G4V5A1_SCHMA Loading...

Sporozoite surface protein 2-like

AlphaFold DB , UniProt , Accession G4V5A1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 412 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	39.8	Very low	43.8	Very low	117 Å²	117	75.4 Å²	75.4	58%	0.576	36%	0.358	S	S	*	.				0	139.9	0	-76.4	-165.4	174.8	0	0	108.7	Y3 S186 W189	M1-Y3 VanDerWaalsContact C-N 3.34Å; M1-Y3 PolarHBondContact O-N 2.96Å; M1-S186 WeakPolarHBondContact CE-O 3.43Å; M1-W189 HydrophobicContact CE-CB 3.55Å; M1-W189 HydrophobicContact CE-CG 4Å; M1-W189 HydrophobicContact SD-CB 4.49Å; M1-W189 HydrophobicContact SD-CG 4.41Å
2	N	38.2	Very low	44.2	Very low	119 Å²	119	72.9 Å²	72.9	64%	0.636	35%	0.345	S	S	*	.			trans	-72.4	97.5	170.5	-83.3	-19	0	0	0	107.2	L4 H5	N2-L4 HydrophobicContact CB-CB 4.43Å; N2-L4 PolarHBondContact O-N 3.03Å; N2-H5 PolarHBondContact O-N 3.08Å
3	Y	35.3	Very low	44.6	Very low	142 Å²	142	68.8 Å²	68.8	56%	0.557	33%	0.326	S	S	*	.	H	α-helix	trans	-44	-27.6	169.9	-75.5	-85.6	0	0	0	111.9	M1 H5 C6 L7 E172	M1-Y3 VanDerWaalsContact C-N 3.34Å; M1-Y3 PolarHBondContact O-N 2.96Å; Y3-H5 PolarHBondContact O-N 3.18Å; Y3-C6 PolarHBondContact O-N 3.2Å; Y3-L7 WeakPolarHBondContact O-CB 3.23Å; Y3-L7 PolarHBondContact O-N 3.18Å; Y3-E172 HydrophobicContact CD1-CG 4.31Å; Y3-E172 HydrophobicContact CE1-CG 3.93Å
4	L	36.2	Very low	44.7	Very low	104 Å²	104	66.6 Å²	66.6	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-57.2	-40.7	172.4	-160	73.4	0	0	0	115.1	N2 Y8	N2-L4 HydrophobicContact CB-CB 4.43Å; N2-L4 PolarHBondContact O-N 3.03Å; L4-Y8 WeakPolarHBondContact O-CB 3.34Å; L4-Y8 PolarHBondContact O-N 3.27Å
5	H	43.8	Very low	44.1	Very low	108 Å²	108	70.3 Å²	70.3	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-72.9	-41.2	179.7	-85.5	63.9	0	0	0	111.5	N2 Y3 Y8 I9	N2-H5 PolarHBondContact O-N 3.08Å; Y3-H5 PolarHBondContact O-N 3.18Å; H5-Y8 WeakPolarHBondContact O-CB 3.21Å; H5-Y8 PolarHBondContact O-N 3.21Å; H5-I9 WeakPolarHBondContact O-CG1 3.39Å; H5-I9 PolarHBondContact O-N 3.3Å
6	C	45.3	Very low	43.7	Very low	5 Å²	5	70.4 Å²	70.4	3%	0.034	34%	0.338	C	S	.	.	H	α-helix	trans	-68.1	-41	175.9	-65.1	0	0	0	0	110.9	Y3 Y8 I9 L10 L175	Y3-C6 PolarHBondContact O-N 3.2Å; C6-Y8 VanDerWaalsContact C-N 3.29Å; C6-Y8 PolarHBondContact O-N 3.13Å; C6-I9 PolarHBondContact O-N 3.09Å; C6-L10 WeakPolarHBondContact O-CB 3.09Å; C6-L10 PolarHBondContact O-N 3.15Å; C6-L175 HydrophobicContact CB-CD1 3.33Å; C6-L175 HydrophobicContact CB-CD2 3.52Å; C6-L175 HydrophobicContact CB-CG 3.95Å
7	L	44.8	Very low	43.2	Very low	43 Å²	43	72.1 Å²	72.1	23%	0.225	36%	0.356	C	S	.	.	H	α-helix	trans	-59.5	-38.5	170.5	-176.5	74	0	0	0	111.6	Y3 L10 L11 I171 V239	Y3-L7 WeakPolarHBondContact O-CB 3.23Å; Y3-L7 PolarHBondContact O-N 3.18Å; L7-L10 PolarHBondContact O-N 3.33Å; L7-L11 HydrophobicContact CD1-CD1 4.34Å; L7-L11 HydrophobicContact CD1-CG 4.44Å; L7-L11 HydrophobicContact CD2-CD1 4.3Å; L7-L11 HydrophobicContact CG-CD1 3.82Å; L7-L11 HydrophobicContact CG-CG 4.32Å; L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 2.74Å; L7-I171 HydrophobicContact CD1-CD1 3.59Å; L7-I171 HydrophobicContact CD1-CG2 3.74Å; L7-V239 HydrophobicContact CD1-CG1 3.82Å
8	Y	47.5	Very low	42.8	Very low	101 Å²	101	73 Å²	73	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-65.2	-45.6	175.8	-173.4	-96	0	0	0	111.7	L4 H5 C6 L10 L11 F12	L4-Y8 WeakPolarHBondContact O-CB 3.34Å; L4-Y8 PolarHBondContact O-N 3.27Å; H5-Y8 WeakPolarHBondContact O-CB 3.21Å; H5-Y8 PolarHBondContact O-N 3.21Å; C6-Y8 VanDerWaalsContact C-N 3.29Å; C6-Y8 PolarHBondContact O-N 3.13Å; Y8-L10 VanDerWaalsContact C-N 3.35Å; Y8-L10 PolarHBondContact O-N 3.5Å; Y8-L11 PolarHBondContact O-N 3.47Å; Y8-F12 WeakPolarHBondContact O-CB 3.41Å; Y8-F12 PolarHBondContact O-N 3.32Å
9	I	52.1	Low	42.2	Very low	33 Å²	33	73.3 Å²	73.3	17%	0.169	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-45.5	175	-66.9	164.6	0	0	0	110.3	H5 C6 F12 I13 W189 Y194 L222	H5-I9 WeakPolarHBondContact O-CG1 3.39Å; H5-I9 PolarHBondContact O-N 3.3Å; C6-I9 PolarHBondContact O-N 3.09Å; I9-F12 PolarHBondContact O-N 2.78Å; I9-I13 HydrophobicContact CG2-CD1 3.69Å; I9-I13 HydrophobicContact CG2-CG1 4.47Å; I9-I13 WeakPolarHBondContact O-CB 3.31Å; I9-I13 WeakPolarHBondContact O-CD1 3.33Å; I9-I13 WeakPolarHBondContact O-CG1 3.19Å; I9-I13 PolarHBondContact O-N 2.91Å; I9-W189 HydrophobicContact CD1-CZ2 4.06Å; I9-Y194 HydrophobicContact CD1-CD2 4.4Å; I9-L222 HydrophobicContact CG2-CD1 4.49Å
10	L	51.2	Low	41.4	Very low	1 Å²	1	73.3 Å²	73.3	1%	0.005	37%	0.372	C	S	.	.	H	α-helix	trans	-64.1	-50.4	178.6	-159.3	95.4	0	0	0	111.1	C6 L7 Y8 F12 I13 I14 I171 L174 L175 F225 I229	C6-L10 WeakPolarHBondContact O-CB 3.09Å; C6-L10 PolarHBondContact O-N 3.15Å; L7-L10 PolarHBondContact O-N 3.33Å; Y8-L10 VanDerWaalsContact C-N 3.35Å; Y8-L10 PolarHBondContact O-N 3.5Å; L10-F12 PolarHBondContact O-N 2.96Å; L10-I13 WeakPolarHBondContact O-CB 3.31Å; L10-I13 PolarHBondContact O-N 2.83Å; L10-I14 HydrophobicContact CB-CD1 4.47Å; L10-I14 HydrophobicContact CD2-CD1 3.7Å; L10-I14 HydrophobicContact CG-CD1 3.67Å; L10-I14 WeakPolarHBondContact O-CB 3.41Å; L10-I14 WeakPolarHBondContact O-CD1 3.41Å; L10-I14 WeakPolarHBondContact O-CG1 3.31Å; L10-I14 PolarHBondContact O-N 3.39Å; L10-I171 HydrophobicContact CD2-CG1 4.46Å; L10-I171 HydrophobicContact CD2-CG2 4.06Å; L10-L174 HydrophobicContact CD1-CB 4.08Å; L10-L174 HydrophobicContact CD2-CD1 4.17Å; L10-L175 HydrophobicContact CB-CD2 4.31Å; L10-L175 HydrophobicContact CD1-CD2 4.06Å; L10-F225 HydrophobicContact CD1-CE1 4.17Å; L10-I229 HydrophobicContact CD1-CD1 3.72Å; L10-I229 HydrophobicContact CG-CD1 4.45Å
11	L	47.3	Very low	40.8	Very low	56 Å²	56	75.8 Å²	75.8	29%	0.293	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-37.3	176.5	-79.8	169.4	0	0	0	111.8	L7 Y8 I14 N15 V239	L7-L11 HydrophobicContact CD1-CD1 4.34Å; L7-L11 HydrophobicContact CD1-CG 4.44Å; L7-L11 HydrophobicContact CD2-CD1 4.3Å; L7-L11 HydrophobicContact CG-CD1 3.82Å; L7-L11 HydrophobicContact CG-CG 4.32Å; L7-L11 WeakPolarHBondContact O-CB 3.48Å; L7-L11 VanDerWaalsContact O-CG 3.23Å; L7-L11 WeakPolarHBondContact O-CG 3.44Å; L7-L11 PolarHBondContact O-N 2.74Å; Y8-L11 PolarHBondContact O-N 3.47Å; L11-I14 PolarHBondContact O-N 3.4Å; L11-N15 WeakPolarHBondContact O-CB 3.4Å; L11-N15 PolarHBondContact O-N 2.94Å; L11-N15 PolarHBondContact O-ND2 2.96Å; L11-V239 HydrophobicContact CD1-CG1 4.3Å; L11-V239 HydrophobicContact CD2-CB 4.17Å; L11-V239 HydrophobicContact CD2-CG1 3.72Å; L11-V239 HydrophobicContact CG-CG1 4.22Å
12	F	48.4	Very low	40.2	Very low	46 Å²	46	78.1 Å²	78.1	20%	0.202	39%	0.394	C	S	.	.	H	α-helix	trans	-68.9	-44.7	177.5	-164.4	-91.7	0	0	0	111.2	Y8 I9 L10 I14 N15 F16 M198	Y8-F12 WeakPolarHBondContact O-CB 3.41Å; Y8-F12 PolarHBondContact O-N 3.32Å; I9-F12 PolarHBondContact O-N 2.78Å; L10-F12 PolarHBondContact O-N 2.96Å; F12-I14 VanDerWaalsContact C-N 3.26Å; F12-I14 PolarHBondContact O-N 3.5Å; F12-N15 PolarHBondContact O-N 2.98Å; F12-F16 AromaticContact CD1-CD2 3.99Å; F12-F16 HydrophobicContact CD1-CD2 3.99Å; F12-F16 HydrophobicContact CD1-CE2 4.04Å; F12-F16 HydrophobicContact CD2-CD2 4.35Å; F12-F16 AromaticContact CD2-CE2 3.88Å; F12-F16 HydrophobicContact CD2-CE2 3.88Å; F12-F16 AromaticContact CE1-CD2 3.77Å; F12-F16 HydrophobicContact CE1-CD2 3.77Å; F12-F16 AromaticContact CE1-CE2 3.49Å; F12-F16 HydrophobicContact CE1-CE2 3.49Å; F12-F16 VanDerWaalsContact CE1-CE2 3.49Å; F12-F16 HydrophobicContact CE1-CG 4.45Å; F12-F16 AromaticContact CE1-CZ 3.94Å; F12-F16 HydrophobicContact CE1-CZ 3.94Å; F12-F16 HydrophobicContact CE2-CD2 4.17Å; F12-F16 AromaticContact CE2-CE2 3.32Å; F12-F16 HydrophobicContact CE2-CE2 3.32Å; F12-F16 AromaticContact CE2-CZ 3.95Å; F12-F16 HydrophobicContact CE2-CZ 3.95Å; F12-F16 HydrophobicContact CG-CD2 4.27Å; F12-F16 HydrophobicContact CG-CE2 4.21Å; F12-F16 AromaticContact CZ-CD2 3.86Å; F12-F16 HydrophobicContact CZ-CD2 3.86Å; F12-F16 HydrophobicContact CZ-CE1 4.38Å; F12-F16 AromaticContact CZ-CE2 3.08Å; F12-F16 HydrophobicContact CZ-CE2 3.08Å; F12-F16 AromaticContact CZ-CZ 3.4Å; F12-F16 HydrophobicContact CZ-CZ 3.4Å; F12-F16 VanDerWaalsContact O-CD2 3.29Å; F12-F16 WeakPolarHBondContact O-CD2 3.29Å; F12-F16 PolarHBondContact O-N 2.7Å; F12-M198 HydrophobicContact CE1-CG 4.32Å; F12-M198 HydrophobicContact CE2-CE 4.36Å; F12-M198 HydrophobicContact CZ-CB 4.25Å; F12-M198 HydrophobicContact CZ-CE 4.37Å; F12-M198 HydrophobicContact CZ-CG 3.68Å; F12-M198 HydrophobicContact CZ-SD 4.27Å
13	I	50.5	Low	39.6	Very low	20 Å²	20	77.3 Å²	77.3	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-58.4	-37.8	174.6	-76.4	168.4	0	0	0	112.1	I9 L10 L222 A226 I229	I9-I13 HydrophobicContact CG2-CD1 3.69Å; I9-I13 HydrophobicContact CG2-CG1 4.47Å; I9-I13 WeakPolarHBondContact O-CB 3.31Å; I9-I13 WeakPolarHBondContact O-CD1 3.33Å; I9-I13 WeakPolarHBondContact O-CG1 3.19Å; I9-I13 PolarHBondContact O-N 2.91Å; L10-I13 WeakPolarHBondContact O-CB 3.31Å; L10-I13 PolarHBondContact O-N 2.83Å; I13-L222 HydrophobicContact CD1-CD1 4.09Å; I13-L222 HydrophobicContact CD1-CG 4.13Å; I13-A226 HydrophobicContact CB-CB 4.47Å; I13-A226 VanDerWaalsContact CG2-CA 3.43Å; I13-A226 HydrophobicContact CG2-CB 3.32Å; I13-I229 HydrophobicContact CG2-CD1 4.09Å
14	I	45.5	Very low	39	Very low	37 Å²	37	75.1 Å²	75.1	19%	0.19	39%	0.393	C	S	.	.	H	α-helix	trans	-80.6	-35.6	-174.9	-65	161.9	0	0	0	112.8	L10 L11 F12 I229 I236	L10-I14 HydrophobicContact CB-CD1 4.47Å; L10-I14 HydrophobicContact CD2-CD1 3.7Å; L10-I14 HydrophobicContact CG-CD1 3.67Å; L10-I14 WeakPolarHBondContact O-CB 3.41Å; L10-I14 WeakPolarHBondContact O-CD1 3.41Å; L10-I14 WeakPolarHBondContact O-CG1 3.31Å; L10-I14 PolarHBondContact O-N 3.39Å; L11-I14 PolarHBondContact O-N 3.4Å; F12-I14 VanDerWaalsContact C-N 3.26Å; F12-I14 PolarHBondContact O-N 3.5Å; I14-I229 HydrophobicContact CD1-CG2 4.18Å; I14-I229 HydrophobicContact CG1-CG2 3.7Å; I14-I236 HydrophobicContact CB-CD1 4.1Å; I14-I236 HydrophobicContact CD1-CB 4.5Å; I14-I236 HydrophobicContact CD1-CD1 3.38Å; I14-I236 HydrophobicContact CD1-CG1 4.18Å; I14-I236 HydrophobicContact CD1-CG2 3.62Å; I14-I236 HydrophobicContact CG1-CD1 3.38Å; I14-I236 HydrophobicContact CG2-CD1 3.56Å; I14-I236 HydrophobicContact CG2-CG2 4.31Å
15	N	35.8	Very low	38.5	Very low	123 Å²	123	74.8 Å²	74.8	66%	0.658	39%	0.391	S	S	*	.	H	α-helix	trans	-88.2	-4.2	-175.6	-73.4	-70.7	0	0	0	113.3	L11 F12	L11-N15 WeakPolarHBondContact O-CB 3.4Å; L11-N15 PolarHBondContact O-N 2.94Å; L11-N15 PolarHBondContact O-ND2 2.96Å; F12-N15 PolarHBondContact O-N 2.98Å
16	F	38.3	Very low	37.6	Very low	72 Å²	72	74.9 Å²	74.9	32%	0.316	39%	0.394	S	S	.	.	S	Bend	trans	-87.3	133.9	172.7	-94.6	-102.5	0	0	0	110.7	F12 L18 E199	F12-F16 AromaticContact CD1-CD2 3.99Å; F12-F16 HydrophobicContact CD1-CD2 3.99Å; F12-F16 HydrophobicContact CD1-CE2 4.04Å; F12-F16 HydrophobicContact CD2-CD2 4.35Å; F12-F16 AromaticContact CD2-CE2 3.88Å; F12-F16 HydrophobicContact CD2-CE2 3.88Å; F12-F16 AromaticContact CE1-CD2 3.77Å; F12-F16 HydrophobicContact CE1-CD2 3.77Å; F12-F16 AromaticContact CE1-CE2 3.49Å; F12-F16 HydrophobicContact CE1-CE2 3.49Å; F12-F16 VanDerWaalsContact CE1-CE2 3.49Å; F12-F16 HydrophobicContact CE1-CG 4.45Å; F12-F16 AromaticContact CE1-CZ 3.94Å; F12-F16 HydrophobicContact CE1-CZ 3.94Å; F12-F16 HydrophobicContact CE2-CD2 4.17Å; F12-F16 AromaticContact CE2-CE2 3.32Å; F12-F16 HydrophobicContact CE2-CE2 3.32Å; F12-F16 AromaticContact CE2-CZ 3.95Å; F12-F16 HydrophobicContact CE2-CZ 3.95Å; F12-F16 HydrophobicContact CG-CD2 4.27Å; F12-F16 HydrophobicContact CG-CE2 4.21Å; F12-F16 AromaticContact CZ-CD2 3.86Å; F12-F16 HydrophobicContact CZ-CD2 3.86Å; F12-F16 HydrophobicContact CZ-CE1 4.38Å; F12-F16 AromaticContact CZ-CE2 3.08Å; F12-F16 HydrophobicContact CZ-CE2 3.08Å; F12-F16 AromaticContact CZ-CZ 3.4Å; F12-F16 HydrophobicContact CZ-CZ 3.4Å; F12-F16 VanDerWaalsContact O-CD2 3.29Å; F12-F16 WeakPolarHBondContact O-CD2 3.29Å; F12-F16 PolarHBondContact O-N 2.7Å; F16-L18 PolarHBondContact O-N 2.59Å; F16-E199 HydrophobicContact CD1-CB 4.27Å; F16-E199 HydrophobicContact CE1-CB 4.15Å
17	P	34.4	Very low	36.6	Very low	99 Å²	99	81.6 Å²	81.6	64%	0.643	43%	0.43	S	S	*	.			trans	-57.1	127	171.2	23.7	-29.9	0	0	0	108.2	L19	P17-L19 PolarHBondContact O-N 3.19Å
18	L	35.4	Very low	35.6	Very low	88 Å²	88	86.8 Å²	86.8	46%	0.461	45%	0.453	S	S	.	.			trans	-43.7	115.6	170.7	-79.6	160.9	0	0	0	108.9	F16 S20 E227 V230	F16-L18 PolarHBondContact O-N 2.59Å; L18-S20 VanDerWaalsContact C-N 3.29Å; L18-S20 PolarHBondContact O-N 3.42Å; L18-E227 HydrophobicContact CD2-CG 4.11Å; L18-V230 HydrophobicContact CD1-CB 3.96Å; L18-V230 HydrophobicContact CD1-CG1 3.3Å; L18-V230 HydrophobicContact CD2-CB 3.97Å; L18-V230 HydrophobicContact CD2-CG1 4.22Å; L18-V230 HydrophobicContact CD2-CG2 4.14Å; L18-V230 HydrophobicContact CG-CB 4.05Å; L18-V230 HydrophobicContact CG-CG1 3.74Å; L18-V230 HydrophobicContact CG-CG2 4.21Å
19	L	32.4	Very low	34.4	Very low	79 Å²	79	86.2 Å²	86.2	41%	0.414	46%	0.46	S	S	.	.			trans	-51.1	105.1	155.9	-87	156.3	0	0	0	105.5	P17 I21 E199 I205	P17-L19 PolarHBondContact O-N 3.19Å; L19-I21 PolarHBondContact O-N 2.98Å; L19-E199 WeakPolarHBondContact CD2-OE1 3.48Å; L19-I205 HydrophobicContact CD1-CD1 4.39Å
20	S	25.4	Very low	33	Very low	73 Å²	73	90.2 Å²	90.2	51%	0.51	48%	0.48	S	S	.	.			trans	-54.4	128	-178	-173.3	0	0	0	0	108.2	L18 E22 N23	L18-S20 VanDerWaalsContact C-N 3.29Å; L18-S20 PolarHBondContact O-N 3.42Å; S20-E22 PolarHBondContact O-N 3.45Å; S20-N23 PolarHBondContact O-N 2.91Å; S20-N23 VanDerWaalsContact O-N 3.14Å
21	I	30.1	Very low	31.7	Very low	125 Å²	125	95.4 Å²	95.4	64%	0.641	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-6.6	170.4	-73.7	165.9	0	0	0	112.3	L19 N23 E227	L19-I21 PolarHBondContact O-N 2.98Å; I21-N23 VanDerWaalsContact C-N 3.28Å; I21-N23 PolarHBondContact O-N 3.29Å; I21-E227 HydrophobicContact CD1-CG 4.46Å; I21-E227 VanDerWaalsContact CG1-OE1 3.31Å; I21-E227 WeakPolarHBondContact CG1-OE1 3.25Å
22	E	27	Very low	30.7	Very low	166 Å²	166	97.9 Å²	97.9	78%	0.776	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-0.9	170.8	-83.3	176.3	144.8	0	0	116.2	S20	S20-E22 PolarHBondContact O-N 3.45Å
23	N	24	Very low	29.6	Very low	103 Å²	103	104.9 Å²	104.9	55%	0.551	56%	0.563	S	S	*	*			trans	-124.7	76.8	166.7	-96	-31.9	0	0	0	112.2	S20 I21 I25	S20-N23 PolarHBondContact O-N 2.91Å; S20-N23 VanDerWaalsContact O-N 3.14Å; I21-N23 VanDerWaalsContact C-N 3.28Å; I21-N23 PolarHBondContact O-N 3.29Å; N23-I25 VanDerWaalsContact C-N 3.31Å; N23-I25 PolarHBondContact O-N 3.47Å
24	P	24.5	Very low	28.4	Very low	96 Å²	96	111 Å²	111	62%	0.623	60%	0.596	S	S	*	*			trans	-72.6	91.8	163.7	31.6	-29.4	0	0	0	107	L26	P24-L26 PolarHBondContact O-N 3.01Å
25	I	24	Very low	27.5	Very low	97 Å²	97	114.6 Å²	114.6	50%	0.497	62%	0.619	S	S	.	*			trans	-77.7	68.5	164.3	-49.3	-179.9	0	0	0	107.6	N23 H263	N23-I25 VanDerWaalsContact C-N 3.31Å; N23-I25 PolarHBondContact O-N 3.47Å; I25-H263 HydrophobicContact CD1-CB 4.36Å; I25-H263 WeakPolarHBondContact CD1-ND1 3.12Å
26	L	24.8	Very low	27	Very low	110 Å²	110	116.9 Å²	116.9	58%	0.576	63%	0.631	S	S	*	*			trans	-123.8	53.3	167.5	-140.5	144.1	0	0	0	105.2	P24 E28	P24-L26 PolarHBondContact O-N 3.01Å; L26-E28 PolarHBondContact O-N 2.82Å
27	N	24.1	Very low	26.3	Very low	145 Å²	145	123.9 Å²	123.9	78%	0.775	66%	0.655	S	S	*	*			trans	-77.6	85.3	162.3	-87.3	0.4	0	0	0	107.2	T29	N27-T29 PolarHBondContact O-N 3.45Å
28	E	24.4	Very low	26	Very low	152 Å²	152	122.8 Å²	122.8	71%	0.71	66%	0.663	S	S	*	*			trans	-63.1	86.9	163.3	-160.3	177.7	-142.5	0	0	107.9	L26 I30	L26-E28 PolarHBondContact O-N 2.82Å; E28-I30 VanDerWaalsContact C-N 3.29Å; E28-I30 HydrophobicContact CG-CG1 4.17Å; E28-I30 PolarHBondContact O-N 2.95Å
29	T	22.7	Very low	25.7	Very low	89 Å²	89	124.9 Å²	124.9	55%	0.546	68%	0.679	S	S	.	*			trans	-77.4	88.3	170.7	-46.5	0	0	0	0	108	N27 T31	N27-T29 PolarHBondContact O-N 3.45Å; T29-T31 VanDerWaalsContact C-N 3.33Å; T29-T31 HydrophobicContact CG2-CG2 4.44Å; T29-T31 PolarHBondContact O-N 3.33Å
30	I	23.5	Very low	25.3	Very low	117 Å²	117	132.1 Å²	132.1	60%	0.6	70%	0.703	S	S	*	*			trans	-66.3	93.5	164.2	-60.6	172.8	0	0	0	107.1	E28 T32	E28-I30 VanDerWaalsContact C-N 3.29Å; E28-I30 HydrophobicContact CG-CG1 4.17Å; E28-I30 PolarHBondContact O-N 2.95Å; I30-T32 HydrophobicContact CG2-CG2 3.82Å; I30-T32 PolarHBondContact O-N 2.91Å
31	T	23.6	Very low	25.5	Very low	110 Å²	110	133.8 Å²	133.8	68%	0.675	71%	0.714	S	S	*	*			trans	-73.1	80.2	162.8	31.3	0	0	0	0	108.8	T29 E33	T29-T31 VanDerWaalsContact C-N 3.33Å; T29-T31 HydrophobicContact CG2-CG2 4.44Å; T29-T31 PolarHBondContact O-N 3.33Å; T31-E33 PolarHBondContact O-N 3.03Å; T31-E33 VanDerWaalsContact O-N 3.12Å
32	T	25.2	Very low	25.3	Very low	108 Å²	108	133 Å²	133	66%	0.663	72%	0.715	S	S	*	*			trans	-74.3	82.7	153.9	34.8	0	0	0	0	107.3	I30 L34	I30-T32 HydrophobicContact CG2-CG2 3.82Å; I30-T32 PolarHBondContact O-N 2.91Å; T32-L34 VanDerWaalsContact C-N 3.28Å; T32-L34 PolarHBondContact O-N 2.79Å
33	E	26.7	Very low	25.5	Very low	193 Å²	193	133 Å²	133	90%	0.902	72%	0.715	S	S	*	*			trans	-69.1	99.2	161.6	-89.9	-160.7	156.4	0	0	108.8	T31	T31-E33 PolarHBondContact O-N 3.03Å; T31-E33 VanDerWaalsContact O-N 3.12Å
34	L	25.5	Very low	25.9	Very low	149 Å²	149	134.8 Å²	134.8	78%	0.78	73%	0.725	S	S	*	*			trans	-44.8	126.1	167.7	-73.6	137.5	0	0	0	112.3	T32	T32-L34 VanDerWaalsContact C-N 3.28Å; T32-L34 PolarHBondContact O-N 2.79Å
35	V	24.6	Very low	26.3	Very low	112 Å²	112	138.6 Å²	138.6	68%	0.679	73%	0.734	S	S	*	*				52.8	100.9	125.6	-173.3	0	0	0	0	115.3	R37	V35-R37 HydrophobicContact CG1-CB 4.15Å
36	D	26.5	Very low	26.4	Very low	171 Å²	171	141.9 Å²	141.9	91%	0.914	75%	0.753	S	S	*	*			trans	-123.2	129.9	131.7	-152.1	0.4	0	0	0	111.6
37	R	23.8	Very low	26.6	Very low	219 Å²	219	141.7 Å²	141.7	83%	0.826	76%	0.761	S	S	*	*			trans	-109.2	79.1	-155.5	-173	178.5	166.6	-171.1	-3.7	106.7	V35	V35-R37 HydrophobicContact CG1-CB 4.15Å
38	G	27.5	Very low	26.6	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	77%	0.765	S	S	*	*			trans	-101.5	96	178	0	0	0	0	0	112.2
39	T	29.8	Very low	26.7	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	77%	0.765	S	S	*	*			trans	-46	135.9	-179.3	35.3	0	0	0	0	117.8
40	Y	24.2	Very low	26.8	Very low	232 Å²	232	142 Å²	142	91%	0.91	77%	0.772	S	S	*	*			trans	-52.2	141.7	158.4	-64.2	-94.6	0	0	0	114.1
41	S	29.3	Very low	26.8	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	78%	0.781	S	S	*	*			trans	-170.9	102.6	139.5	-132.5	0	0	0	0	108
42	T	26.4	Very low	26.9	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.663	78%	0.783	S	S	*	*				77	134.2	98.5	47.3	0	0	0	0	115.3
43	E	30.8	Very low	26.9	Very low	165 Å²	165	144.2 Å²	144.2	77%	0.771	79%	0.79	S	S	*	*			trans	81.3	100.7	153.3	-68.2	159.8	-152.5	0	0	115.9
44	D	32	Very low	26.9	Very low	141 Å²	141	143.5 Å²	143.5	75%	0.754	79%	0.786	S	S	*	*				174.6	110.1	112.9	-80.2	-21.4	0	0	0	109.6
45	E	33.2	Very low	26.8	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	79%	0.786	S	S	*	*				72.6	95.3	115.1	-67.9	-164.4	151.7	0	0	116.1
46	N	26.1	Very low	26.8	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	79%	0.794	S	S	*	*			trans	53	70.7	132.1	-149.7	35.8	0	0	0	117.4
47	S	28.5	Very low	26.8	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	78%	0.783	S	S	*	*			trans	-125	111.1	154.2	74.3	0	0	0	0	111	V49	S47-V49 VanDerWaalsContact C-N 3.34Å; S47-V49 PolarHBondContact O-N 2.97Å
48	N	24.9	Very low	26.8	Very low	161 Å²	161	144.2 Å²	144.2	86%	0.861	78%	0.781	S	S	*	*			trans	-80.4	79.8	165.2	-178.4	27.5	0	0	0	107.6
49	V	26.3	Very low	26.7	Very low	116 Å²	116	146 Å²	146	70%	0.703	78%	0.782	S	S	*	*			trans	-149.8	107.6	167.5	-174.8	0	0	0	0	109.3	S47	S47-V49 VanDerWaalsContact C-N 3.34Å; S47-V49 PolarHBondContact O-N 2.97Å
50	T	23.7	Very low	26.5	Very low	115 Å²	115	144.3 Å²	144.3	71%	0.706	77%	0.772	S	S	*	*			trans	9.6	108	148.4	-35.5	0	0	0	0	116.1	V52	T50-V52 PolarHBondContact O-N 3.2Å
51	S	24.9	Very low	26.5	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	77%	0.771	S	S	*	*			trans	-60.8	105.5	158.3	40.7	0	0	0	0	108	N53	S51-N53 PolarHBondContact O-N 2.85Å; S51-N53 VanDerWaalsContact O-N 3.12Å
52	V	25.5	Very low	26.5	Very low	120 Å²	120	143.7 Å²	143.7	73%	0.727	77%	0.769	S	S	*	*			trans	-57.9	113	175.8	171.9	0	0	0	0	108.1	T50 H54	T50-V52 PolarHBondContact O-N 3.2Å; V52-H54 PolarHBondContact O-N 3.14Å; V52-H54 VanDerWaalsContact O-N 3.16Å
53	N	25.1	Very low	26.3	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	77%	0.769	S	S	*	*			trans	-49.7	110.7	164.6	-71.4	-42.4	0	0	0	110	S51	S51-N53 PolarHBondContact O-N 2.85Å; S51-N53 VanDerWaalsContact O-N 3.12Å
54	H	26.7	Very low	26.2	Very low	178 Å²	178	146.3 Å²	146.3	82%	0.824	77%	0.772	S	S	*	*			trans	-110.1	91.9	152.9	-116.2	-73.4	0	0	0	108.3	V52 I56	V52-H54 PolarHBondContact O-N 3.14Å; V52-H54 VanDerWaalsContact O-N 3.16Å; H54-I56 PolarHBondContact O-N 3.12Å
55	R	23.8	Very low	26	Very low	205 Å²	205	145.1 Å²	145.1	77%	0.774	77%	0.77	S	S	*	*			trans	-48.4	114.8	168.8	177.2	179.3	171.6	-174.4	-2.9	109.8	E57	R55-E57 HydrophobicContact CG-CG 4.37Å
56	I	24.6	Very low	25.8	Very low	167 Å²	167	145.2 Å²	145.2	86%	0.856	77%	0.77	S	S	*	*			trans	-100.2	122.9	157.5	-63.5	178	0	0	0	105.4	H54 N58	H54-I56 PolarHBondContact O-N 3.12Å; I56-N58 PolarHBondContact O-N 2.92Å
57	E	25.7	Very low	25.9	Very low	146 Å²	146	144 Å²	144	68%	0.682	76%	0.764	S	S	*	*			trans	-74.1	101.9	-156.9	-65.7	167.6	152.4	0	0	110.9	R55 S59	R55-E57 HydrophobicContact CG-CG 4.37Å; E57-S59 PolarHBondContact O-N 3.01Å
58	N	24.8	Very low	25.7	Very low	147 Å²	147	146.4 Å²	146.4	79%	0.786	77%	0.768	S	S	*	*			trans	-78.2	105.9	149.6	-81.8	-4.6	0	0	0	106.1	I56 T60	I56-N58 PolarHBondContact O-N 2.92Å; N58-T60 PolarHBondContact O-N 3Å; N58-T60 PolarHBondContact O-OG1 2.95Å
59	S	23.6	Very low	25.8	Very low	114 Å²	114	141.9 Å²	141.9	80%	0.797	76%	0.759	S	S	*	*			trans	-65.5	77.9	169.8	-48.1	0	0	0	0	109	E57	E57-S59 PolarHBondContact O-N 3.01Å
60	T	25.9	Very low	25.8	Very low	97 Å²	97	141.6 Å²	141.6	60%	0.595	76%	0.762	S	S	*	*			trans	-90.1	90.2	162.9	-30.2	0	0	0	0	106	N58 L62	N58-T60 PolarHBondContact O-N 3Å; N58-T60 PolarHBondContact O-OG1 2.95Å; T60-L62 HydrophobicContact CG2-CD1 3.94Å; T60-L62 HydrophobicContact CG2-CD2 4.47Å; T60-L62 HydrophobicContact CG2-CG 3.71Å; T60-L62 PolarHBondContact O-N 2.93Å
61	E	25.7	Very low	25.9	Very low	191 Å²	191	142.1 Å²	142.1	89%	0.893	77%	0.765	S	S	*	*			trans	-71.2	85.1	159.4	-72.4	-171.1	169.2	0	0	106.9
62	L	27.2	Very low	26.2	Very low	136 Å²	136	146 Å²	146	71%	0.712	77%	0.771	S	S	*	*			trans	-80.4	111.8	165.3	-82.1	164	0	0	0	107.7	T60 N64	T60-L62 HydrophobicContact CG2-CD1 3.94Å; T60-L62 HydrophobicContact CG2-CD2 4.47Å; T60-L62 HydrophobicContact CG2-CG 3.71Å; T60-L62 PolarHBondContact O-N 2.93Å; L62-N64 PolarHBondContact O-N 3.31Å
63	Y	24	Very low	26.2	Very low	172 Å²	172	150.4 Å²	150.4	68%	0.675	78%	0.775	S	S	*	*			trans	-47.3	103.9	163.3	-124.9	-97.2	0	0	0	109.8	V65 E309	Y63-V65 HydrophobicContact CD1-CB 4.37Å; Y63-V65 HydrophobicContact CD1-CG2 3.51Å; Y63-V65 HydrophobicContact CE1-CG2 3.68Å; Y63-V65 PolarHBondContact O-N 3.07Å; Y63-E309 VanDerWaalsContact CD2-OE1 3.27Å; Y63-E309 WeakPolarHBondContact CD2-OE1 3.27Å; Y63-E309 WeakPolarHBondContact CE2-OE1 3.43Å
64	N	27.8	Very low	26.4	Very low	156 Å²	156	153 Å²	153	83%	0.834	78%	0.782	S	S	*	*			trans	-81.6	91.8	160.4	-82.1	-26.8	0	0	0	107.2	L62	L62-N64 PolarHBondContact O-N 3.31Å
65	V	27.7	Very low	26.3	Very low	116 Å²	116	150.5 Å²	150.5	70%	0.703	77%	0.771	S	S	*	*			trans	-106.8	108.3	155.8	166.6	0	0	0	0	107	Y63	Y63-V65 HydrophobicContact CD1-CB 4.37Å; Y63-V65 HydrophobicContact CD1-CG2 3.51Å; Y63-V65 HydrophobicContact CE1-CG2 3.68Å; Y63-V65 PolarHBondContact O-N 3.07Å
66	E	29	Very low	26.5	Very low	178 Å²	178	152.3 Å²	152.3	83%	0.832	78%	0.778	S	S	*	*			trans	-62.6	149	171.6	-65.1	173.9	149	0	0	110.8
67	D	27.5	Very low	26.5	Very low	140 Å²	140	150.9 Å²	150.9	75%	0.749	77%	0.771	S	S	*	*			trans	84.7	100.8	143.8	-124.1	11.2	0	0	0	118.8
68	L	25.7	Very low	26.6	Very low	158 Å²	158	148.7 Å²	148.7	83%	0.827	77%	0.773	S	S	*	*				159	121.5	99.2	-80.3	172.8	0	0	0	111.9
69	G	26	Very low	26.4	Very low	66 Å²	66	147.2 Å²	147.2	68%	0.68	77%	0.769	S	S	*	*			trans	108.9	95.2	133.7	0	0	0	0	0	120
70	S	28	Very low	26.5	Very low	109 Å²	109	147 Å²	147	76%	0.762	76%	0.763	S	S	*	*			trans	73.9	105.1	138.6	25.8	0	0	0	0	120.4
71	T	25.6	Very low	26.4	Very low	127 Å²	127	148.8 Å²	148.8	78%	0.779	77%	0.773	S	S	*	*				69.6	121.2	102.1	-5.8	0	0	0	0	112.2
72	E	31.2	Very low	26.3	Very low	192 Å²	192	142.9 Å²	142.9	90%	0.897	76%	0.764	S	S	*	*				-161.9	164.6	52	-76	176.6	174.6	0	0	111.6
73	R	24.1	Very low	26.1	Very low	214 Å²	214	144.1 Å²	144.1	81%	0.808	77%	0.771	S	S	*	*			trans	-103.8	139.3	-167.3	170.1	-157.4	-110	-146.1	-5.7	109.4
74	E	30.3	Very low	26.1	Very low	203 Å²	203	141.6 Å²	141.6	95%	0.949	78%	0.779	S	S	*	*			trans	-152	122	145.6	-116	171.9	-157.8	0	0	112.3
75	E	25.2	Very low	25.9	Very low	127 Å²	127	139.7 Å²	139.7	59%	0.593	78%	0.777	S	S	*	*			trans	-89	161.4	179.7	-163.9	171.5	-165.3	0	0	107.9
76	W	26.9	Very low	25.7	Very low	243 Å²	243	138.4 Å²	138.4	92%	0.92	78%	0.779	S	S	*	*				164.6	126.9	128.8	-92.1	73.9	0	0	0	112.8
77	N	24.9	Very low	25.4	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	78%	0.784	S	S	*	*			trans	-73.1	159.6	-173.7	-65	-51.3	0	0	0	115.6
78	S	27.3	Very low	25.3	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	79%	0.79	S	S	*	*				168.3	113.1	115.8	179.5	0	0	0	0	111.2
79	T	21.6	Very low	25.1	Very low	115 Å²	115	139.1 Å²	139.1	71%	0.706	79%	0.789	S	S	*	*				54.6	133.9	92.3	-13	0	0	0	0	113.6
80	V	24.7	Very low	25	Very low	110 Å²	110	141.6 Å²	141.6	67%	0.667	79%	0.79	S	S	*	*			cis	-170.1	150.3	34.1	-156	0	0	0	0	111.1
81	T	23.7	Very low	24.9	Very low	134 Å²	134	145.7 Å²	145.7	82%	0.822	80%	0.795	S	S	*	*			trans	64.1	128.6	139	40.7	0	0	0	0	124
82	G	24.1	Very low	24.9	Very low	67 Å²	67	149.2 Å²	149.2	69%	0.691	80%	0.799	S	S	*	*				142	68.7	121.6	0	0	0	0	0	119.4
83	N	22.8	Very low	24.6	Very low	163 Å²	163	148.3 Å²	148.3	87%	0.872	80%	0.795	S	S	*	*			trans	43.8	119.9	143.9	-54.8	-2.7	0	0	0	121.1
84	S	23.9	Very low	24.6	Very low	119 Å²	119	145.4 Å²	145.4	83%	0.832	80%	0.795	S	S	*	*				145.4	96.1	105.9	-171.9	0	0	0	0	113.3
85	S	24.5	Very low	24.3	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	78%	0.779	S	S	*	*				175.7	122	129.9	58.1	0	0	0	0	109.5
86	A	22.4	Very low	24.2	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	79%	0.791	S	S	*	*			trans	-62.6	161.3	-175.4	0	0	0	0	0	113.7
87	F	23.4	Very low	24.2	Very low	214 Å²	214	134.2 Å²	134.2	94%	0.939	78%	0.776	S	S	*	*	S	Bend	trans	92.3	40.9	-172.6	-62.4	-75.3	0	0	0	117.4
88	D	24.3	Very low	24.2	Very low	163 Å²	163	135.6 Å²	135.6	87%	0.872	78%	0.783	S	S	*	*			trans	-155.1	75.9	162.3	-150.9	10.8	0	0	0	111.8
89	S	22.9	Very low	24.1	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	79%	0.792	S	S	*	*			trans	-167.4	89.4	160.9	72.3	0	0	0	0	112
90	V	23.8	Very low	24.3	Very low	117 Å²	117	143.3 Å²	143.3	71%	0.709	80%	0.8	S	S	*	*	S	Bend	trans	-143.1	123.7	147.1	-154.3	0	0	0	0	107.7
91	F	26.3	Very low	24.2	Very low	196 Å²	196	141.6 Å²	141.6	86%	0.86	81%	0.805	S	S	*	*			trans	83.9	77.9	174.5	-48.9	-70.3	0	0	0	117.2	E93	F91-E93 PolarHBondContact O-N 3.05Å
92	K	23.8	Very low	24.2	Very low	200 Å²	200	140.3 Å²	140.3	87%	0.87	80%	0.797	S	S	*	*			trans	-69.2	110.1	146.3	-85.5	-173.8	173.7	-172.3	0	108.5
93	E	26.6	Very low	24.2	Very low	174 Å²	174	144.9 Å²	144.9	81%	0.813	81%	0.805	S	S	*	*			trans	-125.9	111.3	151.5	-168.8	169	-160.8	0	0	106	F91 V95	F91-E93 PolarHBondContact O-N 3.05Å; E93-V95 PolarHBondContact O-N 3.2Å
94	D	22.6	Very low	24.3	Very low	152 Å²	152	146 Å²	146	81%	0.813	80%	0.802	S	S	*	*			trans	-67.1	108.9	-175.2	-76	-37.6	0	0	0	109.9
95	V	24.7	Very low	24.3	Very low	100 Å²	100	146.4 Å²	146.4	61%	0.606	80%	0.8	S	S	*	*			trans	-122.7	104.6	161.9	179.9	0	0	0	0	106.5	E93 I97	E93-V95 PolarHBondContact O-N 3.2Å; V95-I97 HydrophobicContact CG1-CG1 4.19Å; V95-I97 PolarHBondContact O-N 2.98Å
96	S	22.7	Very low	24.2	Very low	121 Å²	121	147.3 Å²	147.3	85%	0.846	80%	0.801	S	S	*	*			trans	-66.5	112.3	174.3	62.3	0	0	0	0	109.3
97	I	26.4	Very low	24.3	Very low	117 Å²	117	148.5 Å²	148.5	60%	0.6	80%	0.804	S	S	*	*			trans	-109.2	110.3	170.3	-57.6	173.4	0	0	0	105.7	V95 Q99	V95-I97 HydrophobicContact CG1-CG1 4.19Å; V95-I97 PolarHBondContact O-N 2.98Å; I97-Q99 PolarHBondContact O-N 2.78Å
98	D	24.9	Very low	24.3	Very low	165 Å²	165	147.5 Å²	147.5	88%	0.882	80%	0.802	S	S	*	*			trans	-60.7	129.1	166.8	-86.1	-31.2	0	0	0	109	E100	D98-E100 PolarHBondContact O-N 3.4Å
99	Q	25.1	Very low	24.3	Very low	188 Å²	188	148.3 Å²	148.3	88%	0.879	80%	0.798	S	S	*	*			trans	-70.8	121.6	-173.6	-68.4	174.9	-32.3	0	0	111.5	I97	I97-Q99 PolarHBondContact O-N 2.78Å
100	E	25.8	Very low	24.3	Very low	190 Å²	190	149.8 Å²	149.8	89%	0.888	80%	0.796	S	S	*	*			trans	-131	109.6	143.6	-107.8	-176.8	175.4	0	0	110	D98	D98-E100 PolarHBondContact O-N 3.4Å
101	G	22.9	Very low	24.2	Very low	74 Å²	74	151 Å²	151	76%	0.763	80%	0.803	S	S	*	*			trans	0	109.5	172.6	0	0	0	0	0	120.4
102	V	25	Very low	23.9	Very low	108 Å²	108	146 Å²	146	66%	0.655	79%	0.793	S	S	*	*			trans	-134.9	100.7	141.2	-164.9	0	0	0	0	108.8	F104	V102-F104 HydrophobicContact CB-CD2 4.39Å; V102-F104 HydrophobicContact CB-CE2 4.13Å; V102-F104 HydrophobicContact CG1-CD2 3.6Å; V102-F104 HydrophobicContact CG1-CE1 4.48Å; V102-F104 HydrophobicContact CG1-CE2 3.18Å; V102-F104 HydrophobicContact CG1-CG 4.43Å; V102-F104 HydrophobicContact CG1-CZ 3.68Å; V102-F104 PolarHBondContact O-N 3.47Å
103	N	22.4	Very low	23.8	Very low	162 Å²	162	143.7 Å²	143.7	87%	0.866	79%	0.789	S	S	*	*			trans	-76.3	104.4	168.7	-79.2	-22.2	0	0	0	108.2
104	F	25.5	Very low	23.5	Very low	186 Å²	186	141.6 Å²	141.6	82%	0.816	78%	0.781	S	S	*	*			trans	-92.3	109.3	161.3	-75.6	-75.1	0	0	0	109	V102 T106	V102-F104 HydrophobicContact CB-CD2 4.39Å; V102-F104 HydrophobicContact CB-CE2 4.13Å; V102-F104 HydrophobicContact CG1-CD2 3.6Å; V102-F104 HydrophobicContact CG1-CE1 4.48Å; V102-F104 HydrophobicContact CG1-CE2 3.18Å; V102-F104 HydrophobicContact CG1-CG 4.43Å; V102-F104 HydrophobicContact CG1-CZ 3.68Å; V102-F104 PolarHBondContact O-N 3.47Å; F104-T106 PolarHBondContact O-N 3.22Å
105	T	23.5	Very low	23.5	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	77%	0.765	S	S	*	*			trans	-65	111.5	169.1	41.4	0	0	0	0	109.8	S107	T105-S107 PolarHBondContact O-N 3.49Å
106	T	23.9	Very low	23.3	Very low	135 Å²	135	142.4 Å²	142.4	83%	0.828	78%	0.78	S	S	*	*			trans	-60.1	110.2	162.8	11.6	0	0	0	0	109	F104 E108	F104-T106 PolarHBondContact O-N 3.22Å; T106-E108 PolarHBondContact O-N 2.88Å
107	S	24.2	Very low	23.3	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	77%	0.771	S	S	*	*			trans	-77.4	98.6	166.1	-89.1	0	0	0	0	109.1	T105 K109	T105-S107 PolarHBondContact O-N 3.49Å; S107-K109 PolarHBondContact O-N 3.22Å; S107-K109 VanDerWaalsContact O-N 3.09Å
108	E	22.2	Very low	23.1	Very low	194 Å²	194	148 Å²	148	91%	0.907	78%	0.784	S	S	*	*			trans	-56.8	104.1	157.4	-67.3	179.9	158.9	0	0	108.9	T106	T106-E108 PolarHBondContact O-N 2.88Å
109	K	25.5	Very low	23	Very low	180 Å²	180	145.7 Å²	145.7	78%	0.783	78%	0.776	S	S	*	*			trans	-146.3	90.3	163.8	-147.8	170.3	-177.5	-177.2	0	113.4	S107	S107-K109 PolarHBondContact O-N 3.22Å; S107-K109 VanDerWaalsContact O-N 3.09Å
110	L	22.5	Very low	22.8	Very low	144 Å²	144	142.5 Å²	142.5	75%	0.754	77%	0.77	S	S	*	*			trans	72.2	83.2	143.6	-57.7	171.5	0	0	0	117	S112	L110-S112 PolarHBondContact O-N 2.91Å; L110-S112 VanDerWaalsContact O-N 3.08Å
111	V	20.7	Very low	22.5	Very low	142 Å²	142	138.6 Å²	138.6	86%	0.861	76%	0.763	S	S	*	*			trans	-57.6	102.3	140.9	176.8	0	0	0	0	107.4	I113	V111-I113 HydrophobicContact CG1-CG1 4.3Å
112	S	20.9	Very low	22.5	Very low	91 Å²	91	141.5 Å²	141.5	64%	0.636	76%	0.76	S	S	*	*			trans	-106	104.7	167.9	-179	0	0	0	0	108.4	L110 I114	L110-S112 PolarHBondContact O-N 2.91Å; L110-S112 VanDerWaalsContact O-N 3.08Å; S112-I114 PolarHBondContact O-N 3.41Å
113	I	21.1	Very low	22.5	Very low	153 Å²	153	143.3 Å²	143.3	79%	0.785	77%	0.765	S	S	*	*			trans	-63.5	107.8	172.1	-55.9	164	0	0	0	107.4	V111	V111-I113 HydrophobicContact CG1-CG1 4.3Å
114	I	21.8	Very low	22.5	Very low	129 Å²	129	147 Å²	147	66%	0.662	77%	0.769	S	S	*	*			trans	-107.9	113.6	167.3	-58.9	179.7	0	0	0	107.1	S112 Y117	S112-I114 PolarHBondContact O-N 3.41Å; I114-Y117 HydrophobicContact CG2-CE2 4Å
115	P	20.8	Very low	22.5	Very low	73 Å²	73	145.9 Å²	145.9	47%	0.474	77%	0.766	S	S	.	*			trans	-63.2	148.7	177.4	0.2	2.6	0	0	0	112	Y117	P115-Y117 HydrophobicContact CB-CD1 4.39Å; P115-Y117 HydrophobicContact CB-CE1 3.66Å; P115-Y117 WeakPolarHBondContact CD-OH 3.24Å; P115-Y117 HydrophobicContact CG-CE1 3.68Å; P115-Y117 WeakPolarHBondContact CG-OH 3.5Å; P115-Y117 WeakPolarHBondContact O-CD2 3.07Å; P115-Y117 WeakPolarHBondContact O-CE1 3.34Å; P115-Y117 VanDerWaalsContact O-CE2 3.23Å; P115-Y117 WeakPolarHBondContact O-CE2 3.29Å; P115-Y117 VanDerWaalsContact O-CZ 3.24Å; P115-Y117 PolarHBondContact O-N 3.49Å
116	E	21.1	Very low	22.6	Very low	196 Å²	196	147.2 Å²	147.2	92%	0.916	77%	0.768	S	S	*	*			trans	-51.9	116.4	172.5	-67	173.9	162.1	0	0	111.4
117	Y	23.1	Very low	22.6	Very low	166 Å²	166	153.1 Å²	153.1	65%	0.651	78%	0.776	S	S	*	*			trans	-146.2	131.5	158.9	4.1	-94.9	0	0	0	110.1	I114 P115 V119	I114-Y117 HydrophobicContact CG2-CE2 4Å; P115-Y117 HydrophobicContact CB-CD1 4.39Å; P115-Y117 HydrophobicContact CB-CE1 3.66Å; P115-Y117 WeakPolarHBondContact CD-OH 3.24Å; P115-Y117 HydrophobicContact CG-CE1 3.68Å; P115-Y117 WeakPolarHBondContact CG-OH 3.5Å; P115-Y117 WeakPolarHBondContact O-CD2 3.07Å; P115-Y117 WeakPolarHBondContact O-CE1 3.34Å; P115-Y117 VanDerWaalsContact O-CE2 3.23Å; P115-Y117 WeakPolarHBondContact O-CE2 3.29Å; P115-Y117 VanDerWaalsContact O-CZ 3.24Å; P115-Y117 PolarHBondContact O-N 3.49Å; Y117-V119 PolarHBondContact O-N 3.41Å
118	E	21.6	Very low	22.5	Very low	189 Å²	189	155.5 Å²	155.5	88%	0.883	78%	0.779	S	S	*	*			trans	-26.4	111.2	171.3	-63.6	171.3	138	0	0	114.8
119	V	23.2	Very low	22.6	Very low	117 Å²	117	150.5 Å²	150.5	71%	0.709	77%	0.771	S	S	*	*			trans	-135.5	81.2	152.2	-171.5	0	0	0	0	108.8	Y117 I122	Y117-V119 PolarHBondContact O-N 3.41Å; V119-I122 HydrophobicContact CG1-CD1 3.74Å
120	T	20.1	Very low	22.5	Very low	121 Å²	121	148.1 Å²	148.1	74%	0.742	77%	0.772	S	S	*	*			trans	-54.9	138.9	146	22.2	0	0	0	0	109.4
121	S	21.5	Very low	22.5	Very low	108 Å²	108	146.5 Å²	146.5	76%	0.755	77%	0.768	S	S	*	*			trans	68.8	74.7	153.6	57.1	0	0	0	0	119.8
122	I	22.2	Very low	22.7	Very low	136 Å²	136	149.9 Å²	149.9	70%	0.697	77%	0.772	S	S	*	*			trans	-162.1	104.7	137.1	-25.3	70.1	0	0	0	106.3	V119	V119-I122 HydrophobicContact CG1-CD1 3.74Å
123	L	23.9	Very low	22.8	Very low	146 Å²	146	153.6 Å²	153.6	76%	0.764	78%	0.779	S	S	*	*				-169.5	100.6	82.8	-84.6	157.9	0	0	0	108.3
124	Y	23.2	Very low	22.9	Very low	240 Å²	240	156.5 Å²	156.5	94%	0.941	78%	0.782	S	S	*	*			trans	-76.6	114	147.8	-99.6	-98.7	0	0	0	105.8
125	E	26.3	Very low	23.1	Very low	162 Å²	162	156.2 Å²	156.2	76%	0.757	79%	0.788	S	S	*	*			trans	-156.4	103.4	157.9	-113.1	161.3	-157.2	0	0	109
126	D	24.8	Very low	23.2	Very low	156 Å²	156	158.6 Å²	158.6	83%	0.834	80%	0.801	S	S	*	*			trans	65.4	69.8	147.3	-58.5	-14.1	0	0	0	119.6
127	W	23.7	Very low	23.2	Very low	259 Å²	259	154.7 Å²	154.7	98%	0.981	80%	0.796	S	S	*	*			trans	-113.2	76.5	147.6	-131.8	-0.1	0	0	0	109.6
128	N	22.7	Very low	23.4	Very low	163 Å²	163	152.6 Å²	152.6	87%	0.872	80%	0.8	S	S	*	*			trans	-152.3	124.6	162.8	-105.6	-22.1	0	0	0	112.4
129	A	22.9	Very low	23.4	Very low	89 Å²	89	151.4 Å²	151.4	74%	0.736	80%	0.8	S	S	*	*			trans	71.6	91.4	156.2	0	0	0	0	0	119
130	T	23.6	Very low	23.5	Very low	131 Å²	131	151.5 Å²	151.5	80%	0.804	81%	0.806	S	S	*	*				-156.2	94.6	123.9	-13.9	0	0	0	0	112.3	F132	T130-F132 PolarHBondContact O-N 3.05Å
131	T	24.1	Very low	23.5	Very low	110 Å²	110	153.9 Å²	153.9	68%	0.675	81%	0.81	S	S	*	*			trans	24.9	93.8	137.5	-37.8	0	0	0	0	118.1	Q133	T131-Q133 HydrophobicContact CG2-CG 3.9Å; T131-Q133 PolarHBondContact O-N 2.84Å
132	F	23.6	Very low	23.7	Very low	212 Å²	212	157.2 Å²	157.2	93%	0.93	81%	0.814	S	S	*	*			trans	-84.4	88.6	157.7	-99.9	-94.2	0	0	0	109.4	T130	T130-F132 PolarHBondContact O-N 3.05Å
133	Q	24.5	Very low	23.7	Very low	170 Å²	170	158.7 Å²	158.7	79%	0.794	82%	0.818	S	S	*	*			trans	-74.6	123	164.5	-93.7	175.6	-17.6	0	0	109.1	T131	T131-Q133 HydrophobicContact CG2-CG 3.9Å; T131-Q133 PolarHBondContact O-N 2.84Å
134	Y	22.8	Very low	23.7	Very low	213 Å²	213	157.7 Å²	157.7	84%	0.835	81%	0.812	S	S	*	*			trans	-51.8	139	171.5	-77.3	-92.6	0	0	0	111.7	V136	Y134-V136 PolarHBondContact O-N 3.34Å
135	P	24.5	Very low	24	Very low	123 Å²	123	153.4 Å²	153.4	80%	0.799	81%	0.806	S	S	*	*			trans	-76.2	87.9	176.3	31.1	-31.4	0	0	0	109.8	S137	P135-S137 PolarHBondContact O-N 3.48Å
136	V	24	Very low	23.9	Very low	124 Å²	124	152.2 Å²	152.2	75%	0.752	80%	0.803	S	S	*	*			trans	-76.4	113	159.1	170	0	0	0	0	107.9	Y134 T138	Y134-V136 PolarHBondContact O-N 3.34Å; V136-T138 PolarHBondContact O-N 3.11Å
137	S	21.8	Very low	24.1	Very low	114 Å²	114	153 Å²	153	80%	0.797	81%	0.805	S	S	*	*			trans	-64.7	113.5	174.8	-64.5	0	0	0	0	111.2	P135	P135-S137 PolarHBondContact O-N 3.48Å
138	T	25.5	Very low	24.2	Very low	121 Å²	121	148.5 Å²	148.5	74%	0.742	79%	0.793	S	S	*	*			trans	-152.5	106.4	152.7	52.7	0	0	0	0	111.5	V136	V136-T138 PolarHBondContact O-N 3.11Å
139	N	22.4	Very low	24.5	Very low	164 Å²	164	148.8 Å²	148.8	88%	0.877	79%	0.794	S	S	*	*			trans	12	119	143.5	-57	-34.4	0	0	0	118
140	S	24.7	Very low	24.7	Very low	119 Å²	119	151.1 Å²	151.1	83%	0.832	79%	0.794	S	S	*	*				172.5	125.9	116.1	-172.6	0	0	0	0	111.5
141	M	20.6	Very low	24.9	Very low	171 Å²	171	151.3 Å²	151.3	84%	0.842	80%	0.796	S	S	*	*			trans	-55.1	144	163.7	-63.9	167.8	-163.7	0	0	111.3
142	Q	26.2	Very low	25	Very low	179 Å²	179	151.5 Å²	151.5	84%	0.836	80%	0.801	S	S	*	*				171.2	106.5	117.7	-92.8	168.4	0.8	0	0	111.6
143	E	22.8	Very low	25.1	Very low	167 Å²	167	147.6 Å²	147.6	78%	0.78	80%	0.797	S	S	*	*				46	132.9	123	-98	-169.1	157.6	0	0	122.7
144	I	23.9	Very low	25.2	Very low	124 Å²	124	146.5 Å²	146.5	64%	0.636	80%	0.796	S	S	*	*			trans	84.8	126.1	139.1	-63.4	165.2	0	0	0	114.7
145	N	28.8	Very low	25.2	Very low	151 Å²	151	145.8 Å²	145.8	81%	0.807	80%	0.8	S	S	*	*			cis	-164.6	153.9	47.9	-130.3	-22.9	0	0	0	113.7
146	I	24.8	Very low	25.5	Very low	137 Å²	137	146.7 Å²	146.7	70%	0.703	80%	0.797	S	S	*	*			trans	-72	139.1	-179.7	-63.1	154.7	0	0	0	112.5	K148	I146-K148 HydrophobicContact CG2-CG 4.47Å
147	I	28.8	Very low	25.7	Very low	171 Å²	171	149.5 Å²	149.5	88%	0.877	80%	0.802	S	S	*	*			trans	-133.6	120.8	147.4	-59.8	-178.1	0	0	0	109.9
148	K	25.2	Very low	26	Very low	165 Å²	165	152 Å²	152	72%	0.717	81%	0.806	S	S	*	*			trans	-61.8	141.6	178.3	-66.8	169.4	172.4	178.8	0	112.6	I146	I146-K148 HydrophobicContact CG2-CG 4.47Å
149	N	29.5	Very low	26.2	Very low	170 Å²	170	154.8 Å²	154.8	91%	0.909	81%	0.811	S	S	*	*			trans	-147.7	108.8	139	-99.9	-13.4	0	0	0	109.5
150	D	25.9	Very low	26.3	Very low	138 Å²	138	158.7 Å²	158.7	74%	0.738	81%	0.813	S	S	*	*			trans	-64.1	129.8	173.5	-67.6	-55.7	0	0	0	111
151	T	28	Very low	26.6	Very low	135 Å²	135	158.9 Å²	158.9	83%	0.828	81%	0.81	S	S	*	*				176	125.5	113.6	21.4	0	0	0	0	113.1
152	S	26.6	Very low	27	Very low	114 Å²	114	159.5 Å²	159.5	80%	0.797	81%	0.81	S	S	*	*			trans	86.3	104	156.4	-57.4	0	0	0	0	119.5
153	P	26.2	Very low	27.1	Very low	129 Å²	129	159.4 Å²	159.4	84%	0.838	81%	0.81	S	S	*	*			trans	-87.6	137.1	167	33.4	-27.7	0	0	0	112.3
154	L	25.5	Very low	27.5	Very low	147 Å²	147	156 Å²	156	77%	0.77	80%	0.803	S	S	*	*			trans	-44	135.2	168.5	-122.6	75.8	0	0	0	113	I156	L154-I156 HydrophobicContact CD2-CD1 3.61Å; L154-I156 HydrophobicContact CD2-CG1 3.93Å; L154-I156 HydrophobicContact CG-CD1 4.17Å; L154-I156 HydrophobicContact CG-CG1 4.15Å
155	Q	24.3	Very low	27.6	Very low	199 Å²	199	159.8 Å²	159.8	93%	0.93	82%	0.817	S	S	*	*			trans	-111.6	102.3	152.6	-73.5	-172.5	4.2	0	0	107.5
156	I	30.8	Very low	27.9	Very low	141 Å²	141	156.8 Å²	156.8	72%	0.723	81%	0.805	S	S	*	*			trans	-120.5	122.2	163.2	-61	-178.6	0	0	0	106.2	L154	L154-I156 HydrophobicContact CD2-CD1 3.61Å; L154-I156 HydrophobicContact CD2-CG1 3.93Å; L154-I156 HydrophobicContact CG-CD1 4.17Å; L154-I156 HydrophobicContact CG-CG1 4.15Å
157	Q	28.2	Very low	28.4	Very low	184 Å²	184	158.9 Å²	158.9	86%	0.86	81%	0.811	S	S	*	*			trans	-64.5	127.1	-175.6	-133.9	172	4.3	0	0	110.1	Q159	Q157-Q159 PolarHBondContact O-N 3.38Å
158	D	27.7	Very low	29	Very low	165 Å²	165	153.6 Å²	153.6	88%	0.882	79%	0.79	S	S	*	*			trans	-55.2	104.8	168.6	-84.5	-39.3	0	0	0	110.5
159	Q	29.3	Very low	30	Very low	180 Å²	180	148 Å²	148	84%	0.841	77%	0.767	S	S	*	*			trans	-88	112.1	153.2	-75.8	-170.4	-2.4	0	0	107	Q157 T161	Q157-Q159 PolarHBondContact O-N 3.38Å; Q159-T161 PolarHBondContact O-N 3.46Å
160	R	25.6	Very low	31.1	Very low	247 Å²	247	145 Å²	145	93%	0.932	75%	0.752	S	S	*	*			trans	-58.1	100.9	165.8	-78.9	-179.9	171.3	-172.1	-5.1	108.5
161	T	30.2	Very low	32.1	Very low	123 Å²	123	140.5 Å²	140.5	76%	0.755	73%	0.727	S	S	*	*			trans	-83	112.8	160.6	-54.1	0	0	0	0	106.2	Q159 E163	Q159-T161 PolarHBondContact O-N 3.46Å; T161-E163 PolarHBondContact O-N 2.98Å; T161-E163 VanDerWaalsContact O-N 3.13Å
162	E	29.3	Very low	33	Very low	184 Å²	184	139.3 Å²	139.3	86%	0.86	71%	0.712	S	S	*	*			trans	-58.9	110.9	164	-76.9	173.9	160.8	0	0	107.2
163	E	28.5	Very low	34.4	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	69%	0.693	S	S	*	*			trans	-61.5	131.4	165.1	-88	-179.2	152.6	0	0	107.6	T161 E165	T161-E163 PolarHBondContact O-N 2.98Å; T161-E163 VanDerWaalsContact O-N 3.13Å; E163-E165 PolarHBondContact O-N 3.34Å; E163-E165 VanDerWaalsContact O-N 3.15Å
164	P	30.1	Very low	35.9	Very low	97 Å²	97	131.8 Å²	131.8	63%	0.63	66%	0.656	S	S	*	*			trans	-60	121.9	169	25.7	-30.8	0	0	0	107.9	T166	P164-T166 HydrophobicContact CB-CG2 4.4Å; P164-T166 PolarHBondContact O-N 2.92Å
165	E	27.1	Very low	37.3	Very low	202 Å²	202	125.1 Å²	125.1	94%	0.944	62%	0.621	S	S	*	*			trans	-64.4	77.5	164	-67.6	-173.7	171.4	0	0	107.7	E163 E167	E163-E165 PolarHBondContact O-N 3.34Å; E163-E165 VanDerWaalsContact O-N 3.15Å; E165-E167 PolarHBondContact O-N 2.98Å
166	T	33.5	Very low	39	Very low	88 Å²	88	119.9 Å²	119.9	54%	0.54	60%	0.599	S	S	.	*			trans	-85.9	105.9	166.7	40.2	0	0	0	0	106.8	P164 S168	P164-T166 HydrophobicContact CB-CG2 4.4Å; P164-T166 PolarHBondContact O-N 2.92Å; T166-S168 PolarHBondContact O-N 3.42Å
167	E	35.3	Very low	40.6	Very low	181 Å²	181	117.1 Å²	117.1	85%	0.846	58%	0.583	S	S	*	*			trans	-46.5	110.6	166.1	-82.8	175.4	151.7	0	0	107.7	E165 D169	E165-E167 PolarHBondContact O-N 2.98Å; E167-D169 VanDerWaalsContact C-N 3.32Å; E167-D169 PolarHBondContact O-N 3.42Å
168	S	42	Very low	42.2	Very low	61 Å²	61	108.3 Å²	108.3	43%	0.427	54%	0.542	S	S	.	.			trans	-55.8	103.4	162.6	153.2	0	0	0	0	105.4	T166 D170	T166-S168 PolarHBondContact O-N 3.42Å; S168-D170 PolarHBondContact O-N 2.84Å
169	D	45.8	Very low	43.8	Very low	46 Å²	46	101.8 Å²	101.8	25%	0.246	51%	0.507	C	S	.	.			trans	-57.7	112.4	173.3	-86.1	-37.1	0	0	0	107.6	E167 N173 L174	E167-D169 VanDerWaalsContact C-N 3.32Å; E167-D169 PolarHBondContact O-N 3.42Å; D169-N173 HydrophobicContact CB-CB 4.24Å; D169-L174 HydrophobicContact CB-CD2 4.19Å; D169-L174 HydrophobicContact CB-CG 4.12Å
170	D	52.4	Low	45.5	Very low	108 Å²	108	98.8 Å²	98.8	58%	0.578	50%	0.497	S	S	*	.			trans	-53.7	146.3	174.3	-84.8	-32.4	0	0	0	108.2	S168 E172 N173 L174	S168-D170 PolarHBondContact O-N 2.84Å; D170-E172 CarbonylContact O-C 3.6Å; D170-E172 PolarHBondContact O-N 2.96Å; D170-N173 WeakPolarHBondContact O-CA 3.32Å; D170-N173 WeakPolarHBondContact O-CB 3.5Å; D170-N173 PolarHBondContact O-N 3.21Å; D170-L174 PolarHBondContact O-N 3.43Å; D170-L174 VanDerWaalsContact O-N 3.11Å
171	I	47	Very low	47.4	Very low	44 Å²	44	91.4 Å²	91.4	23%	0.226	47%	0.471	C	S	.	.	H	α-helix	trans	-48.7	-35.3	178.4	-65.3	171.4	0	0	0	110.9	L7 L10 L174 L175 V239	L7-I171 HydrophobicContact CD1-CD1 3.59Å; L7-I171 HydrophobicContact CD1-CG2 3.74Å; L10-I171 HydrophobicContact CD2-CG1 4.46Å; L10-I171 HydrophobicContact CD2-CG2 4.06Å; I171-L174 PolarHBondContact O-N 3.44Å; I171-L175 HydrophobicContact CG2-CD1 3.9Å; I171-L175 HydrophobicContact CG2-CG 4.31Å; I171-L175 WeakPolarHBondContact O-CB 3.06Å; I171-L175 WeakPolarHBondContact O-CG 3.14Å; I171-L175 PolarHBondContact O-N 3.22Å; I171-V239 HydrophobicContact CD1-CB 4.29Å; I171-V239 HydrophobicContact CD1-CG1 3.83Å; I171-V239 HydrophobicContact CD1-CG2 3.67Å; I171-V239 HydrophobicContact CG1-CG2 4.33Å
172	E	48.3	Very low	49	Very low	109 Å²	109	85.9 Å²	85.9	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-45.5	174.9	-61.1	-174.8	179.3	0	0	112	Y3 D170 L174 L175 D176	Y3-E172 HydrophobicContact CD1-CG 4.31Å; Y3-E172 HydrophobicContact CE1-CG 3.93Å; D170-E172 CarbonylContact O-C 3.6Å; D170-E172 PolarHBondContact O-N 2.96Å; E172-L174 PolarHBondContact O-N 2.86Å; E172-L175 PolarHBondContact O-N 2.93Å; E172-D176 WeakPolarHBondContact O-CB 3.39Å; E172-D176 PolarHBondContact O-N 3.41Å
173	N	56.4	Low	50.6	Low	73 Å²	73	83 Å²	83	39%	0.39	42%	0.422	S	S	.	.	H	α-helix	trans	-62.2	-42.7	174.5	-69.6	-9.4	0	0	0	111.7	D169 D170 L175 D176 H177	D169-N173 HydrophobicContact CB-CB 4.24Å; D170-N173 WeakPolarHBondContact O-CA 3.32Å; D170-N173 WeakPolarHBondContact O-CB 3.5Å; D170-N173 PolarHBondContact O-N 3.21Å; N173-L175 VanDerWaalsContact C-N 3.31Å; N173-L175 PolarHBondContact O-N 2.91Å; N173-D176 PolarHBondContact O-N 2.9Å; N173-H177 WeakPolarHBondContact O-CB 3.45Å; N173-H177 PolarHBondContact O-N 3.36Å; N173-H177 PolarHBondContact O-ND1 3.27Å
174	L	56.5	Low	51.9	Low	12 Å²	12	75 Å²	75	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-62.6	-40.7	176.9	-70.6	173.1	0	0	0	111.4	L10 D169 D170 I171 E172 H177 L178 F225 I229	L10-L174 HydrophobicContact CD1-CB 4.08Å; L10-L174 HydrophobicContact CD2-CD1 4.17Å; D169-L174 HydrophobicContact CB-CD2 4.19Å; D169-L174 HydrophobicContact CB-CG 4.12Å; D170-L174 PolarHBondContact O-N 3.43Å; D170-L174 VanDerWaalsContact O-N 3.11Å; I171-L174 PolarHBondContact O-N 3.44Å; E172-L174 PolarHBondContact O-N 2.86Å; L174-H177 PolarHBondContact O-N 3.21Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 2.93Å; L174-F225 HydrophobicContact CB-CZ 4.33Å; L174-F225 HydrophobicContact CD2-CZ 4.28Å; L174-F225 WeakPolarHBondContact O-CZ 3.18Å; L174-I229 HydrophobicContact CD2-CG1 4.48Å
175	L	54.7	Low	53.1	Low	7 Å²	7	73.6 Å²	73.6	4%	0.037	38%	0.376	C	S	.	.	H	α-helix	trans	-69.5	-40.8	177.5	-70.8	174.8	0	0	0	112.3	C6 L10 I171 E172 N173 H177 L178 I179	C6-L175 HydrophobicContact CB-CD1 3.33Å; C6-L175 HydrophobicContact CB-CD2 3.52Å; C6-L175 HydrophobicContact CB-CG 3.95Å; L10-L175 HydrophobicContact CB-CD2 4.31Å; L10-L175 HydrophobicContact CD1-CD2 4.06Å; I171-L175 HydrophobicContact CG2-CD1 3.9Å; I171-L175 HydrophobicContact CG2-CG 4.31Å; I171-L175 WeakPolarHBondContact O-CB 3.06Å; I171-L175 WeakPolarHBondContact O-CG 3.14Å; I171-L175 PolarHBondContact O-N 3.22Å; E172-L175 PolarHBondContact O-N 2.93Å; N173-L175 VanDerWaalsContact C-N 3.31Å; N173-L175 PolarHBondContact O-N 2.91Å; L175-H177 VanDerWaalsContact C-N 3.31Å; L175-H177 PolarHBondContact O-N 3.01Å; L175-L178 PolarHBondContact O-N 2.91Å; L175-I179 WeakPolarHBondContact O-CB 3.42Å; L175-I179 WeakPolarHBondContact O-CD1 3.36Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.06Å
176	D	59.4	Low	54.4	Low	89 Å²	89	67.4 Å²	67.4	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-41.2	173.6	-77.9	-11.6	0	0	0	110.7	E172 N173 L178 I179 N180	E172-D176 WeakPolarHBondContact O-CB 3.39Å; E172-D176 PolarHBondContact O-N 3.41Å; N173-D176 PolarHBondContact O-N 2.9Å; D176-L178 PolarHBondContact O-N 3.01Å; D176-I179 PolarHBondContact O-N 3.38Å; D176-N180 WeakPolarHBondContact O-CB 3.18Å; D176-N180 PolarHBondContact O-N 3.45Å; D176-N180 PolarHBondContact O-ND2 3.37Å
177	H	64.5	Low	55.3	Low	83 Å²	83	70 Å²	70	38%	0.384	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-46	172.2	-72.4	140.5	0	0	0	112	N173 L174 L175 N180 K181 F225	N173-H177 WeakPolarHBondContact O-CB 3.45Å; N173-H177 PolarHBondContact O-N 3.36Å; N173-H177 PolarHBondContact O-ND1 3.27Å; L174-H177 PolarHBondContact O-N 3.21Å; L175-H177 VanDerWaalsContact C-N 3.31Å; L175-H177 PolarHBondContact O-N 3.01Å; H177-N180 PolarHBondContact O-N 3.49Å; H177-K181 WeakPolarHBondContact O-CB 3.5Å; H177-K181 VanDerWaalsContact O-CG 3.31Å; H177-K181 WeakPolarHBondContact O-CG 3.2Å; H177-K181 PolarHBondContact O-N 3.36Å; H177-F225 HydrophobicContact CB-CE2 3.92Å; H177-F225 HydrophobicContact CB-CZ 4.14Å
178	L	62	Low	56	Low	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.6	-48.5	177.6	-179.7	54.4	0	0	0	111.5	L174 L175 D176 N180 K181 L182 L222 F225	L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 PolarHBondContact O-N 2.93Å; L175-L178 PolarHBondContact O-N 2.91Å; D176-L178 PolarHBondContact O-N 3.01Å; L178-N180 VanDerWaalsContact C-N 3.32Å; L178-N180 PolarHBondContact O-N 3.18Å; L178-K181 PolarHBondContact O-N 3.09Å; L178-L182 HydrophobicContact CD1-CD1 3.56Å; L178-L182 HydrophobicContact CD1-CG 3.89Å; L178-L182 HydrophobicContact CD2-CD1 4.46Å; L178-L182 HydrophobicContact CG-CD1 3.65Å; L178-L182 HydrophobicContact CG-CG 4.4Å; L178-L182 WeakPolarHBondContact O-CB 3.25Å; L178-L182 WeakPolarHBondContact O-CD1 3.42Å; L178-L182 VanDerWaalsContact O-CG 3.25Å; L178-L182 WeakPolarHBondContact O-CG 3.38Å; L178-L182 PolarHBondContact O-N 2.86Å; L178-L222 HydrophobicContact CD1-CD1 4.36Å; L178-F225 HydrophobicContact CB-CD1 3.89Å; L178-F225 HydrophobicContact CB-CE1 3.58Å; L178-F225 HydrophobicContact CB-CG 4.46Å; L178-F225 HydrophobicContact CB-CZ 3.96Å; L178-F225 HydrophobicContact CD1-CB 4.01Å; L178-F225 HydrophobicContact CD1-CD1 3.6Å; L178-F225 HydrophobicContact CD1-CE1 4.22Å; L178-F225 HydrophobicContact CD1-CG 3.83Å; L178-F225 HydrophobicContact CD2-CD1 4.13Å; L178-F225 HydrophobicContact CD2-CE1 4.23Å; L178-F225 HydrophobicContact CG-CD1 4.05Å; L178-F225 HydrophobicContact CG-CE1 4.2Å
179	I	61.8	Low	56.4	Low	28 Å²	28	61.7 Å²	61.7	14%	0.144	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-46.1	178.7	-69.2	162.9	0	0	0	110.1	L175 D176 K181 L182 K183 W189	L175-I179 WeakPolarHBondContact O-CB 3.42Å; L175-I179 WeakPolarHBondContact O-CD1 3.36Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.06Å; D176-I179 PolarHBondContact O-N 3.38Å; I179-K181 PolarHBondContact O-N 3.34Å; I179-L182 PolarHBondContact O-N 3.41Å; I179-K183 PolarHBondContact O-N 2.84Å; I179-K183 VanDerWaalsContact O-N 3.09Å; I179-W189 HydrophobicContact CB-CZ3 4.38Å; I179-W189 HydrophobicContact CG1-CE3 4Å; I179-W189 HydrophobicContact CG1-CH2 4.03Å; I179-W189 HydrophobicContact CG1-CZ3 3.55Å
180	N	65.2	Low	56.2	Low	116 Å²	116	66 Å²	66	62%	0.62	34%	0.343	S	S	*	.	H	α-helix	trans	-62.8	-40.9	177.9	-73	-31	0	0	0	112	D176 H177 L178 K183	D176-N180 WeakPolarHBondContact O-CB 3.18Å; D176-N180 PolarHBondContact O-N 3.45Å; D176-N180 PolarHBondContact O-ND2 3.37Å; H177-N180 PolarHBondContact O-N 3.49Å; L178-N180 VanDerWaalsContact C-N 3.32Å; L178-N180 PolarHBondContact O-N 3.18Å; N180-K183 PolarHBondContact O-N 2.85Å
181	K	65.8	Low	55.8	Low	93 Å²	93	65.2 Å²	65.2	40%	0.404	34%	0.339	S	S	.	.	H	α-helix	trans	-68.7	-38.8	177	-75.4	-170.9	-172.6	-154	0	112.5	H177 L178 I179 K183 T221 F225 E228	H177-K181 WeakPolarHBondContact O-CB 3.5Å; H177-K181 VanDerWaalsContact O-CG 3.31Å; H177-K181 WeakPolarHBondContact O-CG 3.2Å; H177-K181 PolarHBondContact O-N 3.36Å; L178-K181 PolarHBondContact O-N 3.09Å; I179-K181 PolarHBondContact O-N 3.34Å; K181-K183 PolarHBondContact O-N 3.26Å; K181-T221 HydrophobicContact CB-CG2 3.71Å; K181-F225 HydrophobicContact CD-CD2 4.02Å; K181-E228 VanDerWaalsContact NZ-CD 3.3Å; K181-E228 IonicContact NZ-OE1 3.19Å; K181-E228 PolarHBondContact NZ-OE1 2.87Å; K181-E228 IonicContact NZ-OE2 2.59Å; K181-E228 PolarHBondContact NZ-OE2 3.43Å
182	L	62.4	Low	55.7	Low	7 Å²	7	64.6 Å²	64.6	4%	0.037	33%	0.334	C	S	.	.	H	α-helix	trans	-70.8	-18.4	178	-70.9	166	0	0	0	112.3	L178 I179 V184 W189 Y194 H218 T221	L178-L182 HydrophobicContact CD1-CD1 3.56Å; L178-L182 HydrophobicContact CD1-CG 3.89Å; L178-L182 HydrophobicContact CD2-CD1 4.46Å; L178-L182 HydrophobicContact CG-CD1 3.65Å; L178-L182 HydrophobicContact CG-CG 4.4Å; L178-L182 WeakPolarHBondContact O-CB 3.25Å; L178-L182 WeakPolarHBondContact O-CD1 3.42Å; L178-L182 VanDerWaalsContact O-CG 3.25Å; L178-L182 WeakPolarHBondContact O-CG 3.38Å; L178-L182 PolarHBondContact O-N 2.86Å; I179-L182 PolarHBondContact O-N 3.41Å; L182-V184 HydrophobicContact CB-CB 4.43Å; L182-V184 HydrophobicContact CB-CG2 4.06Å; L182-V184 PolarHBondContact O-N 2.91Å; L182-W189 HydrophobicContact CD1-CH2 3.69Å; L182-W189 HydrophobicContact CD1-CZ3 3.85Å; L182-Y194 HydrophobicContact CD1-CD1 4.18Å; L182-Y194 HydrophobicContact CD1-CE1 3.46Å; L182-Y194 VanDerWaalsContact CD1-CE1 3.46Å; L182-Y194 HydrophobicContact CD2-CE1 4.16Å; L182-Y194 HydrophobicContact CG-CE1 4.3Å; L182-H218 HydrophobicContact CD2-CB 4.15Å; L182-T221 HydrophobicContact CD2-CG2 3.93Å; L182-T221 HydrophobicContact CG-CG2 4.27Å
183	K	64.3	Low	55.4	Low	123 Å²	123	63.8 Å²	63.8	54%	0.535	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	30.3	-174.7	-60.2	-169.9	176.2	-167.9	0	112.6	I179 N180 K181	I179-K183 PolarHBondContact O-N 2.84Å; I179-K183 VanDerWaalsContact O-N 3.09Å; N180-K183 PolarHBondContact O-N 2.85Å; K181-K183 PolarHBondContact O-N 3.26Å
184	V	55.5	Low	54.9	Low	7 Å²	7	60.8 Å²	60.8	4%	0.042	31%	0.313	C	S	.	.			trans	-86.7	127.6	-178.3	165.4	0	0	0	0	109.6	L182 S186 W189 Y192 Y194	L182-V184 HydrophobicContact CB-CB 4.43Å; L182-V184 HydrophobicContact CB-CG2 4.06Å; L182-V184 PolarHBondContact O-N 2.91Å; V184-S186 PolarHBondContact O-N 3.49Å; V184-W189 HydrophobicContact CG1-CE3 4.16Å; V184-Y192 HydrophobicContact CB-CD2 4.42Å; V184-Y192 HydrophobicContact CB-CE2 4.32Å; V184-Y192 HydrophobicContact CG1-CD2 3.34Å; V184-Y192 HydrophobicContact CG1-CE2 3.45Å; V184-Y192 VanDerWaalsContact CG1-CE2 3.45Å; V184-Y192 HydrophobicContact CG1-CG 3.95Å; V184-Y192 HydrophobicContact CG2-CD1 4.02Å; V184-Y192 HydrophobicContact CG2-CD2 4.22Å; V184-Y192 HydrophobicContact CG2-CE1 3.73Å; V184-Y192 HydrophobicContact CG2-CE2 4.02Å; V184-Y192 HydrophobicContact CG2-CG 4.26Å; V184-Y194 WeakPolarHBondContact CB-OH 3.42Å; V184-Y194 WeakPolarHBondContact CG1-OH 3.41Å; V184-Y194 HydrophobicContact CG2-CE1 4.49Å; V184-Y194 WeakPolarHBondContact CG2-OH 3.48Å
185	P	55.4	Low	54.2	Low	68 Å²	68	60.7 Å²	60.7	44%	0.442	31%	0.312	S	S	.	.			trans	-54.3	129.8	172.4	-23	32.2	0	0	0	109.8	D187 N188	P185-D187 PolarHBondContact O-N 3.37Å; P185-N188 PolarHBondContact O-N 3.29Å
186	S	53.3	Low	53.5	Low	72 Å²	72	64.5 Å²	64.5	50%	0.503	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-48	-33.3	178.1	48.3	0	0	0	0	112.8	M1 V184 N188	M1-S186 WeakPolarHBondContact CE-O 3.43Å; V184-S186 PolarHBondContact O-N 3.49Å; S186-N188 VanDerWaalsContact C-N 3.29Å; S186-N188 PolarHBondContact O-N 2.81Å
187	D	53.6	Low	52.6	Low	142 Å²	142	61.6 Å²	61.6	76%	0.759	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-78	-17.4	-171.6	-52.1	-13.2	0	0	0	112.4	P185	P185-D187 PolarHBondContact O-N 3.37Å
188	N	49	Very low	51.2	Low	51 Å²	51	59.4 Å²	59.4	27%	0.273	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-105.1	0.1	-179.8	-88.6	-22.9	0	0	0	113.7	P185 S186 L190 N191 Y192	P185-N188 PolarHBondContact O-N 3.29Å; S186-N188 VanDerWaalsContact C-N 3.29Å; S186-N188 PolarHBondContact O-N 2.81Å; N188-L190 PolarHBondContact O-N 2.99Å; N188-N191 WeakPolarHBondContact O-CA 3.35Å; N188-N191 WeakPolarHBondContact O-CB 3.49Å; N188-N191 PolarHBondContact O-N 2.96Å; N188-N191 PolarHBondContact OD1-ND2 3.32Å; N188-Y192 HydrophobicContact CB-CD2 3.85Å; N188-Y192 HydrophobicContact CB-CE2 3.7Å; N188-Y192 VanDerWaalsContact O-CD2 3.25Å; N188-Y192 WeakPolarHBondContact O-CD2 3.43Å; N188-Y192 PolarHBondContact O-N 2.91Å
189	W	50.7	Low	49.9	Very low	17 Å²	17	61.8 Å²	61.8	6%	0.064	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.1	-175.7	-170.4	-86.9	0	0	0	113.9	M1 I9 I179 L182 V184 N191 Y192 Y194	M1-W189 HydrophobicContact CE-CB 3.55Å; M1-W189 HydrophobicContact CE-CG 4Å; M1-W189 HydrophobicContact SD-CB 4.49Å; M1-W189 HydrophobicContact SD-CG 4.41Å; I9-W189 HydrophobicContact CD1-CZ2 4.06Å; I179-W189 HydrophobicContact CB-CZ3 4.38Å; I179-W189 HydrophobicContact CG1-CE3 4Å; I179-W189 HydrophobicContact CG1-CH2 4.03Å; I179-W189 HydrophobicContact CG1-CZ3 3.55Å; L182-W189 HydrophobicContact CD1-CH2 3.69Å; L182-W189 HydrophobicContact CD1-CZ3 3.85Å; V184-W189 HydrophobicContact CG1-CE3 4.16Å; W189-N191 VanDerWaalsContact C-N 3.31Å; W189-Y192 CarbonylContact O-C 3.46Å; W189-Y192 PolarHBondContact O-N 3.29Å; W189-Y194 HydrophobicContact CD2-CD2 4.04Å; W189-Y194 AromaticContact CD2-CE2 3.25Å; W189-Y194 HydrophobicContact CD2-CE2 3.25Å; W189-Y194 AromaticContact CE2-CD2 3.56Å; W189-Y194 AromaticContact CE2-CE2 3.25Å; W189-Y194 HydrophobicContact CE3-CD2 4.36Å; W189-Y194 AromaticContact CE3-CE2 3.27Å; W189-Y194 HydrophobicContact CE3-CE2 3.27Å; W189-Y194 AromaticContact CE3-CZ 3.53Å; W189-Y194 HydrophobicContact CG-CE2 4Å; W189-Y194 AromaticContact CH2-CD2 3.83Å; W189-Y194 HydrophobicContact CH2-CD2 3.83Å; W189-Y194 HydrophobicContact CH2-CE1 4.12Å; W189-Y194 AromaticContact CH2-CE2 3.3Å; W189-Y194 HydrophobicContact CH2-CE2 3.3Å; W189-Y194 HydrophobicContact CH2-CG 4.41Å; W189-Y194 AromaticContact CH2-CZ 3.41Å; W189-Y194 VanDerWaalsContact CH2-CZ 3.41Å; W189-Y194 AromaticContact CZ2-CD2 3.46Å; W189-Y194 HydrophobicContact CZ2-CD2 3.46Å; W189-Y194 VanDerWaalsContact CZ2-CD2 3.46Å; W189-Y194 AromaticContact CZ2-CE2 3.29Å; W189-Y194 HydrophobicContact CZ2-CE2 3.29Å; W189-Y194 HydrophobicContact CZ2-CG 4.23Å; W189-Y194 AromaticContact CZ2-CZ 3.92Å; W189-Y194 HydrophobicContact CZ3-CD2 4.28Å; W189-Y194 HydrophobicContact CZ3-CE1 4.21Å; W189-Y194 AromaticContact CZ3-CE2 3.31Å; W189-Y194 HydrophobicContact CZ3-CE2 3.31Å; W189-Y194 AromaticContact CZ3-CZ 3.21Å; W189-Y194 WeakPolarHBondContact CZ3-OH 3.39Å; W189-Y194 AromaticContact NE1-CE2 3.99Å
190	L	42.7	Very low	48.7	Very low	137 Å²	137	61 Å²	61	72%	0.717	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.2	176.1	-69.7	168	0	0	0	113.4	N188	N188-L190 PolarHBondContact O-N 2.99Å
191	N	42.2	Very low	47.1	Very low	91 Å²	91	62.4 Å²	62.4	49%	0.487	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-31.2	175.7	-64.9	-28.9	0	0	0	111.3	N188 W189 H193	N188-N191 WeakPolarHBondContact O-CA 3.35Å; N188-N191 WeakPolarHBondContact O-CB 3.49Å; N188-N191 PolarHBondContact O-N 2.96Å; N188-N191 PolarHBondContact OD1-ND2 3.32Å; W189-N191 VanDerWaalsContact C-N 3.31Å; N191-H193 PolarHBondContact O-N 3.48Å; N191-H193 PolarHBondContact O-ND1 3.19Å
192	Y	46.5	Very low	45.6	Very low	31 Å²	31	62.3 Å²	62.3	12%	0.122	34%	0.337	C	S	.	.	S	Bend	trans	-71.5	84	162.7	-71.9	-92.6	0	0	0	107.8	V184 N188 W189 Y194 Q213 H218	V184-Y192 HydrophobicContact CB-CD2 4.42Å; V184-Y192 HydrophobicContact CB-CE2 4.32Å; V184-Y192 HydrophobicContact CG1-CD2 3.34Å; V184-Y192 HydrophobicContact CG1-CE2 3.45Å; V184-Y192 VanDerWaalsContact CG1-CE2 3.45Å; V184-Y192 HydrophobicContact CG1-CG 3.95Å; V184-Y192 HydrophobicContact CG2-CD1 4.02Å; V184-Y192 HydrophobicContact CG2-CD2 4.22Å; V184-Y192 HydrophobicContact CG2-CE1 3.73Å; V184-Y192 HydrophobicContact CG2-CE2 4.02Å; V184-Y192 HydrophobicContact CG2-CG 4.26Å; N188-Y192 HydrophobicContact CB-CD2 3.85Å; N188-Y192 HydrophobicContact CB-CE2 3.7Å; N188-Y192 VanDerWaalsContact O-CD2 3.25Å; N188-Y192 WeakPolarHBondContact O-CD2 3.43Å; N188-Y192 PolarHBondContact O-N 2.91Å; W189-Y192 CarbonylContact O-C 3.46Å; W189-Y192 PolarHBondContact O-N 3.29Å; Y192-Y194 HydrophobicContact CD1-CE1 4.47Å; Y192-Y194 HydrophobicContact CG-CE2 4.24Å; Y192-Y194 WeakPolarHBondContact O-CD2 3.28Å; Y192-Y194 PolarHBondContact O-N 3.5Å; Y192-Q213 HydrophobicContact CD1-CB 3.83Å; Y192-Q213 HydrophobicContact CE1-CB 3.38Å; Y192-Q213 VanDerWaalsContact CE1-O 3.26Å; Y192-Q213 WeakPolarHBondContact CE1-O 3.1Å; Y192-Q213 HydrophobicContact CE2-CB 4.23Å; Y192-Q213 HydrophobicContact CG-CB 4.45Å; Y192-H218 AromaticContact CE1-NE2 3.9Å
193	H	41.9	Very low	44.3	Very low	92 Å²	92	63.3 Å²	63.3	43%	0.426	35%	0.35	S	S	.	.			trans	-63.3	80.7	157.7	-67	79.5	0	0	0	105.8	N191 I195 H211	N191-H193 PolarHBondContact O-N 3.48Å; N191-H193 PolarHBondContact O-ND1 3.19Å; H193-I195 VanDerWaalsContact C-N 3.29Å; H193-I195 PolarHBondContact O-N 3.35Å; H193-H211 PolarHBondContact O-ND1 2.99Å
194	Y	44.8	Very low	42.9	Very low	10 Å²	10	57.7 Å²	57.7	4%	0.039	33%	0.326	C	S	.	.			trans	-54.6	105.3	175.7	-77.7	-76.4	0	0	0	105.4	I9 L182 V184 W189 Y192 M196	I9-Y194 HydrophobicContact CD1-CD2 4.4Å; L182-Y194 HydrophobicContact CD1-CD1 4.18Å; L182-Y194 HydrophobicContact CD1-CE1 3.46Å; L182-Y194 VanDerWaalsContact CD1-CE1 3.46Å; L182-Y194 HydrophobicContact CD2-CE1 4.16Å; L182-Y194 HydrophobicContact CG-CE1 4.3Å; V184-Y194 WeakPolarHBondContact CB-OH 3.42Å; V184-Y194 WeakPolarHBondContact CG1-OH 3.41Å; V184-Y194 HydrophobicContact CG2-CE1 4.49Å; V184-Y194 WeakPolarHBondContact CG2-OH 3.48Å; W189-Y194 HydrophobicContact CD2-CD2 4.04Å; W189-Y194 AromaticContact CD2-CE2 3.25Å; W189-Y194 HydrophobicContact CD2-CE2 3.25Å; W189-Y194 AromaticContact CE2-CD2 3.56Å; W189-Y194 AromaticContact CE2-CE2 3.25Å; W189-Y194 HydrophobicContact CE3-CD2 4.36Å; W189-Y194 AromaticContact CE3-CE2 3.27Å; W189-Y194 HydrophobicContact CE3-CE2 3.27Å; W189-Y194 AromaticContact CE3-CZ 3.53Å; W189-Y194 HydrophobicContact CG-CE2 4Å; W189-Y194 AromaticContact CH2-CD2 3.83Å; W189-Y194 HydrophobicContact CH2-CD2 3.83Å; W189-Y194 HydrophobicContact CH2-CE1 4.12Å; W189-Y194 AromaticContact CH2-CE2 3.3Å; W189-Y194 HydrophobicContact CH2-CE2 3.3Å; W189-Y194 HydrophobicContact CH2-CG 4.41Å; W189-Y194 AromaticContact CH2-CZ 3.41Å; W189-Y194 VanDerWaalsContact CH2-CZ 3.41Å; W189-Y194 AromaticContact CZ2-CD2 3.46Å; W189-Y194 HydrophobicContact CZ2-CD2 3.46Å; W189-Y194 VanDerWaalsContact CZ2-CD2 3.46Å; W189-Y194 AromaticContact CZ2-CE2 3.29Å; W189-Y194 HydrophobicContact CZ2-CE2 3.29Å; W189-Y194 HydrophobicContact CZ2-CG 4.23Å; W189-Y194 AromaticContact CZ2-CZ 3.92Å; W189-Y194 HydrophobicContact CZ3-CD2 4.28Å; W189-Y194 HydrophobicContact CZ3-CE1 4.21Å; W189-Y194 AromaticContact CZ3-CE2 3.31Å; W189-Y194 HydrophobicContact CZ3-CE2 3.31Å; W189-Y194 AromaticContact CZ3-CZ 3.21Å; W189-Y194 WeakPolarHBondContact CZ3-OH 3.39Å; W189-Y194 AromaticContact NE1-CE2 3.99Å; Y192-Y194 HydrophobicContact CD1-CE1 4.47Å; Y192-Y194 HydrophobicContact CG-CE2 4.24Å; Y192-Y194 WeakPolarHBondContact O-CD2 3.28Å; Y192-Y194 PolarHBondContact O-N 3.5Å; Y194-M196 PolarHBondContact O-N 3.46Å
195	I	43.2	Very low	42.2	Very low	10 Å²	10	59.9 Å²	59.9	5%	0.051	34%	0.337	C	S	.	.			trans	17.4	77.8	143.9	-55.9	150.3	0	0	0	108.5	H193 A197 L219 L222	H193-I195 VanDerWaalsContact C-N 3.29Å; H193-I195 PolarHBondContact O-N 3.35Å; I195-A197 HydrophobicContact CG2-CB 3.34Å; I195-A197 PolarHBondContact O-N 2.79Å; I195-L219 HydrophobicContact CB-CD2 4.07Å; I195-L219 HydrophobicContact CD1-CB 4.26Å; I195-L219 HydrophobicContact CD1-CD2 3.4Å; I195-L219 VanDerWaalsContact CD1-CD2 3.4Å; I195-L219 HydrophobicContact CD1-CG 3.49Å; I195-L219 VanDerWaalsContact CD1-CG 3.49Å; I195-L219 HydrophobicContact CG1-CD2 3.6Å; I195-L219 HydrophobicContact CG1-CG 4.07Å; I195-L219 HydrophobicContact CG2-CD2 3.32Å; I195-L222 HydrophobicContact CB-CD2 4.27Å; I195-L222 HydrophobicContact CG2-CD2 4.23Å
196	M	38.8	Very low	41.4	Very low	87 Å²	87	59.5 Å²	59.5	43%	0.429	33%	0.327	S	S	.	.			trans	-73.5	67.4	154.4	-73.1	-174.7	-72.1	0	0	104.4	Y194 M198 Y206 P208	Y194-M196 PolarHBondContact O-N 3.46Å; M196-M198 HydrophobicContact CB-CE 4.48Å; M196-M198 PolarHBondContact O-N 2.85Å; M196-M198 HydrophobicContact SD-CE 4.39Å; M196-Y206 CarbonylContact C-O 3.37Å; M196-P208 HydrophobicContact CB-CG 4.49Å; M196-P208 HydrophobicContact CE-CG 4.27Å
197	A	41.1	Very low	41.1	Very low	29 Å²	29	58.4 Å²	58.4	24%	0.24	32%	0.317	C	S	.	.			trans	-65.9	77.8	163.6	0	0	0	0	0	105.5	I195 E199 I205 Y206	I195-A197 HydrophobicContact CG2-CB 3.34Å; I195-A197 PolarHBondContact O-N 2.79Å; A197-E199 PolarHBondContact O-N 3.48Å; A197-I205 HydrophobicContact CB-CB 4.39Å; A197-I205 HydrophobicContact CB-CG2 3.26Å; A197-Y206 WeakPolarHBondContact CA-O 3.46Å; A197-Y206 PolarHBondContact N-O 3.46Å
198	M	35.5	Very low	40.5	Very low	36 Å²	36	52.9 Å²	52.9	18%	0.177	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-69.9	122.8	161.2	-54.4	-158.2	178.6	0	0	104.7	F12 M196 S200 S204 I205 Y206 W253	F12-M198 HydrophobicContact CE1-CG 4.32Å; F12-M198 HydrophobicContact CE2-CE 4.36Å; F12-M198 HydrophobicContact CZ-CB 4.25Å; F12-M198 HydrophobicContact CZ-CE 4.37Å; F12-M198 HydrophobicContact CZ-CG 3.68Å; F12-M198 HydrophobicContact CZ-SD 4.27Å; M196-M198 HydrophobicContact CB-CE 4.48Å; M196-M198 PolarHBondContact O-N 2.85Å; M196-M198 HydrophobicContact SD-CE 4.39Å; M198-S200 PolarHBondContact O-N 3.33Å; M198-S204 VanDerWaalsContact O-O 3.05Å; M198-I205 WeakPolarHBondContact O-CA 3.36Å; M198-Y206 HydrophobicContact CB-CD2 3.99Å; M198-Y206 WeakPolarHBondContact O-CD2 3.48Å; M198-Y206 PolarHBondContact O-N 2.89Å; M198-W253 HydrophobicContact CE-CH2 3.43Å; M198-W253 VanDerWaalsContact CE-CH2 3.43Å; M198-W253 HydrophobicContact CE-CZ2 4.45Å; M198-W253 HydrophobicContact CE-CZ3 3.56Å; M198-W253 HydrophobicContact SD-CH2 3.44Å; M198-W253 WeakPolarHBondContact SD-CH2 3.42Å; M198-W253 HydrophobicContact SD-CZ3 3.78Å
199	E	34.7	Very low	40	Very low	51 Å²	51	55 Å²	55	24%	0.238	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-70.6	119	160.3	-162.9	-174.6	172	0	0	105.9	F16 L19 A197 G203 S204	F16-E199 HydrophobicContact CD1-CB 4.27Å; F16-E199 HydrophobicContact CE1-CB 4.15Å; L19-E199 WeakPolarHBondContact CD2-OE1 3.48Å; A197-E199 PolarHBondContact O-N 3.48Å; E199-G203 WeakPolarHBondContact OE1-CA 3.48Å; E199-S204 CarbonylContact C-O 3.46Å; E199-S204 VanDerWaalsContact CA-O 3.23Å; E199-S204 WeakPolarHBondContact CA-O 3.21Å
200	S	35.7	Very low	39.5	Very low	10 Å²	10	58.3 Å²	58.3	7%	0.07	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-62.9	162.9	164	13	0	0	0	0	109.4	M198 D202 G203 S204 Y206	M198-S200 PolarHBondContact O-N 3.33Å; S200-D202 WeakPolarHBondContact CB-OD1 3.36Å; S200-D202 PolarHBondContact O-N 2.76Å; S200-D202 PolarHBondContact OG-OD1 3.07Å; S200-G203 PolarHBondContact O-N 3.38Å; S200-S204 PolarHBondContact N-O 2.71Å; S200-S204 VanDerWaalsContact OG-CB 3.31Å; S200-S204 WeakPolarHBondContact OG-CB 3.23Å; S200-S204 PolarHBondContact OG-O 3.24Å; S200-Y206 VanDerWaalsContact CB-CE2 3.41Å; S200-Y206 WeakPolarHBondContact CB-OH 3.44Å; S200-Y206 WeakPolarHBondContact OG-CE2 3.23Å; S200-Y206 PolarHBondContact OG-OH 2.82Å
201	P	31.6	Very low	39.7	Very low	147 Å²	147	53.7 Å²	53.7	96%	0.955	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-11.4	169.3	-26.1	35	0	0	0	115.4
202	D	35.4	Very low	39.7	Very low	90 Å²	90	57.7 Å²	57.7	48%	0.481	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	2.9	177.2	66.4	10.2	0	0	0	114.3	S200 S204	S200-D202 WeakPolarHBondContact CB-OD1 3.36Å; S200-D202 PolarHBondContact O-N 2.76Å; S200-D202 PolarHBondContact OG-OD1 3.07Å; D202-S204 WeakPolarHBondContact OD1-CB 3.19Å; D202-S204 PolarHBondContact OD1-N 3.36Å; D202-S204 PolarHBondContact OD1-OG 2.82Å; D202-S204 PolarHBondContact OD2-OG 2.87Å
203	G	34	Very low	39.5	Very low	29 Å²	29	59.9 Å²	59.9	30%	0.299	31%	0.314	S	S	.	.	S	Bend	trans	87.9	-2.7	-178.2	0	0	0	0	0	115.3	E199 S200	E199-G203 WeakPolarHBondContact OE1-CA 3.48Å; S200-G203 PolarHBondContact O-N 3.38Å
204	S	36	Very low	40	Very low	4 Å²	4	56.2 Å²	56.2	3%	0.028	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-77.8	139.1	-177.5	-45.4	0	0	0	0	111.6	M198 E199 S200 D202 L261 G262	M198-S204 VanDerWaalsContact O-O 3.05Å; E199-S204 CarbonylContact C-O 3.46Å; E199-S204 VanDerWaalsContact CA-O 3.23Å; E199-S204 WeakPolarHBondContact CA-O 3.21Å; S200-S204 PolarHBondContact N-O 2.71Å; S200-S204 VanDerWaalsContact OG-CB 3.31Å; S200-S204 WeakPolarHBondContact OG-CB 3.23Å; S200-S204 PolarHBondContact OG-O 3.24Å; D202-S204 WeakPolarHBondContact OD1-CB 3.19Å; D202-S204 PolarHBondContact OD1-N 3.36Å; D202-S204 PolarHBondContact OD1-OG 2.82Å; D202-S204 PolarHBondContact OD2-OG 2.87Å; S204-L261 WeakPolarHBondContact CB-O 2.98Å; S204-G262 WeakPolarHBondContact OG-CA 3.29Å
205	I	41.1	Very low	40.2	Very low	54 Å²	54	59.2 Å²	59.2	28%	0.277	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-94.8	119.9	178.8	-70.6	171.9	0	0	0	109.8	L19 A197 M198 V207	L19-I205 HydrophobicContact CD1-CD1 4.39Å; A197-I205 HydrophobicContact CB-CB 4.39Å; A197-I205 HydrophobicContact CB-CG2 3.26Å; M198-I205 WeakPolarHBondContact O-CA 3.36Å; I205-V207 HydrophobicContact CG2-CG2 4.43Å
206	Y	38.4	Very low	40.3	Very low	59 Å²	59	67 Å²	67	23%	0.231	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-82.4	136.2	173.7	-64.3	-79.2	0	0	0	112	M196 A197 M198 S200 I258 V260	M196-Y206 CarbonylContact C-O 3.37Å; A197-Y206 WeakPolarHBondContact CA-O 3.46Å; A197-Y206 PolarHBondContact N-O 3.46Å; M198-Y206 HydrophobicContact CB-CD2 3.99Å; M198-Y206 WeakPolarHBondContact O-CD2 3.48Å; M198-Y206 PolarHBondContact O-N 2.89Å; S200-Y206 VanDerWaalsContact CB-CE2 3.41Å; S200-Y206 WeakPolarHBondContact CB-OH 3.44Å; S200-Y206 WeakPolarHBondContact OG-CE2 3.23Å; S200-Y206 PolarHBondContact OG-OH 2.82Å; Y206-I258 HydrophobicContact CD1-CG2 3.31Å; Y206-I258 HydrophobicContact CE1-CG2 4.02Å; Y206-I258 HydrophobicContact CG-CG2 4.06Å; Y206-V260 HydrophobicContact CD1-CG2 4.39Å; Y206-V260 HydrophobicContact CE1-CB 4.15Å; Y206-V260 HydrophobicContact CE1-CG1 3.91Å; Y206-V260 HydrophobicContact CE1-CG2 3.73Å
207	V	46	Very low	41	Very low	50 Å²	50	69.1 Å²	69.1	30%	0.303	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.9	172.2	-176.3	0	0	0	0	108.5	I205 K209 H211	I205-V207 HydrophobicContact CG2-CG2 4.43Å; V207-K209 PolarHBondContact O-N 3.42Å; V207-H211 HydrophobicContact CG1-CB 3.92Å
208	P	41.6	Very low	41.5	Very low	26 Å²	26	68.9 Å²	68.9	17%	0.169	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	135.6	178.2	-23	32.4	0	0	0	111.8	M196 N210 H211	M196-P208 HydrophobicContact CB-CG 4.49Å; M196-P208 HydrophobicContact CE-CG 4.27Å; P208-N210 PolarHBondContact O-N 3.28Å; P208-N210 VanDerWaalsContact O-N 3.11Å; P208-H211 WeakPolarHBondContact O-CB 2.81Å; P208-H211 PolarHBondContact O-N 3.18Å
209	K	38	Very low	42.3	Very low	95 Å²	95	69.5 Å²	69.5	41%	0.413	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-24.3	179.2	-83.1	-167.3	-132.7	169.4	0	114	V207 H211 D257 L259	V207-K209 PolarHBondContact O-N 3.42Å; K209-H211 PolarHBondContact O-N 3.42Å; K209-D257 HydrophobicContact CB-CB 4.41Å; K209-D257 WeakPolarHBondContact CB-O 3.18Å; K209-D257 HydrophobicContact CD-CB 3.7Å; K209-D257 WeakPolarHBondContact CD-O 3.26Å; K209-D257 VanDerWaalsContact CE-CB 3.43Å; K209-D257 WeakPolarHBondContact CE-O 3.03Å; K209-D257 HydrophobicContact CG-CB 4.38Å; K209-D257 WeakPolarHBondContact CG-O 3.05Å; K209-D257 VanDerWaalsContact NZ-CB 3.35Å; K209-D257 IonicContact NZ-OD1 3.7Å; K209-D257 IonicContact NZ-OD2 2.75Å; K209-D257 PolarHBondContact NZ-OD2 3.47Å; K209-L259 HydrophobicContact CD-CD1 4.15Å; K209-L259 HydrophobicContact CD-CG 4.03Å; K209-L259 HydrophobicContact CG-CB 4.4Å; K209-L259 HydrophobicContact CG-CD1 3.78Å; K209-L259 HydrophobicContact CG-CG 3.81Å
210	N	39.3	Very low	42.9	Very low	86 Å²	86	71.5 Å²	71.5	46%	0.46	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	15	178.5	-65.2	-29.8	0	0	0	113.7	P208 K212	P208-N210 PolarHBondContact O-N 3.28Å; P208-N210 VanDerWaalsContact O-N 3.11Å; N210-K212 PolarHBondContact O-N 2.8Å; N210-K212 VanDerWaalsContact O-N 3.13Å
211	H	47.6	Very low	43.8	Very low	41 Å²	41	72.6 Å²	72.6	19%	0.19	37%	0.369	C	S	.	.			trans	-72	103	178.3	-172.7	78.1	0	0	0	111.3	H193 V207 P208 K209 S214	H193-H211 PolarHBondContact O-ND1 2.99Å; V207-H211 HydrophobicContact CG1-CB 3.92Å; P208-H211 WeakPolarHBondContact O-CB 2.81Å; P208-H211 PolarHBondContact O-N 3.18Å; K209-H211 PolarHBondContact O-N 3.42Å; H211-S214 WeakPolarHBondContact CE1-CB 3.44Å; H211-S214 PolarHBondContact CE1-N 2.87Å; H211-S214 PolarHBondContact CE1-OG 2.78Å; H211-S214 WeakPolarHBondContact NE2-CA 3.37Å; H211-S214 WeakPolarHBondContact NE2-CB 3.09Å; H211-S214 PolarHBondContact NE2-N 3.42Å; H211-S214 PolarHBondContact NE2-O 3.47Å; H211-S214 VanDerWaalsContact NE2-O 3.12Å; H211-S214 PolarHBondContact NE2-OG 3.33Å
212	K	41.8	Very low	45	Very low	174 Å²	174	66.3 Å²	66.3	76%	0.757	33%	0.327	S	S	*	.			trans	-96.5	-18.3	-173.1	-69.1	-170.3	178.1	-170.7	0	115.3	N210	N210-K212 PolarHBondContact O-N 2.8Å; N210-K212 VanDerWaalsContact O-N 3.13Å
213	Q	44	Very low	45.9	Very low	78 Å²	78	65.6 Å²	65.6	36%	0.364	32%	0.323	S	S	.	.	S	Bend	trans	-144.2	-5.4	-161	-68.8	-171.7	-21.7	0	0	117.7	Y192 T215	Y192-Q213 HydrophobicContact CD1-CB 3.83Å; Y192-Q213 HydrophobicContact CE1-CB 3.38Å; Y192-Q213 VanDerWaalsContact CE1-O 3.26Å; Y192-Q213 WeakPolarHBondContact CE1-O 3.1Å; Y192-Q213 HydrophobicContact CE2-CB 4.23Å; Y192-Q213 HydrophobicContact CG-CB 4.45Å; Q213-T215 PolarHBondContact O-N 3.28Å
214	S	51	Low	46.6	Very low	15 Å²	15	65.8 Å²	65.8	11%	0.105	33%	0.325	C	S	.	.			trans	-86.7	111	175.3	-44	0	0	0	0	111	H211	H211-S214 WeakPolarHBondContact CE1-CB 3.44Å; H211-S214 PolarHBondContact CE1-N 2.87Å; H211-S214 PolarHBondContact CE1-OG 2.78Å; H211-S214 WeakPolarHBondContact NE2-CA 3.37Å; H211-S214 WeakPolarHBondContact NE2-CB 3.09Å; H211-S214 PolarHBondContact NE2-N 3.42Å; H211-S214 PolarHBondContact NE2-O 3.47Å; H211-S214 VanDerWaalsContact NE2-O 3.12Å; H211-S214 PolarHBondContact NE2-OG 3.33Å
215	T	48.8	Very low	47.6	Very low	73 Å²	73	65.9 Å²	65.9	45%	0.448	33%	0.325	S	S	.	.			trans	-67.5	162.4	169.5	67.9	0	0	0	0	111	Q213 K217 H218 L219	Q213-T215 PolarHBondContact O-N 3.28Å; T215-K217 PolarHBondContact O-N 3.25Å; T215-K217 WeakPolarHBondContact OG1-CB 3.2Å; T215-K217 PolarHBondContact OG1-N 2.98Å; T215-H218 PolarHBondContact N-ND1 3.48Å; T215-H218 WeakPolarHBondContact O-CA 3.18Å; T215-H218 WeakPolarHBondContact O-CB 3.2Å; T215-H218 PolarHBondContact O-N 2.89Å; T215-H218 PolarHBondContact OG1-CE1 3.12Å; T215-H218 PolarHBondContact OG1-ND1 3.22Å; T215-L219 PolarHBondContact O-N 2.98Å
216	R	46.9	Very low	48	Very low	173 Å²	173	64.2 Å²	64.2	65%	0.653	32%	0.319	S	S	*	.	H	α-helix	trans	-46.1	-33.7	169.6	-177.7	177.9	176.4	-178.7	-0.6	113	L219 I220	R216-L219 WeakPolarHBondContact O-CB 2.98Å; R216-L219 PolarHBondContact O-N 3.48Å; R216-I220 HydrophobicContact CG-CD1 3.82Å; R216-I220 HydrophobicContact CG-CG1 4.43Å; R216-I220 VanDerWaalsContact O-CG1 3.28Å; R216-I220 WeakPolarHBondContact O-CG1 3.02Å; R216-I220 PolarHBondContact O-N 3.42Å
217	K	52.4	Low	48.4	Very low	132 Å²	132	64.6 Å²	64.6	57%	0.574	32%	0.323	S	S	*	.	H	α-helix	trans	-61.3	-43.3	174.4	-175	179.5	-178.5	174	0	112.6	T215 I220 T221	T215-K217 PolarHBondContact O-N 3.25Å; T215-K217 WeakPolarHBondContact OG1-CB 3.2Å; T215-K217 PolarHBondContact OG1-N 2.98Å; K217-I220 PolarHBondContact O-N 2.94Å; K217-T221 WeakPolarHBondContact O-CB 3.2Å; K217-T221 PolarHBondContact O-N 2.8Å; K217-T221 PolarHBondContact O-OG1 3.43Å
218	H	52.1	Low	48.5	Very low	24 Å²	24	66.6 Å²	66.6	11%	0.111	33%	0.329	C	S	.	.	H	α-helix	trans	-66.2	-39	177.9	-64.1	89.8	0	0	0	111.6	L182 Y192 T215 T221 L222	L182-H218 HydrophobicContact CD2-CB 4.15Å; Y192-H218 AromaticContact CE1-NE2 3.9Å; T215-H218 PolarHBondContact N-ND1 3.48Å; T215-H218 WeakPolarHBondContact O-CA 3.18Å; T215-H218 WeakPolarHBondContact O-CB 3.2Å; T215-H218 PolarHBondContact O-N 2.89Å; T215-H218 PolarHBondContact OG1-CE1 3.12Å; T215-H218 PolarHBondContact OG1-ND1 3.22Å; H218-T221 PolarHBondContact O-N 2.79Å; H218-L222 WeakPolarHBondContact O-CB 3.39Å; H218-L222 PolarHBondContact O-N 2.8Å
219	L	52.4	Low	48.9	Very low	48 Å²	48	65.6 Å²	65.6	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-52.7	172.8	-81	161.5	0	0	0	111.4	I195 T215 R216 T221 L222 L223	I195-L219 HydrophobicContact CB-CD2 4.07Å; I195-L219 HydrophobicContact CD1-CB 4.26Å; I195-L219 HydrophobicContact CD1-CD2 3.4Å; I195-L219 VanDerWaalsContact CD1-CD2 3.4Å; I195-L219 HydrophobicContact CD1-CG 3.49Å; I195-L219 VanDerWaalsContact CD1-CG 3.49Å; I195-L219 HydrophobicContact CG1-CD2 3.6Å; I195-L219 HydrophobicContact CG1-CG 4.07Å; I195-L219 HydrophobicContact CG2-CD2 3.32Å; T215-L219 PolarHBondContact O-N 2.98Å; R216-L219 WeakPolarHBondContact O-CB 2.98Å; R216-L219 PolarHBondContact O-N 3.48Å; L219-T221 VanDerWaalsContact C-N 3.32Å; L219-T221 PolarHBondContact O-N 3.27Å; L219-L222 WeakPolarHBondContact O-CB 3.18Å; L219-L222 PolarHBondContact O-N 2.92Å; L219-L223 WeakPolarHBondContact O-CD1 3.47Å; L219-L223 PolarHBondContact O-N 3.4Å
220	I	47.6	Very low	49.1	Very low	94 Å²	94	63.3 Å²	63.3	48%	0.482	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-40.7	179	-67.2	167.5	0	0	0	111	R216 K217 L223 G224	R216-I220 HydrophobicContact CG-CD1 3.82Å; R216-I220 HydrophobicContact CG-CG1 4.43Å; R216-I220 VanDerWaalsContact O-CG1 3.28Å; R216-I220 WeakPolarHBondContact O-CG1 3.02Å; R216-I220 PolarHBondContact O-N 3.42Å; K217-I220 PolarHBondContact O-N 2.94Å; I220-L223 PolarHBondContact O-N 3.35Å; I220-G224 PolarHBondContact O-N 2.98Å
221	T	54.5	Low	49	Very low	32 Å²	32	63.5 Å²	63.5	20%	0.196	32%	0.324	C	S	.	.	H	α-helix	trans	-64	-40.8	176.1	-63.8	0	0	0	0	111.8	K181 L182 K217 H218 L219 F225	K181-T221 HydrophobicContact CB-CG2 3.71Å; L182-T221 HydrophobicContact CD2-CG2 3.93Å; L182-T221 HydrophobicContact CG-CG2 4.27Å; K217-T221 WeakPolarHBondContact O-CB 3.2Å; K217-T221 PolarHBondContact O-N 2.8Å; K217-T221 PolarHBondContact O-OG1 3.43Å; H218-T221 PolarHBondContact O-N 2.79Å; L219-T221 VanDerWaalsContact C-N 3.32Å; L219-T221 PolarHBondContact O-N 3.27Å; T221-F225 VanDerWaalsContact O-CB 3.29Å; T221-F225 WeakPolarHBondContact O-CB 3.31Å; T221-F225 PolarHBondContact O-N 2.86Å
222	L	57.5	Low	48.5	Very low	16 Å²	16	65.3 Å²	65.3	8%	0.084	34%	0.335	C	S	.	.	H	α-helix	trans	-63.6	-45.6	176.7	-165.6	92.5	0	0	0	111	I9 I13 L178 I195 H218 L219 F225 A226	I9-L222 HydrophobicContact CG2-CD1 4.49Å; I13-L222 HydrophobicContact CD1-CD1 4.09Å; I13-L222 HydrophobicContact CD1-CG 4.13Å; L178-L222 HydrophobicContact CD1-CD1 4.36Å; I195-L222 HydrophobicContact CB-CD2 4.27Å; I195-L222 HydrophobicContact CG2-CD2 4.23Å; H218-L222 WeakPolarHBondContact O-CB 3.39Å; H218-L222 PolarHBondContact O-N 2.8Å; L219-L222 WeakPolarHBondContact O-CB 3.18Å; L219-L222 PolarHBondContact O-N 2.92Å; L222-F225 PolarHBondContact O-N 3.44Å; L222-A226 WeakPolarHBondContact O-CB 3.12Å; L222-A226 PolarHBondContact O-N 2.51Å
223	L	53.6	Low	48.3	Very low	75 Å²	75	66.1 Å²	66.1	39%	0.393	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-47.2	176	-79.4	152.4	0	0	0	111.7	L219 I220 F225 A226 E227	L219-L223 WeakPolarHBondContact O-CD1 3.47Å; L219-L223 PolarHBondContact O-N 3.4Å; I220-L223 PolarHBondContact O-N 3.35Å; L223-F225 VanDerWaalsContact C-N 3.32Å; L223-F225 PolarHBondContact O-N 3.03Å; L223-A226 VanDerWaalsContact O-CB 3.32Å; L223-A226 WeakPolarHBondContact O-CB 3.07Å; L223-A226 PolarHBondContact O-N 2.96Å; L223-E227 PolarHBondContact O-N 3.42Å
224	G	48.8	Very low	47.7	Very low	33 Å²	33	67 Å²	67	34%	0.34	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-33.4	177.1	0	0	0	0	0	113.1	I220 E227 E228	I220-G224 PolarHBondContact O-N 2.98Å; G224-E227 PolarHBondContact O-N 2.98Å; G224-E228 WeakPolarHBondContact O-CB 3.34Å; G224-E228 PolarHBondContact O-N 2.84Å
225	F	56.8	Low	46.8	Very low	5 Å²	5	66.6 Å²	66.6	2%	0.022	35%	0.345	C	S	.	.	H	α-helix	trans	-71.3	-36.4	174.4	-167.7	-108.6	0	0	0	111.9	L10 L174 H177 L178 K181 T221 L222 L223 E228 I229	L10-F225 HydrophobicContact CD1-CE1 4.17Å; L174-F225 HydrophobicContact CB-CZ 4.33Å; L174-F225 HydrophobicContact CD2-CZ 4.28Å; L174-F225 WeakPolarHBondContact O-CZ 3.18Å; H177-F225 HydrophobicContact CB-CE2 3.92Å; H177-F225 HydrophobicContact CB-CZ 4.14Å; L178-F225 HydrophobicContact CB-CD1 3.89Å; L178-F225 HydrophobicContact CB-CE1 3.58Å; L178-F225 HydrophobicContact CB-CG 4.46Å; L178-F225 HydrophobicContact CB-CZ 3.96Å; L178-F225 HydrophobicContact CD1-CB 4.01Å; L178-F225 HydrophobicContact CD1-CD1 3.6Å; L178-F225 HydrophobicContact CD1-CE1 4.22Å; L178-F225 HydrophobicContact CD1-CG 3.83Å; L178-F225 HydrophobicContact CD2-CD1 4.13Å; L178-F225 HydrophobicContact CD2-CE1 4.23Å; L178-F225 HydrophobicContact CG-CD1 4.05Å; L178-F225 HydrophobicContact CG-CE1 4.2Å; K181-F225 HydrophobicContact CD-CD2 4.02Å; T221-F225 VanDerWaalsContact O-CB 3.29Å; T221-F225 WeakPolarHBondContact O-CB 3.31Å; T221-F225 PolarHBondContact O-N 2.86Å; L222-F225 PolarHBondContact O-N 3.44Å; L223-F225 VanDerWaalsContact C-N 3.32Å; L223-F225 PolarHBondContact O-N 3.03Å; F225-E228 WeakPolarHBondContact CD2-OE2 3.37Å; F225-E228 PolarHBondContact O-N 2.89Å; F225-I229 HydrophobicContact CD1-CD1 3.34Å; F225-I229 HydrophobicContact CD1-CG1 4.05Å; F225-I229 HydrophobicContact CE1-CD1 3.2Å; F225-I229 HydrophobicContact CE1-CG1 3.8Å; F225-I229 HydrophobicContact CG-CD1 4.27Å; F225-I229 HydrophobicContact CZ-CD1 4Å; F225-I229 HydrophobicContact CZ-CG1 4.1Å; F225-I229 WeakPolarHBondContact O-CB 3.35Å; F225-I229 WeakPolarHBondContact O-CD1 3.03Å; F225-I229 VanDerWaalsContact O-CG1 3.24Å; F225-I229 WeakPolarHBondContact O-CG1 3.32Å; F225-I229 PolarHBondContact O-N 2.69Å
226	A	50.4	Low	46	Very low	19 Å²	19	65.4 Å²	65.4	16%	0.157	34%	0.335	C	S	.	.	H	α-helix	trans	-58.6	-47.7	170.8	0	0	0	0	0	111.5	I13 L222 L223 E228 I229 V230	I13-A226 HydrophobicContact CB-CB 4.47Å; I13-A226 VanDerWaalsContact CG2-CA 3.43Å; I13-A226 HydrophobicContact CG2-CB 3.32Å; L222-A226 WeakPolarHBondContact O-CB 3.12Å; L222-A226 PolarHBondContact O-N 2.51Å; L223-A226 VanDerWaalsContact O-CB 3.32Å; L223-A226 WeakPolarHBondContact O-CB 3.07Å; L223-A226 PolarHBondContact O-N 2.96Å; A226-E228 VanDerWaalsContact C-N 3.34Å; A226-E228 PolarHBondContact O-N 2.98Å; A226-I229 PolarHBondContact O-N 2.95Å; A226-V230 VanDerWaalsContact O-CG2 3.31Å; A226-V230 WeakPolarHBondContact O-CG2 3.01Å; A226-V230 PolarHBondContact O-N 3.44Å
227	E	45.7	Very low	45.1	Very low	67 Å²	67	61.9 Å²	61.9	31%	0.313	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-41.5	175.4	-72	177.4	-179.4	0	0	112.3	L18 I21 L223 G224 V230 S231	L18-E227 HydrophobicContact CD2-CG 4.11Å; I21-E227 HydrophobicContact CD1-CG 4.46Å; I21-E227 VanDerWaalsContact CG1-OE1 3.31Å; I21-E227 WeakPolarHBondContact CG1-OE1 3.25Å; L223-E227 PolarHBondContact O-N 3.42Å; G224-E227 PolarHBondContact O-N 2.98Å; E227-V230 PolarHBondContact O-N 3.37Å; E227-S231 WeakPolarHBondContact O-CB 3.44Å; E227-S231 PolarHBondContact O-N 2.92Å; E227-S231 PolarHBondContact O-OG 3.05Å
228	E	49.1	Very low	43.8	Very low	93 Å²	93	64.8 Å²	64.8	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-44.3	177.1	-176.4	176	-167	0	0	111.8	K181 G224 F225 A226 N232	K181-E228 VanDerWaalsContact NZ-CD 3.3Å; K181-E228 IonicContact NZ-OE1 3.19Å; K181-E228 PolarHBondContact NZ-OE1 2.87Å; K181-E228 IonicContact NZ-OE2 2.59Å; K181-E228 PolarHBondContact NZ-OE2 3.43Å; G224-E228 WeakPolarHBondContact O-CB 3.34Å; G224-E228 PolarHBondContact O-N 2.84Å; F225-E228 WeakPolarHBondContact CD2-OE2 3.37Å; F225-E228 PolarHBondContact O-N 2.89Å; A226-E228 VanDerWaalsContact C-N 3.34Å; A226-E228 PolarHBondContact O-N 2.98Å; E228-N232 VanDerWaalsContact O-CB 3.29Å; E228-N232 WeakPolarHBondContact O-CB 3.33Å; E228-N232 PolarHBondContact O-N 2.8Å
229	I	48	Very low	42.7	Very low	5 Å²	5	65.9 Å²	65.9	3%	0.026	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-48.3	176.6	-71.4	164.6	0	0	0	111.2	L10 I13 I14 L174 F225 A226 N232 I236	L10-I229 HydrophobicContact CD1-CD1 3.72Å; L10-I229 HydrophobicContact CG-CD1 4.45Å; I13-I229 HydrophobicContact CG2-CD1 4.09Å; I14-I229 HydrophobicContact CD1-CG2 4.18Å; I14-I229 HydrophobicContact CG1-CG2 3.7Å; L174-I229 HydrophobicContact CD2-CG1 4.48Å; F225-I229 HydrophobicContact CD1-CD1 3.34Å; F225-I229 HydrophobicContact CD1-CG1 4.05Å; F225-I229 HydrophobicContact CE1-CD1 3.2Å; F225-I229 HydrophobicContact CE1-CG1 3.8Å; F225-I229 HydrophobicContact CG-CD1 4.27Å; F225-I229 HydrophobicContact CZ-CD1 4Å; F225-I229 HydrophobicContact CZ-CG1 4.1Å; F225-I229 WeakPolarHBondContact O-CB 3.35Å; F225-I229 WeakPolarHBondContact O-CD1 3.03Å; F225-I229 VanDerWaalsContact O-CG1 3.24Å; F225-I229 WeakPolarHBondContact O-CG1 3.32Å; F225-I229 PolarHBondContact O-N 2.69Å; A226-I229 PolarHBondContact O-N 2.95Å; I229-N232 PolarHBondContact O-N 3.13Å; I229-I236 HydrophobicContact CG2-CD1 3.05Å; I229-I236 HydrophobicContact CG2-CG1 3.9Å
230	V	42.6	Very low	41.5	Very low	47 Å²	47	70.6 Å²	70.6	29%	0.285	38%	0.375	S	S	.	.	H	α-helix	trans	-72.3	-34.1	-177.6	-177.1	0	0	0	0	111.6	L18 A226 E227 N232	L18-V230 HydrophobicContact CD1-CB 3.96Å; L18-V230 HydrophobicContact CD1-CG1 3.3Å; L18-V230 HydrophobicContact CD2-CB 3.97Å; L18-V230 HydrophobicContact CD2-CG1 4.22Å; L18-V230 HydrophobicContact CD2-CG2 4.14Å; L18-V230 HydrophobicContact CG-CB 4.05Å; L18-V230 HydrophobicContact CG-CG1 3.74Å; L18-V230 HydrophobicContact CG-CG2 4.21Å; A226-V230 VanDerWaalsContact O-CG2 3.31Å; A226-V230 WeakPolarHBondContact O-CG2 3.01Å; A226-V230 PolarHBondContact O-N 3.44Å; E227-V230 PolarHBondContact O-N 3.37Å; V230-N232 VanDerWaalsContact C-N 3.27Å; V230-N232 PolarHBondContact O-N 2.99Å
231	S	38.4	Very low	40.5	Very low	89 Å²	89	73.2 Å²	73.2	62%	0.622	39%	0.39	S	S	*	.	H	α-helix	trans	-67.5	-30.4	174.4	-62.8	0	0	0	0	112	E227 K233	E227-S231 WeakPolarHBondContact O-CB 3.44Å; E227-S231 PolarHBondContact O-N 2.92Å; E227-S231 PolarHBondContact O-OG 3.05Å; S231-K233 PolarHBondContact O-N 2.79Å
232	N	37.6	Very low	39.1	Very low	79 Å²	79	81.6 Å²	81.6	42%	0.422	42%	0.424	S	S	.	.	S	Bend	trans	-77.5	74.5	171.5	-158.9	-5.9	0	0	0	109.6	E228 I229 V230 N234 G235	E228-N232 VanDerWaalsContact O-CB 3.29Å; E228-N232 WeakPolarHBondContact O-CB 3.33Å; E228-N232 PolarHBondContact O-N 2.8Å; I229-N232 PolarHBondContact O-N 3.13Å; V230-N232 VanDerWaalsContact C-N 3.27Å; V230-N232 PolarHBondContact O-N 2.99Å; N232-N234 PolarHBondContact O-N 2.86Å; N232-G235 PolarHBondContact O-N 2.98Å
233	K	35.5	Very low	37.6	Very low	192 Å²	192	86 Å²	86	84%	0.835	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-9.2	-179	-81.3	-178.3	174	178.5	0	115.8	S231	S231-K233 PolarHBondContact O-N 2.79Å
234	N	33.3	Very low	36.2	Very low	95 Å²	95	91.5 Å²	91.5	51%	0.508	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-1.1	-178.3	-69.3	5.7	0	0	0	114.4	N232 I236	N232-N234 PolarHBondContact O-N 2.86Å; N234-I236 PolarHBondContact O-N 3.12Å
235	G	31.5	Very low	35.2	Very low	8 Å²	8	96 Å²	96	8%	0.082	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.2	-169.4	0	0	0	0	0	116.2	N232	N232-G235 PolarHBondContact O-N 2.98Å
236	I	31.7	Very low	33.6	Very low	48 Å²	48	103.9 Å²	103.9	25%	0.246	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144	37.4	-166.8	-33.2	172.5	0	0	0	112.3	I14 I229 N234 Y238 V239	I14-I236 HydrophobicContact CB-CD1 4.1Å; I14-I236 HydrophobicContact CD1-CB 4.5Å; I14-I236 HydrophobicContact CD1-CD1 3.38Å; I14-I236 HydrophobicContact CD1-CG1 4.18Å; I14-I236 HydrophobicContact CD1-CG2 3.62Å; I14-I236 HydrophobicContact CG1-CD1 3.38Å; I14-I236 HydrophobicContact CG2-CD1 3.56Å; I14-I236 HydrophobicContact CG2-CG2 4.31Å; I229-I236 HydrophobicContact CG2-CD1 3.05Å; I229-I236 HydrophobicContact CG2-CG1 3.9Å; N234-I236 PolarHBondContact O-N 3.12Å; I236-Y238 PolarHBondContact O-N 3.19Å; I236-V239 HydrophobicContact CG2-CG2 3.76Å
237	T	28.1	Very low	32.3	Very low	99 Å²	99	110.7 Å²	110.7	61%	0.607	57%	0.567	S	S	*	*	S	Bend	trans	-83.6	3.6	-175.5	-35.2	0	0	0	0	112.9
238	Y	25.3	Very low	31.1	Very low	193 Å²	193	112.8 Å²	112.8	76%	0.757	59%	0.589	S	S	*	*			trans	-146	71.8	-177.2	-74.2	-85	0	0	0	114.8	I236	I236-Y238 PolarHBondContact O-N 3.19Å
239	V	29.1	Very low	29.8	Very low	47 Å²	47	114.7 Å²	114.7	29%	0.285	60%	0.601	S	S	.	*	S	Bend	trans	-116	3.5	166.4	-160	0	0	0	0	113.1	L7 L11 I171 I236	L7-V239 HydrophobicContact CD1-CG1 3.82Å; L11-V239 HydrophobicContact CD1-CG1 4.3Å; L11-V239 HydrophobicContact CD2-CB 4.17Å; L11-V239 HydrophobicContact CD2-CG1 3.72Å; L11-V239 HydrophobicContact CG-CG1 4.22Å; I171-V239 HydrophobicContact CD1-CB 4.29Å; I171-V239 HydrophobicContact CD1-CG1 3.83Å; I171-V239 HydrophobicContact CD1-CG2 3.67Å; I171-V239 HydrophobicContact CG1-CG2 4.33Å; I236-V239 HydrophobicContact CG2-CG2 3.76Å
240	N	25.6	Very low	28.6	Very low	147 Å²	147	120 Å²	120	79%	0.786	63%	0.634	S	S	*	*	S	Bend	trans	-115.5	15.5	-166.3	-145.9	8.5	0	0	0	116.7
241	N	26.7	Very low	27.7	Very low	148 Å²	148	121.8 Å²	121.8	79%	0.791	65%	0.645	S	S	*	*	S	Bend	trans	-141.4	17.6	-170.8	-86.6	-28.7	0	0	0	117.7
242	K	26.4	Very low	27	Very low	209 Å²	209	126 Å²	126	91%	0.909	66%	0.655	S	S	*	*	S	Bend	trans	-130.4	6.3	177.1	-81	-168.9	179.2	174.1	0	117.6	E244	K242-E244 PolarHBondContact O-N 3.11Å
243	S	25.8	Very low	26.4	Very low	109 Å²	109	129.7 Å²	129.7	76%	0.762	66%	0.663	S	S	*	*			trans	-95.6	79.1	166.1	-177.9	0	0	0	0	109.5	D245	S243-D245 PolarHBondContact O-N 3.05Å
244	E	24.9	Very low	25.9	Very low	189 Å²	189	127.5 Å²	127.5	88%	0.883	66%	0.659	S	S	*	*			trans	-70.6	3.2	172.3	-92.3	-177.7	159.4	0	0	113.8	K242	K242-E244 PolarHBondContact O-N 3.11Å
245	D	26.9	Very low	25.3	Very low	129 Å²	129	130.2 Å²	130.2	69%	0.69	67%	0.673	S	S	*	*	S	Bend	trans	-103.5	105.1	172.1	-75	-36.7	0	0	0	111.2	S243 Q247	S243-D245 PolarHBondContact O-N 3.05Å; D245-Q247 VanDerWaalsContact C-N 3.26Å; D245-Q247 PolarHBondContact O-N 3.22Å
246	N	23.2	Very low	25	Very low	170 Å²	170	134.3 Å²	134.3	91%	0.909	69%	0.693	S	S	*	*			trans	-50.4	82.3	162.7	-78.4	-47.2	0	0	0	111.8
247	Q	22.8	Very low	24.5	Very low	161 Å²	161	137.2 Å²	137.2	75%	0.752	71%	0.709	S	S	*	*			trans	-115.2	102.5	156.1	-68.9	-171.2	35.7	0	0	107.5	D245 I249	D245-Q247 VanDerWaalsContact C-N 3.26Å; D245-Q247 PolarHBondContact O-N 3.22Å; Q247-I249 VanDerWaalsContact C-N 3.31Å; Q247-I249 PolarHBondContact O-N 3.16Å
248	S	21	Very low	24.4	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	71%	0.705	S	S	*	*			trans	-49.4	95.9	161	42.5	0	0	0	0	109	T250	S248-T250 PolarHBondContact O-N 3.42Å
249	I	22.2	Very low	24.4	Very low	133 Å²	133	133.6 Å²	133.6	68%	0.682	70%	0.698	S	S	*	*			trans	-73.6	87.9	172	-59.4	173.6	0	0	0	106	Q247 T251	Q247-I249 VanDerWaalsContact C-N 3.31Å; Q247-I249 PolarHBondContact O-N 3.16Å; I249-T251 PolarHBondContact O-N 3Å
250	T	21.4	Very low	24.1	Very low	116 Å²	116	135.7 Å²	135.7	71%	0.712	71%	0.71	S	S	*	*			trans	-61.3	113.8	163.3	27.5	0	0	0	0	108	S248 Q252	S248-T250 PolarHBondContact O-N 3.42Å; T250-Q252 VanDerWaalsContact C-N 3.3Å; T250-Q252 PolarHBondContact O-N 3.48Å
251	T	25.4	Very low	24.1	Very low	84 Å²	84	134.8 Å²	134.8	52%	0.515	71%	0.705	S	S	.	*			trans	-55.2	93.1	162.6	31	0	0	0	0	108.9	I249 W253	I249-T251 PolarHBondContact O-N 3Å; T251-W253 VanDerWaalsContact O-CD1 3.25Å; T251-W253 PolarHBondContact O-N 2.75Å
252	Q	22.4	Very low	23.9	Very low	178 Å²	178	130.2 Å²	130.2	83%	0.832	69%	0.693	S	S	*	*			trans	-88.4	97.4	170.7	-159	171.8	9.7	0	0	106.6	T250 I254	T250-Q252 VanDerWaalsContact C-N 3.3Å; T250-Q252 PolarHBondContact O-N 3.48Å; Q252-I254 PolarHBondContact O-N 2.93Å
253	W	25.8	Very low	23.7	Very low	157 Å²	157	125.1 Å²	125.1	60%	0.595	67%	0.672	S	S	*	*			trans	-66.4	118	177.7	-62.1	77.9	0	0	0	108.4	M198 T251 N255	M198-W253 HydrophobicContact CE-CH2 3.43Å; M198-W253 VanDerWaalsContact CE-CH2 3.43Å; M198-W253 HydrophobicContact CE-CZ2 4.45Å; M198-W253 HydrophobicContact CE-CZ3 3.56Å; M198-W253 HydrophobicContact SD-CH2 3.44Å; M198-W253 WeakPolarHBondContact SD-CH2 3.42Å; M198-W253 HydrophobicContact SD-CZ3 3.78Å; T251-W253 VanDerWaalsContact O-CD1 3.25Å; T251-W253 PolarHBondContact O-N 2.75Å; W253-N255 PolarHBondContact O-N 3.32Å
254	I	24.3	Very low	23.5	Very low	146 Å²	146	128.5 Å²	128.5	75%	0.749	68%	0.682	S	S	*	*			trans	-72.6	109.6	169.6	-61.2	174.5	0	0	0	105.2	Q252 D256	Q252-I254 PolarHBondContact O-N 2.93Å; I254-D256 VanDerWaalsContact C-N 3.25Å; I254-D256 PolarHBondContact O-N 3.41Å
255	N	21.7	Very low	23.4	Very low	152 Å²	152	124 Å²	124	81%	0.813	66%	0.663	S	S	*	*			trans	-60.1	84.1	174.4	-79.7	-20.6	0	0	0	110	W253	W253-N255 PolarHBondContact O-N 3.32Å
256	D	23.8	Very low	23.1	Very low	94 Å²	94	123 Å²	123	50%	0.503	67%	0.666	S	S	.	*			trans	-138	96.4	167.4	-76.1	-37.7	0	0	0	107.7	I254	I254-D256 VanDerWaalsContact C-N 3.25Å; I254-D256 PolarHBondContact O-N 3.41Å
257	D	23	Very low	23	Very low	108 Å²	108	122 Å²	122	58%	0.578	66%	0.66	S	S	*	*			trans	44.6	90.9	140.3	-94.2	20.6	0	0	0	116.1	K209	K209-D257 HydrophobicContact CB-CB 4.41Å; K209-D257 WeakPolarHBondContact CB-O 3.18Å; K209-D257 HydrophobicContact CD-CB 3.7Å; K209-D257 WeakPolarHBondContact CD-O 3.26Å; K209-D257 VanDerWaalsContact CE-CB 3.43Å; K209-D257 WeakPolarHBondContact CE-O 3.03Å; K209-D257 HydrophobicContact CG-CB 4.38Å; K209-D257 WeakPolarHBondContact CG-O 3.05Å; K209-D257 VanDerWaalsContact NZ-CB 3.35Å; K209-D257 IonicContact NZ-OD1 3.7Å; K209-D257 IonicContact NZ-OD2 2.75Å; K209-D257 PolarHBondContact NZ-OD2 3.47Å
258	I	25.8	Very low	23	Very low	101 Å²	101	120.9 Å²	120.9	52%	0.518	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.1	134.7	178.1	-61.3	171	0	0	0	109.8	Y206	Y206-I258 HydrophobicContact CD1-CG2 3.31Å; Y206-I258 HydrophobicContact CE1-CG2 4.02Å; Y206-I258 HydrophobicContact CG-CG2 4.06Å
259	L	24	Very low	23	Very low	116 Å²	116	118.2 Å²	118.2	61%	0.607	65%	0.647	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.7	132.7	167.8	-84.2	165.4	0	0	0	109.5	K209	K209-L259 HydrophobicContact CD-CD1 4.15Å; K209-L259 HydrophobicContact CD-CG 4.03Å; K209-L259 HydrophobicContact CG-CB 4.4Å; K209-L259 HydrophobicContact CG-CD1 3.78Å; K209-L259 HydrophobicContact CG-CG 3.81Å
260	V	23.5	Very low	23	Very low	91 Å²	91	119.4 Å²	119.4	55%	0.552	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-97.5	125.9	-179.2	-169	0	0	0	0	109.3	Y206	Y206-V260 HydrophobicContact CD1-CG2 4.39Å; Y206-V260 HydrophobicContact CE1-CB 4.15Å; Y206-V260 HydrophobicContact CE1-CG1 3.91Å; Y206-V260 HydrophobicContact CE1-CG2 3.73Å
261	L	24.9	Very low	23.1	Very low	127 Å²	127	121.1 Å²	121.1	67%	0.665	66%	0.66	S	S	*	*			trans	-113.2	89.9	172.6	-160.3	80.7	0	0	0	109.2	S204	S204-L261 WeakPolarHBondContact CB-O 2.98Å
262	G	22.2	Very low	22.9	Very low	53 Å²	53	126.3 Å²	126.3	55%	0.546	68%	0.678	S	S	.	*			trans	-94.5	132.4	-175.2	0	0	0	0	0	113.7	S204	S204-G262 WeakPolarHBondContact OG-CA 3.29Å
263	H	23.1	Very low	23	Very low	102 Å²	102	123.5 Å²	123.5	47%	0.472	68%	0.679	S	S	.	*			trans	-102.7	129.9	164.3	-74.2	-150.7	0	0	0	108.8	I25 L265	I25-H263 HydrophobicContact CD1-CB 4.36Å; I25-H263 WeakPolarHBondContact CD1-ND1 3.12Å; H263-L265 PolarHBondContact O-N 3.29Å
264	N	21.1	Very low	22.9	Very low	179 Å²	179	123.2 Å²	123.2	96%	0.957	69%	0.688	S	S	*	*			trans	-69	88.5	172.1	-82.6	-38.8	0	0	0	110.3
265	L	23.4	Very low	22.8	Very low	95 Å²	95	123.3 Å²	123.3	50%	0.497	69%	0.691	S	S	.	*			trans	-90.8	105.1	160.8	-81.3	162.3	0	0	0	108.4	H263 I267	H263-L265 PolarHBondContact O-N 3.29Å; L265-I267 VanDerWaalsContact C-N 3.34Å; L265-I267 PolarHBondContact O-N 3.42Å
266	S	19.5	Very low	22.9	Very low	108 Å²	108	122.9 Å²	122.9	76%	0.755	69%	0.688	S	S	*	*			trans	-62.8	93	171.1	-178.3	0	0	0	0	109.4	I268	S266-I268 PolarHBondContact O-N 2.86Å
267	I	22.8	Very low	22.9	Very low	150 Å²	150	125.1 Å²	125.1	77%	0.769	70%	0.7	S	S	*	*			trans	-82.7	100.2	162.2	-59.3	177.9	0	0	0	105.7	L265 G269	L265-I267 VanDerWaalsContact C-N 3.34Å; L265-I267 PolarHBondContact O-N 3.42Å; I267-G269 PolarHBondContact O-N 2.84Å
268	I	22.4	Very low	23	Very low	137 Å²	137	123.2 Å²	123.2	70%	0.703	71%	0.706	S	S	*	*			trans	-49.8	110.3	167.4	-67.3	168.6	0	0	0	107.2	S266 D270	S266-I268 PolarHBondContact O-N 2.86Å; I268-D270 PolarHBondContact O-N 3.31Å
269	G	21.4	Very low	22.9	Very low	56 Å²	56	129.1 Å²	129.1	58%	0.577	72%	0.724	S	S	*	*			trans	-70.1	98.7	175.5	0	0	0	0	0	110.4	I267 N271	I267-G269 PolarHBondContact O-N 2.84Å; G269-N271 PolarHBondContact O-N 2.96Å
270	D	22	Very low	23	Very low	158 Å²	158	131.7 Å²	131.7	85%	0.845	74%	0.736	S	S	*	*			trans	-77.9	84.9	156	-82.6	-17.8	0	0	0	108.4	I268 Q272	I268-D270 PolarHBondContact O-N 3.31Å; D270-Q272 PolarHBondContact O-N 3.01Å
271	N	22.8	Very low	23.1	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	75%	0.752	S	S	*	*			trans	-54.8	103.4	165.6	-78.8	-51	0	0	0	110.1	G269	G269-N271 PolarHBondContact O-N 2.96Å
272	Q	21.8	Very low	23.1	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	76%	0.762	S	S	*	*			trans	-172.2	92.3	145.7	-104.7	164.5	32	0	0	111.1	D270	D270-Q272 PolarHBondContact O-N 3.01Å
273	S	23.7	Very low	23.2	Very low	120 Å²	120	144 Å²	144	84%	0.839	78%	0.777	S	S	*	*			trans	-140.8	98.1	152.5	178.4	0	0	0	0	109.2	N275	S273-N275 PolarHBondContact O-N 3.23Å
274	N	24.7	Very low	23.2	Very low	150 Å²	150	151.2 Å²	151.2	80%	0.802	80%	0.8	S	S	*	*			trans	-48.8	126.8	165.3	-82	-33.3	0	0	0	110.4	D276	N274-D276 PolarHBondContact O-N 2.75Å
275	N	21.6	Very low	23.3	Very low	149 Å²	149	149.6 Å²	149.6	80%	0.797	79%	0.791	S	S	*	*			trans	16	102.2	136.4	-59.8	-18.5	0	0	0	116.2	S273	S273-N275 PolarHBondContact O-N 3.23Å
276	D	23.5	Very low	23.3	Very low	142 Å²	142	150.9 Å²	150.9	76%	0.759	80%	0.803	S	S	*	*				-166.8	128.3	118.1	-106.6	-12.9	0	0	0	110.4	N274	N274-D276 PolarHBondContact O-N 2.75Å
277	D	24.5	Very low	23.5	Very low	142 Å²	142	153.5 Å²	153.5	76%	0.759	81%	0.809	S	S	*	*			trans	73.8	85.7	143.3	-57.6	-20.5	0	0	0	121.2
278	G	24.9	Very low	23.6	Very low	68 Å²	68	153.8 Å²	153.8	70%	0.701	81%	0.807	S	S	*	*				111.8	0.8	94.5	0	0	0	0	0	120.4
279	Y	23.5	Very low	23.7	Very low	225 Å²	225	152.9 Å²	152.9	88%	0.882	81%	0.808	S	S	*	*	S	Bend	trans	-136.9	1.9	-175.5	-83.6	-83.3	0	0	0	118.7
280	I	24.7	Very low	23.8	Very low	169 Å²	169	160 Å²	160	87%	0.867	82%	0.823	S	S	*	*	S	Bend	trans	-118.1	10.8	-178.1	-57.1	-177.7	0	0	0	113.3
281	N	26.2	Very low	23.8	Very low	168 Å²	168	158.4 Å²	158.4	90%	0.898	82%	0.815	S	S	*	*	S	Bend	trans	-112.2	31.2	-177.4	-115	-1.3	0	0	0	115.1
282	K	25.1	Very low	24.1	Very low	200 Å²	200	159.8 Å²	159.8	87%	0.87	82%	0.817	S	S	*	*	S	Bend	trans	-128.4	14.2	-177.3	-112.7	-175.4	-176.1	-175.8	0	117.3
283	L	24.4	Very low	24.1	Very low	162 Å²	162	160.4 Å²	160.4	85%	0.848	81%	0.811	S	S	*	*	S	Bend	trans	-118	21	176.1	-124	115.8	0	0	0	114.9
284	W	23.8	Very low	24.2	Very low	253 Å²	253	161 Å²	161	96%	0.958	80%	0.804	S	S	*	*	S	Bend	trans	-140.7	37.4	173.5	-83.4	73.6	0	0	0	111.8
285	N	23.1	Very low	24.2	Very low	145 Å²	145	160 Å²	160	78%	0.775	80%	0.799	S	S	*	*			trans	-153.5	70.2	176	-118	-9.3	0	0	0	111.9
286	T	23.6	Very low	24.3	Very low	122 Å²	122	158.1 Å²	158.1	75%	0.748	79%	0.793	S	S	*	*			trans	-126.4	69.3	159.2	42.8	0	0	0	0	109.4	E288	T286-E288 PolarHBondContact O-N 3.19Å; T286-E288 VanDerWaalsContact O-N 3.1Å
287	N	23.5	Very low	24.3	Very low	164 Å²	164	158.1 Å²	158.1	88%	0.877	79%	0.793	S	S	*	*			trans	-72	68.2	140.1	-87.4	-17.6	0	0	0	107.7
288	E	24.8	Very low	24.2	Very low	155 Å²	155	158 Å²	158	72%	0.724	79%	0.792	S	S	*	*			trans	-128.6	81.9	169.1	-79.8	-166.4	166.9	0	0	108.8	T286 F290	T286-E288 PolarHBondContact O-N 3.19Å; T286-E288 VanDerWaalsContact O-N 3.1Å; E288-F290 PolarHBondContact O-N 3.32Å; E288-F290 VanDerWaalsContact O-N 3.1Å
289	T	23.3	Very low	24.3	Very low	119 Å²	119	161.6 Å²	161.6	73%	0.73	80%	0.795	S	S	*	*				38	66.5	129.3	-30.8	0	0	0	0	116.9	N291	T289-N291 HydrophobicContact CG2-CB 3.98Å; T289-N291 PolarHBondContact O-N 3.1Å
290	F	24.3	Very low	24.2	Very low	204 Å²	204	158.9 Å²	158.9	90%	0.895	80%	0.796	S	S	*	*			trans	-84.8	72	150.6	-111.6	-89.3	0	0	0	109	E288	E288-F290 PolarHBondContact O-N 3.32Å; E288-F290 VanDerWaalsContact O-N 3.1Å
291	N	22.8	Very low	24.2	Very low	126 Å²	126	157.5 Å²	157.5	67%	0.674	79%	0.786	S	S	*	*			trans	-92	90.7	165.4	-113.9	-25	0	0	0	107.7	T289	T289-N291 HydrophobicContact CG2-CB 3.98Å; T289-N291 PolarHBondContact O-N 3.1Å
292	E	28.2	Very low	24.1	Very low	180 Å²	180	156.3 Å²	156.3	84%	0.841	78%	0.775	S	S	*	*			trans	-124.7	67.9	152.4	-79.7	-165	159.5	0	0	109.9
293	R	22.3	Very low	24	Very low	206 Å²	206	156.5 Å²	156.5	78%	0.777	78%	0.776	S	S	*	*			trans	-4.2	116	134.3	-179.8	-172.9	-90	142.7	-7.8	115.7
294	N	24.3	Very low	24	Very low	131 Å²	131	152.1 Å²	152.1	70%	0.701	76%	0.759	S	S	*	*			trans	157.1	127.3	135	-88.3	-18.5	0	0	0	107.3
295	N	26.3	Very low	23.9	Very low	129 Å²	129	147 Å²	147	69%	0.69	75%	0.75	S	S	*	*			cis	-160.1	121.8	16.1	-106.4	-39.2	0	0	0	104.1
296	T	23.5	Very low	24.1	Very low	110 Å²	110	147.6 Å²	147.6	68%	0.675	75%	0.752	S	S	*	*				76.9	105.3	101.9	-47	0	0	0	0	113.9
297	N	23.7	Very low	24	Very low	142 Å²	142	148.6 Å²	148.6	76%	0.759	75%	0.753	S	S	*	*			trans	63.8	137.3	147.2	-80.2	-11.1	0	0	0	121.3
298	N	22.9	Very low	24.1	Very low	139 Å²	139	148.7 Å²	148.7	74%	0.743	75%	0.747	S	S	*	*			trans	71.3	109.7	157.4	-73.3	-2.5	0	0	0	116.2
299	N	25.7	Very low	23.9	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	75%	0.745	S	S	*	*				176.3	93.6	120.2	-75.6	-16.2	0	0	0	104.6	H301	N299-H301 VanDerWaalsContact C-N 3.28Å
300	N	22.1	Very low	24.1	Very low	168 Å²	168	148.8 Å²	148.8	90%	0.898	75%	0.749	S	S	*	*				4.2	81	82.1	-74.7	9.9	0	0	0	113.4
301	H	24.3	Very low	24	Very low	141 Å²	141	142.3 Å²	142.3	65%	0.653	74%	0.74	S	S	*	*			trans	-167.4	105.1	147.5	-110.1	-23.9	0	0	0	105.3	N299	N299-H301 VanDerWaalsContact C-N 3.28Å
302	E	23.4	Very low	23.9	Very low	143 Å²	143	142.6 Å²	142.6	67%	0.668	75%	0.746	S	S	*	*				62.1	86.3	88.6	-161.9	171.6	-154.8	0	0	109.7
303	F	24	Very low	23.7	Very low	204 Å²	204	142.3 Å²	142.3	90%	0.895	74%	0.743	S	S	*	*			trans	-106.9	79.7	151.9	-85.1	-80.2	0	0	0	106.6
304	S	23.6	Very low	23.6	Very low	69 Å²	69	138.6 Å²	138.6	48%	0.483	74%	0.743	S	S	.	*			trans	-65.2	150.4	149.1	52.5	0	0	0	0	109.6
305	D	23	Very low	23.6	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	75%	0.746	S	S	*	*			trans	61.1	84.6	157.4	-50.9	-22.6	0	0	0	117.4
306	I	25.9	Very low	23.4	Very low	157 Å²	157	140.9 Å²	140.9	81%	0.805	75%	0.748	S	S	*	*			trans	-123	85.7	141	-56.9	179	0	0	0	106.8
307	D	22	Very low	23.5	Very low	143 Å²	143	142.8 Å²	142.8	77%	0.765	75%	0.754	S	S	*	*			trans	-46.5	133.7	147.5	-86.7	-34	0	0	0	108.5
308	H	25.7	Very low	23.4	Very low	166 Å²	166	142.1 Å²	142.1	77%	0.769	75%	0.75	S	S	*	*			trans	170.3	83.4	147.2	-83.7	-48.7	0	0	0	109.3	T310	H308-T310 PolarHBondContact O-N 3.1Å
309	E	21.6	Very low	23.4	Very low	144 Å²	144	141.5 Å²	141.5	67%	0.673	75%	0.746	S	S	*	*				24.3	83.7	124.9	-157.4	174.9	-150.2	0	0	116.8	Y63	Y63-E309 VanDerWaalsContact CD2-OE1 3.27Å; Y63-E309 WeakPolarHBondContact CD2-OE1 3.27Å; Y63-E309 WeakPolarHBondContact CE2-OE1 3.43Å
310	T	26.3	Very low	23.3	Very low	132 Å²	132	139.4 Å²	139.4	81%	0.81	74%	0.743	S	S	*	*			trans	-154.5	112.7	150.6	47.2	0	0	0	0	109.7	H308	H308-T310 PolarHBondContact O-N 3.1Å
311	G	21.9	Very low	23.3	Very low	69 Å²	69	142.4 Å²	142.4	71%	0.711	74%	0.743	S	S	*	*			trans	-84.7	176.7	-172.9	0	0	0	0	0	116.8
312	T	21.4	Very low	23.2	Very low	132 Å²	132	141.4 Å²	141.4	81%	0.81	75%	0.752	S	S	*	*			trans	65.9	128.4	165.3	44.3	0	0	0	0	116.2
313	F	23.1	Very low	23.2	Very low	174 Å²	174	141 Å²	141	76%	0.763	76%	0.755	S	S	*	*			cis	-143.7	142.8	37.6	-82.7	-105.5	0	0	0	111.6
314	T	20.9	Very low	23.1	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	75%	0.752	S	S	*	*			trans	-120.3	96	164.2	-49.4	0	0	0	0	107.2	I316	T314-I316 HydrophobicContact CG2-CD1 4.29Å; T314-I316 HydrophobicContact CG2-CG1 3.92Å
315	E	24	Very low	23.1	Very low	164 Å²	164	140.9 Å²	140.9	77%	0.766	77%	0.768	S	S	*	*			trans	-100.1	106.6	164.5	-77.1	-172.5	176	0	0	108
316	I	21.9	Very low	23.2	Very low	143 Å²	143	142.6 Å²	142.6	73%	0.733	77%	0.771	S	S	*	*			trans	-87	114.9	170.4	-57	171.1	0	0	0	105.9	T314 D318	T314-I316 HydrophobicContact CG2-CD1 4.29Å; T314-I316 HydrophobicContact CG2-CG1 3.92Å; I316-D318 HydrophobicContact CG2-CB 4.44Å
317	L	25.8	Very low	23.1	Very low	151 Å²	151	143.3 Å²	143.3	79%	0.791	78%	0.775	S	S	*	*			trans	-109.6	91.2	167.3	-101.9	154.5	0	0	0	108.4
318	D	20.9	Very low	23.1	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	78%	0.782	S	S	*	*			trans	-84.9	110.8	171.6	-173	13.4	0	0	0	108.8	I316	I316-D318 HydrophobicContact CG2-CB 4.44Å
319	L	24.8	Very low	23	Very low	125 Å²	125	139.1 Å²	139.1	65%	0.654	77%	0.771	S	S	*	*			trans	-144.1	93.1	167.5	-77.9	176.8	0	0	0	110.4
320	S	21.9	Very low	23.2	Very low	101 Å²	101	143.8 Å²	143.8	71%	0.706	78%	0.782	S	S	*	*			trans	-83.7	133.2	171.8	20.7	0	0	0	0	111.7
321	Y	22.2	Very low	22.9	Very low	230 Å²	230	148.4 Å²	148.4	90%	0.902	79%	0.785	S	S	*	*			trans	10.1	131.3	162.7	-90.8	-97.8	0	0	0	121.5
322	S	22.5	Very low	23.2	Very low	121 Å²	121	153.8 Å²	153.8	85%	0.846	80%	0.797	S	S	*	*			trans	-153.7	140.1	140.5	-166.6	0	0	0	0	113.2
323	N	23.1	Very low	23.3	Very low	134 Å²	134	152.4 Å²	152.4	72%	0.717	79%	0.788	S	S	*	*			trans	-58.5	141.9	-168.7	-67.4	-45	0	0	0	116
324	V	23.1	Very low	23.3	Very low	137 Å²	137	150.4 Å²	150.4	83%	0.83	79%	0.785	S	S	*	*			trans	-139.8	103.8	139.5	-175.1	0	0	0	0	109.5	E326	V324-E326 HydrophobicContact CG1-CB 4.49Å
325	T	22.7	Very low	23.6	Very low	134 Å²	134	152 Å²	152	82%	0.822	78%	0.784	S	S	*	*			trans	-88.9	109.7	162.1	1.2	0	0	0	0	106.6
326	E	24.5	Very low	23.8	Very low	182 Å²	182	152 Å²	152	85%	0.85	78%	0.784	S	S	*	*			trans	-150.3	89.8	161.5	-121.6	177	-167.8	0	0	108.7	V324	V324-E326 HydrophobicContact CG1-CB 4.49Å
327	L	23.8	Very low	23.9	Very low	171 Å²	171	152.8 Å²	152.8	90%	0.895	79%	0.789	S	S	*	*			trans	-116.9	82.5	174.2	-143.8	155	0	0	0	105.8
328	D	23.5	Very low	23.9	Very low	170 Å²	170	153.3 Å²	153.3	91%	0.909	79%	0.787	S	S	*	*			trans	-96.1	107.3	173.7	-162.2	12.3	0	0	0	108.7
329	G	23	Very low	24.2	Very low	52 Å²	52	155.3 Å²	155.3	54%	0.536	79%	0.792	S	S	.	*			trans	153.3	92.3	171.2	0	0	0	0	0	116.3
330	R	25	Very low	24.4	Very low	241 Å²	241	155.1 Å²	155.1	91%	0.909	80%	0.801	S	S	*	*			trans	89	94.2	150.6	-60.3	177.5	166.4	-166.7	-2.2	118.8
331	R	21.9	Very low	24.5	Very low	229 Å²	229	157.5 Å²	157.5	86%	0.864	81%	0.806	S	S	*	*				34.6	101.5	122.1	-74.9	174.3	62.9	165.4	-0.1	116.8
332	L	27.2	Very low	24.7	Very low	182 Å²	182	155.5 Å²	155.5	95%	0.953	81%	0.805	S	S	*	*			trans	-137.1	123	131	-81.3	174.7	0	0	0	108.8
333	T	23.8	Very low	24.9	Very low	104 Å²	104	155.2 Å²	155.2	64%	0.638	80%	0.803	S	S	*	*			trans	-85.6	153.3	-171.5	38.3	0	0	0	0	111.9
334	D	23.6	Very low	25	Very low	131 Å²	131	155.6 Å²	155.6	70%	0.701	81%	0.805	S	S	*	*			trans	67.7	101.2	151.8	-48.2	-27.7	0	0	0	117.7
335	H	26.2	Very low	25.2	Very low	163 Å²	163	155.5 Å²	155.5	76%	0.755	80%	0.8	S	S	*	*				169	126.5	103.7	-96.8	-82.1	0	0	0	112.3
336	E	27.4	Very low	25.2	Very low	162 Å²	162	155.4 Å²	155.4	76%	0.757	79%	0.794	S	S	*	*			trans	57.5	88.6	148.3	-84.1	154.6	136.3	0	0	120
337	L	24.7	Very low	25.3	Very low	161 Å²	161	154.7 Å²	154.7	84%	0.843	79%	0.79	S	S	*	*				-48	126.9	129.3	-68	163	0	0	0	109.9
338	H	26.7	Very low	25.3	Very low	161 Å²	161	151.5 Å²	151.5	75%	0.745	78%	0.777	S	S	*	*			trans	-172.7	115.6	137.2	-98.3	-69.4	0	0	0	111
339	E	27.1	Very low	25.2	Very low	170 Å²	170	151.2 Å²	151.2	79%	0.794	77%	0.774	S	S	*	*			trans	36.6	112	140.9	-68.1	166.4	138.1	0	0	119.7
340	S	27.9	Very low	25.2	Very low	122 Å²	122	153.7 Å²	153.7	85%	0.853	78%	0.779	S	S	*	*			trans	-145.1	102.8	138.6	59.5	0	0	0	0	110
341	N	24.8	Very low	25.2	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	78%	0.775	S	S	*	*			trans	-53.9	165.8	156.6	-83.3	-32.3	0	0	0	111.2
342	E	25.7	Very low	25.3	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	77%	0.765	S	S	*	*			trans	86.7	101.2	164.7	-56.9	177.4	165	0	0	115.7
343	S	27.3	Very low	25.1	Very low	114 Å²	114	142.6 Å²	142.6	80%	0.797	75%	0.752	S	S	*	*				176.9	136.1	90.6	-176.8	0	0	0	0	110.5
344	N	25.3	Very low	25.1	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	75%	0.754	S	S	*	*			trans	-49.6	140.4	171.5	-55	-49.1	0	0	0	112.3
345	D	26.3	Very low	25.3	Very low	136 Å²	136	145.4 Å²	145.4	73%	0.727	76%	0.761	S	S	*	*				-170.1	122	121.3	-99.6	-17	0	0	0	112.2
346	L	24.4	Very low	25.4	Very low	132 Å²	132	144.4 Å²	144.4	69%	0.691	76%	0.762	S	S	*	*			trans	60.1	129.3	132.7	-53.4	164.3	0	0	0	117.7
347	H	25.5	Very low	25.4	Very low	167 Å²	167	142.9 Å²	142.9	77%	0.773	76%	0.758	S	S	*	*			cis	-165.3	133.6	14	-129.7	-69	0	0	0	109.6
348	T	23.5	Very low	25.6	Very low	103 Å²	103	142 Å²	142	63%	0.632	75%	0.752	S	S	*	*			trans	-60.9	137.3	167.9	-51.7	0	0	0	0	114.6	V350	T348-V350 HydrophobicContact CG2-CB 4.21Å; T348-V350 HydrophobicContact CG2-CG2 3.42Å; T348-V350 VanDerWaalsContact CG2-CG2 3.42Å
349	I	22.9	Very low	25.8	Very low	165 Å²	165	140.4 Å²	140.4	85%	0.846	75%	0.749	S	S	*	*			trans	-156.3	104.7	140.2	-54.9	-175.2	0	0	0	104.3
350	V	22.6	Very low	25.9	Very low	103 Å²	103	139.2 Å²	139.2	62%	0.624	74%	0.743	S	S	*	*				51.1	90.8	52	-173.8	0	0	0	0	113.5	T348	T348-V350 HydrophobicContact CG2-CB 4.21Å; T348-V350 HydrophobicContact CG2-CG2 3.42Å; T348-V350 VanDerWaalsContact CG2-CG2 3.42Å
351	E	25.6	Very low	25.9	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	74%	0.739	S	S	*	*			trans	-136.2	93.2	137.1	-127	170.3	-153.1	0	0	109.5
352	T	22.7	Very low	26	Very low	105 Å²	105	142.4 Å²	142.4	64%	0.644	73%	0.734	S	S	*	*			trans	-93.6	108.5	162.4	-47	0	0	0	0	105.4	I354	T352-I354 HydrophobicContact CG2-CD1 4.2Å; T352-I354 HydrophobicContact CG2-CG1 4.1Å
353	I	23.8	Very low	26.3	Very low	135 Å²	135	138.8 Å²	138.8	69%	0.692	73%	0.729	S	S	*	*			trans	-123.2	97	157.9	-60.8	-178.2	0	0	0	107.6	L355	I353-L355 HydrophobicContact CG2-CD1 4.42Å; I353-L355 HydrophobicContact CG2-CG 4.42Å
354	I	24.1	Very low	26.5	Very low	129 Å²	129	142 Å²	142	66%	0.662	73%	0.732	S	S	*	*			trans	-58.6	125.3	158.6	-63.8	157.5	0	0	0	107.4	T352 D356	T352-I354 HydrophobicContact CG2-CD1 4.2Å; T352-I354 HydrophobicContact CG2-CG1 4.1Å; I354-D356 HydrophobicContact CG2-CB 4.12Å
355	L	26.4	Very low	26.8	Very low	165 Å²	165	140.5 Å²	140.5	86%	0.864	73%	0.73	S	S	*	*			trans	-129.5	63.4	155.7	-89.4	162.1	0	0	0	107.8	I353 D357	I353-L355 HydrophobicContact CG2-CD1 4.42Å; I353-L355 HydrophobicContact CG2-CG 4.42Å; L355-D357 PolarHBondContact O-N 3.2Å
356	D	29.1	Very low	27.1	Very low	142 Å²	142	140 Å²	140	76%	0.759	73%	0.732	S	S	*	*			trans	-68.2	107.5	151.4	-102.3	-18.9	0	0	0	107.1	I354	I354-D356 HydrophobicContact CG2-CB 4.12Å
357	D	27.2	Very low	27.3	Very low	129 Å²	129	140.9 Å²	140.9	69%	0.69	74%	0.737	S	S	*	*				46.6	144.5	116.7	-146.9	9.7	0	0	0	120.2	L355	L355-D357 PolarHBondContact O-N 3.2Å
358	M	29.9	Very low	27.5	Very low	144 Å²	144	141.7 Å²	141.7	71%	0.709	74%	0.741	S	S	*	*			trans	78.5	101.9	161.1	-65.1	-174.8	-63.8	0	0	119.8
359	D	29.7	Very low	27.8	Very low	126 Å²	126	141.8 Å²	141.8	67%	0.674	75%	0.746	S	S	*	*				83.4	118.4	118.4	-84.5	-20.4	0	0	0	121.6
360	H	29.1	Very low	28.2	Very low	146 Å²	146	137.7 Å²	137.7	68%	0.676	73%	0.732	S	S	*	*				64.4	110.1	128.4	-70.7	-16.7	0	0	0	119.5
361	R	27.5	Very low	28.5	Very low	204 Å²	204	139.8 Å²	139.8	77%	0.77	74%	0.738	S	S	*	*				81.5	118	121.8	-77.6	-174.2	175.9	-148.1	1.4	118.2
362	I	27.4	Very low	28.8	Very low	136 Å²	136	137.3 Å²	137.3	70%	0.697	73%	0.73	S	S	*	*			trans	76.4	107.2	132	-55	162.9	0	0	0	115.2
363	S	32.7	Very low	29.2	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	73%	0.732	S	S	*	*				175.1	121.9	107.7	-70.1	0	0	0	0	111.2
364	E	31.6	Very low	29.6	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	74%	0.74	S	S	*	*			trans	-32.7	158.6	153.9	-106.2	176.8	-168.1	0	0	113.9
365	P	32.1	Very low	29.8	Very low	110 Å²	110	141.1 Å²	141.1	71%	0.714	75%	0.749	S	S	*	*				-161.3	161.8	73.1	44.8	-23.4	0	0	0	120.3
366	T	31.4	Very low	30.1	Very low	126 Å²	126	141.8 Å²	141.8	77%	0.773	75%	0.747	S	S	*	*			trans	74.9	107	141.5	22.8	0	0	0	0	123
367	N	27.9	Very low	30.1	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	74%	0.74	S	S	*	*			trans	-38.8	144.2	142.2	-66.7	-47.8	0	0	0	114.9
368	Q	30.2	Very low	30.2	Very low	184 Å²	184	141 Å²	141	86%	0.86	74%	0.743	S	S	*	*				176.3	118.6	116.3	-96.6	175.5	9.7	0	0	109.7
369	S	29.8	Very low	30	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	74%	0.739	S	S	*	*				83.7	129.1	107.9	-153.1	0	0	0	0	111.3
370	S	31.1	Very low	30.1	Very low	79 Å²	79	139.6 Å²	139.6	55%	0.552	75%	0.745	S	S	*	*			cis	167	166.3	11.9	42	0	0	0	0	108
371	I	30.1	Very low	30.2	Very low	147 Å²	147	138.9 Å²	138.9	75%	0.754	75%	0.751	S	S	*	*			trans	80.7	135.7	139.9	-80.2	163.1	0	0	0	115.3
372	L	32.2	Very low	30.3	Very low	129 Å²	129	134.5 Å²	134.5	68%	0.675	75%	0.749	S	S	*	*			cis	-157.1	147.5	11.8	-135.4	101.5	0	0	0	108.7
373	D	29.8	Very low	30.5	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	75%	0.748	S	S	*	*			trans	29.3	137.5	137.1	-48	-22.8	0	0	0	122.3
374	T	32.8	Very low	30.3	Very low	139 Å²	139	136.5 Å²	136.5	85%	0.853	75%	0.746	S	S	*	*				-176.3	122.5	99.3	-61.3	0	0	0	0	110.5
375	E	28.9	Very low	30.1	Very low	181 Å²	181	135 Å²	135	85%	0.846	74%	0.743	S	S	*	*			trans	-64.3	153.3	168.5	-58.1	-172.1	151.2	0	0	112.5
376	E	32.3	Very low	29.8	Very low	178 Å²	178	136.9 Å²	136.9	83%	0.832	74%	0.742	S	S	*	*			trans	155	145.7	147.3	-93.9	-157	134.9	0	0	108.1
377	N	28.1	Very low	29.6	Very low	113 Å²	113	136 Å²	136	60%	0.604	74%	0.736	S	S	*	*			cis	176.5	157.4	-12.6	-148.2	-21.3	0	0	0	103.2
378	L	30.3	Very low	29.6	Very low	143 Å²	143	135.2 Å²	135.2	75%	0.749	73%	0.732	S	S	*	*			trans	76.1	105.3	151.4	-54.2	157.1	0	0	0	117.9
379	S	26.1	Very low	29.5	Very low	92 Å²	92	131 Å²	131	64%	0.643	72%	0.723	S	S	*	*				86.3	116	74.8	-163.6	0	0	0	0	113.2
380	N	31.6	Very low	29.5	Very low	148 Å²	148	130.8 Å²	130.8	79%	0.791	72%	0.721	S	S	*	*			trans	147.7	91.6	131.4	-72.2	-16.6	0	0	0	114
381	T	30.6	Very low	29.3	Very low	131 Å²	131	135.9 Å²	135.9	80%	0.804	74%	0.736	S	S	*	*			trans	-49.6	164.5	137.1	29.3	0	0	0	0	111.4
382	P	30.3	Very low	29.4	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	74%	0.74	S	S	*	*			cis	-149.1	178.2	50	29.4	-0.9	0	0	0	114.1
383	I	30.8	Very low	29.2	Very low	135 Å²	135	137.6 Å²	137.6	69%	0.692	74%	0.742	S	S	*	*				166.6	112.7	80.9	-74.7	179.5	0	0	0	103.4
384	E	27.4	Very low	29.4	Very low	156 Å²	156	138 Å²	138	73%	0.729	74%	0.743	S	S	*	*				81.9	137.7	89.3	-145	178.4	-150.7	0	0	114.8
385	L	28	Very low	29.1	Very low	149 Å²	149	136.3 Å²	136.3	78%	0.78	73%	0.732	S	S	*	*			trans	119.5	74	168.6	-64	176.5	0	0	0	112.3
386	Q	26.1	Very low	29.2	Very low	150 Å²	150	133 Å²	133	70%	0.701	73%	0.725	S	S	*	*				77	143.9	61.2	-152.5	-173.8	25.8	0	0	112.6
387	V	27.3	Very low	28.9	Very low	107 Å²	107	131.6 Å²	131.6	65%	0.648	72%	0.723	S	S	*	*			trans	90.3	122.6	159.3	-165.7	0	0	0	0	115.1
388	N	28.8	Very low	29.1	Very low	134 Å²	134	130.9 Å²	130.9	72%	0.717	73%	0.727	S	S	*	*			cis	-166.5	131.5	-0.9	-96.7	-10.4	0	0	0	105.2
389	S	26.5	Very low	29.2	Very low	94 Å²	94	130.7 Å²	130.7	66%	0.657	72%	0.724	S	S	*	*				70.8	143.4	76.9	98.7	0	0	0	0	116.2
390	S	31	Very low	29.9	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	72%	0.724	S	S	*	*			trans	103.9	88.7	162	-41.8	0	0	0	0	113.7
391	Q	26.1	Very low	30.3	Very low	186 Å²	186	126.9 Å²	126.9	87%	0.869	70%	0.698	S	S	*	*				64.6	93.4	75.4	-158.7	175.2	15.5	0	0	111.2
392	E	32.9	Very low	30.5	Very low	178 Å²	178	125.7 Å²	125.7	83%	0.832	69%	0.69	S	S	*	*			trans	-128.3	126.7	153.6	-156.9	168.6	-157.7	0	0	109.7	I394	E392-I394 HydrophobicContact CG-CD1 4.29Å; E392-I394 HydrophobicContact CG-CG1 4.3Å
393	N	28.3	Very low	30.9	Very low	135 Å²	135	127.4 Å²	127.4	72%	0.722	69%	0.688	S	S	*	*			trans	-114.2	98.9	-164.5	176.3	29.5	0	0	0	104.5
394	I	33.9	Very low	31.7	Very low	138 Å²	138	126.1 Å²	126.1	71%	0.708	68%	0.679	S	S	*	*			trans	-139.5	87.6	172.2	-51.3	178.3	0	0	0	109.4	E392	E392-I394 HydrophobicContact CG-CD1 4.29Å; E392-I394 HydrophobicContact CG-CG1 4.3Å
395	T	25.9	Very low	32.4	Very low	102 Å²	102	124.6 Å²	124.6	63%	0.626	67%	0.672	S	S	*	*			trans	-27.8	156.3	143.3	-34	0	0	0	0	114.3
396	T	29.9	Very low	32.8	Very low	112 Å²	112	122.8 Å²	122.8	69%	0.687	66%	0.663	S	S	*	*			trans	107.6	112.3	154.9	66.1	0	0	0	0	117.2
397	D	27.3	Very low	33.5	Very low	148 Å²	148	120.5 Å²	120.5	79%	0.791	66%	0.659	S	S	*	*			trans	74.1	122.3	134.4	-63.1	-16.9	0	0	0	120.2
398	S	32.3	Very low	34.5	Very low	98 Å²	98	122.9 Å²	122.9	69%	0.685	66%	0.66	S	S	*	*			trans	77.6	110.4	147.2	-165.1	0	0	0	0	114.8
399	M	32.3	Very low	35.1	Very low	139 Å²	139	123.5 Å²	123.5	69%	0.685	66%	0.663	S	S	*	*				-154	71.1	63.8	-143.1	160.2	-153.3	0	0	110.8	T401	M399-T401 WeakPolarHBondContact CA-OG1 3.13Å; M399-T401 VanDerWaalsContact CG-CB 3.41Å; M399-T401 WeakPolarHBondContact CG-OG1 3.13Å; M399-T401 PolarHBondContact O-N 3.47Å
400	D	41.1	Very low	35.9	Very low	123 Å²	123	125 Å²	125	66%	0.658	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	34.7	153.3	-138.2	-8.3	0	0	0	111.4	Q404	D400-Q404 WeakPolarHBondContact O-CB 3.33Å; D400-Q404 WeakPolarHBondContact O-CG 3.34Å
401	T	39.7	Very low	36.6	Very low	38 Å²	38	128.1 Å²	128.1	23%	0.233	67%	0.665	C	S	.	*	T	Hydrogen-bonded Turn	trans	-124.1	-18.1	-163.8	-22.9	0	0	0	0	111.3	M399 Q405	M399-T401 WeakPolarHBondContact CA-OG1 3.13Å; M399-T401 VanDerWaalsContact CG-CB 3.41Å; M399-T401 WeakPolarHBondContact CG-OG1 3.13Å; M399-T401 PolarHBondContact O-N 3.47Å; T401-Q405 HydrophobicContact CG2-CG 4.04Å; T401-Q405 WeakPolarHBondContact O-CB 3.33Å; T401-Q405 WeakPolarHBondContact O-CG 2.97Å; T401-Q405 PolarHBondContact O-N 3.06Å
402	V	34.6	Very low	37.2	Very low	106 Å²	106	129.1 Å²	129.1	64%	0.642	68%	0.677	S	S	*	*	H	α-helix	trans	-80.3	-33.5	175.4	-173.7	0	0	0	0	111.4
403	H	38.7	Very low	37.4	Very low	147 Å²	147	126.7 Å²	126.7	68%	0.681	67%	0.669	S	S	*	*	H	α-helix	trans	-92.1	-21	172.7	-92.4	-1.1	0	0	0	114.7	T407	H403-T407 PolarHBondContact O-N 2.85Å; H403-T407 PolarHBondContact O-OG1 3.47Å
404	Q	48.1	Very low	37.9	Very low	107 Å²	107	126.3 Å²	126.3	50%	0.5	67%	0.666	S	S	.	*	H	α-helix	trans	-86.2	-18.7	170.8	-69.2	-172.1	19.6	0	0	114.4	D400	D400-Q404 WeakPolarHBondContact O-CB 3.33Å; D400-Q404 WeakPolarHBondContact O-CG 3.34Å
405	Q	42.4	Very low	38.1	Very low	124 Å²	124	125.6 Å²	125.6	58%	0.579	66%	0.664	S	S	*	*	H	α-helix	trans	-81.3	-31.3	170	-73.8	-179	-10	0	0	112.4	T401 K408	T401-Q405 HydrophobicContact CG2-CG 4.04Å; T401-Q405 WeakPolarHBondContact O-CB 3.33Å; T401-Q405 WeakPolarHBondContact O-CG 2.97Å; T401-Q405 PolarHBondContact O-N 3.06Å; Q405-K408 PolarHBondContact O-N 2.78Å
406	L	35.2	Very low	38.9	Very low	112 Å²	112	127 Å²	127	59%	0.586	67%	0.666	S	S	*	*	H	α-helix	trans	-70.9	-31.6	175.9	-153.5	71.2	0	0	0	112.4
407	T	42.2	Very low	39.4	Very low	101 Å²	101	127.9 Å²	127.9	62%	0.62	67%	0.665	S	S	*	*	H	α-helix	trans	-83.4	-16.5	178.3	-47.2	0	0	0	0	113.4	H403	H403-T407 PolarHBondContact O-N 2.85Å; H403-T407 PolarHBondContact O-OG1 3.47Å
408	K	46.9	Very low	40.2	Very low	157 Å²	157	126.6 Å²	126.6	68%	0.683	66%	0.657	S	S	*	*	H	α-helix	trans	-87	-11.1	174.5	-84.7	-179.6	178.4	172.7	0	114.5	Q405	Q405-K408 PolarHBondContact O-N 2.78Å
409	L	42	Very low	40.8	Very low	148 Å²	148	128.6 Å²	128.6	78%	0.775	66%	0.655	S	S	*	*	S	Bend	trans	-94	-8.1	175.1	-109.6	97.7	0	0	0	114
410	I	43.9	Very low	41.4	Very low	126 Å²	126	127.8 Å²	127.8	65%	0.646	65%	0.652	S	S	*	*	S	Bend	trans	-114.4	-8.8	-172.9	-60.5	175.3	0	0	0	111.8
411	H	45	Very low	41.5	Very low	165 Å²	165	128.3 Å²	128.3	76%	0.764	65%	0.652	S	S	*	*			trans	-135.8	22	-177.4	-93.6	47.9	0	0	0	115.6
412	N	39.1	Very low	41.6	Very low	208 Å²	208	136.5 Å²	136.5	100%	1.112	69%	0.69	S	S	*	*			trans	-149.6	0	162.5	-101	-13.5	0	0	0	108.4

Retrieved 412 of 412 residues in 97.6 ms (Link to these results)

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