A0A5K4F6I8_SCHMA Loading...

Conserved oligomeric Golgi complex subunit 4

AlphaFold DB , UniProt , Accession A0A5K4F6I8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 259 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	37.4	Very low	57.4	Low	161 Å²	161	94.3 Å²	94.3	79%	0.793	50%	0.501	S	S	*	.				0	122.8	0	-148.6	169.4	-97.2	0	0	107	D60	M1-D60 WeakPolarHBondContact CE-OD1 3.22Å; M1-D60 VanDerWaalsContact CE-OD2 3.31Å; M1-D60 WeakPolarHBondContact CE-OD2 3.49Å
2	K	34.5	Very low	58.8	Low	197 Å²	197	94.3 Å²	94.3	86%	0.857	51%	0.514	S	S	*	.			trans	-56.8	145	177.4	-88.6	177.1	170.9	177.6	0	108.7	L4	K2-L4 PolarHBondContact O-N 2.99Å
3	A	44.1	Very low	60	Low	101 Å²	101	92.3 Å²	92.3	84%	0.835	50%	0.503	S	S	*	.			trans	-54.8	114.1	169.8	0	0	0	0	0	108.2	S5	A3-S5 PolarHBondContact O-N 3.12Å; A3-S5 VanDerWaalsContact O-N 3.16Å
4	L	50.7	Low	61.8	Low	46 Å²	46	88.4 Å²	88.4	24%	0.241	48%	0.481	C	S	.	.			trans	-60.8	117.8	176	-98.5	72.2	0	0	0	108	K2 W16 F61	K2-L4 PolarHBondContact O-N 2.99Å; L4-W16 HydrophobicContact CD2-CE3 4.44Å; L4-W16 HydrophobicContact CD2-CH2 3.27Å; L4-W16 HydrophobicContact CD2-CZ2 3.94Å; L4-W16 HydrophobicContact CD2-CZ3 3.62Å; L4-W16 HydrophobicContact CG-CH2 4.49Å; L4-F61 HydrophobicContact CD1-CE2 4.23Å; L4-F61 HydrophobicContact CD2-CE2 3.64Å; L4-F61 HydrophobicContact CD2-CZ 3.47Å; L4-F61 VanDerWaalsContact CD2-CZ 3.47Å; L4-F61 HydrophobicContact CG-CE2 4.37Å
5	S	54.8	Low	63.6	Low	56 Å²	56	83.1 Å²	83.1	39%	0.392	45%	0.453	S	S	.	.			trans	-72.2	137.3	165.7	45.6	0	0	0	0	108.2	A3 D7 E8	A3-S5 PolarHBondContact O-N 3.12Å; A3-S5 VanDerWaalsContact O-N 3.16Å; S5-D7 PolarHBondContact O-N 3.05Å; S5-E8 PolarHBondContact O-N 3.3Å
6	S	57.7	Low	65.3	Low	40 Å²	40	78 Å²	78	28%	0.28	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-55.9	-8.5	172.6	-49.6	0	0	0	0	114	E8 V9	S6-E8 PolarHBondContact O-N 3.24Å; S6-V9 PolarHBondContact O-N 2.85Å
7	D	56.7	Low	66.7	Low	131 Å²	131	76.8 Å²	76.8	70%	0.701	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-66.6	-14.1	175.2	-62.4	-28.8	0	0	0	114.4	S5 V9	S5-D7 PolarHBondContact O-N 3.05Å; D7-V9 VanDerWaalsContact C-N 3.29Å
8	E	73	Confident	68.1	Low	84 Å²	84	75.2 Å²	75.2	39%	0.393	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-85.2	0.5	176.5	-66	-179.7	-179.6	0	0	113.5	S5 S6 W16 C17	S5-E8 PolarHBondContact O-N 3.3Å; S6-E8 PolarHBondContact O-N 3.24Å; E8-W16 HydrophobicContact CB-CE3 3.97Å; E8-W16 HydrophobicContact CB-CZ3 3.96Å; E8-C17 WeakPolarHBondContact O-CB 3.35Å; E8-C17 PolarHBondContact O-N 3.39Å; E8-C17 PolarHBondContact O-SG 2.78Å; E8-C17 VanDerWaalsContact O-SG 3.32Å
9	V	79.2	Confident	69.4	Low	6 Å²	6	71.2 Å²	71.2	4%	0.036	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.6	176.7	-173.8	0	0	0	0	110.3	S6 D7 K11 W16 Y118 V122	S6-V9 PolarHBondContact O-N 2.85Å; D7-V9 VanDerWaalsContact C-N 3.29Å; V9-K11 PolarHBondContact O-N 3Å; V9-K11 VanDerWaalsContact O-N 3.08Å; V9-W16 HydrophobicContact CG2-CD2 4.21Å; V9-W16 HydrophobicContact CG2-CE3 3.55Å; V9-W16 HydrophobicContact CG2-CH2 3.99Å; V9-W16 HydrophobicContact CG2-CZ3 3.41Å; V9-W16 VanDerWaalsContact CG2-CZ3 3.41Å; V9-Y118 HydrophobicContact CB-CE1 4.33Å; V9-Y118 HydrophobicContact CG1-CE1 4.35Å; V9-Y118 WeakPolarHBondContact CG1-OH 3.33Å; V9-Y118 HydrophobicContact CG2-CE1 3.96Å; V9-V122 HydrophobicContact CB-CG1 4.4Å; V9-V122 HydrophobicContact CG1-CB 4.43Å; V9-V122 HydrophobicContact CG1-CG1 3.65Å; V9-V122 HydrophobicContact CG1-CG2 3.86Å; V9-V122 HydrophobicContact CG2-CG1 3.87Å; V9-V122 HydrophobicContact CG2-CG2 4.41Å
10	D	74.3	Confident	70.5	Confident	49 Å²	49	71.9 Å²	71.9	26%	0.262	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	108.3	167.3	175.9	7.2	0	0	0	108.4	S12 N13 N14 V15 C17	D10-S12 PolarHBondContact O-N 3.42Å; D10-S12 WeakPolarHBondContact OD1-CB 3.3Å; D10-S12 PolarHBondContact OD1-N 3.16Å; D10-S12 PolarHBondContact OD1-OG 2.83Å; D10-S12 PolarHBondContact OD2-OG 2.91Å; D10-N13 PolarHBondContact O-N 3.28Å; D10-N13 WeakPolarHBondContact OD2-CB 3.22Å; D10-N13 PolarHBondContact OD2-ND2 2.9Å; D10-N14 VanDerWaalsContact O-CA 3.31Å; D10-N14 WeakPolarHBondContact O-CA 3.44Å; D10-N14 PolarHBondContact O-N 3.44Å; D10-V15 PolarHBondContact N-O 2.94Å; D10-C17 PolarHBondContact N-SG 2.85Å
11	K	68.8	Low	71.6	Confident	166 Å²	166	73 Å²	73	72%	0.722	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.5	-178.4	-63	-179.9	-177.2	173.7	0	113.1	V9	V9-K11 PolarHBondContact O-N 3Å; V9-K11 VanDerWaalsContact O-N 3.08Å
12	S	74.7	Confident	74.4	Confident	94 Å²	94	67.2 Å²	67.2	66%	0.657	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-39.1	178.7	73.5	0	0	0	0	111.7	D10	D10-S12 PolarHBondContact O-N 3.42Å; D10-S12 WeakPolarHBondContact OD1-CB 3.3Å; D10-S12 PolarHBondContact OD1-N 3.16Å; D10-S12 PolarHBondContact OD1-OG 2.83Å; D10-S12 PolarHBondContact OD2-OG 2.91Å
13	N	74.2	Confident	77.3	Confident	69 Å²	69	58.3 Å²	58.3	37%	0.369	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-11.5	-176.2	-81.4	-43.9	0	0	0	114.5	D10 V15 K241	D10-N13 PolarHBondContact O-N 3.28Å; D10-N13 WeakPolarHBondContact OD2-CB 3.22Å; D10-N13 PolarHBondContact OD2-ND2 2.9Å; N13-V15 HydrophobicContact CB-CB 4.26Å; N13-V15 HydrophobicContact CB-CG2 4.19Å; N13-V15 PolarHBondContact O-N 3.31Å; N13-K241 WeakPolarHBondContact O-CE 3.34Å; N13-K241 PolarHBondContact OD1-NZ 2.9Å
14	N	85.3	Confident	79.8	Confident	37 Å²	37	58.6 Å²	58.6	20%	0.198	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	46.1	-169.3	-62.3	-39.5	0	0	0	111.9	D10 V122 N125 V239	D10-N14 VanDerWaalsContact O-CA 3.31Å; D10-N14 WeakPolarHBondContact O-CA 3.44Å; D10-N14 PolarHBondContact O-N 3.44Å; N14-V122 HydrophobicContact CB-CG2 4.46Å; N14-N125 WeakPolarHBondContact CB-ND2 3.15Å; N14-N125 VanDerWaalsContact O-CB 3.25Å; N14-N125 WeakPolarHBondContact O-CB 3.27Å; N14-N125 PolarHBondContact O-ND2 3.48Å; N14-V239 HydrophobicContact CB-CG1 3.91Å; N14-V239 PolarHBondContact ND2-O 2.88Å
15	V	89.3	Confident	82	Confident	10 Å²	10	61.8 Å²	61.8	6%	0.061	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.7	179.8	170.7	0	0	0	0	108.5	D10 N13 C17 I19 N125 S126 A129	D10-V15 PolarHBondContact N-O 2.94Å; N13-V15 HydrophobicContact CB-CB 4.26Å; N13-V15 HydrophobicContact CB-CG2 4.19Å; N13-V15 PolarHBondContact O-N 3.31Å; V15-C17 PolarHBondContact O-N 3.41Å; V15-I19 HydrophobicContact CG1-CB 4.33Å; V15-I19 HydrophobicContact CG1-CG1 4.28Å; V15-N125 HydrophobicContact CG2-CB 3.99Å; V15-S126 WeakPolarHBondContact CA-OG 3.36Å; V15-A129 HydrophobicContact CG1-CB 3.86Å; V15-A129 HydrophobicContact CG2-CB 3.95Å
16	W	90.8	Very high	84	Confident	1 Å²	1	59.9 Å²	59.9	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	125.7	173	-64.2	115.8	0	0	0	111.5	L4 E8 V9 F18 I19 F61 I65 H119 V122 T123 S126	L4-W16 HydrophobicContact CD2-CE3 4.44Å; L4-W16 HydrophobicContact CD2-CH2 3.27Å; L4-W16 HydrophobicContact CD2-CZ2 3.94Å; L4-W16 HydrophobicContact CD2-CZ3 3.62Å; L4-W16 HydrophobicContact CG-CH2 4.49Å; E8-W16 HydrophobicContact CB-CE3 3.97Å; E8-W16 HydrophobicContact CB-CZ3 3.96Å; V9-W16 HydrophobicContact CG2-CD2 4.21Å; V9-W16 HydrophobicContact CG2-CE3 3.55Å; V9-W16 HydrophobicContact CG2-CH2 3.99Å; V9-W16 HydrophobicContact CG2-CZ3 3.41Å; V9-W16 VanDerWaalsContact CG2-CZ3 3.41Å; W16-F18 HydrophobicContact CB-CD1 3.66Å; W16-F18 HydrophobicContact CB-CE1 3.35Å; W16-F18 HydrophobicContact CB-CZ 4.21Å; W16-F18 HydrophobicContact CD2-CE1 4.41Å; W16-F18 HydrophobicContact CG-CD1 4.44Å; W16-F18 AromaticContact CG-CE1 3.78Å; W16-F18 HydrophobicContact CG-CE1 3.78Å; W16-F18 PolarHBondContact O-N 3.42Å; W16-F18 VanDerWaalsContact O-N 3.15Å; W16-I19 HydrophobicContact CB-CG1 3.96Å; W16-I19 WeakPolarHBondContact O-CB 3.4Å; W16-I19 WeakPolarHBondContact O-CG1 3.43Å; W16-I19 PolarHBondContact O-N 2.94Å; W16-I19 VanDerWaalsContact O-N 3.13Å; W16-F61 AromaticContact CD1-CE1 3.69Å; W16-F61 HydrophobicContact CD2-CE1 4.01Å; W16-F61 AromaticContact CD2-CZ 3.97Å; W16-F61 HydrophobicContact CD2-CZ 3.97Å; W16-F61 AromaticContact CE2-CE1 3.83Å; W16-F61 AromaticContact CE2-CZ 3.97Å; W16-F61 HydrophobicContact CE3-CZ 4.29Å; W16-F61 AromaticContact CG-CE1 3.95Å; W16-F61 HydrophobicContact CG-CE1 3.95Å; W16-F61 HydrophobicContact CG-CZ 4.29Å; W16-F61 HydrophobicContact CH2-CZ 4.5Å; W16-F61 HydrophobicContact CZ2-CE1 4.41Å; W16-F61 HydrophobicContact CZ2-CZ 4.26Å; W16-F61 AromaticContact NE1-CE1 3.65Å; W16-I65 HydrophobicContact CZ2-CD1 3.85Å; W16-H119 HydrophobicContact CH2-CB 4.43Å; W16-H119 AromaticContact CH2-CE1 3.35Å; W16-H119 WeakPolarHBondContact CH2-CE1 3.42Å; W16-H119 AromaticContact CH2-CG 3.81Å; W16-H119 AromaticContact CH2-ND1 3.01Å; W16-H119 WeakPolarHBondContact CH2-ND1 3.38Å; W16-H119 HydrophobicContact CZ2-CB 4.05Å; W16-H119 AromaticContact CZ2-CG 3.94Å; W16-H119 AromaticContact CZ2-ND1 3.42Å; W16-H119 WeakPolarHBondContact CZ2-ND1 3.26Å; W16-V122 HydrophobicContact CD2-CG1 3.98Å; W16-V122 HydrophobicContact CG-CG1 4.13Å; W16-V122 HydrophobicContact CZ2-CG1 4.4Å; W16-T123 PolarHBondContact NE1-OG1 3.4Å; W16-S126 PolarHBondContact N-OG 3.36Å
17	C	89.2	Confident	85.9	Confident	57 Å²	57	60.9 Å²	60.9	39%	0.385	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.5	-175.3	-66.3	0	0	0	0	113.1	E8 D10 V15 I19	E8-C17 WeakPolarHBondContact O-CB 3.35Å; E8-C17 PolarHBondContact O-N 3.39Å; E8-C17 PolarHBondContact O-SG 2.78Å; E8-C17 VanDerWaalsContact O-SG 3.32Å; D10-C17 PolarHBondContact N-SG 2.85Å; V15-C17 PolarHBondContact O-N 3.41Å; C17-I19 PolarHBondContact O-N 3.01Å
18	F	90.8	Very high	87.8	Confident	48 Å²	48	60.5 Å²	60.5	21%	0.211	31%	0.309	C	S	.	.	H	α-helix	trans	-69.5	-15.1	-175.9	77.4	-92.9	0	0	0	113.6	W16 D20 D21 V22 M57 F61	W16-F18 HydrophobicContact CB-CD1 3.66Å; W16-F18 HydrophobicContact CB-CE1 3.35Å; W16-F18 HydrophobicContact CB-CZ 4.21Å; W16-F18 HydrophobicContact CD2-CE1 4.41Å; W16-F18 HydrophobicContact CG-CD1 4.44Å; W16-F18 AromaticContact CG-CE1 3.78Å; W16-F18 HydrophobicContact CG-CE1 3.78Å; W16-F18 PolarHBondContact O-N 3.42Å; W16-F18 VanDerWaalsContact O-N 3.15Å; F18-D20 PolarHBondContact O-N 3.28Å; F18-D21 PolarHBondContact O-N 2.82Å; F18-V22 HydrophobicContact CD2-CG2 3.81Å; F18-V22 HydrophobicContact CE2-CG2 4.45Å; F18-V22 WeakPolarHBondContact O-CG2 3.4Å; F18-V22 PolarHBondContact O-N 2.69Å; F18-M57 HydrophobicContact CE2-CG 4.17Å; F18-F61 HydrophobicContact CD1-CZ 4.32Å; F18-F61 AromaticContact CE1-CD1 3.7Å; F18-F61 HydrophobicContact CE1-CD1 3.7Å; F18-F61 HydrophobicContact CE1-CD2 4.29Å; F18-F61 AromaticContact CE1-CE1 3.28Å; F18-F61 HydrophobicContact CE1-CE1 3.28Å; F18-F61 AromaticContact CE1-CE2 3.89Å; F18-F61 HydrophobicContact CE1-CE2 3.89Å; F18-F61 HydrophobicContact CE1-CG 4.18Å; F18-F61 AromaticContact CE1-CZ 3.36Å; F18-F61 HydrophobicContact CE1-CZ 3.36Å; F18-F61 HydrophobicContact CE2-CD1 4.47Å; F18-F61 HydrophobicContact CZ-CB 4.49Å; F18-F61 AromaticContact CZ-CD1 3.34Å; F18-F61 HydrophobicContact CZ-CD1 3.34Å; F18-F61 HydrophobicContact CZ-CD2 4.24Å; F18-F61 AromaticContact CZ-CE1 3.45Å; F18-F61 HydrophobicContact CZ-CE1 3.45Å; F18-F61 VanDerWaalsContact CZ-CE1 3.45Å; F18-F61 HydrophobicContact CZ-CE2 4.3Å; F18-F61 AromaticContact CZ-CG 3.76Å; F18-F61 HydrophobicContact CZ-CG 3.76Å; F18-F61 AromaticContact CZ-CZ 3.93Å; F18-F61 HydrophobicContact CZ-CZ 3.93Å
19	I	93	Very high	88.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-47.7	-177.6	-64.5	-66.8	0	0	0	110.2	V15 W16 C17 D21 V22 F23 M57 L62	V15-I19 HydrophobicContact CG1-CB 4.33Å; V15-I19 HydrophobicContact CG1-CG1 4.28Å; W16-I19 HydrophobicContact CB-CG1 3.96Å; W16-I19 WeakPolarHBondContact O-CB 3.4Å; W16-I19 WeakPolarHBondContact O-CG1 3.43Å; W16-I19 PolarHBondContact O-N 2.94Å; W16-I19 VanDerWaalsContact O-N 3.13Å; C17-I19 PolarHBondContact O-N 3.01Å; I19-D21 VanDerWaalsContact C-N 3.32Å; I19-D21 PolarHBondContact O-N 2.94Å; I19-V22 PolarHBondContact O-N 2.95Å; I19-F23 HydrophobicContact CG2-CD2 4.23Å; I19-F23 HydrophobicContact CG2-CE2 4.25Å; I19-F23 VanDerWaalsContact O-CD2 3.31Å; I19-F23 WeakPolarHBondContact O-CD2 3.1Å; I19-F23 PolarHBondContact O-N 3Å; I19-M57 HydrophobicContact CD1-CE 3.95Å; I19-M57 HydrophobicContact CD1-CG 4.36Å; I19-M57 HydrophobicContact CD1-SD 4.15Å; I19-L62 HydrophobicContact CD1-CD2 4.44Å
20	D	92.4	Very high	89.7	Confident	84 Å²	84	58.6 Å²	58.6	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-40.8	178.1	-69.5	-22.2	0	0	0	111.3	F18 V22 F23 F24 N133	F18-D20 PolarHBondContact O-N 3.28Å; D20-V22 PolarHBondContact O-N 2.88Å; D20-F23 PolarHBondContact O-N 3.41Å; D20-F24 WeakPolarHBondContact O-CB 3.43Å; D20-F24 PolarHBondContact O-N 3.22Å; D20-N133 PolarHBondContact OD1-ND2 3.02Å
21	D	93.6	Very high	90.7	Very high	97 Å²	97	58.5 Å²	58.5	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-43.8	178.3	-70.7	-27	0	0	0	112.2	F18 I19 F24 I25	F18-D21 PolarHBondContact O-N 2.82Å; I19-D21 VanDerWaalsContact C-N 3.32Å; I19-D21 PolarHBondContact O-N 2.94Å; D21-F24 PolarHBondContact O-N 2.92Å; D21-I25 WeakPolarHBondContact O-CB 3.23Å; D21-I25 VanDerWaalsContact O-CG1 3.23Å; D21-I25 WeakPolarHBondContact O-CG1 3.41Å; D21-I25 PolarHBondContact O-N 2.72Å
22	V	95	Very high	91.9	Very high	38 Å²	38	60.1 Å²	60.1	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-46.5	179.5	166.6	0	0	0	0	111.2	F18 I19 D20 T26 L53 M57	F18-V22 HydrophobicContact CD2-CG2 3.81Å; F18-V22 HydrophobicContact CE2-CG2 4.45Å; F18-V22 WeakPolarHBondContact O-CG2 3.4Å; F18-V22 PolarHBondContact O-N 2.69Å; I19-V22 PolarHBondContact O-N 2.95Å; D20-V22 PolarHBondContact O-N 2.88Å; V22-T26 WeakPolarHBondContact O-CB 3.48Å; V22-T26 PolarHBondContact O-N 3.12Å; V22-T26 PolarHBondContact O-OG1 3.15Å; V22-L53 HydrophobicContact CG1-CD2 3.27Å; V22-M57 HydrophobicContact CB-SD 4.4Å; V22-M57 HydrophobicContact CG1-SD 3.8Å
23	F	96.3	Very high	92.9	Very high	10 Å²	10	56.2 Å²	56.2	4%	0.044	28%	0.278	C	S	.	.	H	α-helix	trans	-69.7	-35.5	177.4	-78.8	-77.3	0	0	0	112	I19 D20 K27 M57 S130 N133 L134 L137	I19-F23 HydrophobicContact CG2-CD2 4.23Å; I19-F23 HydrophobicContact CG2-CE2 4.25Å; I19-F23 VanDerWaalsContact O-CD2 3.31Å; I19-F23 WeakPolarHBondContact O-CD2 3.1Å; I19-F23 PolarHBondContact O-N 3Å; D20-F23 PolarHBondContact O-N 3.41Å; F23-K27 WeakPolarHBondContact O-CB 3.42Å; F23-K27 PolarHBondContact O-N 2.72Å; F23-M57 HydrophobicContact CE2-CE 3.8Å; F23-M57 HydrophobicContact CE2-SD 4.13Å; F23-M57 HydrophobicContact CZ-CE 4.13Å; F23-S130 VanDerWaalsContact CZ-O 3.3Å; F23-S130 WeakPolarHBondContact CZ-O 3.44Å; F23-N133 HydrophobicContact CB-CB 4.02Å; F23-N133 HydrophobicContact CD1-CB 4.14Å; F23-N133 HydrophobicContact CD2-CB 3.43Å; F23-N133 VanDerWaalsContact CD2-CB 3.43Å; F23-N133 HydrophobicContact CE2-CB 3.87Å; F23-N133 HydrophobicContact CG-CB 3.59Å; F23-N133 HydrophobicContact CZ-CB 4.4Å; F23-L134 HydrophobicContact CE1-CB 3.69Å; F23-L134 HydrophobicContact CE1-CD1 4.07Å; F23-L134 HydrophobicContact CE1-CG 4.5Å; F23-L134 HydrophobicContact CZ-CB 3.98Å; F23-L137 HydrophobicContact CD1-CB 4.44Å; F23-L137 HydrophobicContact CD1-CD2 3.99Å
24	F	95.9	Very high	93.8	Very high	108 Å²	108	53.3 Å²	53.3	47%	0.474	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-43.4	176	-179.4	-105.1	0	0	0	112.8	D20 D21 K27 K28	D20-F24 WeakPolarHBondContact O-CB 3.43Å; D20-F24 PolarHBondContact O-N 3.22Å; D21-F24 PolarHBondContact O-N 2.92Å; F24-K27 WeakPolarHBondContact O-CB 3.42Å; F24-K27 PolarHBondContact O-N 3.04Å; F24-K28 HydrophobicContact CD1-CD 4.32Å; F24-K28 HydrophobicContact CE1-CD 3.78Å; F24-K28 VanDerWaalsContact CE1-CE 3.48Å; F24-K28 VanDerWaalsContact CE1-NZ 3.3Å; F24-K28 HydrophobicContact CZ-CD 3.96Å; F24-K28 PolarHBondContact O-N 2.8Å
25	I	96.5	Very high	94.1	Very high	113 Å²	113	56 Å²	56	58%	0.579	29%	0.285	S	S	*	.	H	α-helix	trans	-66	-46.6	176.5	-68.9	165.4	0	0	0	110	D21 K27 K28 S29	D21-I25 WeakPolarHBondContact O-CB 3.23Å; D21-I25 VanDerWaalsContact O-CG1 3.23Å; D21-I25 WeakPolarHBondContact O-CG1 3.41Å; D21-I25 PolarHBondContact O-N 2.72Å; I25-K27 VanDerWaalsContact C-N 3.31Å; I25-K27 PolarHBondContact O-N 3.33Å; I25-K28 PolarHBondContact O-N 3.4Å; I25-S29 WeakPolarHBondContact O-CB 3.35Å; I25-S29 PolarHBondContact O-N 2.9Å
26	T	97.3	Very high	94.3	Very high	16 Å²	16	58.6 Å²	58.6	10%	0.098	30%	0.303	C	S	.	.	H	α-helix	trans	-55.8	-48.6	175.5	-58.5	0	0	0	0	110.7	V22 K28 S29 L30 L53 L137	V22-T26 WeakPolarHBondContact O-CB 3.48Å; V22-T26 PolarHBondContact O-N 3.12Å; V22-T26 PolarHBondContact O-OG1 3.15Å; T26-K28 PolarHBondContact O-N 2.85Å; T26-S29 PolarHBondContact O-N 3.37Å; T26-L30 HydrophobicContact CG2-CD1 3.79Å; T26-L30 HydrophobicContact CG2-CG 4.27Å; T26-L30 WeakPolarHBondContact O-CG 3.27Å; T26-L30 PolarHBondContact O-N 3.07Å; T26-L53 HydrophobicContact CG2-CD1 4.09Å; T26-L137 HydrophobicContact CG2-CD2 3.8Å
27	K	97	Very high	94.2	Very high	61 Å²	61	60.9 Å²	60.9	27%	0.265	33%	0.327	S	S	.	.	H	α-helix	trans	-53.1	-53.6	176.3	-176.3	177.1	174.4	166.5	0	111.8	F23 F24 I25 S29 L30 I31 L137 H140	F23-K27 WeakPolarHBondContact O-CB 3.42Å; F23-K27 PolarHBondContact O-N 2.72Å; F24-K27 WeakPolarHBondContact O-CB 3.42Å; F24-K27 PolarHBondContact O-N 3.04Å; I25-K27 VanDerWaalsContact C-N 3.31Å; I25-K27 PolarHBondContact O-N 3.33Å; K27-S29 VanDerWaalsContact C-N 3.33Å; K27-S29 PolarHBondContact O-N 3.04Å; K27-L30 PolarHBondContact O-N 3.28Å; K27-I31 HydrophobicContact CD-CD1 4.4Å; K27-I31 HydrophobicContact CG-CD1 3.67Å; K27-I31 HydrophobicContact CG-CG1 4.46Å; K27-I31 WeakPolarHBondContact O-CB 3.45Å; K27-I31 VanDerWaalsContact O-CG1 3.25Å; K27-I31 WeakPolarHBondContact O-CG1 3.47Å; K27-I31 PolarHBondContact O-N 3.3Å; K27-L137 HydrophobicContact CB-CD1 3.62Å; K27-L137 HydrophobicContact CG-CD1 3.95Å; K27-H140 WeakPolarHBondContact CE-CD2 3.42Å; K27-H140 VanDerWaalsContact CE-NE2 3.27Å; K27-H140 WeakPolarHBondContact CE-NE2 3.24Å; K27-H140 PolarHBondContact NZ-ND1 2.89Å
28	K	96.5	Very high	94.3	Very high	123 Å²	123	61.7 Å²	61.7	54%	0.535	33%	0.327	S	S	.	.	H	α-helix	trans	-61.2	-41.3	-179.7	-80.3	-175.4	165.6	178.5	0	112.4	F24 I25 T26 R32	F24-K28 HydrophobicContact CD1-CD 4.32Å; F24-K28 HydrophobicContact CE1-CD 3.78Å; F24-K28 VanDerWaalsContact CE1-CE 3.48Å; F24-K28 VanDerWaalsContact CE1-NZ 3.3Å; F24-K28 HydrophobicContact CZ-CD 3.96Å; F24-K28 PolarHBondContact O-N 2.8Å; I25-K28 PolarHBondContact O-N 3.4Å; T26-K28 PolarHBondContact O-N 2.85Å; K28-R32 WeakPolarHBondContact O-CB 3.44Å; K28-R32 PolarHBondContact O-N 3.47Å
29	S	95.7	Very high	94.5	Very high	48 Å²	48	60 Å²	60	34%	0.336	32%	0.321	S	S	.	.	H	α-helix	trans	-64.7	-43.3	179.4	-164.7	0	0	0	0	111.7	I25 T26 K27 R32 S33 M45	I25-S29 WeakPolarHBondContact O-CB 3.35Å; I25-S29 PolarHBondContact O-N 2.9Å; T26-S29 PolarHBondContact O-N 3.37Å; K27-S29 VanDerWaalsContact C-N 3.33Å; K27-S29 PolarHBondContact O-N 3.04Å; S29-R32 PolarHBondContact O-N 2.81Å; S29-S33 PolarHBondContact O-N 3.39Å; S29-M45 WeakPolarHBondContact OG-CE 3.48Å
30	L	96.6	Very high	94.5	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-69.6	-43.3	178.9	-66.9	178.4	0	0	0	111.9	T26 K27 R32 S33 L34 M45 V46 L141 L166	T26-L30 HydrophobicContact CG2-CD1 3.79Å; T26-L30 HydrophobicContact CG2-CG 4.27Å; T26-L30 WeakPolarHBondContact O-CG 3.27Å; T26-L30 PolarHBondContact O-N 3.07Å; K27-L30 PolarHBondContact O-N 3.28Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 3.07Å; L30-S33 CarbonylContact O-C 3.58Å; L30-S33 WeakPolarHBondContact O-CA 3.49Å; L30-S33 VanDerWaalsContact O-CB 3.31Å; L30-S33 WeakPolarHBondContact O-CB 3.41Å; L30-S33 PolarHBondContact O-N 3.17Å; L30-L34 WeakPolarHBondContact O-CD1 3.49Å; L30-L34 PolarHBondContact O-N 3.32Å; L30-M45 HydrophobicContact CD2-CB 4.33Å; L30-M45 HydrophobicContact CD2-CG 3.75Å; L30-V46 HydrophobicContact CD2-CB 4.46Å; L30-V46 HydrophobicContact CD2-CG2 3.82Å; L30-L141 HydrophobicContact CB-CD1 4.35Å; L30-L141 HydrophobicContact CB-CD2 3.76Å; L30-L141 HydrophobicContact CD1-CD1 3.59Å; L30-L166 HydrophobicContact CD1-CD2 4.09Å
31	I	95.4	Very high	94.6	Very high	47 Å²	47	63.1 Å²	63.1	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-59.3	-40.3	174.2	-68.5	167	0	0	0	111.2	K27 S33 L34 S35 H140 L141	K27-I31 HydrophobicContact CD-CD1 4.4Å; K27-I31 HydrophobicContact CG-CD1 3.67Å; K27-I31 HydrophobicContact CG-CG1 4.46Å; K27-I31 WeakPolarHBondContact O-CB 3.45Å; K27-I31 VanDerWaalsContact O-CG1 3.25Å; K27-I31 WeakPolarHBondContact O-CG1 3.47Å; K27-I31 PolarHBondContact O-N 3.3Å; I31-S33 VanDerWaalsContact C-N 3.3Å; I31-S33 PolarHBondContact O-N 3.25Å; I31-L34 WeakPolarHBondContact O-CB 3.46Å; I31-L34 PolarHBondContact O-N 3.08Å; I31-S35 PolarHBondContact O-N 2.74Å; I31-S35 PolarHBondContact O-OG 2.93Å; I31-H140 WeakPolarHBondContact CD1-NE2 3.43Å; I31-L141 HydrophobicContact CG1-CD2 4.36Å
32	R	94.8	Very high	94.7	Very high	201 Å²	201	58.6 Å²	58.6	76%	0.758	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-36.1	174.9	-176.6	161.9	-179.8	81.6	0.6	111.9	K28 S29 L30 S35	K28-R32 WeakPolarHBondContact O-CB 3.44Å; K28-R32 PolarHBondContact O-N 3.47Å; S29-R32 PolarHBondContact O-N 2.81Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 3.07Å; R32-S35 WeakPolarHBondContact O-CB 3.41Å; R32-S35 PolarHBondContact O-N 2.96Å
33	S	95.1	Very high	94.8	Very high	12 Å²	12	57.1 Å²	57.1	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-42.9	172.1	-166.1	0	0	0	0	111.7	S29 L30 I31 S35 S36 T41 I42	S29-S33 PolarHBondContact O-N 3.39Å; L30-S33 CarbonylContact O-C 3.58Å; L30-S33 WeakPolarHBondContact O-CA 3.49Å; L30-S33 VanDerWaalsContact O-CB 3.31Å; L30-S33 WeakPolarHBondContact O-CB 3.41Å; L30-S33 PolarHBondContact O-N 3.17Å; I31-S33 VanDerWaalsContact C-N 3.3Å; I31-S33 PolarHBondContact O-N 3.25Å; S33-S35 PolarHBondContact O-N 3.36Å; S33-S36 WeakPolarHBondContact O-CB 3.47Å; S33-S36 PolarHBondContact O-N 3.4Å; S33-S36 PolarHBondContact O-OG 3.43Å; S33-T41 PolarHBondContact OG-O 3.46Å; S33-I42 WeakPolarHBondContact O-CG1 3.48Å; S33-I42 WeakPolarHBondContact OG-CA 3.42Å
34	L	93.6	Very high	94.8	Very high	7 Å²	7	61.8 Å²	61.8	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-55.7	-38.5	173.9	-93.5	70	0	0	0	111.9	L30 I31 S36 G37 I42 L141 E144 L148	L30-L34 WeakPolarHBondContact O-CD1 3.49Å; L30-L34 PolarHBondContact O-N 3.32Å; I31-L34 WeakPolarHBondContact O-CB 3.46Å; I31-L34 PolarHBondContact O-N 3.08Å; L34-S36 PolarHBondContact O-N 3.03Å; L34-S36 VanDerWaalsContact O-N 3.12Å; L34-G37 PolarHBondContact O-N 2.93Å; L34-G37 VanDerWaalsContact O-N 3.15Å; L34-I42 HydrophobicContact CD1-CG2 3.71Å; L34-I42 HydrophobicContact CG-CG2 4.47Å; L34-L141 HydrophobicContact CD1-CD2 4.46Å; L34-E144 HydrophobicContact CD2-CB 3.75Å; L34-L148 HydrophobicContact CB-CD1 4.25Å; L34-L148 HydrophobicContact CD2-CD1 4.37Å
35	S	91.9	Very high	94.8	Very high	95 Å²	95	59.4 Å²	59.4	66%	0.664	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-13.2	177.6	-54	0	0	0	0	113.9	I31 R32 S33 G37	I31-S35 PolarHBondContact O-N 2.74Å; I31-S35 PolarHBondContact O-OG 2.93Å; R32-S35 WeakPolarHBondContact O-CB 3.41Å; R32-S35 PolarHBondContact O-N 2.96Å; S33-S35 PolarHBondContact O-N 3.36Å; S35-G37 VanDerWaalsContact C-N 3.28Å
36	S	92.6	Very high	94.8	Very high	63 Å²	63	54.1 Å²	54.1	44%	0.441	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.9	174.8	74.7	0	0	0	0	113	S33 L34 N38	S33-S36 WeakPolarHBondContact O-CB 3.47Å; S33-S36 PolarHBondContact O-N 3.4Å; S33-S36 PolarHBondContact O-OG 3.43Å; L34-S36 PolarHBondContact O-N 3.03Å; L34-S36 VanDerWaalsContact O-N 3.12Å; S36-N38 PolarHBondContact O-N 3.05Å; S36-N38 VanDerWaalsContact O-N 3.08Å; S36-N38 PolarHBondContact OG-N 3.32Å
37	G	88.3	Confident	94.7	Very high	49 Å²	49	57 Å²	57	51%	0.505	31%	0.311	S	S	.	.			trans	68.9	-6.4	-174.2	0	0	0	0	0	115	L34 S35 Y149	L34-G37 PolarHBondContact O-N 2.93Å; L34-G37 VanDerWaalsContact O-N 3.15Å; S35-G37 VanDerWaalsContact C-N 3.28Å; G37-Y149 PolarHBondContact O-OH 2.88Å; G37-Y149 VanDerWaalsContact O-OH 3.14Å
38	N	92.7	Very high	94.6	Very high	74 Å²	74	59.5 Å²	59.5	40%	0.396	32%	0.324	S	S	.	.			trans	-89.9	109.8	-179.8	-174.5	-19.1	0	0	0	110.4	S36 D40 T41 I42	S36-N38 PolarHBondContact O-N 3.05Å; S36-N38 VanDerWaalsContact O-N 3.08Å; S36-N38 PolarHBondContact OG-N 3.32Å; N38-D40 VanDerWaalsContact C-N 3.27Å; N38-D40 PolarHBondContact O-N 3.36Å; N38-D40 PolarHBondContact OD1-N 3.02Å; N38-T41 PolarHBondContact ND2-OG1 3.43Å; N38-T41 PolarHBondContact O-N 3.43Å; N38-I42 VanDerWaalsContact O-CG1 3.26Å; N38-I42 WeakPolarHBondContact O-CG1 3.28Å; N38-I42 PolarHBondContact O-N 3.37Å
39	V	93.8	Very high	94.6	Very high	14 Å²	14	54 Å²	54	9%	0.085	30%	0.3	C	S	.	.	H	α-helix	trans	-54.7	-42	-178.9	178.9	0	0	0	0	112	I42 C43 Y149 N155 K158 L159	V39-I42 PolarHBondContact O-N 2.95Å; V39-C43 WeakPolarHBondContact O-CB 3.22Å; V39-C43 PolarHBondContact O-N 2.71Å; V39-C43 PolarHBondContact O-SG 3.46Å; V39-Y149 HydrophobicContact CG2-CE1 3.95Å; V39-N155 HydrophobicContact CG2-CB 3.75Å; V39-K158 HydrophobicContact CG1-CD 3.89Å; V39-K158 HydrophobicContact CG1-CG 4.49Å; V39-L159 HydrophobicContact CG1-CD1 4.26Å; V39-L159 HydrophobicContact CG1-CD2 4.04Å; V39-L159 HydrophobicContact CG1-CG 3.99Å; V39-L159 HydrophobicContact CG2-CD1 4.28Å
40	D	94.2	Very high	94.6	Very high	85 Å²	85	52.4 Å²	52.4	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-69.1	-43	-178.2	-63.1	-38.8	0	0	0	111.2	N38 I42 C43 D44 K158	N38-D40 VanDerWaalsContact C-N 3.27Å; N38-D40 PolarHBondContact O-N 3.36Å; N38-D40 PolarHBondContact OD1-N 3.02Å; D40-I42 VanDerWaalsContact C-N 3.29Å; D40-I42 PolarHBondContact O-N 3.48Å; D40-C43 PolarHBondContact O-N 3.41Å; D40-D44 WeakPolarHBondContact O-CB 3.14Å; D40-D44 PolarHBondContact O-N 3.42Å; D40-K158 IonicContact OD1-NZ 3.03Å; D40-K158 PolarHBondContact OD1-NZ 3.3Å
41	T	94.7	Very high	94.6	Very high	63 Å²	63	54.9 Å²	54.9	39%	0.387	31%	0.305	S	S	.	.	H	α-helix	trans	-62.2	-36.5	174.6	-55.1	0	0	0	0	112.3	S33 N38 M45	S33-T41 PolarHBondContact OG-O 3.46Å; N38-T41 PolarHBondContact ND2-OG1 3.43Å; N38-T41 PolarHBondContact O-N 3.43Å; T41-M45 WeakPolarHBondContact O-CB 3.46Å; T41-M45 PolarHBondContact O-N 3.11Å
42	I	95.7	Very high	94.6	Very high	3 Å²	3	56 Å²	56	2%	0.015	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-49	175.8	-61.4	160.2	0	0	0	110.3	S33 L34 N38 V39 D40 D44 M45 V46 Y149 L159	S33-I42 WeakPolarHBondContact O-CG1 3.48Å; S33-I42 WeakPolarHBondContact OG-CA 3.42Å; L34-I42 HydrophobicContact CD1-CG2 3.71Å; L34-I42 HydrophobicContact CG-CG2 4.47Å; N38-I42 VanDerWaalsContact O-CG1 3.26Å; N38-I42 WeakPolarHBondContact O-CG1 3.28Å; N38-I42 PolarHBondContact O-N 3.37Å; V39-I42 PolarHBondContact O-N 2.95Å; D40-I42 VanDerWaalsContact C-N 3.29Å; D40-I42 PolarHBondContact O-N 3.48Å; I42-D44 VanDerWaalsContact C-N 3.33Å; I42-D44 PolarHBondContact O-N 3.46Å; I42-M45 PolarHBondContact O-N 2.79Å; I42-V46 HydrophobicContact CG2-CG2 4.33Å; I42-V46 WeakPolarHBondContact O-CG2 3.37Å; I42-V46 PolarHBondContact O-N 2.98Å; I42-Y149 HydrophobicContact CD1-CE2 4.37Å; I42-Y149 VanDerWaalsContact CD1-OH 3.31Å; I42-Y149 WeakPolarHBondContact CD1-OH 3.46Å; I42-L159 HydrophobicContact CB-CD2 3.69Å; I42-L159 HydrophobicContact CD1-CD1 4.34Å; I42-L159 HydrophobicContact CD1-CD2 4.46Å; I42-L159 HydrophobicContact CG2-CD2 3.49Å; I42-L159 VanDerWaalsContact CG2-CD2 3.49Å
43	C	95.7	Very high	94.7	Very high	6 Å²	6	46.8 Å²	46.8	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-55.8	-47.3	175.4	-72.6	0	0	0	0	111.6	V39 D40 M45 V46 N47 C162	V39-C43 WeakPolarHBondContact O-CB 3.22Å; V39-C43 PolarHBondContact O-N 2.71Å; V39-C43 PolarHBondContact O-SG 3.46Å; D40-C43 PolarHBondContact O-N 3.41Å; C43-M45 VanDerWaalsContact C-N 3.34Å; C43-M45 PolarHBondContact O-N 3.36Å; C43-V46 PolarHBondContact O-N 3.29Å; C43-N47 VanDerWaalsContact O-CB 3.27Å; C43-N47 WeakPolarHBondContact O-CB 3.26Å; C43-N47 PolarHBondContact O-N 3.17Å; C43-N47 PolarHBondContact O-ND2 3.13Å; C43-C162 PolarHBondContact SG-SG 3.27Å
44	D	96.2	Very high	94.8	Very high	109 Å²	109	47.3 Å²	47.3	58%	0.583	28%	0.279	S	S	*	.	H	α-helix	trans	-59.5	-45.2	178.8	-71.6	-17.5	0	0	0	111.3	D40 I42 H48	D40-D44 WeakPolarHBondContact O-CB 3.14Å; D40-D44 PolarHBondContact O-N 3.42Å; I42-D44 VanDerWaalsContact C-N 3.33Å; I42-D44 PolarHBondContact O-N 3.46Å; D44-H48 WeakPolarHBondContact O-CB 3.13Å; D44-H48 PolarHBondContact O-N 3.37Å
45	M	97	Very high	94.9	Very high	57 Å²	57	51.2 Å²	51.2	28%	0.281	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-41.9	179.2	-170.2	74.2	-148.4	0	0	112.4	S29 L30 T41 I42 C43 H48 S49	S29-M45 WeakPolarHBondContact OG-CE 3.48Å; L30-M45 HydrophobicContact CD2-CB 4.33Å; L30-M45 HydrophobicContact CD2-CG 3.75Å; T41-M45 WeakPolarHBondContact O-CB 3.46Å; T41-M45 PolarHBondContact O-N 3.11Å; I42-M45 PolarHBondContact O-N 2.79Å; C43-M45 VanDerWaalsContact C-N 3.34Å; C43-M45 PolarHBondContact O-N 3.36Å; M45-H48 PolarHBondContact O-N 2.7Å; M45-S49 WeakPolarHBondContact O-CB 3.4Å; M45-S49 PolarHBondContact O-N 3.48Å
46	V	96.4	Very high	95.1	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-50.6	176.6	172.4	0	0	0	0	109.9	L30 I42 C43 H48 S49 C50 C162 L166	L30-V46 HydrophobicContact CD2-CB 4.46Å; L30-V46 HydrophobicContact CD2-CG2 3.82Å; I42-V46 HydrophobicContact CG2-CG2 4.33Å; I42-V46 WeakPolarHBondContact O-CG2 3.37Å; I42-V46 PolarHBondContact O-N 2.98Å; C43-V46 PolarHBondContact O-N 3.29Å; V46-H48 PolarHBondContact O-N 3.02Å; V46-S49 PolarHBondContact O-N 3.44Å; V46-S49 VanDerWaalsContact O-N 3.1Å; V46-S49 PolarHBondContact O-OG 3.35Å; V46-C50 PolarHBondContact O-N 3.33Å; V46-C162 HydrophobicContact CB-CB 4.26Å; V46-C162 HydrophobicContact CG1-CB 3.9Å; V46-C162 VanDerWaalsContact CG1-O 3.29Å; V46-C162 WeakPolarHBondContact CG1-O 3.4Å; V46-L166 HydrophobicContact CG1-CB 3.96Å; V46-L166 HydrophobicContact CG1-CD2 4.26Å
47	N	95.2	Very high	95.2	Very high	78 Å²	78	49.3 Å²	49.3	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-30.1	179.2	-67.6	-18	0	0	0	112.3	C43 P51	C43-N47 VanDerWaalsContact O-CB 3.27Å; C43-N47 WeakPolarHBondContact O-CB 3.26Å; C43-N47 PolarHBondContact O-N 3.17Å; C43-N47 PolarHBondContact O-ND2 3.13Å; N47-P51 WeakPolarHBondContact O-CD 3.37Å
48	H	95.3	Very high	95.6	Very high	112 Å²	112	47 Å²	47	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-75.1	-32.3	174.3	-173.3	56.8	0	0	0	112.9	D44 M45 V46 C50 P51 I52	D44-H48 WeakPolarHBondContact O-CB 3.13Å; D44-H48 PolarHBondContact O-N 3.37Å; M45-H48 PolarHBondContact O-N 2.7Å; V46-H48 PolarHBondContact O-N 3.02Å; H48-C50 VanDerWaalsContact C-N 3.35Å; H48-P51 WeakPolarHBondContact O-CD 3.34Å; H48-P51 WeakPolarHBondContact O-CG 3.42Å; H48-I52 WeakPolarHBondContact O-CG1 3.26Å
49	S	96	Very high	95.7	Very high	7 Å²	7	45.8 Å²	45.8	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-69.3	-31.8	179	70.5	0	0	0	0	113.3	M45 V46 I52 L53 L166	M45-S49 WeakPolarHBondContact O-CB 3.4Å; M45-S49 PolarHBondContact O-N 3.48Å; V46-S49 PolarHBondContact O-N 3.44Å; V46-S49 VanDerWaalsContact O-N 3.1Å; V46-S49 PolarHBondContact O-OG 3.35Å; S49-I52 PolarHBondContact O-N 3.31Å; S49-L53 WeakPolarHBondContact O-CG 3.24Å; S49-L53 PolarHBondContact O-N 3.24Å; S49-L53 VanDerWaalsContact O-N 3.08Å; S49-L166 WeakPolarHBondContact OG-CD1 3.32Å
50	C	95.2	Very high	95.7	Very high	15 Å²	15	48.7 Å²	48.7	10%	0.101	26%	0.261	C	S	.	.	H	α-helix	trans	-58.1	-58.2	-179.6	-171.9	0	0	0	0	113.7	V46 H48 I52 L53 I54 L166 S169	V46-C50 PolarHBondContact O-N 3.33Å; H48-C50 VanDerWaalsContact C-N 3.35Å; C50-I52 VanDerWaalsContact C-N 3.29Å; C50-I52 PolarHBondContact O-N 2.89Å; C50-L53 PolarHBondContact O-N 3.32Å; C50-I54 WeakPolarHBondContact O-CG1 3.43Å; C50-I54 PolarHBondContact O-N 3.43Å; C50-I54 VanDerWaalsContact SG-CD1 3.55Å; C50-L166 HydrophobicContact CB-CD1 3.72Å; C50-S169 VanDerWaalsContact SG-CB 3.53Å
51	P	95.8	Very high	95.6	Very high	53 Å²	53	46.1 Å²	46.1	34%	0.344	25%	0.246	S	C	.	.	H	α-helix	trans	-64.1	-31.8	178.9	25.9	-34.9	0	0	0	112.5	N47 H48 I54 D55	N47-P51 WeakPolarHBondContact O-CD 3.37Å; H48-P51 WeakPolarHBondContact O-CD 3.34Å; H48-P51 WeakPolarHBondContact O-CG 3.42Å; P51-I54 PolarHBondContact O-N 2.87Å; P51-D55 WeakPolarHBondContact O-CB 3.29Å; P51-D55 VanDerWaalsContact O-CG 3.23Å; P51-D55 PolarHBondContact O-N 3.27Å
52	I	96.1	Very high	95.6	Very high	72 Å²	72	43.1 Å²	43.1	37%	0.369	23%	0.227	S	C	.	.	H	α-helix	trans	-62.5	-47	176.1	-67.4	173.4	0	0	0	110.9	H48 S49 C50 L56	H48-I52 WeakPolarHBondContact O-CG1 3.26Å; S49-I52 PolarHBondContact O-N 3.31Å; C50-I52 VanDerWaalsContact C-N 3.29Å; C50-I52 PolarHBondContact O-N 2.89Å; I52-L56 HydrophobicContact CG2-CD1 3.93Å; I52-L56 VanDerWaalsContact O-CB 3.3Å; I52-L56 WeakPolarHBondContact O-CB 3.44Å; I52-L56 WeakPolarHBondContact O-CG 3.31Å; I52-L56 PolarHBondContact O-N 3.24Å
53	L	97.1	Very high	95.6	Very high	7 Å²	7	43 Å²	43	4%	0.037	23%	0.227	C	C	.	.	I	π-helix	trans	-66.7	-43.2	178.1	-70.6	174.9	0	0	0	111.3	V22 T26 S49 C50 M57 V58 I170	V22-L53 HydrophobicContact CG1-CD2 3.27Å; T26-L53 HydrophobicContact CG2-CD1 4.09Å; S49-L53 WeakPolarHBondContact O-CG 3.24Å; S49-L53 PolarHBondContact O-N 3.24Å; S49-L53 VanDerWaalsContact O-N 3.08Å; C50-L53 PolarHBondContact O-N 3.32Å; L53-M57 WeakPolarHBondContact O-CB 3.5Å; L53-M57 PolarHBondContact O-N 3.04Å; L53-M57 VanDerWaalsContact O-N 3.14Å; L53-V58 PolarHBondContact O-N 3.19Å; L53-I170 HydrophobicContact CB-CD1 3.92Å; L53-I170 HydrophobicContact CB-CG1 4.5Å; L53-I170 HydrophobicContact CD1-CD1 3.5Å; L53-I170 HydrophobicContact CG-CD1 4.35Å
54	I	97.1	Very high	95.5	Very high	22 Å²	22	45.2 Å²	45.2	11%	0.113	24%	0.238	C	C	.	.	I	π-helix	trans	-63.9	-51.3	178.3	-70.3	172.1	0	0	0	110.8	C50 P51 V58 N59 I170 Q173	C50-I54 WeakPolarHBondContact O-CG1 3.43Å; C50-I54 PolarHBondContact O-N 3.43Å; C50-I54 VanDerWaalsContact SG-CD1 3.55Å; P51-I54 PolarHBondContact O-N 2.87Å; I54-V58 CarbonylContact O-C 3.56Å; I54-V58 WeakPolarHBondContact O-CB 3.29Å; I54-V58 PolarHBondContact O-N 2.98Å; I54-N59 VanDerWaalsContact CG2-ND2 3.34Å; I54-N59 WeakPolarHBondContact CG2-ND2 3.33Å; I54-N59 WeakPolarHBondContact O-CB 3.39Å; I54-N59 PolarHBondContact O-N 3.4Å; I54-N59 PolarHBondContact O-ND2 3.19Å; I54-I170 HydrophobicContact CD1-CG1 4.35Å; I54-I170 HydrophobicContact CG1-CG1 4.04Å; I54-Q173 HydrophobicContact CD1-CG 4.17Å; I54-Q173 HydrophobicContact CG1-CG 4.27Å; I54-Q173 HydrophobicContact CG2-CG 4.19Å
55	D	96.2	Very high	95.4	Very high	90 Å²	90	41.3 Å²	41.3	48%	0.481	22%	0.217	S	C	.	.	I	π-helix	trans	-73.5	-46.1	-172.1	-67.5	-23.6	0	0	0	112.3	P51 D60	P51-D55 WeakPolarHBondContact O-CB 3.29Å; P51-D55 VanDerWaalsContact O-CG 3.23Å; P51-D55 PolarHBondContact O-N 3.27Å; D55-D60 VanDerWaalsContact O-CB 3.25Å; D55-D60 WeakPolarHBondContact O-CB 3.47Å; D55-D60 PolarHBondContact O-N 3.16Å
56	L	94.8	Very high	95.2	Very high	109 Å²	109	38.6 Å²	38.6	57%	0.571	20%	0.204	S	C	*	.	I	π-helix	trans	-84	-51.5	-174.3	-57.3	-177.4	0	0	0	112.2	I52 F61	I52-L56 HydrophobicContact CG2-CD1 3.93Å; I52-L56 VanDerWaalsContact O-CB 3.3Å; I52-L56 WeakPolarHBondContact O-CB 3.44Å; I52-L56 WeakPolarHBondContact O-CG 3.31Å; I52-L56 PolarHBondContact O-N 3.24Å; L56-F61 PolarHBondContact O-N 3.44Å
57	M	95.1	Very high	95	Very high	8 Å²	8	44.8 Å²	44.8	4%	0.039	23%	0.227	C	C	.	.	I	π-helix	trans	-82.8	-52.7	-174.5	174.9	-173.6	134.3	0	0	111.2	F18 I19 V22 F23 L53 F61 L62 S130 L174	F18-M57 HydrophobicContact CE2-CG 4.17Å; I19-M57 HydrophobicContact CD1-CE 3.95Å; I19-M57 HydrophobicContact CD1-CG 4.36Å; I19-M57 HydrophobicContact CD1-SD 4.15Å; V22-M57 HydrophobicContact CB-SD 4.4Å; V22-M57 HydrophobicContact CG1-SD 3.8Å; F23-M57 HydrophobicContact CE2-CE 3.8Å; F23-M57 HydrophobicContact CE2-SD 4.13Å; F23-M57 HydrophobicContact CZ-CE 4.13Å; L53-M57 WeakPolarHBondContact O-CB 3.5Å; L53-M57 PolarHBondContact O-N 3.04Å; L53-M57 VanDerWaalsContact O-N 3.14Å; M57-F61 WeakPolarHBondContact O-CB 3.4Å; M57-L62 HydrophobicContact CE-CD1 4Å; M57-L62 HydrophobicContact CG-CD1 4.31Å; M57-L62 WeakPolarHBondContact O-CG 3.4Å; M57-L62 PolarHBondContact O-N 3.47Å; M57-S130 VanDerWaalsContact CE-CB 3.46Å; M57-S130 WeakPolarHBondContact CE-OG 3.31Å; M57-L174 HydrophobicContact CE-CD2 4.49Å
58	V	96.4	Very high	94.7	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.241	C	C	.	.	I	π-helix	trans	-75.4	-50.8	-174.1	-174.7	0	0	0	0	111.2	L53 I54 G63 Q173 L174 L177	L53-V58 PolarHBondContact O-N 3.19Å; I54-V58 CarbonylContact O-C 3.56Å; I54-V58 WeakPolarHBondContact O-CB 3.29Å; I54-V58 PolarHBondContact O-N 2.98Å; V58-G63 VanDerWaalsContact O-CA 3.27Å; V58-G63 WeakPolarHBondContact O-CA 2.97Å; V58-G63 PolarHBondContact O-N 2.81Å; V58-Q173 HydrophobicContact CG1-CB 4.02Å; V58-L174 HydrophobicContact CG1-CD2 4.22Å; V58-L174 HydrophobicContact CG2-CD2 3.82Å; V58-L174 HydrophobicContact CG2-CG 4.15Å; V58-L177 HydrophobicContact CG1-CD2 4.24Å
59	N	95.1	Very high	94.3	Very high	48 Å²	48	42 Å²	42	26%	0.257	22%	0.223	S	C	.	.	I	π-helix	trans	-85.3	-52.5	-172.3	-72.2	-32.4	0	0	0	112.7	I54 G63 N64 R67	I54-N59 VanDerWaalsContact CG2-ND2 3.34Å; I54-N59 WeakPolarHBondContact CG2-ND2 3.33Å; I54-N59 WeakPolarHBondContact O-CB 3.39Å; I54-N59 PolarHBondContact O-N 3.4Å; I54-N59 PolarHBondContact O-ND2 3.19Å; N59-G63 CarbonylContact O-C 3.59Å; N59-G63 WeakPolarHBondContact O-CA 3.38Å; N59-N64 PolarHBondContact O-N 3.26Å; N59-R67 PolarHBondContact O-NH2 2.85Å
60	D	93.6	Very high	93.9	Very high	75 Å²	75	42.6 Å²	42.6	40%	0.401	23%	0.225	S	C	.	.	I	π-helix	trans	-76.8	-36.7	-175.4	-171.1	50.2	0	0	0	112.8	M1 D55 N64	M1-D60 WeakPolarHBondContact CE-OD1 3.22Å; M1-D60 VanDerWaalsContact CE-OD2 3.31Å; M1-D60 WeakPolarHBondContact CE-OD2 3.49Å; D55-D60 VanDerWaalsContact O-CB 3.25Å; D55-D60 WeakPolarHBondContact O-CB 3.47Å; D55-D60 PolarHBondContact O-N 3.16Å; D60-N64 WeakPolarHBondContact O-CB 3.48Å; D60-N64 PolarHBondContact O-ND2 3.03Å; D60-N64 PolarHBondContact OD1-ND2 2.9Å; D60-N64 VanDerWaalsContact OD1-ND2 3.08Å
61	F	93.4	Very high	93.3	Very high	32 Å²	32	43 Å²	43	14%	0.14	23%	0.227	C	C	.	.	I	π-helix	trans	-91.1	-74.1	178.3	-169.2	-84.3	0	0	0	112.6	L4 W16 F18 L56 M57 G63 N64 I65	L4-F61 HydrophobicContact CD1-CE2 4.23Å; L4-F61 HydrophobicContact CD2-CE2 3.64Å; L4-F61 HydrophobicContact CD2-CZ 3.47Å; L4-F61 VanDerWaalsContact CD2-CZ 3.47Å; L4-F61 HydrophobicContact CG-CE2 4.37Å; W16-F61 AromaticContact CD1-CE1 3.69Å; W16-F61 HydrophobicContact CD2-CE1 4.01Å; W16-F61 AromaticContact CD2-CZ 3.97Å; W16-F61 HydrophobicContact CD2-CZ 3.97Å; W16-F61 AromaticContact CE2-CE1 3.83Å; W16-F61 AromaticContact CE2-CZ 3.97Å; W16-F61 HydrophobicContact CE3-CZ 4.29Å; W16-F61 AromaticContact CG-CE1 3.95Å; W16-F61 HydrophobicContact CG-CE1 3.95Å; W16-F61 HydrophobicContact CG-CZ 4.29Å; W16-F61 HydrophobicContact CH2-CZ 4.5Å; W16-F61 HydrophobicContact CZ2-CE1 4.41Å; W16-F61 HydrophobicContact CZ2-CZ 4.26Å; W16-F61 AromaticContact NE1-CE1 3.65Å; F18-F61 HydrophobicContact CD1-CZ 4.32Å; F18-F61 AromaticContact CE1-CD1 3.7Å; F18-F61 HydrophobicContact CE1-CD1 3.7Å; F18-F61 HydrophobicContact CE1-CD2 4.29Å; F18-F61 AromaticContact CE1-CE1 3.28Å; F18-F61 HydrophobicContact CE1-CE1 3.28Å; F18-F61 AromaticContact CE1-CE2 3.89Å; F18-F61 HydrophobicContact CE1-CE2 3.89Å; F18-F61 HydrophobicContact CE1-CG 4.18Å; F18-F61 AromaticContact CE1-CZ 3.36Å; F18-F61 HydrophobicContact CE1-CZ 3.36Å; F18-F61 HydrophobicContact CE2-CD1 4.47Å; F18-F61 HydrophobicContact CZ-CB 4.49Å; F18-F61 AromaticContact CZ-CD1 3.34Å; F18-F61 HydrophobicContact CZ-CD1 3.34Å; F18-F61 HydrophobicContact CZ-CD2 4.24Å; F18-F61 AromaticContact CZ-CE1 3.45Å; F18-F61 HydrophobicContact CZ-CE1 3.45Å; F18-F61 VanDerWaalsContact CZ-CE1 3.45Å; F18-F61 HydrophobicContact CZ-CE2 4.3Å; F18-F61 AromaticContact CZ-CG 3.76Å; F18-F61 HydrophobicContact CZ-CG 3.76Å; F18-F61 AromaticContact CZ-CZ 3.93Å; F18-F61 HydrophobicContact CZ-CZ 3.93Å; L56-F61 PolarHBondContact O-N 3.44Å; M57-F61 WeakPolarHBondContact O-CB 3.4Å; F61-G63 VanDerWaalsContact C-N 3.3Å; F61-G63 PolarHBondContact O-N 3.44Å; F61-N64 PolarHBondContact O-N 3.28Å; F61-I65 HydrophobicContact CD1-CD1 4.23Å; F61-I65 HydrophobicContact CE1-CD1 3.73Å; F61-I65 HydrophobicContact CZ-CD1 4.12Å; F61-I65 PolarHBondContact O-N 3.08Å
62	L	95.3	Very high	92.5	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.242	C	C	.	.	I	π-helix	trans	-62.9	-43.3	-173.1	-60.1	172.6	0	0	0	110.3	I19 M57 N64 I65 I66 T123 I127 L174 L177	I19-L62 HydrophobicContact CD1-CD2 4.44Å; M57-L62 HydrophobicContact CE-CD1 4Å; M57-L62 HydrophobicContact CG-CD1 4.31Å; M57-L62 WeakPolarHBondContact O-CG 3.4Å; M57-L62 PolarHBondContact O-N 3.47Å; L62-N64 PolarHBondContact O-N 3.44Å; L62-I65 PolarHBondContact O-N 3.41Å; L62-I66 WeakPolarHBondContact O-CG1 3.29Å; L62-I66 PolarHBondContact O-N 3.45Å; L62-T123 HydrophobicContact CB-CG2 4.04Å; L62-T123 HydrophobicContact CD2-CG2 3.74Å; L62-I127 HydrophobicContact CD1-CG1 4.06Å; L62-L174 HydrophobicContact CD1-CD2 4.09Å; L62-L177 HydrophobicContact CB-CD2 3.68Å
63	G	94.9	Very high	91.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-41.5	-179.1	0	0	0	0	0	113.1	V58 N59 F61 I65 I66 R67	V58-G63 VanDerWaalsContact O-CA 3.27Å; V58-G63 WeakPolarHBondContact O-CA 2.97Å; V58-G63 PolarHBondContact O-N 2.81Å; N59-G63 CarbonylContact O-C 3.59Å; N59-G63 WeakPolarHBondContact O-CA 3.38Å; F61-G63 VanDerWaalsContact C-N 3.3Å; F61-G63 PolarHBondContact O-N 3.44Å; G63-I65 VanDerWaalsContact C-N 3.35Å; G63-I65 PolarHBondContact O-N 2.96Å; G63-I66 PolarHBondContact O-N 2.85Å; G63-R67 VanDerWaalsContact C-CZ 3.4Å; G63-R67 VanDerWaalsContact O-CB 3.26Å; G63-R67 WeakPolarHBondContact O-CB 3.4Å; G63-R67 VanDerWaalsContact O-CG 3.23Å; G63-R67 WeakPolarHBondContact O-CG 3.15Å; G63-R67 PolarHBondContact O-N 3.24Å; G63-R67 PolarHBondContact O-NE 3.47Å
64	N	93.9	Very high	89.9	Confident	53 Å²	53	44 Å²	44	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-41.5	176.8	-82.8	-22.1	0	0	0	111.5	N59 D60 F61 L62 R67 T68	N59-N64 PolarHBondContact O-N 3.26Å; D60-N64 WeakPolarHBondContact O-CB 3.48Å; D60-N64 PolarHBondContact O-ND2 3.03Å; D60-N64 PolarHBondContact OD1-ND2 2.9Å; D60-N64 VanDerWaalsContact OD1-ND2 3.08Å; F61-N64 PolarHBondContact O-N 3.28Å; L62-N64 PolarHBondContact O-N 3.44Å; N64-R67 PolarHBondContact O-N 3.29Å; N64-R67 PolarHBondContact OD1-NH2 3.11Å; N64-T68 WeakPolarHBondContact O-CG2 3.09Å; N64-T68 PolarHBondContact O-N 3.38Å
65	I	92.5	Very high	88.4	Confident	27 Å²	27	44.8 Å²	44.8	14%	0.138	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-47.9	177.8	-60.6	169.1	0	0	0	110.5	W16 F61 L62 G63 R67 T68 H119 T123	W16-I65 HydrophobicContact CZ2-CD1 3.85Å; F61-I65 HydrophobicContact CD1-CD1 4.23Å; F61-I65 HydrophobicContact CE1-CD1 3.73Å; F61-I65 HydrophobicContact CZ-CD1 4.12Å; F61-I65 PolarHBondContact O-N 3.08Å; L62-I65 PolarHBondContact O-N 3.41Å; G63-I65 VanDerWaalsContact C-N 3.35Å; G63-I65 PolarHBondContact O-N 2.96Å; I65-R67 PolarHBondContact O-N 2.89Å; I65-T68 PolarHBondContact O-N 3.01Å; I65-T68 PolarHBondContact O-OG1 3.13Å; I65-H119 HydrophobicContact CG2-CB 4.45Å; I65-T123 HydrophobicContact CB-CG2 4.22Å; I65-T123 VanDerWaalsContact CD1-OG1 3.31Å; I65-T123 WeakPolarHBondContact CD1-OG1 3.31Å; I65-T123 HydrophobicContact CG2-CG2 4.33Å; I65-T123 WeakPolarHBondContact CG2-OG1 3.43Å
66	I	93.3	Very high	87.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-42.2	179.2	-62.9	-50.1	0	0	0	111.7	L62 G63 T68 G69 F120 T123 I127 L177 A181	L62-I66 WeakPolarHBondContact O-CG1 3.29Å; L62-I66 PolarHBondContact O-N 3.45Å; G63-I66 PolarHBondContact O-N 2.85Å; I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.31Å; I66-G69 WeakPolarHBondContact O-CA 3.31Å; I66-G69 PolarHBondContact O-N 2.86Å; I66-F120 HydrophobicContact CD1-CD2 3.99Å; I66-F120 HydrophobicContact CD1-CE1 4.5Å; I66-F120 HydrophobicContact CD1-CE2 3.74Å; I66-F120 HydrophobicContact CD1-CG 4.49Å; I66-F120 HydrophobicContact CD1-CZ 4.02Å; I66-F120 HydrophobicContact CG2-CE2 4.44Å; I66-T123 HydrophobicContact CD1-CG2 3.72Å; I66-T123 HydrophobicContact CG1-CG2 3.9Å; I66-I127 HydrophobicContact CD1-CD1 4.47Å; I66-I127 HydrophobicContact CG1-CD1 4.22Å; I66-L177 HydrophobicContact CB-CD1 3.74Å; I66-L177 HydrophobicContact CB-CG 4.3Å; I66-L177 HydrophobicContact CG1-CD1 3.97Å; I66-L177 HydrophobicContact CG1-CD2 4.26Å; I66-L177 HydrophobicContact CG1-CG 3.96Å; I66-L177 HydrophobicContact CG2-CD1 3.82Å; I66-L177 HydrophobicContact CG2-CG 4.45Å; I66-A181 HydrophobicContact CD1-CB 3.7Å; I66-A181 HydrophobicContact CG1-CB 4.17Å; I66-A181 HydrophobicContact CG2-CB 3.71Å
67	R	92.3	Very high	86	Confident	132 Å²	132	43.1 Å²	43.1	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-65.7	-27.7	177.5	-74.3	-172.9	-63.5	-91	3.6	113.4	N59 G63 N64 I65 G69	N59-R67 PolarHBondContact O-NH2 2.85Å; G63-R67 VanDerWaalsContact C-CZ 3.4Å; G63-R67 VanDerWaalsContact O-CB 3.26Å; G63-R67 WeakPolarHBondContact O-CB 3.4Å; G63-R67 VanDerWaalsContact O-CG 3.23Å; G63-R67 WeakPolarHBondContact O-CG 3.15Å; G63-R67 PolarHBondContact O-N 3.24Å; G63-R67 PolarHBondContact O-NE 3.47Å; N64-R67 PolarHBondContact O-N 3.29Å; N64-R67 PolarHBondContact OD1-NH2 3.11Å; I65-R67 PolarHBondContact O-N 2.89Å; R67-G69 PolarHBondContact O-N 3.05Å
68	T	90.2	Very high	84.5	Confident	118 Å²	118	43.5 Å²	43.5	72%	0.724	24%	0.243	S	C	*	.	H	α-helix	trans	-65.9	-16.3	170.3	66.3	0	0	0	0	112.6	N64 I65 I66	N64-T68 WeakPolarHBondContact O-CG2 3.09Å; N64-T68 PolarHBondContact O-N 3.38Å; I65-T68 PolarHBondContact O-N 3.01Å; I65-T68 PolarHBondContact O-OG1 3.13Å; I66-T68 VanDerWaalsContact C-N 3.28Å; I66-T68 PolarHBondContact O-N 3.31Å
69	G	86.6	Confident	83	Confident	13 Å²	13	49.9 Å²	49.9	13%	0.134	27%	0.268	C	S	.	.			trans	78.2	168.9	173.2	0	0	0	0	0	113.3	I66 R67 P71	I66-G69 WeakPolarHBondContact O-CA 3.31Å; I66-G69 PolarHBondContact O-N 2.86Å; R67-G69 PolarHBondContact O-N 3.05Å; G69-P71 WeakPolarHBondContact O-CD 3.33Å
70	F	86.8	Confident	81.7	Confident	20 Å²	20	49.8 Å²	49.8	9%	0.088	27%	0.271	C	S	.	.			trans	-79.7	121.6	172.3	-169.3	-97.8	0	0	0	110	S72 W74 R117 F120 L121 L185 V189	F70-S72 PolarHBondContact O-N 2.94Å; F70-W74 HydrophobicContact CE1-CB 4.17Å; F70-W74 HydrophobicContact CE1-CG 4.05Å; F70-R117 HydrophobicContact CD2-CG 4.48Å; F70-R117 HydrophobicContact CE1-CG 4.21Å; F70-R117 HydrophobicContact CE2-CB 3.83Å; F70-R117 HydrophobicContact CE2-CG 3.89Å; F70-R117 HydrophobicContact CZ-CB 4.03Å; F70-R117 HydrophobicContact CZ-CG 3.74Å; F70-F120 HydrophobicContact CB-CD1 4.39Å; F70-F120 HydrophobicContact CB-CD2 4.44Å; F70-F120 HydrophobicContact CB-CE1 4.33Å; F70-F120 HydrophobicContact CB-CE2 4.38Å; F70-F120 HydrophobicContact CB-CG 4.44Å; F70-F120 HydrophobicContact CB-CZ 4.32Å; F70-F120 HydrophobicContact CD2-CB 4.19Å; F70-F120 AromaticContact CD2-CD1 3.66Å; F70-F120 HydrophobicContact CD2-CD1 3.66Å; F70-F120 HydrophobicContact CD2-CE1 4.22Å; F70-F120 AromaticContact CD2-CG 3.95Å; F70-F120 HydrophobicContact CD2-CG 3.95Å; F70-L121 HydrophobicContact CE2-CD1 4.47Å; F70-L121 HydrophobicContact CE2-CD2 4.3Å; F70-L121 HydrophobicContact CE2-CG 4.24Å; F70-L185 HydrophobicContact CB-CD2 3.93Å; F70-L185 HydrophobicContact CD1-CD2 4.18Å; F70-L185 HydrophobicContact CD2-CD2 3.59Å; F70-L185 HydrophobicContact CE2-CD2 4.08Å; F70-L185 HydrophobicContact CG-CD2 3.63Å; F70-V189 HydrophobicContact CD1-CG2 3.8Å; F70-V189 HydrophobicContact CE1-CG2 3.81Å
71	P	83.6	Confident	80.4	Confident	22 Å²	22	51.2 Å²	51.2	14%	0.143	27%	0.272	C	S	.	.			trans	-59	128.5	-178	-24.8	31.9	0	0	0	113.3	G69 N113 A116 R117	G69-P71 WeakPolarHBondContact O-CD 3.33Å; P71-N113 HydrophobicContact CB-CB 3.55Å; P71-N113 HydrophobicContact CG-CB 4.04Å; P71-A116 HydrophobicContact CG-CB 3.68Å; P71-R117 HydrophobicContact CB-CG 4.06Å; P71-R117 HydrophobicContact CG-CG 3.86Å; P71-R117 PolarHBondContact O-NE 3.15Å
72	S	77.4	Confident	78.9	Confident	95 Å²	95	52.9 Å²	52.9	66%	0.664	29%	0.285	S	S	*	.	S	Bend	trans	-68.1	174.8	177.7	65.6	0	0	0	0	112.8	F70 W74 R117	F70-S72 PolarHBondContact O-N 2.94Å; S72-W74 PolarHBondContact O-N 3.06Å; S72-R117 PolarHBondContact O-NH2 2.98Å
73	G	69.7	Low	77.4	Confident	40 Å²	40	58 Å²	58	41%	0.412	31%	0.308	S	S	.	.			trans	74.7	6.6	177.9	0	0	0	0	0	115	V75 Q76 D77	G73-V75 VanDerWaalsContact C-N 3.25Å; G73-V75 PolarHBondContact O-N 2.69Å; G73-Q76 WeakPolarHBondContact O-CB 3.46Å; G73-Q76 PolarHBondContact O-N 3.17Å; G73-D77 PolarHBondContact O-N 2.83Å
74	W	70.7	Confident	76	Confident	20 Å²	20	63.1 Å²	63.1	8%	0.076	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-36	-176.9	80.6	-83.8	0	0	0	113.3	F70 S72 D77 A78 R117 V189 Q193 F233 P236	F70-W74 HydrophobicContact CE1-CB 4.17Å; F70-W74 HydrophobicContact CE1-CG 4.05Å; S72-W74 PolarHBondContact O-N 3.06Å; W74-D77 PolarHBondContact O-N 2.97Å; W74-A78 WeakPolarHBondContact O-CB 3.01Å; W74-A78 PolarHBondContact O-N 2.94Å; W74-R117 VanDerWaalsContact CA-CZ 3.43Å; W74-R117 VanDerWaalsContact CA-NH2 3.3Å; W74-R117 VanDerWaalsContact CB-CZ 3.49Å; W74-V189 VanDerWaalsContact CE2-CG1 3.46Å; W74-V189 HydrophobicContact CH2-CG1 4.25Å; W74-V189 HydrophobicContact CZ2-CB 4.47Å; W74-V189 HydrophobicContact CZ2-CG1 3.24Å; W74-Q193 HydrophobicContact CZ2-CG 4.17Å; W74-F233 AromaticContact CH2-CD2 3.69Å; W74-F233 HydrophobicContact CH2-CD2 3.69Å; W74-F233 AromaticContact CH2-CE2 3.97Å; W74-F233 HydrophobicContact CH2-CE2 3.97Å; W74-F233 AromaticContact CZ2-CD2 3.82Å; W74-F233 HydrophobicContact CZ2-CD2 3.82Å; W74-F233 AromaticContact CZ2-CE2 3.68Å; W74-F233 HydrophobicContact CZ2-CE2 3.68Å; W74-P236 HydrophobicContact CE3-CG 4.12Å; W74-P236 HydrophobicContact CH2-CG 4.28Å; W74-P236 HydrophobicContact CZ3-CG 3.52Å
75	V	65.7	Low	74.4	Confident	38 Å²	38	63 Å²	63	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-43.7	176.9	-178.7	0	0	0	0	110.4	G73 D77 A78 Y79 Q193	G73-V75 VanDerWaalsContact C-N 3.25Å; G73-V75 PolarHBondContact O-N 2.69Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 2.95Å; V75-A78 PolarHBondContact O-N 3.4Å; V75-Y79 VanDerWaalsContact O-CB 3.23Å; V75-Y79 WeakPolarHBondContact O-CB 3.39Å; V75-Y79 PolarHBondContact O-N 3Å; V75-Q193 VanDerWaalsContact CG1-NE2 3.33Å; V75-Q193 HydrophobicContact CG2-CG 4.02Å
76	Q	68.5	Low	72.7	Confident	134 Å²	134	66.2 Å²	66.2	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-64.7	-39.8	179.3	-167.6	66.1	21.1	0	0	110.5	G73 S80	G73-Q76 WeakPolarHBondContact O-CB 3.46Å; G73-Q76 PolarHBondContact O-N 3.17Å; Q76-S80 VanDerWaalsContact O-CB 3.26Å; Q76-S80 WeakPolarHBondContact O-CB 3.32Å; Q76-S80 PolarHBondContact O-N 2.83Å; Q76-S80 PolarHBondContact O-OG 2.92Å
77	D	70.2	Confident	70.9	Confident	30 Å²	30	69.5 Å²	69.5	16%	0.16	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-44.1	174.9	-65.1	-20.7	0	0	0	111.6	G73 W74 V75 S80 Y81 I110 R117	G73-D77 PolarHBondContact O-N 2.83Å; W74-D77 PolarHBondContact O-N 2.97Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 2.95Å; D77-S80 WeakPolarHBondContact CA-OG 3.38Å; D77-S80 PolarHBondContact O-OG 2.97Å; D77-Y81 WeakPolarHBondContact O-CB 3.49Å; D77-Y81 PolarHBondContact O-N 2.71Å; D77-I110 HydrophobicContact CB-CG2 4.33Å; D77-R117 IonicContact OD2-CZ 2.7Å; D77-R117 VanDerWaalsContact OD2-CZ 3.25Å; D77-R117 IonicContact OD2-NH1 2.65Å; D77-R117 PolarHBondContact OD2-NH1 3.34Å; D77-R117 IonicContact OD2-NH2 2.85Å; D77-R117 PolarHBondContact OD2-NH2 2.89Å
78	A	64.6	Low	68.9	Low	15 Å²	15	67.9 Å²	67.9	12%	0.124	39%	0.391	C	S	.	.	H	α-helix	trans	-64.3	-45.7	177.1	0	0	0	0	0	111.8	W74 V75 Y81 V82 F107	W74-A78 WeakPolarHBondContact O-CB 3.01Å; W74-A78 PolarHBondContact O-N 2.94Å; V75-A78 PolarHBondContact O-N 3.4Å; A78-Y81 PolarHBondContact O-N 3.24Å; A78-V82 WeakPolarHBondContact O-CG2 3.14Å; A78-V82 PolarHBondContact O-N 3.31Å; A78-F107 HydrophobicContact CB-CZ 3.88Å
79	Y	65	Low	67.1	Low	136 Å²	136	65.6 Å²	65.6	53%	0.533	38%	0.384	S	S	.	.	H	α-helix	trans	-65.6	-44.9	179.9	-166.3	-96.3	0	0	0	111.5	V75 Y81 V82 Q83	V75-Y79 VanDerWaalsContact O-CB 3.23Å; V75-Y79 WeakPolarHBondContact O-CB 3.39Å; V75-Y79 PolarHBondContact O-N 3Å; Y79-Y81 VanDerWaalsContact C-N 3.3Å; Y79-Y81 PolarHBondContact O-N 3.27Å; Y79-V82 PolarHBondContact O-N 3.08Å; Y79-Q83 HydrophobicContact CD1-CG 4Å; Y79-Q83 VanDerWaalsContact CE1-CD 3.41Å; Y79-Q83 HydrophobicContact CE1-CG 3.71Å; Y79-Q83 WeakPolarHBondContact O-CG 3.41Å; Y79-Q83 PolarHBondContact O-N 3.28Å; Y79-Q83 PolarHBondContact OH-NE2 3.27Å
80	S	68.3	Low	64.9	Low	46 Å²	46	68.5 Å²	68.5	32%	0.322	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-35.9	175.5	58.5	0	0	0	0	112.6	Q76 D77 N84	Q76-S80 VanDerWaalsContact O-CB 3.26Å; Q76-S80 WeakPolarHBondContact O-CB 3.32Å; Q76-S80 PolarHBondContact O-N 2.83Å; Q76-S80 PolarHBondContact O-OG 2.92Å; D77-S80 WeakPolarHBondContact CA-OG 3.38Å; D77-S80 PolarHBondContact O-OG 2.97Å; S80-N84 VanDerWaalsContact O-CB 3.3Å; S80-N84 WeakPolarHBondContact O-CB 3.48Å; S80-N84 PolarHBondContact O-N 3.4Å; S80-N84 PolarHBondContact O-ND2 3.01Å
81	Y	65.8	Low	62.7	Low	104 Å²	104	71.5 Å²	71.5	41%	0.408	44%	0.438	S	S	.	.	H	α-helix	trans	-65.8	-45.2	173.7	179.9	-94.5	0	0	0	112.8	D77 A78 Y79 N84 S85 I110	D77-Y81 WeakPolarHBondContact O-CB 3.49Å; D77-Y81 PolarHBondContact O-N 2.71Å; A78-Y81 PolarHBondContact O-N 3.24Å; Y79-Y81 VanDerWaalsContact C-N 3.3Å; Y79-Y81 PolarHBondContact O-N 3.27Å; Y81-N84 PolarHBondContact O-N 2.99Å; Y81-S85 WeakPolarHBondContact O-CB 3.31Å; Y81-S85 PolarHBondContact O-N 2.81Å; Y81-S85 PolarHBondContact O-OG 2.85Å; Y81-I110 HydrophobicContact CD1-CD1 3.62Å; Y81-I110 HydrophobicContact CD2-CD1 4.02Å; Y81-I110 HydrophobicContact CD2-CG1 4.14Å; Y81-I110 HydrophobicContact CD2-CG2 4.19Å; Y81-I110 HydrophobicContact CE1-CD1 3.95Å; Y81-I110 HydrophobicContact CE2-CD1 4.33Å; Y81-I110 HydrophobicContact CE2-CG1 4.43Å; Y81-I110 HydrophobicContact CG-CD1 3.65Å; Y81-I110 HydrophobicContact CG-CG1 4.22Å; Y81-I110 HydrophobicContact CG-CG2 4.09Å
82	V	62.3	Low	60.5	Low	68 Å²	68	77.6 Å²	77.6	41%	0.412	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-45.6	176.1	173.6	0	0	0	0	110.6	A78 Y79 N84 S85 V86	A78-V82 WeakPolarHBondContact O-CG2 3.14Å; A78-V82 PolarHBondContact O-N 3.31Å; Y79-V82 PolarHBondContact O-N 3.08Å; V82-N84 PolarHBondContact O-N 2.95Å; V82-S85 WeakPolarHBondContact CA-OG 3.47Å; V82-S85 PolarHBondContact O-N 2.78Å; V82-S85 PolarHBondContact O-OG 3.15Å; V82-V86 HydrophobicContact CG1-CG2 4.19Å; V82-V86 WeakPolarHBondContact O-CB 3.42Å; V82-V86 VanDerWaalsContact O-CG2 3.27Å; V82-V86 WeakPolarHBondContact O-CG2 3.35Å; V82-V86 PolarHBondContact O-N 3.48Å
83	Q	63.6	Low	58.4	Low	106 Å²	106	77.9 Å²	77.9	50%	0.495	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-43	177.2	-72.6	-146.6	-28.3	0	0	112.5	Y79 A87	Y79-Q83 HydrophobicContact CD1-CG 4Å; Y79-Q83 VanDerWaalsContact CE1-CD 3.41Å; Y79-Q83 HydrophobicContact CE1-CG 3.71Å; Y79-Q83 WeakPolarHBondContact O-CG 3.41Å; Y79-Q83 PolarHBondContact O-N 3.28Å; Y79-Q83 PolarHBondContact OH-NE2 3.27Å; Q83-A87 WeakPolarHBondContact O-CB 3.01Å; Q83-A87 PolarHBondContact O-N 2.9Å
84	N	65.8	Low	56.8	Low	108 Å²	108	81 Å²	81	58%	0.578	49%	0.487	S	S	*	.	H	α-helix	trans	-66.2	-40.7	177.4	-74.8	-13.7	0	0	0	112.1	S80 Y81 V82 A87 V88	S80-N84 VanDerWaalsContact O-CB 3.3Å; S80-N84 WeakPolarHBondContact O-CB 3.48Å; S80-N84 PolarHBondContact O-N 3.4Å; S80-N84 PolarHBondContact O-ND2 3.01Å; Y81-N84 PolarHBondContact O-N 2.99Å; V82-N84 PolarHBondContact O-N 2.95Å; N84-A87 PolarHBondContact O-N 3.2Å; N84-V88 WeakPolarHBondContact O-CB 3.38Å; N84-V88 VanDerWaalsContact O-CG2 3.22Å; N84-V88 WeakPolarHBondContact O-CG2 3.37Å; N84-V88 PolarHBondContact O-N 3.08Å
85	S	60.1	Low	54.9	Low	52 Å²	52	85.4 Å²	85.4	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-69.1	-39.4	178.7	53	0	0	0	0	112.6	Y81 V82 V88 A89	Y81-S85 WeakPolarHBondContact O-CB 3.31Å; Y81-S85 PolarHBondContact O-N 2.81Å; Y81-S85 PolarHBondContact O-OG 2.85Å; V82-S85 WeakPolarHBondContact CA-OG 3.47Å; V82-S85 PolarHBondContact O-N 2.78Å; V82-S85 PolarHBondContact O-OG 3.15Å; S85-V88 PolarHBondContact O-N 2.76Å; S85-A89 WeakPolarHBondContact O-CB 3.12Å; S85-A89 PolarHBondContact O-N 2.99Å
86	V	56.4	Low	53.3	Low	94 Å²	94	89.7 Å²	89.7	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-67.3	-41.4	173.7	175.4	0	0	0	0	111.3	V82 V88 A89 G90	V82-V86 HydrophobicContact CG1-CG2 4.19Å; V82-V86 WeakPolarHBondContact O-CB 3.42Å; V82-V86 VanDerWaalsContact O-CG2 3.27Å; V82-V86 WeakPolarHBondContact O-CG2 3.35Å; V82-V86 PolarHBondContact O-N 3.48Å; V86-V88 VanDerWaalsContact C-N 3.31Å; V86-V88 PolarHBondContact O-N 3.17Å; V86-A89 PolarHBondContact O-N 2.97Å; V86-G90 PolarHBondContact O-N 3.31Å
87	A	55.8	Low	51.3	Low	68 Å²	68	88.2 Å²	88.2	56%	0.562	56%	0.556	S	S	*	*	H	α-helix	trans	-61.8	-38.4	175.9	0	0	0	0	0	112.3	Q83 N84	Q83-A87 WeakPolarHBondContact O-CB 3.01Å; Q83-A87 PolarHBondContact O-N 2.9Å; N84-A87 PolarHBondContact O-N 3.2Å
88	V	50.9	Low	49.7	Very low	98 Å²	98	94.2 Å²	94.2	59%	0.594	59%	0.587	S	S	*	*	H	α-helix	trans	-71.5	-40.6	175.5	173.2	0	0	0	0	111.3	N84 S85 V86 G90 S91	N84-V88 WeakPolarHBondContact O-CB 3.38Å; N84-V88 VanDerWaalsContact O-CG2 3.22Å; N84-V88 WeakPolarHBondContact O-CG2 3.37Å; N84-V88 PolarHBondContact O-N 3.08Å; S85-V88 PolarHBondContact O-N 2.76Å; V86-V88 VanDerWaalsContact C-N 3.31Å; V86-V88 PolarHBondContact O-N 3.17Å; V88-G90 VanDerWaalsContact C-N 3.28Å; V88-G90 PolarHBondContact O-N 3.32Å; V88-S91 PolarHBondContact O-N 2.83Å; V88-S91 PolarHBondContact O-OG 2.84Å
89	A	50.5	Low	48.1	Very low	70 Å²	70	99.1 Å²	99.1	58%	0.579	62%	0.615	S	S	*	*	H	α-helix	trans	-62.5	-34.5	176	0	0	0	0	0	112.5	S85 V86 S91 L92	S85-A89 WeakPolarHBondContact O-CB 3.12Å; S85-A89 PolarHBondContact O-N 2.99Å; V86-A89 PolarHBondContact O-N 2.97Å; A89-S91 PolarHBondContact O-N 2.88Å; A89-L92 PolarHBondContact O-N 3.24Å
90	G	41.5	Very low	46.3	Very low	75 Å²	75	99.9 Å²	99.9	77%	0.773	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-15.9	173.5	0	0	0	0	0	114.6	V86 V88	V86-G90 PolarHBondContact O-N 3.31Å; V88-G90 VanDerWaalsContact C-N 3.28Å; V88-G90 PolarHBondContact O-N 3.32Å
91	S	40.3	Very low	44.6	Very low	82 Å²	82	102.4 Å²	102.4	57%	0.573	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-5.4	177.8	80	0	0	0	0	114.4	V88 A89 S93	V88-S91 PolarHBondContact O-N 2.83Å; V88-S91 PolarHBondContact O-OG 2.84Å; A89-S91 PolarHBondContact O-N 2.88Å; S91-S93 PolarHBondContact O-N 3.42Å
92	L	36.6	Very low	43	Very low	151 Å²	151	102.1 Å²	102.1	79%	0.791	65%	0.652	S	S	*	*			trans	-86.4	84.3	-176.9	-142.9	74.2	0	0	0	111.6	A89	A89-L92 PolarHBondContact O-N 3.24Å
93	S	35.1	Very low	41.6	Very low	100 Å²	100	105 Å²	105	70%	0.699	67%	0.67	S	S	*	*			trans	-55.8	131.2	158.6	-59.3	0	0	0	0	110.2	S91	S91-S93 PolarHBondContact O-N 3.42Å
94	S	35.2	Very low	40.5	Very low	107 Å²	107	103.4 Å²	103.4	75%	0.748	67%	0.668	S	S	*	*	S	Bend	trans	48.3	94.3	155.4	58.3	0	0	0	0	117.9
95	S	31.2	Very low	39.3	Very low	111 Å²	111	103.5 Å²	103.5	78%	0.776	68%	0.677	S	S	*	*				-174.5	126.2	126.8	-82.7	0	0	0	0	111.2	S97	S95-S97 PolarHBondContact O-N 2.88Å; S95-S97 VanDerWaalsContact O-N 3.12Å
96	S	31	Very low	38.8	Very low	128 Å²	128	104.2 Å²	104.2	90%	0.895	68%	0.681	S	S	*	*			trans	-56.3	102.8	170.6	48.8	0	0	0	0	111.8
97	S	28.4	Very low	38.5	Very low	104 Å²	104	101 Å²	101	73%	0.727	66%	0.66	S	S	*	*			trans	-151	119	156.6	51.8	0	0	0	0	108.5	S95 V99	S95-S97 PolarHBondContact O-N 2.88Å; S95-S97 VanDerWaalsContact O-N 3.12Å; S97-V99 PolarHBondContact O-N 3.39Å; S97-V99 VanDerWaalsContact O-N 3.16Å
98	I	34.5	Very low	38.3	Very low	156 Å²	156	98.6 Å²	98.6	80%	0.8	64%	0.638	S	S	*	*			trans	-32.5	113.8	174.6	-65.6	155.2	0	0	0	110.7	N100	I98-N100 VanDerWaalsContact C-N 3.33Å; I98-N100 PolarHBondContact O-N 3.22Å
99	V	32.4	Very low	38.4	Very low	117 Å²	117	98.1 Å²	98.1	71%	0.709	63%	0.63	S	S	*	*			trans	8.6	72.2	152	-159.8	0	0	0	0	114.6	S97 V101	S97-V99 PolarHBondContact O-N 3.39Å; S97-V99 VanDerWaalsContact O-N 3.16Å; V99-V101 HydrophobicContact CG1-CB 4.46Å; V99-V101 HydrophobicContact CG1-CG2 3.42Å; V99-V101 VanDerWaalsContact CG1-CG2 3.42Å; V99-V101 PolarHBondContact O-N 3.34Å
100	N	27.8	Very low	38.9	Very low	152 Å²	152	96 Å²	96	81%	0.813	61%	0.609	S	S	*	*			trans	-74.4	79.7	148.2	-78.8	23.8	0	0	0	105	I98 P102	I98-N100 VanDerWaalsContact C-N 3.33Å; I98-N100 PolarHBondContact O-N 3.22Å; N100-P102 VanDerWaalsContact C-N 3.35Å; N100-P102 WeakPolarHBondContact O-CD 3.27Å
101	V	30.7	Very low	40.1	Very low	99 Å²	99	94 Å²	94	60%	0.6	59%	0.587	S	S	*	*			trans	-53.8	114.4	150.3	174.8	0	0	0	0	102.5	V99 T103	V99-V101 HydrophobicContact CG1-CB 4.46Å; V99-V101 HydrophobicContact CG1-CG2 3.42Å; V99-V101 VanDerWaalsContact CG1-CG2 3.42Å; V99-V101 PolarHBondContact O-N 3.34Å; V101-T103 VanDerWaalsContact C-N 3.32Å; V101-T103 PolarHBondContact O-N 2.98Å
102	P	32.4	Very low	41.7	Very low	98 Å²	98	95.5 Å²	95.5	64%	0.636	60%	0.596	S	S	*	*			trans	-54.1	111.9	172.3	-16.4	28.9	0	0	0	103.6	N100 V104	N100-P102 VanDerWaalsContact C-N 3.35Å; N100-P102 WeakPolarHBondContact O-CD 3.27Å; P102-V104 WeakPolarHBondContact O-CG2 3.48Å; P102-V104 PolarHBondContact O-N 3.31Å
103	T	33.7	Very low	43.8	Very low	128 Å²	128	91.8 Å²	91.8	79%	0.785	58%	0.577	S	S	*	*			trans	-54.6	101.5	169.6	35.6	0	0	0	0	103.8	V101 S105	V101-T103 VanDerWaalsContact C-N 3.32Å; V101-T103 PolarHBondContact O-N 2.98Å; T103-S105 PolarHBondContact O-N 3.09Å
104	V	39.6	Very low	45.9	Very low	74 Å²	74	87.7 Å²	87.7	45%	0.448	55%	0.548	S	S	.	.			trans	-71.5	74.7	-168.5	-172.6	0	0	0	0	106.4	P102 S106 F107	P102-V104 WeakPolarHBondContact O-CG2 3.48Å; P102-V104 PolarHBondContact O-N 3.31Å; V104-S106 PolarHBondContact O-N 3.3Å; V104-F107 HydrophobicContact CG1-CB 3.81Å; V104-F107 HydrophobicContact CG1-CD2 4.32Å
105	S	41.3	Very low	48.2	Very low	110 Å²	110	86.2 Å²	86.2	77%	0.769	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-2.2	-175.7	53	0	0	0	0	112	T103	T103-S105 PolarHBondContact O-N 3.09Å
106	S	50.4	Low	50.8	Low	66 Å²	66	82.9 Å²	82.9	46%	0.462	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.9	45.2	-175.2	-52.4	0	0	0	0	113.7	V104 N108 M109	V104-S106 PolarHBondContact O-N 3.3Å; S106-N108 PolarHBondContact O-N 3.2Å; S106-N108 VanDerWaalsContact O-N 3.15Å; S106-M109 WeakPolarHBondContact O-CB 3.33Å; S106-M109 PolarHBondContact O-N 3.28Å
107	F	48.6	Very low	53.4	Low	27 Å²	27	77.6 Å²	77.6	12%	0.118	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-55.2	-29.9	170.2	-171	-90.6	0	0	0	111.6	A78 V104 M109 I110 R235 P236	A78-F107 HydrophobicContact CB-CZ 3.88Å; V104-F107 HydrophobicContact CG1-CB 3.81Å; V104-F107 HydrophobicContact CG1-CD2 4.32Å; F107-M109 PolarHBondContact O-N 2.93Å; F107-M109 VanDerWaalsContact O-N 3.12Å; F107-I110 HydrophobicContact CD2-CD1 3.54Å; F107-I110 HydrophobicContact CE2-CD1 3.77Å; F107-I110 HydrophobicContact CG-CD1 3.99Å; F107-I110 HydrophobicContact CZ-CD1 4.39Å; F107-I110 WeakPolarHBondContact O-CD1 3.46Å; F107-I110 WeakPolarHBondContact O-CG1 3.48Å; F107-I110 PolarHBondContact O-N 2.86Å; F107-R235 HydrophobicContact CG-CG 4.48Å; F107-P236 HydrophobicContact CD1-CB 3.63Å; F107-P236 HydrophobicContact CD1-CG 4Å; F107-P236 HydrophobicContact CE1-CB 3.74Å; F107-P236 VanDerWaalsContact CE1-CD 3.46Å; F107-P236 HydrophobicContact CE1-CG 3.61Å
108	N	51.5	Low	56.1	Low	18 Å²	18	74.2 Å²	74.2	10%	0.096	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-67.7	-8	175.6	-67.3	36	0	0	0	113.8	S106 S114 Y118 L121 P236 V239	S106-N108 PolarHBondContact O-N 3.2Å; S106-N108 VanDerWaalsContact O-N 3.15Å; N108-S114 CarbonylContact O-C 3.57Å; N108-S114 WeakPolarHBondContact O-CB 3.45Å; N108-S114 VanDerWaalsContact O-O 3.14Å; N108-Y118 HydrophobicContact CB-CD2 4.31Å; N108-L121 VanDerWaalsContact ND2-CD1 3.32Å; N108-L121 WeakPolarHBondContact ND2-CD1 3.38Å; N108-P236 PolarHBondContact ND2-O 2.93Å; N108-P236 WeakPolarHBondContact OD1-CA 3.45Å; N108-P236 PolarHBondContact OD1-O 2.97Å; N108-V239 HydrophobicContact CB-CG2 4.38Å; N108-V239 WeakPolarHBondContact ND2-CB 3.14Å; N108-V239 WeakPolarHBondContact ND2-CG2 2.99Å
109	M	54.8	Low	58.7	Low	88 Å²	88	67.5 Å²	67.5	43%	0.433	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-101.5	17.2	-179.6	-62.4	-63.6	-80.2	0	0	113.5	S106 F107 S114	S106-M109 WeakPolarHBondContact O-CB 3.33Å; S106-M109 PolarHBondContact O-N 3.28Å; F107-M109 PolarHBondContact O-N 2.93Å; F107-M109 VanDerWaalsContact O-N 3.12Å; M109-S114 VanDerWaalsContact C-OG 3.31Å; M109-S114 WeakPolarHBondContact CA-OG 3.17Å; M109-S114 WeakPolarHBondContact O-CB 3.42Å; M109-S114 PolarHBondContact O-OG 3.04Å
110	I	60.3	Low	61.5	Low	26 Å²	26	62 Å²	62	13%	0.133	37%	0.374	C	S	.	.			trans	-91.1	128.7	179.8	-59.1	166.7	0	0	0	111.5	D77 Y81 F107 S114 R117	D77-I110 HydrophobicContact CB-CG2 4.33Å; Y81-I110 HydrophobicContact CD1-CD1 3.62Å; Y81-I110 HydrophobicContact CD2-CD1 4.02Å; Y81-I110 HydrophobicContact CD2-CG1 4.14Å; Y81-I110 HydrophobicContact CD2-CG2 4.19Å; Y81-I110 HydrophobicContact CE1-CD1 3.95Å; Y81-I110 HydrophobicContact CE2-CD1 4.33Å; Y81-I110 HydrophobicContact CE2-CG1 4.43Å; Y81-I110 HydrophobicContact CG-CD1 3.65Å; Y81-I110 HydrophobicContact CG-CG1 4.22Å; Y81-I110 HydrophobicContact CG-CG2 4.09Å; F107-I110 HydrophobicContact CD2-CD1 3.54Å; F107-I110 HydrophobicContact CE2-CD1 3.77Å; F107-I110 HydrophobicContact CG-CD1 3.99Å; F107-I110 HydrophobicContact CZ-CD1 4.39Å; F107-I110 WeakPolarHBondContact O-CD1 3.46Å; F107-I110 WeakPolarHBondContact O-CG1 3.48Å; F107-I110 PolarHBondContact O-N 2.86Å; I110-S114 WeakPolarHBondContact O-CB 3.48Å; I110-R117 PolarHBondContact O-NH1 2.8Å; I110-R117 VanDerWaalsContact O-NH1 3.08Å
111	G	67.5	Low	64.5	Low	31 Å²	31	54.9 Å²	54.9	32%	0.32	34%	0.336	S	S	.	.	S	Bend	trans	93.8	169.4	177.1	0	0	0	0	0	114.3	N113 S114	G111-N113 PolarHBondContact O-N 3.4Å; G111-S114 VanDerWaalsContact O-CB 3.27Å; G111-S114 WeakPolarHBondContact O-CB 3.36Å; G111-S114 PolarHBondContact O-N 3.07Å; G111-S114 PolarHBondContact O-OG 3.39Å
112	P	73.6	Confident	67.3	Low	115 Å²	115	50.1 Å²	50.1	75%	0.747	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.7	-176.1	26.5	-34.6	0	0	0	113.4
113	N	81.1	Confident	70.2	Confident	73 Å²	73	45.5 Å²	45.5	39%	0.39	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	14.2	-177	-64.1	-44.7	0	0	0	113.5	P71 G111 L115 A116 R117	P71-N113 HydrophobicContact CB-CB 3.55Å; P71-N113 HydrophobicContact CG-CB 4.04Å; G111-N113 PolarHBondContact O-N 3.4Å; N113-L115 PolarHBondContact O-N 2.82Å; N113-A116 PolarHBondContact O-N 3.22Å; N113-R117 WeakPolarHBondContact O-CG 3.25Å; N113-R117 PolarHBondContact O-N 3.3Å
114	S	78.6	Confident	73	Confident	14 Å²	14	39.4 Å²	39.4	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-39.9	-167.5	72.3	0	0	0	0	113.7	N108 M109 I110 G111 A116 R117 Y118	N108-S114 CarbonylContact O-C 3.57Å; N108-S114 WeakPolarHBondContact O-CB 3.45Å; N108-S114 VanDerWaalsContact O-O 3.14Å; M109-S114 VanDerWaalsContact C-OG 3.31Å; M109-S114 WeakPolarHBondContact CA-OG 3.17Å; M109-S114 WeakPolarHBondContact O-CB 3.42Å; M109-S114 PolarHBondContact O-OG 3.04Å; I110-S114 WeakPolarHBondContact O-CB 3.48Å; G111-S114 VanDerWaalsContact O-CB 3.27Å; G111-S114 WeakPolarHBondContact O-CB 3.36Å; G111-S114 PolarHBondContact O-N 3.07Å; G111-S114 PolarHBondContact O-OG 3.39Å; S114-A116 PolarHBondContact O-N 3.44Å; S114-R117 PolarHBondContact O-N 3.06Å; S114-Y118 WeakPolarHBondContact O-CB 3.43Å; S114-Y118 PolarHBondContact O-N 2.82Å
115	L	83.3	Confident	75.5	Confident	76 Å²	76	35.9 Å²	35.9	40%	0.398	22%	0.218	S	C	.	.	H	α-helix	trans	-61.7	-40.7	173.6	178.8	148.6	0	0	0	112.3	N113 Y118 H119	N113-L115 PolarHBondContact O-N 2.82Å; L115-Y118 PolarHBondContact O-N 3.47Å; L115-H119 WeakPolarHBondContact CD2-CD2 3.49Å; L115-H119 VanDerWaalsContact CD2-NE2 3.28Å; L115-H119 WeakPolarHBondContact CD2-NE2 3.23Å; L115-H119 PolarHBondContact O-CD2 3.39Å; L115-H119 VanDerWaalsContact O-CD2 3.24Å; L115-H119 PolarHBondContact O-N 3.21Å
116	A	86.5	Confident	78	Confident	41 Å²	41	30.7 Å²	30.7	34%	0.339	18%	0.182	S	C	.	.	H	α-helix	trans	-66.8	-39.8	177	0	0	0	0	0	111.8	P71 N113 S114 H119 F120	P71-A116 HydrophobicContact CG-CB 3.68Å; N113-A116 PolarHBondContact O-N 3.22Å; S114-A116 PolarHBondContact O-N 3.44Å; A116-H119 PolarHBondContact O-N 3.24Å; A116-F120 WeakPolarHBondContact O-CB 3.4Å; A116-F120 PolarHBondContact O-N 2.65Å
117	R	85	Confident	80.1	Confident	17 Å²	17	27.5 Å²	27.5	6%	0.064	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-44.4	172.5	-67.3	175.2	-170.3	141.5	5.8	111.4	F70 P71 S72 W74 D77 I110 N113 S114 F120 L121	F70-R117 HydrophobicContact CD2-CG 4.48Å; F70-R117 HydrophobicContact CE1-CG 4.21Å; F70-R117 HydrophobicContact CE2-CB 3.83Å; F70-R117 HydrophobicContact CE2-CG 3.89Å; F70-R117 HydrophobicContact CZ-CB 4.03Å; F70-R117 HydrophobicContact CZ-CG 3.74Å; P71-R117 HydrophobicContact CB-CG 4.06Å; P71-R117 HydrophobicContact CG-CG 3.86Å; P71-R117 PolarHBondContact O-NE 3.15Å; S72-R117 PolarHBondContact O-NH2 2.98Å; W74-R117 VanDerWaalsContact CA-CZ 3.43Å; W74-R117 VanDerWaalsContact CA-NH2 3.3Å; W74-R117 VanDerWaalsContact CB-CZ 3.49Å; D77-R117 IonicContact OD2-CZ 2.7Å; D77-R117 VanDerWaalsContact OD2-CZ 3.25Å; D77-R117 IonicContact OD2-NH1 2.65Å; D77-R117 PolarHBondContact OD2-NH1 3.34Å; D77-R117 IonicContact OD2-NH2 2.85Å; D77-R117 PolarHBondContact OD2-NH2 2.89Å; I110-R117 PolarHBondContact O-NH1 2.8Å; I110-R117 VanDerWaalsContact O-NH1 3.08Å; N113-R117 WeakPolarHBondContact O-CG 3.25Å; N113-R117 PolarHBondContact O-N 3.3Å; S114-R117 PolarHBondContact O-N 3.06Å; R117-F120 PolarHBondContact O-N 2.99Å; R117-L121 WeakPolarHBondContact O-CG 3.23Å; R117-L121 PolarHBondContact O-N 3.13Å; R117-L121 VanDerWaalsContact O-N 3.09Å
118	Y	85.5	Confident	82.2	Confident	32 Å²	32	26.9 Å²	26.9	13%	0.125	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-48.4	176.7	178.2	-108.8	0	0	0	111.4	V9 N108 S114 L115 F120 L121 V122 V239	V9-Y118 HydrophobicContact CB-CE1 4.33Å; V9-Y118 HydrophobicContact CG1-CE1 4.35Å; V9-Y118 WeakPolarHBondContact CG1-OH 3.33Å; V9-Y118 HydrophobicContact CG2-CE1 3.96Å; N108-Y118 HydrophobicContact CB-CD2 4.31Å; S114-Y118 WeakPolarHBondContact O-CB 3.43Å; S114-Y118 PolarHBondContact O-N 2.82Å; L115-Y118 PolarHBondContact O-N 3.47Å; Y118-F120 VanDerWaalsContact C-N 3.33Å; Y118-F120 PolarHBondContact O-N 2.67Å; Y118-L121 PolarHBondContact O-N 3.07Å; Y118-V122 HydrophobicContact CD1-CG2 4.18Å; Y118-V122 HydrophobicContact CD2-CG2 4.08Å; Y118-V122 HydrophobicContact CE1-CG2 3.8Å; Y118-V122 HydrophobicContact CE2-CG2 3.69Å; Y118-V122 HydrophobicContact CG-CG2 4.32Å; Y118-V122 WeakPolarHBondContact O-CB 3.31Å; Y118-V122 VanDerWaalsContact O-CG2 3.31Å; Y118-V122 WeakPolarHBondContact O-CG2 3.32Å; Y118-V122 PolarHBondContact O-N 2.89Å; Y118-V239 HydrophobicContact CD2-CG1 4.37Å; Y118-V239 HydrophobicContact CE2-CG1 4.14Å
119	H	89.4	Confident	84.2	Confident	16 Å²	16	26.8 Å²	26.8	7%	0.074	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-38.2	177.3	-71.1	-38.7	0	0	0	113.2	W16 I65 L115 A116 T123	W16-H119 HydrophobicContact CH2-CB 4.43Å; W16-H119 AromaticContact CH2-CE1 3.35Å; W16-H119 WeakPolarHBondContact CH2-CE1 3.42Å; W16-H119 AromaticContact CH2-CG 3.81Å; W16-H119 AromaticContact CH2-ND1 3.01Å; W16-H119 WeakPolarHBondContact CH2-ND1 3.38Å; W16-H119 HydrophobicContact CZ2-CB 4.05Å; W16-H119 AromaticContact CZ2-CG 3.94Å; W16-H119 AromaticContact CZ2-ND1 3.42Å; W16-H119 WeakPolarHBondContact CZ2-ND1 3.26Å; I65-H119 HydrophobicContact CG2-CB 4.45Å; L115-H119 WeakPolarHBondContact CD2-CD2 3.49Å; L115-H119 VanDerWaalsContact CD2-NE2 3.28Å; L115-H119 WeakPolarHBondContact CD2-NE2 3.23Å; L115-H119 PolarHBondContact O-CD2 3.39Å; L115-H119 VanDerWaalsContact O-CD2 3.24Å; L115-H119 PolarHBondContact O-N 3.21Å; A116-H119 PolarHBondContact O-N 3.24Å; H119-T123 VanDerWaalsContact O-CB 3.23Å; H119-T123 WeakPolarHBondContact O-CB 3.21Å; H119-T123 PolarHBondContact O-N 3.05Å; H119-T123 PolarHBondContact O-OG1 2.89Å
120	F	91	Very high	86.1	Confident	1 Å²	1	22.6 Å²	22.6	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-48	174.4	-173.6	-81.8	0	0	0	111.6	I66 F70 A116 R117 Y118 T123 L124 A181 H184 L185	I66-F120 HydrophobicContact CD1-CD2 3.99Å; I66-F120 HydrophobicContact CD1-CE1 4.5Å; I66-F120 HydrophobicContact CD1-CE2 3.74Å; I66-F120 HydrophobicContact CD1-CG 4.49Å; I66-F120 HydrophobicContact CD1-CZ 4.02Å; I66-F120 HydrophobicContact CG2-CE2 4.44Å; F70-F120 HydrophobicContact CB-CD1 4.39Å; F70-F120 HydrophobicContact CB-CD2 4.44Å; F70-F120 HydrophobicContact CB-CE1 4.33Å; F70-F120 HydrophobicContact CB-CE2 4.38Å; F70-F120 HydrophobicContact CB-CG 4.44Å; F70-F120 HydrophobicContact CB-CZ 4.32Å; F70-F120 HydrophobicContact CD2-CB 4.19Å; F70-F120 AromaticContact CD2-CD1 3.66Å; F70-F120 HydrophobicContact CD2-CD1 3.66Å; F70-F120 HydrophobicContact CD2-CE1 4.22Å; F70-F120 AromaticContact CD2-CG 3.95Å; F70-F120 HydrophobicContact CD2-CG 3.95Å; A116-F120 WeakPolarHBondContact O-CB 3.4Å; A116-F120 PolarHBondContact O-N 2.65Å; R117-F120 PolarHBondContact O-N 2.99Å; Y118-F120 VanDerWaalsContact C-N 3.33Å; Y118-F120 PolarHBondContact O-N 2.67Å; F120-T123 WeakPolarHBondContact O-CB 3.1Å; F120-T123 PolarHBondContact O-N 3.45Å; F120-L124 HydrophobicContact CD1-CD1 4.16Å; F120-L124 HydrophobicContact CE1-CD1 3.79Å; F120-L124 HydrophobicContact CE1-CG 4.27Å; F120-L124 PolarHBondContact O-N 3.02Å; F120-L124 VanDerWaalsContact O-N 3.07Å; F120-A181 HydrophobicContact CE1-CB 4.42Å; F120-A181 HydrophobicContact CZ-CB 3.88Å; F120-H184 HydrophobicContact CZ-CB 4.38Å; F120-L185 HydrophobicContact CD1-CD2 4.29Å; F120-L185 HydrophobicContact CE1-CD1 4.03Å; F120-L185 HydrophobicContact CE1-CD2 3.77Å; F120-L185 HydrophobicContact CE1-CG 3.68Å; F120-L185 HydrophobicContact CZ-CG 4.29Å
121	L	89.5	Confident	87.8	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-69.3	-38.9	-179.4	-63.2	173.9	0	0	0	112.7	F70 N108 R117 Y118 T123 L124 N125 F237 V239 L240	F70-L121 HydrophobicContact CE2-CD1 4.47Å; F70-L121 HydrophobicContact CE2-CD2 4.3Å; F70-L121 HydrophobicContact CE2-CG 4.24Å; N108-L121 VanDerWaalsContact ND2-CD1 3.32Å; N108-L121 WeakPolarHBondContact ND2-CD1 3.38Å; R117-L121 WeakPolarHBondContact O-CG 3.23Å; R117-L121 PolarHBondContact O-N 3.13Å; R117-L121 VanDerWaalsContact O-N 3.09Å; Y118-L121 PolarHBondContact O-N 3.07Å; L121-T123 VanDerWaalsContact C-N 3.26Å; L121-T123 PolarHBondContact O-N 3.28Å; L121-L124 HydrophobicContact CD2-CD1 4.27Å; L121-L124 WeakPolarHBondContact O-CB 3.32Å; L121-L124 PolarHBondContact O-N 2.63Å; L121-N125 PolarHBondContact O-N 2.93Å; L121-F237 HydrophobicContact CD2-CD1 4.05Å; L121-F237 HydrophobicContact CD2-CE1 4.25Å; L121-V239 HydrophobicContact CB-CG1 4.25Å; L121-L240 HydrophobicContact CB-CD2 4.05Å; L121-L240 HydrophobicContact CD2-CD1 4.2Å; L121-L240 HydrophobicContact CD2-CD2 3.88Å; L121-L240 HydrophobicContact CD2-CG 4.04Å; L121-L240 WeakPolarHBondContact O-CD2 3.49Å
122	V	90.2	Very high	89.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-36.9	172.5	168.9	0	0	0	0	110.9	V9 N14 W16 Y118 N125 S126 V239	V9-V122 HydrophobicContact CB-CG1 4.4Å; V9-V122 HydrophobicContact CG1-CB 4.43Å; V9-V122 HydrophobicContact CG1-CG1 3.65Å; V9-V122 HydrophobicContact CG1-CG2 3.86Å; V9-V122 HydrophobicContact CG2-CG1 3.87Å; V9-V122 HydrophobicContact CG2-CG2 4.41Å; N14-V122 HydrophobicContact CB-CG2 4.46Å; W16-V122 HydrophobicContact CD2-CG1 3.98Å; W16-V122 HydrophobicContact CG-CG1 4.13Å; W16-V122 HydrophobicContact CZ2-CG1 4.4Å; Y118-V122 HydrophobicContact CD1-CG2 4.18Å; Y118-V122 HydrophobicContact CD2-CG2 4.08Å; Y118-V122 HydrophobicContact CE1-CG2 3.8Å; Y118-V122 HydrophobicContact CE2-CG2 3.69Å; Y118-V122 HydrophobicContact CG-CG2 4.32Å; Y118-V122 WeakPolarHBondContact O-CB 3.31Å; Y118-V122 VanDerWaalsContact O-CG2 3.31Å; Y118-V122 WeakPolarHBondContact O-CG2 3.32Å; Y118-V122 PolarHBondContact O-N 2.89Å; V122-N125 PolarHBondContact O-N 2.89Å; V122-S126 VanDerWaalsContact O-CB 3.32Å; V122-S126 WeakPolarHBondContact O-CB 3.45Å; V122-S126 PolarHBondContact O-N 2.92Å; V122-S126 PolarHBondContact O-OG 3.49Å; V122-V239 HydrophobicContact CG2-CG1 4.34Å
123	T	92.9	Very high	90.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-40.4	176.9	-62.4	0	0	0	0	111.2	W16 L62 I65 I66 H119 F120 L121 S126 I127	W16-T123 PolarHBondContact NE1-OG1 3.4Å; L62-T123 HydrophobicContact CB-CG2 4.04Å; L62-T123 HydrophobicContact CD2-CG2 3.74Å; I65-T123 HydrophobicContact CB-CG2 4.22Å; I65-T123 VanDerWaalsContact CD1-OG1 3.31Å; I65-T123 WeakPolarHBondContact CD1-OG1 3.31Å; I65-T123 HydrophobicContact CG2-CG2 4.33Å; I65-T123 WeakPolarHBondContact CG2-OG1 3.43Å; I66-T123 HydrophobicContact CD1-CG2 3.72Å; I66-T123 HydrophobicContact CG1-CG2 3.9Å; H119-T123 VanDerWaalsContact O-CB 3.23Å; H119-T123 WeakPolarHBondContact O-CB 3.21Å; H119-T123 PolarHBondContact O-N 3.05Å; H119-T123 PolarHBondContact O-OG1 2.89Å; F120-T123 WeakPolarHBondContact O-CB 3.1Å; F120-T123 PolarHBondContact O-N 3.45Å; L121-T123 VanDerWaalsContact C-N 3.26Å; L121-T123 PolarHBondContact O-N 3.28Å; T123-S126 CarbonylContact O-C 3.56Å; T123-S126 WeakPolarHBondContact O-CB 3.3Å; T123-S126 PolarHBondContact O-N 3.37Å; T123-S126 VanDerWaalsContact O-N 3.11Å; T123-I127 HydrophobicContact CG2-CD1 4.32Å; T123-I127 WeakPolarHBondContact O-CG1 3.25Å; T123-I127 PolarHBondContact O-N 3.48Å
124	L	92.9	Very high	91	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-56.8	-51.2	172.3	-80.9	172.2	0	0	0	112.5	F120 L121 S126 I127 E128 L178 A181 F182 L185 L240 T244	F120-L124 HydrophobicContact CD1-CD1 4.16Å; F120-L124 HydrophobicContact CE1-CD1 3.79Å; F120-L124 HydrophobicContact CE1-CG 4.27Å; F120-L124 PolarHBondContact O-N 3.02Å; F120-L124 VanDerWaalsContact O-N 3.07Å; L121-L124 HydrophobicContact CD2-CD1 4.27Å; L121-L124 WeakPolarHBondContact O-CB 3.32Å; L121-L124 PolarHBondContact O-N 2.63Å; L124-S126 PolarHBondContact O-N 3.47Å; L124-I127 PolarHBondContact O-N 2.65Å; L124-E128 PolarHBondContact O-N 3.26Å; L124-L178 HydrophobicContact CD2-CD1 3.62Å; L124-A181 HydrophobicContact CD2-CB 3.44Å; L124-A181 VanDerWaalsContact CD2-CB 3.44Å; L124-A181 HydrophobicContact CG-CB 4.27Å; L124-F182 HydrophobicContact CD1-CE1 4.5Å; L124-F182 HydrophobicContact CD2-CE1 4.46Å; L124-F182 HydrophobicContact CD2-CZ 4.44Å; L124-L185 HydrophobicContact CD1-CD1 3.64Å; L124-L240 HydrophobicContact CB-CD2 3.82Å; L124-L240 HydrophobicContact CD1-CD2 3.89Å; L124-T244 HydrophobicContact CB-CG2 4.21Å
125	N	91.9	Very high	91.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-36	175.1	-69.8	-20.9	0	0	0	112.1	N14 V15 L121 V122 E128 A129 V239 L240 K241 T244	N14-N125 WeakPolarHBondContact CB-ND2 3.15Å; N14-N125 VanDerWaalsContact O-CB 3.25Å; N14-N125 WeakPolarHBondContact O-CB 3.27Å; N14-N125 PolarHBondContact O-ND2 3.48Å; V15-N125 HydrophobicContact CG2-CB 3.99Å; L121-N125 PolarHBondContact O-N 2.93Å; V122-N125 PolarHBondContact O-N 2.89Å; N125-E128 PolarHBondContact O-N 3.26Å; N125-A129 WeakPolarHBondContact O-CB 3.49Å; N125-A129 PolarHBondContact O-N 2.85Å; N125-V239 PolarHBondContact ND2-O 3.27Å; N125-L240 VanDerWaalsContact OD1-CA 3.27Å; N125-L240 WeakPolarHBondContact OD1-CA 3.39Å; N125-K241 PolarHBondContact OD1-N 3.25Å; N125-T244 PolarHBondContact OD1-OG1 2.85Å
126	S	93.4	Very high	92.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-71.3	-32.7	-178.9	-58.1	0	0	0	0	112.3	V15 W16 V122 T123 L124 A129 S130	V15-S126 WeakPolarHBondContact CA-OG 3.36Å; W16-S126 PolarHBondContact N-OG 3.36Å; V122-S126 VanDerWaalsContact O-CB 3.32Å; V122-S126 WeakPolarHBondContact O-CB 3.45Å; V122-S126 PolarHBondContact O-N 2.92Å; V122-S126 PolarHBondContact O-OG 3.49Å; T123-S126 CarbonylContact O-C 3.56Å; T123-S126 WeakPolarHBondContact O-CB 3.3Å; T123-S126 PolarHBondContact O-N 3.37Å; T123-S126 VanDerWaalsContact O-N 3.11Å; L124-S126 PolarHBondContact O-N 3.47Å; S126-A129 PolarHBondContact O-N 3.22Å; S126-S130 VanDerWaalsContact O-CB 3.32Å; S126-S130 WeakPolarHBondContact O-CB 3.43Å; S126-S130 PolarHBondContact O-N 3.37Å; S126-S130 PolarHBondContact O-OG 3.34Å
127	I	95.2	Very high	93.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-46.7	171.2	-69.1	163.1	0	0	0	109.7	L62 I66 T123 L124 S130 Q131 L174 L177 L178	L62-I127 HydrophobicContact CD1-CG1 4.06Å; I66-I127 HydrophobicContact CD1-CD1 4.47Å; I66-I127 HydrophobicContact CG1-CD1 4.22Å; T123-I127 HydrophobicContact CG2-CD1 4.32Å; T123-I127 WeakPolarHBondContact O-CG1 3.25Å; T123-I127 PolarHBondContact O-N 3.48Å; L124-I127 PolarHBondContact O-N 2.65Å; I127-S130 VanDerWaalsContact O-CB 3.29Å; I127-S130 WeakPolarHBondContact O-CB 3.4Å; I127-S130 PolarHBondContact O-N 3.5Å; I127-Q131 PolarHBondContact O-N 3.34Å; I127-L174 HydrophobicContact CG2-CB 4.14Å; I127-L174 HydrophobicContact CG2-CD2 4.11Å; I127-L174 WeakPolarHBondContact CG2-O 3.32Å; I127-L177 HydrophobicContact CD1-CB 4.43Å; I127-L177 HydrophobicContact CD1-CD2 3.74Å; I127-L177 HydrophobicContact CD1-CG 3.87Å; I127-L177 HydrophobicContact CG1-CD2 4.2Å; I127-L178 HydrophobicContact CG2-CB 4.1Å; I127-L178 HydrophobicContact CG2-CD1 4.22Å
128	E	92.4	Very high	93.7	Very high	14 Å²	14	20.1 Å²	20.1	7%	0.065	11%	0.105	C	C	.	.	H	α-helix	trans	-64.9	-43	177.4	-165.5	-163.5	124.4	0	0	112.2	L124 N125 S130 Q131 K132 D243 T244	L124-E128 PolarHBondContact O-N 3.26Å; N125-E128 PolarHBondContact O-N 3.26Å; E128-S130 PolarHBondContact O-N 3.01Å; E128-Q131 PolarHBondContact O-N 3.08Å; E128-K132 PolarHBondContact O-N 3.19Å; E128-K132 WeakPolarHBondContact OE1-CE 3.08Å; E128-K132 IonicContact OE1-NZ 3.87Å; E128-K132 PolarHBondContact OE1-NZ 2.79Å; E128-D243 WeakPolarHBondContact OE1-CB 3.29Å; E128-T244 PolarHBondContact OE2-N 3.36Å; E128-T244 PolarHBondContact OE2-OG1 3.2Å
129	A	93.2	Very high	94.3	Very high	15 Å²	15	22.4 Å²	22.4	12%	0.124	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-38	173.6	0	0	0	0	0	111.5	V15 N125 S126 K132 N133	V15-A129 HydrophobicContact CG1-CB 3.86Å; V15-A129 HydrophobicContact CG2-CB 3.95Å; N125-A129 WeakPolarHBondContact O-CB 3.49Å; N125-A129 PolarHBondContact O-N 2.85Å; S126-A129 PolarHBondContact O-N 3.22Å; A129-K132 PolarHBondContact O-N 3.3Å; A129-N133 WeakPolarHBondContact O-CB 3.5Å; A129-N133 PolarHBondContact O-N 2.78Å
130	S	96	Very high	94.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.8	-40.8	175.7	-59.5	0	0	0	0	112.3	F23 M57 S126 I127 E128 N133 L134	F23-S130 VanDerWaalsContact CZ-O 3.3Å; F23-S130 WeakPolarHBondContact CZ-O 3.44Å; M57-S130 VanDerWaalsContact CE-CB 3.46Å; M57-S130 WeakPolarHBondContact CE-OG 3.31Å; S126-S130 VanDerWaalsContact O-CB 3.32Å; S126-S130 WeakPolarHBondContact O-CB 3.43Å; S126-S130 PolarHBondContact O-N 3.37Å; S126-S130 PolarHBondContact O-OG 3.34Å; I127-S130 VanDerWaalsContact O-CB 3.29Å; I127-S130 WeakPolarHBondContact O-CB 3.4Å; I127-S130 PolarHBondContact O-N 3.5Å; E128-S130 PolarHBondContact O-N 3.01Å; S130-N133 PolarHBondContact O-N 3.37Å; S130-L134 WeakPolarHBondContact O-CB 3.34Å; S130-L134 PolarHBondContact O-N 2.56Å
131	Q	96	Very high	94.9	Very high	47 Å²	47	24.2 Å²	24.2	22%	0.22	13%	0.128	C	C	.	.	H	α-helix	trans	-63.2	-42.8	174.6	-69.2	179.1	-15.8	0	0	111.5	I127 E128 L134 L135 L174	I127-Q131 PolarHBondContact O-N 3.34Å; E128-Q131 PolarHBondContact O-N 3.08Å; Q131-L134 PolarHBondContact O-N 3.12Å; Q131-L135 PolarHBondContact O-N 3.44Å; Q131-L174 HydrophobicContact CG-CB 4.15Å; Q131-L174 HydrophobicContact CG-CD1 3.93Å
132	K	95	Very high	95.2	Very high	101 Å²	101	26.7 Å²	26.7	44%	0.439	14%	0.14	S	C	.	.	H	α-helix	trans	-62.4	-45.3	176.1	-72.1	172.7	174.1	167.5	0	111.6	E128 A129 L135 S136 D243	E128-K132 PolarHBondContact O-N 3.19Å; E128-K132 WeakPolarHBondContact OE1-CE 3.08Å; E128-K132 IonicContact OE1-NZ 3.87Å; E128-K132 PolarHBondContact OE1-NZ 2.79Å; A129-K132 PolarHBondContact O-N 3.3Å; K132-L135 PolarHBondContact O-N 2.88Å; K132-S136 PolarHBondContact O-N 3.35Å; K132-D243 IonicContact NZ-OD2 2.81Å; K132-D243 PolarHBondContact NZ-OD2 3.27Å
133	N	96.4	Very high	95.4	Very high	38 Å²	38	29.6 Å²	29.6	20%	0.203	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-39	178.1	-74.5	-10.7	0	0	0	112.6	D20 F23 A129 S130 S136 L137	D20-N133 PolarHBondContact OD1-ND2 3.02Å; F23-N133 HydrophobicContact CB-CB 4.02Å; F23-N133 HydrophobicContact CD1-CB 4.14Å; F23-N133 HydrophobicContact CD2-CB 3.43Å; F23-N133 VanDerWaalsContact CD2-CB 3.43Å; F23-N133 HydrophobicContact CE2-CB 3.87Å; F23-N133 HydrophobicContact CG-CB 3.59Å; F23-N133 HydrophobicContact CZ-CB 4.4Å; A129-N133 WeakPolarHBondContact O-CB 3.5Å; A129-N133 PolarHBondContact O-N 2.78Å; S130-N133 PolarHBondContact O-N 3.37Å; N133-S136 PolarHBondContact O-N 3.3Å; N133-L137 WeakPolarHBondContact O-CB 3.39Å; N133-L137 PolarHBondContact O-N 2.81Å
134	L	97.9	Very high	95.4	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-47	173.5	177.1	64.3	0	0	0	111.1	F23 S130 Q131 S136 L137 V138 I170	F23-L134 HydrophobicContact CE1-CB 3.69Å; F23-L134 HydrophobicContact CE1-CD1 4.07Å; F23-L134 HydrophobicContact CE1-CG 4.5Å; F23-L134 HydrophobicContact CZ-CB 3.98Å; S130-L134 WeakPolarHBondContact O-CB 3.34Å; S130-L134 PolarHBondContact O-N 2.56Å; Q131-L134 PolarHBondContact O-N 3.12Å; L134-S136 VanDerWaalsContact C-N 3.33Å; L134-S136 PolarHBondContact O-N 2.64Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 3.32Å; L134-V138 HydrophobicContact CD1-CG2 4.25Å; L134-V138 VanDerWaalsContact O-CG2 3.3Å; L134-V138 WeakPolarHBondContact O-CG2 3.37Å; L134-V138 PolarHBondContact O-N 3.41Å; L134-I170 HydrophobicContact CD1-CB 4.35Å; L134-I170 HydrophobicContact CD1-CD1 4.04Å; L134-I170 HydrophobicContact CD1-CG2 4.42Å; L134-I170 HydrophobicContact CD2-CB 3.81Å; L134-I170 HydrophobicContact CD2-CG2 3.79Å
135	L	97.5	Very high	95.4	Very high	76 Å²	76	32.5 Å²	32.5	40%	0.398	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-43.4	176.9	-176.2	64.3	0	0	0	111.3	Q131 K132 L137 V138 N139	Q131-L135 PolarHBondContact O-N 3.44Å; K132-L135 PolarHBondContact O-N 2.88Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L135-L137 PolarHBondContact O-N 3.04Å; L135-V138 PolarHBondContact O-N 3.43Å; L135-N139 WeakPolarHBondContact O-CB 3.19Å; L135-N139 PolarHBondContact O-N 2.84Å; L135-N139 PolarHBondContact O-ND2 3.43Å; L135-N139 PolarHBondContact O-OD1 3.21Å
136	S	97.7	Very high	95.4	Very high	71 Å²	71	36.2 Å²	36.2	50%	0.497	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-37.3	175.9	-176.5	0	0	0	0	112.8	K132 N133 L134 H140	K132-S136 PolarHBondContact O-N 3.35Å; N133-S136 PolarHBondContact O-N 3.3Å; L134-S136 VanDerWaalsContact C-N 3.33Å; L134-S136 PolarHBondContact O-N 2.64Å; S136-H140 WeakPolarHBondContact O-CB 3.4Å; S136-H140 PolarHBondContact O-N 2.79Å
137	L	97.6	Very high	95.3	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-51.7	175.4	168.7	62.6	0	0	0	110.2	F23 T26 K27 N133 L134 L135 H140 L141	F23-L137 HydrophobicContact CD1-CB 4.44Å; F23-L137 HydrophobicContact CD1-CD2 3.99Å; T26-L137 HydrophobicContact CG2-CD2 3.8Å; K27-L137 HydrophobicContact CB-CD1 3.62Å; K27-L137 HydrophobicContact CG-CD1 3.95Å; N133-L137 WeakPolarHBondContact O-CB 3.39Å; N133-L137 PolarHBondContact O-N 2.81Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 3.32Å; L135-L137 VanDerWaalsContact C-N 3.33Å; L135-L137 PolarHBondContact O-N 3.04Å; L137-H140 PolarHBondContact O-N 3.4Å; L137-L141 HydrophobicContact CD1-CD1 3.88Å; L137-L141 HydrophobicContact CD1-CG 4.05Å; L137-L141 HydrophobicContact CG-CD1 4.05Å; L137-L141 WeakPolarHBondContact O-CG 3.32Å; L137-L141 PolarHBondContact O-N 3.49Å
138	V	97.4	Very high	95.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-50.5	-177.5	169	0	0	0	0	111.2	L134 L135 H140 L141 E142 I163 K167	L134-V138 HydrophobicContact CD1-CG2 4.25Å; L134-V138 VanDerWaalsContact O-CG2 3.3Å; L134-V138 WeakPolarHBondContact O-CG2 3.37Å; L134-V138 PolarHBondContact O-N 3.41Å; L135-V138 PolarHBondContact O-N 3.43Å; V138-H140 PolarHBondContact O-N 3.33Å; V138-L141 PolarHBondContact O-N 3.37Å; V138-E142 HydrophobicContact CG1-CG 4.25Å; V138-E142 WeakPolarHBondContact CG1-OE1 3.3Å; V138-E142 WeakPolarHBondContact O-CG 3.5Å; V138-E142 PolarHBondContact O-N 2.72Å; V138-I163 HydrophobicContact CB-CG2 4.37Å; V138-I163 HydrophobicContact CG1-CG2 3.68Å; V138-I163 HydrophobicContact CG2-CG2 4.36Å; V138-K167 HydrophobicContact CG1-CB 4.44Å; V138-K167 HydrophobicContact CG1-CD 4.09Å; V138-K167 HydrophobicContact CG2-CB 3.77Å; V138-K167 HydrophobicContact CG2-CD 4.46Å; V138-K167 HydrophobicContact CG2-CG 4.11Å
139	N	97.5	Very high	94.9	Very high	80 Å²	80	46 Å²	46	43%	0.428	24%	0.244	S	C	.	.	H	α-helix	trans	-57.6	-36.3	178.6	-68.2	-11.9	0	0	0	111.9	L135 S143	L135-N139 WeakPolarHBondContact O-CB 3.19Å; L135-N139 PolarHBondContact O-N 2.84Å; L135-N139 PolarHBondContact O-ND2 3.43Å; L135-N139 PolarHBondContact O-OD1 3.21Å; N139-S143 WeakPolarHBondContact O-CB 3.31Å; N139-S143 PolarHBondContact O-N 3.18Å
140	H	96.8	Very high	94.5	Very high	54 Å²	54	51.7 Å²	51.7	25%	0.25	27%	0.268	C	S	.	.	H	α-helix	trans	-70.1	-44	176.8	-173.6	81.5	0	0	0	112	K27 I31 S136 L137 V138 S143 E144	K27-H140 WeakPolarHBondContact CE-CD2 3.42Å; K27-H140 VanDerWaalsContact CE-NE2 3.27Å; K27-H140 WeakPolarHBondContact CE-NE2 3.24Å; K27-H140 PolarHBondContact NZ-ND1 2.89Å; I31-H140 WeakPolarHBondContact CD1-NE2 3.43Å; S136-H140 WeakPolarHBondContact O-CB 3.4Å; S136-H140 PolarHBondContact O-N 2.79Å; L137-H140 PolarHBondContact O-N 3.4Å; V138-H140 PolarHBondContact O-N 3.33Å; H140-S143 PolarHBondContact O-N 3.27Å; H140-E144 WeakPolarHBondContact O-CG 3.42Å; H140-E144 PolarHBondContact O-N 3.48Å
141	L	96.1	Very high	94.1	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-42	176.8	-67.2	173.1	0	0	0	111.9	L30 I31 L34 L137 V138 S143 E144 L145 I163	L30-L141 HydrophobicContact CB-CD1 4.35Å; L30-L141 HydrophobicContact CB-CD2 3.76Å; L30-L141 HydrophobicContact CD1-CD1 3.59Å; I31-L141 HydrophobicContact CG1-CD2 4.36Å; L34-L141 HydrophobicContact CD1-CD2 4.46Å; L137-L141 HydrophobicContact CD1-CD1 3.88Å; L137-L141 HydrophobicContact CD1-CG 4.05Å; L137-L141 HydrophobicContact CG-CD1 4.05Å; L137-L141 WeakPolarHBondContact O-CG 3.32Å; L137-L141 PolarHBondContact O-N 3.49Å; V138-L141 PolarHBondContact O-N 3.37Å; L141-S143 VanDerWaalsContact C-N 3.35Å; L141-E144 PolarHBondContact O-N 3.45Å; L141-L145 WeakPolarHBondContact O-CB 3.33Å; L141-L145 PolarHBondContact O-N 3.49Å; L141-I163 HydrophobicContact CB-CD1 3.91Å; L141-I163 HydrophobicContact CB-CG1 4.46Å
142	E	94.9	Very high	93.7	Very high	54 Å²	54	61.3 Å²	61.3	25%	0.252	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-41.7	175.5	-71.1	175.6	171.8	0	0	111.5	V138 L145 N146 I163	V138-E142 HydrophobicContact CG1-CG 4.25Å; V138-E142 WeakPolarHBondContact CG1-OE1 3.3Å; V138-E142 WeakPolarHBondContact O-CG 3.5Å; V138-E142 PolarHBondContact O-N 2.72Å; E142-L145 PolarHBondContact O-N 3.44Å; E142-N146 WeakPolarHBondContact O-CB 3.49Å; E142-N146 PolarHBondContact O-N 3.36Å; E142-N146 PolarHBondContact O-ND2 3.49Å; E142-N146 VanDerWaalsContact O-ND2 3.07Å; E142-I163 HydrophobicContact CG-CG2 4.09Å
143	S	94.3	Very high	93.4	Very high	61 Å²	61	63.3 Å²	63.3	43%	0.427	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-49.2	175.1	-178.1	0	0	0	0	111.9	N139 H140 L141 L145 N146 L147	N139-S143 WeakPolarHBondContact O-CB 3.31Å; N139-S143 PolarHBondContact O-N 3.18Å; H140-S143 PolarHBondContact O-N 3.27Å; L141-S143 VanDerWaalsContact C-N 3.35Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.23Å; S143-N146 PolarHBondContact O-N 3.29Å; S143-L147 WeakPolarHBondContact O-CG 3.34Å; S143-L147 PolarHBondContact O-N 3.27Å; S143-L147 VanDerWaalsContact O-N 3.12Å
144	E	93.4	Very high	93.1	Very high	60 Å²	60	67.9 Å²	67.9	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-63.7	-40.5	177.9	-68.1	-61	128.3	0	0	111.6	L34 H140 L141 L147 L148	L34-E144 HydrophobicContact CD2-CB 3.75Å; H140-E144 WeakPolarHBondContact O-CG 3.42Å; H140-E144 PolarHBondContact O-N 3.48Å; L141-E144 PolarHBondContact O-N 3.45Å; E144-L147 PolarHBondContact O-N 3.27Å; E144-L148 WeakPolarHBondContact O-CG 3.38Å; E144-L148 PolarHBondContact O-N 2.88Å
145	L	92.9	Very high	92.8	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-61.5	-46.7	177.2	-178.1	72.8	0	0	0	111.5	L141 E142 S143 L147 L148 Y149 L159 N160 I163	L141-L145 WeakPolarHBondContact O-CB 3.33Å; L141-L145 PolarHBondContact O-N 3.49Å; E142-L145 PolarHBondContact O-N 3.44Å; S143-L145 VanDerWaalsContact C-N 3.34Å; S143-L145 PolarHBondContact O-N 3.23Å; L145-L147 VanDerWaalsContact C-N 3.26Å; L145-L147 PolarHBondContact O-N 3.39Å; L145-L148 PolarHBondContact O-N 2.63Å; L145-Y149 HydrophobicContact CD1-CD2 3.47Å; L145-Y149 VanDerWaalsContact CD1-CD2 3.47Å; L145-Y149 HydrophobicContact CD1-CE2 3.98Å; L145-Y149 HydrophobicContact CD1-CG 4.18Å; L145-Y149 HydrophobicContact CG-CD2 4.41Å; L145-Y149 PolarHBondContact O-N 2.86Å; L145-L159 HydrophobicContact CD1-CB 3.44Å; L145-L159 VanDerWaalsContact CD1-CB 3.44Å; L145-L159 HydrophobicContact CD1-CD1 3.32Å; L145-L159 HydrophobicContact CD1-CG 3.96Å; L145-L159 HydrophobicContact CD2-CB 3.66Å; L145-L159 HydrophobicContact CG-CB 4.21Å; L145-N160 HydrophobicContact CD2-CB 4.35Å; L145-N160 WeakPolarHBondContact CD2-ND2 3.42Å; L145-N160 WeakPolarHBondContact CD2-OD1 3.38Å; L145-I163 HydrophobicContact CD2-CD1 4.04Å
146	N	91.5	Very high	92.6	Very high	78 Å²	78	67.5 Å²	67.5	42%	0.417	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-35.2	178.2	-75.1	-32.5	0	0	0	111.4	E142 S143 Q150	E142-N146 WeakPolarHBondContact O-CB 3.49Å; E142-N146 PolarHBondContact O-N 3.36Å; E142-N146 PolarHBondContact O-ND2 3.49Å; E142-N146 VanDerWaalsContact O-ND2 3.07Å; S143-N146 PolarHBondContact O-N 3.29Å; N146-Q150 VanDerWaalsContact O-CB 3.29Å; N146-Q150 WeakPolarHBondContact O-CB 3.23Å; N146-Q150 VanDerWaalsContact O-CD 3.32Å; N146-Q150 WeakPolarHBondContact O-CG 3.42Å; N146-Q150 PolarHBondContact O-N 2.74Å; N146-Q150 PolarHBondContact O-NE2 3.11Å
147	L	91.7	Very high	92.3	Very high	111 Å²	111	68.9 Å²	68.9	58%	0.581	35%	0.35	S	S	*	.	H	α-helix	trans	-67.8	-41	175.1	-71.1	175.3	0	0	0	112.6	S143 E144 L145	S143-L147 WeakPolarHBondContact O-CG 3.34Å; S143-L147 PolarHBondContact O-N 3.27Å; S143-L147 VanDerWaalsContact O-N 3.12Å; E144-L147 PolarHBondContact O-N 3.27Å; L145-L147 VanDerWaalsContact C-N 3.26Å; L145-L147 PolarHBondContact O-N 3.39Å
148	L	90.9	Very high	92.2	Very high	97 Å²	97	72.5 Å²	72.5	51%	0.508	37%	0.366	S	S	.	.	H	α-helix	trans	-83.2	-34.5	-174.7	-66.6	174.9	0	0	0	113.9	L34 E144 L145	L34-L148 HydrophobicContact CB-CD1 4.25Å; L34-L148 HydrophobicContact CD2-CD1 4.37Å; E144-L148 WeakPolarHBondContact O-CG 3.38Å; E144-L148 PolarHBondContact O-N 2.88Å; L145-L148 PolarHBondContact O-N 2.63Å
149	Y	89.4	Confident	92.1	Very high	11 Å²	11	72.6 Å²	72.6	4%	0.043	37%	0.367	C	S	.	.	H	α-helix	trans	-116.8	17.9	-170.3	-66	-90.1	0	0	0	114	G37 V39 I42 L145 N151 Q152 N155 L159	G37-Y149 PolarHBondContact O-OH 2.88Å; G37-Y149 VanDerWaalsContact O-OH 3.14Å; V39-Y149 HydrophobicContact CG2-CE1 3.95Å; I42-Y149 HydrophobicContact CD1-CE2 4.37Å; I42-Y149 VanDerWaalsContact CD1-OH 3.31Å; I42-Y149 WeakPolarHBondContact CD1-OH 3.46Å; L145-Y149 HydrophobicContact CD1-CD2 3.47Å; L145-Y149 VanDerWaalsContact CD1-CD2 3.47Å; L145-Y149 HydrophobicContact CD1-CE2 3.98Å; L145-Y149 HydrophobicContact CD1-CG 4.18Å; L145-Y149 HydrophobicContact CG-CD2 4.41Å; L145-Y149 PolarHBondContact O-N 2.86Å; Y149-N151 PolarHBondContact O-N 3.4Å; Y149-Q152 HydrophobicContact CD1-CB 4.25Å; Y149-Q152 PolarHBondContact O-N 2.91Å; Y149-N155 HydrophobicContact CD1-CB 4Å; Y149-N155 HydrophobicContact CE1-CB 4.37Å; Y149-L159 HydrophobicContact CD1-CD1 4.35Å; Y149-L159 HydrophobicContact CD2-CD1 4.03Å; Y149-L159 HydrophobicContact CE1-CD1 4.14Å; Y149-L159 HydrophobicContact CE2-CD1 3.79Å; Y149-L159 HydrophobicContact CG-CD1 4.29Å
150	Q	84.3	Confident	91.9	Very high	135 Å²	135	70.8 Å²	70.8	63%	0.631	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.2	-37.2	178.9	-122.5	159.7	69.3	0	0	114.2	N146	N146-Q150 VanDerWaalsContact O-CB 3.29Å; N146-Q150 WeakPolarHBondContact O-CB 3.23Å; N146-Q150 VanDerWaalsContact O-CD 3.32Å; N146-Q150 WeakPolarHBondContact O-CG 3.42Å; N146-Q150 PolarHBondContact O-N 2.74Å; N146-Q150 PolarHBondContact O-NE2 3.11Å
151	N	87.1	Confident	91.9	Very high	161 Å²	161	74.3 Å²	74.3	86%	0.861	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	8.1	-178.2	-61.9	-39.9	0	0	0	114.1	Y149	Y149-N151 PolarHBondContact O-N 3.4Å
152	Q	88.6	Confident	91.9	Very high	88 Å²	88	75 Å²	75	41%	0.411	38%	0.38	S	S	.	.			trans	-123.6	76.2	-175.7	-61	-174.6	23.8	0	0	110.5	Y149 I154 N155 S156	Y149-Q152 HydrophobicContact CD1-CB 4.25Å; Y149-Q152 PolarHBondContact O-N 2.91Å; Q152-I154 PolarHBondContact O-N 3.24Å; Q152-N155 HydrophobicContact CB-CB 4.07Å; Q152-N155 PolarHBondContact O-N 2.98Å; Q152-N155 PolarHBondContact OE1-ND2 3.42Å; Q152-S156 VanDerWaalsContact O-CB 3.28Å; Q152-S156 WeakPolarHBondContact O-CB 3.35Å; Q152-S156 PolarHBondContact O-N 3.37Å
153	E	88.3	Confident	92	Very high	143 Å²	143	72.6 Å²	72.6	67%	0.668	37%	0.369	S	S	*	.	H	α-helix	trans	-53.6	-49.9	-172.1	-171.4	179.3	175.9	0	0	113.3	N155 S156 Q157	E153-N155 PolarHBondContact O-N 3.18Å; E153-S156 PolarHBondContact O-N 3.46Å; E153-Q157 WeakPolarHBondContact O-CB 3.47Å; E153-Q157 VanDerWaalsContact O-CG 3.27Å; E153-Q157 WeakPolarHBondContact O-CG 3.23Å; E153-Q157 PolarHBondContact O-N 2.91Å; E153-Q157 PolarHBondContact OE1-NE2 3.24Å
154	I	89.3	Confident	92.1	Very high	135 Å²	135	72.9 Å²	72.9	69%	0.692	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-44.8	-178	-61.2	171.9	0	0	0	111.4	Q152 Q157 K158	Q152-I154 PolarHBondContact O-N 3.24Å; I154-Q157 PolarHBondContact O-N 2.85Å; I154-K158 PolarHBondContact O-N 2.98Å; I154-K158 VanDerWaalsContact O-N 3.07Å
155	N	92	Very high	92.3	Very high	55 Å²	55	75.2 Å²	75.2	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-70.1	-41.6	-179.2	-69.8	-17.7	0	0	0	111.2	V39 Y149 Q152 E153 K158 L159	V39-N155 HydrophobicContact CG2-CB 3.75Å; Y149-N155 HydrophobicContact CD1-CB 4Å; Y149-N155 HydrophobicContact CE1-CB 4.37Å; Q152-N155 HydrophobicContact CB-CB 4.07Å; Q152-N155 PolarHBondContact O-N 2.98Å; Q152-N155 PolarHBondContact OE1-ND2 3.42Å; E153-N155 PolarHBondContact O-N 3.18Å; N155-K158 PolarHBondContact O-N 3Å; N155-L159 WeakPolarHBondContact O-CB 3.26Å; N155-L159 VanDerWaalsContact O-CG 3.26Å; N155-L159 WeakPolarHBondContact O-CG 3.25Å; N155-L159 PolarHBondContact O-N 3.45Å
156	S	92.1	Very high	92.5	Very high	16 Å²	16	75.2 Å²	75.2	11%	0.112	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-45.1	174.8	-177.9	0	0	0	0	111.3	Q152 E153 L159 N160	Q152-S156 VanDerWaalsContact O-CB 3.28Å; Q152-S156 WeakPolarHBondContact O-CB 3.35Å; Q152-S156 PolarHBondContact O-N 3.37Å; E153-S156 PolarHBondContact O-N 3.46Å; S156-L159 PolarHBondContact O-N 3.22Å; S156-N160 WeakPolarHBondContact O-CB 3.26Å; S156-N160 PolarHBondContact O-N 2.87Å; S156-N160 PolarHBondContact O-ND2 2.88Å; S156-N160 PolarHBondContact OG-ND2 2.73Å
157	Q	93	Very high	92.8	Very high	100 Å²	100	75.1 Å²	75.1	47%	0.467	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-47.2	176.4	-75.4	172.4	-7.5	0	0	112	E153 I154 L159 N160 M161	E153-Q157 WeakPolarHBondContact O-CB 3.47Å; E153-Q157 VanDerWaalsContact O-CG 3.27Å; E153-Q157 WeakPolarHBondContact O-CG 3.23Å; E153-Q157 PolarHBondContact O-N 2.91Å; E153-Q157 PolarHBondContact OE1-NE2 3.24Å; I154-Q157 PolarHBondContact O-N 2.85Å; Q157-L159 VanDerWaalsContact C-N 3.33Å; Q157-L159 PolarHBondContact O-N 3Å; Q157-N160 PolarHBondContact O-N 2.65Å; Q157-M161 WeakPolarHBondContact O-CG 3.27Å; Q157-M161 PolarHBondContact O-N 3.26Å
158	K	94.3	Very high	93.1	Very high	81 Å²	81	72.8 Å²	72.8	35%	0.352	37%	0.365	S	S	.	.	H	α-helix	trans	-58.4	-44.6	177.8	-172.8	179.1	174.9	-176.3	0	112	V39 D40 I154 N155 M161 C162	V39-K158 HydrophobicContact CG1-CD 3.89Å; V39-K158 HydrophobicContact CG1-CG 4.49Å; D40-K158 IonicContact OD1-NZ 3.03Å; D40-K158 PolarHBondContact OD1-NZ 3.3Å; I154-K158 PolarHBondContact O-N 2.98Å; I154-K158 VanDerWaalsContact O-N 3.07Å; N155-K158 PolarHBondContact O-N 3Å; K158-M161 PolarHBondContact O-N 2.71Å; K158-C162 PolarHBondContact O-N 3.49Å
159	L	95.2	Very high	93.4	Very high	3 Å²	3	69.3 Å²	69.3	2%	0.016	35%	0.348	C	S	.	.	H	α-helix	trans	-70.9	-40.4	-179.1	-68.4	171.3	0	0	0	112.4	V39 I42 L145 Y149 N155 S156 Q157 M161 C162 I163	V39-L159 HydrophobicContact CG1-CD1 4.26Å; V39-L159 HydrophobicContact CG1-CD2 4.04Å; V39-L159 HydrophobicContact CG1-CG 3.99Å; V39-L159 HydrophobicContact CG2-CD1 4.28Å; I42-L159 HydrophobicContact CB-CD2 3.69Å; I42-L159 HydrophobicContact CD1-CD1 4.34Å; I42-L159 HydrophobicContact CD1-CD2 4.46Å; I42-L159 HydrophobicContact CG2-CD2 3.49Å; I42-L159 VanDerWaalsContact CG2-CD2 3.49Å; L145-L159 HydrophobicContact CD1-CB 3.44Å; L145-L159 VanDerWaalsContact CD1-CB 3.44Å; L145-L159 HydrophobicContact CD1-CD1 3.32Å; L145-L159 HydrophobicContact CD1-CG 3.96Å; L145-L159 HydrophobicContact CD2-CB 3.66Å; L145-L159 HydrophobicContact CG-CB 4.21Å; Y149-L159 HydrophobicContact CD1-CD1 4.35Å; Y149-L159 HydrophobicContact CD2-CD1 4.03Å; Y149-L159 HydrophobicContact CE1-CD1 4.14Å; Y149-L159 HydrophobicContact CE2-CD1 3.79Å; Y149-L159 HydrophobicContact CG-CD1 4.29Å; N155-L159 WeakPolarHBondContact O-CB 3.26Å; N155-L159 VanDerWaalsContact O-CG 3.26Å; N155-L159 WeakPolarHBondContact O-CG 3.25Å; N155-L159 PolarHBondContact O-N 3.45Å; S156-L159 PolarHBondContact O-N 3.22Å; Q157-L159 VanDerWaalsContact C-N 3.33Å; Q157-L159 PolarHBondContact O-N 3Å; L159-M161 VanDerWaalsContact C-N 3.29Å; L159-M161 PolarHBondContact O-N 3.06Å; L159-C162 PolarHBondContact O-N 2.69Å; L159-I163 WeakPolarHBondContact O-CG1 3.37Å; L159-I163 PolarHBondContact O-N 2.85Å
160	N	94.9	Very high	93.8	Very high	41 Å²	41	68.8 Å²	68.8	22%	0.219	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-38.4	173.3	-82.2	-60.6	0	0	0	111.8	L145 S156 Q157 I163 T164	L145-N160 HydrophobicContact CD2-CB 4.35Å; L145-N160 WeakPolarHBondContact CD2-ND2 3.42Å; L145-N160 WeakPolarHBondContact CD2-OD1 3.38Å; S156-N160 WeakPolarHBondContact O-CB 3.26Å; S156-N160 PolarHBondContact O-N 2.87Å; S156-N160 PolarHBondContact O-ND2 2.88Å; S156-N160 PolarHBondContact OG-ND2 2.73Å; Q157-N160 PolarHBondContact O-N 2.65Å; N160-I163 PolarHBondContact O-N 2.65Å; N160-T164 WeakPolarHBondContact O-CB 3.37Å; N160-T164 PolarHBondContact O-N 3.34Å; N160-T164 PolarHBondContact O-OG1 3.4Å
161	M	95.5	Very high	94.4	Very high	128 Å²	128	64.3 Å²	64.3	63%	0.631	33%	0.33	S	S	*	.	H	α-helix	trans	-62	-45.6	174.3	-73.4	-172.6	-66.3	0	0	112	Q157 K158 L159 I163 T164 E165	Q157-M161 WeakPolarHBondContact O-CG 3.27Å; Q157-M161 PolarHBondContact O-N 3.26Å; K158-M161 PolarHBondContact O-N 2.71Å; L159-M161 VanDerWaalsContact C-N 3.29Å; L159-M161 PolarHBondContact O-N 3.06Å; M161-I163 PolarHBondContact O-N 2.9Å; M161-T164 PolarHBondContact O-N 2.87Å; M161-E165 WeakPolarHBondContact O-CB 3.36Å; M161-E165 PolarHBondContact O-N 2.97Å
162	C	96.2	Very high	94.9	Very high	16 Å²	16	61.2 Å²	61.2	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-41.5	176.7	-72.5	0	0	0	0	112.7	C43 V46 K158 L159 E165 L166	C43-C162 PolarHBondContact SG-SG 3.27Å; V46-C162 HydrophobicContact CB-CB 4.26Å; V46-C162 HydrophobicContact CG1-CB 3.9Å; V46-C162 VanDerWaalsContact CG1-O 3.29Å; V46-C162 WeakPolarHBondContact CG1-O 3.4Å; K158-C162 PolarHBondContact O-N 3.49Å; L159-C162 PolarHBondContact O-N 2.69Å; C162-E165 PolarHBondContact O-N 2.87Å; C162-L166 PolarHBondContact O-N 3.41Å
163	I	96.6	Very high	95.3	Very high	4 Å²	4	61 Å²	61	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-39.3	177.4	-66.6	167.1	0	0	0	110.9	V138 L141 E142 L145 L159 N160 M161 L166 K167	V138-I163 HydrophobicContact CB-CG2 4.37Å; V138-I163 HydrophobicContact CG1-CG2 3.68Å; V138-I163 HydrophobicContact CG2-CG2 4.36Å; L141-I163 HydrophobicContact CB-CD1 3.91Å; L141-I163 HydrophobicContact CB-CG1 4.46Å; E142-I163 HydrophobicContact CG-CG2 4.09Å; L145-I163 HydrophobicContact CD2-CD1 4.04Å; L159-I163 WeakPolarHBondContact O-CG1 3.37Å; L159-I163 PolarHBondContact O-N 2.85Å; N160-I163 PolarHBondContact O-N 2.65Å; M161-I163 PolarHBondContact O-N 2.9Å; I163-L166 WeakPolarHBondContact O-CB 3.34Å; I163-L166 PolarHBondContact O-N 3.13Å; I163-K167 PolarHBondContact O-N 2.88Å
164	T	96.7	Very high	95.7	Very high	66 Å²	66	54.1 Å²	54.1	41%	0.405	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-44.6	175.9	-59.5	0	0	0	0	110.7	N160 M161 K167 V168	N160-T164 WeakPolarHBondContact O-CB 3.37Å; N160-T164 PolarHBondContact O-N 3.34Å; N160-T164 PolarHBondContact O-OG1 3.4Å; M161-T164 PolarHBondContact O-N 2.87Å; T164-K167 WeakPolarHBondContact O-CB 3.39Å; T164-K167 PolarHBondContact O-N 3.28Å; T164-V168 HydrophobicContact CG2-CG2 4.21Å; T164-V168 WeakPolarHBondContact O-CG2 3.3Å; T164-V168 PolarHBondContact O-N 3.36Å
165	E	96.9	Very high	96	Very high	109 Å²	109	51.1 Å²	51.1	51%	0.509	26%	0.263	S	S	.	.	H	α-helix	trans	-59.8	-48.4	175.7	-173.5	61.7	-157	0	0	110.7	M161 C162 K167 V168 S169	M161-E165 WeakPolarHBondContact O-CB 3.36Å; M161-E165 PolarHBondContact O-N 2.97Å; C162-E165 PolarHBondContact O-N 2.87Å; E165-K167 VanDerWaalsContact C-N 3.26Å; E165-K167 PolarHBondContact O-N 3.05Å; E165-V168 PolarHBondContact O-N 3.02Å; E165-V168 VanDerWaalsContact O-N 3.16Å; E165-S169 WeakPolarHBondContact O-CB 3.48Å; E165-S169 PolarHBondContact O-N 3Å; E165-S169 PolarHBondContact O-OG 2.86Å; E165-S169 PolarHBondContact OE1-OG 2.82Å
166	L	97.2	Very high	96.2	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-51.3	-46.1	174.3	178.1	72.7	0	0	0	112	L30 V46 S49 C50 C162 I163 I170	L30-L166 HydrophobicContact CD1-CD2 4.09Å; V46-L166 HydrophobicContact CG1-CB 3.96Å; V46-L166 HydrophobicContact CG1-CD2 4.26Å; S49-L166 WeakPolarHBondContact OG-CD1 3.32Å; C50-L166 HydrophobicContact CB-CD1 3.72Å; C162-L166 PolarHBondContact O-N 3.41Å; I163-L166 WeakPolarHBondContact O-CB 3.34Å; I163-L166 PolarHBondContact O-N 3.13Å; L166-I170 HydrophobicContact CD1-CD1 3.54Å; L166-I170 HydrophobicContact CG-CD1 4.07Å; L166-I170 WeakPolarHBondContact O-CD1 3.29Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.2Å; L166-I170 PolarHBondContact O-N 3.42Å
167	K	97.9	Very high	96.4	Very high	76 Å²	76	51.2 Å²	51.2	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-53.3	177.8	-175.5	-175.3	173.6	-179.4	0	111.3	V138 I163 T164 E165 S171	V138-K167 HydrophobicContact CG1-CB 4.44Å; V138-K167 HydrophobicContact CG1-CD 4.09Å; V138-K167 HydrophobicContact CG2-CB 3.77Å; V138-K167 HydrophobicContact CG2-CD 4.46Å; V138-K167 HydrophobicContact CG2-CG 4.11Å; I163-K167 PolarHBondContact O-N 2.88Å; T164-K167 WeakPolarHBondContact O-CB 3.39Å; T164-K167 PolarHBondContact O-N 3.28Å; E165-K167 VanDerWaalsContact C-N 3.26Å; E165-K167 PolarHBondContact O-N 3.05Å; K167-S171 WeakPolarHBondContact O-CB 3.41Å; K167-S171 PolarHBondContact O-N 3.18Å
168	V	97.8	Very high	96.4	Very high	62 Å²	62	46.6 Å²	46.6	38%	0.376	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-51	-173.4	172.6	0	0	0	0	110.3	T164 E165 I170 S171 D172	T164-V168 HydrophobicContact CG2-CG2 4.21Å; T164-V168 WeakPolarHBondContact O-CG2 3.3Å; T164-V168 PolarHBondContact O-N 3.36Å; E165-V168 PolarHBondContact O-N 3.02Å; E165-V168 VanDerWaalsContact O-N 3.16Å; V168-I170 VanDerWaalsContact C-N 3.35Å; V168-I170 PolarHBondContact O-N 3.18Å; V168-S171 PolarHBondContact O-N 3.08Å; V168-D172 WeakPolarHBondContact O-CB 3.23Å; V168-D172 VanDerWaalsContact O-CG 3.25Å; V168-D172 PolarHBondContact O-N 2.87Å
169	S	97.2	Very high	96.3	Very high	23 Å²	23	46.7 Å²	46.7	16%	0.161	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-42.9	-177	-41.4	0	0	0	0	112.3	C50 E165 Q173	C50-S169 VanDerWaalsContact SG-CB 3.53Å; E165-S169 WeakPolarHBondContact O-CB 3.48Å; E165-S169 PolarHBondContact O-N 3Å; E165-S169 PolarHBondContact O-OG 2.86Å; E165-S169 PolarHBondContact OE1-OG 2.82Å; S169-Q173 WeakPolarHBondContact O-CG 3.01Å; S169-Q173 PolarHBondContact O-N 3.05Å
170	I	97.6	Very high	96.1	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-73.7	-42.4	179.7	-60.7	171.1	0	0	0	110.6	L53 I54 L134 L166 V168 D172 Q173 L174	L53-I170 HydrophobicContact CB-CD1 3.92Å; L53-I170 HydrophobicContact CB-CG1 4.5Å; L53-I170 HydrophobicContact CD1-CD1 3.5Å; L53-I170 HydrophobicContact CG-CD1 4.35Å; I54-I170 HydrophobicContact CD1-CG1 4.35Å; I54-I170 HydrophobicContact CG1-CG1 4.04Å; L134-I170 HydrophobicContact CD1-CB 4.35Å; L134-I170 HydrophobicContact CD1-CD1 4.04Å; L134-I170 HydrophobicContact CD1-CG2 4.42Å; L134-I170 HydrophobicContact CD2-CB 3.81Å; L134-I170 HydrophobicContact CD2-CG2 3.79Å; L166-I170 HydrophobicContact CD1-CD1 3.54Å; L166-I170 HydrophobicContact CG-CD1 4.07Å; L166-I170 WeakPolarHBondContact O-CD1 3.29Å; L166-I170 VanDerWaalsContact O-CG1 3.29Å; L166-I170 WeakPolarHBondContact O-CG1 3.2Å; L166-I170 PolarHBondContact O-N 3.42Å; V168-I170 VanDerWaalsContact C-N 3.35Å; V168-I170 PolarHBondContact O-N 3.18Å; I170-D172 VanDerWaalsContact C-N 3.33Å; I170-D172 PolarHBondContact O-N 3.41Å; I170-Q173 PolarHBondContact O-N 3.03Å; I170-L174 HydrophobicContact CG2-CD1 3.87Å; I170-L174 HydrophobicContact CG2-CG 4.27Å; I170-L174 WeakPolarHBondContact O-CB 3.44Å; I170-L174 WeakPolarHBondContact O-CG 3.35Å; I170-L174 PolarHBondContact O-N 3.45Å
171	S	97.7	Very high	96	Very high	40 Å²	40	46.4 Å²	46.4	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-60.9	-43.1	179.6	-173.4	0	0	0	0	111.6	K167 V168 L174 Q175	K167-S171 WeakPolarHBondContact O-CB 3.41Å; K167-S171 PolarHBondContact O-N 3.18Å; V168-S171 PolarHBondContact O-N 3.08Å; S171-L174 PolarHBondContact O-N 2.93Å; S171-Q175 VanDerWaalsContact O-CB 3.3Å; S171-Q175 WeakPolarHBondContact O-CB 3.47Å; S171-Q175 PolarHBondContact O-N 3.29Å
172	D	97.7	Very high	95.7	Very high	97 Å²	97	40.4 Å²	40.4	52%	0.519	23%	0.225	S	C	.	.	H	α-helix	trans	-65.1	-40.8	179.5	-72.4	-6.4	0	0	0	111.5	V168 I170 Q175 A176	V168-D172 WeakPolarHBondContact O-CB 3.23Å; V168-D172 VanDerWaalsContact O-CG 3.25Å; V168-D172 PolarHBondContact O-N 2.87Å; I170-D172 VanDerWaalsContact C-N 3.33Å; I170-D172 PolarHBondContact O-N 3.41Å; D172-Q175 PolarHBondContact O-N 2.98Å; D172-A176 WeakPolarHBondContact O-CB 3.4Å; D172-A176 PolarHBondContact O-N 2.85Å
173	Q	97.6	Very high	95.3	Very high	82 Å²	82	45.5 Å²	45.5	38%	0.383	25%	0.247	S	C	.	.	H	α-helix	trans	-67.3	-42.2	176.4	-67.3	-66.9	-33.9	0	0	112.1	I54 V58 S169 I170 Q175 L177	I54-Q173 HydrophobicContact CD1-CG 4.17Å; I54-Q173 HydrophobicContact CG1-CG 4.27Å; I54-Q173 HydrophobicContact CG2-CG 4.19Å; V58-Q173 HydrophobicContact CG1-CB 4.02Å; S169-Q173 WeakPolarHBondContact O-CG 3.01Å; S169-Q173 PolarHBondContact O-N 3.05Å; I170-Q173 PolarHBondContact O-N 3.03Å; Q173-Q175 VanDerWaalsContact C-N 3.34Å; Q173-L177 WeakPolarHBondContact O-CB 3.48Å; Q173-L177 PolarHBondContact O-N 3.04Å
174	L	97.3	Very high	94.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-41.2	173.8	-73.6	172.3	0	0	0	111.5	M57 V58 L62 I127 Q131 I170 S171 L177 L178	M57-L174 HydrophobicContact CE-CD2 4.49Å; V58-L174 HydrophobicContact CG1-CD2 4.22Å; V58-L174 HydrophobicContact CG2-CD2 3.82Å; V58-L174 HydrophobicContact CG2-CG 4.15Å; L62-L174 HydrophobicContact CD1-CD2 4.09Å; I127-L174 HydrophobicContact CG2-CB 4.14Å; I127-L174 HydrophobicContact CG2-CD2 4.11Å; I127-L174 WeakPolarHBondContact CG2-O 3.32Å; Q131-L174 HydrophobicContact CG-CB 4.15Å; Q131-L174 HydrophobicContact CG-CD1 3.93Å; I170-L174 HydrophobicContact CG2-CD1 3.87Å; I170-L174 HydrophobicContact CG2-CG 4.27Å; I170-L174 WeakPolarHBondContact O-CB 3.44Å; I170-L174 WeakPolarHBondContact O-CG 3.35Å; I170-L174 PolarHBondContact O-N 3.45Å; S171-L174 PolarHBondContact O-N 2.93Å; L174-L177 PolarHBondContact O-N 2.78Å; L174-L178 WeakPolarHBondContact O-CB 3.36Å; L174-L178 PolarHBondContact O-N 3.02Å
175	Q	95.6	Very high	94.3	Very high	71 Å²	71	45.7 Å²	45.7	33%	0.332	24%	0.243	S	C	.	.	H	α-helix	trans	-67.6	-46	178.9	-172.8	59.6	47.7	0	0	111.6	S171 D172 Q173 L177 L178 D179	S171-Q175 VanDerWaalsContact O-CB 3.3Å; S171-Q175 WeakPolarHBondContact O-CB 3.47Å; S171-Q175 PolarHBondContact O-N 3.29Å; D172-Q175 PolarHBondContact O-N 2.98Å; Q173-Q175 VanDerWaalsContact C-N 3.34Å; Q175-L177 PolarHBondContact O-N 3.41Å; Q175-L178 WeakPolarHBondContact O-CB 3.36Å; Q175-L178 PolarHBondContact O-N 3.35Å; Q175-L178 VanDerWaalsContact O-N 3.08Å; Q175-D179 PolarHBondContact NE2-OD1 3.24Å; Q175-D179 VanDerWaalsContact O-CG 3.25Å; Q175-D179 PolarHBondContact O-N 2.93Å
176	A	95.6	Very high	93.5	Very high	55 Å²	55	40.8 Å²	40.8	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-58.8	-38.2	175.7	0	0	0	0	0	111.8	D172 S180	D172-A176 WeakPolarHBondContact O-CB 3.4Å; D172-A176 PolarHBondContact O-N 2.85Å; A176-S180 WeakPolarHBondContact O-CB 3.37Å; A176-S180 PolarHBondContact O-N 3.14Å
177	L	95.3	Very high	92.8	Very high	18 Å²	18	44 Å²	44	9%	0.094	24%	0.241	C	C	.	.	H	α-helix	trans	-68.1	-39.7	175.9	-170.4	63.7	0	0	0	112.4	V58 L62 I66 I127 Q173 L174 Q175 A181	V58-L177 HydrophobicContact CG1-CD2 4.24Å; L62-L177 HydrophobicContact CB-CD2 3.68Å; I66-L177 HydrophobicContact CB-CD1 3.74Å; I66-L177 HydrophobicContact CB-CG 4.3Å; I66-L177 HydrophobicContact CG1-CD1 3.97Å; I66-L177 HydrophobicContact CG1-CD2 4.26Å; I66-L177 HydrophobicContact CG1-CG 3.96Å; I66-L177 HydrophobicContact CG2-CD1 3.82Å; I66-L177 HydrophobicContact CG2-CG 4.45Å; I127-L177 HydrophobicContact CD1-CB 4.43Å; I127-L177 HydrophobicContact CD1-CD2 3.74Å; I127-L177 HydrophobicContact CD1-CG 3.87Å; I127-L177 HydrophobicContact CG1-CD2 4.2Å; Q173-L177 WeakPolarHBondContact O-CB 3.48Å; Q173-L177 PolarHBondContact O-N 3.04Å; L174-L177 PolarHBondContact O-N 2.78Å; Q175-L177 PolarHBondContact O-N 3.41Å; L177-A181 WeakPolarHBondContact O-CB 3.34Å; L177-A181 PolarHBondContact O-N 3.37Å
178	L	93.7	Very high	92	Very high	4 Å²	4	42 Å²	42	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-45.9	175.5	-171.6	65.6	0	0	0	111.2	L124 I127 L174 Q175 A181 F182	L124-L178 HydrophobicContact CD2-CD1 3.62Å; I127-L178 HydrophobicContact CG2-CB 4.1Å; I127-L178 HydrophobicContact CG2-CD1 4.22Å; L174-L178 WeakPolarHBondContact O-CB 3.36Å; L174-L178 PolarHBondContact O-N 3.02Å; Q175-L178 WeakPolarHBondContact O-CB 3.36Å; Q175-L178 PolarHBondContact O-N 3.35Å; Q175-L178 VanDerWaalsContact O-N 3.08Å; L178-A181 WeakPolarHBondContact O-CB 3.44Å; L178-A181 PolarHBondContact O-N 2.76Å; L178-F182 HydrophobicContact CD1-CD2 4.16Å; L178-F182 HydrophobicContact CD1-CE2 3.51Å; L178-F182 HydrophobicContact CD1-CZ 4.08Å; L178-F182 HydrophobicContact CD2-CE2 4.05Å; L178-F182 HydrophobicContact CG-CD2 3.87Å; L178-F182 HydrophobicContact CG-CE2 3.5Å; L178-F182 VanDerWaalsContact CG-CE2 3.5Å; L178-F182 VanDerWaalsContact O-CD2 3.23Å; L178-F182 WeakPolarHBondContact O-CD2 3.32Å; L178-F182 PolarHBondContact O-N 3.46Å
179	D	91.6	Very high	90.9	Very high	82 Å²	82	39.1 Å²	39.1	44%	0.439	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-45.3	178.8	-65.3	-22.5	0	0	0	111	Q175 A181 F182 E183	Q175-D179 PolarHBondContact NE2-OD1 3.24Å; Q175-D179 VanDerWaalsContact O-CG 3.25Å; Q175-D179 PolarHBondContact O-N 2.93Å; D179-A181 VanDerWaalsContact C-N 3.33Å; D179-A181 PolarHBondContact O-N 3.23Å; D179-F182 PolarHBondContact O-N 3.29Å; D179-E183 PolarHBondContact O-N 3.41Å
180	S	92.2	Very high	89.7	Confident	39 Å²	39	38.2 Å²	38.2	27%	0.273	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-40.9	175	176.1	0	0	0	0	112.3	A176 E183 H184	A176-S180 WeakPolarHBondContact O-CB 3.37Å; A176-S180 PolarHBondContact O-N 3.14Å; S180-E183 PolarHBondContact O-N 3Å; S180-H184 PolarHBondContact O-CD2 3.03Å; S180-H184 PolarHBondContact O-N 2.76Å
181	A	92	Very high	88.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-40.3	177.1	0	0	0	0	0	112.1	I66 F120 L124 L177 L178 D179 H184 L185	I66-A181 HydrophobicContact CD1-CB 3.7Å; I66-A181 HydrophobicContact CG1-CB 4.17Å; I66-A181 HydrophobicContact CG2-CB 3.71Å; F120-A181 HydrophobicContact CE1-CB 4.42Å; F120-A181 HydrophobicContact CZ-CB 3.88Å; L124-A181 HydrophobicContact CD2-CB 3.44Å; L124-A181 VanDerWaalsContact CD2-CB 3.44Å; L124-A181 HydrophobicContact CG-CB 4.27Å; L177-A181 WeakPolarHBondContact O-CB 3.34Å; L177-A181 PolarHBondContact O-N 3.37Å; L178-A181 WeakPolarHBondContact O-CB 3.44Å; L178-A181 PolarHBondContact O-N 2.76Å; D179-A181 VanDerWaalsContact C-N 3.33Å; D179-A181 PolarHBondContact O-N 3.23Å; A181-H184 PolarHBondContact O-N 3.02Å; A181-L185 PolarHBondContact O-N 3.22Å
182	F	89.6	Confident	87.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-69.7	-36.7	176	-75.6	-50.6	0	0	0	113.1	L124 L178 D179 H184 L185 S186 T244 I247 F248	L124-F182 HydrophobicContact CD1-CE1 4.5Å; L124-F182 HydrophobicContact CD2-CE1 4.46Å; L124-F182 HydrophobicContact CD2-CZ 4.44Å; L178-F182 HydrophobicContact CD1-CD2 4.16Å; L178-F182 HydrophobicContact CD1-CE2 3.51Å; L178-F182 HydrophobicContact CD1-CZ 4.08Å; L178-F182 HydrophobicContact CD2-CE2 4.05Å; L178-F182 HydrophobicContact CG-CD2 3.87Å; L178-F182 HydrophobicContact CG-CE2 3.5Å; L178-F182 VanDerWaalsContact CG-CE2 3.5Å; L178-F182 VanDerWaalsContact O-CD2 3.23Å; L178-F182 WeakPolarHBondContact O-CD2 3.32Å; L178-F182 PolarHBondContact O-N 3.46Å; D179-F182 PolarHBondContact O-N 3.29Å; F182-H184 VanDerWaalsContact C-N 3.31Å; F182-H184 PolarHBondContact O-N 2.9Å; F182-L185 HydrophobicContact CD1-CD1 4.24Å; F182-L185 PolarHBondContact O-N 2.84Å; F182-S186 VanDerWaalsContact O-CB 3.3Å; F182-S186 WeakPolarHBondContact O-CB 3.47Å; F182-S186 PolarHBondContact O-N 3.39Å; F182-T244 HydrophobicContact CE1-CG2 4.46Å; F182-T244 HydrophobicContact CZ-CG2 3.88Å; F182-I247 HydrophobicContact CD2-CG2 3.97Å; F182-I247 HydrophobicContact CE2-CB 4.09Å; F182-I247 HydrophobicContact CE2-CG2 3.31Å; F182-I247 HydrophobicContact CZ-CB 4.05Å; F182-I247 HydrophobicContact CZ-CG2 3.76Å; F182-F248 HydrophobicContact CD1-CB 4.21Å; F182-F248 AromaticContact CD1-CD2 3.72Å; F182-F248 HydrophobicContact CD1-CD2 3.72Å; F182-F248 HydrophobicContact CD1-CG 4.43Å; F182-F248 HydrophobicContact CE1-CB 3.64Å; F182-F248 AromaticContact CE1-CD2 3.95Å; F182-F248 HydrophobicContact CE1-CD2 3.95Å; F182-F248 HydrophobicContact CE1-CG 4.23Å; F182-F248 HydrophobicContact CZ-CB 4.41Å
183	E	87.3	Confident	85.9	Confident	123 Å²	123	40 Å²	40	58%	0.575	22%	0.219	S	C	*	.	H	α-helix	trans	-60.7	-42.1	171.9	-173.1	179.5	-179.8	0	0	111.2	D179 S180 S186 T187	D179-E183 PolarHBondContact O-N 3.41Å; S180-E183 PolarHBondContact O-N 3Å; E183-S186 PolarHBondContact O-N 2.84Å; E183-T187 WeakPolarHBondContact O-CB 3.34Å; E183-T187 PolarHBondContact O-N 3.38Å; E183-T187 PolarHBondContact O-OG1 3.45Å
184	H	86.5	Confident	84.4	Confident	74 Å²	74	37.3 Å²	37.3	34%	0.343	21%	0.208	S	C	.	.	H	α-helix	trans	-62.3	-45.3	174	-79.7	-50.9	0	0	0	112.6	F120 S180 A181 F182 S188	F120-H184 HydrophobicContact CZ-CB 4.38Å; S180-H184 PolarHBondContact O-CD2 3.03Å; S180-H184 PolarHBondContact O-N 2.76Å; A181-H184 PolarHBondContact O-N 3.02Å; F182-H184 VanDerWaalsContact C-N 3.31Å; F182-H184 PolarHBondContact O-N 2.9Å; H184-S188 VanDerWaalsContact O-CB 3.23Å; H184-S188 WeakPolarHBondContact O-CB 3.18Å; H184-S188 PolarHBondContact O-N 3.34Å; H184-S188 PolarHBondContact O-OG 2.93Å
185	L	85.1	Confident	83	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-44.6	175.5	-74.1	178.8	0	0	0	111.5	F70 F120 L124 A181 F182 T187 V189 F237 F248	F70-L185 HydrophobicContact CB-CD2 3.93Å; F70-L185 HydrophobicContact CD1-CD2 4.18Å; F70-L185 HydrophobicContact CD2-CD2 3.59Å; F70-L185 HydrophobicContact CE2-CD2 4.08Å; F70-L185 HydrophobicContact CG-CD2 3.63Å; F120-L185 HydrophobicContact CD1-CD2 4.29Å; F120-L185 HydrophobicContact CE1-CD1 4.03Å; F120-L185 HydrophobicContact CE1-CD2 3.77Å; F120-L185 HydrophobicContact CE1-CG 3.68Å; F120-L185 HydrophobicContact CZ-CG 4.29Å; L124-L185 HydrophobicContact CD1-CD1 3.64Å; A181-L185 PolarHBondContact O-N 3.22Å; F182-L185 HydrophobicContact CD1-CD1 4.24Å; F182-L185 PolarHBondContact O-N 2.84Å; L185-T187 PolarHBondContact O-N 2.93Å; L185-V189 HydrophobicContact CD2-CG2 4.16Å; L185-V189 WeakPolarHBondContact O-CA 3.36Å; L185-V189 WeakPolarHBondContact O-CB 3.37Å; L185-V189 WeakPolarHBondContact O-CG2 3.27Å; L185-V189 PolarHBondContact O-N 3.42Å; L185-F237 HydrophobicContact CD1-CE1 4.23Å; L185-F237 HydrophobicContact CD2-CE1 4.05Å; L185-F248 HydrophobicContact CB-CD2 4.4Å; L185-F248 HydrophobicContact CB-CE2 3.65Å; L185-F248 HydrophobicContact CB-CZ 4.4Å; L185-F248 HydrophobicContact CD1-CD2 4.08Å; L185-F248 HydrophobicContact CD1-CE2 3.95Å; L185-F248 HydrophobicContact CG-CE2 4.44Å
186	S	81.7	Confident	81.8	Confident	5 Å²	5	44.6 Å²	44.6	4%	0.035	24%	0.244	C	C	.	.	I	π-helix	trans	-58.2	-49.9	178.2	-175	0	0	0	0	112.3	F182 E183 I190 Q191 V255	F182-S186 VanDerWaalsContact O-CB 3.3Å; F182-S186 WeakPolarHBondContact O-CB 3.47Å; F182-S186 PolarHBondContact O-N 3.39Å; E183-S186 PolarHBondContact O-N 2.84Å; S186-I190 WeakPolarHBondContact O-CA 3.3Å; S186-I190 WeakPolarHBondContact O-CB 3.19Å; S186-I190 PolarHBondContact O-N 3.42Å; S186-Q191 PolarHBondContact O-N 2.86Å; S186-V255 WeakPolarHBondContact OG-CG2 3.34Å
187	T	81.7	Confident	80.3	Confident	70 Å²	70	44 Å²	44	43%	0.429	23%	0.233	S	C	.	.	I	π-helix	trans	-69.7	-42.5	-178.1	-53.1	0	0	0	0	112	E183 L185	E183-T187 WeakPolarHBondContact O-CB 3.34Å; E183-T187 PolarHBondContact O-N 3.38Å; E183-T187 PolarHBondContact O-OG1 3.45Å; L185-T187 PolarHBondContact O-N 2.93Å
188	S	80.5	Confident	78.9	Confident	35 Å²	35	47.3 Å²	47.3	25%	0.245	25%	0.251	C	S	.	.	I	π-helix	trans	-80.4	-37.1	-175.8	62.7	0	0	0	0	113.5	H184 S192	H184-S188 VanDerWaalsContact O-CB 3.23Å; H184-S188 WeakPolarHBondContact O-CB 3.18Å; H184-S188 PolarHBondContact O-N 3.34Å; H184-S188 PolarHBondContact O-OG 2.93Å; S188-S192 PolarHBondContact O-OG 2.94Å
189	V	75.9	Confident	77.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	I	π-helix	trans	-101.6	-54.4	-171.4	-178.2	0	0	0	0	111.1	F70 W74 L185 S192 Q193 F233 F237	F70-V189 HydrophobicContact CD1-CG2 3.8Å; F70-V189 HydrophobicContact CE1-CG2 3.81Å; W74-V189 VanDerWaalsContact CE2-CG1 3.46Å; W74-V189 HydrophobicContact CH2-CG1 4.25Å; W74-V189 HydrophobicContact CZ2-CB 4.47Å; W74-V189 HydrophobicContact CZ2-CG1 3.24Å; L185-V189 HydrophobicContact CD2-CG2 4.16Å; L185-V189 WeakPolarHBondContact O-CA 3.36Å; L185-V189 WeakPolarHBondContact O-CB 3.37Å; L185-V189 WeakPolarHBondContact O-CG2 3.27Å; L185-V189 PolarHBondContact O-N 3.42Å; V189-S192 PolarHBondContact O-OG 3.22Å; V189-Q193 WeakPolarHBondContact O-CB 3.2Å; V189-Q193 VanDerWaalsContact O-CG 3.29Å; V189-Q193 WeakPolarHBondContact O-CG 3.45Å; V189-Q193 PolarHBondContact O-N 3Å; V189-F233 HydrophobicContact CG1-CE2 3.55Å; V189-F233 HydrophobicContact CG1-CZ 3.75Å; V189-F237 HydrophobicContact CB-CZ 4.39Å; V189-F237 HydrophobicContact CG1-CE2 4.06Å; V189-F237 HydrophobicContact CG1-CZ 3.74Å; V189-F237 HydrophobicContact CG2-CZ 4.24Å
190	I	71.6	Confident	76.4	Confident	5 Å²	5	50 Å²	50	3%	0.026	27%	0.267	C	S	.	.	I	π-helix	trans	-75.2	-48.5	-169.9	-69.1	149.4	0	0	0	110.7	S186 S192 Q193 V194 F233 F248 T252	S186-I190 WeakPolarHBondContact O-CA 3.3Å; S186-I190 WeakPolarHBondContact O-CB 3.19Å; S186-I190 PolarHBondContact O-N 3.42Å; I190-S192 VanDerWaalsContact C-N 3.26Å; I190-S192 PolarHBondContact O-N 2.93Å; I190-Q193 CarbonylContact O-C 3.57Å; I190-Q193 PolarHBondContact O-N 3.34Å; I190-V194 HydrophobicContact CG2-CG2 3.93Å; I190-V194 WeakPolarHBondContact O-CG2 3.3Å; I190-V194 PolarHBondContact O-N 3.25Å; I190-F233 HydrophobicContact CG1-CZ 4.05Å; I190-F248 HydrophobicContact CD1-CE1 4.48Å; I190-F248 HydrophobicContact CD1-CE2 3.7Å; I190-F248 HydrophobicContact CD1-CZ 3.53Å; I190-F248 HydrophobicContact CG1-CZ 4.29Å; I190-T252 HydrophobicContact CD1-CG2 3.38Å; I190-T252 WeakPolarHBondContact CD1-OG1 3.48Å; I190-T252 HydrophobicContact CG1-CG2 3.75Å; I190-T252 HydrophobicContact CG2-CG2 4.1Å
191	Q	72	Confident	75	Confident	99 Å²	99	52 Å²	52	46%	0.463	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-35.3	179	-68	-174.4	-7.9	0	0	113.1	S186 Q193	S186-Q191 PolarHBondContact O-N 2.86Å; Q191-Q193 VanDerWaalsContact C-N 3.32Å
192	S	72.6	Confident	73.7	Confident	54 Å²	54	60.1 Å²	60.1	38%	0.378	31%	0.306	S	S	.	.	H	α-helix	trans	-71.6	-27.8	175.9	67.6	0	0	0	0	112.5	S188 V189 I190 T196	S188-S192 PolarHBondContact O-OG 2.94Å; V189-S192 PolarHBondContact O-OG 3.22Å; I190-S192 VanDerWaalsContact C-N 3.26Å; I190-S192 PolarHBondContact O-N 2.93Å; S192-T196 PolarHBondContact O-OG1 3.4Å
193	Q	68.6	Low	72.6	Confident	21 Å²	21	64.4 Å²	64.4	10%	0.098	34%	0.336	C	S	.	.	H	α-helix	trans	-89.8	-31.6	179.6	-73.1	-54.9	-74	0	0	115	W74 V75 V189 I190 Q191 K195 T196 L197 F233	W74-Q193 HydrophobicContact CZ2-CG 4.17Å; V75-Q193 VanDerWaalsContact CG1-NE2 3.33Å; V75-Q193 HydrophobicContact CG2-CG 4.02Å; V189-Q193 WeakPolarHBondContact O-CB 3.2Å; V189-Q193 VanDerWaalsContact O-CG 3.29Å; V189-Q193 WeakPolarHBondContact O-CG 3.45Å; V189-Q193 PolarHBondContact O-N 3Å; I190-Q193 CarbonylContact O-C 3.57Å; I190-Q193 PolarHBondContact O-N 3.34Å; Q191-Q193 VanDerWaalsContact C-N 3.32Å; Q193-K195 PolarHBondContact O-N 3.34Å; Q193-K195 VanDerWaalsContact O-N 3.15Å; Q193-T196 CarbonylContact O-C 3.54Å; Q193-T196 WeakPolarHBondContact O-CA 3.45Å; Q193-T196 WeakPolarHBondContact O-CB 3.38Å; Q193-T196 PolarHBondContact O-N 3.45Å; Q193-L197 HydrophobicContact CB-CD1 4.47Å; Q193-L197 PolarHBondContact O-N 2.88Å; Q193-F233 HydrophobicContact CB-CD2 4.28Å; Q193-F233 HydrophobicContact CB-CE2 3.9Å; Q193-F233 HydrophobicContact CG-CD2 3.83Å; Q193-F233 HydrophobicContact CG-CE2 3.58Å
194	V	66.7	Low	71.2	Confident	26 Å²	26	61.4 Å²	61.4	16%	0.158	32%	0.323	C	S	.	.	H	α-helix	trans	-52.4	-42.3	177.8	167.2	0	0	0	0	110.4	I190 T196 L198	I190-V194 HydrophobicContact CG2-CG2 3.93Å; I190-V194 WeakPolarHBondContact O-CG2 3.3Å; I190-V194 PolarHBondContact O-N 3.25Å; V194-T196 PolarHBondContact O-N 3.32Å; V194-L198 HydrophobicContact CG1-CD1 3.56Å; V194-L198 HydrophobicContact CG1-CG 4.14Å; V194-L198 WeakPolarHBondContact O-CB 3.25Å; V194-L198 WeakPolarHBondContact O-CD1 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.4Å; V194-L198 PolarHBondContact O-N 3.08Å
195	K	67.4	Low	69.8	Low	157 Å²	157	66.3 Å²	66.3	68%	0.683	34%	0.344	S	S	*	.	H	α-helix	trans	-63.2	-41.1	173.9	-72.2	-177.2	179.5	175.6	0	113.4	Q193 N199	Q193-K195 PolarHBondContact O-N 3.34Å; Q193-K195 VanDerWaalsContact O-N 3.15Å; K195-N199 WeakPolarHBondContact O-CB 3.49Å; K195-N199 PolarHBondContact O-N 2.95Å; K195-N199 PolarHBondContact O-ND2 3.49Å
196	T	70.2	Confident	68.4	Low	67 Å²	67	71 Å²	71	41%	0.411	38%	0.376	S	S	.	.	H	α-helix	trans	-67.6	-47.4	-179.9	-54.3	0	0	0	0	110.7	S192 Q193 V194 N199 V200	S192-T196 PolarHBondContact O-OG1 3.4Å; Q193-T196 CarbonylContact O-C 3.54Å; Q193-T196 WeakPolarHBondContact O-CA 3.45Å; Q193-T196 WeakPolarHBondContact O-CB 3.38Å; Q193-T196 PolarHBondContact O-N 3.45Å; V194-T196 PolarHBondContact O-N 3.32Å; T196-N199 PolarHBondContact O-N 3.43Å; T196-V200 PolarHBondContact O-N 3.18Å
197	L	64.6	Low	67.1	Low	43 Å²	43	75.7 Å²	75.7	23%	0.225	40%	0.4	C	S	.	.	H	α-helix	trans	-61.8	-49.3	175.3	-68.8	170.6	0	0	0	110.9	Q193 N199 V200 F201 H229	Q193-L197 HydrophobicContact CB-CD1 4.47Å; Q193-L197 PolarHBondContact O-N 2.88Å; L197-N199 PolarHBondContact O-N 3.25Å; L197-V200 WeakPolarHBondContact O-CA 3.35Å; L197-V200 WeakPolarHBondContact O-CB 3.44Å; L197-V200 PolarHBondContact O-N 3.23Å; L197-F201 VanDerWaalsContact C-CD2 3.42Å; L197-F201 HydrophobicContact CB-CD2 4.4Å; L197-F201 HydrophobicContact CB-CE2 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 2.97Å; L197-H229 HydrophobicContact CD2-CB 4.26Å
198	L	66.5	Low	65.9	Low	87 Å²	87	77.7 Å²	77.7	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-57.4	-34.7	175.9	-74.6	172.4	0	0	0	112.8	V194 F201 K202	V194-L198 HydrophobicContact CG1-CD1 3.56Å; V194-L198 HydrophobicContact CG1-CG 4.14Å; V194-L198 WeakPolarHBondContact O-CB 3.25Å; V194-L198 WeakPolarHBondContact O-CD1 3.3Å; V194-L198 WeakPolarHBondContact O-CG 3.4Å; V194-L198 PolarHBondContact O-N 3.08Å; L198-F201 PolarHBondContact O-N 3.4Å; L198-K202 WeakPolarHBondContact O-CG 3.22Å; L198-K202 PolarHBondContact O-N 3.46Å
199	N	67.2	Low	65	Low	103 Å²	103	81.2 Å²	81.2	55%	0.551	42%	0.423	S	S	*	.	H	α-helix	trans	-68.1	-39.9	175.1	-75.4	-17.6	0	0	0	112	K195 T196 L197 F201 K202 S203	K195-N199 WeakPolarHBondContact O-CB 3.49Å; K195-N199 PolarHBondContact O-N 2.95Å; K195-N199 PolarHBondContact O-ND2 3.49Å; T196-N199 PolarHBondContact O-N 3.43Å; L197-N199 PolarHBondContact O-N 3.25Å; N199-F201 VanDerWaalsContact C-N 3.33Å; N199-K202 PolarHBondContact O-N 3.33Å; N199-S203 PolarHBondContact O-N 3.05Å; N199-S203 VanDerWaalsContact O-N 3.11Å
200	V	65.1	Low	64.3	Low	41 Å²	41	89.3 Å²	89.3	25%	0.248	46%	0.461	C	S	.	.	H	α-helix	trans	-60.5	-46.1	172.1	178.2	0	0	0	0	109.8	T196 L197 K202 S203 L204	T196-V200 PolarHBondContact O-N 3.18Å; L197-V200 WeakPolarHBondContact O-CA 3.35Å; L197-V200 WeakPolarHBondContact O-CB 3.44Å; L197-V200 PolarHBondContact O-N 3.23Å; V200-K202 PolarHBondContact O-N 3.06Å; V200-S203 PolarHBondContact O-N 3.47Å; V200-S203 VanDerWaalsContact O-N 3.13Å; V200-S203 PolarHBondContact O-OG 3.01Å; V200-L204 HydrophobicContact CG1-CD1 4.33Å; V200-L204 PolarHBondContact O-N 3.38Å
201	F	61.6	Low	63.9	Low	79 Å²	79	97.4 Å²	97.4	35%	0.346	50%	0.499	S	S	.	.	H	α-helix	trans	-58.6	-43.2	176.6	-71.3	-67.4	0	0	0	113.4	L197 L198 N199 S203 L204 W222 C226	L197-F201 VanDerWaalsContact C-CD2 3.42Å; L197-F201 HydrophobicContact CB-CD2 4.4Å; L197-F201 HydrophobicContact CB-CE2 4.07Å; L197-F201 WeakPolarHBondContact O-CD2 3.29Å; L197-F201 PolarHBondContact O-N 2.97Å; L198-F201 PolarHBondContact O-N 3.4Å; N199-F201 VanDerWaalsContact C-N 3.33Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.96Å; F201-L204 PolarHBondContact O-N 2.87Å; F201-W222 AromaticContact CD1-CE2 3.85Å; F201-W222 AromaticContact CD1-CZ2 3.54Å; F201-W222 HydrophobicContact CD1-CZ2 3.54Å; F201-W222 AromaticContact CD1-NE1 3.8Å; F201-W222 AromaticContact CE1-CE2 3.95Å; F201-W222 HydrophobicContact CE1-CH2 4.07Å; F201-W222 AromaticContact CE1-CZ2 3.42Å; F201-W222 HydrophobicContact CE1-CZ2 3.42Å; F201-W222 VanDerWaalsContact CE1-CZ2 3.42Å; F201-C226 WeakPolarHBondContact CE1-SG 3.41Å
202	K	66	Low	63.3	Low	172 Å²	172	95.8 Å²	95.8	75%	0.748	49%	0.493	S	S	*	.	H	α-helix	trans	-66.9	-28	177	-76.9	179.1	-179.3	179.6	0	113.5	L198 N199 V200	L198-K202 WeakPolarHBondContact O-CG 3.22Å; L198-K202 PolarHBondContact O-N 3.46Å; N199-K202 PolarHBondContact O-N 3.33Å; V200-K202 PolarHBondContact O-N 3.06Å
203	S	65.1	Low	62.8	Low	92 Å²	92	97.3 Å²	97.3	64%	0.643	50%	0.497	S	S	*	.	H	α-helix	trans	-79.3	-19.5	-178	72.2	0	0	0	0	113.5	N199 V200 F201 K205	N199-S203 PolarHBondContact O-N 3.05Å; N199-S203 VanDerWaalsContact O-N 3.11Å; V200-S203 PolarHBondContact O-N 3.47Å; V200-S203 VanDerWaalsContact O-N 3.13Å; V200-S203 PolarHBondContact O-OG 3.01Å; F201-S203 VanDerWaalsContact C-N 3.28Å; F201-S203 PolarHBondContact O-N 2.96Å; S203-K205 PolarHBondContact O-N 2.93Å
204	L	59.1	Low	62.7	Low	59 Å²	59	103 Å²	103	31%	0.309	53%	0.528	S	S	.	.	S	Bend	trans	-79.9	110.2	176.8	-68.9	159	0	0	0	108.8	V200 F201 C206 W222	V200-L204 HydrophobicContact CG1-CD1 4.33Å; V200-L204 PolarHBondContact O-N 3.38Å; F201-L204 PolarHBondContact O-N 2.87Å; L204-C206 PolarHBondContact O-N 3.01Å; L204-W222 VanDerWaalsContact CD1-CD1 3.43Å; L204-W222 HydrophobicContact CD1-CG 4.33Å
205	K	57.4	Low	62.6	Low	178 Å²	178	105.8 Å²	105.8	77%	0.774	55%	0.545	S	S	*	.			trans	-62.9	107.7	170.3	-87.2	-170.6	169	-159.9	0	109.2	S203 D207	S203-K205 PolarHBondContact O-N 2.93Å; K205-D207 IonicContact NZ-OD2 2.65Å; K205-D207 PolarHBondContact O-N 3.34Å
206	C	54	Low	62.4	Low	98 Å²	98	101.5 Å²	101.5	66%	0.662	53%	0.526	S	S	*	.			trans	-87	64.5	163.8	-166	0	0	0	0	108.4	L204 L208	L204-C206 PolarHBondContact O-N 3.01Å; C206-L208 VanDerWaalsContact C-N 3.34Å; C206-L208 PolarHBondContact O-N 3.43Å
207	D	55.4	Low	62.1	Low	103 Å²	103	102.6 Å²	102.6	55%	0.551	54%	0.542	S	S	*	.			trans	-84.5	88.7	163.2	-85	-35.4	0	0	0	105.7	K205 L209	K205-D207 IonicContact NZ-OD2 2.65Å; K205-D207 PolarHBondContact O-N 3.34Å; D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 3.24Å
208	L	57	Low	62.2	Low	112 Å²	112	104.1 Å²	104.1	59%	0.586	56%	0.561	S	S	*	*			trans	-71.4	85.9	170	-75.5	162.8	0	0	0	108.1	C206 F216	C206-L208 VanDerWaalsContact C-N 3.34Å; C206-L208 PolarHBondContact O-N 3.43Å; L208-F216 HydrophobicContact CD2-CD2 4.38Å; L208-F216 HydrophobicContact CD2-CE2 4.5Å
209	L	60.7	Low	62.1	Low	109 Å²	109	104.9 Å²	104.9	57%	0.571	57%	0.566	S	S	*	*			trans	-80.3	140.3	160.5	-71.7	167.7	0	0	0	108.2	D207 E211 D212	D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 3.24Å; L209-E211 PolarHBondContact O-N 2.87Å; L209-E211 VanDerWaalsContact O-N 3.08Å; L209-D212 PolarHBondContact O-N 3.01Å
210	E	62.3	Low	62.2	Low	171 Å²	171	102 Å²	102	80%	0.799	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-57.8	-26	-177	-169.4	159.3	-172.9	0	0	112.5	D212 L213	E210-D212 VanDerWaalsContact C-N 3.31Å; E210-D212 PolarHBondContact O-N 3.47Å; E210-L213 HydrophobicContact CB-CD1 4.48Å; E210-L213 HydrophobicContact CG-CD1 4.07Å; E210-L213 PolarHBondContact O-N 3.04Å
211	E	63.4	Low	62.4	Low	174 Å²	174	109.2 Å²	109.2	81%	0.813	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-70.2	-21	176.1	-64.6	170.8	-177.1	0	0	113.7	L209	L209-E211 PolarHBondContact O-N 2.87Å; L209-E211 VanDerWaalsContact O-N 3.08Å
212	D	59.4	Low	62.7	Low	65 Å²	65	110.6 Å²	110.6	35%	0.348	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-92.8	-10.8	179.6	-67.3	-43.8	0	0	0	113	L209 E210 D214 V215 F216	L209-D212 PolarHBondContact O-N 3.01Å; E210-D212 VanDerWaalsContact C-N 3.31Å; E210-D212 PolarHBondContact O-N 3.47Å; D212-D214 VanDerWaalsContact C-N 3.3Å; D212-D214 PolarHBondContact O-N 3.16Å; D212-V215 WeakPolarHBondContact O-CB 3.33Å; D212-V215 PolarHBondContact O-N 3.23Å; D212-F216 HydrophobicContact CB-CD2 3.68Å; D212-F216 HydrophobicContact CB-CE2 3.53Å; D212-F216 WeakPolarHBondContact O-CD2 3.14Å; D212-F216 PolarHBondContact O-N 3.38Å
213	L	61.6	Low	63	Low	86 Å²	86	106.3 Å²	106.3	45%	0.45	56%	0.56	S	S	.	*	H	α-helix	trans	-58.3	-39	-176.3	-79.6	165.3	0	0	0	112.9	E210 V215 F216 A217	E210-L213 HydrophobicContact CB-CD1 4.48Å; E210-L213 HydrophobicContact CG-CD1 4.07Å; E210-L213 PolarHBondContact O-N 3.04Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.19Å; L213-F216 PolarHBondContact O-N 3Å; L213-A217 VanDerWaalsContact O-CB 3.26Å; L213-A217 WeakPolarHBondContact O-CB 3.45Å; L213-A217 PolarHBondContact O-N 2.85Å
214	D	66.2	Low	63.5	Low	140 Å²	140	106.5 Å²	106.5	75%	0.749	55%	0.551	S	S	*	*	H	α-helix	trans	-67.1	-32.8	177.7	-73.6	-25.3	0	0	0	112	D212 A218	D212-D214 VanDerWaalsContact C-N 3.3Å; D212-D214 PolarHBondContact O-N 3.16Å; D214-A218 PolarHBondContact O-N 2.88Å
215	V	63.9	Low	64.1	Low	86 Å²	86	105.3 Å²	105.3	52%	0.521	55%	0.547	S	S	.	.	H	α-helix	trans	-73.8	-42.2	175.8	-178.3	0	0	0	0	110.4	D212 L213 A218 N219	D212-V215 WeakPolarHBondContact O-CB 3.33Å; D212-V215 PolarHBondContact O-N 3.23Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 3.19Å; V215-A218 PolarHBondContact O-N 3.01Å; V215-N219 PolarHBondContact O-N 3.37Å; V215-N219 VanDerWaalsContact O-N 3.07Å
216	F	62.7	Low	64.6	Low	67 Å²	67	97.9 Å²	97.9	29%	0.294	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-34.6	175.2	-76.7	-67.4	0	0	0	112.8	L208 D212 L213 A218 D220	L208-F216 HydrophobicContact CD2-CD2 4.38Å; L208-F216 HydrophobicContact CD2-CE2 4.5Å; D212-F216 HydrophobicContact CB-CD2 3.68Å; D212-F216 HydrophobicContact CB-CE2 3.53Å; D212-F216 WeakPolarHBondContact O-CD2 3.14Å; D212-F216 PolarHBondContact O-N 3.38Å; L213-F216 PolarHBondContact O-N 3Å; F216-A218 VanDerWaalsContact C-N 3.28Å; F216-A218 PolarHBondContact O-N 3.31Å; F216-D220 HydrophobicContact CD1-CB 4.28Å; F216-D220 WeakPolarHBondContact CD1-OD1 3.48Å; F216-D220 PolarHBondContact O-N 2.87Å
217	A	65.2	Low	65.4	Low	89 Å²	89	97.6 Å²	97.6	74%	0.736	51%	0.509	S	S	*	.	H	α-helix	trans	-65.9	-30.8	176.7	0	0	0	0	0	112.7	L213	L213-A217 VanDerWaalsContact O-CB 3.26Å; L213-A217 WeakPolarHBondContact O-CB 3.45Å; L213-A217 PolarHBondContact O-N 2.85Å
218	A	65.6	Low	66.3	Low	76 Å²	76	94.9 Å²	94.9	63%	0.628	50%	0.5	S	S	*	.	H	α-helix	trans	-87.1	-47.1	-178.9	0	0	0	0	0	113.1	D214 V215 F216	D214-A218 PolarHBondContact O-N 2.88Å; V215-A218 PolarHBondContact O-N 3.01Å; F216-A218 VanDerWaalsContact C-N 3.28Å; F216-A218 PolarHBondContact O-N 3.31Å
219	N	65	Low	67	Low	103 Å²	103	93.1 Å²	93.1	55%	0.551	49%	0.489	S	S	*	.			trans	-148.7	90.2	178.6	-82.1	-17.4	0	0	0	109.2	V215 R221	V215-N219 PolarHBondContact O-N 3.37Å; V215-N219 VanDerWaalsContact O-N 3.07Å; N219-R221 PolarHBondContact O-N 2.95Å
220	D	68.8	Low	67.4	Low	41 Å²	41	90.9 Å²	90.9	22%	0.219	48%	0.48	C	S	.	.			trans	-70	100.7	174.4	-170.9	-15.4	0	0	0	110	F216 W222 I223 E224	F216-D220 HydrophobicContact CD1-CB 4.28Å; F216-D220 WeakPolarHBondContact CD1-OD1 3.48Å; F216-D220 PolarHBondContact O-N 2.87Å; D220-W222 PolarHBondContact O-N 3.38Å; D220-W222 VanDerWaalsContact O-N 3.13Å; D220-W222 WeakPolarHBondContact OD1-CA 3.38Å; D220-W222 WeakPolarHBondContact OD1-CB 3.43Å; D220-W222 PolarHBondContact OD1-N 3.33Å; D220-I223 HydrophobicContact CB-CB 3.98Å; D220-I223 HydrophobicContact CB-CD1 3.82Å; D220-I223 HydrophobicContact CB-CG1 3.85Å; D220-I223 PolarHBondContact O-N 3.02Å; D220-I223 PolarHBondContact OD1-N 3.38Å; D220-I223 WeakPolarHBondContact OD2-CD1 3.41Å; D220-I223 WeakPolarHBondContact OD2-CG1 3.35Å; D220-E224 PolarHBondContact O-N 2.93Å
221	R	70.4	Confident	67.9	Low	194 Å²	194	87.7 Å²	87.7	73%	0.732	47%	0.465	S	S	*	.	H	α-helix	trans	-55.5	-28.9	176.9	-65.1	-172.4	-176.6	-167.3	2.7	112.4	N219 S225	N219-R221 PolarHBondContact O-N 2.95Å; R221-S225 VanDerWaalsContact O-CB 3.24Å; R221-S225 WeakPolarHBondContact O-CB 3.4Å; R221-S225 PolarHBondContact O-N 3.4Å
222	W	67.9	Low	68.2	Low	108 Å²	108	83 Å²	83	41%	0.409	45%	0.446	S	S	.	.	H	α-helix	trans	-67.3	-52	174.7	-177.1	94.3	0	0	0	109.8	F201 L204 D220 E224 S225 C226	F201-W222 AromaticContact CD1-CE2 3.85Å; F201-W222 AromaticContact CD1-CZ2 3.54Å; F201-W222 HydrophobicContact CD1-CZ2 3.54Å; F201-W222 AromaticContact CD1-NE1 3.8Å; F201-W222 AromaticContact CE1-CE2 3.95Å; F201-W222 HydrophobicContact CE1-CH2 4.07Å; F201-W222 AromaticContact CE1-CZ2 3.42Å; F201-W222 HydrophobicContact CE1-CZ2 3.42Å; F201-W222 VanDerWaalsContact CE1-CZ2 3.42Å; L204-W222 VanDerWaalsContact CD1-CD1 3.43Å; L204-W222 HydrophobicContact CD1-CG 4.33Å; D220-W222 PolarHBondContact O-N 3.38Å; D220-W222 VanDerWaalsContact O-N 3.13Å; D220-W222 WeakPolarHBondContact OD1-CA 3.38Å; D220-W222 WeakPolarHBondContact OD1-CB 3.43Å; D220-W222 PolarHBondContact OD1-N 3.33Å; W222-E224 PolarHBondContact O-N 2.97Å; W222-S225 PolarHBondContact O-N 3.49Å; W222-C226 PolarHBondContact O-N 2.68Å; W222-C226 PolarHBondContact O-SG 3.1Å
223	I	71.2	Confident	68.8	Low	82 Å²	82	81.1 Å²	81.1	42%	0.421	44%	0.435	S	S	.	.	H	α-helix	trans	-60.4	-46.4	178	-64.2	176.9	0	0	0	110.9	D220 S225 C226 I227	D220-I223 HydrophobicContact CB-CB 3.98Å; D220-I223 HydrophobicContact CB-CD1 3.82Å; D220-I223 HydrophobicContact CB-CG1 3.85Å; D220-I223 PolarHBondContact O-N 3.02Å; D220-I223 PolarHBondContact OD1-N 3.38Å; D220-I223 WeakPolarHBondContact OD2-CD1 3.41Å; D220-I223 WeakPolarHBondContact OD2-CG1 3.35Å; I223-S225 PolarHBondContact O-N 3.31Å; I223-C226 WeakPolarHBondContact O-CB 3.41Å; I223-C226 PolarHBondContact O-N 2.88Å; I223-C226 VanDerWaalsContact O-N 3.11Å; I223-I227 HydrophobicContact CG2-CD1 3.7Å; I223-I227 HydrophobicContact CG2-CG1 4.23Å; I223-I227 WeakPolarHBondContact O-CG1 3.45Å; I223-I227 PolarHBondContact O-N 3.31Å
224	E	76.5	Confident	69.4	Low	95 Å²	95	79.6 Å²	79.6	44%	0.444	43%	0.426	S	S	.	.	H	α-helix	trans	-58.9	-46	178.3	-72.6	-177.6	172.5	0	0	111.9	D220 W222 C226 I227 A228	D220-E224 PolarHBondContact O-N 2.93Å; W222-E224 PolarHBondContact O-N 2.97Å; E224-C226 VanDerWaalsContact C-N 3.29Å; E224-C226 PolarHBondContact O-N 3.02Å; E224-I227 PolarHBondContact O-N 2.84Å; E224-A228 WeakPolarHBondContact O-CB 3.41Å; E224-A228 PolarHBondContact O-N 3.12Å
225	S	72.2	Confident	69.6	Low	34 Å²	34	76.5 Å²	76.5	24%	0.238	40%	0.404	C	S	.	.	H	α-helix	trans	-61.3	-39.2	175.6	-179.8	0	0	0	0	111.4	R221 W222 I223 A228 H229	R221-S225 VanDerWaalsContact O-CB 3.24Å; R221-S225 WeakPolarHBondContact O-CB 3.4Å; R221-S225 PolarHBondContact O-N 3.4Å; W222-S225 PolarHBondContact O-N 3.49Å; I223-S225 PolarHBondContact O-N 3.31Å; S225-A228 PolarHBondContact O-N 3.38Å; S225-H229 PolarHBondContact O-N 3.24Å; S225-H229 PolarHBondContact O-ND1 3.12Å; S225-H229 PolarHBondContact OG-ND1 2.86Å
226	C	66.3	Low	69.8	Low	22 Å²	22	73 Å²	73	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-44.6	177.8	-66.5	0	0	0	0	112.4	F201 W222 I223 E224 T230	F201-C226 WeakPolarHBondContact CE1-SG 3.41Å; W222-C226 PolarHBondContact O-N 2.68Å; W222-C226 PolarHBondContact O-SG 3.1Å; I223-C226 WeakPolarHBondContact O-CB 3.41Å; I223-C226 PolarHBondContact O-N 2.88Å; I223-C226 VanDerWaalsContact O-N 3.11Å; E224-C226 VanDerWaalsContact C-N 3.29Å; E224-C226 PolarHBondContact O-N 3.02Å; C226-T230 VanDerWaalsContact O-CB 3.31Å; C226-T230 WeakPolarHBondContact O-CB 3.37Å; C226-T230 PolarHBondContact O-N 3.41Å; C226-T230 PolarHBondContact O-OG1 3.28Å
227	I	71.9	Confident	70.3	Confident	92 Å²	92	69.9 Å²	69.9	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-60.1	-48.9	175.6	-67.3	168.8	0	0	0	109.2	I223 E224 H229 T230 E231	I223-I227 HydrophobicContact CG2-CD1 3.7Å; I223-I227 HydrophobicContact CG2-CG1 4.23Å; I223-I227 WeakPolarHBondContact O-CG1 3.45Å; I223-I227 PolarHBondContact O-N 3.31Å; E224-I227 PolarHBondContact O-N 2.84Å; I227-H229 PolarHBondContact O-N 3.15Å; I227-T230 PolarHBondContact O-N 2.84Å; I227-T230 VanDerWaalsContact O-N 3.17Å; I227-E231 HydrophobicContact CG2-CG 4.28Å; I227-E231 WeakPolarHBondContact O-CG 3.2Å; I227-E231 PolarHBondContact O-N 3.05Å
228	A	74.9	Confident	70.8	Confident	46 Å²	46	73.5 Å²	73.5	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-47.3	-179.1	0	0	0	0	0	112.7	E224 S225 T230 E231 D232	E224-A228 WeakPolarHBondContact O-CB 3.41Å; E224-A228 PolarHBondContact O-N 3.12Å; S225-A228 PolarHBondContact O-N 3.38Å; A228-T230 VanDerWaalsContact C-N 3.31Å; A228-T230 PolarHBondContact O-N 2.89Å; A228-E231 PolarHBondContact O-N 2.77Å; A228-D232 WeakPolarHBondContact O-CB 3.05Å; A228-D232 PolarHBondContact O-N 3.34Å
229	H	70.8	Confident	71.2	Confident	76 Å²	76	70.9 Å²	70.9	35%	0.352	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-35.8	177.5	-77	82.3	0	0	0	112.3	L197 S225 I227 F233	L197-H229 HydrophobicContact CD2-CB 4.26Å; S225-H229 PolarHBondContact O-N 3.24Å; S225-H229 PolarHBondContact O-ND1 3.12Å; S225-H229 PolarHBondContact OG-ND1 2.86Å; I227-H229 PolarHBondContact O-N 3.15Å; H229-F233 VanDerWaalsContact O-CB 3.29Å; H229-F233 WeakPolarHBondContact O-CB 3.41Å; H229-F233 PolarHBondContact O-N 3.41Å
230	T	70.2	Confident	71.9	Confident	62 Å²	62	66.2 Å²	66.2	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-68.9	-44	177.1	-55.2	0	0	0	0	110.8	C226 I227 A228 F233 L234	C226-T230 VanDerWaalsContact O-CB 3.31Å; C226-T230 WeakPolarHBondContact O-CB 3.37Å; C226-T230 PolarHBondContact O-N 3.41Å; C226-T230 PolarHBondContact O-OG1 3.28Å; I227-T230 PolarHBondContact O-N 2.84Å; I227-T230 VanDerWaalsContact O-N 3.17Å; A228-T230 VanDerWaalsContact C-N 3.31Å; A228-T230 PolarHBondContact O-N 2.89Å; T230-F233 WeakPolarHBondContact O-CB 3.4Å; T230-F233 PolarHBondContact O-N 3.45Å; T230-L234 HydrophobicContact CG2-CD1 3.99Å; T230-L234 HydrophobicContact CG2-CG 4.38Å; T230-L234 WeakPolarHBondContact O-CB 3.31Å; T230-L234 VanDerWaalsContact O-CG 3.29Å; T230-L234 WeakPolarHBondContact O-CG 3.41Å; T230-L234 PolarHBondContact O-N 3.46Å
231	E	71.9	Confident	72.2	Confident	104 Å²	104	67.3 Å²	67.3	49%	0.486	32%	0.318	S	S	.	.	H	α-helix	trans	-63.1	-41.9	176.1	-75	-169.5	174.9	0	0	112.4	I227 A228 F233 L234 R235	I227-E231 HydrophobicContact CG2-CG 4.28Å; I227-E231 WeakPolarHBondContact O-CG 3.2Å; I227-E231 PolarHBondContact O-N 3.05Å; A228-E231 PolarHBondContact O-N 2.77Å; E231-F233 VanDerWaalsContact C-N 3.34Å; E231-L234 PolarHBondContact O-N 3.23Å; E231-R235 WeakPolarHBondContact O-CB 3.41Å; E231-R235 PolarHBondContact O-N 3.42Å
232	D	70	Confident	72.2	Confident	76 Å²	76	65.6 Å²	65.6	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-62.8	-41.6	175.2	-78.9	-21	0	0	0	111.4	A228 R235	A228-D232 WeakPolarHBondContact O-CB 3.05Å; A228-D232 PolarHBondContact O-N 3.34Å; D232-R235 WeakPolarHBondContact O-CB 3.43Å; D232-R235 PolarHBondContact O-N 3.02Å; D232-R235 IonicContact OD1-CZ 3.25Å; D232-R235 IonicContact OD1-NH1 2.72Å; D232-R235 PolarHBondContact OD1-NH1 2.88Å; D232-R235 IonicContact OD1-NH2 2.74Å; D232-R235 PolarHBondContact OD1-NH2 3.08Å
233	F	71.4	Confident	72.2	Confident	25 Å²	25	64.2 Å²	64.2	11%	0.11	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-41.4	174.7	170.7	-98.6	0	0	0	112.5	W74 V189 I190 Q193 H229 T230 E231 P236 F237	W74-F233 AromaticContact CH2-CD2 3.69Å; W74-F233 HydrophobicContact CH2-CD2 3.69Å; W74-F233 AromaticContact CH2-CE2 3.97Å; W74-F233 HydrophobicContact CH2-CE2 3.97Å; W74-F233 AromaticContact CZ2-CD2 3.82Å; W74-F233 HydrophobicContact CZ2-CD2 3.82Å; W74-F233 AromaticContact CZ2-CE2 3.68Å; W74-F233 HydrophobicContact CZ2-CE2 3.68Å; V189-F233 HydrophobicContact CG1-CE2 3.55Å; V189-F233 HydrophobicContact CG1-CZ 3.75Å; I190-F233 HydrophobicContact CG1-CZ 4.05Å; Q193-F233 HydrophobicContact CB-CD2 4.28Å; Q193-F233 HydrophobicContact CB-CE2 3.9Å; Q193-F233 HydrophobicContact CG-CD2 3.83Å; Q193-F233 HydrophobicContact CG-CE2 3.58Å; H229-F233 VanDerWaalsContact O-CB 3.29Å; H229-F233 WeakPolarHBondContact O-CB 3.41Å; H229-F233 PolarHBondContact O-N 3.41Å; T230-F233 WeakPolarHBondContact O-CB 3.4Å; T230-F233 PolarHBondContact O-N 3.45Å; E231-F233 VanDerWaalsContact C-N 3.34Å; F233-P236 WeakPolarHBondContact O-CD 3.49Å; F233-F237 HydrophobicContact CZ-CE2 4.37Å
234	L	73.6	Confident	72.3	Confident	53 Å²	53	60.4 Å²	60.4	28%	0.277	30%	0.297	S	S	.	.	H	α-helix	trans	-79.3	-16.8	-178.6	-68.5	178.4	0	0	0	113.7	T230 E231 F237	T230-L234 HydrophobicContact CG2-CD1 3.99Å; T230-L234 HydrophobicContact CG2-CG 4.38Å; T230-L234 WeakPolarHBondContact O-CB 3.31Å; T230-L234 VanDerWaalsContact O-CG 3.29Å; T230-L234 WeakPolarHBondContact O-CG 3.41Å; T230-L234 PolarHBondContact O-N 3.46Å; E231-L234 PolarHBondContact O-N 3.23Å; L234-F237 WeakPolarHBondContact O-CB 3.38Å; L234-F237 PolarHBondContact O-N 3.34Å
235	R	70.4	Confident	72.1	Confident	76 Å²	76	57.9 Å²	57.9	29%	0.287	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-51	-47.2	-175.8	-168.6	174.8	-71.9	137.4	5.4	115	F107 E231 D232 F237 R238	F107-R235 HydrophobicContact CG-CG 4.48Å; E231-R235 WeakPolarHBondContact O-CB 3.41Å; E231-R235 PolarHBondContact O-N 3.42Å; D232-R235 WeakPolarHBondContact O-CB 3.43Å; D232-R235 PolarHBondContact O-N 3.02Å; D232-R235 IonicContact OD1-CZ 3.25Å; D232-R235 IonicContact OD1-NH1 2.72Å; D232-R235 PolarHBondContact OD1-NH1 2.88Å; D232-R235 IonicContact OD1-NH2 2.74Å; D232-R235 PolarHBondContact OD1-NH2 3.08Å; R235-F237 VanDerWaalsContact C-N 3.28Å; R235-F237 PolarHBondContact O-N 3.36Å; R235-R238 WeakPolarHBondContact O-CB 3.44Å; R235-R238 VanDerWaalsContact O-CG 3.24Å; R235-R238 WeakPolarHBondContact O-CG 3.41Å; R235-R238 PolarHBondContact O-N 2.64Å
236	P	68.2	Low	72.2	Confident	12 Å²	12	59.1 Å²	59.1	8%	0.078	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-66.2	-26.4	176.3	16.1	-25.3	0	0	0	114.5	W74 F107 N108 F233 R238	W74-P236 HydrophobicContact CE3-CG 4.12Å; W74-P236 HydrophobicContact CH2-CG 4.28Å; W74-P236 HydrophobicContact CZ3-CG 3.52Å; F107-P236 HydrophobicContact CD1-CB 3.63Å; F107-P236 HydrophobicContact CD1-CG 4Å; F107-P236 HydrophobicContact CE1-CB 3.74Å; F107-P236 VanDerWaalsContact CE1-CD 3.46Å; F107-P236 HydrophobicContact CE1-CG 3.61Å; N108-P236 PolarHBondContact ND2-O 2.93Å; N108-P236 WeakPolarHBondContact OD1-CA 3.45Å; N108-P236 PolarHBondContact OD1-O 2.97Å; F233-P236 WeakPolarHBondContact O-CD 3.49Å; P236-R238 PolarHBondContact O-N 3.28Å
237	F	74.8	Confident	72.4	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.009	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-76	-3.6	178.5	-62.8	-76.9	0	0	0	112.5	L121 L185 V189 F233 L234 R235 V239 L240 L245 F248	L121-F237 HydrophobicContact CD2-CD1 4.05Å; L121-F237 HydrophobicContact CD2-CE1 4.25Å; L185-F237 HydrophobicContact CD1-CE1 4.23Å; L185-F237 HydrophobicContact CD2-CE1 4.05Å; V189-F237 HydrophobicContact CB-CZ 4.39Å; V189-F237 HydrophobicContact CG1-CE2 4.06Å; V189-F237 HydrophobicContact CG1-CZ 3.74Å; V189-F237 HydrophobicContact CG2-CZ 4.24Å; F233-F237 HydrophobicContact CZ-CE2 4.37Å; L234-F237 WeakPolarHBondContact O-CB 3.38Å; L234-F237 PolarHBondContact O-N 3.34Å; R235-F237 VanDerWaalsContact C-N 3.28Å; R235-F237 PolarHBondContact O-N 3.36Å; F237-V239 PolarHBondContact O-N 2.92Å; F237-V239 VanDerWaalsContact O-N 3.08Å; F237-L240 HydrophobicContact CB-CD1 4.28Å; F237-L240 HydrophobicContact CD1-CD1 3.89Å; F237-L240 WeakPolarHBondContact O-CA 3.38Å; F237-L240 WeakPolarHBondContact O-CB 3.2Å; F237-L240 PolarHBondContact O-N 3.43Å; F237-L245 HydrophobicContact CB-CD2 3.77Å; F237-F248 HydrophobicContact CD1-CD1 4.46Å; F237-F248 HydrophobicContact CD1-CE1 4.1Å; F237-F248 HydrophobicContact CD1-CZ 4.49Å; F237-F248 HydrophobicContact CD2-CE1 4.2Å; F237-F248 HydrophobicContact CE1-CE1 4Å; F237-F248 AromaticContact CE1-CZ 3.96Å; F237-F248 HydrophobicContact CE1-CZ 3.96Å; F237-F248 HydrophobicContact CE2-CE1 4.1Å; F237-F248 HydrophobicContact CE2-CZ 4.36Å; F237-F248 HydrophobicContact CG-CE1 4.19Å; F237-F248 AromaticContact CZ-CE1 3.99Å; F237-F248 HydrophobicContact CZ-CE1 3.99Å; F237-F248 AromaticContact CZ-CZ 3.88Å; F237-F248 HydrophobicContact CZ-CZ 3.88Å
238	R	74.2	Confident	72.5	Confident	164 Å²	164	57 Å²	57	62%	0.619	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-61.6	-15.8	174.9	-69.8	179.6	-179.7	-169.5	-0.4	114.6	R235 P236	R235-R238 WeakPolarHBondContact O-CB 3.44Å; R235-R238 VanDerWaalsContact O-CG 3.24Å; R235-R238 WeakPolarHBondContact O-CG 3.41Å; R235-R238 PolarHBondContact O-N 2.64Å; P236-R238 PolarHBondContact O-N 3.28Å
239	V	75.6	Confident	72.3	Confident	21 Å²	21	61.1 Å²	61.1	13%	0.127	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-69.1	-28.5	170.5	168.9	0	0	0	0	111.2	N14 N108 Y118 L121 V122 N125 F237	N14-V239 HydrophobicContact CB-CG1 3.91Å; N14-V239 PolarHBondContact ND2-O 2.88Å; N108-V239 HydrophobicContact CB-CG2 4.38Å; N108-V239 WeakPolarHBondContact ND2-CB 3.14Å; N108-V239 WeakPolarHBondContact ND2-CG2 2.99Å; Y118-V239 HydrophobicContact CD2-CG1 4.37Å; Y118-V239 HydrophobicContact CE2-CG1 4.14Å; L121-V239 HydrophobicContact CB-CG1 4.25Å; V122-V239 HydrophobicContact CG2-CG1 4.34Å; N125-V239 PolarHBondContact ND2-O 3.27Å; F237-V239 PolarHBondContact O-N 2.92Å; F237-V239 VanDerWaalsContact O-N 3.08Å
240	L	78.2	Confident	72.3	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	30%	0.295	C	S	.	.	S	Bend	trans	-66.3	141	173.2	-62.9	179.9	0	0	0	110	L121 L124 N125 F237 T244 L245	L121-L240 HydrophobicContact CB-CD2 4.05Å; L121-L240 HydrophobicContact CD2-CD1 4.2Å; L121-L240 HydrophobicContact CD2-CD2 3.88Å; L121-L240 HydrophobicContact CD2-CG 4.04Å; L121-L240 WeakPolarHBondContact O-CD2 3.49Å; L124-L240 HydrophobicContact CB-CD2 3.82Å; L124-L240 HydrophobicContact CD1-CD2 3.89Å; N125-L240 VanDerWaalsContact OD1-CA 3.27Å; N125-L240 WeakPolarHBondContact OD1-CA 3.39Å; F237-L240 HydrophobicContact CB-CD1 4.28Å; F237-L240 HydrophobicContact CD1-CD1 3.89Å; F237-L240 WeakPolarHBondContact O-CA 3.38Å; F237-L240 WeakPolarHBondContact O-CB 3.2Å; F237-L240 PolarHBondContact O-N 3.43Å; L240-T244 HydrophobicContact CB-CG2 4.48Å; L240-T244 HydrophobicContact CD1-CG2 4.46Å; L240-T244 HydrophobicContact CD2-CG2 4.01Å; L240-L245 HydrophobicContact CB-CD1 4.48Å; L240-L245 HydrophobicContact CB-CD2 4.28Å; L240-L245 HydrophobicContact CB-CG 3.81Å; L240-L245 HydrophobicContact CD1-CD2 4.46Å; L240-L245 WeakPolarHBondContact O-CD1 3.26Å
241	K	76.1	Confident	72.2	Confident	65 Å²	65	62.3 Å²	62.3	28%	0.283	29%	0.291	S	S	.	.			trans	-65.8	158.5	172.3	-72.9	-169.3	173.9	-174.9	0	110.2	N13 N125 D243 T244 L245	N13-K241 WeakPolarHBondContact O-CE 3.34Å; N13-K241 PolarHBondContact OD1-NZ 2.9Å; N125-K241 PolarHBondContact OD1-N 3.25Å; K241-D243 VanDerWaalsContact C-N 3.27Å; K241-D243 PolarHBondContact O-N 2.84Å; K241-T244 CarbonylContact O-C 3.56Å; K241-T244 WeakPolarHBondContact O-CB 3.32Å; K241-T244 PolarHBondContact O-N 3.25Å; K241-T244 VanDerWaalsContact O-N 3.12Å; K241-L245 WeakPolarHBondContact O-CB 3.33Å; K241-L245 PolarHBondContact O-N 3.45Å
242	F	69.1	Low	72	Confident	157 Å²	157	58.2 Å²	58.2	69%	0.689	27%	0.273	S	S	*	.	H	α-helix	trans	-55.8	-43.1	-178.5	-172.4	-96.8	0	0	0	112.1	T244 L245 V246	F242-T244 PolarHBondContact O-N 3.28Å; F242-L245 WeakPolarHBondContact O-CB 3.41Å; F242-L245 PolarHBondContact O-N 3.44Å; F242-V246 HydrophobicContact CD1-CG2 3.93Å; F242-V246 HydrophobicContact CE1-CG2 3.57Å; F242-V246 HydrophobicContact CE2-CG2 4.45Å; F242-V246 HydrophobicContact CZ-CG2 3.87Å; F242-V246 VanDerWaalsContact O-CG2 3.3Å; F242-V246 WeakPolarHBondContact O-CG2 3.33Å; F242-V246 PolarHBondContact O-N 3.33Å
243	D	69.9	Low	71.8	Confident	80 Å²	80	57.1 Å²	57.1	43%	0.428	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-49.7	176.4	-63.7	-17.8	0	0	0	110.8	E128 K132 K241 L245 V246 I247	E128-D243 WeakPolarHBondContact OE1-CB 3.29Å; K132-D243 IonicContact NZ-OD2 2.81Å; K132-D243 PolarHBondContact NZ-OD2 3.27Å; K241-D243 VanDerWaalsContact C-N 3.27Å; K241-D243 PolarHBondContact O-N 2.84Å; D243-L245 VanDerWaalsContact C-N 3.34Å; D243-L245 PolarHBondContact O-N 3.22Å; D243-V246 PolarHBondContact O-N 3.38Å; D243-I247 WeakPolarHBondContact O-CG1 3.5Å; D243-I247 PolarHBondContact O-N 2.86Å
244	T	72.9	Confident	71.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-62	-38.3	176	-30.9	0	0	0	0	112.7	L124 N125 E128 F182 L240 K241 F242 I247 F248	L124-T244 HydrophobicContact CB-CG2 4.21Å; N125-T244 PolarHBondContact OD1-OG1 2.85Å; E128-T244 PolarHBondContact OE2-N 3.36Å; E128-T244 PolarHBondContact OE2-OG1 3.2Å; F182-T244 HydrophobicContact CE1-CG2 4.46Å; F182-T244 HydrophobicContact CZ-CG2 3.88Å; L240-T244 HydrophobicContact CB-CG2 4.48Å; L240-T244 HydrophobicContact CD1-CG2 4.46Å; L240-T244 HydrophobicContact CD2-CG2 4.01Å; K241-T244 CarbonylContact O-C 3.56Å; K241-T244 WeakPolarHBondContact O-CB 3.32Å; K241-T244 PolarHBondContact O-N 3.25Å; K241-T244 VanDerWaalsContact O-N 3.12Å; F242-T244 PolarHBondContact O-N 3.28Å; T244-I247 PolarHBondContact O-N 3.35Å; T244-F248 WeakPolarHBondContact O-CB 3.18Å; T244-F248 PolarHBondContact O-N 3.07Å
245	L	72.2	Confident	71	Confident	43 Å²	43	58.8 Å²	58.8	23%	0.225	29%	0.287	C	S	.	.	H	α-helix	trans	-65.2	-41.5	176	-87	163.7	0	0	0	112	F237 L240 K241 F242 D243 F248 Y249	F237-L245 HydrophobicContact CB-CD2 3.77Å; L240-L245 HydrophobicContact CB-CD1 4.48Å; L240-L245 HydrophobicContact CB-CD2 4.28Å; L240-L245 HydrophobicContact CB-CG 3.81Å; L240-L245 HydrophobicContact CD1-CD2 4.46Å; L240-L245 WeakPolarHBondContact O-CD1 3.26Å; K241-L245 WeakPolarHBondContact O-CB 3.33Å; K241-L245 PolarHBondContact O-N 3.45Å; F242-L245 WeakPolarHBondContact O-CB 3.41Å; F242-L245 PolarHBondContact O-N 3.44Å; D243-L245 VanDerWaalsContact C-N 3.34Å; D243-L245 PolarHBondContact O-N 3.22Å; L245-F248 PolarHBondContact O-N 2.84Å; L245-Y249 VanDerWaalsContact O-CB 3.25Å; L245-Y249 WeakPolarHBondContact O-CB 3.41Å; L245-Y249 PolarHBondContact O-N 3.14Å
246	V	73.1	Confident	70.4	Confident	59 Å²	59	58.2 Å²	58.2	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-42.5	176.9	170.1	0	0	0	0	110	F242 D243 Y249 N250	F242-V246 HydrophobicContact CD1-CG2 3.93Å; F242-V246 HydrophobicContact CE1-CG2 3.57Å; F242-V246 HydrophobicContact CE2-CG2 4.45Å; F242-V246 HydrophobicContact CZ-CG2 3.87Å; F242-V246 VanDerWaalsContact O-CG2 3.3Å; F242-V246 WeakPolarHBondContact O-CG2 3.33Å; F242-V246 PolarHBondContact O-N 3.33Å; D243-V246 PolarHBondContact O-N 3.38Å; V246-Y249 PolarHBondContact O-N 3.36Å; V246-N250 WeakPolarHBondContact O-CB 3.04Å; V246-N250 VanDerWaalsContact O-CG 3.24Å; V246-N250 PolarHBondContact O-N 2.98Å; V246-N250 PolarHBondContact O-ND2 3.2Å
247	I	72	Confident	70	Confident	68 Å²	68	63.2 Å²	63.2	35%	0.349	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-47.4	174.7	-62.3	164.7	0	0	0	110.1	F182 D243 T244 Y249 N250 H251	F182-I247 HydrophobicContact CD2-CG2 3.97Å; F182-I247 HydrophobicContact CE2-CB 4.09Å; F182-I247 HydrophobicContact CE2-CG2 3.31Å; F182-I247 HydrophobicContact CZ-CB 4.05Å; F182-I247 HydrophobicContact CZ-CG2 3.76Å; D243-I247 WeakPolarHBondContact O-CG1 3.5Å; D243-I247 PolarHBondContact O-N 2.86Å; T244-I247 PolarHBondContact O-N 3.35Å; I247-Y249 VanDerWaalsContact C-N 3.34Å; I247-Y249 PolarHBondContact O-N 3.21Å; I247-N250 PolarHBondContact O-N 3.39Å; I247-H251 WeakPolarHBondContact O-CB 3.49Å; I247-H251 PolarHBondContact O-N 3.28Å
248	F	73	Confident	69	Low	3 Å²	3	67.2 Å²	67.2	1%	0.013	36%	0.356	C	S	.	.	H	α-helix	trans	-57.8	-47.3	176.2	-178.6	-120.2	0	0	0	111.7	F182 L185 I190 F237 T244 L245 H251 T252	F182-F248 HydrophobicContact CD1-CB 4.21Å; F182-F248 AromaticContact CD1-CD2 3.72Å; F182-F248 HydrophobicContact CD1-CD2 3.72Å; F182-F248 HydrophobicContact CD1-CG 4.43Å; F182-F248 HydrophobicContact CE1-CB 3.64Å; F182-F248 AromaticContact CE1-CD2 3.95Å; F182-F248 HydrophobicContact CE1-CD2 3.95Å; F182-F248 HydrophobicContact CE1-CG 4.23Å; F182-F248 HydrophobicContact CZ-CB 4.41Å; L185-F248 HydrophobicContact CB-CD2 4.4Å; L185-F248 HydrophobicContact CB-CE2 3.65Å; L185-F248 HydrophobicContact CB-CZ 4.4Å; L185-F248 HydrophobicContact CD1-CD2 4.08Å; L185-F248 HydrophobicContact CD1-CE2 3.95Å; L185-F248 HydrophobicContact CG-CE2 4.44Å; I190-F248 HydrophobicContact CD1-CE1 4.48Å; I190-F248 HydrophobicContact CD1-CE2 3.7Å; I190-F248 HydrophobicContact CD1-CZ 3.53Å; I190-F248 HydrophobicContact CG1-CZ 4.29Å; F237-F248 HydrophobicContact CD1-CD1 4.46Å; F237-F248 HydrophobicContact CD1-CE1 4.1Å; F237-F248 HydrophobicContact CD1-CZ 4.49Å; F237-F248 HydrophobicContact CD2-CE1 4.2Å; F237-F248 HydrophobicContact CE1-CE1 4Å; F237-F248 AromaticContact CE1-CZ 3.96Å; F237-F248 HydrophobicContact CE1-CZ 3.96Å; F237-F248 HydrophobicContact CE2-CE1 4.1Å; F237-F248 HydrophobicContact CE2-CZ 4.36Å; F237-F248 HydrophobicContact CG-CE1 4.19Å; F237-F248 AromaticContact CZ-CE1 3.99Å; F237-F248 HydrophobicContact CZ-CE1 3.99Å; F237-F248 AromaticContact CZ-CZ 3.88Å; F237-F248 HydrophobicContact CZ-CZ 3.88Å; T244-F248 WeakPolarHBondContact O-CB 3.18Å; T244-F248 PolarHBondContact O-N 3.07Å; L245-F248 PolarHBondContact O-N 2.84Å; F248-H251 PolarHBondContact O-N 3.01Å; F248-T252 VanDerWaalsContact O-CB 3.31Å; F248-T252 WeakPolarHBondContact O-CB 3.27Å; F248-T252 PolarHBondContact O-N 3.41Å; F248-T252 PolarHBondContact O-OG1 2.88Å
249	Y	70.7	Confident	67.7	Low	132 Å²	132	66.4 Å²	66.4	52%	0.518	36%	0.362	S	S	.	.	H	α-helix	trans	-62.2	-46.4	179.7	-176.7	-95.1	0	0	0	111.3	L245 V246 I247 H251 T252 V253	L245-Y249 VanDerWaalsContact O-CB 3.25Å; L245-Y249 WeakPolarHBondContact O-CB 3.41Å; L245-Y249 PolarHBondContact O-N 3.14Å; V246-Y249 PolarHBondContact O-N 3.36Å; I247-Y249 VanDerWaalsContact C-N 3.34Å; I247-Y249 PolarHBondContact O-N 3.21Å; Y249-H251 VanDerWaalsContact C-N 3.33Å; Y249-H251 PolarHBondContact O-N 3.4Å; Y249-T252 WeakPolarHBondContact O-CB 3.34Å; Y249-T252 PolarHBondContact O-N 3.01Å; Y249-V253 HydrophobicContact CD1-CG2 3.93Å; Y249-V253 HydrophobicContact CE1-CG2 3.53Å; Y249-V253 HydrophobicContact CE2-CG2 4.19Å; Y249-V253 HydrophobicContact CG-CG2 4.42Å; Y249-V253 WeakPolarHBondContact O-CB 3.34Å; Y249-V253 VanDerWaalsContact O-CG2 3.32Å; Y249-V253 WeakPolarHBondContact O-CG2 3.31Å; Y249-V253 PolarHBondContact O-N 2.78Å
250	N	71.1	Confident	67.3	Low	98 Å²	98	68.7 Å²	68.7	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-61.2	-42.6	176.4	-72.9	-25.4	0	0	0	111.7	V246 I247 T252 S254	V246-N250 WeakPolarHBondContact O-CB 3.04Å; V246-N250 VanDerWaalsContact O-CG 3.24Å; V246-N250 PolarHBondContact O-N 2.98Å; V246-N250 PolarHBondContact O-ND2 3.2Å; I247-N250 PolarHBondContact O-N 3.39Å; N250-T252 VanDerWaalsContact C-N 3.35Å; N250-S254 WeakPolarHBondContact O-CB 3.26Å; N250-S254 PolarHBondContact O-N 3.32Å
251	H	68.7	Low	66.7	Low	64 Å²	64	72.1 Å²	72.1	30%	0.296	39%	0.392	S	S	.	.	H	α-helix	trans	-63.7	-41.8	175.3	-167.2	83.4	0	0	0	111.4	I247 F248 Y249 S254 V255	I247-H251 WeakPolarHBondContact O-CB 3.49Å; I247-H251 PolarHBondContact O-N 3.28Å; F248-H251 PolarHBondContact O-N 3.01Å; Y249-H251 VanDerWaalsContact C-N 3.33Å; Y249-H251 PolarHBondContact O-N 3.4Å; H251-S254 WeakPolarHBondContact O-CB 3.45Å; H251-S254 PolarHBondContact O-N 2.84Å; H251-V255 WeakPolarHBondContact O-CG2 3.29Å; H251-V255 PolarHBondContact O-N 3.28Å
252	T	66.8	Low	66.2	Low	18 Å²	18	72.4 Å²	72.4	11%	0.11	40%	0.398	C	S	.	.	H	α-helix	trans	-63.2	-47.6	177.2	-55.7	0	0	0	0	112.1	I190 F248 Y249 N250 S254 V255 T256	I190-T252 HydrophobicContact CD1-CG2 3.38Å; I190-T252 WeakPolarHBondContact CD1-OG1 3.48Å; I190-T252 HydrophobicContact CG1-CG2 3.75Å; I190-T252 HydrophobicContact CG2-CG2 4.1Å; F248-T252 VanDerWaalsContact O-CB 3.31Å; F248-T252 WeakPolarHBondContact O-CB 3.27Å; F248-T252 PolarHBondContact O-N 3.41Å; F248-T252 PolarHBondContact O-OG1 2.88Å; Y249-T252 WeakPolarHBondContact O-CB 3.34Å; Y249-T252 PolarHBondContact O-N 3.01Å; N250-T252 VanDerWaalsContact C-N 3.35Å; T252-S254 VanDerWaalsContact C-N 3.34Å; T252-V255 PolarHBondContact O-N 2.65Å; T252-T256 WeakPolarHBondContact O-CB 3.46Å; T252-T256 PolarHBondContact O-N 2.9Å; T252-T256 PolarHBondContact O-OG1 3.03Å
253	V	66.7	Low	66	Low	54 Å²	54	67.5 Å²	67.5	33%	0.327	38%	0.381	S	S	.	.	H	α-helix	trans	-62.6	-43.8	177.6	170.9	0	0	0	0	109.9	Y249 V255 T256 V257	Y249-V253 HydrophobicContact CD1-CG2 3.93Å; Y249-V253 HydrophobicContact CE1-CG2 3.53Å; Y249-V253 HydrophobicContact CE2-CG2 4.19Å; Y249-V253 HydrophobicContact CG-CG2 4.42Å; Y249-V253 WeakPolarHBondContact O-CB 3.34Å; Y249-V253 VanDerWaalsContact O-CG2 3.32Å; Y249-V253 WeakPolarHBondContact O-CG2 3.31Å; Y249-V253 PolarHBondContact O-N 2.78Å; V253-V255 VanDerWaalsContact C-N 3.34Å; V253-V255 PolarHBondContact O-N 3.49Å; V253-T256 PolarHBondContact O-N 3.44Å; V253-V257 HydrophobicContact CG1-CG2 4.13Å; V253-V257 WeakPolarHBondContact O-CB 3.27Å; V253-V257 VanDerWaalsContact O-CG2 3.26Å; V253-V257 WeakPolarHBondContact O-CG2 3.42Å; V253-V257 PolarHBondContact O-N 3.3Å
254	S	65.8	Low	65.8	Low	81 Å²	81	66.7 Å²	66.7	57%	0.566	38%	0.378	S	S	*	.	H	α-helix	trans	-56.5	-47.2	175.5	-173	0	0	0	0	111.9	N250 H251 T252 A258	N250-S254 WeakPolarHBondContact O-CB 3.26Å; N250-S254 PolarHBondContact O-N 3.32Å; H251-S254 WeakPolarHBondContact O-CB 3.45Å; H251-S254 PolarHBondContact O-N 2.84Å; T252-S254 VanDerWaalsContact C-N 3.34Å; S254-A258 WeakPolarHBondContact O-CB 3.38Å; S254-A258 PolarHBondContact O-N 3.23Å; S254-A258 VanDerWaalsContact O-N 3.13Å
255	V	61.4	Low	65.3	Low	32 Å²	32	71.1 Å²	71.1	19%	0.194	40%	0.403	C	S	.	.	H	α-helix	trans	-67	-39.3	177.6	173.2	0	0	0	0	111.8	S186 H251 T252 V253 A258 I259	S186-V255 WeakPolarHBondContact OG-CG2 3.34Å; H251-V255 WeakPolarHBondContact O-CG2 3.29Å; H251-V255 PolarHBondContact O-N 3.28Å; T252-V255 PolarHBondContact O-N 2.65Å; V253-V255 VanDerWaalsContact C-N 3.34Å; V253-V255 PolarHBondContact O-N 3.49Å; V255-A258 PolarHBondContact O-N 2.87Å; V255-I259 HydrophobicContact CG1-CD1 4.19Å; V255-I259 WeakPolarHBondContact O-CG1 3.28Å; V255-I259 PolarHBondContact O-N 3.37Å
256	T	58.5	Low	64.8	Low	64 Å²	64	73.1 Å²	73.1	39%	0.393	42%	0.416	S	S	.	.	H	α-helix	trans	-69.7	-37.1	-179.2	-52.2	0	0	0	0	111.8	T252 V253 A258 I259	T252-T256 WeakPolarHBondContact O-CB 3.46Å; T252-T256 PolarHBondContact O-N 2.9Å; T252-T256 PolarHBondContact O-OG1 3.03Å; V253-T256 PolarHBondContact O-N 3.44Å; T256-A258 VanDerWaalsContact C-N 3.3Å; T256-I259 PolarHBondContact O-N 3.07Å
257	V	58.5	Low	64.2	Low	117 Å²	117	74.2 Å²	74.2	71%	0.709	42%	0.42	S	S	*	.	H	α-helix	trans	-71.7	-26.3	175.6	172.7	0	0	0	0	111.9	V253 I259	V253-V257 HydrophobicContact CG1-CG2 4.13Å; V253-V257 WeakPolarHBondContact O-CB 3.27Å; V253-V257 VanDerWaalsContact O-CG2 3.26Å; V253-V257 WeakPolarHBondContact O-CG2 3.42Å; V253-V257 PolarHBondContact O-N 3.3Å; V257-I259 VanDerWaalsContact C-N 3.34Å
258	A	54.9	Low	63.5	Low	86 Å²	86	74.7 Å²	74.7	71%	0.711	43%	0.426	S	S	*	.	H	α-helix	trans	-78.3	-14.8	177.6	0	0	0	0	0	114.3	S254 V255 T256	S254-A258 WeakPolarHBondContact O-CB 3.38Å; S254-A258 PolarHBondContact O-N 3.23Å; S254-A258 VanDerWaalsContact O-N 3.13Å; V255-A258 PolarHBondContact O-N 2.87Å; T256-A258 VanDerWaalsContact C-N 3.3Å
259	I	46.2	Very low	62.7	Low	147 Å²	147	81.2 Å²	81.2	75%	0.754	46%	0.464	S	S	*	.			trans	-93.4	0	176.9	-64.9	168.5	0	0	0	109.7	V255 T256 V257	V255-I259 HydrophobicContact CG1-CD1 4.19Å; V255-I259 WeakPolarHBondContact O-CG1 3.28Å; V255-I259 PolarHBondContact O-N 3.37Å; T256-I259 PolarHBondContact O-N 3.07Å; V257-I259 VanDerWaalsContact C-N 3.34Å

Retrieved 259 of 259 residues in 240.6 ms (Link to these results)

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