14333_ARATH Loading...

Isoform 2 of 14-3-3-like protein GF14 psi AlphaSync

Canonical isoform description: 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 P42644-2 (canonical: P42644), Species ARATH (Arabidopsis thaliana, Mouse-ear cress), Gene GRF3, Length 254 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	69.3	Low	93.7	Very high	147 Å²	147	70.5 Å²	70.5	72%	0.724	35%	0.353	S	S	*	.				0	127.7	0	-160.2	174.8	-76.1	0	0	106	E5 E6	M1-E5 WeakPolarHBondContact CA-OE2 3.1Å; M1-E5 HydrophobicContact CG-CB 3.41Å; M1-E5 VanDerWaalsContact CG-CB 3.41Å; M1-E5 HydrophobicContact CG-CG 4.49Å; M1-E5 WeakPolarHBondContact CG-OE2 3.19Å; M1-E5 HydrophobicContact SD-CB 4.38Å; M1-E6 HydrophobicContact CB-CG 3.89Å; M1-E6 HydrophobicContact CG-CG 3.64Å; M1-E6 HydrophobicContact SD-CB 4.2Å; M1-E6 HydrophobicContact SD-CG 3.51Å; M1-E6 VanDerWaalsContact SD-CG 3.51Å
2	S	89.3	Confident	94.1	Very high	58 Å²	58	69.3 Å²	69.3	41%	0.406	34%	0.343	S	S	.	.			trans	-69.8	159.7	172.7	74.9	0	0	0	0	109.8	R4 E5 E6	S2-R4 PolarHBondContact O-N 3.29Å; S2-R4 PolarHBondContact OG-N 2.82Å; S2-E5 PolarHBondContact N-OE2 3.45Å; S2-E5 PolarHBondContact O-N 2.98Å; S2-E5 VanDerWaalsContact O-N 3.15Å; S2-E5 WeakPolarHBondContact OG-CG 3.45Å; S2-E5 PolarHBondContact OG-N 3.15Å; S2-E5 VanDerWaalsContact OG-N 3.15Å; S2-E6 WeakPolarHBondContact O-CG 3.34Å; S2-E6 PolarHBondContact O-N 3.15Å
3	T	93	Very high	94.4	Very high	102 Å²	102	69.2 Å²	69.2	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-29.6	175.6	-54.8	0	0	0	0	112.3	N7	T3-N7 PolarHBondContact O-N 3.18Å; T3-N7 VanDerWaalsContact O-N 3.14Å; T3-N7 PolarHBondContact O-ND2 3.46Å
4	R	95.2	Very high	94.7	Very high	26 Å²	26	64.7 Å²	64.7	10%	0.098	32%	0.324	C	S	.	.	H	α-helix	trans	-67.6	-49.6	173.8	-177.5	171	176.9	161.1	-15.6	111.2	S2 E6 N7 V8 V30 E37 E38 E43	S2-R4 PolarHBondContact O-N 3.29Å; S2-R4 PolarHBondContact OG-N 2.82Å; R4-E6 VanDerWaalsContact C-N 3.3Å; R4-E6 PolarHBondContact O-N 3.32Å; R4-N7 PolarHBondContact O-N 3.28Å; R4-V8 WeakPolarHBondContact O-CG2 3.42Å; R4-V8 PolarHBondContact O-N 3.29Å; R4-V30 HydrophobicContact CG-CG1 4.08Å; R4-V30 HydrophobicContact CG-CG2 4.46Å; R4-E37 PolarHBondContact NH1-O 3.4Å; R4-E38 PolarHBondContact NH2-O 2.9Å; R4-E43 IonicContact CZ-OE1 3.34Å; R4-E43 IonicContact CZ-OE2 2.74Å; R4-E43 IonicContact NE-OE1 2.65Å; R4-E43 PolarHBondContact NE-OE1 3.25Å; R4-E43 IonicContact NE-OE2 3.25Å; R4-E43 VanDerWaalsContact NH2-CD 3.35Å; R4-E43 IonicContact NH2-OE1 2.83Å; R4-E43 PolarHBondContact NH2-OE1 3.11Å; R4-E43 IonicContact NH2-OE2 3.33Å; R4-E43 PolarHBondContact NH2-OE2 3.04Å
5	E	95.4	Very high	95	Very high	111 Å²	111	64.9 Å²	64.9	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-58.5	-40.4	176.4	-71.9	169.3	174.4	0	0	112.1	M1 S2 V8 Y9	M1-E5 WeakPolarHBondContact CA-OE2 3.1Å; M1-E5 HydrophobicContact CG-CB 3.41Å; M1-E5 VanDerWaalsContact CG-CB 3.41Å; M1-E5 HydrophobicContact CG-CG 4.49Å; M1-E5 WeakPolarHBondContact CG-OE2 3.19Å; M1-E5 HydrophobicContact SD-CB 4.38Å; S2-E5 PolarHBondContact N-OE2 3.45Å; S2-E5 PolarHBondContact O-N 2.98Å; S2-E5 VanDerWaalsContact O-N 3.15Å; S2-E5 WeakPolarHBondContact OG-CG 3.45Å; S2-E5 PolarHBondContact OG-N 3.15Å; S2-E5 VanDerWaalsContact OG-N 3.15Å; E5-V8 PolarHBondContact O-N 2.62Å; E5-Y9 WeakPolarHBondContact O-CB 3.42Å; E5-Y9 PolarHBondContact O-N 3.29Å
6	E	97.1	Very high	95.1	Very high	93 Å²	93	70.8 Å²	70.8	44%	0.435	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-47.1	175.7	-72.7	174	171.2	0	0	111.6	M1 S2 R4 Y9 M10	M1-E6 HydrophobicContact CB-CG 3.89Å; M1-E6 HydrophobicContact CG-CG 3.64Å; M1-E6 HydrophobicContact SD-CB 4.2Å; M1-E6 HydrophobicContact SD-CG 3.51Å; M1-E6 VanDerWaalsContact SD-CG 3.51Å; S2-E6 WeakPolarHBondContact O-CG 3.34Å; S2-E6 PolarHBondContact O-N 3.15Å; R4-E6 VanDerWaalsContact C-N 3.3Å; R4-E6 PolarHBondContact O-N 3.32Å; E6-Y9 PolarHBondContact O-N 2.76Å; E6-M10 WeakPolarHBondContact O-CB 3.37Å; E6-M10 VanDerWaalsContact O-CG 3.27Å; E6-M10 WeakPolarHBondContact O-CG 3.25Å; E6-M10 PolarHBondContact O-N 3.4Å
7	N	98	Very high	95.3	Very high	20 Å²	20	70.2 Å²	70.2	11%	0.107	36%	0.358	C	S	.	.	H	α-helix	trans	-66	-39.6	178.3	-74.9	-62.2	0	0	0	112.1	T3 R4 Y9 M10 A11 F26 K29 V30	T3-N7 PolarHBondContact O-N 3.18Å; T3-N7 VanDerWaalsContact O-N 3.14Å; T3-N7 PolarHBondContact O-ND2 3.46Å; R4-N7 PolarHBondContact O-N 3.28Å; N7-Y9 VanDerWaalsContact C-N 3.35Å; N7-M10 PolarHBondContact O-N 3.22Å; N7-A11 WeakPolarHBondContact O-CB 3.38Å; N7-A11 PolarHBondContact O-N 3.06Å; N7-F26 HydrophobicContact CB-CB 4.38Å; N7-K29 WeakPolarHBondContact OD1-CD 3.4Å; N7-V30 HydrophobicContact CB-CG2 3.54Å
8	V	98.1	Very high	95.5	Very high	13 Å²	13	74.3 Å²	74.3	8%	0.079	38%	0.376	C	S	.	.	H	α-helix	trans	-62.6	-43.4	175.2	172.1	0	0	0	0	110.8	R4 E5 A11 K12 V30 E43 L46	R4-V8 WeakPolarHBondContact O-CG2 3.42Å; R4-V8 PolarHBondContact O-N 3.29Å; E5-V8 PolarHBondContact O-N 2.62Å; V8-A11 PolarHBondContact O-N 2.83Å; V8-K12 WeakPolarHBondContact O-CG 3.46Å; V8-K12 PolarHBondContact O-N 3.22Å; V8-V30 HydrophobicContact CG2-CG1 4.18Å; V8-V30 HydrophobicContact CG2-CG2 3.79Å; V8-E43 HydrophobicContact CG2-CG 3.8Å; V8-L46 HydrophobicContact CG1-CD1 4.03Å
9	Y	98.3	Very high	95.6	Very high	129 Å²	129	77.5 Å²	77.5	51%	0.506	38%	0.383	S	S	.	.	H	α-helix	trans	-62.3	-44.9	175.9	-180	-109.7	0	0	0	111.9	E5 E6 N7 A11 K12 L13	E5-Y9 WeakPolarHBondContact O-CB 3.42Å; E5-Y9 PolarHBondContact O-N 3.29Å; E6-Y9 PolarHBondContact O-N 2.76Å; N7-Y9 VanDerWaalsContact C-N 3.35Å; Y9-A11 VanDerWaalsContact C-N 3.34Å; Y9-A11 PolarHBondContact O-N 3.22Å; Y9-K12 PolarHBondContact O-N 3.12Å; Y9-L13 HydrophobicContact CD1-CD1 4.06Å; Y9-L13 HydrophobicContact CE1-CD1 3.53Å; Y9-L13 HydrophobicContact CE1-CG 4.15Å; Y9-L13 PolarHBondContact O-N 2.88Å
10	M	98.5	Very high	95.7	Very high	77 Å²	77	76 Å²	76	38%	0.379	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-37.1	176.2	-70.8	-58.6	-61.9	0	0	112.6	E6 N7 L13 A14 F26	E6-M10 WeakPolarHBondContact O-CB 3.37Å; E6-M10 VanDerWaalsContact O-CG 3.27Å; E6-M10 WeakPolarHBondContact O-CG 3.25Å; E6-M10 PolarHBondContact O-N 3.4Å; N7-M10 PolarHBondContact O-N 3.22Å; M10-L13 PolarHBondContact O-N 3.3Å; M10-L13 HydrophobicContact SD-CD1 4.09Å; M10-A14 WeakPolarHBondContact O-CB 3.48Å; M10-A14 PolarHBondContact O-N 3.03Å; M10-F26 HydrophobicContact CB-CD1 3.75Å; M10-F26 HydrophobicContact CB-CD2 3.72Å; M10-F26 HydrophobicContact CB-CE1 3.71Å; M10-F26 HydrophobicContact CB-CE2 3.68Å; M10-F26 HydrophobicContact CB-CG 3.78Å; M10-F26 HydrophobicContact CB-CZ 3.69Å; M10-F26 HydrophobicContact CE-CE1 4.35Å; M10-F26 HydrophobicContact CE-CE2 4.12Å; M10-F26 HydrophobicContact CE-CZ 3.65Å; M10-F26 HydrophobicContact CG-CD1 4.48Å; M10-F26 HydrophobicContact CG-CE1 4.12Å; M10-F26 HydrophobicContact CG-CZ 4.22Å
11	A	98.6	Very high	95.8	Very high	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.6	-41.3	173.7	0	0	0	0	0	111.9	N7 V8 Y9 A14 E15 M23 F26 M27	N7-A11 WeakPolarHBondContact O-CB 3.38Å; N7-A11 PolarHBondContact O-N 3.06Å; V8-A11 PolarHBondContact O-N 2.83Å; Y9-A11 VanDerWaalsContact C-N 3.34Å; Y9-A11 PolarHBondContact O-N 3.22Å; A11-A14 PolarHBondContact O-N 3.32Å; A11-E15 WeakPolarHBondContact O-CB 3.38Å; A11-E15 PolarHBondContact O-N 3.45Å; A11-M23 HydrophobicContact CB-CG 4.06Å; A11-F26 HydrophobicContact CB-CB 4.07Å; 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	56 Å²	56	72.1 Å²	72.1	24%	0.243	35%	0.352	C	S	.	.	H	α-helix	trans	-65.5	-36.1	175.1	-68	178.3	-172	-172.5	0	112.6	V8 Y9 Q16 E42 L46	V8-K12 WeakPolarHBondContact O-CG 3.46Å; V8-K12 PolarHBondContact O-N 3.22Å; Y9-K12 PolarHBondContact O-N 3.12Å; K12-Q16 WeakPolarHBondContact O-CG 3.27Å; K12-Q16 PolarHBondContact O-N 2.91Å; K12-Q16 PolarHBondContact O-NE2 2.93Å; K12-E42 WeakPolarHBondContact CE-OE1 3.4Å; K12-E42 IonicContact NZ-OE1 3.58Å; K12-E42 PolarHBondContact NZ-OE1 2.7Å; K12-E42 IonicContact NZ-OE2 2.62Å; K12-E42 PolarHBondContact NZ-OE2 3.15Å; K12-L46 HydrophobicContact CG-CD1 4.05Å; K12-L46 HydrophobicContact CG-CD2 4.18Å
13	L	98.6	Very high	97.6	Very high	67 Å²	67	69.3 Å²	69.3	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-67.8	-42.1	173	-68.5	-179.4	0	0	0	111.5	Y9 M10 Q16 A17	Y9-L13 HydrophobicContact CD1-CD1 4.06Å; Y9-L13 HydrophobicContact CE1-CD1 3.53Å; Y9-L13 HydrophobicContact CE1-CG 4.15Å; Y9-L13 PolarHBondContact O-N 2.88Å; M10-L13 PolarHBondContact O-N 3.3Å; M10-L13 HydrophobicContact SD-CD1 4.09Å; L13-Q16 PolarHBondContact O-N 3.35Å; L13-A17 WeakPolarHBondContact O-CB 3.45Å; L13-A17 PolarHBondContact O-N 3.44Å; L13-A17 VanDerWaalsContact O-N 3.12Å
14	A	98.5	Very high	97.9	Very high	7 Å²	7	65.3 Å²	65.3	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-40.4	177.1	0	0	0	0	0	111.8	M10 A11 A17 E18 R19 E22 M23 F26	M10-A14 WeakPolarHBondContact O-CB 3.48Å; M10-A14 PolarHBondContact O-N 3.03Å; A11-A14 PolarHBondContact O-N 3.32Å; A14-A17 CarbonylContact O-C 3.45Å; A14-A17 PolarHBondContact O-N 2.94Å; A14-E18 PolarHBondContact O-N 3.2Å; A14-R19 HydrophobicContact CB-CB 4.43Å; A14-R19 PolarHBondContact O-N 3.37Å; A14-E22 HydrophobicContact CB-CB 4.34Å; A14-M23 HydrophobicContact CB-CB 4Å; A14-F26 HydrophobicContact CB-CD2 4.45Å; A14-F26 HydrophobicContact CB-CE2 4.45Å
15	E	98.2	Very high	98	Very high	67 Å²	67	69.4 Å²	69.4	31%	0.313	33%	0.328	S	S	.	.	H	α-helix	trans	-58.4	-49.4	173.9	-176.6	-179.6	-160	0	0	111.9	A11 A17 E18 M23 L46	A11-E15 WeakPolarHBondContact O-CB 3.38Å; A11-E15 PolarHBondContact O-N 3.45Å; E15-A17 PolarHBondContact O-N 2.85Å; E15-E18 PolarHBondContact O-N 3.34Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.92Å; E15-M23 HydrophobicContact CG-CE 4.22Å; E15-M23 HydrophobicContact CG-SD 4.38Å; E15-L46 WeakPolarHBondContact OE2-CD2 3.46Å
16	Q	97.9	Very high	98.2	Very high	159 Å²	159	65.4 Å²	65.4	74%	0.743	31%	0.309	S	S	*	.	H	α-helix	trans	-63.5	-25.8	178.2	-74.1	174.5	63.2	0	0	113.3	K12 L13	K12-Q16 WeakPolarHBondContact O-CG 3.27Å; K12-Q16 PolarHBondContact O-N 2.91Å; K12-Q16 PolarHBondContact O-NE2 2.93Å; L13-Q16 PolarHBondContact O-N 3.35Å
17	A	98	Very high	98.2	Very high	61 Å²	61	61 Å²	61	50%	0.504	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	4.6	176.2	0	0	0	0	0	113.2	L13 A14 E15 R19	L13-A17 WeakPolarHBondContact O-CB 3.45Å; L13-A17 PolarHBondContact O-N 3.44Å; L13-A17 VanDerWaalsContact O-N 3.12Å; A14-A17 CarbonylContact O-C 3.45Å; A14-A17 PolarHBondContact O-N 2.94Å; E15-A17 PolarHBondContact O-N 2.85Å; A17-R19 HydrophobicContact CB-CG 3.98Å; A17-R19 WeakPolarHBondContact O-CG 3.23Å; A17-R19 PolarHBondContact O-N 2.94Å; A17-R19 VanDerWaalsContact O-N 3.15Å
18	E	97.8	Very high	98.2	Very high	145 Å²	145	62 Å²	62	68%	0.678	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	27.7	-175.2	-56.4	-175.1	159.9	0	0	113.9	A14 E15 Y20	A14-E18 PolarHBondContact O-N 3.2Å; E15-E18 PolarHBondContact O-N 3.34Å; E18-Y20 HydrophobicContact CB-CE2 3.97Å; E18-Y20 HydrophobicContact CG-CE2 4.48Å; E18-Y20 WeakPolarHBondContact O-CD2 3.47Å; E18-Y20 PolarHBondContact O-N 3.14Å
19	R	98.4	Very high	98.2	Very high	134 Å²	134	66.1 Å²	66.1	51%	0.506	31%	0.31	S	S	.	.			trans	-93.1	65.8	178.2	-58.5	-172.3	80.1	-156.4	-3.9	110.3	A14 A17 E21 E22 M23	A14-R19 HydrophobicContact CB-CB 4.43Å; A14-R19 PolarHBondContact O-N 3.37Å; A17-R19 HydrophobicContact CB-CG 3.98Å; A17-R19 WeakPolarHBondContact O-CG 3.23Å; A17-R19 PolarHBondContact O-N 2.94Å; A17-R19 VanDerWaalsContact O-N 3.15Å; R19-E21 VanDerWaalsContact C-N 3.3Å; R19-E21 PolarHBondContact O-N 3.15Å; R19-E22 HydrophobicContact CB-CB 4.49Å; R19-E22 IonicContact CZ-OE1 2.73Å; R19-E22 IonicContact CZ-OE2 3.44Å; R19-E22 IonicContact NE-OE1 3.12Å; R19-E22 PolarHBondContact NE-OE1 3.21Å; R19-E22 IonicContact NE-OE2 2.75Å; R19-E22 IonicContact NH1-OE1 3.45Å; R19-E22 PolarHBondContact NH1-OE1 3.2Å; R19-E22 IonicContact NH1-OE2 3.32Å; R19-E22 PolarHBondContact NH1-OE2 3Å; R19-E22 VanDerWaalsContact NH2-CD 3.28Å; R19-E22 IonicContact NH2-OE1 3.74Å; R19-E22 PolarHBondContact NH2-OE1 2.67Å; R19-E22 IonicContact NH2-OE2 3.64Å; R19-E22 PolarHBondContact NH2-OE2 3.2Å; R19-E22 PolarHBondContact O-N 3.15Å; R19-M23 PolarHBondContact O-N 3.5Å; R19-M23 VanDerWaalsContact O-N 3.08Å
20	Y	98.4	Very high	98.1	Very high	47 Å²	47	60 Å²	60	18%	0.184	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-27.2	-170.7	-58.5	-67.9	0	0	0	114.2	E18 M23 V24 V49 N53	E18-Y20 HydrophobicContact CB-CE2 3.97Å; E18-Y20 HydrophobicContact CG-CE2 4.48Å; E18-Y20 WeakPolarHBondContact O-CD2 3.47Å; E18-Y20 PolarHBondContact O-N 3.14Å; Y20-M23 HydrophobicContact CD1-SD 3.97Å; Y20-M23 WeakPolarHBondContact O-CB 3.25Å; Y20-M23 PolarHBondContact O-N 3.03Å; Y20-V24 WeakPolarHBondContact O-CG2 3.43Å; Y20-V24 PolarHBondContact O-N 2.7Å; Y20-V49 HydrophobicContact CE1-CG1 4.44Å; Y20-N53 HydrophobicContact CD1-CB 3.64Å; Y20-N53 HydrophobicContact CD2-CB 3.42Å; Y20-N53 VanDerWaalsContact CD2-CB 3.42Å; Y20-N53 HydrophobicContact CE1-CB 3.93Å; Y20-N53 WeakPolarHBondContact CE1-ND2 3.47Å; Y20-N53 HydrophobicContact CE2-CB 3.69Å; Y20-N53 HydrophobicContact CG-CB 3.36Å; Y20-N53 VanDerWaalsContact CZ-CG 3.47Å
21	E	97.8	Very high	98	Very high	90 Å²	90	56.3 Å²	56.3	42%	0.421	27%	0.268	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.4	-70.7	75.1	-168.8	0	0	111.5	R19 M23 V24 E25 V54 R58	R19-E21 VanDerWaalsContact C-N 3.3Å; R19-E21 PolarHBondContact O-N 3.15Å; E21-M23 VanDerWaalsContact C-N 3.35Å; E21-V24 WeakPolarHBondContact O-CB 3.45Å; E21-V24 PolarHBondContact O-N 2.94Å; E21-E25 PolarHBondContact O-N 3.46Å; E21-V54 HydrophobicContact CG-CG2 4.26Å; E21-R58 IonicContact OE1-CZ 3.32Å; E21-R58 IonicContact OE1-NH2 2.6Å; E21-R58 PolarHBondContact OE1-NH2 3.01Å
22	E	98.1	Very high	97.8	Very high	52 Å²	52	61 Å²	61	24%	0.243	29%	0.288	C	S	.	.	H	α-helix	trans	-67.3	-36.9	172.5	-88	152.3	-83.4	0	0	112.2	A14 R19 V24 E25 F26	A14-E22 HydrophobicContact CB-CB 4.34Å; R19-E22 HydrophobicContact CB-CB 4.49Å; R19-E22 IonicContact CZ-OE1 2.73Å; R19-E22 IonicContact CZ-OE2 3.44Å; R19-E22 IonicContact NE-OE1 3.12Å; R19-E22 PolarHBondContact NE-OE1 3.21Å; R19-E22 IonicContact NE-OE2 2.75Å; R19-E22 IonicContact NH1-OE1 3.45Å; R19-E22 PolarHBondContact NH1-OE1 3.2Å; R19-E22 IonicContact NH1-OE2 3.32Å; R19-E22 PolarHBondContact NH1-OE2 3Å; R19-E22 VanDerWaalsContact NH2-CD 3.28Å; R19-E22 IonicContact NH2-OE1 3.74Å; R19-E22 PolarHBondContact NH2-OE1 2.67Å; R19-E22 IonicContact NH2-OE2 3.64Å; R19-E22 PolarHBondContact NH2-OE2 3.2Å; R19-E22 PolarHBondContact O-N 3.15Å; E22-V24 PolarHBondContact O-N 2.6Å; E22-E25 WeakPolarHBondContact O-CB 3.37Å; E22-E25 PolarHBondContact O-N 2.97Å; E22-E25 VanDerWaalsContact O-N 3.1Å; E22-F26 HydrophobicContact CB-CD2 4.4Å; E22-F26 HydrophobicContact CB-CE2 3.96Å; E22-F26 WeakPolarHBondContact O-CD2 3.34Å; E22-F26 WeakPolarHBondContact O-CG 3.49Å; E22-F26 PolarHBondContact O-N 3.08Å
23	M	98.2	Very high	97.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-40.6	175.3	-163.7	-170.9	178.8	0	0	111	A11 A14 E15 R19 Y20 E21 F26 M27 L46 V49 A50	A11-M23 HydrophobicContact CB-CG 4.06Å; A14-M23 HydrophobicContact CB-CB 4Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.92Å; E15-M23 HydrophobicContact CG-CE 4.22Å; E15-M23 HydrophobicContact CG-SD 4.38Å; R19-M23 PolarHBondContact O-N 3.5Å; R19-M23 VanDerWaalsContact O-N 3.08Å; Y20-M23 HydrophobicContact CD1-SD 3.97Å; Y20-M23 WeakPolarHBondContact O-CB 3.25Å; Y20-M23 PolarHBondContact O-N 3.03Å; E21-M23 VanDerWaalsContact C-N 3.35Å; M23-F26 PolarHBondContact O-N 3.23Å; M23-M27 WeakPolarHBondContact O-CB 3.36Å; M23-M27 VanDerWaalsContact O-CG 3.29Å; M23-M27 WeakPolarHBondContact O-CG 3.28Å; M23-M27 PolarHBondContact O-N 3.15Å; M23-L46 HydrophobicContact CE-CB 3.93Å; M23-L46 HydrophobicContact CE-CD2 3.47Å; M23-L46 VanDerWaalsContact CE-CD2 3.47Å; M23-L46 HydrophobicContact CE-CG 4.32Å; M23-L46 VanDerWaalsContact CE-O 3.22Å; M23-L46 WeakPolarHBondContact CE-O 3.42Å; M23-V49 HydrophobicContact CE-CB 4.22Å; M23-V49 HydrophobicContact CE-CG1 4.12Å; M23-V49 HydrophobicContact SD-CG1 4.32Å; M23-A50 HydrophobicContact CB-CB 3.84Å; M23-A50 HydrophobicContact CE-CB 4.25Å; M23-A50 HydrophobicContact CG-CB 3.58Å; M23-A50 VanDerWaalsContact SD-CA 3.59Å; M23-A50 HydrophobicContact SD-CB 3.57Å; M23-A50 VanDerWaalsContact SD-CB 3.57Å
24	V	98.5	Very high	97	Very high	17 Å²	17	58 Å²	58	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-49.4	172.6	166.9	0	0	0	0	110.5	Y20 E21 E22 F26 M27 E28 A50 Y51 V54	Y20-V24 WeakPolarHBondContact O-CG2 3.43Å; Y20-V24 PolarHBondContact O-N 2.7Å; E21-V24 WeakPolarHBondContact O-CB 3.45Å; E21-V24 PolarHBondContact O-N 2.94Å; E22-V24 PolarHBondContact O-N 2.6Å; V24-F26 VanDerWaalsContact C-N 3.33Å; V24-F26 PolarHBondContact O-N 3.44Å; V24-M27 PolarHBondContact O-N 3.13Å; V24-E28 HydrophobicContact CG1-CG 4.22Å; V24-E28 WeakPolarHBondContact O-CB 3.39Å; V24-E28 WeakPolarHBondContact O-CG 3.35Å; V24-E28 PolarHBondContact O-N 3.42Å; V24-A50 HydrophobicContact CG2-CB 3.77Å; V24-Y51 HydrophobicContact CB-CE2 4.35Å; V24-Y51 HydrophobicContact CG1-CD2 4.23Å; V24-Y51 HydrophobicContact CG1-CE1 4Å; V24-Y51 HydrophobicContact CG1-CE2 3.57Å; V24-Y51 VanDerWaalsContact CG1-CZ 3.46Å; V24-Y51 HydrophobicContact CG2-CD1 4.2Å; V24-Y51 HydrophobicContact CG2-CD2 3.9Å; V24-Y51 HydrophobicContact CG2-CE1 4.39Å; V24-Y51 HydrophobicContact CG2-CE2 4.11Å; V24-Y51 HydrophobicContact CG2-CG 3.97Å; V24-V54 HydrophobicContact CG2-CG2 3.98Å
25	E	98.2	Very high	96.3	Very high	112 Å²	112	64.3 Å²	64.3	52%	0.523	31%	0.31	S	S	.	.	H	α-helix	trans	-58.2	-41.6	179.9	-67.1	-179.7	-166.5	0	0	113.2	E21 E22 K29	E21-E25 PolarHBondContact O-N 3.46Å; E22-E25 WeakPolarHBondContact O-CB 3.37Å; E22-E25 PolarHBondContact O-N 2.97Å; E22-E25 VanDerWaalsContact O-N 3.1Å; E25-K29 WeakPolarHBondContact O-CG 3.38Å; E25-K29 PolarHBondContact O-N 3.36Å
26	F	98.4	Very high	95.5	Very high	27 Å²	27	67.4 Å²	67.4	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-68.9	-45.9	176.4	-64.4	-54	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 3.75Å; M10-F26 HydrophobicContact CB-CD2 3.72Å; M10-F26 HydrophobicContact CB-CE1 3.71Å; M10-F26 HydrophobicContact CB-CE2 3.68Å; M10-F26 HydrophobicContact CB-CG 3.78Å; M10-F26 HydrophobicContact CB-CZ 3.69Å; M10-F26 HydrophobicContact CE-CE1 4.35Å; M10-F26 HydrophobicContact CE-CE2 4.12Å; M10-F26 HydrophobicContact CE-CZ 3.65Å; M10-F26 HydrophobicContact CG-CD1 4.48Å; M10-F26 HydrophobicContact CG-CE1 4.12Å; M10-F26 HydrophobicContact CG-CZ 4.22Å; A11-F26 HydrophobicContact CB-CB 4.07Å; A14-F26 HydrophobicContact CB-CD2 4.45Å; A14-F26 HydrophobicContact CB-CE2 4.45Å; E22-F26 HydrophobicContact CB-CD2 4.4Å; E22-F26 HydrophobicContact CB-CE2 3.96Å; E22-F26 WeakPolarHBondContact O-CD2 3.34Å; E22-F26 WeakPolarHBondContact O-CG 3.49Å; E22-F26 PolarHBondContact O-N 3.08Å; M23-F26 PolarHBondContact O-N 3.23Å; V24-F26 VanDerWaalsContact C-N 3.33Å; V24-F26 PolarHBondContact O-N 3.44Å; F26-E28 VanDerWaalsContact C-N 3.35Å; F26-E28 PolarHBondContact O-N 3.38Å; F26-K29 WeakPolarHBondContact O-CB 3.38Å; F26-K29 PolarHBondContact O-N 3.33Å; F26-V30 PolarHBondContact O-N 2.98Å
27	M	98.3	Very high	95	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-72	-27.1	-176.9	-69.6	-52.2	-51.7	0	0	113.4	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 3.36Å; M23-M27 VanDerWaalsContact O-CG 3.29Å; M23-M27 WeakPolarHBondContact O-CG 3.28Å; M23-M27 PolarHBondContact O-N 3.15Å; V24-M27 PolarHBondContact O-N 3.13Å; M27-K29 VanDerWaalsContact C-N 3.34Å; M27-V30 HydrophobicContact CE-CB 4.08Å; M27-V30 HydrophobicContact CE-CG1 4.06Å; M27-V30 HydrophobicContact CE-CG2 4.42Å; M27-V30 PolarHBondContact O-N 2.88Å; M27-V30 HydrophobicContact SD-CG2 4.36Å; M27-A31 WeakPolarHBondContact O-CB 3.36Å; M27-A31 PolarHBondContact O-N 3.21Å; M27-E43 HydrophobicContact CE-CB 4.17Å; M27-E43 WeakPolarHBondContact CE-O 3.49Å; M27-L46 HydrophobicContact CE-CB 3.97Å; M27-L46 HydrophobicContact CG-CB 4.24Å; M27-L46 HydrophobicContact SD-CB 3.8Å; M27-L46 HydrophobicContact SD-CD1 4.33Å; M27-L47 HydrophobicContact CB-CB 4.2Å; M27-L47 HydrophobicContact CB-CD1 3.67Å; M27-L47 HydrophobicContact CE-CB 4.12Å
28	E	97.7	Very high	94.8	Very high	42 Å²	42	65.2 Å²	65.2	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-64.1	-39.5	169	-77.6	-165.1	-169.2	0	0	112.6	V24 F26 V30 A31 K32 Y51 V105	V24-E28 HydrophobicContact CG1-CG 4.22Å; V24-E28 WeakPolarHBondContact O-CB 3.39Å; V24-E28 WeakPolarHBondContact O-CG 3.35Å; V24-E28 PolarHBondContact O-N 3.42Å; F26-E28 VanDerWaalsContact C-N 3.35Å; F26-E28 PolarHBondContact O-N 3.38Å; E28-V30 VanDerWaalsContact C-N 3.28Å; E28-V30 PolarHBondContact O-N 2.93Å; E28-A31 PolarHBondContact O-N 3.29Å; E28-K32 WeakPolarHBondContact O-CB 3.3Å; E28-K32 WeakPolarHBondContact O-CD 3.35Å; E28-K32 VanDerWaalsContact O-CG 3.23Å; E28-K32 WeakPolarHBondContact O-CG 3.31Å; E28-K32 PolarHBondContact O-N 2.88Å; E28-K32 IonicContact OE2-NZ 2.77Å; E28-K32 PolarHBondContact OE2-NZ 3.49Å; E28-Y51 HydrophobicContact CG-CE2 4.27Å; E28-Y51 PolarHBondContact OE1-OH 2.7Å; E28-V105 HydrophobicContact CG-CG2 4.08Å
29	K	96.7	Very high	94.7	Very high	100 Å²	100	58.8 Å²	58.8	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-40.1	175.7	-67.1	165.4	-172.3	167	0	110.2	N7 E25 F26 M27 K32 T33	N7-K29 WeakPolarHBondContact OD1-CD 3.4Å; E25-K29 WeakPolarHBondContact O-CG 3.38Å; E25-K29 PolarHBondContact O-N 3.36Å; F26-K29 WeakPolarHBondContact O-CB 3.38Å; F26-K29 PolarHBondContact O-N 3.33Å; M27-K29 VanDerWaalsContact C-N 3.34Å; K29-K32 PolarHBondContact O-N 3.29Å; K29-T33 WeakPolarHBondContact O-CG2 3.43Å
30	V	97.2	Very high	94.6	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-49.4	174.5	176	0	0	0	0	110.8	R4 N7 V8 F26 M27 E28 K32 T33 L39 E43	R4-V30 HydrophobicContact CG-CG1 4.08Å; R4-V30 HydrophobicContact CG-CG2 4.46Å; N7-V30 HydrophobicContact CB-CG2 3.54Å; V8-V30 HydrophobicContact CG2-CG1 4.18Å; V8-V30 HydrophobicContact CG2-CG2 3.79Å; F26-V30 PolarHBondContact O-N 2.98Å; M27-V30 HydrophobicContact CE-CB 4.08Å; M27-V30 HydrophobicContact CE-CG1 4.06Å; M27-V30 HydrophobicContact CE-CG2 4.42Å; M27-V30 PolarHBondContact O-N 2.88Å; M27-V30 HydrophobicContact SD-CG2 4.36Å; E28-V30 VanDerWaalsContact C-N 3.28Å; E28-V30 PolarHBondContact O-N 2.93Å; V30-K32 PolarHBondContact O-N 3.19Å; V30-T33 PolarHBondContact O-N 2.86Å; V30-T33 PolarHBondContact O-OG1 3.49Å; V30-L39 HydrophobicContact CG1-CD2 3.69Å; V30-E43 HydrophobicContact CG1-CB 4.5Å; V30-E43 HydrophobicContact CG1-CG 4.4Å
31	A	96.5	Very high	94.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-28.6	179.5	0	0	0	0	0	113.4	M27 E28 T33 V34 L47 V105 H109 L110	M27-A31 WeakPolarHBondContact O-CB 3.36Å; M27-A31 PolarHBondContact O-N 3.21Å; E28-A31 PolarHBondContact O-N 3.29Å; A31-T33 PolarHBondContact O-N 3.22Å; A31-V34 WeakPolarHBondContact O-CG1 3.12Å; A31-V34 WeakPolarHBondContact O-CG2 3.41Å; A31-L47 HydrophobicContact CB-CD2 4.45Å; A31-V105 HydrophobicContact CB-CG1 3.49Å; A31-V105 VanDerWaalsContact CB-CG1 3.49Å; A31-H109 WeakPolarHBondContact O-CB 3.22Å; A31-L110 HydrophobicContact CB-CD1 4.32Å; A31-L110 HydrophobicContact CB-CD2 3.98Å; A31-L110 HydrophobicContact CB-CG 4.38Å
32	K	94.1	Very high	94.3	Very high	98 Å²	98	57.3 Å²	57.3	43%	0.426	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-3.2	175.3	-72.5	162.8	-177.1	158.5	0	113.8	E28 K29 V30	E28-K32 WeakPolarHBondContact O-CB 3.3Å; E28-K32 WeakPolarHBondContact O-CD 3.35Å; E28-K32 VanDerWaalsContact O-CG 3.23Å; E28-K32 WeakPolarHBondContact O-CG 3.31Å; E28-K32 PolarHBondContact O-N 2.88Å; E28-K32 IonicContact OE2-NZ 2.77Å; E28-K32 PolarHBondContact OE2-NZ 3.49Å; K29-K32 PolarHBondContact O-N 3.29Å; V30-K32 PolarHBondContact O-N 3.19Å
33	T	92.4	Very high	94.3	Very high	51 Å²	51	55.8 Å²	55.8	31%	0.313	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	8.7	177.9	65.7	0	0	0	0	114.1	K29 V30 A31 D35 V36	K29-T33 WeakPolarHBondContact O-CG2 3.43Å; V30-T33 PolarHBondContact O-N 2.86Å; V30-T33 PolarHBondContact O-OG1 3.49Å; A31-T33 PolarHBondContact O-N 3.22Å; T33-D35 PolarHBondContact O-N 2.84Å; T33-V36 WeakPolarHBondContact O-CB 3.32Å; T33-V36 PolarHBondContact O-N 3.41Å; T33-V36 VanDerWaalsContact O-N 3.11Å
34	V	86.8	Confident	94.2	Very high	8 Å²	8	56.5 Å²	56.5	5%	0.048	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-15	-174.2	-65.7	0	0	0	0	115.3	A31 V36 E37 L39 H109 L110	A31-V34 WeakPolarHBondContact O-CG1 3.12Å; A31-V34 WeakPolarHBondContact O-CG2 3.41Å; V34-V36 PolarHBondContact O-N 2.97Å; V34-V36 VanDerWaalsContact O-N 3.14Å; V34-E37 VanDerWaalsContact CA-O 3.32Å; V34-E37 WeakPolarHBondContact CA-O 3.37Å; V34-E37 CarbonylContact O-C 3.59Å; V34-E37 PolarHBondContact O-N 2.73Å; V34-L39 HydrophobicContact CG1-CD2 3.75Å; V34-L39 HydrophobicContact CG1-CG 3.83Å; V34-H109 HydrophobicContact CG2-CB 3.76Å; V34-H109 WeakPolarHBondContact CG2-O 3.06Å; V34-L110 HydrophobicContact CG1-CD2 3.83Å
35	D	85.4	Confident	94.1	Very high	140 Å²	140	58.9 Å²	58.9	75%	0.749	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.4	171.3	-60.2	-26	0	0	0	112.3	T33	T33-D35 PolarHBondContact O-N 2.84Å
36	V	80.4	Confident	94.1	Very high	132 Å²	132	54 Å²	54	80%	0.8	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-45.6	175.9	-176.2	0	0	0	0	111.2	T33 V34	T33-V36 WeakPolarHBondContact O-CB 3.32Å; T33-V36 PolarHBondContact O-N 3.41Å; T33-V36 VanDerWaalsContact O-N 3.11Å; V34-V36 PolarHBondContact O-N 2.97Å; V34-V36 VanDerWaalsContact O-N 3.14Å
37	E	87.7	Confident	94.1	Very high	127 Å²	127	52.8 Å²	52.8	59%	0.593	27%	0.274	S	S	*	.	S	Bend	trans	-157.6	131.9	-174.4	-176.7	179.2	-165.1	0	0	110.4	R4 V34	R4-E37 PolarHBondContact NH1-O 3.4Å; V34-E37 VanDerWaalsContact CA-O 3.32Å; V34-E37 WeakPolarHBondContact CA-O 3.37Å; V34-E37 CarbonylContact O-C 3.59Å; V34-E37 PolarHBondContact O-N 2.73Å
38	E	93.4	Very high	94.1	Very high	48 Å²	48	54.4 Å²	54.4	22%	0.224	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-57.1	154.5	175.7	-167.5	176.2	163.2	0	0	111.4	R4 S40 S115 P116 S119	R4-E38 PolarHBondContact NH2-O 2.9Å; E38-S40 PolarHBondContact O-N 3.32Å; E38-S115 PolarHBondContact OE2-N 3.36Å; E38-P116 WeakPolarHBondContact OE1-CD 3.19Å; E38-P116 WeakPolarHBondContact OE2-CD 3.41Å; E38-S119 WeakPolarHBondContact OE1-CB 3.49Å; E38-S119 PolarHBondContact OE1-OG 3.3Å
39	L	96.1	Very high	94.1	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.052	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-64.1	131.7	173.4	-61.3	-169.7	0	0	0	110.8	V30 V34 E43 R44 L47 L110	V30-L39 HydrophobicContact CG1-CD2 3.69Å; V34-L39 HydrophobicContact CG1-CD2 3.75Å; V34-L39 HydrophobicContact CG1-CG 3.83Å; L39-E43 HydrophobicContact CB-CB 4.2Å; L39-E43 HydrophobicContact CD2-CB 4.26Å; L39-R44 HydrophobicContact CB-CB 4.38Å; L39-L47 HydrophobicContact CD1-CD2 4.33Å; L39-L110 HydrophobicContact CD1-CD1 4.44Å; L39-L110 HydrophobicContact CD1-CD2 3.61Å; L39-L110 HydrophobicContact CG-CD2 3.92Å
40	S	95.5	Very high	94.2	Very high	54 Å²	54	49.8 Å²	49.8	38%	0.378	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-63.7	163.5	166	64.5	0	0	0	0	110.9	E38 E42 E43 R44	E38-S40 PolarHBondContact O-N 3.32Å; S40-E42 PolarHBondContact O-N 3.28Å; S40-E43 WeakPolarHBondContact CB-OE2 3.46Å; S40-E43 PolarHBondContact N-OE2 3.08Å; S40-E43 PolarHBondContact O-N 2.76Å; S40-E43 VanDerWaalsContact OG-CD 3.27Å; S40-E43 VanDerWaalsContact OG-CG 3.25Å; S40-E43 WeakPolarHBondContact OG-CG 3.29Å; S40-E43 PolarHBondContact OG-N 3.01Å; S40-E43 PolarHBondContact OG-OE2 3.25Å; S40-R44 VanDerWaalsContact O-CB 3.31Å; S40-R44 WeakPolarHBondContact O-CB 3.46Å; S40-R44 PolarHBondContact O-N 3.32Å
41	V	94.5	Very high	94.3	Very high	80 Å²	80	50 Å²	50	49%	0.485	27%	0.269	S	S	.	.	H	α-helix	trans	-55.8	-40.7	175.7	172.4	0	0	0	0	111.4	N45	V41-N45 VanDerWaalsContact O-CB 3.3Å; V41-N45 WeakPolarHBondContact O-CB 3.02Å; V41-N45 PolarHBondContact O-N 2.86Å; V41-N45 PolarHBondContact O-ND2 2.78Å; V41-N45 PolarHBondContact O-OD1 3.32Å
42	E	96.4	Very high	94.4	Very high	105 Å²	105	56.8 Å²	56.8	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-49	177.9	-173	178.9	-145.8	0	0	111.4	K12 S40 R44 N45 L46	K12-E42 WeakPolarHBondContact CE-OE1 3.4Å; K12-E42 IonicContact NZ-OE1 3.58Å; K12-E42 PolarHBondContact NZ-OE1 2.7Å; K12-E42 IonicContact NZ-OE2 2.62Å; K12-E42 PolarHBondContact NZ-OE2 3.15Å; S40-E42 PolarHBondContact O-N 3.28Å; E42-R44 PolarHBondContact O-N 2.75Å; E42-N45 PolarHBondContact O-N 3.23Å; E42-L46 HydrophobicContact CG-CD1 4.29Å; E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 2.6Å
43	E	97.6	Very high	94.6	Very high	20 Å²	20	54.9 Å²	54.9	9%	0.093	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-42.8	-179.8	-68.8	164.9	134.5	0	0	112.1	R4 V8 M27 V30 L39 S40 N45 L46 L47	R4-E43 IonicContact CZ-OE1 3.34Å; R4-E43 IonicContact CZ-OE2 2.74Å; R4-E43 IonicContact NE-OE1 2.65Å; R4-E43 PolarHBondContact NE-OE1 3.25Å; R4-E43 IonicContact NE-OE2 3.25Å; R4-E43 VanDerWaalsContact NH2-CD 3.35Å; R4-E43 IonicContact NH2-OE1 2.83Å; R4-E43 PolarHBondContact NH2-OE1 3.11Å; R4-E43 IonicContact NH2-OE2 3.33Å; R4-E43 PolarHBondContact NH2-OE2 3.04Å; V8-E43 HydrophobicContact CG2-CG 3.8Å; M27-E43 HydrophobicContact CE-CB 4.17Å; M27-E43 WeakPolarHBondContact CE-O 3.49Å; V30-E43 HydrophobicContact CG1-CB 4.5Å; V30-E43 HydrophobicContact CG1-CG 4.4Å; L39-E43 HydrophobicContact CB-CB 4.2Å; L39-E43 HydrophobicContact CD2-CB 4.26Å; S40-E43 WeakPolarHBondContact CB-OE2 3.46Å; S40-E43 PolarHBondContact N-OE2 3.08Å; S40-E43 PolarHBondContact O-N 2.76Å; S40-E43 VanDerWaalsContact OG-CD 3.27Å; S40-E43 VanDerWaalsContact OG-CG 3.25Å; S40-E43 WeakPolarHBondContact OG-CG 3.29Å; S40-E43 PolarHBondContact OG-N 3.01Å; S40-E43 PolarHBondContact OG-OE2 3.25Å; E43-N45 VanDerWaalsContact C-N 3.29Å; E43-N45 PolarHBondContact O-N 3.32Å; E43-L46 PolarHBondContact O-N 2.77Å; E43-L47 PolarHBondContact O-N 2.85Å
44	R	97.3	Very high	94.9	Very high	15 Å²	15	53 Å²	53	6%	0.057	28%	0.281	C	S	.	.	H	α-helix	trans	-57.9	-44.1	174.2	-178.3	-168.9	72.9	-163.3	-0.7	111.1	L39 S40 E42 L47 S48 F122 Y123	L39-R44 HydrophobicContact CB-CB 4.38Å; S40-R44 VanDerWaalsContact O-CB 3.31Å; S40-R44 WeakPolarHBondContact O-CB 3.46Å; S40-R44 PolarHBondContact O-N 3.32Å; E42-R44 PolarHBondContact O-N 2.75Å; R44-L47 PolarHBondContact O-N 3.48Å; R44-S48 PolarHBondContact O-N 3.26Å; R44-S48 VanDerWaalsContact O-N 3.09Å; R44-F122 HydrophobicContact CG-CD1 3.59Å; R44-F122 HydrophobicContact CG-CE1 3.4Å; R44-F122 VanDerWaalsContact CG-CE1 3.4Å; R44-F122 HydrophobicContact CG-CE2 4.36Å; R44-F122 HydrophobicContact CG-CG 4.16Å; R44-F122 HydrophobicContact CG-CZ 3.81Å; R44-Y123 HydrophobicContact CG-CE1 3.81Å
45	N	96.3	Very high	95.4	Very high	67 Å²	67	52.7 Å²	52.7	36%	0.358	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-41.1	178.9	-70.4	-9.1	0	0	0	111.5	V41 E42 E43 L47 S48 V49	V41-N45 VanDerWaalsContact O-CB 3.3Å; V41-N45 WeakPolarHBondContact O-CB 3.02Å; V41-N45 PolarHBondContact O-N 2.86Å; V41-N45 PolarHBondContact O-ND2 2.78Å; V41-N45 PolarHBondContact O-OD1 3.32Å; E42-N45 PolarHBondContact O-N 3.23Å; E43-N45 VanDerWaalsContact C-N 3.29Å; E43-N45 PolarHBondContact O-N 3.32Å; N45-L47 PolarHBondContact O-N 3.19Å; N45-S48 WeakPolarHBondContact O-CB 3.49Å; N45-S48 PolarHBondContact O-N 3.18Å; N45-V49 WeakPolarHBondContact O-CG2 3.4Å; N45-V49 PolarHBondContact O-N 3.46Å
46	L	98.3	Very high	96	Very high	11 Å²	11	47.5 Å²	47.5	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-46.3	174.7	-73.4	169.7	0	0	0	111.7	V8 K12 E15 M23 M27 E42 E43 S48 V49 A50	V8-L46 HydrophobicContact CG1-CD1 4.03Å; K12-L46 HydrophobicContact CG-CD1 4.05Å; K12-L46 HydrophobicContact CG-CD2 4.18Å; E15-L46 WeakPolarHBondContact OE2-CD2 3.46Å; M23-L46 HydrophobicContact CE-CB 3.93Å; M23-L46 HydrophobicContact CE-CD2 3.47Å; M23-L46 VanDerWaalsContact CE-CD2 3.47Å; M23-L46 HydrophobicContact CE-CG 4.32Å; M23-L46 VanDerWaalsContact CE-O 3.22Å; M23-L46 WeakPolarHBondContact CE-O 3.42Å; M27-L46 HydrophobicContact CE-CB 3.97Å; M27-L46 HydrophobicContact CG-CB 4.24Å; M27-L46 HydrophobicContact SD-CB 3.8Å; M27-L46 HydrophobicContact SD-CD1 4.33Å; E42-L46 HydrophobicContact CG-CD1 4.29Å; E42-L46 WeakPolarHBondContact O-CG 3.44Å; E42-L46 PolarHBondContact O-N 2.6Å; E43-L46 PolarHBondContact O-N 2.77Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 3.28Å; L46-V49 PolarHBondContact O-N 2.88Å; L46-A50 WeakPolarHBondContact O-CB 3.33Å; L46-A50 PolarHBondContact O-N 3.06Å
47	L	98.5	Very high	96.9	Very high	1 Å²	1	43 Å²	43	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-57.8	-44	175.6	178.7	70	0	0	0	111.2	M27 A31 L39 E43 R44 N45 A50 Y51 I102 L110	M27-L47 HydrophobicContact CB-CB 4.2Å; M27-L47 HydrophobicContact CB-CD1 3.67Å; M27-L47 HydrophobicContact CE-CB 4.12Å; A31-L47 HydrophobicContact CB-CD2 4.45Å; L39-L47 HydrophobicContact CD1-CD2 4.33Å; E43-L47 PolarHBondContact O-N 2.85Å; R44-L47 PolarHBondContact O-N 3.48Å; N45-L47 PolarHBondContact O-N 3.19Å; L47-A50 PolarHBondContact O-N 2.89Å; L47-Y51 HydrophobicContact CD1-CD2 3.72Å; L47-Y51 HydrophobicContact CD1-CE2 3.82Å; L47-Y51 HydrophobicContact CG-CD2 4.35Å; L47-Y51 PolarHBondContact O-N 3.47Å; L47-Y51 VanDerWaalsContact O-N 3.16Å; L47-I102 HydrophobicContact CD2-CD1 4.36Å; L47-L110 HydrophobicContact CD2-CD1 3.37Å
48	S	98	Very high	97.4	Very high	33 Å²	33	39.9 Å²	39.9	23%	0.231	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-45.6	178.4	-169.9	0	0	0	0	112.4	R44 N45 L46 K52	R44-S48 PolarHBondContact O-N 3.26Å; R44-S48 VanDerWaalsContact O-N 3.09Å; N45-S48 WeakPolarHBondContact O-CB 3.49Å; N45-S48 PolarHBondContact O-N 3.18Å; L46-S48 VanDerWaalsContact C-N 3.28Å; L46-S48 PolarHBondContact O-N 3.28Å; S48-K52 WeakPolarHBondContact O-CB 3.34Å; S48-K52 PolarHBondContact O-N 3.17Å
49	V	98.3	Very high	97.6	Very high	45 Å²	45	39.2 Å²	39.2	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-61.1	-45.3	177.5	168.8	0	0	0	0	111.1	Y20 M23 N45 L46 K52 N53	Y20-V49 HydrophobicContact CE1-CG1 4.44Å; M23-V49 HydrophobicContact CE-CB 4.22Å; M23-V49 HydrophobicContact CE-CG1 4.12Å; M23-V49 HydrophobicContact SD-CG1 4.32Å; N45-V49 WeakPolarHBondContact O-CG2 3.4Å; N45-V49 PolarHBondContact O-N 3.46Å; L46-V49 PolarHBondContact O-N 2.88Å; V49-K52 PolarHBondContact O-N 3.35Å; V49-N53 PolarHBondContact O-N 3.25Å; V49-N53 VanDerWaalsContact O-N 3.09Å; V49-N53 PolarHBondContact O-ND2 3.38Å
50	A	98.5	Very high	97.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.3	-57.9	178.5	0	0	0	0	0	110.9	M23 V24 L46 L47 K52 N53 V54	M23-A50 HydrophobicContact CB-CB 3.84Å; M23-A50 HydrophobicContact CE-CB 4.25Å; M23-A50 HydrophobicContact CG-CB 3.58Å; M23-A50 VanDerWaalsContact SD-CA 3.59Å; M23-A50 HydrophobicContact SD-CB 3.57Å; M23-A50 VanDerWaalsContact SD-CB 3.57Å; V24-A50 HydrophobicContact CG2-CB 3.77Å; L46-A50 WeakPolarHBondContact O-CB 3.33Å; L46-A50 PolarHBondContact O-N 3.06Å; L47-A50 PolarHBondContact O-N 2.89Å; A50-K52 PolarHBondContact O-N 2.95Å; A50-N53 PolarHBondContact O-N 3.47Å; A50-V54 WeakPolarHBondContact O-CG2 3.35Å; A50-V54 PolarHBondContact O-N 3.38Å
51	Y	98.7	Very high	97.9	Very high	5 Å²	5	40.3 Å²	40.3	2%	0.02	23%	0.226	C	C	.	.	H	α-helix	trans	-68.7	-34.3	-176.6	-95.4	-75.6	0	0	0	113.1	V24 E28 L47 I55 I98 G101 I102 Y130	V24-Y51 HydrophobicContact CB-CE2 4.35Å; V24-Y51 HydrophobicContact CG1-CD2 4.23Å; V24-Y51 HydrophobicContact CG1-CE1 4Å; V24-Y51 HydrophobicContact CG1-CE2 3.57Å; V24-Y51 VanDerWaalsContact CG1-CZ 3.46Å; V24-Y51 HydrophobicContact CG2-CD1 4.2Å; V24-Y51 HydrophobicContact CG2-CD2 3.9Å; V24-Y51 HydrophobicContact CG2-CE1 4.39Å; V24-Y51 HydrophobicContact CG2-CE2 4.11Å; V24-Y51 HydrophobicContact CG2-CG 3.97Å; E28-Y51 HydrophobicContact CG-CE2 4.27Å; E28-Y51 PolarHBondContact OE1-OH 2.7Å; L47-Y51 HydrophobicContact CD1-CD2 3.72Å; L47-Y51 HydrophobicContact CD1-CE2 3.82Å; L47-Y51 HydrophobicContact CG-CD2 4.35Å; L47-Y51 PolarHBondContact O-N 3.47Å; L47-Y51 VanDerWaalsContact O-N 3.16Å; Y51-I55 WeakPolarHBondContact O-CB 3.26Å; Y51-I55 WeakPolarHBondContact O-CG2 3.43Å; Y51-I55 PolarHBondContact O-N 3.14Å; Y51-I98 HydrophobicContact CD1-CG2 4.04Å; Y51-I98 HydrophobicContact CE1-CG2 4.23Å; Y51-G101 VanDerWaalsContact OH-C 3.26Å; Y51-I102 HydrophobicContact CD1-CB 3.74Å; Y51-I102 HydrophobicContact CD1-CG1 4.43Å; Y51-I102 HydrophobicContact CD1-CG2 4.18Å; Y51-I102 HydrophobicContact CD2-CB 4.36Å; Y51-I102 HydrophobicContact CD2-CD1 3.84Å; Y51-I102 HydrophobicContact CD2-CG1 4.43Å; Y51-I102 HydrophobicContact CE1-CB 3.52Å; Y51-I102 HydrophobicContact CE1-CG2 4.14Å; Y51-I102 HydrophobicContact CE2-CB 4.16Å; Y51-I102 HydrophobicContact CE2-CD1 3.87Å; Y51-I102 HydrophobicContact CG-CB 4.13Å; Y51-I102 HydrophobicContact CG-CD1 4.24Å; Y51-I102 HydrophobicContact CG-CG1 4.36Å; Y51-I102 PolarHBondContact OH-N 2.95Å; Y51-Y130 WeakPolarHBondContact CB-OH 3.47Å; Y51-Y130 PolarHBondContact O-OH 2.87Å; Y51-Y130 VanDerWaalsContact O-OH 3.04Å
52	K	98.1	Very high	98.1	Very high	143 Å²	143	38.2 Å²	38.2	62%	0.622	21%	0.209	S	C	*	.	H	α-helix	trans	-63.7	-41.5	176.9	-179	-178.1	177.6	-174.3	0	111.8	S48 V49 A50 G56	S48-K52 WeakPolarHBondContact O-CB 3.34Å; S48-K52 PolarHBondContact O-N 3.17Å; V49-K52 PolarHBondContact O-N 3.35Å; A50-K52 PolarHBondContact O-N 2.95Å; K52-G56 WeakPolarHBondContact O-CA 3.49Å; K52-G56 PolarHBondContact O-N 3.16Å
53	N	98.3	Very high	98.2	Very high	57 Å²	57	38 Å²	38	31%	0.305	20%	0.204	S	C	.	.	H	α-helix	trans	-70.7	-46.4	179.4	-79.9	-70.4	0	0	0	111.9	Y20 V49 A50 G56 A57	Y20-N53 HydrophobicContact CD1-CB 3.64Å; Y20-N53 HydrophobicContact CD2-CB 3.42Å; Y20-N53 VanDerWaalsContact CD2-CB 3.42Å; Y20-N53 HydrophobicContact CE1-CB 3.93Å; Y20-N53 WeakPolarHBondContact CE1-ND2 3.47Å; Y20-N53 HydrophobicContact CE2-CB 3.69Å; Y20-N53 HydrophobicContact CG-CB 3.36Å; Y20-N53 VanDerWaalsContact CZ-CG 3.47Å; V49-N53 PolarHBondContact O-N 3.25Å; V49-N53 VanDerWaalsContact O-N 3.09Å; V49-N53 PolarHBondContact O-ND2 3.38Å; A50-N53 PolarHBondContact O-N 3.47Å; N53-G56 PolarHBondContact O-N 3.43Å; N53-A57 PolarHBondContact O-N 2.8Å
54	V	98.4	Very high	98.2	Very high	11 Å²	11	42 Å²	42	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-49.5	179	177.6	0	0	0	0	111.2	E21 V24 A50 R58 I98	E21-V54 HydrophobicContact CG-CG2 4.26Å; V24-V54 HydrophobicContact CG2-CG2 3.98Å; A50-V54 WeakPolarHBondContact O-CG2 3.35Å; A50-V54 PolarHBondContact O-N 3.38Å; V54-R58 PolarHBondContact O-N 3.38Å; V54-R58 PolarHBondContact O-NE 3.01Å; V54-I98 HydrophobicContact CG1-CD1 3.68Å; V54-I98 HydrophobicContact CG1-CG1 3.92Å; V54-I98 HydrophobicContact CG1-CG2 4.26Å
55	I	98.5	Very high	98.3	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-36.3	179	-160.9	73.2	0	0	0	111.6	Y51 R58 R59 L95 I98 Y130 Y133	Y51-I55 WeakPolarHBondContact O-CB 3.26Å; Y51-I55 WeakPolarHBondContact O-CG2 3.43Å; Y51-I55 PolarHBondContact O-N 3.14Å; I55-R58 PolarHBondContact O-N 3.35Å; I55-R59 HydrophobicContact CG1-CG 4.18Å; I55-R59 WeakPolarHBondContact O-CB 3.49Å; I55-R59 VanDerWaalsContact O-CG 3.3Å; I55-R59 WeakPolarHBondContact O-CG 3.43Å; I55-R59 PolarHBondContact O-N 2.86Å; I55-L95 HydrophobicContact CD1-CD2 3.55Å; I55-L95 HydrophobicContact CG1-CD2 4.24Å; I55-I98 HydrophobicContact CB-CG2 4Å; I55-I98 HydrophobicContact CD1-CB 3.76Å; I55-I98 HydrophobicContact CD1-CD1 4.29Å; I55-I98 HydrophobicContact CD1-CG2 3.56Å; I55-I98 HydrophobicContact CG1-CG2 4.33Å; I55-Y130 HydrophobicContact CB-CE1 3.9Å; I55-Y130 HydrophobicContact CD1-CE1 4.24Å; I55-Y130 HydrophobicContact CG1-CD1 4.45Å; I55-Y130 HydrophobicContact CG1-CE1 3.9Å; I55-Y130 HydrophobicContact CG2-CE1 3.92Å; I55-Y130 WeakPolarHBondContact CG2-OH 3.4Å; I55-Y133 HydrophobicContact CG1-CD2 3.87Å; I55-Y133 HydrophobicContact CG1-CE2 4.35Å; I55-Y133 HydrophobicContact CG2-CD2 4.4Å; I55-Y133 HydrophobicContact CG2-CE2 4.05Å
56	G	98.2	Very high	98.4	Very high	31 Å²	31	40.3 Å²	40.3	32%	0.32	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-48	-179.8	0	0	0	0	0	111.8	K52 N53 R59 A60	K52-G56 WeakPolarHBondContact O-CA 3.49Å; K52-G56 PolarHBondContact O-N 3.16Å; N53-G56 PolarHBondContact O-N 3.43Å; G56-R59 PolarHBondContact O-N 2.89Å; G56-A60 WeakPolarHBondContact O-CB 3.27Å; G56-A60 PolarHBondContact O-N 3.12Å
57	A	98.1	Very high	98.3	Very high	39 Å²	39	42 Å²	42	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-43.1	177.9	0	0	0	0	0	112.1	N53 A60 S61	N53-A57 PolarHBondContact O-N 2.8Å; A57-A60 PolarHBondContact O-N 3.19Å; A57-S61 PolarHBondContact O-N 3.44Å; A57-S61 VanDerWaalsContact O-N 3.07Å; A57-S61 PolarHBondContact O-OG 3.28Å
58	R	98.5	Very high	98.3	Very high	61 Å²	61	45.2 Å²	45.2	23%	0.23	25%	0.247	C	C	.	.	H	α-helix	trans	-67.7	-38.5	176.9	-96.5	34.7	70.2	-163.6	17.5	113.1	E21 V54 I55 A60 S61 W62 E94 L95 I98	E21-R58 IonicContact OE1-CZ 3.32Å; E21-R58 IonicContact OE1-NH2 2.6Å; E21-R58 PolarHBondContact OE1-NH2 3.01Å; V54-R58 PolarHBondContact O-N 3.38Å; V54-R58 PolarHBondContact O-NE 3.01Å; I55-R58 PolarHBondContact O-N 3.35Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 2.83Å; R58-S61 PolarHBondContact O-N 3.16Å; R58-W62 PolarHBondContact O-N 2.91Å; R58-E94 HydrophobicContact CG-CB 4.38Å; R58-L95 HydrophobicContact CB-CD2 3.67Å; R58-L95 HydrophobicContact CB-CG 4.17Å; R58-I98 HydrophobicContact CB-CD1 4.06Å; R58-I98 HydrophobicContact CG-CD1 3.83Å
59	R	98.3	Very high	98.3	Very high	33 Å²	33	44.2 Å²	44.2	13%	0.125	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-36.4	173.9	-75	177.6	65.3	-125.8	17	111.9	I55 G56 W62 R63 L95 Y133 E136	I55-R59 HydrophobicContact CG1-CG 4.18Å; I55-R59 WeakPolarHBondContact O-CB 3.49Å; I55-R59 VanDerWaalsContact O-CG 3.3Å; I55-R59 WeakPolarHBondContact O-CG 3.43Å; I55-R59 PolarHBondContact O-N 2.86Å; G56-R59 PolarHBondContact O-N 2.89Å; R59-W62 PolarHBondContact O-N 3.15Å; R59-R63 WeakPolarHBondContact O-CG 3.11Å; R59-R63 PolarHBondContact O-N 3.16Å; R59-L95 HydrophobicContact CB-CD2 4.45Å; R59-L95 HydrophobicContact CG-CD2 3.58Å; R59-Y133 VanDerWaalsContact CZ-CE1 3.44Å; R59-E136 IonicContact CZ-OE1 3.92Å; R59-E136 IonicContact CZ-OE2 2.88Å; R59-E136 IonicContact NE-OE1 3.69Å; R59-E136 IonicContact NE-OE2 3.85Å; R59-E136 PolarHBondContact NE-OE2 3.44Å; R59-E136 VanDerWaalsContact NH2-CD 3.26Å; R59-E136 IonicContact NH2-OE1 3.88Å; R59-E136 PolarHBondContact NH2-OE1 2.98Å; R59-E136 IonicContact NH2-OE2 2.77Å; R59-E136 PolarHBondContact NH2-OE2 3.16Å
60	A	98.5	Very high	98.3	Very high	45 Å²	45	48.3 Å²	48.3	37%	0.372	26%	0.255	S	S	.	.	H	α-helix	trans	-63	-47.2	173.9	0	0	0	0	0	111.2	G56 A57 R58 W62 R63 I64	G56-A60 WeakPolarHBondContact O-CB 3.27Å; G56-A60 PolarHBondContact O-N 3.12Å; A57-A60 PolarHBondContact O-N 3.19Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 2.83Å; A60-W62 VanDerWaalsContact C-N 3.34Å; A60-W62 PolarHBondContact O-N 3.01Å; A60-R63 PolarHBondContact O-N 2.86Å; A60-I64 WeakPolarHBondContact O-CG1 3.47Å; A60-I64 PolarHBondContact O-N 3.47Å; A60-I64 VanDerWaalsContact O-N 3.09Å
61	S	98.6	Very high	98.3	Very high	43 Å²	43	54 Å²	54	30%	0.301	28%	0.28	S	S	.	.	H	α-helix	trans	-56	-48.8	173.6	-60.8	0	0	0	0	111.6	A57 R58 R63 I64 I65	A57-S61 PolarHBondContact O-N 3.44Å; A57-S61 VanDerWaalsContact O-N 3.07Å; A57-S61 PolarHBondContact O-OG 3.28Å; R58-S61 PolarHBondContact O-N 3.16Å; S61-R63 PolarHBondContact O-N 3.26Å; S61-I64 PolarHBondContact O-N 2.7Å; S61-I65 WeakPolarHBondContact O-CG1 3.48Å; S61-I65 PolarHBondContact O-N 3.23Å
62	W	98.7	Very high	98.2	Very high	35 Å²	35	54.9 Å²	54.9	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-44.4	-180	178.4	78.7	0	0	0	113	R58 R59 A60 I64 I65 S66 I91 E92 L95 E136 F137	R58-W62 PolarHBondContact O-N 2.91Å; R59-W62 PolarHBondContact O-N 3.15Å; A60-W62 VanDerWaalsContact C-N 3.34Å; A60-W62 PolarHBondContact O-N 3.01Å; W62-I64 PolarHBondContact O-N 3.19Å; W62-I65 PolarHBondContact O-N 2.86Å; W62-S66 VanDerWaalsContact O-CB 3.32Å; W62-S66 WeakPolarHBondContact O-CB 3.43Å; W62-S66 PolarHBondContact O-N 3.39Å; W62-S66 PolarHBondContact O-OG 3.44Å; W62-I91 HydrophobicContact CB-CG2 3.75Å; W62-E92 PolarHBondContact NE1-OE1 3Å; W62-L95 HydrophobicContact CB-CD1 3.75Å; W62-L95 HydrophobicContact CG-CD1 3.9Å; W62-E136 HydrophobicContact CH2-CB 4.43Å; W62-E136 WeakPolarHBondContact CH2-O 3.36Å; W62-E136 HydrophobicContact CZ3-CB 4.36Å; W62-F137 HydrophobicContact CD2-CB 4.18Å; W62-F137 VanDerWaalsContact CE2-CB 3.4Å; W62-F137 HydrophobicContact CH2-CB 4.02Å; W62-F137 HydrophobicContact CZ2-CB 3.33Å
63	R	98.3	Very high	98.2	Very high	102 Å²	102	52.2 Å²	52.2	39%	0.385	27%	0.274	S	S	.	.	H	α-helix	trans	-60.9	-45	176.4	-75.3	-175.1	179.2	85.1	11.4	112.4	R59 A60 S61 S66 S67 E136	R59-R63 WeakPolarHBondContact O-CG 3.11Å; R59-R63 PolarHBondContact O-N 3.16Å; A60-R63 PolarHBondContact O-N 2.86Å; S61-R63 PolarHBondContact O-N 3.26Å; R63-S66 PolarHBondContact O-N 3.08Å; R63-S67 WeakPolarHBondContact O-CB 3.44Å; R63-S67 PolarHBondContact O-N 2.85Å; R63-E136 IonicContact NH2-OE2 3.28Å; R63-E136 PolarHBondContact NH2-OE2 3Å
64	I	98.5	Very high	98.1	Very high	103 Å²	103	54.3 Å²	54.3	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-48.7	179.7	-68.8	167.3	0	0	0	110.1	A60 S61 W62 S66 S67 I68	A60-I64 WeakPolarHBondContact O-CG1 3.47Å; A60-I64 PolarHBondContact O-N 3.47Å; A60-I64 VanDerWaalsContact O-N 3.09Å; S61-I64 PolarHBondContact O-N 2.7Å; W62-I64 PolarHBondContact O-N 3.19Å; I64-S66 PolarHBondContact O-N 3.09Å; I64-S67 PolarHBondContact O-N 3.09Å; I64-I68 HydrophobicContact CG2-CD1 3.85Å; I64-I68 WeakPolarHBondContact O-CG1 3.2Å; I64-I68 PolarHBondContact O-N 3.5Å
65	I	98.6	Very high	98.1	Very high	27 Å²	27	60 Å²	60	14%	0.138	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-41.5	-179.7	-63.8	-49.4	0	0	0	111.1	S61 W62 S67 I68 E69 I84 Y87 R88 I91	S61-I65 WeakPolarHBondContact O-CG1 3.48Å; S61-I65 PolarHBondContact O-N 3.23Å; W62-I65 PolarHBondContact O-N 2.86Å; I65-S67 VanDerWaalsContact C-N 3.31Å; I65-S67 PolarHBondContact O-N 3.16Å; I65-I68 HydrophobicContact CD1-CD1 4.24Å; I65-I68 PolarHBondContact O-N 2.66Å; I65-I68 VanDerWaalsContact O-N 3.16Å; I65-E69 PolarHBondContact O-N 3.14Å; I65-I84 HydrophobicContact CG2-CG2 3.81Å; I65-Y87 HydrophobicContact CD1-CD1 3.88Å; I65-Y87 HydrophobicContact CD1-CE1 3.8Å; I65-Y87 HydrophobicContact CG1-CD1 3.96Å; I65-Y87 HydrophobicContact CG1-CE1 3.94Å; I65-Y87 HydrophobicContact CG2-CD1 4.3Å; I65-R88 HydrophobicContact CG2-CB 3.82Å; I65-I91 HydrophobicContact CB-CD1 4.25Å; I65-I91 HydrophobicContact CG1-CD1 3.62Å
66	S	98.1	Very high	97.9	Very high	20 Å²	20	62.5 Å²	62.5	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-37.9	175.2	-57.5	0	0	0	0	112.1	W62 R63 I64 E69 Q70 R88	W62-S66 VanDerWaalsContact O-CB 3.32Å; W62-S66 WeakPolarHBondContact O-CB 3.43Å; W62-S66 PolarHBondContact O-N 3.39Å; W62-S66 PolarHBondContact O-OG 3.44Å; R63-S66 PolarHBondContact O-N 3.08Å; I64-S66 PolarHBondContact O-N 3.09Å; S66-E69 WeakPolarHBondContact O-CB 3.49Å; S66-E69 PolarHBondContact O-N 3.49Å; S66-Q70 WeakPolarHBondContact O-CG 3.17Å; S66-Q70 PolarHBondContact O-N 3.38Å; S66-Q70 VanDerWaalsContact O-N 3.14Å; S66-R88 WeakPolarHBondContact OG-CD 3.32Å
67	S	98.2	Very high	97.8	Very high	46 Å²	46	63.9 Å²	63.9	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-36.6	174.3	-176.7	0	0	0	0	112.8	R63 I64 I65 K71	R63-S67 WeakPolarHBondContact O-CB 3.44Å; R63-S67 PolarHBondContact O-N 2.85Å; I64-S67 PolarHBondContact O-N 3.09Å; I65-S67 VanDerWaalsContact C-N 3.31Å; I65-S67 PolarHBondContact O-N 3.16Å; S67-K71 VanDerWaalsContact O-CG 3.32Å; S67-K71 WeakPolarHBondContact O-CG 3.1Å; S67-K71 PolarHBondContact O-N 3.21Å; S67-K71 VanDerWaalsContact O-N 3.17Å
68	I	98.4	Very high	97.8	Very high	69 Å²	69	69.7 Å²	69.7	35%	0.354	36%	0.364	S	S	.	.	H	α-helix	trans	-67.1	-41.8	175.2	-66.7	167.7	0	0	0	110.1	I64 I65 Q70 K71 E72 I84	I64-I68 HydrophobicContact CG2-CD1 3.85Å; I64-I68 WeakPolarHBondContact O-CG1 3.2Å; I64-I68 PolarHBondContact O-N 3.5Å; I65-I68 HydrophobicContact CD1-CD1 4.24Å; I65-I68 PolarHBondContact O-N 2.66Å; I65-I68 VanDerWaalsContact O-N 3.16Å; I68-Q70 PolarHBondContact O-N 2.96Å; I68-K71 PolarHBondContact O-N 3.46Å; I68-E72 HydrophobicContact CG2-CG 4.4Å; I68-E72 PolarHBondContact O-N 3.2Å; I68-I84 HydrophobicContact CG2-CD1 3.85Å; I68-I84 HydrophobicContact CG2-CG1 4.48Å
69	E	98.1	Very high	97.7	Very high	12 Å²	12	73.3 Å²	73.3	6%	0.056	39%	0.388	C	S	.	.	H	α-helix	trans	-54.1	-54.5	174.3	-171.3	175.5	152	0	0	111.3	I65 S66 K71 E72 E73 I84 K85 R88	I65-E69 PolarHBondContact O-N 3.14Å; S66-E69 WeakPolarHBondContact O-CB 3.49Å; S66-E69 PolarHBondContact O-N 3.49Å; E69-K71 VanDerWaalsContact C-N 3.26Å; E69-K71 PolarHBondContact O-N 2.99Å; E69-E72 PolarHBondContact O-N 3.11Å; E69-E72 VanDerWaalsContact O-N 3.11Å; E69-E73 HydrophobicContact CG-CG 4.48Å; E69-E73 WeakPolarHBondContact O-CB 3.05Å; E69-E73 WeakPolarHBondContact O-CG 3.38Å; E69-E73 PolarHBondContact O-N 3.21Å; E69-I84 HydrophobicContact CB-CG2 3.6Å; E69-I84 HydrophobicContact CG-CG2 4.12Å; E69-K85 HydrophobicContact CG-CG 4.33Å; E69-K85 WeakPolarHBondContact OE1-CE 3.37Å; E69-K85 VanDerWaalsContact OE1-CG 3.23Å; E69-K85 WeakPolarHBondContact OE1-CG 3.49Å; E69-K85 IonicContact OE1-NZ 2.88Å; E69-R88 IonicContact OE1-CZ 3.72Å; E69-R88 IonicContact OE1-NE 3.23Å; E69-R88 IonicContact OE1-NH2 2.84Å; E69-R88 PolarHBondContact OE1-NH2 3.22Å; E69-R88 WeakPolarHBondContact OE2-CD 3.48Å; E69-R88 IonicContact OE2-CZ 3.92Å; E69-R88 IonicContact OE2-NE 2.95Å; E69-R88 PolarHBondContact OE2-NE 3.33Å; E69-R88 IonicContact OE2-NH2 2.79Å; E69-R88 PolarHBondContact OE2-NH2 2.86Å
70	Q	97.4	Very high	97.6	Very high	130 Å²	130	76.6 Å²	76.6	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-57.2	-38.7	178.9	-71.4	173.9	-4.2	0	0	112.5	S66 I68 S74	S66-Q70 WeakPolarHBondContact O-CG 3.17Å; S66-Q70 PolarHBondContact O-N 3.38Å; S66-Q70 VanDerWaalsContact O-N 3.14Å; I68-Q70 PolarHBondContact O-N 2.96Å; Q70-S74 PolarHBondContact O-N 3.32Å
71	K	97.8	Very high	97.6	Very high	119 Å²	119	75 Å²	75	52%	0.517	39%	0.39	S	S	.	.	H	α-helix	trans	-67.4	-42.4	177	-74.4	170.9	-177.5	170.3	0	112.1	S67 I68 E69 S74 K75	S67-K71 VanDerWaalsContact O-CG 3.32Å; S67-K71 WeakPolarHBondContact O-CG 3.1Å; S67-K71 PolarHBondContact O-N 3.21Å; S67-K71 VanDerWaalsContact O-N 3.17Å; I68-K71 PolarHBondContact O-N 3.46Å; E69-K71 VanDerWaalsContact C-N 3.26Å; E69-K71 PolarHBondContact O-N 2.99Å; K71-S74 PolarHBondContact O-N 2.93Å; K71-S74 PolarHBondContact O-OG 3.49Å; K71-K75 WeakPolarHBondContact O-CG 3.37Å; K71-K75 PolarHBondContact O-N 3.35Å
72	E	98	Very high	97.6	Very high	25 Å²	25	75.9 Å²	75.9	12%	0.117	40%	0.4	C	S	.	.	H	α-helix	trans	-72.2	-34.3	178.1	-66.9	-59.5	116	0	0	111.9	I68 E69 S74 K75 G76 N77 H80 V81 I84	I68-E72 HydrophobicContact CG2-CG 4.4Å; I68-E72 PolarHBondContact O-N 3.2Å; E69-E72 PolarHBondContact O-N 3.11Å; E69-E72 VanDerWaalsContact O-N 3.11Å; E72-S74 VanDerWaalsContact C-N 3.34Å; E72-S74 PolarHBondContact O-N 3.33Å; E72-K75 PolarHBondContact O-N 2.95Å; E72-K75 IonicContact OE1-NZ 2.98Å; E72-K75 PolarHBondContact OE1-NZ 2.84Å; E72-G76 PolarHBondContact O-N 3.23Å; E72-N77 HydrophobicContact CB-CB 4.42Å; E72-N77 PolarHBondContact O-N 2.95Å; E72-N77 VanDerWaalsContact O-N 3.14Å; E72-N77 PolarHBondContact OE2-ND2 3.25Å; E72-H80 HydrophobicContact CB-CB 4.43Å; E72-H80 HydrophobicContact CG-CB 4.36Å; E72-H80 IonicContact OE2-CG 2.98Å; E72-H80 IonicContact OE2-ND1 3.52Å; E72-H80 PolarHBondContact OE2-ND1 3.02Å; E72-V81 HydrophobicContact CB-CG2 3.87Å; E72-I84 HydrophobicContact CB-CD1 3.95Å; E72-I84 HydrophobicContact CG-CD1 3.61Å
73	E	97	Very high	97.6	Very high	86 Å²	86	79.8 Å²	79.8	40%	0.402	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-44.2	170.4	-75	-176.6	154.2	0	0	111	E69 K75 G76 V81 K85	E69-E73 HydrophobicContact CG-CG 4.48Å; E69-E73 WeakPolarHBondContact O-CB 3.05Å; E69-E73 WeakPolarHBondContact O-CG 3.38Å; E69-E73 PolarHBondContact O-N 3.21Å; E73-K75 PolarHBondContact O-N 3.1Å; E73-K75 VanDerWaalsContact O-N 3.16Å; E73-G76 PolarHBondContact O-N 3.35Å; E73-V81 HydrophobicContact CB-CG2 4.26Å; E73-V81 HydrophobicContact CG-CB 4.27Å; E73-V81 HydrophobicContact CG-CG1 3.65Å; E73-V81 HydrophobicContact CG-CG2 3.53Å; E73-K85 VanDerWaalsContact OE1-CE 3.29Å; E73-K85 WeakPolarHBondContact OE1-CE 3.5Å; E73-K85 IonicContact OE1-NZ 2.69Å; E73-K85 PolarHBondContact OE1-NZ 2.96Å
74	S	97.3	Very high	97.6	Very high	101 Å²	101	76.1 Å²	76.1	71%	0.706	41%	0.41	S	S	*	.	H	α-helix	trans	-64.2	-20.2	177.9	76.5	0	0	0	0	114.3	Q70 K71 E72	Q70-S74 PolarHBondContact O-N 3.32Å; K71-S74 PolarHBondContact O-N 2.93Å; K71-S74 PolarHBondContact O-OG 3.49Å; E72-S74 VanDerWaalsContact C-N 3.34Å; E72-S74 PolarHBondContact O-N 3.33Å
75	K	97	Very high	97.6	Very high	130 Å²	130	75.4 Å²	75.4	57%	0.565	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.3	175.9	-65.3	172	-168.8	167.9	0	113.2	K71 E72 E73 N77	K71-K75 WeakPolarHBondContact O-CG 3.37Å; K71-K75 PolarHBondContact O-N 3.35Å; E72-K75 PolarHBondContact O-N 2.95Å; E72-K75 IonicContact OE1-NZ 2.98Å; E72-K75 PolarHBondContact OE1-NZ 2.84Å; E73-K75 PolarHBondContact O-N 3.1Å; E73-K75 VanDerWaalsContact O-N 3.16Å; K75-N77 VanDerWaalsContact C-N 3.31Å
76	G	95.8	Very high	97.6	Very high	55 Å²	55	80.3 Å²	80.3	57%	0.567	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	22	-173.2	0	0	0	0	0	114	E72 E73 E78	E72-G76 PolarHBondContact O-N 3.23Å; E73-G76 PolarHBondContact O-N 3.35Å; G76-E78 VanDerWaalsContact C-N 3.27Å; G76-E78 PolarHBondContact O-N 3.44Å
77	N	96.2	Very high	97.6	Very high	60 Å²	60	85.1 Å²	85.1	32%	0.321	45%	0.445	S	S	.	.			trans	-82.2	67.8	-178.8	-69.9	-17.8	0	0	0	111.1	E72 K75 D79 H80 V81	E72-N77 HydrophobicContact CB-CB 4.42Å; E72-N77 PolarHBondContact O-N 2.95Å; E72-N77 VanDerWaalsContact O-N 3.14Å; E72-N77 PolarHBondContact OE2-ND2 3.25Å; K75-N77 VanDerWaalsContact C-N 3.31Å; N77-D79 VanDerWaalsContact C-N 3.31Å; N77-D79 PolarHBondContact O-N 3.48Å; N77-H80 HydrophobicContact CB-CB 4.07Å; N77-H80 PolarHBondContact O-N 3.5Å; N77-V81 WeakPolarHBondContact O-CG2 3.39Å; N77-V81 PolarHBondContact O-N 3.34Å
78	E	96.2	Very high	97.6	Very high	162 Å²	162	85.8 Å²	85.8	76%	0.757	44%	0.441	S	S	*	.	H	α-helix	trans	-53.9	-41.9	-171.7	-65.1	-174.2	174.2	0	0	113.8	G76 H80 V81 A82	G76-E78 VanDerWaalsContact C-N 3.27Å; G76-E78 PolarHBondContact O-N 3.44Å; E78-H80 PolarHBondContact O-N 3.34Å; E78-V81 PolarHBondContact O-N 3.43Å; E78-A82 PolarHBondContact O-N 3.03Å
79	D	96.7	Very high	97.6	Very high	136 Å²	136	83.7 Å²	83.7	73%	0.727	44%	0.436	S	S	*	.	H	α-helix	trans	-62.7	-42.1	178.1	-70.4	-24.4	0	0	0	112.2	N77 A82 I83	N77-D79 VanDerWaalsContact C-N 3.31Å; N77-D79 PolarHBondContact O-N 3.48Å; D79-A82 PolarHBondContact O-N 2.88Å; D79-I83 WeakPolarHBondContact O-CG1 3.31Å; D79-I83 PolarHBondContact O-N 2.88Å
80	H	97.7	Very high	97.6	Very high	102 Å²	102	88.9 Å²	88.9	47%	0.472	46%	0.459	S	S	.	.	H	α-helix	trans	-66.9	-42.7	175.8	-69	179.1	0	0	0	111	E72 N77 E78 A82 I83 I84	E72-H80 HydrophobicContact CB-CB 4.43Å; E72-H80 HydrophobicContact CG-CB 4.36Å; E72-H80 IonicContact OE2-CG 2.98Å; E72-H80 IonicContact OE2-ND1 3.52Å; E72-H80 PolarHBondContact OE2-ND1 3.02Å; N77-H80 HydrophobicContact CB-CB 4.07Å; N77-H80 PolarHBondContact O-N 3.5Å; E78-H80 PolarHBondContact O-N 3.34Å; H80-A82 VanDerWaalsContact C-N 3.28Å; H80-A82 PolarHBondContact O-N 2.85Å; H80-I83 PolarHBondContact O-N 3.37Å; H80-I84 HydrophobicContact CB-CD1 4.35Å; H80-I84 WeakPolarHBondContact O-CB 3.08Å; H80-I84 WeakPolarHBondContact O-CD1 3.43Å; H80-I84 WeakPolarHBondContact O-CG1 3.47Å; H80-I84 PolarHBondContact O-N 3.22Å
81	V	98.3	Very high	97.7	Very high	12 Å²	12	82.9 Å²	82.9	7%	0.073	43%	0.43	C	S	.	.	H	α-helix	trans	-58.8	-41.5	178.7	171.6	0	0	0	0	110.8	E72 E73 N77 E78 I84 K85	E72-V81 HydrophobicContact CB-CG2 3.87Å; E73-V81 HydrophobicContact CB-CG2 4.26Å; E73-V81 HydrophobicContact CG-CB 4.27Å; E73-V81 HydrophobicContact CG-CG1 3.65Å; E73-V81 HydrophobicContact CG-CG2 3.53Å; N77-V81 WeakPolarHBondContact O-CG2 3.39Å; N77-V81 PolarHBondContact O-N 3.34Å; E78-V81 PolarHBondContact O-N 3.43Å; V81-I84 PolarHBondContact O-N 3Å; V81-K85 HydrophobicContact CG1-CD 3.93Å; V81-K85 HydrophobicContact CG1-CG 4.41Å; V81-K85 WeakPolarHBondContact O-CB 3.46Å; V81-K85 WeakPolarHBondContact O-CG 3.34Å; V81-K85 PolarHBondContact O-N 2.99Å
82	A	97.9	Very high	97.7	Very high	61 Å²	61	78.9 Å²	78.9	50%	0.504	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-45.5	176.5	0	0	0	0	0	112.3	E78 D79 H80 K85 D86	E78-A82 PolarHBondContact O-N 3.03Å; D79-A82 PolarHBondContact O-N 2.88Å; H80-A82 VanDerWaalsContact C-N 3.28Å; H80-A82 PolarHBondContact O-N 2.85Å; A82-K85 PolarHBondContact O-N 3.36Å; A82-D86 PolarHBondContact O-N 2.94Å
83	I	98.2	Very high	97.8	Very high	118 Å²	118	80.8 Å²	80.8	61%	0.605	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-42.2	177.2	-63.8	166.7	0	0	0	111	D79 H80 D86 Y87	D79-I83 WeakPolarHBondContact O-CG1 3.31Å; D79-I83 PolarHBondContact O-N 2.88Å; H80-I83 PolarHBondContact O-N 3.37Å; I83-D86 PolarHBondContact O-N 2.89Å; I83-Y87 PolarHBondContact O-N 2.89Å; I83-Y87 VanDerWaalsContact O-N 3.1Å
84	I	98.5	Very high	97.8	Very high	24 Å²	24	80 Å²	80	12%	0.123	43%	0.426	C	S	.	.	H	α-helix	trans	-65.6	-40.9	179.9	-67.3	159.6	0	0	0	110.9	I65 I68 E69 E72 H80 V81 D86 Y87 R88	I65-I84 HydrophobicContact CG2-CG2 3.81Å; I68-I84 HydrophobicContact CG2-CD1 3.85Å; I68-I84 HydrophobicContact CG2-CG1 4.48Å; E69-I84 HydrophobicContact CB-CG2 3.6Å; E69-I84 HydrophobicContact CG-CG2 4.12Å; E72-I84 HydrophobicContact CB-CD1 3.95Å; E72-I84 HydrophobicContact CG-CD1 3.61Å; H80-I84 HydrophobicContact CB-CD1 4.35Å; H80-I84 WeakPolarHBondContact O-CB 3.08Å; H80-I84 WeakPolarHBondContact O-CD1 3.43Å; H80-I84 WeakPolarHBondContact O-CG1 3.47Å; H80-I84 PolarHBondContact O-N 3.22Å; V81-I84 PolarHBondContact O-N 3Å; I84-D86 PolarHBondContact O-N 3.36Å; I84-Y87 PolarHBondContact O-N 3.43Å; I84-R88 WeakPolarHBondContact O-CB 3.46Å; I84-R88 PolarHBondContact O-N 3.38Å
85	K	98.2	Very high	97.9	Very high	88 Å²	88	75.1 Å²	75.1	38%	0.383	39%	0.392	S	S	.	.	H	α-helix	trans	-60.7	-43.3	176.5	-80.8	174.9	178.5	165.5	0	112.3	E69 E73 V81 A82 R88 G89	E69-K85 HydrophobicContact CG-CG 4.33Å; E69-K85 WeakPolarHBondContact OE1-CE 3.37Å; E69-K85 VanDerWaalsContact OE1-CG 3.23Å; E69-K85 WeakPolarHBondContact OE1-CG 3.49Å; E69-K85 IonicContact OE1-NZ 2.88Å; E73-K85 VanDerWaalsContact OE1-CE 3.29Å; E73-K85 WeakPolarHBondContact OE1-CE 3.5Å; E73-K85 IonicContact OE1-NZ 2.69Å; E73-K85 PolarHBondContact OE1-NZ 2.96Å; V81-K85 HydrophobicContact CG1-CD 3.93Å; V81-K85 HydrophobicContact CG1-CG 4.41Å; V81-K85 WeakPolarHBondContact O-CB 3.46Å; V81-K85 WeakPolarHBondContact O-CG 3.34Å; V81-K85 PolarHBondContact O-N 2.99Å; A82-K85 PolarHBondContact O-N 3.36Å; K85-R88 PolarHBondContact O-N 3.21Å; K85-G89 PolarHBondContact O-N 3.4Å
86	D	98.3	Very high	98	Very high	130 Å²	130	69.7 Å²	69.7	70%	0.695	37%	0.371	S	S	*	.	H	α-helix	trans	-61.7	-46.7	175.4	-176.1	67.2	0	0	0	111.4	A82 I83 I84 R88 G89 K90	A82-D86 PolarHBondContact O-N 2.94Å; I83-D86 PolarHBondContact O-N 2.89Å; I84-D86 PolarHBondContact O-N 3.36Å; D86-R88 PolarHBondContact O-N 2.92Å; D86-G89 PolarHBondContact O-N 3.49Å; D86-K90 PolarHBondContact O-N 3.46Å; D86-K90 VanDerWaalsContact O-N 3.08Å
87	Y	98.5	Very high	98.1	Very high	122 Å²	122	74.4 Å²	74.4	48%	0.478	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-38.9	178.2	-171.5	-125	0	0	0	112.8	I65 I83 I84 K90 I91	I65-Y87 HydrophobicContact CD1-CD1 3.88Å; I65-Y87 HydrophobicContact CD1-CE1 3.8Å; I65-Y87 HydrophobicContact CG1-CD1 3.96Å; I65-Y87 HydrophobicContact CG1-CE1 3.94Å; I65-Y87 HydrophobicContact CG2-CD1 4.3Å; I83-Y87 PolarHBondContact O-N 2.89Å; I83-Y87 VanDerWaalsContact O-N 3.1Å; I84-Y87 PolarHBondContact O-N 3.43Å; Y87-K90 WeakPolarHBondContact O-CB 3.35Å; Y87-K90 PolarHBondContact O-N 3.21Å; Y87-I91 HydrophobicContact CD1-CD1 4.24Å; Y87-I91 HydrophobicContact CE1-CD1 3.94Å; Y87-I91 PolarHBondContact O-N 3.41Å
88	R	98.3	Very high	98.2	Very high	59 Å²	59	72.7 Å²	72.7	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-45.2	172	-178.1	172.9	55.3	110	-16.1	111.1	I65 S66 E69 I84 K85 D86 K90 I91 E92	I65-R88 HydrophobicContact CG2-CB 3.82Å; S66-R88 WeakPolarHBondContact OG-CD 3.32Å; E69-R88 IonicContact OE1-CZ 3.72Å; E69-R88 IonicContact OE1-NE 3.23Å; E69-R88 IonicContact OE1-NH2 2.84Å; E69-R88 PolarHBondContact OE1-NH2 3.22Å; E69-R88 WeakPolarHBondContact OE2-CD 3.48Å; E69-R88 IonicContact OE2-CZ 3.92Å; E69-R88 IonicContact OE2-NE 2.95Å; E69-R88 PolarHBondContact OE2-NE 3.33Å; E69-R88 IonicContact OE2-NH2 2.79Å; E69-R88 PolarHBondContact OE2-NH2 2.86Å; I84-R88 WeakPolarHBondContact O-CB 3.46Å; I84-R88 PolarHBondContact O-N 3.38Å; K85-R88 PolarHBondContact O-N 3.21Å; D86-R88 PolarHBondContact O-N 2.92Å; R88-K90 VanDerWaalsContact C-N 3.25Å; R88-K90 PolarHBondContact O-N 3.19Å; R88-I91 WeakPolarHBondContact O-CB 3.36Å; R88-I91 PolarHBondContact O-N 3.02Å; R88-E92 WeakPolarHBondContact CD-OE1 3.23Å; R88-E92 HydrophobicContact CG-CG 4.24Å; R88-E92 WeakPolarHBondContact CG-OE1 3.37Å; R88-E92 IonicContact CZ-OE1 3.78Å; R88-E92 IonicContact NE-OE1 2.76Å; R88-E92 IonicContact NH1-OE1 3.89Å; R88-E92 PolarHBondContact NH1-OE1 2.9Å; R88-E92 WeakPolarHBondContact O-CG 3.39Å; R88-E92 PolarHBondContact O-N 3.29Å
89	G	98.3	Very high	98.3	Very high	25 Å²	25	65 Å²	65	26%	0.258	33%	0.33	S	S	.	.	H	α-helix	trans	-59.3	-34.8	177.5	0	0	0	0	0	113.3	K85 D86 E92 S93	K85-G89 PolarHBondContact O-N 3.4Å; D86-G89 PolarHBondContact O-N 3.49Å; G89-E92 PolarHBondContact O-N 2.92Å; G89-S93 WeakPolarHBondContact O-CB 3.44Å; G89-S93 PolarHBondContact O-N 2.77Å; G89-S93 PolarHBondContact O-OG 2.85Å
90	K	98.6	Very high	98.4	Very high	122 Å²	122	62.1 Å²	62.1	53%	0.53	32%	0.315	S	S	.	.	H	α-helix	trans	-62.5	-46.8	170.9	-176.9	-178.7	174.7	-178	0	111.8	D86 Y87 R88 E92 S93 E94	D86-K90 PolarHBondContact O-N 3.46Å; D86-K90 VanDerWaalsContact O-N 3.08Å; Y87-K90 WeakPolarHBondContact O-CB 3.35Å; Y87-K90 PolarHBondContact O-N 3.21Å; R88-K90 VanDerWaalsContact C-N 3.25Å; R88-K90 PolarHBondContact O-N 3.19Å; K90-E92 VanDerWaalsContact C-N 3.35Å; K90-S93 WeakPolarHBondContact O-CB 3.41Å; K90-S93 PolarHBondContact O-N 3.27Å; K90-E94 VanDerWaalsContact CE-OE1 3.28Å; K90-E94 WeakPolarHBondContact CE-OE1 3.41Å; K90-E94 WeakPolarHBondContact O-CG 3.4Å; K90-E94 PolarHBondContact O-N 2.97Å
91	I	98.7	Very high	98.4	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-40.5	178.4	-61.8	168.3	0	0	0	110.8	W62 I65 Y87 R88 S93 E94 L95	W62-I91 HydrophobicContact CB-CG2 3.75Å; I65-I91 HydrophobicContact CB-CD1 4.25Å; I65-I91 HydrophobicContact CG1-CD1 3.62Å; Y87-I91 HydrophobicContact CD1-CD1 4.24Å; Y87-I91 HydrophobicContact CE1-CD1 3.94Å; Y87-I91 PolarHBondContact O-N 3.41Å; R88-I91 WeakPolarHBondContact O-CB 3.36Å; R88-I91 PolarHBondContact O-N 3.02Å; I91-S93 VanDerWaalsContact C-N 3.28Å; I91-S93 PolarHBondContact O-N 3.46Å; I91-E94 WeakPolarHBondContact O-CB 3.41Å; I91-E94 PolarHBondContact O-N 3.46Å; I91-E94 VanDerWaalsContact O-N 3.17Å; I91-L95 HydrophobicContact CG2-CD1 4.28Å; I91-L95 HydrophobicContact CG2-CG 4.46Å; I91-L95 WeakPolarHBondContact O-CB 3.33Å; I91-L95 WeakPolarHBondContact O-CG 3.33Å; I91-L95 PolarHBondContact O-N 2.93Å
92	E	98.7	Very high	98.4	Very high	36 Å²	36	57.6 Å²	57.6	17%	0.168	30%	0.298	C	S	.	.	H	α-helix	trans	-62.7	-35.6	175.7	-70.8	173.8	176.8	0	0	112	W62 R88 G89 K90 S96 F137	W62-E92 PolarHBondContact NE1-OE1 3Å; R88-E92 WeakPolarHBondContact CD-OE1 3.23Å; R88-E92 HydrophobicContact CG-CG 4.24Å; R88-E92 WeakPolarHBondContact CG-OE1 3.37Å; R88-E92 IonicContact CZ-OE1 3.78Å; R88-E92 IonicContact NE-OE1 2.76Å; R88-E92 IonicContact NH1-OE1 3.89Å; R88-E92 PolarHBondContact NH1-OE1 2.9Å; R88-E92 WeakPolarHBondContact O-CG 3.39Å; R88-E92 PolarHBondContact O-N 3.29Å; G89-E92 PolarHBondContact O-N 2.92Å; K90-E92 VanDerWaalsContact C-N 3.35Å; E92-S96 WeakPolarHBondContact O-CB 3.48Å; E92-S96 PolarHBondContact O-N 2.89Å; E92-S96 PolarHBondContact O-OG 2.75Å; E92-F137 HydrophobicContact CB-CD2 3.73Å; E92-F137 HydrophobicContact CB-CE2 3.95Å; E92-F137 HydrophobicContact CG-CB 4.16Å; E92-F137 HydrophobicContact CG-CD2 3.65Å; E92-F137 HydrophobicContact CG-CE2 4.36Å; E92-F137 HydrophobicContact CG-CG 4.13Å; E92-F137 WeakPolarHBondContact O-CE2 3.47Å
93	S	98.6	Very high	98.5	Very high	64 Å²	64	55.2 Å²	55.2	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-39.1	173	-60.2	0	0	0	0	112.1	G89 K90 I91 K97	G89-S93 WeakPolarHBondContact O-CB 3.44Å; G89-S93 PolarHBondContact O-N 2.77Å; G89-S93 PolarHBondContact O-OG 2.85Å; K90-S93 WeakPolarHBondContact O-CB 3.41Å; K90-S93 PolarHBondContact O-N 3.27Å; I91-S93 VanDerWaalsContact C-N 3.28Å; I91-S93 PolarHBondContact O-N 3.46Å; S93-K97 VanDerWaalsContact O-CG 3.3Å; S93-K97 WeakPolarHBondContact O-CG 3.34Å; S93-K97 PolarHBondContact O-N 3.46Å; S93-K97 VanDerWaalsContact O-N 3.11Å
94	E	98.6	Very high	98.5	Very high	69 Å²	69	54.3 Å²	54.3	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-65.8	-44.9	173.8	-69.1	168.6	-170.2	0	0	111.4	R58 K90 I91 S96 K97 I98	R58-E94 HydrophobicContact CG-CB 4.38Å; K90-E94 VanDerWaalsContact CE-OE1 3.28Å; K90-E94 WeakPolarHBondContact CE-OE1 3.41Å; K90-E94 WeakPolarHBondContact O-CG 3.4Å; K90-E94 PolarHBondContact O-N 2.97Å; I91-E94 WeakPolarHBondContact O-CB 3.41Å; I91-E94 PolarHBondContact O-N 3.46Å; I91-E94 VanDerWaalsContact O-N 3.17Å; E94-S96 PolarHBondContact O-N 2.96Å; E94-K97 PolarHBondContact O-N 3.29Å; E94-I98 WeakPolarHBondContact O-CD1 3.4Å; E94-I98 VanDerWaalsContact O-CG1 3.3Å; E94-I98 WeakPolarHBondContact O-CG1 3.48Å; E94-I98 PolarHBondContact O-N 3.23Å
95	L	98.7	Very high	98.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-47.2	174.1	-79.2	171.5	0	0	0	111.9	I55 R58 R59 W62 I91 K97 I98 C99 F137	I55-L95 HydrophobicContact CD1-CD2 3.55Å; I55-L95 HydrophobicContact CG1-CD2 4.24Å; R58-L95 HydrophobicContact CB-CD2 3.67Å; R58-L95 HydrophobicContact CB-CG 4.17Å; R59-L95 HydrophobicContact CB-CD2 4.45Å; R59-L95 HydrophobicContact CG-CD2 3.58Å; W62-L95 HydrophobicContact CB-CD1 3.75Å; W62-L95 HydrophobicContact CG-CD1 3.9Å; I91-L95 HydrophobicContact CG2-CD1 4.28Å; I91-L95 HydrophobicContact CG2-CG 4.46Å; I91-L95 WeakPolarHBondContact O-CB 3.33Å; I91-L95 WeakPolarHBondContact O-CG 3.33Å; I91-L95 PolarHBondContact O-N 2.93Å; L95-K97 VanDerWaalsContact C-N 3.34Å; L95-K97 PolarHBondContact O-N 2.84Å; L95-I98 PolarHBondContact O-N 3.1Å; L95-C99 PolarHBondContact O-N 2.95Å; L95-C99 PolarHBondContact O-SG 3.31Å; L95-C99 VanDerWaalsContact O-SG 3.4Å; L95-F137 HydrophobicContact CB-CD1 4.42Å; L95-F137 HydrophobicContact CB-CE1 3.69Å; L95-F137 HydrophobicContact CB-CE2 4.49Å; L95-F137 HydrophobicContact CB-CZ 3.73Å; L95-F137 HydrophobicContact CD1-CD1 3.96Å; L95-F137 HydrophobicContact CD1-CE1 4.06Å; L95-F137 HydrophobicContact CD1-CG 4.46Å; L95-F137 HydrophobicContact CG-CE1 4.45Å
96	S	98.6	Very high	98.5	Very high	16 Å²	16	49.2 Å²	49.2	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-48	178.2	-57.5	0	0	0	0	110.6	E92 E94 I98 C99 D100 F137	E92-S96 WeakPolarHBondContact O-CB 3.48Å; E92-S96 PolarHBondContact O-N 2.89Å; E92-S96 PolarHBondContact O-OG 2.75Å; E94-S96 PolarHBondContact O-N 2.96Å; S96-I98 VanDerWaalsContact C-N 3.33Å; S96-I98 PolarHBondContact O-N 3.44Å; S96-C99 PolarHBondContact O-N 3.39Å; S96-D100 WeakPolarHBondContact O-CB 3.48Å; S96-D100 PolarHBondContact O-N 3.04Å; S96-F137 WeakPolarHBondContact OG-CE2 3.36Å; S96-F137 WeakPolarHBondContact OG-CZ 3.41Å
97	K	98.6	Very high	98.5	Very high	153 Å²	153	47.2 Å²	47.2	67%	0.665	24%	0.237	S	C	*	.	H	α-helix	trans	-58.8	-41.3	177.5	-72.3	171.4	-175.8	177.4	0	113.2	S93 E94 L95 G101	S93-K97 VanDerWaalsContact O-CG 3.3Å; S93-K97 WeakPolarHBondContact O-CG 3.34Å; S93-K97 PolarHBondContact O-N 3.46Å; S93-K97 VanDerWaalsContact O-N 3.11Å; E94-K97 PolarHBondContact O-N 3.29Å; L95-K97 VanDerWaalsContact C-N 3.34Å; L95-K97 PolarHBondContact O-N 2.84Å; K97-G101 PolarHBondContact O-N 3.02Å
98	I	98.6	Very high	98.4	Very high	25 Å²	25	44.4 Å²	44.4	13%	0.128	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-45.8	178.2	-63.1	156.4	0	0	0	110.2	Y51 V54 I55 R58 E94 L95 S96 G101 I102 Y130	Y51-I98 HydrophobicContact CD1-CG2 4.04Å; Y51-I98 HydrophobicContact CE1-CG2 4.23Å; V54-I98 HydrophobicContact CG1-CD1 3.68Å; V54-I98 HydrophobicContact CG1-CG1 3.92Å; V54-I98 HydrophobicContact CG1-CG2 4.26Å; I55-I98 HydrophobicContact CB-CG2 4Å; I55-I98 HydrophobicContact CD1-CB 3.76Å; I55-I98 HydrophobicContact CD1-CD1 4.29Å; I55-I98 HydrophobicContact CD1-CG2 3.56Å; I55-I98 HydrophobicContact CG1-CG2 4.33Å; R58-I98 HydrophobicContact CB-CD1 4.06Å; R58-I98 HydrophobicContact CG-CD1 3.83Å; E94-I98 WeakPolarHBondContact O-CD1 3.4Å; E94-I98 VanDerWaalsContact O-CG1 3.3Å; E94-I98 WeakPolarHBondContact O-CG1 3.48Å; E94-I98 PolarHBondContact O-N 3.23Å; L95-I98 PolarHBondContact O-N 3.1Å; S96-I98 VanDerWaalsContact C-N 3.33Å; S96-I98 PolarHBondContact O-N 3.44Å; I98-G101 PolarHBondContact O-N 2.82Å; I98-I102 PolarHBondContact O-N 3.21Å; I98-Y130 HydrophobicContact CG2-CE1 4.49Å
99	C	98.7	Very high	98.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-48	176.7	-69.3	0	0	0	0	111.6	L95 S96 G101 I102 L103 Y130 L134	L95-C99 PolarHBondContact O-N 2.95Å; L95-C99 PolarHBondContact O-SG 3.31Å; L95-C99 VanDerWaalsContact O-SG 3.4Å; S96-C99 PolarHBondContact O-N 3.39Å; C99-G101 VanDerWaalsContact C-N 3.29Å; C99-G101 PolarHBondContact O-N 3.32Å; C99-I102 VanDerWaalsContact O-CG2 3.23Å; C99-I102 WeakPolarHBondContact O-CG2 3.28Å; C99-I102 PolarHBondContact O-N 3.31Å; C99-L103 HydrophobicContact CB-CD1 4.45Å; C99-L103 VanDerWaalsContact O-CB 3.3Å; C99-L103 WeakPolarHBondContact O-CB 3.45Å; C99-L103 WeakPolarHBondContact O-CG 3.29Å; C99-L103 PolarHBondContact O-N 2.92Å; C99-Y130 HydrophobicContact CB-CD1 4.31Å; C99-L134 HydrophobicContact CB-CD1 4.11Å; C99-L134 HydrophobicContact CB-CD2 3.66Å; C99-L134 HydrophobicContact CB-CG 3.76Å
100	D	98.4	Very high	98.3	Very high	76 Å²	76	42.6 Å²	42.6	41%	0.406	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-39.2	179.8	-63.6	-20.1	0	0	0	111.1	S96 L103 N104	S96-D100 WeakPolarHBondContact O-CB 3.48Å; S96-D100 PolarHBondContact O-N 3.04Å; D100-L103 PolarHBondContact O-N 3.34Å; D100-N104 VanDerWaalsContact O-CB 3.27Å; D100-N104 WeakPolarHBondContact O-CB 3.11Å; D100-N104 PolarHBondContact O-N 3.11Å; D100-N104 PolarHBondContact O-ND2 3.45Å
101	G	98	Very high	98.2	Very high	19 Å²	19	39 Å²	39	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-55.3	-55.2	176	0	0	0	0	0	112.7	Y51 K97 I98 C99 V105	Y51-G101 VanDerWaalsContact OH-C 3.26Å; K97-G101 PolarHBondContact O-N 3.02Å; I98-G101 PolarHBondContact O-N 2.82Å; C99-G101 VanDerWaalsContact C-N 3.29Å; C99-G101 PolarHBondContact O-N 3.32Å; G101-V105 WeakPolarHBondContact O-CG2 3.08Å; G101-V105 PolarHBondContact O-N 2.8Å
102	I	98.5	Very high	98.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-71.2	-38.5	-179.8	-177	61.4	0	0	0	112.7	L47 Y51 I98 C99 N104 V105 L106 M126 Y130	L47-I102 HydrophobicContact CD2-CD1 4.36Å; Y51-I102 HydrophobicContact CD1-CB 3.74Å; Y51-I102 HydrophobicContact CD1-CG1 4.43Å; Y51-I102 HydrophobicContact CD1-CG2 4.18Å; Y51-I102 HydrophobicContact CD2-CB 4.36Å; Y51-I102 HydrophobicContact CD2-CD1 3.84Å; Y51-I102 HydrophobicContact CD2-CG1 4.43Å; Y51-I102 HydrophobicContact CE1-CB 3.52Å; Y51-I102 HydrophobicContact CE1-CG2 4.14Å; Y51-I102 HydrophobicContact CE2-CB 4.16Å; Y51-I102 HydrophobicContact CE2-CD1 3.87Å; Y51-I102 HydrophobicContact CG-CB 4.13Å; Y51-I102 HydrophobicContact CG-CD1 4.24Å; Y51-I102 HydrophobicContact CG-CG1 4.36Å; Y51-I102 PolarHBondContact OH-N 2.95Å; I98-I102 PolarHBondContact O-N 3.21Å; C99-I102 VanDerWaalsContact O-CG2 3.23Å; C99-I102 WeakPolarHBondContact O-CG2 3.28Å; C99-I102 PolarHBondContact O-N 3.31Å; I102-N104 VanDerWaalsContact C-N 3.28Å; I102-N104 PolarHBondContact O-N 3.04Å; I102-V105 PolarHBondContact O-N 3.31Å; I102-V105 VanDerWaalsContact O-N 3.17Å; I102-L106 HydrophobicContact CD1-CD1 4.3Å; I102-L106 HydrophobicContact CD1-CG 4.01Å; I102-L106 HydrophobicContact CG1-CD1 3.77Å; I102-L106 HydrophobicContact CG1-CG 4.01Å; I102-L106 WeakPolarHBondContact O-CB 3.49Å; I102-L106 VanDerWaalsContact O-CG 3.25Å; I102-L106 WeakPolarHBondContact O-CG 3.27Å; I102-L106 PolarHBondContact O-N 2.98Å; I102-M126 HydrophobicContact CD1-CE 3.58Å; I102-M126 HydrophobicContact CD1-SD 3.99Å; I102-M126 HydrophobicContact CG1-CE 3.69Å; I102-M126 HydrophobicContact CG1-SD 4.17Å; I102-Y130 HydrophobicContact CG1-CD2 4.25Å; I102-Y130 HydrophobicContact CG1-CE2 4.24Å; I102-Y130 HydrophobicContact CG2-CD1 3.31Å; I102-Y130 HydrophobicContact CG2-CD2 3.64Å; I102-Y130 HydrophobicContact CG2-CE1 3.61Å; I102-Y130 HydrophobicContact CG2-CE2 3.97Å; I102-Y130 HydrophobicContact CG2-CG 3.33Å
103	L	98.7	Very high	97.9	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.052	24%	0.244	C	C	.	.	H	α-helix	trans	-60.2	-43	178.2	-72.2	171.2	0	0	0	110.4	C99 D100 V105 L106 E107 K127 L134	C99-L103 HydrophobicContact CB-CD1 4.45Å; C99-L103 VanDerWaalsContact O-CB 3.3Å; C99-L103 WeakPolarHBondContact O-CB 3.45Å; C99-L103 WeakPolarHBondContact O-CG 3.29Å; C99-L103 PolarHBondContact O-N 2.92Å; D100-L103 PolarHBondContact O-N 3.34Å; L103-V105 PolarHBondContact O-N 3.25Å; L103-L106 PolarHBondContact O-N 2.67Å; L103-E107 WeakPolarHBondContact O-CB 3.42Å; L103-E107 WeakPolarHBondContact O-CG 3.21Å; L103-E107 PolarHBondContact O-N 2.59Å; L103-K127 HydrophobicContact CD2-CB 4.47Å; L103-K127 HydrophobicContact CD2-CG 3.94Å; L103-L134 HydrophobicContact CD1-CD1 3.84Å
104	N	98.3	Very high	97.7	Very high	100 Å²	100	40.6 Å²	40.6	54%	0.535	23%	0.226	S	C	.	.	H	α-helix	trans	-60.7	-44.3	174.5	-74.2	-37.4	0	0	0	112.2	D100 I102 A108	D100-N104 VanDerWaalsContact O-CB 3.27Å; D100-N104 WeakPolarHBondContact O-CB 3.11Å; D100-N104 PolarHBondContact O-N 3.11Å; D100-N104 PolarHBondContact O-ND2 3.45Å; I102-N104 VanDerWaalsContact C-N 3.28Å; I102-N104 PolarHBondContact O-N 3.04Å; N104-A108 WeakPolarHBondContact O-CB 3.41Å; N104-A108 PolarHBondContact O-N 3.19Å
105	V	98.1	Very high	97.4	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-41.4	178.1	172.5	0	0	0	0	111.6	E28 A31 G101 I102 L103 H109 L110	E28-V105 HydrophobicContact CG-CG2 4.08Å; A31-V105 HydrophobicContact CB-CG1 3.49Å; A31-V105 VanDerWaalsContact CB-CG1 3.49Å; G101-V105 WeakPolarHBondContact O-CG2 3.08Å; G101-V105 PolarHBondContact O-N 2.8Å; I102-V105 PolarHBondContact O-N 3.31Å; I102-V105 VanDerWaalsContact O-N 3.17Å; L103-V105 PolarHBondContact O-N 3.25Å; V105-H109 WeakPolarHBondContact O-CB 3.47Å; V105-H109 PolarHBondContact O-N 2.88Å; V105-H109 VanDerWaalsContact O-N 3.11Å; V105-L110 HydrophobicContact CG1-CD1 3.82Å; V105-L110 HydrophobicContact CG1-CG 4.09Å; V105-L110 PolarHBondContact O-N 3.48Å
106	L	98.4	Very high	97.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-63	-49.2	177.8	-72.3	169.1	0	0	0	111.2	I102 L103 L110 I111 Y123 M126 K127	I102-L106 HydrophobicContact CD1-CD1 4.3Å; I102-L106 HydrophobicContact CD1-CG 4.01Å; I102-L106 HydrophobicContact CG1-CD1 3.77Å; I102-L106 HydrophobicContact CG1-CG 4.01Å; I102-L106 WeakPolarHBondContact O-CB 3.49Å; I102-L106 VanDerWaalsContact O-CG 3.25Å; I102-L106 WeakPolarHBondContact O-CG 3.27Å; I102-L106 PolarHBondContact O-N 2.98Å; L103-L106 PolarHBondContact O-N 2.67Å; L106-L110 HydrophobicContact CD2-CB 4.32Å; L106-L110 HydrophobicContact CD2-CD1 4.02Å; L106-L110 PolarHBondContact O-N 3.45Å; L106-I111 HydrophobicContact CB-CD1 4.04Å; L106-I111 HydrophobicContact CB-CG1 4.37Å; L106-I111 VanDerWaalsContact O-CB 3.32Å; L106-I111 WeakPolarHBondContact O-CB 3.41Å; L106-I111 WeakPolarHBondContact O-CG1 3.39Å; L106-I111 PolarHBondContact O-N 3.26Å; L106-Y123 HydrophobicContact CD2-CD1 3.78Å; L106-Y123 HydrophobicContact CD2-CG 4.12Å; L106-M126 HydrophobicContact CD1-CB 4.08Å; L106-M126 HydrophobicContact CD1-CG 4.05Å; L106-M126 HydrophobicContact CD1-SD 4.42Å; L106-M126 HydrophobicContact CD2-CB 4.34Å; L106-M126 HydrophobicContact CD2-SD 4.13Å; L106-K127 HydrophobicContact CD1-CB 4.1Å
107	E	97.9	Very high	97.2	Very high	88 Å²	88	44.4 Å²	44.4	41%	0.411	26%	0.259	S	S	.	.	I	π-helix	trans	-73.6	-40.8	-175.5	-68.9	-177.1	160.1	0	0	113	L103 P112 K127	L103-E107 WeakPolarHBondContact O-CB 3.42Å; L103-E107 WeakPolarHBondContact O-CG 3.21Å; L103-E107 PolarHBondContact O-N 2.59Å; E107-P112 WeakPolarHBondContact O-CD 2.99Å; E107-P112 VanDerWaalsContact O-CG 3.26Å; E107-P112 WeakPolarHBondContact O-CG 3.33Å; E107-K127 WeakPolarHBondContact OE1-CE 3.45Å; E107-K127 IonicContact OE1-NZ 2.8Å; E107-K127 PolarHBondContact OE1-NZ 2.54Å
108	A	96.9	Very high	97.1	Very high	63 Å²	63	40.7 Å²	40.7	52%	0.521	24%	0.244	S	C	.	.	I	π-helix	trans	-78.9	-29.6	-176.1	0	0	0	0	0	113.3	N104	N104-A108 WeakPolarHBondContact O-CB 3.41Å; N104-A108 PolarHBondContact O-N 3.19Å
109	H	96.8	Very high	97.1	Very high	45 Å²	45	39.9 Å²	39.9	21%	0.208	24%	0.241	C	C	.	.	I	π-helix	trans	-129.4	-55	-168.2	-58.2	-64.7	0	0	0	113.6	A31 V34 V105 S113	A31-H109 WeakPolarHBondContact O-CB 3.22Å; V34-H109 HydrophobicContact CG2-CB 3.76Å; V34-H109 WeakPolarHBondContact CG2-O 3.06Å; V105-H109 WeakPolarHBondContact O-CB 3.47Å; V105-H109 PolarHBondContact O-N 2.88Å; V105-H109 VanDerWaalsContact O-N 3.11Å; H109-S113 VanDerWaalsContact O-CB 3.31Å; H109-S113 WeakPolarHBondContact O-CB 3.48Å; H109-S113 PolarHBondContact O-N 3.32Å; H109-S113 PolarHBondContact O-OG 3.17Å
110	L	97.9	Very high	97.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-81.5	-43.9	-164.5	-57.9	178.1	0	0	0	114.2	A31 V34 L39 L47 V105 L106 S113 A114 Y123	A31-L110 HydrophobicContact CB-CD1 4.32Å; A31-L110 HydrophobicContact CB-CD2 3.98Å; A31-L110 HydrophobicContact CB-CG 4.38Å; V34-L110 HydrophobicContact CG1-CD2 3.83Å; L39-L110 HydrophobicContact CD1-CD1 4.44Å; L39-L110 HydrophobicContact CD1-CD2 3.61Å; L39-L110 HydrophobicContact CG-CD2 3.92Å; L47-L110 HydrophobicContact CD2-CD1 3.37Å; V105-L110 HydrophobicContact CG1-CD1 3.82Å; V105-L110 HydrophobicContact CG1-CG 4.09Å; V105-L110 PolarHBondContact O-N 3.48Å; L106-L110 HydrophobicContact CD2-CB 4.32Å; L106-L110 HydrophobicContact CD2-CD1 4.02Å; L106-L110 PolarHBondContact O-N 3.45Å; L110-S113 PolarHBondContact O-N 3.47Å; L110-S113 PolarHBondContact O-OG 2.99Å; L110-A114 WeakPolarHBondContact O-CB 3.42Å; L110-A114 PolarHBondContact O-N 3.45Å; L110-A114 VanDerWaalsContact O-N 3.1Å; L110-Y123 HydrophobicContact CB-CD1 3.98Å; L110-Y123 HydrophobicContact CB-CD2 3.94Å; L110-Y123 HydrophobicContact CB-CE1 4.02Å; L110-Y123 HydrophobicContact CB-CE2 3.98Å; L110-Y123 HydrophobicContact CB-CG 3.97Å; L110-Y123 HydrophobicContact CD1-CD1 4.11Å; L110-Y123 HydrophobicContact CD1-CE1 3.86Å; L110-Y123 HydrophobicContact CG-CE1 4.37Å; L110-Y123 WeakPolarHBondContact O-CD2 3.4Å
111	I	97.6	Very high	97.1	Very high	47 Å²	47	39.7 Å²	39.7	24%	0.241	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-44.6	177.6	-66.4	168.9	0	0	0	111	L106 S113 L124 K127	L106-I111 HydrophobicContact CB-CD1 4.04Å; L106-I111 HydrophobicContact CB-CG1 4.37Å; L106-I111 VanDerWaalsContact O-CB 3.32Å; L106-I111 WeakPolarHBondContact O-CB 3.41Å; L106-I111 WeakPolarHBondContact O-CG1 3.39Å; L106-I111 PolarHBondContact O-N 3.26Å; I111-S113 VanDerWaalsContact C-N 3.33Å; I111-S113 PolarHBondContact O-N 3.03Å; I111-L124 HydrophobicContact CD1-CD2 4.22Å; I111-L124 HydrophobicContact CG2-CD2 4.41Å; I111-K127 HydrophobicContact CD1-CB 4.26Å; I111-K127 HydrophobicContact CD1-CD 3.83Å
112	P	95.7	Very high	97.1	Very high	95 Å²	95	40.2 Å²	40.2	62%	0.617	23%	0.234	S	C	*	.	H	α-helix	trans	-65.4	-31.5	177.4	-24.1	35.3	0	0	0	114.6	E107	E107-P112 WeakPolarHBondContact O-CD 2.99Å; E107-P112 VanDerWaalsContact O-CG 3.26Å; E107-P112 WeakPolarHBondContact O-CG 3.33Å
113	S	93.7	Very high	97.1	Very high	33 Å²	33	40.2 Å²	40.2	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-87.1	-15.4	-178	58	0	0	0	0	114.1	H109 L110 I111 S115	H109-S113 VanDerWaalsContact O-CB 3.31Å; H109-S113 WeakPolarHBondContact O-CB 3.48Å; H109-S113 PolarHBondContact O-N 3.32Å; H109-S113 PolarHBondContact O-OG 3.17Å; L110-S113 PolarHBondContact O-N 3.47Å; L110-S113 PolarHBondContact O-OG 2.99Å; I111-S113 VanDerWaalsContact C-N 3.33Å; I111-S113 PolarHBondContact O-N 3.03Å; S113-S115 PolarHBondContact O-N 3.3Å
114	A	94.6	Very high	97.1	Very high	9 Å²	9	40.9 Å²	40.9	7%	0.074	24%	0.237	C	C	.	.			trans	-66.9	114.1	-176.1	0	0	0	0	0	112.7	L110 K120 Y123	L110-A114 WeakPolarHBondContact O-CB 3.42Å; L110-A114 PolarHBondContact O-N 3.45Å; L110-A114 VanDerWaalsContact O-N 3.1Å; A114-K120 HydrophobicContact CB-CG 3.79Å; A114-K120 WeakPolarHBondContact O-CE 3.12Å; A114-K120 WeakPolarHBondContact O-CG 3.35Å; A114-Y123 HydrophobicContact CB-CD2 3.74Å; A114-Y123 HydrophobicContact CB-CE2 3.91Å
115	S	93.5	Very high	97.1	Very high	85 Å²	85	37.9 Å²	37.9	59%	0.594	22%	0.219	S	C	*	.			trans	-95.2	-53.8	177	172.4	0	0	0	0	112.8	E38 S113 K120	E38-S115 PolarHBondContact OE2-N 3.36Å; S113-S115 PolarHBondContact O-N 3.3Å; S115-K120 WeakPolarHBondContact O-CE 3.46Å; S115-K120 PolarHBondContact O-NZ 3.02Å
116	P	95.4	Very high	97.2	Very high	65 Å²	65	38 Å²	38	42%	0.422	22%	0.22	S	C	.	.	S	Bend	trans	-63.3	146.3	178	-20.5	33.1	0	0	0	112.4	E38 E118 S119 K120	E38-P116 WeakPolarHBondContact OE1-CD 3.19Å; E38-P116 WeakPolarHBondContact OE2-CD 3.41Å; P116-E118 PolarHBondContact O-N 3.44Å; P116-S119 PolarHBondContact O-N 2.7Å; P116-S119 VanDerWaalsContact O-N 3.16Å; P116-K120 WeakPolarHBondContact O-CG 3.33Å; P116-K120 PolarHBondContact O-N 2.92Å; P116-K120 VanDerWaalsContact O-N 3.08Å
117	A	97.4	Very high	97.2	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	23%	0.229	C	C	.	.	H	α-helix	trans	-54.3	-42.6	174.9	0	0	0	0	0	111.9	S119 K120 V121 I160 E164 L165	A117-S119 PolarHBondContact O-N 3.23Å; A117-K120 PolarHBondContact O-N 2.98Å; A117-V121 VanDerWaalsContact O-CG2 3.29Å; A117-V121 WeakPolarHBondContact O-CG2 3.33Å; A117-V121 PolarHBondContact O-N 2.71Å; A117-I160 HydrophobicContact CB-CG2 4.18Å; A117-E164 HydrophobicContact CB-CB 3.61Å; A117-E164 HydrophobicContact CB-CG 4.28Å; A117-E164 WeakPolarHBondContact CB-OE2 3.25Å; A117-L165 HydrophobicContact CB-CD2 4.3Å
118	E	96.8	Very high	97.2	Very high	75 Å²	75	36 Å²	36	35%	0.35	21%	0.21	S	C	.	.	H	α-helix	trans	-56.5	-48.6	177	-71.2	-178.6	-157.2	0	0	112.7	P116 V121 F122 L165 H169 I171	P116-E118 PolarHBondContact O-N 3.44Å; E118-V121 PolarHBondContact O-N 3.4Å; E118-F122 WeakPolarHBondContact O-CB 3.48Å; E118-F122 PolarHBondContact O-N 3.12Å; E118-L165 HydrophobicContact CG-CD2 3.76Å; E118-H169 IonicContact OE1-NE2 2.62Å; E118-H169 PolarHBondContact OE1-NE2 3.45Å; E118-I171 HydrophobicContact CB-CD1 4.1Å; E118-I171 HydrophobicContact CG-CD1 4.46Å
119	S	97.4	Very high	97.3	Very high	8 Å²	8	33.6 Å²	33.6	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-45.2	177.8	-66.8	0	0	0	0	111.3	E38 P116 A117 F122 Y123	E38-S119 WeakPolarHBondContact OE1-CB 3.49Å; E38-S119 PolarHBondContact OE1-OG 3.3Å; P116-S119 PolarHBondContact O-N 2.7Å; P116-S119 VanDerWaalsContact O-N 3.16Å; A117-S119 PolarHBondContact O-N 3.23Å; S119-F122 WeakPolarHBondContact O-CB 3.39Å; S119-F122 PolarHBondContact O-N 2.85Å; S119-Y123 WeakPolarHBondContact O-CD2 3.31Å; S119-Y123 PolarHBondContact O-N 3.28Å
120	K	98.3	Very high	97.4	Very high	73 Å²	73	31.8 Å²	31.8	32%	0.317	18%	0.179	S	C	.	.	H	α-helix	trans	-59.4	-50.8	178.6	-68.3	173.1	-177	161.3	0	111.4	A114 S115 P116 A117 F122 Y123 L124 I160	A114-K120 HydrophobicContact CB-CG 3.79Å; A114-K120 WeakPolarHBondContact O-CE 3.12Å; A114-K120 WeakPolarHBondContact O-CG 3.35Å; S115-K120 WeakPolarHBondContact O-CE 3.46Å; S115-K120 PolarHBondContact O-NZ 3.02Å; P116-K120 WeakPolarHBondContact O-CG 3.33Å; P116-K120 PolarHBondContact O-N 2.92Å; P116-K120 VanDerWaalsContact O-N 3.08Å; A117-K120 PolarHBondContact O-N 2.98Å; K120-F122 VanDerWaalsContact C-N 3.32Å; K120-F122 PolarHBondContact O-N 3.12Å; K120-Y123 PolarHBondContact O-N 2.88Å; K120-L124 WeakPolarHBondContact O-CB 3.42Å; K120-L124 VanDerWaalsContact O-CG 3.27Å; K120-L124 WeakPolarHBondContact O-CG 3.44Å; K120-L124 PolarHBondContact O-N 3.41Å; K120-I160 HydrophobicContact CB-CD1 4.09Å; K120-I160 HydrophobicContact CD-CD1 4.43Å
121	V	98.7	Very high	97.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-41.2	178.8	-180	0	0	0	0	110.3	A117 E118 K125 A157 I160 A161 L165 I171 L175	A117-V121 VanDerWaalsContact O-CG2 3.29Å; A117-V121 WeakPolarHBondContact O-CG2 3.33Å; A117-V121 PolarHBondContact O-N 2.71Å; E118-V121 PolarHBondContact O-N 3.4Å; V121-K125 WeakPolarHBondContact O-CB 3.39Å; V121-K125 PolarHBondContact O-N 3.48Å; V121-A157 HydrophobicContact CG1-CB 4.36Å; V121-I160 HydrophobicContact CG2-CB 3.82Å; V121-I160 HydrophobicContact CG2-CG2 3.57Å; V121-A161 HydrophobicContact CG1-CB 3.86Å; V121-A161 HydrophobicContact CG2-CB 3.91Å; V121-L165 HydrophobicContact CB-CD1 4.18Å; V121-L165 HydrophobicContact CG1-CD1 4.26Å; V121-L165 HydrophobicContact CG2-CD1 3.96Å; V121-I171 HydrophobicContact CB-CG2 4.02Å; V121-I171 HydrophobicContact CG1-CG2 3.55Å; V121-L175 HydrophobicContact CG1-CD2 4.13Å
122	F	98.4	Very high	97.5	Very high	29 Å²	29	31.1 Å²	31.1	13%	0.127	18%	0.175	C	C	.	.	H	α-helix	trans	-58.7	-51.6	178.5	-170.6	-83.3	0	0	0	112	R44 E118 S119 K120 M126 I171	R44-F122 HydrophobicContact CG-CD1 3.59Å; R44-F122 HydrophobicContact CG-CE1 3.4Å; R44-F122 VanDerWaalsContact CG-CE1 3.4Å; R44-F122 HydrophobicContact CG-CE2 4.36Å; R44-F122 HydrophobicContact CG-CG 4.16Å; R44-F122 HydrophobicContact CG-CZ 3.81Å; E118-F122 WeakPolarHBondContact O-CB 3.48Å; E118-F122 PolarHBondContact O-N 3.12Å; S119-F122 WeakPolarHBondContact O-CB 3.39Å; S119-F122 PolarHBondContact O-N 2.85Å; K120-F122 VanDerWaalsContact C-N 3.32Å; K120-F122 PolarHBondContact O-N 3.12Å; F122-M126 HydrophobicContact CE1-SD 4.44Å; F122-M126 WeakPolarHBondContact O-CB 3.22Å; F122-M126 PolarHBondContact O-N 2.85Å; F122-I171 HydrophobicContact CB-CD1 4.35Å; F122-I171 HydrophobicContact CD2-CD1 4.05Å; F122-I171 HydrophobicContact CD2-CG1 4.39Å
123	Y	98.7	Very high	97.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.7	-38.1	-177.7	-60.3	-44.5	0	0	0	112.8	R44 L106 L110 A114 S119 K120 M126 K127	R44-Y123 HydrophobicContact CG-CE1 3.81Å; L106-Y123 HydrophobicContact CD2-CD1 3.78Å; L106-Y123 HydrophobicContact CD2-CG 4.12Å; L110-Y123 HydrophobicContact CB-CD1 3.98Å; L110-Y123 HydrophobicContact CB-CD2 3.94Å; L110-Y123 HydrophobicContact CB-CE1 4.02Å; L110-Y123 HydrophobicContact CB-CE2 3.98Å; L110-Y123 HydrophobicContact CB-CG 3.97Å; L110-Y123 HydrophobicContact CD1-CD1 4.11Å; L110-Y123 HydrophobicContact CD1-CE1 3.86Å; L110-Y123 HydrophobicContact CG-CE1 4.37Å; L110-Y123 WeakPolarHBondContact O-CD2 3.4Å; A114-Y123 HydrophobicContact CB-CD2 3.74Å; A114-Y123 HydrophobicContact CB-CE2 3.91Å; S119-Y123 WeakPolarHBondContact O-CD2 3.31Å; S119-Y123 PolarHBondContact O-N 3.28Å; K120-Y123 PolarHBondContact O-N 2.88Å; Y123-M126 PolarHBondContact O-N 3.32Å; Y123-K127 WeakPolarHBondContact O-CB 3.27Å; Y123-K127 PolarHBondContact O-N 2.9Å
124	L	98.8	Very high	97.9	Very high	25 Å²	25	27.2 Å²	27.2	13%	0.131	14%	0.144	C	C	.	.	H	α-helix	trans	-66.9	-40.2	175.1	-71.2	168.8	0	0	0	111.8	I111 K120 M126 K127 G128 A157 I160	I111-L124 HydrophobicContact CD1-CD2 4.22Å; I111-L124 HydrophobicContact CG2-CD2 4.41Å; K120-L124 WeakPolarHBondContact O-CB 3.42Å; K120-L124 VanDerWaalsContact O-CG 3.27Å; K120-L124 WeakPolarHBondContact O-CG 3.44Å; K120-L124 PolarHBondContact O-N 3.41Å; L124-M126 VanDerWaalsContact C-N 3.34Å; L124-K127 WeakPolarHBondContact O-CB 3.22Å; L124-K127 PolarHBondContact O-N 3.43Å; L124-G128 PolarHBondContact O-N 3.39Å; L124-A157 HydrophobicContact CB-CB 3.7Å; L124-I160 HydrophobicContact CD1-CD1 3.8Å
125	K	98.7	Very high	98.1	Very high	37 Å²	37	26.8 Å²	26.8	16%	0.161	14%	0.14	C	C	.	.	H	α-helix	trans	-58.9	-47.2	171.2	178.2	-170.5	172.6	-67.2	0	110.6	V121 K127 G128 D129 Y154 G174 L175 N178	V121-K125 WeakPolarHBondContact O-CB 3.39Å; V121-K125 PolarHBondContact O-N 3.48Å; K125-K127 VanDerWaalsContact C-N 3.34Å; K125-K127 PolarHBondContact O-N 3.43Å; K125-G128 PolarHBondContact O-N 2.97Å; K125-D129 IonicContact NZ-OD2 2.69Å; K125-D129 PolarHBondContact NZ-OD2 3Å; K125-D129 VanDerWaalsContact O-CG 3.25Å; K125-D129 PolarHBondContact O-N 2.69Å; K125-Y154 HydrophobicContact CG-CE1 4.42Å; K125-Y154 WeakPolarHBondContact O-CE1 3.32Å; K125-G174 WeakPolarHBondContact CE-O 3.41Å; K125-L175 HydrophobicContact CB-CD1 4.08Å; K125-L175 HydrophobicContact CD-CB 4.07Å; K125-L175 HydrophobicContact CG-CB 4.32Å; K125-L175 HydrophobicContact CG-CD1 3.99Å; K125-N178 PolarHBondContact NZ-ND2 2.71Å
126	M	98.6	Very high	98.3	Very high	7 Å²	7	23.8 Å²	23.8	3%	0.034	12%	0.117	C	C	.	.	H	α-helix	trans	-60.9	-44	178.2	-163.3	176.7	-171.3	0	0	111	I102 L106 F122 Y123 L124 G128 D129 Y130	I102-M126 HydrophobicContact CD1-CE 3.58Å; I102-M126 HydrophobicContact CD1-SD 3.99Å; I102-M126 HydrophobicContact CG1-CE 3.69Å; I102-M126 HydrophobicContact CG1-SD 4.17Å; L106-M126 HydrophobicContact CD1-CB 4.08Å; L106-M126 HydrophobicContact CD1-CG 4.05Å; L106-M126 HydrophobicContact CD1-SD 4.42Å; L106-M126 HydrophobicContact CD2-CB 4.34Å; L106-M126 HydrophobicContact CD2-SD 4.13Å; F122-M126 HydrophobicContact CE1-SD 4.44Å; F122-M126 WeakPolarHBondContact O-CB 3.22Å; F122-M126 PolarHBondContact O-N 2.85Å; Y123-M126 PolarHBondContact O-N 3.32Å; L124-M126 VanDerWaalsContact C-N 3.34Å; M126-G128 VanDerWaalsContact C-N 3.32Å; M126-G128 PolarHBondContact O-N 3.23Å; M126-D129 WeakPolarHBondContact O-CB 3.37Å; M126-D129 PolarHBondContact O-N 3.01Å; M126-D129 VanDerWaalsContact O-N 3.1Å; M126-Y130 HydrophobicContact CE-CE2 3.79Å; M126-Y130 HydrophobicContact CG-CD2 3.94Å; M126-Y130 HydrophobicContact CG-CE2 3.81Å; M126-Y130 VanDerWaalsContact O-CD2 3.31Å; M126-Y130 WeakPolarHBondContact O-CD2 3.44Å; M126-Y130 PolarHBondContact O-N 3.43Å
127	K	98.9	Very high	98.4	Very high	47 Å²	47	21.5 Å²	21.5	20%	0.204	10%	0.1	C	C	.	.	H	α-helix	trans	-55.3	-47.4	173.3	178.2	173.8	-176.9	168.3	0	111.6	L103 L106 E107 I111 Y123 L124 K125 D129 Y130 H131 A153	L103-K127 HydrophobicContact CD2-CB 4.47Å; L103-K127 HydrophobicContact CD2-CG 3.94Å; L106-K127 HydrophobicContact CD1-CB 4.1Å; E107-K127 WeakPolarHBondContact OE1-CE 3.45Å; E107-K127 IonicContact OE1-NZ 2.8Å; E107-K127 PolarHBondContact OE1-NZ 2.54Å; I111-K127 HydrophobicContact CD1-CB 4.26Å; I111-K127 HydrophobicContact CD1-CD 3.83Å; Y123-K127 WeakPolarHBondContact O-CB 3.27Å; Y123-K127 PolarHBondContact O-N 2.9Å; L124-K127 WeakPolarHBondContact O-CB 3.22Å; L124-K127 PolarHBondContact O-N 3.43Å; K125-K127 VanDerWaalsContact C-N 3.34Å; K125-K127 PolarHBondContact O-N 3.43Å; K127-D129 PolarHBondContact O-N 3.33Å; K127-Y130 PolarHBondContact O-N 3.48Å; K127-H131 PolarHBondContact O-CD2 3.08Å; K127-H131 VanDerWaalsContact O-CD2 3.26Å; K127-H131 PolarHBondContact O-N 3.03Å; K127-H131 VanDerWaalsContact O-N 3.09Å; K127-A153 HydrophobicContact CB-CB 4.24Å; K127-A153 HydrophobicContact CD-CB 4.26Å; K127-A153 HydrophobicContact CG-CB 3.97Å
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	-59.9	-43.2	174.9	0	0	0	0	0	112.7	L124 K125 M126 Y130 H131 R132 T150	L124-G128 PolarHBondContact O-N 3.39Å; K125-G128 PolarHBondContact O-N 2.97Å; M126-G128 VanDerWaalsContact C-N 3.32Å; M126-G128 PolarHBondContact O-N 3.23Å; G128-Y130 PolarHBondContact O-N 3.1Å; G128-H131 PolarHBondContact O-N 2.98Å; G128-R132 VanDerWaalsContact O-CB 3.27Å; G128-R132 WeakPolarHBondContact O-CB 3.37Å; G128-R132 PolarHBondContact O-N 2.96Å; G128-T150 WeakPolarHBondContact O-CG2 3.44Å
129	D	98.8	Very high	98.4	Very high	11 Å²	11	23.3 Å²	23.3	6%	0.059	12%	0.118	C	C	.	.	H	α-helix	trans	-58.9	-44.7	178.1	-69.1	-29	0	0	0	112.3	K125 M126 K127 R132 Y133 Y154 N178	K125-D129 IonicContact NZ-OD2 2.69Å; K125-D129 PolarHBondContact NZ-OD2 3Å; K125-D129 VanDerWaalsContact O-CG 3.25Å; K125-D129 PolarHBondContact O-N 2.69Å; M126-D129 WeakPolarHBondContact O-CB 3.37Å; M126-D129 PolarHBondContact O-N 3.01Å; M126-D129 VanDerWaalsContact O-N 3.1Å; K127-D129 PolarHBondContact O-N 3.33Å; D129-R132 WeakPolarHBondContact O-CB 3.34Å; D129-R132 PolarHBondContact O-N 3.4Å; D129-R132 IonicContact OD1-NH2 2.8Å; D129-Y133 HydrophobicContact CB-CE2 4.28Å; D129-Y133 WeakPolarHBondContact O-CD1 3.41Å; D129-Y133 VanDerWaalsContact O-CD2 3.22Å; D129-Y133 WeakPolarHBondContact O-CD2 3.4Å; D129-Y133 PolarHBondContact O-N 3.04Å; D129-Y154 WeakPolarHBondContact CA-OH 3.44Å; D129-Y154 PolarHBondContact N-OH 3.42Å; D129-Y154 PolarHBondContact OD1-OH 3.14Å; D129-N178 WeakPolarHBondContact OD1-CB 3.1Å; D129-N178 PolarHBondContact OD1-ND2 2.91Å; D129-N178 PolarHBondContact OD2-ND2 3.5Å
130	Y	98.8	Very high	98.4	Very high	7 Å²	7	25.9 Å²	25.9	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-77.4	-34.1	-177.6	-78.4	-87.2	0	0	0	113.6	Y51 I55 I98 C99 I102 M126 K127 G128 R132 Y133 L134	Y51-Y130 WeakPolarHBondContact CB-OH 3.47Å; Y51-Y130 PolarHBondContact O-OH 2.87Å; Y51-Y130 VanDerWaalsContact O-OH 3.04Å; I55-Y130 HydrophobicContact CB-CE1 3.9Å; I55-Y130 HydrophobicContact CD1-CE1 4.24Å; I55-Y130 HydrophobicContact CG1-CD1 4.45Å; I55-Y130 HydrophobicContact CG1-CE1 3.9Å; I55-Y130 HydrophobicContact CG2-CE1 3.92Å; I55-Y130 WeakPolarHBondContact CG2-OH 3.4Å; I98-Y130 HydrophobicContact CG2-CE1 4.49Å; C99-Y130 HydrophobicContact CB-CD1 4.31Å; I102-Y130 HydrophobicContact CG1-CD2 4.25Å; I102-Y130 HydrophobicContact CG1-CE2 4.24Å; I102-Y130 HydrophobicContact CG2-CD1 3.31Å; I102-Y130 HydrophobicContact CG2-CD2 3.64Å; I102-Y130 HydrophobicContact CG2-CE1 3.61Å; I102-Y130 HydrophobicContact CG2-CE2 3.97Å; I102-Y130 HydrophobicContact CG2-CG 3.33Å; M126-Y130 HydrophobicContact CE-CE2 3.79Å; M126-Y130 HydrophobicContact CG-CD2 3.94Å; M126-Y130 HydrophobicContact CG-CE2 3.81Å; M126-Y130 VanDerWaalsContact O-CD2 3.31Å; M126-Y130 WeakPolarHBondContact O-CD2 3.44Å; M126-Y130 PolarHBondContact O-N 3.43Å; K127-Y130 PolarHBondContact O-N 3.48Å; G128-Y130 PolarHBondContact O-N 3.1Å; Y130-R132 VanDerWaalsContact C-N 3.29Å; Y130-R132 PolarHBondContact O-N 3.26Å; Y130-Y133 AromaticContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CE2 4.25Å; Y130-Y133 HydrophobicContact CE1-CD2 4.07Å; Y130-Y133 HydrophobicContact CE1-CE2 4.2Å; Y130-Y133 HydrophobicContact CE2-CE2 4.43Å; Y130-Y133 HydrophobicContact CG-CD2 4.14Å; Y130-Y133 HydrophobicContact CG-CE2 4.42Å; Y130-Y133 PolarHBondContact O-N 3.33Å; Y130-L134 PolarHBondContact O-N 3.49Å; Y130-L134 VanDerWaalsContact O-N 3.09Å
131	H	98.9	Very high	98.4	Very high	22 Å²	22	26.3 Å²	26.3	10%	0.102	16%	0.164	C	C	.	.	H	α-helix	trans	-64.5	-36	167.1	-76.7	-64.9	0	0	0	112	K127 G128 Y133 L134 A135 T150	K127-H131 PolarHBondContact O-CD2 3.08Å; K127-H131 VanDerWaalsContact O-CD2 3.26Å; K127-H131 PolarHBondContact O-N 3.03Å; K127-H131 VanDerWaalsContact O-N 3.09Å; G128-H131 PolarHBondContact O-N 2.98Å; H131-Y133 VanDerWaalsContact C-N 3.32Å; H131-Y133 PolarHBondContact O-N 3.43Å; H131-L134 WeakPolarHBondContact O-CB 3.38Å; H131-L134 PolarHBondContact O-N 3.38Å; H131-A135 PolarHBondContact O-N 3.2Å; H131-T150 VanDerWaalsContact CB-OG1 3.22Å; H131-T150 WeakPolarHBondContact CB-OG1 3.47Å
132	R	98.7	Very high	98.3	Very high	12 Å²	12	31.4 Å²	31.4	5%	0.045	19%	0.187	C	C	.	.	H	α-helix	trans	-62	-43.6	175.3	-177.9	169.4	61.1	81.6	-1.9	111	G128 D129 Y130 L134 A135 E136 T150 Y154 F182 I186	G128-R132 VanDerWaalsContact O-CB 3.27Å; G128-R132 WeakPolarHBondContact O-CB 3.37Å; G128-R132 PolarHBondContact O-N 2.96Å; D129-R132 WeakPolarHBondContact O-CB 3.34Å; D129-R132 PolarHBondContact O-N 3.4Å; D129-R132 IonicContact OD1-NH2 2.8Å; Y130-R132 VanDerWaalsContact C-N 3.29Å; Y130-R132 PolarHBondContact O-N 3.26Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3.48Å; R132-A135 WeakPolarHBondContact O-CB 3.22Å; R132-A135 PolarHBondContact O-N 3.33Å; R132-A135 VanDerWaalsContact O-N 3.08Å; R132-E136 IonicContact NH1-OE1 3.82Å; R132-E136 PolarHBondContact O-N 3.09Å; R132-E136 VanDerWaalsContact O-N 3.11Å; R132-T150 WeakPolarHBondContact CA-OG1 3.37Å; R132-T150 HydrophobicContact CB-CG2 3.84Å; R132-T150 PolarHBondContact N-OG1 3.09Å; R132-Y154 PolarHBondContact NE-OH 3.26Å; R132-Y154 VanDerWaalsContact NE-OH 3.08Å; R132-F182 HydrophobicContact CG-CD2 4.16Å; R132-I186 HydrophobicContact CG-CG1 3.98Å
133	Y	98.7	Very high	98.3	Very high	28 Å²	28	34.5 Å²	34.5	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-38.9	175.5	-57.6	-28.8	0	0	0	112.2	I55 R59 D129 Y130 H131 A135 E136 F137	I55-Y133 HydrophobicContact CG1-CD2 3.87Å; I55-Y133 HydrophobicContact CG1-CE2 4.35Å; I55-Y133 HydrophobicContact CG2-CD2 4.4Å; I55-Y133 HydrophobicContact CG2-CE2 4.05Å; R59-Y133 VanDerWaalsContact CZ-CE1 3.44Å; D129-Y133 HydrophobicContact CB-CE2 4.28Å; D129-Y133 WeakPolarHBondContact O-CD1 3.41Å; D129-Y133 VanDerWaalsContact O-CD2 3.22Å; D129-Y133 WeakPolarHBondContact O-CD2 3.4Å; D129-Y133 PolarHBondContact O-N 3.04Å; Y130-Y133 AromaticContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CD2 3.8Å; Y130-Y133 HydrophobicContact CD1-CE2 4.25Å; Y130-Y133 HydrophobicContact CE1-CD2 4.07Å; Y130-Y133 HydrophobicContact CE1-CE2 4.2Å; Y130-Y133 HydrophobicContact CE2-CE2 4.43Å; Y130-Y133 HydrophobicContact CG-CD2 4.14Å; Y130-Y133 HydrophobicContact CG-CE2 4.42Å; Y130-Y133 PolarHBondContact O-N 3.33Å; H131-Y133 VanDerWaalsContact C-N 3.32Å; H131-Y133 PolarHBondContact O-N 3.43Å; Y133-A135 VanDerWaalsContact C-N 3.35Å; Y133-E136 WeakPolarHBondContact CD1-OE1 3.31Å; Y133-E136 WeakPolarHBondContact O-CB 3.48Å; Y133-E136 PolarHBondContact O-N 3.36Å; Y133-F137 WeakPolarHBondContact O-CD1 3.38Å; Y133-F137 VanDerWaalsContact O-CE1 3.23Å; Y133-F137 WeakPolarHBondContact O-CE1 3.32Å
134	L	98.8	Very high	98.3	Very high	17 Å²	17	40.8 Å²	40.8	9%	0.089	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-45.6	170.9	-68.6	172.1	0	0	0	111.1	C99 L103 Y130 H131 R132 E136 F137 K138 A146	C99-L134 HydrophobicContact CB-CD1 4.11Å; C99-L134 HydrophobicContact CB-CD2 3.66Å; C99-L134 HydrophobicContact CB-CG 3.76Å; L103-L134 HydrophobicContact CD1-CD1 3.84Å; Y130-L134 PolarHBondContact O-N 3.49Å; Y130-L134 VanDerWaalsContact O-N 3.09Å; H131-L134 WeakPolarHBondContact O-CB 3.38Å; H131-L134 PolarHBondContact O-N 3.38Å; R132-L134 VanDerWaalsContact C-N 3.31Å; R132-L134 PolarHBondContact O-N 3.48Å; L134-E136 PolarHBondContact O-N 3.02Å; L134-F137 HydrophobicContact CD2-CE1 4.16Å; L134-F137 HydrophobicContact CD2-CZ 3.72Å; L134-F137 PolarHBondContact O-N 2.84Å; L134-K138 HydrophobicContact CB-CG 4.37Å; L134-K138 VanDerWaalsContact O-CB 3.24Å; L134-K138 WeakPolarHBondContact O-CB 3.3Å; L134-K138 WeakPolarHBondContact O-CG 3.23Å; L134-K138 PolarHBondContact O-N 3.37Å; L134-A146 HydrophobicContact CB-CB 3.9Å
135	A	98.6	Very high	98.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-20.9	179.9	0	0	0	0	0	114.1	H131 R132 Y133 R143 A146 A147 I186	H131-A135 PolarHBondContact O-N 3.2Å; R132-A135 WeakPolarHBondContact O-CB 3.22Å; R132-A135 PolarHBondContact O-N 3.33Å; R132-A135 VanDerWaalsContact O-N 3.08Å; Y133-A135 VanDerWaalsContact C-N 3.35Å; A135-R143 PolarHBondContact O-NH1 2.94Å; A135-A146 HydrophobicContact CB-CB 3.9Å; A135-A147 HydrophobicContact CB-CB 4.5Å; A135-I186 HydrophobicContact CB-CD1 4.31Å; A135-I186 HydrophobicContact CB-CG2 3.81Å
136	E	97.8	Very high	98.3	Very high	22 Å²	22	44.1 Å²	44.1	10%	0.103	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-44.1	176.7	-72.1	172	-158.4	0	0	111.9	R59 W62 R63 R132 Y133 L134 I186	R59-E136 IonicContact CZ-OE1 3.92Å; R59-E136 IonicContact CZ-OE2 2.88Å; R59-E136 IonicContact NE-OE1 3.69Å; R59-E136 IonicContact NE-OE2 3.85Å; R59-E136 PolarHBondContact NE-OE2 3.44Å; R59-E136 VanDerWaalsContact NH2-CD 3.26Å; R59-E136 IonicContact NH2-OE1 3.88Å; R59-E136 PolarHBondContact NH2-OE1 2.98Å; R59-E136 IonicContact NH2-OE2 2.77Å; R59-E136 PolarHBondContact NH2-OE2 3.16Å; W62-E136 HydrophobicContact CH2-CB 4.43Å; W62-E136 WeakPolarHBondContact CH2-O 3.36Å; W62-E136 HydrophobicContact CZ3-CB 4.36Å; R63-E136 IonicContact NH2-OE2 3.28Å; R63-E136 PolarHBondContact NH2-OE2 3Å; R132-E136 IonicContact NH1-OE1 3.82Å; R132-E136 PolarHBondContact O-N 3.09Å; R132-E136 VanDerWaalsContact O-N 3.11Å; Y133-E136 WeakPolarHBondContact CD1-OE1 3.31Å; Y133-E136 WeakPolarHBondContact O-CB 3.48Å; Y133-E136 PolarHBondContact O-N 3.36Å; L134-E136 PolarHBondContact O-N 3.02Å; E136-I186 HydrophobicContact CG-CD1 3.93Å
137	F	97.3	Very high	98.3	Very high	17 Å²	17	44.4 Å²	44.4	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-114.5	-19.3	-170.6	68.6	-93.8	0	0	0	114.6	W62 E92 L95 S96 Y133 L134	W62-F137 HydrophobicContact CD2-CB 4.18Å; W62-F137 VanDerWaalsContact CE2-CB 3.4Å; W62-F137 HydrophobicContact CH2-CB 4.02Å; W62-F137 HydrophobicContact CZ2-CB 3.33Å; E92-F137 HydrophobicContact CB-CD2 3.73Å; E92-F137 HydrophobicContact CB-CE2 3.95Å; E92-F137 HydrophobicContact CG-CB 4.16Å; E92-F137 HydrophobicContact CG-CD2 3.65Å; E92-F137 HydrophobicContact CG-CE2 4.36Å; E92-F137 HydrophobicContact CG-CG 4.13Å; E92-F137 WeakPolarHBondContact O-CE2 3.47Å; L95-F137 HydrophobicContact CB-CD1 4.42Å; L95-F137 HydrophobicContact CB-CE1 3.69Å; L95-F137 HydrophobicContact CB-CE2 4.49Å; L95-F137 HydrophobicContact CB-CZ 3.73Å; L95-F137 HydrophobicContact CD1-CD1 3.96Å; L95-F137 HydrophobicContact CD1-CE1 4.06Å; L95-F137 HydrophobicContact CD1-CG 4.46Å; L95-F137 HydrophobicContact CG-CE1 4.45Å; S96-F137 WeakPolarHBondContact OG-CE2 3.36Å; S96-F137 WeakPolarHBondContact OG-CZ 3.41Å; Y133-F137 WeakPolarHBondContact O-CD1 3.38Å; Y133-F137 VanDerWaalsContact O-CE1 3.23Å; Y133-F137 WeakPolarHBondContact O-CE1 3.32Å; L134-F137 HydrophobicContact CD2-CE1 4.16Å; L134-F137 HydrophobicContact CD2-CZ 3.72Å; L134-F137 PolarHBondContact O-N 2.84Å
138	K	98.1	Very high	98.3	Very high	53 Å²	53	47.1 Å²	47.1	23%	0.23	26%	0.259	C	S	.	.			trans	-68.6	159.4	174.6	-67.1	-59.6	-157	155	0	111.6	L134 E142 R143	L134-K138 HydrophobicContact CB-CG 4.37Å; L134-K138 VanDerWaalsContact O-CB 3.24Å; L134-K138 WeakPolarHBondContact O-CB 3.3Å; L134-K138 WeakPolarHBondContact O-CG 3.23Å; L134-K138 PolarHBondContact O-N 3.37Å; K138-E142 HydrophobicContact CB-CB 4.14Å; K138-E142 HydrophobicContact CD-CB 4.41Å; K138-E142 VanDerWaalsContact CD-OE2 3.27Å; K138-E142 WeakPolarHBondContact CD-OE2 3.42Å; K138-E142 WeakPolarHBondContact CE-OE2 3.32Å; K138-E142 HydrophobicContact CG-CB 4.4Å; K138-E142 IonicContact NZ-OE1 3.34Å; K138-E142 IonicContact NZ-OE2 3.51Å; K138-E142 PolarHBondContact NZ-OE2 3.32Å; K138-R143 HydrophobicContact CB-CB 4.33Å; K138-R143 WeakPolarHBondContact O-CB 3.35Å
139	A	96.3	Very high	98.3	Very high	74 Å²	74	48.8 Å²	48.8	61%	0.612	27%	0.27	S	S	*	.			trans	-127.4	163.4	-179.8	0	0	0	0	0	112.3	A141 E142 R143	A139-A141 PolarHBondContact O-N 2.84Å; A139-E142 PolarHBondContact O-N 3.47Å; A139-R143 PolarHBondContact O-N 2.91Å
140	G	97.1	Very high	98.3	Very high	63 Å²	63	48.2 Å²	48.2	65%	0.649	27%	0.267	S	S	*	.	H	α-helix	trans	56.7	-131.5	173.1	0	0	0	0	0	114	R143 K144	G140-R143 PolarHBondContact O-N 3.17Å; G140-K144 PolarHBondContact O-N 3.25Å
141	A	98.2	Very high	98.3	Very high	82 Å²	82	50 Å²	50	68%	0.678	28%	0.277	S	S	*	.	H	α-helix	trans	-63.1	-40.3	-178.2	0	0	0	0	0	112.6	A139 R143 K144 E145	A139-A141 PolarHBondContact O-N 2.84Å; A141-R143 VanDerWaalsContact C-N 3.33Å; A141-R143 PolarHBondContact O-N 3.41Å; A141-K144 WeakPolarHBondContact O-CB 3.41Å; A141-K144 PolarHBondContact O-N 3.33Å; A141-K144 VanDerWaalsContact O-N 3.15Å; A141-E145 PolarHBondContact O-N 2.96Å
142	E	98.1	Very high	98.3	Very high	107 Å²	107	53.3 Å²	53.3	50%	0.5	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-40	179.4	-60.9	-171.3	157.5	0	0	111.5	K138 A139 K144 E145 A146	K138-E142 HydrophobicContact CB-CB 4.14Å; K138-E142 HydrophobicContact CD-CB 4.41Å; K138-E142 VanDerWaalsContact CD-OE2 3.27Å; K138-E142 WeakPolarHBondContact CD-OE2 3.42Å; K138-E142 WeakPolarHBondContact CE-OE2 3.32Å; K138-E142 HydrophobicContact CG-CB 4.4Å; K138-E142 IonicContact NZ-OE1 3.34Å; K138-E142 IonicContact NZ-OE2 3.51Å; K138-E142 PolarHBondContact NZ-OE2 3.32Å; A139-E142 PolarHBondContact O-N 3.47Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 3.07Å; E142-E145 PolarHBondContact O-N 3.2Å; E142-A146 WeakPolarHBondContact O-CB 3.41Å; E142-A146 PolarHBondContact O-N 3.06Å
143	R	98.3	Very high	98.3	Very high	93 Å²	93	52.9 Å²	52.9	35%	0.351	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-43.9	174.7	-171.6	-177.2	173.2	105	-1.9	111.5	A135 K138 A139 G140 A141 A146 A147	A135-R143 PolarHBondContact O-NH1 2.94Å; K138-R143 HydrophobicContact CB-CB 4.33Å; K138-R143 WeakPolarHBondContact O-CB 3.35Å; A139-R143 PolarHBondContact O-N 2.91Å; G140-R143 PolarHBondContact O-N 3.17Å; A141-R143 VanDerWaalsContact C-N 3.33Å; A141-R143 PolarHBondContact O-N 3.41Å; R143-A146 PolarHBondContact O-N 3.34Å; R143-A147 WeakPolarHBondContact O-CB 3.26Å; R143-A147 PolarHBondContact O-N 3.3Å
144	K	98.4	Very high	98.3	Very high	133 Å²	133	51.5 Å²	51.5	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-64.1	-47	-179.1	-178.2	179.3	170.3	-177.2	0	110.9	G140 A141 E142 A146 A147 E148	G140-K144 PolarHBondContact O-N 3.25Å; A141-K144 WeakPolarHBondContact O-CB 3.41Å; A141-K144 PolarHBondContact O-N 3.33Å; A141-K144 VanDerWaalsContact O-N 3.15Å; E142-K144 VanDerWaalsContact C-N 3.33Å; E142-K144 PolarHBondContact O-N 3.07Å; K144-A146 PolarHBondContact O-N 3.38Å; K144-A147 PolarHBondContact O-N 3.37Å; K144-E148 WeakPolarHBondContact CE-OE1 3.27Å; K144-E148 IonicContact NZ-OE1 3.99Å; K144-E148 WeakPolarHBondContact O-CG 3.3Å; K144-E148 PolarHBondContact O-N 2.91Å
145	E	98.6	Very high	98.3	Very high	126 Å²	126	55.5 Å²	55.5	59%	0.589	31%	0.309	S	S	*	.	H	α-helix	trans	-60.5	-44	177	-178.2	176	-169.7	0	0	111.8	A141 E142 A147 E148 S149	A141-E145 PolarHBondContact O-N 2.96Å; E142-E145 PolarHBondContact O-N 3.2Å; E145-A147 PolarHBondContact O-N 3.41Å; E145-E148 PolarHBondContact O-N 3.19Å; E145-S149 WeakPolarHBondContact O-CB 3.3Å; E145-S149 PolarHBondContact O-N 3.49Å; E145-S149 PolarHBondContact O-OG 3.23Å
146	A	98.7	Very high	98.3	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-42.4	175.6	0	0	0	0	0	112.2	L134 A135 E142 R143 K144 S149 T150	L134-A146 HydrophobicContact CB-CB 3.9Å; A135-A146 HydrophobicContact CB-CB 3.9Å; E142-A146 WeakPolarHBondContact O-CB 3.41Å; E142-A146 PolarHBondContact O-N 3.06Å; R143-A146 PolarHBondContact O-N 3.34Å; K144-A146 PolarHBondContact O-N 3.38Å; A146-S149 PolarHBondContact O-N 2.89Å; A146-T150 WeakPolarHBondContact O-CB 3.13Å; A146-T150 PolarHBondContact O-N 2.91Å; A146-T150 PolarHBondContact O-OG1 3.45Å
147	A	98.7	Very high	98.3	Very high	13 Å²	13	56.8 Å²	56.8	11%	0.107	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-41.4	176.8	0	0	0	0	0	112.4	A135 R143 K144 E145 T150 L151 F182 I186 L187	A135-A147 HydrophobicContact CB-CB 4.5Å; R143-A147 WeakPolarHBondContact O-CB 3.26Å; R143-A147 PolarHBondContact O-N 3.3Å; K144-A147 PolarHBondContact O-N 3.37Å; E145-A147 PolarHBondContact O-N 3.41Å; A147-T150 WeakPolarHBondContact O-CB 3.42Å; A147-T150 PolarHBondContact O-N 2.96Å; A147-L151 WeakPolarHBondContact O-CB 3.28Å; A147-L151 PolarHBondContact O-N 2.93Å; A147-F182 HydrophobicContact CB-CE2 4.32Å; A147-F182 HydrophobicContact CB-CZ 4.41Å; A147-F182 WeakPolarHBondContact O-CZ 3.34Å; A147-I186 HydrophobicContact CB-CG2 4.04Å; A147-L187 HydrophobicContact CB-CD2 4.48Å
148	E	98.7	Very high	98.4	Very high	104 Å²	104	57.4 Å²	57.4	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-44.8	175.3	-74.4	173.5	176.6	0	0	111.1	K144 E145 T150 L151 V152	K144-E148 WeakPolarHBondContact CE-OE1 3.27Å; K144-E148 IonicContact NZ-OE1 3.99Å; K144-E148 WeakPolarHBondContact O-CG 3.3Å; K144-E148 PolarHBondContact O-N 2.91Å; E145-E148 PolarHBondContact O-N 3.19Å; E148-T150 VanDerWaalsContact C-N 3.34Å; E148-T150 PolarHBondContact O-N 2.94Å; E148-L151 PolarHBondContact O-N 3.48Å; E148-V152 WeakPolarHBondContact O-CG2 3.49Å; E148-V152 PolarHBondContact O-N 2.71Å
149	S	98.8	Very high	98.4	Very high	35 Å²	35	60.4 Å²	60.4	25%	0.245	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-39.4	178	-57.5	0	0	0	0	112.1	E145 A146 V152 A153	E145-S149 WeakPolarHBondContact O-CB 3.3Å; E145-S149 PolarHBondContact O-N 3.49Å; E145-S149 PolarHBondContact O-OG 3.23Å; A146-S149 PolarHBondContact O-N 2.89Å; S149-V152 PolarHBondContact O-N 3.09Å; S149-A153 WeakPolarHBondContact O-CB 3.22Å; S149-A153 PolarHBondContact O-N 2.66Å
150	T	98.8	Very high	98.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.7	-50.4	172.3	-57.8	0	0	0	0	111.1	G128 H131 R132 A146 A147 E148 V152 A153 Y154 F182	G128-T150 WeakPolarHBondContact O-CG2 3.44Å; H131-T150 VanDerWaalsContact CB-OG1 3.22Å; H131-T150 WeakPolarHBondContact CB-OG1 3.47Å; R132-T150 WeakPolarHBondContact CA-OG1 3.37Å; R132-T150 HydrophobicContact CB-CG2 3.84Å; R132-T150 PolarHBondContact N-OG1 3.09Å; A146-T150 WeakPolarHBondContact O-CB 3.13Å; A146-T150 PolarHBondContact O-N 2.91Å; A146-T150 PolarHBondContact O-OG1 3.45Å; A147-T150 WeakPolarHBondContact O-CB 3.42Å; A147-T150 PolarHBondContact O-N 2.96Å; E148-T150 VanDerWaalsContact C-N 3.34Å; E148-T150 PolarHBondContact O-N 2.94Å; T150-V152 PolarHBondContact O-N 3.32Å; T150-A153 PolarHBondContact O-N 2.71Å; T150-Y154 HydrophobicContact CG2-CD2 3.55Å; T150-Y154 HydrophobicContact CG2-CE2 3.33Å; T150-Y154 PolarHBondContact O-N 3.17Å; T150-F182 HydrophobicContact CG2-CB 4.44Å; T150-F182 HydrophobicContact CG2-CD1 4.12Å; T150-F182 HydrophobicContact CG2-CD2 3.38Å; T150-F182 HydrophobicContact CG2-CE1 4.17Å; T150-F182 HydrophobicContact CG2-CE2 3.48Å; T150-F182 VanDerWaalsContact CG2-CE2 3.48Å; T150-F182 HydrophobicContact CG2-CG 3.71Å; T150-F182 HydrophobicContact CG2-CZ 3.88Å
151	L	98.7	Very high	98.6	Very high	43 Å²	43	55.8 Å²	55.8	23%	0.225	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-42.6	-178.3	-177.8	64.2	0	0	0	111.6	A147 E148 K155 F179 F182 Y183	A147-L151 WeakPolarHBondContact O-CB 3.28Å; A147-L151 PolarHBondContact O-N 2.93Å; E148-L151 PolarHBondContact O-N 3.48Å; L151-K155 HydrophobicContact CD1-CD 4.19Å; L151-K155 HydrophobicContact CD1-CG 4.33Å; L151-K155 HydrophobicContact CG-CD 4.16Å; L151-K155 WeakPolarHBondContact O-CB 3.27Å; L151-K155 VanDerWaalsContact O-CG 3.26Å; L151-K155 WeakPolarHBondContact O-CG 3.46Å; L151-K155 PolarHBondContact O-N 2.87Å; L151-F179 HydrophobicContact CD1-CE2 3.83Å; L151-F179 HydrophobicContact CD1-CZ 3.86Å; L151-F182 HydrophobicContact CB-CE1 3.98Å; L151-F182 HydrophobicContact CB-CZ 4.19Å; L151-F182 HydrophobicContact CD1-CE1 4.05Å; L151-Y183 HydrophobicContact CD1-CE1 4.38Å
152	V	98.8	Very high	98.6	Very high	92 Å²	92	55.8 Å²	55.8	56%	0.558	29%	0.287	S	S	*	.	H	α-helix	trans	-62.3	-49.9	176.5	170.6	0	0	0	0	110.5	E148 S149 T150 Y154 K155 S156	E148-V152 WeakPolarHBondContact O-CG2 3.49Å; E148-V152 PolarHBondContact O-N 2.71Å; S149-V152 PolarHBondContact O-N 3.09Å; T150-V152 PolarHBondContact O-N 3.32Å; V152-Y154 PolarHBondContact O-N 3.33Å; V152-K155 PolarHBondContact O-N 3.44Å; V152-S156 PolarHBondContact O-N 3.04Å; V152-S156 PolarHBondContact O-OG 3.44Å; V152-S156 VanDerWaalsContact O-OG 3.1Å
153	A	98.8	Very high	98.6	Very high	3 Å²	3	54.6 Å²	54.6	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-45.9	-178.1	0	0	0	0	0	112.3	K127 S149 T150 S156 A157	K127-A153 HydrophobicContact CB-CB 4.24Å; K127-A153 HydrophobicContact CD-CB 4.26Å; K127-A153 HydrophobicContact CG-CB 3.97Å; S149-A153 WeakPolarHBondContact O-CB 3.22Å; S149-A153 PolarHBondContact O-N 2.66Å; T150-A153 PolarHBondContact O-N 2.71Å; A153-S156 PolarHBondContact O-N 3.39Å; A153-A157 WeakPolarHBondContact O-CB 3.31Å; A153-A157 PolarHBondContact O-N 3Å
154	Y	98.9	Very high	98.6	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-68.5	-36.6	178.3	-72.8	-32.6	0	0	0	113.5	K125 D129 R132 T150 V152 A157 S158 L175 N178 F179 F182	K125-Y154 HydrophobicContact CG-CE1 4.42Å; K125-Y154 WeakPolarHBondContact O-CE1 3.32Å; D129-Y154 WeakPolarHBondContact CA-OH 3.44Å; D129-Y154 PolarHBondContact N-OH 3.42Å; D129-Y154 PolarHBondContact OD1-OH 3.14Å; R132-Y154 PolarHBondContact NE-OH 3.26Å; R132-Y154 VanDerWaalsContact NE-OH 3.08Å; T150-Y154 HydrophobicContact CG2-CD2 3.55Å; T150-Y154 HydrophobicContact CG2-CE2 3.33Å; T150-Y154 PolarHBondContact O-N 3.17Å; V152-Y154 PolarHBondContact O-N 3.33Å; Y154-A157 PolarHBondContact O-N 3.19Å; Y154-S158 VanDerWaalsContact O-CB 3.22Å; Y154-S158 WeakPolarHBondContact O-CB 3.25Å; Y154-S158 PolarHBondContact O-N 2.72Å; Y154-L175 HydrophobicContact CD1-CD1 3.52Å; Y154-L175 HydrophobicContact CE1-CD1 4.17Å; Y154-L175 HydrophobicContact CG-CD1 4.23Å; Y154-N178 HydrophobicContact CE1-CB 4.47Å; Y154-F179 HydrophobicContact CD2-CB 4Å; Y154-F179 AromaticContact CD2-CD2 3.39Å; Y154-F179 HydrophobicContact CD2-CD2 3.39Å; Y154-F179 AromaticContact CD2-CE2 3.97Å; Y154-F179 HydrophobicContact CD2-CE2 3.97Å; Y154-F179 AromaticContact CD2-CG 3.83Å; Y154-F179 HydrophobicContact CD2-CG 3.83Å; Y154-F179 HydrophobicContact CE2-CB 4.44Å; Y154-F179 HydrophobicContact CE2-CD2 4.27Å; Y154-F179 HydrophobicContact CG-CB 4.1Å; Y154-F179 HydrophobicContact CG-CD1 4.44Å; Y154-F179 AromaticContact CG-CD2 3.88Å; Y154-F179 HydrophobicContact CG-CD2 3.88Å; 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 4.29Å; Y154-F182 HydrophobicContact CD2-CD1 4.33Å; Y154-F182 HydrophobicContact CD2-CG 4.38Å; Y154-F182 HydrophobicContact CE2-CB 3.83Å; Y154-F182 HydrophobicContact CE2-CG 4.19Å
155	K	98.7	Very high	98.6	Very high	100 Å²	100	50.3 Å²	50.3	44%	0.435	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-49.8	174	-78.9	179.3	171.9	177.3	0	111.4	L151 V152 A157 S158 D159 F179	L151-K155 HydrophobicContact CD1-CD 4.19Å; L151-K155 HydrophobicContact CD1-CG 4.33Å; L151-K155 HydrophobicContact CG-CD 4.16Å; L151-K155 WeakPolarHBondContact O-CB 3.27Å; L151-K155 VanDerWaalsContact O-CG 3.26Å; L151-K155 WeakPolarHBondContact O-CG 3.46Å; L151-K155 PolarHBondContact O-N 2.87Å; V152-K155 PolarHBondContact O-N 3.44Å; K155-A157 VanDerWaalsContact C-N 3.28Å; K155-A157 PolarHBondContact O-N 3.26Å; K155-S158 WeakPolarHBondContact O-CB 3.38Å; K155-S158 PolarHBondContact O-N 3.02Å; K155-D159 VanDerWaalsContact O-CG 3.3Å; K155-D159 PolarHBondContact O-N 3.36Å; K155-F179 HydrophobicContact CG-CE1 4.39Å; K155-F179 HydrophobicContact CG-CZ 4.04Å
156	S	98.6	Very high	98.5	Very high	49 Å²	49	46.6 Å²	46.6	34%	0.343	27%	0.273	S	S	.	.	H	α-helix	trans	-58.4	-40.8	176.8	-60.1	0	0	0	0	112.1	V152 A153 I160	V152-S156 PolarHBondContact O-N 3.04Å; V152-S156 PolarHBondContact O-OG 3.44Å; V152-S156 VanDerWaalsContact O-OG 3.1Å; A153-S156 PolarHBondContact O-N 3.39Å; S156-I160 WeakPolarHBondContact O-CG1 3.28Å; S156-I160 PolarHBondContact O-N 3.38Å
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	-64.1	-40.8	174	0	0	0	0	0	111.9	V121 L124 A153 Y154 K155 A161 L175	V121-A157 HydrophobicContact CG1-CB 4.36Å; L124-A157 HydrophobicContact CB-CB 3.7Å; A153-A157 WeakPolarHBondContact O-CB 3.31Å; A153-A157 PolarHBondContact O-N 3Å; Y154-A157 PolarHBondContact O-N 3.19Å; K155-A157 VanDerWaalsContact C-N 3.28Å; K155-A157 PolarHBondContact O-N 3.26Å; A157-A161 WeakPolarHBondContact O-CB 3.37Å; A157-A161 PolarHBondContact O-N 3.17Å; A157-L175 VanDerWaalsContact C-CD2 3.47Å; A157-L175 HydrophobicContact CB-CD1 3.86Å; A157-L175 HydrophobicContact CB-CD2 3.59Å; A157-L175 HydrophobicContact CB-CG 4.39Å
158	S	98.7	Very high	98.3	Very high	31 Å²	31	46.7 Å²	46.7	22%	0.217	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-38.1	-176.9	-170.1	0	0	0	0	111.9	Y154 K155 A161 T162	Y154-S158 VanDerWaalsContact O-CB 3.22Å; Y154-S158 WeakPolarHBondContact O-CB 3.25Å; Y154-S158 PolarHBondContact O-N 2.72Å; K155-S158 WeakPolarHBondContact O-CB 3.38Å; K155-S158 PolarHBondContact O-N 3.02Å; S158-A161 PolarHBondContact O-N 3.26Å; S158-T162 VanDerWaalsContact O-CB 3.27Å; S158-T162 WeakPolarHBondContact O-CB 3.23Å; S158-T162 PolarHBondContact O-N 3.09Å; S158-T162 PolarHBondContact O-OG1 3Å
159	D	98.6	Very high	98.2	Very high	116 Å²	116	43.4 Å²	43.4	62%	0.62	26%	0.257	S	S	*	.	H	α-helix	trans	-62.5	-47.3	177.9	-67.2	-18.6	0	0	0	110.5	K155 A163	K155-D159 VanDerWaalsContact O-CG 3.3Å; K155-D159 PolarHBondContact O-N 3.36Å; D159-A163 WeakPolarHBondContact O-CB 3.26Å; D159-A163 PolarHBondContact O-N 3.49Å
160	I	98.7	Very high	98.1	Very high	38 Å²	38	42.8 Å²	42.8	20%	0.195	25%	0.252	C	S	.	.	H	α-helix	trans	-66.2	-46.9	176.3	-59.7	169.3	0	0	0	110.6	A117 K120 V121 L124 S156 T162 A163 E164	A117-I160 HydrophobicContact CB-CG2 4.18Å; K120-I160 HydrophobicContact CB-CD1 4.09Å; K120-I160 HydrophobicContact CD-CD1 4.43Å; V121-I160 HydrophobicContact CG2-CB 3.82Å; V121-I160 HydrophobicContact CG2-CG2 3.57Å; L124-I160 HydrophobicContact CD1-CD1 3.8Å; S156-I160 WeakPolarHBondContact O-CG1 3.28Å; S156-I160 PolarHBondContact O-N 3.38Å; I160-T162 VanDerWaalsContact C-N 3.31Å; I160-T162 PolarHBondContact O-N 3.31Å; I160-A163 PolarHBondContact O-N 3.36Å; I160-E164 WeakPolarHBondContact O-CB 3.33Å; I160-E164 PolarHBondContact O-N 3.01Å
161	A	98.6	Very high	98.1	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-38.9	-177.5	0	0	0	0	0	112.3	V121 A157 S158 A163 L165 R172 L175	V121-A161 HydrophobicContact CG1-CB 3.86Å; V121-A161 HydrophobicContact CG2-CB 3.91Å; A157-A161 WeakPolarHBondContact O-CB 3.37Å; A157-A161 PolarHBondContact O-N 3.17Å; S158-A161 PolarHBondContact O-N 3.26Å; A161-A163 VanDerWaalsContact C-N 3.35Å; A161-L165 HydrophobicContact CB-CD1 4.2Å; A161-L165 WeakPolarHBondContact O-CA 3.44Å; A161-L165 WeakPolarHBondContact O-CB 3.44Å; A161-L165 PolarHBondContact O-N 2.81Å; A161-L165 VanDerWaalsContact O-O 3.06Å; A161-R172 HydrophobicContact CB-CB 4.25Å; A161-R172 HydrophobicContact CB-CG 4.07Å; A161-L175 HydrophobicContact CB-CD2 4.11Å
162	T	98	Very high	98.1	Very high	82 Å²	82	43.6 Å²	43.6	50%	0.503	25%	0.253	S	S	.	.	H	α-helix	trans	-70.4	-35.2	179.1	-55.2	0	0	0	0	111.5	S158 I160	S158-T162 VanDerWaalsContact O-CB 3.27Å; S158-T162 WeakPolarHBondContact O-CB 3.23Å; S158-T162 PolarHBondContact O-N 3.09Å; S158-T162 PolarHBondContact O-OG1 3Å; I160-T162 VanDerWaalsContact C-N 3.31Å; I160-T162 PolarHBondContact O-N 3.31Å
163	A	98	Very high	98	Very high	83 Å²	83	39.3 Å²	39.3	69%	0.686	23%	0.227	S	C	*	.	H	α-helix	trans	-78.6	-35.9	-179.4	0	0	0	0	0	113.5	D159 I160 A161	D159-A163 WeakPolarHBondContact O-CB 3.26Å; D159-A163 PolarHBondContact O-N 3.49Å; I160-A163 PolarHBondContact O-N 3.36Å; A161-A163 VanDerWaalsContact C-N 3.35Å
164	E	98.2	Very high	98	Very high	121 Å²	121	39.7 Å²	39.7	57%	0.565	23%	0.231	S	C	*	.	H	α-helix	trans	-121.9	-12.9	-164.7	-61.1	-169.1	-118.2	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 3.25Å; I160-E164 WeakPolarHBondContact O-CB 3.33Å; I160-E164 PolarHBondContact O-N 3.01Å
165	L	97.3	Very high	98	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.079	23%	0.231	C	C	.	.	S	Bend	trans	-116.1	138.6	180	-53.7	-179.5	0	0	0	111.4	A117 E118 V121 A161 H169 I171 R172	A117-L165 HydrophobicContact CB-CD2 4.3Å; E118-L165 HydrophobicContact CG-CD2 3.76Å; V121-L165 HydrophobicContact CB-CD1 4.18Å; V121-L165 HydrophobicContact CG1-CD1 4.26Å; V121-L165 HydrophobicContact CG2-CD1 3.96Å; A161-L165 HydrophobicContact CB-CD1 4.2Å; A161-L165 WeakPolarHBondContact O-CA 3.44Å; A161-L165 WeakPolarHBondContact O-CB 3.44Å; A161-L165 PolarHBondContact O-N 2.81Å; A161-L165 VanDerWaalsContact O-O 3.06Å; L165-H169 HydrophobicContact CB-CB 4.08Å; L165-I171 HydrophobicContact CD1-CB 4.47Å; L165-I171 HydrophobicContact CD1-CG2 4.49Å; L165-R172 HydrophobicContact CB-CB 4.3Å; L165-R172 HydrophobicContact CD1-CB 4.41Å; L165-R172 PolarHBondContact O-NH1 3.14Å
166	A	96.6	Very high	98	Very high	47 Å²	47	35.6 Å²	35.6	39%	0.388	22%	0.215	S	C	.	.			trans	-57.5	145.7	173.9	0	0	0	0	0	111.2	T168 H169 R172	A166-T168 PolarHBondContact O-N 3.01Å; A166-T168 VanDerWaalsContact O-N 3.12Å; A166-H169 WeakPolarHBondContact O-CB 3.45Å; A166-H169 PolarHBondContact O-N 3Å; A166-R172 WeakPolarHBondContact O-CD 3.5Å
167	P	97.5	Very high	98	Very high	16 Å²	16	34.1 Å²	34.1	10%	0.104	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-32.8	174.2	-29.7	36.3	0	0	0	114.7	H169 L173 D203 E207	P167-H169 VanDerWaalsContact C-N 3.31Å; P167-L173 WeakPolarHBondContact O-CG 3.27Å; P167-D203 HydrophobicContact CB-CB 3.98Å; P167-D203 HydrophobicContact CG-CB 4.47Å; P167-E207 WeakPolarHBondContact CD-OE2 3.4Å
168	T	96.8	Very high	98	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.031	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.4	178.3	52.8	0	0	0	0	113.8	A166 A204 E207 S219	A166-T168 PolarHBondContact O-N 3.01Å; A166-T168 VanDerWaalsContact O-N 3.12Å; T168-A204 HydrophobicContact CG2-CB 4.4Å; T168-A204 WeakPolarHBondContact CG2-O 3.41Å; T168-E207 HydrophobicContact CG2-CB 3.95Å; T168-S219 WeakPolarHBondContact O-CB 3.13Å; T168-S219 PolarHBondContact O-OG 3.39Å
169	H	96.7	Very high	98	Very high	35 Å²	35	34.5 Å²	34.5	16%	0.162	20%	0.203	C	C	.	.			trans	-67.5	128	-176.3	-168.6	-76.8	0	0	0	111.4	E118 L165 A166 P167 I171 R172 L173	E118-H169 IonicContact OE1-NE2 2.62Å; E118-H169 PolarHBondContact OE1-NE2 3.45Å; L165-H169 HydrophobicContact CB-CB 4.08Å; A166-H169 WeakPolarHBondContact O-CB 3.45Å; A166-H169 PolarHBondContact O-N 3Å; P167-H169 VanDerWaalsContact C-N 3.31Å; H169-I171 VanDerWaalsContact C-N 3.3Å; H169-I171 PolarHBondContact ND1-N 3.47Å; H169-I171 VanDerWaalsContact ND1-N 3.19Å; H169-I171 PolarHBondContact O-N 3.33Å; H169-I171 VanDerWaalsContact O-N 3.16Å; H169-R172 HydrophobicContact CB-CB 4.25Å; H169-R172 PolarHBondContact O-N 2.99Å; H169-L173 PolarHBondContact O-N 3.23Å
170	P	97	Very high	98	Very high	22 Å²	22	29 Å²	29	14%	0.143	17%	0.173	C	C	.	.	H	α-helix	trans	-54.6	-39.8	-175.3	-26.7	31.4	0	0	0	114.4	G174 D218 S219 I222	P170-G174 PolarHBondContact O-N 2.96Å; P170-D218 HydrophobicContact CB-CB 4.22Å; P170-D218 HydrophobicContact CG-CB 4.12Å; P170-S219 WeakPolarHBondContact CD-OG 3.43Å; P170-S219 WeakPolarHBondContact CG-OG 3.35Å; P170-I222 HydrophobicContact CB-CD1 4.11Å; P170-I222 WeakPolarHBondContact O-CD1 3.4Å
171	I	97.7	Very high	98	Very high	20 Å²	20	28 Å²	28	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-41.1	177.7	-60.4	177.6	0	0	0	111.8	E118 V121 F122 L165 H169 G174 L175	E118-I171 HydrophobicContact CB-CD1 4.1Å; E118-I171 HydrophobicContact CG-CD1 4.46Å; V121-I171 HydrophobicContact CB-CG2 4.02Å; V121-I171 HydrophobicContact CG1-CG2 3.55Å; F122-I171 HydrophobicContact CB-CD1 4.35Å; F122-I171 HydrophobicContact CD2-CD1 4.05Å; F122-I171 HydrophobicContact CD2-CG1 4.39Å; L165-I171 HydrophobicContact CD1-CB 4.47Å; L165-I171 HydrophobicContact CD1-CG2 4.49Å; H169-I171 VanDerWaalsContact C-N 3.3Å; H169-I171 PolarHBondContact ND1-N 3.47Å; H169-I171 VanDerWaalsContact ND1-N 3.19Å; H169-I171 PolarHBondContact O-N 3.33Å; H169-I171 VanDerWaalsContact O-N 3.16Å; I171-G174 PolarHBondContact O-N 3.46Å; I171-L175 WeakPolarHBondContact O-CB 3.4Å; I171-L175 PolarHBondContact O-N 3.08Å
172	R	98.3	Very high	98	Very high	40 Å²	40	28 Å²	28	15%	0.151	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-46.3	179.1	177.2	175.4	171.8	175.2	-7	110.6	A161 L165 A166 H169 G174 L175 A176 D203	A161-R172 HydrophobicContact CB-CB 4.25Å; A161-R172 HydrophobicContact CB-CG 4.07Å; L165-R172 HydrophobicContact CB-CB 4.3Å; L165-R172 HydrophobicContact CD1-CB 4.41Å; L165-R172 PolarHBondContact O-NH1 3.14Å; A166-R172 WeakPolarHBondContact O-CD 3.5Å; H169-R172 HydrophobicContact CB-CB 4.25Å; H169-R172 PolarHBondContact O-N 2.99Å; R172-G174 PolarHBondContact O-N 3.35Å; R172-L175 WeakPolarHBondContact O-CB 3.22Å; R172-L175 PolarHBondContact O-N 3.44Å; R172-A176 PolarHBondContact O-N 3.11Å; R172-D203 IonicContact NH2-OD2 3.69Å
173	L	98.6	Very high	98.1	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-59.3	-46.2	174.3	-75.2	171.6	0	0	0	111.7	P167 H169 L175 A176 L177 A204 I222 M223 L226	P167-L173 WeakPolarHBondContact O-CG 3.27Å; H169-L173 PolarHBondContact O-N 3.23Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.1Å; L173-A176 PolarHBondContact O-N 2.88Å; L173-L177 PolarHBondContact O-N 3.49Å; L173-A204 HydrophobicContact CD2-CB 3.71Å; L173-I222 HydrophobicContact CB-CB 4.14Å; L173-I222 HydrophobicContact CB-CD1 4.39Å; L173-I222 HydrophobicContact CB-CG2 3.63Å; L173-M223 HydrophobicContact CD1-CG 3.93Å; L173-M223 HydrophobicContact CD1-SD 4.41Å; L173-M223 HydrophobicContact CD2-CG 4.06Å; L173-L226 HydrophobicContact CD2-CD1 3.99Å
174	G	98.5	Very high	98.1	Very high	10 Å²	10	24 Å²	24	10%	0.103	13%	0.127	C	C	.	.	H	α-helix	trans	-65	-33.8	179.1	0	0	0	0	0	112.8	K125 P170 I171 R172 N178	K125-G174 WeakPolarHBondContact CE-O 3.41Å; P170-G174 PolarHBondContact O-N 2.96Å; I171-G174 PolarHBondContact O-N 3.46Å; R172-G174 PolarHBondContact O-N 3.35Å; G174-N178 PolarHBondContact O-N 2.88Å; G174-N178 VanDerWaalsContact O-N 3.12Å
175	L	98.8	Very high	98	Very high	3 Å²	3	23 Å²	23	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-49.4	170.9	171.6	63.8	0	0	0	110.9	V121 K125 Y154 A157 A161 I171 R172 L173 L177 N178 F179	V121-L175 HydrophobicContact CG1-CD2 4.13Å; K125-L175 HydrophobicContact CB-CD1 4.08Å; K125-L175 HydrophobicContact CD-CB 4.07Å; K125-L175 HydrophobicContact CG-CB 4.32Å; K125-L175 HydrophobicContact CG-CD1 3.99Å; Y154-L175 HydrophobicContact CD1-CD1 3.52Å; Y154-L175 HydrophobicContact CE1-CD1 4.17Å; Y154-L175 HydrophobicContact CG-CD1 4.23Å; A157-L175 VanDerWaalsContact C-CD2 3.47Å; A157-L175 HydrophobicContact CB-CD1 3.86Å; A157-L175 HydrophobicContact CB-CD2 3.59Å; A157-L175 HydrophobicContact CB-CG 4.39Å; A161-L175 HydrophobicContact CB-CD2 4.11Å; I171-L175 WeakPolarHBondContact O-CB 3.4Å; I171-L175 PolarHBondContact O-N 3.08Å; R172-L175 WeakPolarHBondContact O-CB 3.22Å; R172-L175 PolarHBondContact O-N 3.44Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.1Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 2.99Å; L175-N178 PolarHBondContact O-N 2.96Å; L175-F179 WeakPolarHBondContact O-CB 3.5Å; L175-F179 PolarHBondContact O-N 2.62Å
176	A	98.8	Very high	98.1	Very high	11 Å²	11	23.2 Å²	23.2	9%	0.091	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-41.8	179.6	0	0	0	0	0	111.8	R172 L173 F179 S180 A200	R172-A176 PolarHBondContact O-N 3.11Å; L173-A176 PolarHBondContact O-N 2.88Å; A176-F179 PolarHBondContact O-N 2.96Å; A176-S180 VanDerWaalsContact O-CB 3.31Å; A176-S180 WeakPolarHBondContact O-CB 3.09Å; A176-S180 PolarHBondContact O-N 3.25Å; A176-S180 PolarHBondContact O-OG 3.09Å; A176-A200 HydrophobicContact CB-CB 3.42Å; A176-A200 VanDerWaalsContact CB-CB 3.42Å
177	L	98.7	Very high	98.1	Very high	19 Å²	19	23.6 Å²	23.6	10%	0.099	12%	0.119	C	C	.	.	H	α-helix	trans	-55.8	-56.9	173.9	177.3	64.5	0	0	0	111	L173 L175 F179 S180 V181 I222 L225 L226 N229	L173-L177 PolarHBondContact O-N 3.49Å; L175-L177 VanDerWaalsContact C-N 3.3Å; L175-L177 PolarHBondContact O-N 2.99Å; L177-F179 VanDerWaalsContact C-N 3.34Å; L177-F179 PolarHBondContact O-N 3.39Å; L177-S180 PolarHBondContact O-N 3.49Å; L177-S180 PolarHBondContact O-OG 3.4Å; L177-V181 WeakPolarHBondContact O-CG2 3.4Å; L177-V181 PolarHBondContact O-N 3.16Å; L177-V181 VanDerWaalsContact O-N 3.12Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; L177-L225 HydrophobicContact CD1-CB 4.09Å; L177-L225 HydrophobicContact CD2-CB 3.93Å; L177-L225 HydrophobicContact CD2-CD1 3.91Å; L177-L226 HydrophobicContact CB-CD2 3.95Å; L177-L226 HydrophobicContact CB-CG 4.25Å; L177-L226 HydrophobicContact CD1-CD2 3.99Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; L177-N229 VanDerWaalsContact CD1-ND2 3.28Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.37Å
178	N	98.6	Very high	98.1	Very high	30 Å²	30	29.5 Å²	29.5	16%	0.16	15%	0.15	C	C	.	.	H	α-helix	trans	-67.8	-35	-176.1	-73.8	5.2	0	0	0	112.9	K125 D129 Y154 G174 L175 V181 F182	K125-N178 PolarHBondContact NZ-ND2 2.71Å; D129-N178 WeakPolarHBondContact OD1-CB 3.1Å; D129-N178 PolarHBondContact OD1-ND2 2.91Å; D129-N178 PolarHBondContact OD2-ND2 3.5Å; Y154-N178 HydrophobicContact CE1-CB 4.47Å; G174-N178 PolarHBondContact O-N 2.88Å; G174-N178 VanDerWaalsContact O-N 3.12Å; L175-N178 PolarHBondContact O-N 2.96Å; N178-V181 PolarHBondContact O-N 2.95Å; N178-F182 PolarHBondContact O-N 3.2Å
179	F	98.8	Very high	98.1	Very high	8 Å²	8	30.8 Å²	30.8	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-71.2	-34.6	177.9	-167.1	-172.5	0	0	0	111.7	L151 Y154 K155 L175 A176 L177 F182 Y183 L196	L151-F179 HydrophobicContact CD1-CE2 3.83Å; L151-F179 HydrophobicContact CD1-CZ 3.86Å; Y154-F179 HydrophobicContact CD2-CB 4Å; Y154-F179 AromaticContact CD2-CD2 3.39Å; Y154-F179 HydrophobicContact CD2-CD2 3.39Å; Y154-F179 AromaticContact CD2-CE2 3.97Å; Y154-F179 HydrophobicContact CD2-CE2 3.97Å; Y154-F179 AromaticContact CD2-CG 3.83Å; Y154-F179 HydrophobicContact CD2-CG 3.83Å; Y154-F179 HydrophobicContact CE2-CB 4.44Å; Y154-F179 HydrophobicContact CE2-CD2 4.27Å; Y154-F179 HydrophobicContact CG-CB 4.1Å; Y154-F179 HydrophobicContact CG-CD1 4.44Å; Y154-F179 AromaticContact CG-CD2 3.88Å; Y154-F179 HydrophobicContact CG-CD2 3.88Å; 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 3.5Å; L175-F179 PolarHBondContact O-N 2.62Å; A176-F179 PolarHBondContact O-N 2.96Å; L177-F179 VanDerWaalsContact C-N 3.34Å; L177-F179 PolarHBondContact O-N 3.39Å; F179-F182 HydrophobicContact CD2-CB 4.41Å; F179-F182 AromaticContact CD2-CD1 3.86Å; F179-F182 HydrophobicContact CD2-CD1 3.86Å; F179-F182 AromaticContact CE2-CD1 3.82Å; F179-F182 HydrophobicContact CE2-CD1 3.82Å; F179-F182 HydrophobicContact CE2-CE1 4.29Å; F179-F182 WeakPolarHBondContact O-CB 3.23Å; F179-F182 PolarHBondContact O-N 3.21Å; F179-Y183 HydrophobicContact CD1-CE2 4.35Å; F179-Y183 AromaticContact CD2-CD2 3.94Å; F179-Y183 HydrophobicContact CD2-CD2 3.94Å; 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 4.05Å; F179-Y183 HydrophobicContact CE2-CE1 4.33Å; F179-Y183 AromaticContact CE2-CE2 3.32Å; F179-Y183 HydrophobicContact CE2-CE2 3.32Å; F179-Y183 AromaticContact CE2-CZ 3.48Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.48Å; F179-Y183 HydrophobicContact CG-CE2 4.12Å; F179-Y183 AromaticContact CZ-CE2 3.63Å; F179-Y183 HydrophobicContact CZ-CE2 3.63Å; F179-Y183 AromaticContact CZ-CZ 3.67Å; F179-Y183 VanDerWaalsContact CZ-OH 3.23Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.49Å; F179-Y183 VanDerWaalsContact O-CD2 3.28Å; F179-Y183 WeakPolarHBondContact O-CD2 3.45Å; F179-Y183 PolarHBondContact O-N 2.96Å; F179-Y183 VanDerWaalsContact O-N 3.09Å; F179-L196 HydrophobicContact CB-CD2 3.77Å; F179-L196 HydrophobicContact CD1-CD2 3.7Å; F179-L196 HydrophobicContact CD2-CD2 4.49Å; F179-L196 HydrophobicContact CE1-CD2 4.49Å; F179-L196 HydrophobicContact CG-CD2 3.71Å
180	S	98.6	Very high	98.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-41.9	172.2	70.7	0	0	0	0	111.7	A176 L177 F182 Y183 Y184 A193 W233	A176-S180 VanDerWaalsContact O-CB 3.31Å; A176-S180 WeakPolarHBondContact O-CB 3.09Å; A176-S180 PolarHBondContact O-N 3.25Å; A176-S180 PolarHBondContact O-OG 3.09Å; L177-S180 PolarHBondContact O-N 3.49Å; L177-S180 PolarHBondContact O-OG 3.4Å; S180-F182 VanDerWaalsContact C-N 3.3Å; S180-F182 PolarHBondContact O-N 3.44Å; S180-Y183 PolarHBondContact O-N 3.4Å; S180-Y184 PolarHBondContact O-N 3.44Å; S180-A193 VanDerWaalsContact O-CB 3.25Å; S180-A193 WeakPolarHBondContact O-CB 3.42Å; S180-W233 WeakPolarHBondContact OG-CH2 3.38Å
181	V	98.4	Very high	98.1	Very high	18 Å²	18	34.8 Å²	34.8	11%	0.109	18%	0.182	C	C	.	.	H	α-helix	trans	-60.1	-40.3	174.1	173.5	0	0	0	0	111.2	L177 N178 Y184 E185 W233	L177-V181 WeakPolarHBondContact O-CG2 3.4Å; L177-V181 PolarHBondContact O-N 3.16Å; L177-V181 VanDerWaalsContact O-N 3.12Å; N178-V181 PolarHBondContact O-N 2.95Å; V181-Y184 PolarHBondContact O-N 2.83Å; V181-E185 VanDerWaalsContact CG1-CD 3.45Å; V181-E185 HydrophobicContact CG1-CG 3.99Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.15Å; V181-E185 WeakPolarHBondContact O-CB 3.45Å; V181-E185 PolarHBondContact O-N 2.89Å; V181-W233 HydrophobicContact CG2-CH2 3.99Å; V181-W233 HydrophobicContact CG2-CZ2 4.01Å
182	F	98.7	Very high	98.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-47.4	173.6	172.3	-113.7	0	0	0	113.2	R132 A147 T150 L151 Y154 N178 F179 S180 Y184 I186 L187	R132-F182 HydrophobicContact CG-CD2 4.16Å; A147-F182 HydrophobicContact CB-CE2 4.32Å; A147-F182 HydrophobicContact CB-CZ 4.41Å; A147-F182 WeakPolarHBondContact O-CZ 3.34Å; T150-F182 HydrophobicContact CG2-CB 4.44Å; T150-F182 HydrophobicContact CG2-CD1 4.12Å; T150-F182 HydrophobicContact CG2-CD2 3.38Å; T150-F182 HydrophobicContact CG2-CE1 4.17Å; T150-F182 HydrophobicContact CG2-CE2 3.48Å; T150-F182 VanDerWaalsContact CG2-CE2 3.48Å; T150-F182 HydrophobicContact CG2-CG 3.71Å; T150-F182 HydrophobicContact CG2-CZ 3.88Å; L151-F182 HydrophobicContact CB-CE1 3.98Å; L151-F182 HydrophobicContact CB-CZ 4.19Å; L151-F182 HydrophobicContact CD1-CE1 4.05Å; Y154-F182 HydrophobicContact CD2-CB 4.29Å; Y154-F182 HydrophobicContact CD2-CD1 4.33Å; Y154-F182 HydrophobicContact CD2-CG 4.38Å; Y154-F182 HydrophobicContact CE2-CB 3.83Å; Y154-F182 HydrophobicContact CE2-CG 4.19Å; N178-F182 PolarHBondContact O-N 3.2Å; F179-F182 HydrophobicContact CD2-CB 4.41Å; F179-F182 AromaticContact CD2-CD1 3.86Å; F179-F182 HydrophobicContact CD2-CD1 3.86Å; F179-F182 AromaticContact CE2-CD1 3.82Å; F179-F182 HydrophobicContact CE2-CD1 3.82Å; F179-F182 HydrophobicContact CE2-CE1 4.29Å; F179-F182 WeakPolarHBondContact O-CB 3.23Å; F179-F182 PolarHBondContact O-N 3.21Å; S180-F182 VanDerWaalsContact C-N 3.3Å; S180-F182 PolarHBondContact O-N 3.44Å; F182-Y184 PolarHBondContact O-N 2.75Å; F182-I186 HydrophobicContact CD2-CB 3.57Å; F182-I186 HydrophobicContact CD2-CG1 3.74Å; F182-I186 HydrophobicContact CD2-CG2 4.02Å; F182-I186 HydrophobicContact CE2-CB 3.67Å; F182-I186 HydrophobicContact CE2-CG1 4.2Å; F182-I186 HydrophobicContact CE2-CG2 3.59Å; F182-I186 WeakPolarHBondContact O-CB 3.33Å; F182-I186 PolarHBondContact O-N 3.48Å; 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 4.33Å; F182-L187 HydrophobicContact CE1-CG 3.65Å; F182-L187 HydrophobicContact CE2-CD2 4.39Å; F182-L187 HydrophobicContact CE2-CG 4.14Å; F182-L187 HydrophobicContact CZ-CD1 3.68Å; F182-L187 HydrophobicContact CZ-CD2 3.81Å; F182-L187 HydrophobicContact CZ-CG 3.56Å; F182-L187 PolarHBondContact O-N 2.89Å; F182-L187 VanDerWaalsContact O-N 3.14Å
183	Y	98.6	Very high	98	Very high	26 Å²	26	39.2 Å²	39.2	10%	0.102	20%	0.197	C	C	.	.	H	α-helix	trans	-59.1	-39.8	177.1	-80.5	-59.5	0	0	0	111.5	L151 F179 S180 L187 N188 S189 R192 L196	L151-Y183 HydrophobicContact CD1-CE1 4.38Å; F179-Y183 HydrophobicContact CD1-CE2 4.35Å; F179-Y183 AromaticContact CD2-CD2 3.94Å; F179-Y183 HydrophobicContact CD2-CD2 3.94Å; 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 4.05Å; F179-Y183 HydrophobicContact CE2-CE1 4.33Å; F179-Y183 AromaticContact CE2-CE2 3.32Å; F179-Y183 HydrophobicContact CE2-CE2 3.32Å; F179-Y183 AromaticContact CE2-CZ 3.48Å; F179-Y183 VanDerWaalsContact CE2-CZ 3.48Å; F179-Y183 HydrophobicContact CG-CE2 4.12Å; F179-Y183 AromaticContact CZ-CE2 3.63Å; F179-Y183 HydrophobicContact CZ-CE2 3.63Å; F179-Y183 AromaticContact CZ-CZ 3.67Å; F179-Y183 VanDerWaalsContact CZ-OH 3.23Å; F179-Y183 WeakPolarHBondContact CZ-OH 3.49Å; F179-Y183 VanDerWaalsContact O-CD2 3.28Å; F179-Y183 WeakPolarHBondContact O-CD2 3.45Å; F179-Y183 PolarHBondContact O-N 2.96Å; F179-Y183 VanDerWaalsContact O-N 3.09Å; S180-Y183 PolarHBondContact O-N 3.4Å; Y183-L187 HydrophobicContact CD1-CB 4.49Å; Y183-L187 HydrophobicContact CD1-CD1 3.68Å; Y183-L187 HydrophobicContact CE1-CD1 3.8Å; Y183-L187 CarbonylContact O-C 3.52Å; Y183-N188 PolarHBondContact O-N 3.49Å; Y183-S189 WeakPolarHBondContact O-CA 3.41Å; Y183-S189 PolarHBondContact O-N 2.81Å; Y183-R192 HydrophobicContact CD1-CB 3.88Å; Y183-R192 HydrophobicContact CD2-CB 4.39Å; Y183-R192 HydrophobicContact CE1-CB 4.34Å; Y183-R192 HydrophobicContact CG-CB 3.93Å; Y183-L196 HydrophobicContact CD2-CD2 4.02Å; Y183-L196 HydrophobicContact CE2-CD2 3.94Å
184	Y	98.3	Very high	98	Very high	57 Å²	57	40 Å²	40	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-70.3	-62.9	179	-166.7	-98.9	0	0	0	112	S180 V181 F182 N188 P190 A193 W233 D236	S180-Y184 PolarHBondContact O-N 3.44Å; V181-Y184 PolarHBondContact O-N 2.83Å; F182-Y184 PolarHBondContact O-N 2.75Å; Y184-N188 WeakPolarHBondContact O-CA 3.4Å; Y184-N188 PolarHBondContact O-N 3.45Å; Y184-P190 HydrophobicContact CD2-CB 3.96Å; Y184-P190 HydrophobicContact CE2-CB 3.89Å; Y184-A193 HydrophobicContact CD2-CB 4.33Å; Y184-W233 AromaticContact CD1-CD1 3.78Å; Y184-W233 AromaticContact CD1-CE2 3.92Å; Y184-W233 HydrophobicContact CD1-CG 4.5Å; Y184-W233 HydrophobicContact CD1-CZ2 4.46Å; Y184-W233 AromaticContact CD1-NE1 3.37Å; Y184-W233 HydrophobicContact CD2-CB 4.05Å; Y184-W233 AromaticContact CD2-CD1 3.53Å; Y184-W233 AromaticContact CD2-CD2 3.74Å; Y184-W233 HydrophobicContact CD2-CD2 3.74Å; Y184-W233 AromaticContact CD2-CE2 3.88Å; Y184-W233 HydrophobicContact CD2-CE3 4.49Å; Y184-W233 AromaticContact CD2-CG 3.51Å; Y184-W233 HydrophobicContact CD2-CG 3.51Å; Y184-W233 AromaticContact CD2-NE1 3.74Å; Y184-W233 AromaticContact CE1-CD1 3.49Å; Y184-W233 VanDerWaalsContact CE1-CD1 3.49Å; Y184-W233 HydrophobicContact CE1-CG 4.41Å; Y184-W233 AromaticContact CE1-NE1 3.47Å; Y184-W233 HydrophobicContact CE2-CB 3.69Å; Y184-W233 AromaticContact CE2-CD1 3.25Å; Y184-W233 HydrophobicContact CE2-CD2 4.17Å; Y184-W233 AromaticContact CE2-CG 3.42Å; Y184-W233 HydrophobicContact CE2-CG 3.42Å; Y184-W233 VanDerWaalsContact CE2-CG 3.42Å; Y184-W233 AromaticContact CE2-NE1 3.86Å; Y184-W233 AromaticContact CG-CD1 3.8Å; Y184-W233 AromaticContact CG-CD2 3.99Å; Y184-W233 HydrophobicContact CG-CD2 3.99Å; Y184-W233 AromaticContact CG-CE2 3.63Å; Y184-W233 HydrophobicContact CG-CG 4.08Å; Y184-W233 HydrophobicContact CG-CZ2 4.14Å; Y184-W233 AromaticContact CG-NE1 3.51Å; Y184-W233 AromaticContact CZ-CD1 3.22Å; Y184-W233 AromaticContact CZ-CG 3.9Å; Y184-W233 AromaticContact CZ-NE1 3.74Å; Y184-D236 PolarHBondContact OH-OD2 3.42Å
185	E	96.8	Very high	98	Very high	100 Å²	100	43.3 Å²	43.3	47%	0.467	22%	0.224	S	C	.	.	H	α-helix	trans	-79.5	-32.8	-166.7	-63.2	-176.5	166.1	0	0	113.7	V181	V181-E185 VanDerWaalsContact CG1-CD 3.45Å; V181-E185 HydrophobicContact CG1-CG 3.99Å; V181-E185 WeakPolarHBondContact CG1-OE2 3.15Å; V181-E185 WeakPolarHBondContact O-CB 3.45Å; V181-E185 PolarHBondContact O-N 2.89Å
186	I	98.2	Very high	98	Very high	19 Å²	19	44.8 Å²	44.8	10%	0.097	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-44.9	-172.7	-53.7	-56.2	0	0	0	112	R132 A135 E136 A147 F182	R132-I186 HydrophobicContact CG-CG1 3.98Å; A135-I186 HydrophobicContact CB-CD1 4.31Å; A135-I186 HydrophobicContact CB-CG2 3.81Å; E136-I186 HydrophobicContact CG-CD1 3.93Å; A147-I186 HydrophobicContact CB-CG2 4.04Å; F182-I186 HydrophobicContact CD2-CB 3.57Å; F182-I186 HydrophobicContact CD2-CG1 3.74Å; F182-I186 HydrophobicContact CD2-CG2 4.02Å; F182-I186 HydrophobicContact CE2-CB 3.67Å; F182-I186 HydrophobicContact CE2-CG1 4.2Å; F182-I186 HydrophobicContact CE2-CG2 3.59Å; F182-I186 WeakPolarHBondContact O-CB 3.33Å; F182-I186 PolarHBondContact O-N 3.48Å
187	L	97.8	Very high	97.9	Very high	55 Å²	55	44.2 Å²	44.2	29%	0.288	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-0.8	-179.6	-62.4	-172.9	0	0	0	113.8	A147 F182 Y183 S189	A147-L187 HydrophobicContact CB-CD2 4.48Å; 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 4.33Å; F182-L187 HydrophobicContact CE1-CG 3.65Å; F182-L187 HydrophobicContact CE2-CD2 4.39Å; F182-L187 HydrophobicContact CE2-CG 4.14Å; F182-L187 HydrophobicContact CZ-CD1 3.68Å; F182-L187 HydrophobicContact CZ-CD2 3.81Å; F182-L187 HydrophobicContact CZ-CG 3.56Å; F182-L187 PolarHBondContact O-N 2.89Å; F182-L187 VanDerWaalsContact O-N 3.14Å; Y183-L187 HydrophobicContact CD1-CB 4.49Å; Y183-L187 HydrophobicContact CD1-CD1 3.68Å; Y183-L187 HydrophobicContact CE1-CD1 3.8Å; Y183-L187 CarbonylContact O-C 3.52Å; L187-S189 PolarHBondContact O-N 3.21Å; L187-S189 VanDerWaalsContact O-N 3.11Å; L187-S189 PolarHBondContact O-OG 3.02Å
188	N	96.8	Very high	97.9	Very high	140 Å²	140	49 Å²	49	75%	0.749	25%	0.248	S	C	*	.			trans	46.4	44.2	-179.3	-166.5	41.8	0	0	0	112.4	Y183 Y184 P190	Y183-N188 PolarHBondContact O-N 3.49Å; Y184-N188 WeakPolarHBondContact O-CA 3.4Å; Y184-N188 PolarHBondContact O-N 3.45Å; N188-P190 VanDerWaalsContact C-CD 3.41Å; N188-P190 WeakPolarHBondContact O-CD 3.41Å
189	S	97.4	Very high	97.9	Very high	32 Å²	32	53 Å²	53	22%	0.224	27%	0.265	C	S	.	.			trans	-121.9	68.3	-173	-66.2	0	0	0	0	109.9	Y183 L187 D191 R192 A193	Y183-S189 WeakPolarHBondContact O-CA 3.41Å; Y183-S189 PolarHBondContact O-N 2.81Å; L187-S189 PolarHBondContact O-N 3.21Å; L187-S189 VanDerWaalsContact O-N 3.11Å; L187-S189 PolarHBondContact O-OG 3.02Å; S189-D191 VanDerWaalsContact C-N 3.28Å; S189-D191 PolarHBondContact O-N 3.17Å; S189-R192 PolarHBondContact O-N 3.41Å; S189-R192 VanDerWaalsContact O-N 3.09Å; S189-A193 PolarHBondContact O-N 3.24Å
190	P	96.6	Very high	97.9	Very high	35 Å²	35	53.3 Å²	53.3	23%	0.227	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-34.9	-174.3	24.8	-35.3	0	0	0	113.1	Y184 N188 R192 A193 C194 M237	Y184-P190 HydrophobicContact CD2-CB 3.96Å; Y184-P190 HydrophobicContact CE2-CB 3.89Å; N188-P190 VanDerWaalsContact C-CD 3.41Å; N188-P190 WeakPolarHBondContact O-CD 3.41Å; P190-R192 VanDerWaalsContact C-N 3.33Å; P190-R192 PolarHBondContact O-N 3.29Å; P190-A193 PolarHBondContact O-N 2.98Å; P190-C194 WeakPolarHBondContact O-CB 3.4Å; P190-C194 PolarHBondContact O-N 2.86Å; P190-C194 PolarHBondContact O-SG 3.06Å; P190-M237 HydrophobicContact CB-CG 4.12Å; P190-M237 HydrophobicContact CB-SD 3.95Å; P190-M237 HydrophobicContact CG-CG 4.44Å
191	D	96.2	Very high	97.8	Very high	105 Å²	105	55.1 Å²	55.1	56%	0.561	28%	0.277	S	S	*	.	H	α-helix	trans	-58.5	-44	175.1	-64.6	-49.5	0	0	0	112.2	S189 S195 M237	S189-D191 VanDerWaalsContact C-N 3.28Å; S189-D191 PolarHBondContact O-N 3.17Å; D191-S195 VanDerWaalsContact O-CB 3.27Å; D191-S195 WeakPolarHBondContact O-CB 3.49Å; D191-S195 PolarHBondContact O-N 3Å; D191-S195 PolarHBondContact O-OG 3.02Å; D191-M237 WeakPolarHBondContact OD1-CE 3.4Å
192	R	97.6	Very high	97.8	Very high	154 Å²	154	57.9 Å²	57.9	58%	0.581	29%	0.291	S	S	*	.	H	α-helix	trans	-70.8	-39.9	178.9	-69.2	-173.9	177.4	179.1	0.8	111.3	Y183 S189 P190 S195 L196	Y183-R192 HydrophobicContact CD1-CB 3.88Å; Y183-R192 HydrophobicContact CD2-CB 4.39Å; Y183-R192 HydrophobicContact CE1-CB 4.34Å; Y183-R192 HydrophobicContact CG-CB 3.93Å; S189-R192 PolarHBondContact O-N 3.41Å; S189-R192 VanDerWaalsContact O-N 3.09Å; P190-R192 VanDerWaalsContact C-N 3.33Å; P190-R192 PolarHBondContact O-N 3.29Å; R192-S195 PolarHBondContact O-N 3.36Å; R192-L196 WeakPolarHBondContact O-CB 3.48Å; R192-L196 PolarHBondContact O-N 3.08Å
193	A	98.1	Very high	97.8	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-50.8	175.9	0	0	0	0	0	111	S180 Y184 S189 P190 L196 A197 W233	S180-A193 VanDerWaalsContact O-CB 3.25Å; S180-A193 WeakPolarHBondContact O-CB 3.42Å; Y184-A193 HydrophobicContact CD2-CB 4.33Å; S189-A193 PolarHBondContact O-N 3.24Å; P190-A193 PolarHBondContact O-N 2.98Å; A193-L196 PolarHBondContact O-N 3.48Å; A193-A197 WeakPolarHBondContact O-CB 3.3Å; A193-A197 PolarHBondContact O-N 3.04Å; A193-W233 HydrophobicContact CB-CE3 4.01Å; A193-W233 HydrophobicContact CB-CZ3 3.94Å
194	C	97.9	Very high	97.7	Very high	17 Å²	17	59.3 Å²	59.3	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-42.7	179.3	-65.2	0	0	0	0	111.8	P190 L196 A197 K198 L230	P190-C194 WeakPolarHBondContact O-CB 3.4Å; P190-C194 PolarHBondContact O-N 2.86Å; P190-C194 PolarHBondContact O-SG 3.06Å; C194-L196 PolarHBondContact O-N 3.11Å; C194-A197 PolarHBondContact O-N 3.33Å; C194-K198 WeakPolarHBondContact O-CB 3Å; C194-K198 PolarHBondContact O-N 3.2Å; C194-L230 HydrophobicContact CB-CD2 4.11Å; C194-L230 WeakPolarHBondContact O-CD2 3.28Å
195	S	97.9	Very high	97.6	Very high	80 Å²	80	60.7 Å²	60.7	56%	0.559	31%	0.311	S	S	*	.	H	α-helix	trans	-59.7	-46.5	178.2	-61.4	0	0	0	0	111.5	D191 R192 Q199	D191-S195 VanDerWaalsContact O-CB 3.27Å; D191-S195 WeakPolarHBondContact O-CB 3.49Å; D191-S195 PolarHBondContact O-N 3Å; D191-S195 PolarHBondContact O-OG 3.02Å; R192-S195 PolarHBondContact O-N 3.36Å; S195-Q199 WeakPolarHBondContact O-CB 3.41Å; S195-Q199 PolarHBondContact O-N 3.07Å
196	L	98.3	Very high	97.6	Very high	34 Å²	34	60 Å²	60	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-47.5	179.6	179.7	63.5	0	0	0	112.1	F179 Y183 R192 A193 C194 K198 Q199 A200	F179-L196 HydrophobicContact CB-CD2 3.77Å; F179-L196 HydrophobicContact CD1-CD2 3.7Å; F179-L196 HydrophobicContact CD2-CD2 4.49Å; F179-L196 HydrophobicContact CE1-CD2 4.49Å; 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 3.48Å; R192-L196 PolarHBondContact O-N 3.08Å; A193-L196 PolarHBondContact O-N 3.48Å; C194-L196 PolarHBondContact O-N 3.11Å; L196-K198 VanDerWaalsContact C-N 3.33Å; L196-K198 PolarHBondContact O-N 2.79Å; L196-Q199 PolarHBondContact O-N 3.09Å; L196-A200 WeakPolarHBondContact O-CB 3.34Å; L196-A200 PolarHBondContact O-N 3.28Å
197	A	98.3	Very high	97.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-40.4	-179.5	0	0	0	0	0	111.7	A193 C194 F201 L226 L230 W233	A193-A197 WeakPolarHBondContact O-CB 3.3Å; A193-A197 PolarHBondContact O-N 3.04Å; C194-A197 PolarHBondContact O-N 3.33Å; A197-F201 WeakPolarHBondContact O-CB 3.5Å; A197-F201 PolarHBondContact O-N 3.11Å; A197-L226 HydrophobicContact CB-CD2 3.86Å; A197-L230 HydrophobicContact CB-CD1 4.3Å; A197-L230 HydrophobicContact CB-CD2 3.8Å; A197-L230 HydrophobicContact CB-CG 3.85Å; A197-W233 HydrophobicContact CB-CZ3 4.32Å
198	K	97.9	Very high	97.2	Very high	120 Å²	120	62 Å²	62	52%	0.522	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-47.5	177.4	-177.1	175.3	179.7	-178.7	0	111.5	C194 L196 A200 F201 D202 L230	C194-K198 WeakPolarHBondContact O-CB 3Å; C194-K198 PolarHBondContact O-N 3.2Å; L196-K198 VanDerWaalsContact C-N 3.33Å; L196-K198 PolarHBondContact O-N 2.79Å; K198-A200 VanDerWaalsContact C-N 3.35Å; K198-A200 PolarHBondContact O-N 2.82Å; K198-F201 PolarHBondContact O-N 3.36Å; K198-D202 WeakPolarHBondContact CE-OD2 3.38Å; K198-D202 WeakPolarHBondContact CG-OD2 3.45Å; K198-D202 WeakPolarHBondContact O-CB 3.49Å; K198-D202 VanDerWaalsContact O-CG 3.28Å; K198-D202 PolarHBondContact O-N 2.91Å; K198-L230 HydrophobicContact CB-CD1 4.18Å; K198-L230 HydrophobicContact CB-CD2 4.02Å
199	Q	98.3	Very high	96.9	Very high	112 Å²	112	63.4 Å²	63.4	52%	0.523	34%	0.339	S	S	.	.	H	α-helix	trans	-57.6	-48.6	177.3	-177.8	-179.8	3.3	0	0	111.3	S195 L196 F201 D202 D203	S195-Q199 WeakPolarHBondContact O-CB 3.41Å; S195-Q199 PolarHBondContact O-N 3.07Å; L196-Q199 PolarHBondContact O-N 3.09Å; Q199-F201 VanDerWaalsContact C-N 3.3Å; Q199-F201 PolarHBondContact O-N 3.25Å; Q199-D202 PolarHBondContact O-N 3.42Å; Q199-D203 WeakPolarHBondContact O-CB 3.46Å; Q199-D203 PolarHBondContact O-N 3.46Å
200	A	98.3	Very high	96.5	Very high	15 Å²	15	67 Å²	67	12%	0.124	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-37.4	179.3	0	0	0	0	0	112.8	A176 L196 K198 A204 L226	A176-A200 HydrophobicContact CB-CB 3.42Å; A176-A200 VanDerWaalsContact CB-CB 3.42Å; L196-A200 WeakPolarHBondContact O-CB 3.34Å; L196-A200 PolarHBondContact O-N 3.28Å; K198-A200 VanDerWaalsContact C-N 3.35Å; K198-A200 PolarHBondContact O-N 2.82Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.42Å; A200-A204 PolarHBondContact O-N 3.05Å; A200-A204 VanDerWaalsContact O-N 3.14Å; A200-L226 HydrophobicContact CB-CD1 4.29Å
201	F	97.9	Very high	96.2	Very high	38 Å²	38	66.7 Å²	66.7	17%	0.167	36%	0.356	C	S	.	.	H	α-helix	trans	-68.1	-47	176.6	-175.1	-98.3	0	0	0	111.9	A197 K198 Q199 A204 I205 M223 L226 R227	A197-F201 WeakPolarHBondContact O-CB 3.5Å; A197-F201 PolarHBondContact O-N 3.11Å; K198-F201 PolarHBondContact O-N 3.36Å; Q199-F201 VanDerWaalsContact C-N 3.3Å; Q199-F201 PolarHBondContact O-N 3.25Å; F201-A204 PolarHBondContact O-N 3.17Å; F201-I205 HydrophobicContact CD1-CD1 3.65Å; F201-I205 HydrophobicContact CD1-CG1 4.33Å; F201-I205 HydrophobicContact CE1-CD1 3.09Å; F201-I205 HydrophobicContact CE1-CG1 4.1Å; F201-I205 HydrophobicContact CE2-CD1 4.31Å; F201-I205 HydrophobicContact CG-CD1 4.48Å; F201-I205 HydrophobicContact CZ-CD1 3.48Å; F201-I205 VanDerWaalsContact CZ-CD1 3.48Å; F201-I205 HydrophobicContact CZ-CG1 4.29Å; F201-I205 WeakPolarHBondContact O-CB 3.33Å; F201-I205 WeakPolarHBondContact O-CG1 3.32Å; F201-I205 PolarHBondContact O-N 3.29Å; F201-M223 HydrophobicContact CD2-CB 4.13Å; F201-M223 WeakPolarHBondContact CD2-O 3.37Å; F201-M223 HydrophobicContact CE2-CB 4.11Å; F201-M223 WeakPolarHBondContact CE2-O 3.32Å; F201-L226 HydrophobicContact CD2-CB 4.42Å; F201-R227 HydrophobicContact CD2-CB 4.36Å; F201-R227 HydrophobicContact CE2-CB 3.84Å; F201-R227 HydrophobicContact CE2-CG 4.45Å; F201-R227 HydrophobicContact CZ-CB 4.17Å; F201-R227 HydrophobicContact CZ-CG 4.29Å
202	D	98	Very high	95.8	Very high	76 Å²	76	63.9 Å²	63.9	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-44.5	-179.8	-69	-15.6	0	0	0	111.1	K198 Q199 A204 I205 A206	K198-D202 WeakPolarHBondContact CE-OD2 3.38Å; K198-D202 WeakPolarHBondContact CG-OD2 3.45Å; K198-D202 WeakPolarHBondContact O-CB 3.49Å; K198-D202 VanDerWaalsContact O-CG 3.28Å; K198-D202 PolarHBondContact O-N 2.91Å; Q199-D202 PolarHBondContact O-N 3.42Å; D202-A204 VanDerWaalsContact C-N 3.34Å; D202-A204 PolarHBondContact O-N 2.95Å; D202-I205 PolarHBondContact O-N 3.49Å; D202-A206 PolarHBondContact O-N 3.37Å
203	D	97.7	Very high	95.3	Very high	57 Å²	57	65.6 Å²	65.6	31%	0.305	37%	0.366	S	S	.	.	H	α-helix	trans	-60.5	-42.5	176.3	-69.8	-11.4	0	0	0	111.2	P167 R172 Q199 A206	P167-D203 HydrophobicContact CB-CB 3.98Å; P167-D203 HydrophobicContact CG-CB 4.47Å; R172-D203 IonicContact NH2-OD2 3.69Å; Q199-D203 WeakPolarHBondContact O-CB 3.46Å; Q199-D203 PolarHBondContact O-N 3.46Å; D203-A206 PolarHBondContact O-N 2.9Å
204	A	97.2	Very high	94.8	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-73.2	-35.1	179.2	0	0	0	0	0	113	T168 L173 A200 F201 D202 A206 E207 L208 M223	T168-A204 HydrophobicContact CG2-CB 4.4Å; T168-A204 WeakPolarHBondContact CG2-O 3.41Å; L173-A204 HydrophobicContact CD2-CB 3.71Å; A200-A204 VanDerWaalsContact O-CB 3.26Å; A200-A204 WeakPolarHBondContact O-CB 3.42Å; A200-A204 PolarHBondContact O-N 3.05Å; A200-A204 VanDerWaalsContact O-N 3.14Å; F201-A204 PolarHBondContact O-N 3.17Å; D202-A204 VanDerWaalsContact C-N 3.34Å; D202-A204 PolarHBondContact O-N 2.95Å; A204-A206 VanDerWaalsContact C-N 3.3Å; A204-A206 PolarHBondContact O-N 3.48Å; A204-E207 PolarHBondContact O-N 3.24Å; A204-L208 WeakPolarHBondContact O-CB 3.46Å; A204-L208 PolarHBondContact O-N 2.96Å; A204-M223 HydrophobicContact CB-CE 3.87Å; A204-M223 HydrophobicContact CB-CG 4.29Å; A204-M223 HydrophobicContact CB-SD 3.95Å
205	I	96.5	Very high	94.5	Very high	85 Å²	85	75.5 Å²	75.5	44%	0.436	42%	0.415	S	S	.	.	H	α-helix	trans	-60.2	-43	172.6	-81.9	-174.4	0	0	0	110.8	F201 D202 E207 L208 M223	F201-I205 HydrophobicContact CD1-CD1 3.65Å; F201-I205 HydrophobicContact CD1-CG1 4.33Å; F201-I205 HydrophobicContact CE1-CD1 3.09Å; F201-I205 HydrophobicContact CE1-CG1 4.1Å; F201-I205 HydrophobicContact CE2-CD1 4.31Å; F201-I205 HydrophobicContact CG-CD1 4.48Å; F201-I205 HydrophobicContact CZ-CD1 3.48Å; F201-I205 VanDerWaalsContact CZ-CD1 3.48Å; F201-I205 HydrophobicContact CZ-CG1 4.29Å; F201-I205 WeakPolarHBondContact O-CB 3.33Å; F201-I205 WeakPolarHBondContact O-CG1 3.32Å; F201-I205 PolarHBondContact O-N 3.29Å; D202-I205 PolarHBondContact O-N 3.49Å; I205-E207 PolarHBondContact O-N 3.45Å; I205-L208 PolarHBondContact O-N 2.89Å; I205-M223 HydrophobicContact CB-CE 4.47Å; I205-M223 HydrophobicContact CG1-CE 3.58Å
206	A	96.4	Very high	94.2	Very high	86 Å²	86	77.3 Å²	77.3	71%	0.711	41%	0.411	S	S	*	.	H	α-helix	trans	-61.4	-25.4	-177.3	0	0	0	0	0	113.2	D202 D203 A204	D202-A206 PolarHBondContact O-N 3.37Å; D203-A206 PolarHBondContact O-N 2.9Å; A204-A206 VanDerWaalsContact C-N 3.3Å; A204-A206 PolarHBondContact O-N 3.48Å
207	E	95.4	Very high	94	Very high	80 Å²	80	83.4 Å²	83.4	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-114.3	5.8	-178.7	-65.9	-172.2	-156.9	0	0	113.5	P167 T168 A204 I205 D209 T210	P167-E207 WeakPolarHBondContact CD-OE2 3.4Å; T168-E207 HydrophobicContact CG2-CB 3.95Å; A204-E207 PolarHBondContact O-N 3.24Å; I205-E207 PolarHBondContact O-N 3.45Å; E207-D209 VanDerWaalsContact C-N 3.25Å; E207-D209 PolarHBondContact O-N 3.48Å; E207-T210 WeakPolarHBondContact O-CB 3.4Å; E207-T210 PolarHBondContact O-N 2.99Å; E207-T210 PolarHBondContact O-OG1 2.79Å
208	L	92.6	Very high	93.8	Very high	37 Å²	37	87.6 Å²	87.6	19%	0.194	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-59.9	-35.4	-172.2	-172.8	62.1	0	0	0	112.9	A204 I205 T210 L211 Y216 T220 M223	A204-L208 WeakPolarHBondContact O-CB 3.46Å; A204-L208 PolarHBondContact O-N 2.96Å; I205-L208 PolarHBondContact O-N 2.89Å; L208-T210 PolarHBondContact O-N 3.46Å; L208-T210 VanDerWaalsContact O-N 3.15Å; L208-L211 HydrophobicContact CD1-CD2 3.97Å; L208-L211 VanDerWaalsContact O-CB 3.23Å; L208-L211 WeakPolarHBondContact O-CB 3.32Å; L208-L211 PolarHBondContact O-N 3.17Å; L208-L211 VanDerWaalsContact O-N 3.11Å; L208-Y216 HydrophobicContact CD1-CE2 4.42Å; L208-T220 HydrophobicContact CD1-CG2 4.14Å; L208-M223 HydrophobicContact CD1-CE 4.37Å; L208-M223 HydrophobicContact CD1-SD 3.94Å; L208-M223 HydrophobicContact CD2-CE 4.32Å
209	D	91.3	Very high	93.7	Very high	169 Å²	169	81.9 Å²	81.9	90%	0.904	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-65.2	-15.6	179	-67.8	-23.3	0	0	0	113.3	E207	E207-D209 VanDerWaalsContact C-N 3.25Å; E207-D209 PolarHBondContact O-N 3.48Å
210	T	88.8	Confident	93.6	Very high	107 Å²	107	78.6 Å²	78.6	66%	0.656	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-91.4	-6.6	178.6	72.2	0	0	0	0	113.2	E207 L208	E207-T210 WeakPolarHBondContact O-CB 3.4Å; E207-T210 PolarHBondContact O-N 2.99Å; E207-T210 PolarHBondContact O-OG1 2.79Å; L208-T210 PolarHBondContact O-N 3.46Å; L208-T210 VanDerWaalsContact O-N 3.15Å
211	L	89.1	Confident	93.6	Very high	29 Å²	29	82.9 Å²	82.9	15%	0.152	44%	0.441	C	S	.	.			trans	-76.1	126.1	-172.1	-171.6	59.4	0	0	0	111.6	L208 Y216	L208-L211 HydrophobicContact CD1-CD2 3.97Å; L208-L211 VanDerWaalsContact O-CB 3.23Å; L208-L211 WeakPolarHBondContact O-CB 3.32Å; L208-L211 PolarHBondContact O-N 3.17Å; L208-L211 VanDerWaalsContact O-N 3.11Å; L211-Y216 HydrophobicContact CB-CD2 4.43Å; L211-Y216 HydrophobicContact CD2-CD2 4.13Å; L211-Y216 HydrophobicContact CG-CD2 4.42Å
212	G	88	Confident	93.6	Very high	46 Å²	46	82.4 Å²	82.4	47%	0.474	44%	0.44	S	S	.	.			trans	-68.7	157.2	175.4	0	0	0	0	0	113.2	E214 S215 Y216	G212-E214 PolarHBondContact O-N 3.25Å; G212-S215 PolarHBondContact O-N 3.21Å; G212-Y216 PolarHBondContact O-N 3.14Å; G212-Y216 VanDerWaalsContact O-N 3.15Å
213	E	88.1	Confident	93.6	Very high	189 Å²	189	79.2 Å²	79.2	88%	0.883	42%	0.423	S	S	*	.	H	α-helix	trans	-57.3	-33.7	-176.1	-67	-175.4	173.3	0	0	113.6	S215 Y216	E213-S215 PolarHBondContact O-N 3.5Å; E213-Y216 PolarHBondContact O-N 3.46Å
214	E	87.7	Confident	93.6	Very high	185 Å²	185	79.5 Å²	79.5	86%	0.864	42%	0.422	S	S	*	.	H	α-helix	trans	-62.6	-41.9	-176.8	-172.2	174.7	-172.4	0	0	112.7	G212	G212-E214 PolarHBondContact O-N 3.25Å
215	S	90.3	Very high	93.6	Very high	41 Å²	41	83.1 Å²	83.1	29%	0.287	44%	0.441	S	S	.	.	H	α-helix	trans	-95.1	-13.2	-178.9	-65.1	0	0	0	0	113.2	G212 E213 K217 D218 S219	G212-S215 PolarHBondContact O-N 3.21Å; E213-S215 PolarHBondContact O-N 3.5Å; S215-K217 VanDerWaalsContact C-N 3.35Å; S215-K217 PolarHBondContact O-N 2.78Å; S215-D218 PolarHBondContact O-N 2.96Å; S215-S219 WeakPolarHBondContact O-CB 3.24Å; S215-S219 PolarHBondContact O-N 2.74Å; S215-S219 PolarHBondContact O-OG 2.87Å
216	Y	91.7	Very high	93.7	Very high	118 Å²	118	79.1 Å²	79.1	46%	0.463	42%	0.42	S	S	.	.	H	α-helix	trans	-55.1	-47.2	-171.4	-171.5	-90.6	0	0	0	112.9	L208 L211 G212 E213 T220	L208-Y216 HydrophobicContact CD1-CE2 4.42Å; L211-Y216 HydrophobicContact CB-CD2 4.43Å; L211-Y216 HydrophobicContact CD2-CD2 4.13Å; L211-Y216 HydrophobicContact CG-CD2 4.42Å; G212-Y216 PolarHBondContact O-N 3.14Å; G212-Y216 VanDerWaalsContact O-N 3.15Å; E213-Y216 PolarHBondContact O-N 3.46Å; Y216-T220 HydrophobicContact CD1-CG2 4.16Å; Y216-T220 HydrophobicContact CD2-CG2 4.49Å; Y216-T220 HydrophobicContact CE1-CG2 3.84Å; Y216-T220 HydrophobicContact CE2-CG2 4.19Å; Y216-T220 HydrophobicContact CG-CG2 4.47Å; Y216-T220 WeakPolarHBondContact O-CB 3.43Å; Y216-T220 VanDerWaalsContact O-CG2 3.25Å; Y216-T220 WeakPolarHBondContact O-CG2 3.37Å; Y216-T220 PolarHBondContact O-N 3.25Å; Y216-T220 PolarHBondContact O-OG1 2.91Å
217	K	94	Very high	93.8	Very high	162 Å²	162	80.7 Å²	80.7	70%	0.704	41%	0.408	S	S	*	.	H	α-helix	trans	-64.1	-44.3	-178.1	-175	-175.8	175.7	-171.9	0	112.2	S215 T220 L221	S215-K217 VanDerWaalsContact C-N 3.35Å; S215-K217 PolarHBondContact O-N 2.78Å; K217-T220 PolarHBondContact O-OG1 2.79Å; K217-L221 WeakPolarHBondContact O-CB 3.41Å; K217-L221 PolarHBondContact O-N 2.95Å; K217-L221 VanDerWaalsContact O-N 3.13Å
218	D	94.4	Very high	93.9	Very high	88 Å²	88	80.2 Å²	80.2	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-72.5	-44.3	-176.1	-71.9	-12.5	0	0	0	111	P170 S215 L221 I222	P170-D218 HydrophobicContact CB-CB 4.22Å; P170-D218 HydrophobicContact CG-CB 4.12Å; S215-D218 PolarHBondContact O-N 2.96Å; D218-L221 PolarHBondContact O-N 2.74Å; D218-I222 VanDerWaalsContact O-CG1 3.28Å; D218-I222 WeakPolarHBondContact O-CG1 3.5Å; D218-I222 PolarHBondContact O-N 3.31Å; D218-I222 VanDerWaalsContact O-N 3.08Å
219	S	96.4	Very high	94.1	Very high	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-46.5	177.5	-59.7	0	0	0	0	112.1	T168 P170 S215 L221 I222 M223	T168-S219 WeakPolarHBondContact O-CB 3.13Å; T168-S219 PolarHBondContact O-OG 3.39Å; P170-S219 WeakPolarHBondContact CD-OG 3.43Å; P170-S219 WeakPolarHBondContact CG-OG 3.35Å; S215-S219 WeakPolarHBondContact O-CB 3.24Å; S215-S219 PolarHBondContact O-N 2.74Å; S215-S219 PolarHBondContact O-OG 2.87Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.11Å; S219-I222 PolarHBondContact O-N 2.94Å; S219-I222 VanDerWaalsContact O-N 3.16Å; S219-M223 VanDerWaalsContact O-CG 3.27Å; S219-M223 WeakPolarHBondContact O-CG 3.27Å; S219-M223 PolarHBondContact O-N 3.37Å
220	T	96.6	Very high	94.3	Very high	43 Å²	43	73.3 Å²	73.3	26%	0.264	37%	0.371	S	S	.	.	H	α-helix	trans	-65.6	-35.6	179.9	52.9	0	0	0	0	112.4	L208 Y216 K217 M223 Q224	L208-T220 HydrophobicContact CD1-CG2 4.14Å; Y216-T220 HydrophobicContact CD1-CG2 4.16Å; Y216-T220 HydrophobicContact CD2-CG2 4.49Å; Y216-T220 HydrophobicContact CE1-CG2 3.84Å; Y216-T220 HydrophobicContact CE2-CG2 4.19Å; Y216-T220 HydrophobicContact CG-CG2 4.47Å; Y216-T220 WeakPolarHBondContact O-CB 3.43Å; Y216-T220 VanDerWaalsContact O-CG2 3.25Å; Y216-T220 WeakPolarHBondContact O-CG2 3.37Å; Y216-T220 PolarHBondContact O-N 3.25Å; Y216-T220 PolarHBondContact O-OG1 2.91Å; K217-T220 PolarHBondContact O-OG1 2.79Å; T220-M223 PolarHBondContact O-N 2.65Å; T220-Q224 WeakPolarHBondContact O-CB 3.46Å; T220-Q224 PolarHBondContact O-N 2.8Å
221	L	97.3	Very high	94.7	Very high	104 Å²	104	72.4 Å²	72.4	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-61.8	-43.1	171.9	179.2	62.6	0	0	0	111.7	K217 D218 S219 Q224 L225	K217-L221 WeakPolarHBondContact O-CB 3.41Å; K217-L221 PolarHBondContact O-N 2.95Å; K217-L221 VanDerWaalsContact O-N 3.13Å; D218-L221 PolarHBondContact O-N 2.74Å; S219-L221 VanDerWaalsContact C-N 3.33Å; S219-L221 PolarHBondContact O-N 3.11Å; L221-Q224 WeakPolarHBondContact O-CB 3.36Å; L221-Q224 PolarHBondContact O-N 3.49Å; L221-L225 WeakPolarHBondContact O-CG 3.43Å; L221-L225 PolarHBondContact O-N 3.34Å; L221-L225 VanDerWaalsContact O-N 3.16Å
222	I	98	Very high	94.9	Very high	28 Å²	28	75.4 Å²	75.4	14%	0.144	38%	0.381	C	S	.	.	H	α-helix	trans	-70.1	-40.5	179	-61.2	163.4	0	0	0	111.2	P170 L173 L177 D218 S219 Q224 L225 L226	P170-I222 HydrophobicContact CB-CD1 4.11Å; P170-I222 WeakPolarHBondContact O-CD1 3.4Å; L173-I222 HydrophobicContact CB-CB 4.14Å; L173-I222 HydrophobicContact CB-CD1 4.39Å; L173-I222 HydrophobicContact CB-CG2 3.63Å; L177-I222 HydrophobicContact CB-CG2 4.27Å; L177-I222 HydrophobicContact CD2-CG2 4.17Å; D218-I222 VanDerWaalsContact O-CG1 3.28Å; D218-I222 WeakPolarHBondContact O-CG1 3.5Å; D218-I222 PolarHBondContact O-N 3.31Å; D218-I222 VanDerWaalsContact O-N 3.08Å; S219-I222 PolarHBondContact O-N 2.94Å; S219-I222 VanDerWaalsContact O-N 3.16Å; I222-Q224 VanDerWaalsContact C-N 3.25Å; I222-Q224 PolarHBondContact O-N 3.19Å; I222-L225 WeakPolarHBondContact O-CB 3.35Å; I222-L225 PolarHBondContact O-N 3.31Å; I222-L225 VanDerWaalsContact O-N 3.15Å; I222-L226 PolarHBondContact O-N 3.08Å
223	M	97.9	Very high	95.2	Very high	9 Å²	9	73.5 Å²	73.5	4%	0.044	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-38.5	174	-70.2	170.9	72.9	0	0	111.6	L173 F201 A204 I205 L208 S219 T220 L226 R227	L173-M223 HydrophobicContact CD1-CG 3.93Å; L173-M223 HydrophobicContact CD1-SD 4.41Å; L173-M223 HydrophobicContact CD2-CG 4.06Å; F201-M223 HydrophobicContact CD2-CB 4.13Å; F201-M223 WeakPolarHBondContact CD2-O 3.37Å; F201-M223 HydrophobicContact CE2-CB 4.11Å; F201-M223 WeakPolarHBondContact CE2-O 3.32Å; A204-M223 HydrophobicContact CB-CE 3.87Å; A204-M223 HydrophobicContact CB-CG 4.29Å; A204-M223 HydrophobicContact CB-SD 3.95Å; I205-M223 HydrophobicContact CB-CE 4.47Å; I205-M223 HydrophobicContact CG1-CE 3.58Å; L208-M223 HydrophobicContact CD1-CE 4.37Å; L208-M223 HydrophobicContact CD1-SD 3.94Å; L208-M223 HydrophobicContact CD2-CE 4.32Å; S219-M223 VanDerWaalsContact O-CG 3.27Å; S219-M223 WeakPolarHBondContact O-CG 3.27Å; S219-M223 PolarHBondContact O-N 3.37Å; T220-M223 PolarHBondContact O-N 2.65Å; M223-L226 WeakPolarHBondContact O-CB 3.42Å; M223-L226 PolarHBondContact O-N 3.19Å; M223-R227 PolarHBondContact O-N 2.88Å
224	Q	97.9	Very high	95.4	Very high	64 Å²	64	67.8 Å²	67.8	30%	0.299	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-46	174	178.4	55	30.3	0	0	111.7	T220 L221 I222 L226 R227 D228	T220-Q224 WeakPolarHBondContact O-CB 3.46Å; T220-Q224 PolarHBondContact O-N 2.8Å; L221-Q224 WeakPolarHBondContact O-CB 3.36Å; L221-Q224 PolarHBondContact O-N 3.49Å; I222-Q224 VanDerWaalsContact C-N 3.25Å; I222-Q224 PolarHBondContact O-N 3.19Å; Q224-L226 PolarHBondContact O-N 3.42Å; Q224-R227 WeakPolarHBondContact O-CB 3.2Å; Q224-R227 PolarHBondContact O-N 3.42Å; Q224-D228 PolarHBondContact NE2-OD1 2.81Å; Q224-D228 PolarHBondContact NE2-OD2 3.28Å; Q224-D228 PolarHBondContact O-N 2.89Å
225	L	98.3	Very high	95.4	Very high	76 Å²	76	61.4 Å²	61.4	40%	0.398	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-39.2	176.5	-66.1	172	0	0	0	112.6	L177 L221 I222 D228 N229	L177-L225 HydrophobicContact CD1-CB 4.09Å; L177-L225 HydrophobicContact CD2-CB 3.93Å; L177-L225 HydrophobicContact CD2-CD1 3.91Å; L221-L225 WeakPolarHBondContact O-CG 3.43Å; L221-L225 PolarHBondContact O-N 3.34Å; L221-L225 VanDerWaalsContact O-N 3.16Å; I222-L225 WeakPolarHBondContact O-CB 3.35Å; I222-L225 PolarHBondContact O-N 3.31Å; I222-L225 VanDerWaalsContact O-N 3.15Å; L225-D228 PolarHBondContact O-N 3.41Å; L225-N229 WeakPolarHBondContact O-CB 3.48Å; L225-N229 PolarHBondContact O-N 3.1Å
226	L	98.3	Very high	95	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-46.3	173.7	-78.1	167.9	0	0	0	111.5	L173 L177 A197 A200 F201 I222 M223 Q224 N229 L230	L173-L226 HydrophobicContact CD2-CD1 3.99Å; L177-L226 HydrophobicContact CB-CD2 3.95Å; L177-L226 HydrophobicContact CB-CG 4.25Å; L177-L226 HydrophobicContact CD1-CD2 3.99Å; L177-L226 HydrophobicContact CD1-CG 4.19Å; A197-L226 HydrophobicContact CB-CD2 3.86Å; A200-L226 HydrophobicContact CB-CD1 4.29Å; F201-L226 HydrophobicContact CD2-CB 4.42Å; I222-L226 PolarHBondContact O-N 3.08Å; M223-L226 WeakPolarHBondContact O-CB 3.42Å; M223-L226 PolarHBondContact O-N 3.19Å; Q224-L226 PolarHBondContact O-N 3.42Å; L226-N229 PolarHBondContact O-N 2.88Å; L226-L230 WeakPolarHBondContact O-CG 3.32Å; L226-L230 PolarHBondContact O-N 3.18Å
227	R	97.5	Very high	94.4	Very high	119 Å²	119	60 Å²	60	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-41.9	177.4	-172.6	-174.5	73.6	178.9	6	112.3	F201 M223 Q224 L230 T231	F201-R227 HydrophobicContact CD2-CB 4.36Å; F201-R227 HydrophobicContact CE2-CB 3.84Å; F201-R227 HydrophobicContact CE2-CG 4.45Å; F201-R227 HydrophobicContact CZ-CB 4.17Å; F201-R227 HydrophobicContact CZ-CG 4.29Å; M223-R227 PolarHBondContact O-N 2.88Å; Q224-R227 WeakPolarHBondContact O-CB 3.2Å; Q224-R227 PolarHBondContact O-N 3.42Å; R227-L230 PolarHBondContact O-N 2.92Å; R227-T231 PolarHBondContact O-N 3.45Å; R227-T231 PolarHBondContact O-OG1 3.21Å
228	D	97.8	Very high	93.5	Very high	71 Å²	71	56.2 Å²	56.2	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-42.1	-179.2	-65	-11.7	0	0	0	110.5	Q224 L225 T231 L232	Q224-D228 PolarHBondContact NE2-OD1 2.81Å; Q224-D228 PolarHBondContact NE2-OD2 3.28Å; Q224-D228 PolarHBondContact O-N 2.89Å; L225-D228 PolarHBondContact O-N 3.41Å; D228-T231 PolarHBondContact O-N 3.05Å; D228-L232 PolarHBondContact O-N 3.4Å
229	N	96.6	Very high	92.4	Very high	35 Å²	35	55.9 Å²	55.9	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-45.4	172.7	-78.5	-2.6	0	0	0	112.6	L177 L225 L226 T231 L232 W233	L177-N229 VanDerWaalsContact CD1-ND2 3.28Å; L177-N229 WeakPolarHBondContact CD1-ND2 3.37Å; L225-N229 WeakPolarHBondContact O-CB 3.48Å; L225-N229 PolarHBondContact O-N 3.1Å; L226-N229 PolarHBondContact O-N 2.88Å; N229-T231 VanDerWaalsContact C-N 3.27Å; N229-T231 PolarHBondContact O-N 2.89Å; N229-L232 PolarHBondContact O-N 3.25Å; N229-W233 HydrophobicContact CB-CD2 4.21Å; N229-W233 HydrophobicContact CB-CE3 4.07Å; N229-W233 HydrophobicContact CB-CH2 3.66Å; N229-W233 HydrophobicContact CB-CZ2 3.79Å; N229-W233 HydrophobicContact CB-CZ3 3.8Å; N229-W233 WeakPolarHBondContact O-CB 3.44Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.42Å
230	L	96.3	Very high	90.8	Very high	26 Å²	26	59.4 Å²	59.4	14%	0.136	32%	0.323	C	S	.	.	H	α-helix	trans	-57.2	-42.8	175.9	-78	167.8	0	0	0	111.7	C194 A197 K198 L226 R227 T234	C194-L230 HydrophobicContact CB-CD2 4.11Å; C194-L230 WeakPolarHBondContact O-CD2 3.28Å; A197-L230 HydrophobicContact CB-CD1 4.3Å; A197-L230 HydrophobicContact CB-CD2 3.8Å; A197-L230 HydrophobicContact CB-CG 3.85Å; K198-L230 HydrophobicContact CB-CD1 4.18Å; K198-L230 HydrophobicContact CB-CD2 4.02Å; L226-L230 WeakPolarHBondContact O-CG 3.32Å; L226-L230 PolarHBondContact O-N 3.18Å; R227-L230 PolarHBondContact O-N 2.92Å; L230-T234 VanDerWaalsContact O-CB 3.32Å; L230-T234 WeakPolarHBondContact O-CB 3.48Å; L230-T234 VanDerWaalsContact O-CG2 3.22Å; L230-T234 WeakPolarHBondContact O-CG2 3.39Å; L230-T234 PolarHBondContact O-N 3.23Å; L230-T234 PolarHBondContact O-OG1 2.7Å
231	T	95.6	Very high	88.9	Confident	87 Å²	87	58.5 Å²	58.5	53%	0.534	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-46.9	178.8	-55.5	0	0	0	0	110.9	R227 D228 N229 T234 S235	R227-T231 PolarHBondContact O-N 3.45Å; R227-T231 PolarHBondContact O-OG1 3.21Å; D228-T231 PolarHBondContact O-N 3.05Å; N229-T231 VanDerWaalsContact C-N 3.27Å; N229-T231 PolarHBondContact O-N 2.89Å; T231-T234 PolarHBondContact O-OG1 3.49Å; T231-S235 PolarHBondContact O-N 3.15Å; T231-S235 VanDerWaalsContact O-N 3.17Å; T231-S235 PolarHBondContact O-OG 3.23Å
232	L	94.2	Very high	86.7	Confident	92 Å²	92	57.7 Å²	57.7	48%	0.482	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-54.2	178.4	-179.5	64.9	0	0	0	111.6	D228 N229 T234 S235 D236	D228-L232 PolarHBondContact O-N 3.4Å; N229-L232 PolarHBondContact O-N 3.25Å; L232-T234 PolarHBondContact O-N 3.48Å; L232-S235 PolarHBondContact O-N 3.42Å; L232-S235 PolarHBondContact O-OG 3.4Å; L232-D236 PolarHBondContact O-N 3.31Å; L232-D236 VanDerWaalsContact O-N 3.09Å
233	W	95.3	Very high	84.5	Confident	6 Å²	6	62.5 Å²	62.5	2%	0.023	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-33.5	-173.2	-58	-26	0	0	0	113.1	S180 V181 Y184 A193 A197 N229 D236 M237	S180-W233 WeakPolarHBondContact OG-CH2 3.38Å; V181-W233 HydrophobicContact CG2-CH2 3.99Å; V181-W233 HydrophobicContact CG2-CZ2 4.01Å; Y184-W233 AromaticContact CD1-CD1 3.78Å; Y184-W233 AromaticContact CD1-CE2 3.92Å; Y184-W233 HydrophobicContact CD1-CG 4.5Å; Y184-W233 HydrophobicContact CD1-CZ2 4.46Å; Y184-W233 AromaticContact CD1-NE1 3.37Å; Y184-W233 HydrophobicContact CD2-CB 4.05Å; Y184-W233 AromaticContact CD2-CD1 3.53Å; Y184-W233 AromaticContact CD2-CD2 3.74Å; Y184-W233 HydrophobicContact CD2-CD2 3.74Å; Y184-W233 AromaticContact CD2-CE2 3.88Å; Y184-W233 HydrophobicContact CD2-CE3 4.49Å; Y184-W233 AromaticContact CD2-CG 3.51Å; Y184-W233 HydrophobicContact CD2-CG 3.51Å; Y184-W233 AromaticContact CD2-NE1 3.74Å; Y184-W233 AromaticContact CE1-CD1 3.49Å; Y184-W233 VanDerWaalsContact CE1-CD1 3.49Å; Y184-W233 HydrophobicContact CE1-CG 4.41Å; Y184-W233 AromaticContact CE1-NE1 3.47Å; Y184-W233 HydrophobicContact CE2-CB 3.69Å; Y184-W233 AromaticContact CE2-CD1 3.25Å; Y184-W233 HydrophobicContact CE2-CD2 4.17Å; Y184-W233 AromaticContact CE2-CG 3.42Å; Y184-W233 HydrophobicContact CE2-CG 3.42Å; Y184-W233 VanDerWaalsContact CE2-CG 3.42Å; Y184-W233 AromaticContact CE2-NE1 3.86Å; Y184-W233 AromaticContact CG-CD1 3.8Å; Y184-W233 AromaticContact CG-CD2 3.99Å; Y184-W233 HydrophobicContact CG-CD2 3.99Å; Y184-W233 AromaticContact CG-CE2 3.63Å; Y184-W233 HydrophobicContact CG-CG 4.08Å; Y184-W233 HydrophobicContact CG-CZ2 4.14Å; Y184-W233 AromaticContact CG-NE1 3.51Å; Y184-W233 AromaticContact CZ-CD1 3.22Å; Y184-W233 AromaticContact CZ-CG 3.9Å; Y184-W233 AromaticContact CZ-NE1 3.74Å; A193-W233 HydrophobicContact CB-CE3 4.01Å; A193-W233 HydrophobicContact CB-CZ3 3.94Å; A197-W233 HydrophobicContact CB-CZ3 4.32Å; N229-W233 HydrophobicContact CB-CD2 4.21Å; N229-W233 HydrophobicContact CB-CE3 4.07Å; N229-W233 HydrophobicContact CB-CH2 3.66Å; N229-W233 HydrophobicContact CB-CZ2 3.79Å; N229-W233 HydrophobicContact CB-CZ3 3.8Å; N229-W233 WeakPolarHBondContact O-CB 3.44Å; N229-W233 VanDerWaalsContact O-CD2 3.27Å; N229-W233 PolarHBondContact O-N 3.42Å; W233-D236 PolarHBondContact O-N 3.41Å; W233-M237 VanDerWaalsContact O-CG 3.31Å; W233-M237 WeakPolarHBondContact O-CG 2.9Å; W233-M237 PolarHBondContact O-N 3.15Å; W233-M237 VanDerWaalsContact O-N 3.14Å
234	T	91.1	Very high	82.3	Confident	70 Å²	70	67.7 Å²	67.7	43%	0.429	37%	0.367	S	S	.	.	H	α-helix	trans	-69.2	-35	174.1	53.5	0	0	0	0	111.9	L230 T231 L232 M237 T238	L230-T234 VanDerWaalsContact O-CB 3.32Å; L230-T234 WeakPolarHBondContact O-CB 3.48Å; L230-T234 VanDerWaalsContact O-CG2 3.22Å; L230-T234 WeakPolarHBondContact O-CG2 3.39Å; L230-T234 PolarHBondContact O-N 3.23Å; L230-T234 PolarHBondContact O-OG1 2.7Å; T231-T234 PolarHBondContact O-OG1 3.49Å; L232-T234 PolarHBondContact O-N 3.48Å; T234-M237 PolarHBondContact O-N 3.49Å; T234-T238 WeakPolarHBondContact O-CG2 3.5Å; T234-T238 PolarHBondContact O-N 2.94Å
235	S	88.2	Confident	80	Confident	51 Å²	51	70.7 Å²	70.7	36%	0.357	38%	0.379	S	S	.	.	H	α-helix	trans	-64.4	-43	172.5	64.5	0	0	0	0	112.5	T231 L232 M237 T238 V239	T231-S235 PolarHBondContact O-N 3.15Å; T231-S235 VanDerWaalsContact O-N 3.17Å; T231-S235 PolarHBondContact O-OG 3.23Å; L232-S235 PolarHBondContact O-N 3.42Å; L232-S235 PolarHBondContact O-OG 3.4Å; S235-M237 VanDerWaalsContact C-N 3.29Å; S235-M237 PolarHBondContact O-N 3.02Å; S235-T238 PolarHBondContact O-N 3.02Å; S235-T238 VanDerWaalsContact O-N 3.08Å; S235-T238 PolarHBondContact O-OG1 3.17Å; S235-V239 WeakPolarHBondContact O-CG2 3.36Å; S235-V239 PolarHBondContact O-N 2.84Å
236	D	80.9	Confident	77.6	Confident	63 Å²	63	74.1 Å²	74.1	34%	0.337	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-37.5	178.1	-70.5	-13.9	0	0	0	111.9	Y184 L232 W233 T240	Y184-D236 PolarHBondContact OH-OD2 3.42Å; L232-D236 PolarHBondContact O-N 3.31Å; L232-D236 VanDerWaalsContact O-N 3.09Å; W233-D236 PolarHBondContact O-N 3.41Å; D236-T240 WeakPolarHBondContact O-CG2 2.85Å; D236-T240 PolarHBondContact O-N 2.76Å; D236-T240 VanDerWaalsContact O-N 3.07Å; D236-T240 PolarHBondContact O-OG1 2.84Å
237	M	79.4	Confident	75.5	Confident	65 Å²	65	78.4 Å²	78.4	32%	0.32	43%	0.429	S	S	.	.	H	α-helix	trans	-67.6	-34	175	-70.3	174.9	72	0	0	113.2	P190 D191 W233 T234 S235 T240 G241	P190-M237 HydrophobicContact CB-CG 4.12Å; P190-M237 HydrophobicContact CB-SD 3.95Å; P190-M237 HydrophobicContact CG-CG 4.44Å; D191-M237 WeakPolarHBondContact OD1-CE 3.4Å; W233-M237 VanDerWaalsContact O-CG 3.31Å; W233-M237 WeakPolarHBondContact O-CG 2.9Å; W233-M237 PolarHBondContact O-N 3.15Å; W233-M237 VanDerWaalsContact O-N 3.14Å; T234-M237 PolarHBondContact O-N 3.49Å; S235-M237 VanDerWaalsContact C-N 3.29Å; S235-M237 PolarHBondContact O-N 3.02Å; M237-T240 WeakPolarHBondContact CA-OG1 3.23Å; M237-T240 PolarHBondContact O-OG1 3.35Å; M237-G241 PolarHBondContact O-N 3.14Å
238	T	75.4	Confident	73.1	Confident	84 Å²	84	76.6 Å²	76.6	52%	0.515	43%	0.434	S	S	.	.	H	α-helix	trans	-71.8	-40.8	176.1	55.7	0	0	0	0	112.3	T234 S235 G241 D242	T234-T238 WeakPolarHBondContact O-CG2 3.5Å; T234-T238 PolarHBondContact O-N 2.94Å; S235-T238 PolarHBondContact O-N 3.02Å; S235-T238 VanDerWaalsContact O-N 3.08Å; S235-T238 PolarHBondContact O-OG1 3.17Å; T238-G241 PolarHBondContact O-N 3.3Å; T238-D242 PolarHBondContact O-N 3.16Å
239	V	71.7	Confident	70.5	Confident	80 Å²	80	80.5 Å²	80.5	49%	0.485	45%	0.448	S	S	.	.	H	α-helix	trans	-64.2	-49	177.8	176	0	0	0	0	110.8	S235 G241 D242 E243	S235-V239 WeakPolarHBondContact O-CG2 3.36Å; S235-V239 PolarHBondContact O-N 2.84Å; V239-G241 VanDerWaalsContact C-N 3.31Å; V239-G241 PolarHBondContact O-N 2.97Å; V239-D242 PolarHBondContact O-N 3.22Å; V239-E243 PolarHBondContact O-N 3.47Å
240	T	61.8	Low	68.2	Low	74 Å²	74	84.2 Å²	84.2	45%	0.454	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-36.2	176.8	48	0	0	0	0	112.5	D236 M237 I244	D236-T240 WeakPolarHBondContact O-CG2 2.85Å; D236-T240 PolarHBondContact O-N 2.76Å; D236-T240 VanDerWaalsContact O-N 3.07Å; D236-T240 PolarHBondContact O-OG1 2.84Å; M237-T240 WeakPolarHBondContact CA-OG1 3.23Å; M237-T240 PolarHBondContact O-OG1 3.35Å; T240-I244 WeakPolarHBondContact O-CD1 3.41Å; T240-I244 VanDerWaalsContact O-CG1 3.28Å; T240-I244 WeakPolarHBondContact O-CG1 3.29Å; T240-I244 PolarHBondContact O-N 3.32Å
241	G	56.5	Low	65.9	Low	25 Å²	25	91.3 Å²	91.3	26%	0.258	51%	0.512	S	S	.	.	H	α-helix	trans	-66.3	-34.3	175.3	0	0	0	0	0	113.9	M237 T238 V239 K245	M237-G241 PolarHBondContact O-N 3.14Å; T238-G241 PolarHBondContact O-N 3.3Å; V239-G241 VanDerWaalsContact C-N 3.31Å; V239-G241 PolarHBondContact O-N 2.97Å; G241-K245 WeakPolarHBondContact O-CG 3.34Å; G241-K245 PolarHBondContact O-N 3.06Å
242	D	52.6	Low	63.4	Low	86 Å²	86	90.4 Å²	90.4	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-80.1	-34.8	179.1	-73.2	-17.9	0	0	0	112.4	T238 V239 I244 K245 E246	T238-D242 PolarHBondContact O-N 3.16Å; V239-D242 PolarHBondContact O-N 3.22Å; D242-I244 VanDerWaalsContact C-N 3.32Å; D242-I244 PolarHBondContact O-N 3.18Å; D242-K245 PolarHBondContact O-N 2.97Å; D242-K245 VanDerWaalsContact O-N 3.15Å; D242-K245 IonicContact OD1-NZ 3.77Å; D242-K245 PolarHBondContact OD1-NZ 3.26Å; D242-E246 PolarHBondContact O-N 3.49Å
243	E	52.1	Low	60.8	Low	129 Å²	129	90.5 Å²	90.5	60%	0.603	53%	0.534	S	S	*	.	H	α-helix	trans	-60.5	-39.9	170.2	-72.4	-179.3	168.3	0	0	112	V239 A247	V239-E243 PolarHBondContact O-N 3.47Å; E243-A247 WeakPolarHBondContact O-CB 3.46Å; E243-A247 PolarHBondContact O-N 2.7Å; E243-A247 VanDerWaalsContact O-N 3.08Å
244	I	51.6	Low	58.1	Low	118 Å²	118	103.4 Å²	103.4	61%	0.605	60%	0.595	S	S	*	*	H	α-helix	trans	-67.5	-36.4	175.2	-66.3	166.5	0	0	0	111.3	T240 D242 S248	T240-I244 WeakPolarHBondContact O-CD1 3.41Å; T240-I244 VanDerWaalsContact O-CG1 3.28Å; T240-I244 WeakPolarHBondContact O-CG1 3.29Å; T240-I244 PolarHBondContact O-N 3.32Å; D242-I244 VanDerWaalsContact C-N 3.32Å; D242-I244 PolarHBondContact O-N 3.18Å; I244-S248 WeakPolarHBondContact O-CB 3.35Å; I244-S248 PolarHBondContact O-N 3.34Å; I244-S248 VanDerWaalsContact O-N 3.13Å; I244-S248 PolarHBondContact O-OG 3.31Å
245	K	47.8	Very low	56.5	Low	128 Å²	128	105.1 Å²	105.1	56%	0.557	60%	0.603	S	S	*	*	H	α-helix	trans	-71.6	-36.6	177.3	-75.6	173.7	-164.7	157.8	0	112.8	G241 D242 S248 K249	G241-K245 WeakPolarHBondContact O-CG 3.34Å; G241-K245 PolarHBondContact O-N 3.06Å; D242-K245 PolarHBondContact O-N 2.97Å; D242-K245 VanDerWaalsContact O-N 3.15Å; D242-K245 IonicContact OD1-NZ 3.77Å; D242-K245 PolarHBondContact OD1-NZ 3.26Å; K245-S248 WeakPolarHBondContact CA-OG 3.38Å; K245-S248 PolarHBondContact O-N 3.46Å; K245-S248 PolarHBondContact O-OG 3.13Å; K245-K249 PolarHBondContact O-N 3.08Å
246	E	49.5	Very low	54.8	Low	147 Å²	147	107.9 Å²	107.9	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-67.2	-40.3	173.9	-75.2	-167.1	159.4	0	0	111.5	D242 S248 K249	D242-E246 PolarHBondContact O-N 3.49Å; E246-S248 PolarHBondContact O-N 3.31Å; E246-K249 PolarHBondContact O-N 2.98Å
247	A	53.4	Low	53.4	Low	91 Å²	91	110.4 Å²	110.4	75%	0.752	63%	0.632	S	S	*	*	H	α-helix	trans	-68.1	-19.5	174.5	0	0	0	0	0	114.1	E243	E243-A247 WeakPolarHBondContact O-CB 3.46Å; E243-A247 PolarHBondContact O-N 2.7Å; E243-A247 VanDerWaalsContact O-N 3.08Å
248	S	46.8	Very low	51.8	Low	80 Å²	80	113.1 Å²	113.1	56%	0.559	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	4.4	-178.8	54.5	0	0	0	0	114.5	I244 K245 E246 P250	I244-S248 WeakPolarHBondContact O-CB 3.35Å; I244-S248 PolarHBondContact O-N 3.34Å; I244-S248 VanDerWaalsContact O-N 3.13Å; I244-S248 PolarHBondContact O-OG 3.31Å; K245-S248 WeakPolarHBondContact CA-OG 3.38Å; K245-S248 PolarHBondContact O-N 3.46Å; K245-S248 PolarHBondContact O-OG 3.13Å; E246-S248 PolarHBondContact O-N 3.31Å; S248-P250 VanDerWaalsContact O-CD 3.29Å; S248-P250 WeakPolarHBondContact O-CD 3.29Å
249	K	43.2	Very low	50.4	Low	153 Å²	153	114.9 Å²	114.9	67%	0.665	66%	0.658	S	S	*	*	S	Bend	trans	-67.3	117.2	162.4	-80.4	-179.3	-178.3	170.3	0	107.6	K245 E246 D251	K245-K249 PolarHBondContact O-N 3.08Å; E246-K249 PolarHBondContact O-N 2.98Å; K249-D251 PolarHBondContact O-N 2.68Å
250	P	48.5	Very low	48.9	Very low	114 Å²	114	117.3 Å²	117.3	74%	0.74	67%	0.67	S	S	*	*			trans	-60.5	134.6	165.4	1.1	12.5	0	0	0	106.2	S248 G252	S248-P250 VanDerWaalsContact O-CD 3.29Å; S248-P250 WeakPolarHBondContact O-CD 3.29Å; P250-G252 PolarHBondContact O-N 3.35Å
251	D	49.1	Very low	48	Very low	175 Å²	175	120.4 Å²	120.4	94%	0.936	69%	0.685	S	S	*	*			trans	-55.1	92.4	165.9	-78.8	-35.5	0	0	0	108	K249 A253	K249-D251 PolarHBondContact O-N 2.68Å; D251-A253 PolarHBondContact O-N 3.3Å
252	G	41.4	Very low	47.4	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	72%	0.718	S	S	*	*			trans	-83.8	100.6	-179.3	0	0	0	0	0	107.9	P250	P250-G252 PolarHBondContact O-N 3.35Å
253	A	40	Very low	46.9	Very low	94 Å²	94	131.2 Å²	131.2	78%	0.777	74%	0.74	S	S	*	*			trans	40.9	101	136.6	0	0	0	0	0	117.5	D251	D251-A253 PolarHBondContact O-N 3.3Å
254	E	39.8	Very low	46.5	Very low	277 Å²	277	131.4 Å²	131.4	100%	1.294	75%	0.752	S	S	*	*				-139	0	127.6	-91.3	-176.3	175	0	0	109.5

Retrieved 254 of 254 residues in 346.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).