146 WeakPolarHBondContact O-CG2 3.45Å; K142-V146 PolarHBondContact O-N 3.28Å; K143-V146 WeakPolarHBondContact O-CG2 3.45Å; K143-V146 PolarHBondContact O-N 3.26Å; N144-V146 PolarHBondContact O-N 3.23Å; V146-S150 VanDerWaalsContact O-CB 3.28Å; V146-S150 WeakPolarHBondContact O-CB 3.24Å; V146-S150 PolarHBondContact O-N 2.92Å
147	V	98.2	Very high	96.2	Very high	13 Å²	13	55.5 Å²	55.5	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-48.8	173.5	171.7	0	0	0	0	110.4	A135 K143 N144 A149 S150 E151 F182 I186	A135-V147 HydrophobicContact CB-CG2 3.83Å; K143-V147 HydrophobicContact CG-CG2 4.18Å; K143-V147 WeakPolarHBondContact O-CB 3.48Å; K143-V147 WeakPolarHBondContact O-CG2 3.36Å; K143-V147 PolarHBondContact O-N 2.91Å; N144-V147 PolarHBondContact O-N 3.4Å; V147-A149 PolarHBondContact O-N 2.91Å; V147-S150 WeakPolarHBondContact O-CB 3.48Å; V147-S150 PolarHBondContact O-N 3.19Å; V147-E151 PolarHBondContact O-N 3.24Å; V147-F182 HydrophobicContact CG1-CE2 4.31Å; V147-F182 HydrophobicContact CG1-CZ 4.02Å; V147-I186 HydrophobicContact CG1-CG2 4.35Å; V147-I186 HydrophobicContact CG2-CG2 3.63Å
148	E	97.9	Very high	96.3	Very high	132 Å²	132	55.8 Å²	55.8	62%	0.617	31%	0.313	S	S	*	.	H	α-helix	trans	-61	-43.6	177.1	-72.3	174.1	-174.5	0	0	111.8	N144 S150 E151 A152	N144-E148 WeakPolarHBondContact O-CG 3.41Å; N144-E148 PolarHBondContact O-N 3.48Å; E148-S150 PolarHBondContact O-N 2.88Å; E148-E151 PolarHBondContact O-N 2.87Å; E148-A152 VanDerWaalsContact O-CB 3.31Å; E148-A152 WeakPolarHBondContact O-CB 3.41Å; E148-A152 PolarHBondContact O-N 3.17Å
149	A	98.4	Very high	96.5	Very high	29 Å²	29	60.5 Å²	60.5	24%	0.24	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-38.6	177.4	0	0	0	0	0	112.6	Y131 S145 V147 A153	Y131-A149 HydrophobicContact CD1-CB 3.78Å; Y131-A149 HydrophobicContact CD2-CB 3.8Å; Y131-A149 HydrophobicContact CE1-CB 3.78Å; Y131-A149 HydrophobicContact CE2-CB 3.8Å; Y131-A149 HydrophobicContact CG-CB 3.81Å; S145-A149 WeakPolarHBondContact O-CB 3.38Å; S145-A149 PolarHBondContact O-N 3.2Å; S145-A149 VanDerWaalsContact O-N 3.09Å; V147-A149 PolarHBondContact O-N 2.91Å; A149-A153 WeakPolarHBondContact O-CB 3.28Å; A149-A153 PolarHBondContact O-N 3.09Å; A149-A153 VanDerWaalsContact O-N 3.14Å
150	S	98.7	Very high	96.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-52.1	173.5	178.4	0	0	0	0	110.9	G128 V146 V147 E148 A152 A153 Y154 F182	G128-S150 PolarHBondContact O-OG 3.09Å; V146-S150 VanDerWaalsContact O-CB 3.28Å; V146-S150 WeakPolarHBondContact O-CB 3.24Å; V146-S150 PolarHBondContact O-N 2.92Å; V147-S150 WeakPolarHBondContact O-CB 3.48Å; V147-S150 PolarHBondContact O-N 3.19Å; E148-S150 PolarHBondContact O-N 2.88Å; S150-A152 PolarHBondContact O-N 3.19Å; S150-A153 PolarHBondContact O-N 3.41Å; S150-Y154 WeakPolarHBondContact O-CD2 3.44Å; S150-Y154 PolarHBondContact O-N 3.07Å; S150-Y154 VanDerWaalsContact OG-CE2 3.3Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.4Å; S150-F182 WeakPolarHBondContact OG-CD2 3.46Å; S150-F182 VanDerWaalsContact OG-CE2 3.24Å; S150-F182 WeakPolarHBondContact OG-CE2 3.44Å
151	E	98.7	Very high	97.2	Very high	37 Å²	37	54.3 Å²	54.3	17%	0.173	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-42.5	-178.6	-170.3	170.8	-179.6	0	0	112.2	V147 E148 A153 Y154 K155 F179 F182 Q187	V147-E151 PolarHBondContact O-N 3.24Å; E148-E151 PolarHBondContact O-N 2.87Å; E151-A153 VanDerWaalsContact C-N 3.35Å; E151-A153 PolarHBondContact O-N 3.48Å; E151-Y154 PolarHBondContact O-N 3.19Å; E151-K155 HydrophobicContact CG-CD 4.06Å; E151-K155 HydrophobicContact CG-CG 4.35Å; E151-K155 WeakPolarHBondContact O-CB 3.38Å; E151-K155 WeakPolarHBondContact O-CG 3.48Å; E151-K155 PolarHBondContact O-N 3.46Å; E151-K155 WeakPolarHBondContact OE1-CE 3.4Å; E151-K155 IonicContact OE1-NZ 2.83Å; E151-K155 PolarHBondContact OE1-NZ 3.01Å; E151-F179 HydrophobicContact CG-CE2 4.46Å; E151-F182 HydrophobicContact CB-CE1 3.78Å; E151-F182 HydrophobicContact CB-CZ 3.74Å; E151-F182 HydrophobicContact CG-CE1 3.99Å; E151-F182 HydrophobicContact CG-CZ 4.42Å; E151-Q187 PolarHBondContact OE2-NE2 3.42Å
152	A	98.7	Very high	97.6	Very high	61 Å²	61	50 Å²	50	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-59.4	-45.3	177.3	0	0	0	0	0	111.8	E148 S150 K155 E156	E148-A152 VanDerWaalsContact O-CB 3.31Å; E148-A152 WeakPolarHBondContact O-CB 3.41Å; E148-A152 PolarHBondContact O-N 3.17Å; S150-A152 PolarHBondContact O-N 3.19Å; A152-K155 PolarHBondContact O-N 3.04Å; A152-E156 WeakPolarHBondContact O-CB 3.26Å; A152-E156 PolarHBondContact O-N 2.81Å
153	A	98.8	Very high	97.8	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-42.2	178.5	0	0	0	0	0	112.2	K127 A149 S150 E151 A157	K127-A153 HydrophobicContact CB-CB 4.1Å; K127-A153 HydrophobicContact CD-CB 4.18Å; K127-A153 HydrophobicContact CG-CB 3.94Å; A149-A153 WeakPolarHBondContact O-CB 3.28Å; A149-A153 PolarHBondContact O-N 3.09Å; A149-A153 VanDerWaalsContact O-N 3.14Å; S150-A153 PolarHBondContact O-N 3.41Å; E151-A153 VanDerWaalsContact C-N 3.35Å; E151-A153 PolarHBondContact O-N 3.48Å; A153-A157 WeakPolarHBondContact O-CB 3.45Å; A153-A157 PolarHBondContact O-N 2.99Å
154	Y	98.9	Very high	97.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-43.5	175.9	-74.7	-56	0	0	0	112.7	G128 D129 R132 S150 E151 A157 F158 L175 N178 F179 F182	G128-Y154 VanDerWaalsContact C-OH 3.25Å; G128-Y154 PolarHBondContact O-OH 3.2Å; D129-Y154 VanDerWaalsContact CA-OH 3.25Å; D129-Y154 WeakPolarHBondContact CA-OH 3.28Å; D129-Y154 PolarHBondContact N-OH 3.15Å; D129-Y154 VanDerWaalsContact N-OH 3.14Å; D129-Y154 PolarHBondContact OD1-OH 3.42Å; R132-Y154 PolarHBondContact NE-OH 3.15Å; S150-Y154 WeakPolarHBondContact O-CD2 3.44Å; S150-Y154 PolarHBondContact O-N 3.07Å; S150-Y154 VanDerWaalsContact OG-CE2 3.3Å; S150-Y154 WeakPolarHBondContact OG-CE2 3.4Å; E151-Y154 PolarHBondContact O-N 3.19Å; Y154-A157 PolarHBondContact O-N 3.46Å; Y154-F158 VanDerWaalsContact O-CB 3.24Å; Y154-F158 WeakPolarHBondContact O-CB 3.17Å; Y154-F158 PolarHBondContact O-N 3.32Å; Y154-L175 HydrophobicContact CD1-CD1 3.64Å; Y154-L175 HydrophobicContact CE1-CD1 4.33Å; Y154-N178 HydrophobicContact CE1-CB 4.2Å; Y154-F179 VanDerWaalsContact CB-CE2 3.46Å; Y154-F179 HydrophobicContact CD1-CB 3.93Å; Y154-F179 HydrophobicContact CD1-CD2 4.3Å; Y154-F179 HydrophobicContact CD1-CG 4.18Å; Y154-F179 AromaticContact CD2-CD2 3.56Å; Y154-F179 HydrophobicContact CD2-CD2 3.56Å; Y154-F179 AromaticContact CD2-CE2 3.99Å; Y154-F179 HydrophobicContact CD2-CE2 3.99Å; Y154-F179 HydrophobicContact CD2-CG 4.26Å; Y154-F179 HydrophobicContact CE1-CB 4.38Å; Y154-F179 HydrophobicContact CE2-CD2 4.39Å; Y154-F179 HydrophobicContact CG-CB 4.02Å; Y154-F179 HydrophobicContact CG-CD1 4.47Å; Y154-F179 AromaticContact CG-CD2 3.51Å; Y154-F179 HydrophobicContact CG-CD2 3.51Å; Y154-F179 HydrophobicContact CG-CE2 4.01Å; Y154-F179 AromaticContact CG-CG 3.78Å; Y154-F179 HydrophobicContact CG-CG 3.78Å; Y154-F182 HydrophobicContact CD2-CB 4.21Å; Y154-F182 HydrophobicContact CD2-CD1 4.35Å; Y154-F182 HydrophobicContact CD2-CG 4.11Å; Y154-F182 HydrophobicContact CE2-CB 3.75Å; Y154-F182 HydrophobicContact CE2-CD2 4.2Å; Y154-F182 AromaticContact CE2-CG 3.94Å; Y154-F182 HydrophobicContact CE2-CG 3.94Å
155	K	98.7	Very high	97.9	Very high	98 Å²	98	48.5 Å²	48.5	43%	0.426	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-46.3	177.5	-75.9	-179.7	179	168.2	0	111.4	E151 A152 A157 F158 E159 F179	E151-K155 HydrophobicContact CG-CD 4.06Å; E151-K155 HydrophobicContact CG-CG 4.35Å; E151-K155 WeakPolarHBondContact O-CB 3.38Å; E151-K155 WeakPolarHBondContact O-CG 3.48Å; E151-K155 PolarHBondContact O-N 3.46Å; E151-K155 WeakPolarHBondContact OE1-CE 3.4Å; E151-K155 IonicContact OE1-NZ 2.83Å; E151-K155 PolarHBondContact OE1-NZ 3.01Å; A152-K155 PolarHBondContact O-N 3.04Å; K155-A157 VanDerWaalsContact C-N 3.34Å; K155-A157 PolarHBondContact O-N 3.27Å; K155-F158 PolarHBondContact O-N 3.44Å; K155-F158 VanDerWaalsContact O-N 3.14Å; K155-E159 WeakPolarHBondContact O-CG 3.49Å; K155-E159 PolarHBondContact O-N 3.32Å; K155-F179 HydrophobicContact CG-CE1 4.33Å; K155-F179 HydrophobicContact CG-CZ 3.89Å
156	E	98.5	Very high	97.9	Very high	81 Å²	81	51.1 Å²	51.1	38%	0.379	25%	0.254	S	S	.	.	H	α-helix	trans	-59.7	-45.7	176.4	-169.3	-173.3	165.1	0	0	111.2	K120 L124 A152 F158 I160	K120-E156 WeakPolarHBondContact CE-OE1 3.36Å; K120-E156 IonicContact NZ-OE1 3.74Å; L124-E156 HydrophobicContact CD1-CB 4.14Å; L124-E156 HydrophobicContact CD1-CG 3.73Å; L124-E156 HydrophobicContact CD2-CB 4.46Å; L124-E156 HydrophobicContact CD2-CG 4.43Å; L124-E156 WeakPolarHBondContact CD2-OE2 3.24Å; A152-E156 WeakPolarHBondContact O-CB 3.26Å; A152-E156 PolarHBondContact O-N 2.81Å; E156-F158 VanDerWaalsContact C-N 3.28Å; E156-F158 PolarHBondContact O-N 3.24Å; E156-I160 HydrophobicContact CG-CD1 4.15Å; E156-I160 WeakPolarHBondContact O-CD1 3.44Å; E156-I160 VanDerWaalsContact O-CG1 3.32Å; E156-I160 WeakPolarHBondContact O-CG1 3.44Å; E156-I160 PolarHBondContact O-N 3.24Å
157	A	98.7	Very high	97.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.9	-40.3	175.6	0	0	0	0	0	111.9	V121 L124 A153 Y154 K155 S161 L175	V121-A157 HydrophobicContact CG1-CB 4.36Å; L124-A157 HydrophobicContact CB-CB 3.67Å; L124-A157 HydrophobicContact CD1-CB 4.47Å; A153-A157 WeakPolarHBondContact O-CB 3.45Å; A153-A157 PolarHBondContact O-N 2.99Å; Y154-A157 PolarHBondContact O-N 3.46Å; K155-A157 VanDerWaalsContact C-N 3.34Å; K155-A157 PolarHBondContact O-N 3.27Å; A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.31Å; A157-S161 PolarHBondContact O-N 3.08Å; A157-S161 PolarHBondContact O-OG 3.18Å; A157-L175 VanDerWaalsContact C-CD2 3.49Å; A157-L175 HydrophobicContact CB-CD1 3.8Å; A157-L175 HydrophobicContact CB-CD2 3.63Å; A157-L175 HydrophobicContact CB-CG 4.39Å
158	F	98.3	Very high	97.8	Very high	24 Å²	24	51 Å²	51	11%	0.105	25%	0.253	C	S	.	.	H	α-helix	trans	-69.9	-43.9	-173.5	-166.1	-119.4	0	0	0	111.6	Y154 K155 E156 S161 K162 L175 L196	Y154-F158 VanDerWaalsContact O-CB 3.24Å; Y154-F158 WeakPolarHBondContact O-CB 3.17Å; Y154-F158 PolarHBondContact O-N 3.32Å; K155-F158 PolarHBondContact O-N 3.44Å; K155-F158 VanDerWaalsContact O-N 3.14Å; E156-F158 VanDerWaalsContact C-N 3.28Å; E156-F158 PolarHBondContact O-N 3.24Å; F158-S161 WeakPolarHBondContact CA-OG 3.48Å; F158-S161 PolarHBondContact O-N 3.38Å; F158-S161 PolarHBondContact O-OG 2.64Å; F158-K162 HydrophobicContact CD1-CD 4.15Å; F158-K162 HydrophobicContact CE1-CD 4.1Å; F158-K162 WeakPolarHBondContact O-CG 3.22Å; F158-K162 PolarHBondContact O-N 2.94Å; F158-L175 HydrophobicContact CB-CD2 4.17Å; F158-L175 HydrophobicContact CD2-CD2 4.14Å; F158-L175 HydrophobicContact CD2-CG 4.46Å; F158-L196 HydrophobicContact CE1-CD1 3.89Å; F158-L196 HydrophobicContact CE2-CD1 3.73Å; F158-L196 HydrophobicContact CZ-CD1 3.31Å
159	E	98	Very high	97.7	Very high	112 Å²	112	46.6 Å²	46.6	52%	0.523	23%	0.232	S	C	.	.	H	α-helix	trans	-61.9	-46.9	176.2	-65.3	-52	120.3	0	0	111.7	K155 S161 K162 E163	K155-E159 WeakPolarHBondContact O-CG 3.49Å; K155-E159 PolarHBondContact O-N 3.32Å; E159-S161 VanDerWaalsContact C-N 3.31Å; E159-S161 PolarHBondContact O-N 2.96Å; E159-K162 PolarHBondContact O-N 3.16Å; E159-K162 IonicContact OE1-NZ 3.71Å; E159-E163 PolarHBondContact O-N 2.95Å
160	I	98.1	Very high	97.6	Very high	27 Å²	27	46.2 Å²	46.2	14%	0.138	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-41.7	175.9	-61.4	167.1	0	0	0	110.8	K120 V121 L124 E156 K162 E163 H164	K120-I160 HydrophobicContact CD-CD1 3.81Å; K120-I160 HydrophobicContact CG-CD1 4.07Å; V121-I160 HydrophobicContact CG2-CB 3.81Å; V121-I160 HydrophobicContact CG2-CG2 3.51Å; L124-I160 HydrophobicContact CD1-CD1 3.8Å; E156-I160 HydrophobicContact CG-CD1 4.15Å; E156-I160 WeakPolarHBondContact O-CD1 3.44Å; E156-I160 VanDerWaalsContact O-CG1 3.32Å; E156-I160 WeakPolarHBondContact O-CG1 3.44Å; E156-I160 PolarHBondContact O-N 3.24Å; I160-K162 VanDerWaalsContact C-N 3.35Å; I160-K162 PolarHBondContact O-N 3.15Å; I160-E163 PolarHBondContact O-N 3.36Å; I160-H164 PolarHBondContact O-CD2 3.26Å; I160-H164 PolarHBondContact O-N 3.3Å; I160-H164 VanDerWaalsContact O-N 3.13Å
161	S	98	Very high	97.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-34.6	-179	77.1	0	0	0	0	113	A157 F158 E159 M165	A157-S161 VanDerWaalsContact O-CB 3.27Å; A157-S161 WeakPolarHBondContact O-CB 3.31Å; A157-S161 PolarHBondContact O-N 3.08Å; A157-S161 PolarHBondContact O-OG 3.18Å; F158-S161 WeakPolarHBondContact CA-OG 3.48Å; F158-S161 PolarHBondContact O-N 3.38Å; F158-S161 PolarHBondContact O-OG 2.64Å; E159-S161 VanDerWaalsContact C-N 3.31Å; E159-S161 PolarHBondContact O-N 2.96Å; S161-M165 WeakPolarHBondContact O-CA 3.33Å; S161-M165 VanDerWaalsContact O-CB 3.27Å; S161-M165 WeakPolarHBondContact O-CB 3.3Å; S161-M165 PolarHBondContact O-N 3.48Å
162	K	96.7	Very high	97.6	Very high	88 Å²	88	47.1 Å²	47.1	38%	0.383	23%	0.231	S	C	.	.	H	α-helix	trans	-67.3	-38.5	176.5	-81	173.9	168.6	168.9	0	112.1	F158 E159 I160	F158-K162 HydrophobicContact CD1-CD 4.15Å; F158-K162 HydrophobicContact CE1-CD 4.1Å; F158-K162 WeakPolarHBondContact O-CG 3.22Å; F158-K162 PolarHBondContact O-N 2.94Å; E159-K162 PolarHBondContact O-N 3.16Å; E159-K162 IonicContact OE1-NZ 3.71Å; I160-K162 VanDerWaalsContact C-N 3.35Å; I160-K162 PolarHBondContact O-N 3.15Å
163	E	96.3	Very high	97.6	Very high	149 Å²	149	44.3 Å²	44.3	70%	0.696	21%	0.207	S	C	*	.	H	α-helix	trans	-74.4	-38.5	-177.7	-171.1	176.8	166.4	0	0	112.4	E159 I160	E159-E163 PolarHBondContact O-N 2.95Å; I160-E163 PolarHBondContact O-N 3.36Å
164	H	96.7	Very high	97.5	Very high	83 Å²	83	44.5 Å²	44.5	38%	0.384	21%	0.21	S	C	.	.	H	α-helix	trans	-117.7	-8.2	-166.5	-59.9	-60.9	0	0	0	116	Y117 I160	Y117-H164 HydrophobicContact CD1-CB 4.05Å; Y117-H164 HydrophobicContact CD2-CB 3.54Å; Y117-H164 HydrophobicContact CE1-CB 4.41Å; Y117-H164 HydrophobicContact CE2-CB 3.95Å; Y117-H164 WeakPolarHBondContact CE2-O 3.48Å; Y117-H164 HydrophobicContact CG-CB 3.62Å; I160-H164 PolarHBondContact O-CD2 3.26Å; I160-H164 PolarHBondContact O-N 3.3Å; I160-H164 VanDerWaalsContact O-N 3.13Å
165	M	96	Very high	97.5	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.039	21%	0.21	C	C	.	.	S	Bend	trans	-125	137.5	-172.1	-49	179.9	69.7	0	0	111.3	Y117 E118 V121 S161 H169 I171 R172	Y117-M165 HydrophobicContact CD2-CG 3.93Å; Y117-M165 HydrophobicContact CE2-CG 4.11Å; E118-M165 HydrophobicContact CG-CE 4.07Å; V121-M165 HydrophobicContact CB-SD 4.06Å; V121-M165 HydrophobicContact CG1-SD 4.03Å; V121-M165 HydrophobicContact CG2-SD 3.9Å; S161-M165 WeakPolarHBondContact O-CA 3.33Å; S161-M165 VanDerWaalsContact O-CB 3.27Å; S161-M165 WeakPolarHBondContact O-CB 3.3Å; S161-M165 PolarHBondContact O-N 3.48Å; M165-H169 HydrophobicContact CB-CB 4.28Å; M165-H169 HydrophobicContact CE-CB 4.24Å; M165-H169 WeakPolarHBondContact CE-CE1 3.45Å; M165-H169 VanDerWaalsContact CE-CG 3.4Å; M165-H169 WeakPolarHBondContact CE-ND1 3.18Å; M165-H169 WeakPolarHBondContact CE-NE2 3.28Å; M165-I171 HydrophobicContact CE-CB 3.78Å; M165-I171 HydrophobicContact CE-CD1 4.49Å; M165-I171 HydrophobicContact CE-CG2 4.08Å; M165-R172 HydrophobicContact CB-CB 4.33Å; M165-R172 PolarHBondContact O-NH1 3.41Å
166	Q	96	Very high	97.5	Very high	119 Å²	119	40 Å²	40	56%	0.556	19%	0.191	S	C	*	.			trans	-61.8	146.4	175.2	-62.8	-60.1	-24.8	0	0	110.9	T168 H169 R172 E207	Q166-T168 PolarHBondContact O-N 2.92Å; Q166-T168 VanDerWaalsContact O-N 3.12Å; Q166-H169 WeakPolarHBondContact O-CB 3.49Å; Q166-H169 PolarHBondContact O-N 3.46Å; Q166-R172 WeakPolarHBondContact O-CD 3.24Å; Q166-E207 PolarHBondContact OE1-OE2 3.4Å
167	P	97.2	Very high	97.5	Very high	14 Å²	14	37 Å²	37	9%	0.091	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-33.2	174.6	-28.7	36	0	0	0	114.4	H169 L173 D203 E207	P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.23Å; P167-L173 WeakPolarHBondContact O-CG 3.41Å; P167-D203 HydrophobicContact CB-CB 3.88Å; P167-D203 HydrophobicContact CG-CB 4.32Å; P167-E207 VanDerWaalsContact CD-OE2 3.32Å; P167-E207 WeakPolarHBondContact CD-OE2 3.13Å
168	T	96.5	Very high	97.5	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.031	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.3	179	54.4	0	0	0	0	114.1	Q166 A204 E207 S219	Q166-T168 PolarHBondContact O-N 2.92Å; Q166-T168 VanDerWaalsContact O-N 3.12Å; T168-A204 HydrophobicContact CG2-CB 4.37Å; T168-A204 WeakPolarHBondContact CG2-O 3.18Å; T168-E207 HydrophobicContact CG2-CB 3.97Å; T168-S219 WeakPolarHBondContact O-CB 3.04Å; T168-S219 PolarHBondContact O-OG 3.17Å
169	H	96.2	Very high	97.6	Very high	39 Å²	39	37.5 Å²	37.5	18%	0.181	18%	0.181	C	C	.	.			trans	-68.2	128.1	-176.4	-171.6	-59.2	0	0	0	111.3	E118 M165 Q166 P167 I171 R172 L173	E118-H169 IonicContact OE1-NE2 2.73Å; E118-H169 PolarHBondContact OE1-NE2 3.37Å; M165-H169 HydrophobicContact CB-CB 4.28Å; M165-H169 HydrophobicContact CE-CB 4.24Å; M165-H169 WeakPolarHBondContact CE-CE1 3.45Å; M165-H169 VanDerWaalsContact CE-CG 3.4Å; M165-H169 WeakPolarHBondContact CE-ND1 3.18Å; M165-H169 WeakPolarHBondContact CE-NE2 3.28Å; Q166-H169 WeakPolarHBondContact O-CB 3.49Å; Q166-H169 PolarHBondContact O-N 3.46Å; P167-H169 VanDerWaalsContact C-N 3.3Å; P167-H169 PolarHBondContact O-N 3.23Å; H169-I171 PolarHBondContact ND1-N 3.45Å; H169-I171 VanDerWaalsContact ND1-N 3.11Å; H169-I171 PolarHBondContact O-N 3.01Å; H169-R172 HydrophobicContact CB-CB 4.24Å; H169-R172 PolarHBondContact O-N 3.02Å; H169-L173 PolarHBondContact O-N 3.43Å
170	P	96.7	Very high	97.6	Very high	21 Å²	21	32.1 Å²	32.1	14%	0.136	16%	0.156	C	C	.	.	H	α-helix	trans	-53.7	-43.9	-175.5	-26.5	30.3	0	0	0	114.9	L173 G174 D218 S219 I222	P170-L173 PolarHBondContact O-N 3.16Å; P170-G174 PolarHBondContact O-N 3.01Å; P170-D218 HydrophobicContact CB-CB 4.15Å; P170-D218 HydrophobicContact CG-CB 4.09Å; P170-S219 WeakPolarHBondContact CD-OG 3.5Å; P170-S219 WeakPolarHBondContact CG-OG 3.49Å; P170-I222 HydrophobicContact CB-CD1 4.15Å; P170-I222 VanDerWaalsContact O-CD1 3.3Å; P170-I222 WeakPolarHBondContact O-CD1 3.4Å
171	I	97.7	Very high	97.6	Very high	23 Å²	23	31.7 Å²	31.7	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-61.8	-42.6	176.4	-61.3	173.3	0	0	0	112.3	E118 V121 F122 M165 H169 G174 L175	E118-I171 HydrophobicContact CB-CD1 4.34Å; V121-I171 HydrophobicContact CB-CG2 4.33Å; V121-I171 HydrophobicContact CG1-CG2 3.73Å; F122-I171 HydrophobicContact CB-CD1 4.43Å; F122-I171 HydrophobicContact CB-CG2 4.44Å; F122-I171 HydrophobicContact CD2-CD1 4.1Å; F122-I171 HydrophobicContact CD2-CG1 4.24Å; M165-I171 HydrophobicContact CE-CB 3.78Å; M165-I171 HydrophobicContact CE-CD1 4.49Å; M165-I171 HydrophobicContact CE-CG2 4.08Å; H169-I171 PolarHBondContact ND1-N 3.45Å; H169-I171 VanDerWaalsContact ND1-N 3.11Å; H169-I171 PolarHBondContact O-N 3.01Å; I171-G174 PolarHBondContact O-N 3.36Å; I171-L175 WeakPolarHBondContact O-CB 3.13Å; I171-L175 PolarHBondContact O-N 3.3Å
172	R	98.1	Very high	97.6	Very high	33 Å²	33	31.7 Å²	31.7	13%	0.125	16%	0.155	C	C	.	.	H	α-helix	trans	-66.4	-43.8	178.7	178.5	175.1	169.2	178.1	-7	110.9	M165 Q166 H169 L175 A176	M165-R172 HydrophobicContact CB-CB 4.33Å; M165-R172 PolarHBondContact O-NH1 3.41Å; Q166-R172 WeakPolarHBondContact O-CD 3.24Å; H169-R172 HydrophobicContact CB-CB 4.24Å; H169-R172 PolarHBondContact O-N 3.02Å; R172-L175 WeakPolarHBondContact O-CB 3.41Å; R172-L175 PolarHBondContact O-N 3.08Å; R172-A176 PolarHBondContact O-N 3.35Å
173	L	98.5	Very high	97.7	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-45.3	174.2	-73.7	167.4	0	0	0	111.9	P167 H169 P170 L175 A176 L177 A204 I222 M223 L226	P167-L173 WeakPolarHBondContact O-CG 3.41Å; H169-L173 PolarHBondContact O-N 3.43Å; P170-L173 PolarHBondContact O-N 3.16Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.26Å; L173-A176 PolarHBondContact O-N 2.96Å; L173-L177 PolarHBondContact O-N 3.15Å; L173-A204 HydrophobicContact CD1-CB 4.48Å; L173-A204 HydrophobicContact CD2-CB 3.74Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.45Å; L173-I222 HydrophobicContact CB-CG2 3.61Å; L173-M223 HydrophobicContact CD1-CG 3.96Å; L173-M223 HydrophobicContact CD1-SD 4.37Å; L173-M223 HydrophobicContact CD2-CG 4.09Å; L173-L226 HydrophobicContact CD2-CD1 3.98Å
174	G	98.4	Very high	97.8	Very high	9 Å²	9	24.5 Å²	24.5	9%	0.093	12%	0.119	C	C	.	.	H	α-helix	trans	-63.9	-33.3	178	0	0	0	0	0	112.4	K125 P170 I171 N178	K125-G174 WeakPolarHBondContact CE-O 3.25Å; P170-G174 PolarHBondContact O-N 3.01Å; I171-G174 PolarHBondContact O-N 3.36Å; G174-N178 PolarHBondContact O-N 2.69Å; G174-N178 VanDerWaalsContact O-N 3.11Å
175	L	98.8	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-50.3	171.4	169.7	63	0	0	0	111	V121 K125 Y154 A157 F158 I171 R172 L173 L177 N178 F179	V121-L175 HydrophobicContact CG1-CD2 4.04Å; K125-L175 HydrophobicContact CB-CD1 4.04Å; K125-L175 HydrophobicContact CD-CB 4.13Å; K125-L175 HydrophobicContact CG-CB 4.31Å; K125-L175 HydrophobicContact CG-CD1 4.01Å; Y154-L175 HydrophobicContact CD1-CD1 3.64Å; Y154-L175 HydrophobicContact CE1-CD1 4.33Å; A157-L175 VanDerWaalsContact C-CD2 3.49Å; A157-L175 HydrophobicContact CB-CD1 3.8Å; A157-L175 HydrophobicContact CB-CD2 3.63Å; A157-L175 HydrophobicContact CB-CG 4.39Å; F158-L175 HydrophobicContact CB-CD2 4.17Å; F158-L175 HydrophobicContact CD2-CD2 4.14Å; F158-L175 HydrophobicContact CD2-CG 4.46Å; I171-L175 WeakPolarHBondContact O-CB 3.13Å; I171-L175 PolarHBondContact O-N 3.3Å; R172-L175 WeakPolarHBondContact O-CB 3.41Å; R172-L175 PolarHBondContact O-N 3.08Å; L173-L175 VanDerWaalsContact C-N 3.27Å; L173-L175 PolarHBondContact O-N 3.26Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 2.75Å; L175-N178 PolarHBondContact O-N 2.76Å; L175-F179 VanDerWaalsContact O-CB 3.24Å; L175-F179 WeakPolarHBondContact O-CB 3.03Å; L175-F179 PolarHBondContact O-N 3.22Å
176	A	98.8	Very high	97.9	Very high	2 Å²	2	26 Å²	26	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-40.9	178.2	0	0	0	0	0	112.2	R172 L173 S180 A200	R172-A176 PolarHBondContact O-N 3.35Å; L173-A176 PolarHBondContact O-N 2.96Å; A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 2.92Å; A176-S180 PolarHBondContact O-OG 2.89Å; A176-S180 VanDerWaalsContact O-OG 3.09Å; A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å
177	L	98.7	Very high	97.9	Very high	19 Å²	19	23.7 Å²	23.7	10%	0.099	12%	0.116	C	C	.	.	H	α-helix	trans	-59.1	-49.4	175.1	176.6	65.1	0	0	0	112	L173 L175 S180 V181 I222 L225 L226 N229	L173-L177 PolarHBondContact O-N 3.15Å; L175-L177 VanDerWaalsContact C-N 3.31Å; L175-L177 PolarHBondContact O-N 2.75Å; L177-S180 PolarHBondContact O-OG 3Å; L177-V181 VanDerWaalsContact O-CG2 3.26Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 2.88Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.15Å; L177-L225 HydrophobicContact CD1-CB 4.09Å; L177-L225 HydrophobicContact CD2-CB 3.9Å; L177-L225 HydrophobicContact CD2-CD1 3.9Å; L177-L226 HydrophobicContact CB-CD2 3.93Å; L177-L226 HydrophobicContact CB-CG 4.22Å; L177-L226 HydrophobicContact CD1-CD2 3.97Å; L177-L226 HydrophobicContact CD1-CG 4.17Å; L177-N229 VanDerWaalsContact CD1-ND2 3.32Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.38Å
178	N	98.6	Very high	97.8	Very high	30 Å²	30	29.7 Å²	29.7	16%	0.16	15%	0.147	C	C	.	.	H	α-helix	trans	-75	-32.3	-176.3	-75.2	14.3	0	0	0	112.4	K125 D129 Y154 G174 L175 V181 F182	K125-N178 PolarHBondContact NZ-ND2 2.93Å; D129-N178 WeakPolarHBondContact OD1-CB 3.29Å; D129-N178 PolarHBondContact OD1-ND2 2.94Å; D129-N178 PolarHBondContact OD2-ND2 2.86Å; Y154-N178 HydrophobicContact CE1-CB 4.2Å; G174-N178 PolarHBondContact O-N 2.69Å; G174-N178 VanDerWaalsContact O-N 3.11Å; L175-N178 PolarHBondContact O-N 2.76Å; N178-V181 PolarHBondContact O-N 3.49Å; N178-F182 PolarHBondContact O-N 2.82Å
179	F	98.8	Very high	97.9	Very high	4 Å²	4	30.4 Å²	30.4	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-74.3	-33.6	177.8	-168.9	-163.5	0	0	0	112	E151 Y154 K155 L175 F182 Y183 L196	E151-F179 HydrophobicContact CG-CE2 4.46Å; Y154-F179 VanDerWaalsContact CB-CE2 3.46Å; Y154-F179 HydrophobicContact CD1-CB 3.93Å; Y154-F179 HydrophobicContact CD1-CD2 4.3Å; Y154-F179 HydrophobicContact CD1-CG 4.18Å; Y154-F179 AromaticContact CD2-CD2 3.56Å; Y154-F179 HydrophobicContact CD2-CD2 3.56Å; Y154-F179 AromaticContact CD2-CE2 3.99Å; Y154-F179 HydrophobicContact CD2-CE2 3.99Å; Y154-F179 HydrophobicContact CD2-CG 4.26Å; Y154-F179 HydrophobicContact CE1-CB 4.38Å; Y154-F179 HydrophobicContact CE2-CD2 4.39Å; Y154-F179 HydrophobicContact CG-CB 4.02Å; Y154-F179 HydrophobicContact CG-CD1 4.47Å; Y154-F179 AromaticContact CG-CD2 3.51Å; Y154-F179 HydrophobicContact CG-CD2 3.51Å; Y154-F179 HydrophobicContact CG-CE2 4.01Å; Y154-F179 AromaticContact CG-CG 3.78Å; Y154-F179 HydrophobicContact CG-CG 3.78Å; K155-F179 HydrophobicContact CG-CE1 4.33Å; K155-F179 HydrophobicContact CG-CZ 3.89Å; L175-F179 VanDerWaalsContact O-CB 3.24Å; L175-F179 WeakPolarHBondContact O-CB 3.03Å; L175-F179 PolarHBondContact O-N 3.22Å; F179-F182 HydrophobicContact CD2-CB 4.22Å; F179-F182 AromaticContact CD2-CD1 3.77Å; F179-F182 HydrophobicContact CD2-CD1 3.77Å; F179-F182 HydrophobicContact CD2-CG 4.35Å; F179-F182 AromaticContact CE2-CD1 3.69Å; F179-F182 HydrophobicContact CE2-CD1 3.69Å; F179-F182 HydrophobicContact CE2-CE1 4.13Å; F179-F182 WeakPolarHBondContact O-CB 3.4Å; F179-F182 PolarHBondContact O-N 3.4Å; F179-Y183 HydrophobicContact CD1-CE2 4.16Å; F179-Y183 HydrophobicContact CD2-CD2 4.01Å; F179-Y183 AromaticContact CD2-CE2 3.69Å; F179-Y183 HydrophobicContact CD2-CE2 3.69Å; F179-Y183 AromaticContact CE1-CE2 3.84Å; F179-Y183 HydrophobicContact CE1-CE2 3.84Å; F179-Y183 HydrophobicContact CE2-CD2 4.02Å; F179-Y183 HydrophobicContact CE2-CE1 4.3Å; F179-Y183 AromaticContact CE2-CE2 3.33Å; F179-Y183 HydrophobicContact CE2-CE2 3.33Å; F179-Y183 AromaticContact CE2-CZ 3.49Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.49Å; F179-Y183 HydrophobicContact CG-CD2 4.44Å; F179-Y183 HydrophobicContact CG-CE2 4.1Å; F179-Y183 HydrophobicContact CZ-CD2 4.48Å; F179-Y183 AromaticContact CZ-CE2 3.42Å; F179-Y183 HydrophobicContact CZ-CE2 3.42Å; F179-Y183 VanDerWaalsContact CZ-CE2 3.42Å; F179-Y183 AromaticContact CZ-CZ 3.48Å; F179-Y183 VanDerWaalsContact CZ-CZ 3.48Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.32Å; F179-Y183 VanDerWaalsContact O-CD2 3.31Å; F179-Y183 WeakPolarHBondContact O-CD2 3.48Å; F179-Y183 PolarHBondContact O-N 2.84Å; F179-L196 HydrophobicContact CB-CD2 3.8Å; F179-L196 HydrophobicContact CD1-CD2 3.62Å; F179-L196 HydrophobicContact CE1-CD2 4.42Å; F179-L196 HydrophobicContact CG-CD2 3.75Å
180	S	98.6	Very high	97.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.4	-40.2	171.6	63.6	0	0	0	0	111.5	A176 L177 F182 Y183 Y184 A193	A176-S180 WeakPolarHBondContact O-CB 3.49Å; A176-S180 PolarHBondContact O-N 2.92Å; A176-S180 PolarHBondContact O-OG 2.89Å; A176-S180 VanDerWaalsContact O-OG 3.09Å; L177-S180 PolarHBondContact O-OG 3Å; S180-F182 VanDerWaalsContact C-N 3.29Å; S180-F182 PolarHBondContact O-N 3.41Å; S180-Y183 PolarHBondContact O-N 2.88Å; S180-Y183 VanDerWaalsContact O-N 3.15Å; S180-Y184 PolarHBondContact O-N 2.9Å; S180-A193 WeakPolarHBondContact CB-O 3.32Å; S180-A193 VanDerWaalsContact O-CB 3.25Å; S180-A193 WeakPolarHBondContact O-CB 3.41Å
181	V	98.4	Very high	97.8	Very high	18 Å²	18	36.5 Å²	36.5	11%	0.109	18%	0.183	C	C	.	.	H	α-helix	trans	-60.9	-37.7	172.2	174.1	0	0	0	0	111.6	L177 N178 Y184 E185 W233	L177-V181 VanDerWaalsContact O-CG2 3.26Å; L177-V181 WeakPolarHBondContact O-CG2 3.46Å; L177-V181 PolarHBondContact O-N 2.88Å; N178-V181 PolarHBondContact O-N 3.49Å; V181-Y184 PolarHBondContact O-N 3.2Å; V181-E185 VanDerWaalsContact CG1-CD 3.45Å; V181-E185 HydrophobicContact CG1-CG 3.92Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.36Å; V181-E185 WeakPolarHBondContact O-CB 3.34Å; V181-E185 PolarHBondContact O-N 3Å; V181-W233 HydrophobicContact CG2-CH2 4.01Å; V181-W233 HydrophobicContact CG2-CZ2 3.98Å
182	F	98.7	Very high	97.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-49.2	171.9	168.6	-100.2	0	0	0	111.9	R132 V147 S150 E151 Y154 N178 F179 S180 Y184 I186 Q187	R132-F182 HydrophobicContact CB-CD2 4.36Å; R132-F182 HydrophobicContact CG-CD2 4.41Å; V147-F182 HydrophobicContact CG1-CE2 4.31Å; V147-F182 HydrophobicContact CG1-CZ 4.02Å; S150-F182 WeakPolarHBondContact OG-CD2 3.46Å; S150-F182 VanDerWaalsContact OG-CE2 3.24Å; S150-F182 WeakPolarHBondContact OG-CE2 3.44Å; E151-F182 HydrophobicContact CB-CE1 3.78Å; E151-F182 HydrophobicContact CB-CZ 3.74Å; E151-F182 HydrophobicContact CG-CE1 3.99Å; E151-F182 HydrophobicContact CG-CZ 4.42Å; Y154-F182 HydrophobicContact CD2-CB 4.21Å; Y154-F182 HydrophobicContact CD2-CD1 4.35Å; Y154-F182 HydrophobicContact CD2-CG 4.11Å; Y154-F182 HydrophobicContact CE2-CB 3.75Å; Y154-F182 HydrophobicContact CE2-CD2 4.2Å; Y154-F182 AromaticContact CE2-CG 3.94Å; Y154-F182 HydrophobicContact CE2-CG 3.94Å; N178-F182 PolarHBondContact O-N 2.82Å; F179-F182 HydrophobicContact CD2-CB 4.22Å; F179-F182 AromaticContact CD2-CD1 3.77Å; F179-F182 HydrophobicContact CD2-CD1 3.77Å; F179-F182 HydrophobicContact CD2-CG 4.35Å; F179-F182 AromaticContact CE2-CD1 3.69Å; F179-F182 HydrophobicContact CE2-CD1 3.69Å; F179-F182 HydrophobicContact CE2-CE1 4.13Å; F179-F182 WeakPolarHBondContact O-CB 3.4Å; F179-F182 PolarHBondContact O-N 3.4Å; S180-F182 VanDerWaalsContact C-N 3.29Å; S180-F182 PolarHBondContact O-N 3.41Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.49Å; F182-I186 HydrophobicContact CD2-CB 3.81Å; F182-I186 HydrophobicContact CD2-CG1 3.99Å; F182-I186 HydrophobicContact CD2-CG2 4.11Å; F182-I186 HydrophobicContact CE2-CB 3.93Å; F182-I186 HydrophobicContact CE2-CG1 4.46Å; F182-I186 HydrophobicContact CE2-CG2 3.73Å; F182-I186 WeakPolarHBondContact O-CA 3.29Å; F182-I186 WeakPolarHBondContact O-CB 3.36Å; F182-I186 PolarHBondContact O-N 2.63Å; F182-Q187 HydrophobicContact CD1-CG 4.18Å; F182-Q187 HydrophobicContact CE1-CG 3.43Å; F182-Q187 VanDerWaalsContact CE1-CG 3.43Å; F182-Q187 HydrophobicContact CE2-CG 4.36Å; F182-Q187 HydrophobicContact CZ-CG 3.53Å; F182-Q187 PolarHBondContact O-N 3.05Å; F182-Q187 VanDerWaalsContact O-N 3.16Å
183	Y	98.5	Very high	97.8	Very high	26 Å²	26	38.9 Å²	38.9	10%	0.102	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-43.2	178.9	-80.1	-58.3	0	0	0	111.7	F179 S180 Q187 N188 A189 Q192 L196	F179-Y183 HydrophobicContact CD1-CE2 4.16Å; F179-Y183 HydrophobicContact CD2-CD2 4.01Å; F179-Y183 AromaticContact CD2-CE2 3.69Å; F179-Y183 HydrophobicContact CD2-CE2 3.69Å; F179-Y183 AromaticContact CE1-CE2 3.84Å; F179-Y183 HydrophobicContact CE1-CE2 3.84Å; F179-Y183 HydrophobicContact CE2-CD2 4.02Å; F179-Y183 HydrophobicContact CE2-CE1 4.3Å; F179-Y183 AromaticContact CE2-CE2 3.33Å; F179-Y183 HydrophobicContact CE2-CE2 3.33Å; F179-Y183 AromaticContact CE2-CZ 3.49Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.49Å; F179-Y183 HydrophobicContact CG-CD2 4.44Å; F179-Y183 HydrophobicContact CG-CE2 4.1Å; F179-Y183 HydrophobicContact CZ-CD2 4.48Å; F179-Y183 AromaticContact CZ-CE2 3.42Å; F179-Y183 HydrophobicContact CZ-CE2 3.42Å; F179-Y183 VanDerWaalsContact CZ-CE2 3.42Å; F179-Y183 AromaticContact CZ-CZ 3.48Å; F179-Y183 VanDerWaalsContact CZ-CZ 3.48Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.32Å; F179-Y183 VanDerWaalsContact O-CD2 3.31Å; F179-Y183 WeakPolarHBondContact O-CD2 3.48Å; F179-Y183 PolarHBondContact O-N 2.84Å; S180-Y183 PolarHBondContact O-N 2.88Å; S180-Y183 VanDerWaalsContact O-N 3.15Å; Y183-Q187 HydrophobicContact CD1-CB 4.3Å; Y183-Q187 HydrophobicContact CD1-CG 4.3Å; Y183-Q187 CarbonylContact O-C 3.55Å; Y183-N188 PolarHBondContact O-N 3.39Å; Y183-N188 VanDerWaalsContact O-N 3.17Å; Y183-A189 HydrophobicContact CD1-CB 4.41Å; Y183-A189 PolarHBondContact O-N 2.97Å; Y183-Q192 HydrophobicContact CD1-CB 4.14Å; Y183-Q192 HydrophobicContact CG-CB 4.14Å; Y183-L196 HydrophobicContact CD2-CD2 3.99Å; Y183-L196 HydrophobicContact CE2-CD2 4.01Å
184	Y	98.1	Very high	97.8	Very high	60 Å²	60	39.5 Å²	39.5	24%	0.235	20%	0.2	C	C	.	.	H	α-helix	trans	-70.1	-59.9	-179.8	-172.8	-87.4	0	0	0	112.1	S180 V181 F182 N188 P190 W233 D236	S180-Y184 PolarHBondContact O-N 2.9Å; V181-Y184 PolarHBondContact O-N 3.2Å; F182-Y184 VanDerWaalsContact C-N 3.29Å; F182-Y184 PolarHBondContact O-N 3.49Å; Y184-N188 WeakPolarHBondContact O-CA 3.19Å; Y184-N188 PolarHBondContact O-N 3.38Å; Y184-P190 HydrophobicContact CD2-CB 3.91Å; Y184-P190 HydrophobicContact CE2-CB 4.06Å; Y184-W233 AromaticContact CD1-CD1 3.97Å; Y184-W233 AromaticContact CD1-CE2 4Å; Y184-W233 HydrophobicContact CD1-CZ2 4.46Å; Y184-W233 AromaticContact CD1-NE1 3.5Å; Y184-W233 HydrophobicContact CD2-CB 3.99Å; Y184-W233 AromaticContact CD2-CD1 3.45Å; Y184-W233 VanDerWaalsContact CD2-CD1 3.45Å; Y184-W233 AromaticContact CD2-CD2 3.67Å; Y184-W233 HydrophobicContact CD2-CD2 3.67Å; Y184-W233 AromaticContact CD2-CE2 3.79Å; Y184-W233 HydrophobicContact CD2-CE3 4.42Å; Y184-W233 AromaticContact CD2-CG 3.44Å; Y184-W233 HydrophobicContact CD2-CG 3.44Å; Y184-W233 VanDerWaalsContact CD2-CG 3.44Å; Y184-W233 AromaticContact CD2-NE1 3.64Å; Y184-W233 AromaticContact CE1-CD1 3.69Å; Y184-W233 AromaticContact CE1-NE1 3.58Å; Y184-W233 HydrophobicContact CE2-CB 3.67Å; Y184-W233 AromaticContact CE2-CD1 3.12Å; Y184-W233 HydrophobicContact CE2-CD2 4.1Å; Y184-W233 AromaticContact CE2-CG 3.36Å; Y184-W233 HydrophobicContact CE2-CG 3.36Å; Y184-W233 AromaticContact CE2-NE1 3.71Å; Y184-W233 AromaticContact CG-CD1 3.86Å; Y184-W233 HydrophobicContact CG-CD2 4Å; Y184-W233 AromaticContact CG-CE2 3.64Å; Y184-W233 HydrophobicContact CG-CG 4.12Å; Y184-W233 HydrophobicContact CG-CZ2 4.1Å; Y184-W233 AromaticContact CG-NE1 3.54Å; Y184-W233 AromaticContact CZ-CD1 3.26Å; Y184-W233 AromaticContact CZ-CG 3.99Å; Y184-W233 AromaticContact CZ-NE1 3.68Å; Y184-D236 PolarHBondContact OH-OD2 3.01Å
185	E	96.3	Very high	97.8	Very high	99 Å²	99	44.9 Å²	44.9	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-78.9	-29.6	-169.4	-63.8	-176	162.7	0	0	113.9	R132 V181	R132-E185 IonicContact NH1-OE2 3.21Å; V181-E185 VanDerWaalsContact CG1-CD 3.45Å; V181-E185 HydrophobicContact CG1-CG 3.92Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.36Å; V181-E185 WeakPolarHBondContact O-CB 3.34Å; V181-E185 PolarHBondContact O-N 3Å
186	I	97.4	Very high	97.7	Very high	24 Å²	24	45.6 Å²	45.6	12%	0.123	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-47.5	-171.7	-56	-54.3	0	0	0	112.4	R132 A135 E136 V147 F182 N188	R132-I186 HydrophobicContact CG-CD1 4.31Å; R132-I186 HydrophobicContact CG-CG1 3.79Å; A135-I186 HydrophobicContact CB-CD1 4.33Å; A135-I186 HydrophobicContact CB-CG2 3.82Å; E136-I186 HydrophobicContact CB-CD1 4.38Å; V147-I186 HydrophobicContact CG1-CG2 4.35Å; V147-I186 HydrophobicContact CG2-CG2 3.63Å; F182-I186 HydrophobicContact CD2-CB 3.81Å; F182-I186 HydrophobicContact CD2-CG1 3.99Å; F182-I186 HydrophobicContact CD2-CG2 4.11Å; F182-I186 HydrophobicContact CE2-CB 3.93Å; F182-I186 HydrophobicContact CE2-CG1 4.46Å; F182-I186 HydrophobicContact CE2-CG2 3.73Å; F182-I186 WeakPolarHBondContact O-CA 3.29Å; F182-I186 WeakPolarHBondContact O-CB 3.36Å; F182-I186 PolarHBondContact O-N 2.63Å; I186-N188 VanDerWaalsContact C-N 3.33Å
187	Q	96.8	Very high	97.7	Very high	69 Å²	69	45.5 Å²	45.5	32%	0.322	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.4	179.5	-70.8	-73.5	16.8	0	0	112.9	E151 F182 Y183 A189	E151-Q187 PolarHBondContact OE2-NE2 3.42Å; F182-Q187 HydrophobicContact CD1-CG 4.18Å; F182-Q187 HydrophobicContact CE1-CG 3.43Å; F182-Q187 VanDerWaalsContact CE1-CG 3.43Å; F182-Q187 HydrophobicContact CE2-CG 4.36Å; F182-Q187 HydrophobicContact CZ-CG 3.53Å; F182-Q187 PolarHBondContact O-N 3.05Å; F182-Q187 VanDerWaalsContact O-N 3.16Å; Y183-Q187 HydrophobicContact CD1-CB 4.3Å; Y183-Q187 HydrophobicContact CD1-CG 4.3Å; Y183-Q187 CarbonylContact O-C 3.55Å; Q187-A189 HydrophobicContact CB-CB 4.12Å; Q187-A189 PolarHBondContact O-N 2.67Å
188	N	95.8	Very high	97.7	Very high	141 Å²	141	50.3 Å²	50.3	75%	0.754	25%	0.249	S	C	*	.			trans	51	42.7	-174.4	-163.9	57.7	0	0	0	111.9	Y183 Y184 I186 P190	Y183-N188 PolarHBondContact O-N 3.39Å; Y183-N188 VanDerWaalsContact O-N 3.17Å; Y184-N188 WeakPolarHBondContact O-CA 3.19Å; Y184-N188 PolarHBondContact O-N 3.38Å; I186-N188 VanDerWaalsContact C-N 3.33Å; N188-P190 VanDerWaalsContact O-CD 3.26Å; N188-P190 WeakPolarHBondContact O-CD 3.4Å
189	A	97.1	Very high	97.7	Very high	19 Å²	19	53.1 Å²	53.1	16%	0.157	26%	0.261	C	S	.	.			trans	-118.6	69.4	-175.5	0	0	0	0	0	110	Y183 Q187 E191 Q192 A193	Y183-A189 HydrophobicContact CD1-CB 4.41Å; Y183-A189 PolarHBondContact O-N 2.97Å; Q187-A189 HydrophobicContact CB-CB 4.12Å; Q187-A189 PolarHBondContact O-N 2.67Å; A189-E191 VanDerWaalsContact C-N 3.33Å; A189-E191 PolarHBondContact O-N 3.16Å; A189-Q192 HydrophobicContact CB-CB 4.12Å; A189-Q192 HydrophobicContact CB-CG 4.3Å; A189-Q192 PolarHBondContact O-N 3.41Å; A189-A193 PolarHBondContact O-N 3.15Å
190	P	96.5	Very high	97.6	Very high	32 Å²	32	53.6 Å²	53.6	21%	0.208	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-34.6	-171.9	27.7	-36.7	0	0	0	112.7	Y184 N188 Q192 A193 C194	Y184-P190 HydrophobicContact CD2-CB 3.91Å; Y184-P190 HydrophobicContact CE2-CB 4.06Å; N188-P190 VanDerWaalsContact O-CD 3.26Å; N188-P190 WeakPolarHBondContact O-CD 3.4Å; P190-Q192 PolarHBondContact O-N 2.83Å; P190-A193 WeakPolarHBondContact O-CB 3.41Å; P190-A193 PolarHBondContact O-N 3.05Å; P190-C194 WeakPolarHBondContact O-CB 3.34Å; P190-C194 PolarHBondContact O-N 3.25Å; P190-C194 PolarHBondContact O-SG 3.47Å; P190-C194 VanDerWaalsContact O-SG 3.37Å
191	E	95.9	Very high	97.6	Very high	156 Å²	156	55.6 Å²	55.6	73%	0.729	27%	0.274	S	S	*	.	H	α-helix	trans	-59.7	-45	173.9	-65.7	-176.3	174	0	0	112.2	A189 C194 L195	A189-E191 VanDerWaalsContact C-N 3.33Å; A189-E191 PolarHBondContact O-N 3.16Å; E191-C194 PolarHBondContact O-N 2.96Å; E191-L195 VanDerWaalsContact O-CB 3.27Å; E191-L195 WeakPolarHBondContact O-CB 3.41Å; E191-L195 PolarHBondContact O-N 3.44Å
192	Q	97.3	Very high	97.6	Very high	106 Å²	106	58.4 Å²	58.4	50%	0.495	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-39.2	178.1	-67.4	-176	-32.5	0	0	111.4	Y183 A189 P190 L195 L196	Y183-Q192 HydrophobicContact CD1-CB 4.14Å; Y183-Q192 HydrophobicContact CG-CB 4.14Å; A189-Q192 HydrophobicContact CB-CB 4.12Å; A189-Q192 HydrophobicContact CB-CG 4.3Å; A189-Q192 PolarHBondContact O-N 3.41Å; P190-Q192 PolarHBondContact O-N 2.83Å; Q192-L195 PolarHBondContact O-N 3.45Å; Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 PolarHBondContact O-N 2.96Å
193	A	98.1	Very high	97.5	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-49.9	175.4	0	0	0	0	0	111.7	S180 A189 P190 L196 A197 W233	S180-A193 WeakPolarHBondContact CB-O 3.32Å; S180-A193 VanDerWaalsContact O-CB 3.25Å; S180-A193 WeakPolarHBondContact O-CB 3.41Å; A189-A193 PolarHBondContact O-N 3.15Å; P190-A193 WeakPolarHBondContact O-CB 3.41Å; P190-A193 PolarHBondContact O-N 3.05Å; A193-L196 PolarHBondContact O-N 3.39Å; A193-A197 WeakPolarHBondContact O-CB 3.37Å; A193-A197 PolarHBondContact O-N 3.01Å; A193-W233 HydrophobicContact CB-CE3 4.18Å; A193-W233 HydrophobicContact CB-CZ3 4Å
194	C	98	Very high	97.5	Very high	16 Å²	16	59.8 Å²	59.8	11%	0.108	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-43.2	178.3	-72.4	0	0	0	0	111.8	P190 E191 L196 A197 K198 L230	P190-C194 WeakPolarHBondContact O-CB 3.34Å; P190-C194 PolarHBondContact O-N 3.25Å; P190-C194 PolarHBondContact O-SG 3.47Å; P190-C194 VanDerWaalsContact O-SG 3.37Å; E191-C194 PolarHBondContact O-N 2.96Å; C194-L196 PolarHBondContact O-N 3.5Å; C194-A197 PolarHBondContact O-N 2.96Å; C194-K198 WeakPolarHBondContact O-CB 3.48Å; C194-K198 PolarHBondContact O-N 3.47Å; C194-L230 HydrophobicContact CB-CD2 4.17Å; C194-L230 WeakPolarHBondContact O-CD2 3.45Å
195	L	97.8	Very high	97.4	Very high	121 Å²	121	60.9 Å²	60.9	63%	0.634	31%	0.307	S	S	*	.	H	α-helix	trans	-58.7	-48.8	177.2	-177.6	67.2	0	0	0	111.3	E191 Q192 Q199	E191-L195 VanDerWaalsContact O-CB 3.27Å; E191-L195 WeakPolarHBondContact O-CB 3.41Å; E191-L195 PolarHBondContact O-N 3.44Å; Q192-L195 PolarHBondContact O-N 3.45Å; L195-Q199 VanDerWaalsContact O-CB 3.3Å; L195-Q199 WeakPolarHBondContact O-CB 3.37Å; L195-Q199 PolarHBondContact O-N 2.67Å
196	L	98.3	Very high	97.4	Very high	15 Å²	15	60.1 Å²	60.1	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-64.4	-47.7	-179.8	-179.4	66.9	0	0	0	112.1	F158 F179 Y183 Q192 A193 C194 A200	F158-L196 HydrophobicContact CE1-CD1 3.89Å; F158-L196 HydrophobicContact CE2-CD1 3.73Å; F158-L196 HydrophobicContact CZ-CD1 3.31Å; F179-L196 HydrophobicContact CB-CD2 3.8Å; F179-L196 HydrophobicContact CD1-CD2 3.62Å; F179-L196 HydrophobicContact CE1-CD2 4.42Å; F179-L196 HydrophobicContact CG-CD2 3.75Å; Y183-L196 HydrophobicContact CD2-CD2 3.99Å; Y183-L196 HydrophobicContact CE2-CD2 4.01Å; Q192-L196 WeakPolarHBondContact O-CB 3.33Å; Q192-L196 PolarHBondContact O-N 2.96Å; A193-L196 PolarHBondContact O-N 3.39Å; C194-L196 PolarHBondContact O-N 3.5Å; L196-A200 WeakPolarHBondContact O-CB 3.42Å; L196-A200 PolarHBondContact O-N 3.31Å
197	A	98.3	Very high	97.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-41.7	-179	0	0	0	0	0	111.8	A193 C194 A200 F201 L226 L230 W233	A193-A197 WeakPolarHBondContact O-CB 3.37Å; A193-A197 PolarHBondContact O-N 3.01Å; C194-A197 PolarHBondContact O-N 2.96Å; A197-A200 PolarHBondContact O-N 3Å; A197-F201 WeakPolarHBondContact O-CB 3.3Å; A197-F201 PolarHBondContact O-N 3.39Å; A197-L226 HydrophobicContact CB-CD2 3.87Å; A197-L230 HydrophobicContact CB-CD1 4.36Å; A197-L230 HydrophobicContact CB-CD2 3.83Å; A197-L230 HydrophobicContact CB-CG 3.94Å; A197-W233 HydrophobicContact CB-CZ3 4.27Å
198	K	98	Very high	97.1	Very high	121 Å²	121	60.4 Å²	60.4	53%	0.526	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-47.4	177.9	-176.6	175.6	180	-179.2	0	111.4	C194 A200 F201 D202 L230	C194-K198 WeakPolarHBondContact O-CB 3.48Å; C194-K198 PolarHBondContact O-N 3.47Å; K198-A200 VanDerWaalsContact C-N 3.33Å; K198-A200 PolarHBondContact O-N 3.26Å; K198-F201 PolarHBondContact O-N 3.02Å; K198-D202 WeakPolarHBondContact CG-OD2 3.31Å; K198-D202 WeakPolarHBondContact O-CB 3.25Å; K198-D202 VanDerWaalsContact O-CG 3.31Å; K198-D202 PolarHBondContact O-N 2.9Å; K198-L230 HydrophobicContact CB-CD1 4.16Å; K198-L230 HydrophobicContact CB-CD2 4.04Å
199	Q	98.3	Very high	96.8	Very high	88 Å²	88	61.7 Å²	61.7	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-47	177.1	-178.2	175.2	7.9	0	0	111.4	L195 F201 D202 D203	L195-Q199 VanDerWaalsContact O-CB 3.3Å; L195-Q199 WeakPolarHBondContact O-CB 3.37Å; L195-Q199 PolarHBondContact O-N 2.67Å; Q199-F201 VanDerWaalsContact C-N 3.31Å; Q199-F201 PolarHBondContact O-N 3.43Å; Q199-D202 PolarHBondContact O-N 3.32Å; Q199-D203 VanDerWaalsContact O-CB 3.31Å; Q199-D203 WeakPolarHBondContact O-CB 3.35Å; Q199-D203 PolarHBondContact O-N 3.49Å
200	A	98.3	Very high	96.4	Very high	15 Å²	15	65.6 Å²	65.6	12%	0.124	35%	0.348	C	S	.	.	H	α-helix	trans	-63.1	-37.5	178.6	0	0	0	0	0	112.9	A176 L196 A197 K198 A204 L226	A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å; L196-A200 WeakPolarHBondContact O-CB 3.42Å; L196-A200 PolarHBondContact O-N 3.31Å; A197-A200 PolarHBondContact O-N 3Å; K198-A200 VanDerWaalsContact C-N 3.33Å; K198-A200 PolarHBondContact O-N 3.26Å; A200-A204 VanDerWaalsContact O-CB 3.28Å; A200-A204 WeakPolarHBondContact O-CB 3.39Å; A200-A204 PolarHBondContact O-N 3.49Å; A200-L226 HydrophobicContact CB-CD1 4.3Å
201	F	98	Very high	95.9	Very high	41 Å²	41	65.4 Å²	65.4	18%	0.18	35%	0.346	C	S	.	.	H	α-helix	trans	-67.1	-49.2	175.6	-176.2	-91.1	0	0	0	111.5	A197 K198 Q199 A204 I205 M223 L226 R227	A197-F201 WeakPolarHBondContact O-CB 3.3Å; A197-F201 PolarHBondContact O-N 3.39Å; K198-F201 PolarHBondContact O-N 3.02Å; Q199-F201 VanDerWaalsContact C-N 3.31Å; Q199-F201 PolarHBondContact O-N 3.43Å; F201-A204 PolarHBondContact O-N 3.06Å; F201-I205 HydrophobicContact CD1-CG1 3.89Å; F201-I205 HydrophobicContact CE1-CD1 4.1Å; F201-I205 HydrophobicContact CE1-CG1 3.52Å; F201-I205 HydrophobicContact CE2-CD1 4.49Å; F201-I205 HydrophobicContact CE2-CG1 4.39Å; F201-I205 HydrophobicContact CG-CG1 4.47Å; F201-I205 HydrophobicContact CZ-CD1 3.89Å; F201-I205 HydrophobicContact CZ-CG1 3.79Å; F201-I205 WeakPolarHBondContact O-CB 3.37Å; F201-I205 VanDerWaalsContact O-CG1 3.29Å; F201-I205 WeakPolarHBondContact O-CG1 3.35Å; F201-I205 PolarHBondContact O-N 2.98Å; F201-M223 HydrophobicContact CD2-CB 4.12Å; F201-M223 WeakPolarHBondContact CD2-O 3.47Å; F201-M223 HydrophobicContact CE2-CB 4.08Å; F201-M223 WeakPolarHBondContact CE2-O 3.27Å; F201-L226 HydrophobicContact CD2-CB 4.45Å; F201-R227 HydrophobicContact CD2-CB 4.33Å; F201-R227 HydrophobicContact CE2-CB 3.93Å; F201-R227 HydrophobicContact CZ-CB 4.45Å
202	D	98.1	Very high	95.5	Very high	77 Å²	77	62.2 Å²	62.2	41%	0.412	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-44.8	-178.3	-69.7	-15.9	0	0	0	111.3	K198 Q199 A204 I205 A206	K198-D202 WeakPolarHBondContact CG-OD2 3.31Å; K198-D202 WeakPolarHBondContact O-CB 3.25Å; K198-D202 VanDerWaalsContact O-CG 3.31Å; K198-D202 PolarHBondContact O-N 2.9Å; Q199-D202 PolarHBondContact O-N 3.32Å; D202-A204 VanDerWaalsContact C-N 3.31Å; D202-A204 PolarHBondContact O-N 2.87Å; D202-I205 PolarHBondContact O-N 3.48Å; D202-A206 PolarHBondContact O-N 3.44Å
203	D	97.6	Very high	94.9	Very high	56 Å²	56	65.9 Å²	65.9	30%	0.299	35%	0.351	S	S	.	.	H	α-helix	trans	-60	-41.5	176.2	-69.5	-11.8	0	0	0	111.1	P167 Q199	P167-D203 HydrophobicContact CB-CB 3.88Å; P167-D203 HydrophobicContact CG-CB 4.32Å; Q199-D203 VanDerWaalsContact O-CB 3.31Å; Q199-D203 WeakPolarHBondContact O-CB 3.35Å; Q199-D203 PolarHBondContact O-N 3.49Å
204	A	97.1	Very high	94.3	Very high	0 Å²	0	73 Å²	73	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-75	-34.5	179.6	0	0	0	0	0	113.3	T168 L173 A200 F201 D202 A206 E207 L208 M223	T168-A204 HydrophobicContact CG2-CB 4.37Å; T168-A204 WeakPolarHBondContact CG2-O 3.18Å; L173-A204 HydrophobicContact CD1-CB 4.48Å; L173-A204 HydrophobicContact CD2-CB 3.74Å; A200-A204 VanDerWaalsContact O-CB 3.28Å; A200-A204 WeakPolarHBondContact O-CB 3.39Å; A200-A204 PolarHBondContact O-N 3.49Å; F201-A204 PolarHBondContact O-N 3.06Å; D202-A204 VanDerWaalsContact C-N 3.31Å; D202-A204 PolarHBondContact O-N 2.87Å; A204-A206 VanDerWaalsContact C-N 3.32Å; A204-E207 PolarHBondContact O-N 2.99Å; A204-L208 WeakPolarHBondContact O-CA 3.45Å; A204-L208 WeakPolarHBondContact O-CB 3.31Å; A204-L208 PolarHBondContact O-N 3.36Å; A204-M223 HydrophobicContact CB-CE 3.82Å; A204-M223 HydrophobicContact CB-CG 4.32Å; A204-M223 HydrophobicContact CB-SD 3.95Å
205	I	96.4	Very high	93.9	Very high	82 Å²	82	73.7 Å²	73.7	42%	0.421	39%	0.393	S	S	.	.	H	α-helix	trans	-62.4	-42	172.6	-75.2	-69.8	0	0	0	110.6	F201 D202 E207 L208 M223	F201-I205 HydrophobicContact CD1-CG1 3.89Å; F201-I205 HydrophobicContact CE1-CD1 4.1Å; F201-I205 HydrophobicContact CE1-CG1 3.52Å; F201-I205 HydrophobicContact CE2-CD1 4.49Å; F201-I205 HydrophobicContact CE2-CG1 4.39Å; F201-I205 HydrophobicContact CG-CG1 4.47Å; F201-I205 HydrophobicContact CZ-CD1 3.89Å; F201-I205 HydrophobicContact CZ-CG1 3.79Å; F201-I205 WeakPolarHBondContact O-CB 3.37Å; F201-I205 VanDerWaalsContact O-CG1 3.29Å; F201-I205 WeakPolarHBondContact O-CG1 3.35Å; F201-I205 PolarHBondContact O-N 2.98Å; D202-I205 PolarHBondContact O-N 3.48Å; I205-E207 PolarHBondContact O-N 3.25Å; I205-L208 HydrophobicContact CD1-CD2 4.39Å; I205-L208 PolarHBondContact O-N 2.91Å; I205-M223 HydrophobicContact CB-CE 4.38Å; I205-M223 HydrophobicContact CD1-CE 3.39Å; I205-M223 HydrophobicContact CG1-CE 3.55Å
206	A	96.4	Very high	93.6	Very high	84 Å²	84	73.4 Å²	73.4	69%	0.694	39%	0.385	S	S	*	.	H	α-helix	trans	-61.6	-26.1	-179.7	0	0	0	0	0	113.5	D202 A204	D202-A206 PolarHBondContact O-N 3.44Å; A204-A206 VanDerWaalsContact C-N 3.32Å
207	E	95.3	Very high	93.4	Very high	67 Å²	67	80.3 Å²	80.3	31%	0.313	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	7.8	-177.8	-64.8	-172.1	-158.1	0	0	113.5	Q166 P167 T168 A204 I205 D209 T210	Q166-E207 PolarHBondContact OE1-OE2 3.4Å; P167-E207 VanDerWaalsContact CD-OE2 3.32Å; P167-E207 WeakPolarHBondContact CD-OE2 3.13Å; T168-E207 HydrophobicContact CG2-CB 3.97Å; A204-E207 PolarHBondContact O-N 2.99Å; I205-E207 PolarHBondContact O-N 3.25Å; E207-D209 PolarHBondContact O-N 3.41Å; E207-T210 WeakPolarHBondContact O-CB 3.42Å; E207-T210 PolarHBondContact O-N 3.27Å; E207-T210 PolarHBondContact O-OG1 3.48Å
208	L	92.2	Very high	93.3	Very high	31 Å²	31	84.6 Å²	84.6	16%	0.162	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-59.5	-34.5	-172.6	-172.2	62.1	0	0	0	112.9	A204 I205 T210 L211 Y216 T220 M223	A204-L208 WeakPolarHBondContact O-CA 3.45Å; A204-L208 WeakPolarHBondContact O-CB 3.31Å; A204-L208 PolarHBondContact O-N 3.36Å; I205-L208 HydrophobicContact CD1-CD2 4.39Å; I205-L208 PolarHBondContact O-N 2.91Å; L208-T210 PolarHBondContact O-N 2.99Å; L208-T210 VanDerWaalsContact O-N 3.17Å; L208-L211 HydrophobicContact CD1-CD2 4.03Å; L208-L211 VanDerWaalsContact O-CB 3.24Å; L208-L211 WeakPolarHBondContact O-CB 3.47Å; L208-L211 PolarHBondContact O-N 3.46Å; L208-L211 VanDerWaalsContact O-N 3.16Å; L208-Y216 HydrophobicContact CD1-CE2 4.47Å; L208-T220 HydrophobicContact CD1-CG2 4.17Å; L208-M223 HydrophobicContact CD1-CE 4.34Å; L208-M223 HydrophobicContact CD1-SD 3.95Å; L208-M223 HydrophobicContact CD2-CE 4.46Å
209	D	90.6	Very high	93.2	Very high	169 Å²	169	78.8 Å²	78.8	90%	0.904	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.1	178.9	-67.2	-24.7	0	0	0	113.4	E207	E207-D209 PolarHBondContact O-N 3.41Å
210	T	87.1	Confident	93.1	Very high	100 Å²	100	76.7 Å²	76.7	61%	0.613	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-89.3	-7.9	178	72.5	0	0	0	0	113.4	E207 L208	E207-T210 WeakPolarHBondContact O-CB 3.42Å; E207-T210 PolarHBondContact O-N 3.27Å; E207-T210 PolarHBondContact O-OG1 3.48Å; L208-T210 PolarHBondContact O-N 2.99Å; L208-T210 VanDerWaalsContact O-N 3.17Å
211	L	87.1	Confident	93.1	Very high	29 Å²	29	80.9 Å²	80.9	15%	0.152	43%	0.425	C	S	.	.			trans	-74.1	135.5	-171.4	-167.8	57.7	0	0	0	111.7	L208 Y216	L208-L211 HydrophobicContact CD1-CD2 4.03Å; L208-L211 VanDerWaalsContact O-CB 3.24Å; L208-L211 WeakPolarHBondContact O-CB 3.47Å; L208-L211 PolarHBondContact O-N 3.46Å; L208-L211 VanDerWaalsContact O-N 3.16Å; L211-Y216 HydrophobicContact CB-CD2 4.42Å; L211-Y216 HydrophobicContact CD2-CD2 4.1Å; L211-Y216 HydrophobicContact CG-CD2 4.45Å
212	N	86.4	Confident	93.1	Very high	89 Å²	89	80.2 Å²	80.2	48%	0.476	42%	0.423	S	S	.	.			trans	-73.8	158.6	174.9	64.4	33.2	0	0	0	112.2	D214 S215 Y216	N212-D214 PolarHBondContact O-N 2.92Å; N212-D214 PolarHBondContact OD1-N 2.91Å; N212-S215 PolarHBondContact O-N 2.81Å; N212-S215 VanDerWaalsContact OD1-CB 3.31Å; N212-S215 WeakPolarHBondContact OD1-CB 3.33Å; N212-S215 PolarHBondContact OD1-N 3.48Å; N212-S215 PolarHBondContact OD1-OG 3.37Å; N212-S215 VanDerWaalsContact OD1-OG 3.09Å; N212-Y216 WeakPolarHBondContact O-CB 3.41Å; N212-Y216 PolarHBondContact O-N 3.46Å; N212-Y216 VanDerWaalsContact O-N 3.1Å
213	E	85.8	Confident	93.1	Very high	183 Å²	183	76.9 Å²	76.9	86%	0.855	41%	0.405	S	S	*	.	H	α-helix	trans	-59.1	-35.7	-178.7	-68.3	-174.9	173.8	0	0	112.6	S215 Y216	E213-S215 PolarHBondContact O-N 3.08Å; E213-Y216 PolarHBondContact O-N 3.31Å
214	D	86.1	Confident	93.1	Very high	148 Å²	148	77.2 Å²	77.2	79%	0.791	41%	0.405	S	S	*	.	H	α-helix	trans	-64.5	-37.1	-176.7	-66.4	-29.3	0	0	0	113.1	N212	N212-D214 PolarHBondContact O-N 2.92Å; N212-D214 PolarHBondContact OD1-N 2.91Å
215	S	89.6	Confident	93.2	Very high	31 Å²	31	80.9 Å²	80.9	22%	0.217	42%	0.424	C	S	.	.	H	α-helix	trans	-95.7	-14.7	-179.1	-55.3	0	0	0	0	113.2	N212 E213 K217 D218 S219	N212-S215 PolarHBondContact O-N 2.81Å; N212-S215 VanDerWaalsContact OD1-CB 3.31Å; N212-S215 WeakPolarHBondContact OD1-CB 3.33Å; N212-S215 PolarHBondContact OD1-N 3.48Å; N212-S215 PolarHBondContact OD1-OG 3.37Å; N212-S215 VanDerWaalsContact OD1-OG 3.09Å; E213-S215 PolarHBondContact O-N 3.08Å; S215-K217 VanDerWaalsContact C-N 3.33Å; S215-K217 PolarHBondContact O-N 3.5Å; S215-D218 PolarHBondContact O-N 3Å; S215-S219 PolarHBondContact O-N 3.17Å; S215-S219 PolarHBondContact O-OG 3.36Å
216	Y	91.6	Very high	93.3	Very high	116 Å²	116	77 Å²	77	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-53.5	-47.9	-171.9	-170.1	-90.8	0	0	0	113.1	L208 L211 N212 E213 T220	L208-Y216 HydrophobicContact CD1-CE2 4.47Å; L211-Y216 HydrophobicContact CB-CD2 4.42Å; L211-Y216 HydrophobicContact CD2-CD2 4.1Å; L211-Y216 HydrophobicContact CG-CD2 4.45Å; N212-Y216 WeakPolarHBondContact O-CB 3.41Å; N212-Y216 PolarHBondContact O-N 3.46Å; N212-Y216 VanDerWaalsContact O-N 3.1Å; E213-Y216 PolarHBondContact O-N 3.31Å; Y216-T220 HydrophobicContact CD1-CG2 4.15Å; Y216-T220 HydrophobicContact CE1-CG2 3.83Å; Y216-T220 HydrophobicContact CE2-CG2 4.28Å; Y216-T220 WeakPolarHBondContact O-CB 3.43Å; Y216-T220 VanDerWaalsContact O-CG2 3.27Å; Y216-T220 WeakPolarHBondContact O-CG2 3.42Å; Y216-T220 PolarHBondContact O-N 2.88Å; Y216-T220 PolarHBondContact O-OG1 3.24Å
217	K	94	Very high	93.3	Very high	160 Å²	160	78.7 Å²	78.7	70%	0.696	39%	0.392	S	S	*	.	H	α-helix	trans	-64.3	-44.1	-178	-174.8	-176.4	175.6	-172.4	0	112.5	S215 T220 L221	S215-K217 VanDerWaalsContact C-N 3.33Å; S215-K217 PolarHBondContact O-N 3.5Å; K217-T220 PolarHBondContact O-OG1 3.19Å; K217-L221 WeakPolarHBondContact O-CB 3.49Å; K217-L221 PolarHBondContact O-N 3.29Å; K217-L221 VanDerWaalsContact O-N 3.15Å
218	D	94.7	Very high	93.4	Very high	89 Å²	89	78.8 Å²	78.8	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-71.9	-44.3	-176.5	-71.9	-14.8	0	0	0	111	P170 S215 L221 I222	P170-D218 HydrophobicContact CB-CB 4.15Å; P170-D218 HydrophobicContact CG-CB 4.09Å; S215-D218 PolarHBondContact O-N 3Å; D218-L221 PolarHBondContact O-N 3.45Å; D218-I222 WeakPolarHBondContact O-CD1 3.11Å; D218-I222 VanDerWaalsContact O-CG1 3.25Å; D218-I222 WeakPolarHBondContact O-CG1 3.44Å; D218-I222 PolarHBondContact O-N 2.9Å; D218-I222 VanDerWaalsContact O-N 3.08Å
219	S	96.4	Very high	93.7	Very high	0 Å²	0	79 Å²	79	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.5	-46.5	178.2	-59.6	0	0	0	0	112	T168 P170 S215 L221 I222 M223	T168-S219 WeakPolarHBondContact O-CB 3.04Å; T168-S219 PolarHBondContact O-OG 3.17Å; P170-S219 WeakPolarHBondContact CD-OG 3.5Å; P170-S219 WeakPolarHBondContact CG-OG 3.49Å; S215-S219 PolarHBondContact O-N 3.17Å; S215-S219 PolarHBondContact O-OG 3.36Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.25Å; S219-I222 PolarHBondContact O-N 3.16Å; S219-I222 VanDerWaalsContact O-N 3.14Å; S219-M223 VanDerWaalsContact O-CG 3.24Å; S219-M223 WeakPolarHBondContact O-CG 3.18Å; S219-M223 PolarHBondContact O-N 3.27Å
220	T	96.6	Very high	94	Very high	43 Å²	43	72.2 Å²	72.2	26%	0.264	36%	0.36	S	S	.	.	H	α-helix	trans	-65	-36.2	179.9	52.4	0	0	0	0	112.4	L208 Y216 K217 M223 Q224	L208-T220 HydrophobicContact CD1-CG2 4.17Å; Y216-T220 HydrophobicContact CD1-CG2 4.15Å; Y216-T220 HydrophobicContact CE1-CG2 3.83Å; Y216-T220 HydrophobicContact CE2-CG2 4.28Å; Y216-T220 WeakPolarHBondContact O-CB 3.43Å; Y216-T220 VanDerWaalsContact O-CG2 3.27Å; Y216-T220 WeakPolarHBondContact O-CG2 3.42Å; Y216-T220 PolarHBondContact O-N 2.88Å; Y216-T220 PolarHBondContact O-OG1 3.24Å; K217-T220 PolarHBondContact O-OG1 3.19Å; T220-M223 PolarHBondContact O-N 2.86Å; T220-Q224 WeakPolarHBondContact O-CB 3.4Å; T220-Q224 PolarHBondContact O-N 3.17Å
221	L	97.3	Very high	94.4	Very high	103 Å²	103	71.9 Å²	71.9	54%	0.539	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-43	172.1	178.4	62.5	0	0	0	111.6	K217 D218 S219 Q224 L225	K217-L221 WeakPolarHBondContact O-CB 3.49Å; K217-L221 PolarHBondContact O-N 3.29Å; K217-L221 VanDerWaalsContact O-N 3.15Å; D218-L221 PolarHBondContact O-N 3.45Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.25Å; L221-Q224 WeakPolarHBondContact O-CB 3.26Å; L221-Q224 PolarHBondContact O-N 3.33Å; L221-L225 WeakPolarHBondContact O-CG 3.27Å; L221-L225 PolarHBondContact O-N 3.09Å; L221-L225 VanDerWaalsContact O-N 3.16Å
222	I	98	Very high	94.8	Very high	28 Å²	28	74.9 Å²	74.9	14%	0.144	37%	0.373	C	S	.	.	H	α-helix	trans	-69.9	-39.9	179	-61.7	163.8	0	0	0	111.2	P170 L173 L177 D218 S219 Q224 L225 L226	P170-I222 HydrophobicContact CB-CD1 4.15Å; P170-I222 VanDerWaalsContact O-CD1 3.3Å; P170-I222 WeakPolarHBondContact O-CD1 3.4Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.45Å; L173-I222 HydrophobicContact CB-CG2 3.61Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.15Å; D218-I222 WeakPolarHBondContact O-CD1 3.11Å; D218-I222 VanDerWaalsContact O-CG1 3.25Å; D218-I222 WeakPolarHBondContact O-CG1 3.44Å; D218-I222 PolarHBondContact O-N 2.9Å; D218-I222 VanDerWaalsContact O-N 3.08Å; S219-I222 PolarHBondContact O-N 3.16Å; S219-I222 VanDerWaalsContact O-N 3.14Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.34Å; I222-L225 WeakPolarHBondContact O-CB 3.42Å; I222-L225 PolarHBondContact O-N 2.84Å; I222-L225 VanDerWaalsContact O-N 3.15Å; I222-L226 PolarHBondContact O-N 3.4Å
223	M	98.1	Very high	95.2	Very high	6 Å²	6	71 Å²	71	3%	0.03	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-38.5	174.4	-69.5	169.3	73.4	0	0	111.7	L173 F201 A204 I205 L208 S219 T220 L226 R227	L173-M223 HydrophobicContact CD1-CG 3.96Å; L173-M223 HydrophobicContact CD1-SD 4.37Å; L173-M223 HydrophobicContact CD2-CG 4.09Å; F201-M223 HydrophobicContact CD2-CB 4.12Å; F201-M223 WeakPolarHBondContact CD2-O 3.47Å; F201-M223 HydrophobicContact CE2-CB 4.08Å; F201-M223 WeakPolarHBondContact CE2-O 3.27Å; A204-M223 HydrophobicContact CB-CE 3.82Å; A204-M223 HydrophobicContact CB-CG 4.32Å; A204-M223 HydrophobicContact CB-SD 3.95Å; I205-M223 HydrophobicContact CB-CE 4.38Å; I205-M223 HydrophobicContact CD1-CE 3.39Å; I205-M223 HydrophobicContact CG1-CE 3.55Å; L208-M223 HydrophobicContact CD1-CE 4.34Å; L208-M223 HydrophobicContact CD1-SD 3.95Å; L208-M223 HydrophobicContact CD2-CE 4.46Å; S219-M223 VanDerWaalsContact O-CG 3.24Å; S219-M223 WeakPolarHBondContact O-CG 3.18Å; S219-M223 PolarHBondContact O-N 3.27Å; T220-M223 PolarHBondContact O-N 2.86Å; M223-L226 PolarHBondContact O-N 3.17Å; M223-R227 PolarHBondContact O-N 3.38Å
224	Q	98.1	Very high	95.5	Very high	64 Å²	64	65 Å²	65	30%	0.299	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-46.1	172.9	177.6	56.2	37.9	0	0	111.5	T220 L221 I222 L226 R227 D228	T220-Q224 WeakPolarHBondContact O-CB 3.4Å; T220-Q224 PolarHBondContact O-N 3.17Å; L221-Q224 WeakPolarHBondContact O-CB 3.26Å; L221-Q224 PolarHBondContact O-N 3.33Å; I222-Q224 VanDerWaalsContact C-N 3.27Å; I222-Q224 PolarHBondContact O-N 3.34Å; Q224-L226 PolarHBondContact O-N 2.89Å; Q224-R227 WeakPolarHBondContact O-CB 3.4Å; Q224-R227 PolarHBondContact O-N 3.19Å; Q224-D228 PolarHBondContact NE2-OD1 3.2Å; Q224-D228 PolarHBondContact NE2-OD2 3.08Å; Q224-D228 PolarHBondContact O-N 2.74Å
225	L	98.4	Very high	95.6	Very high	76 Å²	76	60.2 Å²	60.2	40%	0.398	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-39.4	177.1	-65.8	171.7	0	0	0	112.5	L177 L221 I222 D228 N229	L177-L225 HydrophobicContact CD1-CB 4.09Å; L177-L225 HydrophobicContact CD2-CB 3.9Å; L177-L225 HydrophobicContact CD2-CD1 3.9Å; L221-L225 WeakPolarHBondContact O-CG 3.27Å; L221-L225 PolarHBondContact O-N 3.09Å; L221-L225 VanDerWaalsContact O-N 3.16Å; I222-L225 WeakPolarHBondContact O-CB 3.42Å; I222-L225 PolarHBondContact O-N 2.84Å; I222-L225 VanDerWaalsContact O-N 3.15Å; L225-D228 PolarHBondContact O-N 3.4Å; L225-N229 PolarHBondContact O-N 3.41Å
226	L	98.4	Very high	95.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-46.3	173.6	-78.6	167.9	0	0	0	111.4	L173 L177 A197 A200 F201 I222 M223 Q224 D228 N229 L230	L173-L226 HydrophobicContact CD2-CD1 3.98Å; L177-L226 HydrophobicContact CB-CD2 3.93Å; L177-L226 HydrophobicContact CB-CG 4.22Å; L177-L226 HydrophobicContact CD1-CD2 3.97Å; L177-L226 HydrophobicContact CD1-CG 4.17Å; A197-L226 HydrophobicContact CB-CD2 3.87Å; A200-L226 HydrophobicContact CB-CD1 4.3Å; F201-L226 HydrophobicContact CD2-CB 4.45Å; I222-L226 PolarHBondContact O-N 3.4Å; M223-L226 PolarHBondContact O-N 3.17Å; Q224-L226 PolarHBondContact O-N 2.89Å; L226-D228 VanDerWaalsContact C-N 3.35Å; L226-D228 PolarHBondContact O-N 3.5Å; L226-N229 PolarHBondContact O-N 3.23Å; L226-L230 WeakPolarHBondContact O-CG 3.37Å; L226-L230 PolarHBondContact O-N 2.87Å
227	R	97.8	Very high	94.7	Very high	120 Å²	120	57.5 Å²	57.5	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-41	177.4	-172.1	-173.4	73.9	-174.2	5.8	112.3	F201 M223 Q224 L230 T231	F201-R227 HydrophobicContact CD2-CB 4.33Å; F201-R227 HydrophobicContact CE2-CB 3.93Å; F201-R227 HydrophobicContact CZ-CB 4.45Å; M223-R227 PolarHBondContact O-N 3.38Å; Q224-R227 WeakPolarHBondContact O-CB 3.4Å; Q224-R227 PolarHBondContact O-N 3.19Å; R227-L230 PolarHBondContact O-N 3.46Å; R227-T231 PolarHBondContact O-N 3.15Å; R227-T231 PolarHBondContact O-OG1 3.45Å
228	D	98	Very high	93.8	Very high	70 Å²	70	55.7 Å²	55.7	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-41.6	-179.5	-65.6	-12.7	0	0	0	110.8	Q224 L225 L226 T231 L232	Q224-D228 PolarHBondContact NE2-OD1 3.2Å; Q224-D228 PolarHBondContact NE2-OD2 3.08Å; Q224-D228 PolarHBondContact O-N 2.74Å; L225-D228 PolarHBondContact O-N 3.4Å; L226-D228 VanDerWaalsContact C-N 3.35Å; L226-D228 PolarHBondContact O-N 3.5Å; D228-T231 PolarHBondContact O-N 2.71Å; D228-L232 PolarHBondContact O-N 3.5Å
229	N	97.1	Very high	93	Very high	36 Å²	36	57.1 Å²	57.1	19%	0.193	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-46.5	172.1	-78.1	0.9	0	0	0	112.3	L177 L225 L226 T231 L232 W233	L177-N229 VanDerWaalsContact CD1-ND2 3.32Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.38Å; L225-N229 PolarHBondContact O-N 3.41Å; L226-N229 PolarHBondContact O-N 3.23Å; N229-T231 VanDerWaalsContact C-N 3.25Å; N229-T231 PolarHBondContact O-N 2.68Å; N229-L232 PolarHBondContact O-N 2.72Å; N229-W233 HydrophobicContact CB-CD2 4.19Å; N229-W233 HydrophobicContact CB-CE3 4.08Å; N229-W233 HydrophobicContact CB-CH2 3.68Å; N229-W233 HydrophobicContact CB-CZ2 3.77Å; N229-W233 HydrophobicContact CB-CZ3 3.83Å; N229-W233 WeakPolarHBondContact O-CB 3.24Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.4Å
230	L	97.1	Very high	91.9	Very high	26 Å²	26	63.2 Å²	63.2	14%	0.136	33%	0.326	C	S	.	.	H	α-helix	trans	-57.8	-40.7	177	-76.7	167.6	0	0	0	112	C194 A197 K198 L226 R227 T234	C194-L230 HydrophobicContact CB-CD2 4.17Å; C194-L230 WeakPolarHBondContact O-CD2 3.45Å; A197-L230 HydrophobicContact CB-CD1 4.36Å; A197-L230 HydrophobicContact CB-CD2 3.83Å; A197-L230 HydrophobicContact CB-CG 3.94Å; K198-L230 HydrophobicContact CB-CD1 4.16Å; K198-L230 HydrophobicContact CB-CD2 4.04Å; L226-L230 WeakPolarHBondContact O-CG 3.37Å; L226-L230 PolarHBondContact O-N 2.87Å; R227-L230 PolarHBondContact O-N 3.46Å; L230-T234 VanDerWaalsContact O-CB 3.24Å; L230-T234 WeakPolarHBondContact O-CB 3.45Å; L230-T234 PolarHBondContact O-N 3.09Å; L230-T234 PolarHBondContact O-OG1 3.24Å
231	T	96.2	Very high	90.7	Very high	93 Å²	93	68.3 Å²	68.3	57%	0.571	35%	0.347	S	S	*	.	H	α-helix	trans	-63.7	-48.1	178.5	-55.9	0	0	0	0	110.7	R227 D228 N229 S235	R227-T231 PolarHBondContact O-N 3.15Å; R227-T231 PolarHBondContact O-OG1 3.45Å; D228-T231 PolarHBondContact O-N 2.71Å; N229-T231 VanDerWaalsContact C-N 3.25Å; N229-T231 PolarHBondContact O-N 2.68Å; T231-S235 PolarHBondContact O-N 3.04Å; T231-S235 PolarHBondContact O-OG 3.12Å
232	L	94.9	Very high	89.4	Confident	91 Å²	91	66.7 Å²	66.7	48%	0.476	35%	0.348	S	S	.	.	H	α-helix	trans	-60.9	-51.3	178.7	-180	66.4	0	0	0	111.9	D228 N229 T234 S235 D236	D228-L232 PolarHBondContact O-N 3.5Å; N229-L232 PolarHBondContact O-N 2.72Å; L232-T234 VanDerWaalsContact C-N 3.33Å; L232-T234 PolarHBondContact O-N 3.21Å; L232-S235 PolarHBondContact O-N 3.47Å; L232-S235 PolarHBondContact O-OG 3.42Å; L232-D236 VanDerWaalsContact O-CG 3.24Å; L232-D236 PolarHBondContact O-N 3.36Å; L232-D236 VanDerWaalsContact O-N 3.08Å
233	W	95.6	Very high	87.4	Confident	7 Å²	7	67.8 Å²	67.8	3%	0.027	37%	0.366	C	S	.	.	H	α-helix	trans	-70.7	-30.8	-174.5	-57.5	-26.3	0	0	0	112.9	V181 Y184 A193 A197 N229 D236 Q237	V181-W233 HydrophobicContact CG2-CH2 4.01Å; V181-W233 HydrophobicContact CG2-CZ2 3.98Å; Y184-W233 AromaticContact CD1-CD1 3.97Å; Y184-W233 AromaticContact CD1-CE2 4Å; Y184-W233 HydrophobicContact CD1-CZ2 4.46Å; Y184-W233 AromaticContact CD1-NE1 3.5Å; Y184-W233 HydrophobicContact CD2-CB 3.99Å; Y184-W233 AromaticContact CD2-CD1 3.45Å; Y184-W233 VanDerWaalsContact CD2-CD1 3.45Å; Y184-W233 AromaticContact CD2-CD2 3.67Å; Y184-W233 HydrophobicContact CD2-CD2 3.67Å; Y184-W233 AromaticContact CD2-CE2 3.79Å; Y184-W233 HydrophobicContact CD2-CE3 4.42Å; Y184-W233 AromaticContact CD2-CG 3.44Å; Y184-W233 HydrophobicContact CD2-CG 3.44Å; Y184-W233 VanDerWaalsContact CD2-CG 3.44Å; Y184-W233 AromaticContact CD2-NE1 3.64Å; Y184-W233 AromaticContact CE1-CD1 3.69Å; Y184-W233 AromaticContact CE1-NE1 3.58Å; Y184-W233 HydrophobicContact CE2-CB 3.67Å; Y184-W233 AromaticContact CE2-CD1 3.12Å; Y184-W233 HydrophobicContact CE2-CD2 4.1Å; Y184-W233 AromaticContact CE2-CG 3.36Å; Y184-W233 HydrophobicContact CE2-CG 3.36Å; Y184-W233 AromaticContact CE2-NE1 3.71Å; Y184-W233 AromaticContact CG-CD1 3.86Å; Y184-W233 HydrophobicContact CG-CD2 4Å; Y184-W233 AromaticContact CG-CE2 3.64Å; Y184-W233 HydrophobicContact CG-CG 4.12Å; Y184-W233 HydrophobicContact CG-CZ2 4.1Å; Y184-W233 AromaticContact CG-NE1 3.54Å; Y184-W233 AromaticContact CZ-CD1 3.26Å; Y184-W233 AromaticContact CZ-CG 3.99Å; Y184-W233 AromaticContact CZ-NE1 3.68Å; A193-W233 HydrophobicContact CB-CE3 4.18Å; A193-W233 HydrophobicContact CB-CZ3 4Å; A197-W233 HydrophobicContact CB-CZ3 4.27Å; N229-W233 HydrophobicContact CB-CD2 4.19Å; N229-W233 HydrophobicContact CB-CE3 4.08Å; N229-W233 HydrophobicContact CB-CH2 3.68Å; N229-W233 HydrophobicContact CB-CZ2 3.77Å; N229-W233 HydrophobicContact CB-CZ3 3.83Å; N229-W233 WeakPolarHBondContact O-CB 3.24Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.4Å; W233-D236 PolarHBondContact O-N 3.41Å; W233-Q237 WeakPolarHBondContact O-CG 3.43Å; W233-Q237 PolarHBondContact O-N 3.31Å
234	T	90.9	Very high	85.4	Confident	58 Å²	58	75.8 Å²	75.8	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-72.5	-31.6	175.2	-53.1	0	0	0	0	111.7	L230 L232 Q238	L230-T234 VanDerWaalsContact O-CB 3.24Å; L230-T234 WeakPolarHBondContact O-CB 3.45Å; L230-T234 PolarHBondContact O-N 3.09Å; L230-T234 PolarHBondContact O-OG1 3.24Å; L232-T234 VanDerWaalsContact C-N 3.33Å; L232-T234 PolarHBondContact O-N 3.21Å; T234-Q238 WeakPolarHBondContact O-CG 3.36Å; T234-Q238 PolarHBondContact O-N 3.15Å
235	S	88.1	Confident	82.9	Confident	47 Å²	47	75.7 Å²	75.7	33%	0.329	42%	0.42	S	S	.	.	H	α-helix	trans	-69.9	-40.7	172.1	50.9	0	0	0	0	112.1	T231 L232 Q237 Q238 D239	T231-S235 PolarHBondContact O-N 3.04Å; T231-S235 PolarHBondContact O-OG 3.12Å; L232-S235 PolarHBondContact O-N 3.47Å; L232-S235 PolarHBondContact O-OG 3.42Å; S235-Q237 VanDerWaalsContact C-N 3.31Å; S235-Q237 PolarHBondContact O-N 3.09Å; S235-Q238 PolarHBondContact O-N 3.38Å; S235-Q238 VanDerWaalsContact O-N 3.14Å; S235-D239 PolarHBondContact O-N 3.14Å; S235-D239 VanDerWaalsContact O-N 3.09Å
236	D	82.5	Confident	80.1	Confident	45 Å²	45	82.1 Å²	82.1	24%	0.241	46%	0.455	C	S	.	.	H	α-helix	trans	-61.2	-41	179.1	-61.8	-25.7	0	0	0	111.5	Y184 L232 W233 Q238 D239 E240	Y184-D236 PolarHBondContact OH-OD2 3.01Å; L232-D236 VanDerWaalsContact O-CG 3.24Å; L232-D236 PolarHBondContact O-N 3.36Å; L232-D236 VanDerWaalsContact O-N 3.08Å; W233-D236 PolarHBondContact O-N 3.41Å; D236-Q238 VanDerWaalsContact C-N 3.33Å; D236-Q238 PolarHBondContact O-N 3.09Å; D236-D239 PolarHBondContact O-N 3.29Å; D236-E240 WeakPolarHBondContact O-CG 3.38Å; D236-E240 PolarHBondContact O-N 2.98Å
237	Q	79.9	Confident	79.1	Confident	45 Å²	45	86.3 Å²	86.3	21%	0.21	48%	0.478	C	S	.	.	H	α-helix	trans	-61.4	-38.6	175.7	-74.3	179.1	-28.7	0	0	112.9	W233 S235 E241	W233-Q237 WeakPolarHBondContact O-CG 3.43Å; W233-Q237 PolarHBondContact O-N 3.31Å; S235-Q237 VanDerWaalsContact C-N 3.31Å; S235-Q237 PolarHBondContact O-N 3.09Å; Q237-E241 WeakPolarHBondContact O-CG 3.41Å; Q237-E241 PolarHBondContact O-N 3.42Å; Q237-E241 VanDerWaalsContact O-N 3.09Å
238	Q	76.6	Confident	78.2	Confident	123 Å²	123	84.5 Å²	84.5	58%	0.575	48%	0.479	S	S	*	.	H	α-helix	trans	-69.2	-37.2	177.9	-70.3	172.4	21.1	0	0	112	T234 S235 D236 A242	T234-Q238 WeakPolarHBondContact O-CG 3.36Å; T234-Q238 PolarHBondContact O-N 3.15Å; S235-Q238 PolarHBondContact O-N 3.38Å; S235-Q238 VanDerWaalsContact O-N 3.14Å; D236-Q238 VanDerWaalsContact C-N 3.33Å; D236-Q238 PolarHBondContact O-N 3.09Å; Q238-A242 WeakPolarHBondContact O-CB 3.43Å; Q238-A242 PolarHBondContact O-N 3.08Å; Q238-A242 VanDerWaalsContact O-N 3.08Å
239	D	76.3	Confident	77.1	Confident	119 Å²	119	85.3 Å²	85.3	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-70.6	-37.7	177.8	-74.7	-17.5	0	0	0	111.8	S235 D236 G243	S235-D239 PolarHBondContact O-N 3.14Å; S235-D239 VanDerWaalsContact O-N 3.09Å; D236-D239 PolarHBondContact O-N 3.29Å; D239-G243 PolarHBondContact O-N 3.08Å; D239-G243 VanDerWaalsContact O-N 3.08Å
240	E	73.7	Confident	75.9	Confident	127 Å²	127	88.2 Å²	88.2	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-64	-47.5	173.6	-73.9	179.3	178.2	0	0	111.7	D236 A242 G243 E244	D236-E240 WeakPolarHBondContact O-CG 3.38Å; D236-E240 PolarHBondContact O-N 2.98Å; E240-A242 VanDerWaalsContact C-N 3.32Å; E240-A242 PolarHBondContact O-N 3.39Å; E240-G243 PolarHBondContact O-N 3.21Å; E240-G243 VanDerWaalsContact O-N 3.15Å; E240-E244 PolarHBondContact O-N 3.15Å
241	E	71.6	Confident	74.5	Confident	150 Å²	150	92.1 Å²	92.1	70%	0.701	53%	0.525	S	S	*	.	H	α-helix	trans	-62.6	-36.1	177.2	-74.5	179.2	-176.1	0	0	112.8	Q237	Q237-E241 WeakPolarHBondContact O-CG 3.41Å; Q237-E241 PolarHBondContact O-N 3.42Å; Q237-E241 VanDerWaalsContact O-N 3.09Å
242	A	69.2	Low	73.1	Confident	69 Å²	69	92 Å²	92	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-71.5	-29.9	176.1	0	0	0	0	0	112.8	Q238 E240	Q238-A242 WeakPolarHBondContact O-CB 3.43Å; Q238-A242 PolarHBondContact O-N 3.08Å; Q238-A242 VanDerWaalsContact O-N 3.08Å; E240-A242 VanDerWaalsContact C-N 3.32Å; E240-A242 PolarHBondContact O-N 3.39Å
243	G	57.2	Low	71.5	Confident	51 Å²	51	92.1 Å²	92.1	53%	0.526	53%	0.525	S	S	.	.	H	α-helix	trans	-74.4	-32.5	179.2	0	0	0	0	0	114.2	D239 E240 G245	D239-G243 PolarHBondContact O-N 3.08Å; D239-G243 VanDerWaalsContact O-N 3.08Å; E240-G243 PolarHBondContact O-N 3.21Å; E240-G243 VanDerWaalsContact O-N 3.15Å; G243-G245 PolarHBondContact O-N 3.39Å
244	E	55.6	Low	69.7	Low	175 Å²	175	98.6 Å²	98.6	82%	0.818	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-7.5	177	-66.9	-168.5	163.8	0	0	113.8	E240	E240-E244 PolarHBondContact O-N 3.15Å
245	G	45.5	Very low	67.9	Low	62 Å²	62	102 Å²	102	64%	0.639	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	2.3	-178.3	0	0	0	0	0	116.8	G243	G243-G245 PolarHBondContact O-N 3.39Å
246	N	38.8	Very low	66.1	Low	211 Å²	211	107 Å²	107	100%	1.128	60%	0.603	S	S	*	*			trans	-122.3	0	-178.6	-75.6	-35.9	0	0	0	112.9

Retrieved 246 of 246 residues in 304 ms (Link to these results)

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