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Glycolipid transfer protein a

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.

AlphaFold DB , UniProt , Accession A0A060Y3H5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene gltpa, 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	61.2	Low	82.7	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.02	26%	0.258	C	S	.	.				0	48.5	0	-150.4	63.8	70.2	0	0	113.7	L3 L4 M5 L165 S166 C176 K179 I180	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.3Å; M1-L4 HydrophobicContact CG-CB 3.9Å; M1-L4 HydrophobicContact CG-CD1 4.31Å; M1-L4 HydrophobicContact CG-CG 4.36Å; M1-L4 HydrophobicContact SD-CB 4.34Å; M1-L4 HydrophobicContact SD-CD1 3.76Å; M1-L4 HydrophobicContact SD-CG 4.15Å; M1-M5 HydrophobicContact CB-CG 3.84Å; M1-M5 HydrophobicContact CG-CG 3.77Å; M1-M5 VanDerWaalsContact O-CB 3.3Å; M1-M5 WeakPolarHBondContact O-CB 3.48Å; M1-M5 WeakPolarHBondContact O-CG 3.45Å; M1-M5 PolarHBondContact O-N 3.24Å; M1-L165 CarbonylContact C-O 3.49Å; M1-L165 VanDerWaalsContact CA-O 3.28Å; M1-L165 WeakPolarHBondContact CA-O 3.4Å; M1-L165 HydrophobicContact SD-CB 3.75Å; M1-L165 HydrophobicContact SD-CD1 4.17Å; M1-S166 PolarHBondContact N-OG 2.8Å; M1-C176 VanDerWaalsContact CE-C 3.47Å; M1-C176 HydrophobicContact CE-CB 3.95Å; M1-C176 WeakPolarHBondContact CE-O 3.37Å; M1-C176 WeakPolarHBondContact CE-SG 3.4Å; M1-K179 HydrophobicContact CB-CB 3.69Å; M1-K179 HydrophobicContact CB-CD 3.59Å; M1-K179 HydrophobicContact CB-CG 4.25Å; M1-K179 HydrophobicContact CE-CB 4.06Å; M1-K179 HydrophobicContact CG-CB 3.76Å; M1-I180 HydrophobicContact CE-CD1 3.73Å; M1-I180 HydrophobicContact CE-CG1 3.43Å; M1-I180 VanDerWaalsContact CE-CG1 3.43Å; M1-I180 HydrophobicContact SD-CG1 4.06Å
2	A	64.8	Low	83.8	Confident	4 Å²	4	53.8 Å²	53.8	3%	0.033	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-40.4	179.3	0	0	0	0	0	110.7	L4 E6 L165 K167 R169	A2-L4 PolarHBondContact O-N 3.41Å; A2-E6 WeakPolarHBondContact CB-OE1 3.34Å; A2-E6 WeakPolarHBondContact O-CB 3.07Å; A2-E6 WeakPolarHBondContact O-CG 3.11Å; A2-E6 PolarHBondContact O-N 2.86Å; A2-L165 PolarHBondContact N-O 3.2Å; A2-K167 HydrophobicContact CB-CB 4.33Å; A2-K167 HydrophobicContact CB-CD 3.43Å; A2-K167 VanDerWaalsContact CB-CD 3.43Å; A2-K167 HydrophobicContact CB-CG 3.71Å; A2-R169 VanDerWaalsContact CA-NH2 3.29Å
3	L	79.1	Confident	84.7	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-41.1	-171.4	-170.2	144.3	0	0	0	113.3	M1 P32 F33 L165	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.3Å; L3-P32 HydrophobicContact CD1-CB 3.83Å; L3-F33 HydrophobicContact CD2-CB 4.35Å; L3-L165 HydrophobicContact CD2-CD2 4.27Å
4	L	82.4	Confident	85.3	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-90.9	-25.3	-177.9	-57.7	177.2	0	0	0	114	M1 A2 L30 L108 I180 F183	M1-L4 HydrophobicContact CG-CB 3.9Å; M1-L4 HydrophobicContact CG-CD1 4.31Å; M1-L4 HydrophobicContact CG-CG 4.36Å; M1-L4 HydrophobicContact SD-CB 4.34Å; M1-L4 HydrophobicContact SD-CD1 3.76Å; M1-L4 HydrophobicContact SD-CG 4.15Å; A2-L4 PolarHBondContact O-N 3.41Å; L4-L30 HydrophobicContact CD2-CD2 4.08Å; L4-L108 HydrophobicContact CD1-CD1 3.88Å; L4-L108 HydrophobicContact CD1-CD2 4.44Å; L4-I180 HydrophobicContact CD1-CG1 3.97Å; L4-F183 HydrophobicContact CB-CB 4.22Å; L4-F183 HydrophobicContact CB-CD1 4.45Å; L4-F183 HydrophobicContact CB-CD2 3.95Å; L4-F183 HydrophobicContact CB-CE2 4.47Å; L4-F183 HydrophobicContact CB-CG 3.94Å; L4-F183 HydrophobicContact CD1-CD1 4.2Å; L4-F183 HydrophobicContact CD1-CG 4.44Å; L4-F183 HydrophobicContact CD2-CD1 4.27Å; L4-F183 HydrophobicContact CD2-CD2 4.48Å; L4-F183 HydrophobicContact CD2-CE1 4.04Å; L4-F183 HydrophobicContact CD2-CE2 4.26Å; L4-F183 HydrophobicContact CD2-CG 4.49Å; L4-F183 HydrophobicContact CD2-CZ 4.05Å; L4-F183 WeakPolarHBondContact O-CD2 3.25Å
5	M	84.2	Confident	85.8	Confident	51 Å²	51	61.6 Å²	61.6	25%	0.251	33%	0.328	S	S	.	.	H	α-helix	trans	-94.7	-18.6	-172.2	-62.6	-58.8	-62.8	0	0	113.9	M1 H7 K179 Q182 F183	M1-M5 HydrophobicContact CB-CG 3.84Å; M1-M5 HydrophobicContact CG-CG 3.77Å; M1-M5 VanDerWaalsContact O-CB 3.3Å; M1-M5 WeakPolarHBondContact O-CB 3.48Å; M1-M5 WeakPolarHBondContact O-CG 3.45Å; M1-M5 PolarHBondContact O-N 3.24Å; M5-H7 VanDerWaalsContact C-N 3.28Å; M5-K179 HydrophobicContact CG-CB 3.94Å; M5-K179 HydrophobicContact CG-CD 4.25Å; M5-K179 HydrophobicContact CG-CG 4.23Å; M5-K179 HydrophobicContact SD-CB 3.92Å; M5-K179 HydrophobicContact SD-CG 4.4Å; M5-K179 VanDerWaalsContact SD-O 3.39Å; M5-Q182 HydrophobicContact CE-CG 4.33Å; M5-F183 HydrophobicContact SD-CB 4.47Å
6	E	81	Confident	86.3	Confident	97 Å²	97	64.1 Å²	64.1	45%	0.453	34%	0.335	S	S	.	.	S	Bend	trans	-68.8	-29.4	176.4	-75	163.9	-162.8	0	0	111.5	A2 K167	A2-E6 WeakPolarHBondContact CB-OE1 3.34Å; A2-E6 WeakPolarHBondContact O-CB 3.07Å; A2-E6 WeakPolarHBondContact O-CG 3.11Å; A2-E6 PolarHBondContact O-N 2.86Å; E6-K167 IonicContact OE1-NZ 2.77Å; E6-K167 PolarHBondContact OE1-NZ 3.38Å; E6-K167 IonicContact OE2-NZ 2.66Å; E6-K167 PolarHBondContact OE2-NZ 3.18Å
7	H	83.8	Confident	86.8	Confident	57 Å²	57	64.9 Å²	64.9	26%	0.264	34%	0.337	S	S	.	.	S	Bend	trans	-138	78.7	-173.4	-60.1	-74.3	0	0	0	111.7	M5 Y29	M5-H7 VanDerWaalsContact C-N 3.28Å; H7-Y29 HydrophobicContact CB-CD2 3.5Å; H7-Y29 HydrophobicContact CB-CE2 4.08Å; H7-Y29 HydrophobicContact CB-CG 3.91Å; H7-Y29 AromaticContact CD2-CD1 3.22Å; H7-Y29 WeakPolarHBondContact CD2-CD1 3.3Å; H7-Y29 AromaticContact CD2-CD2 3.32Å; H7-Y29 WeakPolarHBondContact CD2-CD2 3.36Å; H7-Y29 AromaticContact CD2-CE1 3.38Å; H7-Y29 WeakPolarHBondContact CD2-CE1 3.5Å; H7-Y29 AromaticContact CD2-CE2 3.5Å; H7-Y29 VanDerWaalsContact CD2-CE2 3.5Å; H7-Y29 WeakPolarHBondContact CD2-CE2 3.46Å; H7-Y29 AromaticContact CD2-CG 3.18Å; H7-Y29 AromaticContact CD2-CZ 3.51Å; H7-Y29 AromaticContact CE1-CE1 3.7Å; H7-Y29 AromaticContact CE1-CE2 3.4Å; H7-Y29 WeakPolarHBondContact CE1-CE2 3.28Å; H7-Y29 AromaticContact CE1-CZ 3.19Å; H7-Y29 PolarHBondContact CE1-OH 3.36Å; H7-Y29 VanDerWaalsContact CE1-OH 3.31Å; H7-Y29 AromaticContact CG-CD1 3.97Å; H7-Y29 AromaticContact CG-CD2 3.13Å; H7-Y29 AromaticContact CG-CE2 3.3Å; H7-Y29 AromaticContact CG-CG 3.5Å; H7-Y29 VanDerWaalsContact CG-CG 3.5Å; H7-Y29 AromaticContact CG-CZ 3.77Å; H7-Y29 AromaticContact ND1-CD2 3.61Å; H7-Y29 AromaticContact ND1-CE2 3.23Å; H7-Y29 WeakPolarHBondContact ND1-CE2 3.4Å; H7-Y29 AromaticContact ND1-CZ 3.58Å; H7-Y29 AromaticContact NE2-CD1 3.51Å; H7-Y29 AromaticContact NE2-CD2 3.91Å; H7-Y29 AromaticContact NE2-CE1 3.11Å; H7-Y29 WeakPolarHBondContact NE2-CE1 3.13Å; H7-Y29 AromaticContact NE2-CE2 3.58Å; H7-Y29 AromaticContact NE2-CG 3.88Å; H7-Y29 AromaticContact NE2-CZ 3.14Å
8	Q	89.7	Confident	87.4	Confident	73 Å²	73	62.2 Å²	62.2	34%	0.341	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-81	147	179.2	-63.2	-170	-45.7	0	0	112.3	S26	Q8-S26 PolarHBondContact O-OG 2.89Å
9	F	94.3	Very high	88	Confident	9 Å²	9	62.1 Å²	62.1	4%	0.039	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-64.8	139	169	-73.2	-103.2	0	0	0	109.9	F23 V27 L30 F183 N186 F187 A190	F9-F23 HydrophobicContact CD1-CD2 4.44Å; F9-F23 AromaticContact CE1-CD2 3.82Å; F9-F23 HydrophobicContact CE1-CD2 3.82Å; F9-F23 AromaticContact CE1-CE2 3.93Å; F9-F23 HydrophobicContact CE1-CE2 3.93Å; F9-V27 HydrophobicContact CE1-CG1 3.92Å; F9-V27 HydrophobicContact CZ-CG1 3.6Å; F9-L30 HydrophobicContact CE2-CD1 4.22Å; F9-L30 HydrophobicContact CZ-CD1 4.17Å; F9-F183 AromaticContact CD2-CE2 3.93Å; F9-F183 HydrophobicContact CD2-CE2 3.93Å; F9-F183 HydrophobicContact CD2-CZ 4.28Å; F9-F183 AromaticContact CE2-CE2 3.98Å; F9-F183 HydrophobicContact CE2-CE2 3.98Å; F9-F183 HydrophobicContact CE2-CZ 4.03Å; F9-N186 HydrophobicContact CB-CB 3.8Å; F9-N186 WeakPolarHBondContact O-CB 3.09Å; F9-N186 PolarHBondContact O-ND2 2.91Å; F9-F187 HydrophobicContact CD1-CD2 4.4Å; F9-F187 HydrophobicContact CD2-CB 3.97Å; F9-F187 AromaticContact CD2-CD2 3.64Å; F9-F187 HydrophobicContact CD2-CD2 3.64Å; F9-F187 HydrophobicContact CD2-CG 4.25Å; F9-F187 HydrophobicContact CE1-CD2 4.04Å; F9-F187 HydrophobicContact CE1-CE2 4.45Å; F9-F187 HydrophobicContact CE2-CB 4.4Å; F9-F187 AromaticContact CE2-CD2 3.25Å; F9-F187 HydrophobicContact CE2-CD2 3.25Å; F9-F187 AromaticContact CE2-CE2 3.8Å; F9-F187 HydrophobicContact CE2-CE2 3.8Å; F9-F187 HydrophobicContact CE2-CG 4.19Å; F9-F187 HydrophobicContact CG-CB 4.4Å; F9-F187 HydrophobicContact CG-CD2 4.22Å; F9-F187 AromaticContact CZ-CD2 3.46Å; F9-F187 HydrophobicContact CZ-CD2 3.46Å; F9-F187 VanDerWaalsContact CZ-CD2 3.46Å; F9-F187 AromaticContact CZ-CE2 3.7Å; F9-F187 HydrophobicContact CZ-CE2 3.7Å; F9-A190 HydrophobicContact CD1-CB 3.79Å; F9-A190 HydrophobicContact CE1-CB 4.46Å
10	K	93.8	Very high	88.5	Confident	134 Å²	134	59 Å²	59	58%	0.583	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-69.5	148.1	174.2	-66.8	-172.4	-179.8	170.4	0	110.2	L12 S22	K10-L12 PolarHBondContact O-N 2.86Å; K10-S22 WeakPolarHBondContact CD-OG 3.41Å; K10-S22 VanDerWaalsContact CE-OG 3.24Å; K10-S22 WeakPolarHBondContact CE-OG 3.47Å; K10-S22 PolarHBondContact NZ-OG 3.02Å
11	Q	96	Very high	89	Confident	161 Å²	161	61.9 Å²	61.9	75%	0.752	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-58.9	135.9	167.5	-175.9	178.7	3.5	0	0	109	N186	Q11-N186 PolarHBondContact N-ND2 3.17Å
12	L	95.7	Very high	90.7	Very high	37 Å²	37	62.2 Å²	62.2	19%	0.194	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-70.9	143.4	178.2	-66.9	-177.3	0	0	0	111.3	K10 V18 A189 A190 A193	K10-L12 PolarHBondContact O-N 2.86Å; L12-V18 HydrophobicContact CD2-CG2 3.95Å; L12-A189 HydrophobicContact CD1-CB 4.24Å; L12-A189 WeakPolarHBondContact CD1-O 3.36Å; L12-A190 HydrophobicContact CD2-CB 4.47Å; L12-A193 HydrophobicContact CD1-CB 3.61Å
13	P	95.1	Very high	92.3	Very high	67 Å²	67	62.2 Å²	62.2	44%	0.435	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-64.7	167.6	166.5	30	-36.3	0	0	0	111.5	D15 K16 Q17	P13-D15 WeakPolarHBondContact CB-OD1 3.4Å; P13-D15 WeakPolarHBondContact CG-OD1 3.2Å; P13-D15 PolarHBondContact O-N 2.7Å; P13-K16 WeakPolarHBondContact O-CA 3.49Å; P13-K16 PolarHBondContact O-N 2.93Å; P13-Q17 WeakPolarHBondContact CD-O 3.46Å; P13-Q17 WeakPolarHBondContact CG-O 3.28Å
14	A	93.4	Very high	93.2	Very high	113 Å²	113	61.9 Å²	61.9	93%	0.934	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.4	-179.3	0	0	0	0	0	113.6	K16	A14-K16 PolarHBondContact O-N 3.34Å
15	D	92.6	Very high	93.8	Very high	98 Å²	98	66.5 Å²	66.5	52%	0.524	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	3.4	176.7	70.4	-6.4	0	0	0	113.4	P13 Q17	P13-D15 WeakPolarHBondContact CB-OD1 3.4Å; P13-D15 WeakPolarHBondContact CG-OD1 3.2Å; P13-D15 PolarHBondContact O-N 2.7Å; D15-Q17 PolarHBondContact O-N 3.28Å; D15-Q17 VanDerWaalsContact O-N 3.11Å; D15-Q17 PolarHBondContact OD1-N 3.46Å; D15-Q17 VanDerWaalsContact OD1-N 3.15Å; D15-Q17 PolarHBondContact OD2-NE2 3.47Å
16	K	94	Very high	94.3	Very high	101 Å²	101	64.5 Å²	64.5	44%	0.439	33%	0.325	S	S	.	.			trans	57.7	16.4	-179.6	-60.5	-177.5	173.9	-171.8	0	114.9	P13 A14 V18 A193 E196	P13-K16 WeakPolarHBondContact O-CA 3.49Å; P13-K16 PolarHBondContact O-N 2.93Å; A14-K16 PolarHBondContact O-N 3.34Å; K16-V18 PolarHBondContact O-N 2.84Å; K16-A193 HydrophobicContact CB-CB 4.43Å; K16-E196 VanDerWaalsContact NZ-CD 3.3Å; K16-E196 IonicContact NZ-OE1 2.76Å; K16-E196 PolarHBondContact NZ-OE1 3.31Å; K16-E196 IonicContact NZ-OE2 2.6Å; K16-E196 PolarHBondContact NZ-OE2 3.41Å
17	Q	95	Very high	95	Very high	78 Å²	78	60 Å²	60	36%	0.364	30%	0.304	S	S	.	.			trans	-69.6	131.9	178	-73.1	-166.4	63.2	0	0	111.8	P13 D15 T69	P13-Q17 WeakPolarHBondContact CD-O 3.46Å; P13-Q17 WeakPolarHBondContact CG-O 3.28Å; D15-Q17 PolarHBondContact O-N 3.28Å; D15-Q17 VanDerWaalsContact O-N 3.11Å; D15-Q17 PolarHBondContact OD1-N 3.46Å; D15-Q17 VanDerWaalsContact OD1-N 3.15Å; D15-Q17 PolarHBondContact OD2-NE2 3.47Å; Q17-T69 HydrophobicContact CB-CG2 4.22Å; Q17-T69 PolarHBondContact OE1-OG1 3.16Å
18	V	98.1	Very high	95.5	Very high	16 Å²	16	59.8 Å²	59.8	10%	0.097	31%	0.309	C	S	.	.			trans	-94.8	112.9	177.1	-174.9	0	0	0	0	109.4	L12 K16 T20 F23 T69 L70 A193 I194	L12-V18 HydrophobicContact CD2-CG2 3.95Å; K16-V18 PolarHBondContact O-N 2.84Å; V18-T20 PolarHBondContact O-N 3.07Å; V18-F23 HydrophobicContact CG1-CB 3.77Å; V18-F23 HydrophobicContact CG1-CD2 3.91Å; V18-F23 HydrophobicContact CG1-CG 4.03Å; V18-T69 CarbonylContact O-C 3.48Å; V18-T69 WeakPolarHBondContact O-CA 3.45Å; V18-T69 VanDerWaalsContact O-CB 3.32Å; V18-T69 WeakPolarHBondContact O-CB 3.41Å; V18-L70 HydrophobicContact CB-CD1 3.85Å; V18-L70 HydrophobicContact CB-CG 4.11Å; V18-L70 HydrophobicContact CG1-CD1 3.54Å; V18-L70 HydrophobicContact CG1-CG 4Å; V18-L70 PolarHBondContact O-N 3.24Å; V18-A193 HydrophobicContact CG2-CB 4.14Å; V18-I194 HydrophobicContact CG2-CG1 4.23Å
19	E	98.2	Very high	95.6	Very high	61 Å²	61	61.1 Å²	61.1	29%	0.285	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-71.4	123.2	177.8	-163.3	-88	130.8	0	0	110.4	R21 S22 F23	E19-R21 PolarHBondContact O-N 3.5Å; E19-R21 WeakPolarHBondContact OE1-CB 3.26Å; E19-R21 PolarHBondContact OE1-N 3.06Å; E19-R21 VanDerWaalsContact OE1-N 3.11Å; E19-S22 WeakPolarHBondContact OE2-CB 3.34Å; E19-S22 PolarHBondContact OE2-N 2.93Å; E19-S22 PolarHBondContact OE2-OG 3.2Å; E19-F23 WeakPolarHBondContact O-CB 3.28Å; E19-F23 PolarHBondContact O-N 2.93Å
20	T	98.6	Very high	95.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-42.9	-167.5	-57.3	0	0	0	0	112	V18 F23 L24 F60 F67 K68 T69 L70 I73	V18-T20 PolarHBondContact O-N 3.07Å; T20-F23 PolarHBondContact O-N 3.37Å; T20-L24 HydrophobicContact CG2-CD1 3.79Å; T20-L24 HydrophobicContact CG2-CG 4.24Å; T20-L24 WeakPolarHBondContact O-CB 3.4Å; T20-L24 VanDerWaalsContact O-CG 3.31Å; T20-L24 WeakPolarHBondContact O-CG 3.23Å; T20-L24 PolarHBondContact O-N 3.08Å; T20-F60 HydrophobicContact CG2-CB 3.84Å; T20-F60 HydrophobicContact CG2-CD2 3.43Å; T20-F60 VanDerWaalsContact CG2-CD2 3.43Å; T20-F60 HydrophobicContact CG2-CE2 4.12Å; T20-F60 HydrophobicContact CG2-CG 3.69Å; T20-F67 VanDerWaalsContact CB-O 3.28Å; T20-F67 WeakPolarHBondContact CB-O 3.4Å; T20-F67 PolarHBondContact OG1-O 2.9Å; T20-K68 PolarHBondContact N-O 3.4Å; T20-K68 PolarHBondContact OG1-O 3.49Å; T20-T69 VanDerWaalsContact OG1-CA 3.3Å; T20-T69 WeakPolarHBondContact OG1-CA 3.29Å; T20-T69 PolarHBondContact OG1-N 2.98Å; T20-T69 PolarHBondContact OG1-O 3.48Å; T20-L70 HydrophobicContact CG2-CD2 4.05Å; T20-L70 PolarHBondContact OG1-N 3.3Å; T20-I73 HydrophobicContact CG2-CD1 3.8Å
21	R	97.8	Very high	95.4	Very high	120 Å²	120	54.9 Å²	54.9	45%	0.453	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-54.6	-178.1	-177.1	-175.9	-69.8	-87.5	-4	110.7	E19 F23 L24 E25 F60	E19-R21 PolarHBondContact O-N 3.5Å; E19-R21 WeakPolarHBondContact OE1-CB 3.26Å; E19-R21 PolarHBondContact OE1-N 3.06Å; E19-R21 VanDerWaalsContact OE1-N 3.11Å; R21-F23 VanDerWaalsContact C-N 3.26Å; R21-F23 PolarHBondContact O-N 3.02Å; R21-L24 PolarHBondContact O-N 3.37Å; R21-E25 HydrophobicContact CG-CG 4.45Å; R21-E25 VanDerWaalsContact CG-OE1 3.32Å; R21-E25 WeakPolarHBondContact CG-OE1 3.5Å; R21-E25 WeakPolarHBondContact O-CB 3.09Å; R21-E25 WeakPolarHBondContact O-CG 3.11Å; R21-E25 PolarHBondContact O-N 3.48Å; R21-F60 HydrophobicContact CB-CE1 4.23Å; R21-F60 HydrophobicContact CB-CZ 3.82Å; R21-F60 HydrophobicContact CG-CZ 4.47Å
22	S	96.9	Very high	95.2	Very high	10 Å²	10	49.6 Å²	49.6	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-37	-179.7	-59.2	0	0	0	0	112.2	K10 E19 S26	K10-S22 WeakPolarHBondContact CD-OG 3.41Å; K10-S22 VanDerWaalsContact CE-OG 3.24Å; K10-S22 WeakPolarHBondContact CE-OG 3.47Å; K10-S22 PolarHBondContact NZ-OG 3.02Å; E19-S22 WeakPolarHBondContact OE2-CB 3.34Å; E19-S22 PolarHBondContact OE2-N 2.93Å; E19-S22 PolarHBondContact OE2-OG 3.2Å; S22-S26 WeakPolarHBondContact O-CB 3.34Å; S22-S26 PolarHBondContact O-N 3.4Å; S22-S26 PolarHBondContact O-OG 3.38Å
23	F	98.1	Very high	94.9	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-63	-53.6	174.5	175.2	-98.9	0	0	0	111.2	F9 V18 E19 T20 R21 E25 S26 V27 L70 L94 L97 L101 I194	F9-F23 HydrophobicContact CD1-CD2 4.44Å; F9-F23 AromaticContact CE1-CD2 3.82Å; F9-F23 HydrophobicContact CE1-CD2 3.82Å; F9-F23 AromaticContact CE1-CE2 3.93Å; F9-F23 HydrophobicContact CE1-CE2 3.93Å; V18-F23 HydrophobicContact CG1-CB 3.77Å; V18-F23 HydrophobicContact CG1-CD2 3.91Å; V18-F23 HydrophobicContact CG1-CG 4.03Å; E19-F23 WeakPolarHBondContact O-CB 3.28Å; E19-F23 PolarHBondContact O-N 2.93Å; T20-F23 PolarHBondContact O-N 3.37Å; R21-F23 VanDerWaalsContact C-N 3.26Å; R21-F23 PolarHBondContact O-N 3.02Å; F23-E25 VanDerWaalsContact C-N 3.33Å; F23-E25 PolarHBondContact O-N 3.48Å; F23-S26 PolarHBondContact O-N 2.93Å; F23-S26 VanDerWaalsContact O-N 3.08Å; F23-V27 HydrophobicContact CD1-CG1 4.43Å; F23-V27 HydrophobicContact CD1-CG2 4.27Å; F23-V27 HydrophobicContact CD2-CG1 4.15Å; F23-V27 HydrophobicContact CE1-CG1 3.99Å; F23-V27 HydrophobicContact CE1-CG2 4.06Å; F23-V27 HydrophobicContact CE2-CG1 3.65Å; F23-V27 HydrophobicContact CZ-CG1 3.58Å; F23-V27 HydrophobicContact CZ-CG2 4.49Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.16Å; F23-L70 HydrophobicContact CD1-CD1 3.88Å; F23-L70 HydrophobicContact CD1-CD2 3.98Å; F23-L70 HydrophobicContact CD1-CG 4.46Å; F23-L70 HydrophobicContact CD2-CD1 4.21Å; F23-L70 HydrophobicContact CE1-CD1 4.05Å; F23-L70 HydrophobicContact CE1-CD2 4.44Å; F23-L70 HydrophobicContact CE2-CD1 4.38Å; F23-L70 HydrophobicContact CG-CD1 3.95Å; F23-L70 HydrophobicContact CZ-CD1 4.28Å; F23-L94 HydrophobicContact CE1-CD1 3.9Å; F23-L94 HydrophobicContact CZ-CD1 3.96Å; F23-L97 HydrophobicContact CE1-CD2 4.01Å; F23-L97 HydrophobicContact CZ-CD2 4.16Å; F23-L101 HydrophobicContact CE2-CD1 3.97Å; F23-L101 HydrophobicContact CZ-CD1 3.81Å; F23-I194 HydrophobicContact CD2-CD1 4.12Å; F23-I194 HydrophobicContact CE2-CD1 3.39Å; F23-I194 HydrophobicContact CZ-CD1 3.71Å
24	L	97.9	Very high	94.6	Very high	11 Å²	11	44.9 Å²	44.9	6%	0.058	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-42.7	179.4	-74.6	176	0	0	0	112.3	T20 R21 S26 V27 S28 I53 I56 K57 F60	T20-L24 HydrophobicContact CG2-CD1 3.79Å; T20-L24 HydrophobicContact CG2-CG 4.24Å; T20-L24 WeakPolarHBondContact O-CB 3.4Å; T20-L24 VanDerWaalsContact O-CG 3.31Å; T20-L24 WeakPolarHBondContact O-CG 3.23Å; T20-L24 PolarHBondContact O-N 3.08Å; R21-L24 PolarHBondContact O-N 3.37Å; L24-S26 VanDerWaalsContact C-N 3.34Å; L24-S26 PolarHBondContact O-N 2.68Å; L24-V27 HydrophobicContact CD2-CG2 4.39Å; L24-S28 VanDerWaalsContact O-CB 3.24Å; L24-S28 WeakPolarHBondContact O-CB 3.32Å; L24-S28 PolarHBondContact O-N 3.49Å; L24-S28 PolarHBondContact O-OG 3.4Å; L24-I53 HydrophobicContact CD2-CG2 4.28Å; L24-I56 HydrophobicContact CD1-CG2 4.4Å; L24-I56 HydrophobicContact CD2-CB 4.06Å; L24-I56 HydrophobicContact CD2-CG2 3.85Å; L24-I56 HydrophobicContact CG-CG2 4.45Å; L24-K57 HydrophobicContact CD1-CB 4.05Å; L24-K57 HydrophobicContact CD1-CG 4.49Å; L24-F60 HydrophobicContact CD1-CB 4.04Å; L24-F60 HydrophobicContact CD1-CD1 4.15Å; L24-F60 HydrophobicContact CD1-CG 4.21Å
25	E	95.2	Very high	94.3	Very high	98 Å²	98	42.5 Å²	42.5	46%	0.458	21%	0.208	S	C	.	.	H	α-helix	trans	-55.9	-49.7	172.9	-75.8	171.3	-177.4	0	0	110.3	R21 F23 S28 Y29	R21-E25 HydrophobicContact CG-CG 4.45Å; R21-E25 VanDerWaalsContact CG-OE1 3.32Å; R21-E25 WeakPolarHBondContact CG-OE1 3.5Å; R21-E25 WeakPolarHBondContact O-CB 3.09Å; R21-E25 WeakPolarHBondContact O-CG 3.11Å; R21-E25 PolarHBondContact O-N 3.48Å; F23-E25 VanDerWaalsContact C-N 3.33Å; F23-E25 PolarHBondContact O-N 3.48Å; E25-S28 PolarHBondContact O-OG 3.31Å; E25-Y29 WeakPolarHBondContact O-CD2 3.33Å; E25-Y29 VanDerWaalsContact O-CE2 3.23Å; E25-Y29 WeakPolarHBondContact O-CE2 3.34Å
26	S	95.3	Very high	94.2	Very high	10 Å²	10	38.6 Å²	38.6	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-48.4	-179.3	-53	0	0	0	0	112.8	Q8 S22 F23 L24 S28 Y29	Q8-S26 PolarHBondContact O-OG 2.89Å; S22-S26 WeakPolarHBondContact O-CB 3.34Å; S22-S26 PolarHBondContact O-N 3.4Å; S22-S26 PolarHBondContact O-OG 3.38Å; F23-S26 PolarHBondContact O-N 2.93Å; F23-S26 VanDerWaalsContact O-N 3.08Å; L24-S26 VanDerWaalsContact C-N 3.34Å; L24-S26 PolarHBondContact O-N 2.68Å; S26-S28 VanDerWaalsContact C-N 3.28Å; S26-S28 PolarHBondContact O-N 3.06Å; S26-Y29 PolarHBondContact O-N 3.17Å
27	V	95.8	Very high	93.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-69.6	-24.2	-177.1	-65.3	0	0	0	0	113	F9 F23 L24 Y29 L30 P31 I53 L97 L101	F9-V27 HydrophobicContact CE1-CG1 3.92Å; F9-V27 HydrophobicContact CZ-CG1 3.6Å; F23-V27 HydrophobicContact CD1-CG1 4.43Å; F23-V27 HydrophobicContact CD1-CG2 4.27Å; F23-V27 HydrophobicContact CD2-CG1 4.15Å; F23-V27 HydrophobicContact CE1-CG1 3.99Å; F23-V27 HydrophobicContact CE1-CG2 4.06Å; F23-V27 HydrophobicContact CE2-CG1 3.65Å; F23-V27 HydrophobicContact CZ-CG1 3.58Å; F23-V27 HydrophobicContact CZ-CG2 4.49Å; F23-V27 WeakPolarHBondContact O-CG2 3.38Å; F23-V27 PolarHBondContact O-N 3.16Å; L24-V27 HydrophobicContact CD2-CG2 4.39Å; V27-Y29 PolarHBondContact O-N 3.4Å; V27-Y29 VanDerWaalsContact O-N 3.13Å; V27-L30 HydrophobicContact CG1-CD1 4.39Å; V27-L30 WeakPolarHBondContact O-CB 3.38Å; V27-L30 PolarHBondContact O-N 3.32Å; V27-P31 WeakPolarHBondContact O-CD 3.24Å; V27-I53 HydrophobicContact CB-CD1 4.21Å; V27-I53 HydrophobicContact CG2-CD1 4.07Å; V27-I53 HydrophobicContact CG2-CG1 3.95Å; V27-I53 HydrophobicContact CG2-CG2 4.48Å; V27-I53 WeakPolarHBondContact O-CD1 3.21Å; V27-L97 HydrophobicContact CG2-CD2 4.41Å; V27-L101 HydrophobicContact CG1-CD1 3.87Å; V27-L101 HydrophobicContact CG1-CD2 4.14Å
28	S	94.4	Very high	92.9	Very high	54 Å²	54	31.3 Å²	31.3	38%	0.378	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-18.4	-179.8	70.6	0	0	0	0	114.2	L24 E25 S26 P31	L24-S28 VanDerWaalsContact O-CB 3.24Å; L24-S28 WeakPolarHBondContact O-CB 3.32Å; L24-S28 PolarHBondContact O-N 3.49Å; L24-S28 PolarHBondContact O-OG 3.4Å; E25-S28 PolarHBondContact O-OG 3.31Å; S26-S28 VanDerWaalsContact C-N 3.28Å; S26-S28 PolarHBondContact O-N 3.06Å; S28-P31 WeakPolarHBondContact O-CD 3.22Å
29	Y	91.8	Very high	91.5	Very high	101 Å²	101	34.2 Å²	34.2	40%	0.396	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-2.9	177.4	-63.8	-86.9	0	0	0	114.1	H7 E25 S26 V27 P32	H7-Y29 HydrophobicContact CB-CD2 3.5Å; H7-Y29 HydrophobicContact CB-CE2 4.08Å; H7-Y29 HydrophobicContact CB-CG 3.91Å; H7-Y29 AromaticContact CD2-CD1 3.22Å; H7-Y29 WeakPolarHBondContact CD2-CD1 3.3Å; H7-Y29 AromaticContact CD2-CD2 3.32Å; H7-Y29 WeakPolarHBondContact CD2-CD2 3.36Å; H7-Y29 AromaticContact CD2-CE1 3.38Å; H7-Y29 WeakPolarHBondContact CD2-CE1 3.5Å; H7-Y29 AromaticContact CD2-CE2 3.5Å; H7-Y29 VanDerWaalsContact CD2-CE2 3.5Å; H7-Y29 WeakPolarHBondContact CD2-CE2 3.46Å; H7-Y29 AromaticContact CD2-CG 3.18Å; H7-Y29 AromaticContact CD2-CZ 3.51Å; H7-Y29 AromaticContact CE1-CE1 3.7Å; H7-Y29 AromaticContact CE1-CE2 3.4Å; H7-Y29 WeakPolarHBondContact CE1-CE2 3.28Å; H7-Y29 AromaticContact CE1-CZ 3.19Å; H7-Y29 PolarHBondContact CE1-OH 3.36Å; H7-Y29 VanDerWaalsContact CE1-OH 3.31Å; H7-Y29 AromaticContact CG-CD1 3.97Å; H7-Y29 AromaticContact CG-CD2 3.13Å; H7-Y29 AromaticContact CG-CE2 3.3Å; H7-Y29 AromaticContact CG-CG 3.5Å; H7-Y29 VanDerWaalsContact CG-CG 3.5Å; H7-Y29 AromaticContact CG-CZ 3.77Å; H7-Y29 AromaticContact ND1-CD2 3.61Å; H7-Y29 AromaticContact ND1-CE2 3.23Å; H7-Y29 WeakPolarHBondContact ND1-CE2 3.4Å; H7-Y29 AromaticContact ND1-CZ 3.58Å; H7-Y29 AromaticContact NE2-CD1 3.51Å; H7-Y29 AromaticContact NE2-CD2 3.91Å; H7-Y29 AromaticContact NE2-CE1 3.11Å; H7-Y29 WeakPolarHBondContact NE2-CE1 3.13Å; H7-Y29 AromaticContact NE2-CE2 3.58Å; H7-Y29 AromaticContact NE2-CG 3.88Å; H7-Y29 AromaticContact NE2-CZ 3.14Å; E25-Y29 WeakPolarHBondContact O-CD2 3.33Å; E25-Y29 VanDerWaalsContact O-CE2 3.23Å; E25-Y29 WeakPolarHBondContact O-CE2 3.34Å; S26-Y29 PolarHBondContact O-N 3.17Å; V27-Y29 PolarHBondContact O-N 3.4Å; V27-Y29 VanDerWaalsContact O-N 3.13Å; Y29-P32 WeakPolarHBondContact O-CD 3.37Å
30	L	92.6	Very high	90.5	Very high	4 Å²	4	37 Å²	37	2%	0.021	21%	0.205	C	C	.	.	S	Bend	trans	-81.3	-27.7	178.4	-62.6	-179.7	0	0	0	115.1	L4 F9 V27 P32 F33 L101 I104 F183 F187	L4-L30 HydrophobicContact CD2-CD2 4.08Å; F9-L30 HydrophobicContact CE2-CD1 4.22Å; F9-L30 HydrophobicContact CZ-CD1 4.17Å; V27-L30 HydrophobicContact CG1-CD1 4.39Å; V27-L30 WeakPolarHBondContact O-CB 3.38Å; V27-L30 PolarHBondContact O-N 3.32Å; L30-P32 VanDerWaalsContact C-CD 3.44Å; L30-P32 VanDerWaalsContact C-N 3.33Å; L30-F33 WeakPolarHBondContact O-CA 3.23Å; L30-F33 WeakPolarHBondContact O-CB 3.06Å; L30-F33 PolarHBondContact O-N 2.95Å; L30-L101 HydrophobicContact CD1-CD2 3.52Å; L30-I104 HydrophobicContact CB-CD1 4.34Å; L30-F183 HydrophobicContact CD2-CE2 4.4Å; L30-F183 HydrophobicContact CD2-CZ 3.92Å; L30-F187 HydrophobicContact CD1-CE2 3.95Å; L30-F187 HydrophobicContact CD1-CZ 4.34Å
31	P	91.9	Very high	89.5	Confident	7 Å²	7	40.1 Å²	40.1	5%	0.045	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-52.9	-38.6	179.7	-27.4	33.8	0	0	0	115.5	V27 S28 F33 F34 K46 I49 V50 I53	V27-P31 WeakPolarHBondContact O-CD 3.24Å; S28-P31 WeakPolarHBondContact O-CD 3.22Å; P31-F33 PolarHBondContact O-N 3.34Å; P31-F33 VanDerWaalsContact O-N 3.13Å; P31-F34 WeakPolarHBondContact O-CD2 3.41Å; P31-F34 PolarHBondContact O-N 3.42Å; P31-F34 VanDerWaalsContact O-N 3.14Å; P31-K46 HydrophobicContact CB-CG 4.01Å; P31-I49 HydrophobicContact CG-CG2 4.31Å; P31-V50 HydrophobicContact CB-CG2 3.65Å; P31-V50 HydrophobicContact CG-CG2 3.68Å; P31-I53 HydrophobicContact CG-CD1 4.13Å
32	P	90.4	Very high	88.7	Confident	51 Å²	51	34.7 Å²	34.7	33%	0.331	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-65.5	-10.7	175.2	-19.1	32.8	0	0	0	114.7	L3 Y29 L30 F34 D35 C36	L3-P32 HydrophobicContact CD1-CB 3.83Å; Y29-P32 WeakPolarHBondContact O-CD 3.37Å; L30-P32 VanDerWaalsContact C-CD 3.44Å; L30-P32 VanDerWaalsContact C-N 3.33Å; P32-F34 PolarHBondContact O-N 3.15Å; P32-D35 WeakPolarHBondContact CA-OD2 2.83Å; P32-D35 WeakPolarHBondContact O-CB 3.34Å; P32-D35 PolarHBondContact O-N 2.75Å; P32-C36 PolarHBondContact O-N 3.45Å; P32-C36 PolarHBondContact O-SG 3.2Å
33	F	89.8	Confident	88.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-55.4	-39.4	168.2	179.3	-92.1	0	0	0	111.9	L3 L30 P31 D35 C36 L37 I104 L107 L108 F161 L165	L3-F33 HydrophobicContact CD2-CB 4.35Å; L30-F33 WeakPolarHBondContact O-CA 3.23Å; L30-F33 WeakPolarHBondContact O-CB 3.06Å; L30-F33 PolarHBondContact O-N 2.95Å; P31-F33 PolarHBondContact O-N 3.34Å; P31-F33 VanDerWaalsContact O-N 3.13Å; F33-D35 VanDerWaalsContact C-N 3.27Å; F33-D35 PolarHBondContact O-N 3.09Å; F33-C36 WeakPolarHBondContact O-CB 3.38Å; F33-C36 PolarHBondContact O-N 3Å; F33-L37 HydrophobicContact CD1-CD1 4.28Å; F33-L37 HydrophobicContact CE1-CD1 3.83Å; F33-L37 HydrophobicContact CE1-CG 4.35Å; F33-I104 HydrophobicContact CD1-CD1 4.16Å; F33-I104 HydrophobicContact CD1-CG1 3.85Å; F33-I104 HydrophobicContact CD1-CG2 4.45Å; F33-I104 HydrophobicContact CD2-CG2 4.24Å; F33-I104 HydrophobicContact CE1-CB 4.4Å; F33-I104 HydrophobicContact CE1-CG1 3.84Å; F33-I104 HydrophobicContact CE1-CG2 4.21Å; F33-I104 HydrophobicContact CE2-CG2 3.98Å; F33-I104 HydrophobicContact CG-CD1 4.43Å; F33-I104 HydrophobicContact CG-CG1 4.45Å; F33-I104 HydrophobicContact CG-CG2 4.46Å; F33-I104 HydrophobicContact CZ-CG1 4.43Å; F33-I104 HydrophobicContact CZ-CG2 3.96Å; F33-L107 HydrophobicContact CE1-CD2 3.96Å; F33-L107 HydrophobicContact CZ-CD2 3.73Å; F33-L107 HydrophobicContact CZ-CG 4.44Å; F33-L108 HydrophobicContact CE2-CD1 4.18Å; F33-L108 HydrophobicContact CE2-CD2 3.91Å; F33-L108 HydrophobicContact CE2-CG 4.05Å; F33-L108 HydrophobicContact CZ-CD2 4.39Å; F33-L108 HydrophobicContact CZ-CG 4.34Å; F33-F161 HydrophobicContact CE2-CE2 4.08Å; F33-F161 AromaticContact CE2-CZ 3.59Å; F33-F161 HydrophobicContact CE2-CZ 3.59Å; F33-F161 HydrophobicContact CZ-CE2 4.05Å; F33-F161 AromaticContact CZ-CZ 3.67Å; F33-F161 HydrophobicContact CZ-CZ 3.67Å; F33-L165 HydrophobicContact CD2-CD2 3.85Å; F33-L165 HydrophobicContact CE2-CD2 4.15Å
34	F	87.8	Confident	87.4	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.018	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-70.4	-25.5	-179.6	-65.6	-75.8	0	0	0	112.5	P31 P32 C36 L37 F42 I45 K46 I49 F103 I104	P31-F34 WeakPolarHBondContact O-CD2 3.41Å; P31-F34 PolarHBondContact O-N 3.42Å; P31-F34 VanDerWaalsContact O-N 3.14Å; P32-F34 PolarHBondContact O-N 3.15Å; F34-C36 PolarHBondContact O-N 3.31Å; F34-L37 HydrophobicContact CD1-CD1 4.21Å; F34-L37 PolarHBondContact O-N 3.39Å; F34-L37 VanDerWaalsContact O-N 3.16Å; F34-F42 HydrophobicContact CB-CB 4.26Å; F34-I45 HydrophobicContact CD1-CB 4.37Å; F34-I45 HydrophobicContact CD1-CG2 3.72Å; F34-I45 HydrophobicContact CE1-CB 4.47Å; F34-I45 HydrophobicContact CE1-CG2 3.38Å; F34-I45 HydrophobicContact CE2-CG2 4.38Å; F34-I45 HydrophobicContact CG-CG2 4.36Å; F34-I45 HydrophobicContact CZ-CG2 3.75Å; F34-K46 HydrophobicContact CB-CB 4.07Å; F34-K46 HydrophobicContact CD2-CB 4.42Å; F34-K46 HydrophobicContact CG-CB 4.49Å; F34-I49 HydrophobicContact CE2-CB 4.44Å; F34-I49 HydrophobicContact CE2-CG1 3.86Å; F34-I49 HydrophobicContact CZ-CG1 4.16Å; F34-F103 HydrophobicContact CE1-CD1 4.47Å; F34-I104 HydrophobicContact CE2-CD1 4.13Å; F34-I104 HydrophobicContact CZ-CD1 4.05Å; F34-I104 HydrophobicContact CZ-CG1 4.19Å
35	D	88.2	Confident	86.8	Confident	63 Å²	63	43.2 Å²	43.2	34%	0.337	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-66.4	-30	171.7	-55.2	-36.3	0	0	0	110.9	P32 F33 L37 G38 K46	P32-D35 WeakPolarHBondContact CA-OD2 2.83Å; P32-D35 WeakPolarHBondContact O-CB 3.34Å; P32-D35 PolarHBondContact O-N 2.75Å; F33-D35 VanDerWaalsContact C-N 3.27Å; F33-D35 PolarHBondContact O-N 3.09Å; D35-L37 PolarHBondContact O-N 3.45Å; D35-G38 PolarHBondContact O-N 3.27Å; D35-K46 WeakPolarHBondContact OD1-CD 3.3Å; D35-K46 IonicContact OD1-NZ 2.93Å; D35-K46 PolarHBondContact OD1-NZ 3.17Å; D35-K46 IonicContact OD2-NZ 2.7Å; D35-K46 PolarHBondContact OD2-NZ 3.02Å
36	C	90	Very high	86.6	Confident	16 Å²	16	41.4 Å²	41.4	11%	0.108	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-69.5	-20.9	175.8	-54.3	0	0	0	0	112.7	P32 F33 F34 F161 A164 L165	P32-C36 PolarHBondContact O-N 3.45Å; P32-C36 PolarHBondContact O-SG 3.2Å; F33-C36 WeakPolarHBondContact O-CB 3.38Å; F33-C36 PolarHBondContact O-N 3Å; F34-C36 PolarHBondContact O-N 3.31Å; C36-F161 HydrophobicContact CB-CD2 3.94Å; C36-F161 HydrophobicContact CB-CE2 3.96Å; C36-A164 HydrophobicContact CB-CB 3.79Å; C36-L165 HydrophobicContact CB-CD2 4.48Å
37	L	85	Confident	86.4	Confident	0 Å²	0	44 Å²	44	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-89.6	-9.9	177.3	-66.1	174.9	0	0	0	113.4	F33 F34 D35 F42 F103 L107 I124 P156 F161	F33-L37 HydrophobicContact CD1-CD1 4.28Å; F33-L37 HydrophobicContact CE1-CD1 3.83Å; F33-L37 HydrophobicContact CE1-CG 4.35Å; F34-L37 HydrophobicContact CD1-CD1 4.21Å; F34-L37 PolarHBondContact O-N 3.39Å; F34-L37 VanDerWaalsContact O-N 3.16Å; D35-L37 PolarHBondContact O-N 3.45Å; L37-F42 HydrophobicContact CB-CD1 4.41Å; L37-F42 HydrophobicContact CB-CD2 3.75Å; L37-F42 HydrophobicContact CB-CE2 3.89Å; L37-F42 HydrophobicContact CB-CG 4.05Å; L37-F42 HydrophobicContact CB-CZ 4.29Å; L37-F42 HydrophobicContact CD1-CD1 4.46Å; L37-F42 WeakPolarHBondContact O-CD2 3.37Å; L37-F42 WeakPolarHBondContact O-CE2 2.93Å; L37-F103 HydrophobicContact CD1-CE1 4.23Å; L37-L107 HydrophobicContact CD1-CD2 4.28Å; L37-L107 HydrophobicContact CD2-CD2 4.04Å; L37-I124 HydrophobicContact CD2-CD1 3.74Å; L37-P156 VanDerWaalsContact O-CD 3.26Å; L37-P156 WeakPolarHBondContact O-CD 3.37Å; L37-F161 HydrophobicContact CD2-CD2 3.78Å; L37-F161 HydrophobicContact CD2-CE2 3.58Å; L37-F161 HydrophobicContact CD2-CZ 4.45Å; L37-F161 HydrophobicContact CG-CE2 4.12Å
38	G	78.1	Confident	86.2	Confident	27 Å²	27	47.9 Å²	47.9	28%	0.278	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.1	103.6	-177.5	0	0	0	0	0	111.8	D35 T40 V41 F42	D35-G38 PolarHBondContact O-N 3.27Å; G38-T40 VanDerWaalsContact C-N 3.3Å; G38-T40 PolarHBondContact O-N 2.87Å; G38-T40 VanDerWaalsContact O-N 3.09Å; G38-V41 PolarHBondContact O-N 3.14Å; G38-F42 WeakPolarHBondContact O-CD2 3.49Å; G38-F42 PolarHBondContact O-N 3.35Å
39	S	67.1	Low	86.2	Confident	76 Å²	76	45.5 Å²	45.5	53%	0.531	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.6	-166.6	57.5	0	0	0	0	115.7
40	T	77.4	Confident	86.4	Confident	119 Å²	119	43.6 Å²	43.6	73%	0.73	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-40.4	-172.6	-47.1	0	0	0	0	112.8	G38	G38-T40 VanDerWaalsContact C-N 3.3Å; G38-T40 PolarHBondContact O-N 2.87Å; G38-T40 VanDerWaalsContact O-N 3.09Å
41	V	78	Confident	86.7	Confident	66 Å²	66	45 Å²	45	40%	0.4	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-30.7	-174.9	177.9	0	0	0	0	111.4	G38 A151 A154	G38-V41 PolarHBondContact O-N 3.14Å; V41-A151 HydrophobicContact CG1-CB 3.51Å; V41-A154 HydrophobicContact CB-CB 4.26Å; V41-A154 HydrophobicContact CG1-CB 4.3Å; V41-A154 HydrophobicContact CG2-CB 3.81Å
42	F	80.1	Confident	87	Confident	7 Å²	7	45.4 Å²	45.4	3%	0.031	29%	0.291	C	S	.	.	S	Bend	trans	-99.1	3.5	-177.6	-63.4	-86.3	0	0	0	113.7	F34 L37 G38 I45 K46	F34-F42 HydrophobicContact CB-CB 4.26Å; L37-F42 HydrophobicContact CB-CD1 4.41Å; L37-F42 HydrophobicContact CB-CD2 3.75Å; L37-F42 HydrophobicContact CB-CE2 3.89Å; L37-F42 HydrophobicContact CB-CG 4.05Å; L37-F42 HydrophobicContact CB-CZ 4.29Å; L37-F42 HydrophobicContact CD1-CD1 4.46Å; L37-F42 WeakPolarHBondContact O-CD2 3.37Å; L37-F42 WeakPolarHBondContact O-CE2 2.93Å; G38-F42 WeakPolarHBondContact O-CD2 3.49Å; G38-F42 PolarHBondContact O-N 3.35Å; F42-I45 HydrophobicContact CD1-CD1 3.67Å; F42-I45 HydrophobicContact CE1-CD1 4.35Å; F42-I45 WeakPolarHBondContact O-CB 3.31Å; F42-I45 PolarHBondContact O-N 3.09Å; F42-I45 VanDerWaalsContact O-N 3.16Å; F42-K46 PolarHBondContact O-N 3.13Å
43	A	84.7	Confident	87.4	Confident	44 Å²	44	43.6 Å²	43.6	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-57.3	-42.3	179.3	0	0	0	0	0	114.3	I45 K46 A47	A43-I45 VanDerWaalsContact C-N 3.28Å; A43-I45 PolarHBondContact O-N 3.18Å; A43-K46 PolarHBondContact O-N 3.45Å; A43-A47 PolarHBondContact O-N 2.87Å
44	P	84.9	Confident	87.8	Confident	90 Å²	90	47.6 Å²	47.6	58%	0.584	30%	0.303	S	S	*	.	H	α-helix	trans	-61.8	-36.6	176.9	-24.2	35.6	0	0	0	112.8	A47 D48	P44-A47 PolarHBondContact O-N 2.87Å; P44-D48 PolarHBondContact O-N 3.13Å
45	I	84.6	Confident	88.3	Confident	69 Å²	69	50.3 Å²	50.3	35%	0.354	32%	0.32	S	S	.	.	H	α-helix	trans	-68.4	-43.2	178.9	-62.4	160.5	0	0	0	110.1	F34 F42 A43 A47 D48 I49	F34-I45 HydrophobicContact CD1-CB 4.37Å; F34-I45 HydrophobicContact CD1-CG2 3.72Å; F34-I45 HydrophobicContact CE1-CB 4.47Å; F34-I45 HydrophobicContact CE1-CG2 3.38Å; F34-I45 HydrophobicContact CE2-CG2 4.38Å; F34-I45 HydrophobicContact CG-CG2 4.36Å; F34-I45 HydrophobicContact CZ-CG2 3.75Å; F42-I45 HydrophobicContact CD1-CD1 3.67Å; F42-I45 HydrophobicContact CE1-CD1 4.35Å; F42-I45 WeakPolarHBondContact O-CB 3.31Å; F42-I45 PolarHBondContact O-N 3.09Å; F42-I45 VanDerWaalsContact O-N 3.16Å; A43-I45 VanDerWaalsContact C-N 3.28Å; A43-I45 PolarHBondContact O-N 3.18Å; I45-A47 VanDerWaalsContact C-N 3.32Å; I45-A47 PolarHBondContact O-N 3.07Å; I45-D48 PolarHBondContact O-N 2.68Å; I45-I49 WeakPolarHBondContact O-CG1 3.49Å; I45-I49 PolarHBondContact O-N 3.38Å; I45-I49 VanDerWaalsContact O-N 3.12Å
46	K	90.5	Very high	88.8	Confident	60 Å²	60	47.3 Å²	47.3	26%	0.261	30%	0.304	S	S	.	.	H	α-helix	trans	-58.2	-45.6	173.9	-177.1	-178.4	179.9	178.9	0	111.5	P31 F34 D35 F42 A43 I49 V50	P31-K46 HydrophobicContact CB-CG 4.01Å; F34-K46 HydrophobicContact CB-CB 4.07Å; F34-K46 HydrophobicContact CD2-CB 4.42Å; F34-K46 HydrophobicContact CG-CB 4.49Å; D35-K46 WeakPolarHBondContact OD1-CD 3.3Å; D35-K46 IonicContact OD1-NZ 2.93Å; D35-K46 PolarHBondContact OD1-NZ 3.17Å; D35-K46 IonicContact OD2-NZ 2.7Å; D35-K46 PolarHBondContact OD2-NZ 3.02Å; F42-K46 PolarHBondContact O-N 3.13Å; A43-K46 PolarHBondContact O-N 3.45Å; K46-I49 PolarHBondContact O-N 2.74Å; K46-V50 VanDerWaalsContact O-CG2 3.3Å; K46-V50 WeakPolarHBondContact O-CG2 3.23Å; K46-V50 PolarHBondContact O-N 3.41Å
47	A	91.6	Very high	89.2	Confident	64 Å²	64	51 Å²	51	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-42.1	179.9	0	0	0	0	0	112.1	A43 P44 I45 V50 G51	A43-A47 PolarHBondContact O-N 2.87Å; P44-A47 PolarHBondContact O-N 2.87Å; I45-A47 VanDerWaalsContact C-N 3.32Å; I45-A47 PolarHBondContact O-N 3.07Å; A47-V50 PolarHBondContact O-N 3.14Å; A47-G51 PolarHBondContact O-N 3.36Å
48	D	91.7	Very high	89.9	Confident	83 Å²	83	54 Å²	54	44%	0.444	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-48	175.5	-178.5	77.5	0	0	0	112	P44 I45 V50 G51 N52	P44-D48 PolarHBondContact O-N 3.13Å; I45-D48 PolarHBondContact O-N 2.68Å; D48-V50 PolarHBondContact O-N 3.1Å; D48-G51 PolarHBondContact O-N 3.44Å; D48-N52 PolarHBondContact O-N 3.07Å; D48-N52 PolarHBondContact O-ND2 2.99Å; D48-N52 VanDerWaalsContact O-ND2 3.11Å; D48-N52 PolarHBondContact OD2-ND2 3.16Å
49	I	94.1	Very high	90.9	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-44	177.9	-64.1	-68.4	0	0	0	111.7	P31 F34 I45 K46 G51 N52 I53 L97	P31-I49 HydrophobicContact CG-CG2 4.31Å; F34-I49 HydrophobicContact CE2-CB 4.44Å; F34-I49 HydrophobicContact CE2-CG1 3.86Å; F34-I49 HydrophobicContact CZ-CG1 4.16Å; I45-I49 WeakPolarHBondContact O-CG1 3.49Å; I45-I49 PolarHBondContact O-N 3.38Å; I45-I49 VanDerWaalsContact O-N 3.12Å; K46-I49 PolarHBondContact O-N 2.74Å; I49-G51 VanDerWaalsContact C-N 3.33Å; I49-G51 PolarHBondContact O-N 2.97Å; I49-N52 PolarHBondContact O-N 3.36Å; I49-I53 HydrophobicContact CG2-CD1 3.88Å; I49-I53 VanDerWaalsContact O-CG1 3.29Å; I49-I53 WeakPolarHBondContact O-CG1 3.5Å; I49-I53 PolarHBondContact O-N 3.07Å; I49-L97 HydrophobicContact CD1-CD1 4Å; I49-L97 HydrophobicContact CG2-CD1 3.83Å
50	V	96.8	Very high	92.4	Very high	61 Å²	61	50.8 Å²	50.8	37%	0.37	31%	0.314	S	S	.	.	H	α-helix	trans	-62.2	-42.4	176	170.5	0	0	0	0	111	P31 K46 A47 D48 I53 T54	P31-V50 HydrophobicContact CB-CG2 3.65Å; P31-V50 HydrophobicContact CG-CG2 3.68Å; K46-V50 VanDerWaalsContact O-CG2 3.3Å; K46-V50 WeakPolarHBondContact O-CG2 3.23Å; K46-V50 PolarHBondContact O-N 3.41Å; A47-V50 PolarHBondContact O-N 3.14Å; D48-V50 PolarHBondContact O-N 3.1Å; V50-I53 PolarHBondContact O-N 3.02Å; V50-T54 WeakPolarHBondContact O-CB 3.34Å; V50-T54 PolarHBondContact O-N 3.34Å; V50-T54 PolarHBondContact O-OG1 2.83Å
51	G	98.1	Very high	93.4	Very high	33 Å²	33	48.8 Å²	48.8	34%	0.34	30%	0.299	S	S	.	.	H	α-helix	trans	-59.6	-47.5	176.2	0	0	0	0	0	111.7	A47 D48 I49 I53 T54 T55	A47-G51 PolarHBondContact O-N 3.36Å; D48-G51 PolarHBondContact O-N 3.44Å; I49-G51 VanDerWaalsContact C-N 3.33Å; I49-G51 PolarHBondContact O-N 2.97Å; G51-I53 PolarHBondContact O-N 3.2Å; G51-T54 WeakPolarHBondContact O-CB 3.3Å; G51-T54 PolarHBondContact O-N 2.96Å; G51-T55 PolarHBondContact O-N 2.86Å; G51-T55 PolarHBondContact O-OG1 3.28Å; G51-T55 VanDerWaalsContact O-OG1 3.13Å
52	N	98.4	Very high	94.3	Very high	16 Å²	16	49.9 Å²	49.9	9%	0.086	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-46.3	177.7	-71.2	-41.3	0	0	0	112.3	D48 I49 T54 T55 I56 A93 W96 L97	D48-N52 PolarHBondContact O-N 3.07Å; D48-N52 PolarHBondContact O-ND2 2.99Å; D48-N52 VanDerWaalsContact O-ND2 3.11Å; D48-N52 PolarHBondContact OD2-ND2 3.16Å; I49-N52 PolarHBondContact O-N 3.36Å; N52-T54 VanDerWaalsContact C-N 3.31Å; N52-T54 PolarHBondContact O-N 3.32Å; N52-T55 PolarHBondContact O-N 3.33Å; N52-I56 WeakPolarHBondContact O-CD1 3.34Å; N52-I56 VanDerWaalsContact O-CG1 3.24Å; N52-I56 WeakPolarHBondContact O-CG1 3.32Å; N52-I56 PolarHBondContact O-N 2.86Å; N52-I56 VanDerWaalsContact O-N 3.08Å; N52-A93 HydrophobicContact CB-CB 4.25Å; N52-A93 WeakPolarHBondContact CB-O 3.16Å; N52-A93 WeakPolarHBondContact OD1-CA 3.07Å; N52-A93 PolarHBondContact OD1-O 3.22Å; N52-W96 WeakPolarHBondContact ND2-CB 3.31Å; N52-L97 HydrophobicContact CB-CB 4.04Å
53	I	98.5	Very high	95.2	Very high	14 Å²	14	52.6 Å²	52.6	7%	0.072	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-43.9	175.9	-67.5	166.4	0	0	0	110.6	L24 V27 P31 I49 V50 G51 T55 I56 K57 L97	L24-I53 HydrophobicContact CD2-CG2 4.28Å; V27-I53 HydrophobicContact CB-CD1 4.21Å; V27-I53 HydrophobicContact CG2-CD1 4.07Å; V27-I53 HydrophobicContact CG2-CG1 3.95Å; V27-I53 HydrophobicContact CG2-CG2 4.48Å; V27-I53 WeakPolarHBondContact O-CD1 3.21Å; P31-I53 HydrophobicContact CG-CD1 4.13Å; I49-I53 HydrophobicContact CG2-CD1 3.88Å; I49-I53 VanDerWaalsContact O-CG1 3.29Å; I49-I53 WeakPolarHBondContact O-CG1 3.5Å; I49-I53 PolarHBondContact O-N 3.07Å; V50-I53 PolarHBondContact O-N 3.02Å; G51-I53 PolarHBondContact O-N 3.2Å; I53-T55 PolarHBondContact O-N 2.93Å; I53-I56 PolarHBondContact O-N 3.13Å; I53-K57 VanDerWaalsContact O-CB 3.26Å; I53-K57 WeakPolarHBondContact O-CB 3.44Å; I53-K57 PolarHBondContact O-N 2.95Å; I53-L97 HydrophobicContact CD1-CD1 4.35Å; I53-L97 HydrophobicContact CG1-CD1 3.97Å; I53-L97 HydrophobicContact CG1-CD2 3.9Å
54	T	98.5	Very high	95.8	Very high	84 Å²	84	52.9 Å²	52.9	52%	0.515	32%	0.323	S	S	.	.	H	α-helix	trans	-61.3	-44.8	179.5	-58.2	0	0	0	0	111.4	V50 G51 N52 K57 A58	V50-T54 WeakPolarHBondContact O-CB 3.34Å; V50-T54 PolarHBondContact O-N 3.34Å; V50-T54 PolarHBondContact O-OG1 2.83Å; G51-T54 WeakPolarHBondContact O-CB 3.3Å; G51-T54 PolarHBondContact O-N 2.96Å; N52-T54 VanDerWaalsContact C-N 3.31Å; N52-T54 PolarHBondContact O-N 3.32Å; T54-K57 PolarHBondContact O-N 3.11Å; T54-A58 WeakPolarHBondContact O-CB 3.24Å; T54-A58 PolarHBondContact O-N 3.28Å
55	T	98.7	Very high	96.4	Very high	60 Å²	60	53.1 Å²	53.1	37%	0.368	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-48.1	177.4	-61	0	0	0	0	111.8	G51 N52 I53 K57 A58 V59 A93	G51-T55 PolarHBondContact O-N 2.86Å; G51-T55 PolarHBondContact O-OG1 3.28Å; G51-T55 VanDerWaalsContact O-OG1 3.13Å; N52-T55 PolarHBondContact O-N 3.33Å; I53-T55 PolarHBondContact O-N 2.93Å; T55-K57 VanDerWaalsContact C-N 3.3Å; T55-K57 PolarHBondContact O-N 3.22Å; T55-A58 PolarHBondContact O-N 3.39Å; T55-V59 PolarHBondContact O-N 2.79Å; T55-A93 HydrophobicContact CG2-CB 3.79Å
56	I	98.8	Very high	97.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.3	-41	179.1	-58.5	157.8	0	0	0	110.4	L24 N52 I53 V59 F60 I73 A90 A93 L94 L97	L24-I56 HydrophobicContact CD1-CG2 4.4Å; L24-I56 HydrophobicContact CD2-CB 4.06Å; L24-I56 HydrophobicContact CD2-CG2 3.85Å; L24-I56 HydrophobicContact CG-CG2 4.45Å; N52-I56 WeakPolarHBondContact O-CD1 3.34Å; N52-I56 VanDerWaalsContact O-CG1 3.24Å; N52-I56 WeakPolarHBondContact O-CG1 3.32Å; N52-I56 PolarHBondContact O-N 2.86Å; N52-I56 VanDerWaalsContact O-N 3.08Å; I53-I56 PolarHBondContact O-N 3.13Å; I56-V59 PolarHBondContact O-N 3.01Å; I56-F60 WeakPolarHBondContact O-CB 3.5Å; I56-F60 PolarHBondContact O-N 3.48Å; I56-I73 HydrophobicContact CG2-CD1 4.08Å; I56-A90 HydrophobicContact CB-CB 4.39Å; I56-A90 HydrophobicContact CG1-CB 4.17Å; I56-A93 HydrophobicContact CD1-CB 4.39Å; I56-A93 HydrophobicContact CG1-CB 3.9Å; I56-L94 HydrophobicContact CD1-CB 3.75Å; I56-L94 HydrophobicContact CD1-CD1 4.1Å; I56-L94 HydrophobicContact CG1-CB 4.18Å; I56-L97 HydrophobicContact CD1-CB 4.45Å; I56-L97 HydrophobicContact CD1-CD2 3.56Å
57	K	98.6	Very high	97.4	Very high	95 Å²	95	53.5 Å²	53.5	41%	0.413	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-42.4	177.2	179	164.5	174.8	46.6	0	112.3	L24 I53 T54 T55 V59 F60 D61	L24-K57 HydrophobicContact CD1-CB 4.05Å; L24-K57 HydrophobicContact CD1-CG 4.49Å; I53-K57 VanDerWaalsContact O-CB 3.26Å; I53-K57 WeakPolarHBondContact O-CB 3.44Å; I53-K57 PolarHBondContact O-N 2.95Å; T54-K57 PolarHBondContact O-N 3.11Å; T55-K57 VanDerWaalsContact C-N 3.3Å; T55-K57 PolarHBondContact O-N 3.22Å; K57-V59 VanDerWaalsContact C-N 3.34Å; K57-V59 PolarHBondContact O-N 3.14Å; K57-F60 PolarHBondContact O-N 3.46Å; K57-D61 WeakPolarHBondContact CE-OD2 3.38Å; K57-D61 VanDerWaalsContact CG-OD2 3.31Å; K57-D61 WeakPolarHBondContact CG-OD2 3.38Å; K57-D61 IonicContact NZ-OD1 3.33Å; K57-D61 PolarHBondContact NZ-OD1 3.34Å; K57-D61 VanDerWaalsContact NZ-OD1 3.13Å; K57-D61 IonicContact NZ-OD2 2.65Å; K57-D61 PolarHBondContact NZ-OD2 2.7Å; K57-D61 WeakPolarHBondContact O-CB 3.41Å; K57-D61 VanDerWaalsContact O-CG 3.27Å; K57-D61 PolarHBondContact O-N 3.31Å
58	A	98.6	Very high	97.8	Very high	63 Å²	63	56.3 Å²	56.3	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-60.8	-42.8	177.3	0	0	0	0	0	111.9	T54 T55 S62	T54-A58 WeakPolarHBondContact O-CB 3.24Å; T54-A58 PolarHBondContact O-N 3.28Å; T55-A58 PolarHBondContact O-N 3.39Å; A58-S62 PolarHBondContact O-N 2.73Å
59	V	98.4	Very high	98.1	Very high	28 Å²	28	52.9 Å²	52.9	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-47.1	174.6	173.7	0	0	0	0	110.8	T55 I56 K57 D61 S62 F67 I73 A90	T55-V59 PolarHBondContact O-N 2.79Å; I56-V59 PolarHBondContact O-N 3.01Å; K57-V59 VanDerWaalsContact C-N 3.34Å; K57-V59 PolarHBondContact O-N 3.14Å; V59-D61 PolarHBondContact O-N 3Å; V59-S62 WeakPolarHBondContact O-CB 3.31Å; V59-S62 PolarHBondContact O-N 3.13Å; V59-S62 PolarHBondContact O-OG 3.34Å; V59-F67 HydrophobicContact CG1-CD1 4.38Å; V59-F67 HydrophobicContact CG1-CD2 4.28Å; V59-F67 HydrophobicContact CG1-CE1 4.16Å; V59-F67 HydrophobicContact CG1-CE2 4.11Å; V59-F67 HydrophobicContact CG1-CG 4.42Å; V59-F67 HydrophobicContact CG1-CZ 4.03Å; V59-F67 WeakPolarHBondContact O-CD2 3.48Å; V59-F67 WeakPolarHBondContact O-CE2 3.26Å; V59-I73 HydrophobicContact CG1-CG2 4.18Å; V59-A90 HydrophobicContact CB-CB 3.88Å; V59-A90 HydrophobicContact CG1-CB 4.18Å; V59-A90 HydrophobicContact CG2-CB 3.72Å
60	F	98.6	Very high	98.3	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-57.5	-49.1	177.3	173.3	-109.4	0	0	0	112.9	T20 R21 L24 I56 K57 S62 N63 P64 F67	T20-F60 HydrophobicContact CG2-CB 3.84Å; T20-F60 HydrophobicContact CG2-CD2 3.43Å; T20-F60 VanDerWaalsContact CG2-CD2 3.43Å; T20-F60 HydrophobicContact CG2-CE2 4.12Å; T20-F60 HydrophobicContact CG2-CG 3.69Å; R21-F60 HydrophobicContact CB-CE1 4.23Å; R21-F60 HydrophobicContact CB-CZ 3.82Å; R21-F60 HydrophobicContact CG-CZ 4.47Å; L24-F60 HydrophobicContact CD1-CB 4.04Å; L24-F60 HydrophobicContact CD1-CD1 4.15Å; L24-F60 HydrophobicContact CD1-CG 4.21Å; I56-F60 WeakPolarHBondContact O-CB 3.5Å; I56-F60 PolarHBondContact O-N 3.48Å; K57-F60 PolarHBondContact O-N 3.46Å; F60-S62 PolarHBondContact O-N 3.01Å; F60-N63 CarbonylContact O-C 3.53Å; F60-N63 VanDerWaalsContact O-C 3.25Å; F60-N63 PolarHBondContact O-N 2.87Å; F60-P64 HydrophobicContact CD2-CB 4.49Å; F60-P64 HydrophobicContact CE1-CB 4.31Å; F60-P64 HydrophobicContact CE1-CG 4.48Å; F60-P64 HydrophobicContact CE2-CB 3.83Å; F60-P64 HydrophobicContact CZ-CB 3.73Å; F60-P64 HydrophobicContact CZ-CG 4.37Å; F60-P64 WeakPolarHBondContact O-CA 3.45Å; F60-P64 WeakPolarHBondContact O-CD 3.47Å; F60-P64 WeakPolarHBondContact O-CG 3.46Å; F60-P64 VanDerWaalsContact O-N 3.11Å; F60-F67 HydrophobicContact CD2-CB 4.05Å; F60-F67 WeakPolarHBondContact CD2-O 3.48Å
61	D	98.4	Very high	98.4	Very high	78 Å²	78	52.1 Å²	52.1	42%	0.417	30%	0.297	S	S	.	.	H	α-helix	trans	-65.6	-22.7	-176.5	-71	-20.4	0	0	0	112.2	K57 V59 N63	K57-D61 WeakPolarHBondContact CE-OD2 3.38Å; K57-D61 VanDerWaalsContact CG-OD2 3.31Å; K57-D61 WeakPolarHBondContact CG-OD2 3.38Å; K57-D61 IonicContact NZ-OD1 3.33Å; K57-D61 PolarHBondContact NZ-OD1 3.34Å; K57-D61 VanDerWaalsContact NZ-OD1 3.13Å; K57-D61 IonicContact NZ-OD2 2.65Å; K57-D61 PolarHBondContact NZ-OD2 2.7Å; K57-D61 WeakPolarHBondContact O-CB 3.41Å; K57-D61 VanDerWaalsContact O-CG 3.27Å; K57-D61 PolarHBondContact O-N 3.31Å; V59-D61 PolarHBondContact O-N 3Å; D61-N63 VanDerWaalsContact C-N 3.32Å; D61-N63 PolarHBondContact O-N 3.47Å
62	S	98.3	Very high	98.4	Very high	89 Å²	89	54.6 Å²	54.6	62%	0.622	30%	0.299	S	S	*	.	H	α-helix	trans	-65.9	-31.8	175.6	77.1	0	0	0	0	113.4	A58 V59 F60 F67	A58-S62 PolarHBondContact O-N 2.73Å; V59-S62 WeakPolarHBondContact O-CB 3.31Å; V59-S62 PolarHBondContact O-N 3.13Å; V59-S62 PolarHBondContact O-OG 3.34Å; F60-S62 PolarHBondContact O-N 3.01Å; S62-F67 WeakPolarHBondContact OG-CE2 3.48Å
63	N	98.1	Very high	98.4	Very high	63 Å²	63	53.9 Å²	53.9	34%	0.337	30%	0.295	S	S	.	.			trans	-160.7	82.3	173.8	-167.5	-29.6	0	0	0	111.7	F60 D61 S65 R66 F67	F60-N63 CarbonylContact O-C 3.53Å; F60-N63 VanDerWaalsContact O-C 3.25Å; F60-N63 PolarHBondContact O-N 2.87Å; D61-N63 VanDerWaalsContact C-N 3.32Å; D61-N63 PolarHBondContact O-N 3.47Å; N63-S65 PolarHBondContact O-N 3.42Å; N63-S65 VanDerWaalsContact O-N 3.11Å; N63-S65 PolarHBondContact OD1-N 2.87Å; N63-S65 PolarHBondContact OD1-OG 2.86Å; N63-R66 HydrophobicContact CB-CB 3.93Å; N63-R66 VanDerWaalsContact CG-CB 3.45Å; N63-R66 PolarHBondContact O-N 2.98Å; N63-R66 VanDerWaalsContact O-N 3.13Å; N63-R66 WeakPolarHBondContact OD1-CB 3.3Å; N63-R66 PolarHBondContact OD1-N 3.42Å; N63-F67 HydrophobicContact CB-CD2 3.96Å; N63-F67 HydrophobicContact CB-CE2 3.86Å; N63-F67 WeakPolarHBondContact O-CD2 3.38Å; N63-F67 PolarHBondContact O-N 3.08Å
64	P	98.2	Very high	98.4	Very high	51 Å²	51	53.2 Å²	53.2	33%	0.331	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-27	-175.1	-29.5	37.2	0	0	0	114.9	F60 K68	F60-P64 HydrophobicContact CD2-CB 4.49Å; F60-P64 HydrophobicContact CE1-CB 4.31Å; F60-P64 HydrophobicContact CE1-CG 4.48Å; F60-P64 HydrophobicContact CE2-CB 3.83Å; F60-P64 HydrophobicContact CZ-CB 3.73Å; F60-P64 HydrophobicContact CZ-CG 4.37Å; F60-P64 WeakPolarHBondContact O-CA 3.45Å; F60-P64 WeakPolarHBondContact O-CD 3.47Å; F60-P64 WeakPolarHBondContact O-CG 3.46Å; F60-P64 VanDerWaalsContact O-N 3.11Å; P64-K68 PolarHBondContact O-N 3.34Å
65	S	97.5	Very high	98.5	Very high	95 Å²	95	53.1 Å²	53.1	66%	0.664	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-39.5	178.4	64.9	0	0	0	0	111.8	N63	N63-S65 PolarHBondContact O-N 3.42Å; N63-S65 VanDerWaalsContact O-N 3.11Å; N63-S65 PolarHBondContact OD1-N 2.87Å; N63-S65 PolarHBondContact OD1-OG 2.86Å
66	R	97.8	Very high	98.4	Very high	120 Å²	120	50.7 Å²	50.7	45%	0.453	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-43.6	172	-174	175.9	-178.9	173.7	1.2	111.1	N63 K68 K72	N63-R66 HydrophobicContact CB-CB 3.93Å; N63-R66 VanDerWaalsContact CG-CB 3.45Å; N63-R66 PolarHBondContact O-N 2.98Å; N63-R66 VanDerWaalsContact O-N 3.13Å; N63-R66 WeakPolarHBondContact OD1-CB 3.3Å; N63-R66 PolarHBondContact OD1-N 3.42Å; R66-K68 VanDerWaalsContact C-N 3.35Å; R66-K68 PolarHBondContact O-N 2.9Å; R66-K72 WeakPolarHBondContact O-CB 3.42Å; R66-K72 VanDerWaalsContact O-CD 3.27Å; R66-K72 WeakPolarHBondContact O-CD 3.37Å
67	F	98.5	Very high	98.4	Very high	17 Å²	17	51.1 Å²	51.1	8%	0.075	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	32.7	-173.4	-57.7	-57.8	0	0	0	113.9	T20 V59 F60 S62 N63 T69 I73 A76	T20-F67 VanDerWaalsContact CB-O 3.28Å; T20-F67 WeakPolarHBondContact CB-O 3.4Å; T20-F67 PolarHBondContact OG1-O 2.9Å; V59-F67 HydrophobicContact CG1-CD1 4.38Å; V59-F67 HydrophobicContact CG1-CD2 4.28Å; V59-F67 HydrophobicContact CG1-CE1 4.16Å; V59-F67 HydrophobicContact CG1-CE2 4.11Å; V59-F67 HydrophobicContact CG1-CG 4.42Å; V59-F67 HydrophobicContact CG1-CZ 4.03Å; V59-F67 WeakPolarHBondContact O-CD2 3.48Å; V59-F67 WeakPolarHBondContact O-CE2 3.26Å; F60-F67 HydrophobicContact CD2-CB 4.05Å; F60-F67 WeakPolarHBondContact CD2-O 3.48Å; S62-F67 WeakPolarHBondContact OG-CE2 3.48Å; N63-F67 HydrophobicContact CB-CD2 3.96Å; N63-F67 HydrophobicContact CB-CE2 3.86Å; N63-F67 WeakPolarHBondContact O-CD2 3.38Å; N63-F67 PolarHBondContact O-N 3.08Å; F67-T69 PolarHBondContact O-N 3.4Å; F67-T69 VanDerWaalsContact O-N 3.15Å; F67-I73 HydrophobicContact CB-CG1 3.89Å; F67-I73 HydrophobicContact CD1-CB 4.4Å; F67-I73 HydrophobicContact CD1-CG1 3.86Å; F67-I73 HydrophobicContact CG-CG1 4.19Å; F67-A76 HydrophobicContact CD1-CB 4.42Å; F67-A76 HydrophobicContact CE1-CB 3.64Å; F67-A76 HydrophobicContact CZ-CB 4.49Å
68	K	98.3	Very high	98.4	Very high	122 Å²	122	51.2 Å²	51.2	53%	0.53	27%	0.273	S	S	.	.	S	Bend	trans	-56.7	-32.4	-174.9	-174.6	177.7	179.5	-177.4	0	113.8	T20 P64 R66	T20-K68 PolarHBondContact N-O 3.4Å; T20-K68 PolarHBondContact OG1-O 3.49Å; P64-K68 PolarHBondContact O-N 3.34Å; R66-K68 VanDerWaalsContact C-N 3.35Å; R66-K68 PolarHBondContact O-N 2.9Å
69	T	98.7	Very high	98.4	Very high	11 Å²	11	55.5 Å²	55.5	7%	0.067	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-128.7	155.4	178.4	63.2	0	0	0	0	110.5	Q17 V18 T20 F67 Q71 K72 I73	Q17-T69 HydrophobicContact CB-CG2 4.22Å; Q17-T69 PolarHBondContact OE1-OG1 3.16Å; V18-T69 CarbonylContact O-C 3.48Å; V18-T69 WeakPolarHBondContact O-CA 3.45Å; V18-T69 VanDerWaalsContact O-CB 3.32Å; V18-T69 WeakPolarHBondContact O-CB 3.41Å; T20-T69 VanDerWaalsContact OG1-CA 3.3Å; T20-T69 WeakPolarHBondContact OG1-CA 3.29Å; T20-T69 PolarHBondContact OG1-N 2.98Å; T20-T69 PolarHBondContact OG1-O 3.48Å; F67-T69 PolarHBondContact O-N 3.4Å; F67-T69 VanDerWaalsContact O-N 3.15Å; T69-Q71 PolarHBondContact O-N 3.06Å; T69-K72 WeakPolarHBondContact O-CB 3.46Å; T69-K72 PolarHBondContact O-N 3.06Å; T69-K72 WeakPolarHBondContact OG1-CG 3.36Å; T69-I73 PolarHBondContact O-N 3.38Å
70	L	98.8	Very high	98.4	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-35.4	178.9	-60.9	-178.5	0	0	0	111.4	V18 T20 F23 K72 I73 L74 L94 I194 M197	V18-L70 HydrophobicContact CB-CD1 3.85Å; V18-L70 HydrophobicContact CB-CG 4.11Å; V18-L70 HydrophobicContact CG1-CD1 3.54Å; V18-L70 HydrophobicContact CG1-CG 4Å; V18-L70 PolarHBondContact O-N 3.24Å; T20-L70 HydrophobicContact CG2-CD2 4.05Å; T20-L70 PolarHBondContact OG1-N 3.3Å; F23-L70 HydrophobicContact CD1-CD1 3.88Å; F23-L70 HydrophobicContact CD1-CD2 3.98Å; F23-L70 HydrophobicContact CD1-CG 4.46Å; F23-L70 HydrophobicContact CD2-CD1 4.21Å; F23-L70 HydrophobicContact CE1-CD1 4.05Å; F23-L70 HydrophobicContact CE1-CD2 4.44Å; F23-L70 HydrophobicContact CE2-CD1 4.38Å; F23-L70 HydrophobicContact CG-CD1 3.95Å; F23-L70 HydrophobicContact CZ-CD1 4.28Å; L70-K72 VanDerWaalsContact C-N 3.33Å; L70-K72 PolarHBondContact O-N 2.94Å; L70-I73 HydrophobicContact CD2-CD1 4.14Å; L70-I73 WeakPolarHBondContact O-CB 3.32Å; L70-I73 PolarHBondContact O-N 2.74Å; L70-I73 VanDerWaalsContact O-N 3.13Å; L70-L74 WeakPolarHBondContact O-CD1 3.33Å; L70-L74 PolarHBondContact O-N 3.42Å; L70-L94 HydrophobicContact CB-CD2 4.06Å; L70-L94 HydrophobicContact CD1-CD1 4.26Å; L70-L94 HydrophobicContact CD1-CD2 3.99Å; L70-L94 HydrophobicContact CD2-CD2 4.23Å; L70-L94 HydrophobicContact CG-CD2 4.32Å; L70-I194 HydrophobicContact CD1-CD1 3.74Å; L70-I194 HydrophobicContact CD1-CG1 3.84Å; L70-M197 HydrophobicContact CB-CE 3.98Å; L70-M197 HydrophobicContact CB-SD 4.3Å
71	Q	98.5	Very high	98.3	Very high	50 Å²	50	63.2 Å²	63.2	23%	0.234	32%	0.32	C	S	.	.	H	α-helix	trans	-55	-47.2	173	-179.3	67.9	34.5	0	0	111.7	T69 I73 L74 E75 M197 M201	T69-Q71 PolarHBondContact O-N 3.06Å; Q71-I73 VanDerWaalsContact C-N 3.26Å; Q71-I73 PolarHBondContact O-N 3.22Å; Q71-L74 PolarHBondContact O-N 3.22Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.44Å; Q71-E75 PolarHBondContact NE2-OE1 2.99Å; Q71-E75 WeakPolarHBondContact O-CG 3.4Å; Q71-E75 PolarHBondContact O-N 3.41Å; Q71-M197 VanDerWaalsContact CA-SD 3.51Å; Q71-M197 HydrophobicContact CB-SD 3.98Å; Q71-M197 PolarHBondContact N-SD 3.07Å; Q71-M197 PolarHBondContact OE1-SD 3.13Å; Q71-M197 VanDerWaalsContact OE1-SD 3.4Å; Q71-M201 PolarHBondContact NE2-SD 3.44Å
72	K	98.6	Very high	98.3	Very high	85 Å²	85	61.7 Å²	61.7	37%	0.37	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-27.3	178.9	-71.9	-171.8	176.7	-163.1	0	113.4	R66 T69 L70 A76	R66-K72 WeakPolarHBondContact O-CB 3.42Å; R66-K72 VanDerWaalsContact O-CD 3.27Å; R66-K72 WeakPolarHBondContact O-CD 3.37Å; T69-K72 WeakPolarHBondContact O-CB 3.46Å; T69-K72 PolarHBondContact O-N 3.06Å; T69-K72 WeakPolarHBondContact OG1-CG 3.36Å; L70-K72 VanDerWaalsContact C-N 3.33Å; L70-K72 PolarHBondContact O-N 2.94Å; K72-A76 WeakPolarHBondContact O-CB 3.48Å; K72-A76 PolarHBondContact O-N 3.34Å; K72-A76 VanDerWaalsContact O-N 3.08Å
73	I	98.8	Very high	98.2	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-52.9	172.1	-63.2	176.6	0	0	0	109.4	T20 I56 V59 F67 T69 L70 Q71 E75 A76 E77 A90	T20-I73 HydrophobicContact CG2-CD1 3.8Å; I56-I73 HydrophobicContact CG2-CD1 4.08Å; V59-I73 HydrophobicContact CG1-CG2 4.18Å; F67-I73 HydrophobicContact CB-CG1 3.89Å; F67-I73 HydrophobicContact CD1-CB 4.4Å; F67-I73 HydrophobicContact CD1-CG1 3.86Å; F67-I73 HydrophobicContact CG-CG1 4.19Å; T69-I73 PolarHBondContact O-N 3.38Å; L70-I73 HydrophobicContact CD2-CD1 4.14Å; L70-I73 WeakPolarHBondContact O-CB 3.32Å; L70-I73 PolarHBondContact O-N 2.74Å; L70-I73 VanDerWaalsContact O-N 3.13Å; Q71-I73 VanDerWaalsContact C-N 3.26Å; Q71-I73 PolarHBondContact O-N 3.22Å; I73-E75 VanDerWaalsContact C-N 3.33Å; I73-E75 PolarHBondContact O-N 3.48Å; I73-A76 PolarHBondContact O-N 2.91Å; I73-E77 HydrophobicContact CG2-CG 4.49Å; I73-E77 WeakPolarHBondContact O-CB 3.34Å; I73-E77 PolarHBondContact O-N 3.21Å; I73-A90 HydrophobicContact CG2-CB 3.59Å
74	L	98.8	Very high	98.2	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.6	-41.6	-178.8	-87.2	64.5	0	0	0	111.7	L70 Q71 K78 W85 T91 L94 M197 Y198 M201 A203	L70-L74 WeakPolarHBondContact O-CD1 3.33Å; L70-L74 PolarHBondContact O-N 3.42Å; Q71-L74 PolarHBondContact O-N 3.22Å; L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 PolarHBondContact O-N 2.9Å; L74-W85 PolarHBondContact O-NE1 3.43Å; L74-T91 HydrophobicContact CD1-CG2 4.46Å; L74-T91 HydrophobicContact CD2-CG2 4.49Å; L74-T91 HydrophobicContact CG-CG2 3.94Å; L74-L94 HydrophobicContact CD1-CD2 4.06Å; L74-M197 HydrophobicContact CD1-CE 4.14Å; L74-M197 HydrophobicContact CD2-CE 3.94Å; L74-M197 HydrophobicContact CD2-CG 4.09Å; L74-M197 HydrophobicContact CD2-SD 4.24Å; L74-Y198 HydrophobicContact CD1-CE2 4.48Å; L74-Y198 HydrophobicContact CD2-CD2 4.19Å; L74-Y198 HydrophobicContact CD2-CE1 4.49Å; L74-Y198 HydrophobicContact CD2-CE2 3.95Å; L74-M201 HydrophobicContact CB-CE 3.62Å; L74-M201 HydrophobicContact CB-SD 3.5Å; L74-M201 VanDerWaalsContact CB-SD 3.5Å; L74-M201 HydrophobicContact CD2-SD 3.6Å; L74-M201 VanDerWaalsContact CD2-SD 3.6Å; L74-M201 HydrophobicContact CG-SD 4.21Å; L74-A203 HydrophobicContact CD2-CB 3.96Å
75	E	98.6	Very high	98.2	Very high	82 Å²	82	63.6 Å²	63.6	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-49.9	178.2	-72.2	167.8	173.7	0	0	111.5	Q71 I73 K78 E79 M201	Q71-E75 WeakPolarHBondContact CG-OE1 3.44Å; Q71-E75 PolarHBondContact NE2-OE1 2.99Å; Q71-E75 WeakPolarHBondContact O-CG 3.4Å; Q71-E75 PolarHBondContact O-N 3.41Å; I73-E75 VanDerWaalsContact C-N 3.33Å; I73-E75 PolarHBondContact O-N 3.48Å; E75-K78 WeakPolarHBondContact O-CB 3.44Å; E75-K78 PolarHBondContact O-N 3.41Å; E75-E79 WeakPolarHBondContact O-CG 3.35Å; E75-E79 PolarHBondContact O-N 3.38Å; E75-E79 VanDerWaalsContact O-N 3.08Å; E75-M201 HydrophobicContact CB-CE 4.44Å; E75-M201 HydrophobicContact CG-CE 3.61Å
76	A	98.5	Very high	98.2	Very high	8 Å²	8	59.9 Å²	59.9	7%	0.066	31%	0.309	C	S	.	.	H	α-helix	trans	-67.4	-38.3	-179.1	0	0	0	0	0	113	F67 K72 I73 E79 L80	F67-A76 HydrophobicContact CD1-CB 4.42Å; F67-A76 HydrophobicContact CE1-CB 3.64Å; F67-A76 HydrophobicContact CZ-CB 4.49Å; K72-A76 WeakPolarHBondContact O-CB 3.48Å; K72-A76 PolarHBondContact O-N 3.34Å; K72-A76 VanDerWaalsContact O-N 3.08Å; I73-A76 PolarHBondContact O-N 2.91Å; A76-E79 PolarHBondContact O-N 3.35Å; A76-L80 VanDerWaalsContact O-CB 3.29Å; A76-L80 WeakPolarHBondContact O-CB 3.22Å; A76-L80 PolarHBondContact O-N 3.13Å
77	E	98.5	Very high	98.2	Very high	9 Å²	9	60 Å²	60	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-34.2	175.3	-76.5	-168.7	160.5	0	0	112.1	I73 L80 H81 G89 A90 T91	I73-E77 HydrophobicContact CG2-CG 4.49Å; I73-E77 WeakPolarHBondContact O-CB 3.34Å; I73-E77 PolarHBondContact O-N 3.21Å; E77-L80 PolarHBondContact O-N 2.87Å; E77-H81 WeakPolarHBondContact O-CB 3.42Å; E77-H81 PolarHBondContact O-CD2 2.8Å; E77-H81 VanDerWaalsContact O-CD2 3.26Å; E77-H81 PolarHBondContact O-N 3.49Å; E77-G89 WeakPolarHBondContact OE1-CA 3.43Å; E77-A90 WeakPolarHBondContact OE1-CB 3.36Å; E77-A90 PolarHBondContact OE1-N 3.49Å; E77-A90 PolarHBondContact OE2-N 3.46Å; E77-T91 WeakPolarHBondContact OE2-CA 3.49Å; E77-T91 WeakPolarHBondContact OE2-CB 3.5Å; E77-T91 PolarHBondContact OE2-N 3.36Å; E77-T91 PolarHBondContact OE2-OG1 3.44Å
78	K	98.5	Very high	98.2	Very high	98 Å²	98	60.5 Å²	60.5	43%	0.426	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-44.9	173.5	-175.8	174.6	-178.1	172.8	0	111.6	L74 E75 G82 W85	L74-K78 WeakPolarHBondContact O-CB 3.36Å; L74-K78 PolarHBondContact O-N 2.9Å; E75-K78 WeakPolarHBondContact O-CB 3.44Å; E75-K78 PolarHBondContact O-N 3.41Å; K78-G82 PolarHBondContact O-N 3.12Å; K78-W85 VanDerWaalsContact CA-CD1 3.47Å; K78-W85 HydrophobicContact CB-CD2 3.76Å; K78-W85 HydrophobicContact CB-CE3 4.37Å; K78-W85 HydrophobicContact CB-CG 3.86Å; K78-W85 HydrophobicContact CB-CZ2 4.35Å; K78-W85 HydrophobicContact CD-CD2 4.2Å; K78-W85 HydrophobicContact CD-CE3 3.99Å; K78-W85 HydrophobicContact CD-CH2 4.11Å; K78-W85 HydrophobicContact CD-CZ2 4.29Å; K78-W85 HydrophobicContact CD-CZ3 3.96Å; K78-W85 HydrophobicContact CG-CD2 3.78Å; K78-W85 HydrophobicContact CG-CE3 3.9Å; K78-W85 HydrophobicContact CG-CG 4.14Å; K78-W85 HydrophobicContact CG-CZ3 4.38Å
79	E	98.1	Very high	98.2	Very high	152 Å²	152	56.3 Å²	56.3	71%	0.71	31%	0.309	S	S	*	.	H	α-helix	trans	-64	-42.1	174.9	-70.5	173.3	176.3	0	0	112.2	E75 A76	E75-E79 WeakPolarHBondContact O-CG 3.35Å; E75-E79 PolarHBondContact O-N 3.38Å; E75-E79 VanDerWaalsContact O-N 3.08Å; A76-E79 PolarHBondContact O-N 3.35Å
80	L	97.9	Very high	98.2	Very high	128 Å²	128	55.9 Å²	55.9	67%	0.67	31%	0.306	S	S	*	.	H	α-helix	trans	-71.2	-40.4	-175.7	-179.4	61.6	0	0	0	113.1	A76 E77	A76-L80 VanDerWaalsContact O-CB 3.29Å; A76-L80 WeakPolarHBondContact O-CB 3.22Å; A76-L80 PolarHBondContact O-N 3.13Å; E77-L80 PolarHBondContact O-N 2.87Å
81	H	97.8	Very high	98.2	Very high	68 Å²	68	55.9 Å²	55.9	32%	0.315	31%	0.306	S	S	.	.	H	α-helix	trans	-104	-9.8	-170.6	-63.7	-68	0	0	0	114.1	E77 A83 D84 W85 V88	E77-H81 WeakPolarHBondContact O-CB 3.42Å; E77-H81 PolarHBondContact O-CD2 2.8Å; E77-H81 VanDerWaalsContact O-CD2 3.26Å; E77-H81 PolarHBondContact O-N 3.49Å; H81-A83 PolarHBondContact O-N 3.48Å; H81-D84 HydrophobicContact CB-CB 4.42Å; H81-D84 PolarHBondContact O-N 2.84Å; H81-D84 VanDerWaalsContact O-N 3.09Å; H81-W85 HydrophobicContact CB-CB 4.39Å; H81-V88 HydrophobicContact CB-CG2 3.82Å
82	G	97.3	Very high	98.2	Very high	46 Å²	46	55.2 Å²	55.2	47%	0.474	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	52.9	-115	174.3	0	0	0	0	0	112.7	K78 D84 W85	K78-G82 PolarHBondContact O-N 3.12Å; G82-D84 VanDerWaalsContact C-N 3.29Å; G82-D84 PolarHBondContact O-N 3.11Å; G82-W85 WeakPolarHBondContact O-CB 3.47Å; G82-W85 PolarHBondContact O-N 3.35Å
83	A	97.2	Very high	98.2	Very high	103 Å²	103	51.4 Å²	51.4	85%	0.851	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-68.8	-20.9	-175.7	0	0	0	0	0	114.7	H81 W85	H81-A83 PolarHBondContact O-N 3.48Å; A83-W85 VanDerWaalsContact C-N 3.32Å
84	D	97.6	Very high	98.2	Very high	113 Å²	113	51.4 Å²	51.4	60%	0.604	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-79.8	-18.6	179.1	-64.3	-36.6	0	0	0	112.2	H81 G82 K87 V88	H81-D84 HydrophobicContact CB-CB 4.42Å; H81-D84 PolarHBondContact O-N 2.84Å; H81-D84 VanDerWaalsContact O-N 3.09Å; G82-D84 VanDerWaalsContact C-N 3.29Å; G82-D84 PolarHBondContact O-N 3.11Å; D84-K87 PolarHBondContact O-N 3.03Å; D84-K87 VanDerWaalsContact O-N 3.09Å; D84-V88 HydrophobicContact CB-CG1 3.82Å
85	W	98.4	Very high	98.2	Very high	27 Å²	27	51.5 Å²	51.5	10%	0.102	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	139.4	174.6	-173.1	92.8	0	0	0	110.9	L74 K78 H81 G82 A83 V88 T91 M201 A203	L74-W85 PolarHBondContact O-NE1 3.43Å; K78-W85 VanDerWaalsContact CA-CD1 3.47Å; K78-W85 HydrophobicContact CB-CD2 3.76Å; K78-W85 HydrophobicContact CB-CE3 4.37Å; K78-W85 HydrophobicContact CB-CG 3.86Å; K78-W85 HydrophobicContact CB-CZ2 4.35Å; K78-W85 HydrophobicContact CD-CD2 4.2Å; K78-W85 HydrophobicContact CD-CE3 3.99Å; K78-W85 HydrophobicContact CD-CH2 4.11Å; K78-W85 HydrophobicContact CD-CZ2 4.29Å; K78-W85 HydrophobicContact CD-CZ3 3.96Å; K78-W85 HydrophobicContact CG-CD2 3.78Å; K78-W85 HydrophobicContact CG-CE3 3.9Å; K78-W85 HydrophobicContact CG-CG 4.14Å; K78-W85 HydrophobicContact CG-CZ3 4.38Å; H81-W85 HydrophobicContact CB-CB 4.39Å; G82-W85 WeakPolarHBondContact O-CB 3.47Å; G82-W85 PolarHBondContact O-N 3.35Å; A83-W85 VanDerWaalsContact C-N 3.32Å; W85-V88 HydrophobicContact CB-CG2 4.4Å; W85-T91 HydrophobicContact CZ2-CG2 4.25Å; W85-T91 PolarHBondContact NE1-OG1 2.94Å; W85-M201 HydrophobicContact CH2-CB 4.2Å; W85-M201 VanDerWaalsContact CH2-O 3.29Å; W85-M201 WeakPolarHBondContact CH2-O 3.36Å; W85-A203 HydrophobicContact CH2-CB 3.46Å; W85-A203 VanDerWaalsContact CH2-CB 3.46Å; W85-A203 HydrophobicContact CZ2-CB 3.51Å; W85-A203 HydrophobicContact CZ3-CB 4.49Å
86	P	98.1	Very high	98.2	Very high	17 Å²	17	48.9 Å²	48.9	11%	0.11	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	cis	-96.5	10.6	11.3	37.3	-37	0	0	0	115.4	V88 T91 A203 L205	P86-V88 PolarHBondContact O-N 3.41Å; P86-T91 HydrophobicContact CB-CG2 3.69Å; P86-A203 HydrophobicContact CB-CB 4.16Å; P86-A203 WeakPolarHBondContact CG-O 3.47Å; P86-L205 HydrophobicContact CG-CD1 4.1Å; P86-L205 HydrophobicContact CG-CD2 3.72Å; P86-L205 HydrophobicContact CG-CG 3.82Å
87	K	97.9	Very high	98.2	Very high	123 Å²	123	48.5 Å²	48.5	54%	0.535	27%	0.272	S	S	.	.	S	Bend	trans	-84.7	40.8	-174	-156.2	-178.8	177.9	-178.8	0	113	D84 L92 L205	D84-K87 PolarHBondContact O-N 3.03Å; D84-K87 VanDerWaalsContact O-N 3.09Å; K87-L92 HydrophobicContact CG-CD1 4.3Å; K87-L92 HydrophobicContact CG-CD2 4.15Å; K87-L205 HydrophobicContact CB-CD1 3.73Å; K87-L205 HydrophobicContact CD-CD1 4.4Å; K87-L205 HydrophobicContact CG-CD1 3.81Å
88	V	97.7	Very high	98.2	Very high	28 Å²	28	48.1 Å²	48.1	17%	0.17	27%	0.27	C	S	.	.	S	Bend	trans	-143.8	157	-174	-66.4	0	0	0	0	111.7	H81 D84 W85 P86 L92	H81-V88 HydrophobicContact CB-CG2 3.82Å; D84-V88 HydrophobicContact CB-CG1 3.82Å; W85-V88 HydrophobicContact CB-CG2 4.4Å; P86-V88 PolarHBondContact O-N 3.41Å; V88-L92 WeakPolarHBondContact O-CB 3.24Å; V88-L92 PolarHBondContact O-N 2.99Å
89	G	97.9	Very high	98.1	Very high	34 Å²	34	43.4 Å²	43.4	35%	0.351	25%	0.25	S	S	.	.	H	α-helix	trans	56.5	-148	162.4	0	0	0	0	0	116.4	E77 T91 L92 A93	E77-G89 WeakPolarHBondContact OE1-CA 3.43Å; G89-T91 VanDerWaalsContact C-N 3.28Å; G89-T91 PolarHBondContact O-N 3.5Å; G89-L92 PolarHBondContact O-N 3.22Å; G89-A93 PolarHBondContact O-N 3.39Å; G89-A93 VanDerWaalsContact O-N 3.13Å
90	A	98.6	Very high	98.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-25.6	177.7	0	0	0	0	0	112.7	I56 V59 I73 E77 A93 L94	I56-A90 HydrophobicContact CB-CB 4.39Å; I56-A90 HydrophobicContact CG1-CB 4.17Å; V59-A90 HydrophobicContact CB-CB 3.88Å; V59-A90 HydrophobicContact CG1-CB 4.18Å; V59-A90 HydrophobicContact CG2-CB 3.72Å; I73-A90 HydrophobicContact CG2-CB 3.59Å; E77-A90 WeakPolarHBondContact OE1-CB 3.36Å; E77-A90 PolarHBondContact OE1-N 3.49Å; E77-A90 PolarHBondContact OE2-N 3.46Å; A90-A93 PolarHBondContact O-N 2.77Å; A90-L94 WeakPolarHBondContact O-CB 3.47Å; A90-L94 PolarHBondContact O-N 2.9Å
91	T	98.8	Very high	98	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-47.8	172.5	-60.6	0	0	0	0	110.3	L74 E77 W85 P86 G89 M95 Y198 A203	L74-T91 HydrophobicContact CD1-CG2 4.46Å; L74-T91 HydrophobicContact CD2-CG2 4.49Å; L74-T91 HydrophobicContact CG-CG2 3.94Å; E77-T91 WeakPolarHBondContact OE2-CA 3.49Å; E77-T91 WeakPolarHBondContact OE2-CB 3.5Å; E77-T91 PolarHBondContact OE2-N 3.36Å; E77-T91 PolarHBondContact OE2-OG1 3.44Å; W85-T91 HydrophobicContact CZ2-CG2 4.25Å; W85-T91 PolarHBondContact NE1-OG1 2.94Å; P86-T91 HydrophobicContact CB-CG2 3.69Å; G89-T91 VanDerWaalsContact C-N 3.28Å; G89-T91 PolarHBondContact O-N 3.5Å; T91-M95 WeakPolarHBondContact O-CB 3.42Å; T91-M95 PolarHBondContact O-N 2.92Å; T91-M95 VanDerWaalsContact O-N 3.11Å; T91-Y198 HydrophobicContact CG2-CE1 4.35Å; T91-Y198 PolarHBondContact O-OH 3.41Å; T91-A203 HydrophobicContact CG2-CB 4.36Å
92	L	98.7	Very high	98	Very high	37 Å²	37	29 Å²	29	19%	0.194	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-42.8	177	-177.1	60.3	0	0	0	111.3	K87 V88 G89 L94 M95 W96 Y207	K87-L92 HydrophobicContact CG-CD1 4.3Å; K87-L92 HydrophobicContact CG-CD2 4.15Å; V88-L92 WeakPolarHBondContact O-CB 3.24Å; V88-L92 PolarHBondContact O-N 2.99Å; G89-L92 PolarHBondContact O-N 3.22Å; L92-L94 PolarHBondContact O-N 2.94Å; L92-M95 HydrophobicContact CD1-CE 3.51Å; L92-M95 VanDerWaalsContact O-CB 3.32Å; L92-M95 WeakPolarHBondContact O-CB 3.48Å; L92-M95 PolarHBondContact O-N 3.2Å; L92-W96 PolarHBondContact O-N 3.01Å; L92-Y207 HydrophobicContact CD1-CE1 4.33Å
93	A	98.7	Very high	98	Very high	5 Å²	5	27.3 Å²	27.3	4%	0.041	16%	0.159	C	C	.	.	H	α-helix	trans	-61.6	-45.2	179	0	0	0	0	0	112.5	N52 T55 I56 G89 A90 M95 W96 L97	N52-A93 HydrophobicContact CB-CB 4.25Å; N52-A93 WeakPolarHBondContact CB-O 3.16Å; N52-A93 WeakPolarHBondContact OD1-CA 3.07Å; N52-A93 PolarHBondContact OD1-O 3.22Å; T55-A93 HydrophobicContact CG2-CB 3.79Å; I56-A93 HydrophobicContact CD1-CB 4.39Å; I56-A93 HydrophobicContact CG1-CB 3.9Å; G89-A93 PolarHBondContact O-N 3.39Å; G89-A93 VanDerWaalsContact O-N 3.13Å; A90-A93 PolarHBondContact O-N 2.77Å; A93-M95 VanDerWaalsContact C-N 3.26Å; A93-M95 PolarHBondContact O-N 3.25Å; A93-W96 PolarHBondContact O-N 3.12Å; A93-L97 WeakPolarHBondContact O-CB 3.37Å; A93-L97 PolarHBondContact O-N 2.77Å
94	L	98.8	Very high	98	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-67.4	-28.7	177.5	176.9	66.1	0	0	0	111.8	F23 I56 L70 L74 A90 L92 L97 K98 I194 M197 Y198	F23-L94 HydrophobicContact CE1-CD1 3.9Å; F23-L94 HydrophobicContact CZ-CD1 3.96Å; I56-L94 HydrophobicContact CD1-CB 3.75Å; I56-L94 HydrophobicContact CD1-CD1 4.1Å; I56-L94 HydrophobicContact CG1-CB 4.18Å; L70-L94 HydrophobicContact CB-CD2 4.06Å; L70-L94 HydrophobicContact CD1-CD1 4.26Å; L70-L94 HydrophobicContact CD1-CD2 3.99Å; L70-L94 HydrophobicContact CD2-CD2 4.23Å; L70-L94 HydrophobicContact CG-CD2 4.32Å; L74-L94 HydrophobicContact CD1-CD2 4.06Å; A90-L94 WeakPolarHBondContact O-CB 3.47Å; A90-L94 PolarHBondContact O-N 2.9Å; L92-L94 PolarHBondContact O-N 2.94Å; L94-L97 HydrophobicContact CD1-CD2 4.33Å; L94-L97 PolarHBondContact O-N 3.43Å; L94-K98 WeakPolarHBondContact O-CB 3.15Å; L94-K98 WeakPolarHBondContact O-CG 3.27Å; L94-K98 PolarHBondContact O-N 3.49Å; L94-I194 HydrophobicContact CD1-CD1 4.46Å; L94-I194 HydrophobicContact CD1-CG2 4.31Å; L94-I194 HydrophobicContact CD2-CG2 4.32Å; L94-I194 HydrophobicContact CG-CG2 4.25Å; L94-M197 HydrophobicContact CD2-CE 3.86Å; L94-Y198 WeakPolarHBondContact CB-OH 3.33Å; L94-Y198 HydrophobicContact CD2-CE2 3.87Å; L94-Y198 HydrophobicContact CG-CE2 3.92Å; L94-Y198 WeakPolarHBondContact CG-OH 3.26Å
95	M	98.6	Very high	98	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-64.5	-42.6	175.4	-169.2	-174.6	71	0	0	111.8	T91 L92 A93 K98 R99 Y198 L205 Y207	T91-M95 WeakPolarHBondContact O-CB 3.42Å; T91-M95 PolarHBondContact O-N 2.92Å; T91-M95 VanDerWaalsContact O-N 3.11Å; L92-M95 HydrophobicContact CD1-CE 3.51Å; L92-M95 VanDerWaalsContact O-CB 3.32Å; L92-M95 WeakPolarHBondContact O-CB 3.48Å; L92-M95 PolarHBondContact O-N 3.2Å; A93-M95 VanDerWaalsContact C-N 3.26Å; A93-M95 PolarHBondContact O-N 3.25Å; M95-K98 VanDerWaalsContact O-CG 3.26Å; M95-K98 WeakPolarHBondContact O-CG 3.37Å; M95-R99 WeakPolarHBondContact O-CD 3.49Å; M95-R99 WeakPolarHBondContact O-CG 3.41Å; M95-R99 PolarHBondContact O-NE 3.45Å; M95-R99 PolarHBondContact SD-NH2 3.26Å; M95-R99 VanDerWaalsContact SD-NH2 3.45Å; M95-Y198 HydrophobicContact CB-CD1 4.35Å; M95-Y198 HydrophobicContact CB-CE1 3.52Å; M95-Y198 HydrophobicContact CG-CD1 4.16Å; M95-Y198 HydrophobicContact CG-CE1 3.81Å; M95-Y198 PolarHBondContact N-OH 2.94Å; M95-L205 HydrophobicContact CE-CB 4.04Å; M95-L205 HydrophobicContact CE-CD1 4.31Å; M95-L205 HydrophobicContact SD-CB 3.79Å; M95-L205 HydrophobicContact SD-CD1 4.36Å; M95-L205 HydrophobicContact SD-CG 4.07Å; M95-L205 PolarHBondContact SD-N 3.06Å; M95-L205 VanDerWaalsContact SD-N 3.39Å; M95-Y207 HydrophobicContact CE-CE1 3.92Å
96	W	98.4	Very high	98	Very high	28 Å²	28	17.5 Å²	17.5	11%	0.106	10%	0.095	C	C	.	.	H	α-helix	trans	-73.8	-41.9	175.2	-74.2	108.3	0	0	0	111.7	N52 L92 A93 K98 R99 G100 Y207 V209	N52-W96 WeakPolarHBondContact ND2-CB 3.31Å; L92-W96 PolarHBondContact O-N 3.01Å; A93-W96 PolarHBondContact O-N 3.12Å; W96-K98 PolarHBondContact O-N 3.1Å; W96-R99 VanDerWaalsContact CH2-NH1 3.29Å; W96-R99 WeakPolarHBondContact O-CB 3.36Å; W96-R99 PolarHBondContact O-N 3.26Å; W96-R99 VanDerWaalsContact O-N 3.16Å; W96-G100 PolarHBondContact O-N 3.4Å; W96-G100 VanDerWaalsContact O-N 3.16Å; W96-Y207 AromaticContact CE2-CZ 4Å; W96-Y207 HydrophobicContact CZ2-CE1 4.31Å; W96-Y207 AromaticContact CZ2-CE2 3.69Å; W96-Y207 HydrophobicContact CZ2-CE2 3.69Å; W96-Y207 AromaticContact CZ2-CZ 3.54Å; W96-Y207 WeakPolarHBondContact CZ2-OH 3.29Å; W96-Y207 AromaticContact NE1-CZ 3.83Å; W96-Y207 PolarHBondContact NE1-OH 3.12Å; W96-V209 HydrophobicContact CH2-CG1 3.96Å; W96-V209 HydrophobicContact CH2-CG2 3.92Å; W96-V209 HydrophobicContact CZ2-CG1 3.94Å; W96-V209 HydrophobicContact CZ3-CG2 4.41Å
97	L	98.4	Very high	98	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-55.9	-50.4	176.5	-177.6	58.3	0	0	0	111.8	F23 V27 I49 N52 I53 I56 A93 L94 R99 G100 L101	F23-L97 HydrophobicContact CE1-CD2 4.01Å; F23-L97 HydrophobicContact CZ-CD2 4.16Å; V27-L97 HydrophobicContact CG2-CD2 4.41Å; I49-L97 HydrophobicContact CD1-CD1 4Å; I49-L97 HydrophobicContact CG2-CD1 3.83Å; N52-L97 HydrophobicContact CB-CB 4.04Å; I53-L97 HydrophobicContact CD1-CD1 4.35Å; I53-L97 HydrophobicContact CG1-CD1 3.97Å; I53-L97 HydrophobicContact CG1-CD2 3.9Å; I56-L97 HydrophobicContact CD1-CB 4.45Å; I56-L97 HydrophobicContact CD1-CD2 3.56Å; A93-L97 WeakPolarHBondContact O-CB 3.37Å; A93-L97 PolarHBondContact O-N 2.77Å; L94-L97 HydrophobicContact CD1-CD2 4.33Å; L94-L97 PolarHBondContact O-N 3.43Å; L97-R99 PolarHBondContact O-N 2.89Å; L97-G100 CarbonylContact O-C 3.5Å; L97-G100 WeakPolarHBondContact O-CA 3.33Å; L97-G100 PolarHBondContact O-N 2.5Å; L97-L101 HydrophobicContact CD1-CD2 4.27Å; L97-L101 HydrophobicContact CD1-CG 4.25Å; L97-L101 HydrophobicContact CG-CD1 4.22Å; L97-L101 HydrophobicContact CG-CG 4.23Å; L97-L101 WeakPolarHBondContact O-CG 3.27Å; L97-L101 PolarHBondContact O-N 3Å
98	K	98.3	Very high	98	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.3	-29.8	-178.3	71.9	-177.4	-180	61.9	0	113	L94 M95 W96 L101 R102 N191 I194 Y195 Y198 E204	L94-K98 WeakPolarHBondContact O-CB 3.15Å; L94-K98 WeakPolarHBondContact O-CG 3.27Å; L94-K98 PolarHBondContact O-N 3.49Å; M95-K98 VanDerWaalsContact O-CG 3.26Å; M95-K98 WeakPolarHBondContact O-CG 3.37Å; W96-K98 PolarHBondContact O-N 3.1Å; K98-L101 PolarHBondContact O-N 3.43Å; K98-R102 WeakPolarHBondContact O-CB 3.1Å; K98-R102 PolarHBondContact O-N 3.24Å; K98-N191 PolarHBondContact O-OD1 2.9Å; K98-I194 HydrophobicContact CB-CG2 3.91Å; K98-I194 HydrophobicContact CD-CG2 3.68Å; K98-I194 HydrophobicContact CG-CG2 4.4Å; K98-Y195 HydrophobicContact CB-CD2 4.35Å; K98-Y195 HydrophobicContact CB-CE2 3.92Å; K98-Y195 HydrophobicContact CD-CD2 4.15Å; K98-Y195 HydrophobicContact CD-CE2 4.17Å; K98-Y195 HydrophobicContact CD-CG 4.48Å; K98-Y195 HydrophobicContact CG-CD2 4.36Å; K98-Y195 HydrophobicContact CG-CE2 3.9Å; K98-Y195 WeakPolarHBondContact O-CE2 3.46Å; K98-Y195 PolarHBondContact O-OH 2.9Å; K98-Y198 HydrophobicContact CD-CD2 3.81Å; K98-Y198 HydrophobicContact CD-CE2 3.96Å; K98-Y198 HydrophobicContact CD-CG 4.09Å; K98-Y198 VanDerWaalsContact CE-CG 3.46Å; K98-E204 WeakPolarHBondContact CE-OE2 3.46Å; K98-E204 IonicContact NZ-OE1 3.13Å; K98-E204 PolarHBondContact NZ-OE1 3.11Å; K98-E204 IonicContact NZ-OE2 2.93Å; K98-E204 PolarHBondContact NZ-OE2 3.09Å
99	R	97.9	Very high	98	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-69.2	-44.3	174	-63.7	163.9	-176.2	179.7	-1.4	111	M95 W96 L97 L101 R102 F103 L136 Y139 Y195 E204 L205	M95-R99 WeakPolarHBondContact O-CD 3.49Å; M95-R99 WeakPolarHBondContact O-CG 3.41Å; M95-R99 PolarHBondContact O-NE 3.45Å; M95-R99 PolarHBondContact SD-NH2 3.26Å; M95-R99 VanDerWaalsContact SD-NH2 3.45Å; W96-R99 VanDerWaalsContact CH2-NH1 3.29Å; W96-R99 WeakPolarHBondContact O-CB 3.36Å; W96-R99 PolarHBondContact O-N 3.26Å; W96-R99 VanDerWaalsContact O-N 3.16Å; L97-R99 PolarHBondContact O-N 2.89Å; R99-L101 PolarHBondContact O-N 3.06Å; R99-R102 WeakPolarHBondContact O-CB 3.36Å; R99-R102 PolarHBondContact O-N 3.44Å; R99-F103 PolarHBondContact O-N 3.25Å; R99-L136 HydrophobicContact CB-CD2 3.82Å; R99-Y139 VanDerWaalsContact CD-CE2 3.49Å; R99-Y139 HydrophobicContact CG-CD2 4.25Å; R99-Y139 HydrophobicContact CG-CE2 3.79Å; R99-Y195 WeakPolarHBondContact CA-OH 3.24Å; R99-E204 IonicContact CZ-OE1 2.7Å; R99-E204 IonicContact NE-OE1 3.82Å; R99-E204 IonicContact NH2-OE1 3.87Å; R99-E204 PolarHBondContact NH2-OE1 3.18Å; R99-L205 PolarHBondContact NH2-O 3.33Å
100	G	96	Very high	98.1	Very high	7 Å²	7	10.9 Å²	10.9	7%	0.072	5%	0.053	C	C	.	.	H	α-helix	trans	-60.8	-41.5	171.4	0	0	0	0	0	113.2	W96 L97 R102 F103 I104	W96-G100 PolarHBondContact O-N 3.4Å; W96-G100 VanDerWaalsContact O-N 3.16Å; L97-G100 CarbonylContact O-C 3.5Å; L97-G100 WeakPolarHBondContact O-CA 3.33Å; L97-G100 PolarHBondContact O-N 2.5Å; G100-R102 VanDerWaalsContact C-N 3.34Å; G100-R102 PolarHBondContact O-N 3.26Å; G100-F103 WeakPolarHBondContact O-CB 3.49Å; G100-F103 PolarHBondContact O-N 3.27Å; G100-I104 PolarHBondContact O-N 3.23Å; G100-I104 VanDerWaalsContact O-N 3.13Å
101	L	97.3	Very high	98	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.01	6%	0.055	C	C	.	.	H	α-helix	trans	-63.1	-40.6	174.5	-62	-176.1	0	0	0	111.6	F23 V27 L30 L97 K98 R99 F103 I104 Q105 F187	F23-L101 HydrophobicContact CE2-CD1 3.97Å; F23-L101 HydrophobicContact CZ-CD1 3.81Å; V27-L101 HydrophobicContact CG1-CD1 3.87Å; V27-L101 HydrophobicContact CG1-CD2 4.14Å; L30-L101 HydrophobicContact CD1-CD2 3.52Å; L97-L101 HydrophobicContact CD1-CD2 4.27Å; L97-L101 HydrophobicContact CD1-CG 4.25Å; L97-L101 HydrophobicContact CG-CD1 4.22Å; L97-L101 HydrophobicContact CG-CG 4.23Å; L97-L101 WeakPolarHBondContact O-CG 3.27Å; L97-L101 PolarHBondContact O-N 3Å; K98-L101 PolarHBondContact O-N 3.43Å; R99-L101 PolarHBondContact O-N 3.06Å; L101-F103 VanDerWaalsContact C-N 3.3Å; L101-F103 PolarHBondContact O-N 2.92Å; L101-I104 PolarHBondContact O-N 3.32Å; L101-Q105 WeakPolarHBondContact O-CB 3.42Å; L101-Q105 PolarHBondContact O-N 2.84Å; L101-F187 HydrophobicContact CB-CE2 4.08Å; L101-F187 HydrophobicContact CB-CZ 3.88Å; L101-F187 HydrophobicContact CD1-CE2 4.43Å; L101-F187 HydrophobicContact CD2-CE2 4.05Å; L101-F187 HydrophobicContact CD2-CZ 4.2Å; L101-F187 HydrophobicContact CG-CE2 4.4Å; L101-F187 WeakPolarHBondContact O-CZ 3.36Å
102	R	98.1	Very high	98	Very high	36 Å²	36	11.8 Å²	11.8	14%	0.136	6%	0.058	C	C	.	.	H	α-helix	trans	-61.9	-37.8	174.3	-174.5	63.1	60.2	169.2	-0.1	112	K98 R99 G100 Q105 V106 A135 N191 D192 Y195	K98-R102 WeakPolarHBondContact O-CB 3.1Å; K98-R102 PolarHBondContact O-N 3.24Å; R99-R102 WeakPolarHBondContact O-CB 3.36Å; R99-R102 PolarHBondContact O-N 3.44Å; G100-R102 VanDerWaalsContact C-N 3.34Å; G100-R102 PolarHBondContact O-N 3.26Å; R102-Q105 WeakPolarHBondContact O-CB 3.47Å; R102-Q105 PolarHBondContact O-N 2.9Å; R102-V106 HydrophobicContact CG-CG2 4.26Å; R102-V106 VanDerWaalsContact O-CG2 3.3Å; R102-V106 WeakPolarHBondContact O-CG2 3.49Å; R102-V106 PolarHBondContact O-N 3.39Å; R102-A135 HydrophobicContact CB-CB 3.9Å; R102-A135 HydrophobicContact CG-CB 3.83Å; R102-N191 WeakPolarHBondContact CA-ND2 3.22Å; R102-N191 PolarHBondContact N-ND2 3.29Å; R102-N191 PolarHBondContact NE-ND2 3.26Å; R102-D192 IonicContact CZ-OD1 2.89Å; R102-D192 IonicContact NH1-OD1 3.51Å; R102-D192 PolarHBondContact NH1-OD1 3.45Å; R102-D192 IonicContact NH2-OD1 2.68Å; R102-D192 PolarHBondContact NH2-OD1 3.17Å; R102-Y195 HydrophobicContact CB-CE2 4.13Å; R102-Y195 WeakPolarHBondContact CB-OH 3.47Å
103	F	97.1	Very high	97.9	Very high	11 Å²	11	14.5 Å²	14.5	5%	0.048	7%	0.073	C	C	.	.	H	α-helix	trans	-59.3	-51.1	173.7	175.1	-86.4	0	0	0	111	F34 L37 R99 G100 L101 Q105 V106 L107 C128 A131 A135 L136 F148	F34-F103 HydrophobicContact CE1-CD1 4.47Å; L37-F103 HydrophobicContact CD1-CE1 4.23Å; R99-F103 PolarHBondContact O-N 3.25Å; G100-F103 WeakPolarHBondContact O-CB 3.49Å; G100-F103 PolarHBondContact O-N 3.27Å; L101-F103 VanDerWaalsContact C-N 3.3Å; L101-F103 PolarHBondContact O-N 2.92Å; F103-Q105 VanDerWaalsContact C-N 3.3Å; F103-Q105 PolarHBondContact O-N 2.89Å; F103-V106 PolarHBondContact O-N 2.76Å; F103-L107 HydrophobicContact CE1-CD2 3.98Å; F103-L107 HydrophobicContact CZ-CD2 4.37Å; F103-L107 WeakPolarHBondContact O-CB 3.49Å; F103-L107 PolarHBondContact O-N 2.64Å; F103-C128 WeakPolarHBondContact CE2-O 3.4Å; F103-A131 HydrophobicContact CD2-CB 3.55Å; F103-A131 HydrophobicContact CE2-CB 3.63Å; F103-A131 HydrophobicContact CG-CB 4.09Å; F103-A131 HydrophobicContact CZ-CB 4.22Å; F103-A131 WeakPolarHBondContact O-CB 3.31Å; F103-A135 HydrophobicContact CB-CB 3.91Å; F103-L136 HydrophobicContact CB-CD1 4.11Å; F103-L136 HydrophobicContact CD2-CD1 4.03Å; F103-L136 HydrophobicContact CG-CD1 4.25Å; F103-F148 HydrophobicContact CE2-CE2 4.42Å
104	I	96.6	Very high	97.9	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-57.9	-45.5	177.9	-63.2	172.2	0	0	0	110.3	L30 F33 F34 G100 L101 L107 L108 F187	L30-I104 HydrophobicContact CB-CD1 4.34Å; F33-I104 HydrophobicContact CD1-CD1 4.16Å; F33-I104 HydrophobicContact CD1-CG1 3.85Å; F33-I104 HydrophobicContact CD1-CG2 4.45Å; F33-I104 HydrophobicContact CD2-CG2 4.24Å; F33-I104 HydrophobicContact CE1-CB 4.4Å; F33-I104 HydrophobicContact CE1-CG1 3.84Å; F33-I104 HydrophobicContact CE1-CG2 4.21Å; F33-I104 HydrophobicContact CE2-CG2 3.98Å; F33-I104 HydrophobicContact CG-CD1 4.43Å; F33-I104 HydrophobicContact CG-CG1 4.45Å; F33-I104 HydrophobicContact CG-CG2 4.46Å; F33-I104 HydrophobicContact CZ-CG1 4.43Å; F33-I104 HydrophobicContact CZ-CG2 3.96Å; F34-I104 HydrophobicContact CE2-CD1 4.13Å; F34-I104 HydrophobicContact CZ-CD1 4.05Å; F34-I104 HydrophobicContact CZ-CG1 4.19Å; G100-I104 PolarHBondContact O-N 3.23Å; G100-I104 VanDerWaalsContact O-N 3.13Å; L101-I104 PolarHBondContact O-N 3.32Å; I104-L107 PolarHBondContact O-N 3.46Å; I104-L108 HydrophobicContact CG2-CD1 3.78Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.45Å; I104-L108 VanDerWaalsContact O-CG 3.32Å; I104-L108 WeakPolarHBondContact O-CG 3.44Å; I104-L108 PolarHBondContact O-N 2.95Å; I104-F187 HydrophobicContact CB-CE1 4.39Å; I104-F187 HydrophobicContact CB-CZ 4.32Å; I104-F187 HydrophobicContact CG2-CE1 4.19Å; I104-F187 HydrophobicContact CG2-CZ 4.32Å
105	Q	97.8	Very high	97.8	Very high	17 Å²	17	20.2 Å²	20.2	8%	0.079	11%	0.112	C	C	.	.	H	α-helix	trans	-57.5	-54	179.7	-176.8	-161.6	-31.3	0	0	111.4	L101 R102 F103 L107 L108 Q109 L184 F187 N191	L101-Q105 WeakPolarHBondContact O-CB 3.42Å; L101-Q105 PolarHBondContact O-N 2.84Å; R102-Q105 WeakPolarHBondContact O-CB 3.47Å; R102-Q105 PolarHBondContact O-N 2.9Å; F103-Q105 VanDerWaalsContact C-N 3.3Å; F103-Q105 PolarHBondContact O-N 2.89Å; Q105-L107 PolarHBondContact O-N 2.99Å; Q105-L108 PolarHBondContact O-N 3.45Å; Q105-Q109 VanDerWaalsContact O-CB 3.27Å; Q105-Q109 WeakPolarHBondContact O-CB 3.36Å; Q105-Q109 PolarHBondContact O-N 2.75Å; Q105-L184 HydrophobicContact CG-CD2 4.25Å; Q105-F187 HydrophobicContact CB-CD1 4.06Å; Q105-F187 HydrophobicContact CB-CE1 3.56Å; Q105-F187 HydrophobicContact CB-CZ 4.48Å; Q105-F187 HydrophobicContact CG-CD1 4.3Å; Q105-F187 HydrophobicContact CG-CE1 4.29Å; Q105-N191 PolarHBondContact OE1-ND2 2.61Å
106	V	98.6	Very high	97.7	Very high	18 Å²	18	24.9 Å²	24.9	11%	0.109	13%	0.132	C	C	.	.	H	α-helix	trans	-66.4	-40.1	-175.8	173.8	0	0	0	0	111	R102 F103 S110 K130 A131 L134	R102-V106 HydrophobicContact CG-CG2 4.26Å; R102-V106 VanDerWaalsContact O-CG2 3.3Å; R102-V106 WeakPolarHBondContact O-CG2 3.49Å; R102-V106 PolarHBondContact O-N 3.39Å; F103-V106 PolarHBondContact O-N 2.76Å; V106-S110 WeakPolarHBondContact O-CB 3.48Å; V106-S110 PolarHBondContact O-N 3.42Å; V106-K130 HydrophobicContact CG1-CD 4.4Å; V106-K130 HydrophobicContact CG1-CG 4.03Å; V106-A131 HydrophobicContact CB-CB 4.03Å; V106-A131 HydrophobicContact CG1-CB 4.02Å; V106-L134 HydrophobicContact CG1-CD1 4.01Å; V106-L134 HydrophobicContact CG2-CB 4.5Å; V106-L134 HydrophobicContact CG2-CD1 4.47Å
107	L	97.9	Very high	97.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-51.2	176.4	170.7	56.2	0	0	0	111	F33 L37 F103 I104 Q105 S110 L111 N127 A131	F33-L107 HydrophobicContact CE1-CD2 3.96Å; F33-L107 HydrophobicContact CZ-CD2 3.73Å; F33-L107 HydrophobicContact CZ-CG 4.44Å; L37-L107 HydrophobicContact CD1-CD2 4.28Å; L37-L107 HydrophobicContact CD2-CD2 4.04Å; F103-L107 HydrophobicContact CE1-CD2 3.98Å; F103-L107 HydrophobicContact CZ-CD2 4.37Å; F103-L107 WeakPolarHBondContact O-CB 3.49Å; F103-L107 PolarHBondContact O-N 2.64Å; I104-L107 PolarHBondContact O-N 3.46Å; Q105-L107 PolarHBondContact O-N 2.99Å; L107-S110 PolarHBondContact O-N 3.26Å; L107-L111 HydrophobicContact CD1-CD1 4.26Å; L107-L111 HydrophobicContact CD1-CG 4.48Å; L107-L111 WeakPolarHBondContact O-CG 3.2Å; L107-L111 PolarHBondContact O-N 2.89Å; L107-L111 VanDerWaalsContact O-N 3.16Å; L107-N127 HydrophobicContact CD1-CB 3.51Å; L107-A131 HydrophobicContact CB-CB 3.85Å
108	L	97.6	Very high	97.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.6	-41.7	-179.7	-75.4	-178.8	0	0	0	112.4	L4 F33 I104 Q105 L111 V112 F161 L165 I180 F183 L184	L4-L108 HydrophobicContact CD1-CD1 3.88Å; L4-L108 HydrophobicContact CD1-CD2 4.44Å; F33-L108 HydrophobicContact CE2-CD1 4.18Å; F33-L108 HydrophobicContact CE2-CD2 3.91Å; F33-L108 HydrophobicContact CE2-CG 4.05Å; F33-L108 HydrophobicContact CZ-CD2 4.39Å; F33-L108 HydrophobicContact CZ-CG 4.34Å; I104-L108 HydrophobicContact CG2-CD1 3.78Å; I104-L108 HydrophobicContact CG2-CG 4.31Å; I104-L108 WeakPolarHBondContact O-CB 3.45Å; I104-L108 VanDerWaalsContact O-CG 3.32Å; I104-L108 WeakPolarHBondContact O-CG 3.44Å; I104-L108 PolarHBondContact O-N 2.95Å; Q105-L108 PolarHBondContact O-N 3.45Å; L108-L111 PolarHBondContact O-N 3.37Å; L108-V112 WeakPolarHBondContact O-CB 3.15Å; L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 3.25Å; L108-F161 HydrophobicContact CD2-CE1 4.24Å; L108-F161 HydrophobicContact CD2-CZ 4.27Å; L108-L165 HydrophobicContact CD2-CD1 4.27Å; L108-I180 HydrophobicContact CB-CG2 3.72Å; L108-I180 HydrophobicContact CD1-CG2 4.3Å; L108-I180 HydrophobicContact CD2-CD1 4.06Å; L108-I180 HydrophobicContact CD2-CG1 4.17Å; L108-I180 HydrophobicContact CD2-CG2 3.95Å; L108-I180 HydrophobicContact CG-CG2 4.21Å; L108-F183 HydrophobicContact CD1-CD1 4.14Å; L108-F183 HydrophobicContact CD1-CE1 4.03Å; L108-L184 HydrophobicContact CB-CD1 4.15Å; L108-L184 HydrophobicContact CB-CD2 3.96Å; L108-L184 HydrophobicContact CB-CG 4.37Å; L108-L184 HydrophobicContact CD1-CD2 4.49Å
109	Q	98.6	Very high	97.5	Very high	64 Å²	64	39 Å²	39	30%	0.299	21%	0.205	S	C	.	.	H	α-helix	trans	-63.3	-45.5	177.1	-173.3	63.8	60.2	0	0	111.1	Q105 L111 V112 D113 L184	Q105-Q109 VanDerWaalsContact O-CB 3.27Å; Q105-Q109 WeakPolarHBondContact O-CB 3.36Å; Q105-Q109 PolarHBondContact O-N 2.75Å; Q109-L111 VanDerWaalsContact C-N 3.28Å; Q109-L111 PolarHBondContact O-N 3.37Å; Q109-V112 WeakPolarHBondContact O-CB 3.3Å; Q109-V112 PolarHBondContact O-N 3.43Å; Q109-D113 WeakPolarHBondContact CG-OD2 3.3Å; Q109-D113 PolarHBondContact NE2-OD1 3.18Å; Q109-D113 PolarHBondContact NE2-OD2 3.29Å; Q109-D113 WeakPolarHBondContact O-CB 3.37Å; Q109-D113 PolarHBondContact O-N 3.38Å; Q109-L184 HydrophobicContact CB-CD1 4.09Å
110	S	98.6	Very high	97.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-39.8	177.4	-179.8	0	0	0	0	112.4	V106 L107 G114 E115 N127	V106-S110 WeakPolarHBondContact O-CB 3.48Å; V106-S110 PolarHBondContact O-N 3.42Å; L107-S110 PolarHBondContact O-N 3.26Å; S110-G114 PolarHBondContact O-N 2.94Å; S110-E115 VanDerWaalsContact CB-OE2 3.3Å; S110-E115 WeakPolarHBondContact CB-OE2 3.4Å; S110-E115 WeakPolarHBondContact O-CB 3.36Å; S110-E115 PolarHBondContact O-N 2.91Å; S110-E115 VanDerWaalsContact O-N 3.07Å; S110-E115 PolarHBondContact OG-OE2 3.08Å; S110-N127 PolarHBondContact OG-ND2 3.13Å
111	L	97.8	Very high	97.3	Very high	10 Å²	10	44.4 Å²	44.4	5%	0.052	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-40.9	174.6	-68.2	170.6	0	0	0	112.6	L107 L108 Q109 D113 G114 I124 N127 K158 F161 L177	L107-L111 HydrophobicContact CD1-CD1 4.26Å; L107-L111 HydrophobicContact CD1-CG 4.48Å; L107-L111 WeakPolarHBondContact O-CG 3.2Å; L107-L111 PolarHBondContact O-N 2.89Å; L107-L111 VanDerWaalsContact O-N 3.16Å; L108-L111 PolarHBondContact O-N 3.37Å; Q109-L111 VanDerWaalsContact C-N 3.28Å; Q109-L111 PolarHBondContact O-N 3.37Å; L111-D113 VanDerWaalsContact C-N 3.32Å; L111-G114 PolarHBondContact O-N 3.49Å; L111-I124 HydrophobicContact CD2-CB 4.3Å; L111-I124 HydrophobicContact CD2-CG2 3.7Å; L111-N127 HydrophobicContact CD2-CB 4.33Å; L111-N127 HydrophobicContact CG-CB 4.45Å; L111-K158 HydrophobicContact CD2-CD 4.36Å; L111-K158 HydrophobicContact CD2-CG 4.32Å; L111-F161 HydrophobicContact CD1-CD1 3.89Å; L111-F161 HydrophobicContact CD1-CE1 3.49Å; L111-F161 VanDerWaalsContact CD1-CE1 3.49Å; L111-F161 HydrophobicContact CD1-CZ 4.49Å; L111-L177 HydrophobicContact CB-CD2 4.47Å
112	V	97.9	Very high	97.2	Very high	10 Å²	10	49 Å²	49	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-34.9	178.2	153.1	0	0	0	0	112.7	L108 Q109 G114 L177 I180 R181 L184	L108-V112 WeakPolarHBondContact O-CB 3.15Å; L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 3.25Å; Q109-V112 WeakPolarHBondContact O-CB 3.3Å; Q109-V112 PolarHBondContact O-N 3.43Å; V112-G114 PolarHBondContact O-N 3.37Å; V112-L177 HydrophobicContact CG2-CD2 4.37Å; V112-I180 HydrophobicContact CG2-CB 3.81Å; V112-I180 HydrophobicContact CG2-CG2 3.46Å; V112-I180 VanDerWaalsContact CG2-CG2 3.46Å; V112-R181 HydrophobicContact CB-CG 4.25Å; V112-R181 HydrophobicContact CG1-CG 3.33Å; V112-R181 HydrophobicContact CG2-CG 3.87Å; V112-R181 PolarHBondContact O-NH2 2.97Å; V112-L184 HydrophobicContact CG2-CD1 4.29Å
113	D	98.1	Very high	97.2	Very high	94 Å²	94	48.4 Å²	48.4	50%	0.503	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-5.6	178.1	-64.1	-17.4	0	0	0	112.2	Q109 L111 E115	Q109-D113 WeakPolarHBondContact CG-OD2 3.3Å; Q109-D113 PolarHBondContact NE2-OD1 3.18Å; Q109-D113 PolarHBondContact NE2-OD2 3.29Å; Q109-D113 WeakPolarHBondContact O-CB 3.37Å; Q109-D113 PolarHBondContact O-N 3.38Å; L111-D113 VanDerWaalsContact C-N 3.32Å; D113-E115 VanDerWaalsContact C-N 3.31Å; D113-E115 HydrophobicContact CB-CG 4.26Å
114	G	96.9	Very high	97.1	Very high	50 Å²	50	47.9 Å²	47.9	52%	0.515	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	16.2	178.8	0	0	0	0	0	113.9	S110 L111 V112 K116	S110-G114 PolarHBondContact O-N 2.94Å; L111-G114 PolarHBondContact O-N 3.49Å; V112-G114 PolarHBondContact O-N 3.37Å; G114-K116 PolarHBondContact O-N 2.88Å
115	E	97.8	Very high	97.1	Very high	75 Å²	75	51.9 Å²	51.9	35%	0.35	27%	0.272	S	S	.	.			trans	-65.7	130.7	177.1	-61.5	-178.5	166.7	0	0	110.5	S110 D113 N127 K130	S110-E115 VanDerWaalsContact CB-OE2 3.3Å; S110-E115 WeakPolarHBondContact CB-OE2 3.4Å; S110-E115 WeakPolarHBondContact O-CB 3.36Å; S110-E115 PolarHBondContact O-N 2.91Å; S110-E115 VanDerWaalsContact O-N 3.07Å; S110-E115 PolarHBondContact OG-OE2 3.08Å; D113-E115 VanDerWaalsContact C-N 3.31Å; D113-E115 HydrophobicContact CB-CG 4.26Å; E115-N127 PolarHBondContact O-ND2 3.21Å; E115-K130 IonicContact OE1-NZ 2.82Å; E115-K130 PolarHBondContact OE1-NZ 2.88Å; E115-K130 WeakPolarHBondContact OE2-CD 3.43Å; E115-K130 IonicContact OE2-NZ 2.81Å; E115-K130 PolarHBondContact OE2-NZ 2.89Å
116	K	97.2	Very high	97.1	Very high	100 Å²	100	53.9 Å²	53.9	44%	0.435	29%	0.285	S	S	.	.			trans	-156.6	160.8	-175.9	60.5	-176.3	179.8	160.6	0	111	G114 E118 P121	G114-K116 PolarHBondContact O-N 2.88Å; K116-E118 WeakPolarHBondContact CE-OE1 3.42Å; K116-E118 WeakPolarHBondContact CE-OE2 3.43Å; K116-E118 IonicContact NZ-OE2 3.67Å; K116-P121 HydrophobicContact CD-CB 3.91Å
117	D	96.5	Very high	97.1	Very high	48 Å²	48	53.1 Å²	53.1	26%	0.257	28%	0.28	S	S	.	.			trans	-79.8	119.2	163.5	176.4	4.3	0	0	0	108	N119 N120 P121 V126	D117-N119 PolarHBondContact O-N 3.32Å; D117-N119 WeakPolarHBondContact OD1-CB 3.32Å; D117-N119 PolarHBondContact OD1-N 3.39Å; D117-N119 PolarHBondContact OD1-ND2 3.45Å; D117-N120 HydrophobicContact CB-CB 4.35Å; D117-N120 CarbonylContact O-C 3.55Å; D117-N120 PolarHBondContact O-N 3.44Å; D117-N120 PolarHBondContact OD2-ND2 2.84Å; D117-P121 VanDerWaalsContact O-CA 3.23Å; D117-P121 WeakPolarHBondContact O-CA 3.42Å; D117-V126 HydrophobicContact CB-CG1 3.89Å
118	E	96.1	Very high	97	Very high	137 Å²	137	53.2 Å²	53.2	64%	0.64	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.2	179.6	-64.4	-57.5	153.5	0	0	112.9	K116	K116-E118 WeakPolarHBondContact CE-OE1 3.42Å; K116-E118 WeakPolarHBondContact CE-OE2 3.43Å; K116-E118 IonicContact NZ-OE2 3.67Å
119	N	97.3	Very high	97	Very high	138 Å²	138	55.4 Å²	55.4	74%	0.738	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-23.8	175.5	-55	-66.3	0	0	0	112.5	D117	D117-N119 PolarHBondContact O-N 3.32Å; D117-N119 WeakPolarHBondContact OD1-CB 3.32Å; D117-N119 PolarHBondContact OD1-N 3.39Å; D117-N119 PolarHBondContact OD1-ND2 3.45Å
120	N	95.6	Very high	97	Very high	76 Å²	76	55.5 Å²	55.5	41%	0.406	29%	0.294	S	S	.	.	S	Bend	trans	-139.9	61.8	-176.7	-57.2	-85.8	0	0	0	110.9	D117 D122 L123	D117-N120 HydrophobicContact CB-CB 4.35Å; D117-N120 CarbonylContact O-C 3.55Å; D117-N120 PolarHBondContact O-N 3.44Å; D117-N120 PolarHBondContact OD2-ND2 2.84Å; N120-D122 PolarHBondContact O-N 3.47Å; N120-D122 VanDerWaalsContact O-N 3.1Å; N120-L123 HydrophobicContact CB-CB 4.4Å; N120-L123 HydrophobicContact CB-CD1 3.8Å; N120-L123 HydrophobicContact CB-CG 4.13Å; N120-L123 PolarHBondContact O-N 3.5Å
121	P	95.1	Very high	97	Very high	45 Å²	45	55.5 Å²	55.5	29%	0.292	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-16.9	-167.4	27.9	-37.4	0	0	0	114.1	K116 D117	K116-P121 HydrophobicContact CD-CB 3.91Å; D117-P121 VanDerWaalsContact O-CA 3.23Å; D117-P121 WeakPolarHBondContact O-CA 3.42Å
122	D	95.4	Very high	96.9	Very high	99 Å²	99	55.5 Å²	55.5	53%	0.529	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.8	178.4	-61.7	-42.6	0	0	0	113.2	N120 Y157 K158	N120-D122 PolarHBondContact O-N 3.47Å; N120-D122 VanDerWaalsContact O-N 3.1Å; D122-Y157 HydrophobicContact CB-CD1 3.93Å; D122-Y157 CarbonylContact O-C 3.58Å; D122-Y157 VanDerWaalsContact O-CA 3.28Å; D122-Y157 WeakPolarHBondContact O-CA 3.29Å; D122-K158 PolarHBondContact O-N 2.99Å
123	L	96.1	Very high	96.9	Very high	24 Å²	24	59.7 Å²	59.7	13%	0.126	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-98.3	140.7	178.5	-62.6	-177.8	0	0	0	111.5	N120 R125 Y157	N120-L123 HydrophobicContact CB-CB 4.4Å; N120-L123 HydrophobicContact CB-CD1 3.8Å; N120-L123 HydrophobicContact CB-CG 4.13Å; N120-L123 PolarHBondContact O-N 3.5Å; L123-R125 VanDerWaalsContact C-N 3.34Å; L123-R125 HydrophobicContact CB-CG 4.34Å; L123-Y157 HydrophobicContact CD2-CD1 3.69Å; L123-Y157 HydrophobicContact CD2-CE1 3.64Å; L123-Y157 HydrophobicContact CD2-CG 4.41Å
124	I	96.9	Very high	96.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.318	C	S	.	.			trans	-94.5	14	176.7	68.6	175.6	0	0	0	113.6	L37 L111 V126 N127 C128 A155 P156 K158 F161	L37-I124 HydrophobicContact CD2-CD1 3.74Å; L111-I124 HydrophobicContact CD2-CB 4.3Å; L111-I124 HydrophobicContact CD2-CG2 3.7Å; I124-V126 VanDerWaalsContact C-N 3.34Å; I124-V126 PolarHBondContact O-N 3.16Å; I124-N127 WeakPolarHBondContact CA-OD1 3.43Å; I124-N127 PolarHBondContact O-N 3.17Å; I124-N127 PolarHBondContact O-OD1 3Å; I124-C128 PolarHBondContact O-N 3.48Å; I124-C128 PolarHBondContact O-SG 2.57Å; I124-C128 VanDerWaalsContact O-SG 3.41Å; I124-A155 HydrophobicContact CG1-CB 4.14Å; I124-P156 HydrophobicContact CD1-CG 3.92Å; I124-K158 HydrophobicContact CG2-CB 3.67Å; I124-K158 HydrophobicContact CG2-CG 4.05Å; I124-F161 HydrophobicContact CD1-CB 4.15Å; I124-F161 HydrophobicContact CD1-CD1 4.38Å; I124-F161 HydrophobicContact CD1-CD2 4.16Å; I124-F161 HydrophobicContact CD1-CG 3.97Å
125	R	95.9	Very high	96.9	Very high	84 Å²	84	58.4 Å²	58.4	32%	0.317	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-39.7	-173	-67.6	-178.6	-179.9	166.8	-0.4	112.5	L123 C128 T129 V152 F153 A155	L123-R125 VanDerWaalsContact C-N 3.34Å; L123-R125 HydrophobicContact CB-CG 4.34Å; R125-C128 PolarHBondContact O-N 3.25Å; R125-T129 WeakPolarHBondContact O-CB 3.36Å; R125-T129 PolarHBondContact O-N 2.76Å; R125-T129 PolarHBondContact O-OG1 3.02Å; R125-V152 HydrophobicContact CB-CG2 4.31Å; R125-V152 HydrophobicContact CG-CG2 4.47Å; R125-F153 PolarHBondContact NH2-O 3.4Å; R125-A155 HydrophobicContact CG-CB 4.46Å
126	V	97.5	Very high	96.9	Very high	59 Å²	59	56.1 Å²	56.1	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-66.5	-39.8	177.7	-64.3	0	0	0	0	111.2	D117 I124 T129 K130	D117-V126 HydrophobicContact CB-CG1 3.89Å; I124-V126 VanDerWaalsContact C-N 3.34Å; I124-V126 PolarHBondContact O-N 3.16Å; V126-T129 PolarHBondContact O-N 2.6Å; V126-K130 WeakPolarHBondContact O-CB 3.37Å; V126-K130 PolarHBondContact O-N 3.32Å
127	N	98.3	Very high	96.9	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.011	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-45.3	177.5	-42.4	82.6	0	0	0	110.6	L107 S110 L111 E115 I124 T129 K130 A131	L107-N127 HydrophobicContact CD1-CB 3.51Å; S110-N127 PolarHBondContact OG-ND2 3.13Å; L111-N127 HydrophobicContact CD2-CB 4.33Å; L111-N127 HydrophobicContact CG-CB 4.45Å; E115-N127 PolarHBondContact O-ND2 3.21Å; I124-N127 WeakPolarHBondContact CA-OD1 3.43Å; I124-N127 PolarHBondContact O-N 3.17Å; I124-N127 PolarHBondContact O-OD1 3Å; N127-T129 VanDerWaalsContact C-N 3.34Å; N127-T129 PolarHBondContact O-N 3.07Å; N127-K130 PolarHBondContact O-N 3.16Å; N127-A131 WeakPolarHBondContact O-CB 3.36Å; N127-A131 PolarHBondContact O-N 3.41Å
128	C	96.6	Very high	96.9	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.014	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-41.5	174.9	-72.4	0	0	0	0	111.9	F103 I124 R125 A131 Y132 V152	F103-C128 WeakPolarHBondContact CE2-O 3.4Å; I124-C128 PolarHBondContact O-N 3.48Å; I124-C128 PolarHBondContact O-SG 2.57Å; I124-C128 VanDerWaalsContact O-SG 3.41Å; R125-C128 PolarHBondContact O-N 3.25Å; C128-A131 PolarHBondContact O-N 2.89Å; C128-Y132 WeakPolarHBondContact O-CB 3.45Å; C128-Y132 PolarHBondContact O-N 3Å; C128-V152 HydrophobicContact CB-CG2 3.87Å
129	T	97.6	Very high	96.9	Very high	47 Å²	47	52.1 Å²	52.1	29%	0.288	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-50.5	177.6	-58.9	0	0	0	0	110.4	R125 V126 N127 A131 Y132 E133	R125-T129 WeakPolarHBondContact O-CB 3.36Å; R125-T129 PolarHBondContact O-N 2.76Å; R125-T129 PolarHBondContact O-OG1 3.02Å; V126-T129 PolarHBondContact O-N 2.6Å; N127-T129 VanDerWaalsContact C-N 3.34Å; N127-T129 PolarHBondContact O-N 3.07Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.46Å; T129-Y132 WeakPolarHBondContact O-CB 3.47Å; T129-Y132 PolarHBondContact O-N 2.93Å; T129-Y132 VanDerWaalsContact O-N 3.09Å; T129-E133 HydrophobicContact CG2-CG 4.3Å; T129-E133 WeakPolarHBondContact O-CG 3.37Å; T129-E133 PolarHBondContact O-N 3.1Å
130	K	98.4	Very high	96.9	Very high	66 Å²	66	46.9 Å²	46.9	29%	0.287	23%	0.232	S	C	.	.	H	α-helix	trans	-54.3	-47.3	175.9	-179.2	-178.5	176	-174.7	0	111.8	V106 E115 V126 N127 Y132 E133 L134	V106-K130 HydrophobicContact CG1-CD 4.4Å; V106-K130 HydrophobicContact CG1-CG 4.03Å; E115-K130 IonicContact OE1-NZ 2.82Å; E115-K130 PolarHBondContact OE1-NZ 2.88Å; E115-K130 WeakPolarHBondContact OE2-CD 3.43Å; E115-K130 IonicContact OE2-NZ 2.81Å; E115-K130 PolarHBondContact OE2-NZ 2.89Å; V126-K130 WeakPolarHBondContact O-CB 3.37Å; V126-K130 PolarHBondContact O-N 3.32Å; N127-K130 PolarHBondContact O-N 3.16Å; K130-Y132 VanDerWaalsContact C-N 3.33Å; K130-Y132 PolarHBondContact O-N 2.87Å; K130-E133 PolarHBondContact O-N 2.89Å; K130-L134 HydrophobicContact CG-CD1 4.15Å; K130-L134 WeakPolarHBondContact O-CG 3.46Å; K130-L134 PolarHBondContact O-N 2.92Å; K130-L134 VanDerWaalsContact O-N 3.1Å
131	A	97.9	Very high	97	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-43.9	177.1	0	0	0	0	0	112.6	F103 V106 L107 N127 C128 T129 A135	F103-A131 HydrophobicContact CD2-CB 3.55Å; F103-A131 HydrophobicContact CE2-CB 3.63Å; F103-A131 HydrophobicContact CG-CB 4.09Å; F103-A131 HydrophobicContact CZ-CB 4.22Å; F103-A131 WeakPolarHBondContact O-CB 3.31Å; V106-A131 HydrophobicContact CB-CB 4.03Å; V106-A131 HydrophobicContact CG1-CB 4.02Å; L107-A131 HydrophobicContact CB-CB 3.85Å; N127-A131 WeakPolarHBondContact O-CB 3.36Å; N127-A131 PolarHBondContact O-N 3.41Å; C128-A131 PolarHBondContact O-N 2.89Å; T129-A131 VanDerWaalsContact C-N 3.31Å; T129-A131 PolarHBondContact O-N 3.46Å; A131-A135 WeakPolarHBondContact O-CB 3.32Å; A131-A135 PolarHBondContact O-N 3.43Å
132	Y	96.9	Very high	97.1	Very high	10 Å²	10	50.8 Å²	50.8	4%	0.039	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-45.6	177.1	177.9	-103.4	0	0	0	112.8	C128 T129 K130 L134 A135 L136 K137 H140 Q145 F148	C128-Y132 WeakPolarHBondContact O-CB 3.45Å; C128-Y132 PolarHBondContact O-N 3Å; T129-Y132 WeakPolarHBondContact O-CB 3.47Å; T129-Y132 PolarHBondContact O-N 2.93Å; T129-Y132 VanDerWaalsContact O-N 3.09Å; K130-Y132 VanDerWaalsContact C-N 3.33Å; K130-Y132 PolarHBondContact O-N 2.87Å; Y132-L134 VanDerWaalsContact C-N 3.32Å; Y132-L134 PolarHBondContact O-N 3.42Å; Y132-A135 PolarHBondContact O-N 3.09Å; Y132-L136 HydrophobicContact CD2-CB 3.83Å; Y132-L136 HydrophobicContact CD2-CD1 4.27Å; Y132-L136 HydrophobicContact CE2-CB 3.91Å; Y132-L136 PolarHBondContact O-N 3.02Å; Y132-K137 HydrophobicContact CD1-CB 3.88Å; Y132-K137 HydrophobicContact CD1-CD 4.5Å; Y132-K137 HydrophobicContact CD1-CG 4.42Å; Y132-K137 HydrophobicContact CE1-CB 3.57Å; Y132-K137 HydrophobicContact CE1-CD 4.28Å; Y132-K137 HydrophobicContact CE1-CG 3.86Å; Y132-K137 PolarHBondContact O-N 3.33Å; Y132-H140 AromaticContact CE2-CE1 3.78Å; Y132-H140 AromaticContact CE2-ND1 3.29Å; Y132-H140 VanDerWaalsContact CE2-ND1 3.29Å; Y132-H140 WeakPolarHBondContact CE2-ND1 3.12Å; Y132-H140 AromaticContact CZ-ND1 3.54Å; Y132-H140 WeakPolarHBondContact OH-CB 3.13Å; Y132-H140 PolarHBondContact OH-ND1 3.29Å; Y132-Q145 WeakPolarHBondContact OH-CA 3.3Å; Y132-Q145 WeakPolarHBondContact OH-CG 3.19Å; Y132-F148 AromaticContact CD1-CD1 3.36Å; Y132-F148 HydrophobicContact CD1-CD1 3.36Å; Y132-F148 HydrophobicContact CD1-CD2 4.34Å; Y132-F148 AromaticContact CD1-CE1 3.47Å; Y132-F148 HydrophobicContact CD1-CE1 3.47Å; Y132-F148 VanDerWaalsContact CD1-CE1 3.47Å; Y132-F148 HydrophobicContact CD1-CE2 4.42Å; Y132-F148 AromaticContact CD1-CG 3.85Å; Y132-F148 HydrophobicContact CD1-CG 3.85Å; Y132-F148 HydrophobicContact CD1-CZ 4.04Å; Y132-F148 HydrophobicContact CD2-CB 4.33Å; Y132-F148 AromaticContact CD2-CD1 3.97Å; Y132-F148 HydrophobicContact CD2-CD1 3.97Å; Y132-F148 AromaticContact CD2-CD2 3.39Å; Y132-F148 HydrophobicContact CD2-CD2 3.39Å; Y132-F148 HydrophobicContact CD2-CE1 4.17Å; Y132-F148 AromaticContact CD2-CE2 3.61Å; Y132-F148 HydrophobicContact CD2-CE2 3.61Å; Y132-F148 AromaticContact CD2-CG 3.59Å; Y132-F148 HydrophobicContact CD2-CG 3.59Å; Y132-F148 HydrophobicContact CD2-CZ 4.01Å; Y132-F148 HydrophobicContact CE1-CB 4.21Å; Y132-F148 AromaticContact CE1-CD1 3.62Å; Y132-F148 HydrophobicContact CE1-CD1 3.62Å; Y132-F148 HydrophobicContact CE1-CE1 4.21Å; Y132-F148 AromaticContact CE1-CG 3.88Å; Y132-F148 HydrophobicContact CE1-CG 3.88Å; Y132-F148 HydrophobicContact CE2-CB 3.84Å; Y132-F148 HydrophobicContact CE2-CD1 4.17Å; Y132-F148 AromaticContact CE2-CD2 3.74Å; Y132-F148 HydrophobicContact CE2-CD2 3.74Å; Y132-F148 HydrophobicContact CE2-CE2 4.41Å; Y132-F148 AromaticContact CE2-CG 3.61Å; Y132-F148 HydrophobicContact CE2-CG 3.61Å; Y132-F148 AromaticContact CG-CD1 3.55Å; Y132-F148 HydrophobicContact CG-CD1 3.55Å; Y132-F148 AromaticContact CG-CD2 3.72Å; Y132-F148 HydrophobicContact CG-CD2 3.72Å; Y132-F148 AromaticContact CG-CE1 3.45Å; Y132-F148 HydrophobicContact CG-CE1 3.45Å; Y132-F148 VanDerWaalsContact CG-CE1 3.45Å; Y132-F148 AromaticContact CG-CE2 3.61Å; Y132-F148 HydrophobicContact CG-CE2 3.61Å; Y132-F148 AromaticContact CG-CG 3.7Å; Y132-F148 HydrophobicContact CG-CG 3.7Å; Y132-F148 AromaticContact CG-CZ 3.49Å; Y132-F148 HydrophobicContact CG-CZ 3.49Å; Y132-F148 VanDerWaalsContact CG-CZ 3.49Å; Y132-F148 AromaticContact CZ-CG 3.76Å
133	E	98.1	Very high	97.1	Very high	98 Å²	98	51.3 Å²	51.3	46%	0.458	24%	0.244	S	C	.	.	H	α-helix	trans	-61.8	-41.4	-178.4	-66.8	-161.3	134	0	0	112.4	T129 K130 K137	T129-E133 HydrophobicContact CG2-CG 4.3Å; T129-E133 WeakPolarHBondContact O-CG 3.37Å; T129-E133 PolarHBondContact O-N 3.1Å; K130-E133 PolarHBondContact O-N 2.89Å; E133-K137 HydrophobicContact CB-CD 4.29Å; E133-K137 HydrophobicContact CG-CD 3.85Å; E133-K137 IonicContact OE1-NZ 2.73Å; E133-K137 PolarHBondContact OE1-NZ 3.4Å
134	L	98.1	Very high	97	Very high	116 Å²	116	52 Å²	52	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-80.7	-29.6	-178.4	-63.3	-176.7	0	0	0	113.5	V106 K130 Y132	V106-L134 HydrophobicContact CG1-CD1 4.01Å; V106-L134 HydrophobicContact CG2-CB 4.5Å; V106-L134 HydrophobicContact CG2-CD1 4.47Å; K130-L134 HydrophobicContact CG-CD1 4.15Å; K130-L134 WeakPolarHBondContact O-CG 3.46Å; K130-L134 PolarHBondContact O-N 2.92Å; K130-L134 VanDerWaalsContact O-N 3.1Å; Y132-L134 VanDerWaalsContact C-N 3.32Å; Y132-L134 PolarHBondContact O-N 3.42Å
135	A	96.9	Very high	97	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-102.3	-38.2	-171.6	0	0	0	0	0	114.7	R102 F103 A131 Y132 Y139	R102-A135 HydrophobicContact CB-CB 3.9Å; R102-A135 HydrophobicContact CG-CB 3.83Å; F103-A135 HydrophobicContact CB-CB 3.91Å; A131-A135 WeakPolarHBondContact O-CB 3.32Å; A131-A135 PolarHBondContact O-N 3.43Å; Y132-A135 PolarHBondContact O-N 3.09Å; A135-Y139 WeakPolarHBondContact O-CE2 3.36Å
136	L	96.3	Very high	97	Very high	26 Å²	26	55.6 Å²	55.6	14%	0.136	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-36.2	-161.7	-70.5	168	0	0	0	114.2	R99 F103 Y132 K138 Y139	R99-L136 HydrophobicContact CB-CD2 3.82Å; F103-L136 HydrophobicContact CB-CD1 4.11Å; F103-L136 HydrophobicContact CD2-CD1 4.03Å; F103-L136 HydrophobicContact CG-CD1 4.25Å; Y132-L136 HydrophobicContact CD2-CB 3.83Å; Y132-L136 HydrophobicContact CD2-CD1 4.27Å; Y132-L136 HydrophobicContact CE2-CB 3.91Å; Y132-L136 PolarHBondContact O-N 3.02Å; L136-K138 VanDerWaalsContact C-N 3.25Å; L136-K138 PolarHBondContact O-N 3.11Å; L136-Y139 PolarHBondContact O-N 3.04Å
137	K	97.4	Very high	96.8	Very high	74 Å²	74	58 Å²	58	32%	0.322	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-50.7	-41	-169.2	-180	173.8	174.5	-172.3	0	114	Y132 E133 Y139 H140 Q145	Y132-K137 HydrophobicContact CD1-CB 3.88Å; Y132-K137 HydrophobicContact CD1-CD 4.5Å; Y132-K137 HydrophobicContact CD1-CG 4.42Å; Y132-K137 HydrophobicContact CE1-CB 3.57Å; Y132-K137 HydrophobicContact CE1-CD 4.28Å; Y132-K137 HydrophobicContact CE1-CG 3.86Å; Y132-K137 PolarHBondContact O-N 3.33Å; E133-K137 HydrophobicContact CB-CD 4.29Å; E133-K137 HydrophobicContact CG-CD 3.85Å; E133-K137 IonicContact OE1-NZ 2.73Å; E133-K137 PolarHBondContact OE1-NZ 3.4Å; K137-Y139 PolarHBondContact O-N 3.42Å; K137-H140 PolarHBondContact O-N 3.48Å; K137-Q145 PolarHBondContact O-NE2 2.94Å
138	K	97.4	Very high	96.5	Very high	122 Å²	122	59.1 Å²	59.1	53%	0.53	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-66.8	-19.3	-178.8	72.3	177	-167.8	166.9	0	114.1	L136	L136-K138 VanDerWaalsContact C-N 3.25Å; L136-K138 PolarHBondContact O-N 3.11Å
139	Y	96.3	Very high	96.3	Very high	5 Å²	5	65 Å²	65	2%	0.02	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-101.1	4.6	179.5	-48.2	-72.5	0	0	0	112.9	R99 A135 L136 K137 E204 T208 V209	R99-Y139 VanDerWaalsContact CD-CE2 3.49Å; R99-Y139 HydrophobicContact CG-CD2 4.25Å; R99-Y139 HydrophobicContact CG-CE2 3.79Å; A135-Y139 WeakPolarHBondContact O-CE2 3.36Å; L136-Y139 PolarHBondContact O-N 3.04Å; K137-Y139 PolarHBondContact O-N 3.42Å; Y139-E204 PolarHBondContact OH-OE1 3.18Å; Y139-T208 CarbonylContact O-C 3.58Å; Y139-T208 VanDerWaalsContact O-CA 3.23Å; Y139-T208 WeakPolarHBondContact O-CA 3.36Å; Y139-V209 PolarHBondContact O-N 3.03Å
140	H	96.2	Very high	96.1	Very high	28 Å²	28	65.9 Å²	65.9	13%	0.13	32%	0.321	C	S	.	.			trans	-113.7	129	-179.3	-73.6	175.9	0	0	0	110	Y132 K137 V144 Q145 V209	Y132-H140 AromaticContact CE2-CE1 3.78Å; Y132-H140 AromaticContact CE2-ND1 3.29Å; Y132-H140 VanDerWaalsContact CE2-ND1 3.29Å; Y132-H140 WeakPolarHBondContact CE2-ND1 3.12Å; Y132-H140 AromaticContact CZ-ND1 3.54Å; Y132-H140 WeakPolarHBondContact OH-CB 3.13Å; Y132-H140 PolarHBondContact OH-ND1 3.29Å; K137-H140 PolarHBondContact O-N 3.48Å; H140-V144 HydrophobicContact CB-CB 3.95Å; H140-V144 HydrophobicContact CB-CG1 3.97Å; H140-V144 WeakPolarHBondContact ND1-CG1 3.28Å; H140-Q145 HydrophobicContact CB-CG 4Å; H140-Q145 PolarHBondContact O-NE2 3.47Å; H140-V209 CarbonylContact C-O 3.1Å; H140-V209 WeakPolarHBondContact CA-O 3.33Å
141	G	97.3	Very high	95.7	Very high	20 Å²	20	63.7 Å²	63.7	21%	0.206	32%	0.315	C	S	.	.			trans	-67.4	174.8	170.5	0	0	0	0	0	112.1	L143 V144 Q145 V209	G141-L143 VanDerWaalsContact C-N 3.26Å; G141-L143 PolarHBondContact O-N 3.2Å; G141-V144 PolarHBondContact O-N 3.45Å; G141-Q145 WeakPolarHBondContact O-CG 3.4Å; G141-Q145 PolarHBondContact O-N 3.06Å; G141-V209 PolarHBondContact N-O 3.36Å
142	W	97.1	Very high	95.5	Very high	183 Å²	183	64.3 Å²	64.3	69%	0.693	32%	0.319	S	S	*	.	H	α-helix	trans	-54.7	-40.6	-175.2	173.8	91.4	0	0	0	113.2	Q145 K146	W142-Q145 PolarHBondContact O-N 3.13Å; W142-K146 HydrophobicContact CD2-CG 4.19Å; W142-K146 HydrophobicContact CH2-CG 4.48Å; W142-K146 HydrophobicContact CZ2-CD 4.45Å; W142-K146 HydrophobicContact CZ2-CG 4.04Å; W142-K146 VanDerWaalsContact O-CG 3.31Å; W142-K146 WeakPolarHBondContact O-CG 3.48Å; W142-K146 PolarHBondContact O-N 3.11Å
143	L	96.1	Very high	95.2	Very high	110 Å²	110	70.2 Å²	70.2	58%	0.576	35%	0.345	S	S	*	.	H	α-helix	trans	-64.6	-50.6	-178.3	-178.5	60.8	0	0	0	111.7	G141 Q145 K146 L147	G141-L143 VanDerWaalsContact C-N 3.26Å; G141-L143 PolarHBondContact O-N 3.2Å; L143-Q145 VanDerWaalsContact C-N 3.31Å; L143-Q145 PolarHBondContact O-N 2.9Å; L143-K146 WeakPolarHBondContact O-CB 3.32Å; L143-K146 PolarHBondContact O-N 3.34Å; L143-K146 VanDerWaalsContact O-N 3.11Å; L143-L147 PolarHBondContact O-N 3.41Å
144	V	94.6	Very high	94.9	Very high	38 Å²	38	67.8 Å²	67.8	23%	0.23	34%	0.342	C	S	.	.	H	α-helix	trans	-65.3	-37.2	-180	-176.2	0	0	0	0	111	H140 G141 K146 L147 F148 V209	H140-V144 HydrophobicContact CB-CB 3.95Å; H140-V144 HydrophobicContact CB-CG1 3.97Å; H140-V144 WeakPolarHBondContact ND1-CG1 3.28Å; G141-V144 PolarHBondContact O-N 3.45Å; V144-K146 VanDerWaalsContact C-N 3.32Å; V144-K146 PolarHBondContact O-N 3.37Å; V144-L147 PolarHBondContact O-N 3.15Å; V144-F148 PolarHBondContact O-N 3.47Å; V144-V209 WeakPolarHBondContact CG2-O 3.47Å
145	Q	95.9	Very high	94.6	Very high	57 Å²	57	62.7 Å²	62.7	27%	0.266	32%	0.316	S	S	.	.	H	α-helix	trans	-61.1	-37.9	172.5	-69.2	-174.8	33.2	0	0	113	Y132 K137 H140 G141 W142 L143 K149	Y132-Q145 WeakPolarHBondContact OH-CA 3.3Å; Y132-Q145 WeakPolarHBondContact OH-CG 3.19Å; K137-Q145 PolarHBondContact O-NE2 2.94Å; H140-Q145 HydrophobicContact CB-CG 4Å; H140-Q145 PolarHBondContact O-NE2 3.47Å; G141-Q145 WeakPolarHBondContact O-CG 3.4Å; G141-Q145 PolarHBondContact O-N 3.06Å; W142-Q145 PolarHBondContact O-N 3.13Å; L143-Q145 VanDerWaalsContact C-N 3.31Å; L143-Q145 PolarHBondContact O-N 2.9Å; Q145-K149 WeakPolarHBondContact O-CG 3.4Å; Q145-K149 PolarHBondContact O-N 2.79Å; Q145-K149 VanDerWaalsContact O-N 3.12Å
146	K	95.4	Very high	94.5	Very high	104 Å²	104	63.9 Å²	63.9	45%	0.452	32%	0.324	S	S	.	.	H	α-helix	trans	-68	-41.1	175.3	-71.3	-71.7	-175.7	172	0	111.8	W142 L143 V144 F148 K149 A150	W142-K146 HydrophobicContact CD2-CG 4.19Å; W142-K146 HydrophobicContact CH2-CG 4.48Å; W142-K146 HydrophobicContact CZ2-CD 4.45Å; W142-K146 HydrophobicContact CZ2-CG 4.04Å; W142-K146 VanDerWaalsContact O-CG 3.31Å; W142-K146 WeakPolarHBondContact O-CG 3.48Å; W142-K146 PolarHBondContact O-N 3.11Å; L143-K146 WeakPolarHBondContact O-CB 3.32Å; L143-K146 PolarHBondContact O-N 3.34Å; L143-K146 VanDerWaalsContact O-N 3.11Å; V144-K146 VanDerWaalsContact C-N 3.32Å; V144-K146 PolarHBondContact O-N 3.37Å; K146-F148 VanDerWaalsContact C-N 3.35Å; K146-F148 PolarHBondContact O-N 2.97Å; K146-K149 PolarHBondContact O-N 3.24Å; K146-A150 PolarHBondContact O-N 3.37Å; K146-A150 VanDerWaalsContact O-N 3.1Å
147	L	93.3	Very high	94.4	Very high	109 Å²	109	69.1 Å²	69.1	57%	0.571	34%	0.343	S	S	*	.	H	α-helix	trans	-60.3	-44.2	174.6	-68.6	174.2	0	0	0	111.4	L143 V144 K149 A150 A151	L143-L147 PolarHBondContact O-N 3.41Å; V144-L147 PolarHBondContact O-N 3.15Å; L147-K149 PolarHBondContact O-N 2.97Å; L147-A150 PolarHBondContact O-N 3.49Å; L147-A151 WeakPolarHBondContact O-CB 3.47Å; L147-A151 PolarHBondContact O-N 3.03Å
148	F	92.6	Very high	94.3	Very high	25 Å²	25	67.8 Å²	67.8	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-59.1	-46.4	174.9	176.4	-94.6	0	0	0	112.2	F103 Y132 V144 K146 A150 A151 V152	F103-F148 HydrophobicContact CE2-CE2 4.42Å; Y132-F148 AromaticContact CD1-CD1 3.36Å; Y132-F148 HydrophobicContact CD1-CD1 3.36Å; Y132-F148 HydrophobicContact CD1-CD2 4.34Å; Y132-F148 AromaticContact CD1-CE1 3.47Å; Y132-F148 HydrophobicContact CD1-CE1 3.47Å; Y132-F148 VanDerWaalsContact CD1-CE1 3.47Å; Y132-F148 HydrophobicContact CD1-CE2 4.42Å; Y132-F148 AromaticContact CD1-CG 3.85Å; Y132-F148 HydrophobicContact CD1-CG 3.85Å; Y132-F148 HydrophobicContact CD1-CZ 4.04Å; Y132-F148 HydrophobicContact CD2-CB 4.33Å; Y132-F148 AromaticContact CD2-CD1 3.97Å; Y132-F148 HydrophobicContact CD2-CD1 3.97Å; Y132-F148 AromaticContact CD2-CD2 3.39Å; Y132-F148 HydrophobicContact CD2-CD2 3.39Å; Y132-F148 HydrophobicContact CD2-CE1 4.17Å; Y132-F148 AromaticContact CD2-CE2 3.61Å; Y132-F148 HydrophobicContact CD2-CE2 3.61Å; Y132-F148 AromaticContact CD2-CG 3.59Å; Y132-F148 HydrophobicContact CD2-CG 3.59Å; Y132-F148 HydrophobicContact CD2-CZ 4.01Å; Y132-F148 HydrophobicContact CE1-CB 4.21Å; Y132-F148 AromaticContact CE1-CD1 3.62Å; Y132-F148 HydrophobicContact CE1-CD1 3.62Å; Y132-F148 HydrophobicContact CE1-CE1 4.21Å; Y132-F148 AromaticContact CE1-CG 3.88Å; Y132-F148 HydrophobicContact CE1-CG 3.88Å; Y132-F148 HydrophobicContact CE2-CB 3.84Å; Y132-F148 HydrophobicContact CE2-CD1 4.17Å; Y132-F148 AromaticContact CE2-CD2 3.74Å; Y132-F148 HydrophobicContact CE2-CD2 3.74Å; Y132-F148 HydrophobicContact CE2-CE2 4.41Å; Y132-F148 AromaticContact CE2-CG 3.61Å; Y132-F148 HydrophobicContact CE2-CG 3.61Å; Y132-F148 AromaticContact CG-CD1 3.55Å; Y132-F148 HydrophobicContact CG-CD1 3.55Å; Y132-F148 AromaticContact CG-CD2 3.72Å; Y132-F148 HydrophobicContact CG-CD2 3.72Å; Y132-F148 AromaticContact CG-CE1 3.45Å; Y132-F148 HydrophobicContact CG-CE1 3.45Å; Y132-F148 VanDerWaalsContact CG-CE1 3.45Å; Y132-F148 AromaticContact CG-CE2 3.61Å; Y132-F148 HydrophobicContact CG-CE2 3.61Å; Y132-F148 AromaticContact CG-CG 3.7Å; Y132-F148 HydrophobicContact CG-CG 3.7Å; Y132-F148 AromaticContact CG-CZ 3.49Å; Y132-F148 HydrophobicContact CG-CZ 3.49Å; Y132-F148 VanDerWaalsContact CG-CZ 3.49Å; Y132-F148 AromaticContact CZ-CG 3.76Å; V144-F148 PolarHBondContact O-N 3.47Å; K146-F148 VanDerWaalsContact C-N 3.35Å; K146-F148 PolarHBondContact O-N 2.97Å; F148-A150 PolarHBondContact O-N 3.28Å; F148-A151 PolarHBondContact O-N 2.95Å; F148-A151 VanDerWaalsContact O-N 3.12Å; F148-V152 HydrophobicContact CE1-CB 4.46Å; F148-V152 HydrophobicContact CZ-CB 4.34Å; F148-V152 HydrophobicContact CZ-CG2 4.3Å; F148-V152 PolarHBondContact O-N 3.3Å
149	K	93.4	Very high	94.2	Very high	125 Å²	125	64.8 Å²	64.8	54%	0.543	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-32.3	178	-76.3	-178.2	177.4	-172.7	0	112.9	Q145 K146 L147 V152 F153	Q145-K149 WeakPolarHBondContact O-CG 3.4Å; Q145-K149 PolarHBondContact O-N 2.79Å; Q145-K149 VanDerWaalsContact O-N 3.12Å; K146-K149 PolarHBondContact O-N 3.24Å; L147-K149 PolarHBondContact O-N 2.97Å; K149-V152 WeakPolarHBondContact O-CG1 3.41Å; K149-F153 VanDerWaalsContact O-CD2 3.24Å; K149-F153 WeakPolarHBondContact O-CD2 3.19Å; K149-F153 VanDerWaalsContact O-CE2 3.3Å; K149-F153 WeakPolarHBondContact O-CE2 3.2Å
150	A	92.6	Very high	94	Very high	66 Å²	66	68.6 Å²	68.6	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-76.2	-46	172.8	0	0	0	0	0	111.4	K146 L147 F148 V152 F153	K146-A150 PolarHBondContact O-N 3.37Å; K146-A150 VanDerWaalsContact O-N 3.1Å; L147-A150 PolarHBondContact O-N 3.49Å; F148-A150 PolarHBondContact O-N 3.28Å; A150-V152 VanDerWaalsContact C-N 3.32Å; A150-V152 PolarHBondContact O-N 3.24Å; A150-F153 PolarHBondContact O-N 3.15Å
151	A	90.7	Very high	93.9	Very high	20 Å²	20	67.2 Å²	67.2	17%	0.165	35%	0.349	C	S	.	.	H	α-helix	trans	-60.8	-35.9	-176.7	0	0	0	0	0	113.6	V41 L147 F148 F153 A154	V41-A151 HydrophobicContact CG1-CB 3.51Å; L147-A151 WeakPolarHBondContact O-CB 3.47Å; L147-A151 PolarHBondContact O-N 3.03Å; F148-A151 PolarHBondContact O-N 2.95Å; F148-A151 VanDerWaalsContact O-N 3.12Å; A151-F153 PolarHBondContact O-N 3.27Å; A151-F153 VanDerWaalsContact O-N 3.11Å; A151-A154 WeakPolarHBondContact O-CB 3.32Å; A151-A154 PolarHBondContact O-N 3.46Å
152	V	92.4	Very high	93.8	Very high	14 Å²	14	66.7 Å²	66.7	9%	0.085	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-61.6	-22.6	-177.8	77.3	0	0	0	0	113.1	R125 C128 F148 K149 A150 A154 A155	R125-V152 HydrophobicContact CB-CG2 4.31Å; R125-V152 HydrophobicContact CG-CG2 4.47Å; C128-V152 HydrophobicContact CB-CG2 3.87Å; F148-V152 HydrophobicContact CE1-CB 4.46Å; F148-V152 HydrophobicContact CZ-CB 4.34Å; F148-V152 HydrophobicContact CZ-CG2 4.3Å; F148-V152 PolarHBondContact O-N 3.3Å; K149-V152 WeakPolarHBondContact O-CG1 3.41Å; A150-V152 VanDerWaalsContact C-N 3.32Å; A150-V152 PolarHBondContact O-N 3.24Å; V152-A154 PolarHBondContact O-N 2.83Å; V152-A155 WeakPolarHBondContact O-CB 3.5Å; V152-A155 PolarHBondContact O-N 3.39Å; V152-A155 VanDerWaalsContact O-N 3.13Å
153	F	91.8	Very high	93.5	Very high	133 Å²	133	63.7 Å²	63.7	58%	0.583	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-67.6	-23.9	175	-75.4	-87.4	0	0	0	113.1	R125 K149 A150 A151 A155	R125-F153 PolarHBondContact NH2-O 3.4Å; K149-F153 VanDerWaalsContact O-CD2 3.24Å; K149-F153 WeakPolarHBondContact O-CD2 3.19Å; K149-F153 VanDerWaalsContact O-CE2 3.3Å; K149-F153 WeakPolarHBondContact O-CE2 3.2Å; A150-F153 PolarHBondContact O-N 3.15Å; A151-F153 PolarHBondContact O-N 3.27Å; A151-F153 VanDerWaalsContact O-N 3.11Å; F153-A155 VanDerWaalsContact C-N 3.31Å
154	A	90.3	Very high	93.3	Very high	48 Å²	48	60.2 Å²	60.2	40%	0.397	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-84.8	-1.6	175	0	0	0	0	0	113.4	V41 A151 V152	V41-A154 HydrophobicContact CB-CB 4.26Å; V41-A154 HydrophobicContact CG1-CB 4.3Å; V41-A154 HydrophobicContact CG2-CB 3.81Å; A151-A154 WeakPolarHBondContact O-CB 3.32Å; A151-A154 PolarHBondContact O-N 3.46Å; V152-A154 PolarHBondContact O-N 2.83Å
155	A	92.6	Very high	93.1	Very high	8 Å²	8	58.4 Å²	58.4	7%	0.066	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59.6	138.8	173.1	0	0	0	0	0	110.1	I124 R125 V152 F153	I124-A155 HydrophobicContact CG1-CB 4.14Å; R125-A155 HydrophobicContact CG-CB 4.46Å; V152-A155 WeakPolarHBondContact O-CB 3.5Å; V152-A155 PolarHBondContact O-N 3.39Å; V152-A155 VanDerWaalsContact O-N 3.13Å; F153-A155 VanDerWaalsContact C-N 3.31Å
156	P	94.2	Very high	92.8	Very high	27 Å²	27	55.8 Å²	55.8	18%	0.175	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-71.4	172.5	-174.3	33.1	-41.8	0	0	0	112.1	L37 I124 D160 F161	L37-P156 VanDerWaalsContact O-CD 3.26Å; L37-P156 WeakPolarHBondContact O-CD 3.37Å; I124-P156 HydrophobicContact CD1-CG 3.92Å; P156-D160 HydrophobicContact CB-CB 4.35Å; P156-F161 HydrophobicContact CG-CB 3.84Å; P156-F161 HydrophobicContact CG-CD2 4.41Å
157	Y	95.3	Very high	92.4	Very high	136 Å²	136	56.7 Å²	56.7	53%	0.533	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-63.6	149.2	160.3	-67.4	-82.4	0	0	0	110.6	D122 L123 A159 D160 F161	D122-Y157 HydrophobicContact CB-CD1 3.93Å; D122-Y157 CarbonylContact O-C 3.58Å; D122-Y157 VanDerWaalsContact O-CA 3.28Å; D122-Y157 WeakPolarHBondContact O-CA 3.29Å; L123-Y157 HydrophobicContact CD2-CD1 3.69Å; L123-Y157 HydrophobicContact CD2-CE1 3.64Å; L123-Y157 HydrophobicContact CD2-CG 4.41Å; Y157-A159 VanDerWaalsContact C-N 3.3Å; Y157-A159 PolarHBondContact O-N 3.4Å; Y157-D160 PolarHBondContact O-N 3Å; Y157-D160 VanDerWaalsContact O-N 3.15Å; Y157-F161 PolarHBondContact O-N 3.23Å
158	K	95.4	Very high	91.9	Very high	45 Å²	45	53.6 Å²	53.6	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-54.4	-46.2	178	-175.4	-178.4	63.2	163.4	0	111.3	L111 D122 I124 D160 F161 L162 E173	L111-K158 HydrophobicContact CD2-CD 4.36Å; L111-K158 HydrophobicContact CD2-CG 4.32Å; D122-K158 PolarHBondContact O-N 2.99Å; I124-K158 HydrophobicContact CG2-CB 3.67Å; I124-K158 HydrophobicContact CG2-CG 4.05Å; K158-D160 VanDerWaalsContact C-N 3.34Å; K158-D160 PolarHBondContact O-N 3.06Å; K158-F161 PolarHBondContact O-N 3.31Å; K158-L162 HydrophobicContact CG-CD1 4.06Å; K158-L162 HydrophobicContact CG-CG 4.38Å; K158-L162 WeakPolarHBondContact O-CB 3.42Å; K158-L162 VanDerWaalsContact O-CG 3.28Å; K158-L162 WeakPolarHBondContact O-CG 3.41Å; K158-L162 PolarHBondContact O-N 2.77Å; K158-E173 VanDerWaalsContact CE-OE1 3.31Å; K158-E173 WeakPolarHBondContact CE-OE1 3.39Å; K158-E173 IonicContact NZ-OE1 3.52Å; K158-E173 PolarHBondContact NZ-OE1 3.23Å; K158-E173 IonicContact NZ-OE2 3.62Å
159	A	93.9	Very high	91.5	Very high	59 Å²	59	59 Å²	59	49%	0.488	32%	0.316	S	S	.	.	H	α-helix	trans	-60.3	-43.1	179	0	0	0	0	0	112.2	Y157 L162 K163	Y157-A159 VanDerWaalsContact C-N 3.3Å; Y157-A159 PolarHBondContact O-N 3.4Å; A159-L162 PolarHBondContact O-N 2.76Å; A159-K163 VanDerWaalsContact O-CB 3.25Å; A159-K163 WeakPolarHBondContact O-CB 3.47Å; A159-K163 PolarHBondContact O-N 3.29Å
160	D	93.5	Very high	90.9	Very high	85 Å²	85	63.3 Å²	63.3	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-41.2	178.7	-68.4	-37.8	0	0	0	111.8	P156 Y157 K158 K163 A164	P156-D160 HydrophobicContact CB-CB 4.35Å; Y157-D160 PolarHBondContact O-N 3Å; Y157-D160 VanDerWaalsContact O-N 3.15Å; K158-D160 VanDerWaalsContact C-N 3.34Å; K158-D160 PolarHBondContact O-N 3.06Å; D160-K163 PolarHBondContact O-N 2.94Å; D160-A164 WeakPolarHBondContact O-CB 3.49Å; D160-A164 PolarHBondContact O-N 3.42Å
161	F	94.3	Very high	90.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.6	-50.3	174.1	176.1	-107.7	0	0	0	112	F33 C36 L37 L108 L111 I124 P156 Y157 K158 K163 A164 L165	F33-F161 HydrophobicContact CE2-CE2 4.08Å; F33-F161 AromaticContact CE2-CZ 3.59Å; F33-F161 HydrophobicContact CE2-CZ 3.59Å; F33-F161 HydrophobicContact CZ-CE2 4.05Å; F33-F161 AromaticContact CZ-CZ 3.67Å; F33-F161 HydrophobicContact CZ-CZ 3.67Å; C36-F161 HydrophobicContact CB-CD2 3.94Å; C36-F161 HydrophobicContact CB-CE2 3.96Å; L37-F161 HydrophobicContact CD2-CD2 3.78Å; L37-F161 HydrophobicContact CD2-CE2 3.58Å; L37-F161 HydrophobicContact CD2-CZ 4.45Å; L37-F161 HydrophobicContact CG-CE2 4.12Å; L108-F161 HydrophobicContact CD2-CE1 4.24Å; L108-F161 HydrophobicContact CD2-CZ 4.27Å; L111-F161 HydrophobicContact CD1-CD1 3.89Å; L111-F161 HydrophobicContact CD1-CE1 3.49Å; L111-F161 VanDerWaalsContact CD1-CE1 3.49Å; L111-F161 HydrophobicContact CD1-CZ 4.49Å; I124-F161 HydrophobicContact CD1-CB 4.15Å; I124-F161 HydrophobicContact CD1-CD1 4.38Å; I124-F161 HydrophobicContact CD1-CD2 4.16Å; I124-F161 HydrophobicContact CD1-CG 3.97Å; P156-F161 HydrophobicContact CG-CB 3.84Å; P156-F161 HydrophobicContact CG-CD2 4.41Å; Y157-F161 PolarHBondContact O-N 3.23Å; K158-F161 PolarHBondContact O-N 3.31Å; F161-K163 VanDerWaalsContact C-N 3.3Å; F161-K163 PolarHBondContact O-N 2.66Å; F161-A164 WeakPolarHBondContact O-CB 3.32Å; F161-A164 PolarHBondContact O-N 3.13Å; F161-A164 VanDerWaalsContact O-N 3.17Å; F161-L165 HydrophobicContact CD1-CD1 4.05Å; F161-L165 HydrophobicContact CE1-CD1 3.45Å; F161-L165 VanDerWaalsContact CE1-CD1 3.45Å; F161-L165 HydrophobicContact CE1-CG 4.2Å; F161-L165 HydrophobicContact CE2-CD1 4.37Å; F161-L165 HydrophobicContact CE2-CD2 4.5Å; F161-L165 HydrophobicContact CE2-CG 4.32Å; F161-L165 HydrophobicContact CZ-CD1 3.64Å; F161-L165 HydrophobicContact CZ-CD2 4.32Å; F161-L165 HydrophobicContact CZ-CG 4.07Å; F161-L165 WeakPolarHBondContact O-CG 3.44Å; F161-L165 PolarHBondContact O-N 3.37Å
162	L	93.4	Very high	90.5	Very high	8 Å²	8	68.6 Å²	68.6	4%	0.042	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-35.3	179.2	-68.6	-179	0	0	0	112.3	K158 A159 L165 S166 E173 C176 L177 I180	K158-L162 HydrophobicContact CG-CD1 4.06Å; K158-L162 HydrophobicContact CG-CG 4.38Å; K158-L162 WeakPolarHBondContact O-CB 3.42Å; K158-L162 VanDerWaalsContact O-CG 3.28Å; K158-L162 WeakPolarHBondContact O-CG 3.41Å; K158-L162 PolarHBondContact O-N 2.77Å; A159-L162 PolarHBondContact O-N 2.76Å; L162-L165 HydrophobicContact CD2-CD1 4.37Å; L162-S166 PolarHBondContact O-N 2.59Å; L162-S166 PolarHBondContact O-OG 3.01Å; L162-E173 HydrophobicContact CD1-CB 4.44Å; L162-E173 HydrophobicContact CD1-CG 3.67Å; L162-C176 PolarHBondContact O-SG 2.8Å; L162-L177 HydrophobicContact CD2-CD2 4.33Å; L162-I180 HydrophobicContact CD2-CD1 3.86Å
163	K	92.1	Very high	90.5	Very high	120 Å²	120	71.8 Å²	71.8	52%	0.522	36%	0.36	S	S	.	.	H	α-helix	trans	-65.9	-42.6	172.6	-177.9	-179.7	175.9	-172.6	0	111.6	A159 D160 F161 S166 K167 G168	A159-K163 VanDerWaalsContact O-CB 3.25Å; A159-K163 WeakPolarHBondContact O-CB 3.47Å; A159-K163 PolarHBondContact O-N 3.29Å; D160-K163 PolarHBondContact O-N 2.94Å; F161-K163 VanDerWaalsContact C-N 3.3Å; F161-K163 PolarHBondContact O-N 2.66Å; K163-S166 CarbonylContact O-C 3.25Å; K163-S166 WeakPolarHBondContact O-CA 3.47Å; K163-S166 WeakPolarHBondContact O-CB 3.46Å; K163-S166 PolarHBondContact O-N 3.11Å; K163-K167 PolarHBondContact O-N 3.23Å; K163-G168 PolarHBondContact O-N 3.5Å
164	A	91.5	Very high	90.6	Very high	38 Å²	38	72 Å²	72	31%	0.314	36%	0.363	S	S	.	.	H	α-helix	trans	-62.8	-44.9	176.2	0	0	0	0	0	111.8	C36 D160 F161 S166 K167	C36-A164 HydrophobicContact CB-CB 3.79Å; D160-A164 WeakPolarHBondContact O-CB 3.49Å; D160-A164 PolarHBondContact O-N 3.42Å; F161-A164 WeakPolarHBondContact O-CB 3.32Å; F161-A164 PolarHBondContact O-N 3.13Å; F161-A164 VanDerWaalsContact O-N 3.17Å; A164-S166 PolarHBondContact O-N 3.48Å; A164-S166 VanDerWaalsContact O-N 3.08Å; A164-K167 WeakPolarHBondContact O-CA 3.26Å; A164-K167 PolarHBondContact O-N 3.2Å
165	L	90.4	Very high	90.7	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.6	-23.7	172.1	-72.1	-179.4	0	0	0	113.2	M1 A2 L3 F33 C36 L108 F161 L162 K167 I180	M1-L165 CarbonylContact C-O 3.49Å; M1-L165 VanDerWaalsContact CA-O 3.28Å; M1-L165 WeakPolarHBondContact CA-O 3.4Å; M1-L165 HydrophobicContact SD-CB 3.75Å; M1-L165 HydrophobicContact SD-CD1 4.17Å; A2-L165 PolarHBondContact N-O 3.2Å; L3-L165 HydrophobicContact CD2-CD2 4.27Å; F33-L165 HydrophobicContact CD2-CD2 3.85Å; F33-L165 HydrophobicContact CE2-CD2 4.15Å; C36-L165 HydrophobicContact CB-CD2 4.48Å; L108-L165 HydrophobicContact CD2-CD1 4.27Å; F161-L165 HydrophobicContact CD1-CD1 4.05Å; F161-L165 HydrophobicContact CE1-CD1 3.45Å; F161-L165 VanDerWaalsContact CE1-CD1 3.45Å; F161-L165 HydrophobicContact CE1-CG 4.2Å; F161-L165 HydrophobicContact CE2-CD1 4.37Å; F161-L165 HydrophobicContact CE2-CD2 4.5Å; F161-L165 HydrophobicContact CE2-CG 4.32Å; F161-L165 HydrophobicContact CZ-CD1 3.64Å; F161-L165 HydrophobicContact CZ-CD2 4.32Å; F161-L165 HydrophobicContact CZ-CG 4.07Å; F161-L165 WeakPolarHBondContact O-CG 3.44Å; F161-L165 PolarHBondContact O-N 3.37Å; L162-L165 HydrophobicContact CD2-CD1 4.37Å; L165-K167 VanDerWaalsContact C-N 3.33Å; L165-I180 HydrophobicContact CD1-CD1 4.19Å
166	S	88.9	Confident	90.7	Very high	2 Å²	2	72.9 Å²	72.9	1%	0.014	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	7.4	174.8	-67	0	0	0	0	114.8	M1 L162 K163 A164 G168 R169	M1-S166 PolarHBondContact N-OG 2.8Å; L162-S166 PolarHBondContact O-N 2.59Å; L162-S166 PolarHBondContact O-OG 3.01Å; K163-S166 CarbonylContact O-C 3.25Å; K163-S166 WeakPolarHBondContact O-CA 3.47Å; K163-S166 WeakPolarHBondContact O-CB 3.46Å; K163-S166 PolarHBondContact O-N 3.11Å; A164-S166 PolarHBondContact O-N 3.48Å; A164-S166 VanDerWaalsContact O-N 3.08Å; S166-G168 PolarHBondContact O-N 2.72Å; S166-R169 WeakPolarHBondContact O-CB 3.48Å; S166-R169 WeakPolarHBondContact O-CG 3.43Å; S166-R169 PolarHBondContact O-N 3.41Å; S166-R169 PolarHBondContact O-NE 3.49Å
167	K	86.9	Confident	90.7	Very high	122 Å²	122	72.6 Å²	72.6	53%	0.53	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	40.6	-173.6	-62.3	-175.7	-175.3	160.1	0	111	A2 E6 K163 A164 L165 R169	A2-K167 HydrophobicContact CB-CB 4.33Å; A2-K167 HydrophobicContact CB-CD 3.43Å; A2-K167 VanDerWaalsContact CB-CD 3.43Å; A2-K167 HydrophobicContact CB-CG 3.71Å; E6-K167 IonicContact OE1-NZ 2.77Å; E6-K167 PolarHBondContact OE1-NZ 3.38Å; E6-K167 IonicContact OE2-NZ 2.66Å; E6-K167 PolarHBondContact OE2-NZ 3.18Å; K163-K167 PolarHBondContact O-N 3.23Å; A164-K167 WeakPolarHBondContact O-CA 3.26Å; A164-K167 PolarHBondContact O-N 3.2Å; L165-K167 VanDerWaalsContact C-N 3.33Å; K167-R169 VanDerWaalsContact C-N 3.25Å; K167-R169 PolarHBondContact O-N 2.9Å
168	G	83.6	Confident	90.7	Very high	45 Å²	45	70 Å²	70	46%	0.464	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-4.6	179.1	0	0	0	0	0	115.8	K163 S166	K163-G168 PolarHBondContact O-N 3.5Å; S166-G168 PolarHBondContact O-N 2.72Å
169	R	83.5	Confident	90.7	Very high	139 Å²	139	72 Å²	72	53%	0.525	36%	0.36	S	S	.	.			trans	-64.1	136.7	176.2	-65.5	-174.8	-76.9	-179.3	-3.5	110.6	A2 S166 K167 V171	A2-R169 VanDerWaalsContact CA-NH2 3.29Å; S166-R169 WeakPolarHBondContact O-CB 3.48Å; S166-R169 WeakPolarHBondContact O-CG 3.43Å; S166-R169 PolarHBondContact O-N 3.41Å; S166-R169 PolarHBondContact O-NE 3.49Å; K167-R169 VanDerWaalsContact C-N 3.25Å; K167-R169 PolarHBondContact O-N 2.9Å; R169-V171 HydrophobicContact CB-CG2 4.07Å; R169-V171 PolarHBondContact O-N 2.88Å
170	K	81.2	Confident	90.8	Very high	215 Å²	215	69.1 Å²	69.1	94%	0.935	34%	0.337	S	S	*	.			trans	-68.9	110.1	169	-71.2	-172.9	179.9	-177.7	0	108.5
171	V	83.1	Confident	90.9	Very high	50 Å²	50	70.3 Å²	70.3	30%	0.303	34%	0.335	S	S	.	.			trans	-133.1	140.3	178.2	-176.4	0	0	0	0	106	R169 D175	R169-V171 HydrophobicContact CB-CG2 4.07Å; R169-V171 PolarHBondContact O-N 2.88Å; V171-D175 HydrophobicContact CG1-CB 3.73Å
172	K	91.8	Very high	91	Very high	147 Å²	147	75.5 Å²	75.5	64%	0.639	36%	0.359	S	S	*	.			trans	-62	147	174.6	-64	180	177	-178.7	0	109.3	E174 D175 C176	K172-E174 VanDerWaalsContact C-N 3.28Å; K172-E174 PolarHBondContact O-N 2.93Å; K172-D175 HydrophobicContact CB-CB 4.39Å; K172-D175 WeakPolarHBondContact CB-OD2 3.35Å; K172-D175 PolarHBondContact O-N 3.06Å; K172-C176 PolarHBondContact O-N 2.75Å
173	E	92.3	Very high	91.1	Very high	80 Å²	80	75.2 Å²	75.2	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-55.9	-45.5	178.1	172.7	164.2	148.5	0	0	111.3	K158 L162 D175 C176 L177	K158-E173 VanDerWaalsContact CE-OE1 3.31Å; K158-E173 WeakPolarHBondContact CE-OE1 3.39Å; K158-E173 IonicContact NZ-OE1 3.52Å; K158-E173 PolarHBondContact NZ-OE1 3.23Å; K158-E173 IonicContact NZ-OE2 3.62Å; L162-E173 HydrophobicContact CD1-CB 4.44Å; L162-E173 HydrophobicContact CD1-CG 3.67Å; E173-D175 PolarHBondContact O-N 3.4Å; E173-C176 CarbonylContact O-C 3.56Å; E173-C176 WeakPolarHBondContact O-CA 3.32Å; E173-C176 WeakPolarHBondContact O-CB 3.12Å; E173-C176 PolarHBondContact O-N 2.71Å; E173-L177 HydrophobicContact CG-CD1 3.88Å; E173-L177 HydrophobicContact CG-CG 4.25Å; E173-L177 WeakPolarHBondContact O-CG 3.4Å; E173-L177 PolarHBondContact O-N 2.79Å
174	E	93.6	Very high	91.4	Very high	139 Å²	139	69.8 Å²	69.8	65%	0.65	33%	0.334	S	S	*	.	H	α-helix	trans	-56.6	-50.7	177.9	-65.8	170.1	-179.7	0	0	112.2	K172 C176 L177 D178	K172-E174 VanDerWaalsContact C-N 3.28Å; K172-E174 PolarHBondContact O-N 2.93Å; E174-C176 PolarHBondContact O-N 3.27Å; E174-L177 PolarHBondContact O-N 2.87Å; E174-L177 VanDerWaalsContact O-N 3.09Å; E174-D178 PolarHBondContact O-N 3.15Å
175	D	92.9	Very high	91.6	Very high	72 Å²	72	72.4 Å²	72.4	39%	0.385	35%	0.347	S	S	.	.	H	α-helix	trans	-59.8	-30.5	175.9	-60	-25.6	0	0	0	112.4	V171 K172 E173 K179	V171-D175 HydrophobicContact CG1-CB 3.73Å; K172-D175 HydrophobicContact CB-CB 4.39Å; K172-D175 WeakPolarHBondContact CB-OD2 3.35Å; K172-D175 PolarHBondContact O-N 3.06Å; E173-D175 PolarHBondContact O-N 3.4Å; D175-K179 WeakPolarHBondContact O-CG 3.23Å; D175-K179 PolarHBondContact O-N 3.29Å
176	C	92.8	Very high	92	Very high	2 Å²	2	74.5 Å²	74.5	1%	0.014	36%	0.358	C	S	.	.	H	α-helix	trans	-69.2	-53	175.2	-150.3	0	0	0	0	109.2	M1 L162 K172 E173 E174 D178 K179 I180	M1-C176 VanDerWaalsContact CE-C 3.47Å; M1-C176 HydrophobicContact CE-CB 3.95Å; M1-C176 WeakPolarHBondContact CE-O 3.37Å; M1-C176 WeakPolarHBondContact CE-SG 3.4Å; L162-C176 PolarHBondContact O-SG 2.8Å; K172-C176 PolarHBondContact O-N 2.75Å; E173-C176 CarbonylContact O-C 3.56Å; E173-C176 WeakPolarHBondContact O-CA 3.32Å; E173-C176 WeakPolarHBondContact O-CB 3.12Å; E173-C176 PolarHBondContact O-N 2.71Å; E174-C176 PolarHBondContact O-N 3.27Å; C176-D178 VanDerWaalsContact C-N 3.31Å; C176-D178 PolarHBondContact O-N 3.22Å; C176-K179 PolarHBondContact O-N 3.45Å; C176-K179 VanDerWaalsContact O-N 3.14Å; C176-I180 PolarHBondContact O-N 3.32Å
177	L	95.3	Very high	92.4	Very high	20 Å²	20	74.5 Å²	74.5	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-37.1	-179.8	-65.6	174.6	0	0	0	112.3	L111 V112 L162 E173 E174 K179 I180 R181	L111-L177 HydrophobicContact CB-CD2 4.47Å; V112-L177 HydrophobicContact CG2-CD2 4.37Å; L162-L177 HydrophobicContact CD2-CD2 4.33Å; E173-L177 HydrophobicContact CG-CD1 3.88Å; E173-L177 HydrophobicContact CG-CG 4.25Å; E173-L177 WeakPolarHBondContact O-CG 3.4Å; E173-L177 PolarHBondContact O-N 2.79Å; E174-L177 PolarHBondContact O-N 2.87Å; E174-L177 VanDerWaalsContact O-N 3.09Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 3.11Å; L177-I180 HydrophobicContact CD2-CD1 4.19Å; L177-I180 WeakPolarHBondContact O-CB 3.09Å; L177-I180 PolarHBondContact O-N 3.13Å; L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 3.08Å
178	D	95.1	Very high	92.9	Very high	82 Å²	82	70 Å²	70	44%	0.439	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-38.2	175.2	-75.7	-19.3	0	0	0	112.9	E174 C176 I180 R181 Q182	E174-D178 PolarHBondContact O-N 3.15Å; C176-D178 VanDerWaalsContact C-N 3.31Å; C176-D178 PolarHBondContact O-N 3.22Å; D178-I180 VanDerWaalsContact C-N 3.35Å; D178-R181 WeakPolarHBondContact O-CB 3.47Å; D178-R181 PolarHBondContact O-N 2.93Å; D178-R181 IonicContact OD1-CZ 2.75Å; D178-R181 IonicContact OD1-NH1 2.68Å; D178-R181 PolarHBondContact OD1-NH1 3.18Å; D178-Q182 PolarHBondContact O-N 3.49Å
179	K	94.4	Very high	93.6	Very high	86 Å²	86	69.8 Å²	69.8	37%	0.374	33%	0.334	S	S	.	.	H	α-helix	trans	-69.8	-33.9	174.2	-71	174.5	-173.5	178.2	0	111.9	M1 M5 D175 C176 L177 Q182 F183	M1-K179 HydrophobicContact CB-CB 3.69Å; M1-K179 HydrophobicContact CB-CD 3.59Å; M1-K179 HydrophobicContact CB-CG 4.25Å; M1-K179 HydrophobicContact CE-CB 4.06Å; M1-K179 HydrophobicContact CG-CB 3.76Å; M5-K179 HydrophobicContact CG-CB 3.94Å; M5-K179 HydrophobicContact CG-CD 4.25Å; M5-K179 HydrophobicContact CG-CG 4.23Å; M5-K179 HydrophobicContact SD-CB 3.92Å; M5-K179 HydrophobicContact SD-CG 4.4Å; M5-K179 VanDerWaalsContact SD-O 3.39Å; D175-K179 WeakPolarHBondContact O-CG 3.23Å; D175-K179 PolarHBondContact O-N 3.29Å; C176-K179 PolarHBondContact O-N 3.45Å; C176-K179 VanDerWaalsContact O-N 3.14Å; L177-K179 VanDerWaalsContact C-N 3.34Å; L177-K179 PolarHBondContact O-N 3.11Å; K179-Q182 PolarHBondContact O-N 3.25Å; K179-F183 WeakPolarHBondContact O-CB 3.38Å; K179-F183 PolarHBondContact O-N 3.35Å
180	I	95.6	Very high	94.3	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-47.7	171.3	-69.5	158.6	0	0	0	109.8	M1 L4 L108 V112 L162 L165 C176 L177 D178 Q182 F183 L184	M1-I180 HydrophobicContact CE-CD1 3.73Å; M1-I180 HydrophobicContact CE-CG1 3.43Å; M1-I180 VanDerWaalsContact CE-CG1 3.43Å; M1-I180 HydrophobicContact SD-CG1 4.06Å; L4-I180 HydrophobicContact CD1-CG1 3.97Å; L108-I180 HydrophobicContact CB-CG2 3.72Å; L108-I180 HydrophobicContact CD1-CG2 4.3Å; L108-I180 HydrophobicContact CD2-CD1 4.06Å; L108-I180 HydrophobicContact CD2-CG1 4.17Å; L108-I180 HydrophobicContact CD2-CG2 3.95Å; L108-I180 HydrophobicContact CG-CG2 4.21Å; V112-I180 HydrophobicContact CG2-CB 3.81Å; V112-I180 HydrophobicContact CG2-CG2 3.46Å; V112-I180 VanDerWaalsContact CG2-CG2 3.46Å; L162-I180 HydrophobicContact CD2-CD1 3.86Å; L165-I180 HydrophobicContact CD1-CD1 4.19Å; C176-I180 PolarHBondContact O-N 3.32Å; L177-I180 HydrophobicContact CD2-CD1 4.19Å; L177-I180 WeakPolarHBondContact O-CB 3.09Å; L177-I180 PolarHBondContact O-N 3.13Å; D178-I180 VanDerWaalsContact C-N 3.35Å; I180-Q182 VanDerWaalsContact C-N 3.27Å; I180-Q182 PolarHBondContact O-N 3.4Å; I180-F183 PolarHBondContact O-N 2.92Å; I180-F183 VanDerWaalsContact O-N 3.14Å; I180-L184 HydrophobicContact CG2-CD1 3.68Å; I180-L184 HydrophobicContact CG2-CG 4.03Å; I180-L184 WeakPolarHBondContact O-CB 3.44Å; I180-L184 VanDerWaalsContact O-CG 3.3Å; I180-L184 WeakPolarHBondContact O-CG 3.4Å; I180-L184 PolarHBondContact O-N 2.85Å
181	R	96.4	Very high	95.1	Very high	109 Å²	109	53.1 Å²	53.1	41%	0.411	27%	0.266	S	S	.	.	H	α-helix	trans	-51.7	-48.5	175.1	-75.8	172.7	-175.9	127.6	9.3	111.3	V112 L177 D178 L184 V185	V112-R181 HydrophobicContact CB-CG 4.25Å; V112-R181 HydrophobicContact CG1-CG 3.33Å; V112-R181 HydrophobicContact CG2-CG 3.87Å; V112-R181 PolarHBondContact O-NH2 2.97Å; L177-R181 WeakPolarHBondContact O-CG 3.27Å; L177-R181 PolarHBondContact O-N 3.08Å; D178-R181 WeakPolarHBondContact O-CB 3.47Å; D178-R181 PolarHBondContact O-N 2.93Å; D178-R181 IonicContact OD1-CZ 2.75Å; D178-R181 IonicContact OD1-NH1 2.68Å; D178-R181 PolarHBondContact OD1-NH1 3.18Å; R181-L184 PolarHBondContact O-N 3.42Å; R181-V185 WeakPolarHBondContact O-CG2 3.4Å; R181-V185 PolarHBondContact O-N 3.15Å
182	Q	95.9	Very high	95.9	Very high	109 Å²	109	53.6 Å²	53.6	51%	0.509	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-44.3	179.4	-169.7	-178.3	3.4	0	0	112.5	M5 D178 K179 I180 L184	M5-Q182 HydrophobicContact CE-CG 4.33Å; D178-Q182 PolarHBondContact O-N 3.49Å; K179-Q182 PolarHBondContact O-N 3.25Å; I180-Q182 VanDerWaalsContact C-N 3.27Å; I180-Q182 PolarHBondContact O-N 3.4Å; Q182-L184 VanDerWaalsContact C-N 3.33Å; Q182-L184 PolarHBondContact O-N 3.16Å
183	F	96	Very high	96.2	Very high	3 Å²	3	47 Å²	47	1%	0.013	24%	0.239	C	C	.	.	H	α-helix	trans	-60.7	-41.9	175.3	168.7	-97.8	0	0	0	112	L4 M5 F9 L30 L108 K179 I180 V185 F187	L4-F183 HydrophobicContact CB-CB 4.22Å; L4-F183 HydrophobicContact CB-CD1 4.45Å; L4-F183 HydrophobicContact CB-CD2 3.95Å; L4-F183 HydrophobicContact CB-CE2 4.47Å; L4-F183 HydrophobicContact CB-CG 3.94Å; L4-F183 HydrophobicContact CD1-CD1 4.2Å; L4-F183 HydrophobicContact CD1-CG 4.44Å; L4-F183 HydrophobicContact CD2-CD1 4.27Å; L4-F183 HydrophobicContact CD2-CD2 4.48Å; L4-F183 HydrophobicContact CD2-CE1 4.04Å; L4-F183 HydrophobicContact CD2-CE2 4.26Å; L4-F183 HydrophobicContact CD2-CG 4.49Å; L4-F183 HydrophobicContact CD2-CZ 4.05Å; L4-F183 WeakPolarHBondContact O-CD2 3.25Å; M5-F183 HydrophobicContact SD-CB 4.47Å; F9-F183 AromaticContact CD2-CE2 3.93Å; F9-F183 HydrophobicContact CD2-CE2 3.93Å; F9-F183 HydrophobicContact CD2-CZ 4.28Å; F9-F183 AromaticContact CE2-CE2 3.98Å; F9-F183 HydrophobicContact CE2-CE2 3.98Å; F9-F183 HydrophobicContact CE2-CZ 4.03Å; L30-F183 HydrophobicContact CD2-CE2 4.4Å; L30-F183 HydrophobicContact CD2-CZ 3.92Å; L108-F183 HydrophobicContact CD1-CD1 4.14Å; L108-F183 HydrophobicContact CD1-CE1 4.03Å; K179-F183 WeakPolarHBondContact O-CB 3.38Å; K179-F183 PolarHBondContact O-N 3.35Å; I180-F183 PolarHBondContact O-N 2.92Å; I180-F183 VanDerWaalsContact O-N 3.14Å; F183-V185 VanDerWaalsContact C-N 3.25Å; F183-V185 PolarHBondContact O-N 3.48Å; F183-F187 HydrophobicContact CD1-CB 4.29Å; F183-F187 HydrophobicContact CD1-CD1 4.39Å; F183-F187 HydrophobicContact CD1-CG 4.48Å; F183-F187 HydrophobicContact CE1-CB 3.87Å; F183-F187 AromaticContact CE1-CD1 3.54Å; F183-F187 HydrophobicContact CE1-CD1 3.54Å; F183-F187 HydrophobicContact CE1-CD2 4.28Å; F183-F187 HydrophobicContact CE1-CE1 4.04Å; F183-F187 AromaticContact CE1-CG 3.63Å; F183-F187 HydrophobicContact CE1-CG 3.63Å; F183-F187 HydrophobicContact CE2-CB 4.4Å; F183-F187 HydrophobicContact CZ-CB 3.92Å; F183-F187 AromaticContact CZ-CD1 4Å; F183-F187 HydrophobicContact CZ-CD1 4Å; F183-F187 AromaticContact CZ-CD2 3.88Å; F183-F187 HydrophobicContact CZ-CD2 3.88Å; F183-F187 HydrophobicContact CZ-CE1 4.42Å; F183-F187 HydrophobicContact CZ-CE2 4.34Å; F183-F187 AromaticContact CZ-CG 3.66Å; F183-F187 HydrophobicContact CZ-CG 3.66Å; F183-F187 VanDerWaalsContact O-CB 3.26Å; F183-F187 WeakPolarHBondContact O-CB 3.47Å; F183-F187 PolarHBondContact O-N 3.45Å
184	L	97.5	Very high	96.5	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-24.9	-175.6	-77.2	173.9	0	0	0	113.8	Q105 L108 Q109 V112 I180 R181 Q182 F187 T188	Q105-L184 HydrophobicContact CG-CD2 4.25Å; L108-L184 HydrophobicContact CB-CD1 4.15Å; L108-L184 HydrophobicContact CB-CD2 3.96Å; L108-L184 HydrophobicContact CB-CG 4.37Å; L108-L184 HydrophobicContact CD1-CD2 4.49Å; Q109-L184 HydrophobicContact CB-CD1 4.09Å; V112-L184 HydrophobicContact CG2-CD1 4.29Å; I180-L184 HydrophobicContact CG2-CD1 3.68Å; I180-L184 HydrophobicContact CG2-CG 4.03Å; I180-L184 WeakPolarHBondContact O-CB 3.44Å; I180-L184 VanDerWaalsContact O-CG 3.3Å; I180-L184 WeakPolarHBondContact O-CG 3.4Å; I180-L184 PolarHBondContact O-N 2.85Å; R181-L184 PolarHBondContact O-N 3.42Å; Q182-L184 VanDerWaalsContact C-N 3.33Å; Q182-L184 PolarHBondContact O-N 3.16Å; L184-F187 HydrophobicContact CD2-CD1 4.08Å; L184-T188 WeakPolarHBondContact O-CB 3.2Å; L184-T188 PolarHBondContact O-N 3.41Å; L184-T188 PolarHBondContact O-OG1 2.95Å
185	V	97.3	Very high	96.7	Very high	94 Å²	94	38.8 Å²	38.8	57%	0.57	20%	0.2	S	C	*	.	H	α-helix	trans	-56	-65.8	-179.1	-178.5	0	0	0	0	111.3	R181 F183 A189	R181-V185 WeakPolarHBondContact O-CG2 3.4Å; R181-V185 PolarHBondContact O-N 3.15Å; F183-V185 VanDerWaalsContact C-N 3.25Å; F183-V185 PolarHBondContact O-N 3.48Å; V185-A189 PolarHBondContact O-N 2.98Å
186	N	97.5	Very high	97	Very high	44 Å²	44	38.7 Å²	38.7	24%	0.235	20%	0.197	C	C	.	.	H	α-helix	trans	-77.8	-28.8	-176.6	-67.5	-18.5	0	0	0	111.8	F9 Q11 A190	F9-N186 HydrophobicContact CB-CB 3.8Å; F9-N186 WeakPolarHBondContact O-CB 3.09Å; F9-N186 PolarHBondContact O-ND2 2.91Å; Q11-N186 PolarHBondContact N-ND2 3.17Å; N186-A190 VanDerWaalsContact O-CB 3.27Å; N186-A190 WeakPolarHBondContact O-CB 3.38Å; N186-A190 PolarHBondContact O-N 3.48Å
187	F	97.9	Very high	97.3	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-46.4	176.2	178.9	-123.2	0	0	0	111.8	F9 L30 L101 I104 Q105 F183 L184 N191	F9-F187 HydrophobicContact CD1-CD2 4.4Å; F9-F187 HydrophobicContact CD2-CB 3.97Å; F9-F187 AromaticContact CD2-CD2 3.64Å; F9-F187 HydrophobicContact CD2-CD2 3.64Å; F9-F187 HydrophobicContact CD2-CG 4.25Å; F9-F187 HydrophobicContact CE1-CD2 4.04Å; F9-F187 HydrophobicContact CE1-CE2 4.45Å; F9-F187 HydrophobicContact CE2-CB 4.4Å; F9-F187 AromaticContact CE2-CD2 3.25Å; F9-F187 HydrophobicContact CE2-CD2 3.25Å; F9-F187 AromaticContact CE2-CE2 3.8Å; F9-F187 HydrophobicContact CE2-CE2 3.8Å; F9-F187 HydrophobicContact CE2-CG 4.19Å; F9-F187 HydrophobicContact CG-CB 4.4Å; F9-F187 HydrophobicContact CG-CD2 4.22Å; F9-F187 AromaticContact CZ-CD2 3.46Å; F9-F187 HydrophobicContact CZ-CD2 3.46Å; F9-F187 VanDerWaalsContact CZ-CD2 3.46Å; F9-F187 AromaticContact CZ-CE2 3.7Å; F9-F187 HydrophobicContact CZ-CE2 3.7Å; L30-F187 HydrophobicContact CD1-CE2 3.95Å; L30-F187 HydrophobicContact CD1-CZ 4.34Å; L101-F187 HydrophobicContact CB-CE2 4.08Å; L101-F187 HydrophobicContact CB-CZ 3.88Å; L101-F187 HydrophobicContact CD1-CE2 4.43Å; L101-F187 HydrophobicContact CD2-CE2 4.05Å; L101-F187 HydrophobicContact CD2-CZ 4.2Å; L101-F187 HydrophobicContact CG-CE2 4.4Å; L101-F187 WeakPolarHBondContact O-CZ 3.36Å; I104-F187 HydrophobicContact CB-CE1 4.39Å; I104-F187 HydrophobicContact CB-CZ 4.32Å; I104-F187 HydrophobicContact CG2-CE1 4.19Å; I104-F187 HydrophobicContact CG2-CZ 4.32Å; Q105-F187 HydrophobicContact CB-CD1 4.06Å; Q105-F187 HydrophobicContact CB-CE1 3.56Å; Q105-F187 HydrophobicContact CB-CZ 4.48Å; Q105-F187 HydrophobicContact CG-CD1 4.3Å; Q105-F187 HydrophobicContact CG-CE1 4.29Å; F183-F187 HydrophobicContact CD1-CB 4.29Å; F183-F187 HydrophobicContact CD1-CD1 4.39Å; F183-F187 HydrophobicContact CD1-CG 4.48Å; F183-F187 HydrophobicContact CE1-CB 3.87Å; F183-F187 AromaticContact CE1-CD1 3.54Å; F183-F187 HydrophobicContact CE1-CD1 3.54Å; F183-F187 HydrophobicContact CE1-CD2 4.28Å; F183-F187 HydrophobicContact CE1-CE1 4.04Å; F183-F187 AromaticContact CE1-CG 3.63Å; F183-F187 HydrophobicContact CE1-CG 3.63Å; F183-F187 HydrophobicContact CE2-CB 4.4Å; F183-F187 HydrophobicContact CZ-CB 3.92Å; F183-F187 AromaticContact CZ-CD1 4Å; F183-F187 HydrophobicContact CZ-CD1 4Å; F183-F187 AromaticContact CZ-CD2 3.88Å; F183-F187 HydrophobicContact CZ-CD2 3.88Å; F183-F187 HydrophobicContact CZ-CE1 4.42Å; F183-F187 HydrophobicContact CZ-CE2 4.34Å; F183-F187 AromaticContact CZ-CG 3.66Å; F183-F187 HydrophobicContact CZ-CG 3.66Å; F183-F187 VanDerWaalsContact O-CB 3.26Å; F183-F187 WeakPolarHBondContact O-CB 3.47Å; F183-F187 PolarHBondContact O-N 3.45Å; L184-F187 HydrophobicContact CD2-CD1 4.08Å; F187-N191 WeakPolarHBondContact O-CB 3.43Å; F187-N191 PolarHBondContact O-N 3.36Å
188	T	98.2	Very high	97.4	Very high	29 Å²	29	38.4 Å²	38.4	18%	0.178	20%	0.195	C	C	.	.	H	α-helix	trans	-63.4	-48.4	177	-61.3	0	0	0	0	110.7	L184 A190 N191 D192	L184-T188 WeakPolarHBondContact O-CB 3.2Å; L184-T188 PolarHBondContact O-N 3.41Å; L184-T188 PolarHBondContact O-OG1 2.95Å; T188-A190 PolarHBondContact O-N 3.34Å; T188-N191 PolarHBondContact O-N 3.44Å; T188-D192 WeakPolarHBondContact CG2-OD2 3.48Å; T188-D192 WeakPolarHBondContact O-CB 3.31Å; T188-D192 VanDerWaalsContact O-CG 3.25Å; T188-D192 PolarHBondContact O-N 3.33Å
189	A	98.3	Very high	97.6	Very high	39 Å²	39	39.7 Å²	39.7	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-58.5	-45.8	179	0	0	0	0	0	112.5	L12 V185 D192 A193	L12-A189 HydrophobicContact CD1-CB 4.24Å; L12-A189 WeakPolarHBondContact CD1-O 3.36Å; V185-A189 PolarHBondContact O-N 2.98Å; A189-D192 PolarHBondContact O-N 3.24Å; A189-A193 WeakPolarHBondContact O-CB 3.29Å; A189-A193 PolarHBondContact O-N 3.42Å
190	A	98.1	Very high	97.7	Very high	3 Å²	3	43.3 Å²	43.3	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-45.4	177.3	0	0	0	0	0	111.9	F9 L12 N186 T188 A193 I194	F9-A190 HydrophobicContact CD1-CB 3.79Å; F9-A190 HydrophobicContact CE1-CB 4.46Å; L12-A190 HydrophobicContact CD2-CB 4.47Å; N186-A190 VanDerWaalsContact O-CB 3.27Å; N186-A190 WeakPolarHBondContact O-CB 3.38Å; N186-A190 PolarHBondContact O-N 3.48Å; T188-A190 PolarHBondContact O-N 3.34Å; A190-A193 PolarHBondContact O-N 2.99Å; A190-I194 VanDerWaalsContact O-CG1 3.32Å; A190-I194 WeakPolarHBondContact O-CG1 3.36Å; A190-I194 PolarHBondContact O-N 3.1Å; A190-I194 VanDerWaalsContact O-N 3.15Å
191	N	98.1	Very high	97.9	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.011	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-43	178.8	-162.4	31.4	0	0	0	111.4	K98 R102 Q105 F187 T188 A193 I194 Y195	K98-N191 PolarHBondContact O-OD1 2.9Å; R102-N191 WeakPolarHBondContact CA-ND2 3.22Å; R102-N191 PolarHBondContact N-ND2 3.29Å; R102-N191 PolarHBondContact NE-ND2 3.26Å; Q105-N191 PolarHBondContact OE1-ND2 2.61Å; F187-N191 WeakPolarHBondContact O-CB 3.43Å; F187-N191 PolarHBondContact O-N 3.36Å; T188-N191 PolarHBondContact O-N 3.44Å; N191-A193 VanDerWaalsContact C-N 3.35Å; N191-A193 PolarHBondContact O-N 2.99Å; N191-I194 WeakPolarHBondContact O-CB 3.43Å; N191-I194 PolarHBondContact O-N 3.45Å; N191-I194 VanDerWaalsContact O-N 3.16Å; N191-Y195 VanDerWaalsContact O-CD2 3.32Å; N191-Y195 WeakPolarHBondContact O-CD2 3.19Å; N191-Y195 PolarHBondContact O-N 3.13Å
192	D	98.5	Very high	97.9	Very high	59 Å²	59	45.4 Å²	45.4	32%	0.316	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-43	175.9	-71.3	-18.4	0	0	0	111.8	R102 T188 A189 I194 Y195 E196	R102-D192 IonicContact CZ-OD1 2.89Å; R102-D192 IonicContact NH1-OD1 3.51Å; R102-D192 PolarHBondContact NH1-OD1 3.45Å; R102-D192 IonicContact NH2-OD1 2.68Å; R102-D192 PolarHBondContact NH2-OD1 3.17Å; T188-D192 WeakPolarHBondContact CG2-OD2 3.48Å; T188-D192 WeakPolarHBondContact O-CB 3.31Å; T188-D192 VanDerWaalsContact O-CG 3.25Å; T188-D192 PolarHBondContact O-N 3.33Å; A189-D192 PolarHBondContact O-N 3.24Å; D192-I194 VanDerWaalsContact C-N 3.28Å; D192-I194 PolarHBondContact O-N 2.72Å; D192-Y195 PolarHBondContact O-N 2.65Å; D192-Y195 VanDerWaalsContact O-N 3.15Å; D192-E196 WeakPolarHBondContact O-CG 3.45Å; D192-E196 PolarHBondContact O-N 3.33Å
193	A	98.5	Very high	98.1	Very high	8 Å²	8	40.2 Å²	40.2	7%	0.066	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-37.5	175.5	0	0	0	0	0	112.5	L12 K16 V18 A189 A190 N191 E196 M197	L12-A193 HydrophobicContact CD1-CB 3.61Å; K16-A193 HydrophobicContact CB-CB 4.43Å; V18-A193 HydrophobicContact CG2-CB 4.14Å; A189-A193 WeakPolarHBondContact O-CB 3.29Å; A189-A193 PolarHBondContact O-N 3.42Å; A190-A193 PolarHBondContact O-N 2.99Å; N191-A193 VanDerWaalsContact C-N 3.35Å; N191-A193 PolarHBondContact O-N 2.99Å; A193-E196 PolarHBondContact O-N 3.09Å; A193-M197 VanDerWaalsContact O-CB 3.31Å; A193-M197 WeakPolarHBondContact O-CB 3.26Å; A193-M197 PolarHBondContact O-N 3.39Å
194	I	98.7	Very high	98.1	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-44	175	-63.1	164.4	0	0	0	110.3	V18 F23 L70 L94 K98 A190 N191 D192 M197 Y198	V18-I194 HydrophobicContact CG2-CG1 4.23Å; F23-I194 HydrophobicContact CD2-CD1 4.12Å; F23-I194 HydrophobicContact CE2-CD1 3.39Å; F23-I194 HydrophobicContact CZ-CD1 3.71Å; L70-I194 HydrophobicContact CD1-CD1 3.74Å; L70-I194 HydrophobicContact CD1-CG1 3.84Å; L94-I194 HydrophobicContact CD1-CD1 4.46Å; L94-I194 HydrophobicContact CD1-CG2 4.31Å; L94-I194 HydrophobicContact CD2-CG2 4.32Å; L94-I194 HydrophobicContact CG-CG2 4.25Å; K98-I194 HydrophobicContact CB-CG2 3.91Å; K98-I194 HydrophobicContact CD-CG2 3.68Å; K98-I194 HydrophobicContact CG-CG2 4.4Å; A190-I194 VanDerWaalsContact O-CG1 3.32Å; A190-I194 WeakPolarHBondContact O-CG1 3.36Å; A190-I194 PolarHBondContact O-N 3.1Å; A190-I194 VanDerWaalsContact O-N 3.15Å; N191-I194 WeakPolarHBondContact O-CB 3.43Å; N191-I194 PolarHBondContact O-N 3.45Å; N191-I194 VanDerWaalsContact O-N 3.16Å; D192-I194 VanDerWaalsContact C-N 3.28Å; D192-I194 PolarHBondContact O-N 2.72Å; I194-M197 HydrophobicContact CG2-CE 4.01Å; I194-M197 WeakPolarHBondContact O-CB 3.04Å; I194-M197 PolarHBondContact O-N 2.65Å; I194-Y198 HydrophobicContact CG2-CD2 3.9Å; I194-Y198 HydrophobicContact CG2-CE2 3.85Å; I194-Y198 VanDerWaalsContact O-CD2 3.26Å; I194-Y198 WeakPolarHBondContact O-CD2 3.34Å; I194-Y198 PolarHBondContact O-N 3.08Å
195	Y	98.6	Very high	98.1	Very high	47 Å²	47	43.9 Å²	43.9	18%	0.184	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-43.7	175.6	-87.2	-100.5	0	0	0	112.3	K98 R99 R102 N191 D192 M197 Y198 T199	K98-Y195 HydrophobicContact CB-CD2 4.35Å; K98-Y195 HydrophobicContact CB-CE2 3.92Å; K98-Y195 HydrophobicContact CD-CD2 4.15Å; K98-Y195 HydrophobicContact CD-CE2 4.17Å; K98-Y195 HydrophobicContact CD-CG 4.48Å; K98-Y195 HydrophobicContact CG-CD2 4.36Å; K98-Y195 HydrophobicContact CG-CE2 3.9Å; K98-Y195 WeakPolarHBondContact O-CE2 3.46Å; K98-Y195 PolarHBondContact O-OH 2.9Å; R99-Y195 WeakPolarHBondContact CA-OH 3.24Å; R102-Y195 HydrophobicContact CB-CE2 4.13Å; R102-Y195 WeakPolarHBondContact CB-OH 3.47Å; N191-Y195 VanDerWaalsContact O-CD2 3.32Å; N191-Y195 WeakPolarHBondContact O-CD2 3.19Å; N191-Y195 PolarHBondContact O-N 3.13Å; D192-Y195 PolarHBondContact O-N 2.65Å; D192-Y195 VanDerWaalsContact O-N 3.15Å; Y195-M197 VanDerWaalsContact C-N 3.31Å; Y195-M197 PolarHBondContact O-N 2.81Å; Y195-Y198 PolarHBondContact O-N 3.31Å; Y195-T199 PolarHBondContact O-N 3.4Å; Y195-T199 VanDerWaalsContact O-N 3.1Å; Y195-T199 PolarHBondContact O-OG1 2.82Å; Y195-T199 VanDerWaalsContact O-OG1 3.13Å
196	E	98.4	Very high	98	Very high	70 Å²	70	46.6 Å²	46.6	33%	0.327	24%	0.241	S	C	.	.	H	α-helix	trans	-58	-43.8	174	-74.6	-178.4	-154.9	0	0	111.5	K16 D192 A193 T199 K200	K16-E196 VanDerWaalsContact NZ-CD 3.3Å; K16-E196 IonicContact NZ-OE1 2.76Å; K16-E196 PolarHBondContact NZ-OE1 3.31Å; K16-E196 IonicContact NZ-OE2 2.6Å; K16-E196 PolarHBondContact NZ-OE2 3.41Å; D192-E196 WeakPolarHBondContact O-CG 3.45Å; D192-E196 PolarHBondContact O-N 3.33Å; A193-E196 PolarHBondContact O-N 3.09Å; E196-T199 PolarHBondContact O-N 3.33Å; E196-K200 WeakPolarHBondContact O-CB 3.45Å; E196-K200 VanDerWaalsContact O-CG 3.32Å; E196-K200 WeakPolarHBondContact O-CG 3.48Å; E196-K200 PolarHBondContact O-N 3.23Å; E196-K200 IonicContact OE2-NZ 3.17Å
197	M	98.4	Very high	97.9	Very high	16 Å²	16	47.7 Å²	47.7	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-59.2	-50.1	176.7	165.1	177.4	82.8	0	0	111.8	L70 Q71 L74 L94 A193 I194 Y195 T199 K200 M201	L70-M197 HydrophobicContact CB-CE 3.98Å; L70-M197 HydrophobicContact CB-SD 4.3Å; Q71-M197 VanDerWaalsContact CA-SD 3.51Å; Q71-M197 HydrophobicContact CB-SD 3.98Å; Q71-M197 PolarHBondContact N-SD 3.07Å; Q71-M197 PolarHBondContact OE1-SD 3.13Å; Q71-M197 VanDerWaalsContact OE1-SD 3.4Å; L74-M197 HydrophobicContact CD1-CE 4.14Å; L74-M197 HydrophobicContact CD2-CE 3.94Å; L74-M197 HydrophobicContact CD2-CG 4.09Å; L74-M197 HydrophobicContact CD2-SD 4.24Å; L94-M197 HydrophobicContact CD2-CE 3.86Å; A193-M197 VanDerWaalsContact O-CB 3.31Å; A193-M197 WeakPolarHBondContact O-CB 3.26Å; A193-M197 PolarHBondContact O-N 3.39Å; I194-M197 HydrophobicContact CG2-CE 4.01Å; I194-M197 WeakPolarHBondContact O-CB 3.04Å; I194-M197 PolarHBondContact O-N 2.65Å; Y195-M197 VanDerWaalsContact C-N 3.31Å; Y195-M197 PolarHBondContact O-N 2.81Å; M197-T199 VanDerWaalsContact C-N 3.29Å; M197-T199 PolarHBondContact O-N 2.93Å; M197-K200 PolarHBondContact O-N 2.83Å; M197-M201 HydrophobicContact CG-CG 4.49Å; M197-M201 HydrophobicContact CG-SD 4.06Å; M197-M201 WeakPolarHBondContact O-CB 3.48Å; M197-M201 WeakPolarHBondContact O-CG 3.44Å; M197-M201 PolarHBondContact O-N 3.35Å
198	Y	98.6	Very high	97.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-41.4	179.4	-91.2	-104.7	0	0	0	112.1	L74 T91 L94 M95 K98 I194 Y195 N202 A203	L74-Y198 HydrophobicContact CD1-CE2 4.48Å; L74-Y198 HydrophobicContact CD2-CD2 4.19Å; L74-Y198 HydrophobicContact CD2-CE1 4.49Å; L74-Y198 HydrophobicContact CD2-CE2 3.95Å; T91-Y198 HydrophobicContact CG2-CE1 4.35Å; T91-Y198 PolarHBondContact O-OH 3.41Å; L94-Y198 WeakPolarHBondContact CB-OH 3.33Å; L94-Y198 HydrophobicContact CD2-CE2 3.87Å; L94-Y198 HydrophobicContact CG-CE2 3.92Å; L94-Y198 WeakPolarHBondContact CG-OH 3.26Å; M95-Y198 HydrophobicContact CB-CD1 4.35Å; M95-Y198 HydrophobicContact CB-CE1 3.52Å; M95-Y198 HydrophobicContact CG-CD1 4.16Å; M95-Y198 HydrophobicContact CG-CE1 3.81Å; M95-Y198 PolarHBondContact N-OH 2.94Å; K98-Y198 HydrophobicContact CD-CD2 3.81Å; K98-Y198 HydrophobicContact CD-CE2 3.96Å; K98-Y198 HydrophobicContact CD-CG 4.09Å; K98-Y198 VanDerWaalsContact CE-CG 3.46Å; I194-Y198 HydrophobicContact CG2-CD2 3.9Å; I194-Y198 HydrophobicContact CG2-CE2 3.85Å; I194-Y198 VanDerWaalsContact O-CD2 3.26Å; I194-Y198 WeakPolarHBondContact O-CD2 3.34Å; I194-Y198 PolarHBondContact O-N 3.08Å; Y195-Y198 PolarHBondContact O-N 3.31Å; Y198-N202 PolarHBondContact O-N 3.41Å; Y198-A203 HydrophobicContact CD1-CB 3.59Å; Y198-A203 WeakPolarHBondContact CD1-O 3.32Å; Y198-A203 HydrophobicContact CE1-CB 3.94Å; Y198-A203 HydrophobicContact CG-CB 4.16Å; Y198-A203 PolarHBondContact O-N 2.89Å
199	T	98.3	Very high	97.5	Very high	108 Å²	108	55 Å²	55	66%	0.663	29%	0.286	S	S	*	.	H	α-helix	trans	-63.2	-50.4	175.3	-59.1	0	0	0	0	111.3	Y195 E196 M197 M201 N202	Y195-T199 PolarHBondContact O-N 3.4Å; Y195-T199 VanDerWaalsContact O-N 3.1Å; Y195-T199 PolarHBondContact O-OG1 2.82Å; Y195-T199 VanDerWaalsContact O-OG1 3.13Å; E196-T199 PolarHBondContact O-N 3.33Å; M197-T199 VanDerWaalsContact C-N 3.29Å; M197-T199 PolarHBondContact O-N 2.93Å; T199-M201 VanDerWaalsContact C-N 3.28Å; T199-M201 PolarHBondContact O-N 2.93Å; T199-N202 PolarHBondContact O-N 3.05Å
200	K	98	Very high	97.4	Very high	162 Å²	162	55.8 Å²	55.8	70%	0.704	29%	0.285	S	S	*	.	H	α-helix	trans	-61.8	-35.6	-178.7	-74.6	174.2	-176.2	171.2	0	112.9	E196 M197 N202	E196-K200 WeakPolarHBondContact O-CB 3.45Å; E196-K200 VanDerWaalsContact O-CG 3.32Å; E196-K200 WeakPolarHBondContact O-CG 3.48Å; E196-K200 PolarHBondContact O-N 3.23Å; E196-K200 IonicContact OE2-NZ 3.17Å; M197-K200 PolarHBondContact O-N 2.83Å; K200-N202 VanDerWaalsContact C-N 3.34Å
201	M	97.9	Very high	97.4	Very high	22 Å²	22	58.5 Å²	58.5	11%	0.108	30%	0.298	C	S	.	.	H	α-helix	trans	-84.7	-8.5	-179	-66.4	-167.7	77.2	0	0	113.9	Q71 L74 E75 W85 M197 T199 A203	Q71-M201 PolarHBondContact NE2-SD 3.44Å; L74-M201 HydrophobicContact CB-CE 3.62Å; L74-M201 HydrophobicContact CB-SD 3.5Å; L74-M201 VanDerWaalsContact CB-SD 3.5Å; L74-M201 HydrophobicContact CD2-SD 3.6Å; L74-M201 VanDerWaalsContact CD2-SD 3.6Å; L74-M201 HydrophobicContact CG-SD 4.21Å; E75-M201 HydrophobicContact CB-CE 4.44Å; E75-M201 HydrophobicContact CG-CE 3.61Å; W85-M201 HydrophobicContact CH2-CB 4.2Å; W85-M201 VanDerWaalsContact CH2-O 3.29Å; W85-M201 WeakPolarHBondContact CH2-O 3.36Å; M197-M201 HydrophobicContact CG-CG 4.49Å; M197-M201 HydrophobicContact CG-SD 4.06Å; M197-M201 WeakPolarHBondContact O-CB 3.48Å; M197-M201 WeakPolarHBondContact O-CG 3.44Å; M197-M201 PolarHBondContact O-N 3.35Å; T199-M201 VanDerWaalsContact C-N 3.28Å; T199-M201 PolarHBondContact O-N 2.93Å; M201-A203 VanDerWaalsContact C-N 3.3Å; M201-A203 HydrophobicContact CB-CB 4.24Å
202	N	98.1	Very high	97.4	Very high	131 Å²	131	61.7 Å²	61.7	70%	0.701	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	43.4	-167.8	-164.6	44.9	0	0	0	112.3	Y198 T199 K200	Y198-N202 PolarHBondContact O-N 3.41Å; T199-N202 PolarHBondContact O-N 3.05Å; K200-N202 VanDerWaalsContact C-N 3.34Å
203	A	98.4	Very high	97.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.314	C	S	.	.			trans	-98.3	-5.7	-178.1	0	0	0	0	0	113.4	L74 W85 P86 T91 Y198 M201	L74-A203 HydrophobicContact CD2-CB 3.96Å; W85-A203 HydrophobicContact CH2-CB 3.46Å; W85-A203 VanDerWaalsContact CH2-CB 3.46Å; W85-A203 HydrophobicContact CZ2-CB 3.51Å; W85-A203 HydrophobicContact CZ3-CB 4.49Å; P86-A203 HydrophobicContact CB-CB 4.16Å; P86-A203 WeakPolarHBondContact CG-O 3.47Å; T91-A203 HydrophobicContact CG2-CB 4.36Å; Y198-A203 HydrophobicContact CD1-CB 3.59Å; Y198-A203 WeakPolarHBondContact CD1-O 3.32Å; Y198-A203 HydrophobicContact CE1-CB 3.94Å; Y198-A203 HydrophobicContact CG-CB 4.16Å; Y198-A203 PolarHBondContact O-N 2.89Å; M201-A203 VanDerWaalsContact C-N 3.3Å; M201-A203 HydrophobicContact CB-CB 4.24Å
204	E	98	Very high	97.2	Very high	45 Å²	45	65.2 Å²	65.2	21%	0.21	33%	0.33	C	S	.	.			trans	-81.3	129.5	-178.2	-171.7	67.1	-165.7	0	0	111.1	K98 R99 Y139	K98-E204 WeakPolarHBondContact CE-OE2 3.46Å; K98-E204 IonicContact NZ-OE1 3.13Å; K98-E204 PolarHBondContact NZ-OE1 3.11Å; K98-E204 IonicContact NZ-OE2 2.93Å; K98-E204 PolarHBondContact NZ-OE2 3.09Å; R99-E204 IonicContact CZ-OE1 2.7Å; R99-E204 IonicContact NE-OE1 3.82Å; R99-E204 IonicContact NH2-OE1 3.87Å; R99-E204 PolarHBondContact NH2-OE1 3.18Å; Y139-E204 PolarHBondContact OH-OE1 3.18Å
205	L	97.3	Very high	97.1	Very high	41 Å²	41	69.5 Å²	69.5	22%	0.215	35%	0.351	C	S	.	.			trans	-112.4	141.3	175	-58.8	173	0	0	0	111.6	P86 K87 M95 R99 Y207	P86-L205 HydrophobicContact CG-CD1 4.1Å; P86-L205 HydrophobicContact CG-CD2 3.72Å; P86-L205 HydrophobicContact CG-CG 3.82Å; K87-L205 HydrophobicContact CB-CD1 3.73Å; K87-L205 HydrophobicContact CD-CD1 4.4Å; K87-L205 HydrophobicContact CG-CD1 3.81Å; M95-L205 HydrophobicContact CE-CB 4.04Å; M95-L205 HydrophobicContact CE-CD1 4.31Å; M95-L205 HydrophobicContact SD-CB 3.79Å; M95-L205 HydrophobicContact SD-CD1 4.36Å; M95-L205 HydrophobicContact SD-CG 4.07Å; M95-L205 PolarHBondContact SD-N 3.06Å; M95-L205 VanDerWaalsContact SD-N 3.39Å; R99-L205 PolarHBondContact NH2-O 3.33Å; L205-Y207 HydrophobicContact CB-CD1 3.78Å; L205-Y207 HydrophobicContact CB-CE1 4.11Å; L205-Y207 HydrophobicContact CD1-CD1 4.16Å; L205-Y207 HydrophobicContact CD1-CE1 3.95Å
206	E	95.3	Very high	97	Very high	150 Å²	150	71.1 Å²	71.1	70%	0.701	36%	0.363	S	S	*	.			trans	-105.2	17.2	-177.1	-57	-157.7	133.9	0	0	114.3
207	Y	94.8	Very high	96.9	Very high	67 Å²	67	71.2 Å²	71.2	26%	0.263	37%	0.366	S	S	.	.			trans	-69	153.2	176.5	77.5	-91.3	0	0	0	111.7	L92 M95 W96 L205 V209	L92-Y207 HydrophobicContact CD1-CE1 4.33Å; M95-Y207 HydrophobicContact CE-CE1 3.92Å; W96-Y207 AromaticContact CE2-CZ 4Å; W96-Y207 HydrophobicContact CZ2-CE1 4.31Å; W96-Y207 AromaticContact CZ2-CE2 3.69Å; W96-Y207 HydrophobicContact CZ2-CE2 3.69Å; W96-Y207 AromaticContact CZ2-CZ 3.54Å; W96-Y207 WeakPolarHBondContact CZ2-OH 3.29Å; W96-Y207 AromaticContact NE1-CZ 3.83Å; W96-Y207 PolarHBondContact NE1-OH 3.12Å; L205-Y207 HydrophobicContact CB-CD1 3.78Å; L205-Y207 HydrophobicContact CB-CE1 4.11Å; L205-Y207 HydrophobicContact CD1-CD1 4.16Å; L205-Y207 HydrophobicContact CD1-CE1 3.95Å; Y207-V209 HydrophobicContact CD2-CG1 4.32Å; Y207-V209 HydrophobicContact CE2-CG1 3.79Å
208	T	95.6	Very high	96.8	Very high	85 Å²	85	75.8 Å²	75.8	52%	0.521	39%	0.39	S	S	.	.			trans	-103.4	151.1	178.7	54.3	0	0	0	0	112.1	Y139	Y139-T208 CarbonylContact O-C 3.58Å; Y139-T208 VanDerWaalsContact O-CA 3.23Å; Y139-T208 WeakPolarHBondContact O-CA 3.36Å
209	V	91.4	Very high	96.6	Very high	98 Å²	98	82.6 Å²	82.6	59%	0.594	43%	0.425	S	S	*	.			trans	-114.8	0	170	-62.9	0	0	0	0	112.1	W96 Y139 H140 G141 V144 Y207	W96-V209 HydrophobicContact CH2-CG1 3.96Å; W96-V209 HydrophobicContact CH2-CG2 3.92Å; W96-V209 HydrophobicContact CZ2-CG1 3.94Å; W96-V209 HydrophobicContact CZ3-CG2 4.41Å; Y139-V209 PolarHBondContact O-N 3.03Å; H140-V209 CarbonylContact C-O 3.1Å; H140-V209 WeakPolarHBondContact CA-O 3.33Å; G141-V209 PolarHBondContact N-O 3.36Å; V144-V209 WeakPolarHBondContact CG2-O 3.47Å; Y207-V209 HydrophobicContact CD2-CG1 4.32Å; Y207-V209 HydrophobicContact CE2-CG1 3.79Å

Retrieved 209 of 209 residues in 1056.5 ms (Link to these results)

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