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Glycolipid transfer protein

Accelerates the intermembrane transfer of various glycolipids. Catalyzes the transfer of various glycosphingolipids between membranes but does not catalyze the transfer of phospholipids. May be involved in the intracellular translocation of glucosylceramides (By similarity).

AlphaFold DB , UniProt , Accession B0YN54, Species PANTR (Pan troglodytes, Chimpanzee), Gene GLTP, Length 209 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.3	Low	76.5	Confident	27 Å²	27	56.9 Å²	56.9	13%	0.133	31%	0.313	C	S	.	.				0	97.6	0	-75.6	-66	-72.6	0	0	108.1	L3 L4 L165 S166 Q169 K179	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3Å; M1-L4 WeakPolarHBondContact CB-O 3.29Å; M1-L4 HydrophobicContact CE-CB 4.2Å; M1-L4 HydrophobicContact CE-CD1 4.37Å; M1-L4 HydrophobicContact CE-CG 4.42Å; M1-L165 HydrophobicContact CE-CB 3.59Å; M1-L165 HydrophobicContact CE-CD1 4.27Å; M1-L165 HydrophobicContact CE-CD2 4.35Å; M1-L165 HydrophobicContact CE-CG 4.31Å; M1-L165 WeakPolarHBondContact CE-O 3.41Å; M1-L165 HydrophobicContact SD-CB 4.33Å; M1-L165 VanDerWaalsContact SD-O 3.4Å; M1-S166 VanDerWaalsContact SD-CA 3.56Å; M1-Q169 VanDerWaalsContact N-OE1 3.1Å; M1-K179 HydrophobicContact CB-CB 4.3Å; M1-K179 HydrophobicContact CB-CD 3.96Å; M1-K179 HydrophobicContact CG-CB 3.59Å; M1-K179 HydrophobicContact CG-CD 3.4Å; M1-K179 VanDerWaalsContact CG-CD 3.4Å; M1-K179 HydrophobicContact CG-CG 4.1Å
2	A	58.7	Low	78.1	Confident	55 Å²	55	56.4 Å²	56.4	46%	0.455	31%	0.309	S	S	.	.			trans	-83.1	-3.5	-176.3	0	0	0	0	0	113.2	K167	A2-K167 VanDerWaalsContact C-CE 3.44Å; A2-K167 HydrophobicContact CB-CB 4.4Å; A2-K167 HydrophobicContact CB-CD 3.54Å; A2-K167 HydrophobicContact CB-CG 3.96Å; A2-K167 VanDerWaalsContact O-CE 3.26Å; A2-K167 WeakPolarHBondContact O-CE 3.44Å; A2-K167 PolarHBondContact O-NZ 3.28Å
3	L	66.5	Low	79.4	Confident	20 Å²	20	56.8 Å²	56.8	11%	0.105	32%	0.316	C	S	.	.	S	Bend	trans	-109.2	-51	-179.9	-166.5	70.4	0	0	0	113.1	M1 P32 C36 L165	M1-L3 VanDerWaalsContact C-N 3.27Å; M1-L3 PolarHBondContact O-N 3Å; L3-P32 HydrophobicContact CD1-CB 3.73Å; L3-P32 HydrophobicContact CD1-CG 4.22Å; L3-C36 VanDerWaalsContact CD2-SG 3.5Å; L3-L165 HydrophobicContact CD2-CD2 4.22Å
4	L	74.6	Confident	80.5	Confident	0 Å²	0	61 Å²	61	0%	0	36%	0.361	C	S	.	.	S	Bend	trans	-95.8	94.5	170.7	-57.3	179.1	0	0	0	108	M1 E6 L30 F33 L108 L165 I180 F183	M1-L4 WeakPolarHBondContact CB-O 3.29Å; M1-L4 HydrophobicContact CE-CB 4.2Å; M1-L4 HydrophobicContact CE-CD1 4.37Å; M1-L4 HydrophobicContact CE-CG 4.42Å; L4-E6 PolarHBondContact O-N 3.06Å; L4-L30 HydrophobicContact CD2-CD2 4.06Å; L4-F33 HydrophobicContact CD1-CD2 4.43Å; L4-F33 HydrophobicContact CD1-CE2 4.43Å; L4-F33 HydrophobicContact CD2-CD2 4.21Å; L4-L108 HydrophobicContact CD1-CD1 3.77Å; L4-L108 HydrophobicContact CD1-CD2 4.44Å; L4-L165 HydrophobicContact CD1-CD1 4.36Å; L4-L165 HydrophobicContact CD1-CD2 3.95Å; L4-L165 HydrophobicContact CG-CD2 4.18Å; L4-I180 HydrophobicContact CD1-CG1 4.4Å; L4-F183 HydrophobicContact CB-CB 4.5Å; L4-F183 HydrophobicContact CB-CD2 4.03Å; L4-F183 HydrophobicContact CB-CE2 4.45Å; L4-F183 HydrophobicContact CB-CG 4.16Å; L4-F183 HydrophobicContact CD1-CD1 4.4Å; L4-F183 HydrophobicContact CD2-CD2 4.35Å; L4-F183 HydrophobicContact CD2-CE1 4.33Å; L4-F183 HydrophobicContact CD2-CE2 3.95Å; L4-F183 HydrophobicContact CD2-CZ 3.94Å
5	A	75.1	Confident	81.5	Confident	46 Å²	46	63.9 Å²	63.9	38%	0.38	37%	0.374	S	S	.	.			trans	-60.9	136.6	172.3	0	0	0	0	0	109.2	H7 L8 F183	A5-H7 PolarHBondContact O-N 3.21Å; A5-L8 HydrophobicContact CB-CB 4.27Å; A5-L8 HydrophobicContact CB-CD1 4.38Å; A5-L8 PolarHBondContact O-N 3.17Å; A5-F183 WeakPolarHBondContact O-CD2 3.47Å
6	E	74.7	Confident	82.4	Confident	82 Å²	82	66.1 Å²	66.1	38%	0.383	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-29.7	-177.5	-69.7	166.6	-165.2	0	0	112.3	L4 K179 L182 F183	L4-E6 PolarHBondContact O-N 3.06Å; E6-K179 HydrophobicContact CG-CB 4.43Å; E6-K179 HydrophobicContact CG-CG 4.15Å; E6-K179 WeakPolarHBondContact OE1-CE 3.38Å; E6-L182 HydrophobicContact CB-CB 4.22Å; E6-L182 HydrophobicContact CB-CD1 4.49Å; E6-L182 HydrophobicContact CG-CB 4.45Å; E6-L182 HydrophobicContact CG-CD1 4.21Å; E6-L182 CarbonylContact O-C 3.16Å; E6-L182 VanDerWaalsContact O-O 3.08Å; E6-F183 VanDerWaalsContact O-CA 3.25Å; E6-F183 WeakPolarHBondContact O-CA 3.33Å; E6-F183 PolarHBondContact O-N 3.14Å
7	H	77.7	Confident	83.2	Confident	113 Å²	113	66.4 Å²	66.4	52%	0.523	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132	55.4	173.8	-57.3	-52.3	0	0	0	111.5	A5 L9	A5-H7 PolarHBondContact O-N 3.21Å; H7-L9 PolarHBondContact O-N 2.91Å
8	L	84.6	Confident	84.1	Confident	24 Å²	24	63.6 Å²	63.6	13%	0.126	36%	0.359	C	S	.	.	S	Bend	trans	-51.6	-44.7	177.7	-176.9	69.3	0	0	0	111.7	A5 A26 H29 L30 F183	A5-L8 HydrophobicContact CB-CB 4.27Å; A5-L8 HydrophobicContact CB-CD1 4.38Å; A5-L8 PolarHBondContact O-N 3.17Å; L8-A26 WeakPolarHBondContact CD2-O 3.47Å; L8-A26 HydrophobicContact CG-CB 4.2Å; L8-A26 VanDerWaalsContact O-CB 3.26Å; L8-A26 WeakPolarHBondContact O-CB 3.37Å; L8-H29 HydrophobicContact CD1-CB 4.11Å; L8-L30 HydrophobicContact CD2-CD1 4.27Å; L8-L30 HydrophobicContact CD2-CD2 3.63Å; L8-L30 HydrophobicContact CD2-CG 3.78Å; L8-F183 HydrophobicContact CB-CD2 3.95Å; L8-F183 HydrophobicContact CB-CE2 3.8Å; L8-F183 HydrophobicContact CD2-CE2 3.71Å; L8-F183 HydrophobicContact CG-CE2 4.4Å
9	L	91.1	Very high	84.8	Confident	11 Å²	11	64.7 Å²	64.7	6%	0.058	36%	0.361	C	S	.	.	S	Bend	trans	-98.4	139.5	170.2	-72.2	167.6	0	0	0	109.8	H7 F23 A26 N186 Y187 T190	H7-L9 PolarHBondContact O-N 2.91Å; L9-F23 HydrophobicContact CD2-CD2 3.93Å; L9-A26 HydrophobicContact CD2-CB 3.55Å; L9-A26 HydrophobicContact CG-CB 4.24Å; L9-N186 HydrophobicContact CB-CB 4.32Å; L9-N186 WeakPolarHBondContact O-CB 3.15Å; L9-N186 PolarHBondContact O-ND2 2.85Å; L9-Y187 HydrophobicContact CD1-CD2 3.73Å; L9-Y187 HydrophobicContact CD1-CE2 4.37Å; L9-Y187 HydrophobicContact CD1-CG 4.46Å; L9-T190 HydrophobicContact CD1-CG2 4.01Å
10	K	90.4	Very high	85.5	Confident	156 Å²	156	61.5 Å²	61.5	68%	0.678	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-69.3	154	175.5	-66.7	-180	-178.6	175.5	0	110.4	L12	K10-L12 PolarHBondContact O-N 3.21Å
11	P	94.2	Very high	86.1	Confident	92 Å²	92	59.4 Å²	59.4	60%	0.597	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-53.8	140.5	167	-23.5	33.8	0	0	0	110.6
12	L	95.5	Very high	88.1	Confident	51 Å²	51	60.2 Å²	60.2	27%	0.267	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-66.7	142	178	-72.6	169.3	0	0	0	110.7	K10 I18 A189 V193	K10-L12 PolarHBondContact O-N 3.21Å; L12-I18 HydrophobicContact CD2-CD1 4.27Å; L12-I18 HydrophobicContact CD2-CG1 3.67Å; L12-A189 HydrophobicContact CD1-CB 4Å; L12-V193 HydrophobicContact CD1-CB 4.35Å; L12-V193 HydrophobicContact CD1-CG2 3.56Å
13	P	94.9	Very high	90	Very high	62 Å²	62	57.8 Å²	57.8	40%	0.403	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.2	165.1	168.1	30.2	-35.1	0	0	0	111.1	D15 K16 Q17	P13-D15 WeakPolarHBondContact CB-OD1 3.42Å; P13-D15 WeakPolarHBondContact CG-OD1 3.46Å; P13-D15 PolarHBondContact O-N 3.4Å; P13-K16 WeakPolarHBondContact O-CA 3.22Å; P13-K16 PolarHBondContact O-N 3.34Å; P13-Q17 VanDerWaalsContact CG-O 3.23Å; P13-Q17 WeakPolarHBondContact CG-O 3.37Å
14	A	94.7	Very high	91.5	Very high	115 Å²	115	57.1 Å²	57.1	95%	0.95	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.3	-178.1	0	0	0	0	0	113.5	K16	A14-K16 VanDerWaalsContact C-N 3.25Å; A14-K16 PolarHBondContact O-N 3.34Å
15	D	95.4	Very high	92.5	Very high	104 Å²	104	63.5 Å²	63.5	56%	0.556	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.5	175.9	66.8	-1.4	0	0	0	113.4	P13 Q17	P13-D15 WeakPolarHBondContact CB-OD1 3.42Å; P13-D15 WeakPolarHBondContact CG-OD1 3.46Å; P13-D15 PolarHBondContact O-N 3.4Å; D15-Q17 HydrophobicContact CB-CG 4.36Å; D15-Q17 PolarHBondContact O-N 3.15Å; D15-Q17 VanDerWaalsContact O-N 3.09Å; D15-Q17 PolarHBondContact OD1-N 3.34Å
16	K	95.8	Very high	93.5	Very high	100 Å²	100	61.8 Å²	61.8	44%	0.435	33%	0.334	S	S	.	.			trans	57.8	15.9	-178.5	-58.6	174.1	169.9	-175.1	0	114.6	P13 A14 I18 V193 E196	P13-K16 WeakPolarHBondContact O-CA 3.22Å; P13-K16 PolarHBondContact O-N 3.34Å; A14-K16 VanDerWaalsContact C-N 3.25Å; A14-K16 PolarHBondContact O-N 3.34Å; K16-I18 PolarHBondContact O-N 2.95Å; K16-V193 HydrophobicContact CB-CG1 4.12Å; K16-V193 HydrophobicContact CB-CG2 4.12Å; K16-V193 HydrophobicContact CD-CG2 3.95Å; K16-V193 HydrophobicContact CG-CG2 4.23Å; K16-E196 IonicContact NZ-OE2 3.77Å; K16-E196 PolarHBondContact NZ-OE2 3.45Å
17	Q	96.6	Very high	94.5	Very high	70 Å²	70	57.9 Å²	57.9	33%	0.327	32%	0.315	S	S	.	.			trans	-71.1	122.2	177.8	-71.4	-68.3	-35.1	0	0	110.6	P13 D15 T69	P13-Q17 VanDerWaalsContact CG-O 3.23Å; P13-Q17 WeakPolarHBondContact CG-O 3.37Å; D15-Q17 HydrophobicContact CB-CG 4.36Å; D15-Q17 PolarHBondContact O-N 3.15Å; D15-Q17 VanDerWaalsContact O-N 3.09Å; D15-Q17 PolarHBondContact OD1-N 3.34Å; Q17-T69 HydrophobicContact CB-CG2 4.19Å; Q17-T69 PolarHBondContact OE1-OG1 3.16Å
18	I	98.4	Very high	95.3	Very high	17 Å²	17	55.1 Å²	55.1	9%	0.087	31%	0.309	C	S	.	.			trans	-95.9	110.6	179.3	-59.9	164.1	0	0	0	108.6	L12 K16 T20 F23 T69 L70 T190 V193 I194	L12-I18 HydrophobicContact CD2-CD1 4.27Å; L12-I18 HydrophobicContact CD2-CG1 3.67Å; K16-I18 PolarHBondContact O-N 2.95Å; I18-T20 PolarHBondContact O-N 3.49Å; I18-F23 HydrophobicContact CG2-CB 3.72Å; I18-F23 HydrophobicContact CG2-CD2 4Å; I18-F23 HydrophobicContact CG2-CG 4Å; I18-T69 CarbonylContact O-C 3.59Å; I18-T69 WeakPolarHBondContact O-CA 3.42Å; I18-T69 VanDerWaalsContact O-CB 3.31Å; I18-T69 WeakPolarHBondContact O-CB 3.27Å; I18-L70 HydrophobicContact CB-CD1 4.01Å; I18-L70 HydrophobicContact CB-CG 4.14Å; I18-L70 HydrophobicContact CD1-CD1 4.26Å; I18-L70 HydrophobicContact CG2-CD1 3.61Å; I18-L70 HydrophobicContact CG2-CG 3.91Å; I18-L70 PolarHBondContact O-N 3.18Å; I18-T190 HydrophobicContact CD1-CG2 3.72Å; I18-T190 HydrophobicContact CG1-CG2 4.3Å; I18-V193 HydrophobicContact CD1-CB 4.2Å; I18-V193 HydrophobicContact CD1-CG1 3.83Å; I18-V193 HydrophobicContact CG1-CG1 4.42Å; I18-I194 HydrophobicContact CD1-CD1 4.15Å; I18-I194 HydrophobicContact CD1-CG1 3.56Å
19	E	98.3	Very high	95.7	Very high	85 Å²	85	58.8 Å²	58.8	40%	0.397	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-66.2	126.1	174.5	-64.1	-165.3	148.9	0	0	110.9	G21 P22 F23 R68	E19-G21 PolarHBondContact O-N 3.5Å; E19-P22 HydrophobicContact CB-CG 3.95Å; E19-F23 VanDerWaalsContact O-CB 3.28Å; E19-F23 WeakPolarHBondContact O-CB 3.47Å; E19-F23 PolarHBondContact O-N 2.9Å; E19-F23 VanDerWaalsContact O-N 3.07Å; E19-R68 WeakPolarHBondContact CA-O 3.43Å; E19-R68 IonicContact OE1-CZ 2.69Å; E19-R68 IonicContact OE1-NE 3.3Å; E19-R68 PolarHBondContact OE1-NE 3.43Å; E19-R68 IonicContact OE1-NH2 3.6Å; E19-R68 PolarHBondContact OE1-NH2 3.3Å
20	T	98.6	Very high	95.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-48.7	-173	-58.6	0	0	0	0	111.8	I18 F23 L24 I56 Y60 F67 R68 T69 L70 I73	I18-T20 PolarHBondContact O-N 3.49Å; T20-F23 PolarHBondContact O-N 3.16Å; T20-L24 HydrophobicContact CG2-CD1 3.73Å; T20-L24 HydrophobicContact CG2-CG 4.14Å; T20-L24 WeakPolarHBondContact O-CB 3.23Å; T20-L24 VanDerWaalsContact O-CG 3.26Å; T20-L24 WeakPolarHBondContact O-CG 3.3Å; T20-L24 PolarHBondContact O-N 2.79Å; T20-I56 HydrophobicContact CG2-CG2 4.48Å; T20-Y60 HydrophobicContact CG2-CD2 3.49Å; T20-Y60 VanDerWaalsContact CG2-CD2 3.49Å; T20-Y60 HydrophobicContact CG2-CE2 4.19Å; T20-Y60 HydrophobicContact CG2-CG 3.77Å; T20-F67 WeakPolarHBondContact CB-O 3.44Å; T20-F67 PolarHBondContact OG1-O 3.27Å; T20-R68 PolarHBondContact N-O 2.85Å; T20-R68 PolarHBondContact OG1-O 3.2Å; T20-T69 PolarHBondContact OG1-O 3.29Å; T20-L70 HydrophobicContact CG2-CD2 4.17Å; T20-L70 PolarHBondContact OG1-N 3.08Å; T20-I73 HydrophobicContact CG2-CD1 3.69Å
21	G	97.9	Very high	95.9	Very high	17 Å²	17	51.2 Å²	51.2	18%	0.175	29%	0.293	C	S	.	.	H	α-helix	trans	-56.6	-61	-178.2	0	0	0	0	0	112.7	E19 F23 L24 E25	E19-G21 PolarHBondContact O-N 3.5Å; G21-F23 VanDerWaalsContact C-N 3.29Å; G21-F23 PolarHBondContact O-N 2.69Å; G21-L24 PolarHBondContact O-N 3.26Å; G21-E25 PolarHBondContact O-N 3.47Å
22	P	97.1	Very high	95.6	Very high	45 Å²	45	49.1 Å²	49.1	29%	0.292	28%	0.279	S	S	.	.	H	α-helix	trans	-57.6	-37.7	177	-27.4	35.9	0	0	0	114	E19 A26	E19-P22 HydrophobicContact CB-CG 3.95Å; P22-A26 WeakPolarHBondContact O-CB 3.38Å; P22-A26 PolarHBondContact O-N 3.49Å
23	F	98.2	Very high	95.3	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-50.7	175.4	172.4	-99.3	0	0	0	111.5	L9 I18 E19 T20 G21 E25 A26 V27 L70 L94 L97 L101 T190 I194	L9-F23 HydrophobicContact CD2-CD2 3.93Å; I18-F23 HydrophobicContact CG2-CB 3.72Å; I18-F23 HydrophobicContact CG2-CD2 4Å; I18-F23 HydrophobicContact CG2-CG 4Å; E19-F23 VanDerWaalsContact O-CB 3.28Å; E19-F23 WeakPolarHBondContact O-CB 3.47Å; E19-F23 PolarHBondContact O-N 2.9Å; E19-F23 VanDerWaalsContact O-N 3.07Å; T20-F23 PolarHBondContact O-N 3.16Å; G21-F23 VanDerWaalsContact C-N 3.29Å; G21-F23 PolarHBondContact O-N 2.69Å; F23-E25 PolarHBondContact O-N 2.86Å; F23-A26 PolarHBondContact O-N 2.73Å; F23-V27 HydrophobicContact CD1-CG2 4.41Å; F23-V27 HydrophobicContact CD2-CG1 4.16Å; F23-V27 HydrophobicContact CE1-CG1 4.3Å; F23-V27 HydrophobicContact CE1-CG2 4.14Å; F23-V27 HydrophobicContact CE2-CG1 3.72Å; F23-V27 HydrophobicContact CZ-CG1 3.8Å; F23-V27 HydrophobicContact CZ-CG2 4.43Å; F23-V27 WeakPolarHBondContact O-CG2 3.25Å; F23-V27 PolarHBondContact O-N 3.35Å; F23-L70 HydrophobicContact CD1-CD1 3.83Å; F23-L70 HydrophobicContact CD1-CD2 3.89Å; F23-L70 HydrophobicContact CD1-CG 4.35Å; F23-L70 HydrophobicContact CD2-CD1 4.27Å; F23-L70 HydrophobicContact CE1-CD1 3.94Å; F23-L70 HydrophobicContact CE1-CD2 4.32Å; F23-L70 HydrophobicContact CE2-CD1 4.38Å; F23-L70 HydrophobicContact CG-CD1 3.99Å; F23-L70 HydrophobicContact CZ-CD1 4.21Å; F23-L94 HydrophobicContact CE1-CD1 4.09Å; F23-L94 HydrophobicContact CZ-CD1 4.37Å; F23-L97 HydrophobicContact CE1-CD2 4.09Å; F23-L97 HydrophobicContact CZ-CD2 4.43Å; F23-L101 HydrophobicContact CE2-CD1 4.26Å; F23-L101 HydrophobicContact CZ-CD1 3.81Å; F23-T190 HydrophobicContact CD2-CG2 4.14Å; F23-T190 HydrophobicContact CE2-CG2 4.14Å; F23-I194 HydrophobicContact CE2-CD1 3.65Å; F23-I194 HydrophobicContact CZ-CD1 3.74Å
24	L	98.1	Very high	95	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-40.3	-179.7	-69.3	179.6	0	0	0	112.3	T20 G21 V27 S28 I53 I56 K57	T20-L24 HydrophobicContact CG2-CD1 3.73Å; T20-L24 HydrophobicContact CG2-CG 4.14Å; T20-L24 WeakPolarHBondContact O-CB 3.23Å; T20-L24 VanDerWaalsContact O-CG 3.26Å; T20-L24 WeakPolarHBondContact O-CG 3.3Å; T20-L24 PolarHBondContact O-N 2.79Å; G21-L24 PolarHBondContact O-N 3.26Å; L24-V27 HydrophobicContact CD2-CG2 4.49Å; L24-S28 VanDerWaalsContact O-CB 3.29Å; L24-S28 WeakPolarHBondContact O-CB 3.25Å; L24-S28 PolarHBondContact O-N 3.3Å; L24-I53 HydrophobicContact CD2-CG2 4.31Å; L24-I56 HydrophobicContact CD1-CB 4.4Å; L24-I56 HydrophobicContact CD1-CG2 4Å; L24-I56 HydrophobicContact CD2-CB 3.97Å; L24-I56 HydrophobicContact CD2-CD1 4.31Å; L24-I56 HydrophobicContact CD2-CG2 3.87Å; L24-I56 HydrophobicContact CG-CG2 4.4Å; L24-K57 HydrophobicContact CD1-CB 4.01Å; L24-K57 HydrophobicContact CD1-CD 3.97Å
25	E	95.8	Very high	94.7	Very high	134 Å²	134	42.5 Å²	42.5	63%	0.626	22%	0.224	S	C	*	.	H	α-helix	trans	-56.9	-52.8	173.3	-177.6	178.7	-171.6	0	0	110.4	G21 F23 V27 S28 H29	G21-E25 PolarHBondContact O-N 3.47Å; F23-E25 PolarHBondContact O-N 2.86Å; E25-V27 PolarHBondContact O-N 3.39Å; E25-S28 WeakPolarHBondContact O-CB 3.42Å; E25-S28 PolarHBondContact O-N 3.01Å; E25-S28 PolarHBondContact O-OG 3.43Å; E25-H29 PolarHBondContact O-CD2 3.3Å; E25-H29 VanDerWaalsContact O-CD2 3.23Å
26	A	95.6	Very high	94.5	Very high	9 Å²	9	38.2 Å²	38.2	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-58.3	-52.3	178.5	0	0	0	0	0	112.5	L8 L9 P22 F23 S28 H29	L8-A26 WeakPolarHBondContact CD2-O 3.47Å; L8-A26 HydrophobicContact CG-CB 4.2Å; L8-A26 VanDerWaalsContact O-CB 3.26Å; L8-A26 WeakPolarHBondContact O-CB 3.37Å; L9-A26 HydrophobicContact CD2-CB 3.55Å; L9-A26 HydrophobicContact CG-CB 4.24Å; P22-A26 WeakPolarHBondContact O-CB 3.38Å; P22-A26 PolarHBondContact O-N 3.49Å; F23-A26 PolarHBondContact O-N 2.73Å; A26-S28 PolarHBondContact O-N 3.05Å; A26-H29 PolarHBondContact O-N 3.39Å
27	V	96.1	Very high	94.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-71.4	-17.6	-176.6	-59.2	0	0	0	0	113.4	F23 L24 E25 H29 L30 P31 I53 L97 L101	F23-V27 HydrophobicContact CD1-CG2 4.41Å; F23-V27 HydrophobicContact CD2-CG1 4.16Å; F23-V27 HydrophobicContact CE1-CG1 4.3Å; F23-V27 HydrophobicContact CE1-CG2 4.14Å; F23-V27 HydrophobicContact CE2-CG1 3.72Å; F23-V27 HydrophobicContact CZ-CG1 3.8Å; F23-V27 HydrophobicContact CZ-CG2 4.43Å; F23-V27 WeakPolarHBondContact O-CG2 3.25Å; F23-V27 PolarHBondContact O-N 3.35Å; L24-V27 HydrophobicContact CD2-CG2 4.49Å; E25-V27 PolarHBondContact O-N 3.39Å; V27-H29 PolarHBondContact O-N 3.39Å; V27-L30 HydrophobicContact CB-CD1 3.92Å; V27-L30 HydrophobicContact CG1-CD1 3.97Å; V27-L30 WeakPolarHBondContact O-CB 3.23Å; V27-L30 PolarHBondContact O-N 3.46Å; V27-L30 VanDerWaalsContact O-N 3.08Å; V27-P31 WeakPolarHBondContact O-CD 3.42Å; V27-I53 HydrophobicContact CB-CD1 4.28Å; V27-I53 HydrophobicContact CG2-CD1 3.83Å; V27-I53 HydrophobicContact CG2-CG1 3.85Å; V27-I53 WeakPolarHBondContact O-CD1 3.24Å; V27-L97 HydrophobicContact CG2-CD2 4.33Å; V27-L101 HydrophobicContact CG1-CD1 4.14Å; V27-L101 HydrophobicContact CG1-CD2 4.19Å
28	S	95.1	Very high	93.5	Very high	56 Å²	56	33.8 Å²	33.8	39%	0.392	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.7	173.9	79.2	0	0	0	0	113.6	L24 E25 A26 P31	L24-S28 VanDerWaalsContact O-CB 3.29Å; L24-S28 WeakPolarHBondContact O-CB 3.25Å; L24-S28 PolarHBondContact O-N 3.3Å; E25-S28 WeakPolarHBondContact O-CB 3.42Å; E25-S28 PolarHBondContact O-N 3.01Å; E25-S28 PolarHBondContact O-OG 3.43Å; A26-S28 PolarHBondContact O-N 3.05Å; S28-P31 VanDerWaalsContact O-CD 3.27Å; S28-P31 WeakPolarHBondContact O-CD 3.44Å
29	H	92.6	Very high	92.8	Very high	100 Å²	100	34.4 Å²	34.4	46%	0.463	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6	175.7	-61.2	-63.8	0	0	0	114.1	L8 E25 A26 V27 P32	L8-H29 HydrophobicContact CD1-CB 4.11Å; E25-H29 PolarHBondContact O-CD2 3.3Å; E25-H29 VanDerWaalsContact O-CD2 3.23Å; A26-H29 PolarHBondContact O-N 3.39Å; V27-H29 PolarHBondContact O-N 3.39Å; H29-P32 WeakPolarHBondContact O-CD 3.42Å
30	L	92.6	Very high	92.2	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	22%	0.222	C	C	.	.	S	Bend	trans	-79.9	-32.4	-179.9	-66.9	165.9	0	0	0	115.2	L4 L8 V27 P32 F33 L101 F183 Y187	L4-L30 HydrophobicContact CD2-CD2 4.06Å; L8-L30 HydrophobicContact CD2-CD1 4.27Å; L8-L30 HydrophobicContact CD2-CD2 3.63Å; L8-L30 HydrophobicContact CD2-CG 3.78Å; V27-L30 HydrophobicContact CB-CD1 3.92Å; V27-L30 HydrophobicContact CG1-CD1 3.97Å; V27-L30 WeakPolarHBondContact O-CB 3.23Å; V27-L30 PolarHBondContact O-N 3.46Å; V27-L30 VanDerWaalsContact O-N 3.08Å; L30-P32 VanDerWaalsContact C-N 3.32Å; L30-P32 VanDerWaalsContact O-N 3.15Å; L30-F33 WeakPolarHBondContact O-CA 3.35Å; L30-F33 WeakPolarHBondContact O-CB 3.47Å; L30-F33 PolarHBondContact O-N 3.11Å; L30-L101 HydrophobicContact CD1-CD2 3.39Å; L30-F183 HydrophobicContact CD2-CE2 4.19Å; L30-F183 HydrophobicContact CD2-CZ 3.91Å; L30-Y187 HydrophobicContact CD1-CE2 3.75Å; L30-Y187 HydrophobicContact CD2-CE2 4.35Å
31	P	91.6	Very high	91.5	Very high	8 Å²	8	37 Å²	37	5%	0.052	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-51	-38.7	-178.2	-28.6	34.7	0	0	0	115.7	V27 S28 F33 F34 K46 I49 S50 I53	V27-P31 WeakPolarHBondContact O-CD 3.42Å; S28-P31 VanDerWaalsContact O-CD 3.27Å; S28-P31 WeakPolarHBondContact O-CD 3.44Å; P31-F33 PolarHBondContact O-N 3.03Å; P31-F33 VanDerWaalsContact O-N 3.15Å; P31-F34 PolarHBondContact O-N 3.29Å; P31-K46 HydrophobicContact CB-CG 3.92Å; P31-I49 HydrophobicContact CG-CG2 4.24Å; P31-S50 WeakPolarHBondContact CB-OG 3.38Å; P31-S50 VanDerWaalsContact CG-OG 3.29Å; P31-S50 WeakPolarHBondContact CG-OG 3.47Å; P31-I53 HydrophobicContact CG-CD1 4.5Å
32	P	88.7	Confident	90.8	Very high	47 Å²	47	36.8 Å²	36.8	31%	0.305	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-67.4	-10.4	176.1	-12.2	25.7	0	0	0	114.4	L3 H29 L30 F34 D35	L3-P32 HydrophobicContact CD1-CB 3.73Å; L3-P32 HydrophobicContact CD1-CG 4.22Å; H29-P32 WeakPolarHBondContact O-CD 3.42Å; L30-P32 VanDerWaalsContact C-N 3.32Å; L30-P32 VanDerWaalsContact O-N 3.15Å; P32-F34 PolarHBondContact O-N 3.25Å; P32-D35 WeakPolarHBondContact CA-OD2 3.34Å; P32-D35 WeakPolarHBondContact O-CB 3.33Å; P32-D35 PolarHBondContact O-N 3.27Å
33	F	88.4	Confident	90.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-52.2	-40.4	167.8	174.3	-97.8	0	0	0	111.9	L4 L30 P31 D35 C36 I104 F107 L108 F161 L165	L4-F33 HydrophobicContact CD1-CD2 4.43Å; L4-F33 HydrophobicContact CD1-CE2 4.43Å; L4-F33 HydrophobicContact CD2-CD2 4.21Å; L30-F33 WeakPolarHBondContact O-CA 3.35Å; L30-F33 WeakPolarHBondContact O-CB 3.47Å; L30-F33 PolarHBondContact O-N 3.11Å; P31-F33 PolarHBondContact O-N 3.03Å; P31-F33 VanDerWaalsContact O-N 3.15Å; F33-D35 PolarHBondContact O-N 3.29Å; F33-C36 VanDerWaalsContact O-CB 3.25Å; F33-C36 WeakPolarHBondContact O-CB 3.48Å; F33-C36 PolarHBondContact O-N 3Å; F33-C36 VanDerWaalsContact O-N 3.12Å; F33-I104 HydrophobicContact CD1-CD1 4.31Å; F33-I104 HydrophobicContact CD1-CG1 4.13Å; F33-I104 HydrophobicContact CE1-CG1 4.08Å; F33-I104 HydrophobicContact CE1-CG2 4.33Å; F33-I104 HydrophobicContact CE2-CG2 4.46Å; F33-I104 HydrophobicContact CZ-CG2 4.26Å; F33-F107 HydrophobicContact CE1-CD1 4.33Å; F33-F107 HydrophobicContact CE1-CE1 4.48Å; F33-F107 AromaticContact CZ-CD1 3.73Å; F33-F107 HydrophobicContact CZ-CD1 3.73Å; F33-F107 AromaticContact CZ-CE1 3.79Å; F33-F107 HydrophobicContact CZ-CE1 3.79Å; F33-L108 HydrophobicContact CE2-CD1 4.2Å; F33-L108 HydrophobicContact CE2-CD2 3.94Å; F33-L108 HydrophobicContact CE2-CG 4.26Å; F33-L108 HydrophobicContact CZ-CD2 4.21Å; F33-L108 HydrophobicContact CZ-CG 4.34Å; F33-F161 AromaticContact CE2-CE2 3.99Å; F33-F161 HydrophobicContact CE2-CE2 3.99Å; F33-F161 AromaticContact CE2-CZ 3.7Å; F33-F161 HydrophobicContact CE2-CZ 3.7Å; F33-F161 HydrophobicContact CZ-CE2 4.03Å; F33-F161 AromaticContact CZ-CZ 3.82Å; F33-F161 HydrophobicContact CZ-CZ 3.82Å; F33-L165 HydrophobicContact CD2-CD2 3.83Å; F33-L165 HydrophobicContact CE2-CD2 3.99Å
34	F	88.9	Confident	89.8	Confident	3 Å²	3	42 Å²	42	1%	0.013	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-71.6	-21.5	-179.5	-65.7	-81.7	0	0	0	112.5	P31 P32 C36 L37 F42 I45 K46 I49 F103 I104	P31-F34 PolarHBondContact O-N 3.29Å; P32-F34 PolarHBondContact O-N 3.25Å; F34-C36 PolarHBondContact O-N 3.5Å; F34-L37 HydrophobicContact CD1-CD1 3.96Å; F34-L37 WeakPolarHBondContact O-CB 3.18Å; F34-L37 PolarHBondContact O-N 3.14Å; F34-L37 VanDerWaalsContact O-N 3.14Å; F34-F42 HydrophobicContact CB-CB 4.41Å; F34-I45 HydrophobicContact CD1-CB 4.25Å; F34-I45 HydrophobicContact CD1-CG2 3.8Å; F34-I45 HydrophobicContact CE1-CB 4.25Å; F34-I45 HydrophobicContact CE1-CG2 3.32Å; F34-I45 HydrophobicContact CE2-CG2 4.41Å; F34-I45 HydrophobicContact CZ-CG2 3.68Å; F34-K46 HydrophobicContact CB-CB 4.04Å; F34-K46 HydrophobicContact CD2-CB 4.38Å; F34-K46 HydrophobicContact CG-CB 4.39Å; F34-I49 HydrophobicContact CD2-CD1 4.36Å; F34-I49 HydrophobicContact CE2-CD1 3.25Å; F34-I49 HydrophobicContact CZ-CD1 3.4Å; F34-F103 HydrophobicContact CE1-CE1 4.44Å; F34-I104 HydrophobicContact CE2-CD1 3.96Å; F34-I104 HydrophobicContact CE2-CG1 4.46Å; F34-I104 HydrophobicContact CZ-CD1 3.93Å; F34-I104 HydrophobicContact CZ-CG1 3.96Å
35	D	89.3	Confident	89.2	Confident	86 Å²	86	44 Å²	44	46%	0.46	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-69.1	-26.7	173	-55.5	-35.3	0	0	0	110.8	P32 F33 L37 G38 K46	P32-D35 WeakPolarHBondContact CA-OD2 3.34Å; P32-D35 WeakPolarHBondContact O-CB 3.33Å; P32-D35 PolarHBondContact O-N 3.27Å; F33-D35 PolarHBondContact O-N 3.29Å; D35-L37 PolarHBondContact O-N 2.69Å; D35-G38 PolarHBondContact O-N 3.44Å; D35-K46 WeakPolarHBondContact OD1-CD 3.25Å; D35-K46 IonicContact OD1-NZ 3.69Å; D35-K46 PolarHBondContact OD1-NZ 2.6Å; D35-K46 IonicContact OD2-NZ 3.69Å; D35-K46 PolarHBondContact OD2-NZ 3.06Å
36	C	90.7	Very high	88.9	Confident	14 Å²	14	40.5 Å²	40.5	10%	0.095	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-66.6	-12.8	172.9	-58.3	0	0	0	0	113.3	L3 F33 F34 G38 F161 A164 L165	L3-C36 VanDerWaalsContact CD2-SG 3.5Å; F33-C36 VanDerWaalsContact O-CB 3.25Å; F33-C36 WeakPolarHBondContact O-CB 3.48Å; F33-C36 PolarHBondContact O-N 3Å; F33-C36 VanDerWaalsContact O-N 3.12Å; F34-C36 PolarHBondContact O-N 3.5Å; C36-G38 VanDerWaalsContact C-N 3.28Å; C36-F161 HydrophobicContact CB-CD2 4.1Å; C36-F161 HydrophobicContact CB-CE2 4.13Å; C36-A164 HydrophobicContact CB-CB 3.78Å; C36-L165 HydrophobicContact CB-CD2 4.37Å; C36-L165 HydrophobicContact CB-CG 4.47Å
37	L	89.7	Confident	88.9	Confident	7 Å²	7	42.9 Å²	42.9	4%	0.037	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-86.3	0.8	173.1	-57.7	170.3	0	0	0	112.4	F34 D35 S39 F42 F107 I124 P156 F161	F34-L37 HydrophobicContact CD1-CD1 3.96Å; F34-L37 WeakPolarHBondContact O-CB 3.18Å; F34-L37 PolarHBondContact O-N 3.14Å; F34-L37 VanDerWaalsContact O-N 3.14Å; D35-L37 PolarHBondContact O-N 2.69Å; L37-S39 PolarHBondContact O-N 2.69Å; L37-F42 HydrophobicContact CB-CD1 4.24Å; L37-F42 HydrophobicContact CB-CD2 3.46Å; L37-F42 VanDerWaalsContact CB-CD2 3.46Å; L37-F42 HydrophobicContact CB-CE1 4.3Å; L37-F42 HydrophobicContact CB-CE2 3.53Å; L37-F42 HydrophobicContact CB-CG 3.86Å; L37-F42 HydrophobicContact CB-CZ 3.97Å; L37-F42 HydrophobicContact CD1-CD1 3.48Å; L37-F42 VanDerWaalsContact CD1-CD1 3.48Å; L37-F42 HydrophobicContact CD1-CD2 4.27Å; L37-F42 HydrophobicContact CD1-CE1 3.58Å; L37-F42 HydrophobicContact CD1-CE2 4.36Å; L37-F42 HydrophobicContact CD1-CG 3.86Å; L37-F42 HydrophobicContact CD1-CZ 4.04Å; L37-F42 HydrophobicContact CG-CD1 4.49Å; L37-F42 HydrophobicContact CG-CE1 4.48Å; L37-F42 HydrophobicContact CG-CE2 4.5Å; L37-F42 HydrophobicContact CG-CZ 4.48Å; L37-F107 HydrophobicContact CD2-CZ 4.41Å; L37-I124 HydrophobicContact CD2-CD1 4.01Å; L37-P156 WeakPolarHBondContact O-CD 3.18Å; L37-F161 HydrophobicContact CD2-CD2 3.88Å; L37-F161 HydrophobicContact CD2-CE2 3.98Å
38	G	81.2	Confident	88.7	Confident	70 Å²	70	46.4 Å²	46.4	72%	0.722	29%	0.29	S	S	*	.			trans	69.7	-11.6	161.9	0	0	0	0	0	117.5	D35 C36	D35-G38 PolarHBondContact O-N 3.44Å; C36-G38 VanDerWaalsContact C-N 3.28Å
39	S	84.2	Confident	88.7	Confident	31 Å²	31	43.8 Å²	43.8	22%	0.217	27%	0.272	C	S	.	.	S	Bend	trans	-117.1	135.8	-174.4	177.7	0	0	0	0	112.8	L37 V41 F42	L37-S39 PolarHBondContact O-N 2.69Å; S39-V41 PolarHBondContact O-N 2.94Å; S39-V41 WeakPolarHBondContact OG-CG1 3.39Å; S39-V41 PolarHBondContact OG-N 3.12Å; S39-F42 WeakPolarHBondContact O-CD2 3.46Å; S39-F42 PolarHBondContact O-N 3.49Å
40	P	85.8	Confident	88.9	Confident	104 Å²	104	41 Å²	41	68%	0.675	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-57.5	-17.2	173.4	-24.6	34	0	0	0	114.5	F42 T43	P40-F42 PolarHBondContact O-N 3.5Å; P40-F42 VanDerWaalsContact O-N 3.14Å; P40-T43 VanDerWaalsContact O-CB 3.22Å; P40-T43 WeakPolarHBondContact O-CB 3.35Å; P40-T43 PolarHBondContact O-N 3.1Å; P40-T43 PolarHBondContact O-OG1 3Å; P40-T43 VanDerWaalsContact O-OG1 3.05Å
41	V	84.6	Confident	89.2	Confident	35 Å²	35	42.4 Å²	42.4	21%	0.212	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-59.8	-21.6	174.2	76.6	0	0	0	0	112.7	S39 P44 A150 A151 A154	S39-V41 PolarHBondContact O-N 2.94Å; S39-V41 WeakPolarHBondContact OG-CG1 3.39Å; S39-V41 PolarHBondContact OG-N 3.12Å; V41-P44 WeakPolarHBondContact O-CD 3.32Å; V41-A150 HydrophobicContact CG2-CB 4.43Å; V41-A151 HydrophobicContact CB-CB 4.48Å; V41-A151 HydrophobicContact CG1-CB 3.75Å; V41-A151 HydrophobicContact CG2-CB 3.92Å; V41-A154 HydrophobicContact CG1-CB 4.05Å
42	F	82.6	Confident	89.5	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.053	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-88.2	-8	176.6	-62.9	-78.9	0	0	0	113.4	F34 L37 S39 P40 I45 K46 A151 A155	F34-F42 HydrophobicContact CB-CB 4.41Å; L37-F42 HydrophobicContact CB-CD1 4.24Å; L37-F42 HydrophobicContact CB-CD2 3.46Å; L37-F42 VanDerWaalsContact CB-CD2 3.46Å; L37-F42 HydrophobicContact CB-CE1 4.3Å; L37-F42 HydrophobicContact CB-CE2 3.53Å; L37-F42 HydrophobicContact CB-CG 3.86Å; L37-F42 HydrophobicContact CB-CZ 3.97Å; L37-F42 HydrophobicContact CD1-CD1 3.48Å; L37-F42 VanDerWaalsContact CD1-CD1 3.48Å; L37-F42 HydrophobicContact CD1-CD2 4.27Å; L37-F42 HydrophobicContact CD1-CE1 3.58Å; L37-F42 HydrophobicContact CD1-CE2 4.36Å; L37-F42 HydrophobicContact CD1-CG 3.86Å; L37-F42 HydrophobicContact CD1-CZ 4.04Å; L37-F42 HydrophobicContact CG-CD1 4.49Å; L37-F42 HydrophobicContact CG-CE1 4.48Å; L37-F42 HydrophobicContact CG-CE2 4.5Å; L37-F42 HydrophobicContact CG-CZ 4.48Å; S39-F42 WeakPolarHBondContact O-CD2 3.46Å; S39-F42 PolarHBondContact O-N 3.49Å; P40-F42 PolarHBondContact O-N 3.5Å; P40-F42 VanDerWaalsContact O-N 3.14Å; F42-I45 HydrophobicContact CD1-CD1 3.91Å; F42-I45 WeakPolarHBondContact O-CB 3.45Å; F42-I45 PolarHBondContact O-N 2.79Å; F42-I45 VanDerWaalsContact O-N 3.08Å; F42-K46 PolarHBondContact O-N 3.01Å; F42-K46 VanDerWaalsContact O-N 3.1Å; F42-A151 HydrophobicContact CD1-CB 4.3Å; F42-A151 HydrophobicContact CE1-CB 3.74Å; F42-A151 HydrophobicContact CZ-CB 3.9Å; F42-A151 VanDerWaalsContact CZ-O 3.29Å; F42-A151 WeakPolarHBondContact CZ-O 3.37Å; F42-A155 HydrophobicContact CZ-CB 4.31Å
43	T	87.7	Confident	90	Very high	82 Å²	82	40.6 Å²	40.6	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-56.5	-41.9	178.8	-60.2	0	0	0	0	113.5	P40 I45 K46 A47	P40-T43 VanDerWaalsContact O-CB 3.22Å; P40-T43 WeakPolarHBondContact O-CB 3.35Å; P40-T43 PolarHBondContact O-N 3.1Å; P40-T43 PolarHBondContact O-OG1 3Å; P40-T43 VanDerWaalsContact O-OG1 3.05Å; T43-I45 VanDerWaalsContact C-N 3.27Å; T43-I45 PolarHBondContact O-N 3.41Å; T43-K46 PolarHBondContact O-N 3.36Å; T43-A47 WeakPolarHBondContact O-CB 3.31Å; T43-A47 PolarHBondContact O-N 3.26Å
44	P	86.4	Confident	90.5	Very high	78 Å²	78	45.1 Å²	45.1	51%	0.506	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-35.7	175.9	-24.9	36	0	0	0	113.3	V41 A47 D48	V41-P44 WeakPolarHBondContact O-CD 3.32Å; P44-A47 PolarHBondContact O-N 3.27Å; P44-D48 PolarHBondContact O-N 2.78Å
45	I	85.1	Confident	90.9	Very high	47 Å²	47	51 Å²	51	24%	0.241	32%	0.319	C	S	.	.	H	α-helix	trans	-70.5	-43.7	180	-58.5	164.7	0	0	0	110.2	F34 F42 T43 A47 D48 I49	F34-I45 HydrophobicContact CD1-CB 4.25Å; F34-I45 HydrophobicContact CD1-CG2 3.8Å; F34-I45 HydrophobicContact CE1-CB 4.25Å; F34-I45 HydrophobicContact CE1-CG2 3.32Å; F34-I45 HydrophobicContact CE2-CG2 4.41Å; F34-I45 HydrophobicContact CZ-CG2 3.68Å; F42-I45 HydrophobicContact CD1-CD1 3.91Å; F42-I45 WeakPolarHBondContact O-CB 3.45Å; F42-I45 PolarHBondContact O-N 2.79Å; F42-I45 VanDerWaalsContact O-N 3.08Å; T43-I45 VanDerWaalsContact C-N 3.27Å; T43-I45 PolarHBondContact O-N 3.41Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 3.42Å; I45-D48 PolarHBondContact O-N 3.39Å; I45-I49 HydrophobicContact CG2-CD1 4.49Å; I45-I49 PolarHBondContact O-N 3.3Å
46	K	90.9	Very high	91.4	Very high	60 Å²	60	47 Å²	47	26%	0.261	30%	0.297	S	S	.	.	H	α-helix	trans	-57.5	-46.7	172.7	179.9	173.6	168.9	176	0	111.4	P31 F34 D35 F42 T43 I49 S50	P31-K46 HydrophobicContact CB-CG 3.92Å; F34-K46 HydrophobicContact CB-CB 4.04Å; F34-K46 HydrophobicContact CD2-CB 4.38Å; F34-K46 HydrophobicContact CG-CB 4.39Å; D35-K46 WeakPolarHBondContact OD1-CD 3.25Å; D35-K46 IonicContact OD1-NZ 3.69Å; D35-K46 PolarHBondContact OD1-NZ 2.6Å; D35-K46 IonicContact OD2-NZ 3.69Å; D35-K46 PolarHBondContact OD2-NZ 3.06Å; F42-K46 PolarHBondContact O-N 3.01Å; F42-K46 VanDerWaalsContact O-N 3.1Å; T43-K46 PolarHBondContact O-N 3.36Å; K46-I49 PolarHBondContact O-N 3.23Å; K46-S50 PolarHBondContact O-N 2.99Å; K46-S50 PolarHBondContact O-OG 3.3Å
47	A	93.9	Very high	91.8	Very high	59 Å²	59	50.4 Å²	50.4	49%	0.488	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-38.7	-179.7	0	0	0	0	0	112.7	T43 P44 I45 G51	T43-A47 WeakPolarHBondContact O-CB 3.31Å; T43-A47 PolarHBondContact O-N 3.26Å; P44-A47 PolarHBondContact O-N 3.27Å; I45-A47 VanDerWaalsContact C-N 3.33Å; I45-A47 PolarHBondContact O-N 3.42Å; A47-G51 PolarHBondContact O-N 3.29Å
48	D	92.9	Very high	92.2	Very high	74 Å²	74	52.9 Å²	52.9	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-49.8	175.8	178.3	66.6	0	0	0	111.7	P44 I45 S50 G51 N52	P44-D48 PolarHBondContact O-N 2.78Å; I45-D48 PolarHBondContact O-N 3.39Å; D48-S50 PolarHBondContact O-N 3.41Å; D48-G51 PolarHBondContact O-N 3.24Å; D48-N52 WeakPolarHBondContact O-CB 3.25Å; D48-N52 PolarHBondContact O-N 2.94Å; D48-N52 PolarHBondContact O-ND2 3.48Å; D48-N52 PolarHBondContact OD1-ND2 2.92Å; D48-N52 VanDerWaalsContact OD1-ND2 3.15Å; D48-N52 PolarHBondContact OD2-ND2 3.42Å
49	I	95.2	Very high	93	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-48.4	178.5	-72.8	166.6	0	0	0	111.2	P31 F34 I45 K46 G51 N52 I53 L97 I104	P31-I49 HydrophobicContact CG-CG2 4.24Å; F34-I49 HydrophobicContact CD2-CD1 4.36Å; F34-I49 HydrophobicContact CE2-CD1 3.25Å; F34-I49 HydrophobicContact CZ-CD1 3.4Å; I45-I49 HydrophobicContact CG2-CD1 4.49Å; I45-I49 PolarHBondContact O-N 3.3Å; K46-I49 PolarHBondContact O-N 3.23Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.12Å; I49-N52 PolarHBondContact O-N 3.34Å; I49-I53 HydrophobicContact CG2-CD1 3.83Å; I49-I53 VanDerWaalsContact O-CG1 3.32Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 3.4Å; I49-L97 HydrophobicContact CG2-CD1 3.85Å; I49-I104 HydrophobicContact CD1-CD1 4.45Å
50	S	97.1	Very high	93.7	Very high	42 Å²	42	51.5 Å²	51.5	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-59.1	-45.4	176.6	-70.3	0	0	0	0	111.9	P31 K46 D48 N52 I53 T54	P31-S50 WeakPolarHBondContact CB-OG 3.38Å; P31-S50 VanDerWaalsContact CG-OG 3.29Å; P31-S50 WeakPolarHBondContact CG-OG 3.47Å; K46-S50 PolarHBondContact O-N 2.99Å; K46-S50 PolarHBondContact O-OG 3.3Å; D48-S50 PolarHBondContact O-N 3.41Å; S50-N52 PolarHBondContact O-N 3.13Å; S50-I53 PolarHBondContact O-N 2.9Å; S50-T54 PolarHBondContact O-N 3.28Å; S50-T54 PolarHBondContact O-OG1 2.67Å; S50-T54 VanDerWaalsContact O-OG1 3.12Å
51	G	98.1	Very high	94.3	Very high	29 Å²	29	50.5 Å²	50.5	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-62.8	-40.3	179.5	0	0	0	0	0	112.7	A47 D48 I49 T54 K55	A47-G51 PolarHBondContact O-N 3.29Å; D48-G51 PolarHBondContact O-N 3.24Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-G51 PolarHBondContact O-N 3.12Å; G51-T54 PolarHBondContact O-N 3.3Å; G51-K55 VanDerWaalsContact O-CG 3.31Å; G51-K55 WeakPolarHBondContact O-CG 3.42Å; G51-K55 PolarHBondContact O-N 3.19Å
52	N	98.5	Very high	94.9	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.016	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-41.9	175.8	-71.3	-44.2	0	0	0	111.8	D48 I49 S50 T54 K55 I56 A93 W96 L97	D48-N52 WeakPolarHBondContact O-CB 3.25Å; D48-N52 PolarHBondContact O-N 2.94Å; D48-N52 PolarHBondContact O-ND2 3.48Å; D48-N52 PolarHBondContact OD1-ND2 2.92Å; D48-N52 VanDerWaalsContact OD1-ND2 3.15Å; D48-N52 PolarHBondContact OD2-ND2 3.42Å; I49-N52 PolarHBondContact O-N 3.34Å; S50-N52 PolarHBondContact O-N 3.13Å; N52-T54 PolarHBondContact O-N 3.09Å; N52-K55 PolarHBondContact O-N 3.01Å; N52-I56 WeakPolarHBondContact O-CD1 3.42Å; N52-I56 VanDerWaalsContact O-CG1 3.24Å; N52-I56 WeakPolarHBondContact O-CG1 3.42Å; N52-I56 PolarHBondContact O-N 3.41Å; N52-A93 HydrophobicContact CB-CB 4.36Å; N52-A93 WeakPolarHBondContact CB-O 3.36Å; N52-W96 WeakPolarHBondContact ND2-CB 3.33Å; N52-L97 HydrophobicContact CB-CB 4.02Å
53	I	98.5	Very high	95.7	Very high	15 Å²	15	56.6 Å²	56.6	8%	0.077	33%	0.328	C	S	.	.	H	α-helix	trans	-58.8	-47.2	173.6	-68.1	163	0	0	0	110.8	L24 V27 P31 I49 S50 K55 I56 K57 L97	L24-I53 HydrophobicContact CD2-CG2 4.31Å; V27-I53 HydrophobicContact CB-CD1 4.28Å; V27-I53 HydrophobicContact CG2-CD1 3.83Å; V27-I53 HydrophobicContact CG2-CG1 3.85Å; V27-I53 WeakPolarHBondContact O-CD1 3.24Å; P31-I53 HydrophobicContact CG-CD1 4.5Å; I49-I53 HydrophobicContact CG2-CD1 3.83Å; I49-I53 VanDerWaalsContact O-CG1 3.32Å; I49-I53 WeakPolarHBondContact O-CG1 3.42Å; I49-I53 PolarHBondContact O-N 3.4Å; S50-I53 PolarHBondContact O-N 2.9Å; I53-K55 VanDerWaalsContact C-N 3.35Å; I53-K55 PolarHBondContact O-N 2.87Å; I53-I56 PolarHBondContact O-N 3.22Å; I53-K57 WeakPolarHBondContact O-CB 3.11Å; I53-K57 PolarHBondContact O-N 3.05Å; I53-L97 HydrophobicContact CD1-CD1 4.25Å; I53-L97 HydrophobicContact CG1-CD1 3.9Å; I53-L97 HydrophobicContact CG1-CD2 3.83Å
54	T	98.5	Very high	96.2	Very high	94 Å²	94	55.6 Å²	55.6	58%	0.577	32%	0.323	S	S	*	.	H	α-helix	trans	-59.6	-42.7	177.8	-61.2	0	0	0	0	112.3	S50 G51 N52 K57 A58	S50-T54 PolarHBondContact O-N 3.28Å; S50-T54 PolarHBondContact O-OG1 2.67Å; S50-T54 VanDerWaalsContact O-OG1 3.12Å; G51-T54 PolarHBondContact O-N 3.3Å; N52-T54 PolarHBondContact O-N 3.09Å; T54-K57 PolarHBondContact O-N 3.37Å; T54-A58 WeakPolarHBondContact O-CB 3.37Å; T54-A58 PolarHBondContact O-N 3.37Å
55	K	98.7	Very high	96.8	Very high	128 Å²	128	55.8 Å²	55.8	56%	0.557	33%	0.331	S	S	*	.	H	α-helix	trans	-62.8	-43.9	177.7	-73.6	170.6	-176.2	174.1	0	112.2	G51 N52 I53 A58 V59 A93	G51-K55 VanDerWaalsContact O-CG 3.31Å; G51-K55 WeakPolarHBondContact O-CG 3.42Å; G51-K55 PolarHBondContact O-N 3.19Å; N52-K55 PolarHBondContact O-N 3.01Å; I53-K55 VanDerWaalsContact C-N 3.35Å; I53-K55 PolarHBondContact O-N 2.87Å; K55-A58 PolarHBondContact O-N 2.63Å; K55-V59 PolarHBondContact O-N 2.69Å; K55-A93 HydrophobicContact CB-CB 3.74Å; K55-A93 HydrophobicContact CD-CB 4.13Å
56	I	98.8	Very high	97.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-42.9	178.3	-57	158.4	0	0	0	110	T20 L24 N52 I53 A58 V59 Y60 I73 A90 A93 L94 L97	T20-I56 HydrophobicContact CG2-CG2 4.48Å; L24-I56 HydrophobicContact CD1-CB 4.4Å; L24-I56 HydrophobicContact CD1-CG2 4Å; L24-I56 HydrophobicContact CD2-CB 3.97Å; L24-I56 HydrophobicContact CD2-CD1 4.31Å; L24-I56 HydrophobicContact CD2-CG2 3.87Å; L24-I56 HydrophobicContact CG-CG2 4.4Å; N52-I56 WeakPolarHBondContact O-CD1 3.42Å; N52-I56 VanDerWaalsContact O-CG1 3.24Å; N52-I56 WeakPolarHBondContact O-CG1 3.42Å; N52-I56 PolarHBondContact O-N 3.41Å; I53-I56 PolarHBondContact O-N 3.22Å; I56-A58 VanDerWaalsContact C-N 3.32Å; I56-A58 PolarHBondContact O-N 2.66Å; I56-V59 PolarHBondContact O-N 3.3Å; I56-Y60 PolarHBondContact O-N 3.16Å; I56-I73 HydrophobicContact CG2-CD1 3.8Å; I56-A90 HydrophobicContact CB-CB 4.4Å; I56-A90 HydrophobicContact CG1-CB 4.28Å; I56-A90 HydrophobicContact CG2-CB 4.3Å; I56-A93 HydrophobicContact CD1-CB 4.39Å; I56-A93 HydrophobicContact CG1-CB 3.78Å; I56-L94 HydrophobicContact CD1-CB 3.81Å; I56-L94 HydrophobicContact CD1-CD1 4.13Å; I56-L94 HydrophobicContact CG1-CB 4.27Å; I56-L97 HydrophobicContact CD1-CB 4.4Å; I56-L97 HydrophobicContact CD1-CD2 3.54Å
57	K	98.7	Very high	97.8	Very high	87 Å²	87	55.4 Å²	55.4	38%	0.378	33%	0.328	S	S	.	.	H	α-helix	trans	-59.3	-42.1	176.7	-174.2	59.6	163.2	71.4	0	111.9	L24 I53 T54 V59 Y60 D61	L24-K57 HydrophobicContact CD1-CB 4.01Å; L24-K57 HydrophobicContact CD1-CD 3.97Å; I53-K57 WeakPolarHBondContact O-CB 3.11Å; I53-K57 PolarHBondContact O-N 3.05Å; T54-K57 PolarHBondContact O-N 3.37Å; K57-V59 VanDerWaalsContact C-N 3.33Å; K57-V59 PolarHBondContact O-N 3.08Å; K57-Y60 HydrophobicContact CD-CD1 4.13Å; K57-Y60 PolarHBondContact O-N 2.87Å; K57-D61 IonicContact NZ-OD1 2.66Å; K57-D61 PolarHBondContact NZ-OD1 2.81Å; K57-D61 IonicContact NZ-OD2 3.32Å; K57-D61 PolarHBondContact NZ-OD2 3.28Å; K57-D61 WeakPolarHBondContact O-CB 3.38Å; K57-D61 PolarHBondContact O-N 3.09Å
58	A	98.6	Very high	98	Very high	59 Å²	59	59.5 Å²	59.5	49%	0.488	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-41.5	177.6	0	0	0	0	0	112.3	T54 K55 I56 T62	T54-A58 WeakPolarHBondContact O-CB 3.37Å; T54-A58 PolarHBondContact O-N 3.37Å; K55-A58 PolarHBondContact O-N 2.63Å; I56-A58 VanDerWaalsContact C-N 3.32Å; I56-A58 PolarHBondContact O-N 2.66Å; A58-T62 WeakPolarHBondContact O-CG2 3.4Å
59	V	98.5	Very high	98.3	Very high	25 Å²	25	56.4 Å²	56.4	15%	0.152	31%	0.314	C	S	.	.	H	α-helix	trans	-67.8	-47.5	174.7	173.9	0	0	0	0	111.1	K55 I56 K57 D61 T62 F67 A90	K55-V59 PolarHBondContact O-N 2.69Å; I56-V59 PolarHBondContact O-N 3.3Å; K57-V59 VanDerWaalsContact C-N 3.33Å; K57-V59 PolarHBondContact O-N 3.08Å; V59-D61 VanDerWaalsContact C-N 3.28Å; V59-D61 PolarHBondContact O-N 2.81Å; V59-T62 WeakPolarHBondContact O-CB 3.21Å; V59-T62 PolarHBondContact O-N 3.41Å; V59-T62 VanDerWaalsContact O-N 3.12Å; V59-T62 PolarHBondContact O-OG1 3.36Å; V59-F67 HydrophobicContact CG1-CD1 4.15Å; V59-F67 HydrophobicContact CG1-CD2 4.15Å; V59-F67 HydrophobicContact CG1-CE1 3.86Å; V59-F67 HydrophobicContact CG1-CE2 3.9Å; V59-F67 HydrophobicContact CG1-CG 4.27Å; V59-F67 HydrophobicContact CG1-CZ 3.72Å; V59-F67 WeakPolarHBondContact O-CD2 3.37Å; V59-A90 HydrophobicContact CB-CB 3.79Å; V59-A90 HydrophobicContact CG1-CB 4.06Å; V59-A90 HydrophobicContact CG2-CB 3.71Å
60	Y	98.6	Very high	98.4	Very high	47 Å²	47	56.3 Å²	56.3	18%	0.184	31%	0.314	C	S	.	.	H	α-helix	trans	-54.3	-44.2	177.8	172.7	-104.9	0	0	0	112.4	T20 I56 K57 T62 N63 P64 F67	T20-Y60 HydrophobicContact CG2-CD2 3.49Å; T20-Y60 VanDerWaalsContact CG2-CD2 3.49Å; T20-Y60 HydrophobicContact CG2-CE2 4.19Å; T20-Y60 HydrophobicContact CG2-CG 3.77Å; I56-Y60 PolarHBondContact O-N 3.16Å; K57-Y60 HydrophobicContact CD-CD1 4.13Å; K57-Y60 PolarHBondContact O-N 2.87Å; Y60-T62 PolarHBondContact O-N 2.97Å; Y60-N63 CarbonylContact O-C 3.52Å; Y60-N63 VanDerWaalsContact O-C 3.23Å; Y60-N63 PolarHBondContact O-N 3.28Å; Y60-P64 HydrophobicContact CE1-CB 4.26Å; Y60-P64 HydrophobicContact CE1-CG 4.39Å; Y60-P64 HydrophobicContact CE2-CB 3.91Å; Y60-P64 WeakPolarHBondContact O-CA 3.45Å; Y60-P64 WeakPolarHBondContact O-CD 3.27Å; Y60-P64 VanDerWaalsContact O-N 3.11Å; Y60-F67 HydrophobicContact CD2-CB 4.11Å; Y60-F67 WeakPolarHBondContact CD2-O 3.31Å
61	D	98.4	Very high	98.5	Very high	83 Å²	83	56 Å²	56	44%	0.444	31%	0.308	S	S	.	.	H	α-helix	trans	-67.6	-19.4	-177.6	-71.8	-18.7	0	0	0	113.8	K57 V59 N63	K57-D61 IonicContact NZ-OD1 2.66Å; K57-D61 PolarHBondContact NZ-OD1 2.81Å; K57-D61 IonicContact NZ-OD2 3.32Å; K57-D61 PolarHBondContact NZ-OD2 3.28Å; K57-D61 WeakPolarHBondContact O-CB 3.38Å; K57-D61 PolarHBondContact O-N 3.09Å; V59-D61 VanDerWaalsContact C-N 3.28Å; V59-D61 PolarHBondContact O-N 2.81Å; D61-N63 VanDerWaalsContact C-N 3.3Å; D61-N63 PolarHBondContact O-N 2.97Å
62	T	98.2	Very high	98.5	Very high	105 Å²	105	56.7 Å²	56.7	64%	0.644	31%	0.305	S	S	*	.	H	α-helix	trans	-66.9	-33.3	174.6	67.7	0	0	0	0	112.4	A58 V59 Y60 F67	A58-T62 WeakPolarHBondContact O-CG2 3.4Å; V59-T62 WeakPolarHBondContact O-CB 3.21Å; V59-T62 PolarHBondContact O-N 3.41Å; V59-T62 VanDerWaalsContact O-N 3.12Å; V59-T62 PolarHBondContact O-OG1 3.36Å; Y60-T62 PolarHBondContact O-N 2.97Å; T62-F67 WeakPolarHBondContact OG1-CE2 3.43Å
63	N	98.3	Very high	98.5	Very high	69 Å²	69	56.6 Å²	56.6	37%	0.369	30%	0.304	S	S	.	.			trans	-162.8	85.5	177.7	-169.7	-28.5	0	0	0	110.9	Y60 D61 A65 K66 F67	Y60-N63 CarbonylContact O-C 3.52Å; Y60-N63 VanDerWaalsContact O-C 3.23Å; Y60-N63 PolarHBondContact O-N 3.28Å; D61-N63 VanDerWaalsContact C-N 3.3Å; D61-N63 PolarHBondContact O-N 2.97Å; N63-A65 PolarHBondContact O-N 3.32Å; N63-A65 VanDerWaalsContact O-N 3.13Å; N63-A65 PolarHBondContact OD1-N 3.24Å; N63-K66 HydrophobicContact CB-CB 3.84Å; N63-K66 PolarHBondContact O-N 3.13Å; N63-K66 WeakPolarHBondContact OD1-CB 3.45Å; N63-K66 PolarHBondContact OD1-N 3.41Å; N63-F67 HydrophobicContact CB-CD2 4.2Å; N63-F67 HydrophobicContact CB-CE2 4.33Å; N63-F67 VanDerWaalsContact O-CD2 3.32Å; N63-F67 WeakPolarHBondContact O-CD2 3.23Å; N63-F67 PolarHBondContact O-N 3.08Å
64	P	98.4	Very high	98.5	Very high	61 Å²	61	55.9 Å²	55.9	40%	0.396	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.4	-178.1	-30.4	37.7	0	0	0	114.5	Y60 F67 R68	Y60-P64 HydrophobicContact CE1-CB 4.26Å; Y60-P64 HydrophobicContact CE1-CG 4.39Å; Y60-P64 HydrophobicContact CE2-CB 3.91Å; Y60-P64 WeakPolarHBondContact O-CA 3.45Å; Y60-P64 WeakPolarHBondContact O-CD 3.27Å; Y60-P64 VanDerWaalsContact O-N 3.11Å; P64-F67 CarbonylContact O-C 3.04Å; P64-R68 VanDerWaalsContact O-CA 3.3Å; P64-R68 WeakPolarHBondContact O-CA 3.22Å; P64-R68 PolarHBondContact O-N 3.39Å
65	A	98.3	Very high	98.5	Very high	83 Å²	83	55 Å²	55	69%	0.686	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-40.6	177.1	0	0	0	0	0	112	N63	N63-A65 PolarHBondContact O-N 3.32Å; N63-A65 VanDerWaalsContact O-N 3.13Å; N63-A65 PolarHBondContact OD1-N 3.24Å
66	K	98.3	Very high	98.5	Very high	95 Å²	95	49.7 Å²	49.7	41%	0.413	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.8	177.5	-169.6	179.5	-165.4	-164.8	0	112.4	N63 N72 V76	N63-K66 HydrophobicContact CB-CB 3.84Å; N63-K66 PolarHBondContact O-N 3.13Å; N63-K66 WeakPolarHBondContact OD1-CB 3.45Å; N63-K66 PolarHBondContact OD1-N 3.41Å; K66-N72 WeakPolarHBondContact O-CB 3.4Å; K66-V76 HydrophobicContact CD-CG1 3.88Å; K66-V76 HydrophobicContact CD-CG2 4.42Å; K66-V76 HydrophobicContact CG-CG1 4.2Å; K66-V76 HydrophobicContact CG-CG2 3.92Å
67	F	98.4	Very high	98.5	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.018	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	30.7	-178.7	-61.5	-64.8	0	0	0	112.4	T20 V59 Y60 T62 N63 P64 T69 I73 V76 M80	T20-F67 WeakPolarHBondContact CB-O 3.44Å; T20-F67 PolarHBondContact OG1-O 3.27Å; V59-F67 HydrophobicContact CG1-CD1 4.15Å; V59-F67 HydrophobicContact CG1-CD2 4.15Å; V59-F67 HydrophobicContact CG1-CE1 3.86Å; V59-F67 HydrophobicContact CG1-CE2 3.9Å; V59-F67 HydrophobicContact CG1-CG 4.27Å; V59-F67 HydrophobicContact CG1-CZ 3.72Å; V59-F67 WeakPolarHBondContact O-CD2 3.37Å; Y60-F67 HydrophobicContact CD2-CB 4.11Å; Y60-F67 WeakPolarHBondContact CD2-O 3.31Å; T62-F67 WeakPolarHBondContact OG1-CE2 3.43Å; N63-F67 HydrophobicContact CB-CD2 4.2Å; N63-F67 HydrophobicContact CB-CE2 4.33Å; N63-F67 VanDerWaalsContact O-CD2 3.32Å; N63-F67 WeakPolarHBondContact O-CD2 3.23Å; N63-F67 PolarHBondContact O-N 3.08Å; P64-F67 CarbonylContact O-C 3.04Å; F67-T69 VanDerWaalsContact C-N 3.29Å; F67-T69 PolarHBondContact O-N 2.95Å; F67-I73 HydrophobicContact CB-CG1 3.99Å; F67-I73 HydrophobicContact CD1-CB 4.39Å; F67-I73 HydrophobicContact CD1-CG1 3.77Å; F67-I73 HydrophobicContact CG-CG1 4.27Å; F67-V76 HydrophobicContact CD1-CB 4.45Å; F67-V76 HydrophobicContact CD1-CG1 4.45Å; F67-V76 HydrophobicContact CE1-CB 3.82Å; F67-V76 HydrophobicContact CE1-CG1 3.48Å; F67-V76 VanDerWaalsContact CE1-CG1 3.48Å; F67-V76 HydrophobicContact CZ-CG1 3.76Å; F67-M80 HydrophobicContact CZ-CE 4.47Å
68	R	98.6	Very high	98.5	Very high	144 Å²	144	50.1 Å²	50.1	54%	0.543	27%	0.27	S	S	.	.	S	Bend	trans	-54.9	-44	-172.7	-179	-179.5	175.3	-166.8	-3.8	112.4	E19 T20 P64	E19-R68 WeakPolarHBondContact CA-O 3.43Å; E19-R68 IonicContact OE1-CZ 2.69Å; E19-R68 IonicContact OE1-NE 3.3Å; E19-R68 PolarHBondContact OE1-NE 3.43Å; E19-R68 IonicContact OE1-NH2 3.6Å; E19-R68 PolarHBondContact OE1-NH2 3.3Å; T20-R68 PolarHBondContact N-O 2.85Å; T20-R68 PolarHBondContact OG1-O 3.2Å; P64-R68 VanDerWaalsContact O-CA 3.3Å; P64-R68 WeakPolarHBondContact O-CA 3.22Å; P64-R68 PolarHBondContact O-N 3.39Å
69	T	98.7	Very high	98.5	Very high	9 Å²	9	55.3 Å²	55.3	6%	0.055	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-115.6	158.5	178.9	74.8	0	0	0	0	111.7	Q17 I18 T20 F67 Q71 N72 I73	Q17-T69 HydrophobicContact CB-CG2 4.19Å; Q17-T69 PolarHBondContact OE1-OG1 3.16Å; I18-T69 CarbonylContact O-C 3.59Å; I18-T69 WeakPolarHBondContact O-CA 3.42Å; I18-T69 VanDerWaalsContact O-CB 3.31Å; I18-T69 WeakPolarHBondContact O-CB 3.27Å; T20-T69 PolarHBondContact OG1-O 3.29Å; F67-T69 VanDerWaalsContact C-N 3.29Å; F67-T69 PolarHBondContact O-N 2.95Å; T69-Q71 PolarHBondContact O-N 3.29Å; T69-N72 PolarHBondContact N-OD1 2.95Å; T69-N72 PolarHBondContact O-N 3.06Å; T69-N72 VanDerWaalsContact O-N 3.08Å; T69-N72 VanDerWaalsContact OG1-CG 3.32Å; T69-N72 PolarHBondContact OG1-N 3.47Å; T69-N72 PolarHBondContact OG1-OD1 3.24Å; T69-I73 PolarHBondContact O-N 3.24Å; T69-I73 VanDerWaalsContact O-N 3.16Å
70	L	98.7	Very high	98.4	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-33.3	174.6	-61.2	-175.8	0	0	0	111.6	I18 T20 F23 I73 L74 L94 I194 M197	I18-L70 HydrophobicContact CB-CD1 4.01Å; I18-L70 HydrophobicContact CB-CG 4.14Å; I18-L70 HydrophobicContact CD1-CD1 4.26Å; I18-L70 HydrophobicContact CG2-CD1 3.61Å; I18-L70 HydrophobicContact CG2-CG 3.91Å; I18-L70 PolarHBondContact O-N 3.18Å; T20-L70 HydrophobicContact CG2-CD2 4.17Å; T20-L70 PolarHBondContact OG1-N 3.08Å; F23-L70 HydrophobicContact CD1-CD1 3.83Å; F23-L70 HydrophobicContact CD1-CD2 3.89Å; F23-L70 HydrophobicContact CD1-CG 4.35Å; F23-L70 HydrophobicContact CD2-CD1 4.27Å; F23-L70 HydrophobicContact CE1-CD1 3.94Å; F23-L70 HydrophobicContact CE1-CD2 4.32Å; F23-L70 HydrophobicContact CE2-CD1 4.38Å; F23-L70 HydrophobicContact CG-CD1 3.99Å; F23-L70 HydrophobicContact CZ-CD1 4.21Å; L70-I73 HydrophobicContact CD2-CD1 4.19Å; L70-I73 WeakPolarHBondContact O-CB 3.38Å; L70-I73 PolarHBondContact O-N 3.15Å; L70-L74 WeakPolarHBondContact O-CD1 3.48Å; L70-L74 PolarHBondContact O-N 2.96Å; L70-L94 HydrophobicContact CB-CD2 4.1Å; L70-L94 HydrophobicContact CD1-CD1 4.32Å; L70-L94 HydrophobicContact CD1-CD2 4.23Å; L70-L94 HydrophobicContact CD2-CD2 4.2Å; L70-L94 HydrophobicContact CG-CD2 4.42Å; L70-I194 HydrophobicContact CD1-CD1 3.82Å; L70-I194 HydrophobicContact CD1-CG1 3.98Å; L70-M197 HydrophobicContact CB-CE 3.97Å; L70-M197 HydrophobicContact CB-SD 4.4Å
71	Q	98.4	Very high	98.4	Very high	34 Å²	34	60.2 Å²	60.2	16%	0.159	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-46.1	173.6	-179.3	67.3	36.1	0	0	111.1	T69 I73 L74 E75 M197 M201	T69-Q71 PolarHBondContact O-N 3.29Å; Q71-I73 VanDerWaalsContact C-N 3.25Å; Q71-I73 PolarHBondContact O-N 2.91Å; Q71-L74 PolarHBondContact O-N 3.31Å; Q71-L74 VanDerWaalsContact O-N 3.1Å; Q71-E75 HydrophobicContact CG-CG 4.44Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.41Å; Q71-E75 PolarHBondContact NE2-OE1 3.19Å; Q71-E75 WeakPolarHBondContact O-CG 3.5Å; Q71-E75 PolarHBondContact O-N 3.26Å; Q71-M197 VanDerWaalsContact CA-SD 3.52Å; Q71-M197 HydrophobicContact CB-SD 3.98Å; Q71-M197 PolarHBondContact OE1-SD 3.48Å; Q71-M201 PolarHBondContact NE2-SD 2.94Å
72	N	98.5	Very high	98.3	Very high	45 Å²	45	58.5 Å²	58.5	24%	0.241	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-32.3	177.7	-62	147.2	0	0	0	112.5	K66 T69 E75 V76	K66-N72 WeakPolarHBondContact O-CB 3.4Å; T69-N72 PolarHBondContact N-OD1 2.95Å; T69-N72 PolarHBondContact O-N 3.06Å; T69-N72 VanDerWaalsContact O-N 3.08Å; T69-N72 VanDerWaalsContact OG1-CG 3.32Å; T69-N72 PolarHBondContact OG1-N 3.47Å; T69-N72 PolarHBondContact OG1-OD1 3.24Å; N72-E75 PolarHBondContact ND2-OE2 2.97Å; N72-E75 PolarHBondContact O-N 3.35Å; N72-V76 WeakPolarHBondContact O-CB 3.42Å; N72-V76 WeakPolarHBondContact O-CG2 3.43Å; N72-V76 PolarHBondContact O-N 3.06Å
73	I	98.7	Very high	98.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-56.5	-52.5	171.6	-70.6	169.1	0	0	0	110.5	T20 I56 F67 T69 L70 Q71 E75 E77 A90	T20-I73 HydrophobicContact CG2-CD1 3.69Å; I56-I73 HydrophobicContact CG2-CD1 3.8Å; F67-I73 HydrophobicContact CB-CG1 3.99Å; F67-I73 HydrophobicContact CD1-CB 4.39Å; F67-I73 HydrophobicContact CD1-CG1 3.77Å; F67-I73 HydrophobicContact CG-CG1 4.27Å; T69-I73 PolarHBondContact O-N 3.24Å; T69-I73 VanDerWaalsContact O-N 3.16Å; L70-I73 HydrophobicContact CD2-CD1 4.19Å; L70-I73 WeakPolarHBondContact O-CB 3.38Å; L70-I73 PolarHBondContact O-N 3.15Å; Q71-I73 VanDerWaalsContact C-N 3.25Å; Q71-I73 PolarHBondContact O-N 2.91Å; I73-E75 PolarHBondContact O-N 3.17Å; I73-E77 VanDerWaalsContact O-CB 3.25Å; I73-E77 WeakPolarHBondContact O-CB 3.24Å; I73-E77 WeakPolarHBondContact O-CG 3.34Å; I73-E77 PolarHBondContact O-N 3.34Å; I73-A90 HydrophobicContact CG2-CB 3.62Å
74	L	98.7	Very high	98.3	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.5	-42.8	-177.5	-86.5	66.1	0	0	0	111.9	L70 Q71 K78 W85 T91 L94 M197 Y198 M201 A203	L70-L74 WeakPolarHBondContact O-CD1 3.48Å; L70-L74 PolarHBondContact O-N 2.96Å; Q71-L74 PolarHBondContact O-N 3.31Å; Q71-L74 VanDerWaalsContact O-N 3.1Å; L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 PolarHBondContact O-N 2.8Å; L74-W85 PolarHBondContact O-NE1 3.45Å; L74-T91 HydrophobicContact CD1-CG2 4.47Å; L74-T91 HydrophobicContact CG-CG2 4.01Å; L74-L94 HydrophobicContact CD1-CD2 3.91Å; L74-M197 HydrophobicContact CD1-CE 4.19Å; L74-M197 HydrophobicContact CD2-CE 4.25Å; L74-M197 HydrophobicContact CD2-CG 3.82Å; L74-M197 HydrophobicContact CD2-SD 4.21Å; L74-Y198 HydrophobicContact CD1-CE2 4.2Å; L74-Y198 HydrophobicContact CD2-CD2 4.06Å; L74-Y198 HydrophobicContact CD2-CE2 3.95Å; L74-Y198 HydrophobicContact CD2-CG 4.48Å; L74-M201 HydrophobicContact CB-CE 3.74Å; L74-M201 HydrophobicContact CB-SD 3.42Å; L74-M201 WeakPolarHBondContact CB-SD 3.34Å; L74-M201 HydrophobicContact CD2-CB 4.5Å; L74-M201 HydrophobicContact CD2-SD 3.62Å; L74-M201 HydrophobicContact CG-SD 4.17Å; L74-A203 HydrophobicContact CD2-CB 3.98Å
75	E	98.5	Very high	98.3	Very high	75 Å²	75	59.4 Å²	59.4	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-65	-50.7	-178.5	-70.3	168.7	166.6	0	0	111.6	Q71 N72 I73 K78 E79 M201	Q71-E75 HydrophobicContact CG-CG 4.44Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.41Å; Q71-E75 PolarHBondContact NE2-OE1 3.19Å; Q71-E75 WeakPolarHBondContact O-CG 3.5Å; Q71-E75 PolarHBondContact O-N 3.26Å; N72-E75 PolarHBondContact ND2-OE2 2.97Å; N72-E75 PolarHBondContact O-N 3.35Å; I73-E75 PolarHBondContact O-N 3.17Å; E75-K78 WeakPolarHBondContact O-CB 3.3Å; E75-K78 PolarHBondContact O-N 2.98Å; E75-E79 PolarHBondContact O-N 3.42Å; E75-M201 HydrophobicContact CB-CE 4.36Å; E75-M201 HydrophobicContact CG-CE 3.59Å; E75-M201 HydrophobicContact CG-SD 4.4Å
76	V	98.5	Very high	98.3	Very high	18 Å²	18	56.1 Å²	56.1	11%	0.109	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-42.8	-178.1	168.5	0	0	0	0	111.3	K66 F67 N72 K78 E79 M80	K66-V76 HydrophobicContact CD-CG1 3.88Å; K66-V76 HydrophobicContact CD-CG2 4.42Å; K66-V76 HydrophobicContact CG-CG1 4.2Å; K66-V76 HydrophobicContact CG-CG2 3.92Å; F67-V76 HydrophobicContact CD1-CB 4.45Å; F67-V76 HydrophobicContact CD1-CG1 4.45Å; F67-V76 HydrophobicContact CE1-CB 3.82Å; F67-V76 HydrophobicContact CE1-CG1 3.48Å; F67-V76 VanDerWaalsContact CE1-CG1 3.48Å; F67-V76 HydrophobicContact CZ-CG1 3.76Å; N72-V76 WeakPolarHBondContact O-CB 3.42Å; N72-V76 WeakPolarHBondContact O-CG2 3.43Å; N72-V76 PolarHBondContact O-N 3.06Å; V76-K78 VanDerWaalsContact C-N 3.31Å; V76-K78 PolarHBondContact O-N 2.96Å; V76-E79 PolarHBondContact O-N 3.32Å; V76-M80 HydrophobicContact CG1-CE 4.13Å; V76-M80 VanDerWaalsContact O-CB 3.3Å; V76-M80 WeakPolarHBondContact O-CB 3.41Å; V76-M80 PolarHBondContact O-N 2.92Å
77	E	98.5	Very high	98.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-69.2	-30.8	178.5	-74.3	-165.2	149.1	0	0	112.4	I73 M80 Y81 G89 A90 T91	I73-E77 VanDerWaalsContact O-CB 3.25Å; I73-E77 WeakPolarHBondContact O-CB 3.24Å; I73-E77 WeakPolarHBondContact O-CG 3.34Å; I73-E77 PolarHBondContact O-N 3.34Å; E77-M80 PolarHBondContact O-N 3.45Å; E77-Y81 HydrophobicContact CB-CD2 3.82Å; E77-Y81 HydrophobicContact CB-CE2 3.92Å; E77-Y81 HydrophobicContact CG-CD2 4.2Å; E77-Y81 HydrophobicContact CG-CE2 3.76Å; E77-Y81 WeakPolarHBondContact O-CB 3.41Å; E77-Y81 VanDerWaalsContact O-CD2 3.23Å; E77-Y81 WeakPolarHBondContact O-CD2 3.32Å; E77-Y81 PolarHBondContact O-N 3.21Å; E77-G89 WeakPolarHBondContact OE1-CA 3.37Å; E77-A90 VanDerWaalsContact CD-N 3.34Å; E77-A90 PolarHBondContact OE1-N 3.12Å; E77-A90 PolarHBondContact OE2-N 3.08Å; E77-A90 VanDerWaalsContact OE2-N 3.12Å; E77-T91 VanDerWaalsContact OE2-CB 3.25Å; E77-T91 WeakPolarHBondContact OE2-CB 3.48Å; E77-T91 PolarHBondContact OE2-N 3.28Å; E77-T91 PolarHBondContact OE2-OG1 2.9Å
78	K	98.4	Very high	98.2	Very high	96 Å²	96	59.8 Å²	59.8	42%	0.417	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-44.8	173.6	-176	174.5	-178.8	174.4	0	111.8	L74 E75 V76 G82 W85	L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 PolarHBondContact O-N 2.8Å; E75-K78 WeakPolarHBondContact O-CB 3.3Å; E75-K78 PolarHBondContact O-N 2.98Å; V76-K78 VanDerWaalsContact C-N 3.31Å; V76-K78 PolarHBondContact O-N 2.96Å; K78-G82 PolarHBondContact O-N 3.37Å; K78-G82 VanDerWaalsContact O-N 3.17Å; K78-W85 HydrophobicContact CB-CD2 3.81Å; K78-W85 HydrophobicContact CB-CE3 4.46Å; K78-W85 HydrophobicContact CB-CG 3.93Å; K78-W85 HydrophobicContact CB-CZ2 4.3Å; K78-W85 HydrophobicContact CD-CD2 4.28Å; K78-W85 HydrophobicContact CD-CE3 4.14Å; K78-W85 HydrophobicContact CD-CH2 4.12Å; K78-W85 HydrophobicContact CD-CZ2 4.22Å; K78-W85 HydrophobicContact CD-CZ3 4.08Å; K78-W85 HydrophobicContact CG-CD2 3.78Å; K78-W85 HydrophobicContact CG-CE3 3.94Å; K78-W85 HydrophobicContact CG-CG 4.16Å; K78-W85 HydrophobicContact CG-CZ2 4.49Å; K78-W85 HydrophobicContact CG-CZ3 4.4Å
79	E	98	Very high	98.2	Very high	168 Å²	168	54.3 Å²	54.3	79%	0.785	29%	0.293	S	S	*	.	H	α-helix	trans	-67.5	-40.3	175	-67	179.2	172.8	0	0	112	E75 V76	E75-E79 PolarHBondContact O-N 3.42Å; V76-E79 PolarHBondContact O-N 3.32Å
80	M	97.9	Very high	98.2	Very high	99 Å²	99	54 Å²	54	49%	0.488	29%	0.29	S	S	.	.	H	α-helix	trans	-68.7	-43.1	-176.5	-174.9	-177.8	-59.8	0	0	113.4	F67 V76 E77	F67-M80 HydrophobicContact CZ-CE 4.47Å; V76-M80 HydrophobicContact CG1-CE 4.13Å; V76-M80 VanDerWaalsContact O-CB 3.3Å; V76-M80 WeakPolarHBondContact O-CB 3.41Å; V76-M80 PolarHBondContact O-N 2.92Å; E77-M80 PolarHBondContact O-N 3.45Å
81	Y	98.1	Very high	98.2	Very high	76 Å²	76	54 Å²	54	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-101.3	-9.3	-171.6	-63	-61.3	0	0	0	114	E77 A83 E84 V88	E77-Y81 HydrophobicContact CB-CD2 3.82Å; E77-Y81 HydrophobicContact CB-CE2 3.92Å; E77-Y81 HydrophobicContact CG-CD2 4.2Å; E77-Y81 HydrophobicContact CG-CE2 3.76Å; E77-Y81 WeakPolarHBondContact O-CB 3.41Å; E77-Y81 VanDerWaalsContact O-CD2 3.23Å; E77-Y81 WeakPolarHBondContact O-CD2 3.32Å; E77-Y81 PolarHBondContact O-N 3.21Å; Y81-A83 PolarHBondContact O-N 3.47Å; Y81-E84 PolarHBondContact O-N 3.3Å; Y81-V88 HydrophobicContact CD1-CG2 3.88Å; Y81-V88 HydrophobicContact CD2-CG2 3.56Å; Y81-V88 HydrophobicContact CE1-CG2 4.39Å; Y81-V88 HydrophobicContact CE2-CG2 4.11Å; Y81-V88 HydrophobicContact CG-CG2 3.43Å; Y81-V88 VanDerWaalsContact CG-CG2 3.43Å
82	G	96.6	Very high	98.2	Very high	46 Å²	46	54.2 Å²	54.2	47%	0.474	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	50.6	-115.5	175.8	0	0	0	0	0	112.8	K78 E84 W85	K78-G82 PolarHBondContact O-N 3.37Å; K78-G82 VanDerWaalsContact O-N 3.17Å; G82-E84 VanDerWaalsContact C-N 3.25Å; G82-E84 PolarHBondContact O-N 3.03Å; G82-W85 WeakPolarHBondContact O-CB 3.35Å; G82-W85 PolarHBondContact O-N 2.83Å
83	A	97.6	Very high	98.2	Very high	105 Å²	105	52.2 Å²	52.2	87%	0.868	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-67.8	-18.7	-176.8	0	0	0	0	0	114.8	Y81	Y81-A83 PolarHBondContact O-N 3.47Å
84	E	98.1	Very high	98.2	Very high	122 Å²	122	52.2 Å²	52.2	57%	0.57	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-80.3	-20.3	176.6	-63.2	-174.6	82.2	0	0	112	Y81 G82 K87 V88	Y81-E84 PolarHBondContact O-N 3.3Å; G82-E84 VanDerWaalsContact C-N 3.25Å; G82-E84 PolarHBondContact O-N 3.03Å; E84-K87 WeakPolarHBondContact O-CA 3.22Å; E84-K87 VanDerWaalsContact O-CB 3.29Å; E84-K87 WeakPolarHBondContact O-CB 3.43Å; E84-K87 PolarHBondContact O-N 2.92Å; E84-V88 HydrophobicContact CB-CG1 4.11Å; E84-V88 HydrophobicContact CB-CG2 3.99Å
85	W	98.5	Very high	98.2	Very high	28 Å²	28	52.2 Å²	52.2	11%	0.106	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	141.8	175.2	-172.4	93.4	0	0	0	111.5	L74 K78 G82 T91 M201 A203	L74-W85 PolarHBondContact O-NE1 3.45Å; K78-W85 HydrophobicContact CB-CD2 3.81Å; K78-W85 HydrophobicContact CB-CE3 4.46Å; K78-W85 HydrophobicContact CB-CG 3.93Å; K78-W85 HydrophobicContact CB-CZ2 4.3Å; K78-W85 HydrophobicContact CD-CD2 4.28Å; K78-W85 HydrophobicContact CD-CE3 4.14Å; K78-W85 HydrophobicContact CD-CH2 4.12Å; K78-W85 HydrophobicContact CD-CZ2 4.22Å; K78-W85 HydrophobicContact CD-CZ3 4.08Å; K78-W85 HydrophobicContact CG-CD2 3.78Å; K78-W85 HydrophobicContact CG-CE3 3.94Å; K78-W85 HydrophobicContact CG-CG 4.16Å; K78-W85 HydrophobicContact CG-CZ2 4.49Å; K78-W85 HydrophobicContact CG-CZ3 4.4Å; G82-W85 WeakPolarHBondContact O-CB 3.35Å; G82-W85 PolarHBondContact O-N 2.83Å; W85-T91 HydrophobicContact CZ2-CG2 4.26Å; W85-T91 PolarHBondContact NE1-OG1 3.34Å; W85-M201 HydrophobicContact CH2-CB 4.26Å; W85-M201 VanDerWaalsContact CH2-O 3.25Å; W85-M201 WeakPolarHBondContact CH2-O 3.36Å; W85-A203 HydrophobicContact CH2-CB 3.51Å; W85-A203 HydrophobicContact CZ2-CB 3.55Å
86	P	97.7	Very high	98.2	Very high	13 Å²	13	49.7 Å²	49.7	8%	0.084	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	cis	-94	24.6	1.2	38	-36.7	0	0	0	113.4	V88 T91 A203 L205	P86-V88 VanDerWaalsContact C-N 3.25Å; P86-V88 PolarHBondContact O-N 3.45Å; P86-T91 HydrophobicContact CB-CG2 3.71Å; P86-A203 HydrophobicContact CB-CB 4.25Å; P86-A203 WeakPolarHBondContact CG-O 3.48Å; P86-L205 HydrophobicContact CG-CD1 4.23Å; P86-L205 HydrophobicContact CG-CD2 3.7Å; P86-L205 HydrophobicContact CG-CG 3.85Å
87	K	97.9	Very high	98.2	Very high	140 Å²	140	48.9 Å²	48.9	61%	0.609	27%	0.265	S	S	*	.	S	Bend	trans	-85.1	8.1	-172	-55.8	173.8	-177.7	169.8	0	113.9	E84 L92 L205	E84-K87 WeakPolarHBondContact O-CA 3.22Å; E84-K87 VanDerWaalsContact O-CB 3.29Å; E84-K87 WeakPolarHBondContact O-CB 3.43Å; E84-K87 PolarHBondContact O-N 2.92Å; K87-L92 WeakPolarHBondContact O-CD2 3.5Å; K87-L205 HydrophobicContact CB-CD1 4.3Å; K87-L205 HydrophobicContact CG-CD1 3.81Å; K87-L205 HydrophobicContact CG-CD2 4.02Å
88	V	97.8	Very high	98.2	Very high	36 Å²	36	48.9 Å²	48.9	22%	0.218	27%	0.265	C	S	.	.	S	Bend	trans	-141.1	169.3	-175	-63.3	0	0	0	0	110.9	Y81 E84 P86 L92	Y81-V88 HydrophobicContact CD1-CG2 3.88Å; Y81-V88 HydrophobicContact CD2-CG2 3.56Å; Y81-V88 HydrophobicContact CE1-CG2 4.39Å; Y81-V88 HydrophobicContact CE2-CG2 4.11Å; Y81-V88 HydrophobicContact CG-CG2 3.43Å; Y81-V88 VanDerWaalsContact CG-CG2 3.43Å; E84-V88 HydrophobicContact CB-CG1 4.11Å; E84-V88 HydrophobicContact CB-CG2 3.99Å; P86-V88 VanDerWaalsContact C-N 3.25Å; P86-V88 PolarHBondContact O-N 3.45Å; V88-L92 PolarHBondContact O-N 3.31Å
89	G	98	Very high	98.1	Very high	30 Å²	30	44.3 Å²	44.3	31%	0.309	25%	0.245	S	C	.	.	H	α-helix	trans	72	-164.9	170.3	0	0	0	0	0	115.9	E77 T91 L92 A93	E77-G89 WeakPolarHBondContact OE1-CA 3.37Å; G89-T91 PolarHBondContact O-N 3.5Å; G89-L92 PolarHBondContact O-N 3.05Å; G89-A93 PolarHBondContact O-N 2.84Å
90	A	98.7	Very high	98	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-25.4	176	0	0	0	0	0	112.4	I56 V59 I73 E77 L92 A93 L94	I56-A90 HydrophobicContact CB-CB 4.4Å; I56-A90 HydrophobicContact CG1-CB 4.28Å; I56-A90 HydrophobicContact CG2-CB 4.3Å; V59-A90 HydrophobicContact CB-CB 3.79Å; V59-A90 HydrophobicContact CG1-CB 4.06Å; V59-A90 HydrophobicContact CG2-CB 3.71Å; I73-A90 HydrophobicContact CG2-CB 3.62Å; E77-A90 VanDerWaalsContact CD-N 3.34Å; E77-A90 PolarHBondContact OE1-N 3.12Å; E77-A90 PolarHBondContact OE2-N 3.08Å; E77-A90 VanDerWaalsContact OE2-N 3.12Å; A90-L92 VanDerWaalsContact C-N 3.34Å; A90-L92 PolarHBondContact O-N 2.65Å; A90-A93 PolarHBondContact O-N 3.41Å; A90-L94 VanDerWaalsContact O-CB 3.27Å; A90-L94 WeakPolarHBondContact O-CB 3.22Å; A90-L94 PolarHBondContact O-N 2.95Å
91	T	98.8	Very high	98	Very high	1 Å²	1	32 Å²	32	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-46.1	171.5	-61.6	0	0	0	0	110.3	L74 E77 W85 P86 G89 M95 Y198 A203	L74-T91 HydrophobicContact CD1-CG2 4.47Å; L74-T91 HydrophobicContact CG-CG2 4.01Å; E77-T91 VanDerWaalsContact OE2-CB 3.25Å; E77-T91 WeakPolarHBondContact OE2-CB 3.48Å; E77-T91 PolarHBondContact OE2-N 3.28Å; E77-T91 PolarHBondContact OE2-OG1 2.9Å; W85-T91 HydrophobicContact CZ2-CG2 4.26Å; W85-T91 PolarHBondContact NE1-OG1 3.34Å; P86-T91 HydrophobicContact CB-CG2 3.71Å; G89-T91 PolarHBondContact O-N 3.5Å; T91-M95 PolarHBondContact O-N 3.02Å; T91-M95 VanDerWaalsContact O-N 3.14Å; T91-Y198 HydrophobicContact CG2-CE1 4.44Å; T91-Y198 PolarHBondContact O-OH 3.47Å; T91-A203 HydrophobicContact CG2-CB 4.38Å
92	L	98.5	Very high	98	Very high	39 Å²	39	30.1 Å²	30.1	20%	0.204	18%	0.181	C	C	.	.	H	α-helix	trans	-67	-42.8	176.1	-177.2	71.6	0	0	0	111.4	K87 V88 G89 A90 M95 W96 L205	K87-L92 WeakPolarHBondContact O-CD2 3.5Å; V88-L92 PolarHBondContact O-N 3.31Å; G89-L92 PolarHBondContact O-N 3.05Å; A90-L92 VanDerWaalsContact C-N 3.34Å; A90-L92 PolarHBondContact O-N 2.65Å; L92-M95 HydrophobicContact CD1-CE 3.64Å; L92-M95 WeakPolarHBondContact O-CB 3.32Å; L92-M95 PolarHBondContact O-N 2.63Å; L92-W96 PolarHBondContact O-N 2.71Å; L92-L205 HydrophobicContact CD1-CD1 3.76Å
93	A	98.7	Very high	98	Very high	3 Å²	3	28.3 Å²	28.3	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-43.5	-179.9	0	0	0	0	0	112.3	N52 K55 I56 G89 A90 M95 W96 L97	N52-A93 HydrophobicContact CB-CB 4.36Å; N52-A93 WeakPolarHBondContact CB-O 3.36Å; K55-A93 HydrophobicContact CB-CB 3.74Å; K55-A93 HydrophobicContact CD-CB 4.13Å; I56-A93 HydrophobicContact CD1-CB 4.39Å; I56-A93 HydrophobicContact CG1-CB 3.78Å; G89-A93 PolarHBondContact O-N 2.84Å; A90-A93 PolarHBondContact O-N 3.41Å; A93-M95 VanDerWaalsContact C-N 3.27Å; A93-M95 PolarHBondContact O-N 3.45Å; A93-W96 PolarHBondContact O-N 3.3Å; A93-L97 WeakPolarHBondContact O-CB 3.49Å; A93-L97 PolarHBondContact O-N 2.99Å
94	L	98.8	Very high	97.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.2	-30.1	177	177.6	64.6	0	0	0	111.8	F23 I56 L70 L74 A90 L97 K98 I194 M197 Y198	F23-L94 HydrophobicContact CE1-CD1 4.09Å; F23-L94 HydrophobicContact CZ-CD1 4.37Å; I56-L94 HydrophobicContact CD1-CB 3.81Å; I56-L94 HydrophobicContact CD1-CD1 4.13Å; I56-L94 HydrophobicContact CG1-CB 4.27Å; L70-L94 HydrophobicContact CB-CD2 4.1Å; L70-L94 HydrophobicContact CD1-CD1 4.32Å; L70-L94 HydrophobicContact CD1-CD2 4.23Å; L70-L94 HydrophobicContact CD2-CD2 4.2Å; L70-L94 HydrophobicContact CG-CD2 4.42Å; L74-L94 HydrophobicContact CD1-CD2 3.91Å; A90-L94 VanDerWaalsContact O-CB 3.27Å; A90-L94 WeakPolarHBondContact O-CB 3.22Å; A90-L94 PolarHBondContact O-N 2.95Å; L94-L97 HydrophobicContact CD1-CD2 4.36Å; L94-L97 PolarHBondContact O-N 3.07Å; L94-K98 WeakPolarHBondContact O-CB 3.29Å; L94-K98 WeakPolarHBondContact O-CG 3.44Å; L94-K98 PolarHBondContact O-N 3.39Å; L94-I194 HydrophobicContact CD1-CG2 4.46Å; L94-I194 HydrophobicContact CG-CG2 4.46Å; L94-M197 HydrophobicContact CD2-CE 4Å; L94-Y198 VanDerWaalsContact C-OH 3.3Å; L94-Y198 VanDerWaalsContact CB-OH 3.22Å; L94-Y198 WeakPolarHBondContact CB-OH 3.29Å; L94-Y198 HydrophobicContact CD2-CE2 3.94Å; L94-Y198 HydrophobicContact CG-CE2 3.95Å; L94-Y198 WeakPolarHBondContact CG-OH 3.39Å
95	M	98.6	Very high	97.9	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-63.7	-42.6	174.9	-170.5	-165.6	63.1	0	0	111.5	T91 L92 A93 K98 R99 Y198 L205 Y207	T91-M95 PolarHBondContact O-N 3.02Å; T91-M95 VanDerWaalsContact O-N 3.14Å; L92-M95 HydrophobicContact CD1-CE 3.64Å; L92-M95 WeakPolarHBondContact O-CB 3.32Å; L92-M95 PolarHBondContact O-N 2.63Å; A93-M95 VanDerWaalsContact C-N 3.27Å; A93-M95 PolarHBondContact O-N 3.45Å; M95-K98 VanDerWaalsContact O-CG 3.23Å; M95-K98 WeakPolarHBondContact O-CG 3.31Å; M95-R99 WeakPolarHBondContact O-CD 3.34Å; M95-R99 VanDerWaalsContact O-CG 3.31Å; M95-R99 WeakPolarHBondContact O-CG 3.39Å; M95-R99 PolarHBondContact SD-NH2 3.03Å; M95-Y198 HydrophobicContact CB-CD1 4.38Å; M95-Y198 HydrophobicContact CB-CE1 3.52Å; M95-Y198 HydrophobicContact CG-CD1 4.2Å; M95-Y198 HydrophobicContact CG-CE1 3.81Å; M95-Y198 PolarHBondContact N-OH 2.95Å; M95-L205 HydrophobicContact CE-CB 4.2Å; M95-L205 HydrophobicContact CE-CD1 4.32Å; M95-L205 HydrophobicContact SD-CB 3.67Å; M95-L205 HydrophobicContact SD-CD1 4.19Å; M95-L205 HydrophobicContact SD-CG 4.02Å; M95-L205 PolarHBondContact SD-N 2.84Å; M95-L205 VanDerWaalsContact SD-N 3.39Å; M95-Y207 HydrophobicContact CE-CE1 4.11Å
96	W	98.2	Very high	97.9	Very high	22 Å²	22	17.6 Å²	17.6	8%	0.083	9%	0.093	C	C	.	.	H	α-helix	trans	-72.7	-43.3	176.3	-72.7	116.6	0	0	0	111.5	N52 L92 A93 K98 R99 G100 Y139 Y207 V209	N52-W96 WeakPolarHBondContact ND2-CB 3.33Å; L92-W96 PolarHBondContact O-N 2.71Å; A93-W96 PolarHBondContact O-N 3.3Å; W96-K98 PolarHBondContact O-N 2.91Å; W96-R99 WeakPolarHBondContact O-CB 3.38Å; W96-R99 PolarHBondContact O-N 2.91Å; W96-R99 VanDerWaalsContact O-N 3.13Å; W96-G100 PolarHBondContact O-N 3.5Å; W96-G100 VanDerWaalsContact O-N 3.08Å; W96-Y139 HydrophobicContact CZ3-CG 4.49Å; W96-Y207 HydrophobicContact CZ2-CE1 4.09Å; W96-Y207 AromaticContact CZ2-CE2 3.84Å; W96-Y207 HydrophobicContact CZ2-CE2 3.84Å; W96-Y207 AromaticContact CZ2-CZ 3.51Å; W96-Y207 WeakPolarHBondContact CZ2-OH 3.33Å; W96-Y207 PolarHBondContact NE1-OH 2.77Å; W96-Y207 VanDerWaalsContact NE1-OH 3.15Å; W96-V209 HydrophobicContact CH2-CB 4.34Å; W96-V209 HydrophobicContact CH2-CG1 3.69Å; W96-V209 HydrophobicContact CH2-CG2 3.72Å; W96-V209 HydrophobicContact CZ2-CG1 3.49Å; W96-V209 VanDerWaalsContact CZ2-CG1 3.49Å; W96-V209 HydrophobicContact CZ2-CG2 4.33Å; W96-V209 HydrophobicContact CZ3-CG2 4.2Å
97	L	98.4	Very high	97.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-55.9	-50.4	175.7	-177.8	58.1	0	0	0	111.7	F23 V27 I49 N52 I53 I56 A93 L94 R99 G100 L101	F23-L97 HydrophobicContact CE1-CD2 4.09Å; F23-L97 HydrophobicContact CZ-CD2 4.43Å; V27-L97 HydrophobicContact CG2-CD2 4.33Å; I49-L97 HydrophobicContact CG2-CD1 3.85Å; N52-L97 HydrophobicContact CB-CB 4.02Å; I53-L97 HydrophobicContact CD1-CD1 4.25Å; I53-L97 HydrophobicContact CG1-CD1 3.9Å; I53-L97 HydrophobicContact CG1-CD2 3.83Å; I56-L97 HydrophobicContact CD1-CB 4.4Å; I56-L97 HydrophobicContact CD1-CD2 3.54Å; A93-L97 WeakPolarHBondContact O-CB 3.49Å; A93-L97 PolarHBondContact O-N 2.99Å; L94-L97 HydrophobicContact CD1-CD2 4.36Å; L94-L97 PolarHBondContact O-N 3.07Å; L97-R99 PolarHBondContact O-N 2.87Å; L97-R99 VanDerWaalsContact O-N 3.17Å; L97-G100 PolarHBondContact O-N 3.44Å; L97-G100 VanDerWaalsContact O-N 3.07Å; L97-L101 HydrophobicContact CD1-CD1 4.38Å; L97-L101 HydrophobicContact CD1-CD2 4.33Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 4.03Å; L97-L101 HydrophobicContact CG-CG 4.23Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.15Å; L97-L101 PolarHBondContact O-N 2.89Å
98	K	98.2	Very high	97.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.1	-28.2	-179.6	74.5	177.6	-179.3	70.4	0	113.2	L94 M95 W96 R102 I194 Y195 Y198 E204	L94-K98 WeakPolarHBondContact O-CB 3.29Å; L94-K98 WeakPolarHBondContact O-CG 3.44Å; L94-K98 PolarHBondContact O-N 3.39Å; M95-K98 VanDerWaalsContact O-CG 3.23Å; M95-K98 WeakPolarHBondContact O-CG 3.31Å; W96-K98 PolarHBondContact O-N 2.91Å; K98-R102 WeakPolarHBondContact O-CB 3.35Å; K98-R102 PolarHBondContact O-N 3.39Å; K98-I194 HydrophobicContact CB-CG2 3.78Å; K98-I194 HydrophobicContact CD-CG2 3.71Å; K98-I194 HydrophobicContact CG-CG2 4.34Å; K98-Y195 HydrophobicContact CB-CE2 4.11Å; K98-Y195 HydrophobicContact CD-CD2 4.23Å; K98-Y195 HydrophobicContact CD-CE2 4.21Å; K98-Y195 HydrophobicContact CG-CE2 4.05Å; K98-Y195 WeakPolarHBondContact O-CE2 3.4Å; K98-Y195 PolarHBondContact O-OH 2.85Å; K98-Y198 HydrophobicContact CD-CD1 4.4Å; K98-Y198 HydrophobicContact CD-CD2 3.7Å; K98-Y198 HydrophobicContact CD-CE2 3.88Å; K98-Y198 HydrophobicContact CD-CG 3.97Å; K98-E204 WeakPolarHBondContact CE-OE2 3.4Å; K98-E204 IonicContact NZ-OE1 3.95Å; K98-E204 IonicContact NZ-OE2 2.87Å; K98-E204 PolarHBondContact NZ-OE2 3.35Å
99	R	97.8	Very high	97.9	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-72	-45.1	174.4	-68	166.8	-178.5	174	0	111	M95 W96 L97 L101 R102 F103 L136 Y139 E204 L205	M95-R99 WeakPolarHBondContact O-CD 3.34Å; M95-R99 VanDerWaalsContact O-CG 3.31Å; M95-R99 WeakPolarHBondContact O-CG 3.39Å; M95-R99 PolarHBondContact SD-NH2 3.03Å; W96-R99 WeakPolarHBondContact O-CB 3.38Å; W96-R99 PolarHBondContact O-N 2.91Å; W96-R99 VanDerWaalsContact O-N 3.13Å; L97-R99 PolarHBondContact O-N 2.87Å; L97-R99 VanDerWaalsContact O-N 3.17Å; R99-L101 VanDerWaalsContact C-N 3.33Å; R99-L101 PolarHBondContact O-N 3.32Å; R99-R102 PolarHBondContact O-N 3.18Å; R99-F103 PolarHBondContact O-N 2.92Å; R99-L136 HydrophobicContact CB-CD2 3.83Å; R99-Y139 HydrophobicContact CG-CD2 4.45Å; R99-Y139 HydrophobicContact CG-CE2 4.11Å; R99-Y139 VanDerWaalsContact CZ-CD1 3.46Å; R99-Y139 VanDerWaalsContact CZ-CZ 3.45Å; R99-Y139 VanDerWaalsContact NE-CE2 3.33Å; R99-E204 IonicContact CZ-OE1 2.63Å; R99-E204 IonicContact NE-OE1 3.7Å; R99-E204 PolarHBondContact NE-OE1 2.9Å; R99-E204 IonicContact NH2-OE1 2.95Å; R99-E204 PolarHBondContact NH2-OE1 3.42Å; R99-L205 PolarHBondContact NH2-O 3.21Å
100	G	96.2	Very high	97.9	Very high	7 Å²	7	10.4 Å²	10.4	7%	0.072	5%	0.05	C	C	.	.	H	α-helix	trans	-59.8	-41.1	172.1	0	0	0	0	0	112.8	W96 L97 F103 I104	W96-G100 PolarHBondContact O-N 3.5Å; W96-G100 VanDerWaalsContact O-N 3.08Å; L97-G100 PolarHBondContact O-N 3.44Å; L97-G100 VanDerWaalsContact O-N 3.07Å; G100-F103 WeakPolarHBondContact O-CB 3.32Å; G100-F103 PolarHBondContact O-N 3.46Å; G100-I104 PolarHBondContact O-N 3.47Å
101	L	97.1	Very high	97.9	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-65.3	-42.5	175.5	-62.9	177.2	0	0	0	112	F23 V27 L30 L97 R99 F103 I104 Q105 Y187 I191	F23-L101 HydrophobicContact CE2-CD1 4.26Å; F23-L101 HydrophobicContact CZ-CD1 3.81Å; V27-L101 HydrophobicContact CG1-CD1 4.14Å; V27-L101 HydrophobicContact CG1-CD2 4.19Å; L30-L101 HydrophobicContact CD1-CD2 3.39Å; L97-L101 HydrophobicContact CD1-CD1 4.38Å; L97-L101 HydrophobicContact CD1-CD2 4.33Å; L97-L101 HydrophobicContact CD1-CG 4.15Å; L97-L101 HydrophobicContact CG-CD1 4.03Å; L97-L101 HydrophobicContact CG-CG 4.23Å; L97-L101 VanDerWaalsContact O-CG 3.3Å; L97-L101 WeakPolarHBondContact O-CG 3.15Å; L97-L101 PolarHBondContact O-N 2.89Å; R99-L101 VanDerWaalsContact C-N 3.33Å; R99-L101 PolarHBondContact O-N 3.32Å; L101-F103 VanDerWaalsContact C-N 3.28Å; L101-F103 PolarHBondContact O-N 3.07Å; L101-I104 PolarHBondContact O-N 3.17Å; L101-Q105 PolarHBondContact O-N 2.98Å; L101-Y187 VanDerWaalsContact CA-OH 3.25Å; L101-Y187 WeakPolarHBondContact CA-OH 3.28Å; L101-Y187 WeakPolarHBondContact CB-OH 3.46Å; L101-Y187 HydrophobicContact CD2-CE2 4.26Å; L101-Y187 WeakPolarHBondContact CD2-OH 3.47Å; L101-Y187 WeakPolarHBondContact O-CE1 3.31Å; L101-Y187 PolarHBondContact O-OH 3.45Å; L101-Y187 VanDerWaalsContact O-OH 3.13Å; L101-I191 HydrophobicContact CB-CD1 3.77Å; L101-I191 HydrophobicContact CB-CG1 4.1Å
102	R	98	Very high	97.8	Very high	38 Å²	38	11 Å²	11	14%	0.143	5%	0.054	C	C	.	.	H	α-helix	trans	-61.1	-36.8	174.3	-176.6	65.1	67.8	172.5	8.7	112	K98 R99 Q105 V106 A135 I191 D192 Y195	K98-R102 WeakPolarHBondContact O-CB 3.35Å; K98-R102 PolarHBondContact O-N 3.39Å; R99-R102 PolarHBondContact O-N 3.18Å; R102-Q105 VanDerWaalsContact CZ-OE1 3.26Å; R102-Q105 WeakPolarHBondContact O-CB 3.46Å; R102-Q105 PolarHBondContact O-N 2.92Å; R102-V106 HydrophobicContact CG-CG2 4.27Å; R102-V106 WeakPolarHBondContact O-CG2 3.16Å; R102-V106 PolarHBondContact O-N 3.12Å; R102-A135 HydrophobicContact CB-CB 4.02Å; R102-A135 HydrophobicContact CG-CB 3.88Å; R102-I191 HydrophobicContact CB-CG2 4.32Å; R102-D192 IonicContact CZ-OD1 2.65Å; R102-D192 IonicContact NH1-OD1 2.71Å; R102-D192 PolarHBondContact NH1-OD1 3.08Å; R102-D192 IonicContact NH2-OD1 2.63Å; R102-D192 PolarHBondContact NH2-OD1 3.27Å; R102-Y195 HydrophobicContact CB-CE2 3.92Å; R102-Y195 VanDerWaalsContact CB-OH 3.29Å; R102-Y195 WeakPolarHBondContact CB-OH 3.46Å; R102-Y195 HydrophobicContact CG-CE2 4.37Å
103	F	97	Very high	97.8	Very high	8 Å²	8	13.4 Å²	13.4	4%	0.035	7%	0.067	C	C	.	.	H	α-helix	trans	-58.7	-50.8	173.5	173.2	-86.8	0	0	0	111	F34 R99 G100 L101 Q105 V106 F107 A131 A135 L136 F148	F34-F103 HydrophobicContact CE1-CE1 4.44Å; R99-F103 PolarHBondContact O-N 2.92Å; G100-F103 WeakPolarHBondContact O-CB 3.32Å; G100-F103 PolarHBondContact O-N 3.46Å; L101-F103 VanDerWaalsContact C-N 3.28Å; L101-F103 PolarHBondContact O-N 3.07Å; F103-Q105 VanDerWaalsContact C-N 3.31Å; F103-Q105 PolarHBondContact O-N 3.32Å; F103-V106 PolarHBondContact O-N 2.99Å; F103-F107 WeakPolarHBondContact O-CB 3.3Å; F103-F107 PolarHBondContact O-N 3.28Å; F103-A131 HydrophobicContact CD2-CB 3.54Å; F103-A131 HydrophobicContact CE2-CB 3.6Å; F103-A131 HydrophobicContact CG-CB 4.13Å; F103-A131 HydrophobicContact CZ-CB 4.23Å; F103-A131 WeakPolarHBondContact O-CB 3.47Å; F103-A135 HydrophobicContact CB-CB 3.99Å; F103-L136 HydrophobicContact CB-CD1 3.88Å; F103-L136 HydrophobicContact CB-CG 4.35Å; F103-L136 HydrophobicContact CD2-CD1 3.75Å; F103-L136 HydrophobicContact CG-CD1 3.94Å; F103-F148 AromaticContact CE2-CE2 3.92Å; F103-F148 HydrophobicContact CE2-CE2 3.92Å; F103-F148 HydrophobicContact CE2-CZ 4.12Å; F103-F148 HydrophobicContact CZ-CE2 4.2Å
104	I	95.7	Very high	97.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.2	-45.4	178.4	-64.1	169.2	0	0	0	110.5	F33 F34 I49 G100 L101 F107 L108 Y187	F33-I104 HydrophobicContact CD1-CD1 4.31Å; F33-I104 HydrophobicContact CD1-CG1 4.13Å; F33-I104 HydrophobicContact CE1-CG1 4.08Å; F33-I104 HydrophobicContact CE1-CG2 4.33Å; F33-I104 HydrophobicContact CE2-CG2 4.46Å; F33-I104 HydrophobicContact CZ-CG2 4.26Å; F34-I104 HydrophobicContact CE2-CD1 3.96Å; F34-I104 HydrophobicContact CE2-CG1 4.46Å; F34-I104 HydrophobicContact CZ-CD1 3.93Å; F34-I104 HydrophobicContact CZ-CG1 3.96Å; I49-I104 HydrophobicContact CD1-CD1 4.45Å; G100-I104 PolarHBondContact O-N 3.47Å; L101-I104 PolarHBondContact O-N 3.17Å; I104-F107 PolarHBondContact O-N 3.26Å; I104-L108 HydrophobicContact CG2-CD1 3.72Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.19Å; I104-L108 WeakPolarHBondContact O-CG 3.4Å; I104-L108 PolarHBondContact O-N 3.19Å; I104-Y187 HydrophobicContact CB-CE1 4.45Å; I104-Y187 HydrophobicContact CG2-CE1 4.34Å
105	Q	97.4	Very high	97.6	Very high	19 Å²	19	18.8 Å²	18.8	9%	0.089	10%	0.104	C	C	.	.	H	α-helix	trans	-56.3	-57	177.9	-174.7	-153.8	-28.5	0	0	111.6	L101 R102 F103 F107 L108 Q109 L184 Y187 T188 I191	L101-Q105 PolarHBondContact O-N 2.98Å; R102-Q105 VanDerWaalsContact CZ-OE1 3.26Å; R102-Q105 WeakPolarHBondContact O-CB 3.46Å; R102-Q105 PolarHBondContact O-N 2.92Å; F103-Q105 VanDerWaalsContact C-N 3.31Å; F103-Q105 PolarHBondContact O-N 3.32Å; Q105-F107 VanDerWaalsContact C-N 3.28Å; Q105-F107 PolarHBondContact O-N 2.97Å; Q105-L108 PolarHBondContact O-N 3.21Å; Q105-Q109 VanDerWaalsContact O-CB 3.25Å; Q105-Q109 WeakPolarHBondContact O-CB 3.28Å; Q105-Q109 PolarHBondContact O-N 3.42Å; Q105-L184 HydrophobicContact CB-CD2 4.47Å; Q105-L184 HydrophobicContact CG-CD2 4.02Å; Q105-Y187 HydrophobicContact CB-CD1 4.01Å; Q105-Y187 HydrophobicContact CB-CE1 3.76Å; Q105-Y187 HydrophobicContact CG-CD1 4.3Å; Q105-T188 WeakPolarHBondContact CG-OG1 3.36Å; Q105-T188 VanDerWaalsContact NE2-CG2 3.28Å; Q105-T188 PolarHBondContact NE2-OG1 2.99Å; Q105-I191 HydrophobicContact CB-CD1 4.15Å
106	V	98.4	Very high	97.6	Very high	10 Å²	10	25.1 Å²	25.1	6%	0.061	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-38	-174.9	174.9	0	0	0	0	110.7	R102 F103 S110 K130 A131 M134	R102-V106 HydrophobicContact CG-CG2 4.27Å; R102-V106 WeakPolarHBondContact O-CG2 3.16Å; R102-V106 PolarHBondContact O-N 3.12Å; F103-V106 PolarHBondContact O-N 2.99Å; V106-S110 WeakPolarHBondContact O-CB 3.49Å; V106-S110 PolarHBondContact O-N 3.45Å; V106-K130 HydrophobicContact CG1-CD 4.34Å; V106-K130 HydrophobicContact CG1-CG 3.96Å; V106-A131 HydrophobicContact CB-CB 4.04Å; V106-A131 HydrophobicContact CG1-CB 4.05Å; V106-M134 HydrophobicContact CG1-SD 3.65Å; V106-M134 HydrophobicContact CG2-CE 4.34Å; V106-M134 HydrophobicContact CG2-SD 4.39Å
107	F	97.6	Very high	97.5	Very high	3 Å²	3	26.4 Å²	26.4	1%	0.013	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-50.8	178.3	173	-113	0	0	0	111.7	F33 L37 F103 I104 Q105 S110 I111 I124 N127 A128 A131 F161	F33-F107 HydrophobicContact CE1-CD1 4.33Å; F33-F107 HydrophobicContact CE1-CE1 4.48Å; F33-F107 AromaticContact CZ-CD1 3.73Å; F33-F107 HydrophobicContact CZ-CD1 3.73Å; F33-F107 AromaticContact CZ-CE1 3.79Å; F33-F107 HydrophobicContact CZ-CE1 3.79Å; L37-F107 HydrophobicContact CD2-CZ 4.41Å; F103-F107 WeakPolarHBondContact O-CB 3.3Å; F103-F107 PolarHBondContact O-N 3.28Å; I104-F107 PolarHBondContact O-N 3.26Å; Q105-F107 VanDerWaalsContact C-N 3.28Å; Q105-F107 PolarHBondContact O-N 2.97Å; F107-S110 PolarHBondContact O-N 3.42Å; F107-I111 HydrophobicContact CD1-CD1 4.34Å; F107-I111 HydrophobicContact CD2-CD1 4.36Å; F107-I111 HydrophobicContact CE1-CD1 3.78Å; F107-I111 HydrophobicContact CE2-CD1 3.79Å; F107-I111 HydrophobicContact CZ-CD1 3.47Å; F107-I111 VanDerWaalsContact CZ-CD1 3.47Å; F107-I111 WeakPolarHBondContact O-CG1 3.43Å; F107-I111 PolarHBondContact O-N 3.07Å; F107-I111 VanDerWaalsContact O-N 3.16Å; F107-I124 HydrophobicContact CE2-CB 4.14Å; F107-I124 HydrophobicContact CE2-CD1 4.17Å; F107-I124 HydrophobicContact CZ-CB 4.31Å; F107-I124 HydrophobicContact CZ-CD1 3.69Å; F107-I124 HydrophobicContact CZ-CG1 4.48Å; F107-N127 HydrophobicContact CD2-CB 3.73Å; F107-N127 HydrophobicContact CE2-CB 3.83Å; F107-A128 HydrophobicContact CD2-CB 4.08Å; F107-A128 HydrophobicContact CE2-CB 3.98Å; F107-A131 HydrophobicContact CB-CB 3.65Å; F107-F161 HydrophobicContact CD1-CZ 4.47Å; F107-F161 AromaticContact CE1-CE1 3.88Å; F107-F161 HydrophobicContact CE1-CE1 3.88Å; F107-F161 HydrophobicContact CE1-CE2 4Å; F107-F161 AromaticContact CE1-CZ 3.48Å; F107-F161 HydrophobicContact CE1-CZ 3.48Å; F107-F161 VanDerWaalsContact CE1-CZ 3.48Å; F107-F161 HydrophobicContact CZ-CE1 4.23Å; F107-F161 HydrophobicContact CZ-CZ 4.16Å
108	L	97.1	Very high	97.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-42.1	179.1	-73.5	178.3	0	0	0	112.1	L4 F33 I104 Q105 S110 I111 C112 F161 L165 I180 F183 L184	L4-L108 HydrophobicContact CD1-CD1 3.77Å; L4-L108 HydrophobicContact CD1-CD2 4.44Å; F33-L108 HydrophobicContact CE2-CD1 4.2Å; F33-L108 HydrophobicContact CE2-CD2 3.94Å; F33-L108 HydrophobicContact CE2-CG 4.26Å; F33-L108 HydrophobicContact CZ-CD2 4.21Å; F33-L108 HydrophobicContact CZ-CG 4.34Å; I104-L108 HydrophobicContact CG2-CD1 3.72Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.19Å; I104-L108 WeakPolarHBondContact O-CG 3.4Å; I104-L108 PolarHBondContact O-N 3.19Å; Q105-L108 PolarHBondContact O-N 3.21Å; L108-S110 PolarHBondContact O-N 2.85Å; L108-I111 PolarHBondContact O-N 3.07Å; L108-C112 PolarHBondContact O-N 3.14Å; L108-F161 HydrophobicContact CD2-CE1 4.21Å; L108-F161 HydrophobicContact CD2-CZ 4.04Å; L108-L165 HydrophobicContact CD2-CD1 4.44Å; L108-I180 HydrophobicContact CB-CG2 3.74Å; L108-I180 HydrophobicContact CD1-CG2 4.23Å; L108-I180 HydrophobicContact CD2-CD1 4.24Å; L108-I180 HydrophobicContact CD2-CG1 4.49Å; L108-I180 HydrophobicContact CD2-CG2 3.99Å; L108-I180 HydrophobicContact CG-CG2 4.21Å; L108-F183 HydrophobicContact CD1-CD1 4.02Å; L108-F183 HydrophobicContact CD1-CE1 3.72Å; L108-L184 HydrophobicContact CB-CD1 4.06Å; L108-L184 HydrophobicContact CB-CD2 4.12Å; L108-L184 HydrophobicContact CB-CG 4.41Å
109	Q	98.4	Very high	97.4	Very high	65 Å²	65	39.1 Å²	39.1	30%	0.304	20%	0.2	S	C	.	.	H	α-helix	trans	-60.1	-47.1	176.5	-173.7	64.8	61	0	0	110.9	Q105 I111 C112 D113 L184	Q105-Q109 VanDerWaalsContact O-CB 3.25Å; Q105-Q109 WeakPolarHBondContact O-CB 3.28Å; Q105-Q109 PolarHBondContact O-N 3.42Å; Q109-I111 VanDerWaalsContact C-N 3.25Å; Q109-I111 PolarHBondContact O-N 3.39Å; Q109-C112 CarbonylContact O-C 3.23Å; Q109-C112 PolarHBondContact O-N 3.01Å; Q109-D113 PolarHBondContact NE2-OD1 2.99Å; Q109-D113 WeakPolarHBondContact O-CB 3.26Å; Q109-D113 PolarHBondContact O-N 3.38Å; Q109-L184 HydrophobicContact CB-CD1 4.11Å
110	S	98.5	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-37.4	177	178.6	0	0	0	0	112.4	V106 F107 L108 G114 E115 N127	V106-S110 WeakPolarHBondContact O-CB 3.49Å; V106-S110 PolarHBondContact O-N 3.45Å; F107-S110 PolarHBondContact O-N 3.42Å; L108-S110 PolarHBondContact O-N 2.85Å; S110-G114 PolarHBondContact O-N 2.85Å; S110-E115 WeakPolarHBondContact CB-OE2 3.39Å; S110-E115 WeakPolarHBondContact O-CB 3.43Å; S110-E115 PolarHBondContact O-N 2.97Å; S110-E115 PolarHBondContact OG-OE2 3.4Å; S110-N127 VanDerWaalsContact C-ND2 3.26Å; S110-N127 PolarHBondContact O-ND2 2.68Å; S110-N127 WeakPolarHBondContact OG-CA 3.43Å; S110-N127 WeakPolarHBondContact OG-CB 3.37Å; S110-N127 PolarHBondContact OG-ND2 3.47Å
111	I	97.7	Very high	97.2	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-67.3	-44.7	174.1	-71.2	172.1	0	0	0	111.4	F107 L108 Q109 D113 G114 I124 N127 F161 L177	F107-I111 HydrophobicContact CD1-CD1 4.34Å; F107-I111 HydrophobicContact CD2-CD1 4.36Å; F107-I111 HydrophobicContact CE1-CD1 3.78Å; F107-I111 HydrophobicContact CE2-CD1 3.79Å; F107-I111 HydrophobicContact CZ-CD1 3.47Å; F107-I111 VanDerWaalsContact CZ-CD1 3.47Å; F107-I111 WeakPolarHBondContact O-CG1 3.43Å; F107-I111 PolarHBondContact O-N 3.07Å; F107-I111 VanDerWaalsContact O-N 3.16Å; L108-I111 PolarHBondContact O-N 3.07Å; Q109-I111 VanDerWaalsContact C-N 3.25Å; Q109-I111 PolarHBondContact O-N 3.39Å; I111-D113 VanDerWaalsContact C-N 3.3Å; I111-D113 PolarHBondContact O-N 3.36Å; I111-G114 PolarHBondContact O-N 3.06Å; I111-I124 HydrophobicContact CD1-CG2 4.17Å; I111-N127 HydrophobicContact CG1-CB 3.89Å; I111-N127 PolarHBondContact N-ND2 2.74Å; I111-F161 HydrophobicContact CD1-CD1 4.08Å; I111-F161 HydrophobicContact CD1-CE1 3.7Å; I111-L177 HydrophobicContact CG2-CD2 3.68Å
112	C	97.7	Very high	97.1	Very high	12 Å²	12	50.9 Å²	50.9	8%	0.081	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-30.7	178.6	-74.4	0	0	0	0	113.3	L108 Q109 G114 I180 R181	L108-C112 PolarHBondContact O-N 3.14Å; Q109-C112 CarbonylContact O-C 3.23Å; Q109-C112 PolarHBondContact O-N 3.01Å; C112-G114 PolarHBondContact O-N 3.1Å; C112-I180 WeakPolarHBondContact SG-CG2 3.29Å; C112-R181 HydrophobicContact CB-CG 4.07Å
113	D	97.9	Very high	97	Very high	90 Å²	90	50.2 Å²	50.2	48%	0.481	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-6.5	176.6	-64.8	-15.3	0	0	0	112.4	Q109 I111 E115	Q109-D113 PolarHBondContact NE2-OD1 2.99Å; Q109-D113 WeakPolarHBondContact O-CB 3.26Å; Q109-D113 PolarHBondContact O-N 3.38Å; I111-D113 VanDerWaalsContact C-N 3.3Å; I111-D113 PolarHBondContact O-N 3.36Å; D113-E115 VanDerWaalsContact C-N 3.3Å; D113-E115 HydrophobicContact CB-CG 4.25Å; D113-E115 PolarHBondContact O-N 3.27Å
114	G	96.5	Very high	97	Very high	44 Å²	44	49.9 Å²	49.9	45%	0.454	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	13.5	179.1	0	0	0	0	0	114.3	S110 I111 C112 R116	S110-G114 PolarHBondContact O-N 2.85Å; I111-G114 PolarHBondContact O-N 3.06Å; C112-G114 PolarHBondContact O-N 3.1Å; G114-R116 PolarHBondContact O-N 3.3Å
115	E	98	Very high	97	Very high	71 Å²	71	53.9 Å²	53.9	33%	0.332	27%	0.273	S	S	.	.			trans	-64.5	128.2	176.9	-62.9	-179.9	170	0	0	110.4	S110 D113 N127 K130	S110-E115 WeakPolarHBondContact CB-OE2 3.39Å; S110-E115 WeakPolarHBondContact O-CB 3.43Å; S110-E115 PolarHBondContact O-N 2.97Å; S110-E115 PolarHBondContact OG-OE2 3.4Å; D113-E115 VanDerWaalsContact C-N 3.3Å; D113-E115 HydrophobicContact CB-CG 4.25Å; D113-E115 PolarHBondContact O-N 3.27Å; E115-N127 PolarHBondContact O-ND2 2.9Å; E115-K130 IonicContact OE1-NZ 2.75Å; E115-K130 PolarHBondContact OE1-NZ 2.99Å; E115-K130 WeakPolarHBondContact OE2-CD 3.47Å; E115-K130 IonicContact OE2-NZ 3.39Å; E115-K130 PolarHBondContact OE2-NZ 3.48Å
116	R	97.1	Very high	97	Very high	134 Å²	134	55.7 Å²	55.7	51%	0.506	29%	0.285	S	S	.	.			trans	-155.6	163.2	-176.2	66.1	-170	-173	-176.6	3	111.8	G114 E118	G114-R116 PolarHBondContact O-N 3.3Å; R116-E118 WeakPolarHBondContact CG-OE1 3.29Å; R116-E118 IonicContact CZ-OE1 3.25Å; R116-E118 IonicContact CZ-OE2 2.95Å; R116-E118 IonicContact NE-OE1 2.76Å; R116-E118 PolarHBondContact NE-OE1 2.95Å; R116-E118 IonicContact NE-OE2 3.92Å; R116-E118 IonicContact NH2-OE1 2.65Å; R116-E118 IonicContact NH2-OE2 3.48Å; R116-E118 PolarHBondContact NH2-OE2 3.48Å
117	D	96.4	Very high	97	Very high	50 Å²	50	55.5 Å²	55.5	27%	0.267	28%	0.284	S	S	.	.			trans	-80.5	117.3	165.5	177.1	-0.5	0	0	0	108.5	N119 H120 P121 V126	D117-N119 PolarHBondContact O-N 3.21Å; D117-N119 WeakPolarHBondContact OD1-CB 3.41Å; D117-N119 PolarHBondContact OD1-N 2.89Å; D117-N119 PolarHBondContact OD1-ND2 3.33Å; D117-H120 HydrophobicContact CB-CB 4.39Å; D117-H120 CarbonylContact O-C 3.53Å; D117-H120 PolarHBondContact O-N 3.36Å; D117-H120 IonicContact OD2-CG 3.66Å; D117-H120 IonicContact OD2-ND1 2.67Å; D117-H120 PolarHBondContact OD2-ND1 2.65Å; D117-P121 WeakPolarHBondContact O-CA 3.27Å; D117-V126 HydrophobicContact CB-CG2 3.81Å
118	E	96.4	Very high	96.9	Very high	130 Å²	130	55.8 Å²	55.8	61%	0.607	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.8	179.9	-66.2	-57.8	131.3	0	0	113.3	R116	R116-E118 WeakPolarHBondContact CG-OE1 3.29Å; R116-E118 IonicContact CZ-OE1 3.25Å; R116-E118 IonicContact CZ-OE2 2.95Å; R116-E118 IonicContact NE-OE1 2.76Å; R116-E118 PolarHBondContact NE-OE1 2.95Å; R116-E118 IonicContact NE-OE2 3.92Å; R116-E118 IonicContact NH2-OE1 2.65Å; R116-E118 IonicContact NH2-OE2 3.48Å; R116-E118 PolarHBondContact NH2-OE2 3.48Å
119	N	97.7	Very high	96.9	Very high	136 Å²	136	58 Å²	58	73%	0.727	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-23.8	174.3	-58.6	-62.9	0	0	0	112.6	D117	D117-N119 PolarHBondContact O-N 3.21Å; D117-N119 WeakPolarHBondContact OD1-CB 3.41Å; D117-N119 PolarHBondContact OD1-N 2.89Å; D117-N119 PolarHBondContact OD1-ND2 3.33Å
120	H	95.8	Very high	96.9	Very high	105 Å²	105	57.6 Å²	57.6	49%	0.486	30%	0.297	S	S	.	.	S	Bend	trans	-138.9	63.3	-179.4	-53.4	96.6	0	0	0	111.1	D117 N122 L123	D117-H120 HydrophobicContact CB-CB 4.39Å; D117-H120 CarbonylContact O-C 3.53Å; D117-H120 PolarHBondContact O-N 3.36Å; D117-H120 IonicContact OD2-CG 3.66Å; D117-H120 IonicContact OD2-ND1 2.67Å; D117-H120 PolarHBondContact OD2-ND1 2.65Å; H120-N122 PolarHBondContact O-N 2.75Å; H120-L123 HydrophobicContact CB-CB 4.33Å; H120-L123 HydrophobicContact CB-CD1 3.58Å; H120-L123 HydrophobicContact CB-CG 3.91Å; H120-L123 PolarHBondContact O-N 2.67Å
121	P	94.6	Very high	96.9	Very high	51 Å²	51	57.6 Å²	57.6	33%	0.331	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-17	-166.7	24.7	-35.9	0	0	0	114.1	D117	D117-P121 WeakPolarHBondContact O-CA 3.27Å
122	N	95.1	Very high	96.8	Very high	99 Å²	99	58 Å²	58	53%	0.529	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-10.6	178.2	-62.1	-37.5	0	0	0	113.2	H120 Y157 K158	H120-N122 PolarHBondContact O-N 2.75Å; N122-Y157 HydrophobicContact CB-CD1 3.69Å; N122-Y157 HydrophobicContact CB-CE1 4.27Å; N122-Y157 HydrophobicContact CB-CG 4.5Å; N122-Y157 CarbonylContact O-C 3.6Å; N122-Y157 WeakPolarHBondContact O-CA 3.46Å; N122-K158 PolarHBondContact O-N 3.44Å
123	L	96.6	Very high	96.9	Very high	24 Å²	24	62.1 Å²	62.1	13%	0.126	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-87.9	129.8	179.4	-64.4	-178.8	0	0	0	111.1	H120 R125 Y157	H120-L123 HydrophobicContact CB-CB 4.33Å; H120-L123 HydrophobicContact CB-CD1 3.58Å; H120-L123 HydrophobicContact CB-CG 3.91Å; H120-L123 PolarHBondContact O-N 2.67Å; L123-R125 HydrophobicContact CB-CG 4.29Å; L123-R125 PolarHBondContact O-N 2.91Å; L123-Y157 HydrophobicContact CD2-CD1 3.74Å; L123-Y157 HydrophobicContact CD2-CE1 3.54Å; L123-Y157 HydrophobicContact CG-CE1 4.37Å
124	I	96.3	Very high	96.9	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.01	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	15.7	175.3	56	167.7	0	0	0	113.5	L37 F107 I111 V126 N127 A128 A155 P156 K158 F161	L37-I124 HydrophobicContact CD2-CD1 4.01Å; F107-I124 HydrophobicContact CE2-CB 4.14Å; F107-I124 HydrophobicContact CE2-CD1 4.17Å; F107-I124 HydrophobicContact CZ-CB 4.31Å; F107-I124 HydrophobicContact CZ-CD1 3.69Å; F107-I124 HydrophobicContact CZ-CG1 4.48Å; I111-I124 HydrophobicContact CD1-CG2 4.17Å; I124-V126 PolarHBondContact O-N 3.35Å; I124-N127 WeakPolarHBondContact CA-OD1 3.35Å; I124-N127 PolarHBondContact O-N 3.37Å; I124-A128 WeakPolarHBondContact O-CB 3.5Å; I124-A128 PolarHBondContact O-N 3.41Å; I124-A155 HydrophobicContact CD1-CB 4.27Å; I124-A155 HydrophobicContact CG1-CB 4.19Å; I124-P156 HydrophobicContact CD1-CG 4.07Å; I124-P156 WeakPolarHBondContact CG1-O 3.43Å; I124-K158 HydrophobicContact CG2-CB 3.76Å; I124-K158 HydrophobicContact CG2-CG 4.15Å; I124-F161 HydrophobicContact CD1-CB 4.36Å; I124-F161 HydrophobicContact CD1-CG 4.37Å
125	R	95.9	Very high	96.9	Very high	84 Å²	84	61.3 Å²	61.3	32%	0.317	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-38.1	-174.6	-69.7	-177.1	-177.6	159.1	4.4	112.3	L123 A128 T129 L152 Y153	L123-R125 HydrophobicContact CB-CG 4.29Å; L123-R125 PolarHBondContact O-N 2.91Å; R125-A128 PolarHBondContact O-N 3.43Å; R125-T129 VanDerWaalsContact O-CB 3.24Å; R125-T129 WeakPolarHBondContact O-CB 3.35Å; R125-T129 PolarHBondContact O-N 3.14Å; R125-T129 PolarHBondContact O-OG1 3.09Å; R125-L152 WeakPolarHBondContact CG-O 3.25Å; R125-L152 PolarHBondContact NE-O 2.95Å; R125-Y153 PolarHBondContact NH2-O 3.11Å
126	V	97.2	Very high	96.8	Very high	57 Å²	57	58.9 Å²	58.9	35%	0.345	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-46.4	177.1	175.3	0	0	0	0	109.9	D117 I124 T129 K130	D117-V126 HydrophobicContact CB-CG2 3.81Å; I124-V126 PolarHBondContact O-N 3.35Å; V126-T129 PolarHBondContact O-N 3.02Å; V126-K130 WeakPolarHBondContact O-CB 3.24Å; V126-K130 PolarHBondContact O-N 2.69Å
127	N	98	Very high	96.8	Very high	6 Å²	6	56.3 Å²	56.3	3%	0.032	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-46.5	179.5	-41.8	92.5	0	0	0	111.2	F107 S110 I111 E115 I124 T129 K130 A131	F107-N127 HydrophobicContact CD2-CB 3.73Å; F107-N127 HydrophobicContact CE2-CB 3.83Å; S110-N127 VanDerWaalsContact C-ND2 3.26Å; S110-N127 PolarHBondContact O-ND2 2.68Å; S110-N127 WeakPolarHBondContact OG-CA 3.43Å; S110-N127 WeakPolarHBondContact OG-CB 3.37Å; S110-N127 PolarHBondContact OG-ND2 3.47Å; I111-N127 HydrophobicContact CG1-CB 3.89Å; I111-N127 PolarHBondContact N-ND2 2.74Å; E115-N127 PolarHBondContact O-ND2 2.9Å; I124-N127 WeakPolarHBondContact CA-OD1 3.35Å; I124-N127 PolarHBondContact O-N 3.37Å; N127-T129 VanDerWaalsContact C-N 3.35Å; N127-T129 PolarHBondContact O-N 3.38Å; N127-K130 PolarHBondContact O-N 2.86Å; N127-A131 WeakPolarHBondContact O-CB 3.48Å; N127-A131 PolarHBondContact O-N 3.38Å
128	A	96.4	Very high	96.8	Very high	9 Å²	9	59.6 Å²	59.6	7%	0.074	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-38.3	179.1	0	0	0	0	0	111.8	F107 I124 R125 Y132 F148 L152	F107-A128 HydrophobicContact CD2-CB 4.08Å; F107-A128 HydrophobicContact CE2-CB 3.98Å; I124-A128 WeakPolarHBondContact O-CB 3.5Å; I124-A128 PolarHBondContact O-N 3.41Å; R125-A128 PolarHBondContact O-N 3.43Å; A128-Y132 WeakPolarHBondContact O-CB 3.43Å; A128-Y132 PolarHBondContact O-N 3.42Å; A128-F148 WeakPolarHBondContact O-CZ 3.19Å; A128-L152 HydrophobicContact CB-CD2 3.52Å
129	T	97.4	Very high	96.8	Very high	45 Å²	45	53.7 Å²	53.7	28%	0.276	27%	0.266	S	S	.	.	H	α-helix	trans	-63.2	-51.3	175.3	-59.1	0	0	0	0	110.4	R125 V126 N127 A131 Y132 E133 L152	R125-T129 VanDerWaalsContact O-CB 3.24Å; R125-T129 WeakPolarHBondContact O-CB 3.35Å; R125-T129 PolarHBondContact O-N 3.14Å; R125-T129 PolarHBondContact O-OG1 3.09Å; V126-T129 PolarHBondContact O-N 3.02Å; N127-T129 VanDerWaalsContact C-N 3.35Å; N127-T129 PolarHBondContact O-N 3.38Å; T129-A131 VanDerWaalsContact C-N 3.33Å; T129-A131 PolarHBondContact O-N 2.92Å; T129-Y132 WeakPolarHBondContact O-CB 3.5Å; T129-Y132 PolarHBondContact O-N 3.49Å; T129-Y132 VanDerWaalsContact O-N 3.11Å; T129-E133 HydrophobicContact CG2-CG 4.27Å; T129-E133 WeakPolarHBondContact O-CG 3.2Å; T129-E133 PolarHBondContact O-N 3.19Å; T129-L152 WeakPolarHBondContact OG1-CD1 3.47Å
130	K	98.3	Very high	96.7	Very high	57 Å²	57	48.5 Å²	48.5	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-53.7	-49.8	177	178.8	-179.2	175.1	-174.4	0	111.6	V106 E115 V126 N127 Y132 E133 M134	V106-K130 HydrophobicContact CG1-CD 4.34Å; V106-K130 HydrophobicContact CG1-CG 3.96Å; E115-K130 IonicContact OE1-NZ 2.75Å; E115-K130 PolarHBondContact OE1-NZ 2.99Å; E115-K130 WeakPolarHBondContact OE2-CD 3.47Å; E115-K130 IonicContact OE2-NZ 3.39Å; E115-K130 PolarHBondContact OE2-NZ 3.48Å; V126-K130 WeakPolarHBondContact O-CB 3.24Å; V126-K130 PolarHBondContact O-N 2.69Å; N127-K130 PolarHBondContact O-N 2.86Å; K130-Y132 VanDerWaalsContact C-N 3.31Å; K130-Y132 PolarHBondContact O-N 3.49Å; K130-E133 PolarHBondContact O-N 2.94Å; K130-M134 HydrophobicContact CG-SD 3.85Å; K130-M134 WeakPolarHBondContact O-CB 3.44Å; K130-M134 WeakPolarHBondContact O-CG 3.5Å; K130-M134 PolarHBondContact O-N 3.36Å
131	A	97.8	Very high	96.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.3	-43	178.1	0	0	0	0	0	112.8	F103 V106 F107 N127 T129 A135	F103-A131 HydrophobicContact CD2-CB 3.54Å; F103-A131 HydrophobicContact CE2-CB 3.6Å; F103-A131 HydrophobicContact CG-CB 4.13Å; F103-A131 HydrophobicContact CZ-CB 4.23Å; F103-A131 WeakPolarHBondContact O-CB 3.47Å; V106-A131 HydrophobicContact CB-CB 4.04Å; V106-A131 HydrophobicContact CG1-CB 4.05Å; F107-A131 HydrophobicContact CB-CB 3.65Å; N127-A131 WeakPolarHBondContact O-CB 3.48Å; N127-A131 PolarHBondContact O-N 3.38Å; T129-A131 VanDerWaalsContact C-N 3.33Å; T129-A131 PolarHBondContact O-N 2.92Å; A131-A135 VanDerWaalsContact O-CB 3.22Å; A131-A135 WeakPolarHBondContact O-CB 3.49Å; A131-A135 PolarHBondContact O-N 3.37Å
132	Y	96.9	Very high	96.9	Very high	11 Å²	11	51 Å²	51	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-46.3	177.9	-177.6	-114.8	0	0	0	112.7	A128 T129 K130 M134 A135 L136 K137 H140 Q145 F148	A128-Y132 WeakPolarHBondContact O-CB 3.43Å; A128-Y132 PolarHBondContact O-N 3.42Å; T129-Y132 WeakPolarHBondContact O-CB 3.5Å; T129-Y132 PolarHBondContact O-N 3.49Å; T129-Y132 VanDerWaalsContact O-N 3.11Å; K130-Y132 VanDerWaalsContact C-N 3.31Å; K130-Y132 PolarHBondContact O-N 3.49Å; Y132-M134 VanDerWaalsContact C-N 3.33Å; Y132-M134 PolarHBondContact O-N 3.28Å; Y132-A135 PolarHBondContact O-N 3.38Å; Y132-L136 HydrophobicContact CD2-CB 3.63Å; Y132-L136 HydrophobicContact CD2-CD1 4.14Å; Y132-L136 HydrophobicContact CE2-CB 3.68Å; Y132-L136 PolarHBondContact O-N 2.96Å; Y132-K137 HydrophobicContact CD1-CB 3.86Å; Y132-K137 HydrophobicContact CD1-CD 4.37Å; Y132-K137 HydrophobicContact CD1-CG 4.28Å; Y132-K137 HydrophobicContact CE1-CB 3.62Å; Y132-K137 HydrophobicContact CE1-CD 4.23Å; Y132-K137 HydrophobicContact CE1-CG 3.78Å; Y132-K137 HydrophobicContact CG-CB 4.48Å; Y132-K137 WeakPolarHBondContact O-CB 3.47Å; Y132-K137 PolarHBondContact O-N 2.96Å; Y132-H140 AromaticContact CE2-ND1 3.4Å; Y132-H140 WeakPolarHBondContact CE2-ND1 3.34Å; Y132-H140 AromaticContact CZ-ND1 3.79Å; Y132-H140 VanDerWaalsContact OH-CB 3.27Å; Y132-H140 WeakPolarHBondContact OH-CB 3.4Å; Y132-H140 PolarHBondContact OH-ND1 3.2Å; Y132-Q145 VanDerWaalsContact OH-CG 3.25Å; Y132-Q145 WeakPolarHBondContact OH-CG 3.16Å; Y132-F148 AromaticContact CD1-CD1 3.37Å; Y132-F148 HydrophobicContact CD1-CD1 3.37Å; Y132-F148 AromaticContact CD1-CE1 3.49Å; Y132-F148 HydrophobicContact CD1-CE1 3.49Å; Y132-F148 VanDerWaalsContact CD1-CE1 3.49Å; Y132-F148 AromaticContact CD1-CG 3.99Å; Y132-F148 HydrophobicContact CD1-CG 3.99Å; Y132-F148 HydrophobicContact CD1-CZ 4.21Å; Y132-F148 AromaticContact CD2-CD1 3.86Å; Y132-F148 HydrophobicContact CD2-CD1 3.86Å; Y132-F148 AromaticContact CD2-CD2 3.57Å; Y132-F148 HydrophobicContact CD2-CD2 3.57Å; Y132-F148 AromaticContact CD2-CE1 3.95Å; Y132-F148 HydrophobicContact CD2-CE1 3.95Å; Y132-F148 AromaticContact CD2-CE2 3.69Å; Y132-F148 HydrophobicContact CD2-CE2 3.69Å; Y132-F148 AromaticContact CD2-CG 3.68Å; Y132-F148 HydrophobicContact CD2-CG 3.68Å; Y132-F148 AromaticContact CD2-CZ 3.91Å; Y132-F148 HydrophobicContact CD2-CZ 3.91Å; Y132-F148 HydrophobicContact CE1-CB 4.32Å; Y132-F148 AromaticContact CE1-CD1 3.67Å; Y132-F148 HydrophobicContact CE1-CD1 3.67Å; Y132-F148 HydrophobicContact CE1-CE1 4.26Å; Y132-F148 HydrophobicContact CE1-CG 4.01Å; Y132-F148 HydrophobicContact CE2-CB 4.09Å; Y132-F148 HydrophobicContact CE2-CD1 4.16Å; Y132-F148 AromaticContact CE2-CD2 3.9Å; Y132-F148 HydrophobicContact CE2-CD2 3.9Å; Y132-F148 HydrophobicContact CE2-CE2 4.46Å; Y132-F148 AromaticContact CE2-CG 3.75Å; Y132-F148 HydrophobicContact CE2-CG 3.75Å; Y132-F148 AromaticContact CG-CD1 3.48Å; Y132-F148 HydrophobicContact CG-CD1 3.48Å; Y132-F148 VanDerWaalsContact CG-CD1 3.48Å; Y132-F148 AromaticContact CG-CD2 3.98Å; Y132-F148 HydrophobicContact CG-CD2 3.98Å; Y132-F148 AromaticContact CG-CE1 3.31Å; Y132-F148 HydrophobicContact CG-CE1 3.31Å; Y132-F148 AromaticContact CG-CE2 3.84Å; Y132-F148 HydrophobicContact CG-CE2 3.84Å; Y132-F148 AromaticContact CG-CG 3.83Å; Y132-F148 HydrophobicContact CG-CG 3.83Å; Y132-F148 AromaticContact CG-CZ 3.54Å; Y132-F148 HydrophobicContact CG-CZ 3.54Å; Y132-F148 AromaticContact CZ-CG 3.91Å
133	E	97.9	Very high	96.8	Very high	100 Å²	100	51.8 Å²	51.8	47%	0.467	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-41.3	-179.8	-67	-162.8	141.4	0	0	112.1	T129 K130 K137	T129-E133 HydrophobicContact CG2-CG 4.27Å; T129-E133 WeakPolarHBondContact O-CG 3.2Å; T129-E133 PolarHBondContact O-N 3.19Å; K130-E133 PolarHBondContact O-N 2.94Å; E133-K137 HydrophobicContact CB-CD 4.43Å; E133-K137 HydrophobicContact CG-CD 3.78Å; E133-K137 IonicContact OE1-NZ 3.43Å; E133-K137 PolarHBondContact OE1-NZ 3.13Å
134	M	98	Very high	96.7	Very high	116 Å²	116	52.6 Å²	52.6	57%	0.571	25%	0.25	S	S	*	.	H	α-helix	trans	-75	-37.8	-179.3	-67.4	-179.1	68	0	0	113.1	V106 K130 Y132	V106-M134 HydrophobicContact CG1-SD 3.65Å; V106-M134 HydrophobicContact CG2-CE 4.34Å; V106-M134 HydrophobicContact CG2-SD 4.39Å; K130-M134 HydrophobicContact CG-SD 3.85Å; K130-M134 WeakPolarHBondContact O-CB 3.44Å; K130-M134 WeakPolarHBondContact O-CG 3.5Å; K130-M134 PolarHBondContact O-N 3.36Å; Y132-M134 VanDerWaalsContact C-N 3.33Å; Y132-M134 PolarHBondContact O-N 3.28Å
135	A	97	Very high	96.6	Very high	1 Å²	1	55 Å²	55	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-104.1	-32.4	-168.6	0	0	0	0	0	115	R102 F103 A131 Y132	R102-A135 HydrophobicContact CB-CB 4.02Å; R102-A135 HydrophobicContact CG-CB 3.88Å; F103-A135 HydrophobicContact CB-CB 3.99Å; A131-A135 VanDerWaalsContact O-CB 3.22Å; A131-A135 WeakPolarHBondContact O-CB 3.49Å; A131-A135 PolarHBondContact O-N 3.37Å; Y132-A135 PolarHBondContact O-N 3.38Å
136	L	96.2	Very high	96.5	Very high	19 Å²	19	55.8 Å²	55.8	10%	0.099	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-38.4	-161.7	-67	172.7	0	0	0	114.8	R99 F103 Y132 K138 Y139 H140	R99-L136 HydrophobicContact CB-CD2 3.83Å; F103-L136 HydrophobicContact CB-CD1 3.88Å; F103-L136 HydrophobicContact CB-CG 4.35Å; F103-L136 HydrophobicContact CD2-CD1 3.75Å; F103-L136 HydrophobicContact CG-CD1 3.94Å; Y132-L136 HydrophobicContact CD2-CB 3.63Å; Y132-L136 HydrophobicContact CD2-CD1 4.14Å; Y132-L136 HydrophobicContact CE2-CB 3.68Å; Y132-L136 PolarHBondContact O-N 2.96Å; L136-K138 VanDerWaalsContact C-N 3.28Å; L136-K138 PolarHBondContact O-N 3.07Å; L136-K138 VanDerWaalsContact O-N 3.09Å; L136-Y139 PolarHBondContact O-N 3.34Å; L136-H140 PolarHBondContact O-N 3.04Å
137	K	97.1	Very high	96.2	Very high	80 Å²	80	57 Å²	57	35%	0.348	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-51.8	-41.6	-167.7	-177.3	173.7	177.8	-173.3	0	114	Y132 E133 Y139 H140	Y132-K137 HydrophobicContact CD1-CB 3.86Å; Y132-K137 HydrophobicContact CD1-CD 4.37Å; Y132-K137 HydrophobicContact CD1-CG 4.28Å; Y132-K137 HydrophobicContact CE1-CB 3.62Å; Y132-K137 HydrophobicContact CE1-CD 4.23Å; Y132-K137 HydrophobicContact CE1-CG 3.78Å; Y132-K137 HydrophobicContact CG-CB 4.48Å; Y132-K137 WeakPolarHBondContact O-CB 3.47Å; Y132-K137 PolarHBondContact O-N 2.96Å; E133-K137 HydrophobicContact CB-CD 4.43Å; E133-K137 HydrophobicContact CG-CD 3.78Å; E133-K137 IonicContact OE1-NZ 3.43Å; E133-K137 PolarHBondContact OE1-NZ 3.13Å; K137-Y139 PolarHBondContact O-N 3.06Å; K137-H140 PolarHBondContact O-N 3.43Å
138	K	97.2	Very high	95.9	Very high	120 Å²	120	57.4 Å²	57.4	52%	0.522	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-64	-22	179.9	58.8	167.4	160.5	160.9	0	114.1	L136 K208	L136-K138 VanDerWaalsContact C-N 3.28Å; L136-K138 PolarHBondContact O-N 3.07Å; L136-K138 VanDerWaalsContact O-N 3.09Å; K138-K208 WeakPolarHBondContact O-CE 3.42Å; K138-K208 WeakPolarHBondContact O-CG 3.17Å
139	Y	96.5	Very high	95.8	Very high	5 Å²	5	61.2 Å²	61.2	2%	0.02	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-100.9	0.4	-178.3	-49.2	-68.7	0	0	0	113.4	W96 R99 L136 K137 E204 K208 V209	W96-Y139 HydrophobicContact CZ3-CG 4.49Å; R99-Y139 HydrophobicContact CG-CD2 4.45Å; R99-Y139 HydrophobicContact CG-CE2 4.11Å; R99-Y139 VanDerWaalsContact CZ-CD1 3.46Å; R99-Y139 VanDerWaalsContact CZ-CZ 3.45Å; R99-Y139 VanDerWaalsContact NE-CE2 3.33Å; L136-Y139 PolarHBondContact O-N 3.34Å; K137-Y139 PolarHBondContact O-N 3.06Å; Y139-E204 PolarHBondContact OH-OE1 3.39Å; Y139-K208 CarbonylContact O-C 3.52Å; Y139-K208 VanDerWaalsContact O-CA 3.23Å; Y139-K208 WeakPolarHBondContact O-CA 3.44Å; Y139-V209 WeakPolarHBondContact O-CG2 3.26Å; Y139-V209 PolarHBondContact O-N 3.21Å
140	H	95.1	Very high	95.5	Very high	28 Å²	28	61.6 Å²	61.6	13%	0.13	30%	0.296	C	S	.	.			trans	-109.6	129.2	-179	-74	-175.2	0	0	0	109.8	Y132 L136 K137 V144 Q145 V209	Y132-H140 AromaticContact CE2-ND1 3.4Å; Y132-H140 WeakPolarHBondContact CE2-ND1 3.34Å; Y132-H140 AromaticContact CZ-ND1 3.79Å; Y132-H140 VanDerWaalsContact OH-CB 3.27Å; Y132-H140 WeakPolarHBondContact OH-CB 3.4Å; Y132-H140 PolarHBondContact OH-ND1 3.2Å; L136-H140 PolarHBondContact O-N 3.04Å; K137-H140 PolarHBondContact O-N 3.43Å; H140-V144 HydrophobicContact CB-CB 3.93Å; H140-V144 HydrophobicContact CB-CG1 3.97Å; H140-V144 VanDerWaalsContact CG-CG1 3.49Å; H140-V144 WeakPolarHBondContact ND1-CG1 3.23Å; H140-Q145 HydrophobicContact CB-CG 4.14Å; H140-Q145 PolarHBondContact O-NE2 3Å; H140-V209 CarbonylContact C-O 3.56Å; H140-V209 WeakPolarHBondContact CA-O 3.5Å
141	G	96.6	Very high	95.2	Very high	18 Å²	18	58.9 Å²	58.9	19%	0.186	29%	0.285	C	S	.	.			trans	-69.8	177.5	170.3	0	0	0	0	0	111.9	I143 V144 Q145 V209	G141-I143 VanDerWaalsContact C-N 3.32Å; G141-I143 PolarHBondContact O-N 3.19Å; G141-V144 PolarHBondContact O-N 3.29Å; G141-Q145 WeakPolarHBondContact O-CG 3.41Å; G141-Q145 PolarHBondContact O-N 2.89Å; G141-V209 PolarHBondContact N-O 3.23Å
142	W	96.9	Very high	95	Very high	189 Å²	189	60.1 Å²	60.1	72%	0.716	29%	0.291	S	S	*	.	H	α-helix	trans	-58.1	-41.4	-173	177.8	80.8	0	0	0	113.3	Q145 K146	W142-Q145 PolarHBondContact O-N 2.85Å; W142-K146 HydrophobicContact CD2-CG 4.39Å; W142-K146 HydrophobicContact CZ2-CG 4.25Å; W142-K146 WeakPolarHBondContact O-CG 3.29Å; W142-K146 PolarHBondContact O-N 3.14Å
143	I	94.5	Very high	94.8	Very high	117 Å²	117	67.7 Å²	67.7	60%	0.6	32%	0.321	S	S	*	.	H	α-helix	trans	-63.8	-48.4	-179.3	-61.2	175.7	0	0	0	110.9	G141 Q145 K146 I147	G141-I143 VanDerWaalsContact C-N 3.32Å; G141-I143 PolarHBondContact O-N 3.19Å; I143-Q145 VanDerWaalsContact C-N 3.34Å; I143-Q145 PolarHBondContact O-N 3.43Å; I143-K146 WeakPolarHBondContact O-CB 3.46Å; I143-K146 PolarHBondContact O-N 3.12Å; I143-K146 VanDerWaalsContact O-N 3.11Å; I143-I147 HydrophobicContact CG2-CD1 4.23Å; I143-I147 PolarHBondContact O-N 3.38Å
144	V	93.2	Very high	94.5	Very high	40 Å²	40	65 Å²	65	24%	0.242	32%	0.315	C	S	.	.	H	α-helix	trans	-67.5	-36.6	-179.1	-172.6	0	0	0	0	111.2	H140 G141 K146 I147 F148	H140-V144 HydrophobicContact CB-CB 3.93Å; H140-V144 HydrophobicContact CB-CG1 3.97Å; H140-V144 VanDerWaalsContact CG-CG1 3.49Å; H140-V144 WeakPolarHBondContact ND1-CG1 3.23Å; G141-V144 PolarHBondContact O-N 3.29Å; V144-K146 VanDerWaalsContact C-N 3.29Å; V144-K146 PolarHBondContact O-N 3.5Å; V144-I147 PolarHBondContact O-N 3.18Å; V144-F148 PolarHBondContact O-N 2.84Å
145	Q	95.3	Very high	94.3	Very high	54 Å²	54	60 Å²	60	25%	0.252	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-38.3	171.6	-73.4	-178.6	33	0	0	112.2	Y132 H140 G141 W142 I143 F148 Q149	Y132-Q145 VanDerWaalsContact OH-CG 3.25Å; Y132-Q145 WeakPolarHBondContact OH-CG 3.16Å; H140-Q145 HydrophobicContact CB-CG 4.14Å; H140-Q145 PolarHBondContact O-NE2 3Å; G141-Q145 WeakPolarHBondContact O-CG 3.41Å; G141-Q145 PolarHBondContact O-N 2.89Å; W142-Q145 PolarHBondContact O-N 2.85Å; I143-Q145 VanDerWaalsContact C-N 3.34Å; I143-Q145 PolarHBondContact O-N 3.43Å; Q145-F148 PolarHBondContact O-N 3.08Å; Q145-Q149 WeakPolarHBondContact O-CG 3.38Å; Q145-Q149 PolarHBondContact O-N 3.19Å
146	K	93.4	Very high	94.2	Very high	99 Å²	99	61.2 Å²	61.2	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-69.3	-39.1	176.6	-71	-69.7	171.4	-167.7	0	112.9	W142 I143 V144 F148 Q149 A150	W142-K146 HydrophobicContact CD2-CG 4.39Å; W142-K146 HydrophobicContact CZ2-CG 4.25Å; W142-K146 WeakPolarHBondContact O-CG 3.29Å; W142-K146 PolarHBondContact O-N 3.14Å; I143-K146 WeakPolarHBondContact O-CB 3.46Å; I143-K146 PolarHBondContact O-N 3.12Å; I143-K146 VanDerWaalsContact O-N 3.11Å; V144-K146 VanDerWaalsContact C-N 3.29Å; V144-K146 PolarHBondContact O-N 3.5Å; K146-F148 VanDerWaalsContact C-N 3.29Å; K146-F148 PolarHBondContact O-N 2.92Å; K146-Q149 PolarHBondContact O-N 3.02Å; K146-A150 PolarHBondContact O-N 3.24Å
147	I	91.3	Very high	94.2	Very high	83 Å²	83	66.3 Å²	66.3	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-59.2	-44.7	171.5	-68.1	162.4	0	0	0	110.1	I143 V144 Q149 A150 A151	I143-I147 HydrophobicContact CG2-CD1 4.23Å; I143-I147 PolarHBondContact O-N 3.38Å; V144-I147 PolarHBondContact O-N 3.18Å; I147-Q149 PolarHBondContact O-N 3.04Å; I147-A150 PolarHBondContact O-N 3.27Å; I147-A151 PolarHBondContact O-N 3.04Å
148	F	92.2	Very high	94.1	Very high	14 Å²	14	64.4 Å²	64.4	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-41.2	177.3	-173.6	-95.1	0	0	0	112.6	F103 A128 Y132 V144 Q145 K146 A150 A151 L152	F103-F148 AromaticContact CE2-CE2 3.92Å; F103-F148 HydrophobicContact CE2-CE2 3.92Å; F103-F148 HydrophobicContact CE2-CZ 4.12Å; F103-F148 HydrophobicContact CZ-CE2 4.2Å; A128-F148 WeakPolarHBondContact O-CZ 3.19Å; Y132-F148 AromaticContact CD1-CD1 3.37Å; Y132-F148 HydrophobicContact CD1-CD1 3.37Å; Y132-F148 AromaticContact CD1-CE1 3.49Å; Y132-F148 HydrophobicContact CD1-CE1 3.49Å; Y132-F148 VanDerWaalsContact CD1-CE1 3.49Å; Y132-F148 AromaticContact CD1-CG 3.99Å; Y132-F148 HydrophobicContact CD1-CG 3.99Å; Y132-F148 HydrophobicContact CD1-CZ 4.21Å; Y132-F148 AromaticContact CD2-CD1 3.86Å; Y132-F148 HydrophobicContact CD2-CD1 3.86Å; Y132-F148 AromaticContact CD2-CD2 3.57Å; Y132-F148 HydrophobicContact CD2-CD2 3.57Å; Y132-F148 AromaticContact CD2-CE1 3.95Å; Y132-F148 HydrophobicContact CD2-CE1 3.95Å; Y132-F148 AromaticContact CD2-CE2 3.69Å; Y132-F148 HydrophobicContact CD2-CE2 3.69Å; Y132-F148 AromaticContact CD2-CG 3.68Å; Y132-F148 HydrophobicContact CD2-CG 3.68Å; Y132-F148 AromaticContact CD2-CZ 3.91Å; Y132-F148 HydrophobicContact CD2-CZ 3.91Å; Y132-F148 HydrophobicContact CE1-CB 4.32Å; Y132-F148 AromaticContact CE1-CD1 3.67Å; Y132-F148 HydrophobicContact CE1-CD1 3.67Å; Y132-F148 HydrophobicContact CE1-CE1 4.26Å; Y132-F148 HydrophobicContact CE1-CG 4.01Å; Y132-F148 HydrophobicContact CE2-CB 4.09Å; Y132-F148 HydrophobicContact CE2-CD1 4.16Å; Y132-F148 AromaticContact CE2-CD2 3.9Å; Y132-F148 HydrophobicContact CE2-CD2 3.9Å; Y132-F148 HydrophobicContact CE2-CE2 4.46Å; Y132-F148 AromaticContact CE2-CG 3.75Å; Y132-F148 HydrophobicContact CE2-CG 3.75Å; Y132-F148 AromaticContact CG-CD1 3.48Å; Y132-F148 HydrophobicContact CG-CD1 3.48Å; Y132-F148 VanDerWaalsContact CG-CD1 3.48Å; Y132-F148 AromaticContact CG-CD2 3.98Å; Y132-F148 HydrophobicContact CG-CD2 3.98Å; Y132-F148 AromaticContact CG-CE1 3.31Å; Y132-F148 HydrophobicContact CG-CE1 3.31Å; Y132-F148 AromaticContact CG-CE2 3.84Å; Y132-F148 HydrophobicContact CG-CE2 3.84Å; Y132-F148 AromaticContact CG-CG 3.83Å; Y132-F148 HydrophobicContact CG-CG 3.83Å; Y132-F148 AromaticContact CG-CZ 3.54Å; Y132-F148 HydrophobicContact CG-CZ 3.54Å; Y132-F148 AromaticContact CZ-CG 3.91Å; V144-F148 PolarHBondContact O-N 2.84Å; Q145-F148 PolarHBondContact O-N 3.08Å; K146-F148 VanDerWaalsContact C-N 3.29Å; K146-F148 PolarHBondContact O-N 2.92Å; F148-A150 VanDerWaalsContact C-N 3.33Å; F148-A150 PolarHBondContact O-N 3.23Å; F148-A151 WeakPolarHBondContact O-CA 3.4Å; F148-A151 WeakPolarHBondContact O-CB 3.25Å; F148-A151 PolarHBondContact O-N 2.63Å; F148-A151 VanDerWaalsContact O-N 3.07Å; F148-L152 HydrophobicContact CD1-CD1 4.13Å; F148-L152 HydrophobicContact CD1-CG 4.09Å; F148-L152 HydrophobicContact CE1-CD1 3.7Å; F148-L152 HydrophobicContact CE1-CD2 3.64Å; F148-L152 HydrophobicContact CE1-CG 3.58Å; F148-L152 HydrophobicContact CZ-CD2 3.69Å; F148-L152 HydrophobicContact CZ-CG 4.06Å; F148-L152 PolarHBondContact O-N 3.33Å
149	Q	93.7	Very high	93.9	Very high	90 Å²	90	61.9 Å²	61.9	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-58.2	-44.7	174.3	-75.3	-178.2	-13.5	0	0	111.8	Q145 K146 I147 A151 L152 Y153	Q145-Q149 WeakPolarHBondContact O-CG 3.38Å; Q145-Q149 PolarHBondContact O-N 3.19Å; K146-Q149 PolarHBondContact O-N 3.02Å; I147-Q149 PolarHBondContact O-N 3.04Å; Q149-A151 VanDerWaalsContact C-N 3.28Å; Q149-A151 PolarHBondContact O-N 2.58Å; Q149-L152 WeakPolarHBondContact O-CB 3.39Å; Q149-L152 PolarHBondContact O-N 3.16Å; Q149-Y153 WeakPolarHBondContact O-CD2 3.4Å; Q149-Y153 PolarHBondContact O-N 3.15Å
150	A	91.8	Very high	93.8	Very high	52 Å²	52	65.5 Å²	65.5	43%	0.43	33%	0.328	S	S	.	.	H	α-helix	trans	-61.3	-38.7	174.3	0	0	0	0	0	111.9	V41 K146 I147 F148 L152 Y153 A154	V41-A150 HydrophobicContact CG2-CB 4.43Å; K146-A150 PolarHBondContact O-N 3.24Å; I147-A150 PolarHBondContact O-N 3.27Å; F148-A150 VanDerWaalsContact C-N 3.33Å; F148-A150 PolarHBondContact O-N 3.23Å; A150-L152 VanDerWaalsContact C-N 3.35Å; A150-L152 PolarHBondContact O-N 3.25Å; A150-Y153 PolarHBondContact O-N 3.33Å; A150-A154 PolarHBondContact O-N 2.87Å
151	A	91.7	Very high	93.8	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-39.3	176.2	0	0	0	0	0	113	V41 F42 I147 F148 Q149 Y153 A154 A155	V41-A151 HydrophobicContact CB-CB 4.48Å; V41-A151 HydrophobicContact CG1-CB 3.75Å; V41-A151 HydrophobicContact CG2-CB 3.92Å; F42-A151 HydrophobicContact CD1-CB 4.3Å; F42-A151 HydrophobicContact CE1-CB 3.74Å; F42-A151 HydrophobicContact CZ-CB 3.9Å; F42-A151 VanDerWaalsContact CZ-O 3.29Å; F42-A151 WeakPolarHBondContact CZ-O 3.37Å; I147-A151 PolarHBondContact O-N 3.04Å; F148-A151 WeakPolarHBondContact O-CA 3.4Å; F148-A151 WeakPolarHBondContact O-CB 3.25Å; F148-A151 PolarHBondContact O-N 2.63Å; F148-A151 VanDerWaalsContact O-N 3.07Å; Q149-A151 VanDerWaalsContact C-N 3.28Å; Q149-A151 PolarHBondContact O-N 2.58Å; A151-Y153 VanDerWaalsContact C-N 3.3Å; A151-Y153 PolarHBondContact O-N 3.37Å; A151-A154 CarbonylContact O-C 3.54Å; A151-A154 PolarHBondContact O-N 2.83Å; A151-A155 PolarHBondContact O-N 3.46Å
152	L	92.9	Very high	93.6	Very high	25 Å²	25	63.7 Å²	63.7	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-39.1	174.4	-68.7	176.5	0	0	0	112.6	R125 A128 T129 F148 Q149 A150 A154 A155	R125-L152 WeakPolarHBondContact CG-O 3.25Å; R125-L152 PolarHBondContact NE-O 2.95Å; A128-L152 HydrophobicContact CB-CD2 3.52Å; T129-L152 WeakPolarHBondContact OG1-CD1 3.47Å; F148-L152 HydrophobicContact CD1-CD1 4.13Å; F148-L152 HydrophobicContact CD1-CG 4.09Å; F148-L152 HydrophobicContact CE1-CD1 3.7Å; F148-L152 HydrophobicContact CE1-CD2 3.64Å; F148-L152 HydrophobicContact CE1-CG 3.58Å; F148-L152 HydrophobicContact CZ-CD2 3.69Å; F148-L152 HydrophobicContact CZ-CG 4.06Å; F148-L152 PolarHBondContact O-N 3.33Å; Q149-L152 WeakPolarHBondContact O-CB 3.39Å; Q149-L152 PolarHBondContact O-N 3.16Å; A150-L152 VanDerWaalsContact C-N 3.35Å; A150-L152 PolarHBondContact O-N 3.25Å; L152-A154 VanDerWaalsContact C-N 3.32Å; L152-A155 WeakPolarHBondContact O-CB 2.9Å; L152-A155 PolarHBondContact O-N 3Å
153	Y	92.4	Very high	93.4	Very high	171 Å²	171	61.3 Å²	61.3	67%	0.671	31%	0.31	S	S	*	.	H	α-helix	trans	-69.4	-32.7	178.9	-75.3	-72	0	0	0	112.6	R125 Q149 A150 A151	R125-Y153 PolarHBondContact NH2-O 3.11Å; Q149-Y153 WeakPolarHBondContact O-CD2 3.4Å; Q149-Y153 PolarHBondContact O-N 3.15Å; A150-Y153 PolarHBondContact O-N 3.33Å; A151-Y153 VanDerWaalsContact C-N 3.3Å; A151-Y153 PolarHBondContact O-N 3.37Å
154	A	92.1	Very high	93.3	Very high	42 Å²	42	57.5 Å²	57.5	35%	0.347	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.1	178.7	0	0	0	0	0	114.2	V41 A150 A151 L152	V41-A154 HydrophobicContact CG1-CB 4.05Å; A150-A154 PolarHBondContact O-N 2.87Å; A151-A154 CarbonylContact O-C 3.54Å; A151-A154 PolarHBondContact O-N 2.83Å; L152-A154 VanDerWaalsContact C-N 3.32Å
155	A	93.5	Very high	93.2	Very high	13 Å²	13	55.6 Å²	55.6	11%	0.107	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-63.1	142.2	175.7	0	0	0	0	0	110.7	F42 I124 A151 L152	F42-A155 HydrophobicContact CZ-CB 4.31Å; I124-A155 HydrophobicContact CD1-CB 4.27Å; I124-A155 HydrophobicContact CG1-CB 4.19Å; A151-A155 PolarHBondContact O-N 3.46Å; L152-A155 WeakPolarHBondContact O-CB 2.9Å; L152-A155 PolarHBondContact O-N 3Å
156	P	94.7	Very high	92.9	Very high	25 Å²	25	53.1 Å²	53.1	16%	0.162	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-71.3	172.3	-178.3	31.9	-38.9	0	0	0	111.9	L37 I124 D160 F161	L37-P156 WeakPolarHBondContact O-CD 3.18Å; I124-P156 HydrophobicContact CD1-CG 4.07Å; I124-P156 WeakPolarHBondContact CG1-O 3.43Å; P156-D160 HydrophobicContact CB-CB 4.17Å; P156-F161 HydrophobicContact CG-CB 3.98Å
157	Y	95.6	Very high	92.6	Very high	126 Å²	126	54.3 Å²	54.3	49%	0.494	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-67.2	155	163.4	-68	-66.4	0	0	0	110.9	N122 L123 S159 D160 F161	N122-Y157 HydrophobicContact CB-CD1 3.69Å; N122-Y157 HydrophobicContact CB-CE1 4.27Å; N122-Y157 HydrophobicContact CB-CG 4.5Å; N122-Y157 CarbonylContact O-C 3.6Å; N122-Y157 WeakPolarHBondContact O-CA 3.46Å; L123-Y157 HydrophobicContact CD2-CD1 3.74Å; L123-Y157 HydrophobicContact CD2-CE1 3.54Å; L123-Y157 HydrophobicContact CG-CE1 4.37Å; Y157-S159 VanDerWaalsContact C-N 3.28Å; Y157-S159 PolarHBondContact O-N 3.24Å; Y157-D160 PolarHBondContact O-N 3.45Å; Y157-D160 VanDerWaalsContact O-N 3.14Å; Y157-F161 PolarHBondContact O-N 3.38Å
158	K	95.6	Very high	92.1	Very high	40 Å²	40	52.9 Å²	52.9	17%	0.174	28%	0.284	C	S	.	.	H	α-helix	trans	-52.2	-46.5	177.4	-175.2	-174.4	178.9	-173	0	111.6	N122 I124 D160 F161 L162 E173	N122-K158 PolarHBondContact O-N 3.44Å; I124-K158 HydrophobicContact CG2-CB 3.76Å; I124-K158 HydrophobicContact CG2-CG 4.15Å; K158-D160 PolarHBondContact O-N 2.87Å; K158-F161 PolarHBondContact O-N 3.46Å; K158-L162 HydrophobicContact CG-CD1 4.05Å; K158-L162 HydrophobicContact CG-CG 4.35Å; K158-L162 VanDerWaalsContact O-CG 3.3Å; K158-L162 WeakPolarHBondContact O-CG 3.46Å; K158-L162 PolarHBondContact O-N 3.49Å; K158-E173 VanDerWaalsContact CE-OE1 3.25Å; K158-E173 WeakPolarHBondContact CE-OE1 3.15Å; K158-E173 IonicContact NZ-OE1 2.9Å; K158-E173 PolarHBondContact NZ-OE1 3.05Å
159	S	94.1	Very high	91.7	Very high	67 Å²	67	56.8 Å²	56.8	47%	0.469	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-42.9	179.5	53.2	0	0	0	0	112.8	Y157 K163	Y157-S159 VanDerWaalsContact C-N 3.28Å; Y157-S159 PolarHBondContact O-N 3.24Å; S159-K163 VanDerWaalsContact O-CB 3.26Å; S159-K163 WeakPolarHBondContact O-CB 3.49Å; S159-K163 PolarHBondContact O-N 3.16Å
160	D	93.6	Very high	91.3	Very high	82 Å²	82	60.7 Å²	60.7	44%	0.439	33%	0.326	S	S	.	.	H	α-helix	trans	-69.6	-40.7	179.9	-63	-39.5	0	0	0	111	P156 Y157 K158 K163 A164	P156-D160 HydrophobicContact CB-CB 4.17Å; Y157-D160 PolarHBondContact O-N 3.45Å; Y157-D160 VanDerWaalsContact O-N 3.14Å; K158-D160 PolarHBondContact O-N 2.87Å; D160-K163 PolarHBondContact O-N 3.38Å; D160-A164 WeakPolarHBondContact O-CB 3.26Å; D160-A164 PolarHBondContact O-N 2.97Å
161	F	94.3	Very high	91.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-50.4	173.7	171.8	-110.3	0	0	0	112	F33 C36 L37 F107 L108 I111 I124 P156 Y157 K158 K163 A164 L165	F33-F161 AromaticContact CE2-CE2 3.99Å; F33-F161 HydrophobicContact CE2-CE2 3.99Å; F33-F161 AromaticContact CE2-CZ 3.7Å; F33-F161 HydrophobicContact CE2-CZ 3.7Å; F33-F161 HydrophobicContact CZ-CE2 4.03Å; F33-F161 AromaticContact CZ-CZ 3.82Å; F33-F161 HydrophobicContact CZ-CZ 3.82Å; C36-F161 HydrophobicContact CB-CD2 4.1Å; C36-F161 HydrophobicContact CB-CE2 4.13Å; L37-F161 HydrophobicContact CD2-CD2 3.88Å; L37-F161 HydrophobicContact CD2-CE2 3.98Å; F107-F161 HydrophobicContact CD1-CZ 4.47Å; F107-F161 AromaticContact CE1-CE1 3.88Å; F107-F161 HydrophobicContact CE1-CE1 3.88Å; F107-F161 HydrophobicContact CE1-CE2 4Å; F107-F161 AromaticContact CE1-CZ 3.48Å; F107-F161 HydrophobicContact CE1-CZ 3.48Å; F107-F161 VanDerWaalsContact CE1-CZ 3.48Å; F107-F161 HydrophobicContact CZ-CE1 4.23Å; F107-F161 HydrophobicContact CZ-CZ 4.16Å; L108-F161 HydrophobicContact CD2-CE1 4.21Å; L108-F161 HydrophobicContact CD2-CZ 4.04Å; I111-F161 HydrophobicContact CD1-CD1 4.08Å; I111-F161 HydrophobicContact CD1-CE1 3.7Å; I124-F161 HydrophobicContact CD1-CB 4.36Å; I124-F161 HydrophobicContact CD1-CG 4.37Å; P156-F161 HydrophobicContact CG-CB 3.98Å; Y157-F161 PolarHBondContact O-N 3.38Å; K158-F161 PolarHBondContact O-N 3.46Å; F161-K163 VanDerWaalsContact C-N 3.34Å; F161-K163 PolarHBondContact O-N 2.92Å; F161-A164 PolarHBondContact O-N 2.77Å; F161-L165 HydrophobicContact CD1-CD1 4.06Å; F161-L165 HydrophobicContact CD2-CG 4.37Å; F161-L165 HydrophobicContact CE1-CD1 3.35Å; F161-L165 HydrophobicContact CE1-CG 4.14Å; F161-L165 HydrophobicContact CE2-CD1 3.94Å; F161-L165 HydrophobicContact CE2-CD2 4.31Å; F161-L165 HydrophobicContact CE2-CG 3.87Å; F161-L165 HydrophobicContact CZ-CD1 3.27Å; F161-L165 HydrophobicContact CZ-CD2 4.25Å; F161-L165 HydrophobicContact CZ-CG 3.75Å; F161-L165 WeakPolarHBondContact O-CB 3.36Å; F161-L165 PolarHBondContact O-N 3.43Å
162	L	93.7	Very high	91.1	Very high	8 Å²	8	64 Å²	64	4%	0.042	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-37.9	179.6	-66.5	-180	0	0	0	111.9	K158 L165 S166 E173 L177 I180	K158-L162 HydrophobicContact CG-CD1 4.05Å; K158-L162 HydrophobicContact CG-CG 4.35Å; K158-L162 VanDerWaalsContact O-CG 3.3Å; K158-L162 WeakPolarHBondContact O-CG 3.46Å; K158-L162 PolarHBondContact O-N 3.49Å; L162-L165 HydrophobicContact CD2-CD1 4.34Å; L162-L165 WeakPolarHBondContact O-CB 3.34Å; L162-L165 PolarHBondContact O-N 3.26Å; L162-S166 PolarHBondContact O-N 2.99Å; L162-E173 HydrophobicContact CD1-CB 4.47Å; L162-E173 HydrophobicContact CD1-CG 3.72Å; L162-L177 HydrophobicContact CD1-CD2 4.45Å; L162-L177 HydrophobicContact CD2-CD2 4.34Å; L162-I180 HydrophobicContact CD2-CD1 3.86Å
163	K	92	Very high	91.1	Very high	138 Å²	138	67.4 Å²	67.4	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-64.8	-40.4	173.4	-177.4	178.7	179	-179.4	0	112.4	S159 D160 F161 S166 K167 G168	S159-K163 VanDerWaalsContact O-CB 3.26Å; S159-K163 WeakPolarHBondContact O-CB 3.49Å; S159-K163 PolarHBondContact O-N 3.16Å; D160-K163 PolarHBondContact O-N 3.38Å; F161-K163 VanDerWaalsContact C-N 3.34Å; F161-K163 PolarHBondContact O-N 2.92Å; K163-S166 PolarHBondContact O-N 3.37Å; K163-S166 PolarHBondContact O-OG 2.88Å; K163-K167 PolarHBondContact O-N 3.46Å; K163-G168 PolarHBondContact O-N 2.76Å; K163-G168 VanDerWaalsContact O-N 3.09Å
164	A	92	Very high	91.2	Very high	38 Å²	38	64.2 Å²	64.2	31%	0.314	35%	0.347	S	S	.	.	H	α-helix	trans	-66.3	-42.4	175.8	0	0	0	0	0	111.1	C36 D160 F161 S166 K167	C36-A164 HydrophobicContact CB-CB 3.78Å; D160-A164 WeakPolarHBondContact O-CB 3.26Å; D160-A164 PolarHBondContact O-N 2.97Å; F161-A164 PolarHBondContact O-N 2.77Å; A164-S166 VanDerWaalsContact C-N 3.29Å; A164-S166 PolarHBondContact O-N 3.5Å; A164-K167 PolarHBondContact O-N 2.94Å
165	L	91.3	Very high	91.3	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.2	-38.1	174.3	-87.7	-172.2	0	0	0	112.8	M1 L3 L4 F33 C36 L108 F161 L162 K167 I180	M1-L165 HydrophobicContact CE-CB 3.59Å; M1-L165 HydrophobicContact CE-CD1 4.27Å; M1-L165 HydrophobicContact CE-CD2 4.35Å; M1-L165 HydrophobicContact CE-CG 4.31Å; M1-L165 WeakPolarHBondContact CE-O 3.41Å; M1-L165 HydrophobicContact SD-CB 4.33Å; M1-L165 VanDerWaalsContact SD-O 3.4Å; L3-L165 HydrophobicContact CD2-CD2 4.22Å; L4-L165 HydrophobicContact CD1-CD1 4.36Å; L4-L165 HydrophobicContact CD1-CD2 3.95Å; L4-L165 HydrophobicContact CG-CD2 4.18Å; F33-L165 HydrophobicContact CD2-CD2 3.83Å; F33-L165 HydrophobicContact CE2-CD2 3.99Å; C36-L165 HydrophobicContact CB-CD2 4.37Å; C36-L165 HydrophobicContact CB-CG 4.47Å; L108-L165 HydrophobicContact CD2-CD1 4.44Å; F161-L165 HydrophobicContact CD1-CD1 4.06Å; F161-L165 HydrophobicContact CD2-CG 4.37Å; F161-L165 HydrophobicContact CE1-CD1 3.35Å; F161-L165 HydrophobicContact CE1-CG 4.14Å; F161-L165 HydrophobicContact CE2-CD1 3.94Å; F161-L165 HydrophobicContact CE2-CD2 4.31Å; F161-L165 HydrophobicContact CE2-CG 3.87Å; F161-L165 HydrophobicContact CZ-CD1 3.27Å; F161-L165 HydrophobicContact CZ-CD2 4.25Å; F161-L165 HydrophobicContact CZ-CG 3.75Å; F161-L165 WeakPolarHBondContact O-CB 3.36Å; F161-L165 PolarHBondContact O-N 3.43Å; L162-L165 HydrophobicContact CD2-CD1 4.34Å; L162-L165 WeakPolarHBondContact O-CB 3.34Å; L162-L165 PolarHBondContact O-N 3.26Å; L165-K167 PolarHBondContact O-N 3.2Å; L165-I180 HydrophobicContact CD1-CD1 4Å
166	S	90.2	Very high	91.3	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.014	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-2.1	175.6	81.3	0	0	0	0	113.7	M1 L162 K163 A164 G168 Q169	M1-S166 VanDerWaalsContact SD-CA 3.56Å; L162-S166 PolarHBondContact O-N 2.99Å; K163-S166 PolarHBondContact O-N 3.37Å; K163-S166 PolarHBondContact O-OG 2.88Å; A164-S166 VanDerWaalsContact C-N 3.29Å; A164-S166 PolarHBondContact O-N 3.5Å; S166-G168 PolarHBondContact O-N 3.03Å; S166-G168 PolarHBondContact OG-N 3.47Å; S166-Q169 VanDerWaalsContact O-CB 3.29Å; S166-Q169 WeakPolarHBondContact O-CB 3.34Å; S166-Q169 WeakPolarHBondContact O-CG 3.37Å; S166-Q169 PolarHBondContact O-N 2.89Å; S166-Q169 VanDerWaalsContact O-N 3.09Å; S166-Q169 PolarHBondContact OG-N 2.89Å; S166-Q169 PolarHBondContact OG-O 3.47Å
167	K	86.3	Confident	91.3	Very high	124 Å²	124	65.5 Å²	65.5	54%	0.539	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	37.9	-170.2	-57.8	-161.3	-167.8	166.6	0	112.4	A2 K163 A164 L165 Q169	A2-K167 VanDerWaalsContact C-CE 3.44Å; A2-K167 HydrophobicContact CB-CB 4.4Å; A2-K167 HydrophobicContact CB-CD 3.54Å; A2-K167 HydrophobicContact CB-CG 3.96Å; A2-K167 VanDerWaalsContact O-CE 3.26Å; A2-K167 WeakPolarHBondContact O-CE 3.44Å; A2-K167 PolarHBondContact O-NZ 3.28Å; K163-K167 PolarHBondContact O-N 3.46Å; A164-K167 PolarHBondContact O-N 2.94Å; L165-K167 PolarHBondContact O-N 3.2Å; K167-Q169 PolarHBondContact O-N 3.38Å
168	G	79.9	Confident	91.3	Very high	53 Å²	53	63.6 Å²	63.6	55%	0.546	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	8.1	-179.9	0	0	0	0	0	115.1	K163 S166 N170	K163-G168 PolarHBondContact O-N 2.76Å; K163-G168 VanDerWaalsContact O-N 3.09Å; S166-G168 PolarHBondContact O-N 3.03Å; S166-G168 PolarHBondContact OG-N 3.47Å; G168-N170 PolarHBondContact O-N 2.76Å
169	Q	85	Confident	91.1	Very high	95 Å²	95	64 Å²	64	44%	0.444	34%	0.34	S	S	.	.			trans	-58.9	137	168.9	-69.1	-178.3	-37.5	0	0	109.4	M1 S166 K167 V171	M1-Q169 VanDerWaalsContact N-OE1 3.1Å; S166-Q169 VanDerWaalsContact O-CB 3.29Å; S166-Q169 WeakPolarHBondContact O-CB 3.34Å; S166-Q169 WeakPolarHBondContact O-CG 3.37Å; S166-Q169 PolarHBondContact O-N 2.89Å; S166-Q169 VanDerWaalsContact O-N 3.09Å; S166-Q169 PolarHBondContact OG-N 2.89Å; S166-Q169 PolarHBondContact OG-O 3.47Å; K167-Q169 PolarHBondContact O-N 3.38Å; Q169-V171 VanDerWaalsContact C-N 3.3Å; Q169-V171 HydrophobicContact CB-CG1 4.18Å; Q169-V171 PolarHBondContact O-N 3.17Å
170	N	84.3	Confident	91.2	Very high	172 Å²	172	60.9 Å²	60.9	92%	0.92	32%	0.318	S	S	*	.			trans	-74.8	86.6	175	-168.4	31.1	0	0	0	109.2	G168	G168-N170 PolarHBondContact O-N 2.76Å
171	V	87.5	Confident	91.3	Very high	41 Å²	41	60.7 Å²	60.7	25%	0.248	31%	0.311	C	S	.	.			trans	-124.9	146.3	176.4	-62.9	0	0	0	0	108.6	Q169 E175 C176	Q169-V171 VanDerWaalsContact C-N 3.3Å; Q169-V171 HydrophobicContact CB-CG1 4.18Å; Q169-V171 PolarHBondContact O-N 3.17Å; V171-E175 HydrophobicContact CB-CB 4.26Å; V171-C176 HydrophobicContact CG2-CB 4.37Å
172	T	92.8	Very high	91.3	Very high	82 Å²	82	63.3 Å²	63.3	50%	0.503	33%	0.325	S	S	.	.			trans	-66.4	160.5	171.2	62.2	0	0	0	0	110.7	E174 E175 C176	T172-E174 VanDerWaalsContact C-N 3.28Å; T172-E174 PolarHBondContact O-N 2.98Å; T172-E175 WeakPolarHBondContact CB-OE2 3.46Å; T172-E175 PolarHBondContact N-OE2 3.02Å; T172-E175 PolarHBondContact O-N 2.96Å; T172-E175 WeakPolarHBondContact OG1-CB 3.06Å; T172-E175 VanDerWaalsContact OG1-CD 3.3Å; T172-E175 WeakPolarHBondContact OG1-CG 3.49Å; T172-E175 PolarHBondContact OG1-N 3Å; T172-E175 PolarHBondContact OG1-OE2 2.82Å; T172-C176 PolarHBondContact O-N 3.47Å; T172-C176 VanDerWaalsContact O-N 3.11Å
173	E	93	Very high	91.4	Very high	96 Å²	96	63.1 Å²	63.1	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-55.4	-46.5	172.5	173.4	164.6	150.9	0	0	110.9	K158 L162 E175 C176 L177	K158-E173 VanDerWaalsContact CE-OE1 3.25Å; K158-E173 WeakPolarHBondContact CE-OE1 3.15Å; K158-E173 IonicContact NZ-OE1 2.9Å; K158-E173 PolarHBondContact NZ-OE1 3.05Å; L162-E173 HydrophobicContact CD1-CB 4.47Å; L162-E173 HydrophobicContact CD1-CG 3.72Å; E173-E175 PolarHBondContact O-N 3.45Å; E173-C176 WeakPolarHBondContact O-CA 3.41Å; E173-C176 WeakPolarHBondContact O-CB 3.39Å; E173-C176 PolarHBondContact O-N 3.23Å; E173-L177 HydrophobicContact CG-CD1 4.01Å; E173-L177 HydrophobicContact CG-CG 4.22Å; E173-L177 WeakPolarHBondContact O-CG 3.42Å; E173-L177 PolarHBondContact O-N 3.27Å
174	E	94.7	Very high	91.6	Very high	104 Å²	104	56.8 Å²	56.8	49%	0.486	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-41	-178	-169.9	55.6	-142.9	0	0	112.5	T172 C176 L177 E178 R181	T172-E174 VanDerWaalsContact C-N 3.28Å; T172-E174 PolarHBondContact O-N 2.98Å; E174-C176 VanDerWaalsContact C-N 3.26Å; E174-C176 PolarHBondContact O-N 3.19Å; E174-L177 PolarHBondContact O-N 3.2Å; E174-E178 WeakPolarHBondContact O-CB 3.47Å; E174-E178 PolarHBondContact O-N 3.16Å; E174-R181 IonicContact OE1-CZ 3.44Å; E174-R181 IonicContact OE1-NH1 2.74Å; E174-R181 PolarHBondContact OE1-NH1 3.45Å; E174-R181 IonicContact OE1-NH2 2.68Å; E174-R181 PolarHBondContact OE1-NH2 2.97Å
175	E	93.2	Very high	91.8	Very high	96 Å²	96	59.2 Å²	59.2	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-63.5	-32.4	174.1	-72.9	167.7	133	0	0	112.6	V171 T172 E173 K179	V171-E175 HydrophobicContact CB-CB 4.26Å; T172-E175 WeakPolarHBondContact CB-OE2 3.46Å; T172-E175 PolarHBondContact N-OE2 3.02Å; T172-E175 PolarHBondContact O-N 2.96Å; T172-E175 WeakPolarHBondContact OG1-CB 3.06Å; T172-E175 VanDerWaalsContact OG1-CD 3.3Å; T172-E175 WeakPolarHBondContact OG1-CG 3.49Å; T172-E175 PolarHBondContact OG1-N 3Å; T172-E175 PolarHBondContact OG1-OE2 2.82Å; E173-E175 PolarHBondContact O-N 3.45Å; E175-K179 WeakPolarHBondContact O-CG 3.25Å; E175-K179 PolarHBondContact O-N 3.31Å
176	C	93.3	Very high	92	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-69.9	-46.5	174.3	-168.3	0	0	0	0	110.8	V171 T172 E173 E174 E178 K179 I180	V171-C176 HydrophobicContact CG2-CB 4.37Å; T172-C176 PolarHBondContact O-N 3.47Å; T172-C176 VanDerWaalsContact O-N 3.11Å; E173-C176 WeakPolarHBondContact O-CA 3.41Å; E173-C176 WeakPolarHBondContact O-CB 3.39Å; E173-C176 PolarHBondContact O-N 3.23Å; E174-C176 VanDerWaalsContact C-N 3.26Å; E174-C176 PolarHBondContact O-N 3.19Å; C176-E178 VanDerWaalsContact C-N 3.33Å; C176-E178 PolarHBondContact O-N 3.33Å; C176-K179 PolarHBondContact O-N 3.26Å; C176-I180 WeakPolarHBondContact O-CG1 3.36Å; C176-I180 PolarHBondContact O-N 2.8Å
177	L	95.2	Very high	92.4	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.052	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-41	177.3	-65.9	-179.7	0	0	0	111.7	I111 L162 E173 E174 K179 I180 R181	I111-L177 HydrophobicContact CG2-CD2 3.68Å; L162-L177 HydrophobicContact CD1-CD2 4.45Å; L162-L177 HydrophobicContact CD2-CD2 4.34Å; E173-L177 HydrophobicContact CG-CD1 4.01Å; E173-L177 HydrophobicContact CG-CG 4.22Å; E173-L177 WeakPolarHBondContact O-CG 3.42Å; E173-L177 PolarHBondContact O-N 3.27Å; E174-L177 PolarHBondContact O-N 3.2Å; L177-K179 VanDerWaalsContact C-N 3.35Å; L177-K179 PolarHBondContact O-N 3.49Å; L177-I180 HydrophobicContact CD2-CD1 4.4Å; L177-I180 WeakPolarHBondContact O-CB 3.35Å; L177-I180 PolarHBondContact O-N 3.49Å; L177-I180 VanDerWaalsContact O-N 3.13Å; L177-R181 WeakPolarHBondContact O-CG 3.19Å; L177-R181 PolarHBondContact O-N 2.85Å
178	E	94.4	Very high	92.9	Very high	85 Å²	85	55.6 Å²	55.6	40%	0.397	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-41.2	178.5	-173.3	55.1	-156.3	0	0	112.2	E174 C176 I180 R181 L182	E174-E178 WeakPolarHBondContact O-CB 3.47Å; E174-E178 PolarHBondContact O-N 3.16Å; C176-E178 VanDerWaalsContact C-N 3.33Å; C176-E178 PolarHBondContact O-N 3.33Å; E178-I180 VanDerWaalsContact C-N 3.29Å; E178-I180 PolarHBondContact O-N 2.91Å; E178-R181 WeakPolarHBondContact O-CB 3.47Å; E178-R181 PolarHBondContact O-N 3.27Å; E178-R181 VanDerWaalsContact O-N 3.16Å; E178-R181 IonicContact OE2-CZ 3.17Å; E178-R181 IonicContact OE2-NH1 2.89Å; E178-R181 PolarHBondContact OE2-NH1 3.33Å; E178-L182 WeakPolarHBondContact O-CG 3.13Å; E178-L182 PolarHBondContact O-N 3.43Å
179	K	93.3	Very high	93.8	Very high	50 Å²	50	54.9 Å²	54.9	22%	0.217	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-33.5	174.3	-72.1	175.7	178.9	161.8	0	112.6	M1 E6 E175 C176 L177 F183	M1-K179 HydrophobicContact CB-CB 4.3Å; M1-K179 HydrophobicContact CB-CD 3.96Å; M1-K179 HydrophobicContact CG-CB 3.59Å; M1-K179 HydrophobicContact CG-CD 3.4Å; M1-K179 VanDerWaalsContact CG-CD 3.4Å; M1-K179 HydrophobicContact CG-CG 4.1Å; E6-K179 HydrophobicContact CG-CB 4.43Å; E6-K179 HydrophobicContact CG-CG 4.15Å; E6-K179 WeakPolarHBondContact OE1-CE 3.38Å; E175-K179 WeakPolarHBondContact O-CG 3.25Å; E175-K179 PolarHBondContact O-N 3.31Å; C176-K179 PolarHBondContact O-N 3.26Å; L177-K179 VanDerWaalsContact C-N 3.35Å; L177-K179 PolarHBondContact O-N 3.49Å; K179-F183 WeakPolarHBondContact O-CB 3.26Å; K179-F183 PolarHBondContact O-N 2.95Å
180	I	95	Very high	94.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-43.9	172.3	-66.2	164.8	0	0	0	110.1	L4 L108 C112 L162 L165 C176 L177 E178 L182 F183 L184	L4-I180 HydrophobicContact CD1-CG1 4.4Å; L108-I180 HydrophobicContact CB-CG2 3.74Å; L108-I180 HydrophobicContact CD1-CG2 4.23Å; L108-I180 HydrophobicContact CD2-CD1 4.24Å; L108-I180 HydrophobicContact CD2-CG1 4.49Å; L108-I180 HydrophobicContact CD2-CG2 3.99Å; L108-I180 HydrophobicContact CG-CG2 4.21Å; C112-I180 WeakPolarHBondContact SG-CG2 3.29Å; L162-I180 HydrophobicContact CD2-CD1 3.86Å; L165-I180 HydrophobicContact CD1-CD1 4Å; C176-I180 WeakPolarHBondContact O-CG1 3.36Å; C176-I180 PolarHBondContact O-N 2.8Å; L177-I180 HydrophobicContact CD2-CD1 4.4Å; L177-I180 WeakPolarHBondContact O-CB 3.35Å; L177-I180 PolarHBondContact O-N 3.49Å; L177-I180 VanDerWaalsContact O-N 3.13Å; E178-I180 VanDerWaalsContact C-N 3.29Å; E178-I180 PolarHBondContact O-N 2.91Å; I180-L182 PolarHBondContact O-N 3.34Å; I180-F183 WeakPolarHBondContact O-CB 3.42Å; I180-F183 PolarHBondContact O-N 3.3Å; I180-L184 HydrophobicContact CG2-CD1 3.89Å; I180-L184 HydrophobicContact CG2-CG 4.26Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.46Å; I180-L184 PolarHBondContact O-N 2.91Å
181	R	96.1	Very high	95.1	Very high	78 Å²	78	42.4 Å²	42.4	29%	0.294	22%	0.22	S	C	.	.	H	α-helix	trans	-58.5	-46.2	176.2	-67.4	-179	-163.4	111.9	1.9	111.4	C112 E174 L177 E178 L184 V185	C112-R181 HydrophobicContact CB-CG 4.07Å; E174-R181 IonicContact OE1-CZ 3.44Å; E174-R181 IonicContact OE1-NH1 2.74Å; E174-R181 PolarHBondContact OE1-NH1 3.45Å; E174-R181 IonicContact OE1-NH2 2.68Å; E174-R181 PolarHBondContact OE1-NH2 2.97Å; L177-R181 WeakPolarHBondContact O-CG 3.19Å; L177-R181 PolarHBondContact O-N 2.85Å; E178-R181 WeakPolarHBondContact O-CB 3.47Å; E178-R181 PolarHBondContact O-N 3.27Å; E178-R181 VanDerWaalsContact O-N 3.16Å; E178-R181 IonicContact OE2-CZ 3.17Å; E178-R181 IonicContact OE2-NH1 2.89Å; E178-R181 PolarHBondContact OE2-NH1 3.33Å; R181-L184 PolarHBondContact O-N 3Å; R181-L184 VanDerWaalsContact O-N 3.16Å; R181-V185 WeakPolarHBondContact O-CG2 3.16Å; R181-V185 PolarHBondContact O-N 3.2Å
182	L	95	Very high	95.6	Very high	56 Å²	56	43.8 Å²	43.8	29%	0.293	23%	0.226	S	C	.	.	H	α-helix	trans	-60.4	-46.4	176	-69.3	173.4	0	0	0	112.3	E6 E178 I180 L184 V185	E6-L182 HydrophobicContact CB-CB 4.22Å; E6-L182 HydrophobicContact CB-CD1 4.49Å; E6-L182 HydrophobicContact CG-CB 4.45Å; E6-L182 HydrophobicContact CG-CD1 4.21Å; E6-L182 CarbonylContact O-C 3.16Å; E6-L182 VanDerWaalsContact O-O 3.08Å; E178-L182 WeakPolarHBondContact O-CG 3.13Å; E178-L182 PolarHBondContact O-N 3.43Å; I180-L182 PolarHBondContact O-N 3.34Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 2.88Å; L182-V185 PolarHBondContact O-N 3.22Å
183	F	94.7	Very high	95.9	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.018	21%	0.208	C	C	.	.	H	α-helix	trans	-54.9	-43.5	173.6	164.5	-95	0	0	0	111.7	L4 A5 E6 L8 L30 L108 K179 I180 V185 Y187	L4-F183 HydrophobicContact CB-CB 4.5Å; L4-F183 HydrophobicContact CB-CD2 4.03Å; L4-F183 HydrophobicContact CB-CE2 4.45Å; L4-F183 HydrophobicContact CB-CG 4.16Å; L4-F183 HydrophobicContact CD1-CD1 4.4Å; L4-F183 HydrophobicContact CD2-CD2 4.35Å; L4-F183 HydrophobicContact CD2-CE1 4.33Å; L4-F183 HydrophobicContact CD2-CE2 3.95Å; L4-F183 HydrophobicContact CD2-CZ 3.94Å; A5-F183 WeakPolarHBondContact O-CD2 3.47Å; E6-F183 VanDerWaalsContact O-CA 3.25Å; E6-F183 WeakPolarHBondContact O-CA 3.33Å; E6-F183 PolarHBondContact O-N 3.14Å; L8-F183 HydrophobicContact CB-CD2 3.95Å; L8-F183 HydrophobicContact CB-CE2 3.8Å; L8-F183 HydrophobicContact CD2-CE2 3.71Å; L8-F183 HydrophobicContact CG-CE2 4.4Å; L30-F183 HydrophobicContact CD2-CE2 4.19Å; L30-F183 HydrophobicContact CD2-CZ 3.91Å; L108-F183 HydrophobicContact CD1-CD1 4.02Å; L108-F183 HydrophobicContact CD1-CE1 3.72Å; K179-F183 WeakPolarHBondContact O-CB 3.26Å; K179-F183 PolarHBondContact O-N 2.95Å; I180-F183 WeakPolarHBondContact O-CB 3.42Å; I180-F183 PolarHBondContact O-N 3.3Å; F183-V185 VanDerWaalsContact C-N 3.28Å; F183-V185 PolarHBondContact O-N 3.45Å; F183-Y187 AromaticContact CE1-CD1 3.98Å; F183-Y187 HydrophobicContact CE1-CD1 3.98Å; F183-Y187 AromaticContact CE1-CD2 3.94Å; F183-Y187 HydrophobicContact CE1-CD2 3.94Å; F183-Y187 HydrophobicContact CE1-CE1 4.27Å; F183-Y187 HydrophobicContact CE1-CE2 4.3Å; F183-Y187 AromaticContact CE1-CG 3.8Å; F183-Y187 HydrophobicContact CE1-CG 3.8Å; F183-Y187 AromaticContact CE2-CD2 3.89Å; F183-Y187 HydrophobicContact CE2-CD2 3.89Å; F183-Y187 HydrophobicContact CE2-CE2 4.37Å; F183-Y187 HydrophobicContact CE2-CG 4.4Å; F183-Y187 HydrophobicContact CZ-CD1 4.2Å; F183-Y187 AromaticContact CZ-CD2 3.33Å; F183-Y187 HydrophobicContact CZ-CD2 3.33Å; F183-Y187 HydrophobicContact CZ-CE1 4.34Å; F183-Y187 AromaticContact CZ-CE2 3.59Å; F183-Y187 HydrophobicContact CZ-CE2 3.59Å; F183-Y187 AromaticContact CZ-CG 3.7Å; F183-Y187 HydrophobicContact CZ-CG 3.7Å; F183-Y187 WeakPolarHBondContact O-CB 3.38Å; F183-Y187 PolarHBondContact O-N 2.97Å
184	L	97	Very high	96.2	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-68.1	-20.8	-176	-75.1	172.4	0	0	0	114.3	Q105 L108 Q109 I180 R181 L182 Y187 T188	Q105-L184 HydrophobicContact CB-CD2 4.47Å; Q105-L184 HydrophobicContact CG-CD2 4.02Å; L108-L184 HydrophobicContact CB-CD1 4.06Å; L108-L184 HydrophobicContact CB-CD2 4.12Å; L108-L184 HydrophobicContact CB-CG 4.41Å; Q109-L184 HydrophobicContact CB-CD1 4.11Å; I180-L184 HydrophobicContact CG2-CD1 3.89Å; I180-L184 HydrophobicContact CG2-CG 4.26Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 VanDerWaalsContact O-CG 3.28Å; I180-L184 WeakPolarHBondContact O-CG 3.46Å; I180-L184 PolarHBondContact O-N 2.91Å; R181-L184 PolarHBondContact O-N 3Å; R181-L184 VanDerWaalsContact O-N 3.16Å; L182-L184 VanDerWaalsContact C-N 3.26Å; L182-L184 PolarHBondContact O-N 2.88Å; L184-Y187 HydrophobicContact CD2-CD1 4.23Å; L184-T188 WeakPolarHBondContact O-CB 3.33Å; L184-T188 PolarHBondContact O-N 2.87Å; L184-T188 PolarHBondContact O-OG1 2.99Å
185	V	96.3	Very high	96.3	Very high	89 Å²	89	33.7 Å²	33.7	54%	0.539	17%	0.172	S	C	.	.	H	α-helix	trans	-58.4	-66.1	-177.9	177.7	0	0	0	0	111.2	R181 L182 F183 Y187 A189	R181-V185 WeakPolarHBondContact O-CG2 3.16Å; R181-V185 PolarHBondContact O-N 3.2Å; L182-V185 PolarHBondContact O-N 3.22Å; F183-V185 VanDerWaalsContact C-N 3.28Å; F183-V185 PolarHBondContact O-N 3.45Å; V185-Y187 VanDerWaalsContact C-N 3.32Å; V185-A189 PolarHBondContact O-N 3.39Å
186	N	95.8	Very high	96.6	Very high	21 Å²	21	33.1 Å²	33.1	11%	0.112	17%	0.17	C	C	.	.	H	α-helix	trans	-74.2	-29.4	-178.5	-64.3	-24.5	0	0	0	111.6	L9 T190	L9-N186 HydrophobicContact CB-CB 4.32Å; L9-N186 WeakPolarHBondContact O-CB 3.15Å; L9-N186 PolarHBondContact O-ND2 2.85Å; N186-T190 WeakPolarHBondContact O-CB 3.41Å; N186-T190 PolarHBondContact O-N 2.97Å; N186-T190 PolarHBondContact O-OG1 3.5Å
187	Y	97.1	Very high	96.8	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-49.9	178.7	-170.8	-97.8	0	0	0	111.6	L9 L30 L101 I104 Q105 F183 L184 V185 T190 I191	L9-Y187 HydrophobicContact CD1-CD2 3.73Å; L9-Y187 HydrophobicContact CD1-CE2 4.37Å; L9-Y187 HydrophobicContact CD1-CG 4.46Å; L30-Y187 HydrophobicContact CD1-CE2 3.75Å; L30-Y187 HydrophobicContact CD2-CE2 4.35Å; L101-Y187 VanDerWaalsContact CA-OH 3.25Å; L101-Y187 WeakPolarHBondContact CA-OH 3.28Å; L101-Y187 WeakPolarHBondContact CB-OH 3.46Å; L101-Y187 HydrophobicContact CD2-CE2 4.26Å; L101-Y187 WeakPolarHBondContact CD2-OH 3.47Å; L101-Y187 WeakPolarHBondContact O-CE1 3.31Å; L101-Y187 PolarHBondContact O-OH 3.45Å; L101-Y187 VanDerWaalsContact O-OH 3.13Å; I104-Y187 HydrophobicContact CB-CE1 4.45Å; I104-Y187 HydrophobicContact CG2-CE1 4.34Å; Q105-Y187 HydrophobicContact CB-CD1 4.01Å; Q105-Y187 HydrophobicContact CB-CE1 3.76Å; Q105-Y187 HydrophobicContact CG-CD1 4.3Å; F183-Y187 AromaticContact CE1-CD1 3.98Å; F183-Y187 HydrophobicContact CE1-CD1 3.98Å; F183-Y187 AromaticContact CE1-CD2 3.94Å; F183-Y187 HydrophobicContact CE1-CD2 3.94Å; F183-Y187 HydrophobicContact CE1-CE1 4.27Å; F183-Y187 HydrophobicContact CE1-CE2 4.3Å; F183-Y187 AromaticContact CE1-CG 3.8Å; F183-Y187 HydrophobicContact CE1-CG 3.8Å; F183-Y187 AromaticContact CE2-CD2 3.89Å; F183-Y187 HydrophobicContact CE2-CD2 3.89Å; F183-Y187 HydrophobicContact CE2-CE2 4.37Å; F183-Y187 HydrophobicContact CE2-CG 4.4Å; F183-Y187 HydrophobicContact CZ-CD1 4.2Å; F183-Y187 AromaticContact CZ-CD2 3.33Å; F183-Y187 HydrophobicContact CZ-CD2 3.33Å; F183-Y187 HydrophobicContact CZ-CE1 4.34Å; F183-Y187 AromaticContact CZ-CE2 3.59Å; F183-Y187 HydrophobicContact CZ-CE2 3.59Å; F183-Y187 AromaticContact CZ-CG 3.7Å; F183-Y187 HydrophobicContact CZ-CG 3.7Å; F183-Y187 WeakPolarHBondContact O-CB 3.38Å; F183-Y187 PolarHBondContact O-N 2.97Å; L184-Y187 HydrophobicContact CD2-CD1 4.23Å; V185-Y187 VanDerWaalsContact C-N 3.32Å; Y187-T190 PolarHBondContact O-N 3.09Å; Y187-I191 HydrophobicContact CD1-CD1 3.4Å; Y187-I191 VanDerWaalsContact CD1-CD1 3.4Å; Y187-I191 HydrophobicContact CE1-CD1 3.13Å; Y187-I191 HydrophobicContact CE1-CG1 4.46Å; Y187-I191 HydrophobicContact CE2-CD1 4.27Å; Y187-I191 HydrophobicContact CG-CD1 4.11Å; Y187-I191 WeakPolarHBondContact O-CD1 3.39Å; Y187-I191 VanDerWaalsContact O-CG1 3.26Å; Y187-I191 WeakPolarHBondContact O-CG1 3.43Å; Y187-I191 PolarHBondContact O-N 3.41Å
188	T	98.1	Very high	97	Very high	28 Å²	28	33.1 Å²	33.1	17%	0.172	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-49.7	178.3	-61.6	0	0	0	0	111.1	Q105 L184 T190 I191 D192	Q105-T188 WeakPolarHBondContact CG-OG1 3.36Å; Q105-T188 VanDerWaalsContact NE2-CG2 3.28Å; Q105-T188 PolarHBondContact NE2-OG1 2.99Å; L184-T188 WeakPolarHBondContact O-CB 3.33Å; L184-T188 PolarHBondContact O-N 2.87Å; L184-T188 PolarHBondContact O-OG1 2.99Å; T188-T190 VanDerWaalsContact C-N 3.32Å; T188-T190 PolarHBondContact O-N 3.44Å; T188-I191 PolarHBondContact O-N 3.4Å; T188-I191 VanDerWaalsContact O-N 3.16Å; T188-D192 VanDerWaalsContact O-CG 3.31Å; T188-D192 PolarHBondContact O-N 2.95Å
189	A	97.9	Very high	97.1	Very high	39 Å²	39	34 Å²	34	32%	0.322	18%	0.181	S	C	.	.	H	α-helix	trans	-58	-43.5	-179.8	0	0	0	0	0	112.3	L12 V185 D192 V193	L12-A189 HydrophobicContact CD1-CB 4Å; V185-A189 PolarHBondContact O-N 3.39Å; A189-D192 PolarHBondContact O-N 3.27Å; A189-V193 WeakPolarHBondContact O-CG2 3.25Å; A189-V193 PolarHBondContact O-N 3.09Å; A189-V193 VanDerWaalsContact O-N 3.14Å
190	T	98.3	Very high	97.4	Very high	4 Å²	4	38.1 Å²	38.1	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-45.1	177.3	-57.3	0	0	0	0	111.5	L9 I18 F23 N186 Y187 T188 V193 I194	L9-T190 HydrophobicContact CD1-CG2 4.01Å; I18-T190 HydrophobicContact CD1-CG2 3.72Å; I18-T190 HydrophobicContact CG1-CG2 4.3Å; F23-T190 HydrophobicContact CD2-CG2 4.14Å; F23-T190 HydrophobicContact CE2-CG2 4.14Å; N186-T190 WeakPolarHBondContact O-CB 3.41Å; N186-T190 PolarHBondContact O-N 2.97Å; N186-T190 PolarHBondContact O-OG1 3.5Å; Y187-T190 PolarHBondContact O-N 3.09Å; T188-T190 VanDerWaalsContact C-N 3.32Å; T188-T190 PolarHBondContact O-N 3.44Å; T190-V193 PolarHBondContact O-N 3.3Å; T190-I194 HydrophobicContact CG2-CD1 4.18Å; T190-I194 WeakPolarHBondContact O-CG1 3.26Å; T190-I194 PolarHBondContact O-N 3.49Å; T190-I194 VanDerWaalsContact O-N 3.08Å
191	I	98.4	Very high	97.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-41.2	179.6	-64.3	166	0	0	0	110.5	L101 R102 Q105 Y187 T188 V193 I194 Y195	L101-I191 HydrophobicContact CB-CD1 3.77Å; L101-I191 HydrophobicContact CB-CG1 4.1Å; R102-I191 HydrophobicContact CB-CG2 4.32Å; Q105-I191 HydrophobicContact CB-CD1 4.15Å; Y187-I191 HydrophobicContact CD1-CD1 3.4Å; Y187-I191 VanDerWaalsContact CD1-CD1 3.4Å; Y187-I191 HydrophobicContact CE1-CD1 3.13Å; Y187-I191 HydrophobicContact CE1-CG1 4.46Å; Y187-I191 HydrophobicContact CE2-CD1 4.27Å; Y187-I191 HydrophobicContact CG-CD1 4.11Å; Y187-I191 WeakPolarHBondContact O-CD1 3.39Å; Y187-I191 VanDerWaalsContact O-CG1 3.26Å; Y187-I191 WeakPolarHBondContact O-CG1 3.43Å; Y187-I191 PolarHBondContact O-N 3.41Å; T188-I191 PolarHBondContact O-N 3.4Å; T188-I191 VanDerWaalsContact O-N 3.16Å; I191-V193 VanDerWaalsContact C-N 3.32Å; I191-V193 PolarHBondContact O-N 3.4Å; I191-I194 PolarHBondContact O-N 3.33Å; I191-I194 VanDerWaalsContact O-N 3.12Å; I191-Y195 HydrophobicContact CG2-CD2 3.66Å; I191-Y195 HydrophobicContact CG2-CE2 3.6Å; I191-Y195 VanDerWaalsContact O-CD2 3.31Å; I191-Y195 WeakPolarHBondContact O-CD2 3.3Å; I191-Y195 PolarHBondContact O-N 2.95Å
192	D	98.5	Very high	97.5	Very high	71 Å²	71	41.8 Å²	41.8	38%	0.38	23%	0.226	S	C	.	.	H	α-helix	trans	-58.1	-44.4	177.3	-70.3	-20.5	0	0	0	111.6	R102 T188 A189 I194 Y195 E196	R102-D192 IonicContact CZ-OD1 2.65Å; R102-D192 IonicContact NH1-OD1 2.71Å; R102-D192 PolarHBondContact NH1-OD1 3.08Å; R102-D192 IonicContact NH2-OD1 2.63Å; R102-D192 PolarHBondContact NH2-OD1 3.27Å; T188-D192 VanDerWaalsContact O-CG 3.31Å; T188-D192 PolarHBondContact O-N 2.95Å; A189-D192 PolarHBondContact O-N 3.27Å; D192-I194 VanDerWaalsContact C-N 3.35Å; D192-I194 PolarHBondContact O-N 3.32Å; D192-Y195 PolarHBondContact O-N 3.4Å; D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 PolarHBondContact O-N 3.45Å
193	V	98.4	Very high	97.7	Very high	19 Å²	19	39.1 Å²	39.1	12%	0.115	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-41.2	174.4	170	0	0	0	0	112	L12 K16 I18 A189 T190 I191 Y195 E196 M197	L12-V193 HydrophobicContact CD1-CB 4.35Å; L12-V193 HydrophobicContact CD1-CG2 3.56Å; K16-V193 HydrophobicContact CB-CG1 4.12Å; K16-V193 HydrophobicContact CB-CG2 4.12Å; K16-V193 HydrophobicContact CD-CG2 3.95Å; K16-V193 HydrophobicContact CG-CG2 4.23Å; I18-V193 HydrophobicContact CD1-CB 4.2Å; I18-V193 HydrophobicContact CD1-CG1 3.83Å; I18-V193 HydrophobicContact CG1-CG1 4.42Å; A189-V193 WeakPolarHBondContact O-CG2 3.25Å; A189-V193 PolarHBondContact O-N 3.09Å; A189-V193 VanDerWaalsContact O-N 3.14Å; T190-V193 PolarHBondContact O-N 3.3Å; I191-V193 VanDerWaalsContact C-N 3.32Å; I191-V193 PolarHBondContact O-N 3.4Å; V193-Y195 VanDerWaalsContact C-N 3.32Å; V193-Y195 PolarHBondContact O-N 3.25Å; V193-E196 PolarHBondContact O-N 2.87Å; V193-M197 WeakPolarHBondContact O-CB 3.35Å; V193-M197 PolarHBondContact O-N 3.25Å
194	I	98.7	Very high	97.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-40.3	176.5	-62.1	166.9	0	0	0	110.5	I18 F23 L70 L94 K98 T190 I191 D192 M197 Y198	I18-I194 HydrophobicContact CD1-CD1 4.15Å; I18-I194 HydrophobicContact CD1-CG1 3.56Å; F23-I194 HydrophobicContact CE2-CD1 3.65Å; F23-I194 HydrophobicContact CZ-CD1 3.74Å; L70-I194 HydrophobicContact CD1-CD1 3.82Å; L70-I194 HydrophobicContact CD1-CG1 3.98Å; L94-I194 HydrophobicContact CD1-CG2 4.46Å; L94-I194 HydrophobicContact CG-CG2 4.46Å; K98-I194 HydrophobicContact CB-CG2 3.78Å; K98-I194 HydrophobicContact CD-CG2 3.71Å; K98-I194 HydrophobicContact CG-CG2 4.34Å; T190-I194 HydrophobicContact CG2-CD1 4.18Å; T190-I194 WeakPolarHBondContact O-CG1 3.26Å; T190-I194 PolarHBondContact O-N 3.49Å; T190-I194 VanDerWaalsContact O-N 3.08Å; I191-I194 PolarHBondContact O-N 3.33Å; I191-I194 VanDerWaalsContact O-N 3.12Å; D192-I194 VanDerWaalsContact C-N 3.35Å; D192-I194 PolarHBondContact O-N 3.32Å; I194-M197 HydrophobicContact CB-CE 4.4Å; I194-M197 HydrophobicContact CG1-CE 4.47Å; I194-M197 HydrophobicContact CG2-CE 3.94Å; I194-Y198 HydrophobicContact CG2-CD2 4.05Å; I194-Y198 HydrophobicContact CG2-CE2 4.03Å; I194-Y198 VanDerWaalsContact O-CD2 3.24Å; I194-Y198 WeakPolarHBondContact O-CD2 3.2Å; I194-Y198 PolarHBondContact O-N 2.88Å; I194-Y198 VanDerWaalsContact O-N 3.08Å
195	Y	98.5	Very high	97.9	Very high	50 Å²	50	41.8 Å²	41.8	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-66.7	-40.4	175.8	-88.9	-102.8	0	0	0	112.7	K98 R102 I191 D192 V193 Y198 T199	K98-Y195 HydrophobicContact CB-CE2 4.11Å; K98-Y195 HydrophobicContact CD-CD2 4.23Å; K98-Y195 HydrophobicContact CD-CE2 4.21Å; K98-Y195 HydrophobicContact CG-CE2 4.05Å; K98-Y195 WeakPolarHBondContact O-CE2 3.4Å; K98-Y195 PolarHBondContact O-OH 2.85Å; R102-Y195 HydrophobicContact CB-CE2 3.92Å; R102-Y195 VanDerWaalsContact CB-OH 3.29Å; R102-Y195 WeakPolarHBondContact CB-OH 3.46Å; R102-Y195 HydrophobicContact CG-CE2 4.37Å; I191-Y195 HydrophobicContact CG2-CD2 3.66Å; I191-Y195 HydrophobicContact CG2-CE2 3.6Å; I191-Y195 VanDerWaalsContact O-CD2 3.31Å; I191-Y195 WeakPolarHBondContact O-CD2 3.3Å; I191-Y195 PolarHBondContact O-N 2.95Å; D192-Y195 PolarHBondContact O-N 3.4Å; V193-Y195 VanDerWaalsContact C-N 3.32Å; V193-Y195 PolarHBondContact O-N 3.25Å; Y195-Y198 PolarHBondContact O-N 2.65Å; Y195-T199 PolarHBondContact O-N 3.16Å; Y195-T199 PolarHBondContact O-OG1 3.3Å
196	E	98.3	Very high	97.8	Very high	84 Å²	84	43.8 Å²	43.8	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-59.3	-49.7	174.5	-176.4	177	-174.2	0	0	110.5	K16 D192 V193 Y198 T199 Q200	K16-E196 IonicContact NZ-OE2 3.77Å; K16-E196 PolarHBondContact NZ-OE2 3.45Å; D192-E196 WeakPolarHBondContact O-CB 3.37Å; D192-E196 PolarHBondContact O-N 3.45Å; V193-E196 PolarHBondContact O-N 2.87Å; E196-Y198 PolarHBondContact O-N 3.13Å; E196-T199 WeakPolarHBondContact O-CB 3.41Å; E196-T199 PolarHBondContact O-N 3.4Å; E196-T199 VanDerWaalsContact O-N 3.09Å; E196-Q200 HydrophobicContact CG-CG 4.36Å; E196-Q200 WeakPolarHBondContact O-CG 3.46Å; E196-Q200 PolarHBondContact O-N 3.33Å; E196-Q200 PolarHBondContact OE1-NE2 3.06Å; E196-Q200 VanDerWaalsContact OE1-NE2 3.07Å
197	M	98.1	Very high	97.7	Very high	11 Å²	11	47 Å²	47	5%	0.054	24%	0.244	C	C	.	.	H	α-helix	trans	-53.9	-48.7	175.5	167.1	175.3	75.2	0	0	112.4	L70 Q71 L74 L94 V193 I194 T199 Q200 M201	L70-M197 HydrophobicContact CB-CE 3.97Å; L70-M197 HydrophobicContact CB-SD 4.4Å; Q71-M197 VanDerWaalsContact CA-SD 3.52Å; Q71-M197 HydrophobicContact CB-SD 3.98Å; Q71-M197 PolarHBondContact OE1-SD 3.48Å; L74-M197 HydrophobicContact CD1-CE 4.19Å; L74-M197 HydrophobicContact CD2-CE 4.25Å; L74-M197 HydrophobicContact CD2-CG 3.82Å; L74-M197 HydrophobicContact CD2-SD 4.21Å; L94-M197 HydrophobicContact CD2-CE 4Å; V193-M197 WeakPolarHBondContact O-CB 3.35Å; V193-M197 PolarHBondContact O-N 3.25Å; I194-M197 HydrophobicContact CB-CE 4.4Å; I194-M197 HydrophobicContact CG1-CE 4.47Å; I194-M197 HydrophobicContact CG2-CE 3.94Å; M197-T199 VanDerWaalsContact C-N 3.29Å; M197-T199 PolarHBondContact O-N 3.06Å; M197-Q200 PolarHBondContact O-N 3.43Å; M197-M201 HydrophobicContact CG-SD 4.37Å; M197-M201 WeakPolarHBondContact O-CB 3.25Å; M197-M201 WeakPolarHBondContact O-CG 3.46Å; M197-M201 PolarHBondContact O-N 3.11Å
198	Y	98.6	Very high	97.5	Very high	1 Å²	1	53.5 Å²	53.5	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-63.1	-36.2	177.9	-92.2	-104.1	0	0	0	113	L74 T91 L94 M95 K98 I194 Y195 E196 N202 A203	L74-Y198 HydrophobicContact CD1-CE2 4.2Å; L74-Y198 HydrophobicContact CD2-CD2 4.06Å; L74-Y198 HydrophobicContact CD2-CE2 3.95Å; L74-Y198 HydrophobicContact CD2-CG 4.48Å; T91-Y198 HydrophobicContact CG2-CE1 4.44Å; T91-Y198 PolarHBondContact O-OH 3.47Å; L94-Y198 VanDerWaalsContact C-OH 3.3Å; L94-Y198 VanDerWaalsContact CB-OH 3.22Å; L94-Y198 WeakPolarHBondContact CB-OH 3.29Å; L94-Y198 HydrophobicContact CD2-CE2 3.94Å; L94-Y198 HydrophobicContact CG-CE2 3.95Å; L94-Y198 WeakPolarHBondContact CG-OH 3.39Å; M95-Y198 HydrophobicContact CB-CD1 4.38Å; M95-Y198 HydrophobicContact CB-CE1 3.52Å; M95-Y198 HydrophobicContact CG-CD1 4.2Å; M95-Y198 HydrophobicContact CG-CE1 3.81Å; M95-Y198 PolarHBondContact N-OH 2.95Å; K98-Y198 HydrophobicContact CD-CD1 4.4Å; K98-Y198 HydrophobicContact CD-CD2 3.7Å; K98-Y198 HydrophobicContact CD-CE2 3.88Å; K98-Y198 HydrophobicContact CD-CG 3.97Å; I194-Y198 HydrophobicContact CG2-CD2 4.05Å; I194-Y198 HydrophobicContact CG2-CE2 4.03Å; I194-Y198 VanDerWaalsContact O-CD2 3.24Å; I194-Y198 WeakPolarHBondContact O-CD2 3.2Å; I194-Y198 PolarHBondContact O-N 2.88Å; I194-Y198 VanDerWaalsContact O-N 3.08Å; Y195-Y198 PolarHBondContact O-N 2.65Å; E196-Y198 PolarHBondContact O-N 3.13Å; Y198-N202 PolarHBondContact O-N 3.46Å; Y198-A203 HydrophobicContact CD1-CB 3.53Å; Y198-A203 HydrophobicContact CE1-CB 3.85Å; Y198-A203 HydrophobicContact CG-CB 4.13Å; Y198-A203 PolarHBondContact O-N 3.47Å
199	T	98.1	Very high	97.2	Very high	105 Å²	105	56.7 Å²	56.7	64%	0.644	29%	0.291	S	S	*	.	H	α-helix	trans	-68.6	-49.6	178.2	-56.2	0	0	0	0	110.5	Y195 E196 M197 M201 N202	Y195-T199 PolarHBondContact O-N 3.16Å; Y195-T199 PolarHBondContact O-OG1 3.3Å; E196-T199 WeakPolarHBondContact O-CB 3.41Å; E196-T199 PolarHBondContact O-N 3.4Å; E196-T199 VanDerWaalsContact O-N 3.09Å; M197-T199 VanDerWaalsContact C-N 3.29Å; M197-T199 PolarHBondContact O-N 3.06Å; T199-M201 VanDerWaalsContact C-N 3.3Å; T199-M201 PolarHBondContact O-N 3.17Å; T199-N202 PolarHBondContact O-N 3.47Å; T199-N202 VanDerWaalsContact O-N 3.16Å
200	Q	97.9	Very high	97.1	Very high	136 Å²	136	57.6 Å²	57.6	64%	0.636	29%	0.29	S	S	*	.	H	α-helix	trans	-62	-37.6	-179.6	-71.7	175.8	-7.7	0	0	112.4	E196 M197 N202	E196-Q200 HydrophobicContact CG-CG 4.36Å; E196-Q200 WeakPolarHBondContact O-CG 3.46Å; E196-Q200 PolarHBondContact O-N 3.33Å; E196-Q200 PolarHBondContact OE1-NE2 3.06Å; E196-Q200 VanDerWaalsContact OE1-NE2 3.07Å; M197-Q200 PolarHBondContact O-N 3.43Å; Q200-N202 VanDerWaalsContact C-N 3.33Å
201	M	97.5	Very high	97.1	Very high	23 Å²	23	60.4 Å²	60.4	11%	0.113	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-7.1	179.7	-65.1	-167.1	76.7	0	0	114.1	Q71 L74 E75 W85 M197 T199 A203	Q71-M201 PolarHBondContact NE2-SD 2.94Å; L74-M201 HydrophobicContact CB-CE 3.74Å; L74-M201 HydrophobicContact CB-SD 3.42Å; L74-M201 WeakPolarHBondContact CB-SD 3.34Å; L74-M201 HydrophobicContact CD2-CB 4.5Å; L74-M201 HydrophobicContact CD2-SD 3.62Å; L74-M201 HydrophobicContact CG-SD 4.17Å; E75-M201 HydrophobicContact CB-CE 4.36Å; E75-M201 HydrophobicContact CG-CE 3.59Å; E75-M201 HydrophobicContact CG-SD 4.4Å; W85-M201 HydrophobicContact CH2-CB 4.26Å; W85-M201 VanDerWaalsContact CH2-O 3.25Å; W85-M201 WeakPolarHBondContact CH2-O 3.36Å; M197-M201 HydrophobicContact CG-SD 4.37Å; M197-M201 WeakPolarHBondContact O-CB 3.25Å; M197-M201 WeakPolarHBondContact O-CG 3.46Å; M197-M201 PolarHBondContact O-N 3.11Å; T199-M201 VanDerWaalsContact C-N 3.3Å; T199-M201 PolarHBondContact O-N 3.17Å; M201-A203 VanDerWaalsContact C-N 3.28Å; M201-A203 HydrophobicContact CB-CB 4.33Å; M201-A203 PolarHBondContact O-N 2.76Å
202	N	97.5	Very high	97	Very high	131 Å²	131	63.8 Å²	63.8	70%	0.701	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	41.8	-169.9	-166.3	38.4	0	0	0	112.4	Y198 T199 Q200	Y198-N202 PolarHBondContact O-N 3.46Å; T199-N202 PolarHBondContact O-N 3.47Å; T199-N202 VanDerWaalsContact O-N 3.16Å; Q200-N202 VanDerWaalsContact C-N 3.33Å
203	A	98.2	Very high	96.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.317	C	S	.	.			trans	-92.9	-7	-177.7	0	0	0	0	0	113.3	L74 W85 P86 T91 Y198 M201	L74-A203 HydrophobicContact CD2-CB 3.98Å; W85-A203 HydrophobicContact CH2-CB 3.51Å; W85-A203 HydrophobicContact CZ2-CB 3.55Å; P86-A203 HydrophobicContact CB-CB 4.25Å; P86-A203 WeakPolarHBondContact CG-O 3.48Å; T91-A203 HydrophobicContact CG2-CB 4.38Å; Y198-A203 HydrophobicContact CD1-CB 3.53Å; Y198-A203 HydrophobicContact CE1-CB 3.85Å; Y198-A203 HydrophobicContact CG-CB 4.13Å; Y198-A203 PolarHBondContact O-N 3.47Å; M201-A203 VanDerWaalsContact C-N 3.28Å; M201-A203 HydrophobicContact CB-CB 4.33Å; M201-A203 PolarHBondContact O-N 2.76Å
204	E	97.8	Very high	96.8	Very high	40 Å²	40	66.1 Å²	66.1	19%	0.187	33%	0.33	C	S	.	.			trans	-78.4	123.5	-176.9	-174.7	66.5	-166.6	0	0	111.8	K98 R99 Y139	K98-E204 WeakPolarHBondContact CE-OE2 3.4Å; K98-E204 IonicContact NZ-OE1 3.95Å; K98-E204 IonicContact NZ-OE2 2.87Å; K98-E204 PolarHBondContact NZ-OE2 3.35Å; R99-E204 IonicContact CZ-OE1 2.63Å; R99-E204 IonicContact NE-OE1 3.7Å; R99-E204 PolarHBondContact NE-OE1 2.9Å; R99-E204 IonicContact NH2-OE1 2.95Å; R99-E204 PolarHBondContact NH2-OE1 3.42Å; Y139-E204 PolarHBondContact OH-OE1 3.39Å
205	L	97.4	Very high	96.7	Very high	24 Å²	24	70.5 Å²	70.5	13%	0.126	35%	0.352	C	S	.	.			trans	-101.7	129.8	177.6	-62.2	169.5	0	0	0	112.4	P86 K87 L92 M95 R99 Y207	P86-L205 HydrophobicContact CG-CD1 4.23Å; P86-L205 HydrophobicContact CG-CD2 3.7Å; P86-L205 HydrophobicContact CG-CG 3.85Å; K87-L205 HydrophobicContact CB-CD1 4.3Å; K87-L205 HydrophobicContact CG-CD1 3.81Å; K87-L205 HydrophobicContact CG-CD2 4.02Å; L92-L205 HydrophobicContact CD1-CD1 3.76Å; M95-L205 HydrophobicContact CE-CB 4.2Å; M95-L205 HydrophobicContact CE-CD1 4.32Å; M95-L205 HydrophobicContact SD-CB 3.67Å; M95-L205 HydrophobicContact SD-CD1 4.19Å; M95-L205 HydrophobicContact SD-CG 4.02Å; M95-L205 PolarHBondContact SD-N 2.84Å; M95-L205 VanDerWaalsContact SD-N 3.39Å; R99-L205 PolarHBondContact NH2-O 3.21Å; L205-Y207 HydrophobicContact CB-CD1 3.71Å; L205-Y207 HydrophobicContact CB-CE1 3.8Å; L205-Y207 HydrophobicContact CD1-CD1 4.45Å; L205-Y207 HydrophobicContact CD1-CE1 3.9Å; L205-Y207 PolarHBondContact O-N 3.38Å
206	N	94.1	Very high	96.6	Very high	132 Å²	132	72 Å²	72	71%	0.706	36%	0.363	S	S	*	.			trans	-102.4	72.5	178.3	-64	-56.6	0	0	0	111.2
207	Y	93.8	Very high	96.4	Very high	89 Å²	89	71.1 Å²	71.1	35%	0.349	36%	0.361	S	S	.	.			trans	-127	163.8	170.8	72.6	-81.3	0	0	0	111.1	M95 W96 L205 V209	M95-Y207 HydrophobicContact CE-CE1 4.11Å; W96-Y207 HydrophobicContact CZ2-CE1 4.09Å; W96-Y207 AromaticContact CZ2-CE2 3.84Å; W96-Y207 HydrophobicContact CZ2-CE2 3.84Å; W96-Y207 AromaticContact CZ2-CZ 3.51Å; W96-Y207 WeakPolarHBondContact CZ2-OH 3.33Å; W96-Y207 PolarHBondContact NE1-OH 2.77Å; W96-Y207 VanDerWaalsContact NE1-OH 3.15Å; L205-Y207 HydrophobicContact CB-CD1 3.71Å; L205-Y207 HydrophobicContact CB-CE1 3.8Å; L205-Y207 HydrophobicContact CD1-CD1 4.45Å; L205-Y207 HydrophobicContact CD1-CE1 3.9Å; L205-Y207 PolarHBondContact O-N 3.38Å; Y207-V209 HydrophobicContact CD2-CG1 4.17Å; Y207-V209 HydrophobicContact CE2-CG1 3.52Å
208	K	94.4	Very high	96.3	Very high	137 Å²	137	76.1 Å²	76.1	60%	0.596	39%	0.386	S	S	*	.			trans	-103.3	135.6	176.8	-66.6	-178.7	-178.2	178.2	0	110.6	K138 Y139	K138-K208 WeakPolarHBondContact O-CE 3.42Å; K138-K208 WeakPolarHBondContact O-CG 3.17Å; Y139-K208 CarbonylContact O-C 3.52Å; Y139-K208 VanDerWaalsContact O-CA 3.23Å; Y139-K208 WeakPolarHBondContact O-CA 3.44Å
209	V	90.1	Very high	96.1	Very high	95 Å²	95	82.9 Å²	82.9	58%	0.576	42%	0.421	S	S	*	.			trans	-98.5	0	166	-65.1	0	0	0	0	111.4	W96 Y139 H140 G141 Y207	W96-V209 HydrophobicContact CH2-CB 4.34Å; W96-V209 HydrophobicContact CH2-CG1 3.69Å; W96-V209 HydrophobicContact CH2-CG2 3.72Å; W96-V209 HydrophobicContact CZ2-CG1 3.49Å; W96-V209 VanDerWaalsContact CZ2-CG1 3.49Å; W96-V209 HydrophobicContact CZ2-CG2 4.33Å; W96-V209 HydrophobicContact CZ3-CG2 4.2Å; Y139-V209 WeakPolarHBondContact O-CG2 3.26Å; Y139-V209 PolarHBondContact O-N 3.21Å; H140-V209 CarbonylContact C-O 3.56Å; H140-V209 WeakPolarHBondContact CA-O 3.5Å; G141-V209 PolarHBondContact N-O 3.23Å; Y207-V209 HydrophobicContact CD2-CG1 4.17Å; Y207-V209 HydrophobicContact CE2-CG1 3.52Å

Retrieved 209 of 209 residues in 48.2 ms (Link to these results)

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