A0A2K5YUP4_MANLE Loading...

Lens fiber major intrinsic protein

Aquaporins form homotetrameric transmembrane channels, with each monomer independently mediating water transport across the plasma membrane along its osmotic gradient. Specifically expressed in lens fiber cells, this aquaporin is crucial for maintaining lens water homeostasis and transparency. Beyond water permeability, it also acts as a cell-to-cell adhesion molecule, forming thin junctions between lens fiber cells that are essential for maintaining the ordered structure and transparency of the lens.

AlphaFold DB , UniProt , Accession A0A2K5YUP4, Species MANLE (Mandrillus leucophaeus, Drill), Gene MIP, Length 263 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	69.9	Low	89.9	Confident	149 Å²	149	91.9 Å²	91.9	73%	0.734	43%	0.426	S	S	*	.				0	115.7	0	-64.8	-173	-69.8	0	0	108	E3 L4 L84	M1-E3 VanDerWaalsContact C-N 3.28Å; M1-E3 PolarHBondContact O-N 3.08Å; M1-L4 HydrophobicContact CB-CD1 4.43Å; M1-L4 HydrophobicContact CB-CG 4.45Å; M1-L4 HydrophobicContact CE-CD1 3.95Å; M1-L4 PolarHBondContact O-N 3.47Å; M1-L84 HydrophobicContact CB-CD2 4.22Å; M1-L84 HydrophobicContact CE-CD1 3.96Å; M1-L84 HydrophobicContact CE-CD2 3.84Å; M1-L84 HydrophobicContact CE-CG 4.45Å; M1-L84 HydrophobicContact SD-CB 4.5Å; M1-L84 HydrophobicContact SD-CD2 3.81Å
2	W	83.2	Confident	90.6	Very high	104 Å²	104	84.3 Å²	84.3	39%	0.394	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-67.1	-29.2	-173.4	68.5	-88.1	0	0	0	112.6	L4 R5 S6 G239 K241	W2-L4 PolarHBondContact O-N 2.97Å; W2-R5 WeakPolarHBondContact O-CB 3.38Å; W2-R5 PolarHBondContact O-N 2.86Å; W2-S6 PolarHBondContact O-N 2.9Å; W2-G239 PolarHBondContact NE1-O 3.26Å; W2-K241 HydrophobicContact CD2-CB 4.35Å; W2-K241 HydrophobicContact CD2-CG 4.36Å; W2-K241 HydrophobicContact CG-CB 4.46Å; W2-K241 HydrophobicContact CZ2-CB 4.4Å; W2-K241 HydrophobicContact CZ2-CG 4.35Å
3	E	83.9	Confident	91.2	Very high	12 Å²	12	79.2 Å²	79.2	6%	0.056	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-53.7	-40.9	177.6	-67.6	-169	89.8	0	0	112.3	M1 R5 S6 F9 S82 L84 R85	M1-E3 VanDerWaalsContact C-N 3.28Å; M1-E3 PolarHBondContact O-N 3.08Å; E3-R5 PolarHBondContact O-N 3.23Å; E3-R5 VanDerWaalsContact O-N 3.17Å; E3-S6 WeakPolarHBondContact O-CB 3.45Å; E3-S6 PolarHBondContact O-N 3.17Å; E3-F9 HydrophobicContact CB-CD2 3.87Å; E3-F9 HydrophobicContact CB-CE2 4.11Å; E3-F9 HydrophobicContact CB-CG 4.32Å; E3-F9 WeakPolarHBondContact O-CB 3.27Å; E3-F9 WeakPolarHBondContact O-CG 3.35Å; E3-S82 PolarHBondContact OE1-OG 2.66Å; E3-S82 VanDerWaalsContact OE2-CB 3.3Å; E3-S82 WeakPolarHBondContact OE2-CB 3.42Å; E3-S82 PolarHBondContact OE2-OG 3.41Å; E3-L84 HydrophobicContact CB-CD2 4.27Å; E3-R85 IonicContact OE1-CZ 2.66Å; E3-R85 IonicContact OE1-NE 3.35Å; E3-R85 PolarHBondContact OE1-NE 3.37Å; E3-R85 IonicContact OE1-NH2 2.92Å
4	L	88.3	Confident	91.7	Very high	66 Å²	66	82.1 Å²	82.1	35%	0.346	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-64.5	-20.6	178.8	-64.8	179.7	0	0	0	113.8	M1 W2 F9 W10 L84	M1-L4 HydrophobicContact CB-CD1 4.43Å; M1-L4 HydrophobicContact CB-CG 4.45Å; M1-L4 HydrophobicContact CE-CD1 3.95Å; M1-L4 PolarHBondContact O-N 3.47Å; W2-L4 PolarHBondContact O-N 2.97Å; L4-F9 HydrophobicContact CD2-CE1 3.75Å; L4-F9 HydrophobicContact CD2-CZ 4.18Å; L4-W10 HydrophobicContact CD2-CH2 4.48Å; L4-W10 HydrophobicContact CD2-CZ2 4.05Å; L4-W10 PolarHBondContact O-NE1 2.94Å; L4-L84 HydrophobicContact CD2-CD2 3.88Å; L4-L84 HydrophobicContact CG-CD2 3.91Å
5	R	89.8	Confident	92.2	Very high	232 Å²	232	77.3 Å²	77.3	88%	0.875	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-89.5	-10.9	176.2	-60.6	-177.6	178.8	177.3	-1.9	112.1	W2 E3	W2-R5 WeakPolarHBondContact O-CB 3.38Å; W2-R5 PolarHBondContact O-N 2.86Å; E3-R5 PolarHBondContact O-N 3.23Å; E3-R5 VanDerWaalsContact O-N 3.17Å
6	S	92.6	Very high	92.6	Very high	27 Å²	27	72.4 Å²	72.4	19%	0.189	34%	0.336	C	S	.	.			trans	-81.9	127.4	-178.5	179.2	0	0	0	0	111.6	W2 E3 S8 F9 W10	W2-S6 PolarHBondContact O-N 2.9Å; E3-S6 WeakPolarHBondContact O-CB 3.45Å; E3-S6 PolarHBondContact O-N 3.17Å; S6-S8 VanDerWaalsContact C-N 3.27Å; S6-S8 PolarHBondContact O-N 3.43Å; S6-S8 PolarHBondContact OG-N 3.44Å; S6-S8 PolarHBondContact OG-OG 3.48Å; S6-F9 WeakPolarHBondContact O-CB 3.43Å; S6-F9 PolarHBondContact O-N 3.33Å; S6-W10 VanDerWaalsContact O-CD1 3.3Å; S6-W10 PolarHBondContact O-N 3.28Å
7	A	94.6	Very high	93	Very high	60 Å²	60	71.3 Å²	71.3	50%	0.496	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-34	172.1	0	0	0	0	0	112.1	F9 W10 R11	A7-F9 VanDerWaalsContact C-N 3.29Å; A7-F9 PolarHBondContact O-N 2.82Å; A7-W10 PolarHBondContact O-N 2.8Å; A7-R11 VanDerWaalsContact O-CG 3.31Å; A7-R11 WeakPolarHBondContact O-CG 3.47Å; A7-R11 PolarHBondContact O-N 3.13Å
8	S	94.8	Very high	93.3	Very high	72 Å²	72	72.9 Å²	72.9	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-66.6	-32.9	178.8	66.6	0	0	0	0	112.1	S6 A12	S6-S8 VanDerWaalsContact C-N 3.27Å; S6-S8 PolarHBondContact O-N 3.43Å; S6-S8 PolarHBondContact OG-N 3.44Å; S6-S8 PolarHBondContact OG-OG 3.48Å; S8-A12 WeakPolarHBondContact O-CB 3.35Å; S8-A12 PolarHBondContact O-N 3.23Å
9	F	95.9	Very high	93.6	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.4	-49.8	174.1	175.9	-95.2	0	0	0	111.4	E3 L4 S6 A7 A12 I13 L84 R85 C88	E3-F9 HydrophobicContact CB-CD2 3.87Å; E3-F9 HydrophobicContact CB-CE2 4.11Å; E3-F9 HydrophobicContact CB-CG 4.32Å; E3-F9 WeakPolarHBondContact O-CB 3.27Å; E3-F9 WeakPolarHBondContact O-CG 3.35Å; L4-F9 HydrophobicContact CD2-CE1 3.75Å; L4-F9 HydrophobicContact CD2-CZ 4.18Å; S6-F9 WeakPolarHBondContact O-CB 3.43Å; S6-F9 PolarHBondContact O-N 3.33Å; A7-F9 VanDerWaalsContact C-N 3.29Å; A7-F9 PolarHBondContact O-N 2.82Å; F9-A12 WeakPolarHBondContact O-CB 3.43Å; F9-A12 PolarHBondContact O-N 2.98Å; F9-I13 HydrophobicContact CD1-CD1 3.69Å; F9-I13 HydrophobicContact CE1-CD1 3.18Å; F9-I13 HydrophobicContact CE1-CG1 4.34Å; F9-I13 HydrophobicContact CE2-CD1 4.41Å; F9-I13 HydrophobicContact CG-CD1 4.47Å; F9-I13 HydrophobicContact CZ-CD1 3.6Å; F9-I13 WeakPolarHBondContact O-CG1 3.46Å; F9-I13 PolarHBondContact O-N 3.49Å; F9-L84 HydrophobicContact CZ-CD2 4.29Å; F9-L84 HydrophobicContact CZ-CG 4.23Å; F9-R85 HydrophobicContact CE2-CB 4Å; F9-R85 HydrophobicContact CE2-CG 4.19Å; F9-C88 HydrophobicContact CZ-CB 4.16Å
10	W	97.6	Very high	93.9	Very high	115 Å²	115	65.8 Å²	65.8	44%	0.436	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-39	178.8	-67.4	108.6	0	0	0	112.7	L4 S6 A7 A12 I13 F14	L4-W10 HydrophobicContact CD2-CH2 4.48Å; L4-W10 HydrophobicContact CD2-CZ2 4.05Å; L4-W10 PolarHBondContact O-NE1 2.94Å; S6-W10 VanDerWaalsContact O-CD1 3.3Å; S6-W10 PolarHBondContact O-N 3.28Å; A7-W10 PolarHBondContact O-N 2.8Å; W10-A12 VanDerWaalsContact C-N 3.26Å; W10-A12 PolarHBondContact O-N 2.79Å; W10-I13 HydrophobicContact CD2-CD1 4.44Å; W10-I13 HydrophobicContact CE3-CD1 3.72Å; W10-I13 HydrophobicContact CZ3-CD1 3.86Å; W10-I13 PolarHBondContact O-N 2.83Å; W10-F14 WeakPolarHBondContact O-CD2 3.32Å; W10-F14 PolarHBondContact O-N 2.92Å
11	R	98.1	Very high	94.1	Very high	174 Å²	174	63.7 Å²	63.7	66%	0.657	30%	0.295	S	S	*	.	H	α-helix	trans	-57.2	-41.6	172.2	-73.3	173.9	-177.9	176	1.1	111.5	A7 F14 A15 I62	A7-R11 VanDerWaalsContact O-CG 3.31Å; A7-R11 WeakPolarHBondContact O-CG 3.47Å; A7-R11 PolarHBondContact O-N 3.13Å; R11-F14 PolarHBondContact O-N 3.19Å; R11-A15 WeakPolarHBondContact O-CB 3.19Å; R11-A15 PolarHBondContact O-N 2.87Å; R11-I62 HydrophobicContact CB-CG2 4.36Å
12	A	98.3	Very high	95.5	Very high	0 Å²	0	61 Å²	61	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-38.7	176.9	0	0	0	0	0	112.7	S8 F9 W10 A15 E16 Y89	S8-A12 WeakPolarHBondContact O-CB 3.35Å; S8-A12 PolarHBondContact O-N 3.23Å; F9-A12 WeakPolarHBondContact O-CB 3.43Å; F9-A12 PolarHBondContact O-N 2.98Å; W10-A12 VanDerWaalsContact C-N 3.26Å; W10-A12 PolarHBondContact O-N 2.79Å; A12-A15 WeakPolarHBondContact O-CB 3.3Å; A12-A15 PolarHBondContact O-N 2.97Å; A12-E16 WeakPolarHBondContact O-CG 3.44Å; A12-E16 PolarHBondContact O-N 2.69Å; A12-Y89 HydrophobicContact CB-CE1 4.13Å; A12-Y89 WeakPolarHBondContact CB-OH 3.31Å
13	I	98.6	Very high	96.2	Very high	19 Å²	19	56.2 Å²	56.2	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-45.7	173.7	-69.1	171.4	0	0	0	111.2	F9 W10 A15 E16 F17 C88 Y89 A92	F9-I13 HydrophobicContact CD1-CD1 3.69Å; F9-I13 HydrophobicContact CE1-CD1 3.18Å; F9-I13 HydrophobicContact CE1-CG1 4.34Å; F9-I13 HydrophobicContact CE2-CD1 4.41Å; F9-I13 HydrophobicContact CG-CD1 4.47Å; F9-I13 HydrophobicContact CZ-CD1 3.6Å; F9-I13 WeakPolarHBondContact O-CG1 3.46Å; F9-I13 PolarHBondContact O-N 3.49Å; W10-I13 HydrophobicContact CD2-CD1 4.44Å; W10-I13 HydrophobicContact CE3-CD1 3.72Å; W10-I13 HydrophobicContact CZ3-CD1 3.86Å; W10-I13 PolarHBondContact O-N 2.83Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-E16 PolarHBondContact O-N 3.5Å; I13-F17 PolarHBondContact O-N 3.43Å; I13-C88 HydrophobicContact CD1-CB 3.64Å; I13-C88 HydrophobicContact CG1-CB 4.06Å; I13-Y89 HydrophobicContact CG1-CD1 4.43Å; I13-A92 HydrophobicContact CG2-CB 3.92Å
14	F	98.6	Very high	96.9	Very high	120 Å²	120	55.6 Å²	55.6	53%	0.526	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-38.7	176.3	-78.7	-68.1	0	0	0	112	W10 R11 E16 F17 F18	W10-F14 WeakPolarHBondContact O-CD2 3.32Å; W10-F14 PolarHBondContact O-N 2.92Å; R11-F14 PolarHBondContact O-N 3.19Å; F14-E16 VanDerWaalsContact C-N 3.34Å; F14-E16 PolarHBondContact O-N 3.36Å; F14-F17 PolarHBondContact O-N 3.42Å; F14-F18 HydrophobicContact CB-CD2 4.39Å; F14-F18 HydrophobicContact CB-CE2 4.43Å; F14-F18 HydrophobicContact CD1-CE2 4.15Å; F14-F18 WeakPolarHBondContact O-CD2 3.5Å; F14-F18 PolarHBondContact O-N 3.44Å
15	A	98.8	Very high	97.4	Very high	9 Å²	9	54.7 Å²	54.7	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-46.8	173.4	0	0	0	0	0	111.5	R11 A12 I13 F17 A19 V59 I62	R11-A15 WeakPolarHBondContact O-CB 3.19Å; R11-A15 PolarHBondContact O-N 2.87Å; A12-A15 WeakPolarHBondContact O-CB 3.3Å; A12-A15 PolarHBondContact O-N 2.97Å; I13-A15 VanDerWaalsContact C-N 3.34Å; A15-F17 PolarHBondContact O-N 2.84Å; A15-A19 WeakPolarHBondContact O-CB 3.26Å; A15-A19 PolarHBondContact O-N 3.03Å; A15-V59 HydrophobicContact CB-CB 4Å; A15-V59 HydrophobicContact CB-CG1 4.26Å; A15-V59 HydrophobicContact CB-CG2 4.41Å; A15-I62 HydrophobicContact CB-CB 4.36Å; A15-I62 HydrophobicContact CB-CG2 4.03Å
16	E	98.8	Very high	97.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-40.7	175.8	-74.2	-65.6	136.2	0	0	112.8	A12 I13 F14 T20 S63 A65 H66 V67 Y89 A92 Q93	A12-E16 WeakPolarHBondContact O-CG 3.44Å; A12-E16 PolarHBondContact O-N 2.69Å; I13-E16 PolarHBondContact O-N 3.5Å; F14-E16 VanDerWaalsContact C-N 3.34Å; F14-E16 PolarHBondContact O-N 3.36Å; E16-T20 VanDerWaalsContact O-CB 3.3Å; E16-T20 WeakPolarHBondContact O-CB 3.42Å; E16-T20 PolarHBondContact O-N 3.31Å; E16-T20 PolarHBondContact O-OG1 2.94Å; E16-S63 PolarHBondContact OE1-OG 2.91Å; E16-A65 WeakPolarHBondContact OE1-CA 3.4Å; E16-A65 PolarHBondContact OE1-N 3.32Å; E16-H66 PolarHBondContact OE1-N 3Å; E16-V67 WeakPolarHBondContact OE2-CA 3.41Å; E16-V67 PolarHBondContact OE2-N 3.39Å; E16-Y89 HydrophobicContact CG-CD1 4.1Å; E16-Y89 HydrophobicContact CG-CD2 3.56Å; E16-Y89 HydrophobicContact CG-CE1 4.14Å; E16-Y89 HydrophobicContact CG-CE2 3.61Å; E16-Y89 HydrophobicContact CG-CG 3.82Å; E16-A92 HydrophobicContact CB-CB 4.33Å; E16-Q93 HydrophobicContact CB-CG 4.45Å; E16-Q93 PolarHBondContact OE2-NE2 3.27Å
17	F	98.9	Very high	98.1	Very high	53 Å²	53	47.9 Å²	47.9	23%	0.232	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-56.2	175.4	174.8	-91.9	0	0	0	111.7	I13 F14 A15 T20 L21 A92 L95 G96 A99	I13-F17 PolarHBondContact O-N 3.43Å; F14-F17 PolarHBondContact O-N 3.42Å; A15-F17 PolarHBondContact O-N 2.84Å; F17-T20 PolarHBondContact O-N 3.26Å; F17-L21 HydrophobicContact CE1-CD1 4.06Å; F17-L21 HydrophobicContact CZ-CD1 4.41Å; F17-L21 WeakPolarHBondContact O-CB 3.3Å; F17-L21 PolarHBondContact O-N 3.34Å; F17-A92 HydrophobicContact CB-CB 4.17Å; F17-L95 HydrophobicContact CD2-CB 4.14Å; F17-L95 HydrophobicContact CE2-CB 3.96Å; F17-G96 WeakPolarHBondContact O-CA 3.31Å; F17-A99 HydrophobicContact CE2-CB 4.45Å; F17-A99 HydrophobicContact CZ-CB 4.02Å
18	F	98.9	Very high	98.3	Very high	101 Å²	101	45 Å²	45	44%	0.443	20%	0.202	S	C	.	.	H	α-helix	trans	-68.8	-38.5	-176.4	-75.8	-65.6	0	0	0	112.2	F14 L21 F22	F14-F18 HydrophobicContact CB-CD2 4.39Å; F14-F18 HydrophobicContact CB-CE2 4.43Å; F14-F18 HydrophobicContact CD1-CE2 4.15Å; F14-F18 WeakPolarHBondContact O-CD2 3.5Å; F14-F18 PolarHBondContact O-N 3.44Å; F18-L21 HydrophobicContact CD1-CD1 4.45Å; F18-L21 WeakPolarHBondContact O-CB 3.39Å; F18-L21 PolarHBondContact O-N 3.39Å; F18-F22 HydrophobicContact CB-CE2 4.24Å; F18-F22 WeakPolarHBondContact O-CD2 3.3Å; F18-F22 WeakPolarHBondContact O-CG 3.29Å; F18-F22 PolarHBondContact O-N 3.3Å
19	A	98.9	Very high	98.5	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-41.1	176.8	0	0	0	0	0	111.2	A15 L21 F22 Y23 L55 V59 V67	A15-A19 WeakPolarHBondContact O-CB 3.26Å; A15-A19 PolarHBondContact O-N 3.03Å; A19-L21 VanDerWaalsContact C-N 3.34Å; A19-L21 PolarHBondContact O-N 2.97Å; A19-F22 PolarHBondContact O-N 3.31Å; A19-Y23 WeakPolarHBondContact O-CB 3.48Å; A19-Y23 PolarHBondContact O-N 3.11Å; A19-L55 HydrophobicContact CB-CB 4.37Å; A19-L55 HydrophobicContact CB-CD1 4.4Å; A19-L55 HydrophobicContact CB-CD2 4.01Å; A19-L55 HydrophobicContact CB-CG 4.49Å; A19-L55 WeakPolarHBondContact O-CD1 3.33Å; A19-V59 HydrophobicContact CB-CG2 3.68Å; A19-V67 HydrophobicContact CB-CG1 3.37Å
20	T	98.9	Very high	98.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-35.3	175.2	-46.5	0	0	0	0	112.1	E16 F17 Y23 V24 V67 Q93 A97 A186	E16-T20 VanDerWaalsContact O-CB 3.3Å; E16-T20 WeakPolarHBondContact O-CB 3.42Å; E16-T20 PolarHBondContact O-N 3.31Å; E16-T20 PolarHBondContact O-OG1 2.94Å; F17-T20 PolarHBondContact O-N 3.26Å; T20-Y23 PolarHBondContact O-N 3.09Å; T20-V24 HydrophobicContact CG2-CG2 4.35Å; T20-V24 WeakPolarHBondContact O-CB 3.4Å; T20-V24 WeakPolarHBondContact O-CG2 3.36Å; T20-V24 PolarHBondContact O-N 3.31Å; T20-V67 WeakPolarHBondContact OG1-CA 3.26Å; T20-Q93 HydrophobicContact CG2-CB 4.19Å; T20-Q93 WeakPolarHBondContact CG2-O 3.28Å; T20-Q93 WeakPolarHBondContact OG1-CG 3.46Å; T20-A97 HydrophobicContact CG2-CB 3.86Å; T20-A186 HydrophobicContact CG2-CB 4.26Å
21	L	98.9	Very high	98.4	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.12	17%	0.173	C	C	.	.	H	α-helix	trans	-56.9	-54.5	171.9	-178.3	166.2	0	0	0	111.1	F17 F18 A19 V24 F25 G96 A99 G100	F17-L21 HydrophobicContact CE1-CD1 4.06Å; F17-L21 HydrophobicContact CZ-CD1 4.41Å; F17-L21 WeakPolarHBondContact O-CB 3.3Å; F17-L21 PolarHBondContact O-N 3.34Å; F18-L21 HydrophobicContact CD1-CD1 4.45Å; F18-L21 WeakPolarHBondContact O-CB 3.39Å; F18-L21 PolarHBondContact O-N 3.39Å; A19-L21 VanDerWaalsContact C-N 3.34Å; A19-L21 PolarHBondContact O-N 2.97Å; L21-V24 PolarHBondContact O-N 3.41Å; L21-F25 VanDerWaalsContact O-CB 3.24Å; L21-F25 WeakPolarHBondContact O-CB 3.31Å; L21-F25 PolarHBondContact O-N 3Å; L21-G96 WeakPolarHBondContact CA-O 3.41Å; L21-G96 WeakPolarHBondContact CB-O 3.45Å; L21-A99 HydrophobicContact CD1-CB 3.98Å; L21-A99 HydrophobicContact CG-CB 4.36Å; L21-G100 WeakPolarHBondContact O-CA 3.34Å
22	F	98.9	Very high	98.2	Very high	92 Å²	92	30.2 Å²	30.2	40%	0.404	14%	0.144	S	C	.	.	H	α-helix	trans	-65.1	-41.8	179.8	-65.8	-45.7	0	0	0	111.9	F18 A19 V24 F25 F26 L55	F18-F22 HydrophobicContact CB-CE2 4.24Å; F18-F22 WeakPolarHBondContact O-CD2 3.3Å; F18-F22 WeakPolarHBondContact O-CG 3.29Å; F18-F22 PolarHBondContact O-N 3.3Å; A19-F22 PolarHBondContact O-N 3.31Å; F22-V24 VanDerWaalsContact C-N 3.34Å; F22-V24 PolarHBondContact O-N 3.42Å; F22-F25 PolarHBondContact O-N 3.26Å; F22-F26 HydrophobicContact CB-CD2 4.16Å; F22-F26 HydrophobicContact CB-CE2 4.17Å; F22-F26 HydrophobicContact CD1-CE2 4.22Å; F22-F26 HydrophobicContact CG-CE2 4.49Å; F22-F26 WeakPolarHBondContact O-CD2 3.19Å; F22-F26 PolarHBondContact O-N 3.45Å; F22-L55 HydrophobicContact CB-CD1 4.43Å; F22-L55 HydrophobicContact CB-CD2 4.02Å; F22-L55 HydrophobicContact CD2-CD2 4.19Å
23	Y	98.9	Very high	97.8	Very high	3 Å²	3	38.4 Å²	38.4	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-54.9	-50.1	177	175.1	-108	0	0	0	111.5	A19 T20 G27 F48 A51 L52 L168 N184 R187	A19-Y23 WeakPolarHBondContact O-CB 3.48Å; A19-Y23 PolarHBondContact O-N 3.11Å; T20-Y23 PolarHBondContact O-N 3.09Å; Y23-G27 WeakPolarHBondContact O-CA 3.49Å; Y23-G27 PolarHBondContact O-N 3.05Å; Y23-F48 HydrophobicContact CE1-CD1 4.41Å; Y23-F48 HydrophobicContact CE1-CE1 4.33Å; Y23-F48 AromaticContact CE2-CD1 3.7Å; Y23-F48 HydrophobicContact CE2-CD1 3.7Å; Y23-F48 HydrophobicContact CE2-CE1 4.36Å; Y23-F48 AromaticContact CZ-CD1 3.62Å; Y23-F48 AromaticContact CZ-CE1 3.96Å; Y23-F48 WeakPolarHBondContact OH-CD1 3.39Å; Y23-A51 HydrophobicContact CD2-CB 4.44Å; Y23-L52 HydrophobicContact CE2-CB 4.33Å; Y23-L168 HydrophobicContact CE2-CD2 3.61Å; Y23-L168 WeakPolarHBondContact OH-CD2 3.37Å; Y23-N184 VanDerWaalsContact CE1-ND2 3.29Å; Y23-N184 WeakPolarHBondContact CE1-ND2 3.42Å; Y23-R187 HydrophobicContact CE1-CB 3.86Å; Y23-R187 HydrophobicContact CE1-CG 4.08Å
24	V	98.9	Very high	97.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.3	-40.9	179.5	172.8	0	0	0	0	111.5	T20 L21 F22 L28 A97 A101 R187 A190	T20-V24 HydrophobicContact CG2-CG2 4.35Å; T20-V24 WeakPolarHBondContact O-CB 3.4Å; T20-V24 WeakPolarHBondContact O-CG2 3.36Å; T20-V24 PolarHBondContact O-N 3.31Å; L21-V24 PolarHBondContact O-N 3.41Å; F22-V24 VanDerWaalsContact C-N 3.34Å; F22-V24 PolarHBondContact O-N 3.42Å; V24-L28 HydrophobicContact CG1-CD1 3.88Å; V24-L28 HydrophobicContact CG1-CD2 3.74Å; V24-L28 HydrophobicContact CG1-CG 4.34Å; V24-L28 VanDerWaalsContact O-CB 3.3Å; V24-L28 WeakPolarHBondContact O-CB 3.47Å; V24-L28 PolarHBondContact O-N 2.91Å; V24-A97 HydrophobicContact CB-CB 4.47Å; V24-A97 WeakPolarHBondContact CG1-O 3.45Å; V24-A97 HydrophobicContact CG2-CB 3.68Å; V24-A101 HydrophobicContact CG1-CB 3.96Å; V24-R187 HydrophobicContact CG2-CB 4.21Å; V24-A190 HydrophobicContact CG1-CB 4.11Å
25	F	98.9	Very high	96.7	Very high	46 Å²	46	42.2 Å²	42.2	20%	0.202	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-55.1	178	176.9	-94.2	0	0	0	112	L21 F22 G29 V103 L104 V107	L21-F25 VanDerWaalsContact O-CB 3.24Å; L21-F25 WeakPolarHBondContact O-CB 3.31Å; L21-F25 PolarHBondContact O-N 3Å; F22-F25 PolarHBondContact O-N 3.26Å; F25-G29 PolarHBondContact O-N 2.64Å; F25-V103 HydrophobicContact CD2-CB 4.32Å; F25-V103 HydrophobicContact CD2-CG1 4.03Å; F25-V103 HydrophobicContact CE2-CG1 3.85Å; F25-L104 HydrophobicContact CD2-CB 3.8Å; F25-L104 HydrophobicContact CD2-CD1 4.42Å; F25-L104 HydrophobicContact CE2-CB 4.14Å; F25-L104 HydrophobicContact CE2-CD1 4.25Å; F25-V107 HydrophobicContact CE2-CG2 3.95Å; F25-V107 HydrophobicContact CZ-CG2 4.25Å
26	F	98.8	Very high	95.7	Very high	116 Å²	116	48.5 Å²	48.5	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-73	-39	-178.9	-68.4	-65.9	0	0	0	112.1	F22 S30 A51	F22-F26 HydrophobicContact CB-CD2 4.16Å; F22-F26 HydrophobicContact CB-CE2 4.17Å; F22-F26 HydrophobicContact CD1-CE2 4.22Å; F22-F26 HydrophobicContact CG-CE2 4.49Å; F22-F26 WeakPolarHBondContact O-CD2 3.19Å; F22-F26 PolarHBondContact O-N 3.45Å; F26-S30 VanDerWaalsContact O-CB 3.25Å; F26-S30 WeakPolarHBondContact O-CB 3.48Å; F26-S30 PolarHBondContact O-N 2.95Å; F26-S30 PolarHBondContact O-OG 3.29Å; F26-A51 HydrophobicContact CB-CB 4.48Å
27	G	98.3	Very high	94.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-53.3	178	0	0	0	0	0	112.9	Y23 S30 S31 F48	Y23-G27 WeakPolarHBondContact O-CA 3.49Å; Y23-G27 PolarHBondContact O-N 3.05Å; G27-S30 PolarHBondContact O-OG 3.43Å; G27-S31 WeakPolarHBondContact O-CB 3.2Å; G27-S31 PolarHBondContact O-N 2.87Å; G27-S31 PolarHBondContact O-OG 3.31Å; G27-F48 VanDerWaalsContact CA-CE1 3.43Å; G27-F48 VanDerWaalsContact CA-CZ 3.45Å; G27-F48 WeakPolarHBondContact O-CE2 3.36Å; G27-F48 WeakPolarHBondContact O-CZ 3.3Å
28	L	98.3	Very high	93.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.5	-42.8	177.9	-84.5	52.8	0	0	0	111	V24 S30 S31 L32 F48 A101 L104 L116 A117 R187 P191	V24-L28 HydrophobicContact CG1-CD1 3.88Å; V24-L28 HydrophobicContact CG1-CD2 3.74Å; V24-L28 HydrophobicContact CG1-CG 4.34Å; V24-L28 VanDerWaalsContact O-CB 3.3Å; V24-L28 WeakPolarHBondContact O-CB 3.47Å; V24-L28 PolarHBondContact O-N 2.91Å; L28-S30 VanDerWaalsContact C-N 3.29Å; L28-S30 PolarHBondContact O-N 3.02Å; L28-S31 CarbonylContact O-C 3.44Å; L28-S31 WeakPolarHBondContact O-CA 3.3Å; L28-S31 WeakPolarHBondContact O-CB 3.32Å; L28-S31 PolarHBondContact O-N 3.41Å; L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.48Å; L28-L32 VanDerWaalsContact O-N 3.14Å; L28-F48 HydrophobicContact CD1-CZ 4.24Å; L28-A101 HydrophobicContact CD2-CB 4.05Å; L28-L104 HydrophobicContact CB-CD2 3.39Å; L28-L116 VanDerWaalsContact CD2-O 3.22Å; L28-L116 WeakPolarHBondContact CD2-O 3.38Å; L28-L116 VanDerWaalsContact CG-O 3.29Å; L28-L116 WeakPolarHBondContact CG-O 3.13Å; L28-A117 HydrophobicContact CB-CB 4.44Å; L28-A117 HydrophobicContact CG-CB 4.26Å; L28-R187 HydrophobicContact CD1-CG 4.11Å; L28-P191 HydrophobicContact CD2-CB 4.16Å; L28-P191 HydrophobicContact CD2-CG 4.19Å
29	G	97.5	Very high	92.4	Very high	11 Å²	11	51.7 Å²	51.7	11%	0.113	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-38.1	-177	0	0	0	0	0	113.1	F25 S31 L32 W34 L104	F25-G29 PolarHBondContact O-N 2.64Å; G29-S31 VanDerWaalsContact C-N 3.26Å; G29-S31 PolarHBondContact O-N 3.08Å; G29-L32 PolarHBondContact O-N 3.01Å; G29-W34 PolarHBondContact O-NE1 3.22Å; G29-W34 VanDerWaalsContact O-NE1 3.07Å; G29-L104 VanDerWaalsContact N-CD2 3.33Å
30	S	96	Very high	91.8	Very high	24 Å²	24	57.8 Å²	57.8	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-74.8	-15.3	174.7	62.6	0	0	0	0	113.9	F26 G27 L28 Q43 A47	F26-S30 VanDerWaalsContact O-CB 3.25Å; F26-S30 WeakPolarHBondContact O-CB 3.48Å; F26-S30 PolarHBondContact O-N 2.95Å; F26-S30 PolarHBondContact O-OG 3.29Å; G27-S30 PolarHBondContact O-OG 3.43Å; L28-S30 VanDerWaalsContact C-N 3.29Å; L28-S30 PolarHBondContact O-N 3.02Å; S30-Q43 PolarHBondContact O-NE2 3.48Å; S30-A47 VanDerWaalsContact CB-CB 3.46Å; S30-A47 WeakPolarHBondContact OG-CB 3.34Å
31	S	96	Very high	91.6	Very high	8 Å²	8	58.6 Å²	58.6	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-95	-5.4	177.1	-57.3	0	0	0	0	113.7	G27 L28 G29 V44 F48 A117	G27-S31 WeakPolarHBondContact O-CB 3.2Å; G27-S31 PolarHBondContact O-N 2.87Å; G27-S31 PolarHBondContact O-OG 3.31Å; L28-S31 CarbonylContact O-C 3.44Å; L28-S31 WeakPolarHBondContact O-CA 3.3Å; L28-S31 WeakPolarHBondContact O-CB 3.32Å; L28-S31 PolarHBondContact O-N 3.41Å; G29-S31 VanDerWaalsContact C-N 3.26Å; G29-S31 PolarHBondContact O-N 3.08Å; S31-V44 WeakPolarHBondContact OG-CG1 3.45Å; S31-F48 WeakPolarHBondContact OG-CE2 3.44Å; S31-A117 VanDerWaalsContact CB-CB 3.47Å
32	L	95.1	Very high	91.5	Very high	8 Å²	8	63 Å²	63	4%	0.042	34%	0.336	C	S	.	.	S	Bend	trans	-71.5	152.8	174.4	-57.7	-176	0	0	0	111	L28 G29 W34 L104 T108 V112 A117	L28-L32 WeakPolarHBondContact O-CG 3.45Å; L28-L32 PolarHBondContact O-N 3.48Å; L28-L32 VanDerWaalsContact O-N 3.14Å; G29-L32 PolarHBondContact O-N 3.01Å; L32-W34 VanDerWaalsContact O-CD1 3.29Å; L32-W34 PolarHBondContact O-N 3.23Å; L32-L104 HydrophobicContact CD1-CD1 4.44Å; L32-L104 HydrophobicContact CD1-CD2 4.47Å; L32-T108 HydrophobicContact CD1-CG2 3.52Å; L32-V112 HydrophobicContact CB-CG1 3.98Å; L32-V112 HydrophobicContact CD1-CG1 4.35Å; L32-A117 HydrophobicContact CD2-CB 4.35Å
33	R	89.6	Confident	91.3	Very high	171 Å²	171	63.7 Å²	63.7	65%	0.645	34%	0.341	S	S	*	.			trans	-87.4	86.9	179.8	-68	-172.6	-179.5	-170.2	0.7	110.7	L39	R33-L39 HydrophobicContact CG-CD1 4.31Å; R33-L39 HydrophobicContact CG-CD2 3.86Å; R33-L39 HydrophobicContact CG-CG 4.01Å
34	W	89.6	Confident	91.3	Very high	149 Å²	149	63.6 Å²	63.6	56%	0.564	34%	0.341	S	S	*	.			trans	-76.7	-23.2	178.6	-68.9	92.7	0	0	0	114.1	G29 L32 T108 V112	G29-W34 PolarHBondContact O-NE1 3.22Å; G29-W34 VanDerWaalsContact O-NE1 3.07Å; L32-W34 VanDerWaalsContact O-CD1 3.29Å; L32-W34 PolarHBondContact O-N 3.23Å; W34-T108 HydrophobicContact CH2-CG2 4.48Å; W34-V112 HydrophobicContact CD2-CG1 3.68Å; W34-V112 HydrophobicContact CE3-CG1 3.87Å; W34-V112 HydrophobicContact CE3-CG2 4.18Å; W34-V112 HydrophobicContact CG-CG1 4.08Å; W34-V112 HydrophobicContact CH2-CG1 4.38Å; W34-V112 HydrophobicContact CZ2-CG1 4.21Å; W34-V112 HydrophobicContact CZ3-CG1 4.21Å; W34-V112 HydrophobicContact CZ3-CG2 4.35Å
35	A	83.4	Confident	91.2	Very high	71 Å²	71	63.6 Å²	63.6	59%	0.587	34%	0.341	S	S	*	.	S	Bend	trans	-135.1	153.3	179.4	0	0	0	0	0	111.2
36	P	79.2	Confident	91.2	Very high	141 Å²	141	64.4 Å²	64.4	92%	0.916	35%	0.346	S	S	*	.	S	Bend	trans	-60.5	137.8	170.4	-19.8	32.1	0	0	0	111.2
37	G	75.5	Confident	91.2	Very high	48 Å²	48	60.1 Å²	60.1	50%	0.495	33%	0.332	S	S	.	.	S	Bend	trans	131.8	179	178.5	0	0	0	0	0	113.5
38	P	74.1	Confident	91.2	Very high	112 Å²	112	60.1 Å²	60.1	73%	0.727	33%	0.332	S	S	*	.			trans	-66.8	143.4	175.1	29.1	-33.3	0	0	0	110.5	H40	P38-H40 PolarHBondContact O-N 3.02Å
39	L	77.3	Confident	91.2	Very high	61 Å²	61	60.2 Å²	60.2	32%	0.319	33%	0.333	S	S	.	.			trans	-61.6	129.7	171.3	-82.8	163.6	0	0	0	109.6	R33 V41	R33-L39 HydrophobicContact CG-CD1 4.31Å; R33-L39 HydrophobicContact CG-CD2 3.86Å; R33-L39 HydrophobicContact CG-CG 4.01Å; L39-V41 PolarHBondContact O-N 3.3Å
40	H	85.2	Confident	91.3	Very high	130 Å²	130	63.5 Å²	63.5	60%	0.602	35%	0.348	S	S	*	.			trans	-75.8	97.3	175.3	-71.6	-69.4	0	0	0	110.1	P38 L42 Q43 V44	P38-H40 PolarHBondContact O-N 3.02Å; H40-L42 PolarHBondContact O-N 3.35Å; H40-Q43 HydrophobicContact CB-CB 3.86Å; H40-Q43 WeakPolarHBondContact O-CB 3.31Å; H40-Q43 PolarHBondContact O-N 2.96Å; H40-V44 PolarHBondContact O-N 3.4Å; H40-V44 VanDerWaalsContact O-N 3.13Å
41	V	95.3	Very high	91.4	Very high	17 Å²	17	63 Å²	63	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-54.3	-38.8	179.5	173.1	0	0	0	0	111.9	L39 Q43 V44 A45 L173 M176 Y177	L39-V41 PolarHBondContact O-N 3.3Å; V41-Q43 PolarHBondContact O-N 3.18Å; V41-V44 PolarHBondContact O-N 3.37Å; V41-A45 WeakPolarHBondContact O-CB 3.48Å; V41-A45 PolarHBondContact O-N 2.97Å; V41-L173 HydrophobicContact CG1-CD2 4.37Å; V41-M176 HydrophobicContact CG1-CB 3.93Å; V41-M176 HydrophobicContact CG1-CG 4.16Å; V41-M176 HydrophobicContact CG2-CB 4.07Å; V41-Y177 HydrophobicContact CG1-CE2 4.23Å; V41-Y177 HydrophobicContact CG2-CE1 3.82Å; V41-Y177 HydrophobicContact CG2-CE2 4.25Å
42	L	96.5	Very high	91.6	Very high	115 Å²	115	62.8 Å²	62.8	60%	0.602	34%	0.343	S	S	*	.	H	α-helix	trans	-60.5	-43.5	175.6	179.6	62.2	0	0	0	112.3	H40 M46 L173	H40-L42 PolarHBondContact O-N 3.35Å; L42-M46 HydrophobicContact CD1-CG 3.92Å; L42-M46 HydrophobicContact CG-CG 4.43Å; L42-M46 VanDerWaalsContact O-CB 3.32Å; L42-M46 WeakPolarHBondContact O-CB 3.32Å; L42-M46 VanDerWaalsContact O-CG 3.23Å; L42-M46 WeakPolarHBondContact O-CG 3.42Å; L42-M46 PolarHBondContact O-N 3.41Å; L42-L173 HydrophobicContact CD1-CD2 4.06Å
43	Q	96	Very high	91.7	Very high	106 Å²	106	62.7 Å²	62.7	50%	0.495	34%	0.343	S	S	.	.	H	α-helix	trans	-61.9	-49.1	178.3	178.3	-174.9	-55	0	0	110.7	S30 H40 V41 M46 A47	S30-Q43 PolarHBondContact O-NE2 3.48Å; H40-Q43 HydrophobicContact CB-CB 3.86Å; H40-Q43 WeakPolarHBondContact O-CB 3.31Å; H40-Q43 PolarHBondContact O-N 2.96Å; V41-Q43 PolarHBondContact O-N 3.18Å; Q43-M46 PolarHBondContact O-N 3.38Å; Q43-A47 VanDerWaalsContact O-CB 3.28Å; Q43-A47 WeakPolarHBondContact O-CB 3.27Å; Q43-A47 PolarHBondContact O-N 3.37Å
44	V	97.1	Very high	92.2	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.006	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-46	-179.6	176.5	0	0	0	0	110.9	S31 H40 V41 M46 A47 F48 M176	S31-V44 WeakPolarHBondContact OG-CG1 3.45Å; H40-V44 PolarHBondContact O-N 3.4Å; H40-V44 VanDerWaalsContact O-N 3.13Å; V41-V44 PolarHBondContact O-N 3.37Å; V44-M46 PolarHBondContact O-N 3.05Å; V44-A47 PolarHBondContact O-N 3.24Å; V44-F48 HydrophobicContact CG1-CD2 3.71Å; V44-F48 HydrophobicContact CG1-CE2 3.81Å; V44-F48 WeakPolarHBondContact O-CD2 3.48Å; V44-F48 PolarHBondContact O-N 2.97Å; V44-M176 HydrophobicContact CB-CE 4.14Å; V44-M176 HydrophobicContact CG1-CE 3.82Å; V44-M176 HydrophobicContact CG1-SD 3.93Å; V44-M176 HydrophobicContact CG2-CE 4.28Å
45	A	98.4	Very high	92.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-59.3	-46.6	178.3	0	0	0	0	0	112.1	V41 G49 A169 H172 L173	V41-A45 WeakPolarHBondContact O-CB 3.48Å; V41-A45 PolarHBondContact O-N 2.97Å; A45-G49 PolarHBondContact O-N 3.32Å; A45-A169 HydrophobicContact CB-CB 4.48Å; A45-A169 WeakPolarHBondContact CB-O 3.33Å; A45-A169 WeakPolarHBondContact O-CA 3.29Å; A45-A169 VanDerWaalsContact O-CB 3.31Å; A45-A169 WeakPolarHBondContact O-CB 3.3Å; A45-H172 HydrophobicContact CB-CB 3.53Å; A45-L173 HydrophobicContact CB-CD2 3.76Å; A45-L173 HydrophobicContact CB-CG 3.77Å
46	M	98.4	Very high	93.3	Very high	63 Å²	63	49.2 Å²	49.2	31%	0.31	29%	0.289	S	S	.	.	H	α-helix	trans	-66.9	-39.2	176.5	-70.6	-58.9	-63	0	0	111.7	L42 Q43 V44 G49 L50 F166	L42-M46 HydrophobicContact CD1-CG 3.92Å; L42-M46 HydrophobicContact CG-CG 4.43Å; L42-M46 VanDerWaalsContact O-CB 3.32Å; L42-M46 WeakPolarHBondContact O-CB 3.32Å; L42-M46 VanDerWaalsContact O-CG 3.23Å; L42-M46 WeakPolarHBondContact O-CG 3.42Å; L42-M46 PolarHBondContact O-N 3.41Å; Q43-M46 PolarHBondContact O-N 3.38Å; V44-M46 PolarHBondContact O-N 3.05Å; M46-G49 PolarHBondContact O-N 3.46Å; M46-L50 HydrophobicContact CB-CD1 4.49Å; M46-L50 HydrophobicContact CE-CD1 4.08Å; M46-L50 HydrophobicContact CE-CD2 4.29Å; M46-L50 HydrophobicContact CE-CG 4.11Å; M46-L50 WeakPolarHBondContact O-CB 3.25Å; M46-L50 WeakPolarHBondContact O-CG 3.48Å; M46-L50 PolarHBondContact O-N 3.01Å; M46-F166 HydrophobicContact CE-CE1 3.89Å; M46-F166 HydrophobicContact SD-CE1 4.4Å
47	A	98.4	Very high	94.2	Very high	26 Å²	26	48.6 Å²	48.6	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-46.9	178.3	0	0	0	0	0	112	S30 Q43 V44 A51	S30-A47 VanDerWaalsContact CB-CB 3.46Å; S30-A47 WeakPolarHBondContact OG-CB 3.34Å; Q43-A47 VanDerWaalsContact O-CB 3.28Å; Q43-A47 WeakPolarHBondContact O-CB 3.27Å; Q43-A47 PolarHBondContact O-N 3.37Å; V44-A47 PolarHBondContact O-N 3.24Å; A47-A51 WeakPolarHBondContact O-CB 3.36Å; A47-A51 PolarHBondContact O-N 2.98Å
48	F	98.7	Very high	95.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-45.4	175	-87.4	-74.5	0	0	0	112.3	Y23 G27 L28 S31 V44 A51 L52 L168 H172 R187	Y23-F48 HydrophobicContact CE1-CD1 4.41Å; Y23-F48 HydrophobicContact CE1-CE1 4.33Å; Y23-F48 AromaticContact CE2-CD1 3.7Å; Y23-F48 HydrophobicContact CE2-CD1 3.7Å; Y23-F48 HydrophobicContact CE2-CE1 4.36Å; Y23-F48 AromaticContact CZ-CD1 3.62Å; Y23-F48 AromaticContact CZ-CE1 3.96Å; Y23-F48 WeakPolarHBondContact OH-CD1 3.39Å; G27-F48 VanDerWaalsContact CA-CE1 3.43Å; G27-F48 VanDerWaalsContact CA-CZ 3.45Å; G27-F48 WeakPolarHBondContact O-CE2 3.36Å; G27-F48 WeakPolarHBondContact O-CZ 3.3Å; L28-F48 HydrophobicContact CD1-CZ 4.24Å; S31-F48 WeakPolarHBondContact OG-CE2 3.44Å; V44-F48 HydrophobicContact CG1-CD2 3.71Å; V44-F48 HydrophobicContact CG1-CE2 3.81Å; V44-F48 WeakPolarHBondContact O-CD2 3.48Å; V44-F48 PolarHBondContact O-N 2.97Å; F48-A51 PolarHBondContact O-N 3.32Å; F48-L52 PolarHBondContact O-N 2.97Å; F48-L168 HydrophobicContact CB-CD2 4.06Å; F48-L168 HydrophobicContact CB-CG 4.47Å; F48-L168 WeakPolarHBondContact O-CD2 3.22Å; F48-H172 AromaticContact CD1-NE2 3.9Å; F48-H172 AromaticContact CD2-CD2 3.51Å; F48-H172 AromaticContact CD2-NE2 3.25Å; F48-H172 VanDerWaalsContact CD2-NE2 3.25Å; F48-H172 WeakPolarHBondContact CD2-NE2 3.47Å; F48-H172 AromaticContact CE2-NE2 3.71Å; F48-H172 AromaticContact CG-CD2 3.94Å; F48-H172 AromaticContact CG-CE1 3.79Å; F48-H172 AromaticContact CG-NE2 3.35Å; F48-H172 WeakPolarHBondContact CG-NE2 3.44Å; F48-R187 HydrophobicContact CE1-CG 3.97Å; F48-R187 HydrophobicContact CZ-CG 4.33Å
49	G	98.7	Very high	96.5	Very high	2 Å²	2	45.2 Å²	45.2	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-44.8	-179.9	0	0	0	0	0	113.2	A45 M46 L52 A53 G165	A45-G49 PolarHBondContact O-N 3.32Å; M46-G49 PolarHBondContact O-N 3.46Å; G49-L52 PolarHBondContact O-N 3.44Å; G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 3.14Å; G49-G165 WeakPolarHBondContact CA-O 3.38Å; G49-G165 WeakPolarHBondContact O-CA 3.38Å
50	L	98.8	Very high	97.4	Very high	80 Å²	80	43.2 Å²	43.2	42%	0.419	24%	0.238	S	C	.	.	H	α-helix	trans	-68.6	-40.9	176.8	-67.6	174.4	0	0	0	111.5	M46 L52 A53 T54	M46-L50 HydrophobicContact CB-CD1 4.49Å; M46-L50 HydrophobicContact CE-CD1 4.08Å; M46-L50 HydrophobicContact CE-CD2 4.29Å; M46-L50 HydrophobicContact CE-CG 4.11Å; M46-L50 WeakPolarHBondContact O-CB 3.25Å; M46-L50 WeakPolarHBondContact O-CG 3.48Å; M46-L50 PolarHBondContact O-N 3.01Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.46Å; L50-A53 PolarHBondContact O-N 3.05Å; L50-T54 WeakPolarHBondContact O-CB 3.47Å; L50-T54 PolarHBondContact O-N 3.32Å; L50-T54 PolarHBondContact O-OG1 3.36Å
51	A	98.8	Very high	97.9	Very high	13 Å²	13	44.4 Å²	44.4	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-56.5	-46.9	173.4	0	0	0	0	0	110.7	Y23 F26 A47 F48 T54 L55	Y23-A51 HydrophobicContact CD2-CB 4.44Å; F26-A51 HydrophobicContact CB-CB 4.48Å; A47-A51 WeakPolarHBondContact O-CB 3.36Å; A47-A51 PolarHBondContact O-N 2.98Å; F48-A51 PolarHBondContact O-N 3.32Å; A51-T54 PolarHBondContact O-N 3.42Å; A51-L55 WeakPolarHBondContact O-CB 3.21Å; A51-L55 WeakPolarHBondContact O-CD1 3.46Å; A51-L55 WeakPolarHBondContact O-CG 3.2Å; A51-L55 PolarHBondContact O-N 3.44Å
52	L	98.8	Very high	98.1	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-64.8	-45.4	177	-176.5	63.3	0	0	0	112.2	Y23 F48 G49 L50 T54 L55 V56 V67 F141 V164 L168	Y23-L52 HydrophobicContact CE2-CB 4.33Å; F48-L52 PolarHBondContact O-N 2.97Å; G49-L52 PolarHBondContact O-N 3.44Å; L50-L52 VanDerWaalsContact C-N 3.29Å; L50-L52 PolarHBondContact O-N 3.46Å; L52-T54 VanDerWaalsContact C-N 3.33Å; L52-T54 PolarHBondContact O-N 2.98Å; L52-L55 PolarHBondContact O-N 2.75Å; L52-V56 HydrophobicContact CD1-CG2 3.96Å; L52-V56 HydrophobicContact CG-CG2 4.13Å; L52-V56 WeakPolarHBondContact O-CB 3.36Å; L52-V56 VanDerWaalsContact O-CG2 3.27Å; L52-V56 WeakPolarHBondContact O-CG2 3.43Å; L52-V56 PolarHBondContact O-N 2.7Å; L52-V67 HydrophobicContact CD1-CG2 3.37Å; L52-F141 HydrophobicContact CD2-CE2 3.49Å; L52-F141 VanDerWaalsContact CD2-CE2 3.49Å; L52-F141 HydrophobicContact CD2-CZ 3.42Å; L52-F141 VanDerWaalsContact CD2-CZ 3.42Å; L52-V164 HydrophobicContact CD2-CG1 3.64Å; L52-V164 HydrophobicContact CG-CG1 4.13Å; L52-L168 HydrophobicContact CB-CD2 3.77Å; L52-L168 HydrophobicContact CD2-CB 3.86Å; L52-L168 HydrophobicContact CD2-CD2 3.66Å; L52-L168 HydrophobicContact CD2-CG 4.3Å; L52-L168 HydrophobicContact CG-CD2 4.33Å
53	A	98.8	Very high	98.1	Very high	6 Å²	6	42.2 Å²	42.2	5%	0.05	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-44.8	176.8	0	0	0	0	0	112.2	G49 L50 L55 V56 Q57 A161 L162	G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 3.14Å; L50-A53 PolarHBondContact O-N 3.05Å; A53-L55 VanDerWaalsContact C-N 3.35Å; A53-L55 PolarHBondContact O-N 3.18Å; A53-V56 PolarHBondContact O-N 3.31Å; A53-Q57 PolarHBondContact O-N 2.91Å; A53-A161 VanDerWaalsContact CA-O 3.32Å; A53-A161 WeakPolarHBondContact CA-O 3.18Å; A53-A161 VanDerWaalsContact CB-O 3.29Å; A53-A161 WeakPolarHBondContact CB-O 3.39Å; A53-A161 WeakPolarHBondContact O-CB 3.44Å; A53-L162 HydrophobicContact CB-CD2 4.11Å
54	T	98.8	Very high	98.2	Very high	85 Å²	85	38 Å²	38	52%	0.521	22%	0.217	S	C	.	.	H	α-helix	trans	-59	-47.9	175.9	-63.5	0	0	0	0	110.7	L50 A51 L52 Q57 S58	L50-T54 WeakPolarHBondContact O-CB 3.47Å; L50-T54 PolarHBondContact O-N 3.32Å; L50-T54 PolarHBondContact O-OG1 3.36Å; A51-T54 PolarHBondContact O-N 3.42Å; L52-T54 VanDerWaalsContact C-N 3.33Å; L52-T54 PolarHBondContact O-N 2.98Å; T54-Q57 WeakPolarHBondContact O-CB 3.41Å; T54-Q57 PolarHBondContact O-N 2.88Å; T54-S58 WeakPolarHBondContact O-CB 3.3Å; T54-S58 PolarHBondContact O-N 3.27Å; T54-S58 PolarHBondContact O-OG 2.96Å
55	L	98.7	Very high	98.3	Very high	13 Å²	13	38.1 Å²	38.1	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-37.4	-177.4	-67.5	169.7	0	0	0	113	A19 F22 A51 L52 A53 Q57 S58 V59	A19-L55 HydrophobicContact CB-CB 4.37Å; A19-L55 HydrophobicContact CB-CD1 4.4Å; A19-L55 HydrophobicContact CB-CD2 4.01Å; A19-L55 HydrophobicContact CB-CG 4.49Å; A19-L55 WeakPolarHBondContact O-CD1 3.33Å; F22-L55 HydrophobicContact CB-CD1 4.43Å; F22-L55 HydrophobicContact CB-CD2 4.02Å; F22-L55 HydrophobicContact CD2-CD2 4.19Å; A51-L55 WeakPolarHBondContact O-CB 3.21Å; A51-L55 WeakPolarHBondContact O-CD1 3.46Å; A51-L55 WeakPolarHBondContact O-CG 3.2Å; A51-L55 PolarHBondContact O-N 3.44Å; L52-L55 PolarHBondContact O-N 2.75Å; A53-L55 VanDerWaalsContact C-N 3.35Å; A53-L55 PolarHBondContact O-N 3.18Å; L55-Q57 VanDerWaalsContact C-N 3.32Å; L55-Q57 PolarHBondContact O-N 2.94Å; L55-S58 PolarHBondContact O-N 2.81Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 2.84Å
56	V	98.6	Very high	98.3	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-41.5	172.5	174.4	0	0	0	0	110.3	L52 A53 G60 A65 Y149 A161 V164	L52-V56 HydrophobicContact CD1-CG2 3.96Å; L52-V56 HydrophobicContact CG-CG2 4.13Å; L52-V56 WeakPolarHBondContact O-CB 3.36Å; L52-V56 VanDerWaalsContact O-CG2 3.27Å; L52-V56 WeakPolarHBondContact O-CG2 3.43Å; L52-V56 PolarHBondContact O-N 2.7Å; A53-V56 PolarHBondContact O-N 3.31Å; V56-G60 WeakPolarHBondContact O-CA 3.39Å; V56-G60 PolarHBondContact O-N 2.96Å; V56-A65 HydrophobicContact CB-CB 4.28Å; V56-A65 HydrophobicContact CG2-CB 3.92Å; V56-Y149 WeakPolarHBondContact CG1-OH 3.49Å; V56-A161 HydrophobicContact CB-CB 3.88Å; V56-A161 HydrophobicContact CG1-CB 3.7Å; V56-V164 HydrophobicContact CG2-CG1 4.22Å
57	Q	98.5	Very high	98.3	Very high	129 Å²	129	35.9 Å²	35.9	60%	0.603	21%	0.207	S	C	*	.	H	α-helix	trans	-63.1	-43.7	171.5	-87.7	-55.1	90.4	0	0	112.7	A53 T54 L55 A161	A53-Q57 PolarHBondContact O-N 2.91Å; T54-Q57 WeakPolarHBondContact O-CB 3.41Å; T54-Q57 PolarHBondContact O-N 2.88Å; L55-Q57 VanDerWaalsContact C-N 3.32Å; L55-Q57 PolarHBondContact O-N 2.94Å; Q57-A161 HydrophobicContact CB-CB 4.32Å; Q57-A161 HydrophobicContact CG-CB 3.54Å
58	S	98.4	Very high	98.3	Very high	65 Å²	65	34.8 Å²	34.8	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-71.6	-41.3	-173	-60.7	0	0	0	0	113.3	T54 L55 H61	T54-S58 WeakPolarHBondContact O-CB 3.3Å; T54-S58 PolarHBondContact O-N 3.27Å; T54-S58 PolarHBondContact O-OG 2.96Å; L55-S58 PolarHBondContact O-N 2.81Å; S58-H61 PolarHBondContact O-CE1 2.88Å
59	V	98	Very high	98.3	Very high	24 Å²	24	34.8 Å²	34.8	15%	0.145	20%	0.197	C	C	.	.	H	α-helix	trans	-130.1	3.1	-171.8	-55.3	0	0	0	0	114.7	A15 A19 L55 H61 I62 S63 A65	A15-V59 HydrophobicContact CB-CB 4Å; A15-V59 HydrophobicContact CB-CG1 4.26Å; A15-V59 HydrophobicContact CB-CG2 4.41Å; A19-V59 HydrophobicContact CB-CG2 3.68Å; L55-V59 WeakPolarHBondContact O-CG2 3.39Å; L55-V59 PolarHBondContact O-N 2.84Å; V59-H61 VanDerWaalsContact C-N 3.31Å; V59-H61 PolarHBondContact O-N 3.5Å; V59-I62 HydrophobicContact CB-CD1 4.47Å; V59-I62 HydrophobicContact CG1-CD1 4.41Å; V59-I62 WeakPolarHBondContact O-CB 3.31Å; V59-I62 PolarHBondContact O-N 3.48Å; V59-S63 PolarHBondContact O-N 3.32Å; V59-S63 PolarHBondContact O-OG 3.32Å; V59-A65 HydrophobicContact CG2-CB 3.99Å
60	G	96.8	Very high	98.3	Very high	18 Å²	18	34.7 Å²	34.7	19%	0.186	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-42.5	178.3	0	0	0	0	0	112.4	V56 I62 G64	V56-G60 WeakPolarHBondContact O-CA 3.39Å; V56-G60 PolarHBondContact O-N 2.96Å; G60-I62 PolarHBondContact O-N 3.32Å; G60-G64 VanDerWaalsContact O-CA 3.27Å; G60-G64 WeakPolarHBondContact O-CA 3.31Å; G60-G64 PolarHBondContact O-N 3.08Å
61	H	96.6	Very high	98.3	Very high	155 Å²	155	31 Å²	31	72%	0.718	18%	0.177	S	C	*	.	H	α-helix	trans	-68.8	-14.3	176	67	-83.2	0	0	0	114.1	S58 V59	S58-H61 PolarHBondContact O-CE1 2.88Å; V59-H61 VanDerWaalsContact C-N 3.31Å; V59-H61 PolarHBondContact O-N 3.5Å
62	I	97.9	Very high	98.3	Very high	76 Å²	76	30.3 Å²	30.3	39%	0.39	17%	0.172	S	C	.	.	H	α-helix	trans	-94.7	-43.1	-179.7	-53.4	177.9	0	0	0	110.9	R11 A15 V59 G60	R11-I62 HydrophobicContact CB-CG2 4.36Å; A15-I62 HydrophobicContact CB-CB 4.36Å; A15-I62 HydrophobicContact CB-CG2 4.03Å; V59-I62 HydrophobicContact CB-CD1 4.47Å; V59-I62 HydrophobicContact CG1-CD1 4.41Å; V59-I62 WeakPolarHBondContact O-CB 3.31Å; V59-I62 PolarHBondContact O-N 3.48Å; G60-I62 PolarHBondContact O-N 3.32Å
63	S	97.8	Very high	98.3	Very high	10 Å²	10	33.1 Å²	33.1	7%	0.07	18%	0.184	C	C	.	.	H	α-helix	trans	-129.6	-15.8	-166.9	58.1	0	0	0	0	114.9	E16 V59 A65 Y89	E16-S63 PolarHBondContact OE1-OG 2.91Å; V59-S63 PolarHBondContact O-N 3.32Å; V59-S63 PolarHBondContact O-OG 3.32Å; S63-A65 VanDerWaalsContact C-N 3.31Å; S63-A65 PolarHBondContact OG-N 3.02Å; S63-A65 VanDerWaalsContact OG-N 3.08Å; S63-Y89 WeakPolarHBondContact CA-OH 3.49Å; S63-Y89 VanDerWaalsContact O-CE2 3.31Å; S63-Y89 WeakPolarHBondContact O-CE2 3.35Å; S63-Y89 PolarHBondContact O-OH 2.78Å
64	G	97.4	Very high	98.3	Very high	18 Å²	18	32.8 Å²	32.8	19%	0.186	18%	0.181	C	C	.	.			trans	87.3	-6.2	-162.6	0	0	0	0	0	113.7	G60 H66 Y149	G60-G64 VanDerWaalsContact O-CA 3.27Å; G60-G64 WeakPolarHBondContact O-CA 3.31Å; G60-G64 PolarHBondContact O-N 3.08Å; G64-H66 VanDerWaalsContact C-N 3.32Å; G64-H66 PolarHBondContact O-N 3Å; G64-Y149 VanDerWaalsContact O-CE2 3.3Å; G64-Y149 WeakPolarHBondContact O-CE2 3.49Å; G64-Y149 PolarHBondContact O-OH 2.73Å; G64-Y149 VanDerWaalsContact O-OH 3.07Å
65	A	98.3	Very high	98.3	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.033	16%	0.159	C	C	.	.			trans	47.8	50.4	178	0	0	0	0	0	113.4	E16 V56 V59 S63	E16-A65 WeakPolarHBondContact OE1-CA 3.4Å; E16-A65 PolarHBondContact OE1-N 3.32Å; V56-A65 HydrophobicContact CB-CB 4.28Å; V56-A65 HydrophobicContact CG2-CB 3.92Å; V59-A65 HydrophobicContact CG2-CB 3.99Å; S63-A65 VanDerWaalsContact C-N 3.31Å; S63-A65 PolarHBondContact OG-N 3.02Å; S63-A65 VanDerWaalsContact OG-N 3.08Å
66	H	98.8	Very high	98.3	Very high	14 Å²	14	30 Å²	30	7%	0.065	16%	0.162	C	C	.	.			trans	-63.4	-46.9	179.4	-69.5	-168.5	0	0	0	110.5	E16 G64 N68 V71 T72 F75 Y89	E16-H66 PolarHBondContact OE1-N 3Å; G64-H66 VanDerWaalsContact C-N 3.32Å; G64-H66 PolarHBondContact O-N 3Å; H66-N68 WeakPolarHBondContact O-CB 3.44Å; H66-N68 PolarHBondContact O-N 2.83Å; H66-V71 HydrophobicContact CB-CB 4.46Å; H66-V71 HydrophobicContact CB-CG1 4.13Å; H66-T72 WeakPolarHBondContact CB-OG1 3.27Å; H66-T72 WeakPolarHBondContact ND1-CA 3.3Å; H66-T72 PolarHBondContact ND1-OG1 3.48Å; H66-T72 VanDerWaalsContact ND1-OG1 3.09Å; H66-F75 AromaticContact CE1-CD2 3.49Å; H66-F75 VanDerWaalsContact CE1-CD2 3.49Å; H66-F75 WeakPolarHBondContact CE1-CD2 3.44Å; H66-F75 AromaticContact CE1-CG 3.69Å; H66-F75 AromaticContact NE2-CD2 3.4Å; H66-F75 WeakPolarHBondContact NE2-CD2 3.32Å; H66-F75 AromaticContact NE2-CE2 3.67Å; H66-F75 AromaticContact NE2-CG 3.75Å; H66-Y89 HydrophobicContact CB-CD2 4.36Å; H66-Y89 AromaticContact ND1-CD2 3.64Å; H66-Y89 AromaticContact ND1-CE2 3.95Å
67	V	98.6	Very high	98.2	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	17%	0.173	C	C	.	.			trans	47.5	18.9	178.4	-58.9	0	0	0	0	114.8	E16 A19 T20 L52 N184	E16-V67 WeakPolarHBondContact OE2-CA 3.41Å; E16-V67 PolarHBondContact OE2-N 3.39Å; A19-V67 HydrophobicContact CB-CG1 3.37Å; T20-V67 WeakPolarHBondContact OG1-CA 3.26Å; L52-V67 HydrophobicContact CD1-CG2 3.37Å; V67-N184 PolarHBondContact O-ND2 3.3Å
68	N	98.9	Very high	98	Very high	3 Å²	3	25.6 Å²	25.6	2%	0.016	14%	0.144	C	C	.	.	S	Bend	trans	-160.2	121.6	-164.8	-176	-19.4	0	0	0	109.9	H66 A70 V71 T72 Q93 M183 N184 P185	H66-N68 WeakPolarHBondContact O-CB 3.44Å; H66-N68 PolarHBondContact O-N 2.83Å; N68-A70 VanDerWaalsContact C-N 3.28Å; N68-A70 PolarHBondContact O-N 3.47Å; N68-A70 WeakPolarHBondContact OD1-CB 3.41Å; N68-A70 PolarHBondContact OD1-N 2.98Å; N68-V71 HydrophobicContact CB-CB 3.97Å; N68-V71 HydrophobicContact CB-CG2 3.74Å; N68-V71 PolarHBondContact O-N 3.23Å; N68-T72 PolarHBondContact O-N 2.83Å; N68-T72 PolarHBondContact O-OG1 3.42Å; N68-Q93 PolarHBondContact O-OE1 2.9Å; N68-M183 PolarHBondContact ND2-O 3.18Å; N68-N184 HydrophobicContact CB-CB 4.35Å; N68-N184 WeakPolarHBondContact CB-ND2 3.27Å; N68-N184 WeakPolarHBondContact ND2-CB 3.41Å; N68-N184 WeakPolarHBondContact OD1-CA 3.41Å; N68-P185 VanDerWaalsContact OD1-CD 3.29Å; N68-P185 WeakPolarHBondContact OD1-CD 3.37Å
69	P	98.9	Very high	97.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.9	-34.3	176.3	-28.8	36.7	0	0	0	114.1	T72 F73 M90 Q93 N184 P185 A186	P69-T72 PolarHBondContact O-N 3.05Å; P69-F73 VanDerWaalsContact O-CB 3.27Å; P69-F73 WeakPolarHBondContact O-CB 3.31Å; P69-F73 PolarHBondContact O-N 3.24Å; P69-M90 HydrophobicContact CB-CG 3.91Å; P69-M90 HydrophobicContact CB-SD 4.18Å; P69-Q93 HydrophobicContact CG-CB 4.44Å; P69-N184 WeakPolarHBondContact CD-OD1 3.4Å; P69-P185 HydrophobicContact CB-CB 4.18Å; P69-P185 HydrophobicContact CB-CG 4.16Å; P69-P185 HydrophobicContact CG-CB 4.19Å; P69-A186 HydrophobicContact CG-CB 3.85Å
70	A	98.9	Very high	97.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.9	-37.3	177.6	0	0	0	0	0	112.7	N68 A74 T138 P185 P208 I209	N68-A70 VanDerWaalsContact C-N 3.28Å; N68-A70 PolarHBondContact O-N 3.47Å; N68-A70 WeakPolarHBondContact OD1-CB 3.41Å; N68-A70 PolarHBondContact OD1-N 2.98Å; A70-A74 WeakPolarHBondContact O-CB 3.08Å; A70-A74 PolarHBondContact O-N 3.38Å; A70-T138 HydrophobicContact CB-CG2 4.04Å; A70-P185 HydrophobicContact CB-CG 4.31Å; A70-P208 HydrophobicContact CB-CB 3.67Å; A70-P208 WeakPolarHBondContact CB-O 3.09Å; A70-I209 HydrophobicContact CB-CD1 4.46Å
71	V	98.9	Very high	97.6	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.012	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-45.8	173.3	175.8	0	0	0	0	109.9	H66 N68 F73 A74 F75 F141 V142 I145	H66-V71 HydrophobicContact CB-CB 4.46Å; H66-V71 HydrophobicContact CB-CG1 4.13Å; N68-V71 HydrophobicContact CB-CB 3.97Å; N68-V71 HydrophobicContact CB-CG2 3.74Å; N68-V71 PolarHBondContact O-N 3.23Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 2.92Å; V71-A74 WeakPolarHBondContact O-CA 3.38Å; V71-A74 VanDerWaalsContact O-CB 3.31Å; V71-A74 WeakPolarHBondContact O-CB 3.33Å; V71-A74 PolarHBondContact O-N 3.2Å; V71-F75 HydrophobicContact CG1-CD2 3.8Å; V71-F75 HydrophobicContact CG1-CE2 3.66Å; V71-F75 VanDerWaalsContact O-CD2 3.31Å; V71-F75 WeakPolarHBondContact O-CD2 3.43Å; V71-F75 PolarHBondContact O-N 3.46Å; V71-F141 HydrophobicContact CG2-CD1 4.15Å; V71-F141 HydrophobicContact CG2-CE1 3.52Å; V71-F141 HydrophobicContact CG2-CZ 4.32Å; V71-V142 HydrophobicContact CG2-CG2 4.22Å; V71-I145 HydrophobicContact CG1-CD1 3.95Å; V71-I145 HydrophobicContact CG2-CD1 3.69Å
72	T	98.8	Very high	97.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-43.7	176.7	-57	0	0	0	0	112	H66 N68 P69 A74 F75 L76 M81 A86 Y89 M90 Q93	H66-T72 WeakPolarHBondContact CB-OG1 3.27Å; H66-T72 WeakPolarHBondContact ND1-CA 3.3Å; H66-T72 PolarHBondContact ND1-OG1 3.48Å; H66-T72 VanDerWaalsContact ND1-OG1 3.09Å; N68-T72 PolarHBondContact O-N 2.83Å; N68-T72 PolarHBondContact O-OG1 3.42Å; P69-T72 PolarHBondContact O-N 3.05Å; T72-A74 VanDerWaalsContact C-N 3.33Å; T72-A74 PolarHBondContact O-N 3.38Å; T72-F75 PolarHBondContact O-N 3.34Å; T72-L76 PolarHBondContact O-N 3Å; T72-M81 HydrophobicContact CG2-CE 3.91Å; T72-M81 HydrophobicContact CG2-SD 3.68Å; T72-M81 VanDerWaalsContact O-SD 3.38Å; T72-A86 HydrophobicContact CG2-CB 3.95Å; T72-Y89 HydrophobicContact CG2-CD2 4.45Å; T72-M90 HydrophobicContact CG2-CG 3.95Å; T72-Q93 PolarHBondContact OG1-NE2 3.09Å; T72-Q93 PolarHBondContact OG1-OE1 3.49Å
73	F	98.8	Very high	97.6	Very high	62 Å²	62	18.8 Å²	18.8	27%	0.272	10%	0.102	S	C	.	.	H	α-helix	trans	-61.7	-40.7	173.7	179.7	-101	0	0	0	112.1	P69 V71 L76 V77 I209	P69-F73 VanDerWaalsContact O-CB 3.27Å; P69-F73 WeakPolarHBondContact O-CB 3.31Å; P69-F73 PolarHBondContact O-N 3.24Å; V71-F73 VanDerWaalsContact C-N 3.31Å; V71-F73 PolarHBondContact O-N 2.92Å; F73-L76 WeakPolarHBondContact O-CB 3.16Å; F73-L76 PolarHBondContact O-N 2.97Å; F73-V77 HydrophobicContact CD1-CG2 4.13Å; F73-V77 HydrophobicContact CE1-CG2 3.64Å; F73-V77 HydrophobicContact CE2-CG2 4.12Å; F73-V77 HydrophobicContact CZ-CG2 3.63Å; F73-V77 WeakPolarHBondContact O-CG2 3.47Å; F73-V77 PolarHBondContact O-N 3.48Å; F73-I209 HydrophobicContact CB-CD1 3.78Å; F73-I209 HydrophobicContact CD1-CD1 4.19Å; F73-I209 HydrophobicContact CD1-CG2 3.77Å; F73-I209 HydrophobicContact CE1-CG2 3.67Å; F73-I209 HydrophobicContact CG-CD1 3.93Å; F73-I209 HydrophobicContact CG-CG2 4.27Å; F73-I209 HydrophobicContact CZ-CG2 4.11Å
74	A	98.6	Very high	97.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60	-46.4	175.2	0	0	0	0	0	112.1	A70 V71 T72 L76 V77 G78 V142 F146 G212 S216	A70-A74 WeakPolarHBondContact O-CB 3.08Å; A70-A74 PolarHBondContact O-N 3.38Å; V71-A74 WeakPolarHBondContact O-CA 3.38Å; V71-A74 VanDerWaalsContact O-CB 3.31Å; V71-A74 WeakPolarHBondContact O-CB 3.33Å; V71-A74 PolarHBondContact O-N 3.2Å; T72-A74 VanDerWaalsContact C-N 3.33Å; T72-A74 PolarHBondContact O-N 3.38Å; A74-L76 VanDerWaalsContact C-N 3.28Å; A74-L76 PolarHBondContact O-N 3.05Å; A74-V77 PolarHBondContact O-N 3.25Å; A74-G78 PolarHBondContact O-N 3.2Å; A74-V142 HydrophobicContact CB-CG1 3.52Å; A74-V142 HydrophobicContact CB-CG2 4.18Å; A74-F146 HydrophobicContact CB-CE2 3.89Å; A74-F146 HydrophobicContact CB-CZ 4.21Å; A74-F146 WeakPolarHBondContact O-CZ 3.27Å; A74-G212 WeakPolarHBondContact CB-O 3.4Å; A74-S216 WeakPolarHBondContact O-CB 3.26Å; A74-S216 PolarHBondContact O-OG 2.86Å
75	F	98.4	Very high	97.6	Very high	13 Å²	13	21.4 Å²	21.4	6%	0.057	11%	0.107	C	C	.	.	H	α-helix	trans	-63.6	-32.5	175.3	-82	-84.2	0	0	0	113	H66 V71 T72 S79 Q80 M81 I145 F146 Y149	H66-F75 AromaticContact CE1-CD2 3.49Å; H66-F75 VanDerWaalsContact CE1-CD2 3.49Å; H66-F75 WeakPolarHBondContact CE1-CD2 3.44Å; H66-F75 AromaticContact CE1-CG 3.69Å; H66-F75 AromaticContact NE2-CD2 3.4Å; H66-F75 WeakPolarHBondContact NE2-CD2 3.32Å; H66-F75 AromaticContact NE2-CE2 3.67Å; H66-F75 AromaticContact NE2-CG 3.75Å; V71-F75 HydrophobicContact CG1-CD2 3.8Å; V71-F75 HydrophobicContact CG1-CE2 3.66Å; V71-F75 VanDerWaalsContact O-CD2 3.31Å; V71-F75 WeakPolarHBondContact O-CD2 3.43Å; V71-F75 PolarHBondContact O-N 3.46Å; T72-F75 PolarHBondContact O-N 3.34Å; F75-S79 PolarHBondContact O-N 2.81Å; F75-Q80 HydrophobicContact CD1-CB 3.85Å; F75-Q80 HydrophobicContact CD1-CG 4.43Å; F75-Q80 VanDerWaalsContact CD1-OE1 3.22Å; F75-Q80 PolarHBondContact O-N 3.39Å; F75-M81 HydrophobicContact CB-CG 4.15Å; F75-M81 HydrophobicContact CB-SD 3.76Å; F75-I145 HydrophobicContact CE2-CG2 3.7Å; F75-I145 HydrophobicContact CZ-CG2 3.71Å; F75-F146 HydrophobicContact CD1-CE2 4.47Å; F75-F146 HydrophobicContact CD1-CZ 4.43Å; F75-F146 HydrophobicContact CD2-CE2 4.18Å; F75-F146 HydrophobicContact CE1-CE2 4.45Å; F75-F146 HydrophobicContact CE2-CE2 4.17Å; F75-F146 HydrophobicContact CG-CE2 4.33Å; F75-F146 HydrophobicContact CG-CZ 4.42Å; F75-F146 HydrophobicContact CZ-CE2 4.3Å; F75-Y149 HydrophobicContact CE1-CD2 4.4Å; F75-Y149 AromaticContact CZ-CD2 3.75Å; F75-Y149 HydrophobicContact CZ-CD2 3.75Å; F75-Y149 HydrophobicContact CZ-CE2 4.3Å; F75-Y149 HydrophobicContact CZ-CG 4.39Å
76	L	97.9	Very high	97.6	Very high	25 Å²	25	21.2 Å²	21.2	13%	0.131	11%	0.105	C	C	.	.	H	α-helix	trans	-65.5	-48.4	172.7	-176.8	68.4	0	0	0	111.2	T72 F73 A74 G78 S79 M81 L83 A86 L237	T72-L76 PolarHBondContact O-N 3Å; F73-L76 WeakPolarHBondContact O-CB 3.16Å; F73-L76 PolarHBondContact O-N 2.97Å; A74-L76 VanDerWaalsContact C-N 3.28Å; A74-L76 PolarHBondContact O-N 3.05Å; L76-G78 VanDerWaalsContact C-N 3.33Å; L76-G78 PolarHBondContact O-N 3.25Å; L76-S79 WeakPolarHBondContact O-CA 3.27Å; L76-S79 PolarHBondContact O-N 3.42Å; L76-M81 HydrophobicContact CB-CG 4.3Å; L76-M81 HydrophobicContact CD1-CG 4.48Å; L76-L83 HydrophobicContact CD1-CB 4.41Å; L76-L83 HydrophobicContact CD1-CD1 4.23Å; L76-L83 HydrophobicContact CD2-CD1 3.88Å; L76-A86 HydrophobicContact CB-CB 4.2Å; L76-A86 HydrophobicContact CD1-CB 3.94Å; L76-A86 HydrophobicContact CD2-CB 4.07Å; L76-A86 HydrophobicContact CG-CB 4.3Å; L76-L237 HydrophobicContact CD1-CD2 3.51Å; L76-L237 HydrophobicContact CG-CD2 4.25Å
77	V	96.3	Very high	97.6	Very high	46 Å²	46	27.3 Å²	27.3	28%	0.279	13%	0.132	S	C	.	.	H	α-helix	trans	-62	-40.8	176.9	171.8	0	0	0	0	111.2	F73 A74 S79 L217	F73-V77 HydrophobicContact CD1-CG2 4.13Å; F73-V77 HydrophobicContact CE1-CG2 3.64Å; F73-V77 HydrophobicContact CE2-CG2 4.12Å; F73-V77 HydrophobicContact CZ-CG2 3.63Å; F73-V77 WeakPolarHBondContact O-CG2 3.47Å; F73-V77 PolarHBondContact O-N 3.48Å; A74-V77 PolarHBondContact O-N 3.25Å; V77-S79 PolarHBondContact O-N 3.47Å; V77-L217 HydrophobicContact CG1-CD2 3.95Å; V77-L217 HydrophobicContact CG1-CG 4.2Å
78	G	95.4	Very high	97.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-1.6	172.8	0	0	0	0	0	114.4	A74 L76 Q80 S216 D220	A74-G78 PolarHBondContact O-N 3.2Å; L76-G78 VanDerWaalsContact C-N 3.33Å; L76-G78 PolarHBondContact O-N 3.25Å; G78-Q80 WeakPolarHBondContact O-CG 3.4Å; G78-Q80 PolarHBondContact O-N 2.79Å; G78-S216 WeakPolarHBondContact CA-OG 3.1Å; G78-S216 PolarHBondContact N-OG 2.9Å; G78-D220 WeakPolarHBondContact CA-OD2 3.22Å
79	S	95.4	Very high	97.6	Very high	7 Å²	7	28.4 Å²	28.4	5%	0.049	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	41.6	-177.7	-44.9	0	0	0	0	111.7	F75 L76 V77 K228 R233 V236	F75-S79 PolarHBondContact O-N 2.81Å; L76-S79 WeakPolarHBondContact O-CA 3.27Å; L76-S79 PolarHBondContact O-N 3.42Å; V77-S79 PolarHBondContact O-N 3.47Å; S79-K228 PolarHBondContact O-NZ 3.25Å; S79-R233 PolarHBondContact OG-NH1 2.82Å; S79-R233 VanDerWaalsContact OG-NH1 3.14Å; S79-V236 VanDerWaalsContact O-CG1 3.3Å; S79-V236 WeakPolarHBondContact O-CG1 3.27Å
80	Q	94.6	Very high	97.6	Very high	63 Å²	63	30.6 Å²	30.6	29%	0.294	15%	0.15	S	C	.	.			trans	-108	-8.5	-179.6	-61	-165.3	7.9	0	0	112.6	F75 G78	F75-Q80 HydrophobicContact CD1-CB 3.85Å; F75-Q80 HydrophobicContact CD1-CG 4.43Å; F75-Q80 VanDerWaalsContact CD1-OE1 3.22Å; F75-Q80 PolarHBondContact O-N 3.39Å; G78-Q80 WeakPolarHBondContact O-CG 3.4Å; G78-Q80 PolarHBondContact O-N 2.79Å
81	M	95.5	Very high	97.5	Very high	12 Å²	12	32.3 Å²	32.3	6%	0.059	16%	0.164	C	C	.	.	S	Bend	trans	-142.2	157.4	174	70.7	-174.8	-45	0	0	111.7	T72 F75 L76 R85 A86 Y89	T72-M81 HydrophobicContact CG2-CE 3.91Å; T72-M81 HydrophobicContact CG2-SD 3.68Å; T72-M81 VanDerWaalsContact O-SD 3.38Å; F75-M81 HydrophobicContact CB-CG 4.15Å; F75-M81 HydrophobicContact CB-SD 3.76Å; L76-M81 HydrophobicContact CB-CG 4.3Å; L76-M81 HydrophobicContact CD1-CG 4.48Å; M81-R85 HydrophobicContact CE-CB 4.06Å; M81-R85 HydrophobicContact CE-CG 3.64Å; M81-A86 HydrophobicContact CE-CB 4.07Å; M81-A86 HydrophobicContact CG-CB 4.19Å; M81-A86 HydrophobicContact SD-CB 3.85Å; M81-Y89 HydrophobicContact CE-CD2 3.93Å; M81-Y89 HydrophobicContact CE-CE2 4.22Å; M81-Y89 HydrophobicContact CE-CG 4.18Å
82	S	97.1	Very high	97.5	Very high	5 Å²	5	32.5 Å²	32.5	4%	0.035	17%	0.166	C	C	.	.			trans	-72.8	155.7	176.2	75.1	0	0	0	0	112	E3 L84 R85 A86 V236	E3-S82 PolarHBondContact OE1-OG 2.66Å; E3-S82 VanDerWaalsContact OE2-CB 3.3Å; E3-S82 WeakPolarHBondContact OE2-CB 3.42Å; E3-S82 PolarHBondContact OE2-OG 3.41Å; S82-L84 VanDerWaalsContact C-N 3.28Å; S82-L84 PolarHBondContact O-N 2.88Å; S82-R85 PolarHBondContact O-N 2.98Å; S82-R85 VanDerWaalsContact OG-CB 3.32Å; S82-R85 WeakPolarHBondContact OG-CB 3.3Å; S82-R85 PolarHBondContact OG-N 2.85Å; S82-R85 VanDerWaalsContact OG-N 3.11Å; S82-A86 WeakPolarHBondContact O-CB 3.43Å; S82-A86 PolarHBondContact O-N 3.42Å; S82-V236 VanDerWaalsContact CA-O 3.29Å; S82-V236 WeakPolarHBondContact CA-O 3.49Å; S82-V236 WeakPolarHBondContact CB-O 3.28Å
83	L	97.3	Very high	97.6	Very high	109 Å²	109	32.5 Å²	32.5	57%	0.571	17%	0.166	S	C	*	.	H	α-helix	trans	-61.1	-39.7	176.3	-176.5	65.4	0	0	0	111.6	L76 A86 F87 L237	L76-L83 HydrophobicContact CD1-CB 4.41Å; L76-L83 HydrophobicContact CD1-CD1 4.23Å; L76-L83 HydrophobicContact CD2-CD1 3.88Å; L83-A86 PolarHBondContact O-N 3.41Å; L83-F87 WeakPolarHBondContact O-CB 3.12Å; L83-F87 PolarHBondContact O-N 2.7Å; L83-L237 PolarHBondContact N-O 3.18Å
84	L	96.6	Very high	97.6	Very high	35 Å²	35	31.4 Å²	31.4	18%	0.183	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-50.3	176.7	176	66.7	0	0	0	110.9	M1 E3 L4 F9 S82 A86 F87 C88	M1-L84 HydrophobicContact CB-CD2 4.22Å; M1-L84 HydrophobicContact CE-CD1 3.96Å; M1-L84 HydrophobicContact CE-CD2 3.84Å; M1-L84 HydrophobicContact CE-CG 4.45Å; M1-L84 HydrophobicContact SD-CB 4.5Å; M1-L84 HydrophobicContact SD-CD2 3.81Å; E3-L84 HydrophobicContact CB-CD2 4.27Å; L4-L84 HydrophobicContact CD2-CD2 3.88Å; L4-L84 HydrophobicContact CG-CD2 3.91Å; F9-L84 HydrophobicContact CZ-CD2 4.29Å; F9-L84 HydrophobicContact CZ-CG 4.23Å; S82-L84 VanDerWaalsContact C-N 3.28Å; S82-L84 PolarHBondContact O-N 2.88Å; L84-A86 VanDerWaalsContact C-N 3.33Å; L84-A86 PolarHBondContact O-N 3.09Å; L84-F87 PolarHBondContact O-N 3.02Å; L84-C88 PolarHBondContact O-N 2.96Å; L84-C88 PolarHBondContact O-SG 3.37Å; L84-C88 VanDerWaalsContact O-SG 3.39Å
85	R	97.6	Very high	97.6	Very high	47 Å²	47	36.9 Å²	36.9	18%	0.177	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-43.2	179.4	-173.9	178.4	-72.5	-105.3	4	111.2	E3 F9 M81 S82 F87 C88 Y89	E3-R85 IonicContact OE1-CZ 2.66Å; E3-R85 IonicContact OE1-NE 3.35Å; E3-R85 PolarHBondContact OE1-NE 3.37Å; E3-R85 IonicContact OE1-NH2 2.92Å; F9-R85 HydrophobicContact CE2-CB 4Å; F9-R85 HydrophobicContact CE2-CG 4.19Å; M81-R85 HydrophobicContact CE-CB 4.06Å; M81-R85 HydrophobicContact CE-CG 3.64Å; S82-R85 PolarHBondContact O-N 2.98Å; S82-R85 VanDerWaalsContact OG-CB 3.32Å; S82-R85 WeakPolarHBondContact OG-CB 3.3Å; S82-R85 PolarHBondContact OG-N 2.85Å; S82-R85 VanDerWaalsContact OG-N 3.11Å; R85-F87 VanDerWaalsContact C-N 3.34Å; R85-F87 PolarHBondContact O-N 2.92Å; R85-C88 PolarHBondContact O-N 2.93Å; R85-Y89 HydrophobicContact CG-CD1 3.78Å; R85-Y89 HydrophobicContact CG-CE1 3.55Å; R85-Y89 HydrophobicContact CG-CG 4.47Å; R85-Y89 PolarHBondContact NH1-OH 2.79Å; R85-Y89 WeakPolarHBondContact O-CB 3.29Å; R85-Y89 VanDerWaalsContact O-CD1 3.32Å; R85-Y89 WeakPolarHBondContact O-CD1 3.49Å; R85-Y89 PolarHBondContact O-N 2.98Å
86	A	98.4	Very high	97.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-45.3	178.1	0	0	0	0	0	111.6	T72 L76 M81 S82 L83 L84 Y89 M90	T72-A86 HydrophobicContact CG2-CB 3.95Å; L76-A86 HydrophobicContact CB-CB 4.2Å; L76-A86 HydrophobicContact CD1-CB 3.94Å; L76-A86 HydrophobicContact CD2-CB 4.07Å; L76-A86 HydrophobicContact CG-CB 4.3Å; M81-A86 HydrophobicContact CE-CB 4.07Å; M81-A86 HydrophobicContact CG-CB 4.19Å; M81-A86 HydrophobicContact SD-CB 3.85Å; S82-A86 WeakPolarHBondContact O-CB 3.43Å; S82-A86 PolarHBondContact O-N 3.42Å; L83-A86 PolarHBondContact O-N 3.41Å; L84-A86 VanDerWaalsContact C-N 3.33Å; L84-A86 PolarHBondContact O-N 3.09Å; A86-Y89 PolarHBondContact O-N 3.29Å; A86-M90 HydrophobicContact CB-CE 4.22Å; A86-M90 VanDerWaalsContact O-CE 3.3Å; A86-M90 WeakPolarHBondContact O-CE 3.45Å; A86-M90 WeakPolarHBondContact O-CG 3.31Å; A86-M90 PolarHBondContact O-N 2.75Å
87	F	98.3	Very high	97.7	Very high	142 Å²	142	35 Å²	35	62%	0.623	18%	0.182	S	C	*	.	H	α-helix	trans	-62	-48.6	176.2	178.8	-98.2	0	0	0	112.3	L83 L84 R85 Y89 M90 A91	L83-F87 WeakPolarHBondContact O-CB 3.12Å; L83-F87 PolarHBondContact O-N 2.7Å; L84-F87 PolarHBondContact O-N 3.02Å; R85-F87 VanDerWaalsContact C-N 3.34Å; R85-F87 PolarHBondContact O-N 2.92Å; F87-Y89 VanDerWaalsContact C-N 3.33Å; F87-Y89 PolarHBondContact O-N 3.47Å; F87-M90 PolarHBondContact O-N 3.27Å; F87-A91 WeakPolarHBondContact O-CB 3.35Å; F87-A91 PolarHBondContact O-N 3.07Å
88	C	98.4	Very high	97.8	Very high	24 Å²	24	34.7 Å²	34.7	16%	0.162	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-38.1	178.8	-68.2	0	0	0	0	112.5	F9 I13 L84 R85 A92	F9-C88 HydrophobicContact CZ-CB 4.16Å; I13-C88 HydrophobicContact CD1-CB 3.64Å; I13-C88 HydrophobicContact CG1-CB 4.06Å; L84-C88 PolarHBondContact O-N 2.96Å; L84-C88 PolarHBondContact O-SG 3.37Å; L84-C88 VanDerWaalsContact O-SG 3.39Å; R85-C88 PolarHBondContact O-N 2.93Å; C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.47Å; C88-A92 PolarHBondContact O-N 2.92Å
89	Y	98.8	Very high	97.9	Very high	5 Å²	5	36 Å²	36	2%	0.02	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-50.7	174.4	-88.5	35.6	0	0	0	111	A12 I13 E16 S63 H66 T72 M81 R85 A86 F87 A91 A92 Q93	A12-Y89 HydrophobicContact CB-CE1 4.13Å; A12-Y89 WeakPolarHBondContact CB-OH 3.31Å; I13-Y89 HydrophobicContact CG1-CD1 4.43Å; E16-Y89 HydrophobicContact CG-CD1 4.1Å; E16-Y89 HydrophobicContact CG-CD2 3.56Å; E16-Y89 HydrophobicContact CG-CE1 4.14Å; E16-Y89 HydrophobicContact CG-CE2 3.61Å; E16-Y89 HydrophobicContact CG-CG 3.82Å; S63-Y89 WeakPolarHBondContact CA-OH 3.49Å; S63-Y89 VanDerWaalsContact O-CE2 3.31Å; S63-Y89 WeakPolarHBondContact O-CE2 3.35Å; S63-Y89 PolarHBondContact O-OH 2.78Å; H66-Y89 HydrophobicContact CB-CD2 4.36Å; H66-Y89 AromaticContact ND1-CD2 3.64Å; H66-Y89 AromaticContact ND1-CE2 3.95Å; T72-Y89 HydrophobicContact CG2-CD2 4.45Å; M81-Y89 HydrophobicContact CE-CD2 3.93Å; M81-Y89 HydrophobicContact CE-CE2 4.22Å; M81-Y89 HydrophobicContact CE-CG 4.18Å; R85-Y89 HydrophobicContact CG-CD1 3.78Å; R85-Y89 HydrophobicContact CG-CE1 3.55Å; R85-Y89 HydrophobicContact CG-CG 4.47Å; R85-Y89 PolarHBondContact NH1-OH 2.79Å; R85-Y89 WeakPolarHBondContact O-CB 3.29Å; R85-Y89 VanDerWaalsContact O-CD1 3.32Å; R85-Y89 WeakPolarHBondContact O-CD1 3.49Å; R85-Y89 PolarHBondContact O-N 2.98Å; A86-Y89 PolarHBondContact O-N 3.29Å; F87-Y89 VanDerWaalsContact C-N 3.33Å; F87-Y89 PolarHBondContact O-N 3.47Å; Y89-A91 VanDerWaalsContact C-N 3.31Å; Y89-A91 PolarHBondContact O-N 3.38Å; Y89-A92 PolarHBondContact O-N 2.96Å; Y89-Q93 WeakPolarHBondContact O-CB 3.4Å; Y89-Q93 VanDerWaalsContact O-CD 3.25Å; Y89-Q93 WeakPolarHBondContact O-CG 3.46Å; Y89-Q93 PolarHBondContact O-N 2.87Å
90	M	98.8	Very high	98.1	Very high	45 Å²	45	35.7 Å²	35.7	22%	0.222	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-40.4	179.3	-72.4	-174.9	-81.2	0	0	112.1	P69 T72 A86 F87 Q93 L94	P69-M90 HydrophobicContact CB-CG 3.91Å; P69-M90 HydrophobicContact CB-SD 4.18Å; T72-M90 HydrophobicContact CG2-CG 3.95Å; A86-M90 HydrophobicContact CB-CE 4.22Å; A86-M90 VanDerWaalsContact O-CE 3.3Å; A86-M90 WeakPolarHBondContact O-CE 3.45Å; A86-M90 WeakPolarHBondContact O-CG 3.31Å; A86-M90 PolarHBondContact O-N 2.75Å; F87-M90 PolarHBondContact O-N 3.27Å; M90-Q93 PolarHBondContact O-N 3.42Å; M90-L94 WeakPolarHBondContact O-CB 3.46Å; M90-L94 VanDerWaalsContact O-CG 3.25Å; M90-L94 WeakPolarHBondContact O-CG 3.34Å; M90-L94 PolarHBondContact O-N 2.87Å
91	A	98.8	Very high	98.3	Very high	37 Å²	37	32.7 Å²	32.7	31%	0.306	18%	0.175	S	C	.	.	H	α-helix	trans	-63.1	-46.7	174.3	0	0	0	0	0	111.9	F87 Y89 Q93 L94 L95	F87-A91 WeakPolarHBondContact O-CB 3.35Å; F87-A91 PolarHBondContact O-N 3.07Å; Y89-A91 VanDerWaalsContact C-N 3.31Å; Y89-A91 PolarHBondContact O-N 3.38Å; A91-Q93 VanDerWaalsContact C-N 3.34Å; A91-Q93 PolarHBondContact O-N 2.88Å; A91-L94 PolarHBondContact O-N 2.66Å; A91-L95 WeakPolarHBondContact O-CB 3.27Å; A91-L95 VanDerWaalsContact O-CG 3.31Å; A91-L95 WeakPolarHBondContact O-CG 3.39Å; A91-L95 PolarHBondContact O-N 2.9Å
92	A	98.9	Very high	98.5	Very high	6 Å²	6	34.3 Å²	34.3	5%	0.05	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-41.1	177.1	0	0	0	0	0	112.3	I13 E16 F17 C88 Y89 G96	I13-A92 HydrophobicContact CG2-CB 3.92Å; E16-A92 HydrophobicContact CB-CB 4.33Å; F17-A92 HydrophobicContact CB-CB 4.17Å; C88-A92 VanDerWaalsContact O-CB 3.3Å; C88-A92 WeakPolarHBondContact O-CB 3.47Å; C88-A92 PolarHBondContact O-N 2.92Å; Y89-A92 PolarHBondContact O-N 2.96Å; A92-G96 WeakPolarHBondContact O-CA 3.38Å; A92-G96 PolarHBondContact O-N 3.12Å
93	Q	98.9	Very high	98.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-46.8	176.8	-70.5	156.6	2	0	0	111.4	E16 T20 N68 P69 T72 Y89 M90 A91 G96 A97 A186	E16-Q93 HydrophobicContact CB-CG 4.45Å; E16-Q93 PolarHBondContact OE2-NE2 3.27Å; T20-Q93 HydrophobicContact CG2-CB 4.19Å; T20-Q93 WeakPolarHBondContact CG2-O 3.28Å; T20-Q93 WeakPolarHBondContact OG1-CG 3.46Å; N68-Q93 PolarHBondContact O-OE1 2.9Å; P69-Q93 HydrophobicContact CG-CB 4.44Å; T72-Q93 PolarHBondContact OG1-NE2 3.09Å; T72-Q93 PolarHBondContact OG1-OE1 3.49Å; Y89-Q93 WeakPolarHBondContact O-CB 3.4Å; Y89-Q93 VanDerWaalsContact O-CD 3.25Å; Y89-Q93 WeakPolarHBondContact O-CG 3.46Å; Y89-Q93 PolarHBondContact O-N 2.87Å; M90-Q93 PolarHBondContact O-N 3.42Å; A91-Q93 VanDerWaalsContact C-N 3.34Å; A91-Q93 PolarHBondContact O-N 2.88Å; Q93-G96 PolarHBondContact O-N 3.19Å; Q93-A97 WeakPolarHBondContact O-CB 3.36Å; Q93-A97 PolarHBondContact O-N 2.89Å; Q93-A186 HydrophobicContact CB-CB 4.24Å
94	L	98.9	Very high	98.6	Very high	39 Å²	39	32.3 Å²	32.3	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-62.8	-45.9	178.5	-70.9	166.2	0	0	0	111.8	M90 A91 A97 V98 A186 F189 W205	M90-L94 WeakPolarHBondContact O-CB 3.46Å; M90-L94 VanDerWaalsContact O-CG 3.25Å; M90-L94 WeakPolarHBondContact O-CG 3.34Å; M90-L94 PolarHBondContact O-N 2.87Å; A91-L94 PolarHBondContact O-N 2.66Å; L94-A97 PolarHBondContact O-N 3.2Å; L94-V98 VanDerWaalsContact O-CG2 3.32Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.13Å; L94-A186 HydrophobicContact CD2-CB 4.06Å; L94-F189 HydrophobicContact CD2-CB 4.04Å; L94-F189 HydrophobicContact CD2-CD1 3.67Å; L94-F189 HydrophobicContact CD2-CE1 4.32Å; L94-F189 HydrophobicContact CD2-CG 3.93Å; L94-W205 HydrophobicContact CD1-CH2 4.14Å; L94-W205 HydrophobicContact CD2-CH2 3.75Å; L94-W205 HydrophobicContact CD2-CZ2 3.95Å
95	L	98.9	Very high	98.7	Very high	114 Å²	114	36 Å²	36	60%	0.597	19%	0.194	S	C	*	.	H	α-helix	trans	-66.4	-41.1	177.3	-66.9	174.7	0	0	0	111.8	F17 A91 V98 A99	F17-L95 HydrophobicContact CD2-CB 4.14Å; F17-L95 HydrophobicContact CE2-CB 3.96Å; A91-L95 WeakPolarHBondContact O-CB 3.27Å; A91-L95 VanDerWaalsContact O-CG 3.31Å; A91-L95 WeakPolarHBondContact O-CG 3.39Å; A91-L95 PolarHBondContact O-N 2.9Å; L95-V98 PolarHBondContact O-N 3.03Å; L95-A99 WeakPolarHBondContact O-CB 3.38Å; L95-A99 PolarHBondContact O-N 3.46Å
96	G	98.9	Very high	98.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.9	-46.3	176	0	0	0	0	0	111.5	F17 L21 A92 Q93 V98 A99 G100	F17-G96 WeakPolarHBondContact O-CA 3.31Å; L21-G96 WeakPolarHBondContact CA-O 3.41Å; L21-G96 WeakPolarHBondContact CB-O 3.45Å; A92-G96 WeakPolarHBondContact O-CA 3.38Å; A92-G96 PolarHBondContact O-N 3.12Å; Q93-G96 PolarHBondContact O-N 3.19Å; G96-V98 PolarHBondContact O-N 2.94Å; G96-A99 PolarHBondContact O-N 2.95Å; G96-G100 PolarHBondContact O-N 2.85Å
97	A	98.9	Very high	98.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-49	175.8	0	0	0	0	0	111.9	T20 V24 Q93 L94 A99 G100 A101 A186 A190	T20-A97 HydrophobicContact CG2-CB 3.86Å; V24-A97 HydrophobicContact CB-CB 4.47Å; V24-A97 WeakPolarHBondContact CG1-O 3.45Å; V24-A97 HydrophobicContact CG2-CB 3.68Å; Q93-A97 WeakPolarHBondContact O-CB 3.36Å; Q93-A97 PolarHBondContact O-N 2.89Å; L94-A97 PolarHBondContact O-N 3.2Å; A97-A99 PolarHBondContact O-N 3.22Å; A97-G100 PolarHBondContact O-N 3.43Å; A97-A101 PolarHBondContact O-N 3.11Å; A97-A186 HydrophobicContact CB-CB 3.88Å; A97-A186 VanDerWaalsContact CB-O 3.31Å; A97-A186 WeakPolarHBondContact CB-O 3.49Å; A97-A190 VanDerWaalsContact C-CB 3.43Å; A97-A190 HydrophobicContact CB-CB 3.81Å; A97-A190 VanDerWaalsContact O-CB 3.3Å; A97-A190 WeakPolarHBondContact O-CB 3.32Å
98	V	98.9	Very high	98.7	Very high	39 Å²	39	35.3 Å²	35.3	24%	0.236	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-44.8	177	168.8	0	0	0	0	110.9	L94 L95 G96 G100 A101 A102 F189 A190 I193 L194	L94-V98 VanDerWaalsContact O-CG2 3.32Å; L94-V98 WeakPolarHBondContact O-CG2 3.29Å; L94-V98 PolarHBondContact O-N 3.13Å; L95-V98 PolarHBondContact O-N 3.03Å; G96-V98 PolarHBondContact O-N 2.94Å; V98-G100 PolarHBondContact O-N 3.05Å; V98-A101 PolarHBondContact O-N 3.28Å; V98-A102 VanDerWaalsContact O-CB 3.27Å; V98-A102 WeakPolarHBondContact O-CB 3.42Å; V98-A102 PolarHBondContact O-N 2.94Å; V98-F189 HydrophobicContact CG2-CD1 4.02Å; V98-F189 HydrophobicContact CG2-CE1 3.87Å; V98-A190 HydrophobicContact CG2-CB 4.4Å; V98-I193 HydrophobicContact CG2-CG2 3.76Å; V98-L194 HydrophobicContact CG1-CD1 3.91Å
99	A	98.9	Very high	98.7	Very high	28 Å²	28	37.2 Å²	37.2	23%	0.231	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-44.1	176.2	0	0	0	0	0	111.8	F17 L21 L95 G96 A97 A102 V103	F17-A99 HydrophobicContact CE2-CB 4.45Å; F17-A99 HydrophobicContact CZ-CB 4.02Å; L21-A99 HydrophobicContact CD1-CB 3.98Å; L21-A99 HydrophobicContact CG-CB 4.36Å; L95-A99 WeakPolarHBondContact O-CB 3.38Å; L95-A99 PolarHBondContact O-N 3.46Å; G96-A99 PolarHBondContact O-N 2.95Å; A97-A99 PolarHBondContact O-N 3.22Å; A99-A102 PolarHBondContact O-N 2.83Å; A99-V103 VanDerWaalsContact O-CG2 3.31Å; A99-V103 WeakPolarHBondContact O-CG2 3.16Å; A99-V103 PolarHBondContact O-N 2.82Å
100	G	98.9	Very high	98.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-44.6	178.2	0	0	0	0	0	112.4	L21 G96 A97 V98 L104	L21-G100 WeakPolarHBondContact O-CA 3.34Å; G96-G100 PolarHBondContact O-N 2.85Å; A97-G100 PolarHBondContact O-N 3.43Å; V98-G100 PolarHBondContact O-N 3.05Å; G100-L104 WeakPolarHBondContact O-CB 3.42Å; G100-L104 PolarHBondContact O-N 3.48Å
101	A	98.8	Very high	98.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-35.5	175	0	0	0	0	0	112.5	V24 L28 A97 V98 L104 Y105 A190 L194	V24-A101 HydrophobicContact CG1-CB 3.96Å; L28-A101 HydrophobicContact CD2-CB 4.05Å; A97-A101 PolarHBondContact O-N 3.11Å; V98-A101 PolarHBondContact O-N 3.28Å; A101-L104 PolarHBondContact O-N 3.46Å; A101-Y105 WeakPolarHBondContact O-CB 3.24Å; A101-Y105 PolarHBondContact O-N 3.24Å; A101-A190 HydrophobicContact CB-CB 3.82Å; A101-L194 HydrophobicContact CB-CD2 3.78Å
102	A	98.8	Very high	98.2	Very high	45 Å²	45	43.8 Å²	43.8	37%	0.372	27%	0.274	S	S	.	.	H	α-helix	trans	-68.3	-42.8	177.1	0	0	0	0	0	112.1	V98 A99 L104 Y105 S106 L194	V98-A102 VanDerWaalsContact O-CB 3.27Å; V98-A102 WeakPolarHBondContact O-CB 3.42Å; V98-A102 PolarHBondContact O-N 2.94Å; A99-A102 PolarHBondContact O-N 2.83Å; A102-L104 VanDerWaalsContact C-N 3.35Å; A102-Y105 PolarHBondContact O-N 3.39Å; A102-S106 PolarHBondContact O-N 2.94Å; A102-L194 HydrophobicContact CB-CD2 4.22Å
103	V	98.8	Very high	98	Very high	67 Å²	67	45.7 Å²	45.7	41%	0.406	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-42.9	172.7	175	0	0	0	0	110.1	F25 A99 Y105 S106 V107	F25-V103 HydrophobicContact CD2-CB 4.32Å; F25-V103 HydrophobicContact CD2-CG1 4.03Å; F25-V103 HydrophobicContact CE2-CG1 3.85Å; A99-V103 VanDerWaalsContact O-CG2 3.31Å; A99-V103 WeakPolarHBondContact O-CG2 3.16Å; A99-V103 PolarHBondContact O-N 2.82Å; V103-Y105 VanDerWaalsContact C-N 3.34Å; V103-Y105 PolarHBondContact O-N 3.3Å; V103-S106 PolarHBondContact O-N 3.35Å; V103-S106 PolarHBondContact O-OG 3.48Å; V103-V107 WeakPolarHBondContact O-CG2 3.39Å; V103-V107 PolarHBondContact O-N 3.32Å
104	L	98.8	Very high	97.8	Very high	6 Å²	6	49 Å²	49	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-46	174.5	178	65.5	0	0	0	111.6	F25 L28 G29 L32 G100 A101 A102 S106 V107 T108	F25-L104 HydrophobicContact CD2-CB 3.8Å; F25-L104 HydrophobicContact CD2-CD1 4.42Å; F25-L104 HydrophobicContact CE2-CB 4.14Å; F25-L104 HydrophobicContact CE2-CD1 4.25Å; L28-L104 HydrophobicContact CB-CD2 3.39Å; G29-L104 VanDerWaalsContact N-CD2 3.33Å; L32-L104 HydrophobicContact CD1-CD1 4.44Å; L32-L104 HydrophobicContact CD1-CD2 4.47Å; G100-L104 WeakPolarHBondContact O-CB 3.42Å; G100-L104 PolarHBondContact O-N 3.48Å; A101-L104 PolarHBondContact O-N 3.46Å; A102-L104 VanDerWaalsContact C-N 3.35Å; L104-S106 VanDerWaalsContact C-N 3.31Å; L104-S106 PolarHBondContact O-N 3.35Å; L104-V107 PolarHBondContact O-N 3.42Å; L104-T108 WeakPolarHBondContact CD1-OG1 3.24Å; L104-T108 WeakPolarHBondContact O-CB 3.46Å; L104-T108 PolarHBondContact O-N 3.01Å; L104-T108 PolarHBondContact O-OG1 3.02Å
105	Y	98.4	Very high	97.6	Very high	111 Å²	111	50.6 Å²	50.6	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-58.9	-41.6	178.2	-178.3	-87.7	0	0	0	111.8	A101 A102 V103 R113 L116	A101-Y105 WeakPolarHBondContact O-CB 3.24Å; A101-Y105 PolarHBondContact O-N 3.24Å; A102-Y105 PolarHBondContact O-N 3.39Å; V103-Y105 VanDerWaalsContact C-N 3.34Å; V103-Y105 PolarHBondContact O-N 3.3Å; Y105-R113 HydrophobicContact CD2-CG 4.45Å; Y105-R113 VanDerWaalsContact CZ-NH1 3.29Å; Y105-R113 VanDerWaalsContact O-CZ 3.25Å; Y105-R113 PolarHBondContact O-NE 2.87Å; Y105-R113 PolarHBondContact O-NH2 2.85Å; Y105-R113 PolarHBondContact OH-NH1 2.99Å; Y105-L116 HydrophobicContact CD2-CD1 3.92Å; Y105-L116 HydrophobicContact CD2-CD2 4.13Å; Y105-L116 HydrophobicContact CD2-CG 4.27Å
106	S	98.4	Very high	97.5	Very high	82 Å²	82	45.3 Å²	45.3	57%	0.573	30%	0.295	S	S	*	.	H	α-helix	trans	-68.5	-36.4	-178.3	72.9	0	0	0	0	113	A102 V103 L104	A102-S106 PolarHBondContact O-N 2.94Å; V103-S106 PolarHBondContact O-N 3.35Å; V103-S106 PolarHBondContact O-OG 3.48Å; L104-S106 VanDerWaalsContact C-N 3.31Å; L104-S106 PolarHBondContact O-N 3.35Å
107	V	98.4	Very high	97.4	Very high	90 Å²	90	46 Å²	46	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-89.2	-16	-178.5	-55	0	0	0	0	113.8	F25 V103 L104	F25-V107 HydrophobicContact CE2-CG2 3.95Å; F25-V107 HydrophobicContact CZ-CG2 4.25Å; V103-V107 WeakPolarHBondContact O-CG2 3.39Å; V103-V107 PolarHBondContact O-N 3.32Å; L104-V107 PolarHBondContact O-N 3.42Å
108	T	98.1	Very high	97.4	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.025	30%	0.304	C	S	.	.	S	Bend	trans	-87.8	132.5	-178	-59.4	0	0	0	0	111.1	L32 W34 L104 V112 R113	L32-T108 HydrophobicContact CD1-CG2 3.52Å; W34-T108 HydrophobicContact CH2-CG2 4.48Å; L104-T108 WeakPolarHBondContact CD1-OG1 3.24Å; L104-T108 WeakPolarHBondContact O-CB 3.46Å; L104-T108 PolarHBondContact O-N 3.01Å; L104-T108 PolarHBondContact O-OG1 3.02Å; T108-V112 HydrophobicContact CG2-CB 4.09Å; T108-V112 HydrophobicContact CG2-CG1 4.29Å; T108-R113 HydrophobicContact CG2-CG 3.78Å; T108-R113 VanDerWaalsContact O-CZ 3.3Å; T108-R113 PolarHBondContact O-NE 3.4Å; T108-R113 PolarHBondContact O-NH2 3.42Å
109	P	97.5	Very high	97.4	Very high	64 Å²	64	45 Å²	45	42%	0.416	29%	0.294	S	S	.	.			trans	-58.3	139.1	173.7	-25.1	34.5	0	0	0	112.9	A111 V112 R113	P109-A111 PolarHBondContact O-N 2.88Å; P109-V112 PolarHBondContact O-N 3.31Å; P109-R113 PolarHBondContact O-N 3.24Å
110	P	96.4	Very high	97.3	Very high	97 Å²	97	47.4 Å²	47.4	63%	0.63	31%	0.305	S	S	*	.	H	α-helix	trans	-51.1	-37.8	-176.7	-29	34.6	0	0	0	115	V112 R113	P110-V112 PolarHBondContact O-N 3.39Å; P110-R113 PolarHBondContact O-N 3.26Å
111	A	94.7	Very high	97.3	Very high	101 Å²	101	48.7 Å²	48.7	84%	0.835	31%	0.312	S	S	*	.	H	α-helix	trans	-63	-24.2	180	0	0	0	0	0	114.1	P109	P109-A111 PolarHBondContact O-N 2.88Å
112	V	95.3	Very high	97.3	Very high	27 Å²	27	53.5 Å²	53.5	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-102.4	-20	-175.6	-178.3	0	0	0	0	112.2	L32 W34 T108 P109 P110 G114	L32-V112 HydrophobicContact CB-CG1 3.98Å; L32-V112 HydrophobicContact CD1-CG1 4.35Å; W34-V112 HydrophobicContact CD2-CG1 3.68Å; W34-V112 HydrophobicContact CE3-CG1 3.87Å; W34-V112 HydrophobicContact CE3-CG2 4.18Å; W34-V112 HydrophobicContact CG-CG1 4.08Å; W34-V112 HydrophobicContact CH2-CG1 4.38Å; W34-V112 HydrophobicContact CZ2-CG1 4.21Å; W34-V112 HydrophobicContact CZ3-CG1 4.21Å; W34-V112 HydrophobicContact CZ3-CG2 4.35Å; T108-V112 HydrophobicContact CG2-CB 4.09Å; T108-V112 HydrophobicContact CG2-CG1 4.29Å; P109-V112 PolarHBondContact O-N 3.31Å; P110-V112 PolarHBondContact O-N 3.39Å; V112-G114 PolarHBondContact O-N 2.94Å; V112-G114 VanDerWaalsContact O-N 3.15Å
113	R	94.8	Very high	97.2	Very high	46 Å²	46	57.7 Å²	57.7	17%	0.174	36%	0.358	C	S	.	.	H	α-helix	trans	-54.6	-38.7	-175.1	-69.9	176.8	-173.2	164.6	-0.6	113	Y105 T108 P109 P110 N115 L116	Y105-R113 HydrophobicContact CD2-CG 4.45Å; Y105-R113 VanDerWaalsContact CZ-NH1 3.29Å; Y105-R113 VanDerWaalsContact O-CZ 3.25Å; Y105-R113 PolarHBondContact O-NE 2.87Å; Y105-R113 PolarHBondContact O-NH2 2.85Å; Y105-R113 PolarHBondContact OH-NH1 2.99Å; T108-R113 HydrophobicContact CG2-CG 3.78Å; T108-R113 VanDerWaalsContact O-CZ 3.3Å; T108-R113 PolarHBondContact O-NE 3.4Å; T108-R113 PolarHBondContact O-NH2 3.42Å; P109-R113 PolarHBondContact O-N 3.24Å; P110-R113 PolarHBondContact O-N 3.26Å; R113-N115 PolarHBondContact O-N 3.49Å; R113-L116 HydrophobicContact CB-CD2 4.49Å; R113-L116 WeakPolarHBondContact O-CA 3.17Å; R113-L116 PolarHBondContact O-N 3.22Å
114	G	94.2	Very high	97.1	Very high	70 Å²	70	57.4 Å²	57.4	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	-130.6	-174.9	0	0	0	0	0	111.3	V112 L116	V112-G114 PolarHBondContact O-N 2.94Å; V112-G114 VanDerWaalsContact O-N 3.15Å; G114-L116 VanDerWaalsContact C-N 3.35Å
115	N	95.8	Very high	97.1	Very high	72 Å²	72	58.2 Å²	58.2	39%	0.385	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	23.8	173.3	66	2.6	0	0	0	113.1	R113 A117 L118	R113-N115 PolarHBondContact O-N 3.49Å; N115-A117 PolarHBondContact O-N 3.27Å; N115-A117 PolarHBondContact OD1-N 2.8Å; N115-A117 VanDerWaalsContact OD1-N 3.15Å; N115-L118 HydrophobicContact CB-CB 4.11Å; N115-L118 WeakPolarHBondContact O-CB 3.18Å; N115-L118 PolarHBondContact O-N 3.27Å; N115-L118 VanDerWaalsContact O-N 3.11Å; N115-L118 PolarHBondContact OD1-N 2.83Å
116	L	97.1	Very high	97.1	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	37	-173.7	-68	177.6	0	0	0	113.7	L28 Y105 R113 G114 L118 P191 L194 T195	L28-L116 VanDerWaalsContact CD2-O 3.22Å; L28-L116 WeakPolarHBondContact CD2-O 3.38Å; L28-L116 VanDerWaalsContact CG-O 3.29Å; L28-L116 WeakPolarHBondContact CG-O 3.13Å; Y105-L116 HydrophobicContact CD2-CD1 3.92Å; Y105-L116 HydrophobicContact CD2-CD2 4.13Å; Y105-L116 HydrophobicContact CD2-CG 4.27Å; R113-L116 HydrophobicContact CB-CD2 4.49Å; R113-L116 WeakPolarHBondContact O-CA 3.17Å; R113-L116 PolarHBondContact O-N 3.22Å; G114-L116 VanDerWaalsContact C-N 3.35Å; L116-L118 PolarHBondContact O-N 3.31Å; L116-P191 HydrophobicContact CB-CB 4.05Å; L116-P191 WeakPolarHBondContact O-CB 3.47Å; L116-L194 HydrophobicContact CD1-CB 4.04Å; L116-L194 HydrophobicContact CD1-CD2 3.83Å; L116-T195 HydrophobicContact CB-CG2 4.49Å; L116-T195 HydrophobicContact CD1-CG2 4.47Å
117	A	96.8	Very high	97.1	Very high	13 Å²	13	54.4 Å²	54.4	11%	0.107	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	41.4	-176.6	0	0	0	0	0	113	L28 S31 L32 N115 N119 R187	L28-A117 HydrophobicContact CB-CB 4.44Å; L28-A117 HydrophobicContact CG-CB 4.26Å; S31-A117 VanDerWaalsContact CB-CB 3.47Å; L32-A117 HydrophobicContact CD2-CB 4.35Å; N115-A117 PolarHBondContact O-N 3.27Å; N115-A117 PolarHBondContact OD1-N 2.8Å; N115-A117 VanDerWaalsContact OD1-N 3.15Å; A117-N119 PolarHBondContact O-N 2.92Å; A117-R187 PolarHBondContact O-NH1 3.15Å; A117-R187 PolarHBondContact O-NH2 2.8Å
118	L	98.2	Very high	97.1	Very high	15 Å²	15	53 Å²	53	8%	0.079	36%	0.358	C	S	.	.			trans	-50.8	132.7	168.4	-178.7	67.8	0	0	0	109.7	N115 L116 T120 P191 A192 N197	N115-L118 HydrophobicContact CB-CB 4.11Å; N115-L118 WeakPolarHBondContact O-CB 3.18Å; N115-L118 PolarHBondContact O-N 3.27Å; N115-L118 VanDerWaalsContact O-N 3.11Å; N115-L118 PolarHBondContact OD1-N 2.83Å; L116-L118 PolarHBondContact O-N 3.31Å; L118-T120 HydrophobicContact CD2-CG2 4.32Å; L118-T120 HydrophobicContact CG-CG2 4.32Å; L118-T120 PolarHBondContact O-N 2.89Å; L118-P191 HydrophobicContact CB-CB 4.24Å; L118-P191 HydrophobicContact CD1-CB 4.15Å; L118-P191 HydrophobicContact CD1-CG 4.12Å; L118-A192 HydrophobicContact CD1-CB 3.77Å; L118-N197 HydrophobicContact CD2-CB 3.9Å
119	N	98.4	Very high	97.1	Very high	5 Å²	5	58 Å²	58	3%	0.027	38%	0.382	C	S	.	.			trans	-65.5	125.9	171.9	-67.9	102.9	0	0	0	109.4	A117 G180 A181 G182 R187 S188 Y204	A117-N119 PolarHBondContact O-N 2.92Å; N119-G180 PolarHBondContact ND2-O 3.49Å; N119-A181 PolarHBondContact ND2-O 3.25Å; N119-G182 WeakPolarHBondContact ND2-CA 3.42Å; N119-G182 PolarHBondContact ND2-N 2.89Å; N119-R187 WeakPolarHBondContact OD1-CD 3.28Å; N119-R187 PolarHBondContact OD1-NH1 3.17Å; N119-S188 WeakPolarHBondContact OD1-CA 3.4Å; N119-S188 WeakPolarHBondContact OD1-CB 3.21Å; N119-S188 PolarHBondContact OD1-OG 3.27Å; N119-Y204 HydrophobicContact CB-CD1 3.9Å; N119-Y204 HydrophobicContact CB-CD2 4.11Å; N119-Y204 HydrophobicContact CB-CE1 3.41Å; N119-Y204 VanDerWaalsContact CB-CE1 3.41Å; N119-Y204 HydrophobicContact CB-CE2 3.68Å; N119-Y204 HydrophobicContact CB-CG 4.21Å; N119-Y204 WeakPolarHBondContact O-CE2 3.15Å; N119-Y204 PolarHBondContact O-OH 3.39Å
120	T	97.8	Very high	97.2	Very high	77 Å²	77	55 Å²	55	47%	0.472	36%	0.362	S	S	.	.			trans	-134.1	141.4	-178.7	54.2	0	0	0	0	110.3	L118 T179 Y204	L118-T120 HydrophobicContact CD2-CG2 4.32Å; L118-T120 HydrophobicContact CG-CG2 4.32Å; L118-T120 PolarHBondContact O-N 2.89Å; T120-T179 PolarHBondContact N-O 2.94Å; T120-T179 CarbonylContact O-C 3.2Å; T120-Y204 WeakPolarHBondContact CA-OH 3.25Å; T120-Y204 PolarHBondContact N-OH 3.32Å; T120-Y204 VanDerWaalsContact N-OH 3.08Å
121	L	98.3	Very high	97.3	Very high	27 Å²	27	51 Å²	51	14%	0.141	34%	0.336	C	S	.	.			trans	-70.9	143.9	175	-55.9	-170.1	0	0	0	111	V127 A130 T179 N200 V203 Y204	L121-V127 HydrophobicContact CD1-CG1 3.91Å; L121-A130 HydrophobicContact CD1-CB 3.81Å; L121-A130 HydrophobicContact CD2-CB 3.35Å; L121-A130 HydrophobicContact CG-CB 4.19Å; L121-T179 HydrophobicContact CD2-CG2 3.86Å; L121-N200 HydrophobicContact CD1-CB 3.91Å; L121-N200 HydrophobicContact CG-CB 4.14Å; L121-V203 HydrophobicContact CD2-CG1 4.45Å; L121-Y204 WeakPolarHBondContact CD2-OH 3.35Å; L121-Y204 PolarHBondContact N-OH 2.88Å
122	H	97.8	Very high	97.5	Very high	102 Å²	102	49.6 Å²	49.6	47%	0.472	32%	0.317	S	S	.	.			trans	-64.4	138.1	167.6	-177.1	-89.4	0	0	0	110	G124 V125 Y177 Y178	H122-G124 PolarHBondContact ND1-N 3.44Å; H122-G124 VanDerWaalsContact ND1-N 3.16Å; H122-G124 PolarHBondContact O-N 2.88Å; H122-G124 VanDerWaalsContact O-N 3.08Å; H122-V125 HydrophobicContact CB-CB 4.23Å; H122-V125 HydrophobicContact CB-CG2 3.82Å; H122-V125 PolarHBondContact O-N 3.41Å; H122-Y177 VanDerWaalsContact CB-O 3.27Å; H122-Y177 WeakPolarHBondContact CB-O 3.25Å; H122-Y178 PolarHBondContact N-O 3.3Å
123	P	96.8	Very high	97.7	Very high	132 Å²	132	49.1 Å²	49.1	86%	0.857	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-31.3	-174.6	-28.1	35.3	0	0	0	115
124	G	97.9	Very high	97.9	Very high	61 Å²	61	46.9 Å²	46.9	63%	0.629	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	1.6	177.6	0	0	0	0	0	115.3	H122	H122-G124 PolarHBondContact ND1-N 3.44Å; H122-G124 VanDerWaalsContact ND1-N 3.16Å; H122-G124 PolarHBondContact O-N 2.88Å; H122-G124 VanDerWaalsContact O-N 3.08Å
125	V	98.3	Very high	98.1	Very high	23 Å²	23	45 Å²	45	14%	0.139	28%	0.278	C	S	.	.	S	Bend	trans	-107.7	119.2	-177.8	177.7	0	0	0	0	108.9	H122 Q129 A130 Y178	H122-V125 HydrophobicContact CB-CB 4.23Å; H122-V125 HydrophobicContact CB-CG2 3.82Å; H122-V125 PolarHBondContact O-N 3.41Å; V125-Q129 HydrophobicContact CG1-CB 3.82Å; V125-A130 HydrophobicContact CG1-CB 3.97Å; V125-Y178 HydrophobicContact CG2-CD1 3.97Å
126	S	98.5	Very high	98.3	Very high	54 Å²	54	47.9 Å²	47.9	38%	0.378	29%	0.288	S	S	.	.			trans	-67.6	157.8	175.3	66.9	0	0	0	0	111.6	A128 Q129 A130	S126-A128 PolarHBondContact O-N 3.46Å; S126-Q129 PolarHBondContact O-N 2.96Å; S126-Q129 VanDerWaalsContact O-N 3.16Å; S126-Q129 WeakPolarHBondContact OG-CB 3.42Å; S126-Q129 VanDerWaalsContact OG-CD 3.3Å; S126-Q129 VanDerWaalsContact OG-CG 3.28Å; S126-Q129 WeakPolarHBondContact OG-CG 3.42Å; S126-Q129 PolarHBondContact OG-N 3.33Å; S126-Q129 PolarHBondContact OG-OE1 2.95Å; S126-A130 WeakPolarHBondContact O-CB 3.38Å; S126-A130 PolarHBondContact O-N 2.93Å
127	V	98.5	Very high	98.3	Very high	59 Å²	59	48 Å²	48	36%	0.358	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-33.1	177.1	-63.7	0	0	0	0	112.9	L121 T131 W202 V203	L121-V127 HydrophobicContact CD1-CG1 3.91Å; V127-T131 WeakPolarHBondContact O-CB 3.43Å; V127-T131 PolarHBondContact O-N 3.39Å; V127-T131 PolarHBondContact O-OG1 3.47Å; V127-W202 HydrophobicContact CB-CZ2 3.9Å; V127-W202 HydrophobicContact CG2-CZ2 4.1Å; V127-V203 HydrophobicContact CB-CG2 4.44Å
128	A	98.5	Very high	98.4	Very high	61 Å²	61	47.4 Å²	47.4	50%	0.504	28%	0.284	S	S	.	.	H	α-helix	trans	-68.7	-47.6	176.5	0	0	0	0	0	111.3	S126 A130 T131 T132	S126-A128 PolarHBondContact O-N 3.46Å; A128-A130 VanDerWaalsContact C-N 3.34Å; A128-A130 PolarHBondContact O-N 2.84Å; A128-T131 PolarHBondContact O-N 3.1Å; A128-T132 PolarHBondContact O-N 2.83Å; A128-T132 PolarHBondContact O-OG1 3.14Å; A128-T132 VanDerWaalsContact O-OG1 3.09Å
129	Q	98.7	Very high	98.5	Very high	109 Å²	109	48.2 Å²	48.2	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-44	175.2	-72.4	164.5	-46.3	0	0	111.4	V125 S126 T131 T132 V133	V125-Q129 HydrophobicContact CG1-CB 3.82Å; S126-Q129 PolarHBondContact O-N 2.96Å; S126-Q129 VanDerWaalsContact O-N 3.16Å; S126-Q129 WeakPolarHBondContact OG-CB 3.42Å; S126-Q129 VanDerWaalsContact OG-CD 3.3Å; S126-Q129 VanDerWaalsContact OG-CG 3.28Å; S126-Q129 WeakPolarHBondContact OG-CG 3.42Å; S126-Q129 PolarHBondContact OG-N 3.33Å; S126-Q129 PolarHBondContact OG-OE1 2.95Å; Q129-T131 PolarHBondContact O-N 3.33Å; Q129-T132 PolarHBondContact O-N 3.2Å; Q129-V133 WeakPolarHBondContact O-CG2 3.15Å; Q129-V133 PolarHBondContact O-N 3.22Å
130	A	98.8	Very high	98.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-44.1	176.6	0	0	0	0	0	112.5	L121 V125 S126 A128 V133 E134 T179 V203	L121-A130 HydrophobicContact CD1-CB 3.81Å; L121-A130 HydrophobicContact CD2-CB 3.35Å; L121-A130 HydrophobicContact CG-CB 4.19Å; V125-A130 HydrophobicContact CG1-CB 3.97Å; S126-A130 WeakPolarHBondContact O-CB 3.38Å; S126-A130 PolarHBondContact O-N 2.93Å; A128-A130 VanDerWaalsContact C-N 3.34Å; A128-A130 PolarHBondContact O-N 2.84Å; A130-V133 PolarHBondContact O-N 3.41Å; A130-E134 PolarHBondContact O-N 3.12Å; A130-T179 HydrophobicContact CB-CG2 3.69Å; A130-V203 HydrophobicContact CB-CG1 4.03Å
131	T	98.8	Very high	98.5	Very high	14 Å²	14	46.9 Å²	46.9	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-44.2	176.7	-55.4	0	0	0	0	110.7	V127 A128 Q129 V133 E134 I135 W202 V206	V127-T131 WeakPolarHBondContact O-CB 3.43Å; V127-T131 PolarHBondContact O-N 3.39Å; V127-T131 PolarHBondContact O-OG1 3.47Å; A128-T131 PolarHBondContact O-N 3.1Å; Q129-T131 PolarHBondContact O-N 3.33Å; T131-V133 VanDerWaalsContact C-N 3.33Å; T131-V133 PolarHBondContact O-N 3.45Å; T131-E134 PolarHBondContact O-N 3Å; T131-I135 HydrophobicContact CG2-CD1 4.24Å; T131-I135 VanDerWaalsContact O-CG1 3.27Å; T131-I135 WeakPolarHBondContact O-CG1 3.39Å; T131-I135 PolarHBondContact O-N 2.83Å; T131-W202 HydrophobicContact CG2-CZ3 4.34Å; T131-W202 WeakPolarHBondContact OG1-CH2 3.44Å; T131-V206 HydrophobicContact CG2-CG1 4.08Å
132	T	98.8	Very high	98.6	Very high	72 Å²	72	45.6 Å²	45.6	44%	0.442	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-43.8	174.3	-59.7	0	0	0	0	111.6	A128 Q129 I135 F136	A128-T132 PolarHBondContact O-N 2.83Å; A128-T132 PolarHBondContact O-OG1 3.14Å; A128-T132 VanDerWaalsContact O-OG1 3.09Å; Q129-T132 PolarHBondContact O-N 3.2Å; T132-I135 WeakPolarHBondContact O-CB 3.44Å; T132-I135 PolarHBondContact O-N 3.47Å; T132-F136 HydrophobicContact CG2-CD2 3.95Å; T132-F136 HydrophobicContact CG2-CE2 3.95Å; T132-F136 WeakPolarHBondContact O-CD2 3.27Å; T132-F136 PolarHBondContact O-N 3.4Å; T132-F136 VanDerWaalsContact O-N 3.08Å
133	V	98.9	Very high	98.6	Very high	16 Å²	16	42.9 Å²	42.9	10%	0.097	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-52.5	175.2	168	0	0	0	0	110.5	Q129 A130 T131 I135 F136 L137 F174 Y178 T179	Q129-V133 WeakPolarHBondContact O-CG2 3.15Å; Q129-V133 PolarHBondContact O-N 3.22Å; A130-V133 PolarHBondContact O-N 3.41Å; T131-V133 VanDerWaalsContact C-N 3.33Å; T131-V133 PolarHBondContact O-N 3.45Å; V133-I135 VanDerWaalsContact C-N 3.26Å; V133-I135 PolarHBondContact O-N 3Å; V133-F136 PolarHBondContact O-N 3.31Å; V133-F136 VanDerWaalsContact O-N 3.08Å; V133-L137 HydrophobicContact CG1-CD1 3.79Å; V133-L137 HydrophobicContact CG1-CG 4.02Å; V133-L137 VanDerWaalsContact O-CG 3.24Å; V133-L137 WeakPolarHBondContact O-CG 3.47Å; V133-L137 PolarHBondContact O-N 3.45Å; V133-F174 HydrophobicContact CG1-CD1 4.45Å; V133-F174 HydrophobicContact CG1-CE1 4.02Å; V133-F174 HydrophobicContact CG2-CE1 4.4Å; V133-Y178 HydrophobicContact CG1-CG 4.27Å; V133-Y178 HydrophobicContact CG2-CD1 3.89Å; V133-Y178 HydrophobicContact CG2-CE1 4.42Å; V133-Y178 HydrophobicContact CG2-CG 4.04Å; V133-T179 HydrophobicContact CB-CG2 4.41Å; V133-T179 HydrophobicContact CG1-CG2 4.27Å
134	E	98.9	Very high	98.7	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-33.8	178.6	-74.3	-64.8	151	0	0	113.5	A130 T131 T138 T179 G182 M183 V203 Y204 P208	A130-E134 PolarHBondContact O-N 3.12Å; T131-E134 PolarHBondContact O-N 3Å; E134-T138 WeakPolarHBondContact O-CB 3.46Å; E134-T138 PolarHBondContact O-N 3.3Å; E134-T138 PolarHBondContact O-OG1 3.33Å; E134-T179 HydrophobicContact CG-CG2 4.2Å; E134-T179 WeakPolarHBondContact OE1-CB 3.38Å; E134-T179 PolarHBondContact OE1-OG1 3.23Å; E134-G182 PolarHBondContact OE1-N 3.21Å; E134-M183 PolarHBondContact OE2-N 3.07Å; E134-V203 HydrophobicContact CG-CG1 4.16Å; E134-Y204 HydrophobicContact CG-CD1 4.34Å; E134-P208 HydrophobicContact CB-CG 4.43Å
135	I	98.9	Very high	98.7	Very high	29 Å²	29	35.3 Å²	35.3	15%	0.149	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-54.5	171.6	-70.8	167.9	0	0	0	110	T131 T132 V133 L137 T138 L139 G207 I210 G211 L214	T131-I135 HydrophobicContact CG2-CD1 4.24Å; T131-I135 VanDerWaalsContact O-CG1 3.27Å; T131-I135 WeakPolarHBondContact O-CG1 3.39Å; T131-I135 PolarHBondContact O-N 2.83Å; T132-I135 WeakPolarHBondContact O-CB 3.44Å; T132-I135 PolarHBondContact O-N 3.47Å; V133-I135 VanDerWaalsContact C-N 3.26Å; V133-I135 PolarHBondContact O-N 3Å; I135-L137 PolarHBondContact O-N 3.35Å; I135-T138 PolarHBondContact O-N 2.83Å; I135-L139 WeakPolarHBondContact O-CB 3.42Å; I135-L139 PolarHBondContact O-N 3.05Å; I135-G207 WeakPolarHBondContact CA-O 3.4Å; I135-G207 WeakPolarHBondContact CG1-O 3.35Å; I135-I210 HydrophobicContact CD1-CB 4.27Å; I135-I210 HydrophobicContact CD1-CD1 4.5Å; I135-I210 HydrophobicContact CD1-CG2 3.86Å; I135-I210 HydrophobicContact CG1-CB 4.08Å; I135-I210 HydrophobicContact CG1-CG2 3.97Å; I135-I210 HydrophobicContact CG2-CG2 4.36Å; I135-G211 WeakPolarHBondContact O-CA 3.44Å; I135-L214 HydrophobicContact CG2-CD1 4.09Å
136	F	98.9	Very high	98.7	Very high	133 Å²	133	34.4 Å²	34.4	58%	0.583	19%	0.192	S	C	*	.	H	α-helix	trans	-66.6	-39.2	-176.5	-86.2	-85.8	0	0	0	112.8	T132 V133 T138 L139 Q140	T132-F136 HydrophobicContact CG2-CD2 3.95Å; T132-F136 HydrophobicContact CG2-CE2 3.95Å; T132-F136 WeakPolarHBondContact O-CD2 3.27Å; T132-F136 PolarHBondContact O-N 3.4Å; T132-F136 VanDerWaalsContact O-N 3.08Å; V133-F136 PolarHBondContact O-N 3.31Å; V133-F136 VanDerWaalsContact O-N 3.08Å; F136-T138 VanDerWaalsContact C-N 3.32Å; F136-T138 PolarHBondContact O-N 3.1Å; F136-L139 PolarHBondContact O-N 2.94Å; F136-Q140 WeakPolarHBondContact O-CG 3.47Å; F136-Q140 PolarHBondContact O-N 2.97Å; F136-Q140 VanDerWaalsContact O-N 3.1Å
137	L	98.9	Very high	98.6	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-47.5	174.4	-68.7	-179.2	0	0	0	111.2	V133 I135 Q140 F141 G171 F174 A181 M183	V133-L137 HydrophobicContact CG1-CD1 3.79Å; V133-L137 HydrophobicContact CG1-CG 4.02Å; V133-L137 VanDerWaalsContact O-CG 3.24Å; V133-L137 WeakPolarHBondContact O-CG 3.47Å; V133-L137 PolarHBondContact O-N 3.45Å; I135-L137 PolarHBondContact O-N 3.35Å; L137-Q140 WeakPolarHBondContact O-CG 3.41Å; L137-Q140 PolarHBondContact O-NE2 3.12Å; L137-Q140 VanDerWaalsContact O-NE2 3.11Å; L137-F141 WeakPolarHBondContact O-CB 3.44Å; L137-F141 PolarHBondContact O-N 2.87Å; L137-G171 VanDerWaalsContact CD2-O 3.24Å; L137-G171 WeakPolarHBondContact CD2-O 3.48Å; L137-F174 HydrophobicContact CD2-CD1 3.81Å; L137-A181 HydrophobicContact CD1-CB 4.44Å; L137-M183 HydrophobicContact CB-CE 4.32Å; L137-M183 HydrophobicContact CB-CG 3.68Å; L137-M183 HydrophobicContact CB-SD 4.02Å; L137-M183 HydrophobicContact CD1-CG 4.06Å; L137-M183 HydrophobicContact CD1-SD 4.39Å; L137-M183 HydrophobicContact CG-CG 4.47Å; L137-M183 WeakPolarHBondContact O-CE 3.49Å
138	T	98.9	Very high	98.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-77.9	-31.3	-177	-47	0	0	0	0	112	A70 E134 I135 F136 F141 V142 P208	A70-T138 HydrophobicContact CB-CG2 4.04Å; E134-T138 WeakPolarHBondContact O-CB 3.46Å; E134-T138 PolarHBondContact O-N 3.3Å; E134-T138 PolarHBondContact O-OG1 3.33Å; I135-T138 PolarHBondContact O-N 2.83Å; F136-T138 VanDerWaalsContact C-N 3.32Å; F136-T138 PolarHBondContact O-N 3.1Å; T138-F141 PolarHBondContact O-N 3.31Å; T138-V142 HydrophobicContact CG2-CG2 4.15Å; T138-V142 WeakPolarHBondContact O-CB 3.32Å; T138-V142 WeakPolarHBondContact O-CG2 3.43Å; T138-V142 PolarHBondContact O-N 3.4Å; T138-P208 HydrophobicContact CG2-CB 4.02Å; T138-P208 VanDerWaalsContact CG2-O 3.3Å; T138-P208 WeakPolarHBondContact CG2-O 3.33Å; T138-P208 WeakPolarHBondContact OG1-CA 3.39Å; T138-P208 WeakPolarHBondContact OG1-CB 3.22Å
139	L	98.8	Very high	98.3	Very high	32 Å²	32	30.6 Å²	30.6	17%	0.168	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-54.1	175.2	-176.4	163	0	0	0	111.2	I135 F136 F141 V142 L143 G211 L214 L218	I135-L139 WeakPolarHBondContact O-CB 3.42Å; I135-L139 PolarHBondContact O-N 3.05Å; F136-L139 PolarHBondContact O-N 2.94Å; L139-F141 PolarHBondContact O-N 2.64Å; L139-V142 PolarHBondContact O-N 3.04Å; L139-L143 WeakPolarHBondContact O-CB 3.16Å; L139-L143 PolarHBondContact O-N 3Å; L139-G211 WeakPolarHBondContact CA-O 3.49Å; L139-L214 HydrophobicContact CD1-CB 4.05Å; L139-L218 HydrophobicContact CD2-CD2 4.23Å
140	Q	98.8	Very high	98.1	Very high	50 Å²	50	25.6 Å²	25.6	23%	0.234	13%	0.133	C	C	.	.	H	α-helix	trans	-62.7	-29.4	178.7	64.3	86.9	80.7	0	0	112	F136 L137 C144 S167	F136-Q140 WeakPolarHBondContact O-CG 3.47Å; F136-Q140 PolarHBondContact O-N 2.97Å; F136-Q140 VanDerWaalsContact O-N 3.1Å; L137-Q140 WeakPolarHBondContact O-CG 3.41Å; L137-Q140 PolarHBondContact O-NE2 3.12Å; L137-Q140 VanDerWaalsContact O-NE2 3.11Å; Q140-C144 WeakPolarHBondContact O-CB 3.44Å; Q140-C144 PolarHBondContact O-N 2.87Å; Q140-S167 PolarHBondContact NE2-O 2.98Å; Q140-S167 PolarHBondContact NE2-OG 2.92Å; Q140-S167 VanDerWaalsContact NE2-OG 3.1Å
141	F	98.8	Very high	97.7	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-73.4	-50.6	-177.9	175.5	-126.8	0	0	0	110.9	L52 V71 L137 T138 L139 L143 C144 I145 V164 S167 L168 M183	L52-F141 HydrophobicContact CD2-CE2 3.49Å; L52-F141 VanDerWaalsContact CD2-CE2 3.49Å; L52-F141 HydrophobicContact CD2-CZ 3.42Å; L52-F141 VanDerWaalsContact CD2-CZ 3.42Å; V71-F141 HydrophobicContact CG2-CD1 4.15Å; V71-F141 HydrophobicContact CG2-CE1 3.52Å; V71-F141 HydrophobicContact CG2-CZ 4.32Å; L137-F141 WeakPolarHBondContact O-CB 3.44Å; L137-F141 PolarHBondContact O-N 2.87Å; T138-F141 PolarHBondContact O-N 3.31Å; L139-F141 PolarHBondContact O-N 2.64Å; F141-L143 VanDerWaalsContact C-N 3.33Å; F141-L143 PolarHBondContact O-N 3.49Å; F141-C144 WeakPolarHBondContact O-CB 3.43Å; F141-C144 PolarHBondContact O-N 2.93Å; F141-I145 HydrophobicContact CD1-CD1 4.11Å; F141-I145 HydrophobicContact CD2-CD1 4.15Å; F141-I145 HydrophobicContact CE1-CD1 3.7Å; F141-I145 HydrophobicContact CE2-CD1 3.75Å; F141-I145 HydrophobicContact CE2-CG1 4.27Å; F141-I145 HydrophobicContact CG-CD1 4.31Å; F141-I145 HydrophobicContact CZ-CD1 3.51Å; F141-I145 HydrophobicContact CZ-CG1 4.47Å; F141-I145 WeakPolarHBondContact O-CG1 3.45Å; F141-I145 PolarHBondContact O-N 3.29Å; F141-V164 HydrophobicContact CE2-CG1 3.88Å; F141-V164 HydrophobicContact CZ-CG1 4.41Å; F141-S167 WeakPolarHBondContact CA-OG 3.48Å; F141-L168 HydrophobicContact CD2-CB 4.35Å; F141-L168 HydrophobicContact CE2-CB 4Å; F141-M183 HydrophobicContact CB-CE 3.74Å; F141-M183 HydrophobicContact CD1-CE 4.35Å; F141-M183 HydrophobicContact CD2-CE 4.49Å; F141-M183 HydrophobicContact CG-CE 3.97Å
142	V	98.8	Very high	97.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-37.5	176	169.7	0	0	0	0	111.3	V71 A74 T138 L139 C144 I145 F146 G212	V71-V142 HydrophobicContact CG2-CG2 4.22Å; A74-V142 HydrophobicContact CB-CG1 3.52Å; A74-V142 HydrophobicContact CB-CG2 4.18Å; T138-V142 HydrophobicContact CG2-CG2 4.15Å; T138-V142 WeakPolarHBondContact O-CB 3.32Å; T138-V142 WeakPolarHBondContact O-CG2 3.43Å; T138-V142 PolarHBondContact O-N 3.4Å; L139-V142 PolarHBondContact O-N 3.04Å; V142-C144 VanDerWaalsContact C-N 3.31Å; V142-C144 PolarHBondContact O-N 2.97Å; V142-I145 PolarHBondContact O-N 3.35Å; V142-F146 HydrophobicContact CG1-CD2 3.64Å; V142-F146 HydrophobicContact CG1-CE2 3.7Å; V142-F146 WeakPolarHBondContact O-CB 3.34Å; V142-F146 WeakPolarHBondContact O-CD2 3.37Å; V142-F146 PolarHBondContact O-N 3.46Å; V142-G212 WeakPolarHBondContact CG1-O 3.28Å
143	L	98.6	Very high	96.6	Very high	44 Å²	44	40.1 Å²	40.1	23%	0.23	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.7	179.4	62.1	0	0	0	111.4	L139 F141 A147 L218 Y219 L223	L139-L143 WeakPolarHBondContact O-CB 3.16Å; L139-L143 PolarHBondContact O-N 3Å; F141-L143 VanDerWaalsContact C-N 3.33Å; F141-L143 PolarHBondContact O-N 3.49Å; L143-A147 WeakPolarHBondContact O-CB 3.43Å; L143-A147 PolarHBondContact O-N 2.79Å; L143-L218 HydrophobicContact CD2-CD2 4.26Å; L143-Y219 HydrophobicContact CD1-CD2 3.76Å; L143-Y219 HydrophobicContact CD1-CG 4.33Å; L143-L223 HydrophobicContact CD1-CD1 3.65Å; L143-L223 HydrophobicContact CD2-CD1 4.31Å
144	C	98.6	Very high	95	Very high	30 Å²	30	46.8 Å²	46.8	20%	0.203	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-45.9	174.5	-178.7	0	0	0	0	111.7	Q140 F141 V142 A147 T148 S167	Q140-C144 WeakPolarHBondContact O-CB 3.44Å; Q140-C144 PolarHBondContact O-N 2.87Å; F141-C144 WeakPolarHBondContact O-CB 3.43Å; F141-C144 PolarHBondContact O-N 2.93Å; V142-C144 VanDerWaalsContact C-N 3.31Å; V142-C144 PolarHBondContact O-N 2.97Å; C144-A147 PolarHBondContact O-N 3.41Å; C144-T148 WeakPolarHBondContact O-CB 3.49Å; C144-T148 VanDerWaalsContact O-CG2 3.27Å; C144-T148 WeakPolarHBondContact O-CG2 3.43Å; C144-T148 PolarHBondContact O-N 2.85Å; C144-T148 PolarHBondContact O-OG1 3.4Å; C144-S167 WeakPolarHBondContact CB-OG 3.47Å
145	I	98.3	Very high	93.6	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-58.6	-53.9	176.8	-68.9	164	0	0	0	110.5	V71 F75 F141 V142 A147 T148 Y149 V164	V71-I145 HydrophobicContact CG1-CD1 3.95Å; V71-I145 HydrophobicContact CG2-CD1 3.69Å; F75-I145 HydrophobicContact CE2-CG2 3.7Å; F75-I145 HydrophobicContact CZ-CG2 3.71Å; F141-I145 HydrophobicContact CD1-CD1 4.11Å; F141-I145 HydrophobicContact CD2-CD1 4.15Å; F141-I145 HydrophobicContact CE1-CD1 3.7Å; F141-I145 HydrophobicContact CE2-CD1 3.75Å; F141-I145 HydrophobicContact CE2-CG1 4.27Å; F141-I145 HydrophobicContact CG-CD1 4.31Å; F141-I145 HydrophobicContact CZ-CD1 3.51Å; F141-I145 HydrophobicContact CZ-CG1 4.47Å; F141-I145 WeakPolarHBondContact O-CG1 3.45Å; F141-I145 PolarHBondContact O-N 3.29Å; V142-I145 PolarHBondContact O-N 3.35Å; I145-A147 VanDerWaalsContact C-N 3.32Å; I145-A147 PolarHBondContact O-N 3.26Å; I145-T148 PolarHBondContact O-N 3.43Å; I145-T148 VanDerWaalsContact O-N 3.14Å; I145-T148 PolarHBondContact O-OG1 2.7Å; I145-T148 VanDerWaalsContact O-OG1 3.1Å; I145-Y149 HydrophobicContact CG2-CD1 4.02Å; I145-Y149 HydrophobicContact CG2-CD2 4.22Å; I145-Y149 HydrophobicContact CG2-CE1 4.16Å; I145-Y149 HydrophobicContact CG2-CE2 4.33Å; I145-Y149 HydrophobicContact CG2-CG 4.07Å; I145-Y149 VanDerWaalsContact O-CB 3.25Å; I145-Y149 WeakPolarHBondContact O-CB 3.39Å; I145-Y149 VanDerWaalsContact O-CD1 3.28Å; I145-Y149 WeakPolarHBondContact O-CD1 3.4Å; I145-Y149 PolarHBondContact O-N 3.12Å; I145-V164 HydrophobicContact CD1-CG1 4.33Å; I145-V164 HydrophobicContact CG1-CB 4.5Å; I145-V164 HydrophobicContact CG1-CG1 3.84Å; I145-V164 HydrophobicContact CG1-CG2 3.86Å
146	F	97.7	Very high	92.3	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-44.4	-179.2	-88.3	-120.3	0	0	0	111.5	A74 F75 V142 T148 D150 S216 Y219 D220	A74-F146 HydrophobicContact CB-CE2 3.89Å; A74-F146 HydrophobicContact CB-CZ 4.21Å; A74-F146 WeakPolarHBondContact O-CZ 3.27Å; F75-F146 HydrophobicContact CD1-CE2 4.47Å; F75-F146 HydrophobicContact CD1-CZ 4.43Å; F75-F146 HydrophobicContact CD2-CE2 4.18Å; F75-F146 HydrophobicContact CE1-CE2 4.45Å; F75-F146 HydrophobicContact CE2-CE2 4.17Å; F75-F146 HydrophobicContact CG-CE2 4.33Å; F75-F146 HydrophobicContact CG-CZ 4.42Å; F75-F146 HydrophobicContact CZ-CE2 4.3Å; V142-F146 HydrophobicContact CG1-CD2 3.64Å; V142-F146 HydrophobicContact CG1-CE2 3.7Å; V142-F146 WeakPolarHBondContact O-CB 3.34Å; V142-F146 WeakPolarHBondContact O-CD2 3.37Å; V142-F146 PolarHBondContact O-N 3.46Å; F146-T148 VanDerWaalsContact C-N 3.28Å; F146-T148 PolarHBondContact O-N 3.19Å; F146-D150 WeakPolarHBondContact O-CB 3.28Å; F146-D150 PolarHBondContact O-N 2.7Å; F146-D150 VanDerWaalsContact O-N 3.12Å; F146-S216 WeakPolarHBondContact CE1-OG 3.16Å; F146-S216 WeakPolarHBondContact CZ-OG 3.31Å; F146-Y219 HydrophobicContact CB-CD1 3.75Å; F146-Y219 HydrophobicContact CB-CD2 4.41Å; F146-Y219 HydrophobicContact CB-CE1 4.29Å; F146-Y219 HydrophobicContact CB-CG 3.8Å; F146-Y219 HydrophobicContact CD1-CD1 4.01Å; F146-Y219 HydrophobicContact CD1-CG 4.44Å; F146-Y219 HydrophobicContact CG-CD1 4.4Å; F146-D220 WeakPolarHBondContact CE1-OD2 3.37Å
147	A	96.5	Very high	91.4	Very high	18 Å²	18	54.6 Å²	54.6	15%	0.149	28%	0.277	C	S	.	.	H	α-helix	trans	-70.2	-20.3	-179.5	0	0	0	0	0	114.9	L143 C144 I145 R153 Y219	L143-A147 WeakPolarHBondContact O-CB 3.43Å; L143-A147 PolarHBondContact O-N 2.79Å; C144-A147 PolarHBondContact O-N 3.41Å; I145-A147 VanDerWaalsContact C-N 3.32Å; I145-A147 PolarHBondContact O-N 3.26Å; A147-R153 WeakPolarHBondContact O-CD 3.31Å; A147-R153 PolarHBondContact O-NH1 2.81Å; A147-Y219 HydrophobicContact CB-CD2 4.17Å; A147-Y219 HydrophobicContact CB-CE2 3.56Å
148	T	96.1	Very high	91	Very high	14 Å²	14	57.7 Å²	57.7	9%	0.086	31%	0.31	C	S	.	.	H	α-helix	trans	-100.4	-24.3	179.4	54.5	0	0	0	0	112.7	C144 I145 F146 L157 V160 A163	C144-T148 WeakPolarHBondContact O-CB 3.49Å; C144-T148 VanDerWaalsContact O-CG2 3.27Å; C144-T148 WeakPolarHBondContact O-CG2 3.43Å; C144-T148 PolarHBondContact O-N 2.85Å; C144-T148 PolarHBondContact O-OG1 3.4Å; I145-T148 PolarHBondContact O-N 3.43Å; I145-T148 VanDerWaalsContact O-N 3.14Å; I145-T148 PolarHBondContact O-OG1 2.7Å; I145-T148 VanDerWaalsContact O-OG1 3.1Å; F146-T148 VanDerWaalsContact C-N 3.28Å; F146-T148 PolarHBondContact O-N 3.19Å; T148-L157 HydrophobicContact CG2-CD2 4.4Å; T148-V160 WeakPolarHBondContact O-CG2 3.29Å; T148-A163 HydrophobicContact CG2-CB 4.07Å
149	Y	95.6	Very high	90.8	Very high	61 Å²	61	59.7 Å²	59.7	24%	0.239	33%	0.325	C	S	.	.	H	α-helix	trans	-88.3	-11.4	176.6	-78.3	40.4	0	0	0	112	V56 G64 F75 I145 E151 V160 V164	V56-Y149 WeakPolarHBondContact CG1-OH 3.49Å; G64-Y149 VanDerWaalsContact O-CE2 3.3Å; G64-Y149 WeakPolarHBondContact O-CE2 3.49Å; G64-Y149 PolarHBondContact O-OH 2.73Å; G64-Y149 VanDerWaalsContact O-OH 3.07Å; F75-Y149 HydrophobicContact CE1-CD2 4.4Å; F75-Y149 AromaticContact CZ-CD2 3.75Å; F75-Y149 HydrophobicContact CZ-CD2 3.75Å; F75-Y149 HydrophobicContact CZ-CE2 4.3Å; F75-Y149 HydrophobicContact CZ-CG 4.39Å; I145-Y149 HydrophobicContact CG2-CD1 4.02Å; I145-Y149 HydrophobicContact CG2-CD2 4.22Å; I145-Y149 HydrophobicContact CG2-CE1 4.16Å; I145-Y149 HydrophobicContact CG2-CE2 4.33Å; I145-Y149 HydrophobicContact CG2-CG 4.07Å; I145-Y149 VanDerWaalsContact O-CB 3.25Å; I145-Y149 WeakPolarHBondContact O-CB 3.39Å; I145-Y149 VanDerWaalsContact O-CD1 3.28Å; I145-Y149 WeakPolarHBondContact O-CD1 3.4Å; I145-Y149 PolarHBondContact O-N 3.12Å; Y149-E151 PolarHBondContact O-N 3.02Å; Y149-E151 VanDerWaalsContact O-N 3.13Å; Y149-V160 HydrophobicContact CD1-CG1 3.66Å; Y149-V160 HydrophobicContact CE1-CG1 3.47Å; Y149-V160 VanDerWaalsContact CE1-CG1 3.47Å; Y149-V164 HydrophobicContact CE1-CG2 3.99Å
150	D	94.3	Very high	90.6	Very high	5 Å²	5	60 Å²	60	3%	0.027	33%	0.328	C	S	.	.			trans	-74.3	104.7	179.2	-161.6	-8.9	0	0	0	112.3	F146 R152 R153 Y219 F224 R226	F146-D150 WeakPolarHBondContact O-CB 3.28Å; F146-D150 PolarHBondContact O-N 2.7Å; F146-D150 VanDerWaalsContact O-N 3.12Å; D150-R152 PolarHBondContact O-N 3.44Å; D150-R152 VanDerWaalsContact O-N 3.12Å; D150-R152 VanDerWaalsContact OD1-CB 3.26Å; D150-R152 WeakPolarHBondContact OD1-CB 3.47Å; D150-R152 VanDerWaalsContact OD1-CG 3.27Å; D150-R152 WeakPolarHBondContact OD1-CG 3.46Å; D150-R152 IonicContact OD1-CZ 3.38Å; D150-R152 PolarHBondContact OD1-N 2.81Å; D150-R152 VanDerWaalsContact OD1-N 3.09Å; D150-R152 IonicContact OD1-NE 3.91Å; D150-R152 PolarHBondContact OD1-NE 2.79Å; D150-R152 IonicContact OD2-CZ 3.93Å; D150-R152 IonicContact OD2-NE 3.15Å; D150-R152 PolarHBondContact OD2-NE 3.03Å; D150-R152 IonicContact OD2-NH2 2.88Å; D150-R152 PolarHBondContact OD2-NH2 3.43Å; D150-R153 VanDerWaalsContact O-CB 3.27Å; D150-R153 WeakPolarHBondContact O-CB 3Å; D150-R153 PolarHBondContact O-N 2.86Å; D150-Y219 HydrophobicContact CB-CE1 4.08Å; D150-Y219 WeakPolarHBondContact CB-OH 3.41Å; D150-Y219 WeakPolarHBondContact OD2-CE1 3.42Å; D150-Y219 PolarHBondContact OD2-OH 3.48Å; D150-F224 VanDerWaalsContact OD2-CD1 3.31Å; D150-F224 WeakPolarHBondContact OD2-CD1 3.45Å; D150-R226 VanDerWaalsContact CG-NH2 3.27Å; D150-R226 IonicContact OD1-CZ 3.94Å; D150-R226 IonicContact OD1-NH2 3.87Å; D150-R226 PolarHBondContact OD1-NH2 3.47Å; D150-R226 IonicContact OD2-NH2 3.6Å; D150-R226 PolarHBondContact OD2-NH2 3.09Å
151	E	90.1	Very high	90.6	Very high	188 Å²	188	57.7 Å²	57.7	88%	0.879	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22	176.1	-60	176.6	168.6	0	0	113.6	Y149 R153	Y149-E151 PolarHBondContact O-N 3.02Å; Y149-E151 VanDerWaalsContact O-N 3.13Å; E151-R153 PolarHBondContact O-N 3.49Å
152	R	89.9	Confident	90.6	Very high	79 Å²	79	61.2 Å²	61.2	30%	0.298	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.8	177.1	-61.1	178.5	-64.7	165.7	0.8	112.6	D150 N154 F224 P225	D150-R152 PolarHBondContact O-N 3.44Å; D150-R152 VanDerWaalsContact O-N 3.12Å; D150-R152 VanDerWaalsContact OD1-CB 3.26Å; D150-R152 WeakPolarHBondContact OD1-CB 3.47Å; D150-R152 VanDerWaalsContact OD1-CG 3.27Å; D150-R152 WeakPolarHBondContact OD1-CG 3.46Å; D150-R152 IonicContact OD1-CZ 3.38Å; D150-R152 PolarHBondContact OD1-N 2.81Å; D150-R152 VanDerWaalsContact OD1-N 3.09Å; D150-R152 IonicContact OD1-NE 3.91Å; D150-R152 PolarHBondContact OD1-NE 2.79Å; D150-R152 IonicContact OD2-CZ 3.93Å; D150-R152 IonicContact OD2-NE 3.15Å; D150-R152 PolarHBondContact OD2-NE 3.03Å; D150-R152 IonicContact OD2-NH2 2.88Å; D150-R152 PolarHBondContact OD2-NH2 3.43Å; R152-N154 PolarHBondContact O-N 3.06Å; R152-F224 HydrophobicContact CB-CE1 3.63Å; R152-F224 HydrophobicContact CB-CZ 4.26Å; R152-F224 VanDerWaalsContact NH2-CD1 3.32Å; R152-F224 PolarHBondContact NH2-O 2.87Å; R152-P225 PolarHBondContact NH1-O 3.27Å
153	R	83.6	Confident	90.5	Very high	123 Å²	123	62.9 Å²	62.9	46%	0.464	35%	0.35	S	S	.	.			trans	-77.3	102.7	178.6	-177.4	176.8	173.3	164.1	2.9	109.5	A147 D150 E151 G155	A147-R153 WeakPolarHBondContact O-CD 3.31Å; A147-R153 PolarHBondContact O-NH1 2.81Å; D150-R153 VanDerWaalsContact O-CB 3.27Å; D150-R153 WeakPolarHBondContact O-CB 3Å; D150-R153 PolarHBondContact O-N 2.86Å; E151-R153 PolarHBondContact O-N 3.49Å; R153-G155 PolarHBondContact O-N 3.23Å
154	N	66	Low	90.5	Very high	157 Å²	157	60.9 Å²	60.9	84%	0.84	34%	0.339	S	S	*	.			trans	-73.4	122.3	172.2	-59.7	-17.2	0	0	0	109.8	R152	R152-N154 PolarHBondContact O-N 3.06Å
155	G	69.4	Low	90.5	Very high	63 Å²	63	59.5 Å²	59.5	65%	0.649	33%	0.33	S	S	*	.	S	Bend	trans	154.1	-177.3	172	0	0	0	0	0	116.3	R153 L157	R153-G155 PolarHBondContact O-N 3.23Å; G155-L157 PolarHBondContact O-N 3.44Å
156	Q	71.3	Confident	90.5	Very high	205 Å²	205	64.3 Å²	64.3	96%	0.958	35%	0.351	S	S	*	.			trans	-86.7	92.1	178	-66.4	175.9	-12.3	0	0	110.5	G158	Q156-G158 VanDerWaalsContact C-N 3.31Å
157	L	79.7	Confident	90.6	Very high	58 Å²	58	64.7 Å²	64.7	30%	0.304	35%	0.354	S	S	.	.			trans	-75.8	-18.1	177.7	-78.9	161	0	0	0	113.6	T148 G155 V160	T148-L157 HydrophobicContact CG2-CD2 4.4Å; G155-L157 PolarHBondContact O-N 3.44Å; L157-V160 HydrophobicContact CB-CG2 4.3Å; L157-V160 HydrophobicContact CD1-CG2 4.22Å
158	G	90.5	Very high	90.7	Very high	71 Å²	71	63.8 Å²	63.8	73%	0.732	35%	0.347	S	S	*	.			trans	60.8	-137	-164	0	0	0	0	0	110.2	Q156	Q156-G158 VanDerWaalsContact C-N 3.31Å
159	S	95.2	Very high	90.8	Very high	43 Å²	43	63.3 Å²	63.3	30%	0.301	34%	0.344	S	S	.	.			trans	-89.5	108.3	177.1	177.1	0	0	0	0	111.5	A161 L162 A163	S159-A161 PolarHBondContact O-N 2.85Å; S159-L162 PolarHBondContact O-N 3.24Å; S159-L162 PolarHBondContact OG-N 3.26Å; S159-A163 PolarHBondContact O-N 3.1Å; S159-A163 VanDerWaalsContact O-N 3.08Å
160	V	95.7	Very high	91	Very high	39 Å²	39	65.1 Å²	65.1	24%	0.236	36%	0.357	C	S	.	.	H	α-helix	trans	-54.1	-41	171.3	168.1	0	0	0	0	110.9	T148 Y149 L157 L162 A163 V164	T148-V160 WeakPolarHBondContact O-CG2 3.29Å; Y149-V160 HydrophobicContact CD1-CG1 3.66Å; Y149-V160 HydrophobicContact CE1-CG1 3.47Å; Y149-V160 VanDerWaalsContact CE1-CG1 3.47Å; L157-V160 HydrophobicContact CB-CG2 4.3Å; L157-V160 HydrophobicContact CD1-CG2 4.22Å; V160-L162 PolarHBondContact O-N 2.84Å; V160-A163 PolarHBondContact O-N 3.45Å; V160-V164 HydrophobicContact CG1-CG2 4.36Å; V160-V164 WeakPolarHBondContact O-CG2 3.32Å; V160-V164 PolarHBondContact O-N 2.97Å
161	A	97.6	Very high	91.2	Very high	1 Å²	1	65 Å²	65	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-43.5	179.1	0	0	0	0	0	112.9	A53 V56 Q57 S159 G165	A53-A161 VanDerWaalsContact CA-O 3.32Å; A53-A161 WeakPolarHBondContact CA-O 3.18Å; A53-A161 VanDerWaalsContact CB-O 3.29Å; A53-A161 WeakPolarHBondContact CB-O 3.39Å; A53-A161 WeakPolarHBondContact O-CB 3.44Å; V56-A161 HydrophobicContact CB-CB 3.88Å; V56-A161 HydrophobicContact CG1-CB 3.7Å; Q57-A161 HydrophobicContact CB-CB 4.32Å; Q57-A161 HydrophobicContact CG-CB 3.54Å; S159-A161 PolarHBondContact O-N 2.85Å; A161-G165 PolarHBondContact O-N 2.89Å
162	L	98.3	Very high	91.6	Very high	78 Å²	78	56 Å²	56	41%	0.408	32%	0.315	S	S	.	.	H	α-helix	trans	-66.8	-40.9	175	-73.8	176.9	0	0	0	111.9	A53 S159 V160 V164 G165 F166	A53-L162 HydrophobicContact CB-CD2 4.11Å; S159-L162 PolarHBondContact O-N 3.24Å; S159-L162 PolarHBondContact OG-N 3.26Å; V160-L162 PolarHBondContact O-N 2.84Å; L162-V164 PolarHBondContact O-N 3.37Å; L162-G165 PolarHBondContact O-N 2.9Å; L162-F166 HydrophobicContact CB-CD2 4.33Å; L162-F166 HydrophobicContact CB-CE2 4.22Å; L162-F166 HydrophobicContact CD2-CE2 4.36Å; L162-F166 WeakPolarHBondContact O-CB 3.32Å; L162-F166 VanDerWaalsContact O-CD2 3.23Å; L162-F166 WeakPolarHBondContact O-CD2 3.49Å; L162-F166 WeakPolarHBondContact O-CG 3.3Å; L162-F166 PolarHBondContact O-N 3.04Å
163	A	98.2	Very high	92	Very high	35 Å²	35	55.7 Å²	55.7	29%	0.289	32%	0.319	S	S	.	.	H	α-helix	trans	-59.6	-47	177.4	0	0	0	0	0	111.6	T148 S159 V160 F166 S167	T148-A163 HydrophobicContact CG2-CB 4.07Å; S159-A163 PolarHBondContact O-N 3.1Å; S159-A163 VanDerWaalsContact O-N 3.08Å; V160-A163 PolarHBondContact O-N 3.45Å; A163-F166 PolarHBondContact O-N 2.93Å; A163-S167 WeakPolarHBondContact O-CB 3.34Å; A163-S167 PolarHBondContact O-N 2.67Å
164	V	98.4	Very high	92.7	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.012	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-43.5	177.1	170.7	0	0	0	0	111.5	L52 V56 F141 I145 Y149 V160 L162 S167 L168	L52-V164 HydrophobicContact CD2-CG1 3.64Å; L52-V164 HydrophobicContact CG-CG1 4.13Å; V56-V164 HydrophobicContact CG2-CG1 4.22Å; F141-V164 HydrophobicContact CE2-CG1 3.88Å; F141-V164 HydrophobicContact CZ-CG1 4.41Å; I145-V164 HydrophobicContact CD1-CG1 4.33Å; I145-V164 HydrophobicContact CG1-CB 4.5Å; I145-V164 HydrophobicContact CG1-CG1 3.84Å; I145-V164 HydrophobicContact CG1-CG2 3.86Å; Y149-V164 HydrophobicContact CE1-CG2 3.99Å; V160-V164 HydrophobicContact CG1-CG2 4.36Å; V160-V164 WeakPolarHBondContact O-CG2 3.32Å; V160-V164 PolarHBondContact O-N 2.97Å; L162-V164 PolarHBondContact O-N 3.37Å; V164-S167 WeakPolarHBondContact O-CB 3.14Å; V164-S167 PolarHBondContact O-N 3.01Å; V164-L168 PolarHBondContact O-N 3.02Å; V164-L168 VanDerWaalsContact O-N 3.09Å
165	G	98.7	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-45.4	175.6	0	0	0	0	0	113.2	G49 A161 L162 S167 L168 A169	G49-G165 WeakPolarHBondContact CA-O 3.38Å; G49-G165 WeakPolarHBondContact O-CA 3.38Å; A161-G165 PolarHBondContact O-N 2.89Å; L162-G165 PolarHBondContact O-N 2.9Å; G165-S167 VanDerWaalsContact C-N 3.32Å; G165-S167 PolarHBondContact O-N 2.77Å; G165-L168 WeakPolarHBondContact O-CB 3.33Å; G165-L168 PolarHBondContact O-N 3.23Å; G165-A169 PolarHBondContact O-N 2.91Å
166	F	98.8	Very high	95.6	Very high	107 Å²	107	45.6 Å²	45.6	47%	0.469	25%	0.254	S	S	.	.	H	α-helix	trans	-68.4	-30.4	176.5	-72.2	-43.7	0	0	0	112.9	M46 L162 A163 L168 A169 L170	M46-F166 HydrophobicContact CE-CE1 3.89Å; M46-F166 HydrophobicContact SD-CE1 4.4Å; L162-F166 HydrophobicContact CB-CD2 4.33Å; L162-F166 HydrophobicContact CB-CE2 4.22Å; L162-F166 HydrophobicContact CD2-CE2 4.36Å; L162-F166 WeakPolarHBondContact O-CB 3.32Å; L162-F166 VanDerWaalsContact O-CD2 3.23Å; L162-F166 WeakPolarHBondContact O-CD2 3.49Å; L162-F166 WeakPolarHBondContact O-CG 3.3Å; L162-F166 PolarHBondContact O-N 3.04Å; A163-F166 PolarHBondContact O-N 2.93Å; F166-L168 VanDerWaalsContact C-N 3.31Å; F166-A169 PolarHBondContact O-N 2.99Å; F166-L170 WeakPolarHBondContact O-CB 3.46Å; F166-L170 PolarHBondContact O-N 3.25Å
167	S	98.9	Very high	96.8	Very high	11 Å²	11	42.9 Å²	42.9	8%	0.077	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-37.7	170.8	-177.3	0	0	0	0	112	Q140 F141 C144 A163 V164 G165 G171	Q140-S167 PolarHBondContact NE2-O 2.98Å; Q140-S167 PolarHBondContact NE2-OG 2.92Å; Q140-S167 VanDerWaalsContact NE2-OG 3.1Å; F141-S167 WeakPolarHBondContact CA-OG 3.48Å; C144-S167 WeakPolarHBondContact CB-OG 3.47Å; A163-S167 WeakPolarHBondContact O-CB 3.34Å; A163-S167 PolarHBondContact O-N 2.67Å; V164-S167 WeakPolarHBondContact O-CB 3.14Å; V164-S167 PolarHBondContact O-N 3.01Å; G165-S167 VanDerWaalsContact C-N 3.32Å; G165-S167 PolarHBondContact O-N 2.77Å; S167-G171 PolarHBondContact O-N 2.72Å; S167-G171 VanDerWaalsContact O-N 3.15Å
168	L	98.8	Very high	97.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68	-41.9	172.1	-176.3	66.4	0	0	0	111.8	Y23 F48 L52 F141 V164 G165 F166 G171 H172 M183	Y23-L168 HydrophobicContact CE2-CD2 3.61Å; Y23-L168 WeakPolarHBondContact OH-CD2 3.37Å; F48-L168 HydrophobicContact CB-CD2 4.06Å; F48-L168 HydrophobicContact CB-CG 4.47Å; F48-L168 WeakPolarHBondContact O-CD2 3.22Å; L52-L168 HydrophobicContact CB-CD2 3.77Å; L52-L168 HydrophobicContact CD2-CB 3.86Å; L52-L168 HydrophobicContact CD2-CD2 3.66Å; L52-L168 HydrophobicContact CD2-CG 4.3Å; L52-L168 HydrophobicContact CG-CD2 4.33Å; F141-L168 HydrophobicContact CD2-CB 4.35Å; F141-L168 HydrophobicContact CE2-CB 4Å; V164-L168 PolarHBondContact O-N 3.02Å; V164-L168 VanDerWaalsContact O-N 3.09Å; G165-L168 WeakPolarHBondContact O-CB 3.33Å; G165-L168 PolarHBondContact O-N 3.23Å; F166-L168 VanDerWaalsContact C-N 3.31Å; L168-G171 PolarHBondContact O-N 3.02Å; L168-H172 PolarHBondContact O-N 3.48Å; L168-H172 PolarHBondContact O-ND1 2.92Å; L168-M183 HydrophobicContact CD1-CB 4.33Å; L168-M183 HydrophobicContact CD1-CE 3.61Å; L168-M183 HydrophobicContact CD1-SD 3.82Å
169	A	98.8	Very high	98.1	Very high	4 Å²	4	40.8 Å²	40.8	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-61	-44	176	0	0	0	0	0	111.5	A45 G165 F166 G171 H172 L173	A45-A169 HydrophobicContact CB-CB 4.48Å; A45-A169 WeakPolarHBondContact CB-O 3.33Å; A45-A169 WeakPolarHBondContact O-CA 3.29Å; A45-A169 VanDerWaalsContact O-CB 3.31Å; A45-A169 WeakPolarHBondContact O-CB 3.3Å; G165-A169 PolarHBondContact O-N 2.91Å; F166-A169 PolarHBondContact O-N 2.99Å; A169-G171 VanDerWaalsContact C-N 3.29Å; A169-G171 PolarHBondContact O-N 2.88Å; A169-H172 PolarHBondContact O-N 3.38Å; A169-H172 VanDerWaalsContact O-N 3.07Å; A169-L173 WeakPolarHBondContact O-CG 3.19Å; A169-L173 PolarHBondContact O-N 3.34Å
170	L	98.8	Very high	98.2	Very high	99 Å²	99	39.4 Å²	39.4	52%	0.518	19%	0.194	S	C	.	.	H	α-helix	trans	-55.8	-46.3	174.2	174.2	58.9	0	0	0	111.1	F166 H172 L173 F174	F166-L170 WeakPolarHBondContact O-CB 3.46Å; F166-L170 PolarHBondContact O-N 3.25Å; L170-H172 VanDerWaalsContact C-N 3.29Å; L170-H172 PolarHBondContact O-N 3.39Å; L170-L173 PolarHBondContact O-N 3.32Å; L170-F174 PolarHBondContact O-N 2.96Å
171	G	98.8	Very high	98.3	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-38.5	176	0	0	0	0	0	113.1	L137 S167 L168 A169 G175	L137-G171 VanDerWaalsContact CD2-O 3.24Å; L137-G171 WeakPolarHBondContact CD2-O 3.48Å; S167-G171 PolarHBondContact O-N 2.72Å; S167-G171 VanDerWaalsContact O-N 3.15Å; L168-G171 PolarHBondContact O-N 3.02Å; A169-G171 VanDerWaalsContact C-N 3.29Å; A169-G171 PolarHBondContact O-N 2.88Å; G171-G175 WeakPolarHBondContact O-CA 3.35Å; G171-G175 PolarHBondContact O-N 2.92Å
172	H	98.6	Very high	98.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.7	-40.6	175.1	-76.2	71	0	0	0	113.1	A45 F48 L168 A169 L170 F174 M176 A181	A45-H172 HydrophobicContact CB-CB 3.53Å; F48-H172 AromaticContact CD1-NE2 3.9Å; F48-H172 AromaticContact CD2-CD2 3.51Å; F48-H172 AromaticContact CD2-NE2 3.25Å; F48-H172 VanDerWaalsContact CD2-NE2 3.25Å; F48-H172 WeakPolarHBondContact CD2-NE2 3.47Å; F48-H172 AromaticContact CE2-NE2 3.71Å; F48-H172 AromaticContact CG-CD2 3.94Å; F48-H172 AromaticContact CG-CE1 3.79Å; F48-H172 AromaticContact CG-NE2 3.35Å; F48-H172 WeakPolarHBondContact CG-NE2 3.44Å; L168-H172 PolarHBondContact O-N 3.48Å; L168-H172 PolarHBondContact O-ND1 2.92Å; A169-H172 PolarHBondContact O-N 3.38Å; A169-H172 VanDerWaalsContact O-N 3.07Å; L170-H172 VanDerWaalsContact C-N 3.29Å; L170-H172 PolarHBondContact O-N 3.39Å; H172-F174 PolarHBondContact O-N 3.47Å; H172-M176 HydrophobicContact CB-CG 4.19Å; H172-M176 WeakPolarHBondContact O-CB 3.19Å; H172-M176 WeakPolarHBondContact O-CG 3.39Å; H172-M176 PolarHBondContact O-N 3.04Å; H172-M176 VanDerWaalsContact O-N 3.11Å; H172-A181 HydrophobicContact CB-CB 4.31Å
173	L	98.6	Very high	98.3	Very high	73 Å²	73	33.8 Å²	33.8	38%	0.382	16%	0.163	S	C	.	.	H	α-helix	trans	-56.1	-34.5	177.5	-73.6	173.7	0	0	0	111.9	V41 L42 A45 A169 L170	V41-L173 HydrophobicContact CG1-CD2 4.37Å; L42-L173 HydrophobicContact CD1-CD2 4.06Å; A45-L173 HydrophobicContact CB-CD2 3.76Å; A45-L173 HydrophobicContact CB-CG 3.77Å; A169-L173 WeakPolarHBondContact O-CG 3.19Å; A169-L173 PolarHBondContact O-N 3.34Å; L170-L173 PolarHBondContact O-N 3.32Å
174	F	98.6	Very high	98.3	Very high	98 Å²	98	32.1 Å²	32.1	43%	0.43	15%	0.15	S	C	.	.	H	α-helix	trans	-88.9	-55.9	175.4	178.9	-98.6	0	0	0	112.9	V133 L137 L170 H172 M176 Y178	V133-F174 HydrophobicContact CG1-CD1 4.45Å; V133-F174 HydrophobicContact CG1-CE1 4.02Å; V133-F174 HydrophobicContact CG2-CE1 4.4Å; L137-F174 HydrophobicContact CD2-CD1 3.81Å; L170-F174 PolarHBondContact O-N 2.96Å; H172-F174 PolarHBondContact O-N 3.47Å; F174-M176 PolarHBondContact O-N 3.08Å; F174-Y178 HydrophobicContact CD1-CE2 4.42Å; F174-Y178 HydrophobicContact CD2-CE2 4.34Å; F174-Y178 HydrophobicContact CE1-CD2 4.22Å; F174-Y178 AromaticContact CE1-CE2 3.97Å; F174-Y178 HydrophobicContact CE1-CE2 3.97Å; F174-Y178 AromaticContact CE2-CE2 3.87Å; F174-Y178 HydrophobicContact CE2-CE2 3.87Å; F174-Y178 HydrophobicContact CZ-CD2 4.37Å; F174-Y178 AromaticContact CZ-CE2 3.67Å; F174-Y178 HydrophobicContact CZ-CE2 3.67Å; F174-Y178 AromaticContact CZ-CZ 3.91Å; F174-Y178 WeakPolarHBondContact O-CD2 3.25Å
175	G	98.4	Very high	98.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-73.1	-21.1	-166.4	0	0	0	0	0	115.5	G171 Y177 Y178 T179 G180 A181	G171-G175 WeakPolarHBondContact O-CA 3.35Å; G171-G175 PolarHBondContact O-N 2.92Å; G175-Y177 PolarHBondContact O-N 3.46Å; G175-Y178 PolarHBondContact O-N 3.24Å; G175-T179 PolarHBondContact O-N 3.18Å; G175-T179 PolarHBondContact O-OG1 2.76Å; G175-G180 PolarHBondContact O-N 3.05Å; G175-A181 PolarHBondContact O-N 3.45Å
176	M	97.3	Very high	98.3	Very high	32 Å²	32	32 Å²	32	16%	0.158	15%	0.149	C	C	.	.	H	α-helix	trans	-56.9	-35.3	-179.2	-81.7	-72.8	-67	0	0	112.4	V41 V44 H172 F174 Y178 G180 A181	V41-M176 HydrophobicContact CG1-CB 3.93Å; V41-M176 HydrophobicContact CG1-CG 4.16Å; V41-M176 HydrophobicContact CG2-CB 4.07Å; V44-M176 HydrophobicContact CB-CE 4.14Å; V44-M176 HydrophobicContact CG1-CE 3.82Å; V44-M176 HydrophobicContact CG1-SD 3.93Å; V44-M176 HydrophobicContact CG2-CE 4.28Å; H172-M176 HydrophobicContact CB-CG 4.19Å; H172-M176 WeakPolarHBondContact O-CB 3.19Å; H172-M176 WeakPolarHBondContact O-CG 3.39Å; H172-M176 PolarHBondContact O-N 3.04Å; H172-M176 VanDerWaalsContact O-N 3.11Å; F174-M176 PolarHBondContact O-N 3.08Å; M176-Y178 VanDerWaalsContact C-N 3.33Å; M176-Y178 PolarHBondContact O-N 3.25Å; M176-G180 PolarHBondContact O-N 3Å; M176-G180 VanDerWaalsContact SD-O 3.38Å; M176-A181 HydrophobicContact CG-CB 4.28Å; M176-A181 HydrophobicContact SD-CB 4.5Å
177	Y	97.3	Very high	98.3	Very high	148 Å²	148	27.2 Å²	27.2	58%	0.58	13%	0.128	S	C	*	.	H	α-helix	trans	-74.2	-20.6	179.4	-59.8	-70.6	0	0	0	114.2	V41 H122 G175	V41-Y177 HydrophobicContact CG1-CE2 4.23Å; V41-Y177 HydrophobicContact CG2-CE1 3.82Å; V41-Y177 HydrophobicContact CG2-CE2 4.25Å; H122-Y177 VanDerWaalsContact CB-O 3.27Å; H122-Y177 WeakPolarHBondContact CB-O 3.25Å; G175-Y177 PolarHBondContact O-N 3.46Å
178	Y	98.4	Very high	98.3	Very high	86 Å²	86	26.7 Å²	26.7	34%	0.337	12%	0.124	S	C	.	.	H	α-helix	trans	-100.4	-49.5	-174.7	-66.2	-95.9	0	0	0	111.7	H122 V125 V133 F174 G175 M176	H122-Y178 PolarHBondContact N-O 3.3Å; V125-Y178 HydrophobicContact CG2-CD1 3.97Å; V133-Y178 HydrophobicContact CG1-CG 4.27Å; V133-Y178 HydrophobicContact CG2-CD1 3.89Å; V133-Y178 HydrophobicContact CG2-CE1 4.42Å; V133-Y178 HydrophobicContact CG2-CG 4.04Å; F174-Y178 HydrophobicContact CD1-CE2 4.42Å; F174-Y178 HydrophobicContact CD2-CE2 4.34Å; F174-Y178 HydrophobicContact CE1-CD2 4.22Å; F174-Y178 AromaticContact CE1-CE2 3.97Å; F174-Y178 HydrophobicContact CE1-CE2 3.97Å; F174-Y178 AromaticContact CE2-CE2 3.87Å; F174-Y178 HydrophobicContact CE2-CE2 3.87Å; F174-Y178 HydrophobicContact CZ-CD2 4.37Å; F174-Y178 AromaticContact CZ-CE2 3.67Å; F174-Y178 HydrophobicContact CZ-CE2 3.67Å; F174-Y178 AromaticContact CZ-CZ 3.91Å; F174-Y178 WeakPolarHBondContact O-CD2 3.25Å; G175-Y178 PolarHBondContact O-N 3.24Å; M176-Y178 VanDerWaalsContact C-N 3.33Å; M176-Y178 PolarHBondContact O-N 3.25Å
179	T	98.4	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-134.9	-2.4	-166	64.3	0	0	0	0	112.9	T120 L121 A130 V133 E134 G175 A181 Y204	T120-T179 PolarHBondContact N-O 2.94Å; T120-T179 CarbonylContact O-C 3.2Å; L121-T179 HydrophobicContact CD2-CG2 3.86Å; A130-T179 HydrophobicContact CB-CG2 3.69Å; V133-T179 HydrophobicContact CB-CG2 4.41Å; V133-T179 HydrophobicContact CG1-CG2 4.27Å; E134-T179 HydrophobicContact CG-CG2 4.2Å; E134-T179 WeakPolarHBondContact OE1-CB 3.38Å; E134-T179 PolarHBondContact OE1-OG1 3.23Å; G175-T179 PolarHBondContact O-N 3.18Å; G175-T179 PolarHBondContact O-OG1 2.76Å; T179-A181 PolarHBondContact OG1-N 2.99Å; T179-Y204 WeakPolarHBondContact O-CE1 3.42Å; T179-Y204 PolarHBondContact O-OH 3.46Å
180	G	96.9	Very high	98.3	Very high	13 Å²	13	28.7 Å²	28.7	13%	0.134	13%	0.133	C	C	.	.	S	Bend	trans	74	12.6	-165.8	0	0	0	0	0	113.6	N119 G175 M176	N119-G180 PolarHBondContact ND2-O 3.49Å; G175-G180 PolarHBondContact O-N 3.05Å; M176-G180 PolarHBondContact O-N 3Å; M176-G180 VanDerWaalsContact SD-O 3.38Å
181	A	97.8	Very high	98.3	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.108	C	C	.	.			trans	51	80	-177.7	0	0	0	0	0	113.4	N119 L137 H172 G175 M176 T179	N119-A181 PolarHBondContact ND2-O 3.25Å; L137-A181 HydrophobicContact CD1-CB 4.44Å; H172-A181 HydrophobicContact CB-CB 4.31Å; G175-A181 PolarHBondContact O-N 3.45Å; M176-A181 HydrophobicContact CG-CB 4.28Å; M176-A181 HydrophobicContact SD-CB 4.5Å; T179-A181 PolarHBondContact OG1-N 2.99Å
182	G	96.8	Very high	98.3	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.107	C	C	.	.			trans	-65.7	-68.8	176.4	0	0	0	0	0	111.3	N119 E134 N184	N119-G182 WeakPolarHBondContact ND2-CA 3.42Å; N119-G182 PolarHBondContact ND2-N 2.89Å; E134-G182 PolarHBondContact OE1-N 3.21Å; G182-N184 PolarHBondContact O-N 3.16Å
183	M	98.5	Very high	98.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.126	C	C	.	.			trans	55.7	-11.7	-179.8	-58.8	174.2	65.6	0	0	115.8	N68 E134 L137 F141 L168	N68-M183 PolarHBondContact ND2-O 3.18Å; E134-M183 PolarHBondContact OE2-N 3.07Å; L137-M183 HydrophobicContact CB-CE 4.32Å; L137-M183 HydrophobicContact CB-CG 3.68Å; L137-M183 HydrophobicContact CB-SD 4.02Å; L137-M183 HydrophobicContact CD1-CG 4.06Å; L137-M183 HydrophobicContact CD1-SD 4.39Å; L137-M183 HydrophobicContact CG-CG 4.47Å; L137-M183 WeakPolarHBondContact O-CE 3.49Å; F141-M183 HydrophobicContact CB-CE 3.74Å; F141-M183 HydrophobicContact CD1-CE 4.35Å; F141-M183 HydrophobicContact CD2-CE 4.49Å; F141-M183 HydrophobicContact CG-CE 3.97Å; L168-M183 HydrophobicContact CD1-CB 4.33Å; L168-M183 HydrophobicContact CD1-CE 3.61Å; L168-M183 HydrophobicContact CD1-SD 3.82Å
184	N	98.8	Very high	98.3	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	12%	0.124	C	C	.	.			trans	-148.1	107.7	-169	-179	-23.5	0	0	0	109.5	Y23 V67 N68 P69 G182 A186 R187 S188	Y23-N184 VanDerWaalsContact CE1-ND2 3.29Å; Y23-N184 WeakPolarHBondContact CE1-ND2 3.42Å; V67-N184 PolarHBondContact O-ND2 3.3Å; N68-N184 HydrophobicContact CB-CB 4.35Å; N68-N184 WeakPolarHBondContact CB-ND2 3.27Å; N68-N184 WeakPolarHBondContact ND2-CB 3.41Å; N68-N184 WeakPolarHBondContact OD1-CA 3.41Å; P69-N184 WeakPolarHBondContact CD-OD1 3.4Å; G182-N184 PolarHBondContact O-N 3.16Å; N184-A186 VanDerWaalsContact C-N 3.27Å; N184-A186 PolarHBondContact O-N 3.08Å; N184-A186 WeakPolarHBondContact OD1-CB 3.42Å; N184-A186 PolarHBondContact OD1-N 3.43Å; N184-R187 HydrophobicContact CB-CB 3.91Å; N184-R187 PolarHBondContact O-N 2.71Å; N184-R187 PolarHBondContact OD1-N 2.85Å; N184-S188 PolarHBondContact O-N 3.37Å; N184-S188 VanDerWaalsContact O-N 3.12Å; N184-S188 PolarHBondContact O-OG 3.11Å
185	P	98.9	Very high	98.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.1	-35.9	179.8	-27.1	34.7	0	0	0	114.1	N68 P69 A70 S188 F189 W205 P208	N68-P185 VanDerWaalsContact OD1-CD 3.29Å; N68-P185 WeakPolarHBondContact OD1-CD 3.37Å; P69-P185 HydrophobicContact CB-CB 4.18Å; P69-P185 HydrophobicContact CB-CG 4.16Å; P69-P185 HydrophobicContact CG-CB 4.19Å; A70-P185 HydrophobicContact CB-CG 4.31Å; P185-S188 PolarHBondContact O-N 3.47Å; P185-F189 WeakPolarHBondContact O-CB 3.15Å; P185-F189 PolarHBondContact O-N 2.79Å; P185-W205 HydrophobicContact CB-CD2 3.65Å; P185-W205 HydrophobicContact CB-CE3 3.6Å; P185-W205 HydrophobicContact CB-CG 4.27Å; P185-W205 HydrophobicContact CB-CH2 3.99Å; P185-W205 HydrophobicContact CB-CZ2 4.01Å; P185-W205 HydrophobicContact CB-CZ3 3.78Å; P185-W205 HydrophobicContact CG-CD2 4.41Å; P185-W205 HydrophobicContact CG-CE3 4.16Å; P185-P208 HydrophobicContact CG-CB 4.25Å
186	A	98.9	Very high	98.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.1	-41.3	179.6	0	0	0	0	0	112.1	T20 P69 Q93 L94 A97 N184 S188 F189 A190	T20-A186 HydrophobicContact CG2-CB 4.26Å; P69-A186 HydrophobicContact CG-CB 3.85Å; Q93-A186 HydrophobicContact CB-CB 4.24Å; L94-A186 HydrophobicContact CD2-CB 4.06Å; A97-A186 HydrophobicContact CB-CB 3.88Å; A97-A186 VanDerWaalsContact CB-O 3.31Å; A97-A186 WeakPolarHBondContact CB-O 3.49Å; N184-A186 VanDerWaalsContact C-N 3.27Å; N184-A186 PolarHBondContact O-N 3.08Å; N184-A186 WeakPolarHBondContact OD1-CB 3.42Å; N184-A186 PolarHBondContact OD1-N 3.43Å; A186-S188 VanDerWaalsContact C-N 3.33Å; A186-S188 PolarHBondContact O-N 2.91Å; A186-F189 PolarHBondContact O-N 3.27Å; A186-A190 PolarHBondContact O-N 3.43Å
187	R	98.8	Very high	98.3	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-34.9	175.2	173.7	-90.2	-175.2	-95.7	5.2	113.1	Y23 V24 L28 F48 A117 N119 N184 P191	Y23-R187 HydrophobicContact CE1-CB 3.86Å; Y23-R187 HydrophobicContact CE1-CG 4.08Å; V24-R187 HydrophobicContact CG2-CB 4.21Å; L28-R187 HydrophobicContact CD1-CG 4.11Å; F48-R187 HydrophobicContact CE1-CG 3.97Å; F48-R187 HydrophobicContact CZ-CG 4.33Å; A117-R187 PolarHBondContact O-NH1 3.15Å; A117-R187 PolarHBondContact O-NH2 2.8Å; N119-R187 WeakPolarHBondContact OD1-CD 3.28Å; N119-R187 PolarHBondContact OD1-NH1 3.17Å; N184-R187 HydrophobicContact CB-CB 3.91Å; N184-R187 PolarHBondContact O-N 2.71Å; N184-R187 PolarHBondContact OD1-N 2.85Å; R187-P191 WeakPolarHBondContact O-CD 3.39Å; R187-P191 WeakPolarHBondContact O-CG 3.08Å
188	S	98.8	Very high	98.3	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-78.3	-33.5	175.3	-58.4	0	0	0	0	111.8	N119 N184 P185 A186 P191 A192 H201 Y204	N119-S188 WeakPolarHBondContact OD1-CA 3.4Å; N119-S188 WeakPolarHBondContact OD1-CB 3.21Å; N119-S188 PolarHBondContact OD1-OG 3.27Å; N184-S188 PolarHBondContact O-N 3.37Å; N184-S188 VanDerWaalsContact O-N 3.12Å; N184-S188 PolarHBondContact O-OG 3.11Å; P185-S188 PolarHBondContact O-N 3.47Å; A186-S188 VanDerWaalsContact C-N 3.33Å; A186-S188 PolarHBondContact O-N 2.91Å; S188-P191 WeakPolarHBondContact O-CD 3.29Å; S188-A192 WeakPolarHBondContact O-CB 3.23Å; S188-H201 PolarHBondContact O-CE1 3.08Å; S188-Y204 WeakPolarHBondContact OG-CB 3.32Å
189	F	98.9	Very high	98.3	Very high	46 Å²	46	27.8 Å²	27.8	20%	0.202	16%	0.164	C	C	.	.	H	α-helix	trans	-68.3	-43.9	-178.9	178	-105.2	0	0	0	112.7	L94 V98 P185 A186 A192 I193 F198 H201 W205	L94-F189 HydrophobicContact CD2-CB 4.04Å; L94-F189 HydrophobicContact CD2-CD1 3.67Å; L94-F189 HydrophobicContact CD2-CE1 4.32Å; L94-F189 HydrophobicContact CD2-CG 3.93Å; V98-F189 HydrophobicContact CG2-CD1 4.02Å; V98-F189 HydrophobicContact CG2-CE1 3.87Å; P185-F189 WeakPolarHBondContact O-CB 3.15Å; P185-F189 PolarHBondContact O-N 2.79Å; A186-F189 PolarHBondContact O-N 3.27Å; F189-A192 WeakPolarHBondContact O-CB 3.42Å; F189-A192 PolarHBondContact O-N 3.32Å; F189-A192 VanDerWaalsContact O-N 3.11Å; F189-I193 HydrophobicContact CD1-CG2 4.34Å; F189-I193 HydrophobicContact CE1-CB 4.42Å; F189-I193 HydrophobicContact CE1-CD1 4.12Å; F189-I193 HydrophobicContact CE1-CG2 4.05Å; F189-I193 HydrophobicContact CE2-CB 4.38Å; F189-I193 HydrophobicContact CE2-CD1 4.35Å; F189-I193 HydrophobicContact CZ-CB 4.18Å; F189-I193 HydrophobicContact CZ-CD1 3.6Å; F189-I193 HydrophobicContact CZ-CG1 4.46Å; F189-I193 HydrophobicContact CZ-CG2 4.31Å; F189-I193 WeakPolarHBondContact O-CG2 3.25Å; F189-I193 PolarHBondContact O-N 3.26Å; F189-F198 HydrophobicContact CD2-CE1 4.29Å; F189-F198 HydrophobicContact CE2-CE1 4.22Å; F189-H201 AromaticContact CD2-NE2 3.92Å; F189-W205 HydrophobicContact CB-CZ2 4.25Å; F189-W205 HydrophobicContact CD2-CZ2 4.29Å; F189-W205 HydrophobicContact CG-CZ2 4.41Å
190	A	98.8	Very high	98.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.8	-53.2	-176.9	0	0	0	0	0	114.7	V24 A97 V98 A101 A186 A192 I193 L194	V24-A190 HydrophobicContact CG1-CB 4.11Å; A97-A190 VanDerWaalsContact C-CB 3.43Å; A97-A190 HydrophobicContact CB-CB 3.81Å; A97-A190 VanDerWaalsContact O-CB 3.3Å; A97-A190 WeakPolarHBondContact O-CB 3.32Å; V98-A190 HydrophobicContact CG2-CB 4.4Å; A101-A190 HydrophobicContact CB-CB 3.82Å; A186-A190 PolarHBondContact O-N 3.43Å; A190-A192 VanDerWaalsContact C-N 3.3Å; A190-A192 PolarHBondContact O-N 3.3Å; A190-I193 WeakPolarHBondContact O-CG2 3.33Å; A190-L194 WeakPolarHBondContact O-CD1 3.41Å; A190-L194 PolarHBondContact O-N 3.2Å
191	P	98.5	Very high	98.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-31.8	175.4	26.4	-32.4	0	0	0	112	L28 L116 L118 R187 S188 T195	L28-P191 HydrophobicContact CD2-CB 4.16Å; L28-P191 HydrophobicContact CD2-CG 4.19Å; L116-P191 HydrophobicContact CB-CB 4.05Å; L116-P191 WeakPolarHBondContact O-CB 3.47Å; L118-P191 HydrophobicContact CB-CB 4.24Å; L118-P191 HydrophobicContact CD1-CB 4.15Å; L118-P191 HydrophobicContact CD1-CG 4.12Å; R187-P191 WeakPolarHBondContact O-CD 3.39Å; R187-P191 WeakPolarHBondContact O-CG 3.08Å; S188-P191 WeakPolarHBondContact O-CD 3.29Å; P191-T195 VanDerWaalsContact O-CB 3.32Å; P191-T195 WeakPolarHBondContact O-CB 3.45Å; P191-T195 VanDerWaalsContact O-CG2 3.29Å; P191-T195 WeakPolarHBondContact O-CG2 3.37Å; P191-T195 PolarHBondContact O-N 3.43Å; P191-T195 PolarHBondContact O-OG1 3.36Å
192	A	98.7	Very high	98.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.7	-48	179.6	0	0	0	0	0	112.2	L118 S188 F189 A190 G196 N197 F198	L118-A192 HydrophobicContact CD1-CB 3.77Å; S188-A192 WeakPolarHBondContact O-CB 3.23Å; F189-A192 WeakPolarHBondContact O-CB 3.42Å; F189-A192 PolarHBondContact O-N 3.32Å; F189-A192 VanDerWaalsContact O-N 3.11Å; A190-A192 VanDerWaalsContact C-N 3.3Å; A190-A192 PolarHBondContact O-N 3.3Å; A192-G196 CarbonylContact O-C 3.51Å; A192-G196 WeakPolarHBondContact O-CA 3.41Å; A192-G196 PolarHBondContact O-N 2.76Å; A192-N197 WeakPolarHBondContact CA-O 3.45Å; A192-N197 WeakPolarHBondContact CB-O 3.34Å; A192-N197 PolarHBondContact O-N 2.78Å; A192-F198 HydrophobicContact CB-CD1 3.99Å; A192-F198 HydrophobicContact CB-CE1 3.87Å; A192-F198 HydrophobicContact CB-CZ 4.32Å
193	I	98.6	Very high	98.6	Very high	78 Å²	78	36.7 Å²	36.7	40%	0.4	20%	0.199	S	C	.	.	H	α-helix	trans	-70.6	-37.4	179.8	-167.4	168	0	0	0	112.4	V98 F189 A190 F198	V98-I193 HydrophobicContact CG2-CG2 3.76Å; F189-I193 HydrophobicContact CD1-CG2 4.34Å; F189-I193 HydrophobicContact CE1-CB 4.42Å; F189-I193 HydrophobicContact CE1-CD1 4.12Å; F189-I193 HydrophobicContact CE1-CG2 4.05Å; F189-I193 HydrophobicContact CE2-CB 4.38Å; F189-I193 HydrophobicContact CE2-CD1 4.35Å; F189-I193 HydrophobicContact CZ-CB 4.18Å; F189-I193 HydrophobicContact CZ-CD1 3.6Å; F189-I193 HydrophobicContact CZ-CG1 4.46Å; F189-I193 HydrophobicContact CZ-CG2 4.31Å; F189-I193 WeakPolarHBondContact O-CG2 3.25Å; F189-I193 PolarHBondContact O-N 3.26Å; A190-I193 WeakPolarHBondContact O-CG2 3.33Å; I193-F198 HydrophobicContact CB-CZ 3.95Å; I193-F198 HydrophobicContact CG1-CZ 4.34Å
194	L	98	Very high	98.6	Very high	63 Å²	63	36.8 Å²	36.8	33%	0.33	20%	0.199	S	C	.	.	H	α-helix	trans	-70.7	-32.1	177.8	-93.5	64.9	0	0	0	113.2	V98 A101 A102 L116 A190	V98-L194 HydrophobicContact CG1-CD1 3.91Å; A101-L194 HydrophobicContact CB-CD2 3.78Å; A102-L194 HydrophobicContact CB-CD2 4.22Å; L116-L194 HydrophobicContact CD1-CB 4.04Å; L116-L194 HydrophobicContact CD1-CD2 3.83Å; A190-L194 WeakPolarHBondContact O-CD1 3.41Å; A190-L194 PolarHBondContact O-N 3.2Å
195	T	97.7	Very high	98.6	Very high	55 Å²	55	40.5 Å²	40.5	34%	0.337	21%	0.213	S	C	.	.	H	α-helix	trans	-94	-6.4	178.8	61.9	0	0	0	0	113.2	L116 P191 N197	L116-T195 HydrophobicContact CB-CG2 4.49Å; L116-T195 HydrophobicContact CD1-CG2 4.47Å; P191-T195 VanDerWaalsContact O-CB 3.32Å; P191-T195 WeakPolarHBondContact O-CB 3.45Å; P191-T195 VanDerWaalsContact O-CG2 3.29Å; P191-T195 WeakPolarHBondContact O-CG2 3.37Å; P191-T195 PolarHBondContact O-N 3.43Å; P191-T195 PolarHBondContact O-OG1 3.36Å; T195-N197 PolarHBondContact O-N 2.91Å
196	G	98.2	Very high	98.6	Very high	61 Å²	61	43.3 Å²	43.3	63%	0.629	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.2	18.7	-175.7	0	0	0	0	0	114.1	A192	A192-G196 CarbonylContact O-C 3.51Å; A192-G196 WeakPolarHBondContact O-CA 3.41Å; A192-G196 PolarHBondContact O-N 2.76Å
197	N	98.3	Very high	98.6	Very high	65 Å²	65	43.3 Å²	43.3	35%	0.348	23%	0.23	S	C	.	.			trans	-114.7	109.1	-175.3	-171.6	-13.1	0	0	0	111.7	L118 A192 T195 T199	L118-N197 HydrophobicContact CD2-CB 3.9Å; A192-N197 WeakPolarHBondContact CA-O 3.45Å; A192-N197 WeakPolarHBondContact CB-O 3.34Å; A192-N197 PolarHBondContact O-N 2.78Å; T195-N197 PolarHBondContact O-N 2.91Å; N197-T199 VanDerWaalsContact OD1-CB 3.25Å; N197-T199 WeakPolarHBondContact OD1-CB 3.27Å; N197-T199 PolarHBondContact OD1-N 2.59Å; N197-T199 PolarHBondContact OD1-OG1 2.91Å
198	F	98.5	Very high	98.6	Very high	100 Å²	100	43 Å²	43	44%	0.439	23%	0.229	S	C	.	.			trans	-110.2	19.2	179.1	-68.1	-89.9	0	0	0	113.1	F189 A192 I193 N200 H201	F189-F198 HydrophobicContact CD2-CE1 4.29Å; F189-F198 HydrophobicContact CE2-CE1 4.22Å; A192-F198 HydrophobicContact CB-CD1 3.99Å; A192-F198 HydrophobicContact CB-CE1 3.87Å; A192-F198 HydrophobicContact CB-CZ 4.32Å; I193-F198 HydrophobicContact CB-CZ 3.95Å; I193-F198 HydrophobicContact CG1-CZ 4.34Å; F198-N200 PolarHBondContact O-N 3.49Å; F198-H201 HydrophobicContact CB-CB 4.02Å; F198-H201 HydrophobicContact CD1-CB 4.09Å; F198-H201 AromaticContact CD1-CD2 3.63Å; F198-H201 AromaticContact CD1-CG 3.79Å; F198-H201 WeakPolarHBondContact O-CB 3.35Å; F198-H201 PolarHBondContact O-N 3.26Å
199	T	98.4	Very high	98.6	Very high	96 Å²	96	45 Å²	45	59%	0.589	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	123.9	178.4	-55	0	0	0	0	110.2	N197 H201	N197-T199 VanDerWaalsContact OD1-CB 3.25Å; N197-T199 WeakPolarHBondContact OD1-CB 3.27Å; N197-T199 PolarHBondContact OD1-N 2.59Å; N197-T199 PolarHBondContact OD1-OG1 2.91Å; T199-H201 PolarHBondContact O-N 3.07Å
200	N	98.4	Very high	98.6	Very high	59 Å²	59	46.4 Å²	46.4	32%	0.316	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	15.4	-175.8	-56.9	-39.4	0	0	0	115	L121 F198 W202 V203	L121-N200 HydrophobicContact CD1-CB 3.91Å; L121-N200 HydrophobicContact CG-CB 4.14Å; F198-N200 PolarHBondContact O-N 3.49Å; N200-W202 PolarHBondContact O-N 3.31Å; N200-W202 VanDerWaalsContact O-N 3.12Å; N200-V203 HydrophobicContact CB-CG2 4.47Å; N200-V203 WeakPolarHBondContact O-CB 3.42Å; N200-V203 WeakPolarHBondContact O-CG2 3.35Å; N200-V203 PolarHBondContact O-N 2.81Å
201	H	98.6	Very high	98.6	Very high	18 Å²	18	46.4 Å²	46.4	8%	0.083	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-30.1	-170.7	-173	67.5	0	0	0	113.7	S188 F189 F198 T199 V203 Y204 W205	S188-H201 PolarHBondContact O-CE1 3.08Å; F189-H201 AromaticContact CD2-NE2 3.92Å; F198-H201 HydrophobicContact CB-CB 4.02Å; F198-H201 HydrophobicContact CD1-CB 4.09Å; F198-H201 AromaticContact CD1-CD2 3.63Å; F198-H201 AromaticContact CD1-CG 3.79Å; F198-H201 WeakPolarHBondContact O-CB 3.35Å; F198-H201 PolarHBondContact O-N 3.26Å; T199-H201 PolarHBondContact O-N 3.07Å; H201-V203 PolarHBondContact O-N 3.15Å; H201-V203 VanDerWaalsContact O-N 3.16Å; H201-Y204 PolarHBondContact O-N 3.42Å; H201-W205 AromaticContact CD2-CD1 3.66Å; H201-W205 AromaticContact CD2-NE1 3.46Å; H201-W205 PolarHBondContact CD2-NE1 3.33Å; H201-W205 AromaticContact CE1-NE1 3.79Å; H201-W205 AromaticContact NE2-CD1 3.49Å; H201-W205 AromaticContact NE2-NE1 2.89Å; H201-W205 PolarHBondContact NE2-NE1 3.1Å
202	W	98.6	Very high	98.6	Very high	123 Å²	123	46.4 Å²	46.4	47%	0.466	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.7	177.9	72.2	-93.6	0	0	0	113	V127 T131 N200 Y204 W205 V206	V127-W202 HydrophobicContact CB-CZ2 3.9Å; V127-W202 HydrophobicContact CG2-CZ2 4.1Å; T131-W202 HydrophobicContact CG2-CZ3 4.34Å; T131-W202 WeakPolarHBondContact OG1-CH2 3.44Å; N200-W202 PolarHBondContact O-N 3.31Å; N200-W202 VanDerWaalsContact O-N 3.12Å; W202-Y204 PolarHBondContact O-N 3.07Å; W202-W205 PolarHBondContact O-N 3.23Å; W202-W205 VanDerWaalsContact O-N 3.1Å; W202-V206 HydrophobicContact CE3-CB 3.94Å; W202-V206 HydrophobicContact CE3-CG1 4.47Å; W202-V206 HydrophobicContact CE3-CG2 3.76Å; W202-V206 HydrophobicContact CZ3-CB 4.15Å; W202-V206 HydrophobicContact CZ3-CG1 4.22Å; W202-V206 HydrophobicContact CZ3-CG2 4.3Å; W202-V206 WeakPolarHBondContact O-CB 3.39Å; W202-V206 WeakPolarHBondContact O-CG2 3.37Å; W202-V206 PolarHBondContact O-N 3.42Å
203	V	98.8	Very high	98.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-39.5	177.1	174.5	0	0	0	0	110.7	L121 V127 A130 E134 N200 H201 W205 G207 P208	L121-V203 HydrophobicContact CD2-CG1 4.45Å; V127-V203 HydrophobicContact CB-CG2 4.44Å; A130-V203 HydrophobicContact CB-CG1 4.03Å; E134-V203 HydrophobicContact CG-CG1 4.16Å; N200-V203 HydrophobicContact CB-CG2 4.47Å; N200-V203 WeakPolarHBondContact O-CB 3.42Å; N200-V203 WeakPolarHBondContact O-CG2 3.35Å; N200-V203 PolarHBondContact O-N 2.81Å; H201-V203 PolarHBondContact O-N 3.15Å; H201-V203 VanDerWaalsContact O-N 3.16Å; V203-W205 PolarHBondContact O-N 3.45Å; V203-G207 PolarHBondContact O-N 3.07Å; V203-P208 WeakPolarHBondContact O-CD 3.46Å
204	Y	98.8	Very high	98.5	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-80.7	-2.4	-177.9	-53.5	-67.1	0	0	0	114.1	N119 T120 L121 E134 T179 S188 H201 W202 P208	N119-Y204 HydrophobicContact CB-CD1 3.9Å; N119-Y204 HydrophobicContact CB-CD2 4.11Å; N119-Y204 HydrophobicContact CB-CE1 3.41Å; N119-Y204 VanDerWaalsContact CB-CE1 3.41Å; N119-Y204 HydrophobicContact CB-CE2 3.68Å; N119-Y204 HydrophobicContact CB-CG 4.21Å; N119-Y204 WeakPolarHBondContact O-CE2 3.15Å; N119-Y204 PolarHBondContact O-OH 3.39Å; T120-Y204 WeakPolarHBondContact CA-OH 3.25Å; T120-Y204 PolarHBondContact N-OH 3.32Å; T120-Y204 VanDerWaalsContact N-OH 3.08Å; L121-Y204 WeakPolarHBondContact CD2-OH 3.35Å; L121-Y204 PolarHBondContact N-OH 2.88Å; E134-Y204 HydrophobicContact CG-CD1 4.34Å; T179-Y204 WeakPolarHBondContact O-CE1 3.42Å; T179-Y204 PolarHBondContact O-OH 3.46Å; S188-Y204 WeakPolarHBondContact OG-CB 3.32Å; H201-Y204 PolarHBondContact O-N 3.42Å; W202-Y204 PolarHBondContact O-N 3.07Å; Y204-P208 WeakPolarHBondContact O-CD 3.08Å; Y204-P208 WeakPolarHBondContact O-CG 3.2Å
205	W	98.8	Very high	98.6	Very high	79 Å²	79	43.7 Å²	43.7	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-102.6	-54.7	166.9	-74.6	83.2	0	0	0	110.5	L94 P185 F189 H201 W202 V203 I209	L94-W205 HydrophobicContact CD1-CH2 4.14Å; L94-W205 HydrophobicContact CD2-CH2 3.75Å; L94-W205 HydrophobicContact CD2-CZ2 3.95Å; P185-W205 HydrophobicContact CB-CD2 3.65Å; P185-W205 HydrophobicContact CB-CE3 3.6Å; P185-W205 HydrophobicContact CB-CG 4.27Å; P185-W205 HydrophobicContact CB-CH2 3.99Å; P185-W205 HydrophobicContact CB-CZ2 4.01Å; P185-W205 HydrophobicContact CB-CZ3 3.78Å; P185-W205 HydrophobicContact CG-CD2 4.41Å; P185-W205 HydrophobicContact CG-CE3 4.16Å; F189-W205 HydrophobicContact CB-CZ2 4.25Å; F189-W205 HydrophobicContact CD2-CZ2 4.29Å; F189-W205 HydrophobicContact CG-CZ2 4.41Å; H201-W205 AromaticContact CD2-CD1 3.66Å; H201-W205 AromaticContact CD2-NE1 3.46Å; H201-W205 PolarHBondContact CD2-NE1 3.33Å; H201-W205 AromaticContact CE1-NE1 3.79Å; H201-W205 AromaticContact NE2-CD1 3.49Å; H201-W205 AromaticContact NE2-NE1 2.89Å; H201-W205 PolarHBondContact NE2-NE1 3.1Å; W202-W205 PolarHBondContact O-N 3.23Å; W202-W205 VanDerWaalsContact O-N 3.1Å; V203-W205 PolarHBondContact O-N 3.45Å; W205-I209 WeakPolarHBondContact O-CB 3.46Å; W205-I209 WeakPolarHBondContact O-CG1 3.35Å; W205-I209 PolarHBondContact O-N 3.11Å
206	V	98.8	Very high	98.5	Very high	58 Å²	58	41 Å²	41	35%	0.352	22%	0.219	S	C	.	.	H	α-helix	trans	-63.8	-48.7	-174.6	172.7	0	0	0	0	111.2	T131 W202 I210	T131-V206 HydrophobicContact CG2-CG1 4.08Å; W202-V206 HydrophobicContact CE3-CB 3.94Å; W202-V206 HydrophobicContact CE3-CG1 4.47Å; W202-V206 HydrophobicContact CE3-CG2 3.76Å; W202-V206 HydrophobicContact CZ3-CB 4.15Å; W202-V206 HydrophobicContact CZ3-CG1 4.22Å; W202-V206 HydrophobicContact CZ3-CG2 4.3Å; W202-V206 WeakPolarHBondContact O-CB 3.39Å; W202-V206 WeakPolarHBondContact O-CG2 3.37Å; W202-V206 PolarHBondContact O-N 3.42Å; V206-I210 HydrophobicContact CG1-CD1 3.57Å; V206-I210 HydrophobicContact CG1-CG1 4.39Å; V206-I210 WeakPolarHBondContact O-CB 3.44Å; V206-I210 VanDerWaalsContact O-CG1 3.28Å; V206-I210 WeakPolarHBondContact O-CG1 3.36Å; V206-I210 PolarHBondContact O-N 2.75Å
207	G	98.8	Very high	98.5	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-56.4	-179.1	0	0	0	0	0	112	I135 V203 I209 I210 G211	I135-G207 WeakPolarHBondContact CA-O 3.4Å; I135-G207 WeakPolarHBondContact CG1-O 3.35Å; V203-G207 PolarHBondContact O-N 3.07Å; G207-I209 PolarHBondContact O-N 2.93Å; G207-I210 PolarHBondContact O-N 3.35Å; G207-G211 PolarHBondContact O-N 3.47Å
208	P	98.9	Very high	98.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-40	179	-28.2	39.4	0	0	0	114.9	A70 E134 T138 P185 V203 Y204 G211 G212	A70-P208 HydrophobicContact CB-CB 3.67Å; A70-P208 WeakPolarHBondContact CB-O 3.09Å; E134-P208 HydrophobicContact CB-CG 4.43Å; T138-P208 HydrophobicContact CG2-CB 4.02Å; T138-P208 VanDerWaalsContact CG2-O 3.3Å; T138-P208 WeakPolarHBondContact CG2-O 3.33Å; T138-P208 WeakPolarHBondContact OG1-CA 3.39Å; T138-P208 WeakPolarHBondContact OG1-CB 3.22Å; P185-P208 HydrophobicContact CG-CB 4.25Å; V203-P208 WeakPolarHBondContact O-CD 3.46Å; Y204-P208 WeakPolarHBondContact O-CD 3.08Å; Y204-P208 WeakPolarHBondContact O-CG 3.2Å; P208-G211 PolarHBondContact O-N 3.14Å; P208-G212 PolarHBondContact O-N 3.46Å
209	I	98.8	Very high	98.4	Very high	41 Å²	41	37.3 Å²	37.3	21%	0.21	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-43.7	179.2	-69.3	-73.9	0	0	0	111.2	A70 F73 W205 G207 G213	A70-I209 HydrophobicContact CB-CD1 4.46Å; F73-I209 HydrophobicContact CB-CD1 3.78Å; F73-I209 HydrophobicContact CD1-CD1 4.19Å; F73-I209 HydrophobicContact CD1-CG2 3.77Å; F73-I209 HydrophobicContact CE1-CG2 3.67Å; F73-I209 HydrophobicContact CG-CD1 3.93Å; F73-I209 HydrophobicContact CG-CG2 4.27Å; F73-I209 HydrophobicContact CZ-CG2 4.11Å; W205-I209 WeakPolarHBondContact O-CB 3.46Å; W205-I209 WeakPolarHBondContact O-CG1 3.35Å; W205-I209 PolarHBondContact O-N 3.11Å; G207-I209 PolarHBondContact O-N 2.93Å; I209-G213 PolarHBondContact O-N 3.33Å
210	I	98.8	Very high	98.2	Very high	76 Å²	76	32.8 Å²	32.8	39%	0.39	16%	0.16	S	C	.	.	H	α-helix	trans	-65.6	-48.9	175.3	-67.8	173.8	0	0	0	110.1	I135 V206 G207 G212 G213 L214	I135-I210 HydrophobicContact CD1-CB 4.27Å; I135-I210 HydrophobicContact CD1-CD1 4.5Å; I135-I210 HydrophobicContact CD1-CG2 3.86Å; I135-I210 HydrophobicContact CG1-CB 4.08Å; I135-I210 HydrophobicContact CG1-CG2 3.97Å; I135-I210 HydrophobicContact CG2-CG2 4.36Å; V206-I210 HydrophobicContact CG1-CD1 3.57Å; V206-I210 HydrophobicContact CG1-CG1 4.39Å; V206-I210 WeakPolarHBondContact O-CB 3.44Å; V206-I210 VanDerWaalsContact O-CG1 3.28Å; V206-I210 WeakPolarHBondContact O-CG1 3.36Å; V206-I210 PolarHBondContact O-N 2.75Å; G207-I210 PolarHBondContact O-N 3.35Å; I210-G212 VanDerWaalsContact C-N 3.34Å; I210-G212 PolarHBondContact O-N 2.93Å; I210-G213 PolarHBondContact O-N 3.45Å; I210-L214 HydrophobicContact CG2-CD1 3.83Å; I210-L214 HydrophobicContact CG2-CG 4.23Å; I210-L214 WeakPolarHBondContact O-CB 3.41Å; I210-L214 VanDerWaalsContact O-CG 3.31Å; I210-L214 WeakPolarHBondContact O-CG 3.43Å; I210-L214 PolarHBondContact O-N 2.98Å
211	G	98.8	Very high	98	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-44.2	179.2	0	0	0	0	0	112.7	I135 L139 G207 P208 L214 G215	I135-G211 WeakPolarHBondContact O-CA 3.44Å; L139-G211 WeakPolarHBondContact CA-O 3.49Å; G207-G211 PolarHBondContact O-N 3.47Å; P208-G211 PolarHBondContact O-N 3.14Å; G211-L214 PolarHBondContact O-N 3.24Å; G211-G215 PolarHBondContact O-N 3.24Å
212	G	98.4	Very high	97.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-42.9	176.8	0	0	0	0	0	113	A74 V142 P208 I210 L214 G215 S216	A74-G212 WeakPolarHBondContact CB-O 3.4Å; V142-G212 WeakPolarHBondContact CG1-O 3.28Å; P208-G212 PolarHBondContact O-N 3.46Å; I210-G212 VanDerWaalsContact C-N 3.34Å; I210-G212 PolarHBondContact O-N 2.93Å; G212-L214 PolarHBondContact O-N 2.88Å; G212-G215 PolarHBondContact O-N 2.92Å; G212-S216 PolarHBondContact O-N 3.29Å
213	G	98.4	Very high	97.8	Very high	7 Å²	7	39.3 Å²	39.3	7%	0.072	20%	0.198	C	C	.	.	H	α-helix	trans	-58	-48	172.5	0	0	0	0	0	112	I209 I210 G215 S216 L217	I209-G213 PolarHBondContact O-N 3.33Å; I210-G213 PolarHBondContact O-N 3.45Å; G213-G215 PolarHBondContact O-N 3.03Å; G213-S216 PolarHBondContact O-N 3.17Å; G213-L217 VanDerWaalsContact O-CG 3.28Å; G213-L217 WeakPolarHBondContact O-CG 3.02Å; G213-L217 PolarHBondContact O-N 3.1Å
214	L	98.6	Very high	97.6	Very high	77 Å²	77	43.4 Å²	43.4	40%	0.403	22%	0.216	S	C	.	.	H	α-helix	trans	-62.9	-40.4	176.8	-70.6	176.4	0	0	0	112.5	I135 L139 I210 G211 G212 L217 L218	I135-L214 HydrophobicContact CG2-CD1 4.09Å; L139-L214 HydrophobicContact CD1-CB 4.05Å; I210-L214 HydrophobicContact CG2-CD1 3.83Å; I210-L214 HydrophobicContact CG2-CG 4.23Å; I210-L214 WeakPolarHBondContact O-CB 3.41Å; I210-L214 VanDerWaalsContact O-CG 3.31Å; I210-L214 WeakPolarHBondContact O-CG 3.43Å; I210-L214 PolarHBondContact O-N 2.98Å; G211-L214 PolarHBondContact O-N 3.24Å; G212-L214 PolarHBondContact O-N 2.88Å; L214-L217 PolarHBondContact O-N 2.85Å; L214-L218 WeakPolarHBondContact O-CB 3.38Å; L214-L218 PolarHBondContact O-N 3.45Å
215	G	98.3	Very high	97.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-44.7	176.2	0	0	0	0	0	112.3	G211 G212 G213 Y219	G211-G215 PolarHBondContact O-N 3.24Å; G212-G215 PolarHBondContact O-N 2.92Å; G213-G215 PolarHBondContact O-N 3.03Å; G215-Y219 PolarHBondContact O-N 3.09Å; G215-Y219 VanDerWaalsContact O-N 3.1Å
216	S	97.6	Very high	97	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-49	173.7	171.8	0	0	0	0	111.7	A74 G78 F146 G212 G213 L218 Y219 D220	A74-S216 WeakPolarHBondContact O-CB 3.26Å; A74-S216 PolarHBondContact O-OG 2.86Å; G78-S216 WeakPolarHBondContact CA-OG 3.1Å; G78-S216 PolarHBondContact N-OG 2.9Å; F146-S216 WeakPolarHBondContact CE1-OG 3.16Å; F146-S216 WeakPolarHBondContact CZ-OG 3.31Å; G212-S216 PolarHBondContact O-N 3.29Å; G213-S216 PolarHBondContact O-N 3.17Å; S216-L218 PolarHBondContact O-N 2.94Å; S216-Y219 PolarHBondContact O-N 3.19Å; S216-D220 WeakPolarHBondContact O-CB 3.15Å; S216-D220 PolarHBondContact O-N 3.15Å
217	L	97.1	Very high	96.4	Very high	76 Å²	76	50.2 Å²	50.2	40%	0.398	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-44.7	-179.3	-69.5	176.1	0	0	0	111.9	V77 G213 L214 Y219 F221	V77-L217 HydrophobicContact CG1-CD2 3.95Å; V77-L217 HydrophobicContact CG1-CG 4.2Å; G213-L217 VanDerWaalsContact O-CG 3.28Å; G213-L217 WeakPolarHBondContact O-CG 3.02Å; G213-L217 PolarHBondContact O-N 3.1Å; L214-L217 PolarHBondContact O-N 2.85Å; L217-Y219 VanDerWaalsContact C-N 3.31Å; L217-Y219 PolarHBondContact O-N 2.79Å; L217-F221 HydrophobicContact CB-CD2 4.5Å; L217-F221 HydrophobicContact CD2-CD2 3.77Å; L217-F221 HydrophobicContact CD2-CE2 3.54Å; L217-F221 HydrophobicContact CD2-CZ 4.46Å; L217-F221 WeakPolarHBondContact O-CB 3.24Å; L217-F221 PolarHBondContact O-N 3.41Å
218	L	97.8	Very high	95.9	Very high	56 Å²	56	52.7 Å²	52.7	29%	0.293	27%	0.266	S	S	.	.	I	π-helix	trans	-59.2	-43.4	178.3	179.2	63	0	0	0	111.1	L139 L143 L214 S216 L222 L223	L139-L218 HydrophobicContact CD2-CD2 4.23Å; L143-L218 HydrophobicContact CD2-CD2 4.26Å; L214-L218 WeakPolarHBondContact O-CB 3.38Å; L214-L218 PolarHBondContact O-N 3.45Å; S216-L218 PolarHBondContact O-N 2.94Å; L218-L222 HydrophobicContact CD1-CB 4.29Å; L218-L222 HydrophobicContact CD1-CD2 3.67Å; L218-L222 WeakPolarHBondContact O-CB 3.03Å; L218-L222 PolarHBondContact O-N 2.93Å; L218-L223 HydrophobicContact CD1-CD1 4.37Å; L218-L223 HydrophobicContact CD1-CG 4.23Å; L218-L223 HydrophobicContact CD2-CD1 4.22Å; L218-L223 HydrophobicContact CG-CD1 3.82Å; L218-L223 HydrophobicContact CG-CG 4.13Å; L218-L223 PolarHBondContact O-N 2.87Å
219	Y	97.5	Very high	95.5	Very high	16 Å²	16	55.4 Å²	55.4	6%	0.063	29%	0.285	C	S	.	.	I	π-helix	trans	-72.4	-55.9	179.2	-167.5	-98.5	0	0	0	112.5	L143 F146 A147 D150 G215 S216 L217 F221 L223 F224	L143-Y219 HydrophobicContact CD1-CD2 3.76Å; L143-Y219 HydrophobicContact CD1-CG 4.33Å; F146-Y219 HydrophobicContact CB-CD1 3.75Å; F146-Y219 HydrophobicContact CB-CD2 4.41Å; F146-Y219 HydrophobicContact CB-CE1 4.29Å; F146-Y219 HydrophobicContact CB-CG 3.8Å; F146-Y219 HydrophobicContact CD1-CD1 4.01Å; F146-Y219 HydrophobicContact CD1-CG 4.44Å; F146-Y219 HydrophobicContact CG-CD1 4.4Å; A147-Y219 HydrophobicContact CB-CD2 4.17Å; A147-Y219 HydrophobicContact CB-CE2 3.56Å; D150-Y219 HydrophobicContact CB-CE1 4.08Å; D150-Y219 WeakPolarHBondContact CB-OH 3.41Å; D150-Y219 WeakPolarHBondContact OD2-CE1 3.42Å; D150-Y219 PolarHBondContact OD2-OH 3.48Å; G215-Y219 PolarHBondContact O-N 3.09Å; G215-Y219 VanDerWaalsContact O-N 3.1Å; S216-Y219 PolarHBondContact O-N 3.19Å; L217-Y219 VanDerWaalsContact C-N 3.31Å; L217-Y219 PolarHBondContact O-N 2.79Å; Y219-F221 PolarHBondContact O-N 3.22Å; Y219-L223 HydrophobicContact CD2-CB 4.47Å; Y219-L223 PolarHBondContact O-N 2.81Å; Y219-F224 HydrophobicContact CE1-CB 4.14Å; Y219-F224 HydrophobicContact CE2-CB 4.02Å; Y219-F224 CarbonylContact O-C 3.51Å; Y219-F224 PolarHBondContact O-N 3.16Å
220	D	94.7	Very high	95.1	Very high	1 Å²	1	60 Å²	60	1%	0.005	31%	0.308	C	S	.	.	I	π-helix	trans	-76.3	-17	-169.4	-80.8	-18.1	0	0	0	114.1	G78 F146 S216 P225 R226	G78-D220 WeakPolarHBondContact CA-OD2 3.22Å; F146-D220 WeakPolarHBondContact CE1-OD2 3.37Å; S216-D220 WeakPolarHBondContact O-CB 3.15Å; S216-D220 PolarHBondContact O-N 3.15Å; D220-P225 CarbonylContact O-C 3.59Å; D220-P225 VanDerWaalsContact O-CA 3.24Å; D220-P225 WeakPolarHBondContact O-CA 3.36Å; D220-R226 HydrophobicContact CB-CB 4.45Å; D220-R226 PolarHBondContact O-N 2.96Å; D220-R226 IonicContact OD1-NE 2.96Å
221	F	93.6	Very high	94.8	Very high	112 Å²	112	60.6 Å²	60.6	49%	0.491	32%	0.319	S	S	.	.	I	π-helix	trans	-116.4	-22.4	179.7	-65.3	-93.7	0	0	0	114.4	L217 Y219 R233	L217-F221 HydrophobicContact CB-CD2 4.5Å; L217-F221 HydrophobicContact CD2-CD2 3.77Å; L217-F221 HydrophobicContact CD2-CE2 3.54Å; L217-F221 HydrophobicContact CD2-CZ 4.46Å; L217-F221 WeakPolarHBondContact O-CB 3.24Å; L217-F221 PolarHBondContact O-N 3.41Å; Y219-F221 PolarHBondContact O-N 3.22Å; F221-R233 VanDerWaalsContact CZ-NH2 3.3Å
222	L	96.1	Very high	94.4	Very high	127 Å²	127	65.2 Å²	65.2	67%	0.665	34%	0.341	S	S	*	.	I	π-helix	trans	-116.2	-60.1	-177.1	-169.9	68.7	0	0	0	112.9	L218	L218-L222 HydrophobicContact CD1-CB 4.29Å; L218-L222 HydrophobicContact CD1-CD2 3.67Å; L218-L222 WeakPolarHBondContact O-CB 3.03Å; L218-L222 PolarHBondContact O-N 2.93Å
223	L	96.4	Very high	94.1	Very high	97 Å²	97	67 Å²	67	51%	0.508	35%	0.347	S	S	.	.	I	π-helix	trans	-76.9	-44.4	-168.6	-63.2	175.8	0	0	0	113.3	L143 L218 Y219	L143-L223 HydrophobicContact CD1-CD1 3.65Å; L143-L223 HydrophobicContact CD2-CD1 4.31Å; L218-L223 HydrophobicContact CD1-CD1 4.37Å; L218-L223 HydrophobicContact CD1-CG 4.23Å; L218-L223 HydrophobicContact CD2-CD1 4.22Å; L218-L223 HydrophobicContact CG-CD1 3.82Å; L218-L223 HydrophobicContact CG-CG 4.13Å; L218-L223 PolarHBondContact O-N 2.87Å; Y219-L223 HydrophobicContact CD2-CB 4.47Å; Y219-L223 PolarHBondContact O-N 2.81Å
224	F	95.1	Very high	93.8	Very high	87 Å²	87	70.6 Å²	70.6	38%	0.382	36%	0.364	S	S	.	.	S	Bend	trans	-142.7	74	179.2	-160.2	-110.8	0	0	0	110.9	D150 R152 Y219 R226	D150-F224 VanDerWaalsContact OD2-CD1 3.31Å; D150-F224 WeakPolarHBondContact OD2-CD1 3.45Å; R152-F224 HydrophobicContact CB-CE1 3.63Å; R152-F224 HydrophobicContact CB-CZ 4.26Å; R152-F224 VanDerWaalsContact NH2-CD1 3.32Å; R152-F224 PolarHBondContact NH2-O 2.87Å; Y219-F224 HydrophobicContact CE1-CB 4.14Å; Y219-F224 HydrophobicContact CE2-CB 4.02Å; Y219-F224 CarbonylContact O-C 3.51Å; Y219-F224 PolarHBondContact O-N 3.16Å; F224-R226 PolarHBondContact O-N 3.31Å
225	P	93.6	Very high	93.5	Very high	62 Å²	62	69 Å²	69	40%	0.403	36%	0.36	S	S	.	.			trans	-54.7	131.6	-163.4	-29.2	36.1	0	0	0	114.1	R152 D220 L227	R152-P225 PolarHBondContact NH1-O 3.27Å; D220-P225 CarbonylContact O-C 3.59Å; D220-P225 VanDerWaalsContact O-CA 3.24Å; D220-P225 WeakPolarHBondContact O-CA 3.36Å; P225-L227 HydrophobicContact CB-CD2 4.46Å
226	R	90.2	Very high	93.3	Very high	56 Å²	56	71.1 Å²	71.1	21%	0.211	37%	0.373	C	S	.	.			trans	-103.3	94.1	172	-166.5	179.2	-68.4	-96	-1.5	109.1	D150 D220 F224 K228 R233	D150-R226 VanDerWaalsContact CG-NH2 3.27Å; D150-R226 IonicContact OD1-CZ 3.94Å; D150-R226 IonicContact OD1-NH2 3.87Å; D150-R226 PolarHBondContact OD1-NH2 3.47Å; D150-R226 IonicContact OD2-NH2 3.6Å; D150-R226 PolarHBondContact OD2-NH2 3.09Å; D220-R226 HydrophobicContact CB-CB 4.45Å; D220-R226 PolarHBondContact O-N 2.96Å; D220-R226 IonicContact OD1-NE 2.96Å; F224-R226 PolarHBondContact O-N 3.31Å; R226-K228 VanDerWaalsContact C-N 3.3Å; R226-K228 HydrophobicContact CG-CD 4.49Å; R226-K228 HydrophobicContact CG-CG 4.31Å; R226-K228 PolarHBondContact O-N 2.94Å; R226-R233 PolarHBondContact O-NH2 2.98Å
227	L	86.9	Confident	93.1	Very high	164 Å²	164	73.7 Å²	73.7	86%	0.859	39%	0.386	S	S	*	.			trans	-74.4	80.8	-177.6	-59.8	177.1	0	0	0	110.7	P225	P225-L227 HydrophobicContact CB-CD2 4.46Å
228	K	87.6	Confident	92.9	Very high	52 Å²	52	79.3 Å²	79.3	23%	0.226	40%	0.402	C	S	.	.			trans	-97.2	131.8	167.4	-71.5	174	173.9	168.7	0	109.9	S79 R226 E232 R233	S79-K228 PolarHBondContact O-NZ 3.25Å; R226-K228 VanDerWaalsContact C-N 3.3Å; R226-K228 HydrophobicContact CG-CD 4.49Å; R226-K228 HydrophobicContact CG-CG 4.31Å; R226-K228 PolarHBondContact O-N 2.94Å; K228-E232 WeakPolarHBondContact CA-OE2 3.16Å; K228-E232 HydrophobicContact CB-CB 4.36Å; K228-R233 HydrophobicContact CB-CG 3.77Å; K228-R233 HydrophobicContact CD-CG 4.42Å; K228-R233 PolarHBondContact O-NE 3.19Å
229	S	91.4	Very high	92.5	Very high	57 Å²	57	77.2 Å²	77.2	40%	0.399	39%	0.394	S	S	.	.			trans	-62.4	159.7	168.9	70.8	0	0	0	0	111.2	S231 E232 R233	S229-S231 PolarHBondContact O-N 3.49Å; S229-E232 PolarHBondContact N-OE2 2.89Å; S229-E232 PolarHBondContact O-N 3.48Å; S229-E232 VanDerWaalsContact OG-CG 3.26Å; S229-E232 WeakPolarHBondContact OG-CG 3.41Å; S229-E232 PolarHBondContact OG-N 3.35Å; S229-E232 PolarHBondContact OG-OE2 3.27Å; S229-R233 WeakPolarHBondContact O-CG 3.2Å; S229-R233 PolarHBondContact O-N 3.34Å
230	I	90	Very high	91.9	Very high	136 Å²	136	80.6 Å²	80.6	70%	0.697	42%	0.416	S	S	*	.	H	α-helix	trans	-59.2	-38	176.8	-64.1	173.1	0	0	0	110.7	R233 L234	I230-R233 PolarHBondContact O-N 3.08Å; I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.29Å; I230-L234 WeakPolarHBondContact O-CB 3.49Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.37Å; I230-L234 PolarHBondContact O-N 3.29Å
231	S	92	Very high	90.9	Very high	90 Å²	90	85.7 Å²	85.7	63%	0.629	44%	0.438	S	S	*	.	H	α-helix	trans	-61.2	-47	177.7	-170.3	0	0	0	0	111.7	S229 R233 L234 S235	S229-S231 PolarHBondContact O-N 3.49Å; S231-R233 PolarHBondContact O-N 3.4Å; S231-L234 PolarHBondContact O-N 3.01Å; S231-S235 WeakPolarHBondContact O-CB 3.32Å; S231-S235 PolarHBondContact O-N 3.19Å
232	E	91.7	Very high	89.6	Confident	96 Å²	96	84.8 Å²	84.8	45%	0.449	44%	0.444	S	S	.	.	H	α-helix	trans	-64.9	-38.3	177.3	-70.3	164.4	150.8	0	0	112.3	K228 S229 S235 V236	K228-E232 WeakPolarHBondContact CA-OE2 3.16Å; K228-E232 HydrophobicContact CB-CB 4.36Å; S229-E232 PolarHBondContact N-OE2 2.89Å; S229-E232 PolarHBondContact O-N 3.48Å; S229-E232 VanDerWaalsContact OG-CG 3.26Å; S229-E232 WeakPolarHBondContact OG-CG 3.41Å; S229-E232 PolarHBondContact OG-N 3.35Å; S229-E232 PolarHBondContact OG-OE2 3.27Å; E232-S235 WeakPolarHBondContact CA-OG 3.23Å; E232-S235 PolarHBondContact O-N 3.33Å; E232-S235 PolarHBondContact O-OG 3.37Å; E232-V236 WeakPolarHBondContact O-CG2 3.24Å; E232-V236 PolarHBondContact O-N 2.76Å; E232-V236 VanDerWaalsContact O-N 3.08Å
233	R	91.4	Very high	87.9	Confident	38 Å²	38	87.5 Å²	87.5	14%	0.143	45%	0.453	C	S	.	.	H	α-helix	trans	-63.4	-46.5	175.3	-68.3	178.7	178.1	-91.7	4.3	110.9	S79 F221 R226 K228 S229 I230 S231 S235 V236 L237	S79-R233 PolarHBondContact OG-NH1 2.82Å; S79-R233 VanDerWaalsContact OG-NH1 3.14Å; F221-R233 VanDerWaalsContact CZ-NH2 3.3Å; R226-R233 PolarHBondContact O-NH2 2.98Å; K228-R233 HydrophobicContact CB-CG 3.77Å; K228-R233 HydrophobicContact CD-CG 4.42Å; K228-R233 PolarHBondContact O-NE 3.19Å; S229-R233 WeakPolarHBondContact O-CG 3.2Å; S229-R233 PolarHBondContact O-N 3.34Å; I230-R233 PolarHBondContact O-N 3.08Å; S231-R233 PolarHBondContact O-N 3.4Å; R233-S235 VanDerWaalsContact C-N 3.34Å; R233-S235 PolarHBondContact O-N 2.94Å; R233-V236 PolarHBondContact O-N 3.18Å; R233-L237 VanDerWaalsContact O-CG 3.26Å; R233-L237 WeakPolarHBondContact O-CG 3.38Å; R233-L237 PolarHBondContact O-N 3.25Å
234	L	92.3	Very high	85.6	Confident	82 Å²	82	88.6 Å²	88.6	43%	0.429	46%	0.459	S	S	.	.	H	α-helix	trans	-65.6	-35.7	178.4	-70.7	173.5	0	0	0	112.4	I230 S231 R238	I230-L234 HydrophobicContact CG2-CD1 3.87Å; I230-L234 HydrophobicContact CG2-CG 4.29Å; I230-L234 WeakPolarHBondContact O-CB 3.49Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.37Å; I230-L234 PolarHBondContact O-N 3.29Å; S231-L234 PolarHBondContact O-N 3.01Å; L234-R238 WeakPolarHBondContact O-CB 3.39Å; L234-R238 VanDerWaalsContact O-CG 3.27Å; L234-R238 WeakPolarHBondContact O-CG 3.38Å; L234-R238 PolarHBondContact O-N 3.33Å
235	S	92.9	Very high	82.9	Confident	45 Å²	45	90 Å²	90	32%	0.315	48%	0.48	S	S	.	.	H	α-helix	trans	-66.4	-43.1	177.1	71.3	0	0	0	0	111.5	S231 E232 R233 R238 G239 V240	S231-S235 WeakPolarHBondContact O-CB 3.32Å; S231-S235 PolarHBondContact O-N 3.19Å; E232-S235 WeakPolarHBondContact CA-OG 3.23Å; E232-S235 PolarHBondContact O-N 3.33Å; E232-S235 PolarHBondContact O-OG 3.37Å; R233-S235 VanDerWaalsContact C-N 3.34Å; R233-S235 PolarHBondContact O-N 2.94Å; S235-R238 PolarHBondContact O-N 3.11Å; S235-G239 PolarHBondContact O-N 3.38Å; S235-V240 PolarHBondContact O-N 3.07Å
236	V	93.3	Very high	80.2	Confident	43 Å²	43	93.2 Å²	93.2	26%	0.261	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-48.6	174.7	174.6	0	0	0	0	111	S79 S82 E232 R233 R238 G239	S79-V236 VanDerWaalsContact O-CG1 3.3Å; S79-V236 WeakPolarHBondContact O-CG1 3.27Å; S82-V236 VanDerWaalsContact CA-O 3.29Å; S82-V236 WeakPolarHBondContact CA-O 3.49Å; S82-V236 WeakPolarHBondContact CB-O 3.28Å; E232-V236 WeakPolarHBondContact O-CG2 3.24Å; E232-V236 PolarHBondContact O-N 2.76Å; E232-V236 VanDerWaalsContact O-N 3.08Å; R233-V236 PolarHBondContact O-N 3.18Å; V236-R238 VanDerWaalsContact C-N 3.27Å; V236-R238 PolarHBondContact O-N 2.84Å; V236-G239 PolarHBondContact O-N 3.46Å
237	L	93.4	Very high	77.6	Confident	54 Å²	54	94.8 Å²	94.8	28%	0.283	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-34.6	-178.5	-70.1	174.7	0	0	0	112.7	L76 L83 R233 G239	L76-L237 HydrophobicContact CD1-CD2 3.51Å; L76-L237 HydrophobicContact CG-CD2 4.25Å; L83-L237 PolarHBondContact N-O 3.18Å; R233-L237 VanDerWaalsContact O-CG 3.26Å; R233-L237 WeakPolarHBondContact O-CG 3.38Å; R233-L237 PolarHBondContact O-N 3.25Å; L237-G239 VanDerWaalsContact C-N 3.26Å; L237-G239 PolarHBondContact O-N 2.84Å
238	R	92.4	Very high	74.8	Confident	194 Å²	194	94.9 Å²	94.9	73%	0.732	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.5	174.7	-72.6	176.7	-180	-176.7	1.1	113.6	L234 S235 V236 V240	L234-R238 WeakPolarHBondContact O-CB 3.39Å; L234-R238 VanDerWaalsContact O-CG 3.27Å; L234-R238 WeakPolarHBondContact O-CG 3.38Å; L234-R238 PolarHBondContact O-N 3.33Å; S235-R238 PolarHBondContact O-N 3.11Å; V236-R238 VanDerWaalsContact C-N 3.27Å; V236-R238 PolarHBondContact O-N 2.84Å; R238-V240 VanDerWaalsContact C-N 3.34Å; R238-V240 HydrophobicContact CB-CG2 4.05Å
239	G	88.9	Confident	72.4	Confident	12 Å²	12	97.9 Å²	97.9	12%	0.124	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	42	-173.1	0	0	0	0	0	111.4	W2 S235 V236 L237	W2-G239 PolarHBondContact NE1-O 3.26Å; S235-G239 PolarHBondContact O-N 3.38Å; V236-G239 PolarHBondContact O-N 3.46Å; L237-G239 VanDerWaalsContact C-N 3.26Å; L237-G239 PolarHBondContact O-N 2.84Å
240	V	85.3	Confident	69.6	Low	88 Å²	88	104.1 Å²	104.1	53%	0.533	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-66.1	135.2	170.6	-178.5	0	0	0	0	107.8	S235 R238	S235-V240 PolarHBondContact O-N 3.07Å; R238-V240 VanDerWaalsContact C-N 3.34Å; R238-V240 HydrophobicContact CB-CG2 4.05Å
241	K	74	Confident	67	Low	108 Å²	108	103.9 Å²	103.9	47%	0.47	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-59.8	128	177.6	-163.9	-168.1	179.8	-150.7	0	107.1	W2 E243 D244	W2-K241 HydrophobicContact CD2-CB 4.35Å; W2-K241 HydrophobicContact CD2-CG 4.36Å; W2-K241 HydrophobicContact CG-CB 4.46Å; W2-K241 HydrophobicContact CZ2-CB 4.4Å; W2-K241 HydrophobicContact CZ2-CG 4.35Å; K241-E243 PolarHBondContact O-N 3.37Å; K241-D244 IonicContact NZ-OD1 3.7Å; K241-D244 IonicContact NZ-OD2 2.82Å; K241-D244 PolarHBondContact NZ-OD2 3.39Å
242	P	66.7	Low	64.6	Low	93 Å²	93	106 Å²	106	60%	0.604	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-54.6	134.6	168.9	-15.3	26.4	0	0	0	107.8	D244	P242-D244 PolarHBondContact O-N 3.45Å
243	E	60.8	Low	62	Low	184 Å²	184	104.4 Å²	104.4	86%	0.86	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-60.1	128.5	168.5	-71.6	-173.9	165.4	0	0	107.3	K241 S245	K241-E243 PolarHBondContact O-N 3.37Å; E243-S245 VanDerWaalsContact C-N 3.29Å; E243-S245 PolarHBondContact O-N 2.82Å
244	D	46.8	Very low	59.2	Low	119 Å²	119	111 Å²	111	64%	0.636	63%	0.627	S	S	*	*			trans	-62.7	95.5	176.9	-65.8	-49.7	0	0	0	106.9	K241 P242 N246	K241-D244 IonicContact NZ-OD1 3.7Å; K241-D244 IonicContact NZ-OD2 2.82Å; K241-D244 PolarHBondContact NZ-OD2 3.39Å; P242-D244 PolarHBondContact O-N 3.45Å; D244-N246 PolarHBondContact O-N 2.92Å
245	S	40.1	Very low	56.5	Low	116 Å²	116	113.1 Å²	113.1	81%	0.811	65%	0.646	S	S	*	*	S	Bend	trans	-73.9	30.2	-177.9	64.5	0	0	0	0	112.7	E243	E243-S245 VanDerWaalsContact C-N 3.29Å; E243-S245 PolarHBondContact O-N 2.82Å
246	N	36.2	Very low	54	Low	130 Å²	130	117.3 Å²	117.3	70%	0.695	67%	0.669	S	S	*	*	S	Bend	trans	-154.5	109.5	166.7	-95.3	-22.7	0	0	0	107.6	D244 Q248	D244-N246 PolarHBondContact O-N 2.92Å; N246-Q248 PolarHBondContact O-N 2.78Å
247	G	35.4	Very low	51.2	Low	90 Å²	90	124 Å²	124	93%	0.928	70%	0.698	S	S	*	*			trans	-68.3	65.9	169.9	0	0	0	0	0	112.1
248	Q	28.8	Very low	48.5	Very low	166 Å²	166	129.3 Å²	129.3	78%	0.776	73%	0.725	S	S	*	*			trans	-119.3	126.7	164.6	-78	-170.5	-19.7	0	0	109.3	N246 E250	N246-Q248 PolarHBondContact O-N 2.78Å; Q248-E250 PolarHBondContact O-N 2.91Å
249	P	36.1	Very low	45.6	Very low	115 Å²	115	127.9 Å²	127.9	75%	0.747	73%	0.732	S	S	*	*			trans	-62.9	136.6	176.2	25.8	-31.8	0	0	0	110.1	V251	P249-V251 PolarHBondContact O-N 3.08Å
250	E	33.5	Very low	43.4	Very low	187 Å²	187	133.6 Å²	133.6	87%	0.874	77%	0.765	S	S	*	*			trans	-59.4	99.8	175.8	-154.1	173.3	-161	0	0	108.8	Q248 T252	Q248-E250 PolarHBondContact O-N 2.91Å; E250-T252 PolarHBondContact O-N 2.87Å; E250-T252 VanDerWaalsContact O-N 3.08Å
251	V	34.5	Very low	41.1	Very low	131 Å²	131	138.7 Å²	138.7	79%	0.794	78%	0.783	S	S	*	*			trans	-74.8	97.5	171.7	-178.5	0	0	0	0	106.9	P249 G253	P249-V251 PolarHBondContact O-N 3.08Å; V251-G253 VanDerWaalsContact C-N 3.29Å; V251-G253 PolarHBondContact O-N 3.48Å
252	T	42.1	Very low	39.2	Very low	135 Å²	135	138.1 Å²	138.1	83%	0.828	80%	0.798	S	S	*	*			trans	-61	92.7	162.7	30.1	0	0	0	0	108.9	E250	E250-T252 PolarHBondContact O-N 2.87Å; E250-T252 VanDerWaalsContact O-N 3.08Å
253	G	36.1	Very low	37.7	Very low	63 Å²	63	145.7 Å²	145.7	65%	0.649	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-79.9	127.7	172.2	0	0	0	0	0	111	V251	V251-G253 VanDerWaalsContact C-N 3.29Å; V251-G253 PolarHBondContact O-N 3.48Å
254	E	34	Very low	36.6	Very low	176 Å²	176	143.8 Å²	143.8	82%	0.822	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-54.2	154.3	170.8	-74	-176.8	153.9	0	0	112.5	V256	E254-V256 PolarHBondContact O-N 3.06Å; E254-V256 VanDerWaalsContact O-N 3.13Å
255	P	35.4	Very low	36	Very low	126 Å²	126	145.1 Å²	145.1	82%	0.818	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-63.5	116.4	-177.4	24.7	-31.9	0	0	0	111	E257	P255-E257 PolarHBondContact O-N 3.36Å
256	V	39.1	Very low	35.8	Very low	133 Å²	133	146.7 Å²	146.7	81%	0.806	84%	0.843	S	S	*	*			trans	-69	112.1	172.1	177.6	0	0	0	0	108.6	E254 L258	E254-V256 PolarHBondContact O-N 3.06Å; E254-V256 VanDerWaalsContact O-N 3.13Å; V256-L258 PolarHBondContact O-N 3.13Å
257	E	36.2	Very low	35.8	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	85%	0.852	S	S	*	*			trans	-60.7	119.9	166.7	-73	-175.5	154.5	0	0	109.5	P255 N259	P255-E257 PolarHBondContact O-N 3.36Å; E257-N259 PolarHBondContact O-N 3.21Å
258	L	36.1	Very low	35.8	Very low	164 Å²	164	151.3 Å²	151.3	86%	0.859	85%	0.847	S	S	*	*			trans	-72.2	95.4	174.3	-83.8	158.5	0	0	0	109.4	V256 T260	V256-L258 PolarHBondContact O-N 3.13Å; L258-T260 PolarHBondContact O-N 2.99Å; L258-T260 VanDerWaalsContact O-N 3.09Å
259	N	31.5	Very low	36.3	Very low	164 Å²	164	150.3 Å²	150.3	88%	0.877	85%	0.852	S	S	*	*			trans	-63.9	106.8	165.6	-113	-22	0	0	0	109	E257 Q261	E257-N259 PolarHBondContact O-N 3.21Å; N259-Q261 PolarHBondContact O-N 3.16Å
260	T	43.7	Very low	36.3	Very low	133 Å²	133	152.9 Å²	152.9	82%	0.816	86%	0.859	S	S	*	*			trans	-81.1	100.3	172.4	-4.5	0	0	0	0	107.8	L258	L258-T260 PolarHBondContact O-N 2.99Å; L258-T260 VanDerWaalsContact O-N 3.09Å
261	Q	35.4	Very low	36.5	Very low	194 Å²	194	150.2 Å²	150.2	91%	0.907	86%	0.858	S	S	*	*			trans	-165.2	129.7	158.4	-108.1	166.2	37.5	0	0	111.4	N259	N259-Q261 PolarHBondContact O-N 3.16Å
262	A	34.5	Very low	36.6	Very low	96 Å²	96	151.8 Å²	151.8	79%	0.793	86%	0.864	S	S	*	*			trans	98.2	111.3	161.2	0	0	0	0	0	119.2
263	L	35.7	Very low	36.1	Very low	253 Å²	253	153.4 Å²	153.4	100%	1.325	87%	0.867	S	S	*	*			trans	83.1	0	157.1	-63.2	165.5	0	0	0	118.4

Retrieved 263 of 263 residues in 70.2 ms (Link to these results)

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