A0A3Q0KRZ9_SCHMA Loading...

Putative tbc1 domain family member

AlphaFold DB , UniProt , Accession A0A3Q0KRZ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 347 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.3	Very low	52.3	Low	234 Å²	234	92.5 Å²	92.5	100%	1.153	54%	0.536	S	S	*	.				0	-8.2	0	-90.6	-171.8	-101.7	0	0	114.1
2	A	42.1	Very low	53	Low	87 Å²	87	92.3 Å²	92.3	72%	0.719	53%	0.53	S	S	*	.			trans	-90.4	-15.8	-176.3	0	0	0	0	0	116.1
3	S	50.4	Low	53.2	Low	102 Å²	102	96.2 Å²	96.2	71%	0.713	54%	0.544	S	S	*	.	H	α-helix	trans	-73.1	-31.2	-171.1	55.4	0	0	0	0	115.1	E7	S3-E7 PolarHBondContact O-N 3.02Å
4	G	47.2	Very low	53.4	Low	32 Å²	32	97.4 Å²	97.4	33%	0.33	55%	0.554	S	S	.	*	H	α-helix	trans	-79.2	-23.9	-174.6	0	0	0	0	0	115.3	S8	G4-S8 PolarHBondContact O-N 3.37Å; G4-S8 PolarHBondContact O-OG 3.33Å
5	F	50.9	Low	53.8	Low	171 Å²	171	94.1 Å²	94.1	75%	0.75	54%	0.535	S	S	*	.	H	α-helix	trans	-71.4	-39.6	175.8	-84.3	-83.6	0	0	0	111.3	S8 A9	F5-S8 PolarHBondContact O-N 2.87Å; F5-A9 WeakPolarHBondContact O-CB 3.22Å; F5-A9 PolarHBondContact O-N 2.88Å
6	D	57	Low	54.4	Low	98 Å²	98	98 Å²	98	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-42.4	179.2	-163.1	-2.9	0	0	0	111.1	S8 A9 N10	D6-S8 PolarHBondContact O-N 3.3Å; D6-A9 PolarHBondContact O-N 3.42Å; D6-N10 VanDerWaalsContact O-CB 3.31Å; D6-N10 WeakPolarHBondContact O-CB 3.38Å; D6-N10 PolarHBondContact O-N 3.37Å; D6-N10 PolarHBondContact O-ND2 3.3Å; D6-N10 PolarHBondContact OD1-ND2 2.89Å
7	E	56.7	Low	55.8	Low	92 Å²	92	94.7 Å²	94.7	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-67.8	-35.9	178.8	-156.5	174.4	-178.1	0	0	113	S3 N10 I11 I136	S3-E7 PolarHBondContact O-N 3.02Å; E7-N10 PolarHBondContact O-N 2.91Å; E7-I11 VanDerWaalsContact O-CG1 3.32Å; E7-I11 WeakPolarHBondContact O-CG1 3.3Å; E7-I11 PolarHBondContact O-N 3.26Å; E7-I136 HydrophobicContact CB-CD1 4.24Å; E7-I136 HydrophobicContact CB-CG1 4.42Å; E7-I136 HydrophobicContact CG-CG1 4.26Å; E7-I136 HydrophobicContact CG-CG2 4.45Å; E7-I136 WeakPolarHBondContact OE2-CG2 3.38Å
8	S	57.4	Low	57.5	Low	50 Å²	50	91.6 Å²	91.6	35%	0.35	52%	0.524	S	S	.	.	H	α-helix	trans	-65.2	-45.6	173.7	-52.9	0	0	0	0	111.7	G4 F5 D6 N10 I11 L12 I136	G4-S8 PolarHBondContact O-N 3.37Å; G4-S8 PolarHBondContact O-OG 3.33Å; F5-S8 PolarHBondContact O-N 2.87Å; D6-S8 PolarHBondContact O-N 3.3Å; S8-N10 VanDerWaalsContact C-N 3.35Å; S8-I11 PolarHBondContact O-N 3.3Å; S8-L12 WeakPolarHBondContact O-CG 3.42Å; S8-L12 PolarHBondContact O-N 3.35Å; S8-I136 WeakPolarHBondContact OG-CD1 3.45Å
9	A	57.3	Low	59.2	Low	43 Å²	43	87.1 Å²	87.1	36%	0.355	50%	0.498	S	S	.	.	H	α-helix	trans	-62.2	-46.1	175.9	0	0	0	0	0	109.9	F5 D6 I11 L12 M13	F5-A9 WeakPolarHBondContact O-CB 3.22Å; F5-A9 PolarHBondContact O-N 2.88Å; D6-A9 PolarHBondContact O-N 3.42Å; A9-I11 PolarHBondContact O-N 3.39Å; A9-L12 CarbonylContact O-C 3.18Å; A9-L12 WeakPolarHBondContact O-CB 3.3Å; A9-L12 PolarHBondContact O-N 3.22Å; A9-L12 VanDerWaalsContact O-N 3.11Å; A9-M13 WeakPolarHBondContact O-CB 3.38Å; A9-M13 WeakPolarHBondContact O-CG 3.31Å; A9-M13 PolarHBondContact O-N 3.33Å
10	N	57.3	Low	60.6	Low	76 Å²	76	88.5 Å²	88.5	41%	0.406	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-41.1	177.2	-72.6	-35.6	0	0	0	112.3	D6 E7 S8 L12 M13 V14	D6-N10 VanDerWaalsContact O-CB 3.31Å; D6-N10 WeakPolarHBondContact O-CB 3.38Å; D6-N10 PolarHBondContact O-N 3.37Å; D6-N10 PolarHBondContact O-ND2 3.3Å; D6-N10 PolarHBondContact OD1-ND2 2.89Å; E7-N10 PolarHBondContact O-N 2.91Å; S8-N10 VanDerWaalsContact C-N 3.35Å; N10-L12 VanDerWaalsContact C-N 3.35Å; N10-L12 PolarHBondContact O-N 2.98Å; N10-M13 PolarHBondContact O-N 3.11Å; N10-V14 WeakPolarHBondContact O-CB 3.47Å; N10-V14 WeakPolarHBondContact O-CG2 3.15Å; N10-V14 PolarHBondContact O-N 2.96Å
11	I	59	Low	62.1	Low	32 Å²	32	85.9 Å²	85.9	16%	0.164	48%	0.478	C	S	.	.	H	α-helix	trans	-62.6	-42.9	173.9	-71.2	161.2	0	0	0	111.2	E7 S8 A9 M13 N15 F24 A135 I136	E7-I11 VanDerWaalsContact O-CG1 3.32Å; E7-I11 WeakPolarHBondContact O-CG1 3.3Å; E7-I11 PolarHBondContact O-N 3.26Å; S8-I11 PolarHBondContact O-N 3.3Å; A9-I11 PolarHBondContact O-N 3.39Å; I11-M13 VanDerWaalsContact C-N 3.32Å; I11-N15 VanDerWaalsContact O-CB 3.22Å; I11-N15 WeakPolarHBondContact O-CB 3.37Å; I11-N15 PolarHBondContact O-N 2.84Å; I11-F24 HydrophobicContact CG2-CE1 4.44Å; I11-A135 HydrophobicContact CD1-CB 3.87Å; I11-A135 HydrophobicContact CG2-CB 4.44Å; I11-I136 HydrophobicContact CD1-CD1 4.2Å; I11-I136 HydrophobicContact CD1-CG1 3.38Å
12	L	60.1	Low	64.5	Low	90 Å²	90	75.1 Å²	75.1	47%	0.471	43%	0.427	S	S	.	.	H	α-helix	trans	-67.7	-30.8	176.3	-69.7	171.5	0	0	0	112.9	S8 A9 N10 V18 V132	S8-L12 WeakPolarHBondContact O-CG 3.42Å; S8-L12 PolarHBondContact O-N 3.35Å; A9-L12 CarbonylContact O-C 3.18Å; A9-L12 WeakPolarHBondContact O-CB 3.3Å; A9-L12 PolarHBondContact O-N 3.22Å; A9-L12 VanDerWaalsContact O-N 3.11Å; N10-L12 VanDerWaalsContact C-N 3.35Å; N10-L12 PolarHBondContact O-N 2.98Å; L12-V18 HydrophobicContact CD2-CG2 4.12Å; L12-V132 HydrophobicContact CD2-CG1 3.64Å
13	M	55.5	Low	67	Low	143 Å²	143	71 Å²	71	70%	0.704	39%	0.393	S	S	*	.	H	α-helix	trans	-85.9	-28.9	179.6	-67.9	-151	80	0	0	113.1	A9 N10 I11	A9-M13 WeakPolarHBondContact O-CB 3.38Å; A9-M13 WeakPolarHBondContact O-CG 3.31Å; A9-M13 PolarHBondContact O-N 3.33Å; N10-M13 PolarHBondContact O-N 3.11Å; I11-M13 VanDerWaalsContact C-N 3.32Å
14	V	56.8	Low	68.9	Low	114 Å²	114	68.1 Å²	68.1	69%	0.691	37%	0.368	S	S	*	.	H	α-helix	trans	-81.2	-36.9	175.6	172.4	0	0	0	0	110.2	N10 D16	N10-V14 WeakPolarHBondContact O-CB 3.47Å; N10-V14 WeakPolarHBondContact O-CG2 3.15Å; N10-V14 PolarHBondContact O-N 2.96Å; V14-D16 PolarHBondContact O-N 3.15Å
15	N	59.7	Low	70.9	Confident	48 Å²	48	72.3 Å²	72.3	26%	0.257	38%	0.378	S	S	.	.			trans	-95.6	80.8	174.7	-62.1	-31.2	0	0	0	110	I11 A17 V18 F24	I11-N15 VanDerWaalsContact O-CB 3.22Å; I11-N15 WeakPolarHBondContact O-CB 3.37Å; I11-N15 PolarHBondContact O-N 2.84Å; N15-A17 PolarHBondContact O-N 3.48Å; N15-V18 HydrophobicContact CB-CG2 4.26Å; N15-F24 HydrophobicContact CB-CB 4.08Å; N15-F24 WeakPolarHBondContact ND2-CG 3.4Å
16	D	63.3	Low	72.6	Confident	156 Å²	156	66 Å²	66	83%	0.834	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-3.1	172.2	-86.7	-27.3	0	0	0	114.2	V14	V14-D16 PolarHBondContact O-N 3.15Å
17	A	77.2	Confident	74.1	Confident	42 Å²	42	64.6 Å²	64.6	35%	0.347	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	52.2	-173.3	0	0	0	0	0	113.6	N15 M34	N15-A17 PolarHBondContact O-N 3.48Å; A17-M34 HydrophobicContact CB-CE 3.72Å; A17-M34 HydrophobicContact CB-SD 4.41Å
18	V	86.7	Confident	75.8	Confident	39 Å²	39	60.9 Å²	60.9	24%	0.236	34%	0.335	C	S	.	.			trans	-80.9	128.1	167.9	-177.7	0	0	0	0	110	L12 N15 G22 F23 F24 V132	L12-V18 HydrophobicContact CD2-CG2 4.12Å; N15-V18 HydrophobicContact CB-CG2 4.26Å; V18-G22 VanDerWaalsContact CG1-CA 3.43Å; V18-F23 CarbonylContact C-O 3.46Å; V18-F23 WeakPolarHBondContact CA-O 3.16Å; V18-F24 HydrophobicContact CG2-CB 4.36Å; V18-V132 HydrophobicContact CG1-CG1 4.1Å; V18-V132 HydrophobicContact CG2-CG1 4.24Å
19	D	89.5	Confident	77.3	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.027	32%	0.324	C	S	.	.			trans	-70.5	168.7	173.6	87.2	-4	0	0	0	111.8	Y21 G22 F23 F29 N33 M34	D19-Y21 PolarHBondContact O-N 3.45Å; D19-Y21 WeakPolarHBondContact OD1-CA 3.49Å; D19-Y21 WeakPolarHBondContact OD1-CB 3.31Å; D19-Y21 PolarHBondContact OD1-N 2.82Å; D19-G22 PolarHBondContact O-N 3.32Å; D19-G22 PolarHBondContact OD1-N 3.46Å; D19-G22 VanDerWaalsContact OD1-N 3.1Å; D19-F23 PolarHBondContact N-O 2.97Å; D19-F23 PolarHBondContact OD1-N 3.46Å; D19-F29 HydrophobicContact CB-CD2 3.84Å; D19-F29 HydrophobicContact CB-CE2 3.89Å; D19-N33 HydrophobicContact CB-CB 4.28Å; D19-M34 HydrophobicContact CB-CG 4.33Å
20	R	87.8	Confident	78.5	Confident	115 Å²	115	59.3 Å²	59.3	43%	0.434	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-12.7	-177.3	81.8	-172.9	-57.4	163.9	11.4	115.2	N33	R20-N33 WeakPolarHBondContact CB-O 3.34Å; R20-N33 HydrophobicContact CG-CB 4.02Å
21	Y	91.1	Very high	79.7	Confident	34 Å²	34	62.7 Å²	62.7	13%	0.133	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-1.2	-177.4	-62.7	-70	0	0	0	112.7	D19 N33 H131 W251 L255	D19-Y21 PolarHBondContact O-N 3.45Å; D19-Y21 WeakPolarHBondContact OD1-CA 3.49Å; D19-Y21 WeakPolarHBondContact OD1-CB 3.31Å; D19-Y21 PolarHBondContact OD1-N 2.82Å; Y21-N33 HydrophobicContact CE2-CB 4.49Å; Y21-N33 WeakPolarHBondContact CE2-ND2 3.13Å; Y21-H131 PolarHBondContact O-CD2 3.42Å; Y21-H131 PolarHBondContact O-NE2 3.19Å; Y21-W251 VanDerWaalsContact CB-CD1 3.46Å; Y21-W251 AromaticContact CD1-CD1 3.52Å; Y21-W251 AromaticContact CD1-NE1 3.89Å; Y21-W251 HydrophobicContact CD2-CB 4.4Å; Y21-W251 AromaticContact CD2-CD1 3.77Å; Y21-W251 HydrophobicContact CD2-CG 4.47Å; Y21-W251 AromaticContact CG-CD1 3.31Å; Y21-W251 HydrophobicContact CG-CG 4.29Å; Y21-W251 AromaticContact CG-NE1 4Å; Y21-L255 HydrophobicContact CD1-CD1 3.9Å; Y21-L255 HydrophobicContact CE1-CD1 3.34Å
22	G	92.4	Very high	80.7	Confident	9 Å²	9	64 Å²	64	9%	0.093	35%	0.347	C	S	.	.	S	Bend	trans	95.5	9.1	177	0	0	0	0	0	114.5	V18 D19 H131 V132	V18-G22 VanDerWaalsContact CG1-CA 3.43Å; D19-G22 PolarHBondContact O-N 3.32Å; D19-G22 PolarHBondContact OD1-N 3.46Å; D19-G22 VanDerWaalsContact OD1-N 3.1Å; G22-H131 WeakPolarHBondContact O-CA 3.36Å; G22-H131 PolarHBondContact O-CD2 3.11Å; G22-V132 WeakPolarHBondContact O-CG1 3.26Å; G22-V132 PolarHBondContact O-N 3.28Å
23	F	93	Very high	81.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-94.1	140.8	176	-67.2	-84.3	0	0	0	111.4	V18 D19 Q28 F29 L128 N130 H131 I174 W251	V18-F23 CarbonylContact C-O 3.46Å; V18-F23 WeakPolarHBondContact CA-O 3.16Å; D19-F23 PolarHBondContact N-O 2.97Å; D19-F23 PolarHBondContact OD1-N 3.46Å; F23-Q28 HydrophobicContact CD1-CB 3.7Å; F23-Q28 HydrophobicContact CD1-CG 4.47Å; F23-Q28 HydrophobicContact CD2-CB 4.06Å; F23-Q28 HydrophobicContact CE1-CB 3.56Å; F23-Q28 HydrophobicContact CE1-CG 3.88Å; F23-Q28 HydrophobicContact CE2-CB 3.96Å; F23-Q28 HydrophobicContact CG-CB 3.93Å; F23-Q28 HydrophobicContact CZ-CB 3.71Å; F23-Q28 HydrophobicContact CZ-CG 3.96Å; F23-F29 HydrophobicContact CB-CB 4.19Å; F23-F29 HydrophobicContact CB-CD2 4.48Å; F23-F29 WeakPolarHBondContact O-CD2 3.29Å; F23-L128 HydrophobicContact CE1-CB 4.29Å; F23-L128 HydrophobicContact CE1-CD2 4.06Å; F23-L128 HydrophobicContact CZ-CD1 4.33Å; F23-L128 HydrophobicContact CZ-CD2 4.37Å; F23-N130 WeakPolarHBondContact CA-O 3.22Å; F23-N130 WeakPolarHBondContact CD1-ND2 3.46Å; F23-H131 HydrophobicContact CD1-CB 3.84Å; F23-H131 AromaticContact CD2-CD2 3.81Å; F23-H131 HydrophobicContact CE1-CB 3.65Å; F23-H131 AromaticContact CE1-CD2 3.87Å; F23-H131 AromaticContact CE2-CD2 3.55Å; F23-H131 HydrophobicContact CZ-CB 4.19Å; F23-H131 AromaticContact CZ-CD2 3.6Å; F23-I174 HydrophobicContact CE2-CD1 4.46Å; F23-I174 HydrophobicContact CZ-CD1 4.02Å; F23-W251 HydrophobicContact CD2-CB 4.28Å; F23-W251 HydrophobicContact CD2-CD2 4.46Å; F23-W251 HydrophobicContact CD2-CG 4.22Å; F23-W251 HydrophobicContact CE2-CB 4Å; F23-W251 AromaticContact CE2-CD2 3.4Å; F23-W251 HydrophobicContact CE2-CD2 3.4Å; F23-W251 VanDerWaalsContact CE2-CD2 3.4Å; F23-W251 AromaticContact CE2-CE2 3.78Å; F23-W251 AromaticContact CE2-CE3 3.66Å; F23-W251 HydrophobicContact CE2-CE3 3.66Å; F23-W251 AromaticContact CE2-CG 3.56Å; F23-W251 HydrophobicContact CE2-CG 3.56Å; F23-W251 HydrophobicContact CE2-CZ2 4.34Å; F23-W251 HydrophobicContact CE2-CZ3 4.2Å; F23-W251 AromaticContact CZ-CD2 3.82Å; F23-W251 HydrophobicContact CZ-CD2 3.82Å; F23-W251 AromaticContact CZ-CE3 3.57Å; F23-W251 HydrophobicContact CZ-CE3 3.57Å; F23-W251 HydrophobicContact CZ-CG 4.39Å; F23-W251 HydrophobicContact CZ-CH2 4.16Å; F23-W251 HydrophobicContact CZ-CZ2 4.41Å; F23-W251 AromaticContact CZ-CZ3 3.74Å; F23-W251 HydrophobicContact CZ-CZ3 3.74Å
24	F	90.9	Very high	82.5	Confident	42 Å²	42	58 Å²	58	18%	0.184	32%	0.316	C	S	.	.			trans	-106.4	-17.7	174.4	48.3	-95.2	0	0	0	114.1	I11 N15 V18 N130 A135	I11-F24 HydrophobicContact CG2-CE1 4.44Å; N15-F24 HydrophobicContact CB-CB 4.08Å; N15-F24 WeakPolarHBondContact ND2-CG 3.4Å; V18-F24 HydrophobicContact CG2-CB 4.36Å; F24-N130 WeakPolarHBondContact CD1-O 3.32Å; F24-N130 WeakPolarHBondContact CE1-O 3.42Å; F24-N130 HydrophobicContact CE2-CB 4.15Å; F24-N130 HydrophobicContact CZ-CB 4.29Å; F24-N130 PolarHBondContact N-O 3.05Å; F24-N130 VanDerWaalsContact N-O 3.1Å; F24-A135 HydrophobicContact CE1-CB 4.09Å; F24-A135 HydrophobicContact CZ-CB 4.37Å
25	E	88.7	Confident	83.6	Confident	119 Å²	119	61.9 Å²	61.9	56%	0.556	32%	0.319	S	S	*	.	S	Bend	trans	-160.9	-170.7	176.2	66.9	-178.4	171.9	0	0	112	F29 N130	E25-F29 WeakPolarHBondContact O-CB 3.22Å; E25-N130 HydrophobicContact CG-CB 3.9Å; E25-N130 PolarHBondContact O-ND2 2.78Å
26	G	87.5	Confident	84.6	Confident	39 Å²	39	69.5 Å²	69.5	40%	0.402	35%	0.349	S	S	.	.	S	Bend	trans	84.6	-171.6	172.2	0	0	0	0	0	115.5	Q28 F29	G26-Q28 VanDerWaalsContact C-N 3.28Å; G26-Q28 PolarHBondContact O-N 3.29Å; G26-F29 PolarHBondContact O-N 2.99Å
27	E	87.2	Confident	85.7	Confident	68 Å²	68	64.8 Å²	64.8	32%	0.318	32%	0.324	S	S	.	.	S	Bend	trans	-65.8	-30.1	-175.9	-67.9	-57.8	148.8	0	0	113	P250	E27-P250 VanDerWaalsContact O-CA 3.31Å; E27-P250 WeakPolarHBondContact O-CA 3.49Å
28	Q	92.6	Very high	86.4	Confident	15 Å²	15	65.5 Å²	65.5	7%	0.07	33%	0.326	C	S	.	.	S	Bend	trans	-78.6	-27.3	-178.8	-64.8	77.2	19.8	0	0	112.4	F23 G26 L128 N130 T246 W251	F23-Q28 HydrophobicContact CD1-CB 3.7Å; F23-Q28 HydrophobicContact CD1-CG 4.47Å; F23-Q28 HydrophobicContact CD2-CB 4.06Å; F23-Q28 HydrophobicContact CE1-CB 3.56Å; F23-Q28 HydrophobicContact CE1-CG 3.88Å; F23-Q28 HydrophobicContact CE2-CB 3.96Å; F23-Q28 HydrophobicContact CG-CB 3.93Å; F23-Q28 HydrophobicContact CZ-CB 3.71Å; F23-Q28 HydrophobicContact CZ-CG 3.96Å; G26-Q28 VanDerWaalsContact C-N 3.28Å; G26-Q28 PolarHBondContact O-N 3.29Å; Q28-L128 HydrophobicContact CG-CD2 4.19Å; Q28-N130 PolarHBondContact OE1-ND2 3.44Å; Q28-T246 PolarHBondContact NE2-O 3.48Å; Q28-W251 HydrophobicContact CB-CB 4.16Å; Q28-W251 HydrophobicContact CB-CE3 4.17Å; Q28-W251 HydrophobicContact CG-CE3 3.79Å; Q28-W251 HydrophobicContact CG-CZ3 4.28Å; Q28-W251 WeakPolarHBondContact O-CB 3.41Å; Q28-W251 PolarHBondContact O-N 3.37Å
29	F	89.3	Confident	86.7	Confident	26 Å²	26	68.7 Å²	68.7	11%	0.114	34%	0.338	C	S	.	.			trans	-69.3	139.6	-177.6	173.2	-99.4	0	0	0	112.5	D19 F23 E25 G26 E31 M34	D19-F29 HydrophobicContact CB-CD2 3.84Å; D19-F29 HydrophobicContact CB-CE2 3.89Å; F23-F29 HydrophobicContact CB-CB 4.19Å; F23-F29 HydrophobicContact CB-CD2 4.48Å; F23-F29 WeakPolarHBondContact O-CD2 3.29Å; E25-F29 WeakPolarHBondContact O-CB 3.22Å; G26-F29 PolarHBondContact O-N 2.99Å; F29-E31 HydrophobicContact CE1-CG 3.51Å; F29-E31 HydrophobicContact CZ-CG 3.89Å; F29-M34 HydrophobicContact CE2-SD 4.14Å; F29-M34 HydrophobicContact CZ-SD 3.84Å
30	C	83.4	Confident	87	Confident	34 Å²	34	71.9 Å²	71.9	23%	0.23	36%	0.361	C	S	.	.			trans	-142.5	114.4	176.3	178.4	0	0	0	0	111.7	A32 N33	C30-A32 PolarHBondContact O-N 3.49Å; C30-N33 WeakPolarHBondContact CB-ND2 3.35Å; C30-N33 VanDerWaalsContact O-CB 3.26Å; C30-N33 WeakPolarHBondContact O-CB 3.14Å; C30-N33 PolarHBondContact O-N 3.09Å
31	E	81.2	Confident	87.2	Confident	146 Å²	146	68.3 Å²	68.3	68%	0.682	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-56.7	-33.7	179.1	-65.3	176.3	-171.4	0	0	113.3	F29 N33 M34	F29-E31 HydrophobicContact CE1-CG 3.51Å; F29-E31 HydrophobicContact CZ-CG 3.89Å; E31-N33 PolarHBondContact O-N 3.38Å; E31-N33 VanDerWaalsContact O-N 3.09Å; E31-M34 WeakPolarHBondContact O-CB 3.38Å; E31-M34 PolarHBondContact O-N 3.24Å
32	A	80.1	Confident	87.2	Confident	60 Å²	60	69.4 Å²	69.4	50%	0.496	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-59.9	-24.2	177.4	0	0	0	0	0	112.3	C30 M34	C30-A32 PolarHBondContact O-N 3.49Å; A32-M34 VanDerWaalsContact C-N 3.33Å
33	N	79	Confident	87.4	Confident	23 Å²	23	72.4 Å²	72.4	12%	0.123	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-80.3	-8.4	177.4	-66.6	-29.8	0	0	0	114.1	D19 R20 Y21 C30 E31 R35	D19-N33 HydrophobicContact CB-CB 4.28Å; R20-N33 WeakPolarHBondContact CB-O 3.34Å; R20-N33 HydrophobicContact CG-CB 4.02Å; Y21-N33 HydrophobicContact CE2-CB 4.49Å; Y21-N33 WeakPolarHBondContact CE2-ND2 3.13Å; C30-N33 WeakPolarHBondContact CB-ND2 3.35Å; C30-N33 VanDerWaalsContact O-CB 3.26Å; C30-N33 WeakPolarHBondContact O-CB 3.14Å; C30-N33 PolarHBondContact O-N 3.09Å; E31-N33 PolarHBondContact O-N 3.38Å; E31-N33 VanDerWaalsContact O-N 3.09Å; N33-R35 VanDerWaalsContact C-N 3.34Å
34	M	75.5	Confident	87.5	Confident	83 Å²	83	79.2 Å²	79.2	41%	0.409	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-80.1	-17.8	175.6	-62.1	177.1	68.4	0	0	112.6	A17 D19 F29 E31 A32 K36	A17-M34 HydrophobicContact CB-CE 3.72Å; A17-M34 HydrophobicContact CB-SD 4.41Å; D19-M34 HydrophobicContact CB-CG 4.33Å; F29-M34 HydrophobicContact CE2-SD 4.14Å; F29-M34 HydrophobicContact CZ-SD 3.84Å; E31-M34 WeakPolarHBondContact O-CB 3.38Å; E31-M34 PolarHBondContact O-N 3.24Å; A32-M34 VanDerWaalsContact C-N 3.33Å; M34-K36 PolarHBondContact O-N 3.38Å
35	R	79.4	Confident	87.7	Confident	197 Å²	197	79.1 Å²	79.1	74%	0.743	41%	0.406	S	S	*	.	S	Bend	trans	-67.7	132.8	-177.2	-64.3	-179.1	-176.2	175.9	1.6	110.9	N33 L37	N33-R35 VanDerWaalsContact C-N 3.34Å; R35-L37 PolarHBondContact O-N 2.78Å
36	K	81.6	Confident	88	Confident	207 Å²	207	78.8 Å²	78.8	90%	0.9	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-57.5	131.1	170.4	-72.1	-174.5	179.8	178.6	0	109.7	M34	M34-K36 PolarHBondContact O-N 3.38Å
37	L	85.3	Confident	88.4	Confident	57 Å²	57	83 Å²	83	30%	0.298	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-72.2	139.5	175.1	-70.2	-177.6	0	0	0	110.6	R35 L42 I45	R35-L37 PolarHBondContact O-N 2.78Å; L37-L42 HydrophobicContact CB-CD2 3.94Å; L37-L42 HydrophobicContact CB-CG 4.02Å; L37-L42 HydrophobicContact CD1-CD2 3.85Å; L37-I45 HydrophobicContact CD1-CD1 3.43Å; L37-I45 VanDerWaalsContact CD1-CD1 3.43Å
38	S	92	Very high	88.8	Confident	57 Å²	57	83.5 Å²	83.5	40%	0.399	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-63.6	155.2	168.9	66	0	0	0	0	111.3	S40 S41 L42	S38-S40 PolarHBondContact O-N 3.37Å; S38-S40 PolarHBondContact OG-OG 2.99Å; S38-S41 WeakPolarHBondContact O-CA 3.33Å; S38-S41 WeakPolarHBondContact O-CB 3.46Å; S38-S41 PolarHBondContact O-N 2.94Å; S38-S41 WeakPolarHBondContact OG-CB 3.14Å; S38-S41 PolarHBondContact OG-N 2.95Å; S38-S41 PolarHBondContact OG-OG 3.4Å; S38-L42 PolarHBondContact O-N 3.31Å
39	E	93.5	Very high	89.1	Confident	106 Å²	106	84.7 Å²	84.7	50%	0.495	42%	0.416	S	S	.	.	H	α-helix	trans	-57	-37.2	174.9	-172.3	56	-146.6	0	0	111.9	S41 L42 N43 R46	E39-S41 VanDerWaalsContact C-N 3.29Å; E39-S41 PolarHBondContact O-N 2.91Å; E39-L42 PolarHBondContact O-N 3.24Å; E39-N43 WeakPolarHBondContact O-CB 3.31Å; E39-N43 PolarHBondContact O-N 2.94Å; E39-N43 PolarHBondContact O-ND2 2.6Å; E39-N43 PolarHBondContact OE1-ND2 3.22Å; E39-N43 PolarHBondContact OE1-OD1 2.97Å; E39-R46 IonicContact OE1-CZ 2.76Å; E39-R46 IonicContact OE1-NH1 3.99Å; E39-R46 PolarHBondContact OE1-NH1 3.46Å
40	S	95	Very high	89.4	Confident	72 Å²	72	87.4 Å²	87.4	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-62.1	-35.4	174.6	61.8	0	0	0	0	113	S38 K44	S38-S40 PolarHBondContact O-N 3.37Å; S38-S40 PolarHBondContact OG-OG 2.99Å; S40-K44 WeakPolarHBondContact O-CG 3.46Å; S40-K44 PolarHBondContact O-N 3.35Å; S40-K44 VanDerWaalsContact O-N 3.16Å
41	S	92	Very high	90.1	Very high	40 Å²	40	89.9 Å²	89.9	28%	0.28	44%	0.438	S	S	.	.	H	α-helix	trans	-73.7	-42.1	176.1	-59.1	0	0	0	0	111.3	S38 E39 N43 K44 I45	S38-S41 WeakPolarHBondContact O-CA 3.33Å; S38-S41 WeakPolarHBondContact O-CB 3.46Å; S38-S41 PolarHBondContact O-N 2.94Å; S38-S41 WeakPolarHBondContact OG-CB 3.14Å; S38-S41 PolarHBondContact OG-N 2.95Å; S38-S41 PolarHBondContact OG-OG 3.4Å; E39-S41 VanDerWaalsContact C-N 3.29Å; E39-S41 PolarHBondContact O-N 2.91Å; S41-N43 VanDerWaalsContact C-N 3.34Å; S41-N43 PolarHBondContact O-N 3.21Å; S41-K44 PolarHBondContact O-N 2.87Å; S41-I45 WeakPolarHBondContact O-CG1 3.44Å; S41-I45 PolarHBondContact O-N 2.72Å
42	L	92.4	Very high	90.9	Very high	58 Å²	58	83 Å²	83	30%	0.304	41%	0.406	S	S	.	.	H	α-helix	trans	-60.3	-43.6	174.3	-68.1	175.1	0	0	0	111.4	L37 S38 E39 K44 I45 R46	L37-L42 HydrophobicContact CB-CD2 3.94Å; L37-L42 HydrophobicContact CB-CG 4.02Å; L37-L42 HydrophobicContact CD1-CD2 3.85Å; S38-L42 PolarHBondContact O-N 3.31Å; E39-L42 PolarHBondContact O-N 3.24Å; L42-K44 PolarHBondContact O-N 3.12Å; L42-I45 WeakPolarHBondContact O-CB 3.3Å; L42-I45 PolarHBondContact O-N 3.21Å; L42-I45 VanDerWaalsContact O-N 3.12Å; L42-R46 WeakPolarHBondContact O-CG 3.44Å; L42-R46 PolarHBondContact O-N 3.29Å
43	N	96.1	Very high	91.7	Very high	71 Å²	71	84 Å²	84	38%	0.38	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-40.7	175.6	-75.4	-30.4	0	0	0	112.4	E39 S41 I45 R46 Q47	E39-N43 WeakPolarHBondContact O-CB 3.31Å; E39-N43 PolarHBondContact O-N 2.94Å; E39-N43 PolarHBondContact O-ND2 2.6Å; E39-N43 PolarHBondContact OE1-ND2 3.22Å; E39-N43 PolarHBondContact OE1-OD1 2.97Å; S41-N43 VanDerWaalsContact C-N 3.34Å; S41-N43 PolarHBondContact O-N 3.21Å; N43-I45 VanDerWaalsContact C-N 3.3Å; N43-I45 PolarHBondContact O-N 2.9Å; N43-R46 PolarHBondContact O-N 2.74Å; N43-R46 PolarHBondContact OD1-NH1 3.12Å; N43-Q47 VanDerWaalsContact O-CG 3.26Å; N43-Q47 WeakPolarHBondContact O-CG 3.34Å; N43-Q47 PolarHBondContact O-N 2.84Å
44	K	94.7	Very high	92.5	Very high	144 Å²	144	87.9 Å²	87.9	63%	0.626	42%	0.421	S	S	*	.	H	α-helix	trans	-61.2	-38	172.9	-73.9	172.6	-176.7	176.2	0	112.4	S40 S41 L42 K48	S40-K44 WeakPolarHBondContact O-CG 3.46Å; S40-K44 PolarHBondContact O-N 3.35Å; S40-K44 VanDerWaalsContact O-N 3.16Å; S41-K44 PolarHBondContact O-N 2.87Å; L42-K44 PolarHBondContact O-N 3.12Å; K44-K48 WeakPolarHBondContact O-CG 3.18Å; K44-K48 PolarHBondContact O-N 3.34Å; K44-K48 VanDerWaalsContact O-N 3.12Å
45	I	94.4	Very high	93.6	Very high	39 Å²	39	84 Å²	84	20%	0.2	40%	0.402	C	S	.	.	H	α-helix	trans	-65.2	-50.9	176.3	-69.1	170.7	0	0	0	110.3	L37 S41 L42 N43 Q47 K48 E49 A79	L37-I45 HydrophobicContact CD1-CD1 3.43Å; L37-I45 VanDerWaalsContact CD1-CD1 3.43Å; S41-I45 WeakPolarHBondContact O-CG1 3.44Å; S41-I45 PolarHBondContact O-N 2.72Å; L42-I45 WeakPolarHBondContact O-CB 3.3Å; L42-I45 PolarHBondContact O-N 3.21Å; L42-I45 VanDerWaalsContact O-N 3.12Å; N43-I45 VanDerWaalsContact C-N 3.3Å; N43-I45 PolarHBondContact O-N 2.9Å; I45-Q47 VanDerWaalsContact C-N 3.28Å; I45-Q47 PolarHBondContact O-N 3.27Å; I45-K48 WeakPolarHBondContact O-CA 3.42Å; I45-K48 WeakPolarHBondContact O-CB 3.49Å; I45-K48 PolarHBondContact O-N 3.41Å; I45-E49 HydrophobicContact CG2-CG 4.43Å; I45-E49 WeakPolarHBondContact CG2-OE1 3.49Å; I45-E49 WeakPolarHBondContact O-CG 3.41Å; I45-E49 PolarHBondContact O-N 2.9Å; I45-A79 HydrophobicContact CG2-CB 4.05Å
46	R	96.2	Very high	94.4	Very high	113 Å²	113	74.8 Å²	74.8	43%	0.426	37%	0.367	S	S	.	.	H	α-helix	trans	-55.9	-42.2	177.5	-67.6	174.2	-174	136.5	-1.8	112	E39 L42 N43 K48 E49 L50	E39-R46 IonicContact OE1-CZ 2.76Å; E39-R46 IonicContact OE1-NH1 3.99Å; E39-R46 PolarHBondContact OE1-NH1 3.46Å; L42-R46 WeakPolarHBondContact O-CG 3.44Å; L42-R46 PolarHBondContact O-N 3.29Å; N43-R46 PolarHBondContact O-N 2.74Å; N43-R46 PolarHBondContact OD1-NH1 3.12Å; R46-K48 PolarHBondContact O-N 2.86Å; R46-E49 WeakPolarHBondContact O-CB 3.11Å; R46-E49 PolarHBondContact O-N 3.38Å; R46-L50 WeakPolarHBondContact O-CG 3.37Å; R46-L50 PolarHBondContact O-N 3.22Å
47	Q	96.4	Very high	95.2	Very high	127 Å²	127	70.1 Å²	70.1	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-64.9	-37.6	176.7	-68.6	-59.8	-23.3	0	0	112.9	N43 I45 E49 K51	N43-Q47 VanDerWaalsContact O-CG 3.26Å; N43-Q47 WeakPolarHBondContact O-CG 3.34Å; N43-Q47 PolarHBondContact O-N 2.84Å; I45-Q47 VanDerWaalsContact C-N 3.28Å; I45-Q47 PolarHBondContact O-N 3.27Å; Q47-E49 VanDerWaalsContact C-N 3.35Å; Q47-K51 VanDerWaalsContact O-CB 3.31Å; Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 3.42Å; Q47-K51 VanDerWaalsContact O-N 3.08Å
48	K	95.5	Very high	95.7	Very high	79 Å²	79	71.6 Å²	71.6	34%	0.343	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-40.7	171.9	-74.5	-177.2	176.6	-168.5	0	111.4	K44 I45 R46 K51 W52 K76 A79	K44-K48 WeakPolarHBondContact O-CG 3.18Å; K44-K48 PolarHBondContact O-N 3.34Å; K44-K48 VanDerWaalsContact O-N 3.12Å; I45-K48 WeakPolarHBondContact O-CA 3.42Å; I45-K48 WeakPolarHBondContact O-CB 3.49Å; I45-K48 PolarHBondContact O-N 3.41Å; R46-K48 PolarHBondContact O-N 2.86Å; K48-K51 PolarHBondContact O-N 2.9Å; K48-W52 VanDerWaalsContact O-CD1 3.29Å; K48-W52 PolarHBondContact O-N 3.04Å; K48-K76 PolarHBondContact NZ-O 2.93Å; K48-A79 HydrophobicContact CB-CB 4.18Å
49	E	97.1	Very high	95.9	Very high	40 Å²	40	70 Å²	70	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-63.1	-51.5	178.7	-69	169.5	170.9	0	0	111.5	I45 R46 Q47 K51 W52 Q53 A79 A81 I82	I45-E49 HydrophobicContact CG2-CG 4.43Å; I45-E49 WeakPolarHBondContact CG2-OE1 3.49Å; I45-E49 WeakPolarHBondContact O-CG 3.41Å; I45-E49 PolarHBondContact O-N 2.9Å; R46-E49 WeakPolarHBondContact O-CB 3.11Å; R46-E49 PolarHBondContact O-N 3.38Å; Q47-E49 VanDerWaalsContact C-N 3.35Å; E49-K51 VanDerWaalsContact C-N 3.28Å; E49-K51 PolarHBondContact O-N 2.9Å; E49-W52 PolarHBondContact O-N 3.07Å; E49-W52 VanDerWaalsContact O-N 3.14Å; E49-Q53 WeakPolarHBondContact O-CG 3.09Å; E49-Q53 PolarHBondContact O-N 3.28Å; E49-A79 HydrophobicContact CG-CB 3.37Å; E49-A81 WeakPolarHBondContact OE1-CB 3.47Å; E49-I82 HydrophobicContact CG-CB 4.48Å; E49-I82 HydrophobicContact CG-CG2 4.32Å
50	L	97.2	Very high	96	Very high	83 Å²	83	70.6 Å²	70.6	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-57.7	-42	176.6	-71.5	171.5	0	0	0	111.8	R46 W52 Q53 N54	R46-L50 WeakPolarHBondContact O-CG 3.37Å; R46-L50 PolarHBondContact O-N 3.22Å; L50-W52 PolarHBondContact O-N 2.81Å; L50-Q53 PolarHBondContact O-N 2.96Å; L50-N54 VanDerWaalsContact O-CG 3.29Å; L50-N54 PolarHBondContact O-N 2.87Å; L50-N54 PolarHBondContact O-ND2 3.1Å
51	K	96.7	Very high	96.1	Very high	85 Å²	85	72.2 Å²	72.2	37%	0.37	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-45.8	176.4	-175.1	178.2	-176.2	179.3	0	112.1	Q47 K48 E49 N54 M55	Q47-K51 VanDerWaalsContact O-CB 3.31Å; Q47-K51 WeakPolarHBondContact O-CB 3.33Å; Q47-K51 PolarHBondContact O-N 3.42Å; Q47-K51 VanDerWaalsContact O-N 3.08Å; K48-K51 PolarHBondContact O-N 2.9Å; E49-K51 VanDerWaalsContact C-N 3.28Å; E49-K51 PolarHBondContact O-N 2.9Å; K51-N54 PolarHBondContact O-N 3.33Å; K51-M55 HydrophobicContact CG-SD 4.16Å; K51-M55 VanDerWaalsContact O-CG 3.27Å; K51-M55 WeakPolarHBondContact O-CG 3.3Å; K51-M55 PolarHBondContact O-N 2.78Å
52	W	97.8	Very high	96.3	Very high	3 Å²	3	72 Å²	72	1%	0.011	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-41.4	176.3	-87.5	113.7	0	0	0	111.8	K48 E49 L50 N54 M55 L56 W59 V70 Q73 I78 I82 V86	K48-W52 VanDerWaalsContact O-CD1 3.29Å; K48-W52 PolarHBondContact O-N 3.04Å; E49-W52 PolarHBondContact O-N 3.07Å; E49-W52 VanDerWaalsContact O-N 3.14Å; L50-W52 PolarHBondContact O-N 2.81Å; W52-N54 VanDerWaalsContact C-N 3.33Å; W52-N54 PolarHBondContact O-N 3.48Å; W52-M55 HydrophobicContact CE3-CB 4.42Å; W52-M55 HydrophobicContact CE3-CE 4.04Å; W52-M55 HydrophobicContact CE3-SD 4.26Å; W52-M55 HydrophobicContact CH2-CE 4.19Å; W52-M55 HydrophobicContact CZ3-CE 3.75Å; W52-M55 PolarHBondContact O-N 2.95Å; W52-M55 VanDerWaalsContact O-N 3.15Å; W52-L56 WeakPolarHBondContact O-CB 3.23Å; W52-L56 WeakPolarHBondContact O-CG 3.38Å; W52-L56 PolarHBondContact O-N 3.36Å; W52-W59 HydrophobicContact CZ3-CZ3 4.33Å; W52-V70 HydrophobicContact CH2-CG1 4.02Å; W52-V70 HydrophobicContact CZ3-CG1 4.22Å; W52-Q73 HydrophobicContact CH2-CB 3.97Å; W52-Q73 HydrophobicContact CZ2-CB 3.33Å; W52-Q73 HydrophobicContact CZ2-CG 4.38Å; W52-I78 HydrophobicContact CZ2-CD1 4.16Å; W52-I78 HydrophobicContact CZ2-CG1 3.7Å; W52-I82 HydrophobicContact CB-CG1 4.07Å; W52-I82 HydrophobicContact CB-CG2 3.96Å; W52-I82 HydrophobicContact CG-CG2 4.24Å; W52-V86 HydrophobicContact CB-CG2 4.13Å; W52-V86 HydrophobicContact CD2-CG1 4.22Å; W52-V86 HydrophobicContact CD2-CG2 3.7Å; W52-V86 HydrophobicContact CE3-CB 4.43Å; W52-V86 HydrophobicContact CE3-CG1 3.81Å; W52-V86 HydrophobicContact CE3-CG2 3.64Å; W52-V86 HydrophobicContact CG-CG2 3.95Å; W52-V86 HydrophobicContact CH2-CG1 3.69Å; W52-V86 HydrophobicContact CZ2-CG1 4.12Å; W52-V86 HydrophobicContact CZ3-CG1 3.53Å; W52-V86 HydrophobicContact CZ3-CG2 4.24Å
53	Q	97.5	Very high	96.5	Very high	79 Å²	79	72 Å²	72	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-55.6	-48.1	174.7	-73.2	174.9	-3.5	0	0	111.4	E49 L50 M55 L56 T57 I82	E49-Q53 WeakPolarHBondContact O-CG 3.09Å; E49-Q53 PolarHBondContact O-N 3.28Å; L50-Q53 PolarHBondContact O-N 2.96Å; Q53-M55 VanDerWaalsContact C-N 3.34Å; Q53-M55 PolarHBondContact O-N 2.77Å; Q53-L56 PolarHBondContact O-N 2.9Å; Q53-T57 PolarHBondContact O-N 3.31Å; Q53-T57 PolarHBondContact O-OG1 3.5Å; Q53-T57 VanDerWaalsContact O-OG1 3.13Å; Q53-I82 HydrophobicContact CG-CD1 3.81Å; Q53-I82 HydrophobicContact CG-CG1 4.43Å
54	N	96.8	Very high	96.5	Very high	106 Å²	106	77.6 Å²	77.6	57%	0.567	36%	0.361	S	S	*	.	H	α-helix	trans	-60.5	-42.2	176.3	-68.1	-18.6	0	0	0	112.4	L50 K51 W52 L56 T57 E58	L50-N54 VanDerWaalsContact O-CG 3.29Å; L50-N54 PolarHBondContact O-N 2.87Å; L50-N54 PolarHBondContact O-ND2 3.1Å; K51-N54 PolarHBondContact O-N 3.33Å; W52-N54 VanDerWaalsContact C-N 3.33Å; W52-N54 PolarHBondContact O-N 3.48Å; N54-L56 VanDerWaalsContact C-N 3.34Å; N54-L56 PolarHBondContact O-N 3.45Å; N54-T57 PolarHBondContact O-N 2.91Å; N54-E58 PolarHBondContact O-N 3.41Å
55	M	97.5	Very high	96.6	Very high	1 Å²	1	77 Å²	77	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-38.2	177.2	-69.5	170	59.6	0	0	112.6	K51 W52 Q53 E58 W59 W62 V70 Q73	K51-M55 HydrophobicContact CG-SD 4.16Å; K51-M55 VanDerWaalsContact O-CG 3.27Å; K51-M55 WeakPolarHBondContact O-CG 3.3Å; K51-M55 PolarHBondContact O-N 2.78Å; W52-M55 HydrophobicContact CE3-CB 4.42Å; W52-M55 HydrophobicContact CE3-CE 4.04Å; W52-M55 HydrophobicContact CE3-SD 4.26Å; W52-M55 HydrophobicContact CH2-CE 4.19Å; W52-M55 HydrophobicContact CZ3-CE 3.75Å; W52-M55 PolarHBondContact O-N 2.95Å; W52-M55 VanDerWaalsContact O-N 3.15Å; Q53-M55 VanDerWaalsContact C-N 3.34Å; Q53-M55 PolarHBondContact O-N 2.77Å; M55-E58 CarbonylContact O-C 3.38Å; M55-W59 VanDerWaalsContact O-CA 3.24Å; M55-W59 WeakPolarHBondContact O-CA 3.48Å; M55-W59 PolarHBondContact O-N 3.48Å; M55-W59 VanDerWaalsContact O-N 3.16Å; M55-W62 HydrophobicContact CB-CD2 4.31Å; M55-W62 HydrophobicContact CB-CG 4.27Å; M55-W62 HydrophobicContact CE-CE3 4.11Å; M55-W62 HydrophobicContact CE-CZ3 4.46Å; M55-W62 HydrophobicContact CG-CD2 3.76Å; M55-W62 HydrophobicContact CG-CE3 4.06Å; M55-W62 HydrophobicContact CG-CG 4.24Å; M55-W62 HydrophobicContact CG-CH2 4.16Å; M55-W62 HydrophobicContact CG-CZ2 3.88Å; M55-W62 HydrophobicContact CG-CZ3 4.24Å; M55-W62 HydrophobicContact SD-CE3 4.49Å; M55-W62 HydrophobicContact SD-CZ3 4.42Å; M55-V70 HydrophobicContact CE-CB 4.11Å; M55-V70 HydrophobicContact CE-CG1 4.14Å; M55-V70 HydrophobicContact CE-CG2 3.69Å; M55-Q73 HydrophobicContact CE-CG 4.05Å; M55-Q73 HydrophobicContact SD-CG 3.89Å
56	L	97.5	Very high	96.7	Very high	3 Å²	3	78.5 Å²	78.5	2%	0.016	37%	0.365	C	S	.	.	H	α-helix	trans	-73.1	-29.8	-179.9	-68.7	169.9	0	0	0	112.6	W52 Q53 N54 W59 I82 R85 V86 Y89	W52-L56 WeakPolarHBondContact O-CB 3.23Å; W52-L56 WeakPolarHBondContact O-CG 3.38Å; W52-L56 PolarHBondContact O-N 3.36Å; Q53-L56 PolarHBondContact O-N 2.9Å; N54-L56 VanDerWaalsContact C-N 3.34Å; N54-L56 PolarHBondContact O-N 3.45Å; L56-W59 HydrophobicContact CD2-CE3 4.1Å; L56-W59 HydrophobicContact CD2-CZ3 4.38Å; L56-I82 HydrophobicContact CD1-CD1 4.23Å; L56-I82 HydrophobicContact CD1-CG1 4.12Å; L56-R85 HydrophobicContact CD1-CB 4.36Å; L56-R85 HydrophobicContact CD1-CG 3.86Å; L56-V86 HydrophobicContact CD1-CG2 3.91Å; L56-V86 HydrophobicContact CD2-CG2 4.5Å; L56-Y89 HydrophobicContact CD2-CD1 3.77Å; L56-Y89 HydrophobicContact CD2-CD2 3.83Å; L56-Y89 HydrophobicContact CD2-CE1 4.34Å; L56-Y89 HydrophobicContact CD2-CE2 4.38Å; L56-Y89 HydrophobicContact CD2-CG 3.45Å; L56-Y89 VanDerWaalsContact CD2-CG 3.45Å
57	T	97	Very high	96.7	Very high	110 Å²	110	75.5 Å²	75.5	68%	0.675	36%	0.359	S	S	*	.	H	α-helix	trans	-67.1	-38.8	174.4	-61.3	0	0	0	0	111.8	Q53 N54	Q53-T57 PolarHBondContact O-N 3.31Å; Q53-T57 PolarHBondContact O-OG1 3.5Å; Q53-T57 VanDerWaalsContact O-OG1 3.13Å; N54-T57 PolarHBondContact O-N 2.91Å
58	E	95.8	Very high	96.8	Very high	87 Å²	87	73.9 Å²	73.9	41%	0.407	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	39.8	176.1	-64.2	-174	105.6	0	0	111.8	N54 M55 D60 K61 W62	N54-E58 PolarHBondContact O-N 3.41Å; M55-E58 CarbonylContact O-C 3.38Å; E58-D60 PolarHBondContact O-N 2.95Å; E58-K61 HydrophobicContact CB-CB 4.37Å; E58-K61 HydrophobicContact CB-CD 4.4Å; E58-K61 WeakPolarHBondContact O-CB 3.47Å; E58-K61 PolarHBondContact O-N 3.04Å; E58-K61 WeakPolarHBondContact OE1-CD 3.19Å; E58-K61 IonicContact OE1-NZ 3.96Å; E58-K61 PolarHBondContact OE1-NZ 3.39Å; E58-K61 IonicContact OE2-NZ 3.75Å; E58-W62 VanDerWaalsContact O-CD1 3.32Å; E58-W62 PolarHBondContact O-N 3.38Å
59	W	97.1	Very high	96.8	Very high	24 Å²	24	77.3 Å²	77.3	9%	0.091	37%	0.365	C	S	.	.	H	α-helix	trans	-53.1	-49.6	-166	-179.1	-116.6	0	0	0	114.5	W52 M55 L56 K61 W62 M63 V70 Y89 L90	W52-W59 HydrophobicContact CZ3-CZ3 4.33Å; M55-W59 VanDerWaalsContact O-CA 3.24Å; M55-W59 WeakPolarHBondContact O-CA 3.48Å; M55-W59 PolarHBondContact O-N 3.48Å; M55-W59 VanDerWaalsContact O-N 3.16Å; L56-W59 HydrophobicContact CD2-CE3 4.1Å; L56-W59 HydrophobicContact CD2-CZ3 4.38Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 2.7Å; W59-W62 PolarHBondContact O-N 3.19Å; W59-W62 VanDerWaalsContact O-N 3.14Å; W59-M63 HydrophobicContact CD2-CG 3.81Å; W59-M63 VanDerWaalsContact CE2-CG 3.4Å; W59-M63 HydrophobicContact CE3-CG 4.18Å; W59-M63 HydrophobicContact CG-CG 4.43Å; W59-M63 HydrophobicContact CH2-CG 3.84Å; W59-M63 HydrophobicContact CH2-SD 3.51Å; W59-M63 VanDerWaalsContact CH2-SD 3.51Å; W59-M63 HydrophobicContact CZ2-CE 4.42Å; W59-M63 HydrophobicContact CZ2-CG 3.45Å; W59-M63 VanDerWaalsContact CZ2-CG 3.45Å; W59-M63 HydrophobicContact CZ2-SD 3.54Å; W59-M63 VanDerWaalsContact CZ2-SD 3.54Å; W59-M63 HydrophobicContact CZ3-CG 4.19Å; W59-M63 HydrophobicContact CZ3-SD 4.13Å; W59-M63 PolarHBondContact O-N 3.43Å; W59-V70 HydrophobicContact CH2-CG1 4.03Å; W59-V70 HydrophobicContact CZ3-CG1 4.15Å; W59-Y89 HydrophobicContact CB-CD1 3.9Å; W59-Y89 HydrophobicContact CB-CE1 3.97Å; W59-Y89 AromaticContact CD1-CD1 3.67Å; W59-Y89 AromaticContact CD2-CD1 3.82Å; W59-Y89 HydrophobicContact CD2-CD1 3.82Å; W59-Y89 AromaticContact CG-CD1 3.51Å; W59-Y89 HydrophobicContact CG-CD1 3.51Å; W59-Y89 HydrophobicContact CG-CE1 4.08Å; W59-Y89 AromaticContact NE1-CD1 3.98Å; W59-L90 HydrophobicContact CH2-CD2 3.76Å; W59-L90 HydrophobicContact CH2-CG 4.41Å; W59-L90 HydrophobicContact CZ2-CD2 4.26Å
60	D	95.8	Very high	96.9	Very high	119 Å²	119	75.4 Å²	75.4	64%	0.636	36%	0.357	S	S	*	.	H	α-helix	trans	-62.8	-41.5	-176.7	-62	-33	0	0	0	111.7	E58 W62 M63 Y64	E58-D60 PolarHBondContact O-N 2.95Å; D60-W62 VanDerWaalsContact C-N 3.34Å; D60-W62 PolarHBondContact O-N 3.43Å; D60-M63 PolarHBondContact O-N 3.04Å; D60-Y64 VanDerWaalsContact O-CB 3.26Å; D60-Y64 WeakPolarHBondContact O-CB 3.48Å; D60-Y64 PolarHBondContact O-N 3.46Å
61	K	96.7	Very high	96.9	Very high	105 Å²	105	74.8 Å²	74.8	46%	0.457	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-41.2	175.3	-178.2	-175.9	178.2	179.9	0	111.6	E58 W59 H65	E58-K61 HydrophobicContact CB-CB 4.37Å; E58-K61 HydrophobicContact CB-CD 4.4Å; E58-K61 WeakPolarHBondContact O-CB 3.47Å; E58-K61 PolarHBondContact O-N 3.04Å; E58-K61 WeakPolarHBondContact OE1-CD 3.19Å; E58-K61 IonicContact OE1-NZ 3.96Å; E58-K61 PolarHBondContact OE1-NZ 3.39Å; E58-K61 IonicContact OE2-NZ 3.75Å; W59-K61 VanDerWaalsContact C-N 3.34Å; W59-K61 PolarHBondContact O-N 2.7Å; K61-H65 WeakPolarHBondContact O-CB 3.4Å; K61-H65 PolarHBondContact O-CD2 3.37Å; K61-H65 PolarHBondContact O-N 3.36Å
62	W	96.9	Very high	96.9	Very high	36 Å²	36	74.1 Å²	74.1	14%	0.136	35%	0.349	C	S	.	.	H	α-helix	trans	-68.6	-40.9	176.9	-84.4	93	0	0	0	112.4	M55 E58 W59 D60 K66 T67 R69 V70	M55-W62 HydrophobicContact CB-CD2 4.31Å; M55-W62 HydrophobicContact CB-CG 4.27Å; M55-W62 HydrophobicContact CE-CE3 4.11Å; M55-W62 HydrophobicContact CE-CZ3 4.46Å; M55-W62 HydrophobicContact CG-CD2 3.76Å; M55-W62 HydrophobicContact CG-CE3 4.06Å; M55-W62 HydrophobicContact CG-CG 4.24Å; M55-W62 HydrophobicContact CG-CH2 4.16Å; M55-W62 HydrophobicContact CG-CZ2 3.88Å; M55-W62 HydrophobicContact CG-CZ3 4.24Å; M55-W62 HydrophobicContact SD-CE3 4.49Å; M55-W62 HydrophobicContact SD-CZ3 4.42Å; E58-W62 VanDerWaalsContact O-CD1 3.32Å; E58-W62 PolarHBondContact O-N 3.38Å; W59-W62 PolarHBondContact O-N 3.19Å; W59-W62 VanDerWaalsContact O-N 3.14Å; D60-W62 VanDerWaalsContact C-N 3.34Å; D60-W62 PolarHBondContact O-N 3.43Å; W62-K66 HydrophobicContact CD2-CB 4.31Å; W62-K66 HydrophobicContact CD2-CD 3.98Å; W62-K66 HydrophobicContact CE3-CB 3.5Å; W62-K66 HydrophobicContact CE3-CD 3.57Å; W62-K66 HydrophobicContact CE3-CG 4.17Å; W62-K66 HydrophobicContact CH2-CD 3.9Å; W62-K66 HydrophobicContact CZ2-CD 4.26Å; W62-K66 HydrophobicContact CZ3-CB 3.95Å; W62-K66 HydrophobicContact CZ3-CD 3.54Å; W62-K66 HydrophobicContact CZ3-CG 4.36Å; W62-K66 CarbonylContact O-C 3.04Å; W62-K66 WeakPolarHBondContact O-CA 3.2Å; W62-K66 WeakPolarHBondContact O-CB 3.39Å; W62-K66 PolarHBondContact O-N 2.83Å; W62-T67 PolarHBondContact O-N 2.85Å; W62-R69 HydrophobicContact CZ3-CB 4.06Å; W62-V70 HydrophobicContact CB-CG2 4.27Å; W62-V70 HydrophobicContact CE3-CG2 4.39Å
63	M	96.5	Very high	96.9	Very high	59 Å²	59	75 Å²	75	29%	0.291	35%	0.353	S	S	.	.	H	α-helix	trans	-71.4	-32.6	179.1	-74.4	-57	-64	0	0	112.8	W59 D60 T67 V70 F263	W59-M63 HydrophobicContact CD2-CG 3.81Å; W59-M63 VanDerWaalsContact CE2-CG 3.4Å; W59-M63 HydrophobicContact CE3-CG 4.18Å; W59-M63 HydrophobicContact CG-CG 4.43Å; W59-M63 HydrophobicContact CH2-CG 3.84Å; W59-M63 HydrophobicContact CH2-SD 3.51Å; W59-M63 VanDerWaalsContact CH2-SD 3.51Å; W59-M63 HydrophobicContact CZ2-CE 4.42Å; W59-M63 HydrophobicContact CZ2-CG 3.45Å; W59-M63 VanDerWaalsContact CZ2-CG 3.45Å; W59-M63 HydrophobicContact CZ2-SD 3.54Å; W59-M63 VanDerWaalsContact CZ2-SD 3.54Å; W59-M63 HydrophobicContact CZ3-CG 4.19Å; W59-M63 HydrophobicContact CZ3-SD 4.13Å; W59-M63 PolarHBondContact O-N 3.43Å; D60-M63 PolarHBondContact O-N 3.04Å; M63-T67 HydrophobicContact CE-CG2 4.31Å; M63-T67 PolarHBondContact O-OG1 3.2Å; M63-V70 HydrophobicContact SD-CB 4.35Å; M63-V70 HydrophobicContact SD-CG1 4.09Å; M63-V70 HydrophobicContact SD-CG2 4.08Å; M63-F263 HydrophobicContact CE-CE2 3.96Å; M63-F263 HydrophobicContact SD-CE2 4.01Å
64	Y	96	Very high	97	Very high	187 Å²	187	71.2 Å²	71.2	73%	0.733	34%	0.336	S	S	*	.	H	α-helix	trans	-79.7	-45.1	178.6	-173.1	-101.7	0	0	0	112.8	D60	D60-Y64 VanDerWaalsContact O-CB 3.26Å; D60-Y64 WeakPolarHBondContact O-CB 3.48Å; D60-Y64 PolarHBondContact O-N 3.46Å
65	H	96.4	Very high	97	Very high	132 Å²	132	68.4 Å²	68.4	61%	0.611	32%	0.317	S	S	*	.	H	α-helix	trans	-102.1	-19.5	-173.4	-62	-68.7	0	0	0	115.2	K61	K61-H65 WeakPolarHBondContact O-CB 3.4Å; K61-H65 PolarHBondContact O-CD2 3.37Å; K61-H65 PolarHBondContact O-N 3.36Å
66	K	96.4	Very high	97	Very high	70 Å²	70	74.4 Å²	74.4	30%	0.304	34%	0.343	S	S	.	.			trans	-135.4	29.3	-166.8	-63.9	178.9	-177.1	170.2	0	112.6	W62 D68 R69 V70	W62-K66 HydrophobicContact CD2-CB 4.31Å; W62-K66 HydrophobicContact CD2-CD 3.98Å; W62-K66 HydrophobicContact CE3-CB 3.5Å; W62-K66 HydrophobicContact CE3-CD 3.57Å; W62-K66 HydrophobicContact CE3-CG 4.17Å; W62-K66 HydrophobicContact CH2-CD 3.9Å; W62-K66 HydrophobicContact CZ2-CD 4.26Å; W62-K66 HydrophobicContact CZ3-CB 3.95Å; W62-K66 HydrophobicContact CZ3-CD 3.54Å; W62-K66 HydrophobicContact CZ3-CG 4.36Å; W62-K66 CarbonylContact O-C 3.04Å; W62-K66 WeakPolarHBondContact O-CA 3.2Å; W62-K66 WeakPolarHBondContact O-CB 3.39Å; W62-K66 PolarHBondContact O-N 2.83Å; K66-D68 VanDerWaalsContact C-N 3.27Å; K66-D68 PolarHBondContact O-N 3.33Å; K66-R69 HydrophobicContact CB-CB 4.34Å; K66-R69 HydrophobicContact CB-CG 4.46Å; K66-R69 WeakPolarHBondContact O-CA 3.26Å; K66-R69 WeakPolarHBondContact O-CB 3.36Å; K66-R69 PolarHBondContact O-N 3Å; K66-V70 PolarHBondContact O-N 3.13Å; K66-V70 VanDerWaalsContact O-N 3.14Å
67	T	96.8	Very high	97	Very high	50 Å²	50	74.4 Å²	74.4	31%	0.307	34%	0.344	S	S	.	.	H	α-helix	trans	-52.2	-42.3	-176.9	-33.1	0	0	0	0	112.3	W62 M63 R69 V70 R71 F263	W62-T67 PolarHBondContact O-N 2.85Å; M63-T67 HydrophobicContact CE-CG2 4.31Å; M63-T67 PolarHBondContact O-OG1 3.2Å; T67-R69 VanDerWaalsContact C-N 3.31Å; T67-R69 PolarHBondContact O-N 3.28Å; T67-V70 WeakPolarHBondContact O-CB 3.48Å; T67-V70 PolarHBondContact O-N 3.41Å; T67-R71 PolarHBondContact O-N 3.09Å; T67-F263 HydrophobicContact CG2-CE2 4.34Å; T67-F263 HydrophobicContact CG2-CZ 3.65Å; T67-F263 WeakPolarHBondContact O-CZ 3.35Å
68	D	97	Very high	97	Very high	94 Å²	94	69.4 Å²	69.4	50%	0.503	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-34	177.5	-68.6	-28.6	0	0	0	112.9	K66 R71 N72	K66-D68 VanDerWaalsContact C-N 3.27Å; K66-D68 PolarHBondContact O-N 3.33Å; D68-R71 WeakPolarHBondContact O-CB 3.46Å; D68-R71 PolarHBondContact O-N 3.38Å; D68-R71 IonicContact OD1-CZ 3.94Å; D68-R71 IonicContact OD1-NH1 3.69Å; D68-R71 PolarHBondContact OD1-NH1 2.96Å; D68-R71 IonicContact OD1-NH2 3.94Å; D68-R71 PolarHBondContact OD1-NH2 3.17Å; D68-N72 WeakPolarHBondContact O-CB 3.49Å; D68-N72 VanDerWaalsContact O-CG 3.22Å; D68-N72 PolarHBondContact O-N 2.84Å; D68-N72 PolarHBondContact O-ND2 2.9Å
69	R	97.1	Very high	97	Very high	150 Å²	150	65.5 Å²	65.5	57%	0.566	30%	0.296	S	S	*	.	H	α-helix	trans	-70.6	-36.8	176.3	-61.3	-173.5	-180	-171.6	1.4	111.2	W62 K66 T67 N72 Q73	W62-R69 HydrophobicContact CZ3-CB 4.06Å; K66-R69 HydrophobicContact CB-CB 4.34Å; K66-R69 HydrophobicContact CB-CG 4.46Å; K66-R69 WeakPolarHBondContact O-CA 3.26Å; K66-R69 WeakPolarHBondContact O-CB 3.36Å; K66-R69 PolarHBondContact O-N 3Å; T67-R69 VanDerWaalsContact C-N 3.31Å; T67-R69 PolarHBondContact O-N 3.28Å; R69-N72 PolarHBondContact O-N 2.95Å; R69-Q73 WeakPolarHBondContact O-CG 3.49Å; R69-Q73 PolarHBondContact O-N 2.71Å
70	V	98.1	Very high	96.8	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.9	-47.8	172.6	-174.4	0	0	0	0	109.9	W52 M55 W59 W62 M63 K66 T67 N72 Q73 C74 L90 F263	W52-V70 HydrophobicContact CH2-CG1 4.02Å; W52-V70 HydrophobicContact CZ3-CG1 4.22Å; M55-V70 HydrophobicContact CE-CB 4.11Å; M55-V70 HydrophobicContact CE-CG1 4.14Å; M55-V70 HydrophobicContact CE-CG2 3.69Å; W59-V70 HydrophobicContact CH2-CG1 4.03Å; W59-V70 HydrophobicContact CZ3-CG1 4.15Å; W62-V70 HydrophobicContact CB-CG2 4.27Å; W62-V70 HydrophobicContact CE3-CG2 4.39Å; M63-V70 HydrophobicContact SD-CB 4.35Å; M63-V70 HydrophobicContact SD-CG1 4.09Å; M63-V70 HydrophobicContact SD-CG2 4.08Å; K66-V70 PolarHBondContact O-N 3.13Å; K66-V70 VanDerWaalsContact O-N 3.14Å; T67-V70 WeakPolarHBondContact O-CB 3.48Å; T67-V70 PolarHBondContact O-N 3.41Å; V70-N72 VanDerWaalsContact C-N 3.28Å; V70-N72 PolarHBondContact O-N 3.37Å; V70-Q73 PolarHBondContact O-N 2.96Å; V70-C74 PolarHBondContact O-N 3.39Å; V70-C74 PolarHBondContact O-SG 3.45Å; V70-L90 HydrophobicContact CG1-CD2 4.44Å; V70-F263 HydrophobicContact CB-CD2 4.36Å; V70-F263 HydrophobicContact CB-CE2 3.66Å; V70-F263 HydrophobicContact CB-CZ 4.22Å; V70-F263 HydrophobicContact CG1-CD2 3.72Å; V70-F263 HydrophobicContact CG1-CE2 3.46Å; V70-F263 VanDerWaalsContact CG1-CE2 3.46Å; V70-F263 HydrophobicContact CG1-CZ 4.44Å
71	R	97.8	Very high	96.7	Very high	70 Å²	70	64.7 Å²	64.7	26%	0.264	31%	0.307	S	S	.	.	H	α-helix	trans	-51.4	-49.1	173.5	-166	-174	-56.8	125.1	9.8	111.5	T67 D68 Q73 C74 R75 F263 E264	T67-R71 PolarHBondContact O-N 3.09Å; D68-R71 WeakPolarHBondContact O-CB 3.46Å; D68-R71 PolarHBondContact O-N 3.38Å; D68-R71 IonicContact OD1-CZ 3.94Å; D68-R71 IonicContact OD1-NH1 3.69Å; D68-R71 PolarHBondContact OD1-NH1 2.96Å; D68-R71 IonicContact OD1-NH2 3.94Å; D68-R71 PolarHBondContact OD1-NH2 3.17Å; R71-Q73 VanDerWaalsContact C-N 3.31Å; R71-Q73 PolarHBondContact O-N 3.2Å; R71-C74 WeakPolarHBondContact O-CB 3.23Å; R71-C74 PolarHBondContact O-N 3.46Å; R71-C74 VanDerWaalsContact O-N 3.15Å; R71-R75 WeakPolarHBondContact O-CG 3.47Å; R71-R75 PolarHBondContact O-N 3.39Å; R71-F263 HydrophobicContact CB-CD1 3.81Å; R71-F263 HydrophobicContact CB-CE1 3.29Å; R71-F263 HydrophobicContact CB-CZ 3.82Å; R71-F263 HydrophobicContact CG-CD1 3.72Å; R71-F263 HydrophobicContact CG-CE1 3.56Å; R71-E264 HydrophobicContact CG-CG 3.97Å
72	N	97.6	Very high	96.8	Very high	71 Å²	71	60.3 Å²	60.3	38%	0.38	29%	0.288	S	S	.	.	H	α-helix	trans	-67.4	-29.7	-178.8	-71.2	-21.6	0	0	0	112.7	D68 R69 V70 K76	D68-N72 WeakPolarHBondContact O-CB 3.49Å; D68-N72 VanDerWaalsContact O-CG 3.22Å; D68-N72 PolarHBondContact O-N 2.84Å; D68-N72 PolarHBondContact O-ND2 2.9Å; R69-N72 PolarHBondContact O-N 2.95Å; V70-N72 VanDerWaalsContact C-N 3.28Å; V70-N72 PolarHBondContact O-N 3.37Å; N72-K76 WeakPolarHBondContact O-CB 3.2Å; N72-K76 VanDerWaalsContact O-CG 3.25Å; N72-K76 WeakPolarHBondContact O-CG 3.09Å; N72-K76 PolarHBondContact O-N 2.81Å; N72-K76 VanDerWaalsContact O-N 3.14Å
73	Q	97.7	Very high	96.8	Very high	21 Å²	21	59 Å²	59	10%	0.098	28%	0.283	C	S	.	.	H	α-helix	trans	-68.4	-41	170.4	-66	-34.4	-70.8	0	0	111.7	W52 M55 R69 V70 R71 R75 K76 G77	W52-Q73 HydrophobicContact CH2-CB 3.97Å; W52-Q73 HydrophobicContact CZ2-CB 3.33Å; W52-Q73 HydrophobicContact CZ2-CG 4.38Å; M55-Q73 HydrophobicContact CE-CG 4.05Å; M55-Q73 HydrophobicContact SD-CG 3.89Å; R69-Q73 WeakPolarHBondContact O-CG 3.49Å; R69-Q73 PolarHBondContact O-N 2.71Å; V70-Q73 PolarHBondContact O-N 2.96Å; R71-Q73 VanDerWaalsContact C-N 3.31Å; R71-Q73 PolarHBondContact O-N 3.2Å; Q73-R75 PolarHBondContact O-N 3.43Å; Q73-K76 PolarHBondContact O-N 2.7Å; Q73-G77 PolarHBondContact O-N 3.24Å
74	C	98.2	Very high	96.9	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-46.5	176.3	-59.4	0	0	0	0	111	V70 R71 K76 G77 D259 F263	V70-C74 PolarHBondContact O-N 3.39Å; V70-C74 PolarHBondContact O-SG 3.45Å; R71-C74 WeakPolarHBondContact O-CB 3.23Å; R71-C74 PolarHBondContact O-N 3.46Å; R71-C74 VanDerWaalsContact O-N 3.15Å; C74-K76 VanDerWaalsContact C-N 3.3Å; C74-K76 PolarHBondContact O-N 2.94Å; C74-G77 PolarHBondContact O-N 3.35Å; C74-D259 WeakPolarHBondContact CB-O 3.38Å; C74-F263 HydrophobicContact CB-CB 4.22Å
75	R	97.7	Very high	97	Very high	47 Å²	47	53 Å²	53	18%	0.177	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-34.7	175.6	-69.2	-179.5	178.6	179.2	-3.1	113.4	R71 Q73 G77 R256 M260 E264 F318	R71-R75 WeakPolarHBondContact O-CG 3.47Å; R71-R75 PolarHBondContact O-N 3.39Å; Q73-R75 PolarHBondContact O-N 3.43Å; R75-G77 PolarHBondContact O-N 2.83Å; R75-R256 PolarHBondContact O-NH2 2.87Å; R75-M260 HydrophobicContact CG-CG 4.14Å; R75-M260 HydrophobicContact CG-SD 4.07Å; R75-E264 IonicContact CZ-OE1 2.68Å; R75-E264 IonicContact CZ-OE2 2.86Å; R75-E264 IonicContact NE-OE1 2.72Å; R75-E264 PolarHBondContact NE-OE1 3.42Å; R75-E264 IonicContact NE-OE2 3.04Å; R75-E264 IonicContact NH2-OE1 2.92Å; R75-E264 PolarHBondContact NH2-OE1 3.33Å; R75-E264 IonicContact NH2-OE2 2.71Å; R75-E264 PolarHBondContact NH2-OE2 3.2Å; R75-F318 HydrophobicContact CB-CE1 3.79Å; R75-F318 HydrophobicContact CB-CZ 3.93Å; R75-F318 HydrophobicContact CG-CE1 3.8Å; R75-F318 HydrophobicContact CG-CZ 4.44Å
76	K	96.3	Very high	97.1	Very high	127 Å²	127	46.7 Å²	46.7	55%	0.552	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.3	175.3	-75.3	177.9	179.5	-168	0	114.1	K48 N72 Q73 C74 R256	K48-K76 PolarHBondContact NZ-O 2.93Å; N72-K76 WeakPolarHBondContact O-CB 3.2Å; N72-K76 VanDerWaalsContact O-CG 3.25Å; N72-K76 WeakPolarHBondContact O-CG 3.09Å; N72-K76 PolarHBondContact O-N 2.81Å; N72-K76 VanDerWaalsContact O-N 3.14Å; Q73-K76 PolarHBondContact O-N 2.7Å; C74-K76 VanDerWaalsContact C-N 3.3Å; C74-K76 PolarHBondContact O-N 2.94Å; K76-R256 VanDerWaalsContact C-NH2 3.35Å
77	G	97.3	Very high	97.2	Very high	4 Å²	4	43.3 Å²	43.3	4%	0.041	22%	0.215	C	C	.	.			trans	82.9	134.4	-176.1	0	0	0	0	0	112.8	Q73 C74 R75	Q73-G77 PolarHBondContact O-N 3.24Å; C74-G77 PolarHBondContact O-N 3.35Å; R75-G77 PolarHBondContact O-N 2.83Å
78	I	97.8	Very high	97.2	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	21%	0.208	C	C	.	.			trans	-85.4	139.9	176.2	-57.7	166.9	0	0	0	108.4	W52 I82 R83 V86 L90 D259	W52-I78 HydrophobicContact CZ2-CD1 4.16Å; W52-I78 HydrophobicContact CZ2-CG1 3.7Å; I78-I82 HydrophobicContact CG2-CG2 3.82Å; I78-R83 HydrophobicContact CB-CG 4.47Å; I78-R83 HydrophobicContact CG2-CB 3.99Å; I78-R83 HydrophobicContact CG2-CG 4.34Å; I78-R83 PolarHBondContact O-NH2 3.39Å; I78-V86 HydrophobicContact CD1-CB 4.08Å; I78-V86 HydrophobicContact CD1-CG1 3.42Å; I78-V86 VanDerWaalsContact CD1-CG1 3.42Å; I78-V86 HydrophobicContact CG1-CG1 4.24Å; I78-V86 HydrophobicContact CG2-CB 4.07Å; I78-V86 HydrophobicContact CG2-CG1 4.39Å; I78-V86 HydrophobicContact CG2-CG2 3.9Å; I78-L90 HydrophobicContact CD1-CD1 4.18Å; I78-D259 HydrophobicContact CD1-CB 3.86Å; I78-D259 WeakPolarHBondContact CD1-OD1 3.45Å; I78-D259 HydrophobicContact CG1-CB 4.08Å; I78-D259 PolarHBondContact N-OD2 2.96Å
79	A	95.9	Very high	97.3	Very high	4 Å²	4	40.7 Å²	40.7	3%	0.033	19%	0.194	C	C	.	.			trans	-69.7	146.6	179.9	0	0	0	0	0	111.6	I45 K48 E49 A81 I82 R83	I45-A79 HydrophobicContact CG2-CB 4.05Å; K48-A79 HydrophobicContact CB-CB 4.18Å; E49-A79 HydrophobicContact CG-CB 3.37Å; A79-A81 PolarHBondContact O-N 2.95Å; A79-I82 HydrophobicContact CB-CG2 4.18Å; A79-I82 PolarHBondContact O-N 3.27Å; A79-R83 WeakPolarHBondContact O-CB 3.18Å; A79-R83 PolarHBondContact O-N 3.46Å; A79-R83 VanDerWaalsContact O-N 3.07Å
80	P	92.9	Very high	97.3	Very high	48 Å²	48	34.1 Å²	34.1	31%	0.312	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-49.9	-172.2	-28	35.6	0	0	0	115.8	I82 R83	P80-I82 VanDerWaalsContact C-N 3.3Å; P80-I82 PolarHBondContact O-N 3.21Å; P80-R83 PolarHBondContact O-N 3.38Å
81	A	94.2	Very high	97.3	Very high	79 Å²	79	34.3 Å²	34.3	65%	0.653	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-29.2	-172.9	0	0	0	0	0	113.5	E49 A79	E49-A81 WeakPolarHBondContact OE1-CB 3.47Å; A79-A81 PolarHBondContact O-N 2.95Å
82	I	97.5	Very high	97.2	Very high	12 Å²	12	31.6 Å²	31.6	6%	0.062	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.2	-177.9	-157.4	62.9	0	0	0	113	E49 W52 Q53 L56 I78 A79 P80 P84 R85 V86	E49-I82 HydrophobicContact CG-CB 4.48Å; E49-I82 HydrophobicContact CG-CG2 4.32Å; W52-I82 HydrophobicContact CB-CG1 4.07Å; W52-I82 HydrophobicContact CB-CG2 3.96Å; W52-I82 HydrophobicContact CG-CG2 4.24Å; Q53-I82 HydrophobicContact CG-CD1 3.81Å; Q53-I82 HydrophobicContact CG-CG1 4.43Å; L56-I82 HydrophobicContact CD1-CD1 4.23Å; L56-I82 HydrophobicContact CD1-CG1 4.12Å; I78-I82 HydrophobicContact CG2-CG2 3.82Å; A79-I82 HydrophobicContact CB-CG2 4.18Å; A79-I82 PolarHBondContact O-N 3.27Å; P80-I82 VanDerWaalsContact C-N 3.3Å; P80-I82 PolarHBondContact O-N 3.21Å; I82-P84 VanDerWaalsContact C-CD 3.4Å; I82-R85 HydrophobicContact CD1-CB 4.31Å; I82-R85 PolarHBondContact O-N 3.18Å; I82-R85 VanDerWaalsContact O-N 3.14Å; I82-V86 HydrophobicContact CG1-CG2 4.09Å; I82-V86 HydrophobicContact CG2-CG2 4.14Å; I82-V86 WeakPolarHBondContact O-CG2 3.45Å; I82-V86 PolarHBondContact O-N 2.97Å
83	R	97.9	Very high	97.2	Very high	8 Å²	8	28.2 Å²	28.2	3%	0.03	15%	0.147	C	C	.	.	H	α-helix	trans	-50.8	-46.3	-177.1	-172.4	177.3	-59.4	111.7	-0.2	114.3	I78 A79 P80 R85 V86 W87 D259	I78-R83 HydrophobicContact CB-CG 4.47Å; I78-R83 HydrophobicContact CG2-CB 3.99Å; I78-R83 HydrophobicContact CG2-CG 4.34Å; I78-R83 PolarHBondContact O-NH2 3.39Å; A79-R83 WeakPolarHBondContact O-CB 3.18Å; A79-R83 PolarHBondContact O-N 3.46Å; A79-R83 VanDerWaalsContact O-N 3.07Å; P80-R83 PolarHBondContact O-N 3.38Å; R83-R85 VanDerWaalsContact C-N 3.32Å; R83-R85 PolarHBondContact O-N 3.33Å; R83-V86 PolarHBondContact O-N 3.27Å; R83-W87 HydrophobicContact CG-CD2 3.76Å; R83-W87 HydrophobicContact CG-CE3 4.33Å; R83-W87 HydrophobicContact CG-CG 4.19Å; R83-W87 HydrophobicContact CG-CH2 4.25Å; R83-W87 HydrophobicContact CG-CZ2 3.7Å; R83-W87 PolarHBondContact O-N 3.01Å; R83-D259 IonicContact NE-OD1 2.76Å; R83-D259 PolarHBondContact NE-OD1 3.25Å; R83-D259 IonicContact NE-OD2 3.95Å
84	P	97.8	Very high	97.1	Very high	23 Å²	23	29.5 Å²	29.5	15%	0.149	15%	0.153	C	C	.	.	H	α-helix	trans	-56.2	-47.8	179.1	-26.1	37.1	0	0	0	111.8	I82 W87 K88 H175 M176	I82-P84 VanDerWaalsContact C-CD 3.4Å; P84-W87 PolarHBondContact O-N 2.98Å; P84-K88 WeakPolarHBondContact O-CG 3.36Å; P84-K88 PolarHBondContact O-N 2.89Å; P84-K88 VanDerWaalsContact O-N 3.16Å; P84-H175 HydrophobicContact CG-CB 4.17Å; P84-H175 WeakPolarHBondContact CG-O 3.24Å; P84-M176 HydrophobicContact CB-CB 3.98Å
85	R	98.1	Very high	97	Very high	97 Å²	97	34 Å²	34	37%	0.366	17%	0.174	S	C	.	.	H	α-helix	trans	-65.1	-44.7	179.4	-169.5	178.5	171.6	-177.4	-3.6	111	L56 I82 R83 W87 K88 Y89	L56-R85 HydrophobicContact CD1-CB 4.36Å; L56-R85 HydrophobicContact CD1-CG 3.86Å; I82-R85 HydrophobicContact CD1-CB 4.31Å; I82-R85 PolarHBondContact O-N 3.18Å; I82-R85 VanDerWaalsContact O-N 3.14Å; R83-R85 VanDerWaalsContact C-N 3.32Å; R83-R85 PolarHBondContact O-N 3.33Å; R85-W87 PolarHBondContact O-N 3.06Å; R85-K88 PolarHBondContact O-N 2.81Å; R85-Y89 HydrophobicContact CG-CD2 4.15Å; R85-Y89 HydrophobicContact CG-CE2 3.99Å; R85-Y89 VanDerWaalsContact O-CD2 3.25Å; R85-Y89 WeakPolarHBondContact O-CD2 3.45Å; R85-Y89 PolarHBondContact O-N 3.19Å
86	V	98.5	Very high	97	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-46.3	179	178.3	0	0	0	0	111.3	W52 L56 I78 I82 R83 K88 Y89 L90	W52-V86 HydrophobicContact CB-CG2 4.13Å; W52-V86 HydrophobicContact CD2-CG1 4.22Å; W52-V86 HydrophobicContact CD2-CG2 3.7Å; W52-V86 HydrophobicContact CE3-CB 4.43Å; W52-V86 HydrophobicContact CE3-CG1 3.81Å; W52-V86 HydrophobicContact CE3-CG2 3.64Å; W52-V86 HydrophobicContact CG-CG2 3.95Å; W52-V86 HydrophobicContact CH2-CG1 3.69Å; W52-V86 HydrophobicContact CZ2-CG1 4.12Å; W52-V86 HydrophobicContact CZ3-CG1 3.53Å; W52-V86 HydrophobicContact CZ3-CG2 4.24Å; L56-V86 HydrophobicContact CD1-CG2 3.91Å; L56-V86 HydrophobicContact CD2-CG2 4.5Å; I78-V86 HydrophobicContact CD1-CB 4.08Å; I78-V86 HydrophobicContact CD1-CG1 3.42Å; I78-V86 VanDerWaalsContact CD1-CG1 3.42Å; I78-V86 HydrophobicContact CG1-CG1 4.24Å; I78-V86 HydrophobicContact CG2-CB 4.07Å; I78-V86 HydrophobicContact CG2-CG1 4.39Å; I78-V86 HydrophobicContact CG2-CG2 3.9Å; I82-V86 HydrophobicContact CG1-CG2 4.09Å; I82-V86 HydrophobicContact CG2-CG2 4.14Å; I82-V86 WeakPolarHBondContact O-CG2 3.45Å; I82-V86 PolarHBondContact O-N 2.97Å; R83-V86 PolarHBondContact O-N 3.27Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.34Å; V86-Y89 PolarHBondContact O-N 3.18Å; V86-Y89 VanDerWaalsContact O-N 3.12Å; V86-L90 HydrophobicContact CG1-CD1 3.71Å; V86-L90 HydrophobicContact CG1-CG 3.99Å; V86-L90 VanDerWaalsContact O-CG 3.28Å; V86-L90 WeakPolarHBondContact O-CG 3.34Å; V86-L90 PolarHBondContact O-N 3.03Å
87	W	98.6	Very high	97	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-43.5	177.8	-71.3	-5.6	0	0	0	112.2	R83 P84 R85 Y89 L90 C91 L172 H175 M176 L255 W258 D259 F262	R83-W87 HydrophobicContact CG-CD2 3.76Å; R83-W87 HydrophobicContact CG-CE3 4.33Å; R83-W87 HydrophobicContact CG-CG 4.19Å; R83-W87 HydrophobicContact CG-CH2 4.25Å; R83-W87 HydrophobicContact CG-CZ2 3.7Å; R83-W87 PolarHBondContact O-N 3.01Å; P84-W87 PolarHBondContact O-N 2.98Å; R85-W87 PolarHBondContact O-N 3.06Å; W87-Y89 VanDerWaalsContact C-N 3.29Å; W87-Y89 PolarHBondContact O-N 3.28Å; W87-L90 PolarHBondContact O-N 3.11Å; W87-C91 PolarHBondContact O-N 2.82Å; W87-C91 PolarHBondContact O-SG 3.47Å; W87-L172 HydrophobicContact CE3-CD2 4.16Å; W87-L172 HydrophobicContact CZ3-CD2 4.23Å; W87-H175 HydrophobicContact CZ3-CB 4.26Å; W87-M176 HydrophobicContact CE3-CE 3.72Å; W87-M176 HydrophobicContact CZ3-CE 4.3Å; W87-L255 HydrophobicContact CH2-CD2 3.83Å; W87-L255 HydrophobicContact CZ2-CD2 4.28Å; W87-W258 HydrophobicContact CE3-CE3 4.45Å; W87-W258 HydrophobicContact CH2-CB 4.2Å; W87-W258 HydrophobicContact CH2-CD2 4.28Å; W87-W258 AromaticContact CH2-CE3 3.45Å; W87-W258 HydrophobicContact CH2-CE3 3.45Å; W87-W258 VanDerWaalsContact CH2-CE3 3.45Å; W87-W258 HydrophobicContact CH2-CZ3 4.19Å; W87-W258 HydrophobicContact CZ2-CB 3.58Å; W87-W258 AromaticContact CZ2-CE3 3.95Å; W87-W258 HydrophobicContact CZ2-CE3 3.95Å; W87-W258 HydrophobicContact CZ2-CG 4.43Å; W87-W258 AromaticContact CZ3-CE3 3.74Å; W87-W258 HydrophobicContact CZ3-CE3 3.74Å; W87-W258 HydrophobicContact CZ3-CZ3 4.11Å; W87-D259 PolarHBondContact NE1-OD1 3.19Å; W87-F262 HydrophobicContact CB-CD2 4.11Å; W87-F262 HydrophobicContact CB-CE1 4.37Å; W87-F262 HydrophobicContact CB-CE2 3.96Å; W87-F262 HydrophobicContact CB-CG 4.41Å; W87-F262 HydrophobicContact CB-CZ 4.08Å; W87-F262 AromaticContact CD1-CD2 3.44Å; W87-F262 VanDerWaalsContact CD1-CD2 3.44Å; W87-F262 AromaticContact CD1-CE2 3.86Å; W87-F262 AromaticContact CD2-CD2 3.76Å; W87-F262 HydrophobicContact CD2-CD2 3.76Å; W87-F262 AromaticContact CD2-CE2 3.34Å; W87-F262 HydrophobicContact CD2-CE2 3.34Å; W87-F262 HydrophobicContact CD2-CZ 4.1Å; W87-F262 AromaticContact CE2-CD2 3.74Å; W87-F262 AromaticContact CE2-CE2 3.6Å; W87-F262 AromaticContact CE3-CE2 3.77Å; W87-F262 HydrophobicContact CE3-CE2 3.77Å; W87-F262 HydrophobicContact CE3-CZ 4.25Å; W87-F262 AromaticContact CG-CD2 3.52Å; W87-F262 HydrophobicContact CG-CD2 3.52Å; W87-F262 AromaticContact CG-CE2 3.47Å; W87-F262 HydrophobicContact CG-CE2 3.47Å; W87-F262 VanDerWaalsContact CG-CE2 3.47Å; W87-F262 HydrophobicContact CG-CG 4.21Å; W87-F262 HydrophobicContact CG-CZ 4.1Å; W87-F262 HydrophobicContact CZ2-CE2 4.17Å; W87-F262 HydrophobicContact CZ3-CE2 4.38Å; W87-F262 AromaticContact NE1-CD2 3.6Å; W87-F262 AromaticContact NE1-CE2 3.95Å
88	K	98.1	Very high	97	Very high	36 Å²	36	37.8 Å²	37.8	16%	0.157	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-36.8	175.9	-67.4	-169.6	-59.3	-173.2	0	113.6	P84 R85 V86 G92 S93 H94 D180	P84-K88 WeakPolarHBondContact O-CG 3.36Å; P84-K88 PolarHBondContact O-N 2.89Å; P84-K88 VanDerWaalsContact O-N 3.16Å; R85-K88 PolarHBondContact O-N 2.81Å; V86-K88 VanDerWaalsContact C-N 3.32Å; V86-K88 PolarHBondContact O-N 3.34Å; K88-G92 CarbonylContact O-C 3.07Å; K88-G92 WeakPolarHBondContact O-CA 3.43Å; K88-G92 PolarHBondContact O-N 2.84Å; K88-S93 VanDerWaalsContact CA-OG 3.29Å; K88-S93 WeakPolarHBondContact CA-OG 3.32Å; K88-S93 WeakPolarHBondContact CB-OG 3.42Å; K88-S93 WeakPolarHBondContact CG-OG 3.47Å; K88-S93 PolarHBondContact O-N 3.1Å; K88-H94 HydrophobicContact CB-CB 4.29Å; K88-H94 PolarHBondContact O-ND1 3.48Å; K88-D180 HydrophobicContact CD-CB 4Å; K88-D180 VanDerWaalsContact CD-OD1 3.3Å; K88-D180 WeakPolarHBondContact CD-OD1 3.37Å; K88-D180 IonicContact NZ-OD1 2.73Å; K88-D180 PolarHBondContact NZ-OD1 2.96Å; K88-D180 IonicContact NZ-OD2 2.74Å; K88-D180 PolarHBondContact NZ-OD2 3.15Å
89	Y	98	Very high	97	Very high	52 Å²	52	44.5 Å²	44.5	20%	0.204	23%	0.229	C	C	.	.	H	α-helix	trans	-74.8	-40.1	176.7	-86.4	-107.6	0	0	0	112.3	L56 W59 R85 V86 W87 H94	L56-Y89 HydrophobicContact CD2-CD1 3.77Å; L56-Y89 HydrophobicContact CD2-CD2 3.83Å; L56-Y89 HydrophobicContact CD2-CE1 4.34Å; L56-Y89 HydrophobicContact CD2-CE2 4.38Å; L56-Y89 HydrophobicContact CD2-CG 3.45Å; L56-Y89 VanDerWaalsContact CD2-CG 3.45Å; W59-Y89 HydrophobicContact CB-CD1 3.9Å; W59-Y89 HydrophobicContact CB-CE1 3.97Å; W59-Y89 AromaticContact CD1-CD1 3.67Å; W59-Y89 AromaticContact CD2-CD1 3.82Å; W59-Y89 HydrophobicContact CD2-CD1 3.82Å; W59-Y89 AromaticContact CG-CD1 3.51Å; W59-Y89 HydrophobicContact CG-CD1 3.51Å; W59-Y89 HydrophobicContact CG-CE1 4.08Å; W59-Y89 AromaticContact NE1-CD1 3.98Å; R85-Y89 HydrophobicContact CG-CD2 4.15Å; R85-Y89 HydrophobicContact CG-CE2 3.99Å; R85-Y89 VanDerWaalsContact O-CD2 3.25Å; R85-Y89 WeakPolarHBondContact O-CD2 3.45Å; R85-Y89 PolarHBondContact O-N 3.19Å; V86-Y89 PolarHBondContact O-N 3.18Å; V86-Y89 VanDerWaalsContact O-N 3.12Å; W87-Y89 VanDerWaalsContact C-N 3.29Å; W87-Y89 PolarHBondContact O-N 3.28Å; Y89-H94 AromaticContact CD1-CE1 3.99Å; Y89-H94 AromaticContact CD1-NE2 3.93Å; Y89-H94 AromaticContact CE1-NE2 3.99Å
90	L	97.9	Very high	97.1	Very high	13 Å²	13	47.7 Å²	47.7	7%	0.068	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-45.1	177.5	-72.2	174.7	0	0	0	112.4	W59 V70 I78 V86 W87 Y192 F262 F263	W59-L90 HydrophobicContact CH2-CD2 3.76Å; W59-L90 HydrophobicContact CH2-CG 4.41Å; W59-L90 HydrophobicContact CZ2-CD2 4.26Å; V70-L90 HydrophobicContact CG1-CD2 4.44Å; I78-L90 HydrophobicContact CD1-CD1 4.18Å; V86-L90 HydrophobicContact CG1-CD1 3.71Å; V86-L90 HydrophobicContact CG1-CG 3.99Å; V86-L90 VanDerWaalsContact O-CG 3.28Å; V86-L90 WeakPolarHBondContact O-CG 3.34Å; V86-L90 PolarHBondContact O-N 3.03Å; W87-L90 PolarHBondContact O-N 3.11Å; L90-Y192 PolarHBondContact O-OH 3.23Å; L90-F262 HydrophobicContact CB-CB 3.9Å; L90-F262 HydrophobicContact CD1-CB 3.7Å; L90-F262 HydrophobicContact CG-CB 4.44Å; L90-F263 HydrophobicContact CD2-CB 4Å; L90-F263 HydrophobicContact CD2-CD2 3.54Å; L90-F263 HydrophobicContact CD2-CG 4.26Å
91	C	97.2	Very high	97.3	Very high	4 Å²	4	55.9 Å²	55.9	3%	0.027	27%	0.268	C	S	.	.	H	α-helix	trans	-86.3	-18.6	-178.8	72.9	0	0	0	0	114.1	W87 S93 C187 R191 Y192 F262	W87-C91 PolarHBondContact O-N 2.82Å; W87-C91 PolarHBondContact O-SG 3.47Å; C91-S93 VanDerWaalsContact SG-CB 3.55Å; C91-S93 PolarHBondContact SG-N 3.32Å; C91-S93 VanDerWaalsContact SG-N 3.45Å; C91-S93 PolarHBondContact SG-OG 3.28Å; C91-S93 VanDerWaalsContact SG-OG 3.34Å; C91-C187 HydrophobicContact CB-CB 3.87Å; C91-R191 PolarHBondContact O-NH1 3.01Å; C91-Y192 WeakPolarHBondContact CA-OH 3.45Å; C91-Y192 HydrophobicContact CB-CE2 3.93Å; C91-F262 HydrophobicContact CB-CD1 3.84Å; C91-F262 HydrophobicContact CB-CE1 3.97Å
92	G	96.7	Very high	97.5	Very high	12 Å²	12	53.5 Å²	53.5	12%	0.124	25%	0.251	C	S	.	.			trans	87.2	7.4	-177.5	0	0	0	0	0	114.4	K88 H94 Q95 I96	K88-G92 CarbonylContact O-C 3.07Å; K88-G92 WeakPolarHBondContact O-CA 3.43Å; K88-G92 PolarHBondContact O-N 2.84Å; G92-H94 PolarHBondContact O-N 2.94Å; G92-Q95 WeakPolarHBondContact O-CB 3.31Å; G92-Q95 PolarHBondContact O-N 3.41Å; G92-I96 PolarHBondContact O-N 2.9Å
93	S	97.7	Very high	97.5	Very high	1 Å²	1	56 Å²	56	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-28.4	-176.9	62.3	0	0	0	0	113.4	K88 C91 Q95 I96 M97 W183 T184 C187	K88-S93 VanDerWaalsContact CA-OG 3.29Å; K88-S93 WeakPolarHBondContact CA-OG 3.32Å; K88-S93 WeakPolarHBondContact CB-OG 3.42Å; K88-S93 WeakPolarHBondContact CG-OG 3.47Å; K88-S93 PolarHBondContact O-N 3.1Å; C91-S93 VanDerWaalsContact SG-CB 3.55Å; C91-S93 PolarHBondContact SG-N 3.32Å; C91-S93 VanDerWaalsContact SG-N 3.45Å; C91-S93 PolarHBondContact SG-OG 3.28Å; C91-S93 VanDerWaalsContact SG-OG 3.34Å; S93-Q95 VanDerWaalsContact C-N 3.27Å; S93-Q95 PolarHBondContact O-N 3.05Å; S93-I96 PolarHBondContact O-N 3.12Å; S93-M97 VanDerWaalsContact O-CB 3.3Å; S93-M97 WeakPolarHBondContact O-CB 3.25Å; S93-M97 PolarHBondContact O-N 3.04Å; S93-W183 WeakPolarHBondContact CB-O 3.42Å; S93-T184 PolarHBondContact OG-OG1 3.3Å; S93-C187 WeakPolarHBondContact CA-SG 3.47Å
94	H	95.7	Very high	97.5	Very high	47 Å²	47	55.8 Å²	55.8	22%	0.218	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-35.8	173.6	69.4	-70.1	0	0	0	113.1	K88 Y89 G92 H98	K88-H94 HydrophobicContact CB-CB 4.29Å; K88-H94 PolarHBondContact O-ND1 3.48Å; Y89-H94 AromaticContact CD1-CE1 3.99Å; Y89-H94 AromaticContact CD1-NE2 3.93Å; Y89-H94 AromaticContact CE1-NE2 3.99Å; G92-H94 PolarHBondContact O-N 2.94Å; H94-H98 PolarHBondContact O-N 3.08Å
95	Q	96.4	Very high	97.6	Very high	96 Å²	96	58 Å²	58	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-73.8	-45.4	176.6	-71	169.5	-18.6	0	0	110.8	G92 S93 M97 H98 M99	G92-Q95 WeakPolarHBondContact O-CB 3.31Å; G92-Q95 PolarHBondContact O-N 3.41Å; S93-Q95 VanDerWaalsContact C-N 3.27Å; S93-Q95 PolarHBondContact O-N 3.05Å; Q95-M97 PolarHBondContact O-N 3.22Å; Q95-H98 WeakPolarHBondContact O-CB 3.37Å; Q95-H98 PolarHBondContact O-N 3.49Å; Q95-H98 VanDerWaalsContact O-N 3.16Å; Q95-M99 HydrophobicContact CB-CE 4.46Å; Q95-M99 WeakPolarHBondContact O-CG 3.38Å; Q95-M99 PolarHBondContact O-N 2.96Å
96	I	97.1	Very high	97.6	Very high	57 Å²	57	57.4 Å²	57.4	29%	0.292	28%	0.276	S	S	.	.	H	α-helix	trans	-61.4	-46.4	179.5	-57.6	-172.5	0	0	0	110.5	G92 S93 H98 M99 E100 W183 C187	G92-I96 PolarHBondContact O-N 2.9Å; S93-I96 PolarHBondContact O-N 3.12Å; I96-H98 PolarHBondContact O-N 3.34Å; I96-M99 PolarHBondContact O-N 3.09Å; I96-M99 VanDerWaalsContact O-N 3.15Å; I96-E100 HydrophobicContact CG2-CG 4.07Å; I96-E100 VanDerWaalsContact O-CB 3.29Å; I96-E100 WeakPolarHBondContact O-CB 3.47Å; I96-E100 WeakPolarHBondContact O-CG 3.35Å; I96-E100 PolarHBondContact O-N 3.1Å; I96-W183 HydrophobicContact CB-CE3 4.45Å; I96-W183 HydrophobicContact CG2-CD2 4.33Å; I96-W183 HydrophobicContact CG2-CE3 3.51Å; I96-W183 HydrophobicContact CG2-CH2 4.45Å; I96-W183 HydrophobicContact CG2-CZ3 3.59Å; I96-C187 WeakPolarHBondContact CD1-SG 3.45Å
97	M	96.6	Very high	97.6	Very high	51 Å²	51	57.9 Å²	57.9	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-57.7	-37.8	176.7	-179.4	178.4	177.3	0	0	112.3	S93 Q95 R101 E179 W183	S93-M97 VanDerWaalsContact O-CB 3.3Å; S93-M97 WeakPolarHBondContact O-CB 3.25Å; S93-M97 PolarHBondContact O-N 3.04Å; Q95-M97 PolarHBondContact O-N 3.22Å; M97-R101 PolarHBondContact O-N 2.96Å; M97-E179 HydrophobicContact CE-CB 4.45Å; M97-E179 HydrophobicContact CE-CG 3.88Å; M97-W183 HydrophobicContact CB-CB 4.29Å; M97-W183 HydrophobicContact CB-CD2 4.49Å; M97-W183 HydrophobicContact CB-CG 3.85Å; M97-W183 VanDerWaalsContact CG-CD1 3.47Å; M97-W183 HydrophobicContact CG-CG 4.3Å
98	H	96.7	Very high	97.6	Very high	148 Å²	148	60.1 Å²	60.1	69%	0.685	29%	0.29	S	S	*	.	H	α-helix	trans	-68.6	-44.6	176.1	-176.4	71.4	0	0	0	112.1	H94 Q95 I96 E100	H94-H98 PolarHBondContact O-N 3.08Å; Q95-H98 WeakPolarHBondContact O-CB 3.37Å; Q95-H98 PolarHBondContact O-N 3.49Å; Q95-H98 VanDerWaalsContact O-N 3.16Å; I96-H98 PolarHBondContact O-N 3.34Å; H98-E100 VanDerWaalsContact C-N 3.34Å
99	M	97.7	Very high	97.6	Very high	146 Å²	146	68.4 Å²	68.4	72%	0.719	32%	0.321	S	S	*	.	H	α-helix	trans	-66.8	-34.8	179.1	-68.1	173.5	-175.5	0	0	112.5	Q95 I96	Q95-M99 HydrophobicContact CB-CE 4.46Å; Q95-M99 WeakPolarHBondContact O-CG 3.38Å; Q95-M99 PolarHBondContact O-N 2.96Å; I96-M99 PolarHBondContact O-N 3.09Å; I96-M99 VanDerWaalsContact O-N 3.15Å
100	E	97.5	Very high	97.6	Very high	72 Å²	72	69.8 Å²	69.8	34%	0.336	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	30.4	-173.5	-62.5	-81.6	-151.4	0	0	111.7	I96 H98 G102 K103 W183	I96-E100 HydrophobicContact CG2-CG 4.07Å; I96-E100 VanDerWaalsContact O-CB 3.29Å; I96-E100 WeakPolarHBondContact O-CB 3.47Å; I96-E100 WeakPolarHBondContact O-CG 3.35Å; I96-E100 PolarHBondContact O-N 3.1Å; H98-E100 VanDerWaalsContact C-N 3.34Å; E100-G102 PolarHBondContact O-N 3.05Å; E100-K103 HydrophobicContact CB-CB 4.2Å; E100-K103 HydrophobicContact CB-CD 4.1Å; E100-K103 HydrophobicContact CG-CD 4.33Å; E100-K103 WeakPolarHBondContact O-CB 3.47Å; E100-K103 PolarHBondContact O-N 3.23Å; E100-K103 IonicContact OE1-NZ 2.68Å; E100-K103 PolarHBondContact OE1-NZ 3.33Å; E100-K103 WeakPolarHBondContact OE2-CD 3.45Å; E100-K103 IonicContact OE2-NZ 2.71Å; E100-K103 PolarHBondContact OE2-NZ 2.76Å; E100-W183 HydrophobicContact CB-CH2 3.35Å; E100-W183 HydrophobicContact CB-CZ2 3.54Å; E100-W183 HydrophobicContact CB-CZ3 4.16Å; E100-W183 HydrophobicContact CG-CH2 3.88Å; E100-W183 HydrophobicContact CG-CZ3 4.29Å
101	R	97.5	Very high	97.6	Very high	219 Å²	219	74.7 Å²	74.7	83%	0.826	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	129.4	-175.3	-173.1	177.8	-178	177.1	0.4	111.2	M97 K103	M97-R101 PolarHBondContact O-N 2.96Å; R101-K103 VanDerWaalsContact C-N 3.26Å; R101-K103 PolarHBondContact O-N 3.06Å
102	G	97.9	Very high	97.5	Very high	30 Å²	30	75.3 Å²	75.3	31%	0.309	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-13.6	180	0	0	0	0	0	114.5	E100 Y104 Q105 V106	E100-G102 PolarHBondContact O-N 3.05Å; G102-Y104 VanDerWaalsContact C-N 3.33Å; G102-Y104 PolarHBondContact O-N 3.37Å; G102-Q105 VanDerWaalsContact C-OE1 3.32Å; G102-Q105 PolarHBondContact O-N 2.8Å; G102-Q105 PolarHBondContact O-OE1 3.18Å; G102-V106 WeakPolarHBondContact O-CG2 3.38Å; G102-V106 PolarHBondContact O-N 3.01Å; G102-V106 VanDerWaalsContact O-N 3.14Å
103	K	98.5	Very high	97.6	Very high	64 Å²	64	78.7 Å²	78.7	28%	0.278	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-36.7	-178.7	-176.2	163.1	176.9	176.3	0	112.4	E100 R101 Q105 V106 L107 W183	E100-K103 HydrophobicContact CB-CB 4.2Å; E100-K103 HydrophobicContact CB-CD 4.1Å; E100-K103 HydrophobicContact CG-CD 4.33Å; E100-K103 WeakPolarHBondContact O-CB 3.47Å; E100-K103 PolarHBondContact O-N 3.23Å; E100-K103 IonicContact OE1-NZ 2.68Å; E100-K103 PolarHBondContact OE1-NZ 3.33Å; E100-K103 WeakPolarHBondContact OE2-CD 3.45Å; E100-K103 IonicContact OE2-NZ 2.71Å; E100-K103 PolarHBondContact OE2-NZ 2.76Å; R101-K103 VanDerWaalsContact C-N 3.26Å; R101-K103 PolarHBondContact O-N 3.06Å; K103-Q105 VanDerWaalsContact C-N 3.32Å; K103-Q105 PolarHBondContact O-N 2.91Å; K103-V106 WeakPolarHBondContact O-CB 3.3Å; K103-V106 PolarHBondContact O-N 3.09Å; K103-L107 HydrophobicContact CG-CD1 4.26Å; K103-L107 WeakPolarHBondContact O-CG 3.32Å; K103-L107 PolarHBondContact O-N 3.06Å; K103-W183 HydrophobicContact CB-CH2 4.27Å; K103-W183 HydrophobicContact CB-CZ2 4.11Å; K103-W183 HydrophobicContact CD-CH2 4.11Å; K103-W183 HydrophobicContact CG-CH2 4.31Å
104	Y	98.6	Very high	97.6	Very high	4 Å²	4	83.3 Å²	83.3	2%	0.016	42%	0.415	C	S	.	.	H	α-helix	trans	-58.8	-46.4	176.1	-176.7	-120.5	0	0	0	111.2	G102 V106 L107 L108 N147 A151 E178 E179 F182	G102-Y104 VanDerWaalsContact C-N 3.33Å; G102-Y104 PolarHBondContact O-N 3.37Å; Y104-V106 VanDerWaalsContact C-N 3.31Å; Y104-V106 PolarHBondContact O-N 2.91Å; Y104-L107 WeakPolarHBondContact O-CB 3.45Å; Y104-L107 PolarHBondContact O-N 3.4Å; Y104-L107 VanDerWaalsContact O-N 3.12Å; Y104-L108 HydrophobicContact CD1-CD1 4.18Å; Y104-L108 HydrophobicContact CD1-CG 4.49Å; Y104-L108 HydrophobicContact CE1-CD1 3.75Å; Y104-L108 HydrophobicContact CE1-CD2 4.32Å; Y104-L108 HydrophobicContact CE1-CG 4.17Å; Y104-L108 HydrophobicContact CE2-CD2 4.06Å; Y104-L108 HydrophobicContact CE2-CG 4.4Å; Y104-L108 WeakPolarHBondContact O-CG 3.47Å; Y104-L108 PolarHBondContact O-N 2.89Å; Y104-N147 WeakPolarHBondContact OH-CB 3.48Å; Y104-A151 HydrophobicContact CD2-CB 3.89Å; Y104-A151 HydrophobicContact CE2-CB 3.54Å; Y104-E178 HydrophobicContact CE1-CG 4.15Å; Y104-E178 WeakPolarHBondContact CE1-OE1 3.12Å; Y104-E178 VanDerWaalsContact OH-CD 3.32Å; Y104-E178 VanDerWaalsContact OH-CG 3.29Å; Y104-E178 WeakPolarHBondContact OH-CG 3.31Å; Y104-E178 PolarHBondContact OH-OE1 2.73Å; Y104-E179 HydrophobicContact CD1-CB 3.8Å; Y104-E179 HydrophobicContact CD1-CG 3.78Å; Y104-E179 HydrophobicContact CE1-CB 4.18Å; Y104-E179 HydrophobicContact CG-CG 4.06Å; Y104-F182 HydrophobicContact CD2-CB 3.88Å; Y104-F182 AromaticContact CD2-CD1 3.26Å; Y104-F182 HydrophobicContact CD2-CD1 3.26Å; Y104-F182 AromaticContact CD2-CD2 3.81Å; Y104-F182 HydrophobicContact CD2-CD2 3.81Å; Y104-F182 AromaticContact CD2-CE1 3.64Å; Y104-F182 HydrophobicContact CD2-CE1 3.64Å; Y104-F182 HydrophobicContact CD2-CE2 4.15Å; Y104-F182 AromaticContact CD2-CG 3.34Å; Y104-F182 HydrophobicContact CD2-CG 3.34Å; Y104-F182 HydrophobicContact CD2-CZ 4.07Å; Y104-F182 HydrophobicContact CE2-CB 3.63Å; Y104-F182 AromaticContact CE2-CD1 3.88Å; Y104-F182 HydrophobicContact CE2-CD1 3.88Å; Y104-F182 AromaticContact CE2-CD2 3.66Å; Y104-F182 HydrophobicContact CE2-CD2 3.66Å; Y104-F182 HydrophobicContact CE2-CE1 4.47Å; Y104-F182 HydrophobicContact CE2-CE2 4.29Å; Y104-F182 AromaticContact CE2-CG 3.42Å; Y104-F182 HydrophobicContact CE2-CG 3.42Å; Y104-F182 VanDerWaalsContact CE2-CG 3.42Å; Y104-F182 AromaticContact CG-CD1 3.9Å; Y104-F182 HydrophobicContact CG-CD1 3.9Å; Y104-F182 HydrophobicContact CG-CE1 4.36Å; Y104-F182 HydrophobicContact CG-CG 4.26Å
105	Q	98.5	Very high	97.6	Very high	70 Å²	70	89.4 Å²	89.4	33%	0.327	44%	0.441	S	S	.	.	H	α-helix	trans	-64.2	-35.2	178.8	-66.6	71.8	20.2	0	0	112.2	G102 K103 L108 R109 E179	G102-Q105 VanDerWaalsContact C-OE1 3.32Å; G102-Q105 PolarHBondContact O-N 2.8Å; G102-Q105 PolarHBondContact O-OE1 3.18Å; K103-Q105 VanDerWaalsContact C-N 3.32Å; K103-Q105 PolarHBondContact O-N 2.91Å; Q105-L108 PolarHBondContact O-N 2.73Å; Q105-R109 WeakPolarHBondContact O-CG 3.3Å; Q105-R109 PolarHBondContact O-N 3.25Å; Q105-E179 PolarHBondContact NE2-OE2 2.92Å
106	V	98.5	Very high	97.7	Very high	83 Å²	83	86.6 Å²	86.6	50%	0.503	43%	0.429	S	S	.	.	H	α-helix	trans	-62.4	-48.8	171.7	173.8	0	0	0	0	110.5	G102 K103 Y104 L108 R109 M110	G102-V106 WeakPolarHBondContact O-CG2 3.38Å; G102-V106 PolarHBondContact O-N 3.01Å; G102-V106 VanDerWaalsContact O-N 3.14Å; K103-V106 WeakPolarHBondContact O-CB 3.3Å; K103-V106 PolarHBondContact O-N 3.09Å; Y104-V106 VanDerWaalsContact C-N 3.31Å; Y104-V106 PolarHBondContact O-N 2.91Å; V106-L108 VanDerWaalsContact C-N 3.28Å; V106-L108 PolarHBondContact O-N 3.47Å; V106-R109 PolarHBondContact O-N 3.11Å; V106-R109 VanDerWaalsContact O-N 3.1Å; V106-M110 HydrophobicContact CG1-SD 4.26Å; V106-M110 WeakPolarHBondContact O-CG 3.48Å; V106-M110 PolarHBondContact O-N 2.94Å
107	L	98.6	Very high	97.7	Very high	11 Å²	11	85.1 Å²	85.1	6%	0.058	42%	0.421	C	S	.	.	H	α-helix	trans	-60	-36.7	178.6	-67.4	166.6	0	0	0	112.4	K103 Y104 R109 M110 A151 L154 L155 F182	K103-L107 HydrophobicContact CG-CD1 4.26Å; K103-L107 WeakPolarHBondContact O-CG 3.32Å; K103-L107 PolarHBondContact O-N 3.06Å; Y104-L107 WeakPolarHBondContact O-CB 3.45Å; Y104-L107 PolarHBondContact O-N 3.4Å; Y104-L107 VanDerWaalsContact O-N 3.12Å; L107-R109 VanDerWaalsContact C-N 3.28Å; L107-R109 PolarHBondContact O-N 3.41Å; L107-M110 HydrophobicContact CD2-SD 4.24Å; L107-M110 PolarHBondContact O-N 2.98Å; L107-A151 HydrophobicContact CB-CB 3.93Å; L107-A151 HydrophobicContact CD1-CB 4.31Å; L107-L154 HydrophobicContact CD2-CB 3.83Å; L107-L154 VanDerWaalsContact O-CD1 3.31Å; L107-L154 WeakPolarHBondContact O-CD1 3.28Å; L107-L155 HydrophobicContact CD1-CB 4.27Å; L107-F182 HydrophobicContact CD1-CE1 4.21Å; L107-F182 HydrophobicContact CD1-CE2 4.46Å; L107-F182 HydrophobicContact CD1-CZ 3.63Å
108	L	98.2	Very high	97.8	Very high	46 Å²	46	85.9 Å²	85.9	24%	0.241	43%	0.431	C	S	.	.	H	α-helix	trans	-61.9	-36.2	176.7	-68	-175.7	0	0	0	112.8	Y104 Q105 V106 N147 K150 A151	Y104-L108 HydrophobicContact CD1-CD1 4.18Å; Y104-L108 HydrophobicContact CD1-CG 4.49Å; Y104-L108 HydrophobicContact CE1-CD1 3.75Å; Y104-L108 HydrophobicContact CE1-CD2 4.32Å; Y104-L108 HydrophobicContact CE1-CG 4.17Å; Y104-L108 HydrophobicContact CE2-CD2 4.06Å; Y104-L108 HydrophobicContact CE2-CG 4.4Å; Y104-L108 WeakPolarHBondContact O-CG 3.47Å; Y104-L108 PolarHBondContact O-N 2.89Å; Q105-L108 PolarHBondContact O-N 2.73Å; V106-L108 VanDerWaalsContact C-N 3.28Å; V106-L108 PolarHBondContact O-N 3.47Å; L108-N147 HydrophobicContact CD2-CB 3.63Å; L108-K150 PolarHBondContact O-NZ 3.26Å; L108-A151 HydrophobicContact CD2-CB 4.49Å
109	R	98.3	Very high	97.8	Very high	211 Å²	211	81.8 Å²	81.8	80%	0.796	41%	0.412	S	S	*	.	H	α-helix	trans	-78.4	-23.8	-179.2	-66.3	172	-175.4	179.1	1.2	113.2	Q105 V106 L107	Q105-R109 WeakPolarHBondContact O-CG 3.3Å; Q105-R109 PolarHBondContact O-N 3.25Å; V106-R109 PolarHBondContact O-N 3.11Å; V106-R109 VanDerWaalsContact O-N 3.1Å; L107-R109 VanDerWaalsContact C-N 3.28Å; L107-R109 PolarHBondContact O-N 3.41Å
110	M	98.1	Very high	97.8	Very high	81 Å²	81	74.8 Å²	74.8	40%	0.399	38%	0.378	S	S	.	.	S	Bend	trans	-69.5	145.1	-179.9	-70.4	172.8	68.7	0	0	111.6	V106 L107 K150 L154	V106-M110 HydrophobicContact CG1-SD 4.26Å; V106-M110 WeakPolarHBondContact O-CG 3.48Å; V106-M110 PolarHBondContact O-N 2.94Å; L107-M110 HydrophobicContact CD2-SD 4.24Å; L107-M110 PolarHBondContact O-N 2.98Å; M110-K150 WeakPolarHBondContact O-CE 3.4Å; M110-K150 PolarHBondContact O-NZ 3.15Å; M110-L154 HydrophobicContact CB-CD1 3.96Å
111	P	97.1	Very high	97.8	Very high	115 Å²	115	77 Å²	77	75%	0.747	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-67.5	136.1	170	29.4	-33.4	0	0	0	109.7	L154	P111-L154 WeakPolarHBondContact O-CD2 3.42Å
112	G	96.3	Very high	97.6	Very high	18 Å²	18	71.5 Å²	71.5	19%	0.186	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-88.9	163.4	171.5	0	0	0	0	0	111.7	P114	G112-P114 WeakPolarHBondContact O-CD 3.41Å
113	D	97.3	Very high	97.5	Very high	82 Å²	82	70.2 Å²	70.2	44%	0.439	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-59.5	123.6	170.5	177.4	-57.1	0	0	0	109.9	K115 I116 I117	D113-K115 VanDerWaalsContact C-N 3.27Å; D113-K115 PolarHBondContact O-N 3.2Å; D113-K115 WeakPolarHBondContact OD1-CA 3.44Å; D113-K115 VanDerWaalsContact OD1-CB 3.31Å; D113-K115 WeakPolarHBondContact OD1-CB 3.23Å; D113-K115 PolarHBondContact OD1-N 3.46Å; D113-I116 HydrophobicContact CB-CB 4.04Å; D113-I116 HydrophobicContact CB-CD1 3.96Å; D113-I116 HydrophobicContact CB-CG1 4.01Å; D113-I116 PolarHBondContact O-N 3.09Å; D113-I116 VanDerWaalsContact O-N 3.11Å; D113-I116 PolarHBondContact OD1-N 3.27Å; D113-I117 VanDerWaalsContact O-CG1 3.3Å; D113-I117 WeakPolarHBondContact O-CG1 3.47Å; D113-I117 PolarHBondContact O-N 3.23Å
114	P	97.8	Very high	97.4	Very high	98 Å²	98	67.5 Å²	67.5	64%	0.636	35%	0.348	S	S	*	.	H	α-helix	trans	-56.2	-34.5	-175.4	-28.3	35.6	0	0	0	115	G112 S118	G112-P114 WeakPolarHBondContact O-CD 3.41Å; P114-S118 WeakPolarHBondContact O-CB 3.5Å; P114-S118 PolarHBondContact O-N 3.18Å; P114-S118 PolarHBondContact O-OG 3Å
115	K	97.1	Very high	97.1	Very high	176 Å²	176	71.2 Å²	71.2	77%	0.765	37%	0.368	S	S	*	.	H	α-helix	trans	-70.6	-45.4	178.1	-63.4	179.5	179.5	176.7	0	110.2	D113 S118 Q119	D113-K115 VanDerWaalsContact C-N 3.27Å; D113-K115 PolarHBondContact O-N 3.2Å; D113-K115 WeakPolarHBondContact OD1-CA 3.44Å; D113-K115 VanDerWaalsContact OD1-CB 3.31Å; D113-K115 WeakPolarHBondContact OD1-CB 3.23Å; D113-K115 PolarHBondContact OD1-N 3.46Å; K115-S118 PolarHBondContact O-N 3.39Å; K115-Q119 PolarHBondContact O-N 2.87Å
116	I	97.5	Very high	96.8	Very high	37 Å²	37	75.1 Å²	75.1	19%	0.19	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-47.5	176.1	-67.2	-178.7	0	0	0	110.6	D113 S118 Q119 I120 Y161	D113-I116 HydrophobicContact CB-CB 4.04Å; D113-I116 HydrophobicContact CB-CD1 3.96Å; D113-I116 HydrophobicContact CB-CG1 4.01Å; D113-I116 PolarHBondContact O-N 3.09Å; D113-I116 VanDerWaalsContact O-N 3.11Å; D113-I116 PolarHBondContact OD1-N 3.27Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 3.14Å; I116-Q119 PolarHBondContact O-N 3.32Å; I116-Q119 VanDerWaalsContact O-N 3.17Å; I116-I120 HydrophobicContact CG2-CD1 3.62Å; I116-I120 HydrophobicContact CG2-CG1 4.2Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.38Å; I116-Y161 HydrophobicContact CG2-CG 4.49Å
117	I	98	Very high	96.6	Very high	25 Å²	25	72 Å²	72	13%	0.128	36%	0.36	C	S	.	.	H	α-helix	trans	-57.4	-43.4	178.1	-69.3	-53.8	0	0	0	111.3	D113 I120 K121 F146 K150	D113-I117 VanDerWaalsContact O-CG1 3.3Å; D113-I117 WeakPolarHBondContact O-CG1 3.47Å; D113-I117 PolarHBondContact O-N 3.23Å; I117-I120 PolarHBondContact O-N 3.18Å; I117-K121 HydrophobicContact CG2-CD 4.38Å; I117-K121 WeakPolarHBondContact O-CG 3.4Å; I117-K121 PolarHBondContact O-N 3.5Å; I117-F146 HydrophobicContact CD1-CE2 4.19Å; I117-F146 HydrophobicContact CD1-CZ 3.83Å; I117-F146 HydrophobicContact CG2-CE2 4Å; I117-F146 HydrophobicContact CG2-CZ 3.99Å; I117-K150 HydrophobicContact CD1-CB 4.1Å; I117-K150 HydrophobicContact CD1-CD 3.88Å; I117-K150 HydrophobicContact CD1-CG 3.7Å
118	S	97.5	Very high	96.4	Very high	68 Å²	68	72 Å²	72	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-63.4	-42.7	178.6	-58.8	0	0	0	0	111.5	P114 K115 I116 K121 L122	P114-S118 WeakPolarHBondContact O-CB 3.5Å; P114-S118 PolarHBondContact O-N 3.18Å; P114-S118 PolarHBondContact O-OG 3Å; K115-S118 PolarHBondContact O-N 3.39Å; I116-S118 VanDerWaalsContact C-N 3.28Å; I116-S118 PolarHBondContact O-N 3.14Å; S118-K121 PolarHBondContact O-N 2.92Å; S118-L122 WeakPolarHBondContact O-CG 3.22Å; S118-L122 PolarHBondContact O-N 3.13Å
119	Q	97.3	Very high	96.1	Very high	61 Å²	61	72.8 Å²	72.8	29%	0.285	37%	0.368	S	S	.	.	H	α-helix	trans	-66	-43.4	177.4	-171.9	56.3	55.6	0	0	112.2	K115 I116 K121 L122 D123 Y161	K115-Q119 PolarHBondContact O-N 2.87Å; I116-Q119 PolarHBondContact O-N 3.32Å; I116-Q119 VanDerWaalsContact O-N 3.17Å; Q119-K121 VanDerWaalsContact C-N 3.32Å; Q119-K121 PolarHBondContact O-N 3.49Å; Q119-L122 PolarHBondContact O-N 3.13Å; Q119-D123 PolarHBondContact NE2-OD1 2.9Å; Q119-D123 PolarHBondContact NE2-OD2 3.24Å; Q119-D123 PolarHBondContact O-N 3.47Å; Q119-D123 VanDerWaalsContact O-N 3.11Å; Q119-Y161 HydrophobicContact CB-CD1 4.29Å; Q119-Y161 HydrophobicContact CB-CE1 4.42Å; Q119-Y161 HydrophobicContact CG-CD1 3.95Å; Q119-Y161 HydrophobicContact CG-CE1 3.85Å
120	I	98.1	Very high	95.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.3	-44.2	176.7	-67.5	169.7	0	0	0	110.4	I116 I117 L122 D123 V124 F146 L149 Y161	I116-I120 HydrophobicContact CG2-CD1 3.62Å; I116-I120 HydrophobicContact CG2-CG1 4.2Å; I116-I120 WeakPolarHBondContact O-CG1 3.47Å; I116-I120 PolarHBondContact O-N 3.38Å; I117-I120 PolarHBondContact O-N 3.18Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 3.41Å; I120-D123 PolarHBondContact O-N 3.02Å; I120-V124 HydrophobicContact CG2-CG2 3.9Å; I120-V124 WeakPolarHBondContact O-CB 3.12Å; I120-V124 WeakPolarHBondContact O-CG2 3.34Å; I120-V124 PolarHBondContact O-N 3.16Å; I120-F146 HydrophobicContact CB-CD2 4.4Å; I120-F146 HydrophobicContact CG2-CD2 3.63Å; I120-F146 HydrophobicContact CG2-CE2 4.2Å; I120-F146 HydrophobicContact CG2-CG 4.41Å; I120-L149 HydrophobicContact CD1-CB 3.97Å; I120-L149 HydrophobicContact CG1-CB 4.24Å; I120-L149 HydrophobicContact CG2-CB 3.88Å; I120-L149 HydrophobicContact CG2-CD1 3.98Å; I120-Y161 HydrophobicContact CD1-CD2 4.27Å; I120-Y161 HydrophobicContact CD1-CG 4.15Å; I120-Y161 HydrophobicContact CG1-CD1 3.61Å; I120-Y161 HydrophobicContact CG1-CD2 3.82Å; I120-Y161 HydrophobicContact CG1-CE1 3.76Å; I120-Y161 HydrophobicContact CG1-CE2 3.99Å; I120-Y161 HydrophobicContact CG1-CG 3.63Å
121	K	96.3	Very high	95.6	Very high	118 Å²	118	60 Å²	60	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-57.5	-46.5	178.5	-74.7	175.8	178	-177.5	0	112.1	I117 S118 Q119 D123 V124 F146	I117-K121 HydrophobicContact CG2-CD 4.38Å; I117-K121 WeakPolarHBondContact O-CG 3.4Å; I117-K121 PolarHBondContact O-N 3.5Å; S118-K121 PolarHBondContact O-N 2.92Å; Q119-K121 VanDerWaalsContact C-N 3.32Å; Q119-K121 PolarHBondContact O-N 3.49Å; K121-D123 VanDerWaalsContact C-N 3.29Å; K121-D123 PolarHBondContact O-N 3.41Å; K121-V124 PolarHBondContact O-N 3.41Å; K121-F146 HydrophobicContact CG-CD2 4.03Å; K121-F146 HydrophobicContact CG-CE2 3.78Å
122	L	94.8	Very high	95.5	Very high	104 Å²	104	56.7 Å²	56.7	55%	0.545	29%	0.294	S	S	.	.	H	α-helix	trans	-62.3	-35.3	178.1	-68.9	173.8	0	0	0	113.1	S118 Q119 I120 R126	S118-L122 WeakPolarHBondContact O-CG 3.22Å; S118-L122 PolarHBondContact O-N 3.13Å; Q119-L122 PolarHBondContact O-N 3.13Å; I120-L122 VanDerWaalsContact C-N 3.35Å; I120-L122 PolarHBondContact O-N 3.41Å; L122-R126 PolarHBondContact O-NE 3.44Å
123	D	95.4	Very high	95.4	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-82.3	-35.4	-178	-70	-30.3	0	0	0	112.3	Q119 I120 K121 D125 R126 Q127 Y161 Q163	Q119-D123 PolarHBondContact NE2-OD1 2.9Å; Q119-D123 PolarHBondContact NE2-OD2 3.24Å; Q119-D123 PolarHBondContact O-N 3.47Å; Q119-D123 VanDerWaalsContact O-N 3.11Å; I120-D123 PolarHBondContact O-N 3.02Å; K121-D123 VanDerWaalsContact C-N 3.29Å; K121-D123 PolarHBondContact O-N 3.41Å; D123-D125 VanDerWaalsContact C-N 3.27Å; D123-D125 PolarHBondContact O-N 3.18Å; D123-R126 PolarHBondContact O-N 3.08Å; D123-R126 IonicContact OD1-CZ 3.7Å; D123-R126 IonicContact OD1-NE 3.82Å; D123-R126 IonicContact OD1-NH2 2.71Å; D123-R126 PolarHBondContact OD1-NH2 2.9Å; D123-Q127 VanDerWaalsContact O-CG 3.24Å; D123-Q127 WeakPolarHBondContact O-CG 3.31Å; D123-Q127 PolarHBondContact O-N 2.94Å; D123-Q127 PolarHBondContact O-NE2 2.74Å; D123-Y161 VanDerWaalsContact CB-OH 3.22Å; D123-Y161 WeakPolarHBondContact CB-OH 3.41Å; D123-Y161 WeakPolarHBondContact OD2-CE1 3.37Å; D123-Y161 PolarHBondContact OD2-OH 2.88Å; D123-Q163 VanDerWaalsContact OD2-CG 3.32Å; D123-Q163 WeakPolarHBondContact OD2-CG 3.27Å
124	V	96.2	Very high	95.3	Very high	7 Å²	7	54.4 Å²	54.4	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-53.7	-43.5	175.7	163.7	0	0	0	0	111.5	I120 K121 R126 Q127 R142 L145 F146 L149	I120-V124 HydrophobicContact CG2-CG2 3.9Å; I120-V124 WeakPolarHBondContact O-CB 3.12Å; I120-V124 WeakPolarHBondContact O-CG2 3.34Å; I120-V124 PolarHBondContact O-N 3.16Å; K121-V124 PolarHBondContact O-N 3.41Å; V124-R126 PolarHBondContact O-N 3.29Å; V124-Q127 PolarHBondContact O-N 3.31Å; V124-R142 HydrophobicContact CG1-CB 3.56Å; V124-R142 HydrophobicContact CG1-CG 3.86Å; V124-R142 WeakPolarHBondContact CG1-O 3.37Å; V124-L145 HydrophobicContact CB-CD2 4.41Å; V124-L145 HydrophobicContact CG1-CD2 4.43Å; V124-L145 HydrophobicContact CG2-CB 4.36Å; V124-L145 HydrophobicContact CG2-CD2 4.06Å; V124-L145 HydrophobicContact CG2-CG 3.94Å; V124-F146 HydrophobicContact CG2-CB 4.14Å; V124-L149 HydrophobicContact CG2-CD1 4.48Å
125	D	91.6	Very high	95	Very high	81 Å²	81	50.8 Å²	50.8	43%	0.433	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18	-179.5	-72.9	-30.7	0	0	0	113.8	D123 R142	D123-D125 VanDerWaalsContact C-N 3.27Å; D123-D125 PolarHBondContact O-N 3.18Å; D125-R142 IonicContact OD1-CZ 2.75Å; D125-R142 IonicContact OD1-NE 3.28Å; D125-R142 IonicContact OD1-NH1 2.7Å; D125-R142 PolarHBondContact OD1-NH1 3.36Å
126	R	93	Very high	94.6	Very high	152 Å²	152	43 Å²	43	57%	0.574	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.3	-2.3	-177.5	-58.7	-175	-68.3	173.3	3.6	113.4	L122 D123 V124 P129	L122-R126 PolarHBondContact O-NE 3.44Å; D123-R126 PolarHBondContact O-N 3.08Å; D123-R126 IonicContact OD1-CZ 3.7Å; D123-R126 IonicContact OD1-NE 3.82Å; D123-R126 IonicContact OD1-NH2 2.71Å; D123-R126 PolarHBondContact OD1-NH2 2.9Å; V124-R126 PolarHBondContact O-N 3.29Å; R126-P129 WeakPolarHBondContact O-CD 3.28Å
127	Q	94.7	Very high	94.1	Very high	19 Å²	19	44.3 Å²	44.3	9%	0.089	23%	0.234	C	C	.	.	S	Bend	trans	-88	116.4	-178	-67.5	-29.5	-72.3	0	0	112	D123 V124 P129 L145 A166 A170	D123-Q127 VanDerWaalsContact O-CG 3.24Å; D123-Q127 WeakPolarHBondContact O-CG 3.31Å; D123-Q127 PolarHBondContact O-N 2.94Å; D123-Q127 PolarHBondContact O-NE2 2.74Å; V124-Q127 PolarHBondContact O-N 3.31Å; Q127-P129 VanDerWaalsContact C-CD 3.45Å; Q127-P129 VanDerWaalsContact C-N 3.29Å; Q127-L145 HydrophobicContact CB-CD2 3.72Å; Q127-L145 HydrophobicContact CG-CD2 3.92Å; Q127-A166 HydrophobicContact CG-CB 3.42Å; Q127-A166 VanDerWaalsContact CG-CB 3.42Å; Q127-A170 HydrophobicContact CB-CB 4.31Å
128	L	93.2	Very high	93.5	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	27%	0.269	C	S	.	.	S	Bend	trans	46.4	47.6	178	-54.6	177.2	0	0	0	112.5	F23 Q28 N130 H131 F134 A170 I174 W251	F23-L128 HydrophobicContact CE1-CB 4.29Å; F23-L128 HydrophobicContact CE1-CD2 4.06Å; F23-L128 HydrophobicContact CZ-CD1 4.33Å; F23-L128 HydrophobicContact CZ-CD2 4.37Å; Q28-L128 HydrophobicContact CG-CD2 4.19Å; L128-N130 VanDerWaalsContact C-OD1 3.27Å; L128-N130 WeakPolarHBondContact CA-OD1 3.49Å; L128-N130 PolarHBondContact O-N 3.32Å; L128-N130 VanDerWaalsContact O-N 3.09Å; L128-H131 HydrophobicContact CB-CB 4.17Å; L128-H131 VanDerWaalsContact O-CB 3.3Å; L128-H131 WeakPolarHBondContact O-CB 3.3Å; L128-H131 PolarHBondContact O-N 2.99Å; L128-F134 HydrophobicContact CB-CD2 3.86Å; L128-F134 HydrophobicContact CB-CE2 4.36Å; L128-F134 HydrophobicContact CD1-CE2 4.18Å; L128-A170 HydrophobicContact CD1-CB 3.91Å; L128-A170 HydrophobicContact CG-CB 4.45Å; L128-I174 HydrophobicContact CD1-CD1 3.67Å; L128-W251 HydrophobicContact CD1-CH2 4.09Å; L128-W251 HydrophobicContact CD1-CZ3 4.13Å
129	P	92.8	Very high	93.2	Very high	62 Å²	62	49.3 Å²	49.3	40%	0.403	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.4	-175.7	29.6	-36.8	0	0	0	112.2	R126 Q127 H131 A135	R126-P129 WeakPolarHBondContact O-CD 3.28Å; Q127-P129 VanDerWaalsContact C-CD 3.45Å; Q127-P129 VanDerWaalsContact C-N 3.29Å; P129-H131 PolarHBondContact O-N 2.73Å; P129-A135 WeakPolarHBondContact O-CA 3.22Å
130	N	91.7	Very high	93.1	Very high	15 Å²	15	52.9 Å²	52.9	8%	0.08	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	8	173.9	59.1	-38	0	0	0	114.6	F23 F24 E25 Q28 L128	F23-N130 WeakPolarHBondContact CA-O 3.22Å; F23-N130 WeakPolarHBondContact CD1-ND2 3.46Å; F24-N130 WeakPolarHBondContact CD1-O 3.32Å; F24-N130 WeakPolarHBondContact CE1-O 3.42Å; F24-N130 HydrophobicContact CE2-CB 4.15Å; F24-N130 HydrophobicContact CZ-CB 4.29Å; F24-N130 PolarHBondContact N-O 3.05Å; F24-N130 VanDerWaalsContact N-O 3.1Å; E25-N130 HydrophobicContact CG-CB 3.9Å; E25-N130 PolarHBondContact O-ND2 2.78Å; Q28-N130 PolarHBondContact OE1-ND2 3.44Å; L128-N130 VanDerWaalsContact C-OD1 3.27Å; L128-N130 WeakPolarHBondContact CA-OD1 3.49Å; L128-N130 PolarHBondContact O-N 3.32Å; L128-N130 VanDerWaalsContact O-N 3.09Å
131	H	94.6	Very high	93	Very high	7 Å²	7	52.9 Å²	52.9	3%	0.032	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-114.6	136.1	179.5	-175.9	-85.1	0	0	0	111.2	Y21 G22 F23 L128 P129 L133 F134 A135	Y21-H131 PolarHBondContact O-CD2 3.42Å; Y21-H131 PolarHBondContact O-NE2 3.19Å; G22-H131 WeakPolarHBondContact O-CA 3.36Å; G22-H131 PolarHBondContact O-CD2 3.11Å; F23-H131 HydrophobicContact CD1-CB 3.84Å; F23-H131 AromaticContact CD2-CD2 3.81Å; F23-H131 HydrophobicContact CE1-CB 3.65Å; F23-H131 AromaticContact CE1-CD2 3.87Å; F23-H131 AromaticContact CE2-CD2 3.55Å; F23-H131 HydrophobicContact CZ-CB 4.19Å; F23-H131 AromaticContact CZ-CD2 3.6Å; L128-H131 HydrophobicContact CB-CB 4.17Å; L128-H131 VanDerWaalsContact O-CB 3.3Å; L128-H131 WeakPolarHBondContact O-CB 3.3Å; L128-H131 PolarHBondContact O-N 2.99Å; P129-H131 PolarHBondContact O-N 2.73Å; H131-L133 VanDerWaalsContact CE1-CB 3.47Å; H131-L133 WeakPolarHBondContact CE1-CB 3.4Å; H131-L133 WeakPolarHBondContact ND1-CB 3.42Å; H131-L133 PolarHBondContact ND1-N 3.39Å; H131-L133 PolarHBondContact O-N 3.28Å; H131-F134 HydrophobicContact CB-CD2 4.17Å; H131-F134 AromaticContact ND1-CD2 4Å; H131-F134 PolarHBondContact O-N 3.42Å; H131-A135 WeakPolarHBondContact O-CB 3.39Å; H131-A135 PolarHBondContact O-N 3.06Å
132	V	93.8	Very high	93	Very high	46 Å²	46	48.6 Å²	48.6	28%	0.279	25%	0.253	S	S	.	.	H	α-helix	trans	-50.7	-35.5	-175.6	-65.8	0	0	0	0	114.2	L12 V18 G22 F134	L12-V132 HydrophobicContact CD2-CG1 3.64Å; V18-V132 HydrophobicContact CG1-CG1 4.1Å; V18-V132 HydrophobicContact CG2-CG1 4.24Å; G22-V132 WeakPolarHBondContact O-CG1 3.26Å; G22-V132 PolarHBondContact O-N 3.28Å; V132-F134 VanDerWaalsContact C-N 3.35Å; V132-F134 PolarHBondContact O-N 3.41Å
133	L	94.8	Very high	93.1	Very high	53 Å²	53	46 Å²	46	28%	0.277	25%	0.246	S	C	.	.	H	α-helix	trans	-67.8	-29.6	178.4	-174.9	57.9	0	0	0	113.7	H131 I140 G141 L173 I174	H131-L133 VanDerWaalsContact CE1-CB 3.47Å; H131-L133 WeakPolarHBondContact CE1-CB 3.4Å; H131-L133 WeakPolarHBondContact ND1-CB 3.42Å; H131-L133 PolarHBondContact ND1-N 3.39Å; H131-L133 PolarHBondContact O-N 3.28Å; L133-I140 HydrophobicContact CD1-CG2 4.36Å; L133-G141 VanDerWaalsContact O-CA 3.3Å; L133-G141 WeakPolarHBondContact O-CA 3.46Å; L133-L173 HydrophobicContact CD2-CB 4.34Å; L133-I174 HydrophobicContact CD2-CG1 4.28Å
134	F	95.5	Very high	93.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-116.5	-6.8	-172.8	-52.7	-67.9	0	0	0	113.7	L128 H131 V132 I136 G141 R142 L145 A170 L173 I174	L128-F134 HydrophobicContact CB-CD2 3.86Å; L128-F134 HydrophobicContact CB-CE2 4.36Å; L128-F134 HydrophobicContact CD1-CE2 4.18Å; H131-F134 HydrophobicContact CB-CD2 4.17Å; H131-F134 AromaticContact ND1-CD2 4Å; H131-F134 PolarHBondContact O-N 3.42Å; V132-F134 VanDerWaalsContact C-N 3.35Å; V132-F134 PolarHBondContact O-N 3.41Å; F134-I136 VanDerWaalsContact C-N 3.34Å; F134-I136 PolarHBondContact O-N 2.86Å; F134-G141 WeakPolarHBondContact CE1-O 3.39Å; F134-R142 PolarHBondContact O-NE 3.47Å; F134-R142 PolarHBondContact O-NH2 2.92Å; F134-R142 VanDerWaalsContact O-NH2 3.08Å; F134-L145 HydrophobicContact CE1-CB 4.21Å; F134-L145 HydrophobicContact CE1-CD2 4.39Å; F134-A170 HydrophobicContact CE1-CB 4.42Å; F134-A170 HydrophobicContact CE2-CB 3.94Å; F134-A170 HydrophobicContact CZ-CB 3.77Å; F134-A170 WeakPolarHBondContact CZ-O 3.31Å; F134-L173 HydrophobicContact CZ-CB 4.16Å; F134-I174 HydrophobicContact CE2-CD1 3.94Å; F134-I174 HydrophobicContact CE2-CG1 3.76Å; F134-I174 HydrophobicContact CZ-CG1 4.35Å
135	A	92.1	Very high	93.4	Very high	21 Å²	21	46.2 Å²	46.2	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-38.4	-179.2	0	0	0	0	0	112.9	I11 F24 P129 H131 S137 R142	I11-A135 HydrophobicContact CD1-CB 3.87Å; I11-A135 HydrophobicContact CG2-CB 4.44Å; F24-A135 HydrophobicContact CE1-CB 4.09Å; F24-A135 HydrophobicContact CZ-CB 4.37Å; P129-A135 WeakPolarHBondContact O-CA 3.22Å; H131-A135 WeakPolarHBondContact O-CB 3.39Å; H131-A135 PolarHBondContact O-N 3.06Å; A135-S137 PolarHBondContact O-N 3.44Å; A135-R142 PolarHBondContact O-NH2 3.49Å
136	I	88.3	Confident	93.7	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.062	24%	0.237	C	C	.	.	S	Bend	trans	-78	125.6	-177.6	-61.2	168.1	0	0	0	111.2	E7 S8 I11 F134 H138 G139	E7-I136 HydrophobicContact CB-CD1 4.24Å; E7-I136 HydrophobicContact CB-CG1 4.42Å; E7-I136 HydrophobicContact CG-CG1 4.26Å; E7-I136 HydrophobicContact CG-CG2 4.45Å; E7-I136 WeakPolarHBondContact OE2-CG2 3.38Å; S8-I136 WeakPolarHBondContact OG-CD1 3.45Å; I11-I136 HydrophobicContact CD1-CD1 4.2Å; I11-I136 HydrophobicContact CD1-CG1 3.38Å; F134-I136 VanDerWaalsContact C-N 3.34Å; F134-I136 PolarHBondContact O-N 2.86Å; I136-H138 PolarHBondContact O-N 2.86Å; I136-G139 PolarHBondContact O-N 3.24Å
137	S	86.2	Confident	94	Very high	65 Å²	65	39.2 Å²	39.2	46%	0.455	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	130.8	171.2	-64.3	0	0	0	0	110.1	A135 G139 R142	A135-S137 PolarHBondContact O-N 3.44Å; S137-G139 PolarHBondContact O-N 3.18Å; S137-G139 VanDerWaalsContact O-N 3.14Å; S137-R142 PolarHBondContact OG-NH1 3.21Å
138	H	85.7	Confident	94.2	Very high	185 Å²	185	38.3 Å²	38.3	86%	0.856	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	17.3	-172.7	-47.5	-68.6	0	0	0	115	I136	I136-H138 PolarHBondContact O-N 2.86Å
139	G	91.9	Very high	94.4	Very high	13 Å²	13	37.8 Å²	37.8	13%	0.134	21%	0.214	C	C	.	.			trans	-69.4	165	174.4	0	0	0	0	0	113.3	I136 S137 G141 R142 A143	I136-G139 PolarHBondContact O-N 3.24Å; S137-G139 PolarHBondContact O-N 3.18Å; S137-G139 VanDerWaalsContact O-N 3.14Å; G139-G141 VanDerWaalsContact C-N 3.27Å; G139-G141 PolarHBondContact O-N 3.02Å; G139-R142 PolarHBondContact O-N 3.44Å; G139-A143 PolarHBondContact O-N 3.36Å; G139-A143 VanDerWaalsContact O-N 3.16Å
140	I	94.6	Very high	94.7	Very high	137 Å²	137	36.1 Å²	36.1	70%	0.703	20%	0.2	S	C	*	.	H	α-helix	trans	-57.5	-37.7	-177	-167	167.4	0	0	0	112.7	L133 A143 S144	L133-I140 HydrophobicContact CD1-CG2 4.36Å; I140-A143 PolarHBondContact O-N 2.75Å; I140-S144 WeakPolarHBondContact O-CB 3.34Å; I140-S144 PolarHBondContact O-N 3.43Å; I140-S144 PolarHBondContact O-OG 3Å
141	G	95.8	Very high	95.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-41.8	179.7	0	0	0	0	0	113.5	L133 F134 G139 S144 L145	L133-G141 VanDerWaalsContact O-CA 3.3Å; L133-G141 WeakPolarHBondContact O-CA 3.46Å; F134-G141 WeakPolarHBondContact CE1-O 3.39Å; G139-G141 VanDerWaalsContact C-N 3.27Å; G139-G141 PolarHBondContact O-N 3.02Å; G141-S144 PolarHBondContact O-N 3.22Å; G141-L145 WeakPolarHBondContact O-CB 3.49Å; G141-L145 PolarHBondContact O-N 2.9Å
142	R	96.7	Very high	95.2	Very high	28 Å²	28	35.3 Å²	35.3	11%	0.106	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-39.7	175.5	-70.5	-167.5	-171.7	174.4	14.1	111.5	V124 D125 F134 A135 S137 G139 L145 F146	V124-R142 HydrophobicContact CG1-CB 3.56Å; V124-R142 HydrophobicContact CG1-CG 3.86Å; V124-R142 WeakPolarHBondContact CG1-O 3.37Å; D125-R142 IonicContact OD1-CZ 2.75Å; D125-R142 IonicContact OD1-NE 3.28Å; D125-R142 IonicContact OD1-NH1 2.7Å; D125-R142 PolarHBondContact OD1-NH1 3.36Å; F134-R142 PolarHBondContact O-NE 3.47Å; F134-R142 PolarHBondContact O-NH2 2.92Å; F134-R142 VanDerWaalsContact O-NH2 3.08Å; A135-R142 PolarHBondContact O-NH2 3.49Å; S137-R142 PolarHBondContact OG-NH1 3.21Å; G139-R142 PolarHBondContact O-N 3.44Å; R142-L145 PolarHBondContact O-N 3.47Å; R142-F146 WeakPolarHBondContact O-CB 3.37Å; R142-F146 PolarHBondContact O-N 3.31Å
143	A	97.6	Very high	95.5	Very high	48 Å²	48	33.4 Å²	33.4	40%	0.397	18%	0.184	S	C	.	.	H	α-helix	trans	-62.6	-46.5	174.6	0	0	0	0	0	111.8	G139 I140 L145 F146 N147	G139-A143 PolarHBondContact O-N 3.36Å; G139-A143 VanDerWaalsContact O-N 3.16Å; I140-A143 PolarHBondContact O-N 2.75Å; A143-L145 PolarHBondContact O-N 3.25Å; A143-F146 WeakPolarHBondContact O-CB 3.35Å; A143-F146 PolarHBondContact O-N 3.48Å; A143-N147 WeakPolarHBondContact O-CB 3.34Å; A143-N147 VanDerWaalsContact O-CG 3.23Å; A143-N147 PolarHBondContact O-N 2.85Å
144	S	98.3	Very high	95.6	Very high	15 Å²	15	32.9 Å²	32.9	11%	0.105	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-40	176.1	-67.7	0	0	0	0	112.5	I140 G141 N147 V148 E178	I140-S144 WeakPolarHBondContact O-CB 3.34Å; I140-S144 PolarHBondContact O-N 3.43Å; I140-S144 PolarHBondContact O-OG 3Å; G141-S144 PolarHBondContact O-N 3.22Å; S144-N147 PolarHBondContact O-N 3.19Å; S144-V148 WeakPolarHBondContact O-CG2 3.31Å; S144-V148 PolarHBondContact O-N 2.91Å; S144-E178 VanDerWaalsContact CA-OE2 3.26Å; S144-E178 WeakPolarHBondContact CA-OE2 3.42Å; S144-E178 WeakPolarHBondContact CB-OE2 3.2Å; S144-E178 PolarHBondContact OG-OE2 3.34Å
145	L	98.5	Very high	95.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-45.9	175.9	-178.8	58.6	0	0	0	111.7	V124 Q127 F134 G141 R142 A143 N147 V148 L149 A169 A170 L173	V124-L145 HydrophobicContact CB-CD2 4.41Å; V124-L145 HydrophobicContact CG1-CD2 4.43Å; V124-L145 HydrophobicContact CG2-CB 4.36Å; V124-L145 HydrophobicContact CG2-CD2 4.06Å; V124-L145 HydrophobicContact CG2-CG 3.94Å; Q127-L145 HydrophobicContact CB-CD2 3.72Å; Q127-L145 HydrophobicContact CG-CD2 3.92Å; F134-L145 HydrophobicContact CE1-CB 4.21Å; F134-L145 HydrophobicContact CE1-CD2 4.39Å; G141-L145 WeakPolarHBondContact O-CB 3.49Å; G141-L145 PolarHBondContact O-N 2.9Å; R142-L145 PolarHBondContact O-N 3.47Å; A143-L145 PolarHBondContact O-N 3.25Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.18Å; L145-V148 PolarHBondContact O-N 3.43Å; L145-L149 HydrophobicContact CD1-CD1 3.85Å; L145-L149 HydrophobicContact CD1-CG 4.13Å; L145-L149 HydrophobicContact CG-CD1 3.98Å; L145-L149 VanDerWaalsContact O-CG 3.3Å; L145-L149 WeakPolarHBondContact O-CG 3.46Å; L145-L149 PolarHBondContact O-N 3.3Å; L145-L149 VanDerWaalsContact O-N 3.11Å; L145-A169 HydrophobicContact CD1-CB 3.63Å; L145-A170 HydrophobicContact CD1-CB 4Å; L145-A170 HydrophobicContact CD2-CB 4.04Å; L145-L173 VanDerWaalsContact CA-CD1 3.43Å; L145-L173 HydrophobicContact CB-CD1 3.85Å; L145-L173 HydrophobicContact CD1-CD1 4.1Å
146	F	98.4	Very high	95.9	Very high	43 Å²	43	35.7 Å²	35.7	19%	0.189	19%	0.192	C	C	.	.	H	α-helix	trans	-56.8	-47.4	174.2	174.3	-92.6	0	0	0	111.5	I117 I120 K121 V124 R142 A143 L149 K150	I117-F146 HydrophobicContact CD1-CE2 4.19Å; I117-F146 HydrophobicContact CD1-CZ 3.83Å; I117-F146 HydrophobicContact CG2-CE2 4Å; I117-F146 HydrophobicContact CG2-CZ 3.99Å; I120-F146 HydrophobicContact CB-CD2 4.4Å; I120-F146 HydrophobicContact CG2-CD2 3.63Å; I120-F146 HydrophobicContact CG2-CE2 4.2Å; I120-F146 HydrophobicContact CG2-CG 4.41Å; K121-F146 HydrophobicContact CG-CD2 4.03Å; K121-F146 HydrophobicContact CG-CE2 3.78Å; V124-F146 HydrophobicContact CG2-CB 4.14Å; R142-F146 WeakPolarHBondContact O-CB 3.37Å; R142-F146 PolarHBondContact O-N 3.31Å; A143-F146 WeakPolarHBondContact O-CB 3.35Å; A143-F146 PolarHBondContact O-N 3.48Å; F146-L149 PolarHBondContact O-N 2.88Å; F146-K150 HydrophobicContact CE1-CB 4.47Å; F146-K150 HydrophobicContact CE1-CD 3.98Å; F146-K150 HydrophobicContact CZ-CD 4.29Å; F146-K150 VanDerWaalsContact O-CB 3.22Å; F146-K150 WeakPolarHBondContact O-CB 3.44Å; F146-K150 PolarHBondContact O-N 3.11Å
147	N	98.7	Very high	96.2	Very high	44 Å²	44	40.1 Å²	40.1	24%	0.235	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-48.7	-179.4	-76.5	-10.1	0	0	0	112.5	Y104 L108 A143 S144 L145 L149 K150 A151 E178	Y104-N147 WeakPolarHBondContact OH-CB 3.48Å; L108-N147 HydrophobicContact CD2-CB 3.63Å; A143-N147 WeakPolarHBondContact O-CB 3.34Å; A143-N147 VanDerWaalsContact O-CG 3.23Å; A143-N147 PolarHBondContact O-N 2.85Å; S144-N147 PolarHBondContact O-N 3.19Å; L145-N147 VanDerWaalsContact C-N 3.32Å; L145-N147 PolarHBondContact O-N 3.18Å; N147-L149 PolarHBondContact O-N 2.94Å; N147-K150 PolarHBondContact O-N 3.13Å; N147-A151 VanDerWaalsContact O-CB 3.23Å; N147-A151 WeakPolarHBondContact O-CB 3.32Å; N147-A151 PolarHBondContact O-N 3.16Å; N147-E178 VanDerWaalsContact CB-OE1 3.26Å; N147-E178 WeakPolarHBondContact CB-OE1 3.48Å; N147-E178 PolarHBondContact ND2-OE1 3Å; N147-E178 VanDerWaalsContact ND2-OE1 3.09Å
148	V	98.8	Very high	96.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-48.4	179	169	0	0	0	0	111	S144 L145 A151 Y152 A169 L173 E178 F182 F185	S144-V148 WeakPolarHBondContact O-CG2 3.31Å; S144-V148 PolarHBondContact O-N 2.91Å; L145-V148 PolarHBondContact O-N 3.43Å; V148-A151 PolarHBondContact O-N 3.11Å; V148-Y152 WeakPolarHBondContact O-CB 3.2Å; V148-Y152 PolarHBondContact O-N 3.28Å; V148-A169 HydrophobicContact CG1-CB 3.97Å; V148-L173 HydrophobicContact CG2-CD1 4.35Å; V148-L173 HydrophobicContact CG2-CD2 4.24Å; V148-E178 HydrophobicContact CG2-CG 3.93Å; V148-F182 HydrophobicContact CG1-CB 4.44Å; V148-F182 HydrophobicContact CG1-CD2 4.48Å; V148-F182 HydrophobicContact CG2-CB 4.22Å; V148-F185 HydrophobicContact CG1-CD1 4.3Å
149	L	98.7	Very high	96.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-42.4	-177.9	-67.1	173.9	0	0	0	111.9	I120 V124 L145 F146 N147 Y152 S153 Y161 Q165 A166 A169 F185	I120-L149 HydrophobicContact CD1-CB 3.97Å; I120-L149 HydrophobicContact CG1-CB 4.24Å; I120-L149 HydrophobicContact CG2-CB 3.88Å; I120-L149 HydrophobicContact CG2-CD1 3.98Å; V124-L149 HydrophobicContact CG2-CD1 4.48Å; L145-L149 HydrophobicContact CD1-CD1 3.85Å; L145-L149 HydrophobicContact CD1-CG 4.13Å; L145-L149 HydrophobicContact CG-CD1 3.98Å; L145-L149 VanDerWaalsContact O-CG 3.3Å; L145-L149 WeakPolarHBondContact O-CG 3.46Å; L145-L149 PolarHBondContact O-N 3.3Å; L145-L149 VanDerWaalsContact O-N 3.11Å; F146-L149 PolarHBondContact O-N 2.88Å; N147-L149 PolarHBondContact O-N 2.94Å; L149-Y152 PolarHBondContact O-N 3.24Å; L149-S153 PolarHBondContact O-N 3.15Å; L149-Y161 HydrophobicContact CB-CD2 4.48Å; L149-Y161 HydrophobicContact CB-CE2 4.3Å; L149-Y161 HydrophobicContact CD1-CE2 3.86Å; L149-Y161 HydrophobicContact CD2-CD2 4.36Å; L149-Y161 HydrophobicContact CD2-CE2 3.87Å; L149-Y161 HydrophobicContact CG-CE2 4.22Å; L149-Q165 HydrophobicContact CD2-CB 4.07Å; L149-A166 HydrophobicContact CD1-CB 3.98Å; L149-A169 HydrophobicContact CD2-CB 3.7Å; L149-A169 HydrophobicContact CG-CB 4.21Å; L149-F185 HydrophobicContact CD2-CE1 4.46Å
150	K	98.6	Very high	96.9	Very high	27 Å²	27	35.2 Å²	35.2	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-54	174	171.5	-173.4	170.6	-163.5	0	110.4	L108 M110 I117 F146 N147 Y152 S153 L154	L108-K150 PolarHBondContact O-NZ 3.26Å; M110-K150 WeakPolarHBondContact O-CE 3.4Å; M110-K150 PolarHBondContact O-NZ 3.15Å; I117-K150 HydrophobicContact CD1-CB 4.1Å; I117-K150 HydrophobicContact CD1-CD 3.88Å; I117-K150 HydrophobicContact CD1-CG 3.7Å; F146-K150 HydrophobicContact CE1-CB 4.47Å; F146-K150 HydrophobicContact CE1-CD 3.98Å; F146-K150 HydrophobicContact CZ-CD 4.29Å; F146-K150 VanDerWaalsContact O-CB 3.22Å; F146-K150 WeakPolarHBondContact O-CB 3.44Å; F146-K150 PolarHBondContact O-N 3.11Å; N147-K150 PolarHBondContact O-N 3.13Å; K150-Y152 PolarHBondContact O-N 3.04Å; K150-S153 PolarHBondContact O-N 3.03Å; K150-S153 VanDerWaalsContact O-N 3.13Å; K150-S153 PolarHBondContact O-OG 3.36Å; K150-L154 HydrophobicContact CG-CD1 4.14Å; K150-L154 PolarHBondContact O-N 2.67Å
151	A	98.7	Very high	97.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-38.7	-178.5	0	0	0	0	0	111.4	Y104 L107 L108 N147 V148 L154 L155 F182	Y104-A151 HydrophobicContact CD2-CB 3.89Å; Y104-A151 HydrophobicContact CE2-CB 3.54Å; L107-A151 HydrophobicContact CB-CB 3.93Å; L107-A151 HydrophobicContact CD1-CB 4.31Å; L108-A151 HydrophobicContact CD2-CB 4.49Å; N147-A151 VanDerWaalsContact O-CB 3.23Å; N147-A151 WeakPolarHBondContact O-CB 3.32Å; N147-A151 PolarHBondContact O-N 3.16Å; V148-A151 PolarHBondContact O-N 3.11Å; A151-L154 PolarHBondContact O-N 3.21Å; A151-L155 WeakPolarHBondContact O-CB 3.22Å; A151-L155 PolarHBondContact O-N 3.03Å; A151-F182 HydrophobicContact CB-CD2 3.92Å; A151-F182 HydrophobicContact CB-CE2 3.57Å; A151-F182 HydrophobicContact CB-CZ 4.19Å
152	Y	98.6	Very high	97.1	Very high	5 Å²	5	31.5 Å²	31.5	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-45.4	176	-179.3	-88.8	0	0	0	111.8	V148 L149 K150 L154 L155 H156 Q165 F185 V186 C189	V148-Y152 WeakPolarHBondContact O-CB 3.2Å; V148-Y152 PolarHBondContact O-N 3.28Å; L149-Y152 PolarHBondContact O-N 3.24Å; K150-Y152 PolarHBondContact O-N 3.04Å; Y152-L154 VanDerWaalsContact C-N 3.26Å; Y152-L154 PolarHBondContact O-N 2.84Å; Y152-L155 PolarHBondContact O-N 3.07Å; Y152-L155 VanDerWaalsContact O-N 3.13Å; Y152-H156 AromaticContact CD2-CE1 3.94Å; Y152-H156 AromaticContact CD2-ND1 3.63Å; Y152-H156 HydrophobicContact CE1-CB 4.13Å; Y152-H156 AromaticContact CE1-ND1 3.99Å; Y152-H156 AromaticContact CE2-CE1 3.48Å; Y152-H156 VanDerWaalsContact CE2-CE1 3.48Å; Y152-H156 WeakPolarHBondContact CE2-CE1 3.42Å; Y152-H156 AromaticContact CE2-ND1 3.31Å; Y152-H156 VanDerWaalsContact CE2-ND1 3.31Å; Y152-H156 WeakPolarHBondContact CE2-ND1 3.37Å; Y152-H156 AromaticContact CZ-CE1 4Å; Y152-H156 AromaticContact CZ-CG 3.78Å; Y152-H156 AromaticContact CZ-ND1 3.5Å; Y152-H156 PolarHBondContact O-N 3.01Å; Y152-H156 PolarHBondContact O-ND1 2.96Å; Y152-Q165 VanDerWaalsContact CE1-NE2 3.26Å; Y152-F185 AromaticContact CD1-CE1 3.87Å; Y152-F185 HydrophobicContact CD1-CE1 3.87Å; Y152-F185 AromaticContact CD2-CD1 3.57Å; Y152-F185 HydrophobicContact CD2-CD1 3.57Å; Y152-F185 AromaticContact CD2-CE1 3.52Å; Y152-F185 HydrophobicContact CD2-CE1 3.52Å; Y152-F185 HydrophobicContact CE1-CE1 4.35Å; Y152-F185 HydrophobicContact CE2-CD1 4.26Å; Y152-F185 HydrophobicContact CE2-CE1 4.04Å; Y152-F185 AromaticContact CG-CD1 3.83Å; Y152-F185 HydrophobicContact CG-CD1 3.83Å; Y152-F185 AromaticContact CG-CE1 3.44Å; Y152-F185 HydrophobicContact CG-CE1 3.44Å; Y152-F185 VanDerWaalsContact CG-CE1 3.44Å; Y152-V186 HydrophobicContact CD2-CG2 3.91Å; Y152-V186 HydrophobicContact CE2-CG2 4.35Å; Y152-C189 HydrophobicContact CE2-CB 3.68Å; Y152-C189 WeakPolarHBondContact OH-CB 3.41Å
153	S	98.1	Very high	97	Very high	6 Å²	6	34.6 Å²	34.6	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-34.3	179.3	74.4	0	0	0	0	112.8	L149 K150 H156	L149-S153 PolarHBondContact O-N 3.15Å; K150-S153 PolarHBondContact O-N 3.03Å; K150-S153 VanDerWaalsContact O-N 3.13Å; K150-S153 PolarHBondContact O-OG 3.36Å; S153-H156 CarbonylContact O-C 3.45Å
154	L	98.4	Very high	96.9	Very high	41 Å²	41	32.6 Å²	32.6	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-71.7	-36.9	174.6	-75.7	170	0	0	0	112.5	L107 M110 P111 K150 A151 Y152 H156	L107-L154 HydrophobicContact CD2-CB 3.83Å; L107-L154 VanDerWaalsContact O-CD1 3.31Å; L107-L154 WeakPolarHBondContact O-CD1 3.28Å; M110-L154 HydrophobicContact CB-CD1 3.96Å; P111-L154 WeakPolarHBondContact O-CD2 3.42Å; K150-L154 HydrophobicContact CG-CD1 4.14Å; K150-L154 PolarHBondContact O-N 2.67Å; A151-L154 PolarHBondContact O-N 3.21Å; Y152-L154 VanDerWaalsContact C-N 3.26Å; Y152-L154 PolarHBondContact O-N 2.84Å; L154-H156 VanDerWaalsContact C-N 3.32Å
155	L	97.6	Very high	96.9	Very high	46 Å²	46	31.9 Å²	31.9	24%	0.241	19%	0.187	C	C	.	.	H	α-helix	trans	-72.5	-27.3	176.9	-173.6	61.6	0	0	0	112.2	L107 A151 Y152 F182 W183 V186	L107-L155 HydrophobicContact CD1-CB 4.27Å; A151-L155 WeakPolarHBondContact O-CB 3.22Å; A151-L155 PolarHBondContact O-N 3.03Å; Y152-L155 PolarHBondContact O-N 3.07Å; Y152-L155 VanDerWaalsContact O-N 3.13Å; L155-F182 HydrophobicContact CD2-CZ 3.89Å; L155-W183 HydrophobicContact CD2-CZ3 4.35Å; L155-V186 HydrophobicContact CD2-CG1 4.21Å; L155-V186 HydrophobicContact CD2-CG2 3.83Å
156	H	96.6	Very high	96.9	Very high	34 Å²	34	31.9 Å²	31.9	16%	0.157	19%	0.187	C	C	.	.			trans	-127.3	63.9	-177.2	-57.4	85.9	0	0	0	112.1	Y152 S153 L154 A158 T159 G160 N190	Y152-H156 AromaticContact CD2-CE1 3.94Å; Y152-H156 AromaticContact CD2-ND1 3.63Å; Y152-H156 HydrophobicContact CE1-CB 4.13Å; Y152-H156 AromaticContact CE1-ND1 3.99Å; Y152-H156 AromaticContact CE2-CE1 3.48Å; Y152-H156 VanDerWaalsContact CE2-CE1 3.48Å; Y152-H156 WeakPolarHBondContact CE2-CE1 3.42Å; Y152-H156 AromaticContact CE2-ND1 3.31Å; Y152-H156 VanDerWaalsContact CE2-ND1 3.31Å; Y152-H156 WeakPolarHBondContact CE2-ND1 3.37Å; Y152-H156 AromaticContact CZ-CE1 4Å; Y152-H156 AromaticContact CZ-CG 3.78Å; Y152-H156 AromaticContact CZ-ND1 3.5Å; Y152-H156 PolarHBondContact O-N 3.01Å; Y152-H156 PolarHBondContact O-ND1 2.96Å; S153-H156 CarbonylContact O-C 3.45Å; L154-H156 VanDerWaalsContact C-N 3.32Å; H156-A158 PolarHBondContact O-N 3.43Å; H156-A158 VanDerWaalsContact O-N 3.14Å; H156-T159 PolarHBondContact O-N 3.14Å; H156-G160 PolarHBondContact O-N 2.9Å; H156-N190 PolarHBondContact NE2-ND2 3.31Å; H156-N190 PolarHBondContact NE2-OD1 3.41Å; H156-N190 VanDerWaalsContact NE2-OD1 3.11Å
157	P	94.9	Very high	96.9	Very high	106 Å²	106	29.9 Å²	29.9	69%	0.688	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.7	-172	24.7	-35.1	0	0	0	114.1	T159	P157-T159 VanDerWaalsContact C-N 3.31Å; P157-T159 PolarHBondContact O-N 3.05Å
158	A	92.1	Very high	96.8	Very high	108 Å²	108	27.8 Å²	27.8	89%	0.893	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-32.5	177.2	0	0	0	0	0	113.2	H156	H156-A158 PolarHBondContact O-N 3.43Å; H156-A158 VanDerWaalsContact O-N 3.14Å
159	T	92.2	Very high	96.8	Very high	47 Å²	47	27.8 Å²	27.8	29%	0.288	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-34.4	175.9	-53.4	0	0	0	0	110.8	H156 P157 Y161 F197	H156-T159 PolarHBondContact O-N 3.14Å; P157-T159 VanDerWaalsContact C-N 3.31Å; P157-T159 PolarHBondContact O-N 3.05Å; T159-Y161 PolarHBondContact O-N 3.43Å; T159-F197 HydrophobicContact CG2-CB 3.61Å
160	G	94.1	Very high	96.8	Very high	5 Å²	5	27.8 Å²	27.8	5%	0.052	17%	0.167	C	C	.	.			trans	61	-121.8	-176.2	0	0	0	0	0	111.4	H156	H156-G160 PolarHBondContact O-N 2.9Å
161	Y	96.9	Very high	96.8	Very high	30 Å²	30	26.6 Å²	26.6	12%	0.118	16%	0.163	C	C	.	.			trans	-124.1	135	-179.4	176.2	-114.1	0	0	0	111.6	I116 Q119 I120 D123 L149 T159 Q165 A166	I116-Y161 HydrophobicContact CG2-CG 4.49Å; Q119-Y161 HydrophobicContact CB-CD1 4.29Å; Q119-Y161 HydrophobicContact CB-CE1 4.42Å; Q119-Y161 HydrophobicContact CG-CD1 3.95Å; Q119-Y161 HydrophobicContact CG-CE1 3.85Å; I120-Y161 HydrophobicContact CD1-CD2 4.27Å; I120-Y161 HydrophobicContact CD1-CG 4.15Å; I120-Y161 HydrophobicContact CG1-CD1 3.61Å; I120-Y161 HydrophobicContact CG1-CD2 3.82Å; I120-Y161 HydrophobicContact CG1-CE1 3.76Å; I120-Y161 HydrophobicContact CG1-CE2 3.99Å; I120-Y161 HydrophobicContact CG1-CG 3.63Å; D123-Y161 VanDerWaalsContact CB-OH 3.22Å; D123-Y161 WeakPolarHBondContact CB-OH 3.41Å; D123-Y161 WeakPolarHBondContact OD2-CE1 3.37Å; D123-Y161 PolarHBondContact OD2-OH 2.88Å; L149-Y161 HydrophobicContact CB-CD2 4.48Å; L149-Y161 HydrophobicContact CB-CE2 4.3Å; L149-Y161 HydrophobicContact CD1-CE2 3.86Å; L149-Y161 HydrophobicContact CD2-CD2 4.36Å; L149-Y161 HydrophobicContact CD2-CE2 3.87Å; L149-Y161 HydrophobicContact CG-CE2 4.22Å; T159-Y161 PolarHBondContact O-N 3.43Å; Y161-Q165 HydrophobicContact CD2-CB 4.44Å; Y161-Q165 HydrophobicContact CE2-CB 4.17Å; Y161-A166 WeakPolarHBondContact OH-CB 3.44Å
162	C	95.9	Very high	96.8	Very high	28 Å²	28	26.6 Å²	26.6	19%	0.189	16%	0.163	C	C	.	.			trans	-124.3	134.3	172.5	177.5	0	0	0	0	108.8	A164 Q165 F197	C162-A164 PolarHBondContact O-N 3.02Å; C162-Q165 HydrophobicContact CB-CG 4.19Å; C162-Q165 WeakPolarHBondContact O-CB 3.45Å; C162-Q165 VanDerWaalsContact O-CG 3.28Å; C162-Q165 WeakPolarHBondContact O-CG 3.28Å; C162-Q165 PolarHBondContact O-N 2.86Å; C162-Q165 PolarHBondContact O-OE1 3.46Å; C162-F197 HydrophobicContact CB-CB 3.77Å; C162-F197 HydrophobicContact CB-CD1 3.89Å; C162-F197 HydrophobicContact CB-CG 4.18Å
163	Q	95.1	Very high	96.8	Very high	94 Å²	94	27.1 Å²	27.1	44%	0.439	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.5	-173.7	-56.8	-172	-23.4	0	0	113.7	D123 Q165 A166 P167	D123-Q163 VanDerWaalsContact OD2-CG 3.32Å; D123-Q163 WeakPolarHBondContact OD2-CG 3.27Å; Q163-Q165 PolarHBondContact O-N 3.48Å; Q163-A166 WeakPolarHBondContact O-CB 3.12Å; Q163-A166 PolarHBondContact O-N 3.07Å; Q163-P167 WeakPolarHBondContact O-CD 3.4Å
164	A	96.2	Very high	96.8	Very high	6 Å²	6	28.4 Å²	28.4	5%	0.05	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.3	177.2	0	0	0	0	0	114.3	C162 P167 F197 M242	C162-A164 PolarHBondContact O-N 3.02Å; A164-P167 WeakPolarHBondContact O-CD 3.41Å; A164-P167 WeakPolarHBondContact O-CG 3.42Å; A164-F197 HydrophobicContact CB-CD1 4.44Å; A164-F197 HydrophobicContact CB-CE1 4.06Å; A164-M242 HydrophobicContact CB-CB 3.67Å; A164-M242 HydrophobicContact CB-CE 3.86Å
165	Q	98	Very high	96.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-71.6	-33.4	174.9	-68.3	175.2	-29.8	0	0	112.5	L149 Y152 Y161 C162 Q163 I168 A169 F185 F197	L149-Q165 HydrophobicContact CD2-CB 4.07Å; Y152-Q165 VanDerWaalsContact CE1-NE2 3.26Å; Y161-Q165 HydrophobicContact CD2-CB 4.44Å; Y161-Q165 HydrophobicContact CE2-CB 4.17Å; C162-Q165 HydrophobicContact CB-CG 4.19Å; C162-Q165 WeakPolarHBondContact O-CB 3.45Å; C162-Q165 VanDerWaalsContact O-CG 3.28Å; C162-Q165 WeakPolarHBondContact O-CG 3.28Å; C162-Q165 PolarHBondContact O-N 2.86Å; C162-Q165 PolarHBondContact O-OE1 3.46Å; Q163-Q165 PolarHBondContact O-N 3.48Å; Q165-I168 PolarHBondContact O-N 3.48Å; Q165-A169 PolarHBondContact O-N 3.05Å; Q165-F185 HydrophobicContact CB-CE1 4.49Å; Q165-F185 HydrophobicContact CB-CE2 4.36Å; Q165-F185 HydrophobicContact CB-CZ 3.62Å; Q165-F185 HydrophobicContact CG-CZ 3.84Å; Q165-F197 HydrophobicContact CG-CD1 3.69Å; Q165-F197 HydrophobicContact CG-CD2 4.04Å; Q165-F197 HydrophobicContact CG-CE1 3.69Å; Q165-F197 HydrophobicContact CG-CE2 4.04Å; Q165-F197 HydrophobicContact CG-CG 3.87Å; Q165-F197 HydrophobicContact CG-CZ 3.86Å
166	A	98.2	Very high	96.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.4	-49.6	-175.1	0	0	0	0	0	114.1	Q127 L149 Y161 Q163 I168 A169 A170	Q127-A166 HydrophobicContact CG-CB 3.42Å; Q127-A166 VanDerWaalsContact CG-CB 3.42Å; L149-A166 HydrophobicContact CD1-CB 3.98Å; Y161-A166 WeakPolarHBondContact OH-CB 3.44Å; Q163-A166 WeakPolarHBondContact O-CB 3.12Å; Q163-A166 PolarHBondContact O-N 3.07Å; A166-I168 VanDerWaalsContact C-N 3.26Å; A166-I168 PolarHBondContact O-N 2.93Å; A166-A169 PolarHBondContact O-N 2.99Å; A166-A170 VanDerWaalsContact O-CB 3.32Å; A166-A170 WeakPolarHBondContact O-CB 3.44Å; A166-A170 PolarHBondContact O-N 3.37Å
167	P	97.7	Very high	96.8	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-31.4	178.7	23.7	-33.7	0	0	0	112.6	Q163 A164 A171 C243 T246 R247	Q163-P167 WeakPolarHBondContact O-CD 3.4Å; A164-P167 WeakPolarHBondContact O-CD 3.41Å; A164-P167 WeakPolarHBondContact O-CG 3.42Å; P167-A171 VanDerWaalsContact O-CB 3.24Å; P167-A171 WeakPolarHBondContact O-CB 3.45Å; P167-A171 PolarHBondContact O-N 3.43Å; P167-C243 HydrophobicContact CG-CB 3.83Å; P167-C243 VanDerWaalsContact CG-SG 3.59Å; P167-T246 HydrophobicContact CB-CG2 4.05Å; P167-R247 HydrophobicContact CB-CG 4.26Å; P167-R247 HydrophobicContact CG-CG 4.34Å
168	I	98.4	Very high	97	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.6	-48.2	177.2	-61	171.7	0	0	0	110.3	Q165 A166 A170 A171 L172 F185 L188 M193 F197 M242 L244 W258	Q165-I168 PolarHBondContact O-N 3.48Å; A166-I168 VanDerWaalsContact C-N 3.26Å; A166-I168 PolarHBondContact O-N 2.93Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 3.32Å; I168-A171 PolarHBondContact O-N 3.22Å; I168-L172 WeakPolarHBondContact O-CG 3.03Å; I168-L172 PolarHBondContact O-N 2.94Å; I168-F185 HydrophobicContact CB-CD2 4.35Å; I168-F185 HydrophobicContact CB-CE2 3.97Å; I168-F185 HydrophobicContact CG2-CD2 3.75Å; I168-F185 HydrophobicContact CG2-CE2 3.78Å; I168-L188 HydrophobicContact CG2-CD1 3.85Å; I168-M193 HydrophobicContact CD1-CE 3.68Å; I168-M193 HydrophobicContact CD1-SD 3.71Å; I168-F197 HydrophobicContact CD1-CZ 4.07Å; I168-M242 VanDerWaalsContact CD1-O 3.27Å; I168-M242 WeakPolarHBondContact CD1-O 3.37Å; I168-L244 HydrophobicContact CD1-CD1 4.07Å; I168-L244 HydrophobicContact CD1-CG 3.97Å; I168-L244 HydrophobicContact CG1-CD1 4.34Å; I168-L244 HydrophobicContact CG1-CG 4.37Å; I168-L244 HydrophobicContact CG2-CD1 4.38Å; I168-W258 HydrophobicContact CB-CH2 4.43Å; I168-W258 HydrophobicContact CG2-CH2 3.82Å; I168-W258 HydrophobicContact CG2-CZ2 4.24Å
169	A	98.7	Very high	97.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.8	-42.9	177.5	0	0	0	0	0	111.5	L145 V148 L149 Q165 A166 A171 L172 L173 F185	L145-A169 HydrophobicContact CD1-CB 3.63Å; V148-A169 HydrophobicContact CG1-CB 3.97Å; L149-A169 HydrophobicContact CD2-CB 3.7Å; L149-A169 HydrophobicContact CG-CB 4.21Å; Q165-A169 PolarHBondContact O-N 3.05Å; A166-A169 PolarHBondContact O-N 2.99Å; A169-A171 VanDerWaalsContact C-N 3.33Å; A169-A171 PolarHBondContact O-N 2.94Å; A169-L172 PolarHBondContact O-N 3.44Å; A169-L173 WeakPolarHBondContact O-CG 3.23Å; A169-L173 PolarHBondContact O-N 3.1Å; A169-F185 HydrophobicContact CB-CD2 4.38Å
170	A	98.4	Very high	97.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-43.6	175.1	0	0	0	0	0	111.3	Q127 L128 F134 L145 A166 I168 L172 L173 I174	Q127-A170 HydrophobicContact CB-CB 4.31Å; L128-A170 HydrophobicContact CD1-CB 3.91Å; L128-A170 HydrophobicContact CG-CB 4.45Å; F134-A170 HydrophobicContact CE1-CB 4.42Å; F134-A170 HydrophobicContact CE2-CB 3.94Å; F134-A170 HydrophobicContact CZ-CB 3.77Å; F134-A170 WeakPolarHBondContact CZ-O 3.31Å; L145-A170 HydrophobicContact CD1-CB 4Å; L145-A170 HydrophobicContact CD2-CB 4.04Å; A166-A170 VanDerWaalsContact O-CB 3.32Å; A166-A170 WeakPolarHBondContact O-CB 3.44Å; A166-A170 PolarHBondContact O-N 3.37Å; I168-A170 VanDerWaalsContact C-N 3.34Å; I168-A170 PolarHBondContact O-N 3.32Å; A170-L172 VanDerWaalsContact C-N 3.34Å; A170-L172 PolarHBondContact O-N 3.45Å; A170-L173 PolarHBondContact O-N 2.87Å; A170-I174 WeakPolarHBondContact O-CG1 3.44Å; A170-I174 PolarHBondContact O-N 2.86Å
171	A	98.1	Very high	97.8	Very high	2 Å²	2	21.2 Å²	21.2	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-64.2	-36.5	177.4	0	0	0	0	0	113.4	P167 I168 A169 H175 T246 W251 W258	P167-A171 VanDerWaalsContact O-CB 3.24Å; P167-A171 WeakPolarHBondContact O-CB 3.45Å; P167-A171 PolarHBondContact O-N 3.43Å; I168-A171 PolarHBondContact O-N 3.22Å; A169-A171 VanDerWaalsContact C-N 3.33Å; A169-A171 PolarHBondContact O-N 2.94Å; A171-H175 PolarHBondContact O-CD2 3.49Å; A171-H175 VanDerWaalsContact O-CD2 3.27Å; A171-T246 HydrophobicContact CB-CG2 4.04Å; A171-W251 HydrophobicContact CB-CH2 3.47Å; A171-W251 VanDerWaalsContact CB-CH2 3.47Å; A171-W251 HydrophobicContact CB-CZ2 4.26Å; A171-W251 HydrophobicContact CB-CZ3 4.24Å; A171-W258 HydrophobicContact CB-CH2 3.47Å; A171-W258 VanDerWaalsContact CB-CH2 3.47Å; A171-W258 HydrophobicContact CB-CZ2 3.99Å; A171-W258 HydrophobicContact CB-CZ3 4.03Å
172	L	98.7	Very high	97.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.2	-44.7	173	-69.9	168.4	0	0	0	111.7	W87 I168 A169 A170 I174 H175 M176 A181 T184 F185 L188 W258 F262	W87-L172 HydrophobicContact CE3-CD2 4.16Å; W87-L172 HydrophobicContact CZ3-CD2 4.23Å; I168-L172 WeakPolarHBondContact O-CG 3.03Å; I168-L172 PolarHBondContact O-N 2.94Å; A169-L172 PolarHBondContact O-N 3.44Å; A170-L172 VanDerWaalsContact C-N 3.34Å; A170-L172 PolarHBondContact O-N 3.45Å; L172-I174 PolarHBondContact O-N 2.79Å; L172-H175 PolarHBondContact O-N 3.32Å; L172-M176 HydrophobicContact CB-CE 4.39Å; L172-M176 HydrophobicContact CD2-CE 3.56Å; L172-M176 HydrophobicContact CD2-SD 4.3Å; L172-M176 WeakPolarHBondContact O-CG 3.17Å; L172-M176 PolarHBondContact O-N 3.43Å; L172-A181 HydrophobicContact CB-CB 3.85Å; L172-T184 HydrophobicContact CD1-CG2 4.27Å; L172-T184 HydrophobicContact CD2-CG2 3.59Å; L172-F185 HydrophobicContact CD1-CB 3.62Å; L172-F185 HydrophobicContact CD1-CD2 4.15Å; L172-F185 HydrophobicContact CD1-CG 4.37Å; L172-L188 HydrophobicContact CD1-CD1 4.08Å; L172-L188 HydrophobicContact CD2-CD1 4.47Å; L172-W258 HydrophobicContact CD2-CZ3 3.75Å; L172-W258 HydrophobicContact CG-CH2 4.35Å; L172-W258 HydrophobicContact CG-CZ3 3.93Å; L172-F262 HydrophobicContact CD2-CZ 4.28Å
173	L	98.5	Very high	98	Very high	16 Å²	16	18.6 Å²	18.6	8%	0.084	10%	0.098	C	C	.	.	H	α-helix	trans	-61.3	-26.2	-179.7	-76.4	168.6	0	0	0	114	L133 F134 L145 V148 A169 A170 H175 E178 A181	L133-L173 HydrophobicContact CD2-CB 4.34Å; F134-L173 HydrophobicContact CZ-CB 4.16Å; L145-L173 VanDerWaalsContact CA-CD1 3.43Å; L145-L173 HydrophobicContact CB-CD1 3.85Å; L145-L173 HydrophobicContact CD1-CD1 4.1Å; V148-L173 HydrophobicContact CG2-CD1 4.35Å; V148-L173 HydrophobicContact CG2-CD2 4.24Å; A169-L173 WeakPolarHBondContact O-CG 3.23Å; A169-L173 PolarHBondContact O-N 3.1Å; A170-L173 PolarHBondContact O-N 2.87Å; L173-H175 PolarHBondContact O-N 2.75Å; L173-E178 HydrophobicContact CD2-CB 4.2Å; L173-E178 HydrophobicContact CD2-CG 4.29Å; L173-A181 HydrophobicContact CD2-CB 3.73Å; L173-A181 HydrophobicContact CG-CB 3.96Å
174	I	97.6	Very high	98.2	Very high	33 Å²	33	14.1 Å²	14.1	17%	0.169	8%	0.077	C	C	.	.	H	α-helix	trans	-63.7	-31.1	172.7	-70.3	172.2	0	0	0	111.6	F23 L128 L133 F134 A170 L172 W251	F23-I174 HydrophobicContact CE2-CD1 4.46Å; F23-I174 HydrophobicContact CZ-CD1 4.02Å; L128-I174 HydrophobicContact CD1-CD1 3.67Å; L133-I174 HydrophobicContact CD2-CG1 4.28Å; F134-I174 HydrophobicContact CE2-CD1 3.94Å; F134-I174 HydrophobicContact CE2-CG1 3.76Å; F134-I174 HydrophobicContact CZ-CG1 4.35Å; A170-I174 WeakPolarHBondContact O-CG1 3.44Å; A170-I174 PolarHBondContact O-N 2.86Å; L172-I174 PolarHBondContact O-N 2.79Å; I174-W251 HydrophobicContact CB-CZ2 4.14Å; I174-W251 HydrophobicContact CD1-CH2 3.54Å; I174-W251 HydrophobicContact CD1-CZ2 3.52Å; I174-W251 HydrophobicContact CD1-CZ3 4.44Å; I174-W251 HydrophobicContact CG1-CZ2 4.4Å; I174-W251 HydrophobicContact CG2-CZ2 4.02Å
175	H	97.4	Very high	98.3	Very high	34 Å²	34	13.8 Å²	13.8	16%	0.157	7%	0.074	C	C	.	.	H	α-helix	trans	-105.5	-23.5	-172.7	-67.2	-78.7	0	0	0	113.3	P84 W87 A171 L172 L173 W251 L255	P84-H175 HydrophobicContact CG-CB 4.17Å; P84-H175 WeakPolarHBondContact CG-O 3.24Å; W87-H175 HydrophobicContact CZ3-CB 4.26Å; A171-H175 PolarHBondContact O-CD2 3.49Å; A171-H175 VanDerWaalsContact O-CD2 3.27Å; L172-H175 PolarHBondContact O-N 3.32Å; L173-H175 PolarHBondContact O-N 2.75Å; H175-W251 AromaticContact CE1-NE1 3.89Å; H175-W251 AromaticContact NE2-CE2 3.76Å; H175-W251 AromaticContact NE2-CZ2 3.58Å; H175-W251 AromaticContact NE2-NE1 3.43Å; H175-W251 PolarHBondContact NE2-NE1 3.42Å; H175-L255 WeakPolarHBondContact NE2-CD2 3.24Å
176	M	97.7	Very high	98.3	Very high	8 Å²	8	14 Å²	14	4%	0.039	8%	0.076	C	C	.	.	S	Bend	trans	-141.8	156.3	-172.2	73.4	-167.4	70.1	0	0	113.6	P84 W87 L172 D180 A181 T184	P84-M176 HydrophobicContact CB-CB 3.98Å; W87-M176 HydrophobicContact CE3-CE 3.72Å; W87-M176 HydrophobicContact CZ3-CE 4.3Å; L172-M176 HydrophobicContact CB-CE 4.39Å; L172-M176 HydrophobicContact CD2-CE 3.56Å; L172-M176 HydrophobicContact CD2-SD 4.3Å; L172-M176 WeakPolarHBondContact O-CG 3.17Å; L172-M176 PolarHBondContact O-N 3.43Å; M176-D180 HydrophobicContact CB-CB 4Å; M176-D180 HydrophobicContact CG-CB 3.84Å; M176-D180 HydrophobicContact SD-CB 3.99Å; M176-D180 VanDerWaalsContact SD-O 3.42Å; M176-A181 HydrophobicContact CG-CB 3.68Å; M176-A181 VanDerWaalsContact SD-CA 3.55Å; M176-A181 HydrophobicContact SD-CB 4.26Å; M176-T184 HydrophobicContact CE-CG2 4.28Å; M176-T184 HydrophobicContact SD-CG2 4.3Å; M176-T184 PolarHBondContact SD-OG1 3.39Å
177	P	97.8	Very high	98.3	Very high	88 Å²	88	14.4 Å²	14.4	57%	0.571	8%	0.078	S	C	*	.			trans	-53.7	157	174.2	-26	34.8	0	0	0	113.1	E179 D180 A181	P177-E179 PolarHBondContact O-N 2.8Å; P177-D180 HydrophobicContact CB-CB 4.48Å; P177-D180 WeakPolarHBondContact O-CB 3.31Å; P177-D180 PolarHBondContact O-N 3.2Å; P177-D180 VanDerWaalsContact O-N 3.1Å; P177-A181 PolarHBondContact O-N 3.43Å
178	E	98.5	Very high	98.3	Very high	43 Å²	43	14.3 Å²	14.3	20%	0.201	8%	0.078	C	C	.	.	H	α-helix	trans	-53.1	-49.2	-172.4	-173	-176.7	127.6	0	0	114.1	Y104 S144 N147 V148 L173 A181 F182	Y104-E178 HydrophobicContact CE1-CG 4.15Å; Y104-E178 WeakPolarHBondContact CE1-OE1 3.12Å; Y104-E178 VanDerWaalsContact OH-CD 3.32Å; Y104-E178 VanDerWaalsContact OH-CG 3.29Å; Y104-E178 WeakPolarHBondContact OH-CG 3.31Å; Y104-E178 PolarHBondContact OH-OE1 2.73Å; S144-E178 VanDerWaalsContact CA-OE2 3.26Å; S144-E178 WeakPolarHBondContact CA-OE2 3.42Å; S144-E178 WeakPolarHBondContact CB-OE2 3.2Å; S144-E178 PolarHBondContact OG-OE2 3.34Å; N147-E178 VanDerWaalsContact CB-OE1 3.26Å; N147-E178 WeakPolarHBondContact CB-OE1 3.48Å; N147-E178 PolarHBondContact ND2-OE1 3Å; N147-E178 VanDerWaalsContact ND2-OE1 3.09Å; V148-E178 HydrophobicContact CG2-CG 3.93Å; L173-E178 HydrophobicContact CD2-CB 4.2Å; L173-E178 HydrophobicContact CD2-CG 4.29Å; E178-A181 WeakPolarHBondContact O-CB 3.47Å; E178-A181 PolarHBondContact O-N 3.05Å; E178-F182 PolarHBondContact O-N 3.09Å
179	E	98.5	Very high	98.2	Very high	39 Å²	39	14.6 Å²	14.6	18%	0.182	8%	0.079	C	C	.	.	H	α-helix	trans	-70.1	-35.8	-179.3	-175.5	170.3	-176.3	0	0	112.4	M97 Y104 Q105 P177 A181 F182 W183	M97-E179 HydrophobicContact CE-CB 4.45Å; M97-E179 HydrophobicContact CE-CG 3.88Å; Y104-E179 HydrophobicContact CD1-CB 3.8Å; Y104-E179 HydrophobicContact CD1-CG 3.78Å; Y104-E179 HydrophobicContact CE1-CB 4.18Å; Y104-E179 HydrophobicContact CG-CG 4.06Å; Q105-E179 PolarHBondContact NE2-OE2 2.92Å; P177-E179 PolarHBondContact O-N 2.8Å; E179-A181 VanDerWaalsContact C-N 3.3Å; E179-A181 PolarHBondContact O-N 3.45Å; E179-F182 WeakPolarHBondContact O-CB 3.46Å; E179-F182 PolarHBondContact O-N 3.01Å; E179-W183 VanDerWaalsContact O-CD1 3.23Å; E179-W183 PolarHBondContact O-N 3.41Å; E179-W183 VanDerWaalsContact O-N 3.07Å; E179-W183 PolarHBondContact OE1-NE1 3.5Å
180	D	98.6	Very high	98.1	Very high	23 Å²	23	18.2 Å²	18.2	12%	0.123	10%	0.099	C	C	.	.	H	α-helix	trans	-61.9	-41.6	172.8	-83.8	-30.4	0	0	0	110.7	K88 M176 P177 T184	K88-D180 HydrophobicContact CD-CB 4Å; K88-D180 VanDerWaalsContact CD-OD1 3.3Å; K88-D180 WeakPolarHBondContact CD-OD1 3.37Å; K88-D180 IonicContact NZ-OD1 2.73Å; K88-D180 PolarHBondContact NZ-OD1 2.96Å; K88-D180 IonicContact NZ-OD2 2.74Å; K88-D180 PolarHBondContact NZ-OD2 3.15Å; M176-D180 HydrophobicContact CB-CB 4Å; M176-D180 HydrophobicContact CG-CB 3.84Å; M176-D180 HydrophobicContact SD-CB 3.99Å; M176-D180 VanDerWaalsContact SD-O 3.42Å; P177-D180 HydrophobicContact CB-CB 4.48Å; P177-D180 WeakPolarHBondContact O-CB 3.31Å; P177-D180 PolarHBondContact O-N 3.2Å; P177-D180 VanDerWaalsContact O-N 3.1Å; D180-T184 VanDerWaalsContact O-CB 3.25Å; D180-T184 WeakPolarHBondContact O-CB 3.36Å; D180-T184 PolarHBondContact O-N 2.78Å; D180-T184 PolarHBondContact O-OG1 2.87Å
181	A	98.8	Very high	97.9	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-44.2	177.6	0	0	0	0	0	110.4	L172 L173 M176 P177 E178 E179 T184 F185	L172-A181 HydrophobicContact CB-CB 3.85Å; L173-A181 HydrophobicContact CD2-CB 3.73Å; L173-A181 HydrophobicContact CG-CB 3.96Å; M176-A181 HydrophobicContact CG-CB 3.68Å; M176-A181 VanDerWaalsContact SD-CA 3.55Å; M176-A181 HydrophobicContact SD-CB 4.26Å; P177-A181 PolarHBondContact O-N 3.43Å; E178-A181 WeakPolarHBondContact O-CB 3.47Å; E178-A181 PolarHBondContact O-N 3.05Å; E179-A181 VanDerWaalsContact C-N 3.3Å; E179-A181 PolarHBondContact O-N 3.45Å; A181-T184 PolarHBondContact O-N 2.96Å; A181-F185 WeakPolarHBondContact O-CB 3.45Å; A181-F185 PolarHBondContact O-N 3.4Å
182	F	98.8	Very high	97.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-55.8	-55.2	175.5	170.9	-106.1	0	0	0	112.4	Y104 L107 V148 A151 L155 E178 E179 T184 F185 V186	Y104-F182 HydrophobicContact CD2-CB 3.88Å; Y104-F182 AromaticContact CD2-CD1 3.26Å; Y104-F182 HydrophobicContact CD2-CD1 3.26Å; Y104-F182 AromaticContact CD2-CD2 3.81Å; Y104-F182 HydrophobicContact CD2-CD2 3.81Å; Y104-F182 AromaticContact CD2-CE1 3.64Å; Y104-F182 HydrophobicContact CD2-CE1 3.64Å; Y104-F182 HydrophobicContact CD2-CE2 4.15Å; Y104-F182 AromaticContact CD2-CG 3.34Å; Y104-F182 HydrophobicContact CD2-CG 3.34Å; Y104-F182 HydrophobicContact CD2-CZ 4.07Å; Y104-F182 HydrophobicContact CE2-CB 3.63Å; Y104-F182 AromaticContact CE2-CD1 3.88Å; Y104-F182 HydrophobicContact CE2-CD1 3.88Å; Y104-F182 AromaticContact CE2-CD2 3.66Å; Y104-F182 HydrophobicContact CE2-CD2 3.66Å; Y104-F182 HydrophobicContact CE2-CE1 4.47Å; Y104-F182 HydrophobicContact CE2-CE2 4.29Å; Y104-F182 AromaticContact CE2-CG 3.42Å; Y104-F182 HydrophobicContact CE2-CG 3.42Å; Y104-F182 VanDerWaalsContact CE2-CG 3.42Å; Y104-F182 AromaticContact CG-CD1 3.9Å; Y104-F182 HydrophobicContact CG-CD1 3.9Å; Y104-F182 HydrophobicContact CG-CE1 4.36Å; Y104-F182 HydrophobicContact CG-CG 4.26Å; L107-F182 HydrophobicContact CD1-CE1 4.21Å; L107-F182 HydrophobicContact CD1-CE2 4.46Å; L107-F182 HydrophobicContact CD1-CZ 3.63Å; V148-F182 HydrophobicContact CG1-CB 4.44Å; V148-F182 HydrophobicContact CG1-CD2 4.48Å; V148-F182 HydrophobicContact CG2-CB 4.22Å; A151-F182 HydrophobicContact CB-CD2 3.92Å; A151-F182 HydrophobicContact CB-CE2 3.57Å; A151-F182 HydrophobicContact CB-CZ 4.19Å; L155-F182 HydrophobicContact CD2-CZ 3.89Å; E178-F182 PolarHBondContact O-N 3.09Å; E179-F182 WeakPolarHBondContact O-CB 3.46Å; E179-F182 PolarHBondContact O-N 3.01Å; F182-T184 VanDerWaalsContact C-N 3.33Å; F182-T184 PolarHBondContact O-N 3.22Å; F182-F185 WeakPolarHBondContact O-CB 3.46Å; F182-F185 PolarHBondContact O-N 2.75Å; F182-V186 HydrophobicContact CD2-CG2 4.35Å; F182-V186 HydrophobicContact CE1-CG2 4.22Å; F182-V186 HydrophobicContact CE2-CG2 3.9Å; F182-V186 HydrophobicContact CZ-CG2 3.84Å; F182-V186 WeakPolarHBondContact O-CG2 3.25Å; F182-V186 PolarHBondContact O-N 2.95Å
183	W	98.7	Very high	97.6	Very high	3 Å²	3	27.1 Å²	27.1	1%	0.011	13%	0.132	C	C	.	.	H	α-helix	trans	-68.3	-34.2	-177.5	-70.8	116	0	0	0	112.7	S93 I96 M97 E100 K103 L155 E179 F185 V186 C187	S93-W183 WeakPolarHBondContact CB-O 3.42Å; I96-W183 HydrophobicContact CB-CE3 4.45Å; I96-W183 HydrophobicContact CG2-CD2 4.33Å; I96-W183 HydrophobicContact CG2-CE3 3.51Å; I96-W183 HydrophobicContact CG2-CH2 4.45Å; I96-W183 HydrophobicContact CG2-CZ3 3.59Å; M97-W183 HydrophobicContact CB-CB 4.29Å; M97-W183 HydrophobicContact CB-CD2 4.49Å; M97-W183 HydrophobicContact CB-CG 3.85Å; M97-W183 VanDerWaalsContact CG-CD1 3.47Å; M97-W183 HydrophobicContact CG-CG 4.3Å; E100-W183 HydrophobicContact CB-CH2 3.35Å; E100-W183 HydrophobicContact CB-CZ2 3.54Å; E100-W183 HydrophobicContact CB-CZ3 4.16Å; E100-W183 HydrophobicContact CG-CH2 3.88Å; E100-W183 HydrophobicContact CG-CZ3 4.29Å; K103-W183 HydrophobicContact CB-CH2 4.27Å; K103-W183 HydrophobicContact CB-CZ2 4.11Å; K103-W183 HydrophobicContact CD-CH2 4.11Å; K103-W183 HydrophobicContact CG-CH2 4.31Å; L155-W183 HydrophobicContact CD2-CZ3 4.35Å; E179-W183 VanDerWaalsContact O-CD1 3.23Å; E179-W183 PolarHBondContact O-N 3.41Å; E179-W183 VanDerWaalsContact O-N 3.07Å; E179-W183 PolarHBondContact OE1-NE1 3.5Å; W183-F185 VanDerWaalsContact C-N 3.33Å; W183-V186 HydrophobicContact CE3-CB 4.39Å; W183-V186 HydrophobicContact CE3-CG1 4.49Å; W183-V186 HydrophobicContact CE3-CG2 4.38Å; W183-V186 PolarHBondContact O-N 3.39Å; W183-C187 PolarHBondContact O-N 3.44Å
184	T	98.7	Very high	97.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-39.4	173.4	-57	0	0	0	0	111.2	S93 L172 M176 D180 A181 F182 C187 L188 F262	S93-T184 PolarHBondContact OG-OG1 3.3Å; L172-T184 HydrophobicContact CD1-CG2 4.27Å; L172-T184 HydrophobicContact CD2-CG2 3.59Å; M176-T184 HydrophobicContact CE-CG2 4.28Å; M176-T184 HydrophobicContact SD-CG2 4.3Å; M176-T184 PolarHBondContact SD-OG1 3.39Å; D180-T184 VanDerWaalsContact O-CB 3.25Å; D180-T184 WeakPolarHBondContact O-CB 3.36Å; D180-T184 PolarHBondContact O-N 2.78Å; D180-T184 PolarHBondContact O-OG1 2.87Å; A181-T184 PolarHBondContact O-N 2.96Å; F182-T184 VanDerWaalsContact C-N 3.33Å; F182-T184 PolarHBondContact O-N 3.22Å; T184-C187 WeakPolarHBondContact O-CB 3.33Å; T184-C187 PolarHBondContact O-N 3.37Å; T184-L188 WeakPolarHBondContact O-CG 3.1Å; T184-L188 PolarHBondContact O-N 2.97Å; T184-F262 HydrophobicContact CG2-CE1 3.9Å; T184-F262 HydrophobicContact CG2-CZ 3.86Å
185	F	98.6	Very high	97.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.9	-42.7	174.7	-175.7	-115.2	0	0	0	112.1	V148 L149 Y152 Q165 I168 A169 L172 A181 F182 W183 C187 L188 C189	V148-F185 HydrophobicContact CG1-CD1 4.3Å; L149-F185 HydrophobicContact CD2-CE1 4.46Å; Y152-F185 AromaticContact CD1-CE1 3.87Å; Y152-F185 HydrophobicContact CD1-CE1 3.87Å; Y152-F185 AromaticContact CD2-CD1 3.57Å; Y152-F185 HydrophobicContact CD2-CD1 3.57Å; Y152-F185 AromaticContact CD2-CE1 3.52Å; Y152-F185 HydrophobicContact CD2-CE1 3.52Å; Y152-F185 HydrophobicContact CE1-CE1 4.35Å; Y152-F185 HydrophobicContact CE2-CD1 4.26Å; Y152-F185 HydrophobicContact CE2-CE1 4.04Å; Y152-F185 AromaticContact CG-CD1 3.83Å; Y152-F185 HydrophobicContact CG-CD1 3.83Å; Y152-F185 AromaticContact CG-CE1 3.44Å; Y152-F185 HydrophobicContact CG-CE1 3.44Å; Y152-F185 VanDerWaalsContact CG-CE1 3.44Å; Q165-F185 HydrophobicContact CB-CE1 4.49Å; Q165-F185 HydrophobicContact CB-CE2 4.36Å; Q165-F185 HydrophobicContact CB-CZ 3.62Å; Q165-F185 HydrophobicContact CG-CZ 3.84Å; I168-F185 HydrophobicContact CB-CD2 4.35Å; I168-F185 HydrophobicContact CB-CE2 3.97Å; I168-F185 HydrophobicContact CG2-CD2 3.75Å; I168-F185 HydrophobicContact CG2-CE2 3.78Å; A169-F185 HydrophobicContact CB-CD2 4.38Å; L172-F185 HydrophobicContact CD1-CB 3.62Å; L172-F185 HydrophobicContact CD1-CD2 4.15Å; L172-F185 HydrophobicContact CD1-CG 4.37Å; A181-F185 WeakPolarHBondContact O-CB 3.45Å; A181-F185 PolarHBondContact O-N 3.4Å; F182-F185 WeakPolarHBondContact O-CB 3.46Å; F182-F185 PolarHBondContact O-N 2.75Å; W183-F185 VanDerWaalsContact C-N 3.33Å; F185-C187 PolarHBondContact O-N 3.41Å; F185-L188 WeakPolarHBondContact O-CB 3.5Å; F185-L188 PolarHBondContact O-N 2.84Å; F185-C189 VanDerWaalsContact CE2-SG 3.51Å; F185-C189 WeakPolarHBondContact CZ-SG 3.13Å; F185-C189 PolarHBondContact O-N 3.04Å; F185-C189 PolarHBondContact O-SG 3.17Å
186	V	98.3	Very high	97.1	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.03	15%	0.145	C	C	.	.	H	α-helix	trans	-57.9	-49.1	173.1	170.9	0	0	0	0	111	Y152 L155 F182 W183 L188 C189 N190	Y152-V186 HydrophobicContact CD2-CG2 3.91Å; Y152-V186 HydrophobicContact CE2-CG2 4.35Å; L155-V186 HydrophobicContact CD2-CG1 4.21Å; L155-V186 HydrophobicContact CD2-CG2 3.83Å; F182-V186 HydrophobicContact CD2-CG2 4.35Å; F182-V186 HydrophobicContact CE1-CG2 4.22Å; F182-V186 HydrophobicContact CE2-CG2 3.9Å; F182-V186 HydrophobicContact CZ-CG2 3.84Å; F182-V186 WeakPolarHBondContact O-CG2 3.25Å; F182-V186 PolarHBondContact O-N 2.95Å; W183-V186 HydrophobicContact CE3-CB 4.39Å; W183-V186 HydrophobicContact CE3-CG1 4.49Å; W183-V186 HydrophobicContact CE3-CG2 4.38Å; W183-V186 PolarHBondContact O-N 3.39Å; V186-L188 VanDerWaalsContact C-N 3.35Å; V186-L188 PolarHBondContact O-N 3.2Å; V186-C189 PolarHBondContact O-N 3.11Å; V186-N190 WeakPolarHBondContact O-CB 3.38Å; V186-N190 PolarHBondContact O-N 3.34Å
187	C	98	Very high	97	Very high	7 Å²	7	29 Å²	29	5%	0.047	15%	0.145	C	C	.	.	H	α-helix	trans	-57.9	-45.3	175.8	-78.6	0	0	0	0	112.4	C91 S93 I96 W183 T184 F185 R191	C91-C187 HydrophobicContact CB-CB 3.87Å; S93-C187 WeakPolarHBondContact CA-SG 3.47Å; I96-C187 WeakPolarHBondContact CD1-SG 3.45Å; W183-C187 PolarHBondContact O-N 3.44Å; T184-C187 WeakPolarHBondContact O-CB 3.33Å; T184-C187 PolarHBondContact O-N 3.37Å; F185-C187 PolarHBondContact O-N 3.41Å; C187-R191 VanDerWaalsContact O-CB 3.28Å; C187-R191 WeakPolarHBondContact O-CB 3.3Å; C187-R191 PolarHBondContact O-N 3.49Å
188	L	97.5	Very high	96.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	I	π-helix	trans	-57	-53.3	177.9	-80.6	-176.2	0	0	0	111.3	I168 L172 T184 F185 V186 N190 Y192 M193 L244 F261 F262	I168-L188 HydrophobicContact CG2-CD1 3.85Å; L172-L188 HydrophobicContact CD1-CD1 4.08Å; L172-L188 HydrophobicContact CD2-CD1 4.47Å; T184-L188 WeakPolarHBondContact O-CG 3.1Å; T184-L188 PolarHBondContact O-N 2.97Å; F185-L188 WeakPolarHBondContact O-CB 3.5Å; F185-L188 PolarHBondContact O-N 2.84Å; V186-L188 VanDerWaalsContact C-N 3.35Å; V186-L188 PolarHBondContact O-N 3.2Å; L188-N190 PolarHBondContact O-N 3Å; L188-Y192 HydrophobicContact CD2-CD2 4.04Å; L188-Y192 HydrophobicContact CD2-CG 4.33Å; L188-Y192 WeakPolarHBondContact O-CA 3.34Å; L188-Y192 WeakPolarHBondContact O-CB 3.34Å; L188-Y192 PolarHBondContact O-N 2.85Å; L188-M193 PolarHBondContact O-N 3.18Å; L188-L244 HydrophobicContact CD1-CD1 4.45Å; L188-F261 HydrophobicContact CD2-CD1 4.27Å; L188-F261 HydrophobicContact CD2-CE1 3.79Å; L188-F262 HydrophobicContact CD1-CE1 4.19Å; L188-F262 HydrophobicContact CD1-CZ 3.88Å; L188-F262 HydrophobicContact CD2-CD1 3.94Å; L188-F262 HydrophobicContact CD2-CE1 3.35Å; L188-F262 HydrophobicContact CD2-CZ 3.76Å; L188-F262 HydrophobicContact CG-CE1 3.75Å; L188-F262 HydrophobicContact CG-CZ 3.98Å
189	C	97.3	Very high	96.3	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.034	17%	0.171	C	C	.	.	I	π-helix	trans	-63.8	-43.8	-177.2	-62.4	0	0	0	0	112.1	Y152 F185 V186 M193 T194 F197	Y152-C189 HydrophobicContact CE2-CB 3.68Å; Y152-C189 WeakPolarHBondContact OH-CB 3.41Å; F185-C189 VanDerWaalsContact CE2-SG 3.51Å; F185-C189 WeakPolarHBondContact CZ-SG 3.13Å; F185-C189 PolarHBondContact O-N 3.04Å; F185-C189 PolarHBondContact O-SG 3.17Å; V186-C189 PolarHBondContact O-N 3.11Å; C189-M193 CarbonylContact O-C 3.28Å; C189-T194 PolarHBondContact O-N 2.89Å; C189-F197 HydrophobicContact CB-CE2 4.25Å
190	N	95.7	Very high	95.9	Very high	76 Å²	76	35 Å²	35	41%	0.406	18%	0.181	S	C	.	.	I	π-helix	trans	-78.1	-36	-171.9	-68.8	-1.1	0	0	0	112.8	H156 V186 L188 T194	H156-N190 PolarHBondContact NE2-ND2 3.31Å; H156-N190 PolarHBondContact NE2-OD1 3.41Å; H156-N190 VanDerWaalsContact NE2-OD1 3.11Å; V186-N190 WeakPolarHBondContact O-CB 3.38Å; V186-N190 PolarHBondContact O-N 3.34Å; L188-N190 PolarHBondContact O-N 3Å; N190-T194 PolarHBondContact O-OG1 2.72Å
191	R	94.7	Very high	95.6	Very high	165 Å²	165	36.2 Å²	36.2	62%	0.623	19%	0.187	S	C	*	.	I	π-helix	trans	-102.3	-37.2	-172.1	-177.2	177.8	179.5	-172.7	-0.2	114	C91 C187	C91-R191 PolarHBondContact O-NH1 3.01Å; C187-R191 VanDerWaalsContact O-CB 3.28Å; C187-R191 WeakPolarHBondContact O-CB 3.3Å; C187-R191 PolarHBondContact O-N 3.49Å
192	Y	93.9	Very high	95.4	Very high	23 Å²	23	38.3 Å²	38.3	9%	0.09	20%	0.2	C	C	.	.	I	π-helix	trans	-103.7	-35.7	-170.6	-59.5	-98	0	0	0	111.8	L90 C91 L188 F261 F262	L90-Y192 PolarHBondContact O-OH 3.23Å; C91-Y192 WeakPolarHBondContact CA-OH 3.45Å; C91-Y192 HydrophobicContact CB-CE2 3.93Å; L188-Y192 HydrophobicContact CD2-CD2 4.04Å; L188-Y192 HydrophobicContact CD2-CG 4.33Å; L188-Y192 WeakPolarHBondContact O-CA 3.34Å; L188-Y192 WeakPolarHBondContact O-CB 3.34Å; L188-Y192 PolarHBondContact O-N 2.85Å; Y192-F261 HydrophobicContact CD1-CE1 4.21Å; Y192-F261 HydrophobicContact CD1-CZ 4.4Å; Y192-F261 HydrophobicContact CG-CE1 4.15Å; Y192-F261 HydrophobicContact CG-CZ 4.35Å; Y192-F262 WeakPolarHBondContact CE1-O 2.91Å; Y192-F262 PolarHBondContact OH-O 2.48Å
193	M	95.5	Very high	95.2	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.208	C	C	.	.	S	Bend	trans	-116.3	31.5	-174.7	-52.6	-179.1	72.7	0	0	112	I168 L188 C189 D195 Y196 F197 M242 L244 F261	I168-M193 HydrophobicContact CD1-CE 3.68Å; I168-M193 HydrophobicContact CD1-SD 3.71Å; L188-M193 PolarHBondContact O-N 3.18Å; C189-M193 CarbonylContact O-C 3.28Å; M193-D195 PolarHBondContact O-N 3.24Å; M193-Y196 HydrophobicContact CB-CD1 4.12Å; M193-Y196 HydrophobicContact CB-CD2 4.16Å; M193-Y196 HydrophobicContact CB-CG 3.85Å; M193-Y196 HydrophobicContact CE-CD1 3.41Å; M193-Y196 VanDerWaalsContact CE-CD1 3.41Å; M193-Y196 HydrophobicContact CE-CE1 3.88Å; M193-Y196 HydrophobicContact CE-CG 4.19Å; M193-Y196 HydrophobicContact CG-CD1 4.4Å; M193-Y196 VanDerWaalsContact O-CB 3.29Å; M193-Y196 WeakPolarHBondContact O-CB 3.34Å; M193-Y196 PolarHBondContact O-N 3.42Å; M193-F197 HydrophobicContact CB-CE2 4.2Å; M193-F197 HydrophobicContact CE-CE1 4.17Å; M193-F197 HydrophobicContact CE-CE2 4.21Å; M193-F197 HydrophobicContact CE-CZ 3.5Å; M193-F197 VanDerWaalsContact CE-CZ 3.5Å; M193-F197 HydrophobicContact SD-CE2 4.31Å; M193-F197 HydrophobicContact SD-CZ 3.99Å; M193-M242 WeakPolarHBondContact CE-O 3.46Å; M193-L244 HydrophobicContact CE-CD2 3.95Å; M193-L244 HydrophobicContact CE-CG 4.02Å; M193-L244 HydrophobicContact CG-CD2 4.47Å; M193-L244 HydrophobicContact SD-CD1 3.8Å; M193-L244 HydrophobicContact SD-CD2 3.93Å; M193-L244 HydrophobicContact SD-CG 3.89Å; M193-F261 HydrophobicContact CG-CZ 4.27Å
194	T	93.9	Very high	95	Very high	57 Å²	57	40.3 Å²	40.3	35%	0.35	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	129	178.4	-42.8	0	0	0	0	109.7	C189 N190 Y196 R203	C189-T194 PolarHBondContact O-N 2.89Å; N190-T194 PolarHBondContact O-OG1 2.72Å; T194-Y196 PolarHBondContact O-N 3.14Å; T194-R203 PolarHBondContact O-NH1 2.97Å; T194-R203 VanDerWaalsContact O-NH1 3.12Å
195	D	94.5	Very high	94.9	Very high	63 Å²	63	44.8 Å²	44.8	34%	0.337	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	4.5	-179.5	-54.2	-41.9	0	0	0	116.7	M193 F197 K198 R203	M193-D195 PolarHBondContact O-N 3.24Å; D195-F197 VanDerWaalsContact C-N 3.3Å; D195-F197 PolarHBondContact O-N 3.44Å; D195-K198 HydrophobicContact CB-CD 4.01Å; D195-K198 WeakPolarHBondContact OD1-CE 3.49Å; D195-K198 IonicContact OD1-NZ 3.84Å; D195-K198 PolarHBondContact OD1-NZ 3.04Å; D195-R203 HydrophobicContact CB-CB 3.87Å; D195-R203 HydrophobicContact CB-CG 4.28Å; D195-R203 WeakPolarHBondContact O-CB 3.4Å
196	Y	96.1	Very high	94.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-36.9	178.2	-89.4	-135.6	0	0	0	112.9	M193 T194 R203 V204 E207 F241 M242 V266	M193-Y196 HydrophobicContact CB-CD1 4.12Å; M193-Y196 HydrophobicContact CB-CD2 4.16Å; M193-Y196 HydrophobicContact CB-CG 3.85Å; M193-Y196 HydrophobicContact CE-CD1 3.41Å; M193-Y196 VanDerWaalsContact CE-CD1 3.41Å; M193-Y196 HydrophobicContact CE-CE1 3.88Å; M193-Y196 HydrophobicContact CE-CG 4.19Å; M193-Y196 HydrophobicContact CG-CD1 4.4Å; M193-Y196 VanDerWaalsContact O-CB 3.29Å; M193-Y196 WeakPolarHBondContact O-CB 3.34Å; M193-Y196 PolarHBondContact O-N 3.42Å; T194-Y196 PolarHBondContact O-N 3.14Å; Y196-R203 HydrophobicContact CD2-CG 3.57Å; Y196-R203 HydrophobicContact CE2-CG 3.77Å; Y196-V204 HydrophobicContact CD1-CG2 4.14Å; Y196-V204 HydrophobicContact CG-CG2 4.08Å; Y196-E207 WeakPolarHBondContact CE2-OE2 3.06Å; Y196-E207 PolarHBondContact OH-OE2 3.37Å; Y196-F241 HydrophobicContact CE1-CB 4.11Å; Y196-M242 HydrophobicContact CD1-CG 4.39Å; Y196-M242 WeakPolarHBondContact O-CE 3.03Å; Y196-V266 WeakPolarHBondContact OH-CG2 3.19Å
197	F	95	Very high	94.7	Very high	10 Å²	10	44.9 Å²	44.9	4%	0.044	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	11.3	-170.5	-54.3	-60.6	0	0	0	113.5	T159 C162 A164 Q165 I168 C189 M193 D195 M242	T159-F197 HydrophobicContact CG2-CB 3.61Å; C162-F197 HydrophobicContact CB-CB 3.77Å; C162-F197 HydrophobicContact CB-CD1 3.89Å; C162-F197 HydrophobicContact CB-CG 4.18Å; A164-F197 HydrophobicContact CB-CD1 4.44Å; A164-F197 HydrophobicContact CB-CE1 4.06Å; Q165-F197 HydrophobicContact CG-CD1 3.69Å; Q165-F197 HydrophobicContact CG-CD2 4.04Å; Q165-F197 HydrophobicContact CG-CE1 3.69Å; Q165-F197 HydrophobicContact CG-CE2 4.04Å; Q165-F197 HydrophobicContact CG-CG 3.87Å; Q165-F197 HydrophobicContact CG-CZ 3.86Å; I168-F197 HydrophobicContact CD1-CZ 4.07Å; C189-F197 HydrophobicContact CB-CE2 4.25Å; M193-F197 HydrophobicContact CB-CE2 4.2Å; M193-F197 HydrophobicContact CE-CE1 4.17Å; M193-F197 HydrophobicContact CE-CE2 4.21Å; M193-F197 HydrophobicContact CE-CZ 3.5Å; M193-F197 VanDerWaalsContact CE-CZ 3.5Å; M193-F197 HydrophobicContact SD-CE2 4.31Å; M193-F197 HydrophobicContact SD-CZ 3.99Å; D195-F197 VanDerWaalsContact C-N 3.3Å; D195-F197 PolarHBondContact O-N 3.44Å; F197-M242 HydrophobicContact CD1-CE 3.77Å; F197-M242 HydrophobicContact CE1-CE 4.22Å
198	K	92.7	Very high	94.7	Very high	93 Å²	93	44.6 Å²	44.6	40%	0.404	23%	0.225	S	C	.	.	S	Bend	trans	-68.2	147.7	171.6	-75	-178.1	168.4	167.1	0	110.2	D195 D200 L201	D195-K198 HydrophobicContact CB-CD 4.01Å; D195-K198 WeakPolarHBondContact OD1-CE 3.49Å; D195-K198 IonicContact OD1-NZ 3.84Å; D195-K198 PolarHBondContact OD1-NZ 3.04Å; K198-D200 VanDerWaalsContact C-N 3.25Å; K198-D200 PolarHBondContact O-N 3.13Å; K198-L201 WeakPolarHBondContact O-CD2 3.35Å; K198-L201 PolarHBondContact O-N 3.04Å; K198-L201 VanDerWaalsContact O-N 3.13Å
199	S	89	Confident	94.7	Very high	128 Å²	128	47.1 Å²	47.1	90%	0.895	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.9	-174.4	52.3	0	0	0	0	114.2	L201	S199-L201 VanDerWaalsContact C-N 3.31Å; S199-L201 PolarHBondContact O-N 2.96Å
200	D	89.6	Confident	94.7	Very high	76 Å²	76	47 Å²	47	41%	0.406	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-14.6	-179.7	62.4	18.6	0	0	0	114.1	K198 V202 K205	K198-D200 VanDerWaalsContact C-N 3.25Å; K198-D200 PolarHBondContact O-N 3.13Å; D200-V202 HydrophobicContact CB-CG2 3.82Å; D200-V202 PolarHBondContact O-N 2.75Å; D200-V202 VanDerWaalsContact O-N 3.13Å; D200-V202 WeakPolarHBondContact OD1-CB 3.34Å; D200-V202 WeakPolarHBondContact OD1-CG2 3.49Å; D200-V202 PolarHBondContact OD1-N 3.36Å; D200-V202 WeakPolarHBondContact OD2-CG2 3.43Å; D200-K205 PolarHBondContact O-NZ 3.32Å
201	L	92.5	Very high	94.8	Very high	48 Å²	48	43.4 Å²	43.4	25%	0.251	22%	0.219	S	C	.	.			trans	50.9	26.3	-173.3	-58.2	177.1	0	0	0	113.6	K198 S199 R203 V204 K205 M242	K198-L201 WeakPolarHBondContact O-CD2 3.35Å; K198-L201 PolarHBondContact O-N 3.04Å; K198-L201 VanDerWaalsContact O-N 3.13Å; S199-L201 VanDerWaalsContact C-N 3.31Å; S199-L201 PolarHBondContact O-N 2.96Å; L201-R203 VanDerWaalsContact C-N 3.29Å; L201-R203 PolarHBondContact O-N 3.37Å; L201-V204 PolarHBondContact O-N 3.11Å; L201-K205 WeakPolarHBondContact O-CG 3.31Å; L201-K205 PolarHBondContact O-N 2.99Å; L201-M242 HydrophobicContact CD2-CE 3.66Å; L201-M242 HydrophobicContact CD2-SD 3.68Å
202	V	93.5	Very high	95	Very high	44 Å²	44	36.1 Å²	36.1	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-56.6	-45.8	-174.7	164.4	0	0	0	0	110.8	D200 V204 K205 I206 L341	D200-V202 HydrophobicContact CB-CG2 3.82Å; D200-V202 PolarHBondContact O-N 2.75Å; D200-V202 VanDerWaalsContact O-N 3.13Å; D200-V202 WeakPolarHBondContact OD1-CB 3.34Å; D200-V202 WeakPolarHBondContact OD1-CG2 3.49Å; D200-V202 PolarHBondContact OD1-N 3.36Å; D200-V202 WeakPolarHBondContact OD2-CG2 3.43Å; V202-V204 PolarHBondContact O-N 3.46Å; V202-K205 PolarHBondContact O-N 3.01Å; V202-I206 HydrophobicContact CG1-CD1 3.77Å; V202-I206 WeakPolarHBondContact O-CG1 3.45Å; V202-I206 PolarHBondContact O-N 3.22Å; V202-L341 HydrophobicContact CG1-CD1 3.93Å
203	R	94.5	Very high	95.1	Very high	44 Å²	44	38.6 Å²	38.6	17%	0.166	20%	0.204	C	C	.	.	H	α-helix	trans	-57.9	-48.4	179.6	177	57	-177.2	-90.5	-2.1	112.1	T194 D195 Y196 L201 I206 E207 Y332	T194-R203 PolarHBondContact O-NH1 2.97Å; T194-R203 VanDerWaalsContact O-NH1 3.12Å; D195-R203 HydrophobicContact CB-CB 3.87Å; D195-R203 HydrophobicContact CB-CG 4.28Å; D195-R203 WeakPolarHBondContact O-CB 3.4Å; Y196-R203 HydrophobicContact CD2-CG 3.57Å; Y196-R203 HydrophobicContact CE2-CG 3.77Å; L201-R203 VanDerWaalsContact C-N 3.29Å; L201-R203 PolarHBondContact O-N 3.37Å; R203-I206 PolarHBondContact O-N 2.9Å; R203-E207 IonicContact CZ-OE1 2.82Å; R203-E207 IonicContact NE-OE1 2.94Å; R203-E207 PolarHBondContact NE-OE1 3.34Å; R203-E207 IonicContact NH2-OE1 3.42Å; R203-E207 PolarHBondContact NH2-OE1 2.76Å; R203-E207 WeakPolarHBondContact O-CG 3.47Å; R203-E207 PolarHBondContact O-N 3.02Å; R203-E207 VanDerWaalsContact O-N 3.08Å; R203-Y332 VanDerWaalsContact CD-OH 3.29Å; R203-Y332 WeakPolarHBondContact CD-OH 3.47Å
204	V	95.9	Very high	95.3	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-68.3	-43.9	-176.7	-178.5	0	0	0	0	110.4	Y196 L201 V202 I206 E207 L208 I238 M242	Y196-V204 HydrophobicContact CD1-CG2 4.14Å; Y196-V204 HydrophobicContact CG-CG2 4.08Å; L201-V204 PolarHBondContact O-N 3.11Å; V202-V204 PolarHBondContact O-N 3.46Å; V204-I206 VanDerWaalsContact C-N 3.34Å; V204-I206 PolarHBondContact O-N 3.05Å; V204-E207 PolarHBondContact O-N 3.45Å; V204-E207 VanDerWaalsContact O-N 3.16Å; V204-L208 HydrophobicContact CG1-CD1 4.07Å; V204-L208 HydrophobicContact CG1-CG 4.31Å; V204-L208 WeakPolarHBondContact O-CG 3.43Å; V204-L208 PolarHBondContact O-N 3.33Å; V204-I238 HydrophobicContact CG1-CG2 4.4Å; V204-M242 HydrophobicContact CB-CG 4.47Å; V204-M242 HydrophobicContact CG1-CG 4.02Å; V204-M242 HydrophobicContact CG1-SD 4.4Å; V204-M242 HydrophobicContact CG2-CG 3.67Å; V204-M242 HydrophobicContact CG2-SD 3.96Å
205	K	95.6	Very high	95.5	Very high	95 Å²	95	35.9 Å²	35.9	41%	0.413	19%	0.187	S	C	.	.	H	α-helix	trans	-57	-46.6	176.1	-71.7	169.6	177.8	163.6	0	111.8	D200 L201 V202 E207 L208 N209 I234	D200-K205 PolarHBondContact O-NZ 3.32Å; L201-K205 WeakPolarHBondContact O-CG 3.31Å; L201-K205 PolarHBondContact O-N 2.99Å; V202-K205 PolarHBondContact O-N 3.01Å; K205-E207 VanDerWaalsContact C-N 3.35Å; K205-E207 PolarHBondContact O-N 3.24Å; K205-L208 PolarHBondContact O-N 3.48Å; K205-N209 PolarHBondContact O-N 2.88Å; K205-N209 PolarHBondContact O-OD1 3.21Å; K205-I234 HydrophobicContact CG-CD1 4.01Å
206	I	96.1	Very high	95.7	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-60.1	-46.4	176.4	-70.4	167.9	0	0	0	110.7	V202 R203 V204 L208 N209 I210 Y332 Q335 L336 I339	V202-I206 HydrophobicContact CG1-CD1 3.77Å; V202-I206 WeakPolarHBondContact O-CG1 3.45Å; V202-I206 PolarHBondContact O-N 3.22Å; R203-I206 PolarHBondContact O-N 2.9Å; V204-I206 VanDerWaalsContact C-N 3.34Å; V204-I206 PolarHBondContact O-N 3.05Å; I206-L208 VanDerWaalsContact C-N 3.33Å; I206-L208 PolarHBondContact O-N 2.78Å; I206-N209 WeakPolarHBondContact O-CB 3.47Å; I206-N209 PolarHBondContact O-N 3.48Å; I206-I210 HydrophobicContact CG2-CD1 3.95Å; I206-I210 HydrophobicContact CG2-CG1 4.36Å; I206-I210 VanDerWaalsContact O-CG1 3.31Å; I206-I210 WeakPolarHBondContact O-CG1 3.43Å; I206-I210 PolarHBondContact O-N 3.07Å; I206-Y332 HydrophobicContact CB-CD2 4.32Å; I206-Y332 HydrophobicContact CB-CE2 3.91Å; I206-Y332 HydrophobicContact CD1-CE2 4.14Å; I206-Y332 HydrophobicContact CG2-CD2 3.33Å; I206-Y332 HydrophobicContact CG2-CE2 3.39Å; I206-Y332 HydrophobicContact CG2-CG 4.24Å; I206-Q335 HydrophobicContact CG1-CB 4.47Å; I206-Q335 HydrophobicContact CG2-CB 3.6Å; I206-Q335 HydrophobicContact CG2-CG 4.13Å; I206-L336 HydrophobicContact CD1-CD2 3.47Å; I206-L336 VanDerWaalsContact CD1-CD2 3.47Å; I206-L336 HydrophobicContact CD1-CG 4.16Å; I206-I339 HydrophobicContact CD1-CD1 4.31Å; I206-I339 HydrophobicContact CG1-CD1 3.85Å
207	E	97.1	Very high	95.7	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.023	22%	0.217	C	C	.	.	H	α-helix	trans	-66.5	-33.7	-179.4	-74	-170	172.3	0	0	113.3	Y196 R203 V204 K205 N209 I210 L211 F241 F270	Y196-E207 WeakPolarHBondContact CE2-OE2 3.06Å; Y196-E207 PolarHBondContact OH-OE2 3.37Å; R203-E207 IonicContact CZ-OE1 2.82Å; R203-E207 IonicContact NE-OE1 2.94Å; R203-E207 PolarHBondContact NE-OE1 3.34Å; R203-E207 IonicContact NH2-OE1 3.42Å; R203-E207 PolarHBondContact NH2-OE1 2.76Å; R203-E207 WeakPolarHBondContact O-CG 3.47Å; R203-E207 PolarHBondContact O-N 3.02Å; R203-E207 VanDerWaalsContact O-N 3.08Å; V204-E207 PolarHBondContact O-N 3.45Å; V204-E207 VanDerWaalsContact O-N 3.16Å; K205-E207 VanDerWaalsContact C-N 3.35Å; K205-E207 PolarHBondContact O-N 3.24Å; E207-N209 VanDerWaalsContact C-N 3.34Å; E207-I210 WeakPolarHBondContact O-CB 3.3Å; E207-I210 PolarHBondContact O-N 3.4Å; E207-L211 PolarHBondContact O-N 3.25Å; E207-F241 HydrophobicContact CB-CD1 4.43Å; E207-F241 HydrophobicContact CB-CE1 4.32Å; E207-F270 HydrophobicContact CB-CE1 4.47Å; E207-F270 HydrophobicContact CB-CZ 3.8Å; E207-F270 HydrophobicContact CG-CZ 3.96Å; E207-F270 VanDerWaalsContact O-CE1 3.28Å; E207-F270 WeakPolarHBondContact O-CE1 3.29Å
208	L	97.8	Very high	95.9	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-69.4	-32.9	173.4	-65.7	-179	0	0	0	112.2	V204 K205 I206 L211 F212 P233 I234 A237 I238 F241	V204-L208 HydrophobicContact CG1-CD1 4.07Å; V204-L208 HydrophobicContact CG1-CG 4.31Å; V204-L208 WeakPolarHBondContact O-CG 3.43Å; V204-L208 PolarHBondContact O-N 3.33Å; K205-L208 PolarHBondContact O-N 3.48Å; I206-L208 VanDerWaalsContact C-N 3.33Å; I206-L208 PolarHBondContact O-N 2.78Å; L208-L211 HydrophobicContact CD2-CD2 4.32Å; L208-L211 WeakPolarHBondContact O-CB 3.27Å; L208-L211 PolarHBondContact O-N 2.87Å; L208-F212 PolarHBondContact O-N 3.41Å; L208-F212 VanDerWaalsContact O-N 3.09Å; L208-P233 HydrophobicContact CB-CB 4.32Å; L208-P233 HydrophobicContact CD2-CB 4.29Å; L208-I234 HydrophobicContact CD1-CB 4.39Å; L208-I234 HydrophobicContact CD1-CG1 4.46Å; L208-A237 HydrophobicContact CD2-CB 3.8Å; L208-I238 HydrophobicContact CD1-CB 4.44Å; L208-I238 HydrophobicContact CD1-CG1 3.61Å; L208-F241 HydrophobicContact CD2-CD2 4Å; L208-F241 HydrophobicContact CD2-CE2 4.1Å; L208-F241 HydrophobicContact CD2-CG 4.36Å
209	N	97	Very high	96.2	Very high	54 Å²	54	42.1 Å²	42.1	29%	0.289	21%	0.21	S	C	.	.	H	α-helix	trans	-66.9	-43	170	-67	-6.7	0	0	0	111.4	K205 I206 E207 L211 F212 E213	K205-N209 PolarHBondContact O-N 2.88Å; K205-N209 PolarHBondContact O-OD1 3.21Å; I206-N209 WeakPolarHBondContact O-CB 3.47Å; I206-N209 PolarHBondContact O-N 3.48Å; E207-N209 VanDerWaalsContact C-N 3.34Å; N209-L211 VanDerWaalsContact C-N 3.28Å; N209-L211 PolarHBondContact O-N 3.31Å; N209-F212 PolarHBondContact O-N 3.16Å; N209-F212 VanDerWaalsContact O-N 3.13Å; N209-E213 PolarHBondContact O-N 2.88Å
210	I	97.7	Very high	96.6	Very high	2 Å²	2	39 Å²	39	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-43.5	173.4	-67.1	171.1	0	0	0	110.4	I206 E207 F212 E213 L214 F270 L328 L331 Y332 Q335	I206-I210 HydrophobicContact CG2-CD1 3.95Å; I206-I210 HydrophobicContact CG2-CG1 4.36Å; I206-I210 VanDerWaalsContact O-CG1 3.31Å; I206-I210 WeakPolarHBondContact O-CG1 3.43Å; I206-I210 PolarHBondContact O-N 3.07Å; E207-I210 WeakPolarHBondContact O-CB 3.3Å; E207-I210 PolarHBondContact O-N 3.4Å; I210-F212 VanDerWaalsContact C-N 3.27Å; I210-F212 PolarHBondContact O-N 3.24Å; I210-E213 PolarHBondContact O-N 3.3Å; I210-L214 HydrophobicContact CG2-CD1 4.1Å; I210-L214 HydrophobicContact CG2-CG 4.42Å; I210-L214 VanDerWaalsContact O-CG 3.31Å; I210-L214 WeakPolarHBondContact O-CG 3.33Å; I210-L214 PolarHBondContact O-N 3.43Å; I210-F270 HydrophobicContact CB-CE1 4.01Å; I210-F270 HydrophobicContact CB-CZ 4.46Å; I210-F270 HydrophobicContact CG2-CD1 4.42Å; I210-F270 HydrophobicContact CG2-CE1 3.68Å; I210-F270 HydrophobicContact CG2-CZ 4.18Å; I210-L328 HydrophobicContact CG2-CD2 3.79Å; I210-L331 HydrophobicContact CD1-CB 4.18Å; I210-L331 HydrophobicContact CG1-CB 3.96Å; I210-L331 HydrophobicContact CG2-CB 3.95Å; I210-L331 HydrophobicContact CG2-CD1 3.81Å; I210-Y332 HydrophobicContact CD1-CD2 3.93Å; I210-Y332 HydrophobicContact CD1-CG 4.41Å; I210-Q335 HydrophobicContact CG1-CG 4.02Å
211	L	98.4	Very high	97.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-44.6	176.5	174.2	60.6	0	0	0	110.5	E207 L208 N209 L214 V215 P233 F241 F270 A273 L274 F277	E207-L211 PolarHBondContact O-N 3.25Å; L208-L211 HydrophobicContact CD2-CD2 4.32Å; L208-L211 WeakPolarHBondContact O-CB 3.27Å; L208-L211 PolarHBondContact O-N 2.87Å; N209-L211 VanDerWaalsContact C-N 3.28Å; N209-L211 PolarHBondContact O-N 3.31Å; L211-L214 WeakPolarHBondContact O-CB 3.29Å; L211-L214 PolarHBondContact O-N 3.27Å; L211-V215 WeakPolarHBondContact O-CG2 3.3Å; L211-V215 PolarHBondContact O-N 3.45Å; L211-P233 HydrophobicContact CD2-CB 3.98Å; L211-P233 HydrophobicContact CD2-CG 4.25Å; L211-P233 HydrophobicContact CG-CG 4.35Å; L211-F241 HydrophobicContact CD2-CE2 4.02Å; L211-F241 HydrophobicContact CD2-CZ 4.17Å; L211-F270 HydrophobicContact CB-CD1 4.04Å; L211-F270 HydrophobicContact CB-CE1 4.08Å; L211-F270 HydrophobicContact CD1-CD1 4.23Å; L211-A273 HydrophobicContact CD1-CB 3.63Å; L211-A273 HydrophobicContact CD2-CB 3.73Å; L211-A273 HydrophobicContact CG-CB 4.34Å; L211-L274 HydrophobicContact CD1-CD2 4.36Å; L211-L274 HydrophobicContact CD1-CG 4.24Å; L211-F277 HydrophobicContact CD1-CE2 4.12Å; L211-F277 HydrophobicContact CD2-CE2 4.05Å; L211-F277 HydrophobicContact CD2-CZ 4.37Å; L211-F277 HydrophobicContact CG-CE2 4.11Å
212	F	98.1	Very high	97.3	Very high	13 Å²	13	38 Å²	38	6%	0.057	18%	0.181	C	C	.	.	H	α-helix	trans	-69.2	-34.9	-179.2	-154.8	-153.7	0	0	0	113.1	L208 N209 I210 L214 V215 K216 Y223 M226 M227 E232 P233	L208-F212 PolarHBondContact O-N 3.41Å; L208-F212 VanDerWaalsContact O-N 3.09Å; N209-F212 PolarHBondContact O-N 3.16Å; N209-F212 VanDerWaalsContact O-N 3.13Å; I210-F212 VanDerWaalsContact C-N 3.27Å; I210-F212 PolarHBondContact O-N 3.24Å; F212-L214 VanDerWaalsContact C-N 3.32Å; F212-L214 PolarHBondContact O-N 3.18Å; F212-V215 HydrophobicContact CD2-CB 4.23Å; F212-V215 WeakPolarHBondContact O-CB 3.46Å; F212-V215 PolarHBondContact O-N 3.05Å; F212-K216 PolarHBondContact O-N 2.8Å; F212-Y223 HydrophobicContact CD1-CD2 4.49Å; F212-Y223 AromaticContact CD1-CE2 3.93Å; F212-Y223 HydrophobicContact CD1-CE2 3.93Å; F212-Y223 AromaticContact CD2-CD2 3.74Å; F212-Y223 HydrophobicContact CD2-CD2 3.74Å; F212-Y223 HydrophobicContact CD2-CE2 4.01Å; F212-Y223 HydrophobicContact CE1-CD2 4.19Å; F212-Y223 AromaticContact CE1-CE2 3.62Å; F212-Y223 HydrophobicContact CE1-CE2 3.62Å; F212-Y223 AromaticContact CE2-CD2 3.38Å; F212-Y223 HydrophobicContact CE2-CD2 3.38Å; F212-Y223 AromaticContact CE2-CE2 3.72Å; F212-Y223 HydrophobicContact CE2-CE2 3.72Å; F212-Y223 HydrophobicContact CE2-CG 4.44Å; F212-Y223 HydrophobicContact CG-CD2 4.28Å; F212-Y223 HydrophobicContact CG-CE2 4.1Å; F212-Y223 AromaticContact CZ-CD2 3.63Å; F212-Y223 HydrophobicContact CZ-CD2 3.63Å; F212-Y223 AromaticContact CZ-CE2 3.51Å; F212-Y223 HydrophobicContact CZ-CE2 3.51Å; F212-M226 HydrophobicContact CE2-CB 4.03Å; F212-M226 HydrophobicContact CE2-CE 4.06Å; F212-M226 HydrophobicContact CE2-SD 4.12Å; F212-M226 HydrophobicContact CZ-CB 4.23Å; F212-M227 HydrophobicContact CE1-CG 4.46Å; F212-M227 HydrophobicContact CE1-SD 3.55Å; F212-M227 VanDerWaalsContact CE1-SD 3.55Å; F212-M227 HydrophobicContact CZ-CG 3.99Å; F212-M227 HydrophobicContact CZ-SD 3.61Å; F212-E232 HydrophobicContact CD1-CG 4.23Å; F212-E232 HydrophobicContact CE1-CB 4.4Å; F212-E232 HydrophobicContact CE1-CG 3.7Å; F212-E232 HydrophobicContact CZ-CG 4.32Å; F212-P233 HydrophobicContact CB-CG 3.95Å; F212-P233 HydrophobicContact CD2-CG 4.1Å; F212-P233 HydrophobicContact CG-CG 4.14Å
213	E	97.3	Very high	97.6	Very high	75 Å²	75	37.5 Å²	37.5	35%	0.35	18%	0.175	S	C	.	.	H	α-helix	trans	-62.9	-36.8	169.9	-73.6	-59.7	135.6	0	0	112.4	N209 I210 K216 K217	N209-E213 PolarHBondContact O-N 2.88Å; I210-E213 PolarHBondContact O-N 3.3Å; E213-K216 WeakPolarHBondContact O-CB 3.29Å; E213-K216 PolarHBondContact O-N 3.36Å; E213-K217 WeakPolarHBondContact O-CB 3.11Å; E213-K217 PolarHBondContact O-N 3.19Å
214	L	98.5	Very high	97.8	Very high	1 Å²	1	41 Å²	41	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-38.5	173.3	-65.8	168	0	0	0	111.6	I210 L211 F212 K217 Y218 F270 L274 I323 L328 L331	I210-L214 HydrophobicContact CG2-CD1 4.1Å; I210-L214 HydrophobicContact CG2-CG 4.42Å; I210-L214 VanDerWaalsContact O-CG 3.31Å; I210-L214 WeakPolarHBondContact O-CG 3.33Å; I210-L214 PolarHBondContact O-N 3.43Å; L211-L214 WeakPolarHBondContact O-CB 3.29Å; L211-L214 PolarHBondContact O-N 3.27Å; F212-L214 VanDerWaalsContact C-N 3.32Å; F212-L214 PolarHBondContact O-N 3.18Å; L214-K217 PolarHBondContact O-N 2.77Å; L214-Y218 HydrophobicContact CB-CD2 4.33Å; L214-Y218 HydrophobicContact CD2-CD2 4.11Å; L214-Y218 HydrophobicContact CD2-CE2 3.68Å; L214-Y218 WeakPolarHBondContact O-CB 3.45Å; L214-Y218 VanDerWaalsContact O-CD2 3.32Å; L214-Y218 WeakPolarHBondContact O-CD2 3.49Å; L214-Y218 PolarHBondContact O-N 2.86Å; L214-F270 HydrophobicContact CD1-CB 4.29Å; L214-F270 HydrophobicContact CD1-CD1 3.67Å; L214-F270 HydrophobicContact CD1-CE1 4.35Å; L214-F270 HydrophobicContact CD1-CG 4.26Å; L214-L274 HydrophobicContact CB-CD1 4.24Å; L214-L274 HydrophobicContact CB-CD2 4.23Å; L214-I323 HydrophobicContact CD1-CD1 4.44Å; L214-L328 HydrophobicContact CD1-CD2 3.85Å; L214-L331 HydrophobicContact CD2-CD1 3.89Å; L214-L331 HydrophobicContact CG-CD1 4.27Å
215	V	98.5	Very high	97.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-46.6	173	-179.4	0	0	0	0	109.7	L211 F212 K217 Y218 Q219 I222 M226 L274 F277	L211-V215 WeakPolarHBondContact O-CG2 3.3Å; L211-V215 PolarHBondContact O-N 3.45Å; F212-V215 HydrophobicContact CD2-CB 4.23Å; F212-V215 WeakPolarHBondContact O-CB 3.46Å; F212-V215 PolarHBondContact O-N 3.05Å; V215-K217 VanDerWaalsContact C-N 3.29Å; V215-K217 PolarHBondContact O-N 3.26Å; V215-Y218 PolarHBondContact O-N 3.27Å; V215-Q219 HydrophobicContact CG1-CB 4.06Å; V215-Q219 CarbonylContact O-C 3.37Å; V215-Q219 WeakPolarHBondContact O-CA 3.37Å; V215-Q219 WeakPolarHBondContact O-CB 3.44Å; V215-Q219 PolarHBondContact O-N 3.24Å; V215-I222 HydrophobicContact CG1-CB 4.29Å; V215-I222 HydrophobicContact CG1-CG2 4.08Å; V215-M226 HydrophobicContact CG1-SD 4.48Å; V215-L274 HydrophobicContact CB-CD2 4.49Å; V215-L274 HydrophobicContact CG2-CD2 3.72Å; V215-F277 HydrophobicContact CG2-CD2 3.57Å; V215-F277 HydrophobicContact CG2-CE2 3.72Å
216	K	98.3	Very high	98.1	Very high	96 Å²	96	37.4 Å²	37.4	42%	0.417	18%	0.178	S	C	.	.	H	α-helix	trans	-55.7	-44.2	175.9	-175	178.5	179.8	177.8	0	112.4	F212 E213 Y223	F212-K216 PolarHBondContact O-N 2.8Å; E213-K216 WeakPolarHBondContact O-CB 3.29Å; E213-K216 PolarHBondContact O-N 3.36Å; K216-Y223 HydrophobicContact CB-CD1 4.16Å; K216-Y223 HydrophobicContact CB-CD2 3.64Å; K216-Y223 HydrophobicContact CB-CE1 4.38Å; K216-Y223 HydrophobicContact CB-CE2 3.9Å; K216-Y223 HydrophobicContact CB-CG 3.78Å; K216-Y223 HydrophobicContact CD-CE1 4.03Å; K216-Y223 HydrophobicContact CD-CE2 4.23Å; K216-Y223 HydrophobicContact CG-CD1 3.91Å; K216-Y223 HydrophobicContact CG-CD2 4.24Å; K216-Y223 HydrophobicContact CG-CE1 3.91Å; K216-Y223 HydrophobicContact CG-CE2 4.25Å; K216-Y223 HydrophobicContact CG-CG 4.07Å
217	K	97.7	Very high	98.2	Very high	123 Å²	123	41.1 Å²	41.1	54%	0.535	20%	0.196	S	C	.	.	H	α-helix	trans	-73.7	-43.1	-177.3	-177.5	175.1	175.7	-169.7	0	113.5	E213 L214 V215 E327	E213-K217 WeakPolarHBondContact O-CB 3.11Å; E213-K217 PolarHBondContact O-N 3.19Å; L214-K217 PolarHBondContact O-N 2.77Å; V215-K217 VanDerWaalsContact C-N 3.29Å; V215-K217 PolarHBondContact O-N 3.26Å; K217-E327 IonicContact NZ-OE1 3.44Å; K217-E327 PolarHBondContact NZ-OE1 2.93Å
218	Y	98.2	Very high	98.2	Very high	71 Å²	71	48.7 Å²	48.7	28%	0.278	23%	0.229	S	C	.	.	H	α-helix	trans	-108.6	-12.8	-168.7	-62.8	-64.4	0	0	0	114.2	L214 V215 F322 E327	L214-Y218 HydrophobicContact CB-CD2 4.33Å; L214-Y218 HydrophobicContact CD2-CD2 4.11Å; L214-Y218 HydrophobicContact CD2-CE2 3.68Å; L214-Y218 WeakPolarHBondContact O-CB 3.45Å; L214-Y218 VanDerWaalsContact O-CD2 3.32Å; L214-Y218 WeakPolarHBondContact O-CD2 3.49Å; L214-Y218 PolarHBondContact O-N 2.86Å; V215-Y218 PolarHBondContact O-N 3.27Å; Y218-F322 AromaticContact CD1-CE2 3.73Å; Y218-F322 HydrophobicContact CD1-CE2 3.73Å; Y218-F322 AromaticContact CD1-CZ 3.84Å; Y218-F322 HydrophobicContact CD1-CZ 3.84Å; Y218-F322 HydrophobicContact CD2-CE2 4.1Å; Y218-F322 HydrophobicContact CE1-CD2 4.17Å; Y218-F322 AromaticContact CE1-CE2 3.38Å; Y218-F322 HydrophobicContact CE1-CE2 3.38Å; Y218-F322 AromaticContact CE1-CZ 3.94Å; Y218-F322 HydrophobicContact CE1-CZ 3.94Å; Y218-F322 AromaticContact CE2-CE2 3.8Å; Y218-F322 HydrophobicContact CE2-CE2 3.8Å; Y218-F322 HydrophobicContact CG-CE2 4.07Å; Y218-F322 HydrophobicContact CG-CZ 4.16Å; Y218-F322 AromaticContact CZ-CE2 3.41Å; Y218-F322 VanDerWaalsContact CZ-CE2 3.41Å; Y218-E327 PolarHBondContact OH-OE1 3.17Å
219	Q	98.4	Very high	98.2	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.028	23%	0.23	C	C	.	.			trans	-142.8	55.6	-176.1	-63.7	175.3	-29.6	0	0	110.9	V215 D221 I222 Y223 L274 Y320	V215-Q219 HydrophobicContact CG1-CB 4.06Å; V215-Q219 CarbonylContact O-C 3.37Å; V215-Q219 WeakPolarHBondContact O-CA 3.37Å; V215-Q219 WeakPolarHBondContact O-CB 3.44Å; V215-Q219 PolarHBondContact O-N 3.24Å; Q219-D221 VanDerWaalsContact C-N 3.3Å; Q219-D221 PolarHBondContact O-N 2.9Å; Q219-I222 HydrophobicContact CB-CB 4.06Å; Q219-I222 HydrophobicContact CB-CD1 3.94Å; Q219-I222 HydrophobicContact CB-CG1 4.34Å; Q219-I222 HydrophobicContact CG-CD1 4.14Å; Q219-I222 WeakPolarHBondContact O-CB 3.45Å; Q219-I222 PolarHBondContact O-N 2.71Å; Q219-Y223 PolarHBondContact O-N 2.71Å; Q219-L274 PolarHBondContact NE2-O 3.34Å; Q219-Y320 PolarHBondContact NE2-OH 3.01Å
220	P	98.5	Very high	98.3	Very high	62 Å²	62	52.1 Å²	52.1	40%	0.403	25%	0.248	S	C	.	.	H	α-helix	trans	-57.3	-39.8	-170.2	22.4	-34.1	0	0	0	113	I222 Y223 H224	P220-I222 VanDerWaalsContact C-N 3.28Å; P220-I222 PolarHBondContact O-N 3.29Å; P220-Y223 WeakPolarHBondContact O-CB 3.3Å; P220-Y223 PolarHBondContact O-N 2.91Å; P220-H224 PolarHBondContact O-N 3.3Å; P220-H224 PolarHBondContact O-ND1 3.32Å
221	D	98.6	Very high	98.3	Very high	100 Å²	100	52.1 Å²	52.1	54%	0.535	25%	0.247	S	C	.	.	H	α-helix	trans	-60.3	-38.2	176.6	-71	-8.2	0	0	0	112.9	Q219 H225 R287	Q219-D221 VanDerWaalsContact C-N 3.3Å; Q219-D221 PolarHBondContact O-N 2.9Å; D221-H225 VanDerWaalsContact O-CB 3.31Å; D221-H225 WeakPolarHBondContact O-CB 3.32Å; D221-H225 PolarHBondContact O-N 3.48Å; D221-H225 VanDerWaalsContact O-N 3.12Å; D221-R287 IonicContact OD2-NH2 3.49Å; D221-R287 PolarHBondContact OD2-NH2 3.45Å
222	I	98.7	Very high	98.2	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-71.7	-42.5	177.8	-63.4	168.3	0	0	0	109.6	V215 Q219 P220 H225 M226 F277 L281	V215-I222 HydrophobicContact CG1-CB 4.29Å; V215-I222 HydrophobicContact CG1-CG2 4.08Å; Q219-I222 HydrophobicContact CB-CB 4.06Å; Q219-I222 HydrophobicContact CB-CD1 3.94Å; Q219-I222 HydrophobicContact CB-CG1 4.34Å; Q219-I222 HydrophobicContact CG-CD1 4.14Å; Q219-I222 WeakPolarHBondContact O-CB 3.45Å; Q219-I222 PolarHBondContact O-N 2.71Å; P220-I222 VanDerWaalsContact C-N 3.28Å; P220-I222 PolarHBondContact O-N 3.29Å; I222-H225 WeakPolarHBondContact O-CB 3.23Å; I222-H225 PolarHBondContact O-N 3.25Å; I222-M226 HydrophobicContact CG2-CG 4.23Å; I222-M226 HydrophobicContact CG2-SD 3.96Å; I222-M226 WeakPolarHBondContact O-CB 3.23Å; I222-M226 WeakPolarHBondContact O-CG 3.47Å; I222-M226 PolarHBondContact O-N 2.94Å; I222-F277 WeakPolarHBondContact CD1-O 3.5Å; I222-F277 HydrophobicContact CG2-CB 4.27Å; I222-L281 HydrophobicContact CD1-CB 4.26Å; I222-L281 HydrophobicContact CG1-CB 3.91Å; I222-L281 HydrophobicContact CG2-CB 4.02Å; I222-L281 HydrophobicContact CG2-CD1 3.73Å
223	Y	98.8	Very high	98.2	Very high	34 Å²	34	54.7 Å²	54.7	13%	0.133	26%	0.26	C	S	.	.	H	α-helix	trans	-55.9	-53.3	175.1	175.9	-100.7	0	0	0	111.8	F212 K216 Q219 P220 H225 M226 M227	F212-Y223 HydrophobicContact CD1-CD2 4.49Å; F212-Y223 AromaticContact CD1-CE2 3.93Å; F212-Y223 HydrophobicContact CD1-CE2 3.93Å; F212-Y223 AromaticContact CD2-CD2 3.74Å; F212-Y223 HydrophobicContact CD2-CD2 3.74Å; F212-Y223 HydrophobicContact CD2-CE2 4.01Å; F212-Y223 HydrophobicContact CE1-CD2 4.19Å; F212-Y223 AromaticContact CE1-CE2 3.62Å; F212-Y223 HydrophobicContact CE1-CE2 3.62Å; F212-Y223 AromaticContact CE2-CD2 3.38Å; F212-Y223 HydrophobicContact CE2-CD2 3.38Å; F212-Y223 AromaticContact CE2-CE2 3.72Å; F212-Y223 HydrophobicContact CE2-CE2 3.72Å; F212-Y223 HydrophobicContact CE2-CG 4.44Å; F212-Y223 HydrophobicContact CG-CD2 4.28Å; F212-Y223 HydrophobicContact CG-CE2 4.1Å; F212-Y223 AromaticContact CZ-CD2 3.63Å; F212-Y223 HydrophobicContact CZ-CD2 3.63Å; F212-Y223 AromaticContact CZ-CE2 3.51Å; F212-Y223 HydrophobicContact CZ-CE2 3.51Å; K216-Y223 HydrophobicContact CB-CD1 4.16Å; K216-Y223 HydrophobicContact CB-CD2 3.64Å; K216-Y223 HydrophobicContact CB-CE1 4.38Å; K216-Y223 HydrophobicContact CB-CE2 3.9Å; K216-Y223 HydrophobicContact CB-CG 3.78Å; K216-Y223 HydrophobicContact CD-CE1 4.03Å; K216-Y223 HydrophobicContact CD-CE2 4.23Å; K216-Y223 HydrophobicContact CG-CD1 3.91Å; K216-Y223 HydrophobicContact CG-CD2 4.24Å; K216-Y223 HydrophobicContact CG-CE1 3.91Å; K216-Y223 HydrophobicContact CG-CE2 4.25Å; K216-Y223 HydrophobicContact CG-CG 4.07Å; Q219-Y223 PolarHBondContact O-N 2.71Å; P220-Y223 WeakPolarHBondContact O-CB 3.3Å; P220-Y223 PolarHBondContact O-N 2.91Å; Y223-H225 VanDerWaalsContact C-N 3.26Å; Y223-H225 PolarHBondContact O-N 2.95Å; Y223-M226 PolarHBondContact O-N 3.37Å; Y223-M227 HydrophobicContact CD1-CG 4.29Å; Y223-M227 HydrophobicContact CD2-CG 4.46Å; Y223-M227 HydrophobicContact CE1-CG 3.89Å; Y223-M227 HydrophobicContact CE2-CG 4.07Å; Y223-M227 HydrophobicContact CE2-SD 4.28Å; Y223-M227 WeakPolarHBondContact O-CG 3.37Å; Y223-M227 PolarHBondContact O-N 3.23Å
224	H	98.6	Very high	98.1	Very high	118 Å²	118	53.5 Å²	53.5	55%	0.546	26%	0.255	S	S	.	.	H	α-helix	trans	-61.1	-36.8	179.2	-66.1	106.1	0	0	0	112	P220 K228	P220-H224 PolarHBondContact O-N 3.3Å; P220-H224 PolarHBondContact O-ND1 3.32Å; H224-K228 WeakPolarHBondContact O-CB 3.4Å; H224-K228 PolarHBondContact O-N 3.28Å
225	H	98.7	Very high	98	Very high	20 Å²	20	58.6 Å²	58.6	9%	0.093	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-45.1	176	-177.4	73	0	0	0	112.7	D221 I222 Y223 K228 C229 R287 L290	D221-H225 VanDerWaalsContact O-CB 3.31Å; D221-H225 WeakPolarHBondContact O-CB 3.32Å; D221-H225 PolarHBondContact O-N 3.48Å; D221-H225 VanDerWaalsContact O-N 3.12Å; I222-H225 WeakPolarHBondContact O-CB 3.23Å; I222-H225 PolarHBondContact O-N 3.25Å; Y223-H225 VanDerWaalsContact C-N 3.26Å; Y223-H225 PolarHBondContact O-N 2.95Å; H225-K228 PolarHBondContact O-N 3.26Å; H225-C229 PolarHBondContact O-N 3.41Å; H225-C229 PolarHBondContact O-SG 2.86Å; H225-R287 HydrophobicContact CB-CG 4.38Å; H225-R287 PolarHBondContact CE1-O 3.34Å; H225-L290 PolarHBondContact CE1-O 2.87Å; H225-L290 VanDerWaalsContact CE1-O 3.29Å; H225-L290 PolarHBondContact NE2-O 2.74Å
226	M	98.6	Very high	97.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-43.6	176	-74.8	-177.9	69.9	0	0	111.4	F212 V215 I222 Y223 C229 N230 T231 P233 F236 F277 L281 L296	F212-M226 HydrophobicContact CE2-CB 4.03Å; F212-M226 HydrophobicContact CE2-CE 4.06Å; F212-M226 HydrophobicContact CE2-SD 4.12Å; F212-M226 HydrophobicContact CZ-CB 4.23Å; V215-M226 HydrophobicContact CG1-SD 4.48Å; I222-M226 HydrophobicContact CG2-CG 4.23Å; I222-M226 HydrophobicContact CG2-SD 3.96Å; I222-M226 WeakPolarHBondContact O-CB 3.23Å; I222-M226 WeakPolarHBondContact O-CG 3.47Å; I222-M226 PolarHBondContact O-N 2.94Å; Y223-M226 PolarHBondContact O-N 3.37Å; M226-C229 CarbonylContact O-C 3.59Å; M226-C229 PolarHBondContact O-N 3.11Å; M226-C229 VanDerWaalsContact O-N 3.15Å; M226-N230 PolarHBondContact O-N 2.68Å; M226-N230 VanDerWaalsContact O-N 3.11Å; M226-T231 WeakPolarHBondContact CB-O 3.48Å; M226-T231 HydrophobicContact CE-CG2 4.43Å; M226-T231 PolarHBondContact O-N 3.44Å; M226-P233 HydrophobicContact CE-CG 4.4Å; M226-F236 HydrophobicContact CE-CE1 4.13Å; M226-F236 HydrophobicContact CE-CZ 4.01Å; M226-F277 HydrophobicContact CE-CE1 4.24Å; M226-F277 HydrophobicContact CE-CZ 4.38Å; M226-F277 HydrophobicContact SD-CD1 4.41Å; M226-F277 HydrophobicContact SD-CE1 4.36Å; M226-L281 HydrophobicContact CG-CD1 4.28Å; M226-L296 HydrophobicContact CG-CD2 4.25Å
227	M	98.2	Very high	97.9	Very high	79 Å²	79	54.8 Å²	54.8	39%	0.389	26%	0.259	S	S	.	.	H	α-helix	trans	-60.4	-46.2	173.5	-71.2	-61.1	-62	0	0	111.9	F212 Y223 C229 N230	F212-M227 HydrophobicContact CE1-CG 4.46Å; F212-M227 HydrophobicContact CE1-SD 3.55Å; F212-M227 VanDerWaalsContact CE1-SD 3.55Å; F212-M227 HydrophobicContact CZ-CG 3.99Å; F212-M227 HydrophobicContact CZ-SD 3.61Å; Y223-M227 HydrophobicContact CD1-CG 4.29Å; Y223-M227 HydrophobicContact CD2-CG 4.46Å; Y223-M227 HydrophobicContact CE1-CG 3.89Å; Y223-M227 HydrophobicContact CE2-CG 4.07Å; Y223-M227 HydrophobicContact CE2-SD 4.28Å; Y223-M227 WeakPolarHBondContact O-CG 3.37Å; Y223-M227 PolarHBondContact O-N 3.23Å; M227-C229 PolarHBondContact O-N 3.16Å; M227-N230 PolarHBondContact O-N 2.81Å
228	K	98.2	Very high	97.9	Very high	165 Å²	165	51.4 Å²	51.4	72%	0.717	25%	0.246	S	C	*	.	H	α-helix	trans	-59	-33.4	175.3	179.6	179.6	176.9	178.6	0	112.4	H224 H225 N230	H224-K228 WeakPolarHBondContact O-CB 3.4Å; H224-K228 PolarHBondContact O-N 3.28Å; H225-K228 PolarHBondContact O-N 3.26Å; K228-N230 VanDerWaalsContact C-N 3.32Å
229	C	98.1	Very high	97.8	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.034	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	1.9	176.8	-62.2	0	0	0	0	113.6	H225 M226 M227 T231 M293 L296	H225-C229 PolarHBondContact O-N 3.41Å; H225-C229 PolarHBondContact O-SG 2.86Å; M226-C229 CarbonylContact O-C 3.59Å; M226-C229 PolarHBondContact O-N 3.11Å; M226-C229 VanDerWaalsContact O-N 3.15Å; M227-C229 PolarHBondContact O-N 3.16Å; C229-T231 PolarHBondContact O-N 3.15Å; C229-T231 PolarHBondContact O-OG1 2.92Å; C229-M293 WeakPolarHBondContact O-CA 3.47Å; C229-M293 WeakPolarHBondContact O-CB 3.49Å; C229-M293 WeakPolarHBondContact O-CG 3.25Å; C229-L296 HydrophobicContact CB-CD2 3.73Å
230	N	97.4	Very high	97.8	Very high	122 Å²	122	50.2 Å²	50.2	65%	0.652	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	38.5	-173.4	-58.6	-53.7	0	0	0	113.4	M226 M227 K228	M226-N230 PolarHBondContact O-N 2.68Å; M226-N230 VanDerWaalsContact O-N 3.11Å; M227-N230 PolarHBondContact O-N 2.81Å; K228-N230 VanDerWaalsContact C-N 3.32Å
231	T	97.7	Very high	97.8	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.226	C	C	.	.			trans	-117.9	121.7	-176.8	-62.4	0	0	0	0	111	M226 C229 F236 L296 M297 L300	M226-T231 WeakPolarHBondContact CB-O 3.48Å; M226-T231 HydrophobicContact CE-CG2 4.43Å; M226-T231 PolarHBondContact O-N 3.44Å; C229-T231 PolarHBondContact O-N 3.15Å; C229-T231 PolarHBondContact O-OG1 2.92Å; T231-F236 HydrophobicContact CG2-CD1 4.12Å; T231-F236 HydrophobicContact CG2-CE1 3.78Å; T231-L296 HydrophobicContact CG2-CD2 3.95Å; T231-L296 HydrophobicContact CG2-CG 4.21Å; T231-M297 HydrophobicContact CG2-CG 4.33Å; T231-M297 HydrophobicContact CG2-SD 3.55Å; T231-M297 VanDerWaalsContact CG2-SD 3.55Å; T231-L300 HydrophobicContact CG2-CD1 4Å
232	E	96.8	Very high	97.7	Very high	65 Å²	65	42.8 Å²	42.8	30%	0.304	20%	0.201	S	C	.	.			trans	-118.6	154.3	176	-63.5	-173.1	-141.6	0	0	111.3	F212 I234 Y235 F236	F212-E232 HydrophobicContact CD1-CG 4.23Å; F212-E232 HydrophobicContact CE1-CB 4.4Å; F212-E232 HydrophobicContact CE1-CG 3.7Å; F212-E232 HydrophobicContact CZ-CG 4.32Å; E232-I234 HydrophobicContact CB-CG2 4.12Å; E232-I234 PolarHBondContact O-N 3.14Å; E232-Y235 HydrophobicContact CB-CD2 4.24Å; E232-Y235 HydrophobicContact CB-CE2 3.97Å; E232-Y235 HydrophobicContact CG-CE2 4.3Å; E232-Y235 PolarHBondContact O-N 3.23Å; E232-F236 WeakPolarHBondContact O-CD1 3.49Å; E232-F236 VanDerWaalsContact O-CE1 3.23Å; E232-F236 WeakPolarHBondContact O-CE1 3.3Å
233	P	98.2	Very high	97.7	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.013	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-52.7	-31.2	179.6	-29.3	37.1	0	0	0	115	L208 L211 F212 M226 Y235 F236 A237 F277	L208-P233 HydrophobicContact CB-CB 4.32Å; L208-P233 HydrophobicContact CD2-CB 4.29Å; L211-P233 HydrophobicContact CD2-CB 3.98Å; L211-P233 HydrophobicContact CD2-CG 4.25Å; L211-P233 HydrophobicContact CG-CG 4.35Å; F212-P233 HydrophobicContact CB-CG 3.95Å; F212-P233 HydrophobicContact CD2-CG 4.1Å; F212-P233 HydrophobicContact CG-CG 4.14Å; M226-P233 HydrophobicContact CE-CG 4.4Å; P233-Y235 PolarHBondContact O-N 3.12Å; P233-Y235 VanDerWaalsContact O-N 3.1Å; P233-F236 HydrophobicContact CB-CZ 4.33Å; P233-F236 PolarHBondContact O-N 2.69Å; P233-A237 HydrophobicContact CB-CB 4.26Å; P233-A237 VanDerWaalsContact O-CB 3.3Å; P233-A237 WeakPolarHBondContact O-CB 3.48Å; P233-A237 PolarHBondContact O-N 3.06Å; P233-F277 HydrophobicContact CG-CZ 4.48Å
234	I	96.1	Very high	97.7	Very high	50 Å²	50	41.1 Å²	41.1	26%	0.256	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-58.1	-24	178.4	-165.4	166.1	0	0	0	113.7	K205 L208 E232 I238	K205-I234 HydrophobicContact CG-CD1 4.01Å; L208-I234 HydrophobicContact CD1-CB 4.39Å; L208-I234 HydrophobicContact CD1-CG1 4.46Å; E232-I234 HydrophobicContact CB-CG2 4.12Å; E232-I234 PolarHBondContact O-N 3.14Å; I234-I238 HydrophobicContact CG1-CD1 4.44Å; I234-I238 WeakPolarHBondContact O-CD1 3.44Å
235	Y	96.2	Very high	97.6	Very high	108 Å²	108	35.5 Å²	35.5	42%	0.424	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-82.2	-14.4	-177.4	-54	-37	0	0	0	114.7	E232 P233 M293 M297	E232-Y235 HydrophobicContact CB-CD2 4.24Å; E232-Y235 HydrophobicContact CB-CE2 3.97Å; E232-Y235 HydrophobicContact CG-CE2 4.3Å; E232-Y235 PolarHBondContact O-N 3.23Å; P233-Y235 PolarHBondContact O-N 3.12Å; P233-Y235 VanDerWaalsContact O-N 3.1Å; Y235-M293 HydrophobicContact CD2-CE 4.36Å; Y235-M297 WeakPolarHBondContact O-CE 3.29Å
236	F	96.9	Very high	97.6	Very high	17 Å²	17	34.5 Å²	34.5	8%	0.075	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.1	-25.6	-174.7	62	-90.4	0	0	0	115.1	M226 T231 E232 P233 W240 F277 M297 L300 R301	M226-F236 HydrophobicContact CE-CE1 4.13Å; M226-F236 HydrophobicContact CE-CZ 4.01Å; T231-F236 HydrophobicContact CG2-CD1 4.12Å; T231-F236 HydrophobicContact CG2-CE1 3.78Å; E232-F236 WeakPolarHBondContact O-CD1 3.49Å; E232-F236 VanDerWaalsContact O-CE1 3.23Å; E232-F236 WeakPolarHBondContact O-CE1 3.3Å; P233-F236 HydrophobicContact CB-CZ 4.33Å; P233-F236 PolarHBondContact O-N 2.69Å; F236-W240 AromaticContact CD2-CH2 3.9Å; F236-W240 HydrophobicContact CD2-CH2 3.9Å; F236-W240 AromaticContact CD2-CZ2 3.69Å; F236-W240 HydrophobicContact CD2-CZ2 3.69Å; F236-W240 HydrophobicContact CD2-CZ3 4.44Å; F236-W240 HydrophobicContact CE2-CE3 4.49Å; F236-W240 AromaticContact CE2-CH2 3.52Å; F236-W240 HydrophobicContact CE2-CH2 3.52Å; F236-W240 AromaticContact CE2-CZ2 3.83Å; F236-W240 HydrophobicContact CE2-CZ2 3.83Å; F236-W240 AromaticContact CE2-CZ3 3.88Å; F236-W240 HydrophobicContact CE2-CZ3 3.88Å; F236-F277 AromaticContact CE2-CE1 3.71Å; F236-F277 HydrophobicContact CE2-CE1 3.71Å; F236-F277 AromaticContact CE2-CZ 3.84Å; F236-F277 HydrophobicContact CE2-CZ 3.84Å; F236-F277 AromaticContact CZ-CE1 3.55Å; F236-F277 HydrophobicContact CZ-CE1 3.55Å; F236-F277 AromaticContact CZ-CZ 3.66Å; F236-F277 HydrophobicContact CZ-CZ 3.66Å; F236-M297 HydrophobicContact CB-CE 4.02Å; F236-M297 HydrophobicContact CB-SD 4.45Å; F236-M297 HydrophobicContact CD1-CE 4.37Å; F236-M297 HydrophobicContact CD1-SD 3.84Å; F236-L300 HydrophobicContact CB-CB 4.42Å; F236-L300 HydrophobicContact CD1-CB 4.37Å; F236-L300 HydrophobicContact CD1-CD1 3.88Å; F236-L300 HydrophobicContact CD2-CB 3.91Å; F236-L300 HydrophobicContact CD2-CD1 4.34Å; F236-L300 HydrophobicContact CD2-CD2 4.32Å; F236-L300 HydrophobicContact CD2-CG 4.44Å; F236-L300 HydrophobicContact CE1-CD1 3.57Å; F236-L300 HydrophobicContact CE2-CB 4.29Å; F236-L300 HydrophobicContact CE2-CD1 4.06Å; F236-L300 HydrophobicContact CE2-CD2 3.88Å; F236-L300 HydrophobicContact CE2-CG 4.32Å; F236-L300 HydrophobicContact CG-CB 3.97Å; F236-L300 HydrophobicContact CG-CD1 4.26Å; F236-L300 HydrophobicContact CZ-CD1 3.67Å; F236-L300 HydrophobicContact CZ-CD2 4.16Å; F236-L300 HydrophobicContact CZ-CG 4.4Å; F236-R301 HydrophobicContact CB-CG 4.39Å
237	A	97.9	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.179	C	C	.	.			trans	-96	3.8	-170.7	0	0	0	0	0	114.5	L208 P233 D239 W240 F241	L208-A237 HydrophobicContact CD2-CB 3.8Å; P233-A237 HydrophobicContact CB-CB 4.26Å; P233-A237 VanDerWaalsContact O-CB 3.3Å; P233-A237 WeakPolarHBondContact O-CB 3.48Å; P233-A237 PolarHBondContact O-N 3.06Å; A237-D239 PolarHBondContact O-N 3.19Å; A237-W240 HydrophobicContact CB-CB 4.32Å; A237-W240 HydrophobicContact CB-CD2 3.86Å; A237-W240 HydrophobicContact CB-CE3 3.76Å; A237-W240 HydrophobicContact CB-CG 4.14Å; A237-W240 HydrophobicContact CB-CZ3 4.37Å; A237-W240 WeakPolarHBondContact O-CB 3.47Å; A237-W240 PolarHBondContact O-N 3.48Å; A237-F241 PolarHBondContact O-N 2.94Å
238	I	97.4	Very high	97.2	Very high	52 Å²	52	35.8 Å²	35.8	27%	0.267	17%	0.166	S	C	.	.	H	α-helix	trans	-53.2	-48.1	172.7	-66.6	173.4	0	0	0	109.6	V204 L208 I234 W240 F241 M242	V204-I238 HydrophobicContact CG1-CG2 4.4Å; L208-I238 HydrophobicContact CD1-CB 4.44Å; L208-I238 HydrophobicContact CD1-CG1 3.61Å; I234-I238 HydrophobicContact CG1-CD1 4.44Å; I234-I238 WeakPolarHBondContact O-CD1 3.44Å; I238-W240 PolarHBondContact O-N 3.13Å; I238-F241 PolarHBondContact O-N 3.35Å; I238-M242 HydrophobicContact CG2-CG 4.06Å; I238-M242 HydrophobicContact CG2-SD 3.59Å; I238-M242 VanDerWaalsContact CG2-SD 3.59Å; I238-M242 WeakPolarHBondContact O-CB 3.2Å; I238-M242 WeakPolarHBondContact O-CG 3.34Å; I238-M242 PolarHBondContact O-N 3.27Å
239	D	96.1	Very high	97.1	Very high	51 Å²	51	28 Å²	28	27%	0.273	13%	0.132	S	C	.	.	H	α-helix	trans	-67.6	-33.9	-179.1	-77.2	7	0	0	0	113.8	A237 F241 C243 R247	A237-D239 PolarHBondContact O-N 3.19Å; D239-F241 PolarHBondContact O-N 2.83Å; D239-C243 WeakPolarHBondContact O-CA 3.34Å; D239-C243 VanDerWaalsContact O-CB 3.25Å; D239-C243 WeakPolarHBondContact O-CB 3.17Å; D239-C243 PolarHBondContact O-N 3.39Å; D239-R247 IonicContact OD1-CZ 3.13Å; D239-R247 IonicContact OD1-NH2 2.81Å; D239-R247 PolarHBondContact OD1-NH2 3.26Å; D239-R247 IonicContact OD2-CZ 3.92Å; D239-R247 IonicContact OD2-NE 2.82Å; D239-R247 PolarHBondContact OD2-NE 2.87Å; D239-R247 IonicContact OD2-NH2 3.74Å; D239-R247 PolarHBondContact OD2-NH2 3.5Å
240	W	98.3	Very high	97	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-57.1	-39.1	177.1	-66.6	9.7	0	0	0	110.5	F236 A237 I238 L244 Y245 N248 A273 I276 F277 L300 L303	F236-W240 AromaticContact CD2-CH2 3.9Å; F236-W240 HydrophobicContact CD2-CH2 3.9Å; F236-W240 AromaticContact CD2-CZ2 3.69Å; F236-W240 HydrophobicContact CD2-CZ2 3.69Å; F236-W240 HydrophobicContact CD2-CZ3 4.44Å; F236-W240 HydrophobicContact CE2-CE3 4.49Å; F236-W240 AromaticContact CE2-CH2 3.52Å; F236-W240 HydrophobicContact CE2-CH2 3.52Å; F236-W240 AromaticContact CE2-CZ2 3.83Å; F236-W240 HydrophobicContact CE2-CZ2 3.83Å; F236-W240 AromaticContact CE2-CZ3 3.88Å; F236-W240 HydrophobicContact CE2-CZ3 3.88Å; A237-W240 HydrophobicContact CB-CB 4.32Å; A237-W240 HydrophobicContact CB-CD2 3.86Å; A237-W240 HydrophobicContact CB-CE3 3.76Å; A237-W240 HydrophobicContact CB-CG 4.14Å; A237-W240 HydrophobicContact CB-CZ3 4.37Å; A237-W240 WeakPolarHBondContact O-CB 3.47Å; A237-W240 PolarHBondContact O-N 3.48Å; I238-W240 PolarHBondContact O-N 3.13Å; W240-L244 CarbonylContact O-C 3.33Å; W240-Y245 HydrophobicContact CB-CD1 3.82Å; W240-Y245 HydrophobicContact CB-CE1 3.44Å; W240-Y245 VanDerWaalsContact CB-CE1 3.44Å; W240-Y245 HydrophobicContact CD2-CD1 4.47Å; W240-Y245 AromaticContact CD2-CE1 3.79Å; W240-Y245 HydrophobicContact CD2-CE1 3.79Å; W240-Y245 AromaticContact CE3-CE1 3.9Å; W240-Y245 HydrophobicContact CE3-CE1 3.9Å; W240-Y245 AromaticContact CG-CD1 3.97Å; W240-Y245 HydrophobicContact CG-CD1 3.97Å; W240-Y245 AromaticContact CG-CE1 3.62Å; W240-Y245 HydrophobicContact CG-CE1 3.62Å; W240-Y245 WeakPolarHBondContact O-CD2 3.41Å; W240-Y245 PolarHBondContact O-N 3.13Å; W240-N248 VanDerWaalsContact CD1-CG 3.49Å; W240-A273 HydrophobicContact CE3-CB 4.08Å; W240-A273 HydrophobicContact CZ3-CB 4.08Å; W240-I276 HydrophobicContact CE3-CD1 4.34Å; W240-I276 HydrophobicContact CH2-CB 4.3Å; W240-I276 HydrophobicContact CH2-CD1 4.18Å; W240-I276 HydrophobicContact CH2-CG2 3.68Å; W240-I276 HydrophobicContact CZ2-CG2 4.36Å; W240-I276 HydrophobicContact CZ3-CB 4.43Å; W240-I276 HydrophobicContact CZ3-CD1 4.07Å; W240-I276 HydrophobicContact CZ3-CG2 4.29Å; W240-F277 HydrophobicContact CH2-CE1 4.11Å; W240-F277 HydrophobicContact CH2-CZ 4.43Å; W240-F277 HydrophobicContact CZ3-CE1 4.16Å; W240-F277 HydrophobicContact CZ3-CZ 4.04Å; W240-L300 HydrophobicContact CH2-CD2 4.08Å; W240-L300 HydrophobicContact CZ2-CD2 4.44Å; W240-L303 HydrophobicContact CH2-CD2 4.48Å; W240-L303 HydrophobicContact CZ2-CD1 3.89Å; W240-L303 HydrophobicContact CZ2-CD2 4.09Å; W240-L303 HydrophobicContact CZ2-CG 4.33Å
241	F	98.2	Very high	96.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-88.4	-53.3	-178.4	-78.4	-121.7	0	0	0	111.4	Y196 E207 L208 L211 A237 I238 D239 C243 L244 L269 F270 A273	Y196-F241 HydrophobicContact CE1-CB 4.11Å; E207-F241 HydrophobicContact CB-CD1 4.43Å; E207-F241 HydrophobicContact CB-CE1 4.32Å; L208-F241 HydrophobicContact CD2-CD2 4Å; L208-F241 HydrophobicContact CD2-CE2 4.1Å; L208-F241 HydrophobicContact CD2-CG 4.36Å; L211-F241 HydrophobicContact CD2-CE2 4.02Å; L211-F241 HydrophobicContact CD2-CZ 4.17Å; A237-F241 PolarHBondContact O-N 2.94Å; I238-F241 PolarHBondContact O-N 3.35Å; D239-F241 PolarHBondContact O-N 2.83Å; F241-C243 VanDerWaalsContact C-N 3.3Å; F241-C243 PolarHBondContact O-N 3.47Å; F241-L244 PolarHBondContact O-N 3.31Å; F241-L269 HydrophobicContact CD1-CB 4.29Å; F241-L269 HydrophobicContact CD1-CD1 4.12Å; F241-L269 HydrophobicContact CE1-CB 4.07Å; F241-L269 HydrophobicContact CE2-CB 4.42Å; F241-L269 HydrophobicContact CG-CD1 4.34Å; F241-L269 HydrophobicContact CZ-CB 4.13Å; F241-F270 HydrophobicContact CE1-CD1 4.31Å; F241-F270 HydrophobicContact CE1-CD2 4.12Å; F241-F270 HydrophobicContact CE1-CE1 4.03Å; F241-F270 AromaticContact CE1-CE2 3.81Å; F241-F270 HydrophobicContact CE1-CE2 3.81Å; F241-F270 HydrophobicContact CE1-CG 4.37Å; F241-F270 AromaticContact CE1-CZ 3.78Å; F241-F270 HydrophobicContact CE1-CZ 3.78Å; F241-F270 HydrophobicContact CZ-CD1 4.11Å; F241-F270 HydrophobicContact CZ-CD2 4.42Å; F241-F270 HydrophobicContact CZ-CE1 4.19Å; F241-F270 HydrophobicContact CZ-CE2 4.48Å; F241-F270 HydrophobicContact CZ-CG 4.25Å; F241-F270 HydrophobicContact CZ-CZ 4.38Å; F241-A273 HydrophobicContact CE2-CB 4.43Å
242	M	97.6	Very high	96.8	Very high	6 Å²	6	22.7 Å²	22.7	3%	0.03	11%	0.105	C	C	.	.	H	α-helix	trans	-68.9	-27.5	-173.9	-68.1	-166.1	70.6	0	0	113.9	A164 I168 M193 Y196 F197 L201 V204 I238	A164-M242 HydrophobicContact CB-CB 3.67Å; A164-M242 HydrophobicContact CB-CE 3.86Å; I168-M242 VanDerWaalsContact CD1-O 3.27Å; I168-M242 WeakPolarHBondContact CD1-O 3.37Å; M193-M242 WeakPolarHBondContact CE-O 3.46Å; Y196-M242 HydrophobicContact CD1-CG 4.39Å; Y196-M242 WeakPolarHBondContact O-CE 3.03Å; F197-M242 HydrophobicContact CD1-CE 3.77Å; F197-M242 HydrophobicContact CE1-CE 4.22Å; L201-M242 HydrophobicContact CD2-CE 3.66Å; L201-M242 HydrophobicContact CD2-SD 3.68Å; V204-M242 HydrophobicContact CB-CG 4.47Å; V204-M242 HydrophobicContact CG1-CG 4.02Å; V204-M242 HydrophobicContact CG1-SD 4.4Å; V204-M242 HydrophobicContact CG2-CG 3.67Å; V204-M242 HydrophobicContact CG2-SD 3.96Å; I238-M242 HydrophobicContact CG2-CG 4.06Å; I238-M242 HydrophobicContact CG2-SD 3.59Å; I238-M242 VanDerWaalsContact CG2-SD 3.59Å; I238-M242 WeakPolarHBondContact O-CB 3.2Å; I238-M242 WeakPolarHBondContact O-CG 3.34Å; I238-M242 PolarHBondContact O-N 3.27Å
243	C	97.7	Very high	96.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	13.1	176.5	-56.9	0	0	0	0	112	P167 D239 F241 Y245 T246 R247	P167-C243 HydrophobicContact CG-CB 3.83Å; P167-C243 VanDerWaalsContact CG-SG 3.59Å; D239-C243 WeakPolarHBondContact O-CA 3.34Å; D239-C243 VanDerWaalsContact O-CB 3.25Å; D239-C243 WeakPolarHBondContact O-CB 3.17Å; D239-C243 PolarHBondContact O-N 3.39Å; F241-C243 VanDerWaalsContact C-N 3.3Å; F241-C243 PolarHBondContact O-N 3.47Å; C243-Y245 PolarHBondContact O-N 2.88Å; C243-Y245 VanDerWaalsContact O-N 3.13Å; C243-T246 WeakPolarHBondContact O-CB 3.41Å; C243-T246 PolarHBondContact O-N 2.97Å; C243-T246 PolarHBondContact O-OG1 2.98Å; C243-R247 HydrophobicContact CB-CG 4.13Å; C243-R247 PolarHBondContact SG-NE 2.99Å; C243-R247 PolarHBondContact SG-NH2 2.71Å; C243-R247 VanDerWaalsContact SG-NH2 3.43Å
244	L	98.2	Very high	96.8	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	44.4	-179.4	-57.5	178.5	0	0	0	113.1	I168 L188 M193 W240 F241 T246 W258 F261 L269	I168-L244 HydrophobicContact CD1-CD1 4.07Å; I168-L244 HydrophobicContact CD1-CG 3.97Å; I168-L244 HydrophobicContact CG1-CD1 4.34Å; I168-L244 HydrophobicContact CG1-CG 4.37Å; I168-L244 HydrophobicContact CG2-CD1 4.38Å; L188-L244 HydrophobicContact CD1-CD1 4.45Å; M193-L244 HydrophobicContact CE-CD2 3.95Å; M193-L244 HydrophobicContact CE-CG 4.02Å; M193-L244 HydrophobicContact CG-CD2 4.47Å; M193-L244 HydrophobicContact SD-CD1 3.8Å; M193-L244 HydrophobicContact SD-CD2 3.93Å; M193-L244 HydrophobicContact SD-CG 3.89Å; W240-L244 CarbonylContact O-C 3.33Å; F241-L244 PolarHBondContact O-N 3.31Å; L244-T246 PolarHBondContact O-N 3.37Å; L244-T246 VanDerWaalsContact O-N 3.11Å; L244-W258 HydrophobicContact CB-CZ2 4.09Å; L244-W258 HydrophobicContact CD1-CZ2 4.08Å; L244-W258 PolarHBondContact O-NE1 3.39Å; L244-F261 HydrophobicContact CD1-CD1 4.31Å; L244-F261 HydrophobicContact CD1-CE1 3.82Å; L244-F261 HydrophobicContact CD1-CZ 4.3Å; L244-F261 HydrophobicContact CD2-CE1 3.9Å; L244-F261 HydrophobicContact CD2-CE2 3.89Å; L244-F261 HydrophobicContact CD2-CZ 3.54Å; L244-L269 HydrophobicContact CD2-CD1 3.83Å; L244-L269 HydrophobicContact CD2-CD2 4.05Å
245	Y	98	Very high	96.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	1.5	-175.6	-64.1	-83.6	0	0	0	117.4	W240 C243 R247 N248 L249 I257 L269 I272 A273 I276	W240-Y245 HydrophobicContact CB-CD1 3.82Å; W240-Y245 HydrophobicContact CB-CE1 3.44Å; W240-Y245 VanDerWaalsContact CB-CE1 3.44Å; W240-Y245 HydrophobicContact CD2-CD1 4.47Å; W240-Y245 AromaticContact CD2-CE1 3.79Å; W240-Y245 HydrophobicContact CD2-CE1 3.79Å; W240-Y245 AromaticContact CE3-CE1 3.9Å; W240-Y245 HydrophobicContact CE3-CE1 3.9Å; W240-Y245 AromaticContact CG-CD1 3.97Å; W240-Y245 HydrophobicContact CG-CD1 3.97Å; W240-Y245 AromaticContact CG-CE1 3.62Å; W240-Y245 HydrophobicContact CG-CE1 3.62Å; W240-Y245 WeakPolarHBondContact O-CD2 3.41Å; W240-Y245 PolarHBondContact O-N 3.13Å; C243-Y245 PolarHBondContact O-N 2.88Å; C243-Y245 VanDerWaalsContact O-N 3.13Å; Y245-R247 PolarHBondContact O-N 2.99Å; Y245-N248 PolarHBondContact O-N 3.49Å; Y245-L249 HydrophobicContact CD1-CD1 3.54Å; Y245-L249 HydrophobicContact CD1-CG 3.94Å; Y245-L249 HydrophobicContact CE1-CD1 4.36Å; Y245-L249 HydrophobicContact CG-CD1 3.66Å; Y245-L249 HydrophobicContact CG-CG 4.29Å; Y245-L249 PolarHBondContact O-N 2.93Å; Y245-I257 HydrophobicContact CD2-CD1 4.03Å; Y245-I257 HydrophobicContact CD2-CG2 4.16Å; Y245-I257 HydrophobicContact CG-CD1 4.15Å; Y245-L269 HydrophobicContact CD2-CD2 3.89Å; Y245-L269 HydrophobicContact CE2-CB 4.13Å; Y245-L269 HydrophobicContact CE2-CD2 3.67Å; Y245-L269 HydrophobicContact CE2-CG 4.49Å; Y245-L269 PolarHBondContact OH-O 3.34Å; Y245-I272 HydrophobicContact CD1-CG2 4.4Å; Y245-I272 HydrophobicContact CD2-CG2 4.4Å; Y245-I272 HydrophobicContact CE1-CG2 3.81Å; Y245-I272 HydrophobicContact CE2-CB 4Å; Y245-I272 HydrophobicContact CE2-CG2 3.84Å; Y245-A273 WeakPolarHBondContact OH-CB 3.41Å; Y245-A273 PolarHBondContact OH-N 3.22Å; Y245-I276 HydrophobicContact CE1-CD1 3.88Å
246	T	97.2	Very high	97	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.4	-175.7	-59	0	0	0	0	113.4	Q28 P167 A171 C243 L244 W251 W258	Q28-T246 PolarHBondContact NE2-O 3.48Å; P167-T246 HydrophobicContact CB-CG2 4.05Å; A171-T246 HydrophobicContact CB-CG2 4.04Å; C243-T246 WeakPolarHBondContact O-CB 3.41Å; C243-T246 PolarHBondContact O-N 2.97Å; C243-T246 PolarHBondContact O-OG1 2.98Å; L244-T246 PolarHBondContact O-N 3.37Å; L244-T246 VanDerWaalsContact O-N 3.11Å; T246-W251 HydrophobicContact CG2-CH2 4.49Å; T246-W251 HydrophobicContact CG2-CZ3 3.88Å; T246-W258 WeakPolarHBondContact OG1-CZ2 3.02Å
247	R	94.3	Very high	97.1	Very high	83 Å²	83	12.6 Å²	12.6	31%	0.313	6%	0.059	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.8	178.9	-66	-154.3	-76.7	-141.5	-3	114.8	P167 D239 C243 Y245	P167-R247 HydrophobicContact CB-CG 4.26Å; P167-R247 HydrophobicContact CG-CG 4.34Å; D239-R247 IonicContact OD1-CZ 3.13Å; D239-R247 IonicContact OD1-NH2 2.81Å; D239-R247 PolarHBondContact OD1-NH2 3.26Å; D239-R247 IonicContact OD2-CZ 3.92Å; D239-R247 IonicContact OD2-NE 2.82Å; D239-R247 PolarHBondContact OD2-NE 2.87Å; D239-R247 IonicContact OD2-NH2 3.74Å; D239-R247 PolarHBondContact OD2-NH2 3.5Å; C243-R247 HydrophobicContact CB-CG 4.13Å; C243-R247 PolarHBondContact SG-NE 2.99Å; C243-R247 PolarHBondContact SG-NH2 2.71Å; C243-R247 VanDerWaalsContact SG-NH2 3.43Å; Y245-R247 PolarHBondContact O-N 2.99Å
248	N	94.6	Very high	97.2	Very high	23 Å²	23	12.7 Å²	12.7	12%	0.123	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-13.3	-158.9	-52.4	103.3	0	0	0	114.1	W240 Y245	W240-N248 VanDerWaalsContact CD1-CG 3.49Å; Y245-N248 PolarHBondContact O-N 3.49Å
249	L	96.2	Very high	97.2	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.047	C	C	.	.	S	Bend	trans	-129.7	155.7	-173.5	-56.3	-178.6	0	0	0	111.3	Y245 T253 V254 I257 I272 I276 L303 V308 L313	Y245-L249 HydrophobicContact CD1-CD1 3.54Å; Y245-L249 HydrophobicContact CD1-CG 3.94Å; Y245-L249 HydrophobicContact CE1-CD1 4.36Å; Y245-L249 HydrophobicContact CG-CD1 3.66Å; Y245-L249 HydrophobicContact CG-CG 4.29Å; Y245-L249 PolarHBondContact O-N 2.93Å; L249-T253 HydrophobicContact CB-CG2 4.36Å; L249-T253 HydrophobicContact CD1-CG2 3.95Å; L249-V254 HydrophobicContact CB-CG2 3.95Å; L249-I257 HydrophobicContact CD1-CD1 3.37Å; L249-I272 HydrophobicContact CD1-CG2 4.41Å; L249-I276 HydrophobicContact CD2-CD1 4.3Å; L249-L303 HydrophobicContact CD2-CD1 3.74Å; L249-V308 HydrophobicContact CD2-CB 3.7Å; L249-V308 HydrophobicContact CD2-CG1 3.48Å; L249-V308 VanDerWaalsContact CD2-CG1 3.48Å; L249-L313 HydrophobicContact CD1-CD2 4.01Å; L249-L313 HydrophobicContact CD2-CD2 4.23Å
250	P	95.5	Very high	97.3	Very high	10 Å²	10	8 Å²	8	7%	0.065	4%	0.035	C	C	.	.			trans	-52.6	144.6	170.1	-26.4	34.9	0	0	0	112.2	E27 S252 T253 V254 V308	E27-P250 VanDerWaalsContact O-CA 3.31Å; E27-P250 WeakPolarHBondContact O-CA 3.49Å; P250-S252 VanDerWaalsContact C-N 3.3Å; P250-S252 PolarHBondContact O-N 3.3Å; P250-T253 WeakPolarHBondContact O-CA 3.25Å; P250-T253 VanDerWaalsContact O-CB 3.3Å; P250-T253 WeakPolarHBondContact O-CB 3.49Å; P250-T253 PolarHBondContact O-N 2.96Å; P250-V254 PolarHBondContact O-N 2.87Å; P250-V308 HydrophobicContact CG-CG2 3.98Å
251	W	96.1	Very high	97.4	Very high	1 Å²	1	8 Å²	8	0%	0.004	4%	0.035	C	C	.	.	H	α-helix	trans	-58.3	-43	-171.9	-166.6	-112.3	0	0	0	112.9	Y21 F23 Q28 L128 A171 I174 H175 T246 T253 V254 L255	Y21-W251 VanDerWaalsContact CB-CD1 3.46Å; Y21-W251 AromaticContact CD1-CD1 3.52Å; Y21-W251 AromaticContact CD1-NE1 3.89Å; Y21-W251 HydrophobicContact CD2-CB 4.4Å; Y21-W251 AromaticContact CD2-CD1 3.77Å; Y21-W251 HydrophobicContact CD2-CG 4.47Å; Y21-W251 AromaticContact CG-CD1 3.31Å; Y21-W251 HydrophobicContact CG-CG 4.29Å; Y21-W251 AromaticContact CG-NE1 4Å; F23-W251 HydrophobicContact CD2-CB 4.28Å; F23-W251 HydrophobicContact CD2-CD2 4.46Å; F23-W251 HydrophobicContact CD2-CG 4.22Å; F23-W251 HydrophobicContact CE2-CB 4Å; F23-W251 AromaticContact CE2-CD2 3.4Å; F23-W251 HydrophobicContact CE2-CD2 3.4Å; F23-W251 VanDerWaalsContact CE2-CD2 3.4Å; F23-W251 AromaticContact CE2-CE2 3.78Å; F23-W251 AromaticContact CE2-CE3 3.66Å; F23-W251 HydrophobicContact CE2-CE3 3.66Å; F23-W251 AromaticContact CE2-CG 3.56Å; F23-W251 HydrophobicContact CE2-CG 3.56Å; F23-W251 HydrophobicContact CE2-CZ2 4.34Å; F23-W251 HydrophobicContact CE2-CZ3 4.2Å; F23-W251 AromaticContact CZ-CD2 3.82Å; F23-W251 HydrophobicContact CZ-CD2 3.82Å; F23-W251 AromaticContact CZ-CE3 3.57Å; F23-W251 HydrophobicContact CZ-CE3 3.57Å; F23-W251 HydrophobicContact CZ-CG 4.39Å; F23-W251 HydrophobicContact CZ-CH2 4.16Å; F23-W251 HydrophobicContact CZ-CZ2 4.41Å; F23-W251 AromaticContact CZ-CZ3 3.74Å; F23-W251 HydrophobicContact CZ-CZ3 3.74Å; Q28-W251 HydrophobicContact CB-CB 4.16Å; Q28-W251 HydrophobicContact CB-CE3 4.17Å; Q28-W251 HydrophobicContact CG-CE3 3.79Å; Q28-W251 HydrophobicContact CG-CZ3 4.28Å; Q28-W251 WeakPolarHBondContact O-CB 3.41Å; Q28-W251 PolarHBondContact O-N 3.37Å; L128-W251 HydrophobicContact CD1-CH2 4.09Å; L128-W251 HydrophobicContact CD1-CZ3 4.13Å; A171-W251 HydrophobicContact CB-CH2 3.47Å; A171-W251 VanDerWaalsContact CB-CH2 3.47Å; A171-W251 HydrophobicContact CB-CZ2 4.26Å; A171-W251 HydrophobicContact CB-CZ3 4.24Å; I174-W251 HydrophobicContact CB-CZ2 4.14Å; I174-W251 HydrophobicContact CD1-CH2 3.54Å; I174-W251 HydrophobicContact CD1-CZ2 3.52Å; I174-W251 HydrophobicContact CD1-CZ3 4.44Å; I174-W251 HydrophobicContact CG1-CZ2 4.4Å; I174-W251 HydrophobicContact CG2-CZ2 4.02Å; H175-W251 AromaticContact CE1-NE1 3.89Å; H175-W251 AromaticContact NE2-CE2 3.76Å; H175-W251 AromaticContact NE2-CZ2 3.58Å; H175-W251 AromaticContact NE2-NE1 3.43Å; H175-W251 PolarHBondContact NE2-NE1 3.42Å; T246-W251 HydrophobicContact CG2-CH2 4.49Å; T246-W251 HydrophobicContact CG2-CZ3 3.88Å; W251-T253 VanDerWaalsContact C-N 3.26Å; W251-T253 PolarHBondContact O-N 3.42Å; W251-V254 WeakPolarHBondContact O-CB 3.37Å; W251-V254 PolarHBondContact O-N 2.74Å; W251-V254 VanDerWaalsContact O-N 3.07Å; W251-L255 HydrophobicContact CZ2-CD2 4.43Å; W251-L255 WeakPolarHBondContact O-CG 3.46Å; W251-L255 PolarHBondContact O-N 3.28Å
252	S	95.1	Very high	97.4	Very high	6 Å²	6	8.1 Å²	8.1	4%	0.042	4%	0.035	C	C	.	.	H	α-helix	trans	-62.7	-36.6	-178.8	78.7	0	0	0	0	111.6	P250 L255 R256 E310	P250-S252 VanDerWaalsContact C-N 3.3Å; P250-S252 PolarHBondContact O-N 3.3Å; S252-L255 PolarHBondContact O-N 2.61Å; S252-R256 WeakPolarHBondContact O-CG 3.09Å; S252-R256 PolarHBondContact O-N 2.98Å; S252-E310 WeakPolarHBondContact CB-OE2 3.13Å; S252-E310 PolarHBondContact OG-OE2 2.81Å
253	T	97.7	Very high	97.4	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-63.6	-47.5	170.4	-55.4	0	0	0	0	111.9	L249 P250 W251 L255 R256 I257 V308 E310 L313 I314	L249-T253 HydrophobicContact CB-CG2 4.36Å; L249-T253 HydrophobicContact CD1-CG2 3.95Å; P250-T253 WeakPolarHBondContact O-CA 3.25Å; P250-T253 VanDerWaalsContact O-CB 3.3Å; P250-T253 WeakPolarHBondContact O-CB 3.49Å; P250-T253 PolarHBondContact O-N 2.96Å; W251-T253 VanDerWaalsContact C-N 3.26Å; W251-T253 PolarHBondContact O-N 3.42Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 2.79Å; T253-R256 PolarHBondContact O-N 3.21Å; T253-R256 VanDerWaalsContact O-N 3.15Å; T253-I257 HydrophobicContact CG2-CD1 4.03Å; T253-I257 WeakPolarHBondContact O-CG1 3.18Å; T253-I257 PolarHBondContact O-N 3.24Å; T253-V308 WeakPolarHBondContact CG2-O 3.22Å; T253-V308 PolarHBondContact OG1-O 3Å; T253-E310 VanDerWaalsContact OG1-CA 3.28Å; T253-E310 WeakPolarHBondContact OG1-CA 3.31Å; T253-E310 PolarHBondContact OG1-N 3.45Å; T253-L313 HydrophobicContact CG2-CB 4.47Å; T253-L313 HydrophobicContact CG2-CD2 3.94Å; T253-I314 HydrophobicContact CG2-CD1 4.27Å
254	V	98.2	Very high	97.3	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-55.3	-46.4	177.5	174.9	0	0	0	0	110.6	L249 P250 W251 R256 I257 W258	L249-V254 HydrophobicContact CB-CG2 3.95Å; P250-V254 PolarHBondContact O-N 2.87Å; W251-V254 WeakPolarHBondContact O-CB 3.37Å; W251-V254 PolarHBondContact O-N 2.74Å; W251-V254 VanDerWaalsContact O-N 3.07Å; V254-R256 VanDerWaalsContact C-N 3.33Å; V254-R256 PolarHBondContact O-N 2.82Å; V254-I257 WeakPolarHBondContact O-CB 3.47Å; V254-I257 PolarHBondContact O-N 2.75Å; V254-W258 HydrophobicContact CG1-CG 4.46Å; V254-W258 PolarHBondContact O-N 2.93Å
255	L	98.2	Very high	97.3	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-61.2	-40.1	179.1	-62.4	178.3	0	0	0	112.6	Y21 W87 H175 W251 S252 T253 W258 D259	Y21-L255 HydrophobicContact CD1-CD1 3.9Å; Y21-L255 HydrophobicContact CE1-CD1 3.34Å; W87-L255 HydrophobicContact CH2-CD2 3.83Å; W87-L255 HydrophobicContact CZ2-CD2 4.28Å; H175-L255 WeakPolarHBondContact NE2-CD2 3.24Å; W251-L255 HydrophobicContact CZ2-CD2 4.43Å; W251-L255 WeakPolarHBondContact O-CG 3.46Å; W251-L255 PolarHBondContact O-N 3.28Å; S252-L255 PolarHBondContact O-N 2.61Å; T253-L255 VanDerWaalsContact C-N 3.3Å; T253-L255 PolarHBondContact O-N 2.79Å; L255-W258 PolarHBondContact O-N 3.22Å; L255-D259 PolarHBondContact O-N 2.93Å
256	R	98.2	Very high	97.2	Very high	28 Å²	28	12.1 Å²	12.1	11%	0.106	6%	0.059	C	C	.	.	H	α-helix	trans	-68.4	-37.3	176.8	-65.9	-59.7	-63.3	-80.7	-5.2	112.6	R75 K76 S252 T253 V254 W258 M260 E310 I314	R75-R256 PolarHBondContact O-NH2 2.87Å; K76-R256 VanDerWaalsContact C-NH2 3.35Å; S252-R256 WeakPolarHBondContact O-CG 3.09Å; S252-R256 PolarHBondContact O-N 2.98Å; T253-R256 PolarHBondContact O-N 3.21Å; T253-R256 VanDerWaalsContact O-N 3.15Å; V254-R256 VanDerWaalsContact C-N 3.33Å; V254-R256 PolarHBondContact O-N 2.82Å; R256-W258 VanDerWaalsContact C-N 3.32Å; R256-M260 WeakPolarHBondContact O-CE 3.37Å; R256-M260 PolarHBondContact O-N 3.09Å; R256-E310 HydrophobicContact CB-CG 4.49Å; R256-E310 WeakPolarHBondContact CD-OE1 3.47Å; R256-E310 HydrophobicContact CG-CG 3.61Å; R256-E310 WeakPolarHBondContact CG-OE1 3.38Å; R256-E310 IonicContact CZ-OE1 2.72Å; R256-E310 IonicContact NE-OE1 3.17Å; R256-E310 IonicContact NH1-OE1 3.74Å; R256-E310 PolarHBondContact NH1-OE1 3.2Å; R256-I314 HydrophobicContact CB-CD1 3.6Å; R256-I314 HydrophobicContact CB-CG1 3.7Å; R256-I314 HydrophobicContact CG-CG1 4.32Å
257	I	98.8	Very high	97.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61	-46.6	172.2	-67.3	170.3	0	0	0	109.4	Y245 L249 T253 V254 M260 F261 V268 L269 I272 I314	Y245-I257 HydrophobicContact CD2-CD1 4.03Å; Y245-I257 HydrophobicContact CD2-CG2 4.16Å; Y245-I257 HydrophobicContact CG-CD1 4.15Å; L249-I257 HydrophobicContact CD1-CD1 3.37Å; T253-I257 HydrophobicContact CG2-CD1 4.03Å; T253-I257 WeakPolarHBondContact O-CG1 3.18Å; T253-I257 PolarHBondContact O-N 3.24Å; V254-I257 WeakPolarHBondContact O-CB 3.47Å; V254-I257 PolarHBondContact O-N 2.75Å; I257-M260 PolarHBondContact O-N 3Å; I257-F261 VanDerWaalsContact O-CB 3.23Å; I257-F261 WeakPolarHBondContact O-CB 3.26Å; I257-F261 PolarHBondContact O-N 3.29Å; I257-V268 HydrophobicContact CG2-CG1 4.06Å; I257-L269 HydrophobicContact CG2-CD2 4.33Å; I257-I272 HydrophobicContact CD1-CD1 4.06Å; I257-I272 HydrophobicContact CD1-CG1 4.02Å; I257-I272 HydrophobicContact CD1-CG2 3.88Å; I257-I272 HydrophobicContact CG1-CD1 3.74Å; I257-I272 HydrophobicContact CG1-CG1 3.9Å; I257-I272 HydrophobicContact CG2-CG1 4.47Å; I257-I314 HydrophobicContact CG1-CD1 3.84Å
258	W	98.8	Very high	97.4	Very high	2 Å²	2	10 Å²	10	1%	0.008	5%	0.052	C	C	.	.	H	α-helix	trans	-64.4	-43.8	-179.4	-77.8	36.6	0	0	0	112.2	W87 I168 A171 L172 L244 T246 V254 L255 R256 M260 F261 F262	W87-W258 HydrophobicContact CE3-CE3 4.45Å; W87-W258 HydrophobicContact CH2-CB 4.2Å; W87-W258 HydrophobicContact CH2-CD2 4.28Å; W87-W258 AromaticContact CH2-CE3 3.45Å; W87-W258 HydrophobicContact CH2-CE3 3.45Å; W87-W258 VanDerWaalsContact CH2-CE3 3.45Å; W87-W258 HydrophobicContact CH2-CZ3 4.19Å; W87-W258 HydrophobicContact CZ2-CB 3.58Å; W87-W258 AromaticContact CZ2-CE3 3.95Å; W87-W258 HydrophobicContact CZ2-CE3 3.95Å; W87-W258 HydrophobicContact CZ2-CG 4.43Å; W87-W258 AromaticContact CZ3-CE3 3.74Å; W87-W258 HydrophobicContact CZ3-CE3 3.74Å; W87-W258 HydrophobicContact CZ3-CZ3 4.11Å; I168-W258 HydrophobicContact CB-CH2 4.43Å; I168-W258 HydrophobicContact CG2-CH2 3.82Å; I168-W258 HydrophobicContact CG2-CZ2 4.24Å; A171-W258 HydrophobicContact CB-CH2 3.47Å; A171-W258 VanDerWaalsContact CB-CH2 3.47Å; A171-W258 HydrophobicContact CB-CZ2 3.99Å; A171-W258 HydrophobicContact CB-CZ3 4.03Å; L172-W258 HydrophobicContact CD2-CZ3 3.75Å; L172-W258 HydrophobicContact CG-CH2 4.35Å; L172-W258 HydrophobicContact CG-CZ3 3.93Å; L244-W258 HydrophobicContact CB-CZ2 4.09Å; L244-W258 HydrophobicContact CD1-CZ2 4.08Å; L244-W258 PolarHBondContact O-NE1 3.39Å; T246-W258 WeakPolarHBondContact OG1-CZ2 3.02Å; V254-W258 HydrophobicContact CG1-CG 4.46Å; V254-W258 PolarHBondContact O-N 2.93Å; L255-W258 PolarHBondContact O-N 3.22Å; R256-W258 VanDerWaalsContact C-N 3.32Å; W258-M260 PolarHBondContact O-N 3.15Å; W258-F261 PolarHBondContact O-N 2.98Å; W258-F262 HydrophobicContact CB-CD2 4.34Å; W258-F262 HydrophobicContact CB-CE2 4.33Å; W258-F262 AromaticContact CE3-CE2 3.91Å; W258-F262 HydrophobicContact CE3-CE2 3.91Å; W258-F262 HydrophobicContact CE3-CZ 4.49Å; W258-F262 WeakPolarHBondContact O-CD2 3.46Å; W258-F262 PolarHBondContact O-N 3.38Å
259	D	98.7	Very high	97.6	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-51.9	-45.2	174.3	-70.5	-15.1	0	0	0	111.5	C74 I78 R83 W87 L255	C74-D259 WeakPolarHBondContact CB-O 3.38Å; I78-D259 HydrophobicContact CD1-CB 3.86Å; I78-D259 WeakPolarHBondContact CD1-OD1 3.45Å; I78-D259 HydrophobicContact CG1-CB 4.08Å; I78-D259 PolarHBondContact N-OD2 2.96Å; R83-D259 IonicContact NE-OD1 2.76Å; R83-D259 PolarHBondContact NE-OD1 3.25Å; R83-D259 IonicContact NE-OD2 3.95Å; W87-D259 PolarHBondContact NE1-OD1 3.19Å; L255-D259 PolarHBondContact O-N 2.93Å
260	M	98.7	Very high	97.7	Very high	5 Å²	5	9 Å²	9	3%	0.025	5%	0.046	C	C	.	.	H	α-helix	trans	-72.8	-41.3	175.4	-65.9	-175	-69	0	0	112.3	R75 R256 I257 W258 F263 E264 V268 I314 F318	R75-M260 HydrophobicContact CG-CG 4.14Å; R75-M260 HydrophobicContact CG-SD 4.07Å; R256-M260 WeakPolarHBondContact O-CE 3.37Å; R256-M260 PolarHBondContact O-N 3.09Å; I257-M260 PolarHBondContact O-N 3Å; W258-M260 PolarHBondContact O-N 3.15Å; M260-F263 PolarHBondContact O-N 3.29Å; M260-E264 VanDerWaalsContact O-CB 3.32Å; M260-E264 WeakPolarHBondContact O-CB 3.42Å; M260-E264 PolarHBondContact O-N 3.41Å; M260-V268 HydrophobicContact CB-CG1 4.01Å; M260-V268 HydrophobicContact CB-CG2 3.87Å; M260-V268 HydrophobicContact CE-CG1 4.21Å; M260-I314 HydrophobicContact CE-CD1 3.92Å; M260-I314 HydrophobicContact CE-CG2 4.11Å; M260-F318 HydrophobicContact SD-CE1 3.7Å; M260-F318 HydrophobicContact SD-CZ 4.22Å
261	F	98.6	Very high	97.9	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64.5	-41.2	-176	177.2	-99.3	0	0	0	112.3	L188 Y192 M193 L244 I257 W258 F263 G265 V268 L269	L188-F261 HydrophobicContact CD2-CD1 4.27Å; L188-F261 HydrophobicContact CD2-CE1 3.79Å; Y192-F261 HydrophobicContact CD1-CE1 4.21Å; Y192-F261 HydrophobicContact CD1-CZ 4.4Å; Y192-F261 HydrophobicContact CG-CE1 4.15Å; Y192-F261 HydrophobicContact CG-CZ 4.35Å; M193-F261 HydrophobicContact CG-CZ 4.27Å; L244-F261 HydrophobicContact CD1-CD1 4.31Å; L244-F261 HydrophobicContact CD1-CE1 3.82Å; L244-F261 HydrophobicContact CD1-CZ 4.3Å; L244-F261 HydrophobicContact CD2-CE1 3.9Å; L244-F261 HydrophobicContact CD2-CE2 3.89Å; L244-F261 HydrophobicContact CD2-CZ 3.54Å; I257-F261 VanDerWaalsContact O-CB 3.23Å; I257-F261 WeakPolarHBondContact O-CB 3.26Å; I257-F261 PolarHBondContact O-N 3.29Å; W258-F261 PolarHBondContact O-N 2.98Å; F261-F263 PolarHBondContact O-N 3.39Å; F261-G265 WeakPolarHBondContact O-CA 3.17Å; F261-G265 PolarHBondContact O-N 3.14Å; F261-V268 HydrophobicContact CB-CB 4.46Å; F261-L269 HydrophobicContact CD2-CD1 4.48Å; F261-L269 HydrophobicContact CD2-CD2 4.01Å; F261-L269 HydrophobicContact CD2-CG 4.05Å; F261-L269 HydrophobicContact CE2-CD1 3.9Å; F261-L269 HydrophobicContact CE2-CD2 4.22Å; F261-L269 HydrophobicContact CE2-CG 3.97Å
262	F	98.2	Very high	98	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.009	5%	0.045	C	C	.	.	H	α-helix	trans	-59.1	-31.5	176.2	-85.9	-68.7	0	0	0	113	W87 L90 C91 L172 T184 L188 Y192 W258	W87-F262 HydrophobicContact CB-CD2 4.11Å; W87-F262 HydrophobicContact CB-CE1 4.37Å; W87-F262 HydrophobicContact CB-CE2 3.96Å; W87-F262 HydrophobicContact CB-CG 4.41Å; W87-F262 HydrophobicContact CB-CZ 4.08Å; W87-F262 AromaticContact CD1-CD2 3.44Å; W87-F262 VanDerWaalsContact CD1-CD2 3.44Å; W87-F262 AromaticContact CD1-CE2 3.86Å; W87-F262 AromaticContact CD2-CD2 3.76Å; W87-F262 HydrophobicContact CD2-CD2 3.76Å; W87-F262 AromaticContact CD2-CE2 3.34Å; W87-F262 HydrophobicContact CD2-CE2 3.34Å; W87-F262 HydrophobicContact CD2-CZ 4.1Å; W87-F262 AromaticContact CE2-CD2 3.74Å; W87-F262 AromaticContact CE2-CE2 3.6Å; W87-F262 AromaticContact CE3-CE2 3.77Å; W87-F262 HydrophobicContact CE3-CE2 3.77Å; W87-F262 HydrophobicContact CE3-CZ 4.25Å; W87-F262 AromaticContact CG-CD2 3.52Å; W87-F262 HydrophobicContact CG-CD2 3.52Å; W87-F262 AromaticContact CG-CE2 3.47Å; W87-F262 HydrophobicContact CG-CE2 3.47Å; W87-F262 VanDerWaalsContact CG-CE2 3.47Å; W87-F262 HydrophobicContact CG-CG 4.21Å; W87-F262 HydrophobicContact CG-CZ 4.1Å; W87-F262 HydrophobicContact CZ2-CE2 4.17Å; W87-F262 HydrophobicContact CZ3-CE2 4.38Å; W87-F262 AromaticContact NE1-CD2 3.6Å; W87-F262 AromaticContact NE1-CE2 3.95Å; L90-F262 HydrophobicContact CB-CB 3.9Å; L90-F262 HydrophobicContact CD1-CB 3.7Å; L90-F262 HydrophobicContact CG-CB 4.44Å; C91-F262 HydrophobicContact CB-CD1 3.84Å; C91-F262 HydrophobicContact CB-CE1 3.97Å; L172-F262 HydrophobicContact CD2-CZ 4.28Å; T184-F262 HydrophobicContact CG2-CE1 3.9Å; T184-F262 HydrophobicContact CG2-CZ 3.86Å; L188-F262 HydrophobicContact CD1-CE1 4.19Å; L188-F262 HydrophobicContact CD1-CZ 3.88Å; L188-F262 HydrophobicContact CD2-CD1 3.94Å; L188-F262 HydrophobicContact CD2-CE1 3.35Å; L188-F262 HydrophobicContact CD2-CZ 3.76Å; L188-F262 HydrophobicContact CG-CE1 3.75Å; L188-F262 HydrophobicContact CG-CZ 3.98Å; Y192-F262 WeakPolarHBondContact CE1-O 2.91Å; Y192-F262 PolarHBondContact OH-O 2.48Å; W258-F262 HydrophobicContact CB-CD2 4.34Å; W258-F262 HydrophobicContact CB-CE2 4.33Å; W258-F262 AromaticContact CE3-CE2 3.91Å; W258-F262 HydrophobicContact CE3-CE2 3.91Å; W258-F262 HydrophobicContact CE3-CZ 4.49Å; W258-F262 WeakPolarHBondContact O-CD2 3.46Å; W258-F262 PolarHBondContact O-N 3.38Å
263	F	97.7	Very high	98.2	Very high	40 Å²	40	8.8 Å²	8.8	18%	0.175	4%	0.043	C	C	.	.	H	α-helix	trans	-93.5	-46.7	178	-172.6	-84.3	0	0	0	113.3	M63 T67 V70 R71 C74 L90 M260 F261	M63-F263 HydrophobicContact CE-CE2 3.96Å; M63-F263 HydrophobicContact SD-CE2 4.01Å; T67-F263 HydrophobicContact CG2-CE2 4.34Å; T67-F263 HydrophobicContact CG2-CZ 3.65Å; T67-F263 WeakPolarHBondContact O-CZ 3.35Å; V70-F263 HydrophobicContact CB-CD2 4.36Å; V70-F263 HydrophobicContact CB-CE2 3.66Å; V70-F263 HydrophobicContact CB-CZ 4.22Å; V70-F263 HydrophobicContact CG1-CD2 3.72Å; V70-F263 HydrophobicContact CG1-CE2 3.46Å; V70-F263 VanDerWaalsContact CG1-CE2 3.46Å; V70-F263 HydrophobicContact CG1-CZ 4.44Å; R71-F263 HydrophobicContact CB-CD1 3.81Å; R71-F263 HydrophobicContact CB-CE1 3.29Å; R71-F263 HydrophobicContact CB-CZ 3.82Å; R71-F263 HydrophobicContact CG-CD1 3.72Å; R71-F263 HydrophobicContact CG-CE1 3.56Å; C74-F263 HydrophobicContact CB-CB 4.22Å; L90-F263 HydrophobicContact CD2-CB 4Å; L90-F263 HydrophobicContact CD2-CD2 3.54Å; L90-F263 HydrophobicContact CD2-CG 4.26Å; M260-F263 PolarHBondContact O-N 3.29Å; F261-F263 PolarHBondContact O-N 3.39Å
264	E	97.3	Very high	98.3	Very high	13 Å²	13	8.8 Å²	8.8	6%	0.061	4%	0.043	C	C	.	.	H	α-helix	trans	-95	-18	-170.8	-66.9	-167.1	-120	0	0	113.8	R71 R75 M260 K267 V268 R271	R71-E264 HydrophobicContact CG-CG 3.97Å; R75-E264 IonicContact CZ-OE1 2.68Å; R75-E264 IonicContact CZ-OE2 2.86Å; R75-E264 IonicContact NE-OE1 2.72Å; R75-E264 PolarHBondContact NE-OE1 3.42Å; R75-E264 IonicContact NE-OE2 3.04Å; R75-E264 IonicContact NH2-OE1 2.92Å; R75-E264 PolarHBondContact NH2-OE1 3.33Å; R75-E264 IonicContact NH2-OE2 2.71Å; R75-E264 PolarHBondContact NH2-OE2 3.2Å; M260-E264 VanDerWaalsContact O-CB 3.32Å; M260-E264 WeakPolarHBondContact O-CB 3.42Å; M260-E264 PolarHBondContact O-N 3.41Å; E264-K267 PolarHBondContact O-NZ 3.36Å; E264-K267 WeakPolarHBondContact OE2-CE 3.32Å; E264-V268 HydrophobicContact CB-CG2 3.68Å; E264-R271 IonicContact OE1-NH1 2.75Å; E264-R271 IonicContact OE2-CZ 2.73Å; E264-R271 IonicContact OE2-NH1 3.91Å; E264-R271 PolarHBondContact OE2-NH1 3.12Å; E264-R271 IonicContact OE2-NH2 3.69Å
265	G	96.8	Very high	98.3	Very high	11 Å²	11	8.8 Å²	8.8	11%	0.113	4%	0.043	C	C	.	.			trans	73.2	-160.2	-179.7	0	0	0	0	0	114.6	F261 K267 V268	F261-G265 WeakPolarHBondContact O-CA 3.17Å; F261-G265 PolarHBondContact O-N 3.14Å; G265-K267 PolarHBondContact O-N 3.49Å; G265-V268 WeakPolarHBondContact O-CG2 3.38Å; G265-V268 PolarHBondContact O-N 3Å
266	V	96.4	Very high	98.3	Very high	28 Å²	28	8.7 Å²	8.7	17%	0.17	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-28.7	-167.2	76.9	0	0	0	0	115.5	Y196 V268 L269 F270 L328	Y196-V266 WeakPolarHBondContact OH-CG2 3.19Å; V266-V268 PolarHBondContact O-N 3.34Å; V266-L269 HydrophobicContact CG2-CD1 4.08Å; V266-L269 WeakPolarHBondContact O-CB 3.17Å; V266-L269 PolarHBondContact O-N 3.3Å; V266-F270 HydrophobicContact CG1-CE2 4.48Å; V266-F270 HydrophobicContact CG2-CE2 4.07Å; V266-F270 WeakPolarHBondContact O-CD2 3.26Å; V266-L328 HydrophobicContact CG1-CD1 4.48Å
267	K	97.5	Very high	98.3	Very high	35 Å²	35	7.3 Å²	7.3	15%	0.152	4%	0.038	C	C	.	.	H	α-helix	trans	-56.7	-25.7	177.8	66.6	-178.9	-176.6	-86.8	0	113.8	E264 G265 L269 F270 R271 L328	E264-K267 PolarHBondContact O-NZ 3.36Å; E264-K267 WeakPolarHBondContact OE2-CE 3.32Å; G265-K267 PolarHBondContact O-N 3.49Å; K267-L269 VanDerWaalsContact C-N 3.29Å; K267-L269 PolarHBondContact O-N 3.07Å; K267-F270 PolarHBondContact O-N 2.93Å; K267-R271 VanDerWaalsContact O-CG 3.3Å; K267-R271 WeakPolarHBondContact O-CG 3.42Å; K267-R271 PolarHBondContact O-N 3.12Å; K267-L328 HydrophobicContact CB-CD1 3.55Å
268	V	98.6	Very high	98.3	Very high	3 Å²	3	10.4 Å²	10.4	2%	0.018	5%	0.052	C	C	.	.	H	α-helix	trans	-60.6	-41.7	174.3	177.2	0	0	0	0	110.6	I257 M260 F261 E264 G265 V266 F270 R271 I272	I257-V268 HydrophobicContact CG2-CG1 4.06Å; M260-V268 HydrophobicContact CB-CG1 4.01Å; M260-V268 HydrophobicContact CB-CG2 3.87Å; M260-V268 HydrophobicContact CE-CG1 4.21Å; F261-V268 HydrophobicContact CB-CB 4.46Å; E264-V268 HydrophobicContact CB-CG2 3.68Å; G265-V268 WeakPolarHBondContact O-CG2 3.38Å; G265-V268 PolarHBondContact O-N 3Å; V266-V268 PolarHBondContact O-N 3.34Å; V268-F270 VanDerWaalsContact C-N 3.33Å; V268-F270 PolarHBondContact O-N 3.29Å; V268-R271 PolarHBondContact O-N 3.03Å; V268-I272 HydrophobicContact CG1-CG1 4.25Å; V268-I272 VanDerWaalsContact O-CG1 3.31Å; V268-I272 WeakPolarHBondContact O-CG1 3.45Å; V268-I272 PolarHBondContact O-N 2.87Å
269	L	98.6	Very high	98.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.1	-41.7	-177	-52.8	-179.2	0	0	0	111.9	F241 L244 Y245 I257 F261 V266 K267 I272 A273	F241-L269 HydrophobicContact CD1-CB 4.29Å; F241-L269 HydrophobicContact CD1-CD1 4.12Å; F241-L269 HydrophobicContact CE1-CB 4.07Å; F241-L269 HydrophobicContact CE2-CB 4.42Å; F241-L269 HydrophobicContact CG-CD1 4.34Å; F241-L269 HydrophobicContact CZ-CB 4.13Å; L244-L269 HydrophobicContact CD2-CD1 3.83Å; L244-L269 HydrophobicContact CD2-CD2 4.05Å; Y245-L269 HydrophobicContact CD2-CD2 3.89Å; Y245-L269 HydrophobicContact CE2-CB 4.13Å; Y245-L269 HydrophobicContact CE2-CD2 3.67Å; Y245-L269 HydrophobicContact CE2-CG 4.49Å; Y245-L269 PolarHBondContact OH-O 3.34Å; I257-L269 HydrophobicContact CG2-CD2 4.33Å; F261-L269 HydrophobicContact CD2-CD1 4.48Å; F261-L269 HydrophobicContact CD2-CD2 4.01Å; F261-L269 HydrophobicContact CD2-CG 4.05Å; F261-L269 HydrophobicContact CE2-CD1 3.9Å; F261-L269 HydrophobicContact CE2-CD2 4.22Å; F261-L269 HydrophobicContact CE2-CG 3.97Å; V266-L269 HydrophobicContact CG2-CD1 4.08Å; V266-L269 WeakPolarHBondContact O-CB 3.17Å; V266-L269 PolarHBondContact O-N 3.3Å; K267-L269 VanDerWaalsContact C-N 3.29Å; K267-L269 PolarHBondContact O-N 3.07Å; L269-I272 PolarHBondContact O-N 3.37Å; L269-A273 PolarHBondContact O-N 2.93Å
270	F	98.7	Very high	98.3	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.009	6%	0.064	C	C	.	.	H	α-helix	trans	-63.1	-43.6	175.1	-67.8	-90.3	0	0	0	112.8	E207 I210 L211 L214 F241 V266 K267 V268 I272 A273 L274 L328	E207-F270 HydrophobicContact CB-CE1 4.47Å; E207-F270 HydrophobicContact CB-CZ 3.8Å; E207-F270 HydrophobicContact CG-CZ 3.96Å; E207-F270 VanDerWaalsContact O-CE1 3.28Å; E207-F270 WeakPolarHBondContact O-CE1 3.29Å; I210-F270 HydrophobicContact CB-CE1 4.01Å; I210-F270 HydrophobicContact CB-CZ 4.46Å; I210-F270 HydrophobicContact CG2-CD1 4.42Å; I210-F270 HydrophobicContact CG2-CE1 3.68Å; I210-F270 HydrophobicContact CG2-CZ 4.18Å; L211-F270 HydrophobicContact CB-CD1 4.04Å; L211-F270 HydrophobicContact CB-CE1 4.08Å; L211-F270 HydrophobicContact CD1-CD1 4.23Å; L214-F270 HydrophobicContact CD1-CB 4.29Å; L214-F270 HydrophobicContact CD1-CD1 3.67Å; L214-F270 HydrophobicContact CD1-CE1 4.35Å; L214-F270 HydrophobicContact CD1-CG 4.26Å; F241-F270 HydrophobicContact CE1-CD1 4.31Å; F241-F270 HydrophobicContact CE1-CD2 4.12Å; F241-F270 HydrophobicContact CE1-CE1 4.03Å; F241-F270 AromaticContact CE1-CE2 3.81Å; F241-F270 HydrophobicContact CE1-CE2 3.81Å; F241-F270 HydrophobicContact CE1-CG 4.37Å; F241-F270 AromaticContact CE1-CZ 3.78Å; F241-F270 HydrophobicContact CE1-CZ 3.78Å; F241-F270 HydrophobicContact CZ-CD1 4.11Å; F241-F270 HydrophobicContact CZ-CD2 4.42Å; F241-F270 HydrophobicContact CZ-CE1 4.19Å; F241-F270 HydrophobicContact CZ-CE2 4.48Å; F241-F270 HydrophobicContact CZ-CG 4.25Å; F241-F270 HydrophobicContact CZ-CZ 4.38Å; V266-F270 HydrophobicContact CG1-CE2 4.48Å; V266-F270 HydrophobicContact CG2-CE2 4.07Å; V266-F270 WeakPolarHBondContact O-CD2 3.26Å; K267-F270 PolarHBondContact O-N 2.93Å; V268-F270 VanDerWaalsContact C-N 3.33Å; V268-F270 PolarHBondContact O-N 3.29Å; F270-I272 VanDerWaalsContact C-N 3.3Å; F270-I272 PolarHBondContact O-N 3.02Å; F270-A273 PolarHBondContact O-N 3.4Å; F270-L274 WeakPolarHBondContact O-CG 3.39Å; F270-L274 PolarHBondContact O-N 3.44Å; F270-L328 HydrophobicContact CD1-CD2 4.14Å; F270-L328 HydrophobicContact CD2-CD1 3.69Å; F270-L328 HydrophobicContact CD2-CD2 4.09Å; F270-L328 HydrophobicContact CE1-CD2 4.17Å; F270-L328 HydrophobicContact CE2-CD1 3.87Å; F270-L328 HydrophobicContact CE2-CD2 4.13Å; F270-L328 HydrophobicContact CG-CD1 4.34Å; F270-L328 HydrophobicContact CG-CD2 4.08Å; F270-L328 HydrophobicContact CZ-CD2 4.16Å
271	R	98.7	Very high	98.3	Very high	13 Å²	13	12.4 Å²	12.4	5%	0.049	6%	0.063	C	C	.	.	H	α-helix	trans	-64.1	-37.3	179.4	-66.1	171.3	-177.3	170.8	-3.5	112.1	E264 K267 V268 S275 Y320 T321 I323	E264-R271 IonicContact OE1-NH1 2.75Å; E264-R271 IonicContact OE2-CZ 2.73Å; E264-R271 IonicContact OE2-NH1 3.91Å; E264-R271 PolarHBondContact OE2-NH1 3.12Å; E264-R271 IonicContact OE2-NH2 3.69Å; K267-R271 VanDerWaalsContact O-CG 3.3Å; K267-R271 WeakPolarHBondContact O-CG 3.42Å; K267-R271 PolarHBondContact O-N 3.12Å; V268-R271 PolarHBondContact O-N 3.03Å; R271-S275 WeakPolarHBondContact O-CB 3.39Å; R271-S275 PolarHBondContact O-N 3.06Å; R271-S275 VanDerWaalsContact O-N 3.11Å; R271-S275 PolarHBondContact O-OG 3.02Å; R271-Y320 WeakPolarHBondContact CD-O 3.5Å; R271-Y320 WeakPolarHBondContact CG-O 3.47Å; R271-Y320 PolarHBondContact NE-O 3.41Å; R271-Y320 VanDerWaalsContact NE-O 3.15Å; R271-T321 PolarHBondContact NH2-O 2.87Å; R271-I323 HydrophobicContact CG-CB 4.42Å; R271-I323 PolarHBondContact NE-O 3.38Å; R271-I323 PolarHBondContact NH2-O 3.02Å
272	I	98.8	Very high	98.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-66.7	-49	174.7	-63.8	-65.7	0	0	0	110.1	Y245 L249 I257 V268 L269 F270 L274 S275 I276 L313 I314	Y245-I272 HydrophobicContact CD1-CG2 4.4Å; Y245-I272 HydrophobicContact CD2-CG2 4.4Å; Y245-I272 HydrophobicContact CE1-CG2 3.81Å; Y245-I272 HydrophobicContact CE2-CB 4Å; Y245-I272 HydrophobicContact CE2-CG2 3.84Å; L249-I272 HydrophobicContact CD1-CG2 4.41Å; I257-I272 HydrophobicContact CD1-CD1 4.06Å; I257-I272 HydrophobicContact CD1-CG1 4.02Å; I257-I272 HydrophobicContact CD1-CG2 3.88Å; I257-I272 HydrophobicContact CG1-CD1 3.74Å; I257-I272 HydrophobicContact CG1-CG1 3.9Å; I257-I272 HydrophobicContact CG2-CG1 4.47Å; V268-I272 HydrophobicContact CG1-CG1 4.25Å; V268-I272 VanDerWaalsContact O-CG1 3.31Å; V268-I272 WeakPolarHBondContact O-CG1 3.45Å; V268-I272 PolarHBondContact O-N 2.87Å; L269-I272 PolarHBondContact O-N 3.37Å; F270-I272 VanDerWaalsContact C-N 3.3Å; F270-I272 PolarHBondContact O-N 3.02Å; I272-L274 PolarHBondContact O-N 3.44Å; I272-S275 WeakPolarHBondContact O-CA 3.47Å; I272-S275 WeakPolarHBondContact O-CB 2.88Å; I272-S275 PolarHBondContact O-N 3.4Å; I272-I276 HydrophobicContact CG2-CD1 3.95Å; I272-I276 HydrophobicContact CG2-CG1 4.47Å; I272-I276 WeakPolarHBondContact O-CG1 3.4Å; I272-I276 PolarHBondContact O-N 2.76Å; I272-L313 HydrophobicContact CD1-CG 4.45Å; I272-L313 HydrophobicContact CG2-CD1 4.5Å; I272-L313 HydrophobicContact CG2-CD2 4.04Å; I272-L313 HydrophobicContact CG2-CG 4.42Å; I272-I314 HydrophobicContact CD1-CD1 4.17Å
273	A	98.8	Very high	98.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-57.7	-47.1	178.7	0	0	0	0	0	112.2	L211 W240 F241 Y245 L269 F270 S275 I276 F277	L211-A273 HydrophobicContact CD1-CB 3.63Å; L211-A273 HydrophobicContact CD2-CB 3.73Å; L211-A273 HydrophobicContact CG-CB 4.34Å; W240-A273 HydrophobicContact CE3-CB 4.08Å; W240-A273 HydrophobicContact CZ3-CB 4.08Å; F241-A273 HydrophobicContact CE2-CB 4.43Å; Y245-A273 WeakPolarHBondContact OH-CB 3.41Å; Y245-A273 PolarHBondContact OH-N 3.22Å; L269-A273 PolarHBondContact O-N 2.93Å; F270-A273 PolarHBondContact O-N 3.4Å; A273-S275 VanDerWaalsContact C-N 3.26Å; A273-S275 PolarHBondContact O-N 3.44Å; A273-I276 WeakPolarHBondContact O-CB 3.2Å; A273-I276 PolarHBondContact O-N 2.87Å; A273-F277 HydrophobicContact CB-CE2 4.37Å; A273-F277 WeakPolarHBondContact O-CD2 3.48Å; A273-F277 WeakPolarHBondContact O-CG 3.38Å; A273-F277 PolarHBondContact O-N 2.86Å
274	L	98.9	Very high	98.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60.6	-36.5	175.2	-69.6	168.1	0	0	0	112.3	L211 L214 V215 Q219 F270 I272 F277 Q278 Y320 I323	L211-L274 HydrophobicContact CD1-CD2 4.36Å; L211-L274 HydrophobicContact CD1-CG 4.24Å; L214-L274 HydrophobicContact CB-CD1 4.24Å; L214-L274 HydrophobicContact CB-CD2 4.23Å; V215-L274 HydrophobicContact CB-CD2 4.49Å; V215-L274 HydrophobicContact CG2-CD2 3.72Å; Q219-L274 PolarHBondContact NE2-O 3.34Å; F270-L274 WeakPolarHBondContact O-CG 3.39Å; F270-L274 PolarHBondContact O-N 3.44Å; I272-L274 PolarHBondContact O-N 3.44Å; L274-F277 PolarHBondContact O-N 2.84Å; L274-Q278 WeakPolarHBondContact O-CB 3.42Å; L274-Q278 PolarHBondContact O-N 3.33Å; L274-Y320 HydrophobicContact CB-CD1 4.11Å; L274-Y320 HydrophobicContact CB-CD2 4.06Å; L274-Y320 HydrophobicContact CB-CE1 4.02Å; L274-Y320 HydrophobicContact CB-CE2 3.95Å; L274-Y320 HydrophobicContact CB-CG 4.15Å; L274-Y320 HydrophobicContact CD1-CD1 3.93Å; L274-Y320 HydrophobicContact CD1-CE1 4.37Å; L274-Y320 HydrophobicContact CD1-CG 4.26Å; L274-I323 HydrophobicContact CD1-CD1 3.09Å
275	S	98.8	Very high	98.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-68.2	-40.4	176	-61.6	0	0	0	0	112.5	R271 I272 A273 F277 Q278 L279 H316 S317 Y320	R271-S275 WeakPolarHBondContact O-CB 3.39Å; R271-S275 PolarHBondContact O-N 3.06Å; R271-S275 VanDerWaalsContact O-N 3.11Å; R271-S275 PolarHBondContact O-OG 3.02Å; I272-S275 WeakPolarHBondContact O-CA 3.47Å; I272-S275 WeakPolarHBondContact O-CB 2.88Å; I272-S275 PolarHBondContact O-N 3.4Å; A273-S275 VanDerWaalsContact C-N 3.26Å; A273-S275 PolarHBondContact O-N 3.44Å; S275-F277 VanDerWaalsContact C-N 3.33Å; S275-F277 PolarHBondContact O-N 3.25Å; S275-Q278 PolarHBondContact O-N 3.37Å; S275-L279 WeakPolarHBondContact O-CB 3.5Å; S275-L279 VanDerWaalsContact O-CG 3.26Å; S275-L279 WeakPolarHBondContact O-CG 3.46Å; S275-L279 PolarHBondContact O-N 3.4Å; S275-H316 VanDerWaalsContact CB-ND1 3.32Å; S275-H316 WeakPolarHBondContact CB-ND1 3.43Å; S275-H316 PolarHBondContact OG-ND1 3.11Å; S275-S317 WeakPolarHBondContact OG-CA 3.25Å; S275-S317 PolarHBondContact OG-N 2.97Å; S275-Y320 VanDerWaalsContact OG-CD2 3.3Å; S275-Y320 WeakPolarHBondContact OG-CD2 3.44Å; S275-Y320 VanDerWaalsContact OG-CE2 3.31Å; S275-Y320 WeakPolarHBondContact OG-CE2 3.45Å
276	I	98.8	Very high	98.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.6	-48.3	173.3	-68.2	166.2	0	0	0	109.5	W240 Y245 L249 I272 A273 Q278 L279 L280 L303 L313	W240-I276 HydrophobicContact CE3-CD1 4.34Å; W240-I276 HydrophobicContact CH2-CB 4.3Å; W240-I276 HydrophobicContact CH2-CD1 4.18Å; W240-I276 HydrophobicContact CH2-CG2 3.68Å; W240-I276 HydrophobicContact CZ2-CG2 4.36Å; W240-I276 HydrophobicContact CZ3-CB 4.43Å; W240-I276 HydrophobicContact CZ3-CD1 4.07Å; W240-I276 HydrophobicContact CZ3-CG2 4.29Å; Y245-I276 HydrophobicContact CE1-CD1 3.88Å; L249-I276 HydrophobicContact CD2-CD1 4.3Å; I272-I276 HydrophobicContact CG2-CD1 3.95Å; I272-I276 HydrophobicContact CG2-CG1 4.47Å; I272-I276 WeakPolarHBondContact O-CG1 3.4Å; I272-I276 PolarHBondContact O-N 2.76Å; A273-I276 WeakPolarHBondContact O-CB 3.2Å; A273-I276 PolarHBondContact O-N 2.87Å; I276-Q278 PolarHBondContact O-N 2.9Å; I276-L279 PolarHBondContact O-N 2.96Å; I276-L280 WeakPolarHBondContact O-CB 3.41Å; I276-L280 PolarHBondContact O-N 3.43Å; I276-L303 HydrophobicContact CD1-CD1 3.95Å; I276-L303 HydrophobicContact CG2-CD1 4.12Å; I276-L303 HydrophobicContact CG2-CD2 3.51Å; I276-L303 HydrophobicContact CG2-CG 4.48Å; I276-L313 HydrophobicContact CD1-CD2 4.32Å; I276-L313 HydrophobicContact CG1-CD1 3.85Å; I276-L313 HydrophobicContact CG1-CD2 4.01Å
277	F	98.8	Very high	98.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.3	-44.4	177.2	-64.3	-40.8	0	0	0	112.8	L211 V215 I222 M226 P233 F236 W240 A273 L274 S275 L280 L281 L300	L211-F277 HydrophobicContact CD1-CE2 4.12Å; L211-F277 HydrophobicContact CD2-CE2 4.05Å; L211-F277 HydrophobicContact CD2-CZ 4.37Å; L211-F277 HydrophobicContact CG-CE2 4.11Å; V215-F277 HydrophobicContact CG2-CD2 3.57Å; V215-F277 HydrophobicContact CG2-CE2 3.72Å; I222-F277 WeakPolarHBondContact CD1-O 3.5Å; I222-F277 HydrophobicContact CG2-CB 4.27Å; M226-F277 HydrophobicContact CE-CE1 4.24Å; M226-F277 HydrophobicContact CE-CZ 4.38Å; M226-F277 HydrophobicContact SD-CD1 4.41Å; M226-F277 HydrophobicContact SD-CE1 4.36Å; P233-F277 HydrophobicContact CG-CZ 4.48Å; F236-F277 AromaticContact CE2-CE1 3.71Å; F236-F277 HydrophobicContact CE2-CE1 3.71Å; F236-F277 AromaticContact CE2-CZ 3.84Å; F236-F277 HydrophobicContact CE2-CZ 3.84Å; F236-F277 AromaticContact CZ-CE1 3.55Å; F236-F277 HydrophobicContact CZ-CE1 3.55Å; F236-F277 AromaticContact CZ-CZ 3.66Å; F236-F277 HydrophobicContact CZ-CZ 3.66Å; W240-F277 HydrophobicContact CH2-CE1 4.11Å; W240-F277 HydrophobicContact CH2-CZ 4.43Å; W240-F277 HydrophobicContact CZ3-CE1 4.16Å; W240-F277 HydrophobicContact CZ3-CZ 4.04Å; A273-F277 HydrophobicContact CB-CE2 4.37Å; A273-F277 WeakPolarHBondContact O-CD2 3.48Å; A273-F277 WeakPolarHBondContact O-CG 3.38Å; A273-F277 PolarHBondContact O-N 2.86Å; L274-F277 PolarHBondContact O-N 2.84Å; S275-F277 VanDerWaalsContact C-N 3.33Å; S275-F277 PolarHBondContact O-N 3.25Å; F277-L280 PolarHBondContact O-N 2.94Å; F277-L281 WeakPolarHBondContact O-CA 3.45Å; F277-L281 WeakPolarHBondContact O-CB 3.46Å; F277-L281 PolarHBondContact O-N 3.01Å; F277-L300 HydrophobicContact CD1-CD2 4.17Å; F277-L300 HydrophobicContact CE1-CD2 3.87Å
278	Q	98.7	Very high	98.4	Very high	64 Å²	64	27.5 Å²	27.5	30%	0.299	15%	0.145	S	C	.	.	H	α-helix	trans	-64	-43.3	178.7	-170.6	60.3	39.9	0	0	112.3	L274 S275 I276 L280 G282 H316	L274-Q278 WeakPolarHBondContact O-CB 3.42Å; L274-Q278 PolarHBondContact O-N 3.33Å; S275-Q278 PolarHBondContact O-N 3.37Å; I276-Q278 PolarHBondContact O-N 2.9Å; Q278-L280 VanDerWaalsContact C-N 3.34Å; Q278-G282 WeakPolarHBondContact O-CA 3.48Å; Q278-G282 PolarHBondContact O-N 3.36Å; Q278-H316 VanDerWaalsContact CB-CE1 3.46Å; Q278-H316 WeakPolarHBondContact CB-CE1 3.45Å; Q278-H316 VanDerWaalsContact CG-CE1 3.49Å; Q278-H316 WeakPolarHBondContact CG-CE1 3.26Å; Q278-H316 WeakPolarHBondContact CG-NE2 3.42Å
279	L	98.5	Very high	98.4	Very high	45 Å²	45	33.9 Å²	33.9	24%	0.236	17%	0.169	C	C	.	.	H	α-helix	trans	-72.7	-30.2	-178.5	-69.7	166.3	0	0	0	111.9	S275 I276 I307 V312 L313 H316	S275-L279 WeakPolarHBondContact O-CB 3.5Å; S275-L279 VanDerWaalsContact O-CG 3.26Å; S275-L279 WeakPolarHBondContact O-CG 3.46Å; S275-L279 PolarHBondContact O-N 3.4Å; I276-L279 PolarHBondContact O-N 2.96Å; L279-I307 HydrophobicContact CB-CB 3.88Å; L279-I307 HydrophobicContact CB-CD1 4.39Å; L279-I307 HydrophobicContact CB-CG2 4.13Å; L279-I307 HydrophobicContact CD1-CB 4.44Å; L279-I307 WeakPolarHBondContact CD1-O 3.44Å; L279-V312 HydrophobicContact CD1-CG1 4.02Å; L279-V312 HydrophobicContact CD2-CG1 4.17Å; L279-L313 HydrophobicContact CD1-CD1 4.07Å; L279-H316 HydrophobicContact CD1-CB 4.01Å; L279-H316 HydrophobicContact CG-CB 4.46Å
280	L	98.4	Very high	98.3	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-85.5	-39.3	-179.5	-174.8	60.6	0	0	0	113.5	I276 F277 Q278 S286 L290 S299 L300 P304 I307	I276-L280 WeakPolarHBondContact O-CB 3.41Å; I276-L280 PolarHBondContact O-N 3.43Å; F277-L280 PolarHBondContact O-N 2.94Å; Q278-L280 VanDerWaalsContact C-N 3.34Å; L280-S286 WeakPolarHBondContact O-CB 3.31Å; L280-L290 HydrophobicContact CD1-CD1 3.85Å; L280-L290 HydrophobicContact CD2-CD1 4.42Å; L280-L290 HydrophobicContact CG-CD1 3.97Å; L280-S299 WeakPolarHBondContact CD1-OG 3.35Å; L280-L300 HydrophobicContact CD2-CD2 3.69Å; L280-L300 HydrophobicContact CD2-CG 4.14Å; L280-P304 HydrophobicContact CD1-CG 4.06Å; L280-I307 HydrophobicContact CB-CD1 3.7Å; L280-I307 HydrophobicContact CD1-CD1 4Å; L280-I307 HydrophobicContact CG-CD1 4.36Å
281	L	98.5	Very high	98.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-126.3	3.3	-167.6	-59	171.8	0	0	0	113.1	I222 M226 F277 D283 R287 L290 L296	I222-L281 HydrophobicContact CD1-CB 4.26Å; I222-L281 HydrophobicContact CG1-CB 3.91Å; I222-L281 HydrophobicContact CG2-CB 4.02Å; I222-L281 HydrophobicContact CG2-CD1 3.73Å; M226-L281 HydrophobicContact CG-CD1 4.28Å; F277-L281 WeakPolarHBondContact O-CA 3.45Å; F277-L281 WeakPolarHBondContact O-CB 3.46Å; F277-L281 PolarHBondContact O-N 3.01Å; L281-D283 VanDerWaalsContact C-N 3.3Å; L281-D283 PolarHBondContact O-N 3.01Å; L281-R287 HydrophobicContact CB-CG 4.21Å; L281-R287 HydrophobicContact CD2-CG 4.48Å; L281-R287 WeakPolarHBondContact O-CD 3.37Å; L281-R287 VanDerWaalsContact O-CG 3.22Å; L281-R287 WeakPolarHBondContact O-CG 3.43Å; L281-R287 PolarHBondContact O-NH1 3.38Å; L281-L290 HydrophobicContact CD2-CB 4.24Å; L281-L290 HydrophobicContact CD2-CD1 3.8Å; L281-L296 HydrophobicContact CD1-CD1 3.86Å; L281-L296 HydrophobicContact CD2-CD1 3.89Å; L281-L296 HydrophobicContact CG-CD1 4.41Å
282	G	97.7	Very high	98.2	Very high	23 Å²	23	39.8 Å²	39.8	24%	0.237	21%	0.205	C	C	.	.	S	Bend	trans	-64.4	-33.3	-175.5	0	0	0	0	0	113.5	Q278 R287	Q278-G282 WeakPolarHBondContact O-CA 3.48Å; Q278-G282 PolarHBondContact O-N 3.36Å; G282-R287 VanDerWaalsContact C-NH1 3.28Å; G282-R287 PolarHBondContact O-NH1 3.2Å
283	D	97.2	Very high	98.2	Very high	69 Å²	69	44 Å²	44	37%	0.369	23%	0.225	S	C	.	.	S	Bend	trans	-94.1	149.7	176.8	78.8	91.6	0	0	0	112.6	L281 N285 S286 R287	L281-D283 VanDerWaalsContact C-N 3.3Å; L281-D283 PolarHBondContact O-N 3.01Å; D283-N285 VanDerWaalsContact C-N 3.3Å; D283-N285 PolarHBondContact O-N 3.41Å; D283-N285 WeakPolarHBondContact OD1-CA 3.31Å; D283-N285 VanDerWaalsContact OD1-CB 3.3Å; D283-N285 WeakPolarHBondContact OD1-CB 3.35Å; D283-N285 PolarHBondContact OD1-N 2.96Å; D283-S286 PolarHBondContact O-N 3.49Å; D283-S286 PolarHBondContact OD1-N 2.59Å; D283-S286 PolarHBondContact OD1-OG 3.17Å; D283-S286 WeakPolarHBondContact OD2-CB 3.23Å; D283-S286 PolarHBondContact OD2-OG 3.41Å; D283-R287 PolarHBondContact O-N 3Å
284	S	97.8	Very high	98.1	Very high	58 Å²	58	51.7 Å²	51.7	41%	0.406	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-30.7	-177.5	-171	0	0	0	0	112.8	R287 K288	S284-R287 PolarHBondContact O-N 3.07Å; S284-K288 VanDerWaalsContact O-CG 3.31Å; S284-K288 WeakPolarHBondContact O-CG 3.28Å; S284-K288 PolarHBondContact O-N 3.34Å
285	N	98	Very high	98.1	Very high	110 Å²	110	56.7 Å²	56.7	59%	0.588	28%	0.283	S	S	*	.	H	α-helix	trans	-70.2	-39.5	179.8	-66.7	-25.7	0	0	0	111.1	D283 K288 R289	D283-N285 VanDerWaalsContact C-N 3.3Å; D283-N285 PolarHBondContact O-N 3.41Å; D283-N285 WeakPolarHBondContact OD1-CA 3.31Å; D283-N285 VanDerWaalsContact OD1-CB 3.3Å; D283-N285 WeakPolarHBondContact OD1-CB 3.35Å; D283-N285 PolarHBondContact OD1-N 2.96Å; N285-K288 PolarHBondContact O-N 2.97Å; N285-R289 WeakPolarHBondContact O-CB 3.4Å; N285-R289 PolarHBondContact O-N 2.71Å
286	S	97.8	Very high	98.1	Very high	11 Å²	11	56.7 Å²	56.7	8%	0.077	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-39.1	173.6	-64.6	0	0	0	0	112.2	L280 D283 R289 L290	L280-S286 WeakPolarHBondContact O-CB 3.31Å; D283-S286 PolarHBondContact O-N 3.49Å; D283-S286 PolarHBondContact OD1-N 2.59Å; D283-S286 PolarHBondContact OD1-OG 3.17Å; D283-S286 WeakPolarHBondContact OD2-CB 3.23Å; D283-S286 PolarHBondContact OD2-OG 3.41Å; S286-R289 PolarHBondContact O-N 2.68Å; S286-R289 PolarHBondContact OG-NH1 3.28Å; S286-R289 PolarHBondContact OG-NH2 3.27Å; S286-L290 WeakPolarHBondContact O-CB 3.29Å; S286-L290 WeakPolarHBondContact O-CG 3.43Å; S286-L290 PolarHBondContact O-N 3.47Å
287	R	98.4	Very high	98	Very high	36 Å²	36	57.1 Å²	57.1	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-42.6	172.3	-66.7	-167.2	-63.9	-92.1	14	112.6	D221 H225 L281 G282 D283 S284 R289 L290 N291	D221-R287 IonicContact OD2-NH2 3.49Å; D221-R287 PolarHBondContact OD2-NH2 3.45Å; H225-R287 HydrophobicContact CB-CG 4.38Å; H225-R287 PolarHBondContact CE1-O 3.34Å; L281-R287 HydrophobicContact CB-CG 4.21Å; L281-R287 HydrophobicContact CD2-CG 4.48Å; L281-R287 WeakPolarHBondContact O-CD 3.37Å; L281-R287 VanDerWaalsContact O-CG 3.22Å; L281-R287 WeakPolarHBondContact O-CG 3.43Å; L281-R287 PolarHBondContact O-NH1 3.38Å; G282-R287 VanDerWaalsContact C-NH1 3.28Å; G282-R287 PolarHBondContact O-NH1 3.2Å; D283-R287 PolarHBondContact O-N 3Å; S284-R287 PolarHBondContact O-N 3.07Å; R287-R289 VanDerWaalsContact C-N 3.31Å; R287-R289 PolarHBondContact O-N 2.91Å; R287-L290 CarbonylContact O-C 3.51Å; R287-L290 PolarHBondContact O-N 2.77Å; R287-N291 PolarHBondContact O-N 3.1Å
288	K	98	Very high	97.9	Very high	138 Å²	138	58.9 Å²	58.9	60%	0.6	30%	0.303	S	S	*	.	H	α-helix	trans	-62.3	-37.7	174	-73	173.5	-175.1	178.4	0	112.3	S284 N285 N291	S284-K288 VanDerWaalsContact O-CG 3.31Å; S284-K288 WeakPolarHBondContact O-CG 3.28Å; S284-K288 PolarHBondContact O-N 3.34Å; N285-K288 PolarHBondContact O-N 2.97Å; K288-N291 VanDerWaalsContact O-CB 3.3Å; K288-N291 WeakPolarHBondContact O-CB 3.5Å; K288-N291 VanDerWaalsContact O-CG 3.22Å; K288-N291 PolarHBondContact O-ND2 2.99Å
289	R	97.9	Very high	97.9	Very high	138 Å²	138	56.7 Å²	56.7	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-67.9	-45.7	176.3	-175.7	176.4	64.9	-106	-4.5	111.4	N285 S286 R287 N291 K295	N285-R289 WeakPolarHBondContact O-CB 3.4Å; N285-R289 PolarHBondContact O-N 2.71Å; S286-R289 PolarHBondContact O-N 2.68Å; S286-R289 PolarHBondContact OG-NH1 3.28Å; S286-R289 PolarHBondContact OG-NH2 3.27Å; R287-R289 VanDerWaalsContact C-N 3.31Å; R287-R289 PolarHBondContact O-N 2.91Å; R289-N291 PolarHBondContact O-N 3.49Å; R289-K295 WeakPolarHBondContact O-CD 3.39Å
290	L	97.9	Very high	97.8	Very high	15 Å²	15	54.6 Å²	54.6	8%	0.079	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	54.2	-177.6	-57.8	177.2	0	0	0	111.4	H225 L280 L281 S286 R287 K295	H225-L290 PolarHBondContact CE1-O 2.87Å; H225-L290 VanDerWaalsContact CE1-O 3.29Å; H225-L290 PolarHBondContact NE2-O 2.74Å; L280-L290 HydrophobicContact CD1-CD1 3.85Å; L280-L290 HydrophobicContact CD2-CD1 4.42Å; L280-L290 HydrophobicContact CG-CD1 3.97Å; L281-L290 HydrophobicContact CD2-CB 4.24Å; L281-L290 HydrophobicContact CD2-CD1 3.8Å; S286-L290 WeakPolarHBondContact O-CB 3.29Å; S286-L290 WeakPolarHBondContact O-CG 3.43Å; S286-L290 PolarHBondContact O-N 3.47Å; R287-L290 CarbonylContact O-C 3.51Å; R287-L290 PolarHBondContact O-N 2.77Å; L290-K295 HydrophobicContact CD2-CB 4.23Å
291	N	97	Very high	97.7	Very high	84 Å²	84	61.7 Å²	61.7	45%	0.449	31%	0.31	S	S	.	.			trans	-96.3	10.7	-167	66.4	-13	0	0	0	116.4	R287 K288 R289 K295	R287-N291 PolarHBondContact O-N 3.1Å; K288-N291 VanDerWaalsContact O-CB 3.3Å; K288-N291 WeakPolarHBondContact O-CB 3.5Å; K288-N291 VanDerWaalsContact O-CG 3.22Å; K288-N291 PolarHBondContact O-ND2 2.99Å; R289-N291 PolarHBondContact O-N 3.49Å; N291-K295 PolarHBondContact OD1-NZ 3.34Å
292	S	97.8	Very high	97.5	Very high	39 Å²	39	66.9 Å²	66.9	27%	0.273	34%	0.338	S	S	.	.	S	Bend	trans	-135.6	158.6	175	68.8	0	0	0	0	110.1	E294 K295 L296	S292-E294 VanDerWaalsContact C-N 3.25Å; S292-E294 PolarHBondContact O-N 3.37Å; S292-K295 PolarHBondContact O-N 3.16Å; S292-K295 WeakPolarHBondContact OG-CG 3.48Å; S292-K295 PolarHBondContact OG-N 3.23Å; S292-L296 VanDerWaalsContact O-CB 3.29Å; S292-L296 WeakPolarHBondContact O-CB 3.21Å; S292-L296 PolarHBondContact O-N 3.49Å
293	M	97.9	Very high	97.5	Very high	89 Å²	89	66.1 Å²	66.1	44%	0.438	33%	0.329	S	S	.	.	H	α-helix	trans	-51.4	-47.7	175.9	-166.9	-176.9	-179.1	0	0	111.2	C229 Y235 L296 M297	C229-M293 WeakPolarHBondContact O-CA 3.47Å; C229-M293 WeakPolarHBondContact O-CB 3.49Å; C229-M293 WeakPolarHBondContact O-CG 3.25Å; Y235-M293 HydrophobicContact CD2-CE 4.36Å; M293-L296 PolarHBondContact O-N 2.88Å; M293-M297 HydrophobicContact CG-CG 4.1Å; M293-M297 WeakPolarHBondContact O-CB 3.37Å; M293-M297 WeakPolarHBondContact O-CG 3.4Å; M293-M297 PolarHBondContact O-N 3.12Å
294	E	97.8	Very high	97.3	Very high	162 Å²	162	64.8 Å²	64.8	76%	0.757	32%	0.324	S	S	*	.	H	α-helix	trans	-58.5	-53.5	-179.2	-175.2	-172.9	176.8	0	0	112.3	S292 L296 M297 G298	S292-E294 VanDerWaalsContact C-N 3.25Å; S292-E294 PolarHBondContact O-N 3.37Å; E294-L296 PolarHBondContact O-N 3.33Å; E294-M297 PolarHBondContact O-N 3.24Å; E294-G298 PolarHBondContact O-N 3.03Å
295	K	98	Very high	97	Very high	104 Å²	104	67.9 Å²	67.9	45%	0.452	33%	0.33	S	S	.	.	H	α-helix	trans	-63.3	-44.2	-179	-67.2	179.7	-170.9	171.1	0	111.5	R289 L290 N291 S292 G298 S299	R289-K295 WeakPolarHBondContact O-CD 3.39Å; L290-K295 HydrophobicContact CD2-CB 4.23Å; N291-K295 PolarHBondContact OD1-NZ 3.34Å; S292-K295 PolarHBondContact O-N 3.16Å; S292-K295 WeakPolarHBondContact OG-CG 3.48Å; S292-K295 PolarHBondContact OG-N 3.23Å; K295-G298 PolarHBondContact O-N 3.22Å; K295-S299 PolarHBondContact O-N 3.14Å; K295-S299 VanDerWaalsContact O-N 3.09Å
296	L	98.3	Very high	96.8	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.2	-47.1	-179.4	178.5	55.9	0	0	0	111.1	M226 C229 T231 L281 S292 M293 E294 S299 L300	M226-L296 HydrophobicContact CG-CD2 4.25Å; C229-L296 HydrophobicContact CB-CD2 3.73Å; T231-L296 HydrophobicContact CG2-CD2 3.95Å; T231-L296 HydrophobicContact CG2-CG 4.21Å; L281-L296 HydrophobicContact CD1-CD1 3.86Å; L281-L296 HydrophobicContact CD2-CD1 3.89Å; L281-L296 HydrophobicContact CG-CD1 4.41Å; S292-L296 VanDerWaalsContact O-CB 3.29Å; S292-L296 WeakPolarHBondContact O-CB 3.21Å; S292-L296 PolarHBondContact O-N 3.49Å; M293-L296 PolarHBondContact O-N 2.88Å; E294-L296 PolarHBondContact O-N 3.33Å; L296-S299 PolarHBondContact O-N 2.89Å; L296-L300 HydrophobicContact CD1-CD1 3.63Å; L296-L300 HydrophobicContact CD1-CG 4.03Å; L296-L300 HydrophobicContact CD2-CD1 4.49Å; L296-L300 HydrophobicContact CG-CD1 3.7Å; L296-L300 HydrophobicContact CG-CG 4.48Å; L296-L300 WeakPolarHBondContact O-CB 3.28Å; L296-L300 VanDerWaalsContact O-CG 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.47Å; L296-L300 PolarHBondContact O-N 3.47Å
297	M	97.6	Very high	96.7	Very high	10 Å²	10	68.5 Å²	68.5	5%	0.049	33%	0.332	C	S	.	.	H	α-helix	trans	-64.1	-40.6	176.8	-73.4	-62.4	-65.9	0	0	112.1	T231 Y235 F236 M293 E294 S299 L300 R301	T231-M297 HydrophobicContact CG2-CG 4.33Å; T231-M297 HydrophobicContact CG2-SD 3.55Å; T231-M297 VanDerWaalsContact CG2-SD 3.55Å; Y235-M297 WeakPolarHBondContact O-CE 3.29Å; F236-M297 HydrophobicContact CB-CE 4.02Å; F236-M297 HydrophobicContact CB-SD 4.45Å; F236-M297 HydrophobicContact CD1-CE 4.37Å; F236-M297 HydrophobicContact CD1-SD 3.84Å; M293-M297 HydrophobicContact CG-CG 4.1Å; M293-M297 WeakPolarHBondContact O-CB 3.37Å; M293-M297 WeakPolarHBondContact O-CG 3.4Å; M293-M297 PolarHBondContact O-N 3.12Å; E294-M297 PolarHBondContact O-N 3.24Å; M297-S299 VanDerWaalsContact C-N 3.3Å; M297-S299 PolarHBondContact O-N 3.44Å; M297-L300 PolarHBondContact O-N 2.93Å; M297-R301 WeakPolarHBondContact O-CB 3.4Å; M297-R301 VanDerWaalsContact O-CG 3.31Å; M297-R301 WeakPolarHBondContact O-CG 3.46Å; M297-R301 PolarHBondContact O-N 3.01Å
298	G	97.3	Very high	96.6	Very high	37 Å²	37	66.9 Å²	66.9	38%	0.381	33%	0.326	S	S	.	.	H	α-helix	trans	-56.4	-45.3	174.7	0	0	0	0	0	111.7	E294 K295 N302	E294-G298 PolarHBondContact O-N 3.03Å; K295-G298 PolarHBondContact O-N 3.22Å; G298-N302 PolarHBondContact O-N 3.38Å; G298-N302 VanDerWaalsContact O-N 3.12Å; G298-N302 PolarHBondContact O-ND2 2.89Å
299	S	97.6	Very high	96.5	Very high	18 Å²	18	61.4 Å²	61.4	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-75.8	-28.3	178.2	-168.6	0	0	0	0	114.4	L280 K295 L296 M297 N302 L303	L280-S299 WeakPolarHBondContact CD1-OG 3.35Å; K295-S299 PolarHBondContact O-N 3.14Å; K295-S299 VanDerWaalsContact O-N 3.09Å; L296-S299 PolarHBondContact O-N 2.89Å; M297-S299 VanDerWaalsContact C-N 3.3Å; M297-S299 PolarHBondContact O-N 3.44Å; S299-N302 CarbonylContact O-C 3.59Å; S299-N302 VanDerWaalsContact O-C 3.28Å; S299-L303 WeakPolarHBondContact O-CA 3.43Å
300	L	97.6	Very high	96.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-79.6	-30.1	177.9	-75.2	167.4	0	0	0	112.6	T231 F236 W240 F277 L280 L296 M297	T231-L300 HydrophobicContact CG2-CD1 4Å; F236-L300 HydrophobicContact CB-CB 4.42Å; F236-L300 HydrophobicContact CD1-CB 4.37Å; F236-L300 HydrophobicContact CD1-CD1 3.88Å; F236-L300 HydrophobicContact CD2-CB 3.91Å; F236-L300 HydrophobicContact CD2-CD1 4.34Å; F236-L300 HydrophobicContact CD2-CD2 4.32Å; F236-L300 HydrophobicContact CD2-CG 4.44Å; F236-L300 HydrophobicContact CE1-CD1 3.57Å; F236-L300 HydrophobicContact CE2-CB 4.29Å; F236-L300 HydrophobicContact CE2-CD1 4.06Å; F236-L300 HydrophobicContact CE2-CD2 3.88Å; F236-L300 HydrophobicContact CE2-CG 4.32Å; F236-L300 HydrophobicContact CG-CB 3.97Å; F236-L300 HydrophobicContact CG-CD1 4.26Å; F236-L300 HydrophobicContact CZ-CD1 3.67Å; F236-L300 HydrophobicContact CZ-CD2 4.16Å; F236-L300 HydrophobicContact CZ-CG 4.4Å; W240-L300 HydrophobicContact CH2-CD2 4.08Å; W240-L300 HydrophobicContact CZ2-CD2 4.44Å; F277-L300 HydrophobicContact CD1-CD2 4.17Å; F277-L300 HydrophobicContact CE1-CD2 3.87Å; L280-L300 HydrophobicContact CD2-CD2 3.69Å; L280-L300 HydrophobicContact CD2-CG 4.14Å; L296-L300 HydrophobicContact CD1-CD1 3.63Å; L296-L300 HydrophobicContact CD1-CG 4.03Å; L296-L300 HydrophobicContact CD2-CD1 4.49Å; L296-L300 HydrophobicContact CG-CD1 3.7Å; L296-L300 HydrophobicContact CG-CG 4.48Å; L296-L300 WeakPolarHBondContact O-CB 3.28Å; L296-L300 VanDerWaalsContact O-CG 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.47Å; L296-L300 PolarHBondContact O-N 3.47Å; M297-L300 PolarHBondContact O-N 2.93Å
301	R	95.5	Very high	96.1	Very high	154 Å²	154	61.7 Å²	61.7	58%	0.581	32%	0.32	S	S	*	.	H	α-helix	trans	-76.2	-35	172.9	-71.2	176.6	176.5	169.7	1.5	111.9	F236 M297	F236-R301 HydrophobicContact CB-CG 4.39Å; M297-R301 WeakPolarHBondContact O-CB 3.4Å; M297-R301 VanDerWaalsContact O-CG 3.31Å; M297-R301 WeakPolarHBondContact O-CG 3.46Å; M297-R301 PolarHBondContact O-N 3.01Å
302	N	94.8	Very high	96.1	Very high	109 Å²	109	60.9 Å²	60.9	58%	0.583	32%	0.318	S	S	*	.	S	Bend	trans	-121.2	86.1	177.1	-55.5	-60.6	0	0	0	109.6	G298 S299	G298-N302 PolarHBondContact O-N 3.38Å; G298-N302 VanDerWaalsContact O-N 3.12Å; G298-N302 PolarHBondContact O-ND2 2.89Å; S299-N302 CarbonylContact O-C 3.59Å; S299-N302 VanDerWaalsContact O-C 3.28Å
303	L	96.5	Very high	96.2	Very high	8 Å²	8	59 Å²	59	4%	0.042	31%	0.305	C	S	.	.			trans	-68.4	133.5	-173	-67.9	170.7	0	0	0	111.4	W240 L249 I276 S299 K305 V308	W240-L303 HydrophobicContact CH2-CD2 4.48Å; W240-L303 HydrophobicContact CZ2-CD1 3.89Å; W240-L303 HydrophobicContact CZ2-CD2 4.09Å; W240-L303 HydrophobicContact CZ2-CG 4.33Å; L249-L303 HydrophobicContact CD2-CD1 3.74Å; I276-L303 HydrophobicContact CD1-CD1 3.95Å; I276-L303 HydrophobicContact CG2-CD1 4.12Å; I276-L303 HydrophobicContact CG2-CD2 3.51Å; I276-L303 HydrophobicContact CG2-CG 4.48Å; S299-L303 WeakPolarHBondContact O-CA 3.43Å; L303-K305 PolarHBondContact O-N 3.19Å; L303-V308 HydrophobicContact CB-CG1 3.59Å; L303-V308 HydrophobicContact CD1-CG1 3.81Å; L303-V308 HydrophobicContact CG-CG1 4.28Å
304	P	94.8	Very high	96.2	Very high	41 Å²	41	54.8 Å²	54.8	27%	0.266	28%	0.284	S	S	.	.			trans	-59.2	126	178.3	-25.6	34.5	0	0	0	112.8	L280 N306 I307 V308	L280-P304 HydrophobicContact CD1-CG 4.06Å; P304-N306 WeakPolarHBondContact CB-OD1 3.44Å; P304-N306 PolarHBondContact O-N 2.72Å; P304-I307 HydrophobicContact CB-CG1 4.29Å; P304-I307 VanDerWaalsContact O-CG1 3.23Å; P304-I307 WeakPolarHBondContact O-CG1 3.34Å; P304-I307 PolarHBondContact O-N 3.34Å; P304-V308 PolarHBondContact O-N 2.99Å
305	K	91.3	Very high	96.2	Very high	123 Å²	123	51.5 Å²	51.5	54%	0.535	27%	0.271	S	S	.	.	H	α-helix	trans	-54.6	-31.1	-176.3	-67.8	-168.6	177.4	-170.2	0	113.8	L303 I307 V308 G309	L303-K305 PolarHBondContact O-N 3.19Å; K305-I307 VanDerWaalsContact C-N 3.29Å; K305-I307 PolarHBondContact O-N 3.19Å; K305-V308 PolarHBondContact O-N 3.14Å; K305-G309 PolarHBondContact O-N 3.14Å
306	N	92.9	Very high	96.2	Very high	122 Å²	122	47.2 Å²	47.2	65%	0.652	25%	0.253	S	S	*	.	H	α-helix	trans	-67.7	-24	178.7	66.6	-57.1	0	0	0	113.9	P304	P304-N306 WeakPolarHBondContact CB-OD1 3.44Å; P304-N306 PolarHBondContact O-N 2.72Å
307	I	96.1	Very high	96.3	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.062	26%	0.255	C	S	.	.	H	α-helix	trans	-96.2	-23.1	178	73.1	167	0	0	0	112.9	L279 L280 P304 K305	L279-I307 HydrophobicContact CB-CB 3.88Å; L279-I307 HydrophobicContact CB-CD1 4.39Å; L279-I307 HydrophobicContact CB-CG2 4.13Å; L279-I307 HydrophobicContact CD1-CB 4.44Å; L279-I307 WeakPolarHBondContact CD1-O 3.44Å; L280-I307 HydrophobicContact CB-CD1 3.7Å; L280-I307 HydrophobicContact CD1-CD1 4Å; L280-I307 HydrophobicContact CG-CD1 4.36Å; P304-I307 HydrophobicContact CB-CG1 4.29Å; P304-I307 VanDerWaalsContact O-CG1 3.23Å; P304-I307 WeakPolarHBondContact O-CG1 3.34Å; P304-I307 PolarHBondContact O-N 3.34Å; K305-I307 VanDerWaalsContact C-N 3.29Å; K305-I307 PolarHBondContact O-N 3.19Å
308	V	96.6	Very high	96.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-100.2	-0.3	-176.9	-62.3	0	0	0	0	114.7	L249 P250 T253 L303 P304 K305 L313	L249-V308 HydrophobicContact CD2-CB 3.7Å; L249-V308 HydrophobicContact CD2-CG1 3.48Å; L249-V308 VanDerWaalsContact CD2-CG1 3.48Å; P250-V308 HydrophobicContact CG-CG2 3.98Å; T253-V308 WeakPolarHBondContact CG2-O 3.22Å; T253-V308 PolarHBondContact OG1-O 3Å; L303-V308 HydrophobicContact CB-CG1 3.59Å; L303-V308 HydrophobicContact CD1-CG1 3.81Å; L303-V308 HydrophobicContact CG-CG1 4.28Å; P304-V308 PolarHBondContact O-N 2.99Å; K305-V308 PolarHBondContact O-N 3.14Å; V308-L313 HydrophobicContact CB-CD2 4.34Å; V308-L313 HydrophobicContact CG1-CD2 4.37Å
309	G	94.9	Very high	96.3	Very high	23 Å²	23	56 Å²	56	24%	0.237	28%	0.276	C	S	.	.	S	Bend	trans	-58.7	147.5	173	0	0	0	0	0	112.3	K305 D311 V312 L313	K305-G309 PolarHBondContact O-N 3.14Å; G309-D311 PolarHBondContact O-N 3.49Å; G309-V312 PolarHBondContact O-N 2.84Å; G309-V312 VanDerWaalsContact O-N 3.09Å; G309-L313 PolarHBondContact O-N 3.34Å
310	E	94.4	Very high	96.4	Very high	43 Å²	43	55.9 Å²	55.9	20%	0.201	27%	0.274	C	S	.	.	H	α-helix	trans	-51	-54.8	-171.3	-176.3	-176.9	158.1	0	0	112.7	S252 T253 R256 V312 I314	S252-E310 WeakPolarHBondContact CB-OE2 3.13Å; S252-E310 PolarHBondContact OG-OE2 2.81Å; T253-E310 VanDerWaalsContact OG1-CA 3.28Å; T253-E310 WeakPolarHBondContact OG1-CA 3.31Å; T253-E310 PolarHBondContact OG1-N 3.45Å; R256-E310 HydrophobicContact CB-CG 4.49Å; R256-E310 WeakPolarHBondContact CD-OE1 3.47Å; R256-E310 HydrophobicContact CG-CG 3.61Å; R256-E310 WeakPolarHBondContact CG-OE1 3.38Å; R256-E310 IonicContact CZ-OE1 2.72Å; R256-E310 IonicContact NE-OE1 3.17Å; R256-E310 IonicContact NH1-OE1 3.74Å; R256-E310 PolarHBondContact NH1-OE1 3.2Å; E310-V312 VanDerWaalsContact C-N 3.3Å; E310-V312 PolarHBondContact O-N 3.19Å; E310-I314 HydrophobicContact CG-CG1 4.25Å; E310-I314 WeakPolarHBondContact O-CB 3.47Å; E310-I314 WeakPolarHBondContact O-CG1 3.47Å; E310-I314 PolarHBondContact O-N 3.08Å
311	D	93.9	Very high	96.3	Very high	116 Å²	116	58.5 Å²	58.5	62%	0.62	29%	0.29	S	S	*	.	H	α-helix	trans	-68.7	-28.6	-176.7	-70.3	-42.8	0	0	0	113	G309 N315	G309-D311 PolarHBondContact O-N 3.49Å; D311-N315 WeakPolarHBondContact O-CB 3.46Å; D311-N315 VanDerWaalsContact O-CG 3.25Å; D311-N315 PolarHBondContact O-ND2 2.93Å
312	V	97.6	Very high	96.3	Very high	67 Å²	67	55.8 Å²	55.8	41%	0.406	28%	0.282	S	S	.	.	H	α-helix	trans	-77.3	-57.5	-179.9	179.7	0	0	0	0	109.6	L279 G309 E310 H316	L279-V312 HydrophobicContact CD1-CG1 4.02Å; L279-V312 HydrophobicContact CD2-CG1 4.17Å; G309-V312 PolarHBondContact O-N 2.84Å; G309-V312 VanDerWaalsContact O-N 3.09Å; E310-V312 VanDerWaalsContact C-N 3.3Å; E310-V312 PolarHBondContact O-N 3.19Å; V312-H316 VanDerWaalsContact O-CB 3.23Å; V312-H316 WeakPolarHBondContact O-CB 2.96Å; V312-H316 PolarHBondContact O-N 2.76Å
313	L	98.5	Very high	96.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.9	-43.6	-171.9	-176.8	52.9	0	0	0	112.1	L249 T253 I272 I276 L279 V308 G309 H316 S317	L249-L313 HydrophobicContact CD1-CD2 4.01Å; L249-L313 HydrophobicContact CD2-CD2 4.23Å; T253-L313 HydrophobicContact CG2-CB 4.47Å; T253-L313 HydrophobicContact CG2-CD2 3.94Å; I272-L313 HydrophobicContact CD1-CG 4.45Å; I272-L313 HydrophobicContact CG2-CD1 4.5Å; I272-L313 HydrophobicContact CG2-CD2 4.04Å; I272-L313 HydrophobicContact CG2-CG 4.42Å; I276-L313 HydrophobicContact CD1-CD2 4.32Å; I276-L313 HydrophobicContact CG1-CD1 3.85Å; I276-L313 HydrophobicContact CG1-CD2 4.01Å; L279-L313 HydrophobicContact CD1-CD1 4.07Å; V308-L313 HydrophobicContact CB-CD2 4.34Å; V308-L313 HydrophobicContact CG1-CD2 4.37Å; G309-L313 PolarHBondContact O-N 3.34Å; L313-H316 PolarHBondContact O-N 2.98Å; L313-S317 WeakPolarHBondContact O-CB 3.44Å; L313-S317 PolarHBondContact O-N 3.47Å
314	I	98.4	Very high	96.4	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-66.9	-45.4	-177.6	-58	-62.1	0	0	0	110.4	T253 R256 I257 M260 I272 E310 H316 S317 F318	T253-I314 HydrophobicContact CG2-CD1 4.27Å; R256-I314 HydrophobicContact CB-CD1 3.6Å; R256-I314 HydrophobicContact CB-CG1 3.7Å; R256-I314 HydrophobicContact CG-CG1 4.32Å; I257-I314 HydrophobicContact CG1-CD1 3.84Å; M260-I314 HydrophobicContact CE-CD1 3.92Å; M260-I314 HydrophobicContact CE-CG2 4.11Å; I272-I314 HydrophobicContact CD1-CD1 4.17Å; E310-I314 HydrophobicContact CG-CG1 4.25Å; E310-I314 WeakPolarHBondContact O-CB 3.47Å; E310-I314 WeakPolarHBondContact O-CG1 3.47Å; E310-I314 PolarHBondContact O-N 3.08Å; I314-H316 VanDerWaalsContact C-N 3.35Å; I314-H316 PolarHBondContact O-N 3.1Å; I314-S317 WeakPolarHBondContact O-CB 3.42Å; I314-S317 PolarHBondContact O-N 2.92Å; I314-S317 PolarHBondContact O-OG 3.36Å; I314-F318 HydrophobicContact CG2-CE2 4.07Å; I314-F318 HydrophobicContact CG2-CZ 3.8Å; I314-F318 WeakPolarHBondContact O-CD2 3.33Å
315	N	98.2	Very high	96.3	Very high	92 Å²	92	58.1 Å²	58.1	49%	0.492	29%	0.287	S	S	.	.	H	α-helix	trans	-65.9	-39.3	178.2	-69.3	-38.2	0	0	0	111.8	D311 S317 F318	D311-N315 WeakPolarHBondContact O-CB 3.46Å; D311-N315 VanDerWaalsContact O-CG 3.25Å; D311-N315 PolarHBondContact O-ND2 2.93Å; N315-S317 VanDerWaalsContact C-N 3.29Å; N315-S317 PolarHBondContact O-N 3.43Å; N315-F318 PolarHBondContact O-N 3.14Å
316	H	98.6	Very high	96.5	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.069	30%	0.298	C	S	.	.	H	α-helix	trans	-61.3	-38.5	174.7	-168.2	-74.6	0	0	0	111.9	S275 Q278 L279 V312 L313 I314 F318 R319 Y320	S275-H316 VanDerWaalsContact CB-ND1 3.32Å; S275-H316 WeakPolarHBondContact CB-ND1 3.43Å; S275-H316 PolarHBondContact OG-ND1 3.11Å; Q278-H316 VanDerWaalsContact CB-CE1 3.46Å; Q278-H316 WeakPolarHBondContact CB-CE1 3.45Å; Q278-H316 VanDerWaalsContact CG-CE1 3.49Å; Q278-H316 WeakPolarHBondContact CG-CE1 3.26Å; Q278-H316 WeakPolarHBondContact CG-NE2 3.42Å; L279-H316 HydrophobicContact CD1-CB 4.01Å; L279-H316 HydrophobicContact CG-CB 4.46Å; V312-H316 VanDerWaalsContact O-CB 3.23Å; V312-H316 WeakPolarHBondContact O-CB 2.96Å; V312-H316 PolarHBondContact O-N 2.76Å; L313-H316 PolarHBondContact O-N 2.98Å; I314-H316 VanDerWaalsContact C-N 3.35Å; I314-H316 PolarHBondContact O-N 3.1Å; H316-F318 PolarHBondContact O-N 3.32Å; H316-F318 VanDerWaalsContact O-N 3.12Å; H316-R319 PolarHBondContact CD2-NH1 3.12Å; H316-R319 PolarHBondContact NE2-NH1 3.22Å; H316-R319 VanDerWaalsContact O-CB 3.3Å; H316-R319 WeakPolarHBondContact O-CB 3.3Å; H316-R319 WeakPolarHBondContact O-CG 3.46Å; H316-R319 PolarHBondContact O-N 2.96Å; H316-Y320 AromaticContact CE1-CE2 3.76Å; H316-Y320 AromaticContact ND1-CE2 3.84Å
317	S	98.6	Very high	96.6	Very high	5 Å²	5	55.6 Å²	55.6	4%	0.035	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-23.7	180	83.6	0	0	0	0	115	S275 L313 I314 N315 R319 Y320	S275-S317 WeakPolarHBondContact OG-CA 3.25Å; S275-S317 PolarHBondContact OG-N 2.97Å; L313-S317 WeakPolarHBondContact O-CB 3.44Å; L313-S317 PolarHBondContact O-N 3.47Å; I314-S317 WeakPolarHBondContact O-CB 3.42Å; I314-S317 PolarHBondContact O-N 2.92Å; I314-S317 PolarHBondContact O-OG 3.36Å; N315-S317 VanDerWaalsContact C-N 3.29Å; N315-S317 PolarHBondContact O-N 3.43Å; S317-R319 PolarHBondContact O-N 3.38Å; S317-Y320 PolarHBondContact O-N 3.3Å; S317-Y320 VanDerWaalsContact O-N 3.11Å
318	F	98.2	Very high	96.6	Very high	58 Å²	58	55.6 Å²	55.6	25%	0.254	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-68	-18.3	177.3	-61.4	-46.8	0	0	0	113.5	R75 M260 I314 N315 H316 Y320 T321	R75-F318 HydrophobicContact CB-CE1 3.79Å; R75-F318 HydrophobicContact CB-CZ 3.93Å; R75-F318 HydrophobicContact CG-CE1 3.8Å; R75-F318 HydrophobicContact CG-CZ 4.44Å; M260-F318 HydrophobicContact SD-CE1 3.7Å; M260-F318 HydrophobicContact SD-CZ 4.22Å; I314-F318 HydrophobicContact CG2-CE2 4.07Å; I314-F318 HydrophobicContact CG2-CZ 3.8Å; I314-F318 WeakPolarHBondContact O-CD2 3.33Å; N315-F318 PolarHBondContact O-N 3.14Å; H316-F318 PolarHBondContact O-N 3.32Å; H316-F318 VanDerWaalsContact O-N 3.12Å; F318-Y320 PolarHBondContact O-N 3.26Å; F318-T321 HydrophobicContact CB-CG2 4.39Å; F318-T321 HydrophobicContact CD1-CG2 4.3Å; F318-T321 WeakPolarHBondContact O-CB 3.41Å; F318-T321 VanDerWaalsContact O-CG2 3.23Å; F318-T321 WeakPolarHBondContact O-CG2 3.3Å; F318-T321 PolarHBondContact O-N 3.47Å; F318-T321 PolarHBondContact O-OG1 3.3Å
319	R	98	Very high	96.5	Very high	167 Å²	167	58.3 Å²	58.3	63%	0.63	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-61.8	-26.5	171.8	-66.6	176.9	170.4	167.6	-3.9	112.5	H316 S317 F322	H316-R319 PolarHBondContact CD2-NH1 3.12Å; H316-R319 PolarHBondContact NE2-NH1 3.22Å; H316-R319 VanDerWaalsContact O-CB 3.3Å; H316-R319 WeakPolarHBondContact O-CB 3.3Å; H316-R319 WeakPolarHBondContact O-CG 3.46Å; H316-R319 PolarHBondContact O-N 2.96Å; S317-R319 PolarHBondContact O-N 3.38Å; R319-F322 VanDerWaalsContact O-CD1 3.23Å; R319-F322 WeakPolarHBondContact O-CD1 3.22Å; R319-F322 WeakPolarHBondContact O-CE1 3.38Å
320	Y	98.1	Very high	96.5	Very high	17 Å²	17	65 Å²	65	7%	0.067	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-99.6	19.5	-178.7	-57.3	-74.1	0	0	0	113.2	Q219 R271 L274 S275 H316 S317 F318 F322 I323	Q219-Y320 PolarHBondContact NE2-OH 3.01Å; R271-Y320 WeakPolarHBondContact CD-O 3.5Å; R271-Y320 WeakPolarHBondContact CG-O 3.47Å; R271-Y320 PolarHBondContact NE-O 3.41Å; R271-Y320 VanDerWaalsContact NE-O 3.15Å; L274-Y320 HydrophobicContact CB-CD1 4.11Å; L274-Y320 HydrophobicContact CB-CD2 4.06Å; L274-Y320 HydrophobicContact CB-CE1 4.02Å; L274-Y320 HydrophobicContact CB-CE2 3.95Å; L274-Y320 HydrophobicContact CB-CG 4.15Å; L274-Y320 HydrophobicContact CD1-CD1 3.93Å; L274-Y320 HydrophobicContact CD1-CE1 4.37Å; L274-Y320 HydrophobicContact CD1-CG 4.26Å; S275-Y320 VanDerWaalsContact OG-CD2 3.3Å; S275-Y320 WeakPolarHBondContact OG-CD2 3.44Å; S275-Y320 VanDerWaalsContact OG-CE2 3.31Å; S275-Y320 WeakPolarHBondContact OG-CE2 3.45Å; H316-Y320 AromaticContact CE1-CE2 3.76Å; H316-Y320 AromaticContact ND1-CE2 3.84Å; S317-Y320 PolarHBondContact O-N 3.3Å; S317-Y320 VanDerWaalsContact O-N 3.11Å; F318-Y320 PolarHBondContact O-N 3.26Å; Y320-F322 HydrophobicContact CD1-CE1 4.16Å; Y320-F322 AromaticContact CD1-CZ 3.78Å; Y320-F322 HydrophobicContact CD1-CZ 3.78Å; Y320-F322 HydrophobicContact CE1-CZ 4.47Å; Y320-F322 PolarHBondContact O-N 3.5Å; Y320-F322 VanDerWaalsContact O-N 3.16Å; Y320-I323 HydrophobicContact CD1-CD1 4.37Å; Y320-I323 WeakPolarHBondContact O-CB 3.46Å; Y320-I323 PolarHBondContact O-N 3.34Å
321	T	96.5	Very high	96.5	Very high	55 Å²	55	65 Å²	65	34%	0.337	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.4	179.2	46.4	0	0	0	0	113.8	R271 F318 I323	R271-T321 PolarHBondContact NH2-O 2.87Å; F318-T321 HydrophobicContact CB-CG2 4.39Å; F318-T321 HydrophobicContact CD1-CG2 4.3Å; F318-T321 WeakPolarHBondContact O-CB 3.41Å; F318-T321 VanDerWaalsContact O-CG2 3.23Å; F318-T321 WeakPolarHBondContact O-CG2 3.3Å; F318-T321 PolarHBondContact O-N 3.47Å; F318-T321 PolarHBondContact O-OG1 3.3Å; T321-I323 PolarHBondContact O-N 3.06Å
322	F	96.3	Very high	96.5	Very high	96 Å²	96	61.9 Å²	61.9	42%	0.421	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.2	171.7	62.1	-103.1	0	0	0	113.5	Y218 R319 Y320 T324	Y218-F322 AromaticContact CD1-CE2 3.73Å; Y218-F322 HydrophobicContact CD1-CE2 3.73Å; Y218-F322 AromaticContact CD1-CZ 3.84Å; Y218-F322 HydrophobicContact CD1-CZ 3.84Å; Y218-F322 HydrophobicContact CD2-CE2 4.1Å; Y218-F322 HydrophobicContact CE1-CD2 4.17Å; Y218-F322 AromaticContact CE1-CE2 3.38Å; Y218-F322 HydrophobicContact CE1-CE2 3.38Å; Y218-F322 AromaticContact CE1-CZ 3.94Å; Y218-F322 HydrophobicContact CE1-CZ 3.94Å; Y218-F322 AromaticContact CE2-CE2 3.8Å; Y218-F322 HydrophobicContact CE2-CE2 3.8Å; Y218-F322 HydrophobicContact CG-CE2 4.07Å; Y218-F322 HydrophobicContact CG-CZ 4.16Å; Y218-F322 AromaticContact CZ-CE2 3.41Å; Y218-F322 VanDerWaalsContact CZ-CE2 3.41Å; R319-F322 VanDerWaalsContact O-CD1 3.23Å; R319-F322 WeakPolarHBondContact O-CD1 3.22Å; R319-F322 WeakPolarHBondContact O-CE1 3.38Å; Y320-F322 HydrophobicContact CD1-CE1 4.16Å; Y320-F322 AromaticContact CD1-CZ 3.78Å; Y320-F322 HydrophobicContact CD1-CZ 3.78Å; Y320-F322 HydrophobicContact CE1-CZ 4.47Å; Y320-F322 PolarHBondContact O-N 3.5Å; Y320-F322 VanDerWaalsContact O-N 3.16Å; F322-T324 VanDerWaalsContact O-CG2 3.29Å; F322-T324 WeakPolarHBondContact O-CG2 3.45Å; F322-T324 PolarHBondContact O-N 3.19Å; F322-T324 VanDerWaalsContact O-N 3.13Å
323	I	97.2	Very high	96.2	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.303	C	S	.	.			trans	-71	110.6	174.4	-60.3	179.5	0	0	0	108.1	L214 R271 L274 Y320 T321 L328	L214-I323 HydrophobicContact CD1-CD1 4.44Å; R271-I323 HydrophobicContact CG-CB 4.42Å; R271-I323 PolarHBondContact NE-O 3.38Å; R271-I323 PolarHBondContact NH2-O 3.02Å; L274-I323 HydrophobicContact CD1-CD1 3.09Å; Y320-I323 HydrophobicContact CD1-CD1 4.37Å; Y320-I323 WeakPolarHBondContact O-CB 3.46Å; Y320-I323 PolarHBondContact O-N 3.34Å; T321-I323 PolarHBondContact O-N 3.06Å; I323-L328 HydrophobicContact CG2-CD1 4.42Å; I323-L328 HydrophobicContact CG2-CD2 4.12Å; I323-L328 HydrophobicContact CG2-CG 4.2Å
324	T	95	Very high	95.9	Very high	56 Å²	56	69.6 Å²	69.6	34%	0.344	33%	0.326	S	S	.	.			trans	-102.4	164.1	-173.6	69.1	0	0	0	0	112.3	F322 Q326 E327 L328	F322-T324 VanDerWaalsContact O-CG2 3.29Å; F322-T324 WeakPolarHBondContact O-CG2 3.45Å; F322-T324 PolarHBondContact O-N 3.19Å; F322-T324 VanDerWaalsContact O-N 3.13Å; T324-Q326 PolarHBondContact O-N 3.03Å; T324-Q326 PolarHBondContact OG1-N 2.63Å; T324-E327 PolarHBondContact O-N 2.77Å; T324-E327 PolarHBondContact OG1-N 2.74Å; T324-E327 VanDerWaalsContact OG1-N 3.14Å; T324-L328 WeakPolarHBondContact O-CG 3.25Å; T324-L328 PolarHBondContact O-N 3.23Å
325	K	94.1	Very high	95.4	Very high	151 Å²	151	71 Å²	71	66%	0.657	33%	0.333	S	S	*	.	H	α-helix	trans	-59.1	-36.6	169.7	-177.7	-179.8	177.2	-177.5	0	111.2	L328 V329	K325-L328 PolarHBondContact O-N 2.89Å; K325-V329 HydrophobicContact CG-CG2 4.3Å; K325-V329 WeakPolarHBondContact O-CB 3.19Å; K325-V329 VanDerWaalsContact O-CG2 3.25Å; K325-V329 WeakPolarHBondContact O-CG2 3.44Å; K325-V329 PolarHBondContact O-N 2.86Å
326	Q	94.7	Very high	94.9	Very high	161 Å²	161	67.7 Å²	67.7	75%	0.752	32%	0.315	S	S	*	.	H	α-helix	trans	-65.8	-43.7	-178.7	-69.1	169.3	-14.4	0	0	111.6	T324 V329 K330	T324-Q326 PolarHBondContact O-N 3.03Å; T324-Q326 PolarHBondContact OG1-N 2.63Å; Q326-V329 PolarHBondContact O-N 3.15Å; Q326-K330 PolarHBondContact O-N 3.05Å
327	E	94.9	Very high	94.3	Very high	32 Å²	32	70.8 Å²	70.8	15%	0.15	33%	0.328	C	S	.	.	H	α-helix	trans	-60.7	-47.4	175.2	-179.8	171.5	-152	0	0	111.5	K217 Y218 T324 V329 K330 L331	K217-E327 IonicContact NZ-OE1 3.44Å; K217-E327 PolarHBondContact NZ-OE1 2.93Å; Y218-E327 PolarHBondContact OH-OE1 3.17Å; T324-E327 PolarHBondContact O-N 2.77Å; T324-E327 PolarHBondContact OG1-N 2.74Å; T324-E327 VanDerWaalsContact OG1-N 3.14Å; E327-V329 PolarHBondContact O-N 3.41Å; E327-K330 WeakPolarHBondContact O-CB 3.27Å; E327-K330 PolarHBondContact O-N 3.41Å; E327-L331 HydrophobicContact CG-CD1 4.09Å; E327-L331 WeakPolarHBondContact O-CG 3.48Å; E327-L331 PolarHBondContact O-N 3.42Å
328	L	96.2	Very high	93.5	Very high	12 Å²	12	74.8 Å²	74.8	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-40.1	178.5	-64.5	177.2	0	0	0	112.4	I210 L214 V266 K267 F270 I323 T324 K325 K330 L331 Y332	I210-L328 HydrophobicContact CG2-CD2 3.79Å; L214-L328 HydrophobicContact CD1-CD2 3.85Å; V266-L328 HydrophobicContact CG1-CD1 4.48Å; K267-L328 HydrophobicContact CB-CD1 3.55Å; F270-L328 HydrophobicContact CD1-CD2 4.14Å; F270-L328 HydrophobicContact CD2-CD1 3.69Å; F270-L328 HydrophobicContact CD2-CD2 4.09Å; F270-L328 HydrophobicContact CE1-CD2 4.17Å; F270-L328 HydrophobicContact CE2-CD1 3.87Å; F270-L328 HydrophobicContact CE2-CD2 4.13Å; F270-L328 HydrophobicContact CG-CD1 4.34Å; F270-L328 HydrophobicContact CG-CD2 4.08Å; F270-L328 HydrophobicContact CZ-CD2 4.16Å; I323-L328 HydrophobicContact CG2-CD1 4.42Å; I323-L328 HydrophobicContact CG2-CD2 4.12Å; I323-L328 HydrophobicContact CG2-CG 4.2Å; T324-L328 WeakPolarHBondContact O-CG 3.25Å; T324-L328 PolarHBondContact O-N 3.23Å; K325-L328 PolarHBondContact O-N 2.89Å; L328-K330 VanDerWaalsContact C-N 3.34Å; L328-K330 PolarHBondContact O-N 3.49Å; L328-L331 PolarHBondContact O-N 3.21Å; L328-Y332 VanDerWaalsContact O-CB 3.27Å; L328-Y332 WeakPolarHBondContact O-CB 3.1Å; L328-Y332 PolarHBondContact O-N 3.41Å
329	V	94.3	Very high	92.7	Very high	57 Å²	57	76.5 Å²	76.5	35%	0.345	37%	0.367	S	S	.	.	H	α-helix	trans	-63.5	-40.1	175.5	168.6	0	0	0	0	111.2	K325 Q326 E327 Y332 R333	K325-V329 HydrophobicContact CG-CG2 4.3Å; K325-V329 WeakPolarHBondContact O-CB 3.19Å; K325-V329 VanDerWaalsContact O-CG2 3.25Å; K325-V329 WeakPolarHBondContact O-CG2 3.44Å; K325-V329 PolarHBondContact O-N 2.86Å; Q326-V329 PolarHBondContact O-N 3.15Å; E327-V329 PolarHBondContact O-N 3.41Å; V329-Y332 PolarHBondContact O-N 3Å; V329-R333 WeakPolarHBondContact O-CG 3.29Å; V329-R333 PolarHBondContact O-N 3.29Å
330	K	94.5	Very high	91.6	Very high	164 Å²	164	71.6 Å²	71.6	71%	0.713	37%	0.368	S	S	*	.	H	α-helix	trans	-62.2	-47.6	175.7	-176.5	-179.3	178.1	179.8	0	111.2	Q326 E327 L328 Y332 R333 S334	Q326-K330 PolarHBondContact O-N 3.05Å; E327-K330 WeakPolarHBondContact O-CB 3.27Å; E327-K330 PolarHBondContact O-N 3.41Å; L328-K330 VanDerWaalsContact C-N 3.34Å; L328-K330 PolarHBondContact O-N 3.49Å; K330-Y332 VanDerWaalsContact C-N 3.34Å; K330-Y332 PolarHBondContact O-N 2.98Å; K330-R333 PolarHBondContact O-N 3.31Å; K330-S334 PolarHBondContact O-N 2.83Å; K330-S334 VanDerWaalsContact O-N 3.09Å
331	L	94.4	Very high	90.4	Very high	44 Å²	44	75.8 Å²	75.8	23%	0.23	39%	0.391	C	S	.	.	H	α-helix	trans	-63.5	-40.5	177.7	-68.3	170.6	0	0	0	111.5	I210 L214 E327 L328 R333 S334 Q335	I210-L331 HydrophobicContact CD1-CB 4.18Å; I210-L331 HydrophobicContact CG1-CB 3.96Å; I210-L331 HydrophobicContact CG2-CB 3.95Å; I210-L331 HydrophobicContact CG2-CD1 3.81Å; L214-L331 HydrophobicContact CD2-CD1 3.89Å; L214-L331 HydrophobicContact CG-CD1 4.27Å; E327-L331 HydrophobicContact CG-CD1 4.09Å; E327-L331 WeakPolarHBondContact O-CG 3.48Å; E327-L331 PolarHBondContact O-N 3.42Å; L328-L331 PolarHBondContact O-N 3.21Å; L331-R333 PolarHBondContact O-N 3.33Å; L331-S334 WeakPolarHBondContact O-CB 3.32Å; L331-S334 PolarHBondContact O-N 3.43Å; L331-Q335 WeakPolarHBondContact O-CG 3.46Å; L331-Q335 PolarHBondContact O-N 3.28Å
332	Y	93.6	Very high	88.8	Confident	49 Å²	49	75.8 Å²	75.8	19%	0.192	39%	0.388	C	S	.	.	H	α-helix	trans	-60.8	-46.2	176.5	-167.8	-96.7	0	0	0	112.7	R203 I206 I210 L328 V329 K330 S334 Q335 L336	R203-Y332 VanDerWaalsContact CD-OH 3.29Å; R203-Y332 WeakPolarHBondContact CD-OH 3.47Å; I206-Y332 HydrophobicContact CB-CD2 4.32Å; I206-Y332 HydrophobicContact CB-CE2 3.91Å; I206-Y332 HydrophobicContact CD1-CE2 4.14Å; I206-Y332 HydrophobicContact CG2-CD2 3.33Å; I206-Y332 HydrophobicContact CG2-CE2 3.39Å; I206-Y332 HydrophobicContact CG2-CG 4.24Å; I210-Y332 HydrophobicContact CD1-CD2 3.93Å; I210-Y332 HydrophobicContact CD1-CG 4.41Å; L328-Y332 VanDerWaalsContact O-CB 3.27Å; L328-Y332 WeakPolarHBondContact O-CB 3.1Å; L328-Y332 PolarHBondContact O-N 3.41Å; V329-Y332 PolarHBondContact O-N 3Å; K330-Y332 VanDerWaalsContact C-N 3.34Å; K330-Y332 PolarHBondContact O-N 2.98Å; Y332-S334 VanDerWaalsContact C-N 3.29Å; Y332-S334 PolarHBondContact O-N 3.15Å; Y332-Q335 PolarHBondContact O-N 3.32Å; Y332-L336 HydrophobicContact CD1-CD1 3.77Å; Y332-L336 HydrophobicContact CD1-CG 4.21Å; Y332-L336 HydrophobicContact CE1-CD1 3.42Å; Y332-L336 VanDerWaalsContact CE1-CD1 3.42Å; Y332-L336 HydrophobicContact CE1-CD2 4.41Å; Y332-L336 HydrophobicContact CE1-CG 3.92Å; Y332-L336 PolarHBondContact O-N 3.16Å
333	R	92.1	Very high	86.4	Confident	159 Å²	159	74.5 Å²	74.5	60%	0.6	39%	0.391	S	S	*	.	H	α-helix	trans	-61	-38.9	174.5	-72	176.7	179.8	-178.5	-1.3	112.2	V329 K330 L331 L336 K337	V329-R333 WeakPolarHBondContact O-CG 3.29Å; V329-R333 PolarHBondContact O-N 3.29Å; K330-R333 PolarHBondContact O-N 3.31Å; L331-R333 PolarHBondContact O-N 3.33Å; R333-L336 PolarHBondContact O-N 3.27Å; R333-K337 WeakPolarHBondContact O-CG 3.26Å; R333-K337 PolarHBondContact O-N 2.87Å; R333-K337 VanDerWaalsContact O-N 3.15Å
334	S	91.3	Very high	84.3	Confident	71 Å²	71	79.7 Å²	79.7	50%	0.497	43%	0.428	S	S	.	.	H	α-helix	trans	-61.7	-43.3	176	-166.2	0	0	0	0	112	K330 L331 Y332 K337 S338	K330-S334 PolarHBondContact O-N 2.83Å; K330-S334 VanDerWaalsContact O-N 3.09Å; L331-S334 WeakPolarHBondContact O-CB 3.32Å; L331-S334 PolarHBondContact O-N 3.43Å; Y332-S334 VanDerWaalsContact C-N 3.29Å; Y332-S334 PolarHBondContact O-N 3.15Å; S334-K337 PolarHBondContact O-N 2.95Å; S334-S338 PolarHBondContact O-N 2.88Å; S334-S338 VanDerWaalsContact O-N 3.14Å
335	Q	89.5	Confident	82.2	Confident	31 Å²	31	81.8 Å²	81.8	15%	0.145	45%	0.445	C	S	.	.	H	α-helix	trans	-70.2	-36.3	179	-67.4	-69.3	-23.7	0	0	112.5	I206 I210 L331 Y332 K337 S338 I339	I206-Q335 HydrophobicContact CG1-CB 4.47Å; I206-Q335 HydrophobicContact CG2-CB 3.6Å; I206-Q335 HydrophobicContact CG2-CG 4.13Å; I210-Q335 HydrophobicContact CG1-CG 4.02Å; L331-Q335 WeakPolarHBondContact O-CG 3.46Å; L331-Q335 PolarHBondContact O-N 3.28Å; Y332-Q335 PolarHBondContact O-N 3.32Å; Q335-K337 VanDerWaalsContact C-N 3.29Å; Q335-K337 PolarHBondContact O-N 3.32Å; Q335-S338 WeakPolarHBondContact CA-OG 3.43Å; Q335-S338 PolarHBondContact O-N 3.45Å; Q335-S338 PolarHBondContact O-OG 3.14Å; Q335-I339 WeakPolarHBondContact O-CG1 3.46Å; Q335-I339 PolarHBondContact O-N 3.07Å
336	L	87.4	Confident	79.9	Confident	22 Å²	22	77.3 Å²	77.3	12%	0.115	43%	0.433	C	S	.	.	H	α-helix	trans	-63.7	-36.4	173.7	-76.1	179	0	0	0	112.5	I206 Y332 R333 G340 L341 I342	I206-L336 HydrophobicContact CD1-CD2 3.47Å; I206-L336 VanDerWaalsContact CD1-CD2 3.47Å; I206-L336 HydrophobicContact CD1-CG 4.16Å; Y332-L336 HydrophobicContact CD1-CD1 3.77Å; Y332-L336 HydrophobicContact CD1-CG 4.21Å; Y332-L336 HydrophobicContact CE1-CD1 3.42Å; Y332-L336 VanDerWaalsContact CE1-CD1 3.42Å; Y332-L336 HydrophobicContact CE1-CD2 4.41Å; Y332-L336 HydrophobicContact CE1-CG 3.92Å; Y332-L336 PolarHBondContact O-N 3.16Å; R333-L336 PolarHBondContact O-N 3.27Å; L336-G340 PolarHBondContact O-N 3Å; L336-L341 HydrophobicContact CD2-CB 3.92Å; L336-L341 HydrophobicContact CD2-CD1 3.74Å; L336-L341 HydrophobicContact CD2-CG 4.49Å; L336-L341 PolarHBondContact O-N 3.18Å; L336-I342 HydrophobicContact CB-CB 4.41Å; L336-I342 HydrophobicContact CB-CD1 3.76Å; L336-I342 HydrophobicContact CB-CG1 3.95Å; L336-I342 HydrophobicContact CD1-CD1 3.41Å; L336-I342 VanDerWaalsContact CD1-CD1 3.41Å; L336-I342 HydrophobicContact CD1-CG1 4.11Å; L336-I342 HydrophobicContact CG-CD1 4.25Å
337	K	84.5	Confident	77.2	Confident	80 Å²	80	77.8 Å²	77.8	35%	0.348	45%	0.453	S	S	.	.	H	α-helix	trans	-67.2	-41.3	174.7	-72.1	-177.1	179.6	-164.3	0	111.8	R333 S334 Q335 I339 G340 I342 S346	R333-K337 WeakPolarHBondContact O-CG 3.26Å; R333-K337 PolarHBondContact O-N 2.87Å; R333-K337 VanDerWaalsContact O-N 3.15Å; S334-K337 PolarHBondContact O-N 2.95Å; Q335-K337 VanDerWaalsContact C-N 3.29Å; Q335-K337 PolarHBondContact O-N 3.32Å; K337-I339 VanDerWaalsContact C-N 3.29Å; K337-I339 PolarHBondContact O-N 3.44Å; K337-G340 PolarHBondContact O-N 3.39Å; K337-I342 HydrophobicContact CG-CB 4.27Å; K337-I342 HydrophobicContact CG-CG2 4.27Å; K337-S346 WeakPolarHBondContact CE-O 3.24Å; K337-S346 PolarHBondContact NZ-O 2.73Å
338	S	82.2	Confident	76.3	Confident	88 Å²	88	80.1 Å²	80.1	62%	0.615	47%	0.469	S	S	*	.	H	α-helix	trans	-67.5	-28	-180	61.1	0	0	0	0	113.6	S334 Q335	S334-S338 PolarHBondContact O-N 2.88Å; S334-S338 VanDerWaalsContact O-N 3.14Å; Q335-S338 WeakPolarHBondContact CA-OG 3.43Å; Q335-S338 PolarHBondContact O-N 3.45Å; Q335-S338 PolarHBondContact O-OG 3.14Å
339	I	82	Confident	75.3	Confident	95 Å²	95	83.6 Å²	83.6	49%	0.487	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-3	177.4	-55.2	164.1	0	0	0	111.7	I206 Q335 K337 L341	I206-I339 HydrophobicContact CD1-CD1 4.31Å; I206-I339 HydrophobicContact CG1-CD1 3.85Å; Q335-I339 WeakPolarHBondContact O-CG1 3.46Å; Q335-I339 PolarHBondContact O-N 3.07Å; K337-I339 VanDerWaalsContact C-N 3.29Å; K337-I339 PolarHBondContact O-N 3.44Å; I339-L341 HydrophobicContact CG2-CD1 4.49Å; I339-L341 HydrophobicContact CG2-CG 4.49Å
340	G	74.2	Confident	74.2	Confident	63 Å²	63	85.1 Å²	85.1	65%	0.649	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	16.2	177.5	0	0	0	0	0	115.3	L336 K337	L336-G340 PolarHBondContact O-N 3Å; K337-G340 PolarHBondContact O-N 3.39Å
341	L	72.7	Confident	73.1	Confident	105 Å²	105	80.5 Å²	80.5	55%	0.55	49%	0.485	S	S	.	.	S	Bend	trans	-85.8	-12.4	178.8	-69.9	174.9	0	0	0	113.7	V202 L336 I339	V202-L341 HydrophobicContact CG1-CD1 3.93Å; L336-L341 HydrophobicContact CD2-CB 3.92Å; L336-L341 HydrophobicContact CD2-CD1 3.74Å; L336-L341 HydrophobicContact CD2-CG 4.49Å; L336-L341 PolarHBondContact O-N 3.18Å; I339-L341 HydrophobicContact CG2-CD1 4.49Å; I339-L341 HydrophobicContact CG2-CG 4.49Å
342	I	62.7	Low	71.7	Confident	55 Å²	55	82.8 Å²	82.8	28%	0.282	50%	0.501	S	S	.	.	S	Bend	trans	-133.7	134.9	173.8	-67.1	-178.5	0	0	0	108.7	L336 K337 S346	L336-I342 HydrophobicContact CB-CB 4.41Å; L336-I342 HydrophobicContact CB-CD1 3.76Å; L336-I342 HydrophobicContact CB-CG1 3.95Å; L336-I342 HydrophobicContact CD1-CD1 3.41Å; L336-I342 VanDerWaalsContact CD1-CD1 3.41Å; L336-I342 HydrophobicContact CD1-CG1 4.11Å; L336-I342 HydrophobicContact CG-CD1 4.25Å; K337-I342 HydrophobicContact CG-CB 4.27Å; K337-I342 HydrophobicContact CG-CG2 4.27Å; I342-S346 WeakPolarHBondContact CG2-OG 3.36Å
343	S	47.9	Very low	70.3	Confident	69 Å²	69	85 Å²	85	48%	0.483	52%	0.522	S	S	.	.			trans	-63.6	143.4	176.6	72	0	0	0	0	111.8	S345 S346	S343-S345 PolarHBondContact O-N 3.4Å; S343-S345 VanDerWaalsContact O-N 3.15Å; S343-S345 PolarHBondContact OG-OG 3.44Å; S343-S345 VanDerWaalsContact OG-OG 3.11Å; S343-S346 PolarHBondContact O-N 3.03Å; S343-S346 PolarHBondContact O-OG 3.16Å
344	S	52.9	Low	68.7	Low	109 Å²	109	79.7 Å²	79.7	76%	0.762	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.7	176.1	46.9	0	0	0	0	113.4	S346	S344-S346 VanDerWaalsContact C-N 3.34Å; S344-S346 PolarHBondContact O-N 3.13Å
345	S	50.7	Low	67	Low	100 Å²	100	80.4 Å²	80.4	70%	0.699	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.8	-177.6	52.3	0	0	0	0	116	S343	S343-S345 PolarHBondContact O-N 3.4Å; S343-S345 VanDerWaalsContact O-N 3.15Å; S343-S345 PolarHBondContact OG-OG 3.44Å; S343-S345 VanDerWaalsContact OG-OG 3.11Å
346	S	44.3	Very low	65.1	Low	58 Å²	58	84.5 Å²	84.5	41%	0.406	55%	0.549	S	S	.	.			trans	-95.3	95.7	174.5	53.1	0	0	0	0	110.3	K337 I342 S343 S344	K337-S346 WeakPolarHBondContact CE-O 3.24Å; K337-S346 PolarHBondContact NZ-O 2.73Å; I342-S346 WeakPolarHBondContact CG2-OG 3.36Å; S343-S346 PolarHBondContact O-N 3.03Å; S343-S346 PolarHBondContact O-OG 3.16Å; S344-S346 VanDerWaalsContact C-N 3.34Å; S344-S346 PolarHBondContact O-N 3.13Å
347	S	39.5	Very low	63.1	Low	170 Å²	170	90.2 Å²	90.2	100%	1.189	59%	0.588	S	S	*	*			trans	-129.4	0	171.9	49.7	0	0	0	0	107.7

Retrieved 347 of 347 residues in 887.9 ms (Link to these results)

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