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14-3-3-like protein GF14 psi

Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes^1,2,3. Involved in the regulation of nutrient metabolism^4,5. Reciprocal negative transcription regulation of miR396⁶. Negative regulator of constitutive freezing tolerance and cold acclimation by controlling cold-induced gene expression partially through an ethylene (ET)-dependent pathway; prevents ethylene (ET) biosynthesis, probably by binding 1-aminocyclopropane-1-carboxylate synthases (ACS) to reduce their stability, thus contributing to establish adequate ET levels under both standard and low-temperature conditions⁷.

AlphaFold DB , UniProt , Accession P42644, Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene GRF3, Length 255 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	64.6	Low	93.2	Very high	147 Å²	147	70.4 Å²	70.4	72%	0.724	35%	0.352	S	S	*	.				0	128.3	0	-161.3	173.9	-84.2	0	0	105.8	E5 E6	M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; M1-E5 HydrophobicContact CG-CB 3.38Å; M1-E5 HydrophobicContact CG-CG 4.47Å; M1-E5 WeakPolarHBondContact CG-OE2 3.35Å; M1-E5 HydrophobicContact SD-CB 4.35Å; M1-E6 HydrophobicContact CB-CG 3.87Å; M1-E6 HydrophobicContact CG-CG 3.64Å; M1-E6 HydrophobicContact SD-CB 4.23Å; M1-E6 HydrophobicContact SD-CG 3.55Å; M1-E6 VanDerWaalsContact SD-CG 3.55Å
2	S	87.6	Confident	93.7	Very high	58 Å²	58	69.5 Å²	69.5	41%	0.406	34%	0.344	S	S	.	.			trans	-68.8	158.8	173	74.5	0	0	0	0	109.7	R4 E5 E6	S2-R4 PolarHBondContact O-N 3.21Å; S2-E5 PolarHBondContact N-OE2 3.48Å; S2-E5 PolarHBondContact O-N 3.06Å; S2-E5 VanDerWaalsContact O-N 3.14Å; S2-E5 WeakPolarHBondContact OG-CG 3.35Å; S2-E5 PolarHBondContact OG-N 3.16Å; S2-E6 WeakPolarHBondContact O-CG 3.48Å; S2-E6 PolarHBondContact O-N 3.48Å
3	T	93.2	Very high	94.1	Very high	102 Å²	102	69.4 Å²	69.4	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-58.6	-29.3	175.8	-54.8	0	0	0	0	112.2	N7	T3-N7 PolarHBondContact O-N 3.3Å; T3-N7 VanDerWaalsContact O-N 3.16Å; T3-N7 PolarHBondContact O-ND2 3.27Å
4	R	95.6	Very high	94.4	Very high	27 Å²	27	64.9 Å²	64.9	10%	0.102	33%	0.325	C	S	.	.	H	α-helix	trans	-67.9	-49.9	174.2	-176.4	172.3	177.5	157.5	-18.6	111.4	S2 E6 N7 V8 V30 T33 E37 E38 E43	S2-R4 PolarHBondContact O-N 3.21Å; R4-E6 VanDerWaalsContact C-N 3.29Å; R4-E6 PolarHBondContact O-N 2.99Å; R4-N7 PolarHBondContact O-N 3.43Å; R4-V8 WeakPolarHBondContact O-CG2 3.41Å; R4-V8 PolarHBondContact O-N 3.09Å; R4-V30 HydrophobicContact CG-CG1 4.07Å; R4-V30 HydrophobicContact CG-CG2 4.43Å; R4-T33 PolarHBondContact NH1-OG1 3.22Å; R4-E37 PolarHBondContact NH1-O 2.93Å; R4-E38 PolarHBondContact NH2-O 3.46Å; R4-E43 IonicContact CZ-OE1 2.69Å; R4-E43 IonicContact CZ-OE2 3.53Å; R4-E43 IonicContact NE-OE1 2.87Å; R4-E43 PolarHBondContact NE-OE1 3.19Å; R4-E43 IonicContact NE-OE2 2.61Å; R4-E43 IonicContact NH2-OE1 2.65Å; R4-E43 PolarHBondContact NH2-OE1 2.87Å; R4-E43 IonicContact NH2-OE2 2.97Å; R4-E43 PolarHBondContact NH2-OE2 3.29Å
5	E	95.7	Very high	94.6	Very high	110 Å²	110	65.3 Å²	65.3	51%	0.514	33%	0.325	S	S	.	.	H	α-helix	trans	-58.6	-39.9	176.6	-72	169	175.7	0	0	112.1	M1 S2 V8 Y9	M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; M1-E5 HydrophobicContact CG-CB 3.38Å; M1-E5 HydrophobicContact CG-CG 4.47Å; M1-E5 WeakPolarHBondContact CG-OE2 3.35Å; M1-E5 HydrophobicContact SD-CB 4.35Å; S2-E5 PolarHBondContact N-OE2 3.48Å; S2-E5 PolarHBondContact O-N 3.06Å; S2-E5 VanDerWaalsContact O-N 3.14Å; S2-E5 WeakPolarHBondContact OG-CG 3.35Å; S2-E5 PolarHBondContact OG-N 3.16Å; E5-V8 PolarHBondContact O-N 3.41Å; E5-Y9 WeakPolarHBondContact O-CB 3.36Å; E5-Y9 PolarHBondContact O-N 2.97Å
6	E	97.3	Very high	94.9	Very high	93 Å²	93	71.4 Å²	71.4	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-46.4	175.6	-72.2	174.9	171.1	0	0	111.5	M1 S2 R4 Y9 M10	M1-E6 HydrophobicContact CB-CG 3.87Å; M1-E6 HydrophobicContact CG-CG 3.64Å; M1-E6 HydrophobicContact SD-CB 4.23Å; M1-E6 HydrophobicContact SD-CG 3.55Å; M1-E6 VanDerWaalsContact SD-CG 3.55Å; S2-E6 WeakPolarHBondContact O-CG 3.48Å; S2-E6 PolarHBondContact O-N 3.48Å; R4-E6 VanDerWaalsContact C-N 3.29Å; R4-E6 PolarHBondContact O-N 2.99Å; E6-Y9 PolarHBondContact O-N 3.37Å; E6-M10 WeakPolarHBondContact O-CB 3.2Å; E6-M10 VanDerWaalsContact O-CG 3.27Å; E6-M10 WeakPolarHBondContact O-CG 3.23Å; E6-M10 PolarHBondContact O-N 2.88Å
7	N	98.1	Very high	95	Very high	18 Å²	18	70.8 Å²	70.8	10%	0.096	36%	0.361	C	S	.	.	H	α-helix	trans	-66.5	-39.6	178.1	-75	-62.9	0	0	0	112.1	T3 R4 Y9 M10 A11 F26 K29 V30	T3-N7 PolarHBondContact O-N 3.3Å; T3-N7 VanDerWaalsContact O-N 3.16Å; T3-N7 PolarHBondContact O-ND2 3.27Å; R4-N7 PolarHBondContact O-N 3.43Å; N7-Y9 VanDerWaalsContact C-N 3.34Å; N7-Y9 PolarHBondContact O-N 3.33Å; N7-M10 PolarHBondContact O-N 2.97Å; N7-A11 WeakPolarHBondContact O-CB 3.25Å; N7-A11 PolarHBondContact O-N 2.98Å; N7-F26 HydrophobicContact CB-CB 4.38Å; N7-K29 VanDerWaalsContact OD1-CD 3.27Å; N7-K29 WeakPolarHBondContact OD1-CD 3.48Å; N7-V30 HydrophobicContact CB-CG2 3.55Å
8	V	98.2	Very high	95.2	Very high	14 Å²	14	75.1 Å²	75.1	9%	0.085	38%	0.38	C	S	.	.	H	α-helix	trans	-62.7	-42.7	175	173.3	0	0	0	0	110.9	R4 E5 A11 K12 V30 E43 L46	R4-V8 WeakPolarHBondContact O-CG2 3.41Å; R4-V8 PolarHBondContact O-N 3.09Å; E5-V8 PolarHBondContact O-N 3.41Å; V8-A11 PolarHBondContact O-N 3.3Å; V8-K12 HydrophobicContact CG1-CD 4.46Å; V8-K12 WeakPolarHBondContact O-CG 3.39Å; V8-K12 PolarHBondContact O-N 2.75Å; V8-V30 HydrophobicContact CG2-CG1 4.19Å; V8-V30 HydrophobicContact CG2-CG2 3.79Å; V8-E43 HydrophobicContact CG2-CG 3.84Å; V8-L46 HydrophobicContact CG1-CD1 4Å
9	Y	98.3	Very high	95.4	Very high	128 Å²	128	78.3 Å²	78.3	50%	0.502	39%	0.387	S	S	.	.	H	α-helix	trans	-62.6	-45.1	175.7	-179.7	-111.1	0	0	0	111.8	E5 E6 N7 A11 K12 L13	E5-Y9 WeakPolarHBondContact O-CB 3.36Å; E5-Y9 PolarHBondContact O-N 2.97Å; E6-Y9 PolarHBondContact O-N 3.37Å; N7-Y9 VanDerWaalsContact C-N 3.34Å; N7-Y9 PolarHBondContact O-N 3.33Å; Y9-A11 VanDerWaalsContact C-N 3.34Å; Y9-A11 PolarHBondContact O-N 2.88Å; Y9-K12 PolarHBondContact O-N 3.16Å; Y9-L13 HydrophobicContact CD1-CD1 4.06Å; Y9-L13 HydrophobicContact CE1-CD1 3.54Å; Y9-L13 HydrophobicContact CE1-CG 4.17Å; Y9-L13 HydrophobicContact CE2-CG 4.5Å; Y9-L13 PolarHBondContact O-N 2.74Å
10	M	98.5	Very high	95.5	Very high	77 Å²	77	76.7 Å²	76.7	38%	0.379	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-37.2	176.4	-71.1	-58.8	-61.2	0	0	112.6	E6 N7 L13 A14 F26	E6-M10 WeakPolarHBondContact O-CB 3.2Å; E6-M10 VanDerWaalsContact O-CG 3.27Å; E6-M10 WeakPolarHBondContact O-CG 3.23Å; E6-M10 PolarHBondContact O-N 2.88Å; N7-M10 PolarHBondContact O-N 2.97Å; M10-L13 PolarHBondContact O-N 2.99Å; M10-L13 HydrophobicContact SD-CD1 4.09Å; M10-A14 WeakPolarHBondContact O-CB 3.4Å; M10-A14 PolarHBondContact O-N 3.16Å; M10-F26 HydrophobicContact CB-CD1 3.73Å; M10-F26 HydrophobicContact CB-CD2 3.7Å; M10-F26 HydrophobicContact CB-CE1 3.71Å; M10-F26 HydrophobicContact CB-CE2 3.68Å; M10-F26 HydrophobicContact CB-CG 3.76Å; M10-F26 HydrophobicContact CB-CZ 3.7Å; M10-F26 HydrophobicContact CE-CE1 4.31Å; M10-F26 HydrophobicContact CE-CE2 4.1Å; M10-F26 HydrophobicContact CE-CZ 3.63Å; M10-F26 HydrophobicContact CG-CD1 4.47Å; M10-F26 HydrophobicContact CG-CE1 4.13Å; M10-F26 HydrophobicContact CG-CZ 4.24Å
11	A	98.6	Very high	95.6	Very high	0 Å²	0	77.7 Å²	77.7	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62.3	-41.7	173.9	0	0	0	0	0	111.9	N7 V8 Y9 A14 E15 M23 F26 M27	N7-A11 WeakPolarHBondContact O-CB 3.25Å; N7-A11 PolarHBondContact O-N 2.98Å; V8-A11 PolarHBondContact O-N 3.3Å; Y9-A11 VanDerWaalsContact C-N 3.34Å; Y9-A11 PolarHBondContact O-N 2.88Å; A11-A14 PolarHBondContact O-N 3.31Å; A11-E15 WeakPolarHBondContact O-CB 3.26Å; A11-E15 PolarHBondContact O-N 3.47Å; A11-M23 HydrophobicContact CB-CG 4.05Å; A11-F26 HydrophobicContact CB-CB 4.05Å; A11-M27 HydrophobicContact CB-CG 3.78Å; A11-M27 HydrophobicContact CB-SD 3.53Å; A11-M27 VanDerWaalsContact CB-SD 3.53Å
12	K	98.5	Very high	97.2	Very high	60 Å²	60	73.1 Å²	73.1	26%	0.261	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-39	175	-69.8	174	179.2	-177.9	0	112.3	V8 Y9 Q16 E42 L46	V8-K12 HydrophobicContact CG1-CD 4.46Å; V8-K12 WeakPolarHBondContact O-CG 3.39Å; V8-K12 PolarHBondContact O-N 2.75Å; Y9-K12 PolarHBondContact O-N 3.16Å; K12-Q16 WeakPolarHBondContact O-CG 3.44Å; K12-Q16 PolarHBondContact O-N 3.49Å; K12-Q16 VanDerWaalsContact O-N 3.15Å; K12-E42 WeakPolarHBondContact CE-OE1 2.88Å; K12-E42 IonicContact NZ-OE1 3.29Å; K12-E42 PolarHBondContact NZ-OE1 2.73Å; K12-E42 IonicContact NZ-OE2 3.46Å; K12-E42 PolarHBondContact NZ-OE2 3.3Å; K12-L46 HydrophobicContact CG-CD1 4.09Å; K12-L46 HydrophobicContact CG-CD2 4.18Å
13	L	98.6	Very high	97.8	Very high	68 Å²	68	70.3 Å²	70.3	36%	0.356	34%	0.338	S	S	.	.	H	α-helix	trans	-65.6	-42.1	173.5	-68.3	-179.6	0	0	0	111.7	Y9 M10 Q16 A17	Y9-L13 HydrophobicContact CD1-CD1 4.06Å; Y9-L13 HydrophobicContact CE1-CD1 3.54Å; Y9-L13 HydrophobicContact CE1-CG 4.17Å; Y9-L13 HydrophobicContact CE2-CG 4.5Å; Y9-L13 PolarHBondContact O-N 2.74Å; M10-L13 PolarHBondContact O-N 2.99Å; M10-L13 HydrophobicContact SD-CD1 4.09Å; L13-Q16 PolarHBondContact O-N 3.06Å; L13-A17 WeakPolarHBondContact O-CB 3.43Å; L13-A17 PolarHBondContact O-N 2.91Å; L13-A17 VanDerWaalsContact O-N 3.11Å
14	A	98.6	Very high	98	Very high	7 Å²	7	66.2 Å²	66.2	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-40.3	177.1	0	0	0	0	0	111.8	M10 A11 A17 E18 R19 E22 M23 F26	M10-A14 WeakPolarHBondContact O-CB 3.4Å; M10-A14 PolarHBondContact O-N 3.16Å; A11-A14 PolarHBondContact O-N 3.31Å; A14-A17 CarbonylContact O-C 3.45Å; A14-A17 PolarHBondContact O-N 3.3Å; A14-E18 PolarHBondContact O-N 3.26Å; A14-R19 HydrophobicContact CB-CB 4.44Å; A14-R19 PolarHBondContact O-N 3.2Å; A14-E22 HydrophobicContact CB-CB 4.3Å; A14-M23 HydrophobicContact CB-CB 3.99Å; A14-F26 HydrophobicContact CB-CD2 4.39Å; A14-F26 HydrophobicContact CB-CE2 4.38Å
15	E	98.3	Very high	98.1	Very high	71 Å²	71	70.2 Å²	70.2	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-58.4	-49.5	173.7	-176.4	-178.3	-162.3	0	0	111.7	A11 A17 E18 M23 L46	A11-E15 WeakPolarHBondContact O-CB 3.26Å; A11-E15 PolarHBondContact O-N 3.47Å; E15-A17 PolarHBondContact O-N 3.4Å; E15-E18 PolarHBondContact O-N 3.03Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.89Å; E15-M23 HydrophobicContact CG-CE 4.21Å; E15-M23 HydrophobicContact CG-SD 4.35Å; E15-L46 WeakPolarHBondContact OE2-CD2 3.4Å
16	Q	98	Very high	98.3	Very high	162 Å²	162	66.3 Å²	66.3	76%	0.757	31%	0.313	S	S	*	.	H	α-helix	trans	-63.8	-26.2	178.6	-70.7	177.5	28.1	0	0	113.2	K12 L13	K12-Q16 WeakPolarHBondContact O-CG 3.44Å; K12-Q16 PolarHBondContact O-N 3.49Å; K12-Q16 VanDerWaalsContact O-N 3.15Å; L13-Q16 PolarHBondContact O-N 3.06Å
17	A	98.1	Very high	98.3	Very high	62 Å²	62	61.9 Å²	61.9	51%	0.512	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4.3	176.2	0	0	0	0	0	113.3	L13 A14 E15 R19	L13-A17 WeakPolarHBondContact O-CB 3.43Å; L13-A17 PolarHBondContact O-N 2.91Å; L13-A17 VanDerWaalsContact O-N 3.11Å; A14-A17 CarbonylContact O-C 3.45Å; A14-A17 PolarHBondContact O-N 3.3Å; E15-A17 PolarHBondContact O-N 3.4Å; A17-R19 HydrophobicContact CB-CG 3.98Å; A17-R19 WeakPolarHBondContact O-CG 3.45Å; A17-R19 PolarHBondContact O-N 3.17Å; A17-R19 VanDerWaalsContact O-N 3.17Å
18	E	97.9	Very high	98.3	Very high	147 Å²	147	63 Å²	63	69%	0.687	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	28.7	-175.3	-56.8	-176.1	169.3	0	0	113.8	A14 E15 Y20	A14-E18 PolarHBondContact O-N 3.26Å; E15-E18 PolarHBondContact O-N 3.03Å; E18-Y20 HydrophobicContact CB-CE2 3.96Å; E18-Y20 HydrophobicContact CG-CE2 4.47Å; E18-Y20 WeakPolarHBondContact O-CD2 3.38Å; E18-Y20 PolarHBondContact O-N 2.8Å
19	R	98.4	Very high	98.3	Very high	136 Å²	136	67 Å²	67	51%	0.513	31%	0.314	S	S	.	.			trans	-94.3	66.5	177.8	-57.7	-171.2	79.7	-157.9	-3.5	110.2	A14 A17 E21 E22 M23	A14-R19 HydrophobicContact CB-CB 4.44Å; A14-R19 PolarHBondContact O-N 3.2Å; A17-R19 HydrophobicContact CB-CG 3.98Å; A17-R19 WeakPolarHBondContact O-CG 3.45Å; A17-R19 PolarHBondContact O-N 3.17Å; A17-R19 VanDerWaalsContact O-N 3.17Å; R19-E21 VanDerWaalsContact C-N 3.31Å; R19-E21 PolarHBondContact O-N 3.19Å; R19-E22 HydrophobicContact CB-CB 4.43Å; R19-E22 IonicContact CZ-OE1 2.99Å; R19-E22 IonicContact CZ-OE2 3.47Å; R19-E22 IonicContact NE-OE1 2.89Å; R19-E22 PolarHBondContact NE-OE1 2.95Å; R19-E22 IonicContact NE-OE2 3.72Å; R19-E22 IonicContact NH1-OE1 3.85Å; R19-E22 PolarHBondContact NH1-OE1 3.21Å; R19-E22 IonicContact NH1-OE2 2.66Å; R19-E22 PolarHBondContact NH1-OE2 3.35Å; R19-E22 VanDerWaalsContact NH2-CD 3.31Å; R19-E22 IonicContact NH2-OE1 3.36Å; R19-E22 PolarHBondContact NH2-OE1 3.5Å; R19-E22 IonicContact NH2-OE2 3.6Å; R19-E22 PolarHBondContact NH2-OE2 3.12Å; R19-E22 PolarHBondContact O-N 3.46Å; R19-M23 PolarHBondContact O-N 2.86Å
20	Y	98.4	Very high	98.2	Very high	47 Å²	47	60.9 Å²	60.9	18%	0.184	29%	0.29	C	S	.	.	H	α-helix	trans	-67.2	-27.4	-170.2	-58.4	-68.3	0	0	0	114.2	E18 M23 V24 N53	E18-Y20 HydrophobicContact CB-CE2 3.96Å; E18-Y20 HydrophobicContact CG-CE2 4.47Å; E18-Y20 WeakPolarHBondContact O-CD2 3.38Å; E18-Y20 PolarHBondContact O-N 2.8Å; Y20-M23 HydrophobicContact CD1-SD 4.01Å; Y20-M23 WeakPolarHBondContact O-CB 3.33Å; Y20-M23 PolarHBondContact O-N 3.1Å; Y20-V24 WeakPolarHBondContact O-CG2 3.46Å; Y20-V24 PolarHBondContact O-N 2.88Å; Y20-N53 HydrophobicContact CD1-CB 3.61Å; Y20-N53 HydrophobicContact CD2-CB 3.42Å; Y20-N53 VanDerWaalsContact CD2-CB 3.42Å; Y20-N53 HydrophobicContact CE1-CB 3.9Å; Y20-N53 WeakPolarHBondContact CE1-ND2 3.33Å; Y20-N53 HydrophobicContact CE2-CB 3.69Å; Y20-N53 HydrophobicContact CG-CB 3.36Å; Y20-N53 VanDerWaalsContact CZ-CG 3.48Å
21	E	97.9	Very high	98.1	Very high	97 Å²	97	57.2 Å²	57.2	45%	0.453	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-44.9	173	-69.9	81	178	0	0	111.6	R19 M23 V24 E25 V54	R19-E21 VanDerWaalsContact C-N 3.31Å; R19-E21 PolarHBondContact O-N 3.19Å; E21-M23 VanDerWaalsContact C-N 3.34Å; E21-V24 WeakPolarHBondContact O-CB 3.4Å; E21-V24 PolarHBondContact O-N 2.86Å; E21-E25 PolarHBondContact O-N 2.96Å; E21-E25 VanDerWaalsContact O-N 3.15Å; E21-V54 HydrophobicContact CG-CG2 4.26Å
22	E	98.3	Very high	98	Very high	51 Å²	51	61.9 Å²	61.9	24%	0.238	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-37.6	172.7	-87.9	152	-86.3	0	0	111.9	A14 R19 V24 E25 F26	A14-E22 HydrophobicContact CB-CB 4.3Å; R19-E22 HydrophobicContact CB-CB 4.43Å; R19-E22 IonicContact CZ-OE1 2.99Å; R19-E22 IonicContact CZ-OE2 3.47Å; R19-E22 IonicContact NE-OE1 2.89Å; R19-E22 PolarHBondContact NE-OE1 2.95Å; R19-E22 IonicContact NE-OE2 3.72Å; R19-E22 IonicContact NH1-OE1 3.85Å; R19-E22 PolarHBondContact NH1-OE1 3.21Å; R19-E22 IonicContact NH1-OE2 2.66Å; R19-E22 PolarHBondContact NH1-OE2 3.35Å; R19-E22 VanDerWaalsContact NH2-CD 3.31Å; R19-E22 IonicContact NH2-OE1 3.36Å; R19-E22 PolarHBondContact NH2-OE1 3.5Å; R19-E22 IonicContact NH2-OE2 3.6Å; R19-E22 PolarHBondContact NH2-OE2 3.12Å; R19-E22 PolarHBondContact O-N 3.46Å; E22-V24 PolarHBondContact O-N 3.26Å; E22-E25 WeakPolarHBondContact O-CB 3.4Å; E22-E25 PolarHBondContact O-N 2.89Å; E22-E25 VanDerWaalsContact O-N 3.1Å; E22-F26 HydrophobicContact CB-CD2 4.41Å; E22-F26 HydrophobicContact CB-CE2 3.94Å; E22-F26 WeakPolarHBondContact O-CD2 3.4Å; E22-F26 WeakPolarHBondContact O-CG 3.34Å; E22-F26 PolarHBondContact O-N 3.25Å
23	M	98.3	Very high	97.8	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.8	-40.9	174.9	-163.7	-171.3	178.9	0	0	111.1	A11 A14 E15 R19 Y20 E21 F26 M27 L46 V49 A50	A11-M23 HydrophobicContact CB-CG 4.05Å; A14-M23 HydrophobicContact CB-CB 3.99Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.89Å; E15-M23 HydrophobicContact CG-CE 4.21Å; E15-M23 HydrophobicContact CG-SD 4.35Å; R19-M23 PolarHBondContact O-N 2.86Å; Y20-M23 HydrophobicContact CD1-SD 4.01Å; Y20-M23 WeakPolarHBondContact O-CB 3.33Å; Y20-M23 PolarHBondContact O-N 3.1Å; E21-M23 VanDerWaalsContact C-N 3.34Å; M23-F26 PolarHBondContact O-N 2.97Å; M23-M27 WeakPolarHBondContact O-CB 3.43Å; M23-M27 VanDerWaalsContact O-CG 3.3Å; M23-M27 WeakPolarHBondContact O-CG 3.5Å; M23-M27 PolarHBondContact O-N 3.48Å; M23-L46 HydrophobicContact CE-CB 3.94Å; M23-L46 HydrophobicContact CE-CD2 3.51Å; M23-L46 HydrophobicContact CE-CG 4.34Å; M23-L46 VanDerWaalsContact CE-O 3.22Å; M23-L46 WeakPolarHBondContact CE-O 3.47Å; M23-V49 HydrophobicContact CE-CB 4.22Å; M23-V49 HydrophobicContact CE-CG1 4.1Å; M23-V49 HydrophobicContact SD-CG1 4.31Å; M23-A50 HydrophobicContact CB-CB 3.83Å; M23-A50 HydrophobicContact CE-CB 4.23Å; M23-A50 HydrophobicContact CG-CB 3.56Å; M23-A50 VanDerWaalsContact SD-CA 3.57Å; M23-A50 HydrophobicContact SD-CB 3.56Å; M23-A50 VanDerWaalsContact SD-CB 3.56Å
24	V	98.5	Very high	97.4	Very high	16 Å²	16	58.6 Å²	58.6	10%	0.097	28%	0.28	C	S	.	.	H	α-helix	trans	-60.6	-49.2	172.7	166.5	0	0	0	0	110.6	Y20 E21 E22 F26 M27 E28 A50 Y51 V54	Y20-V24 WeakPolarHBondContact O-CG2 3.46Å; Y20-V24 PolarHBondContact O-N 2.88Å; E21-V24 WeakPolarHBondContact O-CB 3.4Å; E21-V24 PolarHBondContact O-N 2.86Å; E22-V24 PolarHBondContact O-N 3.26Å; V24-F26 VanDerWaalsContact C-N 3.32Å; V24-F26 PolarHBondContact O-N 3.17Å; V24-M27 PolarHBondContact O-N 3.23Å; V24-E28 HydrophobicContact CG1-CG 4.23Å; V24-E28 WeakPolarHBondContact O-CB 3.41Å; V24-E28 WeakPolarHBondContact O-CG 3.45Å; V24-E28 PolarHBondContact O-N 3.16Å; V24-A50 HydrophobicContact CG2-CB 3.78Å; V24-Y51 HydrophobicContact CB-CE2 4.33Å; V24-Y51 HydrophobicContact CG1-CD2 4.23Å; V24-Y51 HydrophobicContact CG1-CE1 4Å; V24-Y51 HydrophobicContact CG1-CE2 3.56Å; V24-Y51 VanDerWaalsContact CG1-CZ 3.45Å; V24-Y51 HydrophobicContact CG2-CD1 4.19Å; V24-Y51 HydrophobicContact CG2-CD2 3.87Å; V24-Y51 HydrophobicContact CG2-CE1 4.37Å; V24-Y51 HydrophobicContact CG2-CE2 4.08Å; V24-Y51 HydrophobicContact CG2-CG 3.95Å; V24-V54 HydrophobicContact CG2-CG2 3.98Å
25	E	98.3	Very high	96.9	Very high	111 Å²	111	64.8 Å²	64.8	52%	0.519	31%	0.312	S	S	.	.	H	α-helix	trans	-58.1	-41.6	179.7	-67.8	-179.7	-165.3	0	0	113.2	E21 E22 K29	E21-E25 PolarHBondContact O-N 2.96Å; E21-E25 VanDerWaalsContact O-N 3.15Å; E22-E25 WeakPolarHBondContact O-CB 3.4Å; E22-E25 PolarHBondContact O-N 2.89Å; E22-E25 VanDerWaalsContact O-N 3.1Å; E25-K29 WeakPolarHBondContact O-CG 3.49Å; E25-K29 PolarHBondContact O-N 3.45Å
26	F	98.4	Very high	96.2	Very high	27 Å²	27	67.2 Å²	67.2	12%	0.118	33%	0.332	C	S	.	.	H	α-helix	trans	-69.2	-46.2	176.6	-63.4	-53.6	0	0	0	111.6	N7 M10 A11 A14 E22 M23 V24 E28 K29 V30	N7-F26 HydrophobicContact CB-CB 4.38Å; M10-F26 HydrophobicContact CB-CD1 3.73Å; M10-F26 HydrophobicContact CB-CD2 3.7Å; M10-F26 HydrophobicContact CB-CE1 3.71Å; M10-F26 HydrophobicContact CB-CE2 3.68Å; M10-F26 HydrophobicContact CB-CG 3.76Å; M10-F26 HydrophobicContact CB-CZ 3.7Å; M10-F26 HydrophobicContact CE-CE1 4.31Å; M10-F26 HydrophobicContact CE-CE2 4.1Å; M10-F26 HydrophobicContact CE-CZ 3.63Å; M10-F26 HydrophobicContact CG-CD1 4.47Å; M10-F26 HydrophobicContact CG-CE1 4.13Å; M10-F26 HydrophobicContact CG-CZ 4.24Å; A11-F26 HydrophobicContact CB-CB 4.05Å; A14-F26 HydrophobicContact CB-CD2 4.39Å; A14-F26 HydrophobicContact CB-CE2 4.38Å; E22-F26 HydrophobicContact CB-CD2 4.41Å; E22-F26 HydrophobicContact CB-CE2 3.94Å; E22-F26 WeakPolarHBondContact O-CD2 3.4Å; E22-F26 WeakPolarHBondContact O-CG 3.34Å; E22-F26 PolarHBondContact O-N 3.25Å; M23-F26 PolarHBondContact O-N 2.97Å; V24-F26 VanDerWaalsContact C-N 3.32Å; V24-F26 PolarHBondContact O-N 3.17Å; F26-E28 VanDerWaalsContact C-N 3.34Å; F26-E28 PolarHBondContact O-N 2.71Å; F26-K29 WeakPolarHBondContact O-CB 3.46Å; F26-K29 PolarHBondContact O-N 2.89Å; F26-K29 VanDerWaalsContact O-N 3.16Å; F26-V30 PolarHBondContact O-N 2.96Å
27	M	98.4	Very high	95.8	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71.5	-27	-177.1	-69.7	-52.2	-51.7	0	0	113.2	A11 M23 V24 K29 V30 A31 E43 L46 L47	A11-M27 HydrophobicContact CB-CG 3.78Å; A11-M27 HydrophobicContact CB-SD 3.53Å; A11-M27 VanDerWaalsContact CB-SD 3.53Å; M23-M27 WeakPolarHBondContact O-CB 3.43Å; M23-M27 VanDerWaalsContact O-CG 3.3Å; M23-M27 WeakPolarHBondContact O-CG 3.5Å; M23-M27 PolarHBondContact O-N 3.48Å; V24-M27 PolarHBondContact O-N 3.23Å; M27-K29 VanDerWaalsContact C-N 3.34Å; M27-V30 HydrophobicContact CE-CB 4.07Å; M27-V30 HydrophobicContact CE-CG1 4.06Å; M27-V30 HydrophobicContact CE-CG2 4.41Å; M27-V30 PolarHBondContact O-N 2.67Å; M27-V30 HydrophobicContact SD-CG2 4.35Å; M27-A31 WeakPolarHBondContact O-CB 3.39Å; M27-A31 PolarHBondContact O-N 3.17Å; M27-E43 HydrophobicContact CE-CB 4.17Å; M27-E43 WeakPolarHBondContact CE-O 3.24Å; M27-L46 HydrophobicContact CE-CB 3.98Å; M27-L46 HydrophobicContact CG-CB 4.26Å; M27-L46 HydrophobicContact SD-CB 3.8Å; M27-L46 HydrophobicContact SD-CD1 4.35Å; M27-L47 HydrophobicContact CB-CB 4.21Å; M27-L47 HydrophobicContact CB-CD1 3.68Å; M27-L47 HydrophobicContact CE-CB 4.12Å
28	E	97.9	Very high	95.6	Very high	41 Å²	41	65 Å²	65	19%	0.192	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-39.3	169.1	-79	-164.9	-170.1	0	0	112.6	V24 F26 V30 A31 K32 Y51 V105	V24-E28 HydrophobicContact CG1-CG 4.23Å; V24-E28 WeakPolarHBondContact O-CB 3.41Å; V24-E28 WeakPolarHBondContact O-CG 3.45Å; V24-E28 PolarHBondContact O-N 3.16Å; F26-E28 VanDerWaalsContact C-N 3.34Å; F26-E28 PolarHBondContact O-N 2.71Å; E28-V30 VanDerWaalsContact C-N 3.28Å; E28-V30 PolarHBondContact O-N 2.69Å; E28-A31 PolarHBondContact O-N 3.03Å; E28-K32 WeakPolarHBondContact O-CB 3.4Å; E28-K32 WeakPolarHBondContact O-CD 3.45Å; E28-K32 WeakPolarHBondContact O-CG 3.46Å; E28-K32 PolarHBondContact O-N 2.84Å; E28-K32 IonicContact OE2-NZ 2.96Å; E28-K32 PolarHBondContact OE2-NZ 2.86Å; E28-Y51 HydrophobicContact CG-CE2 4.31Å; E28-Y51 PolarHBondContact OE1-OH 3.33Å; E28-V105 HydrophobicContact CG-CG2 4.01Å
29	K	97.1	Very high	95.6	Very high	99 Å²	99	58.4 Å²	58.4	43%	0.43	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-39.7	175.7	-67.1	164.4	-173.1	165.7	0	110.3	N7 E25 F26 M27 K32 T33	N7-K29 VanDerWaalsContact OD1-CD 3.27Å; N7-K29 WeakPolarHBondContact OD1-CD 3.48Å; E25-K29 WeakPolarHBondContact O-CG 3.49Å; E25-K29 PolarHBondContact O-N 3.45Å; F26-K29 WeakPolarHBondContact O-CB 3.46Å; F26-K29 PolarHBondContact O-N 2.89Å; F26-K29 VanDerWaalsContact O-N 3.16Å; M27-K29 VanDerWaalsContact C-N 3.34Å; K29-K32 PolarHBondContact O-N 3.38Å; K29-T33 WeakPolarHBondContact O-CG2 3.47Å
30	V	97.5	Very high	95.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-49.4	174.2	176.6	0	0	0	0	110.9	R4 N7 V8 F26 M27 E28 K32 T33 L39 E43	R4-V30 HydrophobicContact CG-CG1 4.07Å; R4-V30 HydrophobicContact CG-CG2 4.43Å; N7-V30 HydrophobicContact CB-CG2 3.55Å; V8-V30 HydrophobicContact CG2-CG1 4.19Å; V8-V30 HydrophobicContact CG2-CG2 3.79Å; F26-V30 PolarHBondContact O-N 2.96Å; M27-V30 HydrophobicContact CE-CB 4.07Å; M27-V30 HydrophobicContact CE-CG1 4.06Å; M27-V30 HydrophobicContact CE-CG2 4.41Å; M27-V30 PolarHBondContact O-N 2.67Å; M27-V30 HydrophobicContact SD-CG2 4.35Å; E28-V30 VanDerWaalsContact C-N 3.28Å; E28-V30 PolarHBondContact O-N 2.69Å; V30-K32 PolarHBondContact O-N 3.49Å; V30-T33 PolarHBondContact O-N 3.01Å; V30-T33 PolarHBondContact O-OG1 3.35Å; V30-L39 HydrophobicContact CG1-CD2 3.68Å; V30-E43 HydrophobicContact CG1-CB 4.49Å; V30-E43 HydrophobicContact CG1-CG 4.38Å
31	A	97	Very high	95.3	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-27.4	179.4	0	0	0	0	0	113.6	M27 E28 T33 V34 L47 V105 H109 L110	M27-A31 WeakPolarHBondContact O-CB 3.39Å; M27-A31 PolarHBondContact O-N 3.17Å; E28-A31 PolarHBondContact O-N 3.03Å; A31-T33 PolarHBondContact O-N 3.06Å; A31-V34 WeakPolarHBondContact O-CG1 3.42Å; A31-V34 WeakPolarHBondContact O-CG2 3.28Å; A31-L47 HydrophobicContact CB-CD2 4.48Å; A31-V105 HydrophobicContact CB-CG1 3.55Å; A31-H109 WeakPolarHBondContact O-CB 3.45Å; A31-L110 HydrophobicContact CB-CD1 4.32Å; A31-L110 HydrophobicContact CB-CD2 3.97Å; A31-L110 HydrophobicContact CB-CG 4.37Å
32	K	95	Very high	95.2	Very high	97 Å²	97	56.5 Å²	56.5	42%	0.422	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.3	175.8	-72.9	163.4	-175.6	158.9	0	114	E28 K29 V30	E28-K32 WeakPolarHBondContact O-CB 3.4Å; E28-K32 WeakPolarHBondContact O-CD 3.45Å; E28-K32 WeakPolarHBondContact O-CG 3.46Å; E28-K32 PolarHBondContact O-N 2.84Å; E28-K32 IonicContact OE2-NZ 2.96Å; E28-K32 PolarHBondContact OE2-NZ 2.86Å; K29-K32 PolarHBondContact O-N 3.38Å; V30-K32 PolarHBondContact O-N 3.49Å
33	T	94	Very high	95.2	Very high	46 Å²	46	55 Å²	55	28%	0.282	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.3	178.5	66.1	0	0	0	0	114	R4 K29 V30 A31 D35 V36	R4-T33 PolarHBondContact NH1-OG1 3.22Å; K29-T33 WeakPolarHBondContact O-CG2 3.47Å; V30-T33 PolarHBondContact O-N 3.01Å; V30-T33 PolarHBondContact O-OG1 3.35Å; A31-T33 PolarHBondContact O-N 3.06Å; T33-D35 WeakPolarHBondContact CA-OD1 3.43Å; T33-D35 PolarHBondContact O-N 3.23Å; T33-V36 PolarHBondContact O-N 2.87Å; T33-V36 VanDerWaalsContact O-N 3.14Å
34	V	90.4	Very high	95.2	Very high	14 Å²	14	55.7 Å²	55.7	9%	0.085	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-9.4	-176	-64.2	0	0	0	0	115	A31 V36 E37 L39 H109 L110	A31-V34 WeakPolarHBondContact O-CG1 3.42Å; A31-V34 WeakPolarHBondContact O-CG2 3.28Å; V34-V36 PolarHBondContact O-N 2.97Å; V34-E37 WeakPolarHBondContact CA-O 3.3Å; V34-L39 HydrophobicContact CG1-CD2 3.74Å; V34-L39 HydrophobicContact CG1-CG 3.83Å; V34-H109 HydrophobicContact CG2-CB 3.8Å; V34-L110 HydrophobicContact CG1-CD2 3.84Å
35	D	88	Confident	95	Very high	137 Å²	137	58.3 Å²	58.3	73%	0.733	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23.5	167.1	61.5	-39.8	0	0	0	112.4	T33	T33-D35 WeakPolarHBondContact CA-OD1 3.43Å; T33-D35 PolarHBondContact O-N 3.23Å
36	V	84.7	Confident	95	Very high	122 Å²	122	53.5 Å²	53.5	74%	0.739	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-47.7	175	-175.9	0	0	0	0	111.3	T33 V34	T33-V36 PolarHBondContact O-N 2.87Å; T33-V36 VanDerWaalsContact O-N 3.14Å; V34-V36 PolarHBondContact O-N 2.97Å
37	E	89.6	Confident	95	Very high	130 Å²	130	52.3 Å²	52.3	61%	0.607	27%	0.271	S	S	*	.	S	Bend	trans	-155.1	130.7	-174.5	-176	177.4	-162.9	0	0	110.8	R4 V34	R4-E37 PolarHBondContact NH1-O 2.93Å; V34-E37 WeakPolarHBondContact CA-O 3.3Å
38	E	94.3	Very high	95	Very high	47 Å²	47	53.9 Å²	53.9	22%	0.22	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-56.9	153.6	176	-167.3	176.4	164.6	0	0	111.3	R4 S40 S115 P116 S119	R4-E38 PolarHBondContact NH2-O 3.46Å; E38-S40 PolarHBondContact O-N 2.92Å; E38-S115 PolarHBondContact OE2-N 3.41Å; E38-P116 WeakPolarHBondContact OE1-CD 3.4Å; E38-P116 WeakPolarHBondContact OE2-CD 3.45Å; E38-S119 WeakPolarHBondContact OE1-CB 3.07Å; E38-S119 PolarHBondContact OE1-OG 3.46Å
39	L	96.6	Very high	95.1	Very high	9 Å²	9	54 Å²	54	5%	0.047	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-63.4	131.9	173.9	-61.2	-169.3	0	0	0	110.9	V30 V34 E43 R44 L47 L110	V30-L39 HydrophobicContact CG1-CD2 3.68Å; V34-L39 HydrophobicContact CG1-CD2 3.74Å; V34-L39 HydrophobicContact CG1-CG 3.83Å; L39-E43 HydrophobicContact CB-CB 4.18Å; L39-E43 HydrophobicContact CD2-CB 4.24Å; L39-R44 HydrophobicContact CB-CB 4.38Å; L39-L47 HydrophobicContact CD1-CD2 4.3Å; L39-L110 HydrophobicContact CD1-CD1 4.47Å; L39-L110 HydrophobicContact CD1-CD2 3.62Å; L39-L110 HydrophobicContact CG-CD2 3.92Å
40	S	95.9	Very high	95.1	Very high	52 Å²	52	49.3 Å²	49.3	36%	0.364	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-64	164	166.1	64.5	0	0	0	0	111.1	E38 E42 E43 R44	E38-S40 PolarHBondContact O-N 2.92Å; S40-E42 PolarHBondContact O-N 3.29Å; S40-E43 WeakPolarHBondContact CB-OE2 3.49Å; S40-E43 PolarHBondContact N-OE2 2.76Å; S40-E43 PolarHBondContact O-N 3.07Å; S40-E43 VanDerWaalsContact OG-CD 3.29Å; S40-E43 VanDerWaalsContact OG-CG 3.24Å; S40-E43 WeakPolarHBondContact OG-CG 3.45Å; S40-E43 PolarHBondContact OG-N 3.11Å; S40-E43 PolarHBondContact OG-OE2 3.36Å; S40-R44 VanDerWaalsContact O-CB 3.3Å; S40-R44 WeakPolarHBondContact O-CB 3.12Å; S40-R44 PolarHBondContact O-N 2.78Å
41	V	94.7	Very high	95.2	Very high	81 Å²	81	49.5 Å²	49.5	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-55.9	-40.4	175.4	173	0	0	0	0	111.4	N45	V41-N45 VanDerWaalsContact O-CB 3.3Å; V41-N45 WeakPolarHBondContact O-CB 3.3Å; V41-N45 PolarHBondContact O-N 3.34Å; V41-N45 PolarHBondContact O-ND2 3.04Å; V41-N45 PolarHBondContact O-OD1 3.34Å
42	E	96.6	Very high	95.2	Very high	106 Å²	106	56.4 Å²	56.4	50%	0.495	30%	0.296	S	S	.	.	H	α-helix	trans	-63.9	-49.4	177.7	-174.3	179	-147.3	0	0	111.4	K12 S40 R44 N45 L46	K12-E42 WeakPolarHBondContact CE-OE1 2.88Å; K12-E42 IonicContact NZ-OE1 3.29Å; K12-E42 PolarHBondContact NZ-OE1 2.73Å; K12-E42 IonicContact NZ-OE2 3.46Å; K12-E42 PolarHBondContact NZ-OE2 3.3Å; S40-E42 PolarHBondContact O-N 3.29Å; E42-R44 PolarHBondContact O-N 3.47Å; E42-N45 PolarHBondContact O-N 3.15Å; E42-L46 HydrophobicContact CG-CD1 4.23Å; E42-L46 WeakPolarHBondContact O-CG 3.35Å; E42-L46 PolarHBondContact O-N 2.86Å
43	E	97.8	Very high	95.4	Very high	20 Å²	20	54.5 Å²	54.5	9%	0.093	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-42.4	-179.5	-69	165.5	135	0	0	112	R4 V8 M27 V30 L39 S40 N45 L46 L47	R4-E43 IonicContact CZ-OE1 2.69Å; R4-E43 IonicContact CZ-OE2 3.53Å; R4-E43 IonicContact NE-OE1 2.87Å; R4-E43 PolarHBondContact NE-OE1 3.19Å; R4-E43 IonicContact NE-OE2 2.61Å; R4-E43 IonicContact NH2-OE1 2.65Å; R4-E43 PolarHBondContact NH2-OE1 2.87Å; R4-E43 IonicContact NH2-OE2 2.97Å; R4-E43 PolarHBondContact NH2-OE2 3.29Å; V8-E43 HydrophobicContact CG2-CG 3.84Å; M27-E43 HydrophobicContact CE-CB 4.17Å; M27-E43 WeakPolarHBondContact CE-O 3.24Å; V30-E43 HydrophobicContact CG1-CB 4.49Å; V30-E43 HydrophobicContact CG1-CG 4.38Å; L39-E43 HydrophobicContact CB-CB 4.18Å; L39-E43 HydrophobicContact CD2-CB 4.24Å; S40-E43 WeakPolarHBondContact CB-OE2 3.49Å; S40-E43 PolarHBondContact N-OE2 2.76Å; S40-E43 PolarHBondContact O-N 3.07Å; S40-E43 VanDerWaalsContact OG-CD 3.29Å; S40-E43 VanDerWaalsContact OG-CG 3.24Å; S40-E43 WeakPolarHBondContact OG-CG 3.45Å; S40-E43 PolarHBondContact OG-N 3.11Å; S40-E43 PolarHBondContact OG-OE2 3.36Å; E43-N45 VanDerWaalsContact C-N 3.29Å; E43-N45 PolarHBondContact O-N 3.46Å; E43-L46 PolarHBondContact O-N 2.61Å; E43-L47 PolarHBondContact O-N 3.31Å
44	R	97.5	Very high	95.6	Very high	15 Å²	15	53 Å²	53	6%	0.057	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-43.6	174.1	-177.7	-168.4	72.8	-164	-0.8	111.2	L39 S40 E42 S48 F122 Y123	L39-R44 HydrophobicContact CB-CB 4.38Å; S40-R44 VanDerWaalsContact O-CB 3.3Å; S40-R44 WeakPolarHBondContact O-CB 3.12Å; S40-R44 PolarHBondContact O-N 2.78Å; E42-R44 PolarHBondContact O-N 3.47Å; R44-S48 PolarHBondContact O-N 3.26Å; R44-S48 VanDerWaalsContact O-N 3.11Å; R44-F122 HydrophobicContact CG-CD1 3.59Å; R44-F122 HydrophobicContact CG-CD2 4.44Å; R44-F122 HydrophobicContact CG-CE1 3.38Å; R44-F122 HydrophobicContact CG-CE2 4.25Å; R44-F122 HydrophobicContact CG-CG 4.12Å; R44-F122 HydrophobicContact CG-CZ 3.72Å; R44-Y123 HydrophobicContact CG-CE1 3.85Å
45	N	96.3	Very high	96	Very high	70 Å²	70	52.4 Å²	52.4	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-67.6	-41.9	178.5	-70.8	-9.8	0	0	0	111.5	V41 E42 E43 L47 S48 V49	V41-N45 VanDerWaalsContact O-CB 3.3Å; V41-N45 WeakPolarHBondContact O-CB 3.3Å; V41-N45 PolarHBondContact O-N 3.34Å; V41-N45 PolarHBondContact O-ND2 3.04Å; V41-N45 PolarHBondContact O-OD1 3.34Å; E42-N45 PolarHBondContact O-N 3.15Å; E43-N45 VanDerWaalsContact C-N 3.29Å; E43-N45 PolarHBondContact O-N 3.46Å; N45-L47 PolarHBondContact O-N 3.48Å; N45-S48 WeakPolarHBondContact O-CB 3.37Å; N45-S48 PolarHBondContact O-N 3.09Å; N45-V49 WeakPolarHBondContact O-CG2 3.41Å; N45-V49 PolarHBondContact O-N 3.19Å
46	L	98.4	Very high	96.5	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-46.3	175	-72.7	169.4	0	0	0	111.8	V8 K12 E15 M23 M27 E42 E43 S48 V49 A50	V8-L46 HydrophobicContact CG1-CD1 4Å; K12-L46 HydrophobicContact CG-CD1 4.09Å; K12-L46 HydrophobicContact CG-CD2 4.18Å; E15-L46 WeakPolarHBondContact OE2-CD2 3.4Å; M23-L46 HydrophobicContact CE-CB 3.94Å; M23-L46 HydrophobicContact CE-CD2 3.51Å; M23-L46 HydrophobicContact CE-CG 4.34Å; M23-L46 VanDerWaalsContact CE-O 3.22Å; M23-L46 WeakPolarHBondContact CE-O 3.47Å; M27-L46 HydrophobicContact CE-CB 3.98Å; M27-L46 HydrophobicContact CG-CB 4.26Å; M27-L46 HydrophobicContact SD-CB 3.8Å; M27-L46 HydrophobicContact SD-CD1 4.35Å; E42-L46 HydrophobicContact CG-CD1 4.23Å; E42-L46 WeakPolarHBondContact O-CG 3.35Å; E42-L46 PolarHBondContact O-N 2.86Å; E43-L46 PolarHBondContact O-N 2.61Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 2.98Å; L46-V49 PolarHBondContact O-N 2.97Å; L46-A50 WeakPolarHBondContact O-CB 3.45Å; L46-A50 PolarHBondContact O-N 2.94Å
47	L	98.5	Very high	97.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-57.7	-44.2	175.9	178.2	69.3	0	0	0	111.3	M27 A31 L39 E43 N45 A50 Y51 I102 L110	M27-L47 HydrophobicContact CB-CB 4.21Å; M27-L47 HydrophobicContact CB-CD1 3.68Å; M27-L47 HydrophobicContact CE-CB 4.12Å; A31-L47 HydrophobicContact CB-CD2 4.48Å; L39-L47 HydrophobicContact CD1-CD2 4.3Å; E43-L47 PolarHBondContact O-N 3.31Å; N45-L47 PolarHBondContact O-N 3.48Å; L47-A50 PolarHBondContact O-N 2.85Å; L47-Y51 HydrophobicContact CD1-CD2 3.73Å; L47-Y51 HydrophobicContact CD1-CE2 3.83Å; L47-Y51 HydrophobicContact CG-CD2 4.37Å; L47-Y51 PolarHBondContact O-N 3.35Å; L47-Y51 VanDerWaalsContact O-N 3.16Å; L47-I102 HydrophobicContact CD2-CD1 4.41Å; L47-L110 HydrophobicContact CD2-CD1 3.37Å
48	S	98	Very high	97.5	Very high	34 Å²	34	41.3 Å²	41.3	24%	0.238	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-44.9	178.3	-177.2	0	0	0	0	112.4	R44 N45 L46 K52	R44-S48 PolarHBondContact O-N 3.26Å; R44-S48 VanDerWaalsContact O-N 3.11Å; N45-S48 WeakPolarHBondContact O-CB 3.37Å; N45-S48 PolarHBondContact O-N 3.09Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 2.98Å; S48-K52 WeakPolarHBondContact O-CB 3.43Å; S48-K52 PolarHBondContact O-N 3.24Å
49	V	98.3	Very high	97.7	Very high	44 Å²	44	40.5 Å²	40.5	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-60.8	-45.6	176.6	168.6	0	0	0	0	111.1	M23 N45 L46 K52 N53	M23-V49 HydrophobicContact CE-CB 4.22Å; M23-V49 HydrophobicContact CE-CG1 4.1Å; M23-V49 HydrophobicContact SD-CG1 4.31Å; N45-V49 WeakPolarHBondContact O-CG2 3.41Å; N45-V49 PolarHBondContact O-N 3.19Å; L46-V49 PolarHBondContact O-N 2.97Å; V49-K52 PolarHBondContact O-N 3.49Å; V49-N53 PolarHBondContact O-N 3.29Å; V49-N53 VanDerWaalsContact O-N 3.11Å; V49-N53 PolarHBondContact O-ND2 3.49Å
50	A	98.6	Very high	97.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.2	-58.3	178.9	0	0	0	0	0	110.9	M23 V24 L46 L47 K52 N53 V54	M23-A50 HydrophobicContact CB-CB 3.83Å; M23-A50 HydrophobicContact CE-CB 4.23Å; M23-A50 HydrophobicContact CG-CB 3.56Å; M23-A50 VanDerWaalsContact SD-CA 3.57Å; M23-A50 HydrophobicContact SD-CB 3.56Å; M23-A50 VanDerWaalsContact SD-CB 3.56Å; V24-A50 HydrophobicContact CG2-CB 3.78Å; L46-A50 WeakPolarHBondContact O-CB 3.45Å; L46-A50 PolarHBondContact O-N 2.94Å; L47-A50 PolarHBondContact O-N 2.85Å; A50-K52 PolarHBondContact O-N 3.38Å; A50-N53 PolarHBondContact O-N 3.35Å; A50-V54 WeakPolarHBondContact O-CG2 3.45Å; A50-V54 PolarHBondContact O-N 3.4Å
51	Y	98.7	Very high	97.9	Very high	4 Å²	4	42 Å²	42	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-67.1	-38.8	-176.8	-95.6	-75.7	0	0	0	112.7	V24 E28 L47 N53 V54 I55 I98 G101 I102 Y130	V24-Y51 HydrophobicContact CB-CE2 4.33Å; V24-Y51 HydrophobicContact CG1-CD2 4.23Å; V24-Y51 HydrophobicContact CG1-CE1 4Å; V24-Y51 HydrophobicContact CG1-CE2 3.56Å; V24-Y51 VanDerWaalsContact CG1-CZ 3.45Å; V24-Y51 HydrophobicContact CG2-CD1 4.19Å; V24-Y51 HydrophobicContact CG2-CD2 3.87Å; V24-Y51 HydrophobicContact CG2-CE1 4.37Å; V24-Y51 HydrophobicContact CG2-CE2 4.08Å; V24-Y51 HydrophobicContact CG2-CG 3.95Å; E28-Y51 HydrophobicContact CG-CE2 4.31Å; E28-Y51 PolarHBondContact OE1-OH 3.33Å; L47-Y51 HydrophobicContact CD1-CD2 3.73Å; L47-Y51 HydrophobicContact CD1-CE2 3.83Å; L47-Y51 HydrophobicContact CG-CD2 4.37Å; L47-Y51 PolarHBondContact O-N 3.35Å; L47-Y51 VanDerWaalsContact O-N 3.16Å; Y51-N53 VanDerWaalsContact C-N 3.33Å; Y51-N53 PolarHBondContact O-N 3.01Å; Y51-V54 PolarHBondContact O-N 3.23Å; Y51-I55 WeakPolarHBondContact O-CB 3.35Å; Y51-I55 VanDerWaalsContact O-CG2 3.25Å; Y51-I55 WeakPolarHBondContact O-CG2 3.14Å; Y51-I55 PolarHBondContact O-N 3.17Å; Y51-I98 HydrophobicContact CD1-CG2 4.1Å; Y51-I98 HydrophobicContact CE1-CG2 4.27Å; Y51-G101 VanDerWaalsContact OH-C 3.28Å; Y51-I102 HydrophobicContact CD1-CB 3.74Å; Y51-I102 HydrophobicContact CD1-CG1 4.44Å; Y51-I102 HydrophobicContact CD1-CG2 4.16Å; Y51-I102 HydrophobicContact CD2-CB 4.36Å; Y51-I102 HydrophobicContact CD2-CD1 3.86Å; Y51-I102 HydrophobicContact CD2-CG1 4.44Å; Y51-I102 HydrophobicContact CE1-CB 3.51Å; Y51-I102 HydrophobicContact CE1-CG2 4.12Å; Y51-I102 HydrophobicContact CE2-CB 4.16Å; Y51-I102 HydrophobicContact CE2-CD1 3.89Å; Y51-I102 HydrophobicContact CG-CB 4.14Å; Y51-I102 HydrophobicContact CG-CD1 4.27Å; Y51-I102 HydrophobicContact CG-CG1 4.37Å; Y51-I102 PolarHBondContact OH-N 3.02Å; Y51-Y130 VanDerWaalsContact C-OH 3.26Å; Y51-Y130 WeakPolarHBondContact CB-OH 3.37Å; Y51-Y130 PolarHBondContact O-OH 3.29Å
52	K	98.1	Very high	98.1	Very high	144 Å²	144	39.9 Å²	39.9	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-59.7	-41.3	177.6	-179.2	-178.2	176.8	-174.7	0	112.2	S48 V49 A50 G56	S48-K52 WeakPolarHBondContact O-CB 3.43Å; S48-K52 PolarHBondContact O-N 3.24Å; V49-K52 PolarHBondContact O-N 3.49Å; A50-K52 PolarHBondContact O-N 3.38Å; K52-G56 WeakPolarHBondContact O-CA 3.5Å; K52-G56 PolarHBondContact O-N 3.11Å
53	N	98.3	Very high	98.2	Very high	58 Å²	58	40 Å²	40	31%	0.31	22%	0.217	S	C	.	.	H	α-helix	trans	-71.1	-46.2	179.3	-79.5	-71.1	0	0	0	111.8	Y20 V49 A50 Y51 G56 A57	Y20-N53 HydrophobicContact CD1-CB 3.61Å; Y20-N53 HydrophobicContact CD2-CB 3.42Å; Y20-N53 VanDerWaalsContact CD2-CB 3.42Å; Y20-N53 HydrophobicContact CE1-CB 3.9Å; Y20-N53 WeakPolarHBondContact CE1-ND2 3.33Å; Y20-N53 HydrophobicContact CE2-CB 3.69Å; Y20-N53 HydrophobicContact CG-CB 3.36Å; Y20-N53 VanDerWaalsContact CZ-CG 3.48Å; V49-N53 PolarHBondContact O-N 3.29Å; V49-N53 VanDerWaalsContact O-N 3.11Å; V49-N53 PolarHBondContact O-ND2 3.49Å; A50-N53 PolarHBondContact O-N 3.35Å; Y51-N53 VanDerWaalsContact C-N 3.33Å; Y51-N53 PolarHBondContact O-N 3.01Å; N53-G56 PolarHBondContact O-N 3.26Å; N53-A57 PolarHBondContact O-N 3.04Å
54	V	98.5	Very high	98.2	Very high	13 Å²	13	44 Å²	44	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-50.6	178.4	176.9	0	0	0	0	111.2	E21 V24 A50 Y51 G56 R58 I98	E21-V54 HydrophobicContact CG-CG2 4.26Å; V24-V54 HydrophobicContact CG2-CG2 3.98Å; A50-V54 WeakPolarHBondContact O-CG2 3.45Å; A50-V54 PolarHBondContact O-N 3.4Å; Y51-V54 PolarHBondContact O-N 3.23Å; V54-G56 VanDerWaalsContact C-N 3.35Å; V54-G56 PolarHBondContact O-N 2.85Å; V54-R58 PolarHBondContact O-N 3.29Å; V54-I98 HydrophobicContact CG1-CD1 3.74Å; V54-I98 HydrophobicContact CG1-CG1 3.93Å; V54-I98 HydrophobicContact CG1-CG2 4.17Å
55	I	98.5	Very high	98.3	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-35.4	179.4	-161.5	72.2	0	0	0	111.7	Y51 R58 R59 L95 I98 Y130 Y133	Y51-I55 WeakPolarHBondContact O-CB 3.35Å; Y51-I55 VanDerWaalsContact O-CG2 3.25Å; Y51-I55 WeakPolarHBondContact O-CG2 3.14Å; Y51-I55 PolarHBondContact O-N 3.17Å; I55-R58 PolarHBondContact O-N 3.4Å; I55-R59 HydrophobicContact CG1-CG 4.18Å; I55-R59 WeakPolarHBondContact O-CB 3.39Å; I55-R59 VanDerWaalsContact O-CG 3.31Å; I55-R59 WeakPolarHBondContact O-CG 3.26Å; I55-R59 PolarHBondContact O-N 3.5Å; I55-L95 HydrophobicContact CD1-CD2 3.58Å; I55-L95 HydrophobicContact CG1-CD2 4.32Å; I55-I98 HydrophobicContact CB-CG2 4.02Å; I55-I98 HydrophobicContact CD1-CB 3.8Å; I55-I98 HydrophobicContact CD1-CD1 4.28Å; I55-I98 HydrophobicContact CD1-CG2 3.59Å; I55-I98 HydrophobicContact CG1-CG2 4.35Å; I55-Y130 HydrophobicContact CB-CE1 3.91Å; I55-Y130 HydrophobicContact CD1-CE1 4.26Å; I55-Y130 HydrophobicContact CG1-CD1 4.46Å; I55-Y130 HydrophobicContact CG1-CE1 3.89Å; I55-Y130 HydrophobicContact CG2-CE1 3.92Å; I55-Y130 WeakPolarHBondContact CG2-OH 3.24Å; I55-Y133 HydrophobicContact CG1-CD2 3.85Å; I55-Y133 HydrophobicContact CG1-CE2 4.29Å; I55-Y133 HydrophobicContact CG2-CD2 4.44Å; I55-Y133 HydrophobicContact CG2-CE2 4.05Å
56	G	98.2	Very high	98.4	Very high	30 Å²	30	42.2 Å²	42.2	31%	0.309	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-50	179.5	0	0	0	0	0	112.2	K52 N53 V54 R58 R59 A60	K52-G56 WeakPolarHBondContact O-CA 3.5Å; K52-G56 PolarHBondContact O-N 3.11Å; N53-G56 PolarHBondContact O-N 3.26Å; V54-G56 VanDerWaalsContact C-N 3.35Å; V54-G56 PolarHBondContact O-N 2.85Å; G56-R58 VanDerWaalsContact C-N 3.3Å; G56-R58 PolarHBondContact O-N 3.02Å; G56-R59 PolarHBondContact O-N 3.32Å; G56-A60 WeakPolarHBondContact O-CB 3.4Å; G56-A60 PolarHBondContact O-N 3.39Å
57	A	98	Very high	98.4	Very high	57 Å²	57	43.8 Å²	43.8	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-41.1	177	0	0	0	0	0	111.9	N53 A60 S61	N53-A57 PolarHBondContact O-N 3.04Å; A57-A60 PolarHBondContact O-N 3.21Å; A57-S61 PolarHBondContact O-N 3.39Å; A57-S61 VanDerWaalsContact O-N 3.07Å; A57-S61 PolarHBondContact O-OG 2.8Å
58	R	98.5	Very high	98.4	Very high	70 Å²	70	47 Å²	47	26%	0.264	26%	0.259	S	S	.	.	H	α-helix	trans	-71.3	-40	-179.7	-155.9	62.4	51.3	177.3	-7.1	112.5	V54 I55 G56 S61 W62 I91 E94 L95 I98	V54-R58 PolarHBondContact O-N 3.29Å; I55-R58 PolarHBondContact O-N 3.4Å; G56-R58 VanDerWaalsContact C-N 3.3Å; G56-R58 PolarHBondContact O-N 3.02Å; R58-S61 WeakPolarHBondContact O-CB 3.41Å; R58-S61 PolarHBondContact O-N 3.31Å; R58-W62 PolarHBondContact O-N 2.86Å; R58-I91 HydrophobicContact CG-CG2 4.15Å; R58-E94 VanDerWaalsContact CD-OE2 3.24Å; R58-E94 WeakPolarHBondContact CD-OE2 3.23Å; R58-E94 HydrophobicContact CG-CB 4.19Å; R58-E94 IonicContact CZ-OE2 2.78Å; R58-E94 IonicContact NE-OE2 3.59Å; R58-E94 IonicContact NH1-OE2 2.98Å; R58-E94 PolarHBondContact NH1-OE2 2.92Å; R58-L95 HydrophobicContact CB-CD2 3.65Å; R58-L95 HydrophobicContact CB-CG 4.3Å; R58-L95 HydrophobicContact CG-CD2 3.71Å; R58-L95 HydrophobicContact CG-CG 3.79Å; R58-I98 HydrophobicContact CB-CD1 3.97Å; R58-I98 HydrophobicContact CG-CD1 4.04Å
59	R	98.3	Very high	98.4	Very high	30 Å²	30	46.1 Å²	46.1	11%	0.113	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-36.7	174.8	-74.9	177.3	64.5	-132.4	14.3	112	I55 G56 W62 R63 L95 E136	I55-R59 HydrophobicContact CG1-CG 4.18Å; I55-R59 WeakPolarHBondContact O-CB 3.39Å; I55-R59 VanDerWaalsContact O-CG 3.31Å; I55-R59 WeakPolarHBondContact O-CG 3.26Å; I55-R59 PolarHBondContact O-N 3.5Å; G56-R59 PolarHBondContact O-N 3.32Å; R59-W62 PolarHBondContact O-N 2.94Å; R59-R63 WeakPolarHBondContact O-CG 3.23Å; R59-R63 PolarHBondContact O-N 2.96Å; R59-L95 HydrophobicContact CB-CD2 4.44Å; R59-L95 HydrophobicContact CG-CD2 3.56Å; R59-E136 IonicContact CZ-OE1 3.46Å; R59-E136 IonicContact CZ-OE2 3.89Å; R59-E136 IonicContact NE-OE1 3.75Å; R59-E136 IonicContact NE-OE2 2.62Å; R59-E136 PolarHBondContact NE-OE2 3.23Å; R59-E136 IonicContact NH2-OE1 3.66Å; R59-E136 PolarHBondContact NH2-OE1 3.32Å; R59-E136 IonicContact NH2-OE2 3.78Å; R59-E136 PolarHBondContact NH2-OE2 2.83Å
60	A	98.5	Very high	98.3	Very high	46 Å²	46	50.1 Å²	50.1	38%	0.38	27%	0.267	S	S	.	.	H	α-helix	trans	-61.7	-46.2	172.9	0	0	0	0	0	111.2	G56 A57 W62 R63 I64	G56-A60 WeakPolarHBondContact O-CB 3.4Å; G56-A60 PolarHBondContact O-N 3.39Å; A57-A60 PolarHBondContact O-N 3.21Å; A60-W62 PolarHBondContact O-N 2.8Å; A60-R63 PolarHBondContact O-N 3.08Å; A60-I64 WeakPolarHBondContact O-CG1 3.21Å; A60-I64 PolarHBondContact O-N 3.5Å; A60-I64 VanDerWaalsContact O-N 3.11Å
61	S	98.6	Very high	98.3	Very high	47 Å²	47	55.8 Å²	55.8	33%	0.329	29%	0.291	S	S	.	.	H	α-helix	trans	-57.1	-48.6	174.7	-55.6	0	0	0	0	111.3	A57 R58 R63 I64 I65	A57-S61 PolarHBondContact O-N 3.39Å; A57-S61 VanDerWaalsContact O-N 3.07Å; A57-S61 PolarHBondContact O-OG 2.8Å; R58-S61 WeakPolarHBondContact O-CB 3.41Å; R58-S61 PolarHBondContact O-N 3.31Å; S61-R63 PolarHBondContact O-N 2.99Å; S61-I64 PolarHBondContact O-N 2.98Å; S61-I65 WeakPolarHBondContact O-CG1 3.4Å; S61-I65 PolarHBondContact O-N 3.33Å
62	W	98.7	Very high	98.2	Very high	36 Å²	36	56.8 Å²	56.8	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-49.3	178.1	178.1	78	0	0	0	112.4	R58 R59 A60 I64 I65 S66 I91 E92 L95 E136 F137	R58-W62 PolarHBondContact O-N 2.86Å; R59-W62 PolarHBondContact O-N 2.94Å; A60-W62 PolarHBondContact O-N 2.8Å; W62-I64 VanDerWaalsContact C-N 3.33Å; W62-I64 PolarHBondContact O-N 3.3Å; W62-I65 PolarHBondContact O-N 3.14Å; W62-S66 WeakPolarHBondContact O-CB 3.24Å; W62-S66 PolarHBondContact O-N 3.44Å; W62-S66 PolarHBondContact O-OG 3.1Å; W62-S66 VanDerWaalsContact O-OG 3.06Å; W62-I91 HydrophobicContact CB-CG2 3.72Å; W62-E92 PolarHBondContact NE1-OE1 2.89Å; W62-L95 HydrophobicContact CB-CD1 3.78Å; W62-L95 HydrophobicContact CG-CD1 3.9Å; W62-E136 HydrophobicContact CH2-CB 4.34Å; W62-E136 HydrophobicContact CZ3-CB 4.35Å; W62-F137 HydrophobicContact CD2-CB 4.33Å; W62-F137 VanDerWaalsContact CE2-CB 3.48Å; W62-F137 HydrophobicContact CH2-CB 4.09Å; W62-F137 HydrophobicContact CZ2-CB 3.36Å
63	R	98.3	Very high	98.2	Very high	109 Å²	109	54 Å²	54	41%	0.411	29%	0.285	S	S	.	.	H	α-helix	trans	-57.8	-43.5	178.4	-74	-176.2	-178.8	89.2	4.5	113	R59 A60 S61 S67 E136	R59-R63 WeakPolarHBondContact O-CG 3.23Å; R59-R63 PolarHBondContact O-N 2.96Å; A60-R63 PolarHBondContact O-N 3.08Å; S61-R63 PolarHBondContact O-N 2.99Å; R63-S67 WeakPolarHBondContact O-CB 3.27Å; R63-S67 PolarHBondContact O-N 2.83Å; R63-E136 IonicContact NH2-OE2 2.91Å
64	I	98.5	Very high	98.1	Very high	103 Å²	103	56 Å²	56	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-47.8	179	-69.1	166.9	0	0	0	109.9	A60 S61 W62 S67 I68	A60-I64 WeakPolarHBondContact O-CG1 3.21Å; A60-I64 PolarHBondContact O-N 3.5Å; A60-I64 VanDerWaalsContact O-N 3.11Å; S61-I64 PolarHBondContact O-N 2.98Å; W62-I64 VanDerWaalsContact C-N 3.33Å; W62-I64 PolarHBondContact O-N 3.3Å; I64-S67 PolarHBondContact O-N 3.15Å; I64-I68 HydrophobicContact CG2-CD1 3.86Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 3.27Å
65	I	98.6	Very high	98	Very high	26 Å²	26	61.5 Å²	61.5	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-43.1	-179.7	-62.8	-49.2	0	0	0	111.3	S61 W62 S67 I68 E69 I84 Y87 R88 I91	S61-I65 WeakPolarHBondContact O-CG1 3.4Å; S61-I65 PolarHBondContact O-N 3.33Å; W62-I65 PolarHBondContact O-N 3.14Å; I65-S67 VanDerWaalsContact C-N 3.28Å; I65-S67 PolarHBondContact O-N 3.18Å; I65-I68 HydrophobicContact CD1-CD1 4.21Å; I65-I68 PolarHBondContact O-N 3.21Å; I65-I68 VanDerWaalsContact O-N 3.12Å; I65-E69 PolarHBondContact O-N 3.37Å; I65-I84 HydrophobicContact CG2-CG2 3.79Å; I65-Y87 HydrophobicContact CD1-CD1 3.87Å; I65-Y87 HydrophobicContact CD1-CE1 3.79Å; I65-Y87 HydrophobicContact CG1-CD1 3.92Å; I65-Y87 HydrophobicContact CG1-CE1 3.9Å; I65-Y87 HydrophobicContact CG2-CD1 4.24Å; I65-R88 HydrophobicContact CG2-CB 3.84Å; I65-I91 HydrophobicContact CB-CD1 4.22Å; I65-I91 HydrophobicContact CG1-CD1 3.59Å
66	S	98.1	Very high	97.9	Very high	21 Å²	21	63.9 Å²	63.9	15%	0.147	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-37.7	174.1	-60.2	0	0	0	0	112.3	W62 E69 Q70 R88	W62-S66 WeakPolarHBondContact O-CB 3.24Å; W62-S66 PolarHBondContact O-N 3.44Å; W62-S66 PolarHBondContact O-OG 3.1Å; W62-S66 VanDerWaalsContact O-OG 3.06Å; S66-E69 WeakPolarHBondContact O-CB 3.41Å; S66-E69 PolarHBondContact O-N 3.32Å; S66-Q70 WeakPolarHBondContact O-CG 3.37Å; S66-Q70 PolarHBondContact O-N 3.37Å; S66-Q70 VanDerWaalsContact O-N 3.16Å; S66-R88 WeakPolarHBondContact OG-CD 3.44Å
67	S	98.2	Very high	97.8	Very high	45 Å²	45	65.3 Å²	65.3	32%	0.315	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-37	174.7	-176.1	0	0	0	0	112.7	R63 I64 I65 K71	R63-S67 WeakPolarHBondContact O-CB 3.27Å; R63-S67 PolarHBondContact O-N 2.83Å; I64-S67 PolarHBondContact O-N 3.15Å; I65-S67 VanDerWaalsContact C-N 3.28Å; I65-S67 PolarHBondContact O-N 3.18Å; S67-K71 WeakPolarHBondContact O-CG 3.46Å; S67-K71 PolarHBondContact O-N 2.9Å; S67-K71 VanDerWaalsContact O-N 3.17Å
68	I	98.4	Very high	97.7	Very high	69 Å²	69	70.3 Å²	70.3	35%	0.354	37%	0.366	S	S	.	.	H	α-helix	trans	-67.2	-40.8	175.2	-66.9	167.4	0	0	0	110.3	I64 I65 Q70 K71 E72 I84	I64-I68 HydrophobicContact CG2-CD1 3.86Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 3.27Å; I65-I68 HydrophobicContact CD1-CD1 4.21Å; I65-I68 PolarHBondContact O-N 3.21Å; I65-I68 VanDerWaalsContact O-N 3.12Å; I68-Q70 PolarHBondContact O-N 2.98Å; I68-K71 PolarHBondContact O-N 2.59Å; I68-E72 HydrophobicContact CG2-CG 4.45Å; I68-E72 PolarHBondContact O-N 3.24Å; I68-I84 HydrophobicContact CG2-CD1 3.83Å; I68-I84 HydrophobicContact CG2-CG1 4.45Å
69	E	98	Very high	97.6	Very high	14 Å²	14	73.4 Å²	73.4	7%	0.065	39%	0.388	C	S	.	.	H	α-helix	trans	-54.1	-54.6	174.4	-171.5	174.8	151.8	0	0	111	I65 S66 K71 E72 E73 I84 K85 R88	I65-E69 PolarHBondContact O-N 3.37Å; S66-E69 WeakPolarHBondContact O-CB 3.41Å; S66-E69 PolarHBondContact O-N 3.32Å; E69-K71 VanDerWaalsContact C-N 3.27Å; E69-K71 PolarHBondContact O-N 2.99Å; E69-E72 PolarHBondContact O-N 2.66Å; E69-E72 VanDerWaalsContact O-N 3.1Å; E69-E73 WeakPolarHBondContact O-CG 3.37Å; E69-E73 PolarHBondContact O-N 3.1Å; E69-I84 HydrophobicContact CB-CG2 3.6Å; E69-I84 HydrophobicContact CG-CG2 4.14Å; E69-K85 HydrophobicContact CG-CG 4.29Å; E69-K85 WeakPolarHBondContact OE1-CE 3.35Å; E69-K85 VanDerWaalsContact OE1-CG 3.23Å; E69-K85 WeakPolarHBondContact OE1-CG 3.35Å; E69-R88 IonicContact OE1-CZ 3.65Å; E69-R88 IonicContact OE1-NE 3.76Å; E69-R88 IonicContact OE1-NH2 3.86Å; E69-R88 PolarHBondContact OE1-NH2 2.86Å; E69-R88 WeakPolarHBondContact OE2-CD 3.47Å; E69-R88 IonicContact OE2-CZ 3.72Å; E69-R88 IonicContact OE2-NE 3.45Å; E69-R88 PolarHBondContact OE2-NE 3.49Å; E69-R88 IonicContact OE2-NH2 2.71Å; E69-R88 PolarHBondContact OE2-NH2 3.29Å
70	Q	97.4	Very high	97.5	Very high	129 Å²	129	76.8 Å²	76.8	60%	0.603	41%	0.405	S	S	*	.	H	α-helix	trans	-57.4	-39.2	178.6	-70.4	173.1	-6.7	0	0	112.5	S66 I68 S74	S66-Q70 WeakPolarHBondContact O-CG 3.37Å; S66-Q70 PolarHBondContact O-N 3.37Å; S66-Q70 VanDerWaalsContact O-N 3.16Å; I68-Q70 PolarHBondContact O-N 2.98Å; Q70-S74 PolarHBondContact O-N 2.84Å; Q70-S74 PolarHBondContact O-OG 3.41Å
71	K	97.7	Very high	97.5	Very high	119 Å²	119	75.1 Å²	75.1	52%	0.517	39%	0.39	S	S	.	.	H	α-helix	trans	-68.2	-36.7	177.5	-74.1	173.1	-174.8	172.6	0	112.8	S67 I68 E69 S74 K75	S67-K71 WeakPolarHBondContact O-CG 3.46Å; S67-K71 PolarHBondContact O-N 2.9Å; S67-K71 VanDerWaalsContact O-N 3.17Å; I68-K71 PolarHBondContact O-N 2.59Å; E69-K71 VanDerWaalsContact C-N 3.27Å; E69-K71 PolarHBondContact O-N 2.99Å; K71-S74 PolarHBondContact O-OG 2.89Å; K71-K75 WeakPolarHBondContact O-CG 3.44Å
72	E	97.8	Very high	97.5	Very high	24 Å²	24	75.9 Å²	75.9	11%	0.112	40%	0.399	C	S	.	.	H	α-helix	trans	-77.4	-33.6	176.3	-67.3	-60.1	116.9	0	0	111.9	I68 E69 K75 G76 N77 H80 V81 I84	I68-E72 HydrophobicContact CG2-CG 4.45Å; I68-E72 PolarHBondContact O-N 3.24Å; E69-E72 PolarHBondContact O-N 2.66Å; E69-E72 VanDerWaalsContact O-N 3.1Å; E72-K75 PolarHBondContact O-N 3.49Å; E72-K75 VanDerWaalsContact O-N 3.16Å; E72-K75 IonicContact OE1-NZ 2.73Å; E72-K75 PolarHBondContact OE1-NZ 3.23Å; E72-G76 PolarHBondContact O-N 3.33Å; E72-N77 HydrophobicContact CB-CB 4.44Å; E72-N77 PolarHBondContact O-N 3.3Å; E72-N77 VanDerWaalsContact O-N 3.16Å; E72-N77 PolarHBondContact OE2-ND2 2.94Å; E72-H80 HydrophobicContact CB-CB 4.43Å; E72-H80 HydrophobicContact CG-CB 4.34Å; E72-H80 IonicContact OE2-CG 3.79Å; E72-H80 IonicContact OE2-ND1 2.99Å; E72-H80 PolarHBondContact OE2-ND1 3.36Å; E72-V81 HydrophobicContact CB-CG2 3.86Å; E72-I84 HydrophobicContact CB-CD1 3.92Å; E72-I84 HydrophobicContact CG-CD1 3.59Å
73	E	96.9	Very high	97.5	Very high	86 Å²	86	79.8 Å²	79.8	40%	0.402	42%	0.421	S	S	.	.	H	α-helix	trans	-59.9	-46.4	172	-76.3	-176.1	155.2	0	0	111.3	E69 K75 G76 V81 K85	E69-E73 WeakPolarHBondContact O-CG 3.37Å; E69-E73 PolarHBondContact O-N 3.1Å; E73-K75 PolarHBondContact O-N 3.15Å; E73-G76 PolarHBondContact O-N 2.94Å; E73-V81 HydrophobicContact CB-CG2 4.25Å; E73-V81 HydrophobicContact CG-CB 4.25Å; E73-V81 HydrophobicContact CG-CG1 3.62Å; E73-V81 HydrophobicContact CG-CG2 3.52Å; E73-K85 VanDerWaalsContact OE1-CE 3.25Å; E73-K85 WeakPolarHBondContact OE1-CE 3.41Å; E73-K85 IonicContact OE1-NZ 2.74Å; E73-K85 PolarHBondContact OE1-NZ 3.23Å
74	S	97.1	Very high	97.5	Very high	99 Å²	99	75.8 Å²	75.8	69%	0.692	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.1	176.6	60.7	0	0	0	0	114.8	Q70 K71	Q70-S74 PolarHBondContact O-N 2.84Å; Q70-S74 PolarHBondContact O-OG 3.41Å; K71-S74 PolarHBondContact O-OG 2.89Å
75	K	96.8	Very high	97.5	Very high	129 Å²	129	75 Å²	75	56%	0.561	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-8.6	173.2	-66	171.5	-167.3	168.5	0	113.1	K71 E72 E73 N77	K71-K75 WeakPolarHBondContact O-CG 3.44Å; E72-K75 PolarHBondContact O-N 3.49Å; E72-K75 VanDerWaalsContact O-N 3.16Å; E72-K75 IonicContact OE1-NZ 2.73Å; E72-K75 PolarHBondContact OE1-NZ 3.23Å; E73-K75 PolarHBondContact O-N 3.15Å; K75-N77 VanDerWaalsContact C-N 3.31Å
76	G	95.6	Very high	97.5	Very high	53 Å²	53	80 Å²	80	55%	0.546	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	21.9	-173.4	0	0	0	0	0	113.9	E72 E73 E78	E72-G76 PolarHBondContact O-N 3.33Å; E73-G76 PolarHBondContact O-N 2.94Å; G76-E78 VanDerWaalsContact C-N 3.27Å; G76-E78 PolarHBondContact O-N 3.29Å
77	N	95.6	Very high	97.5	Very high	60 Å²	60	85 Å²	85	32%	0.321	44%	0.444	S	S	.	.			trans	-82.4	68.2	-178.7	-70	-18.4	0	0	0	111.2	E72 K75 D79 H80 V81	E72-N77 HydrophobicContact CB-CB 4.44Å; E72-N77 PolarHBondContact O-N 3.3Å; E72-N77 VanDerWaalsContact O-N 3.16Å; E72-N77 PolarHBondContact OE2-ND2 2.94Å; K75-N77 VanDerWaalsContact C-N 3.31Å; N77-D79 VanDerWaalsContact C-N 3.31Å; N77-D79 PolarHBondContact O-N 3.41Å; N77-H80 HydrophobicContact CB-CB 4.08Å; N77-H80 PolarHBondContact O-N 3.49Å; N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 2.92Å
78	E	95.8	Very high	97.5	Very high	161 Å²	161	85.5 Å²	85.5	75%	0.752	44%	0.439	S	S	*	.	H	α-helix	trans	-53.4	-42	-171.8	-65.1	-174.3	174.6	0	0	113.8	G76 H80 V81 A82	G76-E78 VanDerWaalsContact C-N 3.27Å; G76-E78 PolarHBondContact O-N 3.29Å; E78-H80 PolarHBondContact O-N 2.95Å; E78-V81 PolarHBondContact O-N 3.06Å; E78-A82 PolarHBondContact O-N 3.23Å
79	D	96.4	Very high	97.5	Very high	136 Å²	136	83.5 Å²	83.5	73%	0.727	44%	0.435	S	S	*	.	H	α-helix	trans	-62.7	-42.5	178.3	-71	-23.5	0	0	0	112.2	N77 A82 I83	N77-D79 VanDerWaalsContact C-N 3.31Å; N77-D79 PolarHBondContact O-N 3.41Å; D79-A82 PolarHBondContact O-N 3.41Å; D79-I83 WeakPolarHBondContact O-CG1 3.31Å; D79-I83 PolarHBondContact O-N 2.95Å
80	H	97.4	Very high	97.5	Very high	100 Å²	100	88.5 Å²	88.5	46%	0.463	46%	0.457	S	S	.	.	H	α-helix	trans	-67.3	-42.3	176	-70.3	178.8	0	0	0	111.1	E72 N77 E78 A82 I83 I84	E72-H80 HydrophobicContact CB-CB 4.43Å; E72-H80 HydrophobicContact CG-CB 4.34Å; E72-H80 IonicContact OE2-CG 3.79Å; E72-H80 IonicContact OE2-ND1 2.99Å; E72-H80 PolarHBondContact OE2-ND1 3.36Å; N77-H80 HydrophobicContact CB-CB 4.08Å; N77-H80 PolarHBondContact O-N 3.49Å; E78-H80 PolarHBondContact O-N 2.95Å; H80-A82 VanDerWaalsContact C-N 3.27Å; H80-A82 PolarHBondContact O-N 3.39Å; H80-I83 PolarHBondContact O-N 3.11Å; H80-I84 HydrophobicContact CB-CD1 4.36Å; H80-I84 WeakPolarHBondContact O-CB 3.46Å; H80-I84 WeakPolarHBondContact O-CD1 3.3Å; H80-I84 WeakPolarHBondContact O-CG1 3.46Å; H80-I84 PolarHBondContact O-N 3.35Å
81	V	98.3	Very high	97.6	Very high	12 Å²	12	82.5 Å²	82.5	7%	0.073	43%	0.429	C	S	.	.	H	α-helix	trans	-58.4	-42	178.2	171.6	0	0	0	0	110.8	E72 E73 N77 E78 I84 K85	E72-V81 HydrophobicContact CB-CG2 3.86Å; E73-V81 HydrophobicContact CB-CG2 4.25Å; E73-V81 HydrophobicContact CG-CB 4.25Å; E73-V81 HydrophobicContact CG-CG1 3.62Å; E73-V81 HydrophobicContact CG-CG2 3.52Å; N77-V81 WeakPolarHBondContact O-CG2 3.48Å; N77-V81 PolarHBondContact O-N 2.92Å; E78-V81 PolarHBondContact O-N 3.06Å; V81-I84 PolarHBondContact O-N 3.25Å; V81-K85 HydrophobicContact CG1-CD 3.93Å; V81-K85 HydrophobicContact CG1-CG 4.42Å; V81-K85 WeakPolarHBondContact O-CB 3.25Å; V81-K85 WeakPolarHBondContact O-CG 3.49Å; V81-K85 PolarHBondContact O-N 3.16Å
82	A	97.9	Very high	97.6	Very high	62 Å²	62	78.5 Å²	78.5	51%	0.512	41%	0.412	S	S	.	.	H	α-helix	trans	-60.8	-45.3	176.6	0	0	0	0	0	112.3	E78 D79 H80 K85 D86	E78-A82 PolarHBondContact O-N 3.23Å; D79-A82 PolarHBondContact O-N 3.41Å; H80-A82 VanDerWaalsContact C-N 3.27Å; H80-A82 PolarHBondContact O-N 3.39Å; A82-K85 PolarHBondContact O-N 3.47Å; A82-D86 PolarHBondContact O-N 2.85Å; A82-D86 VanDerWaalsContact O-N 3.16Å
83	I	98.2	Very high	97.7	Very high	119 Å²	119	80.4 Å²	80.4	61%	0.61	43%	0.428	S	S	*	.	H	α-helix	trans	-63.8	-42.2	177	-64.3	166.5	0	0	0	111	D79 H80 D86 Y87	D79-I83 WeakPolarHBondContact O-CG1 3.31Å; D79-I83 PolarHBondContact O-N 2.95Å; H80-I83 PolarHBondContact O-N 3.11Å; I83-D86 PolarHBondContact O-N 3.47Å; I83-Y87 PolarHBondContact O-N 2.85Å; I83-Y87 VanDerWaalsContact O-N 3.09Å
84	I	98.5	Very high	97.7	Very high	25 Å²	25	78.7 Å²	78.7	13%	0.128	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-41	-180	-66.9	159.3	0	0	0	110.8	I65 I68 E69 E72 H80 V81 D86 Y87 R88	I65-I84 HydrophobicContact CG2-CG2 3.79Å; I68-I84 HydrophobicContact CG2-CD1 3.83Å; I68-I84 HydrophobicContact CG2-CG1 4.45Å; E69-I84 HydrophobicContact CB-CG2 3.6Å; E69-I84 HydrophobicContact CG-CG2 4.14Å; E72-I84 HydrophobicContact CB-CD1 3.92Å; E72-I84 HydrophobicContact CG-CD1 3.59Å; H80-I84 HydrophobicContact CB-CD1 4.36Å; H80-I84 WeakPolarHBondContact O-CB 3.46Å; H80-I84 WeakPolarHBondContact O-CD1 3.3Å; H80-I84 WeakPolarHBondContact O-CG1 3.46Å; H80-I84 PolarHBondContact O-N 3.35Å; V81-I84 PolarHBondContact O-N 3.25Å; I84-D86 PolarHBondContact O-N 2.84Å; I84-Y87 PolarHBondContact O-N 3.3Å; I84-R88 WeakPolarHBondContact O-CB 2.99Å; I84-R88 PolarHBondContact O-N 3.33Å
85	K	98.3	Very high	97.8	Very high	86 Å²	86	74 Å²	74	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-60.4	-43.5	176.2	-81	174.9	178.9	166.5	0	112.2	E69 E73 V81 A82 R88 G89	E69-K85 HydrophobicContact CG-CG 4.29Å; E69-K85 WeakPolarHBondContact OE1-CE 3.35Å; E69-K85 VanDerWaalsContact OE1-CG 3.23Å; E69-K85 WeakPolarHBondContact OE1-CG 3.35Å; E73-K85 VanDerWaalsContact OE1-CE 3.25Å; E73-K85 WeakPolarHBondContact OE1-CE 3.41Å; E73-K85 IonicContact OE1-NZ 2.74Å; E73-K85 PolarHBondContact OE1-NZ 3.23Å; V81-K85 HydrophobicContact CG1-CD 3.93Å; V81-K85 HydrophobicContact CG1-CG 4.42Å; V81-K85 WeakPolarHBondContact O-CB 3.25Å; V81-K85 WeakPolarHBondContact O-CG 3.49Å; V81-K85 PolarHBondContact O-N 3.16Å; A82-K85 PolarHBondContact O-N 3.47Å; K85-R88 PolarHBondContact O-N 2.91Å; K85-G89 PolarHBondContact O-N 3.07Å
86	D	98.3	Very high	97.9	Very high	132 Å²	132	68.6 Å²	68.6	71%	0.706	37%	0.365	S	S	*	.	H	α-helix	trans	-61.7	-46	175.5	-175.6	66.2	0	0	0	111.3	A82 I83 I84 R88 G89 K90	A82-D86 PolarHBondContact O-N 2.85Å; A82-D86 VanDerWaalsContact O-N 3.16Å; I83-D86 PolarHBondContact O-N 3.47Å; I84-D86 PolarHBondContact O-N 2.84Å; D86-R88 PolarHBondContact O-N 3.35Å; D86-G89 PolarHBondContact O-N 3.46Å; D86-K90 PolarHBondContact O-N 3.15Å
87	Y	98.5	Very high	98.1	Very high	124 Å²	124	73.3 Å²	73.3	49%	0.486	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-39.4	177.9	-170.7	-123.5	0	0	0	112.8	I65 I83 I84 G89 K90 I91	I65-Y87 HydrophobicContact CD1-CD1 3.87Å; I65-Y87 HydrophobicContact CD1-CE1 3.79Å; I65-Y87 HydrophobicContact CG1-CD1 3.92Å; I65-Y87 HydrophobicContact CG1-CE1 3.9Å; I65-Y87 HydrophobicContact CG2-CD1 4.24Å; I83-Y87 PolarHBondContact O-N 2.85Å; I83-Y87 VanDerWaalsContact O-N 3.09Å; I84-Y87 PolarHBondContact O-N 3.3Å; Y87-G89 VanDerWaalsContact C-N 3.35Å; Y87-K90 WeakPolarHBondContact O-CB 3.27Å; Y87-K90 PolarHBondContact O-N 2.93Å; Y87-I91 HydrophobicContact CD1-CD1 4.21Å; Y87-I91 HydrophobicContact CE1-CD1 3.91Å; Y87-I91 PolarHBondContact O-N 2.87Å
88	R	98.4	Very high	98.2	Very high	57 Å²	57	71.6 Å²	71.6	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-45.7	172	-178.4	174.7	54.9	103.9	-14	110.9	I65 S66 E69 I84 K85 D86 K90 I91 E92	I65-R88 HydrophobicContact CG2-CB 3.84Å; S66-R88 WeakPolarHBondContact OG-CD 3.44Å; E69-R88 IonicContact OE1-CZ 3.65Å; E69-R88 IonicContact OE1-NE 3.76Å; E69-R88 IonicContact OE1-NH2 3.86Å; E69-R88 PolarHBondContact OE1-NH2 2.86Å; E69-R88 WeakPolarHBondContact OE2-CD 3.47Å; E69-R88 IonicContact OE2-CZ 3.72Å; E69-R88 IonicContact OE2-NE 3.45Å; E69-R88 PolarHBondContact OE2-NE 3.49Å; E69-R88 IonicContact OE2-NH2 2.71Å; E69-R88 PolarHBondContact OE2-NH2 3.29Å; I84-R88 WeakPolarHBondContact O-CB 2.99Å; I84-R88 PolarHBondContact O-N 3.33Å; K85-R88 PolarHBondContact O-N 2.91Å; D86-R88 PolarHBondContact O-N 3.35Å; R88-K90 VanDerWaalsContact C-N 3.26Å; R88-K90 PolarHBondContact O-N 3.42Å; R88-I91 WeakPolarHBondContact O-CA 3.4Å; R88-I91 WeakPolarHBondContact O-CB 3.47Å; R88-I91 PolarHBondContact O-N 3.42Å; R88-E92 WeakPolarHBondContact CD-OE1 3.44Å; R88-E92 HydrophobicContact CG-CG 4.25Å; R88-E92 WeakPolarHBondContact CG-OE1 3.37Å; R88-E92 IonicContact CZ-OE1 3.36Å; R88-E92 IonicContact NE-OE1 3.63Å; R88-E92 IonicContact NH1-OE1 3.75Å; R88-E92 PolarHBondContact NH1-OE1 3.28Å; R88-E92 IonicContact NH1-OE2 3.1Å; R88-E92 WeakPolarHBondContact O-CG 3.4Å; R88-E92 PolarHBondContact O-N 2.94Å
89	G	98.4	Very high	98.3	Very high	26 Å²	26	64 Å²	64	27%	0.268	33%	0.326	S	S	.	.	H	α-helix	trans	-59.5	-34.7	178	0	0	0	0	0	113.3	K85 D86 Y87 E92 S93	K85-G89 PolarHBondContact O-N 3.07Å; D86-G89 PolarHBondContact O-N 3.46Å; Y87-G89 VanDerWaalsContact C-N 3.35Å; G89-E92 PolarHBondContact O-N 3.03Å; G89-S93 WeakPolarHBondContact O-CB 3.13Å; G89-S93 PolarHBondContact O-N 3.19Å; G89-S93 PolarHBondContact O-OG 2.92Å
90	K	98.6	Very high	98.4	Very high	120 Å²	120	61.1 Å²	61.1	52%	0.522	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-46.8	170.6	-178.1	-178.1	174.4	-176.2	0	111.8	D86 Y87 R88 E92 S93 E94	D86-K90 PolarHBondContact O-N 3.15Å; Y87-K90 WeakPolarHBondContact O-CB 3.27Å; Y87-K90 PolarHBondContact O-N 2.93Å; R88-K90 VanDerWaalsContact C-N 3.26Å; R88-K90 PolarHBondContact O-N 3.42Å; K90-E92 VanDerWaalsContact C-N 3.34Å; K90-E92 PolarHBondContact O-N 3.18Å; K90-S93 WeakPolarHBondContact O-CB 3.15Å; K90-S93 PolarHBondContact O-N 2.9Å; K90-E94 VanDerWaalsContact CE-OE1 3.26Å; K90-E94 WeakPolarHBondContact CE-OE1 3.46Å; K90-E94 WeakPolarHBondContact O-CG 3.29Å; K90-E94 PolarHBondContact O-N 3.48Å
91	I	98.7	Very high	98.5	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-40.6	178.2	-63.1	170	0	0	0	110.8	R58 W62 I65 Y87 R88 S93 E94 L95	R58-I91 HydrophobicContact CG-CG2 4.15Å; W62-I91 HydrophobicContact CB-CG2 3.72Å; I65-I91 HydrophobicContact CB-CD1 4.22Å; I65-I91 HydrophobicContact CG1-CD1 3.59Å; Y87-I91 HydrophobicContact CD1-CD1 4.21Å; Y87-I91 HydrophobicContact CE1-CD1 3.91Å; Y87-I91 PolarHBondContact O-N 2.87Å; R88-I91 WeakPolarHBondContact O-CA 3.4Å; R88-I91 WeakPolarHBondContact O-CB 3.47Å; R88-I91 PolarHBondContact O-N 3.42Å; I91-S93 VanDerWaalsContact C-N 3.31Å; I91-S93 PolarHBondContact O-N 3.28Å; I91-E94 WeakPolarHBondContact O-CB 3.33Å; I91-E94 PolarHBondContact O-N 3.41Å; I91-E94 VanDerWaalsContact O-N 3.17Å; I91-L95 HydrophobicContact CG2-CD1 4.36Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 3.26Å
92	E	98.7	Very high	98.5	Very high	34 Å²	34	56.7 Å²	56.7	16%	0.159	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-39.4	175.6	-71.2	174.1	175.9	0	0	111.7	W62 R88 G89 K90 E94 L95 S96 F137	W62-E92 PolarHBondContact NE1-OE1 2.89Å; R88-E92 WeakPolarHBondContact CD-OE1 3.44Å; R88-E92 HydrophobicContact CG-CG 4.25Å; R88-E92 WeakPolarHBondContact CG-OE1 3.37Å; R88-E92 IonicContact CZ-OE1 3.36Å; R88-E92 IonicContact NE-OE1 3.63Å; R88-E92 IonicContact NH1-OE1 3.75Å; R88-E92 PolarHBondContact NH1-OE1 3.28Å; R88-E92 IonicContact NH1-OE2 3.1Å; R88-E92 WeakPolarHBondContact O-CG 3.4Å; R88-E92 PolarHBondContact O-N 2.94Å; G89-E92 PolarHBondContact O-N 3.03Å; K90-E92 VanDerWaalsContact C-N 3.34Å; K90-E92 PolarHBondContact O-N 3.18Å; E92-E94 VanDerWaalsContact C-N 3.33Å; E92-E94 PolarHBondContact O-N 3.49Å; E92-L95 WeakPolarHBondContact O-CB 3.4Å; E92-L95 PolarHBondContact O-N 3.41Å; E92-S96 PolarHBondContact O-N 3.09Å; E92-S96 PolarHBondContact O-OG 2.93Å; E92-F137 HydrophobicContact CB-CD2 3.71Å; E92-F137 HydrophobicContact CB-CE2 3.9Å; E92-F137 HydrophobicContact CG-CB 4.12Å; E92-F137 HydrophobicContact CG-CD2 3.61Å; E92-F137 HydrophobicContact CG-CE2 4.29Å; E92-F137 HydrophobicContact CG-CG 4.08Å
93	S	98.6	Very high	98.5	Very high	65 Å²	65	54.1 Å²	54.1	46%	0.455	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-37.5	173.8	-59.9	0	0	0	0	112.3	G89 K90 I91 K97	G89-S93 WeakPolarHBondContact O-CB 3.13Å; G89-S93 PolarHBondContact O-N 3.19Å; G89-S93 PolarHBondContact O-OG 2.92Å; K90-S93 WeakPolarHBondContact O-CB 3.15Å; K90-S93 PolarHBondContact O-N 2.9Å; I91-S93 VanDerWaalsContact C-N 3.31Å; I91-S93 PolarHBondContact O-N 3.28Å; S93-K97 VanDerWaalsContact O-CG 3.3Å; S93-K97 WeakPolarHBondContact O-CG 3.42Å; S93-K97 PolarHBondContact O-N 2.98Å; S93-K97 VanDerWaalsContact O-N 3.15Å
94	E	98.6	Very high	98.5	Very high	50 Å²	50	53.3 Å²	53.3	23%	0.234	27%	0.268	C	S	.	.	H	α-helix	trans	-67.3	-43.1	173.8	-68.7	167.5	-176.3	0	0	111.2	R58 K90 I91 E92 K97 I98	R58-E94 VanDerWaalsContact CD-OE2 3.24Å; R58-E94 WeakPolarHBondContact CD-OE2 3.23Å; R58-E94 HydrophobicContact CG-CB 4.19Å; R58-E94 IonicContact CZ-OE2 2.78Å; R58-E94 IonicContact NE-OE2 3.59Å; R58-E94 IonicContact NH1-OE2 2.98Å; R58-E94 PolarHBondContact NH1-OE2 2.92Å; K90-E94 VanDerWaalsContact CE-OE1 3.26Å; K90-E94 WeakPolarHBondContact CE-OE1 3.46Å; K90-E94 WeakPolarHBondContact O-CG 3.29Å; K90-E94 PolarHBondContact O-N 3.48Å; I91-E94 WeakPolarHBondContact O-CB 3.33Å; I91-E94 PolarHBondContact O-N 3.41Å; I91-E94 VanDerWaalsContact O-N 3.17Å; E92-E94 VanDerWaalsContact C-N 3.33Å; E92-E94 PolarHBondContact O-N 3.49Å; E94-K97 PolarHBondContact O-N 2.89Å; E94-I98 WeakPolarHBondContact O-CD1 3.43Å; E94-I98 VanDerWaalsContact O-CG1 3.3Å; E94-I98 WeakPolarHBondContact O-CG1 3.31Å; E94-I98 PolarHBondContact O-N 3.47Å; E94-I98 VanDerWaalsContact O-N 3.09Å
95	L	98.6	Very high	98.5	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-47.2	174.3	-77.7	172.2	0	0	0	112.2	I55 R58 R59 W62 I91 E92 K97 I98 C99 F137	I55-L95 HydrophobicContact CD1-CD2 3.58Å; I55-L95 HydrophobicContact CG1-CD2 4.32Å; R58-L95 HydrophobicContact CB-CD2 3.65Å; R58-L95 HydrophobicContact CB-CG 4.3Å; R58-L95 HydrophobicContact CG-CD2 3.71Å; R58-L95 HydrophobicContact CG-CG 3.79Å; R59-L95 HydrophobicContact CB-CD2 4.44Å; R59-L95 HydrophobicContact CG-CD2 3.56Å; W62-L95 HydrophobicContact CB-CD1 3.78Å; W62-L95 HydrophobicContact CG-CD1 3.9Å; I91-L95 HydrophobicContact CG2-CD1 4.36Å; I91-L95 WeakPolarHBondContact O-CG 3.4Å; I91-L95 PolarHBondContact O-N 3.26Å; E92-L95 WeakPolarHBondContact O-CB 3.4Å; E92-L95 PolarHBondContact O-N 3.41Å; L95-K97 VanDerWaalsContact C-N 3.35Å; L95-K97 PolarHBondContact O-N 3.34Å; L95-I98 PolarHBondContact O-N 3.02Å; L95-C99 PolarHBondContact O-N 3.32Å; L95-C99 PolarHBondContact O-SG 3.47Å; L95-F137 HydrophobicContact CB-CD1 4.49Å; L95-F137 HydrophobicContact CB-CE1 3.69Å; L95-F137 HydrophobicContact CB-CE2 4.46Å; L95-F137 HydrophobicContact CB-CZ 3.66Å; L95-F137 HydrophobicContact CD1-CD1 3.97Å; L95-F137 HydrophobicContact CD1-CE1 3.98Å; L95-F137 HydrophobicContact CG-CE1 4.42Å
96	S	98.6	Very high	98.5	Very high	14 Å²	14	48.2 Å²	48.2	10%	0.098	25%	0.246	C	C	.	.	H	α-helix	trans	-57.5	-48.2	176.5	-74.5	0	0	0	0	111	E92 I98 C99 D100 F137 K138	E92-S96 PolarHBondContact O-N 3.09Å; E92-S96 PolarHBondContact O-OG 2.93Å; S96-I98 VanDerWaalsContact C-N 3.32Å; S96-I98 PolarHBondContact O-N 3.48Å; S96-C99 PolarHBondContact O-N 2.71Å; S96-C99 VanDerWaalsContact O-N 3.14Å; S96-D100 WeakPolarHBondContact O-CB 3.38Å; S96-D100 PolarHBondContact O-N 3.17Å; S96-F137 WeakPolarHBondContact OG-CE2 3.4Å; S96-F137 WeakPolarHBondContact OG-CZ 3.44Å; S96-K138 WeakPolarHBondContact OG-CE 3.48Å
97	K	98.6	Very high	98.5	Very high	153 Å²	153	46.2 Å²	46.2	67%	0.665	23%	0.232	S	C	*	.	H	α-helix	trans	-57.8	-41.7	177.7	-72.8	171.3	-175.1	177.7	0	113.2	S93 E94 L95 G101	S93-K97 VanDerWaalsContact O-CG 3.3Å; S93-K97 WeakPolarHBondContact O-CG 3.42Å; S93-K97 PolarHBondContact O-N 2.98Å; S93-K97 VanDerWaalsContact O-N 3.15Å; E94-K97 PolarHBondContact O-N 2.89Å; L95-K97 VanDerWaalsContact C-N 3.35Å; L95-K97 PolarHBondContact O-N 3.34Å; K97-G101 PolarHBondContact O-N 3.48Å
98	I	98.6	Very high	98.4	Very high	24 Å²	24	43.5 Å²	43.5	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-44.9	178	-62.5	156.2	0	0	0	110.3	Y51 V54 I55 R58 E94 L95 S96 G101 I102	Y51-I98 HydrophobicContact CD1-CG2 4.1Å; Y51-I98 HydrophobicContact CE1-CG2 4.27Å; V54-I98 HydrophobicContact CG1-CD1 3.74Å; V54-I98 HydrophobicContact CG1-CG1 3.93Å; V54-I98 HydrophobicContact CG1-CG2 4.17Å; I55-I98 HydrophobicContact CB-CG2 4.02Å; I55-I98 HydrophobicContact CD1-CB 3.8Å; I55-I98 HydrophobicContact CD1-CD1 4.28Å; I55-I98 HydrophobicContact CD1-CG2 3.59Å; I55-I98 HydrophobicContact CG1-CG2 4.35Å; R58-I98 HydrophobicContact CB-CD1 3.97Å; R58-I98 HydrophobicContact CG-CD1 4.04Å; E94-I98 WeakPolarHBondContact O-CD1 3.43Å; E94-I98 VanDerWaalsContact O-CG1 3.3Å; E94-I98 WeakPolarHBondContact O-CG1 3.31Å; E94-I98 PolarHBondContact O-N 3.47Å; E94-I98 VanDerWaalsContact O-N 3.09Å; L95-I98 PolarHBondContact O-N 3.02Å; S96-I98 VanDerWaalsContact C-N 3.32Å; S96-I98 PolarHBondContact O-N 3.48Å; I98-G101 PolarHBondContact O-N 3.4Å; I98-I102 PolarHBondContact O-N 3.3Å
99	C	98.7	Very high	98.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-47	178.4	-62.8	0	0	0	0	111.2	L95 S96 G101 I102 L103 Y130 L134	L95-C99 PolarHBondContact O-N 3.32Å; L95-C99 PolarHBondContact O-SG 3.47Å; S96-C99 PolarHBondContact O-N 2.71Å; S96-C99 VanDerWaalsContact O-N 3.14Å; C99-G101 VanDerWaalsContact C-N 3.28Å; C99-G101 PolarHBondContact O-N 2.89Å; C99-I102 VanDerWaalsContact O-CG2 3.23Å; C99-I102 WeakPolarHBondContact O-CG2 3.28Å; C99-I102 PolarHBondContact O-N 3.35Å; C99-L103 HydrophobicContact CB-CD1 4.44Å; C99-L103 VanDerWaalsContact O-CB 3.29Å; C99-L103 WeakPolarHBondContact O-CB 3.35Å; C99-L103 WeakPolarHBondContact O-CG 3.28Å; C99-L103 PolarHBondContact O-N 3.04Å; C99-Y130 HydrophobicContact CB-CD1 4.25Å; C99-L134 HydrophobicContact CB-CD1 4.12Å; C99-L134 HydrophobicContact CB-CD2 3.74Å; C99-L134 HydrophobicContact CB-CG 3.8Å
100	D	98.4	Very high	98.4	Very high	77 Å²	77	42.4 Å²	42.4	41%	0.412	23%	0.226	S	C	.	.	H	α-helix	trans	-61.2	-39	179	-62.6	-20.2	0	0	0	111	S96 N104	S96-D100 WeakPolarHBondContact O-CB 3.38Å; S96-D100 PolarHBondContact O-N 3.17Å; D100-N104 VanDerWaalsContact O-CB 3.26Å; D100-N104 WeakPolarHBondContact O-CB 3.45Å; D100-N104 PolarHBondContact O-N 2.93Å; D100-N104 PolarHBondContact O-ND2 2.83Å
101	G	98.1	Very high	98.3	Very high	18 Å²	18	38.9 Å²	38.9	19%	0.186	21%	0.212	C	C	.	.	H	α-helix	trans	-54.9	-56.8	175.6	0	0	0	0	0	112.6	Y51 K97 I98 C99 N104 V105	Y51-G101 VanDerWaalsContact OH-C 3.28Å; K97-G101 PolarHBondContact O-N 3.48Å; I98-G101 PolarHBondContact O-N 3.4Å; C99-G101 VanDerWaalsContact C-N 3.28Å; C99-G101 PolarHBondContact O-N 2.89Å; G101-N104 PolarHBondContact O-N 3.23Å; G101-V105 WeakPolarHBondContact O-CG2 3.37Å; G101-V105 PolarHBondContact O-N 3.34Å; G101-V105 VanDerWaalsContact O-N 3.16Å
102	I	98.5	Very high	98.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-70.1	-38.5	-179.7	-177.4	61.5	0	0	0	112.8	L47 Y51 I98 C99 N104 V105 L106 M126 Y130	L47-I102 HydrophobicContact CD2-CD1 4.41Å; Y51-I102 HydrophobicContact CD1-CB 3.74Å; Y51-I102 HydrophobicContact CD1-CG1 4.44Å; Y51-I102 HydrophobicContact CD1-CG2 4.16Å; Y51-I102 HydrophobicContact CD2-CB 4.36Å; Y51-I102 HydrophobicContact CD2-CD1 3.86Å; Y51-I102 HydrophobicContact CD2-CG1 4.44Å; Y51-I102 HydrophobicContact CE1-CB 3.51Å; Y51-I102 HydrophobicContact CE1-CG2 4.12Å; Y51-I102 HydrophobicContact CE2-CB 4.16Å; Y51-I102 HydrophobicContact CE2-CD1 3.89Å; Y51-I102 HydrophobicContact CG-CB 4.14Å; Y51-I102 HydrophobicContact CG-CD1 4.27Å; Y51-I102 HydrophobicContact CG-CG1 4.37Å; Y51-I102 PolarHBondContact OH-N 3.02Å; I98-I102 PolarHBondContact O-N 3.3Å; C99-I102 VanDerWaalsContact O-CG2 3.23Å; C99-I102 WeakPolarHBondContact O-CG2 3.28Å; C99-I102 PolarHBondContact O-N 3.35Å; I102-N104 VanDerWaalsContact C-N 3.29Å; I102-N104 PolarHBondContact O-N 3.16Å; I102-V105 PolarHBondContact O-N 3.39Å; I102-V105 VanDerWaalsContact O-N 3.17Å; I102-L106 HydrophobicContact CD1-CD1 4.27Å; I102-L106 HydrophobicContact CD1-CD2 4.48Å; I102-L106 HydrophobicContact CD1-CG 3.99Å; I102-L106 HydrophobicContact CG1-CD1 3.76Å; I102-L106 HydrophobicContact CG1-CG 4.01Å; I102-L106 WeakPolarHBondContact O-CB 3.37Å; I102-L106 VanDerWaalsContact O-CG 3.25Å; I102-L106 WeakPolarHBondContact O-CG 3.22Å; I102-L106 PolarHBondContact O-N 3.36Å; I102-M126 HydrophobicContact CD1-CE 3.6Å; I102-M126 HydrophobicContact CD1-SD 3.96Å; I102-M126 HydrophobicContact CG1-CE 3.74Å; I102-M126 HydrophobicContact CG1-CG 4.49Å; I102-M126 HydrophobicContact CG1-SD 4.16Å; I102-Y130 HydrophobicContact CG1-CD2 4.18Å; I102-Y130 HydrophobicContact CG1-CE2 4.15Å; I102-Y130 HydrophobicContact CG2-CD1 3.34Å; I102-Y130 HydrophobicContact CG2-CD2 3.58Å; I102-Y130 HydrophobicContact CG2-CE1 3.63Å; I102-Y130 HydrophobicContact CG2-CE2 3.89Å; I102-Y130 HydrophobicContact CG2-CG 3.33Å
103	L	98.8	Very high	98	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-43.2	178.3	-71.9	171.2	0	0	0	110.5	C99 V105 L106 E107 K127 L134	C99-L103 HydrophobicContact CB-CD1 4.44Å; C99-L103 VanDerWaalsContact O-CB 3.29Å; C99-L103 WeakPolarHBondContact O-CB 3.35Å; C99-L103 WeakPolarHBondContact O-CG 3.28Å; C99-L103 PolarHBondContact O-N 3.04Å; L103-V105 PolarHBondContact O-N 3.24Å; L103-L106 PolarHBondContact O-N 2.7Å; L103-E107 WeakPolarHBondContact O-CB 3.25Å; L103-E107 WeakPolarHBondContact O-CG 3.43Å; L103-E107 PolarHBondContact O-N 3Å; L103-K127 HydrophobicContact CD2-CB 4.46Å; L103-K127 HydrophobicContact CD2-CG 3.92Å; L103-L134 HydrophobicContact CD1-CD1 3.86Å
104	N	98.4	Very high	97.8	Very high	101 Å²	101	40.5 Å²	40.5	54%	0.54	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-43.7	174.4	-74.2	-38.8	0	0	0	112.2	D100 G101 I102 A108	D100-N104 VanDerWaalsContact O-CB 3.26Å; D100-N104 WeakPolarHBondContact O-CB 3.45Å; D100-N104 PolarHBondContact O-N 2.93Å; D100-N104 PolarHBondContact O-ND2 2.83Å; G101-N104 PolarHBondContact O-N 3.23Å; I102-N104 VanDerWaalsContact C-N 3.29Å; I102-N104 PolarHBondContact O-N 3.16Å; N104-A108 WeakPolarHBondContact O-CB 3.26Å; N104-A108 PolarHBondContact O-N 3.17Å
105	V	98.2	Very high	97.6	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-42	177.8	172.8	0	0	0	0	111.5	E28 A31 G101 I102 L103 H109 L110	E28-V105 HydrophobicContact CG-CG2 4.01Å; A31-V105 HydrophobicContact CB-CG1 3.55Å; G101-V105 WeakPolarHBondContact O-CG2 3.37Å; G101-V105 PolarHBondContact O-N 3.34Å; G101-V105 VanDerWaalsContact O-N 3.16Å; I102-V105 PolarHBondContact O-N 3.39Å; I102-V105 VanDerWaalsContact O-N 3.17Å; L103-V105 PolarHBondContact O-N 3.24Å; V105-H109 WeakPolarHBondContact O-CB 3.39Å; V105-H109 PolarHBondContact O-N 3.43Å; V105-H109 VanDerWaalsContact O-N 3.11Å; V105-L110 HydrophobicContact CG1-CD1 3.83Å; V105-L110 HydrophobicContact CG1-CG 4.14Å; V105-L110 PolarHBondContact O-N 3.03Å
106	L	98.5	Very high	97.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-63.4	-48.9	178	-71.8	168.4	0	0	0	111.3	I102 L103 L110 I111 Y123 M126 K127	I102-L106 HydrophobicContact CD1-CD1 4.27Å; I102-L106 HydrophobicContact CD1-CD2 4.48Å; I102-L106 HydrophobicContact CD1-CG 3.99Å; I102-L106 HydrophobicContact CG1-CD1 3.76Å; I102-L106 HydrophobicContact CG1-CG 4.01Å; I102-L106 WeakPolarHBondContact O-CB 3.37Å; I102-L106 VanDerWaalsContact O-CG 3.25Å; I102-L106 WeakPolarHBondContact O-CG 3.22Å; I102-L106 PolarHBondContact O-N 3.36Å; L103-L106 PolarHBondContact O-N 2.7Å; L106-L110 HydrophobicContact CD2-CB 4.33Å; L106-L110 HydrophobicContact CD2-CD1 4.01Å; L106-L110 PolarHBondContact O-N 3.11Å; L106-I111 HydrophobicContact CB-CD1 4.03Å; L106-I111 HydrophobicContact CB-CG1 4.34Å; L106-I111 WeakPolarHBondContact O-CB 3.37Å; L106-I111 WeakPolarHBondContact O-CG1 3.26Å; L106-I111 PolarHBondContact O-N 3.06Å; L106-Y123 HydrophobicContact CD2-CD1 3.77Å; L106-Y123 HydrophobicContact CD2-CG 4.11Å; L106-M126 HydrophobicContact CD1-CB 4.1Å; L106-M126 HydrophobicContact CD1-CG 4.07Å; L106-M126 HydrophobicContact CD1-SD 4.43Å; L106-M126 HydrophobicContact CD2-CB 4.36Å; L106-M126 HydrophobicContact CD2-SD 4.13Å; L106-K127 HydrophobicContact CD1-CB 4.09Å
107	E	98.1	Very high	97.4	Very high	89 Å²	89	45.3 Å²	45.3	42%	0.416	26%	0.264	S	S	.	.	I	π-helix	trans	-73.1	-40.9	-175.8	-69.4	-175.9	161.1	0	0	113	L103 P112 K127	L103-E107 WeakPolarHBondContact O-CB 3.25Å; L103-E107 WeakPolarHBondContact O-CG 3.43Å; L103-E107 PolarHBondContact O-N 3Å; E107-P112 WeakPolarHBondContact O-CD 3.41Å; E107-P112 VanDerWaalsContact O-CG 3.25Å; E107-P112 WeakPolarHBondContact O-CG 3.36Å; E107-K127 WeakPolarHBondContact OE1-CE 3.25Å; E107-K127 IonicContact OE1-NZ 2.69Å; E107-K127 PolarHBondContact OE1-NZ 2.92Å
108	A	97.3	Very high	97.3	Very high	67 Å²	67	41.7 Å²	41.7	55%	0.554	25%	0.25	S	C	*	.	I	π-helix	trans	-79.7	-28.3	-175.9	0	0	0	0	0	113.4	N104	N104-A108 WeakPolarHBondContact O-CB 3.26Å; N104-A108 PolarHBondContact O-N 3.17Å
109	H	97.2	Very high	97.3	Very high	60 Å²	60	40.9 Å²	40.9	28%	0.278	25%	0.246	S	C	.	.	I	π-helix	trans	-128.1	-59.6	-169.2	-57.3	-66.6	0	0	0	113	A31 V34 V105 S113	A31-H109 WeakPolarHBondContact O-CB 3.45Å; V34-H109 HydrophobicContact CG2-CB 3.8Å; V105-H109 WeakPolarHBondContact O-CB 3.39Å; V105-H109 PolarHBondContact O-N 3.43Å; V105-H109 VanDerWaalsContact O-N 3.11Å; H109-S113 VanDerWaalsContact O-CB 3.31Å; H109-S113 WeakPolarHBondContact O-CB 3.34Å; H109-S113 PolarHBondContact O-N 3.25Å; H109-S113 PolarHBondContact O-OG 3.03Å
110	L	98	Very high	97.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-79.8	-42.7	-162.4	-58.2	177	0	0	0	114.6	A31 V34 L39 L47 V105 L106 S113 A114 Y123	A31-L110 HydrophobicContact CB-CD1 4.32Å; A31-L110 HydrophobicContact CB-CD2 3.97Å; A31-L110 HydrophobicContact CB-CG 4.37Å; V34-L110 HydrophobicContact CG1-CD2 3.84Å; L39-L110 HydrophobicContact CD1-CD1 4.47Å; L39-L110 HydrophobicContact CD1-CD2 3.62Å; L39-L110 HydrophobicContact CG-CD2 3.92Å; L47-L110 HydrophobicContact CD2-CD1 3.37Å; V105-L110 HydrophobicContact CG1-CD1 3.83Å; V105-L110 HydrophobicContact CG1-CG 4.14Å; V105-L110 PolarHBondContact O-N 3.03Å; L106-L110 HydrophobicContact CD2-CB 4.33Å; L106-L110 HydrophobicContact CD2-CD1 4.01Å; L106-L110 PolarHBondContact O-N 3.11Å; L110-S113 PolarHBondContact O-N 3.38Å; L110-S113 PolarHBondContact O-OG 3.37Å; L110-A114 WeakPolarHBondContact O-CB 3.46Å; L110-A114 PolarHBondContact O-N 2.81Å; L110-A114 VanDerWaalsContact O-N 3.12Å; L110-Y123 HydrophobicContact CB-CD1 3.99Å; L110-Y123 HydrophobicContact CB-CD2 3.94Å; L110-Y123 HydrophobicContact CB-CE1 4.02Å; L110-Y123 HydrophobicContact CB-CE2 3.97Å; L110-Y123 HydrophobicContact CB-CG 3.98Å; L110-Y123 HydrophobicContact CD1-CD1 4.12Å; L110-Y123 HydrophobicContact CD1-CE1 3.87Å; L110-Y123 HydrophobicContact CG-CE1 4.37Å; L110-Y123 WeakPolarHBondContact O-CD2 3.37Å
111	I	97.8	Very high	97.3	Very high	47 Å²	47	40.6 Å²	40.6	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-45.9	177.6	-66.6	169.6	0	0	0	110.5	L106 S113 A114 L124 K127	L106-I111 HydrophobicContact CB-CD1 4.03Å; L106-I111 HydrophobicContact CB-CG1 4.34Å; L106-I111 WeakPolarHBondContact O-CB 3.37Å; L106-I111 WeakPolarHBondContact O-CG1 3.26Å; L106-I111 PolarHBondContact O-N 3.06Å; I111-S113 VanDerWaalsContact C-N 3.33Å; I111-S113 PolarHBondContact O-N 2.8Å; I111-A114 PolarHBondContact O-N 2.97Å; I111-L124 HydrophobicContact CD1-CD2 4.23Å; I111-L124 HydrophobicContact CG2-CD2 4.42Å; I111-K127 HydrophobicContact CD1-CB 4.28Å; I111-K127 HydrophobicContact CD1-CD 3.84Å
112	P	96.1	Very high	97.3	Very high	93 Å²	93	41.1 Å²	41.1	60%	0.604	24%	0.238	S	C	*	.	H	α-helix	trans	-63.5	-33.2	176.2	-24.8	35.3	0	0	0	114.4	E107	E107-P112 WeakPolarHBondContact O-CD 3.41Å; E107-P112 VanDerWaalsContact O-CG 3.25Å; E107-P112 WeakPolarHBondContact O-CG 3.36Å
113	S	94.1	Very high	97.3	Very high	32 Å²	32	41.1 Å²	41.1	22%	0.224	24%	0.238	C	C	.	.	H	α-helix	trans	-84	-14.6	-177.9	70	0	0	0	0	114	H109 L110 I111 S115	H109-S113 VanDerWaalsContact O-CB 3.31Å; H109-S113 WeakPolarHBondContact O-CB 3.34Å; H109-S113 PolarHBondContact O-N 3.25Å; H109-S113 PolarHBondContact O-OG 3.03Å; L110-S113 PolarHBondContact O-N 3.38Å; L110-S113 PolarHBondContact O-OG 3.37Å; I111-S113 VanDerWaalsContact C-N 3.33Å; I111-S113 PolarHBondContact O-N 2.8Å; S113-S115 PolarHBondContact O-N 3.22Å
114	A	94.9	Very high	97.3	Very high	10 Å²	10	41.9 Å²	41.9	8%	0.083	24%	0.242	C	C	.	.			trans	-70.6	115.5	-172.8	0	0	0	0	0	112.2	L110 I111 K120 Y123	L110-A114 WeakPolarHBondContact O-CB 3.46Å; L110-A114 PolarHBondContact O-N 2.81Å; L110-A114 VanDerWaalsContact O-N 3.12Å; I111-A114 PolarHBondContact O-N 2.97Å; A114-K120 HydrophobicContact CB-CG 3.79Å; A114-K120 WeakPolarHBondContact O-CE 3.12Å; A114-Y123 HydrophobicContact CB-CD2 3.75Å; A114-Y123 HydrophobicContact CB-CE2 3.91Å
115	S	93.9	Very high	97.3	Very high	87 Å²	87	38.8 Å²	38.8	61%	0.608	22%	0.224	S	C	*	.			trans	-96.9	-52.5	177.1	-176.1	0	0	0	0	113.1	E38 S113 K120	E38-S115 PolarHBondContact OE2-N 3.41Å; S113-S115 PolarHBondContact O-N 3.22Å; S115-K120 WeakPolarHBondContact O-CE 3.39Å; S115-K120 PolarHBondContact O-NZ 3.48Å
116	P	95.7	Very high	97.4	Very high	65 Å²	65	39 Å²	39	42%	0.422	23%	0.225	S	C	.	.	S	Bend	trans	-63.5	146.5	177.4	-20	33.3	0	0	0	112.5	E38 E118 S119 K120	E38-P116 WeakPolarHBondContact OE1-CD 3.4Å; E38-P116 WeakPolarHBondContact OE2-CD 3.45Å; P116-E118 PolarHBondContact O-N 3.16Å; P116-S119 PolarHBondContact O-N 3.48Å; P116-K120 WeakPolarHBondContact O-CG 3.41Å; P116-K120 PolarHBondContact O-N 3Å; P116-K120 VanDerWaalsContact O-N 3.09Å
117	A	97.7	Very high	97.4	Very high	14 Å²	14	41.1 Å²	41.1	12%	0.116	23%	0.234	C	C	.	.	H	α-helix	trans	-54.2	-42.8	174.9	0	0	0	0	0	111.9	S119 K120 V121 I160 E164 L165	A117-S119 PolarHBondContact O-N 3.22Å; A117-K120 PolarHBondContact O-N 3.19Å; A117-V121 VanDerWaalsContact O-CG2 3.28Å; A117-V121 WeakPolarHBondContact O-CG2 3.13Å; A117-V121 PolarHBondContact O-N 3.33Å; A117-I160 HydrophobicContact CB-CG2 4.14Å; A117-E164 HydrophobicContact CB-CB 3.61Å; A117-E164 HydrophobicContact CB-CG 4.28Å; A117-E164 WeakPolarHBondContact CB-OE2 3.31Å; A117-L165 HydrophobicContact CB-CD2 4.25Å
118	E	97.1	Very high	97.4	Very high	77 Å²	77	36.9 Å²	36.9	36%	0.36	22%	0.215	S	C	.	.	H	α-helix	trans	-56.5	-48.8	177.3	-71.4	-178.2	-155.7	0	0	112.8	P116 V121 F122 L165 H169 I171	P116-E118 PolarHBondContact O-N 3.16Å; E118-V121 PolarHBondContact O-N 3.19Å; E118-F122 WeakPolarHBondContact O-CB 3.41Å; E118-F122 PolarHBondContact O-N 3.16Å; E118-L165 HydrophobicContact CG-CD2 3.77Å; E118-H169 IonicContact OE1-NE2 2.76Å; E118-H169 PolarHBondContact OE1-NE2 2.99Å; E118-I171 HydrophobicContact CB-CD1 4.09Å; E118-I171 HydrophobicContact CG-CD1 4.46Å
119	S	97.7	Very high	97.5	Very high	7 Å²	7	34.1 Å²	34.1	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-45.1	178	-66.6	0	0	0	0	111.3	E38 P116 A117 F122 Y123	E38-S119 WeakPolarHBondContact OE1-CB 3.07Å; E38-S119 PolarHBondContact OE1-OG 3.46Å; P116-S119 PolarHBondContact O-N 3.48Å; A117-S119 PolarHBondContact O-N 3.22Å; S119-F122 WeakPolarHBondContact O-CB 3.42Å; S119-F122 PolarHBondContact O-N 3.44Å; S119-Y123 WeakPolarHBondContact O-CD2 3.07Å; S119-Y123 PolarHBondContact O-N 2.91Å
120	K	98.4	Very high	97.6	Very high	72 Å²	72	31.7 Å²	31.7	31%	0.313	18%	0.179	S	C	.	.	H	α-helix	trans	-59.2	-51.2	178.6	-69.3	171.7	-179.6	160.2	0	111.3	A114 S115 P116 A117 F122 Y123 L124 I160	A114-K120 HydrophobicContact CB-CG 3.79Å; A114-K120 WeakPolarHBondContact O-CE 3.12Å; S115-K120 WeakPolarHBondContact O-CE 3.39Å; S115-K120 PolarHBondContact O-NZ 3.48Å; P116-K120 WeakPolarHBondContact O-CG 3.41Å; P116-K120 PolarHBondContact O-N 3Å; P116-K120 VanDerWaalsContact O-N 3.09Å; A117-K120 PolarHBondContact O-N 3.19Å; K120-F122 VanDerWaalsContact C-N 3.31Å; K120-F122 PolarHBondContact O-N 3.36Å; K120-Y123 PolarHBondContact O-N 2.86Å; K120-L124 WeakPolarHBondContact O-CB 3.22Å; K120-L124 VanDerWaalsContact O-CG 3.26Å; K120-L124 WeakPolarHBondContact O-CG 2.88Å; K120-L124 PolarHBondContact O-N 3.18Å; K120-I160 HydrophobicContact CB-CD1 4.04Å; K120-I160 HydrophobicContact CD-CD1 4.41Å
121	V	98.7	Very high	97.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-41.6	178.9	-179.8	0	0	0	0	110.3	A117 E118 K125 A157 I160 A161 L165 I171 L175	A117-V121 VanDerWaalsContact O-CG2 3.28Å; A117-V121 WeakPolarHBondContact O-CG2 3.13Å; A117-V121 PolarHBondContact O-N 3.33Å; E118-V121 PolarHBondContact O-N 3.19Å; V121-K125 WeakPolarHBondContact O-CB 3.37Å; V121-K125 PolarHBondContact O-N 3.36Å; V121-A157 HydrophobicContact CG1-CB 4.33Å; V121-I160 HydrophobicContact CG2-CB 3.81Å; V121-I160 HydrophobicContact CG2-CG2 3.61Å; V121-A161 HydrophobicContact CG1-CB 3.86Å; V121-A161 HydrophobicContact CG2-CB 3.91Å; V121-L165 HydrophobicContact CB-CD1 4.17Å; V121-L165 HydrophobicContact CG1-CD1 4.27Å; V121-L165 HydrophobicContact CG2-CD1 3.95Å; V121-I171 HydrophobicContact CB-CG2 4.02Å; V121-I171 HydrophobicContact CG1-CG2 3.56Å; V121-L175 HydrophobicContact CG1-CD2 4.12Å
122	F	98.5	Very high	97.6	Very high	28 Å²	28	31.1 Å²	31.1	12%	0.123	17%	0.174	C	C	.	.	H	α-helix	trans	-58.6	-51.5	178.6	-171.1	-83	0	0	0	112.1	R44 E118 S119 K120 M126 I171	R44-F122 HydrophobicContact CG-CD1 3.59Å; R44-F122 HydrophobicContact CG-CD2 4.44Å; R44-F122 HydrophobicContact CG-CE1 3.38Å; R44-F122 HydrophobicContact CG-CE2 4.25Å; R44-F122 HydrophobicContact CG-CG 4.12Å; R44-F122 HydrophobicContact CG-CZ 3.72Å; E118-F122 WeakPolarHBondContact O-CB 3.41Å; E118-F122 PolarHBondContact O-N 3.16Å; S119-F122 WeakPolarHBondContact O-CB 3.42Å; S119-F122 PolarHBondContact O-N 3.44Å; K120-F122 VanDerWaalsContact C-N 3.31Å; K120-F122 PolarHBondContact O-N 3.36Å; F122-M126 HydrophobicContact CE1-SD 4.39Å; F122-M126 WeakPolarHBondContact O-CB 3.48Å; F122-M126 PolarHBondContact O-N 3.18Å; F122-I171 HydrophobicContact CB-CD1 4.33Å; F122-I171 HydrophobicContact CD2-CD1 4.06Å; F122-I171 HydrophobicContact CD2-CG1 4.4Å
123	Y	98.7	Very high	97.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.9	-38	-177.5	-60.4	-44.2	0	0	0	112.7	R44 L106 L110 A114 S119 K120 M126 K127	R44-Y123 HydrophobicContact CG-CE1 3.85Å; L106-Y123 HydrophobicContact CD2-CD1 3.77Å; L106-Y123 HydrophobicContact CD2-CG 4.11Å; L110-Y123 HydrophobicContact CB-CD1 3.99Å; L110-Y123 HydrophobicContact CB-CD2 3.94Å; L110-Y123 HydrophobicContact CB-CE1 4.02Å; L110-Y123 HydrophobicContact CB-CE2 3.97Å; L110-Y123 HydrophobicContact CB-CG 3.98Å; L110-Y123 HydrophobicContact CD1-CD1 4.12Å; L110-Y123 HydrophobicContact CD1-CE1 3.87Å; L110-Y123 HydrophobicContact CG-CE1 4.37Å; L110-Y123 WeakPolarHBondContact O-CD2 3.37Å; A114-Y123 HydrophobicContact CB-CD2 3.75Å; A114-Y123 HydrophobicContact CB-CE2 3.91Å; S119-Y123 WeakPolarHBondContact O-CD2 3.07Å; S119-Y123 PolarHBondContact O-N 2.91Å; K120-Y123 PolarHBondContact O-N 2.86Å; Y123-M126 PolarHBondContact O-N 2.63Å; Y123-K127 WeakPolarHBondContact O-CB 3.37Å; Y123-K127 PolarHBondContact O-N 2.78Å
124	L	98.8	Very high	98	Very high	25 Å²	25	27.2 Å²	27.2	13%	0.131	14%	0.144	C	C	.	.	H	α-helix	trans	-66.8	-40.8	175	-71.2	169.1	0	0	0	111.7	I111 K120 M126 K127 G128 A157 I160	I111-L124 HydrophobicContact CD1-CD2 4.23Å; I111-L124 HydrophobicContact CG2-CD2 4.42Å; K120-L124 WeakPolarHBondContact O-CB 3.22Å; K120-L124 VanDerWaalsContact O-CG 3.26Å; K120-L124 WeakPolarHBondContact O-CG 2.88Å; K120-L124 PolarHBondContact O-N 3.18Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-K127 WeakPolarHBondContact O-CB 3.39Å; L124-K127 PolarHBondContact O-N 2.96Å; L124-G128 PolarHBondContact O-N 3.28Å; L124-A157 HydrophobicContact CB-CB 3.69Å; L124-I160 HydrophobicContact CD1-CD1 3.79Å
125	K	98.7	Very high	98.2	Very high	36 Å²	36	26.7 Å²	26.7	16%	0.157	14%	0.14	C	C	.	.	H	α-helix	trans	-58.4	-48.3	171	178.5	-169.9	173.4	-66.1	0	110.5	V121 K127 G128 D129 Y154 G174 L175 N178	V121-K125 WeakPolarHBondContact O-CB 3.37Å; V121-K125 PolarHBondContact O-N 3.36Å; K125-K127 VanDerWaalsContact C-N 3.33Å; K125-K127 PolarHBondContact O-N 3.49Å; K125-G128 PolarHBondContact O-N 2.86Å; K125-D129 IonicContact NZ-OD2 3.33Å; K125-D129 PolarHBondContact NZ-OD2 3.2Å; K125-D129 PolarHBondContact O-N 2.94Å; K125-Y154 HydrophobicContact CG-CE1 4.44Å; K125-Y154 WeakPolarHBondContact O-CE1 3.45Å; K125-G174 WeakPolarHBondContact CE-O 3.44Å; K125-L175 HydrophobicContact CB-CD1 4.06Å; K125-L175 HydrophobicContact CD-CB 4.08Å; K125-L175 HydrophobicContact CG-CB 4.3Å; K125-L175 HydrophobicContact CG-CD1 3.98Å; K125-N178 PolarHBondContact NZ-ND2 3.01Å
126	M	98.6	Very high	98.4	Very high	9 Å²	9	23.7 Å²	23.7	4%	0.044	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-43.5	178.6	-163.7	177	-169	0	0	111.1	I102 L106 F122 Y123 L124 G128 D129 Y130	I102-M126 HydrophobicContact CD1-CE 3.6Å; I102-M126 HydrophobicContact CD1-SD 3.96Å; I102-M126 HydrophobicContact CG1-CE 3.74Å; I102-M126 HydrophobicContact CG1-CG 4.49Å; I102-M126 HydrophobicContact CG1-SD 4.16Å; L106-M126 HydrophobicContact CD1-CB 4.1Å; L106-M126 HydrophobicContact CD1-CG 4.07Å; L106-M126 HydrophobicContact CD1-SD 4.43Å; L106-M126 HydrophobicContact CD2-CB 4.36Å; L106-M126 HydrophobicContact CD2-SD 4.13Å; F122-M126 HydrophobicContact CE1-SD 4.39Å; F122-M126 WeakPolarHBondContact O-CB 3.48Å; F122-M126 PolarHBondContact O-N 3.18Å; Y123-M126 PolarHBondContact O-N 2.63Å; L124-M126 VanDerWaalsContact C-N 3.34Å; M126-G128 VanDerWaalsContact C-N 3.33Å; M126-G128 PolarHBondContact O-N 3.37Å; M126-D129 WeakPolarHBondContact O-CB 3.32Å; M126-D129 PolarHBondContact O-N 3.16Å; M126-D129 VanDerWaalsContact O-N 3.14Å; M126-Y130 HydrophobicContact CE-CE2 3.83Å; M126-Y130 HydrophobicContact CG-CD2 3.96Å; M126-Y130 HydrophobicContact CG-CE2 3.79Å; M126-Y130 VanDerWaalsContact O-CD2 3.28Å; M126-Y130 WeakPolarHBondContact O-CD2 3.12Å; M126-Y130 PolarHBondContact O-N 3.11Å
127	K	98.9	Very high	98.4	Very high	46 Å²	46	21.5 Å²	21.5	20%	0.2	10%	0.1	C	C	.	.	H	α-helix	trans	-55.8	-47.7	173.5	178.6	174.3	-176.1	169.2	0	111.7	L103 L106 E107 I111 Y123 L124 K125 D129 Y130 H131 A153	L103-K127 HydrophobicContact CD2-CB 4.46Å; L103-K127 HydrophobicContact CD2-CG 3.92Å; L106-K127 HydrophobicContact CD1-CB 4.09Å; E107-K127 WeakPolarHBondContact OE1-CE 3.25Å; E107-K127 IonicContact OE1-NZ 2.69Å; E107-K127 PolarHBondContact OE1-NZ 2.92Å; I111-K127 HydrophobicContact CD1-CB 4.28Å; I111-K127 HydrophobicContact CD1-CD 3.84Å; Y123-K127 WeakPolarHBondContact O-CB 3.37Å; Y123-K127 PolarHBondContact O-N 2.78Å; L124-K127 WeakPolarHBondContact O-CB 3.39Å; L124-K127 PolarHBondContact O-N 2.96Å; K125-K127 VanDerWaalsContact C-N 3.33Å; K125-K127 PolarHBondContact O-N 3.49Å; K127-D129 VanDerWaalsContact C-N 3.35Å; K127-D129 PolarHBondContact O-N 3.49Å; K127-Y130 PolarHBondContact O-N 2.97Å; K127-H131 PolarHBondContact O-CD2 2.93Å; K127-H131 VanDerWaalsContact O-CD2 3.29Å; K127-H131 PolarHBondContact O-N 2.93Å; K127-H131 VanDerWaalsContact O-N 3.09Å; K127-A153 HydrophobicContact CB-CB 4.24Å; K127-A153 HydrophobicContact CD-CB 4.27Å; K127-A153 HydrophobicContact CG-CB 4.01Å
128	G	98.9	Very high	98.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-42.5	175.6	0	0	0	0	0	112.6	L124 K125 M126 Y130 H131 R132 T150	L124-G128 PolarHBondContact O-N 3.28Å; K125-G128 PolarHBondContact O-N 2.86Å; M126-G128 VanDerWaalsContact C-N 3.33Å; M126-G128 PolarHBondContact O-N 3.37Å; G128-Y130 PolarHBondContact O-N 3.14Å; G128-H131 PolarHBondContact O-N 3.43Å; G128-R132 VanDerWaalsContact O-CB 3.26Å; G128-R132 WeakPolarHBondContact O-CB 3.49Å; G128-R132 PolarHBondContact O-N 3.19Å; G128-T150 WeakPolarHBondContact O-CG2 3.24Å
129	D	98.8	Very high	98.4	Very high	9 Å²	9	23.2 Å²	23.2	5%	0.048	12%	0.118	C	C	.	.	H	α-helix	trans	-58.6	-44.9	177.2	-81	-46.1	0	0	0	112.6	K125 M126 K127 R132 Y133 Y154 N178	K125-D129 IonicContact NZ-OD2 3.33Å; K125-D129 PolarHBondContact NZ-OD2 3.2Å; K125-D129 PolarHBondContact O-N 2.94Å; M126-D129 WeakPolarHBondContact O-CB 3.32Å; M126-D129 PolarHBondContact O-N 3.16Å; M126-D129 VanDerWaalsContact O-N 3.14Å; K127-D129 VanDerWaalsContact C-N 3.35Å; K127-D129 PolarHBondContact O-N 3.49Å; D129-R132 WeakPolarHBondContact O-CB 3.34Å; D129-R132 PolarHBondContact O-N 3.41Å; D129-R132 IonicContact OD1-CZ 3.37Å; D129-R132 IonicContact OD1-NE 2.67Å; D129-R132 IonicContact OD1-NH2 3.73Å; D129-R132 PolarHBondContact OD1-NH2 3.29Å; D129-Y133 HydrophobicContact CB-CE2 4.36Å; D129-Y133 WeakPolarHBondContact O-CD1 3.4Å; D129-Y133 VanDerWaalsContact O-CD2 3.26Å; D129-Y133 WeakPolarHBondContact O-CD2 3.37Å; D129-Y133 PolarHBondContact O-N 2.98Å; D129-Y154 PolarHBondContact N-OH 3.38Å; D129-Y154 PolarHBondContact OD1-OH 3.47Å; D129-N178 WeakPolarHBondContact OD1-CB 3.32Å; D129-N178 PolarHBondContact OD1-ND2 3.32Å; D129-N178 PolarHBondContact OD2-ND2 3.04Å
130	Y	98.8	Very high	98.4	Very high	8 Å²	8	25.9 Å²	25.9	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-76.7	-34.4	-178	-78.3	-85.2	0	0	0	113.4	Y51 I55 C99 I102 M126 K127 G128 R132 Y133 L134	Y51-Y130 VanDerWaalsContact C-OH 3.26Å; Y51-Y130 WeakPolarHBondContact CB-OH 3.37Å; Y51-Y130 PolarHBondContact O-OH 3.29Å; I55-Y130 HydrophobicContact CB-CE1 3.91Å; I55-Y130 HydrophobicContact CD1-CE1 4.26Å; I55-Y130 HydrophobicContact CG1-CD1 4.46Å; I55-Y130 HydrophobicContact CG1-CE1 3.89Å; I55-Y130 HydrophobicContact CG2-CE1 3.92Å; I55-Y130 WeakPolarHBondContact CG2-OH 3.24Å; C99-Y130 HydrophobicContact CB-CD1 4.25Å; I102-Y130 HydrophobicContact CG1-CD2 4.18Å; I102-Y130 HydrophobicContact CG1-CE2 4.15Å; I102-Y130 HydrophobicContact CG2-CD1 3.34Å; I102-Y130 HydrophobicContact CG2-CD2 3.58Å; I102-Y130 HydrophobicContact CG2-CE1 3.63Å; I102-Y130 HydrophobicContact CG2-CE2 3.89Å; I102-Y130 HydrophobicContact CG2-CG 3.33Å; M126-Y130 HydrophobicContact CE-CE2 3.83Å; M126-Y130 HydrophobicContact CG-CD2 3.96Å; M126-Y130 HydrophobicContact CG-CE2 3.79Å; M126-Y130 VanDerWaalsContact O-CD2 3.28Å; M126-Y130 WeakPolarHBondContact O-CD2 3.12Å; M126-Y130 PolarHBondContact O-N 3.11Å; K127-Y130 PolarHBondContact O-N 2.97Å; G128-Y130 PolarHBondContact O-N 3.14Å; Y130-R132 VanDerWaalsContact C-N 3.28Å; Y130-R132 PolarHBondContact O-N 2.99Å; Y130-Y133 AromaticContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CE2 4.24Å; Y130-Y133 HydrophobicContact CE1-CD2 4.05Å; Y130-Y133 HydrophobicContact CE1-CE2 4.16Å; Y130-Y133 HydrophobicContact CG-CD2 4.19Å; Y130-Y133 HydrophobicContact CG-CE2 4.47Å; Y130-Y133 PolarHBondContact O-N 2.85Å; Y130-L134 PolarHBondContact O-N 3.44Å; Y130-L134 VanDerWaalsContact O-N 3.1Å
131	H	98.9	Very high	98.4	Very high	23 Å²	23	26.4 Å²	26.4	11%	0.106	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-36.1	167.9	-78.1	-62.8	0	0	0	112.1	K127 G128 Y133 L134 A135 T150	K127-H131 PolarHBondContact O-CD2 2.93Å; K127-H131 VanDerWaalsContact O-CD2 3.29Å; K127-H131 PolarHBondContact O-N 2.93Å; K127-H131 VanDerWaalsContact O-N 3.09Å; G128-H131 PolarHBondContact O-N 3.43Å; H131-Y133 VanDerWaalsContact C-N 3.33Å; H131-Y133 PolarHBondContact O-N 3.17Å; H131-L134 WeakPolarHBondContact O-CB 3.45Å; H131-L134 PolarHBondContact O-N 3.35Å; H131-A135 PolarHBondContact O-N 3.14Å; H131-T150 VanDerWaalsContact CB-OG1 3.23Å; H131-T150 WeakPolarHBondContact CB-OG1 3.39Å
132	R	98.7	Very high	98.4	Very high	12 Å²	12	31.6 Å²	31.6	5%	0.045	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-43	175.5	-178.4	172.5	60.9	92.5	-8.3	111.2	G128 D129 Y130 L134 A135 E136 T150 Y154 F182 I186	G128-R132 VanDerWaalsContact O-CB 3.26Å; G128-R132 WeakPolarHBondContact O-CB 3.49Å; G128-R132 PolarHBondContact O-N 3.19Å; D129-R132 WeakPolarHBondContact O-CB 3.34Å; D129-R132 PolarHBondContact O-N 3.41Å; D129-R132 IonicContact OD1-CZ 3.37Å; D129-R132 IonicContact OD1-NE 2.67Å; D129-R132 IonicContact OD1-NH2 3.73Å; D129-R132 PolarHBondContact OD1-NH2 3.29Å; Y130-R132 VanDerWaalsContact C-N 3.28Å; Y130-R132 PolarHBondContact O-N 2.99Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3Å; R132-A135 WeakPolarHBondContact O-CB 3.47Å; R132-A135 PolarHBondContact O-N 3.14Å; R132-A135 VanDerWaalsContact O-N 3.08Å; R132-E136 IonicContact NH1-OE1 2.75Å; R132-E136 PolarHBondContact O-N 3.39Å; R132-E136 VanDerWaalsContact O-N 3.15Å; R132-T150 WeakPolarHBondContact CA-OG1 3.47Å; R132-T150 HydrophobicContact CB-CG2 3.83Å; R132-T150 PolarHBondContact N-OG1 3.4Å; R132-Y154 PolarHBondContact NE-OH 2.62Å; R132-Y154 VanDerWaalsContact NE-OH 3.11Å; R132-F182 HydrophobicContact CG-CD2 4.19Å; R132-I186 HydrophobicContact CG-CG1 4Å
133	Y	98.7	Very high	98.4	Very high	28 Å²	28	34.4 Å²	34.4	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-39.4	175.3	-58	-27.4	0	0	0	112.1	I55 D129 Y130 H131 A135 E136 F137	I55-Y133 HydrophobicContact CG1-CD2 3.85Å; I55-Y133 HydrophobicContact CG1-CE2 4.29Å; I55-Y133 HydrophobicContact CG2-CD2 4.44Å; I55-Y133 HydrophobicContact CG2-CE2 4.05Å; D129-Y133 HydrophobicContact CB-CE2 4.36Å; D129-Y133 WeakPolarHBondContact O-CD1 3.4Å; D129-Y133 VanDerWaalsContact O-CD2 3.26Å; D129-Y133 WeakPolarHBondContact O-CD2 3.37Å; D129-Y133 PolarHBondContact O-N 2.98Å; Y130-Y133 AromaticContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CE2 4.24Å; Y130-Y133 HydrophobicContact CE1-CD2 4.05Å; Y130-Y133 HydrophobicContact CE1-CE2 4.16Å; Y130-Y133 HydrophobicContact CG-CD2 4.19Å; Y130-Y133 HydrophobicContact CG-CE2 4.47Å; Y130-Y133 PolarHBondContact O-N 2.85Å; H131-Y133 VanDerWaalsContact C-N 3.33Å; H131-Y133 PolarHBondContact O-N 3.17Å; Y133-A135 VanDerWaalsContact C-N 3.33Å; Y133-A135 PolarHBondContact O-N 2.82Å; Y133-E136 WeakPolarHBondContact CD1-OE1 3.41Å; Y133-E136 WeakPolarHBondContact O-CB 3.49Å; Y133-E136 PolarHBondContact O-N 3.11Å; Y133-F137 WeakPolarHBondContact O-CD1 3.35Å; Y133-F137 WeakPolarHBondContact O-CE1 3.32Å
134	L	98.8	Very high	98.3	Very high	15 Å²	15	40.7 Å²	40.7	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-44.4	171.2	-69	171.6	0	0	0	111.2	C99 L103 Y130 H131 R132 E136 F137 K138 A146	C99-L134 HydrophobicContact CB-CD1 4.12Å; C99-L134 HydrophobicContact CB-CD2 3.74Å; C99-L134 HydrophobicContact CB-CG 3.8Å; L103-L134 HydrophobicContact CD1-CD1 3.86Å; Y130-L134 PolarHBondContact O-N 3.44Å; Y130-L134 VanDerWaalsContact O-N 3.1Å; H131-L134 WeakPolarHBondContact O-CB 3.45Å; H131-L134 PolarHBondContact O-N 3.35Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3Å; L134-E136 PolarHBondContact O-N 3.25Å; L134-F137 HydrophobicContact CD2-CE1 4.23Å; L134-F137 HydrophobicContact CD2-CZ 3.76Å; L134-F137 PolarHBondContact O-N 3.31Å; L134-K138 HydrophobicContact CB-CG 4.38Å; L134-K138 VanDerWaalsContact O-CB 3.24Å; L134-K138 WeakPolarHBondContact O-CB 3.39Å; L134-K138 WeakPolarHBondContact O-CG 3.46Å; L134-K138 PolarHBondContact O-N 2.93Å; L134-A146 HydrophobicContact CB-CB 3.91Å
135	A	98.6	Very high	98.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-21.5	179.7	0	0	0	0	0	113.8	H131 R132 Y133 R143 A146 I186	H131-A135 PolarHBondContact O-N 3.14Å; R132-A135 WeakPolarHBondContact O-CB 3.47Å; R132-A135 PolarHBondContact O-N 3.14Å; R132-A135 VanDerWaalsContact O-N 3.08Å; Y133-A135 VanDerWaalsContact C-N 3.33Å; Y133-A135 PolarHBondContact O-N 2.82Å; A135-R143 VanDerWaalsContact O-CZ 3.26Å; A135-R143 PolarHBondContact O-NH1 2.86Å; A135-A146 HydrophobicContact CB-CB 3.89Å; A135-I186 HydrophobicContact CB-CD1 4.32Å; A135-I186 HydrophobicContact CB-CG2 3.82Å
136	E	97.9	Very high	98.3	Very high	24 Å²	24	44.3 Å²	44.3	11%	0.112	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-42.3	177.6	-71.6	169.6	-159	0	0	112.4	R59 W62 R63 R132 Y133 L134 I186	R59-E136 IonicContact CZ-OE1 3.46Å; R59-E136 IonicContact CZ-OE2 3.89Å; R59-E136 IonicContact NE-OE1 3.75Å; R59-E136 IonicContact NE-OE2 2.62Å; R59-E136 PolarHBondContact NE-OE2 3.23Å; R59-E136 IonicContact NH2-OE1 3.66Å; R59-E136 PolarHBondContact NH2-OE1 3.32Å; R59-E136 IonicContact NH2-OE2 3.78Å; R59-E136 PolarHBondContact NH2-OE2 2.83Å; W62-E136 HydrophobicContact CH2-CB 4.34Å; W62-E136 HydrophobicContact CZ3-CB 4.35Å; R63-E136 IonicContact NH2-OE2 2.91Å; R132-E136 IonicContact NH1-OE1 2.75Å; R132-E136 PolarHBondContact O-N 3.39Å; R132-E136 VanDerWaalsContact O-N 3.15Å; Y133-E136 WeakPolarHBondContact CD1-OE1 3.41Å; Y133-E136 WeakPolarHBondContact O-CB 3.49Å; Y133-E136 PolarHBondContact O-N 3.11Å; L134-E136 PolarHBondContact O-N 3.25Å; E136-I186 HydrophobicContact CG-CD1 3.96Å
137	F	97.3	Very high	98.3	Very high	19 Å²	19	44.5 Å²	44.5	8%	0.083	25%	0.247	C	C	.	.	H	α-helix	trans	-117	-19.1	-170.4	67.1	-92.9	0	0	0	114.5	W62 E92 L95 S96 Y133 L134	W62-F137 HydrophobicContact CD2-CB 4.33Å; W62-F137 VanDerWaalsContact CE2-CB 3.48Å; W62-F137 HydrophobicContact CH2-CB 4.09Å; W62-F137 HydrophobicContact CZ2-CB 3.36Å; E92-F137 HydrophobicContact CB-CD2 3.71Å; E92-F137 HydrophobicContact CB-CE2 3.9Å; E92-F137 HydrophobicContact CG-CB 4.12Å; E92-F137 HydrophobicContact CG-CD2 3.61Å; E92-F137 HydrophobicContact CG-CE2 4.29Å; E92-F137 HydrophobicContact CG-CG 4.08Å; L95-F137 HydrophobicContact CB-CD1 4.49Å; L95-F137 HydrophobicContact CB-CE1 3.69Å; L95-F137 HydrophobicContact CB-CE2 4.46Å; L95-F137 HydrophobicContact CB-CZ 3.66Å; L95-F137 HydrophobicContact CD1-CD1 3.97Å; L95-F137 HydrophobicContact CD1-CE1 3.98Å; L95-F137 HydrophobicContact CG-CE1 4.42Å; S96-F137 WeakPolarHBondContact OG-CE2 3.4Å; S96-F137 WeakPolarHBondContact OG-CZ 3.44Å; Y133-F137 WeakPolarHBondContact O-CD1 3.35Å; Y133-F137 WeakPolarHBondContact O-CE1 3.32Å; L134-F137 HydrophobicContact CD2-CE1 4.23Å; L134-F137 HydrophobicContact CD2-CZ 3.76Å; L134-F137 PolarHBondContact O-N 3.31Å
138	K	98.1	Very high	98.3	Very high	52 Å²	52	47.2 Å²	47.2	23%	0.226	26%	0.26	C	S	.	.			trans	-67.4	159.4	173.9	-68.3	-58.7	-155.6	156.6	0	111.4	S96 L134 E142 R143	S96-K138 WeakPolarHBondContact OG-CE 3.48Å; L134-K138 HydrophobicContact CB-CG 4.38Å; L134-K138 VanDerWaalsContact O-CB 3.24Å; L134-K138 WeakPolarHBondContact O-CB 3.39Å; L134-K138 WeakPolarHBondContact O-CG 3.46Å; L134-K138 PolarHBondContact O-N 2.93Å; K138-E142 HydrophobicContact CB-CB 4.11Å; K138-E142 HydrophobicContact CD-CB 4.34Å; K138-E142 VanDerWaalsContact CD-OE2 3.28Å; K138-E142 WeakPolarHBondContact CD-OE2 3.45Å; K138-E142 WeakPolarHBondContact CE-OE2 3.38Å; K138-E142 HydrophobicContact CG-CB 4.36Å; K138-E142 IonicContact NZ-OE1 2.8Å; K138-E142 IonicContact NZ-OE2 3.38Å; K138-E142 PolarHBondContact NZ-OE2 3.3Å; K138-R143 HydrophobicContact CB-CB 4.32Å; K138-R143 WeakPolarHBondContact O-CB 3.24Å
139	A	96.5	Very high	98.3	Very high	74 Å²	74	49 Å²	49	61%	0.612	27%	0.272	S	S	*	.			trans	-127.9	162.3	-179.3	0	0	0	0	0	112.2	A141 E142 R143	A139-A141 PolarHBondContact O-N 2.97Å; A139-E142 PolarHBondContact O-N 3.14Å; A139-R143 PolarHBondContact O-N 2.84Å
140	G	97.2	Very high	98.3	Very high	63 Å²	63	48.5 Å²	48.5	65%	0.649	27%	0.27	S	S	*	.	H	α-helix	trans	56.1	-130.1	173.3	0	0	0	0	0	113.8	E142 R143 K144	G140-E142 PolarHBondContact O-N 2.87Å; G140-R143 PolarHBondContact O-N 3.4Å; G140-K144 PolarHBondContact O-N 3.18Å
141	A	98.3	Very high	98.3	Very high	83 Å²	83	50.2 Å²	50.2	69%	0.686	28%	0.279	S	S	*	.	H	α-helix	trans	-63	-40.4	-178.2	0	0	0	0	0	112.6	A139 R143 K144 E145	A139-A141 PolarHBondContact O-N 2.97Å; A141-R143 VanDerWaalsContact C-N 3.33Å; A141-R143 PolarHBondContact O-N 3.48Å; A141-K144 PolarHBondContact O-N 3.45Å; A141-E145 PolarHBondContact O-N 3.33Å
142	E	98.1	Very high	98.3	Very high	109 Å²	109	53.6 Å²	53.6	51%	0.509	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-39.5	179.6	-61.1	-171.3	146.4	0	0	111.5	K138 A139 G140 K144 A146	K138-E142 HydrophobicContact CB-CB 4.11Å; K138-E142 HydrophobicContact CD-CB 4.34Å; K138-E142 VanDerWaalsContact CD-OE2 3.28Å; K138-E142 WeakPolarHBondContact CD-OE2 3.45Å; K138-E142 WeakPolarHBondContact CE-OE2 3.38Å; K138-E142 HydrophobicContact CG-CB 4.36Å; K138-E142 IonicContact NZ-OE1 2.8Å; K138-E142 IonicContact NZ-OE2 3.38Å; K138-E142 PolarHBondContact NZ-OE2 3.3Å; A139-E142 PolarHBondContact O-N 3.14Å; G140-E142 PolarHBondContact O-N 2.87Å; E142-K144 VanDerWaalsContact C-N 3.35Å; E142-A146 WeakPolarHBondContact O-CB 3.41Å; E142-A146 PolarHBondContact O-N 3.5Å
143	R	98.4	Very high	98.3	Very high	87 Å²	87	53.2 Å²	53.2	33%	0.328	30%	0.3	S	S	.	.	H	α-helix	trans	-62.1	-44.6	174.6	-172	-178.6	172	102.2	-1.2	111.4	A135 K138 A139 G140 A141 A146 A147	A135-R143 VanDerWaalsContact O-CZ 3.26Å; A135-R143 PolarHBondContact O-NH1 2.86Å; K138-R143 HydrophobicContact CB-CB 4.32Å; K138-R143 WeakPolarHBondContact O-CB 3.24Å; A139-R143 PolarHBondContact O-N 2.84Å; G140-R143 PolarHBondContact O-N 3.4Å; A141-R143 VanDerWaalsContact C-N 3.33Å; A141-R143 PolarHBondContact O-N 3.48Å; R143-A146 PolarHBondContact O-N 3.02Å; R143-A147 WeakPolarHBondContact O-CB 3.25Å; R143-A147 PolarHBondContact O-N 3.09Å
144	K	98.5	Very high	98.3	Very high	133 Å²	133	51.9 Å²	51.9	58%	0.578	30%	0.295	S	S	*	.	H	α-helix	trans	-63.1	-46.9	-179.2	-178.7	178.3	170.9	-178.6	0	110.9	G140 A141 E142 A146 A147 E148	G140-K144 PolarHBondContact O-N 3.18Å; A141-K144 PolarHBondContact O-N 3.45Å; E142-K144 VanDerWaalsContact C-N 3.35Å; K144-A146 PolarHBondContact O-N 3.13Å; K144-A147 PolarHBondContact O-N 3.38Å; K144-E148 WeakPolarHBondContact CE-OE1 3.42Å; K144-E148 IonicContact NZ-OE1 2.75Å; K144-E148 WeakPolarHBondContact O-CG 3.28Å; K144-E148 PolarHBondContact O-N 3.12Å
145	E	98.6	Very high	98.3	Very high	130 Å²	130	55.8 Å²	55.8	61%	0.607	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-45.4	176.5	-177.9	177.1	-174	0	0	111.5	A141 A147 E148 S149	A141-E145 PolarHBondContact O-N 3.33Å; E145-A147 VanDerWaalsContact C-N 3.34Å; E145-A147 PolarHBondContact O-N 2.7Å; E145-E148 PolarHBondContact O-N 3.27Å; E145-S149 WeakPolarHBondContact O-CB 3.44Å; E145-S149 PolarHBondContact O-N 3.33Å; E145-S149 PolarHBondContact O-OG 3.34Å
146	A	98.7	Very high	98.3	Very high	6 Å²	6	58.2 Å²	58.2	5%	0.05	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-42	176.4	0	0	0	0	0	112.2	L134 A135 E142 R143 K144 T150	L134-A146 HydrophobicContact CB-CB 3.91Å; A135-A146 HydrophobicContact CB-CB 3.89Å; E142-A146 WeakPolarHBondContact O-CB 3.41Å; E142-A146 PolarHBondContact O-N 3.5Å; R143-A146 PolarHBondContact O-N 3.02Å; K144-A146 PolarHBondContact O-N 3.13Å; A146-T150 WeakPolarHBondContact O-CB 3.4Å; A146-T150 PolarHBondContact O-N 3.07Å; A146-T150 PolarHBondContact O-OG1 3.24Å
147	A	98.7	Very high	98.4	Very high	14 Å²	14	57 Å²	57	12%	0.116	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-40.8	176.4	0	0	0	0	0	112.4	R143 K144 E145 T150 L151 F182 I186 L187	R143-A147 WeakPolarHBondContact O-CB 3.25Å; R143-A147 PolarHBondContact O-N 3.09Å; K144-A147 PolarHBondContact O-N 3.38Å; E145-A147 VanDerWaalsContact C-N 3.34Å; E145-A147 PolarHBondContact O-N 2.7Å; A147-T150 WeakPolarHBondContact O-CB 3.4Å; A147-T150 PolarHBondContact O-N 3.14Å; A147-L151 WeakPolarHBondContact O-CB 3.39Å; A147-L151 PolarHBondContact O-N 3.4Å; A147-F182 HydrophobicContact CB-CE2 4.28Å; A147-F182 HydrophobicContact CB-CZ 4.41Å; A147-F182 VanDerWaalsContact O-CZ 3.32Å; A147-F182 WeakPolarHBondContact O-CZ 3.39Å; A147-I186 HydrophobicContact CB-CG2 4.06Å; A147-L187 HydrophobicContact CB-CD2 4.47Å
148	E	98.7	Very high	98.4	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-47.2	176.1	-74.5	173.9	177.2	0	0	111.2	K144 E145 T150 L151 V152	K144-E148 WeakPolarHBondContact CE-OE1 3.42Å; K144-E148 IonicContact NZ-OE1 2.75Å; K144-E148 WeakPolarHBondContact O-CG 3.28Å; K144-E148 PolarHBondContact O-N 3.12Å; E145-E148 PolarHBondContact O-N 3.27Å; E148-T150 VanDerWaalsContact C-N 3.32Å; E148-T150 PolarHBondContact O-N 2.98Å; E148-L151 PolarHBondContact O-N 2.92Å; E148-V152 WeakPolarHBondContact O-CG2 3.33Å; E148-V152 PolarHBondContact O-N 2.94Å
149	S	98.8	Very high	98.5	Very high	36 Å²	36	60.6 Å²	60.6	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-38.1	176	-67.9	0	0	0	0	112.6	E145 A153	E145-S149 WeakPolarHBondContact O-CB 3.44Å; E145-S149 PolarHBondContact O-N 3.33Å; E145-S149 PolarHBondContact O-OG 3.34Å; S149-A153 WeakPolarHBondContact O-CB 3.42Å; S149-A153 PolarHBondContact O-N 2.72Å
150	T	98.8	Very high	98.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-51	172.3	-58.2	0	0	0	0	111.2	G128 H131 R132 A146 A147 E148 V152 A153 Y154 F182	G128-T150 WeakPolarHBondContact O-CG2 3.24Å; H131-T150 VanDerWaalsContact CB-OG1 3.23Å; H131-T150 WeakPolarHBondContact CB-OG1 3.39Å; R132-T150 WeakPolarHBondContact CA-OG1 3.47Å; R132-T150 HydrophobicContact CB-CG2 3.83Å; R132-T150 PolarHBondContact N-OG1 3.4Å; A146-T150 WeakPolarHBondContact O-CB 3.4Å; A146-T150 PolarHBondContact O-N 3.07Å; A146-T150 PolarHBondContact O-OG1 3.24Å; A147-T150 WeakPolarHBondContact O-CB 3.4Å; A147-T150 PolarHBondContact O-N 3.14Å; E148-T150 VanDerWaalsContact C-N 3.32Å; E148-T150 PolarHBondContact O-N 2.98Å; T150-V152 VanDerWaalsContact C-N 3.34Å; T150-V152 PolarHBondContact O-N 2.86Å; T150-A153 PolarHBondContact O-N 2.75Å; T150-Y154 HydrophobicContact CG2-CD2 3.6Å; T150-Y154 HydrophobicContact CG2-CE2 3.4Å; T150-Y154 PolarHBondContact O-N 3.25Å; T150-F182 HydrophobicContact CG2-CB 4.4Å; T150-F182 HydrophobicContact CG2-CD1 4.1Å; T150-F182 HydrophobicContact CG2-CD2 3.38Å; T150-F182 HydrophobicContact CG2-CE1 4.17Å; T150-F182 HydrophobicContact CG2-CE2 3.5Å; T150-F182 VanDerWaalsContact CG2-CE2 3.5Å; T150-F182 HydrophobicContact CG2-CG 3.69Å; T150-F182 HydrophobicContact CG2-CZ 3.9Å
151	L	98.7	Very high	98.6	Very high	44 Å²	44	56 Å²	56	23%	0.23	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-42.3	-178.3	-178.6	63.1	0	0	0	111.6	A147 E148 K155 F179 F182 Y183	A147-L151 WeakPolarHBondContact O-CB 3.39Å; A147-L151 PolarHBondContact O-N 3.4Å; E148-L151 PolarHBondContact O-N 2.92Å; L151-K155 HydrophobicContact CD1-CD 4.12Å; L151-K155 HydrophobicContact CD1-CG 4.31Å; L151-K155 HydrophobicContact CG-CD 4.13Å; L151-K155 WeakPolarHBondContact O-CB 3.35Å; L151-K155 VanDerWaalsContact O-CG 3.27Å; L151-K155 WeakPolarHBondContact O-CG 3.33Å; L151-K155 PolarHBondContact O-N 3.09Å; L151-F179 HydrophobicContact CD1-CE2 3.83Å; L151-F179 HydrophobicContact CD1-CZ 3.86Å; L151-F182 HydrophobicContact CB-CE1 3.96Å; L151-F182 HydrophobicContact CB-CZ 4.15Å; L151-F182 HydrophobicContact CD1-CE1 4.06Å; L151-Y183 HydrophobicContact CD1-CE1 4.41Å
152	V	98.8	Very high	98.6	Very high	94 Å²	94	56 Å²	56	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-62.3	-51.4	176.9	170.6	0	0	0	0	110.4	E148 T150 Y154 K155 S156	E148-V152 WeakPolarHBondContact O-CG2 3.33Å; E148-V152 PolarHBondContact O-N 2.94Å; T150-V152 VanDerWaalsContact C-N 3.34Å; T150-V152 PolarHBondContact O-N 2.86Å; V152-Y154 PolarHBondContact O-N 3.12Å; V152-K155 PolarHBondContact O-N 3.46Å; V152-S156 PolarHBondContact O-N 2.82Å; V152-S156 PolarHBondContact O-OG 3.16Å
153	A	98.8	Very high	98.6	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-45	-177.7	0	0	0	0	0	112.2	K127 S149 T150 S156 A157	K127-A153 HydrophobicContact CB-CB 4.24Å; K127-A153 HydrophobicContact CD-CB 4.27Å; K127-A153 HydrophobicContact CG-CB 4.01Å; S149-A153 WeakPolarHBondContact O-CB 3.42Å; S149-A153 PolarHBondContact O-N 2.72Å; T150-A153 PolarHBondContact O-N 2.75Å; A153-S156 PolarHBondContact O-N 2.93Å; A153-A157 WeakPolarHBondContact O-CB 3.49Å; A153-A157 PolarHBondContact O-N 3.18Å
154	Y	98.9	Very high	98.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68.6	-37.2	177.9	-72.5	-29.1	0	0	0	113.8	K125 D129 R132 T150 V152 A157 S158 L175 F179 F182	K125-Y154 HydrophobicContact CG-CE1 4.44Å; K125-Y154 WeakPolarHBondContact O-CE1 3.45Å; D129-Y154 PolarHBondContact N-OH 3.38Å; D129-Y154 PolarHBondContact OD1-OH 3.47Å; R132-Y154 PolarHBondContact NE-OH 2.62Å; R132-Y154 VanDerWaalsContact NE-OH 3.11Å; T150-Y154 HydrophobicContact CG2-CD2 3.6Å; T150-Y154 HydrophobicContact CG2-CE2 3.4Å; T150-Y154 PolarHBondContact O-N 3.25Å; V152-Y154 PolarHBondContact O-N 3.12Å; Y154-A157 PolarHBondContact O-N 2.69Å; Y154-S158 WeakPolarHBondContact O-CB 3.48Å; Y154-S158 PolarHBondContact O-N 3.32Å; Y154-L175 HydrophobicContact CD1-CD1 3.55Å; Y154-L175 HydrophobicContact CE1-CD1 4.17Å; Y154-L175 HydrophobicContact CG-CD1 4.22Å; Y154-F179 HydrophobicContact CD2-CB 3.92Å; Y154-F179 AromaticContact CD2-CD2 3.33Å; Y154-F179 HydrophobicContact CD2-CD2 3.33Å; Y154-F179 AromaticContact CD2-CE2 3.91Å; Y154-F179 HydrophobicContact CD2-CE2 3.91Å; Y154-F179 AromaticContact CD2-CG 3.74Å; Y154-F179 HydrophobicContact CD2-CG 3.74Å; Y154-F179 HydrophobicContact CE2-CB 4.3Å; Y154-F179 HydrophobicContact CE2-CD2 4.17Å; Y154-F179 HydrophobicContact CG-CB 4.11Å; Y154-F179 HydrophobicContact CG-CD1 4.41Å; Y154-F179 AromaticContact CG-CD2 3.89Å; Y154-F179 HydrophobicContact CG-CD2 3.89Å; Y154-F179 HydrophobicContact CG-CE2 4.35Å; Y154-F179 AromaticContact CG-CG 3.92Å; Y154-F179 HydrophobicContact CG-CG 3.92Å; Y154-F182 HydrophobicContact CD2-CB 4.32Å; Y154-F182 HydrophobicContact CD2-CD1 4.32Å; Y154-F182 HydrophobicContact CD2-CG 4.41Å; Y154-F182 HydrophobicContact CE2-CB 3.81Å; Y154-F182 HydrophobicContact CE2-CG 4.2Å
155	K	98.7	Very high	98.6	Very high	98 Å²	98	50.6 Å²	50.6	43%	0.426	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-49.2	174	-79.2	177.7	170.9	174.4	0	111.2	L151 V152 A157 S158 D159 F179	L151-K155 HydrophobicContact CD1-CD 4.12Å; L151-K155 HydrophobicContact CD1-CG 4.31Å; L151-K155 HydrophobicContact CG-CD 4.13Å; L151-K155 WeakPolarHBondContact O-CB 3.35Å; L151-K155 VanDerWaalsContact O-CG 3.27Å; L151-K155 WeakPolarHBondContact O-CG 3.33Å; L151-K155 PolarHBondContact O-N 3.09Å; V152-K155 PolarHBondContact O-N 3.46Å; K155-A157 VanDerWaalsContact C-N 3.29Å; K155-A157 PolarHBondContact O-N 3.22Å; K155-S158 WeakPolarHBondContact O-CB 3.34Å; K155-S158 PolarHBondContact O-N 3.13Å; K155-D159 VanDerWaalsContact O-CG 3.26Å; K155-D159 PolarHBondContact O-N 3.4Å; K155-F179 HydrophobicContact CG-CE1 4.39Å; K155-F179 HydrophobicContact CG-CZ 4.04Å
156	S	98.6	Very high	98.5	Very high	50 Å²	50	46.6 Å²	46.6	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-40.3	176.6	-60.7	0	0	0	0	112.4	V152 A153 I160	V152-S156 PolarHBondContact O-N 2.82Å; V152-S156 PolarHBondContact O-OG 3.16Å; A153-S156 PolarHBondContact O-N 2.93Å; S156-I160 WeakPolarHBondContact O-CG1 3.3Å; S156-I160 PolarHBondContact O-N 3.05Å
157	A	98.8	Very high	98.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-41.1	173.7	0	0	0	0	0	111.9	V121 L124 A153 Y154 K155 I160 A161 L175	V121-A157 HydrophobicContact CG1-CB 4.33Å; L124-A157 HydrophobicContact CB-CB 3.69Å; A153-A157 WeakPolarHBondContact O-CB 3.49Å; A153-A157 PolarHBondContact O-N 3.18Å; Y154-A157 PolarHBondContact O-N 2.69Å; K155-A157 VanDerWaalsContact C-N 3.29Å; K155-A157 PolarHBondContact O-N 3.22Å; A157-I160 PolarHBondContact O-N 2.98Å; A157-A161 WeakPolarHBondContact O-CB 3.4Å; A157-A161 PolarHBondContact O-N 2.73Å; A157-L175 VanDerWaalsContact C-CD2 3.47Å; A157-L175 HydrophobicContact CB-CD1 3.85Å; A157-L175 HydrophobicContact CB-CD2 3.57Å; A157-L175 HydrophobicContact CB-CG 4.38Å
158	S	98.7	Very high	98.4	Very high	32 Å²	32	46.8 Å²	46.8	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-38.7	-176.6	-170.4	0	0	0	0	112	Y154 K155 A161 T162	Y154-S158 WeakPolarHBondContact O-CB 3.48Å; Y154-S158 PolarHBondContact O-N 3.32Å; K155-S158 WeakPolarHBondContact O-CB 3.34Å; K155-S158 PolarHBondContact O-N 3.13Å; S158-A161 PolarHBondContact O-N 2.75Å; S158-T162 VanDerWaalsContact O-CB 3.27Å; S158-T162 WeakPolarHBondContact O-CB 3.33Å; S158-T162 PolarHBondContact O-N 3.11Å; S158-T162 PolarHBondContact O-OG1 2.8Å
159	D	98.6	Very high	98.3	Very high	114 Å²	114	43.5 Å²	43.5	61%	0.61	26%	0.257	S	S	*	.	H	α-helix	trans	-61.3	-47.5	177.5	-66.7	-20.4	0	0	0	110.4	K155 A163	K155-D159 VanDerWaalsContact O-CG 3.26Å; K155-D159 PolarHBondContact O-N 3.4Å; D159-A163 WeakPolarHBondContact O-CB 3.5Å; D159-A163 PolarHBondContact O-N 3.23Å
160	I	98.7	Very high	98.2	Very high	38 Å²	38	42.9 Å²	42.9	20%	0.195	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-46.6	177.3	-58	171.1	0	0	0	110.6	A117 K120 V121 L124 S156 A157 T162 A163 E164	A117-I160 HydrophobicContact CB-CG2 4.14Å; K120-I160 HydrophobicContact CB-CD1 4.04Å; K120-I160 HydrophobicContact CD-CD1 4.41Å; V121-I160 HydrophobicContact CG2-CB 3.81Å; V121-I160 HydrophobicContact CG2-CG2 3.61Å; L124-I160 HydrophobicContact CD1-CD1 3.79Å; S156-I160 WeakPolarHBondContact O-CG1 3.3Å; S156-I160 PolarHBondContact O-N 3.05Å; A157-I160 PolarHBondContact O-N 2.98Å; I160-T162 VanDerWaalsContact C-N 3.3Å; I160-T162 PolarHBondContact O-N 2.76Å; I160-A163 PolarHBondContact O-N 3.33Å; I160-E164 WeakPolarHBondContact O-CB 3.25Å; I160-E164 PolarHBondContact O-N 2.85Å
161	A	98.7	Very high	98.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-61.5	-39.3	-178.1	0	0	0	0	0	112.4	V121 A157 S158 L165 R172 L175	V121-A161 HydrophobicContact CG1-CB 3.86Å; V121-A161 HydrophobicContact CG2-CB 3.91Å; A157-A161 WeakPolarHBondContact O-CB 3.4Å; A157-A161 PolarHBondContact O-N 2.73Å; S158-A161 PolarHBondContact O-N 2.75Å; A161-L165 HydrophobicContact CB-CD1 4.2Å; A161-L165 WeakPolarHBondContact O-CA 3.39Å; A161-L165 WeakPolarHBondContact O-CB 3.27Å; A161-L165 PolarHBondContact O-N 2.89Å; A161-L165 VanDerWaalsContact O-O 3.07Å; A161-R172 HydrophobicContact CB-CB 4.25Å; A161-R172 HydrophobicContact CB-CG 4.09Å; A161-L175 HydrophobicContact CB-CD2 4.14Å
162	T	98	Very high	98.2	Very high	83 Å²	83	43.6 Å²	43.6	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-70.9	-34.8	179.6	-55.4	0	0	0	0	111.6	S158 I160	S158-T162 VanDerWaalsContact O-CB 3.27Å; S158-T162 WeakPolarHBondContact O-CB 3.33Å; S158-T162 PolarHBondContact O-N 3.11Å; S158-T162 PolarHBondContact O-OG1 2.8Å; I160-T162 VanDerWaalsContact C-N 3.3Å; I160-T162 PolarHBondContact O-N 2.76Å
163	A	98.1	Very high	98.2	Very high	82 Å²	82	39.2 Å²	39.2	68%	0.678	23%	0.227	S	C	*	.	H	α-helix	trans	-78.6	-35.8	-179.7	0	0	0	0	0	113.5	D159 I160	D159-A163 WeakPolarHBondContact O-CB 3.5Å; D159-A163 PolarHBondContact O-N 3.23Å; I160-A163 PolarHBondContact O-N 3.33Å
164	E	98.2	Very high	98.2	Very high	121 Å²	121	39.5 Å²	39.5	57%	0.565	23%	0.23	S	C	*	.	H	α-helix	trans	-122.4	-13	-164.7	-61.2	-169.9	-116.9	0	0	114.7	A117 I160	A117-E164 HydrophobicContact CB-CB 3.61Å; A117-E164 HydrophobicContact CB-CG 4.28Å; A117-E164 WeakPolarHBondContact CB-OE2 3.31Å; I160-E164 WeakPolarHBondContact O-CB 3.25Å; I160-E164 PolarHBondContact O-N 2.85Å
165	L	97.5	Very high	98.1	Very high	14 Å²	14	39.7 Å²	39.7	7%	0.073	23%	0.231	C	C	.	.	S	Bend	trans	-115.8	138.5	-179.8	-53.2	-179.6	0	0	0	111.5	A117 E118 V121 A161 H169 R172	A117-L165 HydrophobicContact CB-CD2 4.25Å; E118-L165 HydrophobicContact CG-CD2 3.77Å; V121-L165 HydrophobicContact CB-CD1 4.17Å; V121-L165 HydrophobicContact CG1-CD1 4.27Å; V121-L165 HydrophobicContact CG2-CD1 3.95Å; A161-L165 HydrophobicContact CB-CD1 4.2Å; A161-L165 WeakPolarHBondContact O-CA 3.39Å; A161-L165 WeakPolarHBondContact O-CB 3.27Å; A161-L165 PolarHBondContact O-N 2.89Å; A161-L165 VanDerWaalsContact O-O 3.07Å; L165-H169 HydrophobicContact CB-CB 4.09Å; L165-R172 HydrophobicContact CB-CB 4.31Å; L165-R172 HydrophobicContact CD1-CB 4.42Å; L165-R172 PolarHBondContact O-NH1 3.31Å
166	A	96.9	Very high	98.2	Very high	46 Å²	46	35.6 Å²	35.6	38%	0.38	22%	0.215	S	C	.	.			trans	-57.7	146.2	174.3	0	0	0	0	0	111.2	T168 H169 R172	A166-T168 PolarHBondContact O-N 3.48Å; A166-T168 VanDerWaalsContact O-N 3.12Å; A166-H169 WeakPolarHBondContact O-CB 3.38Å; A166-H169 PolarHBondContact O-N 3.3Å; A166-R172 WeakPolarHBondContact O-CD 3.31Å
167	P	97.7	Very high	98.2	Very high	17 Å²	17	34.1 Å²	34.1	11%	0.11	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-32.8	175	-29.1	36.4	0	0	0	114.5	H169 L173 D203 E207	P167-H169 VanDerWaalsContact C-N 3.31Å; P167-H169 PolarHBondContact O-N 3.42Å; P167-L173 WeakPolarHBondContact O-CG 3.21Å; P167-D203 HydrophobicContact CB-CB 3.96Å; P167-D203 HydrophobicContact CG-CB 4.46Å; P167-E207 WeakPolarHBondContact CD-OE2 3.47Å
168	T	97.3	Very high	98.2	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.037	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-3.5	178.4	53.6	0	0	0	0	113.9	A166 A204 E207 S219	A166-T168 PolarHBondContact O-N 3.48Å; A166-T168 VanDerWaalsContact O-N 3.12Å; T168-A204 HydrophobicContact CG2-CB 4.44Å; T168-A204 WeakPolarHBondContact CG2-O 3.18Å; T168-E207 HydrophobicContact CG2-CB 3.98Å; T168-S219 WeakPolarHBondContact O-CB 3.45Å; T168-S219 PolarHBondContact O-OG 3.4Å
169	H	97.1	Very high	98.2	Very high	35 Å²	35	34.4 Å²	34.4	16%	0.162	20%	0.202	C	C	.	.			trans	-67.7	127.9	-176	-169.1	-77.8	0	0	0	111.4	E118 L165 A166 P167 I171 R172 L173	E118-H169 IonicContact OE1-NE2 2.76Å; E118-H169 PolarHBondContact OE1-NE2 2.99Å; L165-H169 HydrophobicContact CB-CB 4.09Å; A166-H169 WeakPolarHBondContact O-CB 3.38Å; A166-H169 PolarHBondContact O-N 3.3Å; P167-H169 VanDerWaalsContact C-N 3.31Å; P167-H169 PolarHBondContact O-N 3.42Å; H169-I171 VanDerWaalsContact C-N 3.3Å; H169-I171 PolarHBondContact ND1-N 3.39Å; H169-I171 VanDerWaalsContact ND1-N 3.2Å; H169-I171 PolarHBondContact O-N 3.2Å; H169-I171 VanDerWaalsContact O-N 3.16Å; H169-R172 HydrophobicContact CB-CB 4.26Å; H169-R172 PolarHBondContact O-N 3.24Å; H169-L173 PolarHBondContact O-N 3.45Å
170	P	97.2	Very high	98.2	Very high	23 Å²	23	29 Å²	29	15%	0.149	17%	0.173	C	C	.	.	H	α-helix	trans	-54.7	-39.9	-175	-26.3	30.8	0	0	0	114.4	G174 D218 S219 I222	P170-G174 PolarHBondContact O-N 3.32Å; P170-D218 HydrophobicContact CB-CB 4.22Å; P170-D218 HydrophobicContact CG-CB 4.15Å; P170-S219 WeakPolarHBondContact CD-OG 3.33Å; P170-S219 WeakPolarHBondContact CG-OG 3.26Å; P170-I222 HydrophobicContact CB-CD1 4.14Å; P170-I222 WeakPolarHBondContact O-CD1 3.38Å
171	I	98	Very high	98.2	Very high	19 Å²	19	28 Å²	28	10%	0.097	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-40.8	178.1	-60	177.5	0	0	0	111.6	E118 V121 F122 H169 G174 L175	E118-I171 HydrophobicContact CB-CD1 4.09Å; E118-I171 HydrophobicContact CG-CD1 4.46Å; V121-I171 HydrophobicContact CB-CG2 4.02Å; V121-I171 HydrophobicContact CG1-CG2 3.56Å; F122-I171 HydrophobicContact CB-CD1 4.33Å; F122-I171 HydrophobicContact CD2-CD1 4.06Å; F122-I171 HydrophobicContact CD2-CG1 4.4Å; H169-I171 VanDerWaalsContact C-N 3.3Å; H169-I171 PolarHBondContact ND1-N 3.39Å; H169-I171 VanDerWaalsContact ND1-N 3.2Å; H169-I171 PolarHBondContact O-N 3.2Å; H169-I171 VanDerWaalsContact O-N 3.16Å; I171-G174 PolarHBondContact O-N 2.99Å; I171-L175 WeakPolarHBondContact O-CB 3.37Å; I171-L175 PolarHBondContact O-N 3.16Å
172	R	98.4	Very high	98.2	Very high	40 Å²	40	28 Å²	28	15%	0.151	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-46.7	179.2	176.5	175.3	171.2	175	-6.9	110.6	A161 L165 A166 H169 G174 L175 A176 D203	A161-R172 HydrophobicContact CB-CB 4.25Å; A161-R172 HydrophobicContact CB-CG 4.09Å; L165-R172 HydrophobicContact CB-CB 4.31Å; L165-R172 HydrophobicContact CD1-CB 4.42Å; L165-R172 PolarHBondContact O-NH1 3.31Å; A166-R172 WeakPolarHBondContact O-CD 3.31Å; H169-R172 HydrophobicContact CB-CB 4.26Å; H169-R172 PolarHBondContact O-N 3.24Å; R172-G174 VanDerWaalsContact C-N 3.35Å; R172-G174 PolarHBondContact O-N 3.1Å; R172-L175 WeakPolarHBondContact O-CB 3.25Å; R172-L175 PolarHBondContact O-N 2.88Å; R172-A176 PolarHBondContact O-N 3.12Å; R172-D203 IonicContact NH2-OD2 3.85Å
173	L	98.6	Very high	98.2	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-45.5	174.7	-73.3	171.3	0	0	0	111.5	P167 H169 L175 A176 L177 A204 I222 M223 L226	P167-L173 WeakPolarHBondContact O-CG 3.21Å; H169-L173 PolarHBondContact O-N 3.45Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.27Å; L173-A176 PolarHBondContact O-N 2.97Å; L173-L177 PolarHBondContact O-N 2.95Å; L173-A204 HydrophobicContact CD1-CB 4.46Å; L173-A204 HydrophobicContact CD2-CB 3.62Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.43Å; L173-I222 HydrophobicContact CB-CG2 3.62Å; L173-M223 HydrophobicContact CD1-CG 3.9Å; L173-M223 HydrophobicContact CD1-SD 4.32Å; L173-M223 HydrophobicContact CD2-CG 4.12Å; L173-L226 HydrophobicContact CD2-CD1 4.09Å
174	G	98.5	Very high	98.2	Very high	9 Å²	9	24.4 Å²	24.4	9%	0.093	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-34	178.7	0	0	0	0	0	112.9	K125 P170 I171 R172 N178	K125-G174 WeakPolarHBondContact CE-O 3.44Å; P170-G174 PolarHBondContact O-N 3.32Å; I171-G174 PolarHBondContact O-N 2.99Å; R172-G174 VanDerWaalsContact C-N 3.35Å; R172-G174 PolarHBondContact O-N 3.1Å; G174-N178 PolarHBondContact O-N 3.31Å; G174-N178 VanDerWaalsContact O-N 3.12Å
175	L	98.8	Very high	98.1	Very high	4 Å²	4	23.4 Å²	23.4	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-64.1	-49.2	171.4	171.6	64.1	0	0	0	111	V121 K125 Y154 A157 A161 I171 R172 L173 L177 N178 F179	V121-L175 HydrophobicContact CG1-CD2 4.12Å; K125-L175 HydrophobicContact CB-CD1 4.06Å; K125-L175 HydrophobicContact CD-CB 4.08Å; K125-L175 HydrophobicContact CG-CB 4.3Å; K125-L175 HydrophobicContact CG-CD1 3.98Å; Y154-L175 HydrophobicContact CD1-CD1 3.55Å; Y154-L175 HydrophobicContact CE1-CD1 4.17Å; Y154-L175 HydrophobicContact CG-CD1 4.22Å; A157-L175 VanDerWaalsContact C-CD2 3.47Å; A157-L175 HydrophobicContact CB-CD1 3.85Å; A157-L175 HydrophobicContact CB-CD2 3.57Å; A157-L175 HydrophobicContact CB-CG 4.38Å; A161-L175 HydrophobicContact CB-CD2 4.14Å; I171-L175 WeakPolarHBondContact O-CB 3.37Å; I171-L175 PolarHBondContact O-N 3.16Å; R172-L175 WeakPolarHBondContact O-CB 3.25Å; R172-L175 PolarHBondContact O-N 2.88Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.27Å; L175-L177 VanDerWaalsContact C-N 3.29Å; L175-L177 PolarHBondContact O-N 3.4Å; L175-N178 PolarHBondContact O-N 3.43Å; L175-F179 WeakPolarHBondContact O-CB 3.05Å; L175-F179 PolarHBondContact O-N 2.95Å
176	A	98.8	Very high	98.2	Very high	11 Å²	11	23.6 Å²	23.6	9%	0.091	13%	0.125	C	C	.	.	H	α-helix	trans	-60.4	-39.9	178.6	0	0	0	0	0	112.2	R172 L173 S180 A200	R172-A176 PolarHBondContact O-N 3.12Å; L173-A176 PolarHBondContact O-N 2.97Å; A176-S180 WeakPolarHBondContact O-CB 3.44Å; A176-S180 PolarHBondContact O-N 3.18Å; A176-S180 PolarHBondContact O-OG 2.65Å; A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å
177	L	98.8	Very high	98.2	Very high	19 Å²	19	24.2 Å²	24.2	10%	0.099	12%	0.121	C	C	.	.	H	α-helix	trans	-58.5	-53.1	174.1	177.5	63.9	0	0	0	111.3	L173 L175 F179 S180 V181 I222 L225 L226 N229	L173-L177 PolarHBondContact O-N 2.95Å; L175-L177 VanDerWaalsContact C-N 3.29Å; L175-L177 PolarHBondContact O-N 3.4Å; L177-F179 PolarHBondContact O-N 3.49Å; L177-S180 PolarHBondContact O-N 3.21Å; L177-S180 PolarHBondContact O-OG 3.18Å; L177-V181 WeakPolarHBondContact O-CG2 3.08Å; L177-V181 PolarHBondContact O-N 2.98Å; L177-V181 VanDerWaalsContact O-N 3.16Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; L177-L225 HydrophobicContact CD1-CB 4.11Å; L177-L225 HydrophobicContact CD2-CB 3.93Å; L177-L225 HydrophobicContact CD2-CD1 3.9Å; L177-L226 HydrophobicContact CB-CD2 3.94Å; L177-L226 HydrophobicContact CB-CG 4.23Å; L177-L226 HydrophobicContact CD1-CD2 4Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; L177-N229 VanDerWaalsContact CD1-ND2 3.33Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.08Å
178	N	98.6	Very high	98.2	Very high	30 Å²	30	30 Å²	30	16%	0.16	15%	0.152	C	C	.	.	H	α-helix	trans	-72.7	-30.4	-175.8	-72.5	4.6	0	0	0	112.9	K125 D129 G174 L175 F182	K125-N178 PolarHBondContact NZ-ND2 3.01Å; D129-N178 WeakPolarHBondContact OD1-CB 3.32Å; D129-N178 PolarHBondContact OD1-ND2 3.32Å; D129-N178 PolarHBondContact OD2-ND2 3.04Å; G174-N178 PolarHBondContact O-N 3.31Å; G174-N178 VanDerWaalsContact O-N 3.12Å; L175-N178 PolarHBondContact O-N 3.43Å; N178-F182 PolarHBondContact O-N 3.43Å; N178-F182 VanDerWaalsContact O-N 3.12Å
179	F	98.8	Very high	98.2	Very high	9 Å²	9	31.2 Å²	31.2	4%	0.039	16%	0.16	C	C	.	.	H	α-helix	trans	-74.6	-36	177.1	-167	-173.2	0	0	0	111.8	L151 Y154 K155 L175 L177 F182 Y183 L196	L151-F179 HydrophobicContact CD1-CE2 3.83Å; L151-F179 HydrophobicContact CD1-CZ 3.86Å; Y154-F179 HydrophobicContact CD2-CB 3.92Å; Y154-F179 AromaticContact CD2-CD2 3.33Å; Y154-F179 HydrophobicContact CD2-CD2 3.33Å; Y154-F179 AromaticContact CD2-CE2 3.91Å; Y154-F179 HydrophobicContact CD2-CE2 3.91Å; Y154-F179 AromaticContact CD2-CG 3.74Å; Y154-F179 HydrophobicContact CD2-CG 3.74Å; Y154-F179 HydrophobicContact CE2-CB 4.3Å; Y154-F179 HydrophobicContact CE2-CD2 4.17Å; Y154-F179 HydrophobicContact CG-CB 4.11Å; Y154-F179 HydrophobicContact CG-CD1 4.41Å; Y154-F179 AromaticContact CG-CD2 3.89Å; Y154-F179 HydrophobicContact CG-CD2 3.89Å; Y154-F179 HydrophobicContact CG-CE2 4.35Å; Y154-F179 AromaticContact CG-CG 3.92Å; Y154-F179 HydrophobicContact CG-CG 3.92Å; K155-F179 HydrophobicContact CG-CE1 4.39Å; K155-F179 HydrophobicContact CG-CZ 4.04Å; L175-F179 WeakPolarHBondContact O-CB 3.05Å; L175-F179 PolarHBondContact O-N 2.95Å; L177-F179 PolarHBondContact O-N 3.49Å; F179-F182 HydrophobicContact CD2-CB 4.45Å; F179-F182 AromaticContact CD2-CD1 3.86Å; F179-F182 HydrophobicContact CD2-CD1 3.86Å; F179-F182 AromaticContact CE2-CD1 3.83Å; F179-F182 HydrophobicContact CE2-CD1 3.83Å; F179-F182 HydrophobicContact CE2-CE1 4.27Å; F179-F182 WeakPolarHBondContact O-CB 3.43Å; F179-F182 PolarHBondContact O-N 3.45Å; F179-Y183 HydrophobicContact CD1-CE2 4.37Å; F179-Y183 AromaticContact CD2-CD2 3.93Å; F179-Y183 HydrophobicContact CD2-CD2 3.93Å; F179-Y183 AromaticContact CD2-CE2 3.59Å; F179-Y183 HydrophobicContact CD2-CE2 3.59Å; F179-Y183 HydrophobicContact CE1-CE2 4.14Å; F179-Y183 HydrophobicContact CE2-CD2 4.04Å; F179-Y183 HydrophobicContact CE2-CE1 4.33Å; F179-Y183 AromaticContact CE2-CE2 3.31Å; F179-Y183 HydrophobicContact CE2-CE2 3.31Å; F179-Y183 AromaticContact CE2-CZ 3.49Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.49Å; F179-Y183 HydrophobicContact CG-CE2 4.13Å; F179-Y183 AromaticContact CZ-CE2 3.63Å; F179-Y183 HydrophobicContact CZ-CE2 3.63Å; F179-Y183 AromaticContact CZ-CZ 3.68Å; F179-Y183 VanDerWaalsContact CZ-OH 3.25Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.09Å; F179-Y183 VanDerWaalsContact O-CD2 3.31Å; F179-Y183 WeakPolarHBondContact O-CD2 3.5Å; F179-Y183 PolarHBondContact O-N 2.98Å; F179-Y183 VanDerWaalsContact O-N 3.07Å; F179-L196 HydrophobicContact CB-CD2 3.77Å; F179-L196 HydrophobicContact CD1-CD2 3.71Å; F179-L196 HydrophobicContact CD2-CD2 4.49Å; F179-L196 HydrophobicContact CE1-CD2 4.5Å; F179-L196 HydrophobicContact CG-CD2 3.71Å
180	S	98.7	Very high	98.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-41.8	172.4	58.4	0	0	0	0	111.7	A176 L177 F182 Y183 Y184 A193	A176-S180 WeakPolarHBondContact O-CB 3.44Å; A176-S180 PolarHBondContact O-N 3.18Å; A176-S180 PolarHBondContact O-OG 2.65Å; L177-S180 PolarHBondContact O-N 3.21Å; L177-S180 PolarHBondContact O-OG 3.18Å; S180-F182 VanDerWaalsContact C-N 3.28Å; S180-F182 PolarHBondContact O-N 3.46Å; S180-Y183 PolarHBondContact O-N 3.45Å; S180-Y183 VanDerWaalsContact O-N 3.13Å; S180-Y184 PolarHBondContact O-N 2.85Å; S180-A193 WeakPolarHBondContact CB-O 3.27Å; S180-A193 VanDerWaalsContact O-CB 3.24Å; S180-A193 WeakPolarHBondContact O-CB 3.2Å
181	V	98.5	Very high	98.1	Very high	18 Å²	18	34.9 Å²	34.9	11%	0.109	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-40.1	172.4	172.4	0	0	0	0	111.7	L177 Y184 E185 W233	L177-V181 WeakPolarHBondContact O-CG2 3.08Å; L177-V181 PolarHBondContact O-N 2.98Å; L177-V181 VanDerWaalsContact O-N 3.16Å; V181-Y184 PolarHBondContact O-N 2.91Å; V181-E185 VanDerWaalsContact CG1-CD 3.46Å; V181-E185 HydrophobicContact CG1-CG 3.99Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.38Å; V181-E185 WeakPolarHBondContact O-CB 3.33Å; V181-E185 PolarHBondContact O-N 3.14Å; V181-W233 HydrophobicContact CG2-CH2 4.04Å; V181-W233 HydrophobicContact CG2-CZ2 4Å
182	F	98.7	Very high	98.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-45.8	174.2	170.1	-111.6	0	0	0	113.3	R132 A147 T150 L151 Y154 N178 F179 S180 Y184 I186 L187	R132-F182 HydrophobicContact CG-CD2 4.19Å; A147-F182 HydrophobicContact CB-CE2 4.28Å; A147-F182 HydrophobicContact CB-CZ 4.41Å; A147-F182 VanDerWaalsContact O-CZ 3.32Å; A147-F182 WeakPolarHBondContact O-CZ 3.39Å; T150-F182 HydrophobicContact CG2-CB 4.4Å; T150-F182 HydrophobicContact CG2-CD1 4.1Å; T150-F182 HydrophobicContact CG2-CD2 3.38Å; T150-F182 HydrophobicContact CG2-CE1 4.17Å; T150-F182 HydrophobicContact CG2-CE2 3.5Å; T150-F182 VanDerWaalsContact CG2-CE2 3.5Å; T150-F182 HydrophobicContact CG2-CG 3.69Å; T150-F182 HydrophobicContact CG2-CZ 3.9Å; L151-F182 HydrophobicContact CB-CE1 3.96Å; L151-F182 HydrophobicContact CB-CZ 4.15Å; L151-F182 HydrophobicContact CD1-CE1 4.06Å; Y154-F182 HydrophobicContact CD2-CB 4.32Å; Y154-F182 HydrophobicContact CD2-CD1 4.32Å; Y154-F182 HydrophobicContact CD2-CG 4.41Å; Y154-F182 HydrophobicContact CE2-CB 3.81Å; Y154-F182 HydrophobicContact CE2-CG 4.2Å; N178-F182 PolarHBondContact O-N 3.43Å; N178-F182 VanDerWaalsContact O-N 3.12Å; F179-F182 HydrophobicContact CD2-CB 4.45Å; F179-F182 AromaticContact CD2-CD1 3.86Å; F179-F182 HydrophobicContact CD2-CD1 3.86Å; F179-F182 AromaticContact CE2-CD1 3.83Å; F179-F182 HydrophobicContact CE2-CD1 3.83Å; F179-F182 HydrophobicContact CE2-CE1 4.27Å; F179-F182 WeakPolarHBondContact O-CB 3.43Å; F179-F182 PolarHBondContact O-N 3.45Å; S180-F182 VanDerWaalsContact C-N 3.28Å; S180-F182 PolarHBondContact O-N 3.46Å; F182-Y184 VanDerWaalsContact C-N 3.25Å; F182-Y184 PolarHBondContact O-N 3.12Å; F182-I186 HydrophobicContact CD2-CB 3.55Å; F182-I186 HydrophobicContact CD2-CG1 3.76Å; F182-I186 HydrophobicContact CD2-CG2 3.98Å; F182-I186 HydrophobicContact CE2-CB 3.69Å; F182-I186 HydrophobicContact CE2-CG1 4.25Å; F182-I186 HydrophobicContact CE2-CG2 3.58Å; F182-I186 WeakPolarHBondContact O-CB 3.43Å; F182-I186 PolarHBondContact O-N 3.06Å; F182-L187 HydrophobicContact CD1-CD1 4.05Å; F182-L187 HydrophobicContact CD1-CG 4.28Å; F182-L187 HydrophobicContact CE1-CD1 3.31Å; F182-L187 HydrophobicContact CE1-CD2 4.32Å; F182-L187 HydrophobicContact CE1-CG 3.66Å; F182-L187 HydrophobicContact CE2-CD2 4.33Å; F182-L187 HydrophobicContact CE2-CG 4.11Å; F182-L187 HydrophobicContact CZ-CD1 3.66Å; F182-L187 HydrophobicContact CZ-CD2 3.78Å; F182-L187 HydrophobicContact CZ-CG 3.55Å; F182-L187 PolarHBondContact O-N 3.01Å; F182-L187 VanDerWaalsContact O-N 3.14Å
183	Y	98.6	Very high	98.1	Very high	28 Å²	28	39.4 Å²	39.4	11%	0.11	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-41.4	176.9	-81.4	-59.7	0	0	0	111.5	L151 F179 S180 L187 N188 S189 R192 L196	L151-Y183 HydrophobicContact CD1-CE1 4.41Å; F179-Y183 HydrophobicContact CD1-CE2 4.37Å; F179-Y183 AromaticContact CD2-CD2 3.93Å; F179-Y183 HydrophobicContact CD2-CD2 3.93Å; F179-Y183 AromaticContact CD2-CE2 3.59Å; F179-Y183 HydrophobicContact CD2-CE2 3.59Å; F179-Y183 HydrophobicContact CE1-CE2 4.14Å; F179-Y183 HydrophobicContact CE2-CD2 4.04Å; F179-Y183 HydrophobicContact CE2-CE1 4.33Å; F179-Y183 AromaticContact CE2-CE2 3.31Å; F179-Y183 HydrophobicContact CE2-CE2 3.31Å; F179-Y183 AromaticContact CE2-CZ 3.49Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.49Å; F179-Y183 HydrophobicContact CG-CE2 4.13Å; F179-Y183 AromaticContact CZ-CE2 3.63Å; F179-Y183 HydrophobicContact CZ-CE2 3.63Å; F179-Y183 AromaticContact CZ-CZ 3.68Å; F179-Y183 VanDerWaalsContact CZ-OH 3.25Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.09Å; F179-Y183 VanDerWaalsContact O-CD2 3.31Å; F179-Y183 WeakPolarHBondContact O-CD2 3.5Å; F179-Y183 PolarHBondContact O-N 2.98Å; F179-Y183 VanDerWaalsContact O-N 3.07Å; S180-Y183 PolarHBondContact O-N 3.45Å; S180-Y183 VanDerWaalsContact O-N 3.13Å; Y183-L187 HydrophobicContact CD1-CD1 3.7Å; Y183-L187 HydrophobicContact CE1-CD1 3.82Å; Y183-L187 CarbonylContact O-C 3.5Å; Y183-N188 PolarHBondContact O-N 3.09Å; Y183-S189 WeakPolarHBondContact O-CA 3.45Å; Y183-S189 PolarHBondContact O-N 3.45Å; Y183-R192 HydrophobicContact CD1-CB 3.9Å; Y183-R192 HydrophobicContact CD2-CB 4.4Å; Y183-R192 HydrophobicContact CE1-CB 4.35Å; Y183-R192 HydrophobicContact CG-CB 3.94Å; Y183-L196 HydrophobicContact CD2-CD2 4.02Å; Y183-L196 HydrophobicContact CE2-CD2 3.94Å
184	Y	98.3	Very high	98	Very high	62 Å²	62	40.2 Å²	40.2	24%	0.243	20%	0.202	C	C	.	.	H	α-helix	trans	-71.1	-63	179.2	-173.9	-88.7	0	0	0	111.5	S180 V181 F182 N188 P190 W233 D236	S180-Y184 PolarHBondContact O-N 2.85Å; V181-Y184 PolarHBondContact O-N 2.91Å; F182-Y184 VanDerWaalsContact C-N 3.25Å; F182-Y184 PolarHBondContact O-N 3.12Å; Y184-N188 WeakPolarHBondContact O-CA 3.35Å; Y184-N188 PolarHBondContact O-N 2.71Å; Y184-P190 HydrophobicContact CD2-CB 4Å; Y184-P190 HydrophobicContact CE2-CB 4.2Å; Y184-W233 AromaticContact CD1-CD1 3.98Å; Y184-W233 AromaticContact CD1-NE1 3.53Å; Y184-W233 HydrophobicContact CD2-CB 3.97Å; Y184-W233 AromaticContact CD2-CD1 3.4Å; Y184-W233 VanDerWaalsContact CD2-CD1 3.4Å; Y184-W233 AromaticContact CD2-CD2 3.73Å; Y184-W233 HydrophobicContact CD2-CD2 3.73Å; Y184-W233 AromaticContact CD2-CE2 3.86Å; Y184-W233 AromaticContact CD2-CG 3.43Å; Y184-W233 HydrophobicContact CD2-CG 3.43Å; Y184-W233 VanDerWaalsContact CD2-CG 3.43Å; Y184-W233 AromaticContact CD2-NE1 3.64Å; Y184-W233 AromaticContact CE1-CD1 3.75Å; Y184-W233 AromaticContact CE1-NE1 3.63Å; Y184-W233 HydrophobicContact CE2-CB 3.73Å; Y184-W233 AromaticContact CE2-CD1 3.11Å; Y184-W233 HydrophobicContact CE2-CD2 4.2Å; Y184-W233 AromaticContact CE2-CG 3.41Å; Y184-W233 HydrophobicContact CE2-CG 3.41Å; Y184-W233 VanDerWaalsContact CE2-CG 3.41Å; Y184-W233 AromaticContact CE2-NE1 3.72Å; Y184-W233 AromaticContact CG-CD1 3.82Å; Y184-W233 HydrophobicContact CG-CD2 4.04Å; Y184-W233 AromaticContact CG-CE2 3.69Å; Y184-W233 HydrophobicContact CG-CG 4.11Å; Y184-W233 HydrophobicContact CG-CZ2 4.2Å; Y184-W233 AromaticContact CG-NE1 3.54Å; Y184-W233 AromaticContact CZ-CD1 3.31Å; Y184-W233 AromaticContact CZ-NE1 3.72Å; Y184-D236 PolarHBondContact OH-OD2 3.45Å
185	E	96.9	Very high	98	Very high	100 Å²	100	43.4 Å²	43.4	47%	0.467	22%	0.224	S	C	.	.	H	α-helix	trans	-77.2	-31.6	-167.7	-63	-176.8	166.7	0	0	114.2	V181	V181-E185 VanDerWaalsContact CG1-CD 3.46Å; V181-E185 HydrophobicContact CG1-CG 3.99Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.38Å; V181-E185 WeakPolarHBondContact O-CB 3.33Å; V181-E185 PolarHBondContact O-N 3.14Å
186	I	98.2	Very high	98	Very high	18 Å²	18	44.8 Å²	44.8	9%	0.092	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-43.2	-172.3	-54.2	-57	0	0	0	112.1	R132 A135 E136 A147 F182	R132-I186 HydrophobicContact CG-CG1 4Å; A135-I186 HydrophobicContact CB-CD1 4.32Å; A135-I186 HydrophobicContact CB-CG2 3.82Å; E136-I186 HydrophobicContact CG-CD1 3.96Å; A147-I186 HydrophobicContact CB-CG2 4.06Å; F182-I186 HydrophobicContact CD2-CB 3.55Å; F182-I186 HydrophobicContact CD2-CG1 3.76Å; F182-I186 HydrophobicContact CD2-CG2 3.98Å; F182-I186 HydrophobicContact CE2-CB 3.69Å; F182-I186 HydrophobicContact CE2-CG1 4.25Å; F182-I186 HydrophobicContact CE2-CG2 3.58Å; F182-I186 WeakPolarHBondContact O-CB 3.43Å; F182-I186 PolarHBondContact O-N 3.06Å
187	L	97.9	Very high	97.9	Very high	58 Å²	58	44.3 Å²	44.3	30%	0.304	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.7	-179.8	-62.3	-172.7	0	0	0	113.8	A147 F182 Y183 S189	A147-L187 HydrophobicContact CB-CD2 4.47Å; F182-L187 HydrophobicContact CD1-CD1 4.05Å; F182-L187 HydrophobicContact CD1-CG 4.28Å; F182-L187 HydrophobicContact CE1-CD1 3.31Å; F182-L187 HydrophobicContact CE1-CD2 4.32Å; F182-L187 HydrophobicContact CE1-CG 3.66Å; F182-L187 HydrophobicContact CE2-CD2 4.33Å; F182-L187 HydrophobicContact CE2-CG 4.11Å; F182-L187 HydrophobicContact CZ-CD1 3.66Å; F182-L187 HydrophobicContact CZ-CD2 3.78Å; F182-L187 HydrophobicContact CZ-CG 3.55Å; F182-L187 PolarHBondContact O-N 3.01Å; F182-L187 VanDerWaalsContact O-N 3.14Å; Y183-L187 HydrophobicContact CD1-CD1 3.7Å; Y183-L187 HydrophobicContact CE1-CD1 3.82Å; Y183-L187 CarbonylContact O-C 3.5Å; L187-S189 PolarHBondContact O-N 2.85Å; L187-S189 VanDerWaalsContact O-N 3.14Å; L187-S189 PolarHBondContact O-OG 3.27Å
188	N	96.7	Very high	97.9	Very high	140 Å²	140	49 Å²	49	75%	0.749	25%	0.246	S	C	*	.			trans	46.5	45.5	-178.8	-162.7	50.2	0	0	0	112.3	Y183 Y184 P190	Y183-N188 PolarHBondContact O-N 3.09Å; Y184-N188 WeakPolarHBondContact O-CA 3.35Å; Y184-N188 PolarHBondContact O-N 2.71Å; N188-P190 VanDerWaalsContact C-CD 3.42Å; N188-P190 WeakPolarHBondContact O-CD 3.3Å
189	S	97.3	Very high	97.9	Very high	31 Å²	31	53.1 Å²	53.1	22%	0.217	26%	0.264	C	S	.	.			trans	-123.3	67.3	-173.3	-65	0	0	0	0	110	Y183 L187 D191 R192 A193	Y183-S189 WeakPolarHBondContact O-CA 3.45Å; Y183-S189 PolarHBondContact O-N 3.45Å; L187-S189 PolarHBondContact O-N 2.85Å; L187-S189 VanDerWaalsContact O-N 3.14Å; L187-S189 PolarHBondContact O-OG 3.27Å; S189-D191 VanDerWaalsContact C-N 3.3Å; S189-D191 PolarHBondContact O-N 3.31Å; S189-R192 PolarHBondContact O-N 3.41Å; S189-R192 VanDerWaalsContact O-N 3.09Å; S189-A193 PolarHBondContact O-N 2.86Å
190	P	96.4	Very high	97.9	Very high	28 Å²	28	53.4 Å²	53.4	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-38.4	-174.7	23.8	-34.3	0	0	0	112.6	Y184 N188 R192 A193 C194 M237	Y184-P190 HydrophobicContact CD2-CB 4Å; Y184-P190 HydrophobicContact CE2-CB 4.2Å; N188-P190 VanDerWaalsContact C-CD 3.42Å; N188-P190 WeakPolarHBondContact O-CD 3.3Å; P190-R192 VanDerWaalsContact C-N 3.29Å; P190-R192 PolarHBondContact O-N 2.96Å; P190-A193 WeakPolarHBondContact O-CB 3.5Å; P190-A193 PolarHBondContact O-N 2.85Å; P190-A193 VanDerWaalsContact O-N 3.14Å; P190-C194 WeakPolarHBondContact O-CB 3.23Å; P190-C194 PolarHBondContact O-N 2.93Å; P190-C194 PolarHBondContact O-SG 2.93Å; P190-M237 HydrophobicContact CB-CG 4.09Å; P190-M237 HydrophobicContact CB-SD 3.94Å; P190-M237 HydrophobicContact CG-CG 4.4Å
191	D	96	Very high	97.9	Very high	107 Å²	107	55.3 Å²	55.3	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-55.6	-43.2	175.5	-66.8	-46.3	0	0	0	112.7	S189 S195 M237	S189-D191 VanDerWaalsContact C-N 3.3Å; S189-D191 PolarHBondContact O-N 3.31Å; D191-S195 VanDerWaalsContact O-CB 3.25Å; D191-S195 WeakPolarHBondContact O-CB 3.33Å; D191-S195 PolarHBondContact O-N 3.43Å; D191-S195 PolarHBondContact O-OG 2.75Å; D191-M237 WeakPolarHBondContact OD1-CE 3.45Å
192	R	97.6	Very high	97.8	Very high	154 Å²	154	58.2 Å²	58.2	58%	0.581	29%	0.292	S	S	*	.	H	α-helix	trans	-72	-38.8	179.2	-69.3	-174	176.3	178.4	1	111.4	Y183 S189 P190 L196	Y183-R192 HydrophobicContact CD1-CB 3.9Å; Y183-R192 HydrophobicContact CD2-CB 4.4Å; Y183-R192 HydrophobicContact CE1-CB 4.35Å; Y183-R192 HydrophobicContact CG-CB 3.94Å; S189-R192 PolarHBondContact O-N 3.41Å; S189-R192 VanDerWaalsContact O-N 3.09Å; P190-R192 VanDerWaalsContact C-N 3.29Å; P190-R192 PolarHBondContact O-N 2.96Å; R192-L196 WeakPolarHBondContact O-CB 3.36Å; R192-L196 PolarHBondContact O-N 3.28Å
193	A	98.1	Very high	97.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.3	-51.5	175.7	0	0	0	0	0	111	S180 S189 P190 L196 A197 W233	S180-A193 WeakPolarHBondContact CB-O 3.27Å; S180-A193 VanDerWaalsContact O-CB 3.24Å; S180-A193 WeakPolarHBondContact O-CB 3.2Å; S189-A193 PolarHBondContact O-N 2.86Å; P190-A193 WeakPolarHBondContact O-CB 3.5Å; P190-A193 PolarHBondContact O-N 2.85Å; P190-A193 VanDerWaalsContact O-N 3.14Å; A193-L196 PolarHBondContact O-N 3.27Å; A193-A197 WeakPolarHBondContact O-CB 3.36Å; A193-A197 PolarHBondContact O-N 3.39Å; A193-W233 HydrophobicContact CB-CE3 4.01Å; A193-W233 HydrophobicContact CB-CH2 4.49Å; A193-W233 HydrophobicContact CB-CZ3 3.9Å
194	C	97.9	Very high	97.8	Very high	18 Å²	18	59.5 Å²	59.5	12%	0.122	30%	0.301	C	S	.	.	H	α-helix	trans	-62.9	-44.2	178.2	-69.9	0	0	0	0	112	P190 L196 A197 K198 L230	P190-C194 WeakPolarHBondContact O-CB 3.23Å; P190-C194 PolarHBondContact O-N 2.93Å; P190-C194 PolarHBondContact O-SG 2.93Å; C194-L196 PolarHBondContact O-N 3.4Å; C194-A197 PolarHBondContact O-N 3.47Å; C194-K198 WeakPolarHBondContact O-CB 3.42Å; C194-K198 PolarHBondContact O-N 2.92Å; C194-L230 HydrophobicContact CB-CD2 4.08Å; C194-L230 WeakPolarHBondContact O-CD2 3.43Å
195	S	98	Very high	97.7	Very high	77 Å²	77	60.4 Å²	60.4	54%	0.538	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-46.5	177.7	-62.2	0	0	0	0	111.9	D191 Q199	D191-S195 VanDerWaalsContact O-CB 3.25Å; D191-S195 WeakPolarHBondContact O-CB 3.33Å; D191-S195 PolarHBondContact O-N 3.43Å; D191-S195 PolarHBondContact O-OG 2.75Å; S195-Q199 WeakPolarHBondContact O-CB 3.45Å; S195-Q199 PolarHBondContact O-N 3.04Å
196	L	98.4	Very high	97.7	Very high	33 Å²	33	59.7 Å²	59.7	17%	0.173	32%	0.32	C	S	.	.	H	α-helix	trans	-66.8	-47	179.4	179.3	62.8	0	0	0	112.2	F179 Y183 R192 A193 C194 K198 Q199 A200	F179-L196 HydrophobicContact CB-CD2 3.77Å; F179-L196 HydrophobicContact CD1-CD2 3.71Å; F179-L196 HydrophobicContact CD2-CD2 4.49Å; F179-L196 HydrophobicContact CE1-CD2 4.5Å; F179-L196 HydrophobicContact CG-CD2 3.71Å; Y183-L196 HydrophobicContact CD2-CD2 4.02Å; Y183-L196 HydrophobicContact CE2-CD2 3.94Å; R192-L196 WeakPolarHBondContact O-CB 3.36Å; R192-L196 PolarHBondContact O-N 3.28Å; A193-L196 PolarHBondContact O-N 3.27Å; C194-L196 PolarHBondContact O-N 3.4Å; L196-K198 VanDerWaalsContact C-N 3.34Å; L196-K198 PolarHBondContact O-N 2.92Å; L196-Q199 PolarHBondContact O-N 2.94Å; L196-A200 WeakPolarHBondContact O-CB 3.12Å; L196-A200 PolarHBondContact O-N 3.29Å
197	A	98.3	Very high	97.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.2	-40.8	-179.4	0	0	0	0	0	111.6	A193 C194 F201 L226 L230 W233	A193-A197 WeakPolarHBondContact O-CB 3.36Å; A193-A197 PolarHBondContact O-N 3.39Å; C194-A197 PolarHBondContact O-N 3.47Å; A197-F201 WeakPolarHBondContact O-CB 3.22Å; A197-F201 PolarHBondContact O-N 3.21Å; A197-L226 HydrophobicContact CB-CD2 3.85Å; A197-L230 HydrophobicContact CB-CD1 4.28Å; A197-L230 HydrophobicContact CB-CD2 3.82Å; A197-L230 HydrophobicContact CB-CG 3.87Å; A197-W233 HydrophobicContact CB-CZ3 4.27Å
198	K	98	Very high	97.4	Very high	119 Å²	119	61.5 Å²	61.5	52%	0.517	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-48.3	177	-179	170.4	-177.7	166.6	0	111.7	C194 L196 A200 F201 D202 L230	C194-K198 WeakPolarHBondContact O-CB 3.42Å; C194-K198 PolarHBondContact O-N 2.92Å; L196-K198 VanDerWaalsContact C-N 3.34Å; L196-K198 PolarHBondContact O-N 2.92Å; K198-A200 VanDerWaalsContact C-N 3.34Å; K198-A200 PolarHBondContact O-N 3.22Å; K198-F201 PolarHBondContact O-N 3.01Å; K198-D202 WeakPolarHBondContact CE-OD2 3.46Å; K198-D202 WeakPolarHBondContact CG-OD2 3.35Å; K198-D202 WeakPolarHBondContact O-CB 3.38Å; K198-D202 VanDerWaalsContact O-CG 3.31Å; K198-D202 PolarHBondContact O-N 3.2Å; K198-L230 HydrophobicContact CB-CD1 4.16Å; K198-L230 HydrophobicContact CB-CD2 4.08Å
199	Q	98.4	Very high	97.2	Very high	115 Å²	115	63 Å²	63	54%	0.537	34%	0.335	S	S	.	.	H	α-helix	trans	-57.4	-48.2	177.6	-177.7	-179.7	4.5	0	0	111.3	S195 L196 F201 D202 D203	S195-Q199 WeakPolarHBondContact O-CB 3.45Å; S195-Q199 PolarHBondContact O-N 3.04Å; L196-Q199 PolarHBondContact O-N 2.94Å; Q199-F201 VanDerWaalsContact C-N 3.31Å; Q199-F201 PolarHBondContact O-N 2.66Å; Q199-D202 PolarHBondContact O-N 3.39Å; Q199-D203 WeakPolarHBondContact O-CB 3.02Å; Q199-D203 PolarHBondContact O-N 2.96Å
200	A	98.4	Very high	96.8	Very high	16 Å²	16	66.5 Å²	66.5	13%	0.132	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-37.9	179.2	0	0	0	0	0	112.7	A176 L196 K198 A204 L226	A176-A200 HydrophobicContact CB-CB 3.41Å; A176-A200 VanDerWaalsContact CB-CB 3.41Å; L196-A200 WeakPolarHBondContact O-CB 3.12Å; L196-A200 PolarHBondContact O-N 3.29Å; K198-A200 VanDerWaalsContact C-N 3.34Å; K198-A200 PolarHBondContact O-N 3.22Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.47Å; A200-A204 PolarHBondContact O-N 2.84Å; A200-A204 VanDerWaalsContact O-N 3.14Å; A200-L226 HydrophobicContact CB-CD1 4.27Å
201	F	98.2	Very high	96.5	Very high	39 Å²	39	66.6 Å²	66.6	17%	0.171	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-49	175.6	-175.4	-91	0	0	0	111.6	A197 K198 Q199 A204 I205 M223 R227	A197-F201 WeakPolarHBondContact O-CB 3.22Å; A197-F201 PolarHBondContact O-N 3.21Å; K198-F201 PolarHBondContact O-N 3.01Å; Q199-F201 VanDerWaalsContact C-N 3.31Å; Q199-F201 PolarHBondContact O-N 2.66Å; F201-A204 PolarHBondContact O-N 2.93Å; F201-I205 HydrophobicContact CD1-CG1 3.87Å; F201-I205 HydrophobicContact CE1-CD1 4.1Å; F201-I205 HydrophobicContact CE1-CG1 3.51Å; F201-I205 HydrophobicContact CE2-CD1 4.5Å; F201-I205 HydrophobicContact CE2-CG1 4.37Å; F201-I205 HydrophobicContact CG-CG1 4.45Å; F201-I205 HydrophobicContact CZ-CD1 3.9Å; F201-I205 HydrophobicContact CZ-CG1 3.78Å; F201-I205 WeakPolarHBondContact O-CB 3.4Å; F201-I205 VanDerWaalsContact O-CG1 3.27Å; F201-I205 WeakPolarHBondContact O-CG1 3.22Å; F201-I205 PolarHBondContact O-N 2.99Å; F201-M223 HydrophobicContact CD2-CB 4.12Å; F201-M223 WeakPolarHBondContact CD2-O 3.43Å; F201-M223 HydrophobicContact CE2-CB 4.08Å; F201-M223 WeakPolarHBondContact CE2-O 3.38Å; F201-R227 HydrophobicContact CD2-CB 4.25Å; F201-R227 HydrophobicContact CE2-CB 3.89Å; F201-R227 HydrophobicContact CE2-CG 4.44Å; F201-R227 HydrophobicContact CZ-CB 4.42Å; F201-R227 HydrophobicContact CZ-CG 4.5Å
202	D	98.1	Very high	96.2	Very high	79 Å²	79	63.7 Å²	63.7	42%	0.422	35%	0.35	S	S	.	.	H	α-helix	trans	-65	-43.6	-178	-69.4	-17.1	0	0	0	111.2	K198 Q199 A204 I205 A206	K198-D202 WeakPolarHBondContact CE-OD2 3.46Å; K198-D202 WeakPolarHBondContact CG-OD2 3.35Å; K198-D202 WeakPolarHBondContact O-CB 3.38Å; K198-D202 VanDerWaalsContact O-CG 3.31Å; K198-D202 PolarHBondContact O-N 3.2Å; Q199-D202 PolarHBondContact O-N 3.39Å; D202-A204 VanDerWaalsContact C-N 3.35Å; D202-A204 PolarHBondContact O-N 3.04Å; D202-I205 PolarHBondContact O-N 3.45Å; D202-A206 PolarHBondContact O-N 3.36Å
203	D	97.9	Very high	95.8	Very high	56 Å²	56	65.4 Å²	65.4	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-60.9	-43	175.9	-69.7	-11.4	0	0	0	111.2	P167 R172 Q199	P167-D203 HydrophobicContact CB-CB 3.96Å; P167-D203 HydrophobicContact CG-CB 4.46Å; R172-D203 IonicContact NH2-OD2 3.85Å; Q199-D203 WeakPolarHBondContact O-CB 3.02Å; Q199-D203 PolarHBondContact O-N 2.96Å
204	A	97.6	Very high	95.3	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-71.8	-37.4	179.2	0	0	0	0	0	112.6	T168 L173 A200 F201 D202 A206 E207 L208 M223	T168-A204 HydrophobicContact CG2-CB 4.44Å; T168-A204 WeakPolarHBondContact CG2-O 3.18Å; L173-A204 HydrophobicContact CD1-CB 4.46Å; L173-A204 HydrophobicContact CD2-CB 3.62Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.47Å; A200-A204 PolarHBondContact O-N 2.84Å; A200-A204 VanDerWaalsContact O-N 3.14Å; F201-A204 PolarHBondContact O-N 2.93Å; D202-A204 VanDerWaalsContact C-N 3.35Å; D202-A204 PolarHBondContact O-N 3.04Å; A204-A206 VanDerWaalsContact C-N 3.31Å; A204-A206 PolarHBondContact O-N 3.32Å; A204-E207 PolarHBondContact O-N 3.03Å; A204-L208 WeakPolarHBondContact O-CA 3.06Å; A204-L208 WeakPolarHBondContact O-CB 3.37Å; A204-L208 PolarHBondContact O-N 3.07Å; A204-M223 HydrophobicContact CB-CE 3.78Å; A204-M223 HydrophobicContact CB-CG 4.25Å; A204-M223 HydrophobicContact CB-SD 3.9Å
205	I	96.9	Very high	95	Very high	80 Å²	80	75.5 Å²	75.5	41%	0.41	41%	0.414	S	S	.	.	H	α-helix	trans	-61.4	-41.1	174.8	-76.6	-69.1	0	0	0	110.9	F201 D202 E207 L208 M223	F201-I205 HydrophobicContact CD1-CG1 3.87Å; F201-I205 HydrophobicContact CE1-CD1 4.1Å; F201-I205 HydrophobicContact CE1-CG1 3.51Å; F201-I205 HydrophobicContact CE2-CD1 4.5Å; F201-I205 HydrophobicContact CE2-CG1 4.37Å; F201-I205 HydrophobicContact CG-CG1 4.45Å; F201-I205 HydrophobicContact CZ-CD1 3.9Å; F201-I205 HydrophobicContact CZ-CG1 3.78Å; F201-I205 WeakPolarHBondContact O-CB 3.4Å; F201-I205 VanDerWaalsContact O-CG1 3.27Å; F201-I205 WeakPolarHBondContact O-CG1 3.22Å; F201-I205 PolarHBondContact O-N 2.99Å; D202-I205 PolarHBondContact O-N 3.45Å; I205-E207 PolarHBondContact O-N 3.32Å; I205-L208 HydrophobicContact CD1-CD2 4.31Å; I205-L208 PolarHBondContact O-N 2.87Å; I205-M223 HydrophobicContact CB-CE 4.37Å; I205-M223 HydrophobicContact CD1-CE 3.39Å; I205-M223 HydrophobicContact CG1-CE 3.53Å
206	A	96.9	Very high	94.8	Very high	86 Å²	86	77.4 Å²	77.4	71%	0.711	41%	0.411	S	S	*	.	H	α-helix	trans	-62	-26	-179.4	0	0	0	0	0	113.5	D202 A204	D202-A206 PolarHBondContact O-N 3.36Å; A204-A206 VanDerWaalsContact C-N 3.31Å; A204-A206 PolarHBondContact O-N 3.32Å
207	E	95.8	Very high	94.6	Very high	84 Å²	84	83.5 Å²	83.5	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-114	5.6	-178.4	-66.1	-171.8	-157.8	0	0	113.5	P167 T168 A204 I205 D209 T210	P167-E207 WeakPolarHBondContact CD-OE2 3.47Å; T168-E207 HydrophobicContact CG2-CB 3.98Å; A204-E207 PolarHBondContact O-N 3.03Å; I205-E207 PolarHBondContact O-N 3.32Å; E207-D209 PolarHBondContact O-N 2.99Å; E207-T210 WeakPolarHBondContact O-CB 3.28Å; E207-T210 PolarHBondContact O-N 3.41Å; E207-T210 PolarHBondContact O-OG1 3.16Å
208	L	93.5	Very high	94.4	Very high	30 Å²	30	87.8 Å²	87.8	16%	0.157	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-59.2	-35.1	-172.3	-172.7	62.3	0	0	0	113	A204 I205 T210 L211 Y216 T220 M223	A204-L208 WeakPolarHBondContact O-CA 3.06Å; A204-L208 WeakPolarHBondContact O-CB 3.37Å; A204-L208 PolarHBondContact O-N 3.07Å; I205-L208 HydrophobicContact CD1-CD2 4.31Å; I205-L208 PolarHBondContact O-N 2.87Å; L208-T210 PolarHBondContact O-N 3.43Å; L208-T210 VanDerWaalsContact O-N 3.13Å; L208-L211 HydrophobicContact CD1-CD2 3.9Å; L208-L211 WeakPolarHBondContact O-CB 3.34Å; L208-L211 PolarHBondContact O-N 3.44Å; L208-L211 VanDerWaalsContact O-N 3.08Å; L208-Y216 HydrophobicContact CD1-CE2 4.44Å; L208-T220 HydrophobicContact CD1-CG2 4.13Å; L208-M223 HydrophobicContact CD1-CE 4.38Å; L208-M223 HydrophobicContact CD1-SD 3.97Å; L208-M223 HydrophobicContact CD2-CE 4.35Å
209	D	92.4	Very high	94.4	Very high	170 Å²	170	82.1 Å²	82.1	91%	0.909	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-64.3	-16.2	178.9	-68.8	-21.4	0	0	0	113.3	E207	E207-D209 PolarHBondContact O-N 2.99Å
210	T	89.7	Confident	94.3	Very high	106 Å²	106	78.6 Å²	78.6	65%	0.65	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-90.4	-7.3	178.2	72	0	0	0	0	113.2	E207 L208 G212	E207-T210 WeakPolarHBondContact O-CB 3.28Å; E207-T210 PolarHBondContact O-N 3.41Å; E207-T210 PolarHBondContact O-OG1 3.16Å; L208-T210 PolarHBondContact O-N 3.43Å; L208-T210 VanDerWaalsContact O-N 3.13Å; T210-G212 PolarHBondContact O-N 3.15Å
211	L	90.4	Very high	94.3	Very high	29 Å²	29	82.6 Å²	82.6	15%	0.152	44%	0.439	C	S	.	.			trans	-75.6	125.8	-171.9	-172.3	59.2	0	0	0	111.6	L208 Y216	L208-L211 HydrophobicContact CD1-CD2 3.9Å; L208-L211 WeakPolarHBondContact O-CB 3.34Å; L208-L211 PolarHBondContact O-N 3.44Å; L208-L211 VanDerWaalsContact O-N 3.08Å; L211-Y216 HydrophobicContact CB-CD2 4.44Å; L211-Y216 HydrophobicContact CD2-CD2 4.14Å; L211-Y216 HydrophobicContact CG-CD2 4.42Å
212	G	89.1	Confident	94.3	Very high	46 Å²	46	82 Å²	82	47%	0.474	44%	0.437	S	S	.	.			trans	-69	156.4	175.8	0	0	0	0	0	113.2	T210 E214 S215 Y216	T210-G212 PolarHBondContact O-N 3.15Å; G212-E214 PolarHBondContact O-N 3.14Å; G212-E214 VanDerWaalsContact O-N 3.16Å; G212-S215 PolarHBondContact O-N 3.44Å; G212-Y216 PolarHBondContact O-N 2.94Å; G212-Y216 VanDerWaalsContact O-N 3.14Å
213	E	89	Confident	94.3	Very high	190 Å²	190	78.5 Å²	78.5	89%	0.888	42%	0.418	S	S	*	.	H	α-helix	trans	-56.2	-34.6	-176.5	-66.5	-175.6	173.2	0	0	113.6	S215 Y216	E213-S215 PolarHBondContact O-N 2.92Å; E213-Y216 PolarHBondContact O-N 3.21Å
214	E	88.8	Confident	94.3	Very high	190 Å²	190	79.5 Å²	79.5	89%	0.888	42%	0.422	S	S	*	.	H	α-helix	trans	-62.4	-40.3	-176.9	-173.6	175.8	-171.5	0	0	112.8	G212	G212-E214 PolarHBondContact O-N 3.14Å; G212-E214 VanDerWaalsContact O-N 3.16Å
215	S	91.2	Very high	94.3	Very high	40 Å²	40	83.1 Å²	83.1	28%	0.28	44%	0.44	S	S	.	.	H	α-helix	trans	-97	-12.5	-179.5	-67.2	0	0	0	0	113.5	G212 E213 K217 D218 S219	G212-S215 PolarHBondContact O-N 3.44Å; E213-S215 PolarHBondContact O-N 2.92Å; S215-K217 VanDerWaalsContact C-N 3.35Å; S215-K217 PolarHBondContact O-N 3.2Å; S215-D218 PolarHBondContact O-N 3.03Å; S215-S219 PolarHBondContact O-N 2.89Å; S215-S219 PolarHBondContact O-OG 3.46Å
216	Y	92.8	Very high	94.4	Very high	118 Å²	118	79.3 Å²	79.3	46%	0.463	42%	0.421	S	S	.	.	H	α-helix	trans	-54.5	-47.5	-171.6	-171.4	-90.6	0	0	0	113.1	L208 L211 G212 E213 T220	L208-Y216 HydrophobicContact CD1-CE2 4.44Å; L211-Y216 HydrophobicContact CB-CD2 4.44Å; L211-Y216 HydrophobicContact CD2-CD2 4.14Å; L211-Y216 HydrophobicContact CG-CD2 4.42Å; G212-Y216 PolarHBondContact O-N 2.94Å; G212-Y216 VanDerWaalsContact O-N 3.14Å; E213-Y216 PolarHBondContact O-N 3.21Å; Y216-T220 HydrophobicContact CD1-CG2 4.18Å; Y216-T220 HydrophobicContact CE1-CG2 3.87Å; Y216-T220 HydrophobicContact CE2-CG2 4.22Å; Y216-T220 HydrophobicContact CG-CG2 4.49Å; Y216-T220 WeakPolarHBondContact O-CB 3.39Å; Y216-T220 VanDerWaalsContact O-CG2 3.26Å; Y216-T220 WeakPolarHBondContact O-CG2 3.13Å; Y216-T220 PolarHBondContact O-N 3.14Å; Y216-T220 PolarHBondContact O-OG1 2.84Å
217	K	94.7	Very high	94.4	Very high	161 Å²	161	80.4 Å²	80.4	70%	0.7	41%	0.406	S	S	*	.	H	α-helix	trans	-63.8	-44.5	-178.4	-177.9	-178.9	171.9	-172.9	0	112.3	S215 T220 L221	S215-K217 VanDerWaalsContact C-N 3.35Å; S215-K217 PolarHBondContact O-N 3.2Å; K217-T220 PolarHBondContact O-OG1 2.7Å; K217-L221 WeakPolarHBondContact O-CB 3.26Å; K217-L221 PolarHBondContact O-N 2.9Å; K217-L221 VanDerWaalsContact O-N 3.14Å
218	D	95	Very high	94.5	Very high	89 Å²	89	79.6 Å²	79.6	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-72.2	-44.7	-176	-71.5	-13	0	0	0	111	P170 S215 L221 I222	P170-D218 HydrophobicContact CB-CB 4.22Å; P170-D218 HydrophobicContact CG-CB 4.15Å; S215-D218 PolarHBondContact O-N 3.03Å; D218-L221 PolarHBondContact O-N 3.34Å; D218-I222 VanDerWaalsContact O-CG1 3.27Å; D218-I222 WeakPolarHBondContact O-CG1 3.42Å; D218-I222 PolarHBondContact O-N 3.25Å; D218-I222 VanDerWaalsContact O-N 3.07Å
219	S	96.9	Very high	94.7	Very high	0 Å²	0	80 Å²	80	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-62.8	-46.2	177.8	-59.3	0	0	0	0	112.1	T168 P170 S215 L221 I222 M223	T168-S219 WeakPolarHBondContact O-CB 3.45Å; T168-S219 PolarHBondContact O-OG 3.4Å; P170-S219 WeakPolarHBondContact CD-OG 3.33Å; P170-S219 WeakPolarHBondContact CG-OG 3.26Å; S215-S219 PolarHBondContact O-N 2.89Å; S215-S219 PolarHBondContact O-OG 3.46Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.49Å; S219-I222 PolarHBondContact O-N 3.24Å; S219-I222 VanDerWaalsContact O-N 3.15Å; S219-M223 VanDerWaalsContact O-CG 3.24Å; S219-M223 WeakPolarHBondContact O-CG 3.32Å; S219-M223 PolarHBondContact O-N 2.91Å
220	T	97.1	Very high	94.9	Very high	41 Å²	41	73.1 Å²	73.1	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-35.7	-179.8	52.8	0	0	0	0	112.4	L208 Y216 K217 M223 Q224	L208-T220 HydrophobicContact CD1-CG2 4.13Å; Y216-T220 HydrophobicContact CD1-CG2 4.18Å; Y216-T220 HydrophobicContact CE1-CG2 3.87Å; Y216-T220 HydrophobicContact CE2-CG2 4.22Å; Y216-T220 HydrophobicContact CG-CG2 4.49Å; Y216-T220 WeakPolarHBondContact O-CB 3.39Å; Y216-T220 VanDerWaalsContact O-CG2 3.26Å; Y216-T220 WeakPolarHBondContact O-CG2 3.13Å; Y216-T220 PolarHBondContact O-N 3.14Å; Y216-T220 PolarHBondContact O-OG1 2.84Å; K217-T220 PolarHBondContact O-OG1 2.7Å; T220-M223 PolarHBondContact O-N 3.25Å; T220-Q224 WeakPolarHBondContact O-CB 3.24Å; T220-Q224 PolarHBondContact O-N 3.09Å
221	L	97.7	Very high	95.2	Very high	100 Å²	100	72.5 Å²	72.5	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-43.1	171.9	178.4	62.5	0	0	0	111.6	K217 D218 S219 Q224 L225	K217-L221 WeakPolarHBondContact O-CB 3.26Å; K217-L221 PolarHBondContact O-N 2.9Å; K217-L221 VanDerWaalsContact O-N 3.14Å; D218-L221 PolarHBondContact O-N 3.34Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.49Å; L221-Q224 WeakPolarHBondContact O-CB 3.38Å; L221-Q224 PolarHBondContact O-N 3.39Å; L221-L225 WeakPolarHBondContact O-CG 3.36Å; L221-L225 PolarHBondContact O-N 3.44Å; L221-L225 VanDerWaalsContact O-N 3.14Å
222	I	98.2	Very high	95.4	Very high	26 Å²	26	75.5 Å²	75.5	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-69.4	-40	178.7	-61.4	163.7	0	0	0	111.2	P170 L173 L177 D218 S219 Q224 L225 L226	P170-I222 HydrophobicContact CB-CD1 4.14Å; P170-I222 WeakPolarHBondContact O-CD1 3.38Å; L173-I222 HydrophobicContact CB-CB 4.16Å; L173-I222 HydrophobicContact CB-CD1 4.43Å; L173-I222 HydrophobicContact CB-CG2 3.62Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; D218-I222 VanDerWaalsContact O-CG1 3.27Å; D218-I222 WeakPolarHBondContact O-CG1 3.42Å; D218-I222 PolarHBondContact O-N 3.25Å; D218-I222 VanDerWaalsContact O-N 3.07Å; S219-I222 PolarHBondContact O-N 3.24Å; S219-I222 VanDerWaalsContact O-N 3.15Å; I222-Q224 VanDerWaalsContact C-N 3.31Å; I222-Q224 PolarHBondContact O-N 2.72Å; I222-L225 WeakPolarHBondContact O-CB 3.26Å; I222-L225 PolarHBondContact O-N 3.47Å; I222-L225 VanDerWaalsContact O-N 3.16Å; I222-L226 HydrophobicContact CG2-CD1 4.5Å; I222-L226 PolarHBondContact O-N 3.48Å
223	M	98.2	Very high	95.7	Very high	6 Å²	6	73.6 Å²	73.6	3%	0.03	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-39.6	175.3	-69.6	169.1	72.9	0	0	111.9	L173 F201 A204 I205 L208 S219 T220 L226 R227	L173-M223 HydrophobicContact CD1-CG 3.9Å; L173-M223 HydrophobicContact CD1-SD 4.32Å; L173-M223 HydrophobicContact CD2-CG 4.12Å; F201-M223 HydrophobicContact CD2-CB 4.12Å; F201-M223 WeakPolarHBondContact CD2-O 3.43Å; F201-M223 HydrophobicContact CE2-CB 4.08Å; F201-M223 WeakPolarHBondContact CE2-O 3.38Å; A204-M223 HydrophobicContact CB-CE 3.78Å; A204-M223 HydrophobicContact CB-CG 4.25Å; A204-M223 HydrophobicContact CB-SD 3.9Å; I205-M223 HydrophobicContact CB-CE 4.37Å; I205-M223 HydrophobicContact CD1-CE 3.39Å; I205-M223 HydrophobicContact CG1-CE 3.53Å; L208-M223 HydrophobicContact CD1-CE 4.38Å; L208-M223 HydrophobicContact CD1-SD 3.97Å; L208-M223 HydrophobicContact CD2-CE 4.35Å; S219-M223 VanDerWaalsContact O-CG 3.24Å; S219-M223 WeakPolarHBondContact O-CG 3.32Å; S219-M223 PolarHBondContact O-N 2.91Å; T220-M223 PolarHBondContact O-N 3.25Å; M223-L226 WeakPolarHBondContact O-CB 3.41Å; M223-L226 PolarHBondContact O-N 3.04Å; M223-R227 PolarHBondContact O-N 3Å
224	Q	98.1	Very high	95.8	Very high	78 Å²	78	68.1 Å²	68.1	36%	0.364	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-47.7	172.3	171.8	76.1	30.7	0	0	110.9	T220 L221 I222 L226 R227 D228	T220-Q224 WeakPolarHBondContact O-CB 3.24Å; T220-Q224 PolarHBondContact O-N 3.09Å; L221-Q224 WeakPolarHBondContact O-CB 3.38Å; L221-Q224 PolarHBondContact O-N 3.39Å; I222-Q224 VanDerWaalsContact C-N 3.31Å; I222-Q224 PolarHBondContact O-N 2.72Å; Q224-L226 PolarHBondContact O-N 3.42Å; Q224-R227 PolarHBondContact O-N 3.49Å; Q224-D228 PolarHBondContact NE2-OD1 3.2Å; Q224-D228 VanDerWaalsContact NE2-OD1 3.12Å; Q224-D228 PolarHBondContact NE2-OD2 3.16Å; Q224-D228 WeakPolarHBondContact O-CB 3.47Å; Q224-D228 PolarHBondContact O-N 3.43Å
225	L	98.4	Very high	95.9	Very high	75 Å²	75	61.3 Å²	61.3	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-40.2	177.3	-66.8	171.7	0	0	0	112.7	L177 L221 I222 R227 D228 N229	L177-L225 HydrophobicContact CD1-CB 4.11Å; L177-L225 HydrophobicContact CD2-CB 3.93Å; L177-L225 HydrophobicContact CD2-CD1 3.9Å; L221-L225 WeakPolarHBondContact O-CG 3.36Å; L221-L225 PolarHBondContact O-N 3.44Å; L221-L225 VanDerWaalsContact O-N 3.14Å; I222-L225 WeakPolarHBondContact O-CB 3.26Å; I222-L225 PolarHBondContact O-N 3.47Å; I222-L225 VanDerWaalsContact O-N 3.16Å; L225-R227 VanDerWaalsContact C-N 3.35Å; L225-D228 PolarHBondContact O-N 3.18Å; L225-N229 WeakPolarHBondContact O-CB 3.49Å; L225-N229 PolarHBondContact O-N 3.29Å
226	L	98.4	Very high	95.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-46.2	173.9	-78.9	167.8	0	0	0	111.5	L173 L177 A197 A200 I222 M223 Q224 N229 L230	L173-L226 HydrophobicContact CD2-CD1 4.09Å; L177-L226 HydrophobicContact CB-CD2 3.94Å; L177-L226 HydrophobicContact CB-CG 4.23Å; L177-L226 HydrophobicContact CD1-CD2 4Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; A197-L226 HydrophobicContact CB-CD2 3.85Å; A200-L226 HydrophobicContact CB-CD1 4.27Å; I222-L226 HydrophobicContact CG2-CD1 4.5Å; I222-L226 PolarHBondContact O-N 3.48Å; M223-L226 WeakPolarHBondContact O-CB 3.41Å; M223-L226 PolarHBondContact O-N 3.04Å; Q224-L226 PolarHBondContact O-N 3.42Å; L226-N229 PolarHBondContact O-N 3.46Å; L226-L230 WeakPolarHBondContact O-CG 3.27Å; L226-L230 PolarHBondContact O-N 3.46Å
227	R	97.7	Very high	95.1	Very high	109 Å²	109	58.8 Å²	58.8	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-41.2	178.5	-170	-167.6	68.7	-159	-3.7	112.4	F201 M223 Q224 L225 N229 L230 T231	F201-R227 HydrophobicContact CD2-CB 4.25Å; F201-R227 HydrophobicContact CE2-CB 3.89Å; F201-R227 HydrophobicContact CE2-CG 4.44Å; F201-R227 HydrophobicContact CZ-CB 4.42Å; F201-R227 HydrophobicContact CZ-CG 4.5Å; M223-R227 PolarHBondContact O-N 3Å; Q224-R227 PolarHBondContact O-N 3.49Å; L225-R227 VanDerWaalsContact C-N 3.35Å; R227-N229 VanDerWaalsContact C-N 3.35Å; R227-L230 PolarHBondContact O-N 2.99Å; R227-T231 PolarHBondContact O-N 3.14Å; R227-T231 PolarHBondContact O-OG1 2.88Å
228	D	98	Very high	94.4	Very high	68 Å²	68	55.3 Å²	55.3	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-41	-179.8	-64.3	-12.9	0	0	0	110.1	Q224 L225 T231 L232	Q224-D228 PolarHBondContact NE2-OD1 3.2Å; Q224-D228 VanDerWaalsContact NE2-OD1 3.12Å; Q224-D228 PolarHBondContact NE2-OD2 3.16Å; Q224-D228 WeakPolarHBondContact O-CB 3.47Å; Q224-D228 PolarHBondContact O-N 3.43Å; L225-D228 PolarHBondContact O-N 3.18Å; D228-T231 PolarHBondContact O-N 3.46Å; D228-L232 PolarHBondContact O-N 3.21Å; D228-L232 VanDerWaalsContact O-N 3.1Å
229	N	97	Very high	93.6	Very high	37 Å²	37	56.1 Å²	56.1	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-45.6	171.5	-78.7	-0.3	0	0	0	112.8	L177 L225 L226 R227 T231 L232 W233	L177-N229 VanDerWaalsContact CD1-ND2 3.33Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.08Å; L225-N229 WeakPolarHBondContact O-CB 3.49Å; L225-N229 PolarHBondContact O-N 3.29Å; L226-N229 PolarHBondContact O-N 3.46Å; R227-N229 VanDerWaalsContact C-N 3.35Å; N229-T231 PolarHBondContact O-N 3.03Å; N229-L232 PolarHBondContact O-N 3Å; N229-W233 HydrophobicContact CB-CD2 4.22Å; N229-W233 HydrophobicContact CB-CE3 4.11Å; N229-W233 HydrophobicContact CB-CH2 3.69Å; N229-W233 HydrophobicContact CB-CZ2 3.79Å; N229-W233 HydrophobicContact CB-CZ3 3.84Å; N229-W233 VanDerWaalsContact O-CD2 3.31Å; N229-W233 VanDerWaalsContact O-CG 3.23Å; N229-W233 PolarHBondContact O-N 2.6Å
230	L	96.6	Very high	92.5	Very high	26 Å²	26	62.2 Å²	62.2	14%	0.136	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-39.9	177.2	-78.6	167.5	0	0	0	112.1	C194 A197 K198 L226 R227 T234	C194-L230 HydrophobicContact CB-CD2 4.08Å; C194-L230 WeakPolarHBondContact O-CD2 3.43Å; A197-L230 HydrophobicContact CB-CD1 4.28Å; A197-L230 HydrophobicContact CB-CD2 3.82Å; A197-L230 HydrophobicContact CB-CG 3.87Å; K198-L230 HydrophobicContact CB-CD1 4.16Å; K198-L230 HydrophobicContact CB-CD2 4.08Å; L226-L230 WeakPolarHBondContact O-CG 3.27Å; L226-L230 PolarHBondContact O-N 3.46Å; R227-L230 PolarHBondContact O-N 2.99Å; L230-T234 VanDerWaalsContact O-CB 3.23Å; L230-T234 WeakPolarHBondContact O-CB 3.36Å; L230-T234 PolarHBondContact O-N 3.19Å; L230-T234 PolarHBondContact O-OG1 3.43Å
231	T	95.8	Very high	91.3	Very high	93 Å²	93	62.4 Å²	62.4	57%	0.571	34%	0.335	S	S	*	.	H	α-helix	trans	-65.4	-48.2	178.9	-60.5	0	0	0	0	110.5	R227 D228 N229 S235	R227-T231 PolarHBondContact O-N 3.14Å; R227-T231 PolarHBondContact O-OG1 2.88Å; D228-T231 PolarHBondContact O-N 3.46Å; N229-T231 PolarHBondContact O-N 3.03Å; T231-S235 PolarHBondContact O-N 3.27Å; T231-S235 VanDerWaalsContact O-N 3.13Å; T231-S235 PolarHBondContact O-OG 3.04Å
232	L	94.8	Very high	89.5	Confident	93 Å²	93	58.9 Å²	58.9	49%	0.487	32%	0.323	S	S	.	.	H	α-helix	trans	-59.2	-52.6	178.2	180	65.9	0	0	0	112	D228 N229 T234 S235 D236	D228-L232 PolarHBondContact O-N 3.21Å; D228-L232 VanDerWaalsContact O-N 3.1Å; N229-L232 PolarHBondContact O-N 3Å; L232-T234 VanDerWaalsContact C-N 3.33Å; L232-T234 PolarHBondContact O-N 3.43Å; L232-S235 PolarHBondContact O-N 3.27Å; L232-S235 PolarHBondContact O-OG 2.85Å; L232-D236 VanDerWaalsContact O-CG 3.23Å; L232-D236 PolarHBondContact O-N 3.14Å; L232-D236 VanDerWaalsContact O-N 3.09Å
233	W	95.8	Very high	87.8	Confident	6 Å²	6	61.9 Å²	61.9	2%	0.023	34%	0.339	C	S	.	.	H	α-helix	trans	-70.4	-31.8	-174.5	-57.4	-26.9	0	0	0	112.8	V181 Y184 A193 A197 N229 D236 M237	V181-W233 HydrophobicContact CG2-CH2 4.04Å; V181-W233 HydrophobicContact CG2-CZ2 4Å; Y184-W233 AromaticContact CD1-CD1 3.98Å; Y184-W233 AromaticContact CD1-NE1 3.53Å; Y184-W233 HydrophobicContact CD2-CB 3.97Å; Y184-W233 AromaticContact CD2-CD1 3.4Å; Y184-W233 VanDerWaalsContact CD2-CD1 3.4Å; Y184-W233 AromaticContact CD2-CD2 3.73Å; Y184-W233 HydrophobicContact CD2-CD2 3.73Å; Y184-W233 AromaticContact CD2-CE2 3.86Å; Y184-W233 AromaticContact CD2-CG 3.43Å; Y184-W233 HydrophobicContact CD2-CG 3.43Å; Y184-W233 VanDerWaalsContact CD2-CG 3.43Å; Y184-W233 AromaticContact CD2-NE1 3.64Å; Y184-W233 AromaticContact CE1-CD1 3.75Å; Y184-W233 AromaticContact CE1-NE1 3.63Å; Y184-W233 HydrophobicContact CE2-CB 3.73Å; Y184-W233 AromaticContact CE2-CD1 3.11Å; Y184-W233 HydrophobicContact CE2-CD2 4.2Å; Y184-W233 AromaticContact CE2-CG 3.41Å; Y184-W233 HydrophobicContact CE2-CG 3.41Å; Y184-W233 VanDerWaalsContact CE2-CG 3.41Å; Y184-W233 AromaticContact CE2-NE1 3.72Å; Y184-W233 AromaticContact CG-CD1 3.82Å; Y184-W233 HydrophobicContact CG-CD2 4.04Å; Y184-W233 AromaticContact CG-CE2 3.69Å; Y184-W233 HydrophobicContact CG-CG 4.11Å; Y184-W233 HydrophobicContact CG-CZ2 4.2Å; Y184-W233 AromaticContact CG-NE1 3.54Å; Y184-W233 AromaticContact CZ-CD1 3.31Å; Y184-W233 AromaticContact CZ-NE1 3.72Å; A193-W233 HydrophobicContact CB-CE3 4.01Å; A193-W233 HydrophobicContact CB-CH2 4.49Å; A193-W233 HydrophobicContact CB-CZ3 3.9Å; A197-W233 HydrophobicContact CB-CZ3 4.27Å; N229-W233 HydrophobicContact CB-CD2 4.22Å; N229-W233 HydrophobicContact CB-CE3 4.11Å; N229-W233 HydrophobicContact CB-CH2 3.69Å; N229-W233 HydrophobicContact CB-CZ2 3.79Å; N229-W233 HydrophobicContact CB-CZ3 3.84Å; N229-W233 VanDerWaalsContact O-CD2 3.31Å; N229-W233 VanDerWaalsContact O-CG 3.23Å; N229-W233 PolarHBondContact O-N 2.6Å; W233-D236 PolarHBondContact O-N 3.43Å; W233-M237 VanDerWaalsContact O-CG 3.28Å; W233-M237 WeakPolarHBondContact O-CG 3.32Å; W233-M237 PolarHBondContact O-N 3.21Å
234	T	91.6	Very high	86	Confident	74 Å²	74	68.6 Å²	68.6	45%	0.454	37%	0.37	S	S	.	.	H	α-helix	trans	-69.9	-35.5	175.1	-53.5	0	0	0	0	111.2	L230 L232 T238	L230-T234 VanDerWaalsContact O-CB 3.23Å; L230-T234 WeakPolarHBondContact O-CB 3.36Å; L230-T234 PolarHBondContact O-N 3.19Å; L230-T234 PolarHBondContact O-OG1 3.43Å; L232-T234 VanDerWaalsContact C-N 3.33Å; L232-T234 PolarHBondContact O-N 3.43Å; T234-T238 PolarHBondContact O-N 2.72Å; T234-T238 PolarHBondContact O-OG1 3.01Å
235	S	89.4	Confident	84.1	Confident	47 Å²	47	70.5 Å²	70.5	33%	0.329	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-42.4	173.4	47.6	0	0	0	0	112.2	T231 L232 M237 T238 D239	T231-S235 PolarHBondContact O-N 3.27Å; T231-S235 VanDerWaalsContact O-N 3.13Å; T231-S235 PolarHBondContact O-OG 3.04Å; L232-S235 PolarHBondContact O-N 3.27Å; L232-S235 PolarHBondContact O-OG 2.85Å; S235-M237 VanDerWaalsContact C-N 3.32Å; S235-M237 PolarHBondContact O-N 3.22Å; S235-T238 WeakPolarHBondContact CA-OG1 3.11Å; S235-T238 PolarHBondContact O-N 2.9Å; S235-T238 VanDerWaalsContact O-N 3.11Å; S235-T238 PolarHBondContact O-OG1 2.9Å; S235-D239 PolarHBondContact O-N 3.35Å
236	D	84.3	Confident	82	Confident	46 Å²	46	73.2 Å²	73.2	25%	0.246	39%	0.39	C	S	.	.	H	α-helix	trans	-60.1	-43.7	179.1	-59.4	-24.8	0	0	0	111.2	Y184 L232 W233 T238 D239 E240	Y184-D236 PolarHBondContact OH-OD2 3.45Å; L232-D236 VanDerWaalsContact O-CG 3.23Å; L232-D236 PolarHBondContact O-N 3.14Å; L232-D236 VanDerWaalsContact O-N 3.09Å; W233-D236 PolarHBondContact O-N 3.43Å; D236-T238 VanDerWaalsContact C-N 3.31Å; D236-T238 PolarHBondContact O-N 2.93Å; D236-D239 PolarHBondContact O-N 3.44Å; D236-E240 WeakPolarHBondContact O-CG 3.27Å; D236-E240 PolarHBondContact O-N 3.34Å
237	M	82.8	Confident	79.9	Confident	59 Å²	59	80 Å²	80	29%	0.291	42%	0.422	S	S	.	.	H	α-helix	trans	-63	-35.1	176.8	-68.8	171.7	70.9	0	0	112.9	P190 D191 W233 S235 A241	P190-M237 HydrophobicContact CB-CG 4.09Å; P190-M237 HydrophobicContact CB-SD 3.94Å; P190-M237 HydrophobicContact CG-CG 4.4Å; D191-M237 WeakPolarHBondContact OD1-CE 3.45Å; W233-M237 VanDerWaalsContact O-CG 3.28Å; W233-M237 WeakPolarHBondContact O-CG 3.32Å; W233-M237 PolarHBondContact O-N 3.21Å; S235-M237 VanDerWaalsContact C-N 3.32Å; S235-M237 PolarHBondContact O-N 3.22Å; M237-A241 WeakPolarHBondContact O-CB 3.46Å; M237-A241 PolarHBondContact O-N 2.9Å
238	T	81.3	Confident	78	Confident	88 Å²	88	79 Å²	79	54%	0.54	44%	0.438	S	S	.	.	H	α-helix	trans	-73.6	-33.9	176.5	50.4	0	0	0	0	112.8	T234 S235 D236 G242	T234-T238 PolarHBondContact O-N 2.72Å; T234-T238 PolarHBondContact O-OG1 3.01Å; S235-T238 WeakPolarHBondContact CA-OG1 3.11Å; S235-T238 PolarHBondContact O-N 2.9Å; S235-T238 VanDerWaalsContact O-N 3.11Å; S235-T238 PolarHBondContact O-OG1 2.9Å; D236-T238 VanDerWaalsContact C-N 3.31Å; D236-T238 PolarHBondContact O-N 2.93Å; T238-G242 PolarHBondContact O-N 3.49Å; T238-G242 VanDerWaalsContact O-N 3.09Å
239	D	78.6	Confident	75.8	Confident	106 Å²	106	79.6 Å²	79.6	57%	0.567	45%	0.447	S	S	*	.	H	α-helix	trans	-71.4	-43.7	177.7	-74	-18.6	0	0	0	111	S235 D236 A241 G242 D243	S235-D239 PolarHBondContact O-N 3.35Å; D236-D239 PolarHBondContact O-N 3.44Å; D239-A241 PolarHBondContact O-N 2.81Å; D239-G242 PolarHBondContact O-N 2.89Å; D239-G242 VanDerWaalsContact O-N 3.16Å; D239-D243 PolarHBondContact O-N 3.12Å
240	E	73.4	Confident	73.5	Confident	128 Å²	128	85 Å²	85	60%	0.598	47%	0.468	S	S	*	.	H	α-helix	trans	-59.2	-46.2	174.6	-73.9	-179	172.9	0	0	112	D236 G242 D243 E244	D236-E240 WeakPolarHBondContact O-CG 3.27Å; D236-E240 PolarHBondContact O-N 3.34Å; E240-G242 VanDerWaalsContact C-N 3.29Å; E240-G242 PolarHBondContact O-N 3.39Å; E240-D243 PolarHBondContact O-N 3.46Å; E240-E244 PolarHBondContact O-N 2.98Å
241	A	70.9	Confident	71.2	Confident	46 Å²	46	89 Å²	89	38%	0.38	50%	0.496	S	S	.	.	H	α-helix	trans	-63.7	-34.3	176.4	0	0	0	0	0	112.5	M237 D239 I245	M237-A241 WeakPolarHBondContact O-CB 3.46Å; M237-A241 PolarHBondContact O-N 2.9Å; D239-A241 PolarHBondContact O-N 2.81Å; A241-I245 WeakPolarHBondContact O-CD1 3.36Å; A241-I245 VanDerWaalsContact O-CG1 3.25Å; A241-I245 WeakPolarHBondContact O-CG1 3.41Å; A241-I245 PolarHBondContact O-N 3.33Å
242	G	60.7	Low	69	Low	26 Å²	26	93.4 Å²	93.4	27%	0.268	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-35.3	175.8	0	0	0	0	0	113.1	T238 D239 E240 K246	T238-G242 PolarHBondContact O-N 3.49Å; T238-G242 VanDerWaalsContact O-N 3.09Å; D239-G242 PolarHBondContact O-N 2.89Å; D239-G242 VanDerWaalsContact O-N 3.16Å; E240-G242 VanDerWaalsContact C-N 3.29Å; E240-G242 PolarHBondContact O-N 3.39Å; G242-K246 WeakPolarHBondContact O-CG 3.5Å; G242-K246 PolarHBondContact O-N 3.22Å
243	D	62.4	Low	66.4	Low	88 Å²	88	91.7 Å²	91.7	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-77.7	-36.4	178.3	-76.5	-13.4	0	0	0	112.5	D239 E240 I245 K246 E247	D239-D243 PolarHBondContact O-N 3.12Å; E240-D243 PolarHBondContact O-N 3.46Å; D243-I245 VanDerWaalsContact C-N 3.31Å; D243-I245 PolarHBondContact O-N 3.33Å; D243-K246 PolarHBondContact O-N 3.04Å; D243-K246 IonicContact OD1-NZ 2.76Å; D243-K246 PolarHBondContact OD1-NZ 2.86Å; D243-E247 PolarHBondContact O-N 3.37Å
244	E	59.1	Low	63.7	Low	147 Å²	147	96.1 Å²	96.1	69%	0.687	56%	0.559	S	S	*	*	H	α-helix	trans	-59.7	-40.1	169.9	-72.8	-170.6	168.5	0	0	112.1	E240 E247 A248	E240-E244 PolarHBondContact O-N 2.98Å; E244-E247 PolarHBondContact O-N 3.49Å; E244-A248 VanDerWaalsContact O-CB 3.31Å; E244-A248 WeakPolarHBondContact O-CB 3.21Å; E244-A248 PolarHBondContact O-N 2.66Å
245	I	58.3	Low	61.3	Low	118 Å²	118	105.7 Å²	105.7	61%	0.605	60%	0.598	S	S	*	*	H	α-helix	trans	-66.4	-37.2	176.4	-67.3	165.6	0	0	0	111.3	A241 D243 S249	A241-I245 WeakPolarHBondContact O-CD1 3.36Å; A241-I245 VanDerWaalsContact O-CG1 3.25Å; A241-I245 WeakPolarHBondContact O-CG1 3.41Å; A241-I245 PolarHBondContact O-N 3.33Å; D243-I245 VanDerWaalsContact C-N 3.31Å; D243-I245 PolarHBondContact O-N 3.33Å; I245-S249 VanDerWaalsContact O-CB 3.28Å; I245-S249 WeakPolarHBondContact O-CB 3.48Å; I245-S249 PolarHBondContact O-N 3.32Å; I245-S249 PolarHBondContact O-OG 3.48Å
246	K	54.8	Low	59.9	Low	132 Å²	132	108.6 Å²	108.6	57%	0.574	61%	0.612	S	S	*	*	H	α-helix	trans	-69	-36.2	175.6	-72.4	174.9	-155.5	147.6	0	112.2	G242 D243 S249	G242-K246 WeakPolarHBondContact O-CG 3.5Å; G242-K246 PolarHBondContact O-N 3.22Å; D243-K246 PolarHBondContact O-N 3.04Å; D243-K246 IonicContact OD1-NZ 2.76Å; D243-K246 PolarHBondContact OD1-NZ 2.86Å; K246-S249 WeakPolarHBondContact CA-OG 3.35Å; K246-S249 PolarHBondContact O-OG 3.16Å
247	E	55.4	Low	58.6	Low	143 Å²	143	111.9 Å²	111.9	67%	0.668	63%	0.631	S	S	*	*	H	α-helix	trans	-70.1	-42.8	174.4	-72.3	-160.5	152.3	0	0	111.8	D243 E244 S249 K250	D243-E247 PolarHBondContact O-N 3.37Å; E244-E247 PolarHBondContact O-N 3.49Å; E247-S249 VanDerWaalsContact C-N 3.26Å; E247-S249 PolarHBondContact O-N 3.08Å; E247-K250 PolarHBondContact O-N 3.13Å
248	A	56.3	Low	57.3	Low	89 Å²	89	114.8 Å²	114.8	74%	0.736	65%	0.65	S	S	*	*	H	α-helix	trans	-69.1	-21.2	177.1	0	0	0	0	0	113.9	E244	E244-A248 VanDerWaalsContact O-CB 3.31Å; E244-A248 WeakPolarHBondContact O-CB 3.21Å; E244-A248 PolarHBondContact O-N 2.66Å
249	S	52.2	Low	55.8	Low	79 Å²	79	116.4 Å²	116.4	55%	0.552	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	3.7	177.2	55.9	0	0	0	0	114.2	I245 K246 E247 P251	I245-S249 VanDerWaalsContact O-CB 3.28Å; I245-S249 WeakPolarHBondContact O-CB 3.48Å; I245-S249 PolarHBondContact O-N 3.32Å; I245-S249 PolarHBondContact O-OG 3.48Å; K246-S249 WeakPolarHBondContact CA-OG 3.35Å; K246-S249 PolarHBondContact O-OG 3.16Å; E247-S249 VanDerWaalsContact C-N 3.26Å; E247-S249 PolarHBondContact O-N 3.08Å; S249-P251 VanDerWaalsContact O-CD 3.24Å; S249-P251 WeakPolarHBondContact O-CD 3.44Å
250	K	48.3	Very low	54.4	Low	151 Å²	151	117.1 Å²	117.1	66%	0.657	66%	0.662	S	S	*	*	S	Bend	trans	-67.7	115.1	162	-75.7	-178.6	-178.3	167.7	0	107.7	E247 D252	E247-K250 PolarHBondContact O-N 3.13Å; K250-D252 PolarHBondContact O-N 2.98Å
251	P	48.4	Very low	53.2	Low	111 Å²	111	116.3 Å²	116.3	72%	0.721	67%	0.666	S	S	*	*			trans	-64.4	129	178.3	26.4	-31.3	0	0	0	108.8	S249 G253	S249-P251 VanDerWaalsContact O-CD 3.24Å; S249-P251 WeakPolarHBondContact O-CD 3.44Å; P251-G253 PolarHBondContact O-N 3.18Å
252	D	51	Low	51.9	Low	184 Å²	184	121.4 Å²	121.4	98%	0.984	69%	0.687	S	S	*	*			trans	-59	89.3	154.7	-82.8	-28.5	0	0	0	106.8	K250	K250-D252 PolarHBondContact O-N 2.98Å
253	G	38.6	Very low	51.2	Low	57 Å²	57	128.7 Å²	128.7	59%	0.588	72%	0.719	S	S	*	*			trans	-158.1	104.1	-165	0	0	0	0	0	112.6	P251	P251-G253 PolarHBondContact O-N 3.18Å
254	A	40.9	Very low	50.3	Low	100 Å²	100	132.1 Å²	132.1	83%	0.826	74%	0.74	S	S	*	*			trans	78.4	96.2	155.1	0	0	0	0	0	117.2
255	E	40	Very low	49.5	Very low	274 Å²	274	130.7 Å²	130.7	100%	1.28	75%	0.745	S	S	*	*				-160.6	0	83.6	-95.7	179.8	168.6	0	0	111.5

Retrieved 255 of 255 residues in 322.9 ms (Link to these results)

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